A0A087YHI1_POEFO Loading...

VPS35 endosomal protein-sorting factor-like

AlphaFold DB , UniProt , Accession A0A087YHI1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 895 aa.

						>A0A087YHI1_POEFO|A0A087YHI1
MLDGTDPLSMFAATETSAAASHSSSVGDLGRKRRVKEEEALGADFEPWSTKRGEILARFTTTEKLSINLCMGSDRGKAPNPGSSAVSEKVRTRLEELDDLEEGSHRELLNLSQQDYANRIEELNQSLKEAWSSDQKVKALKIVIQCSKLLSDTSVIQFYPSKFVLITDILDTFGRLVYDRIWTMCSDPRPLPDSFTVEDVNDTAKETCLNWFFKIASIRELLPRLYVEAAILKCNRFLSKSGIQETLPRLTAMIRGMGDPLVAAYARAYLCRVGMEVAPHLKESLNANIFDLLTTFRQISGDSVQKQLHLQKVEVPAYLMLYSPAINWILQCVAYRAPEPLLTEMMERCKMMANNALLLNSIMRAFRPEFVATRATDFIGMIKDCDESGFPKHLLYGSLGRSLACADPPESERLTILNEAWKVITKVRNPQDYMNCAEIWVEFTCRHFAKREVNTVLADIIKHMTPDRAFEEAYPQLQSVITKILMYFHDFSVLFSMERFLPFLDMFQKDSVRVEVCKSIMEVFIKHQLELTRDPVILNAMLHICKTMHDSVNALTLEDEKRSLALLIIGFIRMVSFGRDFEQQLSFCVEARSTFCNLEPVLVQLIHTVNQLAMETRMVMKGNHSRKTAAFVRACAAYCFITIPSLSSIFSRLHLYLLSGQVALANQCLSQADAFLKAAVSVLPEVPRSISVEGKLRSSESFLLDFINNFLATLLVVPDHPEHGVLYLVRGLLNMVQDYTWEDNSDAKVRIYISALPLLAAMSQETYLYSIHKVDSNETLYGGDPKFLSEINKLCETLIGQILDHLKTLTRDEQSMRRQSALAFSLFGVLLAHGDLKNNKLSQLSINLWNLSHKHGHSETRVSIRTLESIRHQAQRPDMAHLSDTIQRLALQSRT
					

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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	23.4	Very low	28.8	Very low	227 Å²	227	144.1 Å²	144.1	100%	1.118	81%	0.81	S	S	*	*				0	106.2	0	-76.6	-159.4	-165.4	0	0	107.5
2	L	21	Very low	28.8	Very low	158 Å²	158	140.9 Å²	140.9	83%	0.827	82%	0.815	S	S	*	*			cis	-158.3	95.2	-3.3	-103.7	144.6	0	0	0	101.4
3	D	30.3	Very low	28.9	Very low	158 Å²	158	134.9 Å²	134.9	85%	0.845	79%	0.793	S	S	*	*				25.2	114.3	114.8	-68.6	-23.8	0	0	0	115.5
4	G	25.1	Very low	28.5	Very low	83 Å²	83	133.9 Å²	133.9	86%	0.856	79%	0.789	S	S	*	*			trans	-166.5	54	-179.5	0	0	0	0	0	110.2
5	T	28.3	Very low	28.2	Very low	140 Å²	140	135.5 Å²	135.5	86%	0.859	79%	0.786	S	S	*	*			trans	-81.1	145.7	167	25.1	0	0	0	0	111.2
6	D	30.9	Very low	28	Very low	108 Å²	108	135.4 Å²	135.4	58%	0.578	79%	0.788	S	S	*	*			trans	-55.8	131.7	-165.2	-173.7	-12.8	0	0	0	115.9	L8	D6-L8 VanDerWaalsContact C-N 3.28Å; D6-L8 PolarHBondContact O-N 3.03Å; D6-L8 PolarHBondContact OD1-N 3.2Å
7	P	31.6	Very low	27.9	Very low	106 Å²	106	133.8 Å²	133.8	69%	0.688	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-70.7	4.8	-175.6	27.3	-36.2	0	0	0	117.6
8	L	29.1	Very low	27.7	Very low	144 Å²	144	131.6 Å²	131.6	75%	0.754	79%	0.785	S	S	*	*	G	3₁₀ helix	trans	-85.3	-12.3	179	-94.2	140.1	0	0	0	115.1	D6	D6-L8 VanDerWaalsContact C-N 3.28Å; D6-L8 PolarHBondContact O-N 3.03Å; D6-L8 PolarHBondContact OD1-N 3.2Å
9	S	36.4	Very low	27.4	Very low	106 Å²	106	129.9 Å²	129.9	74%	0.741	79%	0.787	S	S	*	*	G	3₁₀ helix	trans	-85.6	-6	179.4	-48.7	0	0	0	0	114.4
10	M	32.4	Very low	27.2	Very low	157 Å²	157	128.2 Å²	128.2	77%	0.773	79%	0.787	S	S	*	*	G	3₁₀ helix	trans	-105.9	10.3	-179.2	-68.3	-142.1	-37.5	0	0	115.1
11	F	28	Very low	27	Very low	198 Å²	198	127 Å²	127	87%	0.868	79%	0.785	S	S	*	*	S	Bend	trans	-102.3	9.6	177.1	-104.3	-81	0	0	0	115.1
12	A	29.5	Very low	27	Very low	106 Å²	106	125.3 Å²	125.3	88%	0.876	77%	0.773	S	S	*	*	S	Bend	trans	-121	-3.5	172.5	0	0	0	0	0	114.8
13	A	29.5	Very low	27.1	Very low	63 Å²	63	123.4 Å²	123.4	52%	0.521	77%	0.773	S	S	.	*	S	Bend	trans	-144.4	114.5	177.4	0	0	0	0	0	111.1
14	T	24.1	Very low	27	Very low	120 Å²	120	121.5 Å²	121.5	74%	0.736	77%	0.772	S	S	*	*			trans	62.8	129.4	157.3	57.5	0	0	0	0	116.9
15	E	24.3	Very low	27	Very low	159 Å²	159	123 Å²	123	74%	0.743	77%	0.769	S	S	*	*			cis	179.1	139.1	13.4	-120.3	175.3	-174.8	0	0	107.5
16	T	24.7	Very low	27	Very low	134 Å²	134	123.6 Å²	123.6	82%	0.822	77%	0.773	S	S	*	*			trans	60.9	155.2	144.2	52.3	0	0	0	0	120.3
17	S	26.2	Very low	26.9	Very low	108 Å²	108	121.1 Å²	121.1	76%	0.755	77%	0.773	S	S	*	*			cis	178.2	156.4	2.9	147	0	0	0	0	107.7
18	A	24.6	Very low	26.8	Very low	93 Å²	93	121.9 Å²	121.9	77%	0.769	77%	0.771	S	S	*	*			trans	137.7	133.7	132.8	0	0	0	0	0	111.1
19	A	22	Very low	26.7	Very low	100 Å²	100	122.7 Å²	122.7	83%	0.826	78%	0.775	S	S	*	*			cis	-155.8	167.6	23	0	0	0	0	0	107.9
20	A	22.3	Very low	26.4	Very low	95 Å²	95	119.5 Å²	119.5	79%	0.785	76%	0.759	S	S	*	*			cis	-160.4	167.3	7.6	0	0	0	0	0	104.4
21	S	23	Very low	26.2	Very low	105 Å²	105	120.7 Å²	120.7	73%	0.734	76%	0.755	S	S	*	*			cis	-166.6	145.4	16.7	37	0	0	0	0	108.8
22	H	23.9	Very low	26.3	Very low	190 Å²	190	120 Å²	120	88%	0.88	75%	0.751	S	S	*	*			trans	5.3	121.4	156.8	-62	-71.7	0	0	0	121
23	S	23.1	Very low	26.2	Very low	119 Å²	119	124.1 Å²	124.1	83%	0.832	74%	0.744	S	S	*	*				-158.6	132.1	110.3	58.1	0	0	0	0	111.5
24	S	27.9	Very low	26.4	Very low	118 Å²	118	129.5 Å²	129.5	83%	0.825	75%	0.751	S	S	*	*			trans	-68.5	132	176.2	46.5	0	0	0	0	112
25	S	24.8	Very low	26.8	Very low	113 Å²	113	128.7 Å²	128.7	79%	0.79	75%	0.746	S	S	*	*			trans	-138.6	127.5	156.2	77.8	0	0	0	0	111.7	G27	S25-G27 PolarHBondContact O-N 3.31Å
26	V	28.7	Very low	27	Very low	153 Å²	153	130 Å²	130	93%	0.927	75%	0.749	S	S	*	*			trans	-77.1	25.1	-171.3	172.5	0	0	0	0	112
27	G	28.9	Very low	27.2	Very low	56 Å²	56	130.3 Å²	130.3	58%	0.577	74%	0.742	S	S	*	*			trans	-89.6	-23	-163	0	0	0	0	0	117.7	S25	S25-G27 PolarHBondContact O-N 3.31Å
28	D	29.3	Very low	27.8	Very low	123 Å²	123	131.9 Å²	131.9	66%	0.658	74%	0.737	S	S	*	*	S	Bend	trans	-103.1	-14.3	-158.3	-144.5	20.2	0	0	0	115.7	G30 R31	D28-G30 VanDerWaalsContact C-N 3.3Å; D28-R31 PolarHBondContact O-N 3.48Å
29	L	27.6	Very low	28.6	Very low	161 Å²	161	134.8 Å²	134.8	84%	0.843	73%	0.734	S	S	*	*	H	α-helix	trans	-74.6	-21.1	170.8	-76.4	162.5	0	0	0	112.7	R31	L29-R31 VanDerWaalsContact C-N 3.32Å
30	G	28.8	Very low	30	Very low	39 Å²	39	133.2 Å²	133.2	40%	0.402	72%	0.722	S	S	.	*	H	α-helix	trans	-71.2	-25.8	174.3	0	0	0	0	0	113.3	D28 R34	D28-G30 VanDerWaalsContact C-N 3.3Å; G30-R34 WeakPolarHBondContact O-CB 3.43Å; G30-R34 WeakPolarHBondContact O-CG 3.41Å; G30-R34 PolarHBondContact O-N 2.63Å; G30-R34 VanDerWaalsContact O-N 3.09Å
31	R	29.4	Very low	32	Very low	181 Å²	181	130.5 Å²	130.5	68%	0.683	69%	0.694	S	S	*	*	H	α-helix	trans	-81.2	-33.4	-173.2	-150.2	174.6	-173.3	177.1	1.5	113.4	D28 L29	D28-R31 PolarHBondContact O-N 3.48Å; L29-R31 VanDerWaalsContact C-N 3.32Å
32	K	29.5	Very low	34	Very low	183 Å²	183	126.6 Å²	126.6	80%	0.796	67%	0.67	S	S	*	*	H	α-helix	trans	-77.9	-25.1	173.3	-86.2	-177.9	176.1	175.5	0	113.6
33	R	28.1	Very low	35.8	Very low	193 Å²	193	122.8 Å²	122.8	73%	0.728	67%	0.671	S	S	*	*	H	α-helix	trans	-78.7	-35.5	173.8	-148	173.7	-176.4	170	0.3	111.7	V35 K36	R33-V35 PolarHBondContact O-N 2.89Å; R33-K36 PolarHBondContact O-N 3.44Å
34	R	33.8	Very low	38.1	Very low	176 Å²	176	122.2 Å²	122.2	66%	0.664	66%	0.659	S	S	*	*	H	α-helix	trans	-55.6	-28.9	173.1	-87.9	174.7	177.7	-179.4	0.2	115	G30	G30-R34 WeakPolarHBondContact O-CB 3.43Å; G30-R34 WeakPolarHBondContact O-CG 3.41Å; G30-R34 PolarHBondContact O-N 2.63Å; G30-R34 VanDerWaalsContact O-N 3.09Å
35	V	32.3	Very low	40.6	Very low	103 Å²	103	117.5 Å²	117.5	62%	0.624	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-19.1	-177.5	179.2	0	0	0	0	112.6	R33	R33-V35 PolarHBondContact O-N 2.89Å
36	K	28.3	Very low	43.2	Very low	186 Å²	186	116 Å²	116	81%	0.809	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-13.6	-170.8	-117.9	-178.8	179.3	-176	0	115.1	R33	R33-K36 PolarHBondContact O-N 3.44Å
37	E	29.3	Very low	45.9	Very low	142 Å²	142	111.6 Å²	111.6	66%	0.664	58%	0.579	S	S	*	*	S	Bend	trans	-112.9	-3.4	-178.7	-75.5	177.1	-178.2	0	0	113.6
38	E	37.2	Very low	48.5	Very low	140 Å²	140	109.9 Å²	109.9	65%	0.654	56%	0.555	S	S	*	*			trans	-79.5	-8.1	174.8	-84.2	-162.5	131.7	0	0	114.4	A40 K233	E38-A40 PolarHBondContact O-N 2.95Å; E38-A40 VanDerWaalsContact O-N 3.08Å; E38-K233 IonicContact OE1-NZ 3.09Å
39	E	41.8	Very low	51	Low	154 Å²	154	108 Å²	108	72%	0.72	55%	0.551	S	S	*	*			trans	-84	83.2	179.4	-76.5	-176.2	170.4	0	0	111.8	L41	E39-L41 PolarHBondContact O-N 3.03Å
40	A	52.6	Low	53.6	Low	68 Å²	68	104.3 Å²	104.3	56%	0.562	54%	0.535	S	S	*	.			trans	-66.2	-11.1	166.6	0	0	0	0	0	113.1	E38 P279	E38-A40 PolarHBondContact O-N 2.95Å; E38-A40 VanDerWaalsContact O-N 3.08Å; A40-P279 HydrophobicContact CB-CG 4.16Å
41	L	62.7	Low	56.2	Low	37 Å²	37	103.7 Å²	103.7	19%	0.194	52%	0.522	C	S	.	.	S	Bend	trans	-111.3	135.5	179.1	-60.7	169	0	0	0	108.1	E39 F45 M275 P279 Y335	E39-L41 PolarHBondContact O-N 3.03Å; L41-F45 HydrophobicContact CB-CB 4.28Å; L41-F45 HydrophobicContact CB-CD1 4.42Å; L41-F45 HydrophobicContact CD1-CD1 3.81Å; L41-F45 HydrophobicContact CD1-CE1 3.96Å; L41-F45 HydrophobicContact CD1-CG 4.49Å; L41-M275 HydrophobicContact CD2-CE 3.57Å; L41-P279 HydrophobicContact CD2-CB 3.97Å; L41-Y335 HydrophobicContact CD2-CD1 4.32Å; L41-Y335 HydrophobicContact CD2-CE1 3.79Å
42	G	65.1	Low	58.9	Low	23 Å²	23	99.1 Å²	99.1	24%	0.237	50%	0.504	C	S	.	.			trans	-74.5	167.9	-179.7	0	0	0	0	0	111.9	D44 F45 Y335	G42-D44 VanDerWaalsContact C-OD1 3.25Å; G42-D44 VanDerWaalsContact CA-OD1 3.25Å; G42-D44 WeakPolarHBondContact CA-OD1 3.17Å; G42-D44 PolarHBondContact O-N 2.85Å; G42-F45 PolarHBondContact O-N 2.84Å; G42-Y335 PolarHBondContact N-OH 3.15Å
43	A	62.3	Low	61.4	Low	110 Å²	110	92.5 Å²	92.5	91%	0.909	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-11.5	175.4	0	0	0	0	0	113.8	F45	A43-F45 VanDerWaalsContact C-N 3.33Å
44	D	71.3	Confident	64.1	Low	108 Å²	108	87.9 Å²	87.9	58%	0.578	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-7	175.1	59.3	-41.6	0	0	0	114	G42 Y335 R336	G42-D44 VanDerWaalsContact C-OD1 3.25Å; G42-D44 VanDerWaalsContact CA-OD1 3.25Å; G42-D44 WeakPolarHBondContact CA-OD1 3.17Å; G42-D44 PolarHBondContact O-N 2.85Å; D44-Y335 WeakPolarHBondContact OD2-CE2 3.38Å; D44-R336 IonicContact OD1-NH2 2.99Å
45	F	80.7	Confident	66.7	Low	19 Å²	19	79.8 Å²	79.8	8%	0.083	45%	0.445	C	S	.	.	S	Bend	trans	-99	117.1	176.2	-171.4	-99.9	0	0	0	111.8	L41 G42 A43 P47 M275 W328 Q331 Y335	L41-F45 HydrophobicContact CB-CB 4.28Å; L41-F45 HydrophobicContact CB-CD1 4.42Å; L41-F45 HydrophobicContact CD1-CD1 3.81Å; L41-F45 HydrophobicContact CD1-CE1 3.96Å; L41-F45 HydrophobicContact CD1-CG 4.49Å; G42-F45 PolarHBondContact O-N 2.84Å; A43-F45 VanDerWaalsContact C-N 3.33Å; F45-P47 WeakPolarHBondContact O-CD 3.38Å; F45-M275 HydrophobicContact CE2-CE 4.39Å; F45-W328 AromaticContact CE1-CH2 3.67Å; F45-W328 HydrophobicContact CE1-CH2 3.67Å; F45-W328 HydrophobicContact CE1-CZ2 4.15Å; F45-W328 HydrophobicContact CE1-CZ3 4.4Å; F45-W328 AromaticContact CZ-CH2 3.89Å; F45-W328 HydrophobicContact CZ-CH2 3.89Å; F45-W328 HydrophobicContact CZ-CZ2 4.15Å; F45-W328 HydrophobicContact CZ-CZ3 4.41Å; F45-Q331 HydrophobicContact CD2-CG 4.5Å; F45-Q331 HydrophobicContact CE2-CG 3.93Å; F45-Y335 HydrophobicContact CB-CD2 4.07Å; F45-Y335 HydrophobicContact CB-CE2 3.74Å; F45-Y335 HydrophobicContact CD2-CD1 4.23Å; F45-Y335 AromaticContact CD2-CD2 3.59Å; F45-Y335 HydrophobicContact CD2-CD2 3.59Å; F45-Y335 HydrophobicContact CD2-CE2 4.11Å; F45-Y335 AromaticContact CD2-CG 3.64Å; F45-Y335 HydrophobicContact CD2-CG 3.64Å; F45-Y335 HydrophobicContact CE2-CG 4.21Å; F45-Y335 HydrophobicContact CG-CD2 4.28Å; F45-Y335 HydrophobicContact CG-CE2 4.37Å
46	E	80.4	Confident	69.3	Low	82 Å²	82	76.8 Å²	76.8	38%	0.383	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-66.1	120.2	176.2	-172.8	-166.7	-178.3	0	0	110.9	T50 K51 W328 Q331	E46-T50 HydrophobicContact CG-CG2 4.47Å; E46-K51 WeakPolarHBondContact OE1-CE 3.46Å; E46-K51 WeakPolarHBondContact OE2-CE 3.32Å; E46-K51 IonicContact OE2-NZ 2.69Å; E46-K51 PolarHBondContact OE2-NZ 3.43Å; E46-K51 VanDerWaalsContact OE2-NZ 3.14Å; E46-W328 WeakPolarHBondContact O-CZ3 3.29Å; E46-Q331 PolarHBondContact O-NE2 3.43Å
47	P	83.7	Confident	72	Confident	60 Å²	60	71.6 Å²	71.6	39%	0.39	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-75.8	154.3	-177.7	30.7	-34.3	0	0	0	112.1	F45 S49 T50	F45-P47 WeakPolarHBondContact O-CD 3.38Å; P47-S49 PolarHBondContact O-N 3.15Å; P47-T50 PolarHBondContact O-N 3.24Å; P47-T50 VanDerWaalsContact O-N 3.14Å
48	W	83.3	Confident	74.5	Confident	20 Å²	20	69.1 Å²	69.1	8%	0.076	40%	0.402	C	S	.	.	H	α-helix	trans	-60.4	-29.5	179.3	-178.6	-107.7	0	0	0	112.9	T50 K51 R52 I55 F163 V164 R272 W328	W48-T50 PolarHBondContact O-N 3.08Å; W48-K51 HydrophobicContact CE3-CB 4.48Å; W48-K51 PolarHBondContact O-N 3.1Å; W48-K51 VanDerWaalsContact O-N 3.07Å; W48-R52 PolarHBondContact O-N 2.99Å; W48-R52 VanDerWaalsContact O-N 3.11Å; W48-I55 HydrophobicContact CH2-CD1 3.92Å; W48-I55 HydrophobicContact CZ2-CD1 4.06Å; W48-F163 HydrophobicContact CH2-CE1 4.26Å; W48-F163 HydrophobicContact CZ2-CD1 4.24Å; W48-F163 AromaticContact CZ2-CE1 3.73Å; W48-F163 HydrophobicContact CZ2-CE1 3.73Å; W48-V164 HydrophobicContact CZ2-CG2 3.97Å; W48-R272 HydrophobicContact CB-CG 4.49Å; W48-W328 HydrophobicContact CB-CH2 3.65Å; W48-W328 HydrophobicContact CB-CZ2 3.91Å; W48-W328 HydrophobicContact CB-CZ3 4.07Å; W48-W328 HydrophobicContact CD2-CD2 4.48Å; W48-W328 HydrophobicContact CE3-CB 4.3Å; W48-W328 AromaticContact CE3-CD2 3.4Å; W48-W328 HydrophobicContact CE3-CD2 3.4Å; W48-W328 AromaticContact CE3-CE2 3.85Å; W48-W328 AromaticContact CE3-CE3 3.5Å; W48-W328 HydrophobicContact CE3-CE3 3.5Å; W48-W328 VanDerWaalsContact CE3-CE3 3.5Å; W48-W328 AromaticContact CE3-CG 3.77Å; W48-W328 HydrophobicContact CE3-CG 3.77Å; W48-W328 HydrophobicContact CE3-CH2 4.38Å; W48-W328 HydrophobicContact CE3-CZ2 4.33Å; W48-W328 AromaticContact CE3-CZ3 3.98Å; W48-W328 HydrophobicContact CE3-CZ3 3.98Å; W48-W328 HydrophobicContact CZ3-CB 3.75Å; W48-W328 AromaticContact CZ3-CD2 3.81Å; W48-W328 HydrophobicContact CZ3-CD2 3.81Å; W48-W328 HydrophobicContact CZ3-CE3 4.07Å; W48-W328 AromaticContact CZ3-CG 3.66Å; W48-W328 HydrophobicContact CZ3-CG 3.66Å; W48-W328 VanDerWaalsContact N-CH2 3.29Å
49	S	82.2	Confident	76.9	Confident	83 Å²	83	63 Å²	63	58%	0.58	37%	0.373	S	S	*	.	H	α-helix	trans	-59.1	-32.2	177.3	49.9	0	0	0	0	113.1	P47 R52	P47-S49 PolarHBondContact O-N 3.15Å; S49-R52 WeakPolarHBondContact O-CB 3.3Å
50	T	83	Confident	78.9	Confident	83 Å²	83	59.2 Å²	59.2	51%	0.509	36%	0.36	S	S	.	.	H	α-helix	trans	-66.8	-39.3	175.4	-51.6	0	0	0	0	111.1	E46 P47 W48	E46-T50 HydrophobicContact CG-CG2 4.47Å; P47-T50 PolarHBondContact O-N 3.24Å; P47-T50 VanDerWaalsContact O-N 3.14Å; W48-T50 PolarHBondContact O-N 3.08Å
51	K	82.5	Confident	80.2	Confident	26 Å²	26	56.7 Å²	56.7	11%	0.113	34%	0.338	C	S	.	.	H	α-helix	trans	-75.6	-25	-179.3	-58.8	-166.9	-179.2	-172	0	113.4	E46 W48 G53 E54 I55 W328	E46-K51 WeakPolarHBondContact OE1-CE 3.46Å; E46-K51 WeakPolarHBondContact OE2-CE 3.32Å; E46-K51 IonicContact OE2-NZ 2.69Å; E46-K51 PolarHBondContact OE2-NZ 3.43Å; E46-K51 VanDerWaalsContact OE2-NZ 3.14Å; W48-K51 HydrophobicContact CE3-CB 4.48Å; W48-K51 PolarHBondContact O-N 3.1Å; W48-K51 VanDerWaalsContact O-N 3.07Å; K51-G53 VanDerWaalsContact C-N 3.33Å; K51-G53 PolarHBondContact O-N 3.5Å; K51-E54 PolarHBondContact O-N 2.85Å; K51-I55 HydrophobicContact CB-CD1 4.29Å; K51-I55 WeakPolarHBondContact O-CD1 3.48Å; K51-I55 VanDerWaalsContact O-CG1 3.22Å; K51-I55 WeakPolarHBondContact O-CG1 3.42Å; K51-I55 PolarHBondContact O-N 3Å; K51-W328 HydrophobicContact CD-CE3 4.02Å; K51-W328 HydrophobicContact CD-CZ3 4.41Å
52	R	86.2	Confident	80.7	Confident	85 Å²	85	62 Å²	62	32%	0.321	37%	0.372	S	S	.	.	H	α-helix	trans	-53.4	-47.3	178.2	167.9	169.8	-162.2	-64.1	0.8	112.4	W48 S49 I55 L56 V164 D168	W48-R52 PolarHBondContact O-N 2.99Å; W48-R52 VanDerWaalsContact O-N 3.11Å; S49-R52 WeakPolarHBondContact O-CB 3.3Å; R52-I55 PolarHBondContact O-N 3.48Å; R52-L56 HydrophobicContact CG-CD1 4.03Å; R52-L56 WeakPolarHBondContact O-CG 3.21Å; R52-L56 PolarHBondContact O-N 3.27Å; R52-L56 VanDerWaalsContact O-N 3.13Å; R52-V164 HydrophobicContact CB-CG1 4.1Å; R52-V164 HydrophobicContact CG-CG1 3.65Å; R52-D168 IonicContact CZ-OD2 2.64Å; R52-D168 IonicContact NE-OD1 2.95Å; R52-D168 IonicContact NE-OD2 2.9Å; R52-D168 PolarHBondContact NE-OD2 3.45Å; R52-D168 IonicContact NH2-OD2 3.85Å; R52-D168 PolarHBondContact NH2-OD2 3.47Å
53	G	83.6	Confident	81.2	Confident	45 Å²	45	64.9 Å²	64.9	46%	0.464	38%	0.379	S	S	.	.	H	α-helix	trans	-62.6	-46.5	-179.6	0	0	0	0	0	112.7	K51 I55 L56 A57	K51-G53 VanDerWaalsContact C-N 3.33Å; K51-G53 PolarHBondContact O-N 3.5Å; G53-I55 PolarHBondContact O-N 2.82Å; G53-L56 PolarHBondContact O-N 3.47Å; G53-A57 WeakPolarHBondContact O-CB 3.35Å; G53-A57 PolarHBondContact O-N 3.12Å; G53-A57 VanDerWaalsContact O-N 3.11Å
54	E	84.8	Confident	81.7	Confident	96 Å²	96	66.6 Å²	66.6	45%	0.449	37%	0.367	S	S	.	.	H	α-helix	trans	-61.3	-43.4	178.2	-171.7	-171.9	164.4	0	0	111.5	K51 A57 R58	K51-E54 PolarHBondContact O-N 2.85Å; E54-A57 PolarHBondContact O-N 3.03Å; E54-R58 WeakPolarHBondContact O-CB 3.22Å; E54-R58 PolarHBondContact O-N 2.85Å; E54-R58 IonicContact OE1-NH1 2.76Å
55	I	87.4	Confident	82.1	Confident	6 Å²	6	61.6 Å²	61.6	3%	0.031	34%	0.34	C	S	.	.	H	α-helix	trans	-63	-48.4	-179.3	-65.7	164.4	0	0	0	110.7	W48 K51 R52 G53 A57 R58 F59 P160 S161 V164 P324	W48-I55 HydrophobicContact CH2-CD1 3.92Å; W48-I55 HydrophobicContact CZ2-CD1 4.06Å; K51-I55 HydrophobicContact CB-CD1 4.29Å; K51-I55 WeakPolarHBondContact O-CD1 3.48Å; K51-I55 VanDerWaalsContact O-CG1 3.22Å; K51-I55 WeakPolarHBondContact O-CG1 3.42Å; K51-I55 PolarHBondContact O-N 3Å; R52-I55 PolarHBondContact O-N 3.48Å; G53-I55 PolarHBondContact O-N 2.82Å; I55-A57 VanDerWaalsContact C-N 3.3Å; I55-A57 PolarHBondContact O-N 3.45Å; I55-R58 PolarHBondContact O-N 2.89Å; I55-F59 HydrophobicContact CB-CD2 4.4Å; I55-F59 HydrophobicContact CG2-CD2 3.87Å; I55-F59 HydrophobicContact CG2-CE2 4.47Å; I55-F59 WeakPolarHBondContact O-CD2 3.38Å; I55-F59 PolarHBondContact O-N 3.04Å; I55-P160 HydrophobicContact CG2-CB 3.72Å; I55-S161 PolarHBondContact O-OG 3.47Å; I55-V164 HydrophobicContact CB-CG2 4.35Å; I55-V164 HydrophobicContact CD1-CG2 3.91Å; I55-V164 HydrophobicContact CG2-CG2 3.91Å; I55-P324 HydrophobicContact CD1-CB 3.8Å; I55-P324 HydrophobicContact CD1-CG 4.48Å; I55-P324 HydrophobicContact CG1-CB 3.95Å; I55-P324 HydrophobicContact CG1-CG 4.1Å
56	L	86.6	Confident	81.6	Confident	40 Å²	40	61.9 Å²	61.9	21%	0.209	34%	0.344	C	S	.	.	H	α-helix	trans	-65.6	-33	-178.1	-68.1	174	0	0	0	112.9	R52 G53 L165	R52-L56 HydrophobicContact CG-CD1 4.03Å; R52-L56 WeakPolarHBondContact O-CG 3.21Å; R52-L56 PolarHBondContact O-N 3.27Å; R52-L56 VanDerWaalsContact O-N 3.13Å; G53-L56 PolarHBondContact O-N 3.47Å; L56-L165 HydrophobicContact CD2-CD2 4.19Å; L56-L165 HydrophobicContact CD2-CG 4.11Å
57	A	84.4	Confident	81.1	Confident	77 Å²	77	58 Å²	58	64%	0.636	33%	0.326	S	S	*	.	H	α-helix	trans	-76.4	-34.8	177.2	0	0	0	0	0	112.8	G53 E54 I55 T60	G53-A57 WeakPolarHBondContact O-CB 3.35Å; G53-A57 PolarHBondContact O-N 3.12Å; G53-A57 VanDerWaalsContact O-N 3.11Å; E54-A57 PolarHBondContact O-N 3.03Å; I55-A57 VanDerWaalsContact C-N 3.3Å; I55-A57 PolarHBondContact O-N 3.45Å; A57-T60 WeakPolarHBondContact O-CG2 3.47Å
58	R	83.8	Confident	80	Confident	90 Å²	90	59 Å²	59	34%	0.34	33%	0.328	S	S	.	.	H	α-helix	trans	-86.3	-37.3	-174.1	-173.8	174.8	-178.3	178.6	-0.8	113.8	E54 I55 T60 M320	E54-R58 WeakPolarHBondContact O-CB 3.22Å; E54-R58 PolarHBondContact O-N 2.85Å; E54-R58 IonicContact OE1-NH1 2.76Å; I55-R58 PolarHBondContact O-N 2.89Å; R58-T60 PolarHBondContact O-N 3.3Å; R58-M320 PolarHBondContact NH2-SD 3.12Å
59	F	86.3	Confident	78.8	Confident	12 Å²	12	58.9 Å²	58.9	5%	0.053	33%	0.329	C	S	.	.	S	Bend	trans	-103.6	72.5	-174.4	-60.1	-75.2	0	0	0	110.2	I55 P160 S161 L321 P324	I55-F59 HydrophobicContact CB-CD2 4.4Å; I55-F59 HydrophobicContact CG2-CD2 3.87Å; I55-F59 HydrophobicContact CG2-CE2 4.47Å; I55-F59 WeakPolarHBondContact O-CD2 3.38Å; I55-F59 PolarHBondContact O-N 3.04Å; F59-P160 HydrophobicContact CB-CB 4.01Å; F59-P160 HydrophobicContact CB-CG 4.19Å; F59-P160 HydrophobicContact CD1-CB 4.33Å; F59-P160 HydrophobicContact CD1-CG 3.83Å; F59-P160 HydrophobicContact CD2-CB 3.59Å; F59-P160 HydrophobicContact CD2-CG 3.99Å; F59-P160 HydrophobicContact CE1-CG 4.16Å; F59-P160 HydrophobicContact CE2-CB 4.09Å; F59-P160 HydrophobicContact CE2-CG 4.3Å; F59-P160 HydrophobicContact CG-CB 3.71Å; F59-P160 HydrophobicContact CG-CG 3.72Å; F59-P160 HydrophobicContact CZ-CG 4.37Å; F59-S161 WeakPolarHBondContact O-CB 3.36Å; F59-S161 PolarHBondContact O-OG 2.82Å; F59-L321 HydrophobicContact CD1-CD2 3.56Å; F59-L321 HydrophobicContact CE1-CD2 3.68Å; F59-P324 HydrophobicContact CE2-CG 3.49Å; F59-P324 VanDerWaalsContact CE2-CG 3.49Å; F59-P324 HydrophobicContact CZ-CG 3.84Å
60	T	84.3	Confident	76.7	Confident	73 Å²	73	58.4 Å²	58.4	45%	0.448	33%	0.325	S	S	.	.			trans	-100.6	163.6	178.3	60.7	0	0	0	0	110.9	A57 R58 Q113	A57-T60 WeakPolarHBondContact O-CG2 3.47Å; R58-T60 PolarHBondContact O-N 3.3Å; T60-Q113 VanDerWaalsContact CA-OE1 3.24Å
61	T	80.7	Confident	74.6	Confident	15 Å²	15	57.2 Å²	57.2	9%	0.092	31%	0.314	C	S	.	.			trans	-147.2	144.9	175.9	-173.5	0	0	0	0	112.2	E63 L65 Q113 V155 F158	T61-E63 WeakPolarHBondContact OG1-CB 3.44Å; T61-E63 PolarHBondContact OG1-N 2.97Å; T61-L65 HydrophobicContact CG2-CD1 4.23Å; T61-L65 HydrophobicContact CG2-CD2 4.13Å; T61-L65 HydrophobicContact CG2-CG 4.27Å; T61-Q113 VanDerWaalsContact N-OE1 3.15Å; T61-V155 HydrophobicContact CG2-CG1 4.17Å; T61-F158 HydrophobicContact CG2-CB 3.73Å; T61-F158 HydrophobicContact CG2-CD2 4.03Å; T61-F158 HydrophobicContact CG2-CG 3.93Å
62	T	72.7	Confident	72.3	Confident	150 Å²	150	59.4 Å²	59.4	92%	0.92	34%	0.344	S	S	*	.			trans	-95	-5.2	167.8	55.1	0	0	0	0	112.3
63	E	74.4	Confident	69.4	Low	82 Å²	82	60.9 Å²	60.9	38%	0.383	37%	0.367	S	S	.	.	S	Bend	trans	-73.8	149.8	177.9	-62.4	-169.4	158.4	0	0	111.5	T61 L65 V155	T61-E63 WeakPolarHBondContact OG1-CB 3.44Å; T61-E63 PolarHBondContact OG1-N 2.97Å; E63-L65 PolarHBondContact O-N 3.13Å; E63-V155 HydrophobicContact CB-CG1 4.24Å; E63-V155 HydrophobicContact CB-CG2 4.33Å
64	K	74.7	Confident	66.8	Low	147 Å²	147	65.5 Å²	65.5	64%	0.639	38%	0.381	S	S	*	.			trans	-74.7	114	-178.1	-83.7	-179.1	177.7	-167.4	0	110.3	N110	K64-N110 HydrophobicContact CB-CB 4.41Å; K64-N110 HydrophobicContact CD-CB 3.79Å; K64-N110 WeakPolarHBondContact CD-OD1 3.42Å; K64-N110 HydrophobicContact CG-CB 4.21Å
65	L	78.1	Confident	64.4	Low	2 Å²	2	73.4 Å²	73.4	1%	0.01	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	155.2	-179	-63	170.3	0	0	0	111.3	T61 E63 N110 L111 Y116 V155 F158	T61-L65 HydrophobicContact CG2-CD1 4.23Å; T61-L65 HydrophobicContact CG2-CD2 4.13Å; T61-L65 HydrophobicContact CG2-CG 4.27Å; E63-L65 PolarHBondContact O-N 3.13Å; L65-N110 PolarHBondContact O-N 3.22Å; L65-N110 VanDerWaalsContact O-N 3.08Å; L65-L111 HydrophobicContact CB-CB 4.28Å; L65-L111 PolarHBondContact N-O 3.16Å; L65-L111 PolarHBondContact O-N 3.45Å; L65-Y116 HydrophobicContact CB-CD2 3.83Å; L65-Y116 HydrophobicContact CB-CG 4.46Å; L65-Y116 HydrophobicContact CD1-CD1 4.5Å; L65-Y116 HydrophobicContact CD1-CD2 3.95Å; L65-Y116 HydrophobicContact CD1-CG 3.79Å; L65-Y116 HydrophobicContact CG-CD2 4.47Å; L65-V155 HydrophobicContact CD2-CB 3.82Å; L65-V155 HydrophobicContact CD2-CG1 3.99Å; L65-V155 HydrophobicContact CD2-CG2 3.87Å; L65-F158 HydrophobicContact CD1-CD1 3.74Å; L65-F158 HydrophobicContact CD1-CE1 3.66Å; L65-F158 HydrophobicContact CD1-CG 4.3Å; L65-F158 HydrophobicContact CD1-CZ 4.15Å; L65-F158 HydrophobicContact CD2-CB 4.36Å; L65-F158 HydrophobicContact CD2-CD1 3.76Å; L65-F158 HydrophobicContact CD2-CE1 4.44Å; L65-F158 HydrophobicContact CD2-CG 4.25Å; L65-F158 HydrophobicContact CG-CD1 4.44Å
66	S	70.3	Confident	61.8	Low	26 Å²	26	75.7 Å²	75.7	18%	0.182	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	144.7	174.9	54.1	0	0	0	0	111.9	L108	S66-L108 CarbonylContact C-O 3.53Å; S66-L108 VanDerWaalsContact CA-O 3.24Å; S66-L108 WeakPolarHBondContact CA-O 3.43Å
67	I	71.4	Confident	59.1	Low	0 Å²	0	83.5 Å²	83.5	0%	0	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	110.4	171.3	-67.3	173.3	0	0	0	107.8	L69 L108 L111 Y116 R119 L149	I67-L69 HydrophobicContact CG2-CD1 3.75Å; I67-L69 HydrophobicContact CG2-CD2 4.31Å; I67-L69 HydrophobicContact CG2-CG 3.63Å; I67-L108 HydrophobicContact CB-CB 4.36Å; I67-L108 PolarHBondContact N-O 2.96Å; I67-L108 PolarHBondContact O-N 3.14Å; I67-L108 VanDerWaalsContact O-N 3.08Å; I67-L111 HydrophobicContact CB-CD1 4.32Å; I67-L111 HydrophobicContact CD1-CD1 3.59Å; I67-L111 HydrophobicContact CG1-CD1 3.8Å; I67-Y116 HydrophobicContact CD1-CD2 3.72Å; I67-Y116 HydrophobicContact CD1-CE2 3.75Å; I67-Y116 HydrophobicContact CD1-CG 4.36Å; I67-Y116 HydrophobicContact CG1-CD2 3.63Å; I67-Y116 HydrophobicContact CG1-CE2 3.32Å; I67-R119 HydrophobicContact CD1-CB 3.97Å; I67-R119 HydrophobicContact CD1-CG 3.7Å; I67-L149 HydrophobicContact CG2-CD1 4.34Å; I67-L149 HydrophobicContact CG2-CD2 4.15Å
68	N	60.3	Low	56.5	Low	80 Å²	80	84.3 Å²	84.3	43%	0.428	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	96.3	177.1	-67.8	-19.3	0	0	0	109.5	C70	N68-C70 VanDerWaalsContact C-N 3.3Å; N68-C70 PolarHBondContact O-N 3.06Å
69	L	56.8	Low	54.1	Low	19 Å²	19	86 Å²	86	10%	0.099	49%	0.494	C	S	.	.			trans	-93.8	40.1	179.1	-69	162.8	0	0	0	112.1	I67 M71 Q145	I67-L69 HydrophobicContact CG2-CD1 3.75Å; I67-L69 HydrophobicContact CG2-CD2 4.31Å; I67-L69 HydrophobicContact CG2-CG 3.63Å; L69-M71 PolarHBondContact O-N 3.34Å; L69-Q145 HydrophobicContact CD2-CB 3.81Å; L69-Q145 HydrophobicContact CD2-CG 4.39Å
70	C	39.3	Very low	51.3	Low	73 Å²	73	92.8 Å²	92.8	49%	0.493	53%	0.531	S	S	.	.			trans	-72.3	116.5	-174.1	-153.8	0	0	0	0	111.3	N68	N68-C70 VanDerWaalsContact C-N 3.3Å; N68-C70 PolarHBondContact O-N 3.06Å
71	M	37.3	Very low	48.9	Very low	57 Å²	57	95.7 Å²	95.7	28%	0.281	55%	0.551	S	S	.	*			trans	-81.3	111.2	167	-72.1	-79.4	-89.2	0	0	107.4	L69 S73 K141 Q145	L69-M71 PolarHBondContact O-N 3.34Å; M71-S73 PolarHBondContact O-N 2.94Å; M71-K141 HydrophobicContact CE-CD 3.69Å; M71-K141 HydrophobicContact CE-CG 4.21Å; M71-Q145 VanDerWaalsContact CG-NE2 3.3Å; M71-Q145 HydrophobicContact SD-CG 4.44Å; M71-Q145 PolarHBondContact SD-NE2 3.34Å
72	G	34.9	Very low	46.7	Very low	73 Å²	73	98.5 Å²	98.5	75%	0.753	58%	0.583	S	S	*	*			trans	-66.3	123.6	-171.7	0	0	0	0	0	113.3
73	S	26.4	Very low	44.5	Very low	115 Å²	115	96.9 Å²	96.9	80%	0.804	58%	0.578	S	S	*	*			trans	-91.9	130.9	136	175.6	0	0	0	0	107.7	M71 R75	M71-S73 PolarHBondContact O-N 2.94Å; S73-R75 PolarHBondContact O-N 2.96Å; S73-R75 VanDerWaalsContact O-N 3.14Å
74	D	28.1	Very low	42.5	Very low	142 Å²	142	97.9 Å²	97.9	76%	0.759	59%	0.594	S	S	*	*			trans	-51	112.3	-179.1	-83.6	-38.8	0	0	0	111.8	G76	D74-G76 PolarHBondContact O-N 3.16Å
75	R	35.3	Very low	41.1	Very low	262 Å²	262	95.7 Å²	95.7	99%	0.989	60%	0.603	S	S	*	*			trans	-76.2	79.1	160.1	-83.9	-165.4	174.7	-164	1.3	109	S73	S73-R75 PolarHBondContact O-N 2.96Å; S73-R75 VanDerWaalsContact O-N 3.14Å
76	G	32.8	Very low	39.3	Very low	54 Å²	54	100.5 Å²	100.5	56%	0.557	63%	0.632	S	S	*	*			trans	-162.3	60.9	-177.1	0	0	0	0	0	114	D74	D74-G76 PolarHBondContact O-N 3.16Å
77	K	28.9	Very low	38.1	Very low	205 Å²	205	103 Å²	103	89%	0.891	65%	0.65	S	S	*	*			trans	166.4	131.1	140.5	-92.3	160.1	-176.2	-179.8	0	110.5
78	A	29.8	Very low	36.8	Very low	94 Å²	94	110.7 Å²	110.7	78%	0.777	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-56.2	137.7	166.2	0	0	0	0	0	110	N80	A78-N80 PolarHBondContact O-N 3.32Å
79	P	33.2	Very low	36	Very low	126 Å²	126	114.6 Å²	114.6	82%	0.818	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-81.6	120.1	176.6	30	-26.6	0	0	0	109.6
80	N	27.8	Very low	35.5	Very low	154 Å²	154	117.1 Å²	117.1	82%	0.824	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-65.3	142.2	157.1	-86.7	-12.3	0	0	0	109.1	A78 G82	A78-N80 PolarHBondContact O-N 3.32Å; N80-G82 PolarHBondContact O-N 3.09Å
81	P	33.3	Very low	35.8	Very low	133 Å²	133	120.9 Å²	120.9	86%	0.864	72%	0.719	S	S	*	*	S	Bend	trans	-83.5	117.6	177.9	32.1	-29	0	0	0	109.8
82	G	34.4	Very low	36.2	Very low	75 Å²	75	121.2 Å²	121.2	77%	0.773	72%	0.724	S	S	*	*			trans	140.3	100.7	163.7	0	0	0	0	0	113.6	N80	N80-G82 PolarHBondContact O-N 3.09Å
83	S	27.2	Very low	36.6	Very low	116 Å²	116	126.5 Å²	126.5	81%	0.811	72%	0.722	S	S	*	*			trans	161.8	114.6	134.6	170.6	0	0	0	0	112.1
84	S	32.8	Very low	37.3	Very low	103 Å²	103	126 Å²	126	72%	0.72	71%	0.709	S	S	*	*			trans	83.7	108.5	136.1	-172.4	0	0	0	0	120.4	V86	S84-V86 PolarHBondContact O-N 2.66Å
85	A	44.5	Very low	38.1	Very low	101 Å²	101	122.7 Å²	122.7	84%	0.835	69%	0.689	S	S	*	*			trans	-18.5	111.4	158.9	0	0	0	0	0	117
86	V	40.5	Very low	38.3	Very low	102 Å²	102	115.8 Å²	115.8	62%	0.618	67%	0.668	S	S	*	*			trans	-105.7	127.6	153.3	177.7	0	0	0	0	106.8	S84 E88 V90	S84-V86 PolarHBondContact O-N 2.66Å; V86-E88 PolarHBondContact O-N 3.34Å; V86-V90 HydrophobicContact CG1-CB 3.82Å; V86-V90 HydrophobicContact CG1-CG1 3.77Å
87	S	46.1	Very low	38.7	Very low	80 Å²	80	118.6 Å²	118.6	56%	0.559	67%	0.67	S	S	*	*			trans	-53.2	135.2	-177.9	-179.5	0	0	0	0	111.5	K89 V90 R91	S87-K89 PolarHBondContact O-N 3.3Å; S87-V90 PolarHBondContact O-N 3.18Å; S87-R91 PolarHBondContact O-N 3.29Å; S87-R91 VanDerWaalsContact O-N 3.12Å
88	E	42.3	Very low	39	Very low	160 Å²	160	113.9 Å²	113.9	75%	0.748	65%	0.654	S	S	*	*	H	α-helix	trans	-52.1	-24.8	-179.8	-155.7	168	-157.5	0	0	113.2	V86 T92	V86-E88 PolarHBondContact O-N 3.34Å; E88-T92 PolarHBondContact O-N 2.88Å; E88-T92 PolarHBondContact O-OG1 3.13Å
89	K	44.2	Very low	39.2	Very low	162 Å²	162	114.1 Å²	114.1	70%	0.704	64%	0.643	S	S	*	*	H	α-helix	trans	-76.1	-28.8	173.6	-77.2	-176.4	174.9	178.2	0	115.2	S87 T92 R93	S87-K89 PolarHBondContact O-N 3.3Å; K89-T92 VanDerWaalsContact CA-OG1 3.29Å; K89-T92 WeakPolarHBondContact CA-OG1 3.44Å; K89-R93 WeakPolarHBondContact O-CG 3.44Å; K89-R93 PolarHBondContact O-N 3.08Å
90	V	45.9	Very low	39.3	Very low	73 Å²	73	115.2 Å²	115.2	44%	0.442	64%	0.641	S	S	.	*	H	α-helix	trans	-80.5	-34.2	172.8	175.7	0	0	0	0	109.2	V86 S87 R93 L94	V86-V90 HydrophobicContact CG1-CB 3.82Å; V86-V90 HydrophobicContact CG1-CG1 3.77Å; S87-V90 PolarHBondContact O-N 3.18Å; V90-R93 PolarHBondContact O-N 2.95Å; V90-L94 HydrophobicContact CG1-CD1 3.93Å; V90-L94 WeakPolarHBondContact O-CB 3.44Å; V90-L94 PolarHBondContact O-N 2.96Å
91	R	45.9	Very low	39.8	Very low	152 Å²	152	112.8 Å²	112.8	57%	0.574	63%	0.625	S	S	*	*	H	α-helix	trans	-64.3	-46.8	170.8	-172.3	180	171.4	133	8.6	111.9	S87 R93 L94 E95	S87-R91 PolarHBondContact O-N 3.29Å; S87-R91 VanDerWaalsContact O-N 3.12Å; R91-R93 VanDerWaalsContact C-N 3.31Å; R91-R93 PolarHBondContact O-N 3.33Å; R91-L94 CarbonylContact O-C 3.59Å; R91-L94 PolarHBondContact O-N 3.16Å; R91-E95 HydrophobicContact CG-CG 4.31Å; R91-E95 IonicContact CZ-OE1 3.35Å; R91-E95 IonicContact NE-OE1 2.75Å; R91-E95 PolarHBondContact NE-OE1 3.16Å; R91-E95 IonicContact NE-OE2 3.86Å; R91-E95 IonicContact NH2-OE1 3.05Å; R91-E95 PolarHBondContact NH2-OE1 3.33Å; R91-E95 VanDerWaalsContact O-CB 3.28Å; R91-E95 WeakPolarHBondContact O-CB 3.42Å; R91-E95 WeakPolarHBondContact O-CG 3.25Å; R91-E95 PolarHBondContact O-N 3.23Å
92	T	45	Very low	39.9	Very low	64 Å²	64	113.8 Å²	113.8	39%	0.393	62%	0.618	S	S	.	*	H	α-helix	trans	-65.7	-29.9	173.4	21.9	0	0	0	0	112.9	E88 K89 E96	E88-T92 PolarHBondContact O-N 2.88Å; E88-T92 PolarHBondContact O-OG1 3.13Å; K89-T92 VanDerWaalsContact CA-OG1 3.29Å; K89-T92 WeakPolarHBondContact CA-OG1 3.44Å; T92-E96 WeakPolarHBondContact O-CB 3.41Å; T92-E96 WeakPolarHBondContact O-CG 3.39Å; T92-E96 PolarHBondContact O-N 3.03Å
93	R	44.7	Very low	39.9	Very low	184 Å²	184	113.9 Å²	113.9	69%	0.694	62%	0.619	S	S	*	*	H	α-helix	trans	-75.2	-28.3	172	-78.4	-176.2	-178.6	179.3	0.8	114	K89 V90 R91 L97	K89-R93 WeakPolarHBondContact O-CG 3.44Å; K89-R93 PolarHBondContact O-N 3.08Å; V90-R93 PolarHBondContact O-N 2.95Å; R91-R93 VanDerWaalsContact C-N 3.31Å; R91-R93 PolarHBondContact O-N 3.33Å; R93-L97 WeakPolarHBondContact O-CB 3.43Å; R93-L97 WeakPolarHBondContact O-CD1 3.49Å; R93-L97 WeakPolarHBondContact O-CG 3.34Å; R93-L97 PolarHBondContact O-N 3.06Å; R93-L97 VanDerWaalsContact O-N 3.17Å
94	L	40.2	Very low	40.4	Very low	103 Å²	103	110.6 Å²	110.6	54%	0.539	60%	0.596	S	S	.	*	H	α-helix	trans	-78.5	-38.3	172.7	-88.6	152.3	0	0	0	111	V90 R91 L97 D98	V90-L94 HydrophobicContact CG1-CD1 3.93Å; V90-L94 WeakPolarHBondContact O-CB 3.44Å; V90-L94 PolarHBondContact O-N 2.96Å; R91-L94 CarbonylContact O-C 3.59Å; R91-L94 PolarHBondContact O-N 3.16Å; L94-L97 PolarHBondContact O-N 3.07Å; L94-D98 WeakPolarHBondContact O-CB 3.27Å; L94-D98 PolarHBondContact O-N 2.93Å
95	E	44.8	Very low	40.8	Very low	74 Å²	74	111.8 Å²	111.8	35%	0.346	59%	0.59	S	S	.	*	H	α-helix	trans	-68.8	-38.4	172.3	-73.1	169.1	169.3	0	0	110.5	R91 L97 D98 D99	R91-E95 HydrophobicContact CG-CG 4.31Å; R91-E95 IonicContact CZ-OE1 3.35Å; R91-E95 IonicContact NE-OE1 2.75Å; R91-E95 PolarHBondContact NE-OE1 3.16Å; R91-E95 IonicContact NE-OE2 3.86Å; R91-E95 IonicContact NH2-OE1 3.05Å; R91-E95 PolarHBondContact NH2-OE1 3.33Å; R91-E95 VanDerWaalsContact O-CB 3.28Å; R91-E95 WeakPolarHBondContact O-CB 3.42Å; R91-E95 WeakPolarHBondContact O-CG 3.25Å; R91-E95 PolarHBondContact O-N 3.23Å; E95-L97 VanDerWaalsContact C-N 3.3Å; E95-L97 PolarHBondContact O-N 2.96Å; E95-D98 CarbonylContact O-C 3.6Å; E95-D98 PolarHBondContact O-N 3.29Å; E95-D99 VanDerWaalsContact O-CB 3.26Å; E95-D99 WeakPolarHBondContact O-CB 3.46Å; E95-D99 PolarHBondContact O-N 3.42Å
96	E	41.2	Very low	41	Very low	117 Å²	117	115.9 Å²	115.9	55%	0.547	58%	0.584	S	S	.	*	H	α-helix	trans	-70.5	-23.1	171.2	-77.7	173.3	174.4	0	0	113.1	T92 L100	T92-E96 WeakPolarHBondContact O-CB 3.41Å; T92-E96 WeakPolarHBondContact O-CG 3.39Å; T92-E96 PolarHBondContact O-N 3.03Å; E96-L100 WeakPolarHBondContact O-CD1 3.38Å; E96-L100 VanDerWaalsContact O-CG 3.29Å; E96-L100 WeakPolarHBondContact O-CG 3.34Å; E96-L100 PolarHBondContact O-N 3.29Å
97	L	39.5	Very low	41.5	Very low	112 Å²	112	117.1 Å²	117.1	59%	0.586	58%	0.583	S	S	*	*	H	α-helix	trans	-81.4	-32.3	171	-81.1	166.4	0	0	0	111.9	R93 L94 E95 E101	R93-L97 WeakPolarHBondContact O-CB 3.43Å; R93-L97 WeakPolarHBondContact O-CD1 3.49Å; R93-L97 WeakPolarHBondContact O-CG 3.34Å; R93-L97 PolarHBondContact O-N 3.06Å; R93-L97 VanDerWaalsContact O-N 3.17Å; L94-L97 PolarHBondContact O-N 3.07Å; E95-L97 VanDerWaalsContact C-N 3.3Å; E95-L97 PolarHBondContact O-N 2.96Å; L97-E101 PolarHBondContact O-N 2.9Å
98	D	35.4	Very low	42.2	Very low	106 Å²	106	115.3 Å²	115.3	57%	0.567	57%	0.567	S	S	*	*	H	α-helix	trans	-70.5	-40.9	170	-99.4	-12.8	0	0	0	111.2	L94 E95 L100 E101 E102	L94-D98 WeakPolarHBondContact O-CB 3.27Å; L94-D98 PolarHBondContact O-N 2.93Å; E95-D98 CarbonylContact O-C 3.6Å; E95-D98 PolarHBondContact O-N 3.29Å; D98-L100 PolarHBondContact O-N 3.2Å; D98-E101 PolarHBondContact O-N 2.89Å; D98-E102 PolarHBondContact O-N 2.91Å; D98-E102 VanDerWaalsContact O-N 3.17Å
99	D	34.9	Very low	43.4	Very low	100 Å²	100	112.4 Å²	112.4	54%	0.535	56%	0.556	S	S	.	*	H	α-helix	trans	-67.9	-23.2	177.8	-72.4	-14.5	0	0	0	112.1	E95	E95-D99 VanDerWaalsContact O-CB 3.26Å; E95-D99 WeakPolarHBondContact O-CB 3.46Å; E95-D99 PolarHBondContact O-N 3.42Å
100	L	35	Very low	44.7	Very low	148 Å²	148	109.8 Å²	109.8	78%	0.775	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-16.4	170.5	-76.7	168.2	0	0	0	113.2	E96 D98	E96-L100 WeakPolarHBondContact O-CD1 3.38Å; E96-L100 VanDerWaalsContact O-CG 3.29Å; E96-L100 WeakPolarHBondContact O-CG 3.34Å; E96-L100 PolarHBondContact O-N 3.29Å; D98-L100 PolarHBondContact O-N 3.2Å
101	E	39	Very low	46.1	Very low	104 Å²	104	107.4 Å²	107.4	49%	0.486	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-7.1	173.2	-76.8	-160.9	144	0	0	113.5	L97 D98 G103 S104 K141	L97-E101 PolarHBondContact O-N 2.9Å; D98-E101 PolarHBondContact O-N 2.89Å; E101-G103 PolarHBondContact O-N 3.37Å; E101-S104 PolarHBondContact O-OG 2.88Å; E101-K141 IonicContact OE1-NZ 3.88Å; E101-K141 PolarHBondContact OE1-NZ 2.9Å
102	E	35.3	Very low	47.9	Very low	153 Å²	153	102.6 Å²	102.6	72%	0.715	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	21.1	-177.8	-107.7	-167	175.3	0	0	116.5	D98	D98-E102 PolarHBondContact O-N 2.91Å; D98-E102 VanDerWaalsContact O-N 3.17Å
103	G	34	Very low	49.6	Very low	78 Å²	78	102.2 Å²	102.2	80%	0.804	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-8.6	168.3	0	0	0	0	0	114.8	E101	E101-G103 PolarHBondContact O-N 3.37Å
104	S	36.7	Very low	51.4	Low	47 Å²	47	100.3 Å²	100.3	33%	0.329	52%	0.516	S	S	.	.			trans	-128.7	20.6	-157.6	66	0	0	0	0	116.9	E101	E101-S104 PolarHBondContact O-OG 2.88Å
105	H	40.8	Very low	53.5	Low	127 Å²	127	99.3 Å²	99.3	59%	0.588	51%	0.512	S	S	*	.			trans	-110.5	73.9	169.4	-75.2	-104	0	0	0	110.8
106	R	49	Very low	55.4	Low	188 Å²	188	95.8 Å²	95.8	71%	0.709	50%	0.495	S	S	*	.			trans	-120.6	101.8	165.1	-75.4	-172.9	173.9	-177.9	-0.9	109.1	L108	R106-L108 HydrophobicContact CB-CG 4.19Å; R106-L108 PolarHBondContact O-N 3.4Å; R106-L108 VanDerWaalsContact O-N 3.11Å
107	E	52.3	Low	57.5	Low	127 Å²	127	91.8 Å²	91.8	59%	0.593	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66	102.6	155.8	-73.6	-175.8	169.2	0	0	106.7	L109	E107-L109 PolarHBondContact O-N 3.15Å
108	L	61	Low	59.7	Low	43 Å²	43	90.4 Å²	90.4	23%	0.225	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	100.1	176.7	-71.9	161.6	0	0	0	106.7	S66 I67 R106 L111 R119	S66-L108 CarbonylContact C-O 3.53Å; S66-L108 VanDerWaalsContact CA-O 3.24Å; S66-L108 WeakPolarHBondContact CA-O 3.43Å; I67-L108 HydrophobicContact CB-CB 4.36Å; I67-L108 PolarHBondContact N-O 2.96Å; I67-L108 PolarHBondContact O-N 3.14Å; I67-L108 VanDerWaalsContact O-N 3.08Å; R106-L108 HydrophobicContact CB-CG 4.19Å; R106-L108 PolarHBondContact O-N 3.4Å; R106-L108 VanDerWaalsContact O-N 3.11Å; L108-L111 HydrophobicContact CB-CD1 4.05Å; L108-L111 HydrophobicContact CB-CD2 4.42Å; L108-L111 HydrophobicContact CB-CG 4.4Å; L108-R119 HydrophobicContact CD1-CG 4.18Å
109	L	67.3	Low	62.1	Low	99 Å²	99	89.1 Å²	89.1	52%	0.518	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	155.1	176.3	-58.1	175.6	0	0	0	109.7	E107	E107-L109 PolarHBondContact O-N 3.15Å
110	N	69.9	Low	64.6	Low	106 Å²	106	84.6 Å²	84.6	57%	0.567	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	66.9	37	169.6	-53.9	-39.4	0	0	0	116.3	K64 L65	K64-N110 HydrophobicContact CB-CB 4.41Å; K64-N110 HydrophobicContact CD-CB 3.79Å; K64-N110 WeakPolarHBondContact CD-OD1 3.42Å; K64-N110 HydrophobicContact CG-CB 4.21Å; L65-N110 PolarHBondContact O-N 3.22Å; L65-N110 VanDerWaalsContact O-N 3.08Å
111	L	77.2	Confident	67.1	Low	23 Å²	23	82.2 Å²	82.2	12%	0.12	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	141.1	175.4	-60.2	173.9	0	0	0	111.1	L65 I67 L108 D115 Y116	L65-L111 HydrophobicContact CB-CB 4.28Å; L65-L111 PolarHBondContact N-O 3.16Å; L65-L111 PolarHBondContact O-N 3.45Å; I67-L111 HydrophobicContact CB-CD1 4.32Å; I67-L111 HydrophobicContact CD1-CD1 3.59Å; I67-L111 HydrophobicContact CG1-CD1 3.8Å; L108-L111 HydrophobicContact CB-CD1 4.05Å; L108-L111 HydrophobicContact CB-CD2 4.42Å; L108-L111 HydrophobicContact CB-CG 4.4Å; L111-D115 HydrophobicContact CB-CB 4.3Å; L111-D115 HydrophobicContact CD2-CB 4.15Å; L111-Y116 HydrophobicContact CD1-CD2 4.28Å
112	S	82.1	Confident	69.5	Low	52 Å²	52	81.8 Å²	81.8	36%	0.364	42%	0.421	S	S	.	.			trans	-72.2	166.9	163.7	75.9	0	0	0	0	110.6	Q114 D115 Y116	S112-Q114 VanDerWaalsContact C-N 3.26Å; S112-Q114 PolarHBondContact O-N 3.49Å; S112-Q114 PolarHBondContact OG-N 3.48Å; S112-D115 VanDerWaalsContact CB-OD2 3.31Å; S112-D115 WeakPolarHBondContact CB-OD2 3.48Å; S112-D115 PolarHBondContact N-OD2 3.44Å; S112-D115 PolarHBondContact O-N 2.85Å; S112-D115 PolarHBondContact OG-N 3.18Å; S112-D115 VanDerWaalsContact OG-N 3.14Å; S112-D115 PolarHBondContact OG-OD2 3.25Å; S112-Y116 WeakPolarHBondContact O-CB 3.31Å; S112-Y116 PolarHBondContact O-N 3.04Å
113	Q	81.4	Confident	72	Confident	55 Å²	55	75 Å²	75	26%	0.257	39%	0.39	S	S	.	.	H	α-helix	trans	-56	-41.9	174.2	176.2	176.5	-18.1	0	0	112.3	T60 T61 A117 F158	T60-Q113 VanDerWaalsContact CA-OE1 3.24Å; T61-Q113 VanDerWaalsContact N-OE1 3.15Å; Q113-A117 PolarHBondContact O-N 2.89Å; Q113-F158 HydrophobicContact CG-CE2 3.77Å; Q113-F158 HydrophobicContact CG-CZ 4.33Å
114	Q	83.6	Confident	74.7	Confident	144 Å²	144	71.8 Å²	71.8	67%	0.673	35%	0.354	S	S	*	.	H	α-helix	trans	-71	-40.1	-178.9	-168.5	170.8	5.6	0	0	111.3	S112 Y116 A117 N118	S112-Q114 VanDerWaalsContact C-N 3.26Å; S112-Q114 PolarHBondContact O-N 3.49Å; S112-Q114 PolarHBondContact OG-N 3.48Å; Q114-Y116 VanDerWaalsContact C-N 3.34Å; Q114-Y116 PolarHBondContact O-N 2.94Å; Q114-A117 PolarHBondContact O-N 3.14Å; Q114-N118 WeakPolarHBondContact O-CB 3.47Å; Q114-N118 PolarHBondContact O-N 3.2Å; Q114-N118 PolarHBondContact O-ND2 3.14Å
115	D	83.2	Confident	77.3	Confident	82 Å²	82	73.7 Å²	73.7	44%	0.439	36%	0.358	S	S	.	.	H	α-helix	trans	-65.2	-39.8	176	-58.5	-39.4	0	0	0	111.6	L111 S112 N118 R119	L111-D115 HydrophobicContact CB-CB 4.3Å; L111-D115 HydrophobicContact CD2-CB 4.15Å; S112-D115 VanDerWaalsContact CB-OD2 3.31Å; S112-D115 WeakPolarHBondContact CB-OD2 3.48Å; S112-D115 PolarHBondContact N-OD2 3.44Å; S112-D115 PolarHBondContact O-N 2.85Å; S112-D115 PolarHBondContact OG-N 3.18Å; S112-D115 VanDerWaalsContact OG-N 3.14Å; S112-D115 PolarHBondContact OG-OD2 3.25Å; D115-N118 PolarHBondContact O-N 3.2Å; D115-R119 WeakPolarHBondContact O-CB 3.37Å; D115-R119 PolarHBondContact O-N 3.19Å
116	Y	84.8	Confident	79.6	Confident	1 Å²	1	69.9 Å²	69.9	0%	0.004	35%	0.345	C	S	.	.	H	α-helix	trans	-60.8	-49	174.1	-173.1	-80.6	0	0	0	110.9	L65 I67 L111 S112 Q114 N118 R119 I120 F158 K162	L65-Y116 HydrophobicContact CB-CD2 3.83Å; L65-Y116 HydrophobicContact CB-CG 4.46Å; L65-Y116 HydrophobicContact CD1-CD1 4.5Å; L65-Y116 HydrophobicContact CD1-CD2 3.95Å; L65-Y116 HydrophobicContact CD1-CG 3.79Å; L65-Y116 HydrophobicContact CG-CD2 4.47Å; I67-Y116 HydrophobicContact CD1-CD2 3.72Å; I67-Y116 HydrophobicContact CD1-CE2 3.75Å; I67-Y116 HydrophobicContact CD1-CG 4.36Å; I67-Y116 HydrophobicContact CG1-CD2 3.63Å; I67-Y116 HydrophobicContact CG1-CE2 3.32Å; L111-Y116 HydrophobicContact CD1-CD2 4.28Å; S112-Y116 WeakPolarHBondContact O-CB 3.31Å; S112-Y116 PolarHBondContact O-N 3.04Å; Q114-Y116 VanDerWaalsContact C-N 3.34Å; Q114-Y116 PolarHBondContact O-N 2.94Å; Y116-N118 PolarHBondContact O-N 3.27Å; Y116-R119 PolarHBondContact O-N 3.2Å; Y116-I120 HydrophobicContact CD1-CG1 3.91Å; Y116-I120 HydrophobicContact CE1-CD1 3.96Å; Y116-I120 HydrophobicContact CE1-CG1 3.55Å; Y116-I120 WeakPolarHBondContact O-CG1 3.35Å; Y116-I120 PolarHBondContact O-N 3.15Å; Y116-F158 AromaticContact CD1-CE1 3.68Å; Y116-F158 HydrophobicContact CD1-CE1 3.68Å; Y116-F158 HydrophobicContact CD1-CZ 4.01Å; Y116-F158 AromaticContact CE1-CE1 3.82Å; Y116-F158 HydrophobicContact CE1-CE1 3.82Å; Y116-F158 HydrophobicContact CE1-CZ 4.45Å; Y116-F158 HydrophobicContact CG-CE1 4.22Å; Y116-K162 HydrophobicContact CE1-CG 4.3Å; Y116-K162 WeakPolarHBondContact OH-CG 3.38Å
117	A	85.8	Confident	81.7	Confident	32 Å²	32	60.9 Å²	60.9	26%	0.264	31%	0.311	S	S	.	.	H	α-helix	trans	-61.1	-44.6	178.8	0	0	0	0	0	112.3	Q113 Q114 R119 I120 E121 L165	Q113-A117 PolarHBondContact O-N 2.89Å; Q114-A117 PolarHBondContact O-N 3.14Å; A117-R119 VanDerWaalsContact C-N 3.31Å; A117-R119 PolarHBondContact O-N 3.38Å; A117-I120 PolarHBondContact O-N 2.93Å; A117-E121 PolarHBondContact O-N 3.07Å; A117-L165 HydrophobicContact CB-CD1 4.14Å
118	N	86.2	Confident	83.5	Confident	84 Å²	84	58.6 Å²	58.6	45%	0.449	30%	0.3	S	S	.	.	H	α-helix	trans	-59.4	-42.8	175.6	-70.4	-18.6	0	0	0	111.4	Q114 D115 Y116 I120 E121 E122	Q114-N118 WeakPolarHBondContact O-CB 3.47Å; Q114-N118 PolarHBondContact O-N 3.2Å; Q114-N118 PolarHBondContact O-ND2 3.14Å; D115-N118 PolarHBondContact O-N 3.2Å; Y116-N118 PolarHBondContact O-N 3.27Å; N118-I120 PolarHBondContact O-N 3.23Å; N118-E121 PolarHBondContact O-N 2.9Å; N118-E121 VanDerWaalsContact O-N 3.17Å; N118-E122 WeakPolarHBondContact O-CG 3.47Å; N118-E122 PolarHBondContact O-N 3.31Å
119	R	84.7	Confident	85	Confident	79 Å²	79	61.3 Å²	61.3	30%	0.298	31%	0.311	S	S	.	.	H	α-helix	trans	-67.2	-35.2	179.8	-173.1	55.8	179.9	171.8	5.9	112.9	I67 L108 D115 Y116 A117 E121 E122 L123	I67-R119 HydrophobicContact CD1-CB 3.97Å; I67-R119 HydrophobicContact CD1-CG 3.7Å; L108-R119 HydrophobicContact CD1-CG 4.18Å; D115-R119 WeakPolarHBondContact O-CB 3.37Å; D115-R119 PolarHBondContact O-N 3.19Å; Y116-R119 PolarHBondContact O-N 3.2Å; A117-R119 VanDerWaalsContact C-N 3.31Å; A117-R119 PolarHBondContact O-N 3.38Å; R119-E121 VanDerWaalsContact C-N 3.35Å; R119-E122 WeakPolarHBondContact CD-OE2 3.27Å; R119-E122 IonicContact CZ-OE2 2.66Å; R119-E122 IonicContact NE-OE2 2.63Å; R119-E122 IonicContact NH1-OE2 3.79Å; R119-E122 PolarHBondContact NH1-OE2 2.76Å; R119-E122 PolarHBondContact O-N 3.06Å; R119-L123 WeakPolarHBondContact O-CG 3.43Å; R119-L123 PolarHBondContact O-N 2.96Å; R119-L123 VanDerWaalsContact O-N 3.12Å
120	I	87.2	Confident	86.1	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.021	29%	0.288	C	S	.	.	H	α-helix	trans	-66	-39.6	172.6	-63	-62.8	0	0	0	110.4	Y116 A117 N118 L123 N124 L149 L165 I166 I169	Y116-I120 HydrophobicContact CD1-CG1 3.91Å; Y116-I120 HydrophobicContact CE1-CD1 3.96Å; Y116-I120 HydrophobicContact CE1-CG1 3.55Å; Y116-I120 WeakPolarHBondContact O-CG1 3.35Å; Y116-I120 PolarHBondContact O-N 3.15Å; A117-I120 PolarHBondContact O-N 2.93Å; N118-I120 PolarHBondContact O-N 3.23Å; I120-L123 HydrophobicContact CD1-CD1 4.27Å; I120-L123 WeakPolarHBondContact O-CB 3.48Å; I120-L123 PolarHBondContact O-N 3.14Å; I120-N124 PolarHBondContact O-N 3.16Å; I120-L149 HydrophobicContact CD1-CD1 3.9Å; I120-L165 HydrophobicContact CG2-CB 4.04Å; I120-I166 HydrophobicContact CD1-CG1 4.35Å; I120-I169 HydrophobicContact CG2-CD1 3.6Å; I120-I169 HydrophobicContact CG2-CG1 4.4Å; I120-I169 WeakPolarHBondContact O-CD1 3.41Å
121	E	88.3	Confident	87.2	Confident	99 Å²	99	53.1 Å²	53.1	46%	0.463	27%	0.266	S	S	.	.	H	α-helix	trans	-66.1	-37.8	175	-167.9	58.4	-137.8	0	0	112.3	A117 N118 R119 L123 N124 Q125	A117-E121 PolarHBondContact O-N 3.07Å; N118-E121 PolarHBondContact O-N 2.9Å; N118-E121 VanDerWaalsContact O-N 3.17Å; R119-E121 VanDerWaalsContact C-N 3.35Å; E121-L123 VanDerWaalsContact C-N 3.28Å; E121-L123 PolarHBondContact O-N 3.38Å; E121-N124 VanDerWaalsContact O-CB 3.3Å; E121-N124 WeakPolarHBondContact O-CB 3.34Å; E121-N124 PolarHBondContact O-N 3.33Å; E121-N124 VanDerWaalsContact O-N 3.1Å; E121-N124 PolarHBondContact OE1-ND2 3.01Å; E121-Q125 PolarHBondContact O-N 3.3Å
122	E	87.9	Confident	87.8	Confident	95 Å²	95	56.5 Å²	56.5	44%	0.444	29%	0.292	S	S	.	.	H	α-helix	trans	-59.8	-37.7	172.1	-72.2	173.4	-176.9	0	0	112.2	N118 R119 Q125 S126	N118-E122 WeakPolarHBondContact O-CG 3.47Å; N118-E122 PolarHBondContact O-N 3.31Å; R119-E122 WeakPolarHBondContact CD-OE2 3.27Å; R119-E122 IonicContact CZ-OE2 2.66Å; R119-E122 IonicContact NE-OE2 2.63Å; R119-E122 IonicContact NH1-OE2 3.79Å; R119-E122 PolarHBondContact NH1-OE2 2.76Å; R119-E122 PolarHBondContact O-N 3.06Å; E122-Q125 PolarHBondContact O-N 3.42Å; E122-S126 WeakPolarHBondContact O-CB 3.32Å; E122-S126 PolarHBondContact O-N 2.81Å; E122-S126 PolarHBondContact O-OG 3.22Å
123	L	88.6	Confident	88.2	Confident	11 Å²	11	57.8 Å²	57.8	6%	0.058	30%	0.301	C	S	.	.	H	α-helix	trans	-67	-38.5	173.4	-70.7	171.9	0	0	0	111.7	R119 I120 E121 Q125 S126 L127 I169	R119-L123 WeakPolarHBondContact O-CG 3.43Å; R119-L123 PolarHBondContact O-N 2.96Å; R119-L123 VanDerWaalsContact O-N 3.12Å; I120-L123 HydrophobicContact CD1-CD1 4.27Å; I120-L123 WeakPolarHBondContact O-CB 3.48Å; I120-L123 PolarHBondContact O-N 3.14Å; E121-L123 VanDerWaalsContact C-N 3.28Å; E121-L123 PolarHBondContact O-N 3.38Å; L123-Q125 VanDerWaalsContact C-N 3.34Å; L123-S126 PolarHBondContact O-N 2.87Å; L123-L127 WeakPolarHBondContact O-CB 3.38Å; L123-L127 PolarHBondContact O-N 2.71Å; L123-I169 HydrophobicContact CB-CD1 4.3Å
124	N	90.4	Very high	88.6	Confident	10 Å²	10	60.4 Å²	60.4	5%	0.053	32%	0.317	C	S	.	.	H	α-helix	trans	-62.7	-41.4	173.8	-168.4	29.8	0	0	0	111.8	I120 E121 L127 K128 I169	I120-N124 PolarHBondContact O-N 3.16Å; E121-N124 VanDerWaalsContact O-CB 3.3Å; E121-N124 WeakPolarHBondContact O-CB 3.34Å; E121-N124 PolarHBondContact O-N 3.33Å; E121-N124 VanDerWaalsContact O-N 3.1Å; E121-N124 PolarHBondContact OE1-ND2 3.01Å; N124-L127 WeakPolarHBondContact O-CB 3.31Å; N124-L127 PolarHBondContact O-N 3.33Å; N124-K128 PolarHBondContact ND2-NZ 3.37Å; N124-K128 WeakPolarHBondContact O-CG 3.31Å; N124-K128 PolarHBondContact O-N 3.35Å; N124-K128 VanDerWaalsContact O-N 3.15Å; N124-I169 HydrophobicContact CB-CD1 4.09Å; N124-I169 HydrophobicContact CB-CG1 3.88Å
125	Q	91.1	Very high	88.8	Confident	86 Å²	86	58 Å²	58	40%	0.402	31%	0.305	S	S	.	.	H	α-helix	trans	-68	-44.1	176.5	-175.5	56.4	25.6	0	0	111.3	E121 E122 L123 L127 K128 E129	E121-Q125 PolarHBondContact O-N 3.3Å; E122-Q125 PolarHBondContact O-N 3.42Å; L123-Q125 VanDerWaalsContact C-N 3.34Å; Q125-L127 VanDerWaalsContact C-N 3.25Å; Q125-L127 PolarHBondContact O-N 2.72Å; Q125-K128 PolarHBondContact O-N 3.39Å; Q125-K128 VanDerWaalsContact O-N 3.09Å; Q125-E129 WeakPolarHBondContact CG-OE1 3.4Å; Q125-E129 PolarHBondContact NE2-OE1 3.1Å; Q125-E129 WeakPolarHBondContact O-CG 3.47Å; Q125-E129 PolarHBondContact O-N 2.94Å
126	S	90.3	Very high	89.1	Confident	47 Å²	47	55.6 Å²	55.6	33%	0.329	29%	0.291	S	S	.	.	H	α-helix	trans	-59.2	-36	174.2	-60.8	0	0	0	0	112.4	E122 L123 A130	E122-S126 WeakPolarHBondContact O-CB 3.32Å; E122-S126 PolarHBondContact O-N 2.81Å; E122-S126 PolarHBondContact O-OG 3.22Å; L123-S126 PolarHBondContact O-N 2.87Å; S126-A130 VanDerWaalsContact O-CB 3.24Å; S126-A130 WeakPolarHBondContact O-CB 3.3Å; S126-A130 PolarHBondContact O-N 3Å
127	L	91.8	Very high	89.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62.3	-49.1	173.2	170.7	65.8	0	0	0	111.4	L123 N124 Q125 A130 W131 A139 I142 V143 I169 F173	L123-L127 WeakPolarHBondContact O-CB 3.38Å; L123-L127 PolarHBondContact O-N 2.71Å; N124-L127 WeakPolarHBondContact O-CB 3.31Å; N124-L127 PolarHBondContact O-N 3.33Å; Q125-L127 VanDerWaalsContact C-N 3.25Å; Q125-L127 PolarHBondContact O-N 2.72Å; L127-A130 PolarHBondContact O-N 3.37Å; L127-W131 WeakPolarHBondContact O-CB 3.28Å; L127-W131 PolarHBondContact O-N 2.87Å; L127-A139 HydrophobicContact CD1-CB 3.61Å; L127-A139 WeakPolarHBondContact CD1-O 3.39Å; L127-I142 HydrophobicContact CB-CG2 4.23Å; L127-V143 HydrophobicContact CD1-CG2 3.7Å; L127-V143 HydrophobicContact CD2-CG2 3.91Å; L127-V143 HydrophobicContact CG-CG2 4.44Å; L127-I169 HydrophobicContact CD2-CG2 3.63Å; L127-F173 HydrophobicContact CD1-CD2 4.28Å; L127-F173 HydrophobicContact CD2-CB 4.13Å
128	K	91.6	Very high	89.3	Confident	79 Å²	79	64 Å²	64	34%	0.343	33%	0.329	S	S	.	.	H	α-helix	trans	-63.2	-42.2	179.3	-68.7	168.9	-171	162.3	0	111.5	N124 Q125 W131 S132 T172	N124-K128 PolarHBondContact ND2-NZ 3.37Å; N124-K128 WeakPolarHBondContact O-CG 3.31Å; N124-K128 PolarHBondContact O-N 3.35Å; N124-K128 VanDerWaalsContact O-N 3.15Å; Q125-K128 PolarHBondContact O-N 3.39Å; Q125-K128 VanDerWaalsContact O-N 3.09Å; K128-W131 PolarHBondContact O-N 3.47Å; K128-S132 WeakPolarHBondContact O-CB 3.18Å; K128-S132 PolarHBondContact O-N 2.97Å; K128-T172 HydrophobicContact CG-CG2 4.35Å
129	E	91.8	Very high	89.4	Confident	100 Å²	100	60 Å²	60	47%	0.467	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-52.6	176.2	-74	170.8	-167.2	0	0	111.2	Q125 W131 S132 S133	Q125-E129 WeakPolarHBondContact CG-OE1 3.4Å; Q125-E129 PolarHBondContact NE2-OE1 3.1Å; Q125-E129 WeakPolarHBondContact O-CG 3.47Å; Q125-E129 PolarHBondContact O-N 2.94Å; E129-W131 PolarHBondContact O-N 2.87Å; E129-S132 PolarHBondContact O-N 3.44Å; E129-S132 PolarHBondContact O-OG 2.92Å; E129-S133 PolarHBondContact O-N 3.46Å; E129-S133 PolarHBondContact O-OG 2.98Å
130	A	90.4	Very high	89.7	Confident	4 Å²	4	57.2 Å²	57.2	3%	0.033	30%	0.299	C	S	.	.	H	α-helix	trans	-57.5	-36.8	175.7	0	0	0	0	0	112.1	S126 L127 Q135 K138 A139 I142	S126-A130 VanDerWaalsContact O-CB 3.24Å; S126-A130 WeakPolarHBondContact O-CB 3.3Å; S126-A130 PolarHBondContact O-N 3Å; L127-A130 PolarHBondContact O-N 3.37Å; A130-Q135 HydrophobicContact CB-CB 4.37Å; A130-Q135 CarbonylContact O-C 3.54Å; A130-Q135 WeakPolarHBondContact O-CA 3.46Å; A130-Q135 WeakPolarHBondContact O-CB 3.4Å; A130-Q135 PolarHBondContact O-N 3.11Å; A130-K138 HydrophobicContact CB-CB 4.32Å; A130-K138 HydrophobicContact CB-CD 4.13Å; A130-K138 HydrophobicContact CB-CG 4.25Å; A130-A139 HydrophobicContact CB-CB 4.48Å; A130-I142 HydrophobicContact CB-CD1 4.42Å
131	W	92.1	Very high	89.8	Confident	28 Å²	28	60.7 Å²	60.7	11%	0.106	31%	0.314	C	S	.	.	H	α-helix	trans	-66.6	-43	174.8	-167.8	-91.1	0	0	0	112.3	L127 K128 E129 S133 D134 K136 A139 F173 L176 V177 R180 W211	L127-W131 WeakPolarHBondContact O-CB 3.28Å; L127-W131 PolarHBondContact O-N 2.87Å; K128-W131 PolarHBondContact O-N 3.47Å; E129-W131 PolarHBondContact O-N 2.87Å; W131-S133 VanDerWaalsContact C-N 3.34Å; W131-D134 PolarHBondContact O-N 3.38Å; W131-K136 HydrophobicContact CD2-CD 3.81Å; W131-K136 VanDerWaalsContact CE2-NZ 3.25Å; W131-K136 HydrophobicContact CE3-CD 3.65Å; W131-K136 HydrophobicContact CG-CD 4.5Å; W131-K136 HydrophobicContact CH2-CD 4.06Å; W131-K136 HydrophobicContact CZ2-CD 4.19Å; W131-K136 HydrophobicContact CZ3-CD 3.79Å; W131-K136 PolarHBondContact O-NZ 3.26Å; W131-A139 HydrophobicContact CE3-CB 3.91Å; W131-F173 HydrophobicContact CZ3-CD2 4.32Å; W131-F173 AromaticContact CZ3-CE2 3.96Å; W131-F173 HydrophobicContact CZ3-CE2 3.96Å; W131-L176 HydrophobicContact CB-CD1 4.06Å; W131-L176 HydrophobicContact CD2-CB 3.88Å; W131-L176 HydrophobicContact CD2-CD1 4.05Å; W131-L176 HydrophobicContact CD2-CG 4.4Å; W131-L176 HydrophobicContact CE3-CB 4.29Å; W131-L176 HydrophobicContact CE3-CD1 4.48Å; W131-L176 HydrophobicContact CG-CB 4.33Å; W131-L176 HydrophobicContact CG-CD1 3.84Å; W131-L176 HydrophobicContact CG-CD2 4.23Å; W131-L176 HydrophobicContact CG-CG 4.36Å; W131-L176 HydrophobicContact CH2-CB 4.29Å; W131-L176 VanDerWaalsContact CZ2-C 3.44Å; W131-L176 HydrophobicContact CZ2-CB 3.89Å; W131-L176 WeakPolarHBondContact CZ2-O 3.42Å; W131-L176 HydrophobicContact CZ3-CB 4.48Å; W131-V177 HydrophobicContact CH2-CB 4.34Å; W131-V177 HydrophobicContact CH2-CG2 3.66Å; W131-V177 HydrophobicContact CZ3-CG2 4.02Å; W131-R180 HydrophobicContact CZ2-CB 4Å; W131-W211 HydrophobicContact CH2-CH2 4.39Å; W131-W211 AromaticContact CH2-CZ2 3.92Å; W131-W211 HydrophobicContact CH2-CZ2 3.92Å; W131-W211 HydrophobicContact CZ3-CH2 4.09Å; W131-W211 HydrophobicContact CZ3-CZ2 4.07Å
132	S	90.8	Very high	89.8	Confident	95 Å²	95	56.6 Å²	56.6	66%	0.664	30%	0.295	S	S	*	.	H	α-helix	trans	-66.6	-34.4	179.2	75.3	0	0	0	0	112.8	K128 E129 D134	K128-S132 WeakPolarHBondContact O-CB 3.18Å; K128-S132 PolarHBondContact O-N 2.97Å; E129-S132 PolarHBondContact O-N 3.44Å; E129-S132 PolarHBondContact O-OG 2.92Å; S132-D134 PolarHBondContact O-N 2.91Å
133	S	90.9	Very high	89.9	Confident	78 Å²	78	52 Å²	52	55%	0.545	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	15.4	175.8	-50.3	0	0	0	0	113.7	E129 W131 Q135	E129-S133 PolarHBondContact O-N 3.46Å; E129-S133 PolarHBondContact O-OG 2.98Å; W131-S133 VanDerWaalsContact C-N 3.34Å; S133-Q135 PolarHBondContact O-N 3.4Å
134	D	88.2	Confident	90	Very high	111 Å²	111	53 Å²	53	59%	0.594	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	15.8	-177.6	-150.9	42.9	0	0	0	115.6	W131 S132 K136	W131-D134 PolarHBondContact O-N 3.38Å; S132-D134 PolarHBondContact O-N 2.91Å; D134-K136 PolarHBondContact O-N 3.02Å; D134-K136 WeakPolarHBondContact OD1-CE 3.39Å; D134-K136 IonicContact OD1-NZ 3.82Å
135	Q	89.4	Confident	89.8	Confident	93 Å²	93	53.6 Å²	53.6	44%	0.435	28%	0.281	S	S	.	.			trans	-81.6	62.6	177.1	-61.5	-175.5	-6.7	0	0	111.6	A130 S133 V137 K138 A139	A130-Q135 HydrophobicContact CB-CB 4.37Å; A130-Q135 CarbonylContact O-C 3.54Å; A130-Q135 WeakPolarHBondContact O-CA 3.46Å; A130-Q135 WeakPolarHBondContact O-CB 3.4Å; A130-Q135 PolarHBondContact O-N 3.11Å; S133-Q135 PolarHBondContact O-N 3.4Å; Q135-V137 VanDerWaalsContact C-N 3.3Å; Q135-V137 PolarHBondContact O-N 2.84Å; Q135-K138 HydrophobicContact CB-CB 3.98Å; Q135-K138 WeakPolarHBondContact O-CB 3.49Å; Q135-K138 PolarHBondContact O-N 2.94Å; Q135-K138 VanDerWaalsContact O-N 3.08Å; Q135-A139 PolarHBondContact O-N 3.44Å
136	K	87.9	Confident	89.7	Confident	32 Å²	32	49.5 Å²	49.5	14%	0.139	26%	0.262	C	S	.	.	H	α-helix	trans	-63.7	-29.9	-172.5	-52.5	-55.7	-175	-164.3	0	114.3	W131 D134 L140 W211	W131-K136 HydrophobicContact CD2-CD 3.81Å; W131-K136 VanDerWaalsContact CE2-NZ 3.25Å; W131-K136 HydrophobicContact CE3-CD 3.65Å; W131-K136 HydrophobicContact CG-CD 4.5Å; W131-K136 HydrophobicContact CH2-CD 4.06Å; W131-K136 HydrophobicContact CZ2-CD 4.19Å; W131-K136 HydrophobicContact CZ3-CD 3.79Å; W131-K136 PolarHBondContact O-NZ 3.26Å; D134-K136 PolarHBondContact O-N 3.02Å; D134-K136 WeakPolarHBondContact OD1-CE 3.39Å; D134-K136 IonicContact OD1-NZ 3.82Å; K136-L140 PolarHBondContact O-N 3.47Å; K136-W211 HydrophobicContact CB-CH2 4.25Å; K136-W211 HydrophobicContact CB-CZ2 4.35Å
137	V	88.5	Confident	89.8	Confident	96 Å²	96	47.3 Å²	47.3	58%	0.582	25%	0.246	S	C	*	.	H	α-helix	trans	-69.2	-40.4	174.9	179.3	0	0	0	0	110.7	Q135 L140 K141	Q135-V137 VanDerWaalsContact C-N 3.3Å; Q135-V137 PolarHBondContact O-N 2.84Å; V137-L140 PolarHBondContact O-N 2.96Å; V137-K141 WeakPolarHBondContact O-CG 3.32Å; V137-K141 PolarHBondContact O-N 3.27Å
138	K	86.6	Confident	89.7	Confident	113 Å²	113	50 Å²	50	49%	0.491	26%	0.258	S	S	.	.	H	α-helix	trans	-65.1	-43	175.3	-171.1	-179.2	-179.2	179.7	0	110.9	A130 Q135 L140 K141 I142	A130-K138 HydrophobicContact CB-CB 4.32Å; A130-K138 HydrophobicContact CB-CD 4.13Å; A130-K138 HydrophobicContact CB-CG 4.25Å; Q135-K138 HydrophobicContact CB-CB 3.98Å; Q135-K138 WeakPolarHBondContact O-CB 3.49Å; Q135-K138 PolarHBondContact O-N 2.94Å; Q135-K138 VanDerWaalsContact O-N 3.08Å; K138-L140 PolarHBondContact O-N 2.8Å; K138-K141 PolarHBondContact O-N 3.47Å; K138-I142 HydrophobicContact CG-CD1 4.39Å; K138-I142 WeakPolarHBondContact O-CG1 3.37Å; K138-I142 PolarHBondContact O-N 3.39Å
139	A	89.5	Confident	89.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-56.5	-47.7	172.6	0	0	0	0	0	112.1	L127 A130 W131 Q135 K141 I142 V143	L127-A139 HydrophobicContact CD1-CB 3.61Å; L127-A139 WeakPolarHBondContact CD1-O 3.39Å; A130-A139 HydrophobicContact CB-CB 4.48Å; W131-A139 HydrophobicContact CE3-CB 3.91Å; Q135-A139 PolarHBondContact O-N 3.44Å; A139-K141 PolarHBondContact O-N 2.86Å; A139-I142 PolarHBondContact O-N 3.02Å; A139-V143 VanDerWaalsContact O-CG2 3.31Å; A139-V143 WeakPolarHBondContact O-CG2 3.18Å; A139-V143 PolarHBondContact O-N 2.9Å
140	L	90.6	Very high	89.4	Confident	20 Å²	20	41.9 Å²	41.9	11%	0.105	22%	0.222	C	C	.	.	H	α-helix	trans	-62.6	-42.1	176.2	-179.3	61.5	0	0	0	112.3	K136 V137 K138 I142 V143 I144 F173 W211 K214 V227	K136-L140 PolarHBondContact O-N 3.47Å; V137-L140 PolarHBondContact O-N 2.96Å; K138-L140 PolarHBondContact O-N 2.8Å; L140-I142 PolarHBondContact O-N 3.05Å; L140-V143 PolarHBondContact O-N 3.24Å; L140-I144 HydrophobicContact CD1-CD1 4.17Å; L140-I144 HydrophobicContact CD1-CG1 4.33Å; L140-I144 HydrophobicContact CG-CD1 3.92Å; L140-I144 VanDerWaalsContact O-CG1 3.29Å; L140-I144 WeakPolarHBondContact O-CG1 3.39Å; L140-I144 PolarHBondContact O-N 3.2Å; L140-F173 HydrophobicContact CD1-CE1 4.39Å; L140-F173 HydrophobicContact CD1-CZ 3.87Å; L140-W211 HydrophobicContact CB-CZ3 4.29Å; L140-W211 HydrophobicContact CD1-CZ3 4.3Å; L140-W211 HydrophobicContact CD2-CZ3 4.17Å; L140-W211 HydrophobicContact CG-CZ3 4.49Å; L140-K214 HydrophobicContact CD2-CB 4.46Å; L140-V227 HydrophobicContact CD1-CG1 4.05Å
141	K	89.1	Confident	89.4	Confident	77 Å²	77	45.2 Å²	45.2	34%	0.335	25%	0.245	S	C	.	.	H	α-helix	trans	-57.9	-45.4	175.7	-77.5	179.9	171.1	-170.7	0	111.4	M71 E101 V137 K138 A139 V143 I144 Q145	M71-K141 HydrophobicContact CE-CD 3.69Å; M71-K141 HydrophobicContact CE-CG 4.21Å; E101-K141 IonicContact OE1-NZ 3.88Å; E101-K141 PolarHBondContact OE1-NZ 2.9Å; V137-K141 WeakPolarHBondContact O-CG 3.32Å; V137-K141 PolarHBondContact O-N 3.27Å; K138-K141 PolarHBondContact O-N 3.47Å; A139-K141 PolarHBondContact O-N 2.86Å; K141-V143 PolarHBondContact O-N 3.36Å; K141-I144 PolarHBondContact O-N 3.47Å; K141-Q145 WeakPolarHBondContact O-CG 3.27Å; K141-Q145 PolarHBondContact O-N 3.38Å
142	I	88.1	Confident	89	Confident	13 Å²	13	46 Å²	46	7%	0.067	25%	0.251	C	S	.	.	H	α-helix	trans	-59.3	-45.2	178.5	-67.8	165.1	0	0	0	111.1	L127 A130 K138 A139 L140 Q145 C146	L127-I142 HydrophobicContact CB-CG2 4.23Å; A130-I142 HydrophobicContact CB-CD1 4.42Å; K138-I142 HydrophobicContact CG-CD1 4.39Å; K138-I142 WeakPolarHBondContact O-CG1 3.37Å; K138-I142 PolarHBondContact O-N 3.39Å; A139-I142 PolarHBondContact O-N 3.02Å; L140-I142 PolarHBondContact O-N 3.05Å; I142-Q145 WeakPolarHBondContact O-CB 3.27Å; I142-Q145 PolarHBondContact O-N 3.07Å; I142-C146 PolarHBondContact O-N 2.91Å; I142-C146 PolarHBondContact O-SG 3.14Å
143	V	90.8	Very high	88.6	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-69.7	-38.4	-177.4	178.9	0	0	0	0	111.4	L127 A139 L140 K141 Q145 C146 S147 L170 F173 V227	L127-V143 HydrophobicContact CD1-CG2 3.7Å; L127-V143 HydrophobicContact CD2-CG2 3.91Å; L127-V143 HydrophobicContact CG-CG2 4.44Å; A139-V143 VanDerWaalsContact O-CG2 3.31Å; A139-V143 WeakPolarHBondContact O-CG2 3.18Å; A139-V143 PolarHBondContact O-N 2.9Å; L140-V143 PolarHBondContact O-N 3.24Å; K141-V143 PolarHBondContact O-N 3.36Å; V143-Q145 VanDerWaalsContact C-N 3.33Å; V143-C146 PolarHBondContact O-N 2.98Å; V143-S147 PolarHBondContact O-N 3.16Å; V143-S147 PolarHBondContact O-OG 2.94Å; V143-L170 HydrophobicContact CG1-CD2 3.48Å; V143-L170 VanDerWaalsContact CG1-CD2 3.48Å; V143-F173 HydrophobicContact CB-CG 4.32Å; V143-F173 HydrophobicContact CG1-CB 4.18Å; V143-F173 HydrophobicContact CG1-CD1 3.96Å; V143-F173 HydrophobicContact CG1-CG 4.05Å; V143-F173 HydrophobicContact CG2-CB 3.64Å; V143-F173 HydrophobicContact CG2-CD1 4.32Å; V143-F173 HydrophobicContact CG2-CD2 3.69Å; V143-F173 HydrophobicContact CG2-CE2 4.4Å; V143-F173 HydrophobicContact CG2-CG 3.62Å; V143-V227 HydrophobicContact CG1-CG2 3.82Å
144	I	89.4	Confident	88	Confident	30 Å²	30	41.1 Å²	41.1	15%	0.154	22%	0.216	C	C	.	.	H	α-helix	trans	-59.5	-47	171.9	-70.2	168.7	0	0	0	109.9	L140 K141 S147 K148 I218 P223 V227	L140-I144 HydrophobicContact CD1-CD1 4.17Å; L140-I144 HydrophobicContact CD1-CG1 4.33Å; L140-I144 HydrophobicContact CG-CD1 3.92Å; L140-I144 VanDerWaalsContact O-CG1 3.29Å; L140-I144 WeakPolarHBondContact O-CG1 3.39Å; L140-I144 PolarHBondContact O-N 3.2Å; K141-I144 PolarHBondContact O-N 3.47Å; I144-S147 PolarHBondContact O-N 2.9Å; I144-K148 WeakPolarHBondContact O-CG 3.38Å; I144-K148 PolarHBondContact O-N 3.37Å; I144-I218 HydrophobicContact CD1-CD1 3.69Å; I144-I218 HydrophobicContact CD1-CG1 3.93Å; I144-I218 HydrophobicContact CG1-CD1 3.83Å; I144-P223 HydrophobicContact CG2-CB 4.04Å; I144-V227 HydrophobicContact CG1-CG2 4.41Å
145	Q	86.9	Confident	87.8	Confident	24 Å²	24	36.1 Å²	36.1	11%	0.112	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-45.4	177.8	-73.7	175.3	-14.6	0	0	112.1	L69 M71 K141 I142 V143 S147 K148 L149	L69-Q145 HydrophobicContact CD2-CB 3.81Å; L69-Q145 HydrophobicContact CD2-CG 4.39Å; M71-Q145 VanDerWaalsContact CG-NE2 3.3Å; M71-Q145 HydrophobicContact SD-CG 4.44Å; M71-Q145 PolarHBondContact SD-NE2 3.34Å; K141-Q145 WeakPolarHBondContact O-CG 3.27Å; K141-Q145 PolarHBondContact O-N 3.38Å; I142-Q145 WeakPolarHBondContact O-CB 3.27Å; I142-Q145 PolarHBondContact O-N 3.07Å; V143-Q145 VanDerWaalsContact C-N 3.33Å; Q145-S147 VanDerWaalsContact C-N 3.29Å; Q145-S147 PolarHBondContact O-N 3.36Å; Q145-K148 WeakPolarHBondContact O-CB 3.4Å; Q145-K148 PolarHBondContact O-N 3.12Å; Q145-K148 VanDerWaalsContact O-N 3.11Å; Q145-L149 PolarHBondContact O-N 3.17Å
146	C	89.6	Confident	87.6	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58.8	-42.8	176.1	-65.4	0	0	0	0	111.2	I142 V143 K148 L149 I166	I142-C146 PolarHBondContact O-N 2.91Å; I142-C146 PolarHBondContact O-SG 3.14Å; V143-C146 PolarHBondContact O-N 2.98Å; C146-K148 VanDerWaalsContact C-N 3.3Å; C146-K148 PolarHBondContact O-N 3.36Å; C146-L149 WeakPolarHBondContact O-CB 3.35Å; C146-L149 PolarHBondContact O-N 3.15Å; C146-I166 HydrophobicContact CB-CG2 4.14Å; C146-I166 WeakPolarHBondContact O-CG2 3.37Å
147	S	91.4	Very high	87.5	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.5	-32.3	177.1	-51.2	0	0	0	0	113	V143 I144 Q145 L149 L150 L170	V143-S147 PolarHBondContact O-N 3.16Å; V143-S147 PolarHBondContact O-OG 2.94Å; I144-S147 PolarHBondContact O-N 2.9Å; Q145-S147 VanDerWaalsContact C-N 3.29Å; Q145-S147 PolarHBondContact O-N 3.36Å; S147-L149 VanDerWaalsContact C-N 3.3Å; S147-L149 PolarHBondContact O-N 3.02Å; S147-L150 WeakPolarHBondContact O-CB 3.45Å; S147-L150 PolarHBondContact O-N 3.32Å; S147-L170 WeakPolarHBondContact OG-CD2 3.4Å
148	K	90.5	Very high	87.6	Confident	56 Å²	56	29.2 Å²	29.2	24%	0.243	15%	0.151	C	C	.	.	H	α-helix	trans	-65.8	-32.7	175.6	-71	-175.9	-169.1	-163.3	0	112.2	I144 Q145 C146 L150 S151 E220 P223	I144-K148 WeakPolarHBondContact O-CG 3.38Å; I144-K148 PolarHBondContact O-N 3.37Å; Q145-K148 WeakPolarHBondContact O-CB 3.4Å; Q145-K148 PolarHBondContact O-N 3.12Å; Q145-K148 VanDerWaalsContact O-N 3.11Å; C146-K148 VanDerWaalsContact C-N 3.3Å; C146-K148 PolarHBondContact O-N 3.36Å; K148-L150 PolarHBondContact O-N 3.08Å; K148-L150 VanDerWaalsContact O-N 3.1Å; K148-S151 WeakPolarHBondContact O-CB 3.44Å; K148-S151 PolarHBondContact O-N 2.95Å; K148-S151 PolarHBondContact O-OG 2.92Å; K148-E220 WeakPolarHBondContact CD-OE2 3.2Å; K148-E220 VanDerWaalsContact CE-CD 3.49Å; K148-E220 WeakPolarHBondContact CE-OE1 3.22Å; K148-E220 VanDerWaalsContact CE-OE2 3.29Å; K148-E220 WeakPolarHBondContact CE-OE2 3.32Å; K148-E220 IonicContact NZ-OE1 3.04Å; K148-E220 PolarHBondContact NZ-OE1 3.33Å; K148-E220 IonicContact NZ-OE2 3.6Å; K148-P223 HydrophobicContact CB-CG 4.48Å; K148-P223 HydrophobicContact CD-CG 4.49Å; K148-P223 HydrophobicContact CG-CB 4.47Å; K148-P223 HydrophobicContact CG-CG 3.43Å; K148-P223 VanDerWaalsContact CG-CG 3.43Å
149	L	87.8	Confident	87.8	Confident	9 Å²	9	23.8 Å²	23.8	5%	0.047	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-61.5	-20.2	177.3	-59.6	175.7	0	0	0	112.6	I67 I120 Q145 C146 S147 S151 D152 I166	I67-L149 HydrophobicContact CG2-CD1 4.34Å; I67-L149 HydrophobicContact CG2-CD2 4.15Å; I120-L149 HydrophobicContact CD1-CD1 3.9Å; Q145-L149 PolarHBondContact O-N 3.17Å; C146-L149 WeakPolarHBondContact O-CB 3.35Å; C146-L149 PolarHBondContact O-N 3.15Å; S147-L149 VanDerWaalsContact C-N 3.3Å; S147-L149 PolarHBondContact O-N 3.02Å; L149-S151 VanDerWaalsContact C-N 3.29Å; L149-S151 PolarHBondContact O-N 2.8Å; L149-D152 PolarHBondContact O-N 2.93Å; L149-I166 HydrophobicContact CB-CD1 3.68Å; L149-I166 HydrophobicContact CD1-CD1 4.45Å
150	L	89.8	Confident	88	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-75.5	-12	175.1	-62.8	174.6	0	0	0	114	S147 K148 D152 Y159 F163 I166 L222 Y226	S147-L150 WeakPolarHBondContact O-CB 3.45Å; S147-L150 PolarHBondContact O-N 3.32Å; K148-L150 PolarHBondContact O-N 3.08Å; K148-L150 VanDerWaalsContact O-N 3.1Å; L150-D152 VanDerWaalsContact C-N 3.31Å; L150-Y159 VanDerWaalsContact O-CE2 3.29Å; L150-Y159 WeakPolarHBondContact O-CE2 3.46Å; L150-Y159 PolarHBondContact O-OH 3.39Å; L150-F163 HydrophobicContact CD2-CB 4.32Å; L150-F163 HydrophobicContact CD2-CD2 4.36Å; L150-I166 HydrophobicContact CD1-CB 4.45Å; L150-I166 HydrophobicContact CD1-CG2 3.78Å; L150-I166 HydrophobicContact CD2-CB 4.03Å; L150-I166 HydrophobicContact CD2-CD1 3.57Å; L150-I166 HydrophobicContact CD2-CG1 4.39Å; L150-I166 HydrophobicContact CD2-CG2 4.18Å; L150-I166 HydrophobicContact CG-CB 4.29Å; L150-I166 HydrophobicContact CG-CD1 3.89Å; L150-I166 HydrophobicContact CG-CG2 3.87Å; L150-L222 HydrophobicContact CB-CD2 4.17Å; L150-Y226 HydrophobicContact CB-CE2 4.23Å; L150-Y226 HydrophobicContact CD1-CD1 4.35Å; L150-Y226 HydrophobicContact CD1-CD2 3.88Å; L150-Y226 HydrophobicContact CD1-CE1 4.03Å; L150-Y226 HydrophobicContact CD1-CE2 3.48Å; L150-Y226 VanDerWaalsContact CD1-CE2 3.48Å; L150-Y226 HydrophobicContact CD1-CG 4.3Å
151	S	88.5	Confident	88	Confident	75 Å²	75	22.9 Å²	22.9	52%	0.524	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-79.3	-18.9	172.2	70.5	0	0	0	0	112.4	K148 L149 T153	K148-S151 WeakPolarHBondContact O-CB 3.44Å; K148-S151 PolarHBondContact O-N 2.95Å; K148-S151 PolarHBondContact O-OG 2.92Å; L149-S151 VanDerWaalsContact C-N 3.29Å; L149-S151 PolarHBondContact O-N 2.8Å; S151-T153 PolarHBondContact O-N 3.48Å
152	D	85.1	Confident	88.1	Confident	45 Å²	45	19.2 Å²	19.2	24%	0.241	11%	0.107	C	C	.	.			trans	-82.5	109.4	-176.7	170.4	37.5	0	0	0	111.9	L149 L150 S154 K162	L149-D152 PolarHBondContact O-N 2.93Å; L150-D152 VanDerWaalsContact C-N 3.31Å; D152-S154 VanDerWaalsContact CG-OG 3.24Å; D152-S154 WeakPolarHBondContact OD1-CB 3.19Å; D152-S154 PolarHBondContact OD1-N 2.98Å; D152-S154 PolarHBondContact OD1-OG 3.49Å; D152-S154 PolarHBondContact OD2-OG 2.78Å; D152-K162 PolarHBondContact O-NZ 3.46Å; D152-K162 IonicContact OD2-NZ 3.79Å; D152-K162 PolarHBondContact OD2-NZ 2.82Å
153	T	82.7	Confident	88.4	Confident	18 Å²	18	18.7 Å²	18.7	11%	0.11	10%	0.104	C	C	.	.			trans	-106.4	26.9	174.1	59.4	0	0	0	0	112.6	S151 V155 I156 Y159 D259 V262 Q307 Q311	S151-T153 PolarHBondContact O-N 3.48Å; T153-V155 VanDerWaalsContact C-N 3.32Å; T153-V155 PolarHBondContact O-N 3.41Å; T153-I156 WeakPolarHBondContact O-CG1 3.3Å; T153-Y159 HydrophobicContact CG2-CD2 3.98Å; T153-Y159 HydrophobicContact CG2-CE2 3.95Å; T153-D259 WeakPolarHBondContact CG2-OD2 3.38Å; T153-D259 PolarHBondContact OG1-OD2 2.94Å; T153-V262 HydrophobicContact CG2-CG2 3.63Å; T153-Q307 PolarHBondContact O-NE2 3.48Å; T153-Q307 PolarHBondContact OG1-NE2 3.1Å; T153-Q311 PolarHBondContact O-NE2 2.62Å; T153-Q311 VanDerWaalsContact O-NE2 3.07Å
154	S	78.6	Confident	88.5	Confident	51 Å²	51	18.7 Å²	18.7	36%	0.357	10%	0.104	S	C	.	.	S	Bend	trans	-57.1	-41.4	175.7	54.4	0	0	0	0	113.5	D152 Q311	D152-S154 VanDerWaalsContact CG-OG 3.24Å; D152-S154 WeakPolarHBondContact OD1-CB 3.19Å; D152-S154 PolarHBondContact OD1-N 2.98Å; D152-S154 PolarHBondContact OD1-OG 3.49Å; D152-S154 PolarHBondContact OD2-OG 2.78Å; S154-Q311 VanDerWaalsContact O-CD 3.24Å; S154-Q311 PolarHBondContact O-NE2 3.46Å; S154-Q311 PolarHBondContact O-OE1 3.33Å
155	V	83.7	Confident	88.5	Confident	7 Å²	7	18.3 Å²	18.3	4%	0.042	10%	0.103	C	C	.	.	S	Bend	trans	-116.1	87.6	173	-177.8	0	0	0	0	108.9	T61 E63 L65 T153 Q157 F158	T61-V155 HydrophobicContact CG2-CG1 4.17Å; E63-V155 HydrophobicContact CB-CG1 4.24Å; E63-V155 HydrophobicContact CB-CG2 4.33Å; L65-V155 HydrophobicContact CD2-CB 3.82Å; L65-V155 HydrophobicContact CD2-CG1 3.99Å; L65-V155 HydrophobicContact CD2-CG2 3.87Å; T153-V155 VanDerWaalsContact C-N 3.32Å; T153-V155 PolarHBondContact O-N 3.41Å; V155-Q157 VanDerWaalsContact C-N 3.34Å; V155-Q157 PolarHBondContact O-N 3.04Å; V155-F158 HydrophobicContact CG1-CB 3.98Å; V155-F158 PolarHBondContact O-N 3.09Å
156	I	85.1	Confident	88.8	Confident	5 Å²	5	17.1 Å²	17.1	3%	0.026	10%	0.097	C	C	.	.	G	3₁₀ helix	trans	-63.8	-37	-171.5	-68	170.5	0	0	0	112.2	T153 F158 Y159 L261 Q307 L308 Y318 L321	T153-I156 WeakPolarHBondContact O-CG1 3.3Å; I156-F158 PolarHBondContact O-N 3.35Å; I156-Y159 WeakPolarHBondContact O-CB 3.42Å; I156-Y159 PolarHBondContact O-N 3.03Å; I156-Y159 VanDerWaalsContact O-N 3.09Å; I156-L261 HydrophobicContact CG2-CD2 3.86Å; I156-Q307 HydrophobicContact CD1-CG 3.85Å; I156-Q307 VanDerWaalsContact CD1-NE2 3.27Å; I156-L308 HydrophobicContact CD1-CD2 4.42Å; I156-Y318 HydrophobicContact CG2-CD2 4.02Å; I156-Y318 HydrophobicContact CG2-CE2 4.21Å; I156-L321 HydrophobicContact CB-CD1 4.47Å; I156-L321 HydrophobicContact CG2-CD1 3.25Å
157	Q	85.9	Confident	88.9	Confident	68 Å²	68	17.1 Å²	17.1	32%	0.318	10%	0.097	S	C	.	.	G	3₁₀ helix	trans	-62.2	-30.6	-177	-64.9	-178	-4.4	0	0	113.4	V155 V313	V155-Q157 VanDerWaalsContact C-N 3.34Å; V155-Q157 PolarHBondContact O-N 3.04Å; Q157-V313 HydrophobicContact CG-CG1 4.42Å; Q157-V313 HydrophobicContact CG-CG2 4.13Å
158	F	88.9	Confident	88.9	Confident	2 Å²	2	19.1 Å²	19.1	1%	0.009	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-88.1	-5.7	179.9	-175.7	-113.1	0	0	0	113.2	T61 L65 Q113 Y116 V155 I156 S161 K162 L165	T61-F158 HydrophobicContact CG2-CB 3.73Å; T61-F158 HydrophobicContact CG2-CD2 4.03Å; T61-F158 HydrophobicContact CG2-CG 3.93Å; L65-F158 HydrophobicContact CD1-CD1 3.74Å; L65-F158 HydrophobicContact CD1-CE1 3.66Å; L65-F158 HydrophobicContact CD1-CG 4.3Å; L65-F158 HydrophobicContact CD1-CZ 4.15Å; L65-F158 HydrophobicContact CD2-CB 4.36Å; L65-F158 HydrophobicContact CD2-CD1 3.76Å; L65-F158 HydrophobicContact CD2-CE1 4.44Å; L65-F158 HydrophobicContact CD2-CG 4.25Å; L65-F158 HydrophobicContact CG-CD1 4.44Å; Q113-F158 HydrophobicContact CG-CE2 3.77Å; Q113-F158 HydrophobicContact CG-CZ 4.33Å; Y116-F158 AromaticContact CD1-CE1 3.68Å; Y116-F158 HydrophobicContact CD1-CE1 3.68Å; Y116-F158 HydrophobicContact CD1-CZ 4.01Å; Y116-F158 AromaticContact CE1-CE1 3.82Å; Y116-F158 HydrophobicContact CE1-CE1 3.82Å; Y116-F158 HydrophobicContact CE1-CZ 4.45Å; Y116-F158 HydrophobicContact CG-CE1 4.22Å; V155-F158 HydrophobicContact CG1-CB 3.98Å; V155-F158 PolarHBondContact O-N 3.09Å; I156-F158 PolarHBondContact O-N 3.35Å; F158-S161 PolarHBondContact O-N 2.96Å; F158-S161 VanDerWaalsContact O-N 3.13Å; F158-K162 HydrophobicContact CD1-CB 3.98Å; F158-K162 HydrophobicContact CE1-CB 3.95Å; F158-K162 PolarHBondContact O-N 2.9Å; F158-L165 HydrophobicContact CZ-CD1 4.39Å
159	Y	92	Very high	88.9	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-55.3	-43.6	-174.5	-168.7	-88.2	0	0	0	114.1	L150 T153 I156 S161 K162 F163 L261 V262 Y265	L150-Y159 VanDerWaalsContact O-CE2 3.29Å; L150-Y159 WeakPolarHBondContact O-CE2 3.46Å; L150-Y159 PolarHBondContact O-OH 3.39Å; T153-Y159 HydrophobicContact CG2-CD2 3.98Å; T153-Y159 HydrophobicContact CG2-CE2 3.95Å; I156-Y159 WeakPolarHBondContact O-CB 3.42Å; I156-Y159 PolarHBondContact O-N 3.03Å; I156-Y159 VanDerWaalsContact O-N 3.09Å; Y159-S161 VanDerWaalsContact C-N 3.33Å; Y159-S161 PolarHBondContact O-N 3.37Å; Y159-K162 WeakPolarHBondContact O-CB 3.37Å; Y159-K162 PolarHBondContact O-N 3.34Å; Y159-F163 WeakPolarHBondContact O-CB 3.35Å; Y159-F163 PolarHBondContact O-N 3.36Å; Y159-L261 HydrophobicContact CD1-CD2 3.84Å; Y159-L261 HydrophobicContact CD1-CG 3.8Å; Y159-L261 HydrophobicContact CE1-CG 4.2Å; Y159-L261 HydrophobicContact CG-CD2 3.81Å; Y159-L261 HydrophobicContact CG-CG 4.27Å; Y159-V262 HydrophobicContact CE2-CG2 3.98Å; Y159-V262 WeakPolarHBondContact OH-CA 3.47Å; Y159-V262 WeakPolarHBondContact OH-CG1 3.21Å; Y159-Y265 AromaticContact CD1-CD2 3.79Å; Y159-Y265 HydrophobicContact CD1-CD2 3.79Å; Y159-Y265 HydrophobicContact CD1-CE2 4.08Å; Y159-Y265 HydrophobicContact CD1-CG 4.3Å; Y159-Y265 AromaticContact CE1-CD2 3.63Å; Y159-Y265 HydrophobicContact CE1-CD2 3.63Å; Y159-Y265 HydrophobicContact CE1-CE2 4.38Å; Y159-Y265 AromaticContact CE1-CG 3.83Å; Y159-Y265 HydrophobicContact CE1-CG 3.83Å
160	P	93.6	Very high	89.2	Confident	0 Å²	0	16 Å²	16	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-57.2	-43.3	176.1	-28.7	39.1	0	0	0	113.6	I55 F59 F163 V164 Y265 L321	I55-P160 HydrophobicContact CG2-CB 3.72Å; F59-P160 HydrophobicContact CB-CB 4.01Å; F59-P160 HydrophobicContact CB-CG 4.19Å; F59-P160 HydrophobicContact CD1-CB 4.33Å; F59-P160 HydrophobicContact CD1-CG 3.83Å; F59-P160 HydrophobicContact CD2-CB 3.59Å; F59-P160 HydrophobicContact CD2-CG 3.99Å; F59-P160 HydrophobicContact CE1-CG 4.16Å; F59-P160 HydrophobicContact CE2-CB 4.09Å; F59-P160 HydrophobicContact CE2-CG 4.3Å; F59-P160 HydrophobicContact CG-CB 3.71Å; F59-P160 HydrophobicContact CG-CG 3.72Å; F59-P160 HydrophobicContact CZ-CG 4.37Å; P160-F163 WeakPolarHBondContact O-CB 3.42Å; P160-F163 PolarHBondContact O-N 2.84Å; P160-V164 WeakPolarHBondContact O-CG2 3.46Å; P160-V164 PolarHBondContact O-N 3.29Å; P160-Y265 WeakPolarHBondContact CB-OH 3.44Å; P160-Y265 HydrophobicContact CG-CE2 4.42Å; P160-Y265 VanDerWaalsContact CG-OH 3.27Å; P160-Y265 WeakPolarHBondContact CG-OH 3.44Å; P160-L321 HydrophobicContact CG-CB 4.24Å; P160-L321 HydrophobicContact CG-CD2 3.95Å
161	S	90.8	Very high	89.3	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-69.4	-43	178.1	-66.9	0	0	0	0	111.7	I55 F59 F158 Y159 F163 V164 L165	I55-S161 PolarHBondContact O-OG 3.47Å; F59-S161 WeakPolarHBondContact O-CB 3.36Å; F59-S161 PolarHBondContact O-OG 2.82Å; F158-S161 PolarHBondContact O-N 2.96Å; F158-S161 VanDerWaalsContact O-N 3.13Å; Y159-S161 VanDerWaalsContact C-N 3.33Å; Y159-S161 PolarHBondContact O-N 3.37Å; S161-F163 VanDerWaalsContact C-N 3.29Å; S161-F163 PolarHBondContact O-N 2.9Å; S161-V164 PolarHBondContact O-N 3.17Å; S161-L165 WeakPolarHBondContact O-CG 3.46Å; S161-L165 PolarHBondContact O-N 3.36Å
162	K	91.1	Very high	89.5	Confident	1 Å²	1	14.8 Å²	14.8	0%	0.004	8%	0.082	C	C	.	.	H	α-helix	trans	-54.7	-46.3	173.2	-175.6	-174.3	-60.7	-172.7	0	111.1	Y116 D152 F158 Y159 I166	Y116-K162 HydrophobicContact CE1-CG 4.3Å; Y116-K162 WeakPolarHBondContact OH-CG 3.38Å; D152-K162 PolarHBondContact O-NZ 3.46Å; D152-K162 IonicContact OD2-NZ 3.79Å; D152-K162 PolarHBondContact OD2-NZ 2.82Å; F158-K162 HydrophobicContact CD1-CB 3.98Å; F158-K162 HydrophobicContact CE1-CB 3.95Å; F158-K162 PolarHBondContact O-N 2.9Å; Y159-K162 WeakPolarHBondContact O-CB 3.37Å; Y159-K162 PolarHBondContact O-N 3.34Å; K162-I166 HydrophobicContact CD-CD1 4.44Å; K162-I166 HydrophobicContact CG-CD1 3.79Å; K162-I166 WeakPolarHBondContact O-CG1 3.48Å; K162-I166 PolarHBondContact O-N 3.01Å
163	F	93.8	Very high	89.9	Confident	1 Å²	1	12.6 Å²	12.6	0%	0.004	7%	0.07	C	C	.	.	H	α-helix	trans	-57.2	-54.1	178.5	171.5	-94.8	0	0	0	111.8	W48 L150 Y159 P160 S161 L165 I166 T167 Y226 Y265 Y269	W48-F163 HydrophobicContact CH2-CE1 4.26Å; W48-F163 HydrophobicContact CZ2-CD1 4.24Å; W48-F163 AromaticContact CZ2-CE1 3.73Å; W48-F163 HydrophobicContact CZ2-CE1 3.73Å; L150-F163 HydrophobicContact CD2-CB 4.32Å; L150-F163 HydrophobicContact CD2-CD2 4.36Å; Y159-F163 WeakPolarHBondContact O-CB 3.35Å; Y159-F163 PolarHBondContact O-N 3.36Å; P160-F163 WeakPolarHBondContact O-CB 3.42Å; P160-F163 PolarHBondContact O-N 2.84Å; S161-F163 VanDerWaalsContact C-N 3.29Å; S161-F163 PolarHBondContact O-N 2.9Å; F163-L165 VanDerWaalsContact C-N 3.35Å; F163-L165 PolarHBondContact O-N 2.97Å; F163-I166 PolarHBondContact O-N 3.36Å; F163-T167 HydrophobicContact CD1-CG2 4.28Å; F163-T167 HydrophobicContact CD2-CG2 3.91Å; F163-T167 HydrophobicContact CE1-CG2 4.01Å; F163-T167 HydrophobicContact CE2-CG2 3.62Å; F163-T167 HydrophobicContact CG-CG2 4.25Å; F163-T167 HydrophobicContact CZ-CG2 3.7Å; F163-T167 VanDerWaalsContact O-CG2 3.32Å; F163-T167 WeakPolarHBondContact O-CG2 3.47Å; F163-T167 PolarHBondContact O-N 3.2Å; F163-T167 PolarHBondContact O-OG1 3.28Å; F163-T167 VanDerWaalsContact O-OG1 3.06Å; F163-Y226 HydrophobicContact CE2-CE1 4.09Å; F163-Y265 HydrophobicContact CB-CD1 3.93Å; F163-Y265 HydrophobicContact CB-CE1 4.28Å; F163-Y265 AromaticContact CD1-CD1 3.41Å; F163-Y265 HydrophobicContact CD1-CD1 3.41Å; F163-Y265 VanDerWaalsContact CD1-CD1 3.41Å; F163-Y265 AromaticContact CD1-CE1 3.81Å; F163-Y265 HydrophobicContact CD1-CE1 3.81Å; F163-Y265 AromaticContact CD2-CD1 3.73Å; F163-Y265 HydrophobicContact CD2-CD1 3.73Å; F163-Y265 HydrophobicContact CD2-CG 4.1Å; F163-Y265 AromaticContact CE1-CD1 3.71Å; F163-Y265 HydrophobicContact CE1-CD1 3.71Å; F163-Y265 HydrophobicContact CE1-CE1 4.29Å; F163-Y265 AromaticContact CE2-CD1 3.99Å; F163-Y265 HydrophobicContact CE2-CD1 3.99Å; F163-Y265 HydrophobicContact CE2-CG 4.39Å; F163-Y265 VanDerWaalsContact CE2-O 3.3Å; F163-Y265 WeakPolarHBondContact CE2-O 3.34Å; F163-Y265 AromaticContact CG-CD1 3.4Å; F163-Y265 HydrophobicContact CG-CD1 3.4Å; F163-Y265 VanDerWaalsContact CG-CD1 3.4Å; F163-Y265 HydrophobicContact CG-CE1 4.05Å; F163-Y265 HydrophobicContact CG-CG 4.13Å; F163-Y265 AromaticContact CZ-CD1 3.96Å; F163-Y265 HydrophobicContact CZ-CD1 3.96Å; F163-Y265 WeakPolarHBondContact CZ-O 3.41Å; F163-Y269 HydrophobicContact CZ-CD2 4.34Å
164	V	92.4	Very high	90.4	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-58.4	-47	-176.3	175.1	0	0	0	0	111.5	W48 R52 I55 P160 S161 I166 T167 D168	W48-V164 HydrophobicContact CZ2-CG2 3.97Å; R52-V164 HydrophobicContact CB-CG1 4.1Å; R52-V164 HydrophobicContact CG-CG1 3.65Å; I55-V164 HydrophobicContact CB-CG2 4.35Å; I55-V164 HydrophobicContact CD1-CG2 3.91Å; I55-V164 HydrophobicContact CG2-CG2 3.91Å; P160-V164 WeakPolarHBondContact O-CG2 3.46Å; P160-V164 PolarHBondContact O-N 3.29Å; S161-V164 PolarHBondContact O-N 3.17Å; V164-I166 PolarHBondContact O-N 2.91Å; V164-T167 WeakPolarHBondContact CA-OG1 3.37Å; V164-T167 PolarHBondContact O-N 3.45Å; V164-T167 PolarHBondContact O-OG1 3.4Å; V164-D168 PolarHBondContact O-N 3.47Å
165	L	90.2	Very high	91	Very high	22 Å²	22	16.7 Å²	16.7	12%	0.115	8%	0.078	C	C	.	.	H	α-helix	trans	-60.7	-42.1	-180	-66	172.6	0	0	0	112.7	L56 A117 I120 F158 S161 F163	L56-L165 HydrophobicContact CD2-CD2 4.19Å; L56-L165 HydrophobicContact CD2-CG 4.11Å; A117-L165 HydrophobicContact CB-CD1 4.14Å; I120-L165 HydrophobicContact CG2-CB 4.04Å; F158-L165 HydrophobicContact CZ-CD1 4.39Å; S161-L165 WeakPolarHBondContact O-CG 3.46Å; S161-L165 PolarHBondContact O-N 3.36Å; F163-L165 VanDerWaalsContact C-N 3.35Å; F163-L165 PolarHBondContact O-N 2.97Å
166	I	92.5	Very high	91.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-73.6	-38.7	-179.6	-70.3	165.4	0	0	0	111.1	I120 C146 L149 L150 K162 F163 V164 D168 I169 L170	I120-I166 HydrophobicContact CD1-CG1 4.35Å; C146-I166 HydrophobicContact CB-CG2 4.14Å; C146-I166 WeakPolarHBondContact O-CG2 3.37Å; L149-I166 HydrophobicContact CB-CD1 3.68Å; L149-I166 HydrophobicContact CD1-CD1 4.45Å; L150-I166 HydrophobicContact CD1-CB 4.45Å; L150-I166 HydrophobicContact CD1-CG2 3.78Å; L150-I166 HydrophobicContact CD2-CB 4.03Å; L150-I166 HydrophobicContact CD2-CD1 3.57Å; L150-I166 HydrophobicContact CD2-CG1 4.39Å; L150-I166 HydrophobicContact CD2-CG2 4.18Å; L150-I166 HydrophobicContact CG-CB 4.29Å; L150-I166 HydrophobicContact CG-CD1 3.89Å; L150-I166 HydrophobicContact CG-CG2 3.87Å; K162-I166 HydrophobicContact CD-CD1 4.44Å; K162-I166 HydrophobicContact CG-CD1 3.79Å; K162-I166 WeakPolarHBondContact O-CG1 3.48Å; K162-I166 PolarHBondContact O-N 3.01Å; F163-I166 PolarHBondContact O-N 3.36Å; V164-I166 PolarHBondContact O-N 2.91Å; I166-D168 PolarHBondContact O-N 3.22Å; I166-I169 WeakPolarHBondContact O-CB 3.39Å; I166-I169 PolarHBondContact O-N 3.11Å; I166-I169 VanDerWaalsContact O-N 3.08Å; I166-L170 PolarHBondContact O-N 3.22Å
167	T	92.7	Very high	91.8	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64.8	-27.8	179	54.5	0	0	0	0	113	F163 V164 I169 L170 D171 Y269	F163-T167 HydrophobicContact CD1-CG2 4.28Å; F163-T167 HydrophobicContact CD2-CG2 3.91Å; F163-T167 HydrophobicContact CE1-CG2 4.01Å; F163-T167 HydrophobicContact CE2-CG2 3.62Å; F163-T167 HydrophobicContact CG-CG2 4.25Å; F163-T167 HydrophobicContact CZ-CG2 3.7Å; F163-T167 VanDerWaalsContact O-CG2 3.32Å; F163-T167 WeakPolarHBondContact O-CG2 3.47Å; F163-T167 PolarHBondContact O-N 3.2Å; F163-T167 PolarHBondContact O-OG1 3.28Å; F163-T167 VanDerWaalsContact O-OG1 3.06Å; V164-T167 WeakPolarHBondContact CA-OG1 3.37Å; V164-T167 PolarHBondContact O-N 3.45Å; V164-T167 PolarHBondContact O-OG1 3.4Å; T167-I169 VanDerWaalsContact C-N 3.27Å; T167-I169 PolarHBondContact O-N 3.14Å; T167-L170 HydrophobicContact CG2-CD1 4.29Å; T167-L170 WeakPolarHBondContact O-CB 3.5Å; T167-L170 PolarHBondContact O-N 3.28Å; T167-D171 VanDerWaalsContact O-CG 3.31Å; T167-D171 PolarHBondContact O-N 2.87Å; T167-Y269 HydrophobicContact CG2-CD2 3.41Å; T167-Y269 VanDerWaalsContact CG2-CD2 3.41Å; T167-Y269 HydrophobicContact CG2-CE2 3.64Å; T167-Y269 HydrophobicContact CG2-CG 4.4Å
168	D	90.4	Very high	92	Very high	41 Å²	41	16 Å²	16	22%	0.219	7%	0.074	C	C	.	.	H	α-helix	trans	-61.9	-35.8	172.7	-70.9	-15.6	0	0	0	111.5	R52 V164 I166 T172	R52-D168 IonicContact CZ-OD2 2.64Å; R52-D168 IonicContact NE-OD1 2.95Å; R52-D168 IonicContact NE-OD2 2.9Å; R52-D168 PolarHBondContact NE-OD2 3.45Å; R52-D168 IonicContact NH2-OD2 3.85Å; R52-D168 PolarHBondContact NH2-OD2 3.47Å; V164-D168 PolarHBondContact O-N 3.47Å; I166-D168 PolarHBondContact O-N 3.22Å; D168-T172 WeakPolarHBondContact O-CB 3.44Å; D168-T172 PolarHBondContact O-N 3.03Å; D168-T172 PolarHBondContact O-OG1 2.65Å
169	I	92.3	Very high	92	Very high	1 Å²	1	20 Å²	20	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-69.8	-43.4	175	-58.6	-176.7	0	0	0	110.5	I120 L123 N124 L127 I166 T167 D171 T172 F173	I120-I169 HydrophobicContact CG2-CD1 3.6Å; I120-I169 HydrophobicContact CG2-CG1 4.4Å; I120-I169 WeakPolarHBondContact O-CD1 3.41Å; L123-I169 HydrophobicContact CB-CD1 4.3Å; N124-I169 HydrophobicContact CB-CD1 4.09Å; N124-I169 HydrophobicContact CB-CG1 3.88Å; L127-I169 HydrophobicContact CD2-CG2 3.63Å; I166-I169 WeakPolarHBondContact O-CB 3.39Å; I166-I169 PolarHBondContact O-N 3.11Å; I166-I169 VanDerWaalsContact O-N 3.08Å; T167-I169 VanDerWaalsContact C-N 3.27Å; T167-I169 PolarHBondContact O-N 3.14Å; I169-D171 VanDerWaalsContact C-N 3.34Å; I169-D171 PolarHBondContact O-N 3.38Å; I169-T172 WeakPolarHBondContact O-CB 3.41Å; I169-T172 PolarHBondContact O-N 3.48Å; I169-F173 PolarHBondContact O-N 3.43Å
170	L	93	Very high	91.8	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-59.4	-45.4	177.1	-61.8	178.7	0	0	0	111.4	V143 S147 I166 T167 T172 F173 G174 Y226 A230 Y269	V143-L170 HydrophobicContact CG1-CD2 3.48Å; V143-L170 VanDerWaalsContact CG1-CD2 3.48Å; S147-L170 WeakPolarHBondContact OG-CD2 3.4Å; I166-L170 PolarHBondContact O-N 3.22Å; T167-L170 HydrophobicContact CG2-CD1 4.29Å; T167-L170 WeakPolarHBondContact O-CB 3.5Å; T167-L170 PolarHBondContact O-N 3.28Å; L170-T172 VanDerWaalsContact C-N 3.32Å; L170-T172 PolarHBondContact O-N 3.17Å; L170-F173 WeakPolarHBondContact O-CB 3.29Å; L170-F173 PolarHBondContact O-N 3.15Å; L170-G174 PolarHBondContact O-N 3.03Å; L170-Y226 HydrophobicContact CD1-CD1 3.67Å; L170-Y226 HydrophobicContact CD1-CG 3.94Å; L170-A230 HydrophobicContact CB-CB 4.19Å; L170-Y269 HydrophobicContact CB-CE2 4.39Å; L170-Y269 VanDerWaalsContact CB-OH 3.29Å; L170-Y269 WeakPolarHBondContact CB-OH 3.25Å; L170-Y269 HydrophobicContact CD1-CE1 4.46Å; L170-Y269 HydrophobicContact CD1-CE2 4.07Å
171	D	91.8	Very high	91.5	Very high	34 Å²	34	23.2 Å²	23.2	18%	0.182	11%	0.108	C	C	.	.	H	α-helix	trans	-65	-36.8	177.5	-69.3	-19.4	0	0	0	112	T167 I169 G174 R175 Y269 R272	T167-D171 VanDerWaalsContact O-CG 3.31Å; T167-D171 PolarHBondContact O-N 2.87Å; I169-D171 VanDerWaalsContact C-N 3.34Å; I169-D171 PolarHBondContact O-N 3.38Å; D171-G174 PolarHBondContact O-N 3.3Å; D171-R175 WeakPolarHBondContact O-CB 3.4Å; D171-R175 WeakPolarHBondContact O-CG 3.24Å; D171-R175 PolarHBondContact O-N 3.42Å; D171-R175 PolarHBondContact O-NE 3.39Å; D171-Y269 PolarHBondContact OD1-OH 3.25Å; D171-R272 IonicContact OD1-CZ 3.41Å; D171-R272 IonicContact OD1-NH1 3.25Å; D171-R272 PolarHBondContact OD1-NH1 3.29Å; D171-R272 IonicContact OD1-NH2 2.78Å; D171-R272 PolarHBondContact OD1-NH2 3.38Å; D171-R272 IonicContact OD2-CZ 3.34Å; D171-R272 IonicContact OD2-NH1 3.6Å; D171-R272 PolarHBondContact OD2-NH1 3.44Å; D171-R272 IonicContact OD2-NH2 3.28Å; D171-R272 PolarHBondContact OD2-NH2 2.92Å
172	T	92.5	Very high	91.2	Very high	14 Å²	14	25.4 Å²	25.4	9%	0.086	12%	0.117	C	C	.	.	H	α-helix	trans	-63	-46.2	174.1	-59.9	0	0	0	0	110.6	K128 D168 I169 L170 R175 L176	K128-T172 HydrophobicContact CG-CG2 4.35Å; D168-T172 WeakPolarHBondContact O-CB 3.44Å; D168-T172 PolarHBondContact O-N 3.03Å; D168-T172 PolarHBondContact O-OG1 2.65Å; I169-T172 WeakPolarHBondContact O-CB 3.41Å; I169-T172 PolarHBondContact O-N 3.48Å; L170-T172 VanDerWaalsContact C-N 3.32Å; L170-T172 PolarHBondContact O-N 3.17Å; T172-R175 PolarHBondContact O-N 3.07Å; T172-R175 PolarHBondContact OG1-NH2 3.27Å; T172-L176 HydrophobicContact CG2-CD1 4.16Å; T172-L176 WeakPolarHBondContact O-CB 3.48Å; T172-L176 VanDerWaalsContact O-CG 3.22Å; T172-L176 WeakPolarHBondContact O-CG 3.41Å; T172-L176 PolarHBondContact O-N 2.91Å
173	F	94.6	Very high	90.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-61.6	-46.5	174.9	176.4	-105.1	0	0	0	112.6	L127 W131 L140 V143 I169 L170 R175 L176 V177 W211 V227 I231	L127-F173 HydrophobicContact CD1-CD2 4.28Å; L127-F173 HydrophobicContact CD2-CB 4.13Å; W131-F173 HydrophobicContact CZ3-CD2 4.32Å; W131-F173 AromaticContact CZ3-CE2 3.96Å; W131-F173 HydrophobicContact CZ3-CE2 3.96Å; L140-F173 HydrophobicContact CD1-CE1 4.39Å; L140-F173 HydrophobicContact CD1-CZ 3.87Å; V143-F173 HydrophobicContact CB-CG 4.32Å; V143-F173 HydrophobicContact CG1-CB 4.18Å; V143-F173 HydrophobicContact CG1-CD1 3.96Å; V143-F173 HydrophobicContact CG1-CG 4.05Å; V143-F173 HydrophobicContact CG2-CB 3.64Å; V143-F173 HydrophobicContact CG2-CD1 4.32Å; V143-F173 HydrophobicContact CG2-CD2 3.69Å; V143-F173 HydrophobicContact CG2-CE2 4.4Å; V143-F173 HydrophobicContact CG2-CG 3.62Å; I169-F173 PolarHBondContact O-N 3.43Å; L170-F173 WeakPolarHBondContact O-CB 3.29Å; L170-F173 PolarHBondContact O-N 3.15Å; F173-R175 VanDerWaalsContact C-N 3.34Å; F173-R175 PolarHBondContact O-N 3.37Å; F173-L176 PolarHBondContact O-N 3.22Å; F173-V177 HydrophobicContact CD1-CG2 4.27Å; F173-V177 HydrophobicContact CD2-CG2 4.21Å; F173-V177 HydrophobicContact CE1-CG2 3.84Å; F173-V177 HydrophobicContact CE2-CG2 3.8Å; F173-V177 HydrophobicContact CG-CG2 4.45Å; F173-V177 HydrophobicContact CZ-CG2 3.59Å; F173-V177 WeakPolarHBondContact O-CG2 3.03Å; F173-V177 PolarHBondContact O-N 3.36Å; F173-W211 HydrophobicContact CE2-CH2 4.24Å; F173-W211 HydrophobicContact CE2-CZ3 4.24Å; F173-W211 HydrophobicContact CZ-CE3 4.3Å; F173-W211 HydrophobicContact CZ-CH2 4.13Å; F173-W211 AromaticContact CZ-CZ3 3.7Å; F173-W211 HydrophobicContact CZ-CZ3 3.7Å; F173-V227 HydrophobicContact CD1-CG1 4.49Å; F173-V227 HydrophobicContact CE1-CG1 3.89Å; F173-I231 HydrophobicContact CD1-CG2 4.34Å; F173-I231 HydrophobicContact CE1-CG2 3.96Å
174	G	92.4	Very high	90.3	Very high	7 Å²	7	32.8 Å²	32.8	7%	0.072	16%	0.158	C	C	.	.	H	α-helix	trans	-56.1	-46.5	178.1	0	0	0	0	0	112.4	L170 D171 V177 Y178 A230	L170-G174 PolarHBondContact O-N 3.03Å; D171-G174 PolarHBondContact O-N 3.3Å; G174-V177 PolarHBondContact O-N 3.25Å; G174-Y178 WeakPolarHBondContact O-CB 3.46Å; G174-Y178 PolarHBondContact O-N 3.27Å; G174-A230 WeakPolarHBondContact CA-O 3.28Å
175	R	92.2	Very high	89.5	Confident	148 Å²	148	33.3 Å²	33.3	56%	0.558	16%	0.161	S	C	*	.	H	α-helix	trans	-62.1	-46.5	174.8	-74.3	-179.1	-68.6	147.1	-4.4	112.5	D171 T172 F173 V177 Y178 D179	D171-R175 WeakPolarHBondContact O-CB 3.4Å; D171-R175 WeakPolarHBondContact O-CG 3.24Å; D171-R175 PolarHBondContact O-N 3.42Å; D171-R175 PolarHBondContact O-NE 3.39Å; T172-R175 PolarHBondContact O-N 3.07Å; T172-R175 PolarHBondContact OG1-NH2 3.27Å; F173-R175 VanDerWaalsContact C-N 3.34Å; F173-R175 PolarHBondContact O-N 3.37Å; R175-V177 VanDerWaalsContact C-N 3.31Å; R175-V177 PolarHBondContact O-N 3.41Å; R175-Y178 PolarHBondContact O-N 3.05Å; R175-D179 WeakPolarHBondContact O-CB 3.34Å; R175-D179 VanDerWaalsContact O-CG 3.25Å; R175-D179 PolarHBondContact O-N 3.29Å
176	L	92.7	Very high	88.1	Confident	39 Å²	39	33.7 Å²	33.7	20%	0.204	17%	0.166	C	C	.	.	H	α-helix	trans	-59.1	-41.8	178.3	-72.6	173.1	0	0	0	112.3	W131 T172 F173 R180	W131-L176 HydrophobicContact CB-CD1 4.06Å; W131-L176 HydrophobicContact CD2-CB 3.88Å; W131-L176 HydrophobicContact CD2-CD1 4.05Å; W131-L176 HydrophobicContact CD2-CG 4.4Å; W131-L176 HydrophobicContact CE3-CB 4.29Å; W131-L176 HydrophobicContact CE3-CD1 4.48Å; W131-L176 HydrophobicContact CG-CB 4.33Å; W131-L176 HydrophobicContact CG-CD1 3.84Å; W131-L176 HydrophobicContact CG-CD2 4.23Å; W131-L176 HydrophobicContact CG-CG 4.36Å; W131-L176 HydrophobicContact CH2-CB 4.29Å; W131-L176 VanDerWaalsContact CZ2-C 3.44Å; W131-L176 HydrophobicContact CZ2-CB 3.89Å; W131-L176 WeakPolarHBondContact CZ2-O 3.42Å; W131-L176 HydrophobicContact CZ3-CB 4.48Å; T172-L176 HydrophobicContact CG2-CD1 4.16Å; T172-L176 WeakPolarHBondContact O-CB 3.48Å; T172-L176 VanDerWaalsContact O-CG 3.22Å; T172-L176 WeakPolarHBondContact O-CG 3.41Å; T172-L176 PolarHBondContact O-N 2.91Å; F173-L176 PolarHBondContact O-N 3.22Å; L176-R180 WeakPolarHBondContact O-CB 3.36Å; L176-R180 PolarHBondContact O-N 3.45Å; L176-R180 VanDerWaalsContact O-N 3.17Å
177	V	92	Very high	86.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-65.9	-46	175.6	175.9	0	0	0	0	110.8	W131 F173 G174 R175 R180 I181 W211 I231	W131-V177 HydrophobicContact CH2-CB 4.34Å; W131-V177 HydrophobicContact CH2-CG2 3.66Å; W131-V177 HydrophobicContact CZ3-CG2 4.02Å; F173-V177 HydrophobicContact CD1-CG2 4.27Å; F173-V177 HydrophobicContact CD2-CG2 4.21Å; F173-V177 HydrophobicContact CE1-CG2 3.84Å; F173-V177 HydrophobicContact CE2-CG2 3.8Å; F173-V177 HydrophobicContact CG-CG2 4.45Å; F173-V177 HydrophobicContact CZ-CG2 3.59Å; F173-V177 WeakPolarHBondContact O-CG2 3.03Å; F173-V177 PolarHBondContact O-N 3.36Å; G174-V177 PolarHBondContact O-N 3.25Å; R175-V177 VanDerWaalsContact C-N 3.31Å; R175-V177 PolarHBondContact O-N 3.41Å; V177-R180 PolarHBondContact O-N 2.86Å; V177-I181 HydrophobicContact CG1-CD1 3.92Å; V177-I181 WeakPolarHBondContact O-CG1 3.4Å; V177-I181 PolarHBondContact O-N 2.82Å; V177-I181 VanDerWaalsContact O-N 3.14Å; V177-W211 HydrophobicContact CG1-CD2 4.24Å; V177-W211 HydrophobicContact CG1-CG 4.1Å; V177-W211 HydrophobicContact CG2-CH2 4.46Å; V177-W211 HydrophobicContact CG2-CZ2 4.3Å; V177-I231 HydrophobicContact CB-CG2 4.19Å; V177-I231 HydrophobicContact CG1-CG2 4.15Å; V177-I231 HydrophobicContact CG2-CG2 4.24Å
178	Y	89.9	Confident	84.7	Confident	25 Å²	25	45.9 Å²	45.9	10%	0.098	24%	0.238	C	C	.	.	H	α-helix	trans	-59.7	-50.5	178.2	-176.8	-89.1	0	0	0	111.8	G174 R175 R180 I181 W182 K233 F237	G174-Y178 WeakPolarHBondContact O-CB 3.46Å; G174-Y178 PolarHBondContact O-N 3.27Å; R175-Y178 PolarHBondContact O-N 3.05Å; Y178-R180 VanDerWaalsContact C-N 3.26Å; Y178-R180 PolarHBondContact O-N 2.87Å; Y178-I181 PolarHBondContact O-N 3.04Å; Y178-I181 VanDerWaalsContact O-N 3.11Å; Y178-W182 HydrophobicContact CE1-CB 4.47Å; Y178-W182 HydrophobicContact CE1-CE3 4.44Å; Y178-W182 WeakPolarHBondContact O-CB 3.21Å; Y178-W182 PolarHBondContact O-N 3.43Å; Y178-K233 HydrophobicContact CD2-CB 4.09Å; Y178-K233 HydrophobicContact CD2-CD 3.92Å; Y178-K233 HydrophobicContact CD2-CG 3.77Å; Y178-K233 HydrophobicContact CE2-CB 4.39Å; Y178-K233 HydrophobicContact CE2-CD 3.89Å; Y178-K233 HydrophobicContact CE2-CG 3.64Å; Y178-K233 HydrophobicContact CG-CD 4.35Å; Y178-F237 AromaticContact CD2-CE2 3.57Å; Y178-F237 HydrophobicContact CD2-CE2 3.57Å; Y178-F237 HydrophobicContact CD2-CZ 4.02Å; Y178-F237 HydrophobicContact CE1-CZ 4.44Å; Y178-F237 AromaticContact CE2-CE2 3.46Å; Y178-F237 HydrophobicContact CE2-CE2 3.46Å; Y178-F237 VanDerWaalsContact CE2-CE2 3.46Å; Y178-F237 AromaticContact CE2-CZ 3.56Å; Y178-F237 HydrophobicContact CE2-CZ 3.56Å; Y178-F237 HydrophobicContact CG-CE2 4.36Å; Y178-F237 AromaticContact CZ-CZ 3.8Å
179	D	89.3	Confident	83.2	Confident	88 Å²	88	53.9 Å²	53.9	47%	0.471	27%	0.265	S	S	.	.	H	α-helix	trans	-59.6	-38.2	-179.6	-71.4	-15.8	0	0	0	111.5	R175 W182 T183	R175-D179 WeakPolarHBondContact O-CB 3.34Å; R175-D179 VanDerWaalsContact O-CG 3.25Å; R175-D179 PolarHBondContact O-N 3.29Å; D179-W182 PolarHBondContact O-N 2.91Å; D179-T183 VanDerWaalsContact O-CG2 3.3Å; D179-T183 WeakPolarHBondContact O-CG2 3.48Å; D179-T183 PolarHBondContact O-N 3.39Å; D179-T183 PolarHBondContact O-OG1 2.87Å
180	R	88.7	Confident	81.8	Confident	66 Å²	66	58.9 Å²	58.9	25%	0.249	30%	0.298	C	S	.	.	H	α-helix	trans	-64.4	-44.3	175.6	177.9	-177.5	-178.4	-166.4	2.8	112.4	W131 L176 V177 Y178 W182 T183 M184	W131-R180 HydrophobicContact CZ2-CB 4Å; L176-R180 WeakPolarHBondContact O-CB 3.36Å; L176-R180 PolarHBondContact O-N 3.45Å; L176-R180 VanDerWaalsContact O-N 3.17Å; V177-R180 PolarHBondContact O-N 2.86Å; Y178-R180 VanDerWaalsContact C-N 3.26Å; Y178-R180 PolarHBondContact O-N 2.87Å; R180-W182 VanDerWaalsContact C-N 3.31Å; R180-T183 PolarHBondContact O-OG1 3.49Å; R180-M184 HydrophobicContact CG-CE 4.1Å; R180-M184 WeakPolarHBondContact O-CG 3.38Å; R180-M184 PolarHBondContact O-N 2.95Å
181	I	87	Confident	80.5	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-68.4	-39.6	179.6	-63.2	164.7	0	0	0	109.1	V177 Y178 M184 C185 A204 C208 C234 F237	V177-I181 HydrophobicContact CG1-CD1 3.92Å; V177-I181 WeakPolarHBondContact O-CG1 3.4Å; V177-I181 PolarHBondContact O-N 2.82Å; V177-I181 VanDerWaalsContact O-N 3.14Å; Y178-I181 PolarHBondContact O-N 3.04Å; Y178-I181 VanDerWaalsContact O-N 3.11Å; I181-M184 PolarHBondContact O-N 3.32Å; I181-C185 WeakPolarHBondContact O-CB 3.22Å; I181-C185 PolarHBondContact O-N 3.46Å; I181-A204 HydrophobicContact CG2-CB 4.14Å; I181-C208 HydrophobicContact CD1-CB 3.92Å; I181-C208 HydrophobicContact CG2-CB 4.37Å; I181-C234 HydrophobicContact CD1-CB 4.16Å; I181-F237 HydrophobicContact CB-CD2 4.2Å; I181-F237 HydrophobicContact CB-CE2 3.97Å; I181-F237 HydrophobicContact CB-CZ 4.38Å; I181-F237 HydrophobicContact CG2-CB 4.35Å; I181-F237 HydrophobicContact CG2-CD1 4.06Å; I181-F237 HydrophobicContact CG2-CD2 3.49Å; I181-F237 VanDerWaalsContact CG2-CD2 3.49Å; I181-F237 HydrophobicContact CG2-CE1 4.22Å; I181-F237 HydrophobicContact CG2-CE2 3.68Å; I181-F237 HydrophobicContact CG2-CG 3.71Å; I181-F237 HydrophobicContact CG2-CZ 4.04Å
182	W	84.4	Confident	79.3	Confident	47 Å²	47	61.7 Å²	61.7	18%	0.178	32%	0.317	C	S	.	.	H	α-helix	trans	-60.9	-44.2	176.1	-177.9	-92.5	0	0	0	113.4	Y178 D179 R180 C185 S186 L191 F195 F237	Y178-W182 HydrophobicContact CE1-CB 4.47Å; Y178-W182 HydrophobicContact CE1-CE3 4.44Å; Y178-W182 WeakPolarHBondContact O-CB 3.21Å; Y178-W182 PolarHBondContact O-N 3.43Å; D179-W182 PolarHBondContact O-N 2.91Å; R180-W182 VanDerWaalsContact C-N 3.31Å; W182-C185 WeakPolarHBondContact O-CB 3.35Å; W182-C185 PolarHBondContact O-N 3.39Å; W182-C185 VanDerWaalsContact O-N 3.12Å; W182-S186 PolarHBondContact O-N 2.97Å; W182-S186 PolarHBondContact O-OG 2.95Å; W182-L191 HydrophobicContact CH2-CB 3.59Å; W182-L191 HydrophobicContact CZ2-CB 3.97Å; W182-L191 HydrophobicContact CZ3-CB 4.07Å; W182-F195 HydrophobicContact CE3-CE1 4.2Å; W182-F195 AromaticContact CH2-CD1 4Å; W182-F195 HydrophobicContact CH2-CD1 4Å; W182-F195 HydrophobicContact CH2-CE1 4.3Å; W182-F195 AromaticContact CZ3-CD1 3.48Å; W182-F195 HydrophobicContact CZ3-CD1 3.48Å; W182-F195 VanDerWaalsContact CZ3-CD1 3.48Å; W182-F195 AromaticContact CZ3-CE1 3.39Å; W182-F195 HydrophobicContact CZ3-CE1 3.39Å; W182-F195 HydrophobicContact CZ3-CG 4.29Å; W182-F195 HydrophobicContact CZ3-CZ 4.11Å; W182-F237 HydrophobicContact CB-CZ 4.32Å; W182-F237 AromaticContact CE3-CE1 3.94Å; W182-F237 HydrophobicContact CE3-CE1 3.94Å; W182-F237 HydrophobicContact CE3-CZ 4.04Å
183	T	84	Confident	77.5	Confident	90 Å²	90	66.4 Å²	66.4	55%	0.552	34%	0.341	S	S	*	.	H	α-helix	trans	-67	-37.1	179.7	52.3	0	0	0	0	112.6	D179 R180 C185 S186	D179-T183 VanDerWaalsContact O-CG2 3.3Å; D179-T183 WeakPolarHBondContact O-CG2 3.48Å; D179-T183 PolarHBondContact O-N 3.39Å; D179-T183 PolarHBondContact O-OG1 2.87Å; R180-T183 PolarHBondContact O-OG1 3.49Å; T183-C185 PolarHBondContact O-N 3.38Å; T183-S186 PolarHBondContact O-N 3.47Å
184	M	81.7	Confident	76	Confident	66 Å²	66	71 Å²	71	33%	0.325	37%	0.374	S	S	.	.	H	α-helix	trans	-61.7	-22.4	173.1	-70.8	176.2	170.7	0	0	113.3	R180 I181 N201 A204 T207	R180-M184 HydrophobicContact CG-CE 4.1Å; R180-M184 WeakPolarHBondContact O-CG 3.38Å; R180-M184 PolarHBondContact O-N 2.95Å; I181-M184 PolarHBondContact O-N 3.32Å; M184-N201 PolarHBondContact O-ND2 3.48Å; M184-A204 HydrophobicContact CB-CB 4.3Å; M184-T207 HydrophobicContact CE-CG2 4.42Å; M184-T207 HydrophobicContact SD-CG2 3.97Å
185	C	74.3	Confident	75	Confident	11 Å²	11	71.1 Å²	71.1	7%	0.074	37%	0.372	C	S	.	.	H	α-helix	trans	-90.6	-21.5	-175.5	-117.5	0	0	0	0	112.2	I181 W182 T183 L191 V200	I181-C185 WeakPolarHBondContact O-CB 3.22Å; I181-C185 PolarHBondContact O-N 3.46Å; W182-C185 WeakPolarHBondContact O-CB 3.35Å; W182-C185 PolarHBondContact O-N 3.39Å; W182-C185 VanDerWaalsContact O-N 3.12Å; T183-C185 PolarHBondContact O-N 3.38Å; C185-L191 HydrophobicContact CB-CD1 3.22Å; C185-L191 WeakPolarHBondContact O-CD1 3.46Å; C185-V200 VanDerWaalsContact SG-CG1 3.53Å
186	S	62.7	Low	73.9	Confident	31 Å²	31	66.6 Å²	66.6	22%	0.217	36%	0.361	C	S	.	.	S	Bend	trans	-91.5	3.1	-171.4	-61.6	0	0	0	0	114.8	W182 T183 R189	W182-S186 PolarHBondContact O-N 2.97Å; W182-S186 PolarHBondContact O-OG 2.95Å; T183-S186 PolarHBondContact O-N 3.47Å; S186-R189 CarbonylContact C-O 3.56Å; S186-R189 WeakPolarHBondContact CA-O 3.32Å; S186-R189 CarbonylContact O-C 3.46Å; S186-R189 PolarHBondContact O-N 3.19Å
187	D	57.6	Low	72.9	Confident	134 Å²	134	65.9 Å²	65.9	72%	0.717	36%	0.358	S	S	*	.	S	Bend	trans	-111.1	111	-178	-160.8	-0.7	0	0	0	109.2
188	P	54.4	Low	71.8	Confident	122 Å²	122	72.9 Å²	72.9	79%	0.792	39%	0.391	S	S	*	.	S	Bend	cis	-104.9	6.6	19.5	33.2	-23.3	0	0	0	116.3
189	R	59.7	Low	71	Confident	209 Å²	209	75.8 Å²	75.8	79%	0.789	41%	0.408	S	S	*	.	S	Bend	trans	-134.2	133.8	174.7	-79	-175.9	-101.9	-168.3	-4.7	110.9	S186 L191	S186-R189 CarbonylContact C-O 3.56Å; S186-R189 WeakPolarHBondContact CA-O 3.32Å; S186-R189 CarbonylContact O-C 3.46Å; S186-R189 PolarHBondContact O-N 3.19Å; R189-L191 PolarHBondContact O-N 3.28Å
190	P	62.5	Low	70.6	Confident	106 Å²	106	71.8 Å²	71.8	69%	0.688	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-65.1	134.8	177.4	26	-31.9	0	0	0	110.6
191	L	65.8	Low	70.3	Confident	16 Å²	16	71 Å²	71	8%	0.084	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-66.7	142.4	177.1	-83	129.1	0	0	0	111.5	W182 C185 R189 F195 D199	W182-L191 HydrophobicContact CH2-CB 3.59Å; W182-L191 HydrophobicContact CZ2-CB 3.97Å; W182-L191 HydrophobicContact CZ3-CB 4.07Å; C185-L191 HydrophobicContact CB-CD1 3.22Å; C185-L191 WeakPolarHBondContact O-CD1 3.46Å; R189-L191 PolarHBondContact O-N 3.28Å; L191-F195 HydrophobicContact CB-CB 4.21Å; L191-F195 HydrophobicContact CD2-CB 3.42Å; L191-F195 VanDerWaalsContact CD2-CB 3.42Å; L191-F195 HydrophobicContact CD2-CD2 3.89Å; L191-F195 HydrophobicContact CD2-CG 3.8Å; L191-F195 HydrophobicContact CG-CB 4.43Å; L191-D199 HydrophobicContact CD2-CB 3.58Å
192	P	66	Low	70.1	Confident	77 Å²	77	76.7 Å²	76.7	50%	0.5	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-61	150.9	169.2	-18	29.9	0	0	0	111.7	S194 F195	P192-S194 PolarHBondContact O-N 2.96Å; P192-S194 VanDerWaalsContact O-N 3.09Å; P192-F195 WeakPolarHBondContact O-CB 3.5Å; P192-F195 PolarHBondContact O-N 2.86Å
193	D	56.4	Low	70.1	Confident	112 Å²	112	78.5 Å²	78.5	60%	0.599	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.2	180	-63.3	-47.4	0	0	0	112.9	R236	D193-R236 PolarHBondContact O-NH1 2.88Å; D193-R236 PolarHBondContact O-NH2 3.45Å
194	S	62.3	Low	70.1	Confident	98 Å²	98	74.2 Å²	74.2	69%	0.685	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	36	173.3	67.1	0	0	0	0	113.6	P192	P192-S194 PolarHBondContact O-N 2.96Å; P192-S194 VanDerWaalsContact O-N 3.09Å
195	F	72.3	Confident	70.3	Confident	8 Å²	8	73.3 Å²	73.3	4%	0.035	40%	0.402	C	S	.	.			trans	-58.5	150.8	178.8	76.3	-75.6	0	0	0	113.4	W182 L191 P192 D199 V200 R236 F237	W182-F195 HydrophobicContact CE3-CE1 4.2Å; W182-F195 AromaticContact CH2-CD1 4Å; W182-F195 HydrophobicContact CH2-CD1 4Å; W182-F195 HydrophobicContact CH2-CE1 4.3Å; W182-F195 AromaticContact CZ3-CD1 3.48Å; W182-F195 HydrophobicContact CZ3-CD1 3.48Å; W182-F195 VanDerWaalsContact CZ3-CD1 3.48Å; W182-F195 AromaticContact CZ3-CE1 3.39Å; W182-F195 HydrophobicContact CZ3-CE1 3.39Å; W182-F195 HydrophobicContact CZ3-CG 4.29Å; W182-F195 HydrophobicContact CZ3-CZ 4.11Å; L191-F195 HydrophobicContact CB-CB 4.21Å; L191-F195 HydrophobicContact CD2-CB 3.42Å; L191-F195 VanDerWaalsContact CD2-CB 3.42Å; L191-F195 HydrophobicContact CD2-CD2 3.89Å; L191-F195 HydrophobicContact CD2-CG 3.8Å; L191-F195 HydrophobicContact CG-CB 4.43Å; P192-F195 WeakPolarHBondContact O-CB 3.5Å; P192-F195 PolarHBondContact O-N 2.86Å; F195-D199 HydrophobicContact CB-CB 4.4Å; F195-V200 HydrophobicContact CD2-CG2 3.63Å; F195-V200 HydrophobicContact CE2-CG2 3.57Å; F195-R236 VanDerWaalsContact CD1-NH2 3.32Å; F195-R236 HydrophobicContact CE1-CG 4.24Å; F195-R236 VanDerWaalsContact CE1-NE 3.27Å; F195-R236 HydrophobicContact CE2-CG 4.27Å; F195-R236 HydrophobicContact CZ-CB 4.39Å; F195-R236 HydrophobicContact CZ-CG 3.72Å; F195-R236 PolarHBondContact O-NH2 3.15Å; F195-F237 HydrophobicContact CE1-CE1 4.37Å; F195-F237 AromaticContact CE2-CD1 3.58Å; F195-F237 HydrophobicContact CE2-CD1 3.58Å; F195-F237 AromaticContact CE2-CE1 3.77Å; F195-F237 HydrophobicContact CE2-CE1 3.77Å; F195-F237 AromaticContact CZ-CD1 3.66Å; F195-F237 HydrophobicContact CZ-CD1 3.66Å; F195-F237 AromaticContact CZ-CE1 3.45Å; F195-F237 HydrophobicContact CZ-CE1 3.45Å; F195-F237 VanDerWaalsContact CZ-CE1 3.45Å; F195-F237 HydrophobicContact CZ-CZ 4.2Å
196	T	68.6	Low	70.9	Confident	53 Å²	53	78.6 Å²	78.6	33%	0.325	43%	0.426	S	S	.	.			trans	-106.9	165	175.2	71.3	0	0	0	0	111.2	E198 D199	T196-E198 PolarHBondContact O-N 3.44Å; T196-E198 VanDerWaalsContact O-N 3.1Å; T196-D199 WeakPolarHBondContact CA-OD2 3.43Å; T196-D199 PolarHBondContact N-OD2 3.43Å; T196-D199 WeakPolarHBondContact O-CB 3.43Å; T196-D199 PolarHBondContact O-N 3.23Å; T196-D199 PolarHBondContact OG1-OD2 3.38Å
197	V	71.6	Confident	72.1	Confident	24 Å²	24	78.6 Å²	78.6	15%	0.145	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-59.1	-24.2	-179.7	-178.9	0	0	0	0	112.9	D199 K205 L238 K240	V197-D199 VanDerWaalsContact C-N 3.3Å; V197-K205 WeakPolarHBondContact O-CE 3.19Å; V197-K205 PolarHBondContact O-NZ 2.99Å; V197-L238 WeakPolarHBondContact CG1-O 3.34Å; V197-K240 HydrophobicContact CG2-CG 3.79Å
198	E	69.6	Low	73.5	Confident	147 Å²	147	72.2 Å²	72.2	69%	0.687	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-73.8	-24.4	178.3	-68.6	157.3	-125.6	0	0	111.8	T196 V200 K240	T196-E198 PolarHBondContact O-N 3.44Å; T196-E198 VanDerWaalsContact O-N 3.1Å; E198-V200 VanDerWaalsContact C-N 3.31Å; E198-V200 PolarHBondContact O-N 3.37Å; E198-K240 IonicContact OE1-NZ 3.67Å; E198-K240 PolarHBondContact OE1-NZ 3.35Å
199	D	72.3	Confident	75.1	Confident	86 Å²	86	69.9 Å²	69.9	46%	0.46	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-82.8	-9.2	-179.8	-53	-54.7	0	0	0	112.8	L191 F195 T196 V197	L191-D199 HydrophobicContact CD2-CB 3.58Å; F195-D199 HydrophobicContact CB-CB 4.4Å; T196-D199 WeakPolarHBondContact CA-OD2 3.43Å; T196-D199 PolarHBondContact N-OD2 3.43Å; T196-D199 WeakPolarHBondContact O-CB 3.43Å; T196-D199 PolarHBondContact O-N 3.23Å; T196-D199 PolarHBondContact OG1-OD2 3.38Å; V197-D199 VanDerWaalsContact C-N 3.3Å
200	V	79.9	Confident	76.6	Confident	5 Å²	5	64 Å²	64	3%	0.03	36%	0.355	C	S	.	.	S	Bend	trans	-91	126.9	-176.3	179.8	0	0	0	0	109.8	C185 F195 E198 A204 K205 F237	C185-V200 VanDerWaalsContact SG-CG1 3.53Å; F195-V200 HydrophobicContact CD2-CG2 3.63Å; F195-V200 HydrophobicContact CE2-CG2 3.57Å; E198-V200 VanDerWaalsContact C-N 3.31Å; E198-V200 PolarHBondContact O-N 3.37Å; V200-A204 HydrophobicContact CG1-CB 4.16Å; V200-K205 HydrophobicContact CB-CG 4.42Å; V200-K205 HydrophobicContact CG1-CD 4.48Å; V200-K205 HydrophobicContact CG1-CG 3.72Å; V200-K205 WeakPolarHBondContact O-CE 3.32Å; V200-K205 PolarHBondContact O-NZ 3.21Å; V200-F237 HydrophobicContact CG1-CB 4.21Å; V200-F237 HydrophobicContact CG1-CD1 4.27Å; V200-F237 HydrophobicContact CG2-CD1 4.05Å
201	N	82.9	Confident	78	Confident	50 Å²	50	59.5 Å²	59.5	27%	0.267	33%	0.325	S	S	.	.			trans	-67.7	155.9	178.7	65.7	17.2	0	0	0	112.9	M184 T203 A204 K205	M184-N201 PolarHBondContact O-ND2 3.48Å; N201-T203 VanDerWaalsContact C-N 3.28Å; N201-T203 PolarHBondContact O-N 2.96Å; N201-T203 PolarHBondContact OD1-OG1 3.17Å; N201-A204 PolarHBondContact O-N 3.29Å; N201-A204 WeakPolarHBondContact OD1-CA 3.48Å; N201-A204 WeakPolarHBondContact OD1-CB 3.47Å; N201-A204 PolarHBondContact OD1-N 2.99Å; N201-K205 WeakPolarHBondContact O-CG 3.29Å; N201-K205 PolarHBondContact O-N 3.1Å; N201-K205 VanDerWaalsContact O-N 3.12Å
202	D	82.7	Confident	79.2	Confident	118 Å²	118	59.9 Å²	59.9	63%	0.631	33%	0.326	S	S	*	.	H	α-helix	trans	-65.4	-32.6	-175.2	-64.3	-34.2	0	0	0	112.3	K205 E206	D202-K205 WeakPolarHBondContact O-CB 3.5Å; D202-K205 PolarHBondContact O-N 3.45Å; D202-E206 WeakPolarHBondContact O-CG 3.5Å; D202-E206 PolarHBondContact O-N 3.06Å
203	T	84.3	Confident	80.4	Confident	85 Å²	85	62.8 Å²	62.8	52%	0.521	33%	0.331	S	S	.	.	H	α-helix	trans	-66.3	-39.6	177.6	52.4	0	0	0	0	112.9	N201 T207	N201-T203 VanDerWaalsContact C-N 3.28Å; N201-T203 PolarHBondContact O-N 2.96Å; N201-T203 PolarHBondContact OD1-OG1 3.17Å; T203-T207 WeakPolarHBondContact O-CB 3.43Å; T203-T207 PolarHBondContact O-N 3.31Å; T203-T207 PolarHBondContact O-OG1 3.29Å
204	A	84.9	Confident	82	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-70.6	-36.9	173.3	0	0	0	0	0	111.6	I181 M184 V200 N201 T207 C208	I181-A204 HydrophobicContact CG2-CB 4.14Å; M184-A204 HydrophobicContact CB-CB 4.3Å; V200-A204 HydrophobicContact CG1-CB 4.16Å; N201-A204 PolarHBondContact O-N 3.29Å; N201-A204 WeakPolarHBondContact OD1-CA 3.48Å; N201-A204 WeakPolarHBondContact OD1-CB 3.47Å; N201-A204 PolarHBondContact OD1-N 2.99Å; A204-T207 PolarHBondContact O-N 3.46Å; A204-C208 VanDerWaalsContact O-CB 3.25Å; A204-C208 WeakPolarHBondContact O-CB 3.5Å; A204-C208 PolarHBondContact O-N 3.02Å
205	K	84.8	Confident	83.4	Confident	47 Å²	47	57.9 Å²	57.9	20%	0.204	29%	0.292	C	S	.	.	H	α-helix	trans	-61	-48.8	173.7	-73.5	173.3	179.1	155.3	0	111.8	V197 V200 N201 D202 T207 C208 L209 L238	V197-K205 WeakPolarHBondContact O-CE 3.19Å; V197-K205 PolarHBondContact O-NZ 2.99Å; V200-K205 HydrophobicContact CB-CG 4.42Å; V200-K205 HydrophobicContact CG1-CD 4.48Å; V200-K205 HydrophobicContact CG1-CG 3.72Å; V200-K205 WeakPolarHBondContact O-CE 3.32Å; V200-K205 PolarHBondContact O-NZ 3.21Å; N201-K205 WeakPolarHBondContact O-CG 3.29Å; N201-K205 PolarHBondContact O-N 3.1Å; N201-K205 VanDerWaalsContact O-N 3.12Å; D202-K205 WeakPolarHBondContact O-CB 3.5Å; D202-K205 PolarHBondContact O-N 3.45Å; K205-T207 PolarHBondContact O-N 3.04Å; K205-C208 PolarHBondContact O-N 3.36Å; K205-L209 WeakPolarHBondContact O-CG 3.41Å; K205-L209 PolarHBondContact O-N 3.3Å; K205-L238 HydrophobicContact CB-CD2 4.38Å; K205-L238 WeakPolarHBondContact O-CD2 3.44Å
206	E	86.6	Confident	84.2	Confident	122 Å²	122	60 Å²	60	57%	0.57	31%	0.311	S	S	*	.	H	α-helix	trans	-61.2	-43.7	175.9	-74.8	-178.9	177.4	0	0	111.7	D202 C208 L209 N210	D202-E206 WeakPolarHBondContact O-CG 3.5Å; D202-E206 PolarHBondContact O-N 3.06Å; E206-C208 VanDerWaalsContact C-N 3.31Å; E206-C208 PolarHBondContact O-N 3.16Å; E206-L209 PolarHBondContact O-N 3.41Å; E206-N210 WeakPolarHBondContact O-CB 3.35Å; E206-N210 PolarHBondContact O-N 3.45Å; E206-N210 PolarHBondContact O-ND2 2.9Å; E206-N210 VanDerWaalsContact O-ND2 3.08Å
207	T	88.1	Confident	85.2	Confident	31 Å²	31	61.7 Å²	61.7	19%	0.19	33%	0.325	C	S	.	.	H	α-helix	trans	-62.5	-39.8	177.2	-60.1	0	0	0	0	111.6	M184 T203 A204 K205 N210 W211	M184-T207 HydrophobicContact CE-CG2 4.42Å; M184-T207 HydrophobicContact SD-CG2 3.97Å; T203-T207 WeakPolarHBondContact O-CB 3.43Å; T203-T207 PolarHBondContact O-N 3.31Å; T203-T207 PolarHBondContact O-OG1 3.29Å; A204-T207 PolarHBondContact O-N 3.46Å; K205-T207 PolarHBondContact O-N 3.04Å; T207-N210 PolarHBondContact O-N 3.43Å; T207-W211 VanDerWaalsContact O-CD1 3.23Å; T207-W211 PolarHBondContact O-N 3.23Å
208	C	88.4	Confident	86.2	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-66.6	-47.1	176.1	-171.7	0	0	0	0	111.7	I181 A204 K205 E206 N210 W211 F212 C234 L238	I181-C208 HydrophobicContact CD1-CB 3.92Å; I181-C208 HydrophobicContact CG2-CB 4.37Å; A204-C208 VanDerWaalsContact O-CB 3.25Å; A204-C208 WeakPolarHBondContact O-CB 3.5Å; A204-C208 PolarHBondContact O-N 3.02Å; K205-C208 PolarHBondContact O-N 3.36Å; E206-C208 VanDerWaalsContact C-N 3.31Å; E206-C208 PolarHBondContact O-N 3.16Å; C208-N210 VanDerWaalsContact C-N 3.3Å; C208-N210 PolarHBondContact O-N 2.9Å; C208-W211 WeakPolarHBondContact O-CB 3.36Å; C208-W211 PolarHBondContact O-N 3.47Å; C208-W211 VanDerWaalsContact O-N 3.1Å; C208-F212 WeakPolarHBondContact O-CD2 3.4Å; C208-F212 PolarHBondContact O-N 3.42Å; C208-C234 PolarHBondContact SG-O 3Å; C208-C234 VanDerWaalsContact SG-O 3.35Å; C208-L238 HydrophobicContact CB-CD2 3.87Å; C208-L238 HydrophobicContact CB-CG 4.22Å
209	L	87.9	Confident	87.1	Confident	73 Å²	73	65.1 Å²	65.1	38%	0.382	33%	0.33	S	S	.	.	H	α-helix	trans	-57.4	-42.3	173.9	-76.5	170.2	0	0	0	112	K205 E206 W211 F212 F213 L238	K205-L209 WeakPolarHBondContact O-CG 3.41Å; K205-L209 PolarHBondContact O-N 3.3Å; E206-L209 PolarHBondContact O-N 3.41Å; L209-W211 VanDerWaalsContact C-N 3.27Å; L209-W211 PolarHBondContact O-N 3.03Å; L209-F212 PolarHBondContact O-N 2.87Å; L209-F212 VanDerWaalsContact O-N 3.13Å; L209-F213 HydrophobicContact CB-CD2 4.33Å; L209-F213 HydrophobicContact CB-CE2 4.02Å; L209-F213 WeakPolarHBondContact O-CD2 3.09Å; L209-F213 PolarHBondContact O-N 2.93Å; L209-L238 HydrophobicContact CD1-CD2 4.48Å; L209-L238 HydrophobicContact CD2-CD1 3.8Å; L209-L238 HydrophobicContact CD2-CD2 4.05Å; L209-L238 HydrophobicContact CG-CD1 4.23Å; L209-L238 HydrophobicContact CG-CD2 3.7Å
210	N	90.6	Very high	87.9	Confident	85 Å²	85	65.3 Å²	65.3	46%	0.455	33%	0.328	S	S	.	.	H	α-helix	trans	-59.6	-36.2	177.1	-78	-34.8	0	0	0	112.6	E206 T207 C208 K214	E206-N210 WeakPolarHBondContact O-CB 3.35Å; E206-N210 PolarHBondContact O-N 3.45Å; E206-N210 PolarHBondContact O-ND2 2.9Å; E206-N210 VanDerWaalsContact O-ND2 3.08Å; T207-N210 PolarHBondContact O-N 3.43Å; C208-N210 VanDerWaalsContact C-N 3.3Å; C208-N210 PolarHBondContact O-N 2.9Å; N210-K214 WeakPolarHBondContact O-CB 3.46Å; N210-K214 WeakPolarHBondContact O-CG 3.46Å; N210-K214 PolarHBondContact O-N 3.4Å
211	W	92.6	Very high	88.5	Confident	13 Å²	13	67.7 Å²	67.7	5%	0.049	34%	0.34	C	S	.	.	H	α-helix	trans	-66.1	-46.5	173.1	-82.3	110.8	0	0	0	111.8	W131 K136 L140 F173 V177 T207 C208 L209 F213 K214 I215 I231	W131-W211 HydrophobicContact CH2-CH2 4.39Å; W131-W211 AromaticContact CH2-CZ2 3.92Å; W131-W211 HydrophobicContact CH2-CZ2 3.92Å; W131-W211 HydrophobicContact CZ3-CH2 4.09Å; W131-W211 HydrophobicContact CZ3-CZ2 4.07Å; K136-W211 HydrophobicContact CB-CH2 4.25Å; K136-W211 HydrophobicContact CB-CZ2 4.35Å; L140-W211 HydrophobicContact CB-CZ3 4.29Å; L140-W211 HydrophobicContact CD1-CZ3 4.3Å; L140-W211 HydrophobicContact CD2-CZ3 4.17Å; L140-W211 HydrophobicContact CG-CZ3 4.49Å; F173-W211 HydrophobicContact CE2-CH2 4.24Å; F173-W211 HydrophobicContact CE2-CZ3 4.24Å; F173-W211 HydrophobicContact CZ-CE3 4.3Å; F173-W211 HydrophobicContact CZ-CH2 4.13Å; F173-W211 AromaticContact CZ-CZ3 3.7Å; F173-W211 HydrophobicContact CZ-CZ3 3.7Å; V177-W211 HydrophobicContact CG1-CD2 4.24Å; V177-W211 HydrophobicContact CG1-CG 4.1Å; V177-W211 HydrophobicContact CG2-CH2 4.46Å; V177-W211 HydrophobicContact CG2-CZ2 4.3Å; T207-W211 VanDerWaalsContact O-CD1 3.23Å; T207-W211 PolarHBondContact O-N 3.23Å; C208-W211 WeakPolarHBondContact O-CB 3.36Å; C208-W211 PolarHBondContact O-N 3.47Å; C208-W211 VanDerWaalsContact O-N 3.1Å; L209-W211 VanDerWaalsContact C-N 3.27Å; L209-W211 PolarHBondContact O-N 3.03Å; W211-F213 PolarHBondContact O-N 2.88Å; W211-K214 PolarHBondContact O-N 3.3Å; W211-I215 WeakPolarHBondContact O-CD1 3.36Å; W211-I215 VanDerWaalsContact O-CG1 3.31Å; W211-I215 WeakPolarHBondContact O-CG1 3.31Å; W211-I215 PolarHBondContact O-N 3.39Å; W211-I231 HydrophobicContact CB-CD1 4.46Å
212	F	90.4	Very high	88.9	Confident	24 Å²	24	66.4 Å²	66.4	11%	0.105	33%	0.333	C	S	.	.	H	α-helix	trans	-61.7	-41.9	176.9	-77.2	-72.5	0	0	0	112.5	C208 L209 I215 A216 I231 C234 N235 L238	C208-F212 WeakPolarHBondContact O-CD2 3.4Å; C208-F212 PolarHBondContact O-N 3.42Å; L209-F212 PolarHBondContact O-N 2.87Å; L209-F212 VanDerWaalsContact O-N 3.13Å; F212-I215 PolarHBondContact O-N 3.31Å; F212-A216 VanDerWaalsContact O-CB 3.28Å; F212-A216 WeakPolarHBondContact O-CB 3.36Å; F212-A216 PolarHBondContact O-N 3.42Å; F212-I231 HydrophobicContact CD1-CD1 3.72Å; F212-I231 HydrophobicContact CD2-CD1 4.37Å; F212-I231 HydrophobicContact CE1-CD1 3.5Å; F212-I231 HydrophobicContact CE1-CG1 4Å; F212-I231 HydrophobicContact CE2-CD1 4.19Å; F212-I231 HydrophobicContact CG-CD1 4.15Å; F212-I231 HydrophobicContact CZ-CD1 3.75Å; F212-I231 HydrophobicContact CZ-CG1 4.3Å; F212-C234 HydrophobicContact CE2-CB 4.31Å; F212-C234 HydrophobicContact CZ-CB 4.39Å; F212-N235 WeakPolarHBondContact CE2-OD1 3.43Å; F212-N235 HydrophobicContact CZ-CB 4.36Å; F212-N235 VanDerWaalsContact CZ-CG 3.45Å; F212-N235 WeakPolarHBondContact CZ-OD1 3.43Å; F212-L238 HydrophobicContact CD2-CD1 3.53Å; F212-L238 HydrophobicContact CE2-CD1 3.61Å
213	F	90.3	Very high	89.4	Confident	137 Å²	137	60.8 Å²	60.8	60%	0.601	30%	0.303	S	S	*	.	H	α-helix	trans	-64.8	-41.5	175.9	-69.8	-50.1	0	0	0	112.7	L209 W211 I215 A216 S217	L209-F213 HydrophobicContact CB-CD2 4.33Å; L209-F213 HydrophobicContact CB-CE2 4.02Å; L209-F213 WeakPolarHBondContact O-CD2 3.09Å; L209-F213 PolarHBondContact O-N 2.93Å; W211-F213 PolarHBondContact O-N 2.88Å; F213-I215 VanDerWaalsContact C-N 3.31Å; F213-I215 PolarHBondContact O-N 3.37Å; F213-A216 PolarHBondContact O-N 3.34Å; F213-S217 PolarHBondContact O-N 2.9Å
214	K	91.3	Very high	89.9	Confident	108 Å²	108	59.9 Å²	59.9	47%	0.47	29%	0.29	S	S	.	.	H	α-helix	trans	-61.9	-41.1	175.1	-75.8	174.1	-177	-176.1	0	111.5	L140 N210 W211 S217	L140-K214 HydrophobicContact CD2-CB 4.46Å; N210-K214 WeakPolarHBondContact O-CB 3.46Å; N210-K214 WeakPolarHBondContact O-CG 3.46Å; N210-K214 PolarHBondContact O-N 3.4Å; W211-K214 PolarHBondContact O-N 3.3Å; K214-S217 PolarHBondContact O-N 3.17Å; K214-S217 PolarHBondContact O-OG 3.42Å
215	I	91.8	Very high	90.4	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-70.9	-41.6	178.4	-68.5	162	0	0	0	111.2	W211 F212 F213 S217 I218 R224 V227 E228 I231	W211-I215 WeakPolarHBondContact O-CD1 3.36Å; W211-I215 VanDerWaalsContact O-CG1 3.31Å; W211-I215 WeakPolarHBondContact O-CG1 3.31Å; W211-I215 PolarHBondContact O-N 3.39Å; F212-I215 PolarHBondContact O-N 3.31Å; F213-I215 VanDerWaalsContact C-N 3.31Å; F213-I215 PolarHBondContact O-N 3.37Å; I215-S217 PolarHBondContact O-N 3Å; I215-I218 HydrophobicContact CB-CD1 4.47Å; I215-I218 HydrophobicContact CG2-CD1 4.23Å; I215-I218 VanDerWaalsContact O-CB 3.29Å; I215-I218 WeakPolarHBondContact O-CB 3.12Å; I215-I218 WeakPolarHBondContact O-CD1 3.35Å; I215-I218 VanDerWaalsContact O-CG1 3.27Å; I215-I218 WeakPolarHBondContact O-CG1 3.36Å; I215-I218 PolarHBondContact O-N 3.18Å; I215-R224 HydrophobicContact CG2-CG 4.48Å; I215-V227 HydrophobicContact CD1-CG1 3.78Å; I215-V227 HydrophobicContact CG1-CG1 3.75Å; I215-V227 HydrophobicContact CG2-CB 4.38Å; I215-V227 HydrophobicContact CG2-CG1 4.27Å; I215-E228 HydrophobicContact CG2-CB 3.72Å; I215-E228 HydrophobicContact CG2-CG 4.45Å; I215-I231 HydrophobicContact CD1-CD1 3.21Å; I215-I231 HydrophobicContact CD1-CG1 3.71Å; I215-I231 HydrophobicContact CD1-CG2 4.37Å
216	A	88.6	Confident	90.8	Very high	52 Å²	52	57.6 Å²	57.6	43%	0.43	28%	0.281	S	S	.	.	H	α-helix	trans	-59.7	-29.7	175.5	0	0	0	0	0	112.6	F212 F213 I218	F212-A216 VanDerWaalsContact O-CB 3.28Å; F212-A216 WeakPolarHBondContact O-CB 3.36Å; F212-A216 PolarHBondContact O-N 3.42Å; F213-A216 PolarHBondContact O-N 3.34Å; A216-I218 PolarHBondContact O-N 2.67Å
217	S	90.8	Very high	91.2	Very high	89 Å²	89	51.8 Å²	51.8	62%	0.622	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-10.2	176.9	79.9	0	0	0	0	114.8	F213 K214 I215 R219	F213-S217 PolarHBondContact O-N 2.9Å; K214-S217 PolarHBondContact O-N 3.17Å; K214-S217 PolarHBondContact O-OG 3.42Å; I215-S217 PolarHBondContact O-N 3Å; S217-R219 PolarHBondContact O-N 2.88Å
218	I	91.6	Very high	91.5	Very high	19 Å²	19	50.8 Å²	50.8	10%	0.097	25%	0.247	C	C	.	.			trans	-65.9	121.9	175	-60.7	167.1	0	0	0	109	I144 I215 A216 P223 R224	I144-I218 HydrophobicContact CD1-CD1 3.69Å; I144-I218 HydrophobicContact CD1-CG1 3.93Å; I144-I218 HydrophobicContact CG1-CD1 3.83Å; I215-I218 HydrophobicContact CB-CD1 4.47Å; I215-I218 HydrophobicContact CG2-CD1 4.23Å; I215-I218 VanDerWaalsContact O-CB 3.29Å; I215-I218 WeakPolarHBondContact O-CB 3.12Å; I215-I218 WeakPolarHBondContact O-CD1 3.35Å; I215-I218 VanDerWaalsContact O-CG1 3.27Å; I215-I218 WeakPolarHBondContact O-CG1 3.36Å; I215-I218 PolarHBondContact O-N 3.18Å; A216-I218 PolarHBondContact O-N 2.67Å; I218-P223 HydrophobicContact CG2-CB 4.31Å; I218-R224 HydrophobicContact CB-CB 4.01Å; I218-R224 HydrophobicContact CB-CG 4.42Å; I218-R224 HydrophobicContact CG2-CB 4.08Å
219	R	89.3	Confident	91.7	Very high	224 Å²	224	50.8 Å²	50.8	85%	0.845	25%	0.247	S	C	*	.			trans	-70.3	-40	-175.9	-65.1	-177.2	-178.5	174.7	1.1	113	S217	S217-R219 PolarHBondContact O-N 2.88Å
220	E	89.3	Confident	91.9	Very high	90 Å²	90	47.9 Å²	47.9	42%	0.421	23%	0.233	S	C	.	.	S	Bend	trans	-77.1	131.8	-177.4	-70	172.2	-127.7	0	0	111.5	K148 L222 P223 R224	K148-E220 WeakPolarHBondContact CD-OE2 3.2Å; K148-E220 VanDerWaalsContact CE-CD 3.49Å; K148-E220 WeakPolarHBondContact CE-OE1 3.22Å; K148-E220 VanDerWaalsContact CE-OE2 3.29Å; K148-E220 WeakPolarHBondContact CE-OE2 3.32Å; K148-E220 IonicContact NZ-OE1 3.04Å; K148-E220 PolarHBondContact NZ-OE1 3.33Å; K148-E220 IonicContact NZ-OE2 3.6Å; E220-L222 PolarHBondContact O-N 3.45Å; E220-P223 HydrophobicContact CB-CG 4.05Å; E220-R224 VanDerWaalsContact O-CB 3.25Å; E220-R224 WeakPolarHBondContact O-CB 3.4Å; E220-R224 PolarHBondContact O-N 2.89Å
221	L	91.1	Very high	92	Very high	55 Å²	55	43.9 Å²	43.9	29%	0.288	21%	0.212	S	C	.	.	H	α-helix	trans	-62.1	-46.7	-175.7	179.3	63.3	0	0	0	112.7	R224 L225 M253 M257	L221-R224 PolarHBondContact O-N 2.86Å; L221-L225 WeakPolarHBondContact O-CB 3.3Å; L221-L225 PolarHBondContact O-N 3.27Å; L221-M253 HydrophobicContact CD1-CB 4.36Å; L221-M257 HydrophobicContact CD2-CG 4.43Å
222	L	92	Very high	91.8	Very high	22 Å²	22	43.3 Å²	43.3	12%	0.115	21%	0.209	C	C	.	.	H	α-helix	trans	-66.2	-52.3	-171.7	-172	66.7	0	0	0	112.7	L150 E220 R224 L225 Y226 M257 V262	L150-L222 HydrophobicContact CB-CD2 4.17Å; E220-L222 PolarHBondContact O-N 3.45Å; L222-R224 VanDerWaalsContact C-N 3.31Å; L222-R224 PolarHBondContact O-N 2.87Å; L222-L225 PolarHBondContact O-N 3.26Å; L222-Y226 HydrophobicContact CD1-CD2 3.76Å; L222-Y226 HydrophobicContact CD1-CE2 3.39Å; L222-Y226 HydrophobicContact CD2-CE2 4.48Å; L222-Y226 HydrophobicContact CG-CD2 3.91Å; L222-Y226 HydrophobicContact CG-CE2 3.86Å; L222-Y226 WeakPolarHBondContact O-CD2 3.41Å; L222-Y226 PolarHBondContact O-N 2.97Å; L222-Y226 VanDerWaalsContact O-N 3.13Å; L222-M257 HydrophobicContact CD1-CE 3.26Å; L222-M257 HydrophobicContact CD1-SD 4.06Å; L222-V262 HydrophobicContact CD1-CG1 4.06Å; L222-V262 HydrophobicContact CD2-CG1 4.05Å
223	P	93.4	Very high	91.6	Very high	1 Å²	1	44.8 Å²	44.8	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-62.9	-38.3	176	-21.8	35.8	0	0	0	112.3	I144 K148 I218 E220 L225 Y226 V227	I144-P223 HydrophobicContact CG2-CB 4.04Å; K148-P223 HydrophobicContact CB-CG 4.48Å; K148-P223 HydrophobicContact CD-CG 4.49Å; K148-P223 HydrophobicContact CG-CB 4.47Å; K148-P223 HydrophobicContact CG-CG 3.43Å; K148-P223 VanDerWaalsContact CG-CG 3.43Å; I218-P223 HydrophobicContact CG2-CB 4.31Å; E220-P223 HydrophobicContact CB-CG 4.05Å; P223-L225 VanDerWaalsContact C-N 3.34Å; P223-L225 PolarHBondContact O-N 2.89Å; P223-Y226 PolarHBondContact O-N 2.84Å; P223-V227 WeakPolarHBondContact O-CB 3.34Å; P223-V227 WeakPolarHBondContact O-CG2 3.49Å; P223-V227 PolarHBondContact O-N 2.91Å
224	R	94.4	Very high	91.5	Very high	65 Å²	65	38.3 Å²	38.3	25%	0.245	19%	0.188	C	C	.	.	H	α-helix	trans	-57.9	-48.6	176.2	-176.6	173.2	65.8	-166.1	1.2	111.1	I215 I218 E220 L221 L222 E228	I215-R224 HydrophobicContact CG2-CG 4.48Å; I218-R224 HydrophobicContact CB-CB 4.01Å; I218-R224 HydrophobicContact CB-CG 4.42Å; I218-R224 HydrophobicContact CG2-CB 4.08Å; E220-R224 VanDerWaalsContact O-CB 3.25Å; E220-R224 WeakPolarHBondContact O-CB 3.4Å; E220-R224 PolarHBondContact O-N 2.89Å; L221-R224 PolarHBondContact O-N 2.86Å; L222-R224 VanDerWaalsContact C-N 3.31Å; L222-R224 PolarHBondContact O-N 2.87Å; R224-E228 WeakPolarHBondContact O-CB 3.49Å; R224-E228 PolarHBondContact O-N 3.37Å
225	L	94.2	Very high	91.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.3	-48.4	-178.3	-176	139	0	0	0	112.4	L221 L222 P223 A229 M253 I254 A266	L221-L225 WeakPolarHBondContact O-CB 3.3Å; L221-L225 PolarHBondContact O-N 3.27Å; L222-L225 PolarHBondContact O-N 3.26Å; P223-L225 VanDerWaalsContact C-N 3.34Å; P223-L225 PolarHBondContact O-N 2.89Å; L225-A229 WeakPolarHBondContact O-CB 3.33Å; L225-A229 PolarHBondContact O-N 3.49Å; L225-M253 HydrophobicContact CD1-CB 3.99Å; L225-I254 HydrophobicContact CD1-CD1 4.47Å; L225-I254 HydrophobicContact CD1-CG1 3.53Å; L225-I254 HydrophobicContact CD2-CG1 4.43Å; L225-A266 HydrophobicContact CD2-CB 4.27Å
226	Y	95	Very high	90.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.7	-43.7	-178.6	-85.9	-66.2	0	0	0	112.9	L150 F163 L170 L222 P223 A229 A230 A266 Y269	L150-Y226 HydrophobicContact CB-CE2 4.23Å; L150-Y226 HydrophobicContact CD1-CD1 4.35Å; L150-Y226 HydrophobicContact CD1-CD2 3.88Å; L150-Y226 HydrophobicContact CD1-CE1 4.03Å; L150-Y226 HydrophobicContact CD1-CE2 3.48Å; L150-Y226 VanDerWaalsContact CD1-CE2 3.48Å; L150-Y226 HydrophobicContact CD1-CG 4.3Å; F163-Y226 HydrophobicContact CE2-CE1 4.09Å; L170-Y226 HydrophobicContact CD1-CD1 3.67Å; L170-Y226 HydrophobicContact CD1-CG 3.94Å; L222-Y226 HydrophobicContact CD1-CD2 3.76Å; L222-Y226 HydrophobicContact CD1-CE2 3.39Å; L222-Y226 HydrophobicContact CD2-CE2 4.48Å; L222-Y226 HydrophobicContact CG-CD2 3.91Å; L222-Y226 HydrophobicContact CG-CE2 3.86Å; L222-Y226 WeakPolarHBondContact O-CD2 3.41Å; L222-Y226 PolarHBondContact O-N 2.97Å; L222-Y226 VanDerWaalsContact O-N 3.13Å; P223-Y226 PolarHBondContact O-N 2.84Å; Y226-A229 PolarHBondContact O-N 2.89Å; Y226-A230 WeakPolarHBondContact O-CB 3.42Å; Y226-A230 PolarHBondContact O-N 2.88Å; Y226-A266 VanDerWaalsContact OH-CA 3.31Å; Y226-A266 WeakPolarHBondContact OH-CA 3.35Å; Y226-A266 PolarHBondContact OH-N 3.44Å; Y226-Y269 AromaticContact CD1-CD1 3.58Å; Y226-Y269 HydrophobicContact CD1-CD1 3.58Å; Y226-Y269 HydrophobicContact CD1-CD2 4.42Å; Y226-Y269 AromaticContact CD1-CE1 3.92Å; Y226-Y269 HydrophobicContact CD1-CE1 3.92Å; Y226-Y269 AromaticContact CD1-CG 3.87Å; Y226-Y269 HydrophobicContact CD1-CG 3.87Å; Y226-Y269 AromaticContact CE1-CD1 3.87Å; Y226-Y269 HydrophobicContact CE1-CD1 3.87Å; Y226-Y269 HydrophobicContact CE1-CD2 4.33Å; Y226-Y269 AromaticContact CE1-CG 3.73Å; Y226-Y269 HydrophobicContact CE1-CG 3.73Å
227	V	94.3	Very high	90.5	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-69.1	-40.1	179.4	-178.9	0	0	0	0	110.8	L140 V143 I144 F173 I215 P223 A230 I231	L140-V227 HydrophobicContact CD1-CG1 4.05Å; V143-V227 HydrophobicContact CG1-CG2 3.82Å; I144-V227 HydrophobicContact CG1-CG2 4.41Å; F173-V227 HydrophobicContact CD1-CG1 4.49Å; F173-V227 HydrophobicContact CE1-CG1 3.89Å; I215-V227 HydrophobicContact CD1-CG1 3.78Å; I215-V227 HydrophobicContact CG1-CG1 3.75Å; I215-V227 HydrophobicContact CG2-CB 4.38Å; I215-V227 HydrophobicContact CG2-CG1 4.27Å; P223-V227 WeakPolarHBondContact O-CB 3.34Å; P223-V227 WeakPolarHBondContact O-CG2 3.49Å; P223-V227 PolarHBondContact O-N 2.91Å; V227-A230 PolarHBondContact O-N 3.45Å; V227-I231 PolarHBondContact O-N 2.93Å
228	E	93.6	Very high	90	Very high	10 Å²	10	32.7 Å²	32.7	5%	0.047	14%	0.142	C	C	.	.	H	α-helix	trans	-64.1	-42.8	174.6	-173.5	165.9	-159.8	0	0	111.7	I215 R224 I231 L232 R249 L250	I215-E228 HydrophobicContact CG2-CB 3.72Å; I215-E228 HydrophobicContact CG2-CG 4.45Å; R224-E228 WeakPolarHBondContact O-CB 3.49Å; R224-E228 PolarHBondContact O-N 3.37Å; E228-I231 WeakPolarHBondContact O-CG1 3.43Å; E228-I231 PolarHBondContact O-N 2.85Å; E228-L232 PolarHBondContact O-N 3.43Å; E228-R249 IonicContact OE1-CZ 2.7Å; E228-R249 IonicContact OE1-NH1 3.71Å; E228-R249 PolarHBondContact OE1-NH1 3.14Å; E228-R249 IonicContact OE1-NH2 3.18Å; E228-R249 PolarHBondContact OE1-NH2 2.94Å; E228-R249 IonicContact OE2-CZ 2.92Å; E228-R249 IonicContact OE2-NH1 3.98Å; E228-R249 PolarHBondContact OE2-NH1 3.44Å; E228-R249 VanDerWaalsContact OE2-NH1 3.09Å; E228-R249 IonicContact OE2-NH2 3.37Å; E228-L250 HydrophobicContact CB-CD2 4.39Å; E228-L250 HydrophobicContact CG-CD1 4.49Å; E228-L250 HydrophobicContact CG-CD2 4.1Å
229	A	92.5	Very high	89.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-40.4	174.2	0	0	0	0	0	111.7	L225 Y226 I231 L232 L250 Y269 L270 V273	L225-A229 WeakPolarHBondContact O-CB 3.33Å; L225-A229 PolarHBondContact O-N 3.49Å; Y226-A229 PolarHBondContact O-N 2.89Å; A229-I231 VanDerWaalsContact C-N 3.26Å; A229-I231 PolarHBondContact O-N 3.43Å; A229-L232 WeakPolarHBondContact O-CB 3.31Å; A229-L232 PolarHBondContact O-N 3.36Å; A229-L250 HydrophobicContact CB-CD1 4.43Å; A229-Y269 HydrophobicContact CB-CD1 3.96Å; A229-Y269 HydrophobicContact CB-CE1 3.67Å; A229-L270 HydrophobicContact CB-CD1 4.2Å; A229-V273 WeakPolarHBondContact O-CG1 3.22Å
230	A	92.8	Very high	88.2	Confident	12 Å²	12	29.7 Å²	29.7	10%	0.099	14%	0.139	C	C	.	.	H	α-helix	trans	-60.2	-32.8	178.9	0	0	0	0	0	113.7	L170 G174 Y226 V227 Y269	L170-A230 HydrophobicContact CB-CB 4.19Å; G174-A230 WeakPolarHBondContact CA-O 3.28Å; Y226-A230 WeakPolarHBondContact O-CB 3.42Å; Y226-A230 PolarHBondContact O-N 2.88Å; V227-A230 PolarHBondContact O-N 3.45Å; A230-Y269 WeakPolarHBondContact CB-OH 3.26Å
231	I	91.9	Very high	87.3	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	12.2	177.7	67.5	150.1	0	0	0	113.1	F173 V177 W211 F212 I215 V227 E228 A229 K233 C234	F173-I231 HydrophobicContact CD1-CG2 4.34Å; F173-I231 HydrophobicContact CE1-CG2 3.96Å; V177-I231 HydrophobicContact CB-CG2 4.19Å; V177-I231 HydrophobicContact CG1-CG2 4.15Å; V177-I231 HydrophobicContact CG2-CG2 4.24Å; W211-I231 HydrophobicContact CB-CD1 4.46Å; F212-I231 HydrophobicContact CD1-CD1 3.72Å; F212-I231 HydrophobicContact CD2-CD1 4.37Å; F212-I231 HydrophobicContact CE1-CD1 3.5Å; F212-I231 HydrophobicContact CE1-CG1 4Å; F212-I231 HydrophobicContact CE2-CD1 4.19Å; F212-I231 HydrophobicContact CG-CD1 4.15Å; F212-I231 HydrophobicContact CZ-CD1 3.75Å; F212-I231 HydrophobicContact CZ-CG1 4.3Å; I215-I231 HydrophobicContact CD1-CD1 3.21Å; I215-I231 HydrophobicContact CD1-CG1 3.71Å; I215-I231 HydrophobicContact CD1-CG2 4.37Å; V227-I231 PolarHBondContact O-N 2.93Å; E228-I231 WeakPolarHBondContact O-CG1 3.43Å; E228-I231 PolarHBondContact O-N 2.85Å; A229-I231 VanDerWaalsContact C-N 3.26Å; A229-I231 PolarHBondContact O-N 3.43Å; I231-K233 PolarHBondContact O-N 2.78Å; I231-K233 VanDerWaalsContact O-N 3.14Å; I231-C234 WeakPolarHBondContact O-CB 3.39Å; I231-C234 PolarHBondContact O-N 2.85Å
232	L	89.7	Confident	86.6	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-57.2	-34.3	-174.8	-173.5	70.3	0	0	0	112.4	E228 A229 C234 N235 T246 L247 L250 V273	E228-L232 PolarHBondContact O-N 3.43Å; A229-L232 WeakPolarHBondContact O-CB 3.31Å; A229-L232 PolarHBondContact O-N 3.36Å; L232-C234 PolarHBondContact O-N 3.43Å; L232-N235 WeakPolarHBondContact O-CB 3.1Å; L232-N235 PolarHBondContact O-N 3.33Å; L232-T246 HydrophobicContact CD1-CG2 3.59Å; L232-L247 HydrophobicContact CD2-CD1 4.21Å; L232-L250 HydrophobicContact CD1-CD1 4.29Å; L232-V273 HydrophobicContact CB-CG1 3.96Å; L232-V273 HydrophobicContact CD2-CG1 4.14Å
233	K	86.1	Confident	86.1	Confident	56 Å²	56	25.2 Å²	25.2	24%	0.243	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-57.2	-30.1	175.2	-163.6	178	-179.9	173.1	0	112.2	E38 Y178 I231 N235 R236 V277	E38-K233 IonicContact OE1-NZ 3.09Å; Y178-K233 HydrophobicContact CD2-CB 4.09Å; Y178-K233 HydrophobicContact CD2-CD 3.92Å; Y178-K233 HydrophobicContact CD2-CG 3.77Å; Y178-K233 HydrophobicContact CE2-CB 4.39Å; Y178-K233 HydrophobicContact CE2-CD 3.89Å; Y178-K233 HydrophobicContact CE2-CG 3.64Å; Y178-K233 HydrophobicContact CG-CD 4.35Å; I231-K233 PolarHBondContact O-N 2.78Å; I231-K233 VanDerWaalsContact O-N 3.14Å; K233-N235 PolarHBondContact O-N 3.19Å; K233-R236 WeakPolarHBondContact O-CB 3.39Å; K233-R236 PolarHBondContact O-N 3.44Å; K233-V277 HydrophobicContact CB-CG2 3.79Å; K233-V277 HydrophobicContact CG-CG2 4.17Å
234	C	87.8	Confident	85.5	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.007	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-68.2	-18.1	178.5	-58.1	0	0	0	0	113.3	I181 C208 F212 I231 L232 R236 F237	I181-C234 HydrophobicContact CD1-CB 4.16Å; C208-C234 PolarHBondContact SG-O 3Å; C208-C234 VanDerWaalsContact SG-O 3.35Å; F212-C234 HydrophobicContact CE2-CB 4.31Å; F212-C234 HydrophobicContact CZ-CB 4.39Å; I231-C234 WeakPolarHBondContact O-CB 3.39Å; I231-C234 PolarHBondContact O-N 2.85Å; L232-C234 PolarHBondContact O-N 3.43Å; C234-R236 PolarHBondContact O-N 3.27Å; C234-R236 VanDerWaalsContact O-N 3.11Å; C234-F237 HydrophobicContact CB-CD2 4.25Å; C234-F237 VanDerWaalsContact O-CD2 3.29Å; C234-F237 WeakPolarHBondContact O-CD2 3.46Å; C234-F237 PolarHBondContact O-N 3.36Å
235	N	85.3	Confident	85	Confident	10 Å²	10	33.2 Å²	33.2	5%	0.053	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-60	-22.9	174.1	-86.7	-44.3	0	0	0	113	F212 L232 K233 F237 L238 S239 I243	F212-N235 WeakPolarHBondContact CE2-OD1 3.43Å; F212-N235 HydrophobicContact CZ-CB 4.36Å; F212-N235 VanDerWaalsContact CZ-CG 3.45Å; F212-N235 WeakPolarHBondContact CZ-OD1 3.43Å; L232-N235 WeakPolarHBondContact O-CB 3.1Å; L232-N235 PolarHBondContact O-N 3.33Å; K233-N235 PolarHBondContact O-N 3.19Å; N235-F237 PolarHBondContact O-N 3.13Å; N235-L238 PolarHBondContact O-N 2.85Å; N235-S239 PolarHBondContact O-N 3.02Å; N235-S239 VanDerWaalsContact O-N 3.14Å; N235-I243 HydrophobicContact CB-CG1 3.72Å
236	R	82.1	Confident	84.7	Confident	84 Å²	84	33.9 Å²	33.9	32%	0.317	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-58.9	-26.6	175.1	-171.5	175.3	170.1	-173.9	-8.2	112.9	D193 F195 K233 C234	D193-R236 PolarHBondContact O-NH1 2.88Å; D193-R236 PolarHBondContact O-NH2 3.45Å; F195-R236 VanDerWaalsContact CD1-NH2 3.32Å; F195-R236 HydrophobicContact CE1-CG 4.24Å; F195-R236 VanDerWaalsContact CE1-NE 3.27Å; F195-R236 HydrophobicContact CE2-CG 4.27Å; F195-R236 HydrophobicContact CZ-CB 4.39Å; F195-R236 HydrophobicContact CZ-CG 3.72Å; F195-R236 PolarHBondContact O-NH2 3.15Å; K233-R236 WeakPolarHBondContact O-CB 3.39Å; K233-R236 PolarHBondContact O-N 3.44Å; C234-R236 PolarHBondContact O-N 3.27Å; C234-R236 VanDerWaalsContact O-N 3.11Å
237	F	82.6	Confident	84.3	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-77.4	-20.4	176.3	-60	-68.6	0	0	0	113.5	Y178 I181 W182 F195 V200 C234 N235	Y178-F237 AromaticContact CD2-CE2 3.57Å; Y178-F237 HydrophobicContact CD2-CE2 3.57Å; Y178-F237 HydrophobicContact CD2-CZ 4.02Å; Y178-F237 HydrophobicContact CE1-CZ 4.44Å; Y178-F237 AromaticContact CE2-CE2 3.46Å; Y178-F237 HydrophobicContact CE2-CE2 3.46Å; Y178-F237 VanDerWaalsContact CE2-CE2 3.46Å; Y178-F237 AromaticContact CE2-CZ 3.56Å; Y178-F237 HydrophobicContact CE2-CZ 3.56Å; Y178-F237 HydrophobicContact CG-CE2 4.36Å; Y178-F237 AromaticContact CZ-CZ 3.8Å; I181-F237 HydrophobicContact CB-CD2 4.2Å; I181-F237 HydrophobicContact CB-CE2 3.97Å; I181-F237 HydrophobicContact CB-CZ 4.38Å; I181-F237 HydrophobicContact CG2-CB 4.35Å; I181-F237 HydrophobicContact CG2-CD1 4.06Å; I181-F237 HydrophobicContact CG2-CD2 3.49Å; I181-F237 VanDerWaalsContact CG2-CD2 3.49Å; I181-F237 HydrophobicContact CG2-CE1 4.22Å; I181-F237 HydrophobicContact CG2-CE2 3.68Å; I181-F237 HydrophobicContact CG2-CG 3.71Å; I181-F237 HydrophobicContact CG2-CZ 4.04Å; W182-F237 HydrophobicContact CB-CZ 4.32Å; W182-F237 AromaticContact CE3-CE1 3.94Å; W182-F237 HydrophobicContact CE3-CE1 3.94Å; W182-F237 HydrophobicContact CE3-CZ 4.04Å; F195-F237 HydrophobicContact CE1-CE1 4.37Å; F195-F237 AromaticContact CE2-CD1 3.58Å; F195-F237 HydrophobicContact CE2-CD1 3.58Å; F195-F237 AromaticContact CE2-CE1 3.77Å; F195-F237 HydrophobicContact CE2-CE1 3.77Å; F195-F237 AromaticContact CZ-CD1 3.66Å; F195-F237 HydrophobicContact CZ-CD1 3.66Å; F195-F237 AromaticContact CZ-CE1 3.45Å; F195-F237 HydrophobicContact CZ-CE1 3.45Å; F195-F237 VanDerWaalsContact CZ-CE1 3.45Å; F195-F237 HydrophobicContact CZ-CZ 4.2Å; V200-F237 HydrophobicContact CG1-CB 4.21Å; V200-F237 HydrophobicContact CG1-CD1 4.27Å; V200-F237 HydrophobicContact CG2-CD1 4.05Å; C234-F237 HydrophobicContact CB-CD2 4.25Å; C234-F237 VanDerWaalsContact O-CD2 3.29Å; C234-F237 WeakPolarHBondContact O-CD2 3.46Å; C234-F237 PolarHBondContact O-N 3.36Å; N235-F237 PolarHBondContact O-N 3.13Å
238	L	81.5	Confident	83.9	Confident	37 Å²	37	36.7 Å²	36.7	19%	0.194	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.3	-43.4	-171.8	-63.7	-179.1	0	0	0	113.3	V197 K205 C208 L209 F212 N235	V197-L238 WeakPolarHBondContact CG1-O 3.34Å; K205-L238 HydrophobicContact CB-CD2 4.38Å; K205-L238 WeakPolarHBondContact O-CD2 3.44Å; C208-L238 HydrophobicContact CB-CD2 3.87Å; C208-L238 HydrophobicContact CB-CG 4.22Å; L209-L238 HydrophobicContact CD1-CD2 4.48Å; L209-L238 HydrophobicContact CD2-CD1 3.8Å; L209-L238 HydrophobicContact CD2-CD2 4.05Å; L209-L238 HydrophobicContact CG-CD1 4.23Å; L209-L238 HydrophobicContact CG-CD2 3.7Å; F212-L238 HydrophobicContact CD2-CD1 3.53Å; F212-L238 HydrophobicContact CE2-CD1 3.61Å; N235-L238 PolarHBondContact O-N 2.85Å
239	S	77.5	Confident	83.8	Confident	39 Å²	39	40.7 Å²	40.7	27%	0.273	20%	0.2	S	C	.	.			trans	-156.5	150.1	-176.9	57.2	0	0	0	0	112.5	N235 S241 G242	N235-S239 PolarHBondContact O-N 3.02Å; N235-S239 VanDerWaalsContact O-N 3.14Å; S239-S241 VanDerWaalsContact C-N 3.29Å; S239-S241 PolarHBondContact O-N 3.44Å; S239-G242 WeakPolarHBondContact OG-CA 3.34Å; S239-G242 PolarHBondContact OG-N 2.89Å
240	K	65.8	Low	83.7	Confident	141 Å²	141	40.7 Å²	40.7	61%	0.613	20%	0.2	S	C	*	.	S	Bend	trans	-69.6	-28.3	176.7	-66	179.4	-174.4	164.8	0	111.4	V197 E198	V197-K240 HydrophobicContact CG2-CG 3.79Å; E198-K240 IonicContact OE1-NZ 3.67Å; E198-K240 PolarHBondContact OE1-NZ 3.35Å
241	S	69.9	Low	83.6	Confident	46 Å²	46	40.4 Å²	40.4	32%	0.322	20%	0.197	S	C	.	.	S	Bend	trans	-106.2	-5	-179.2	58.6	0	0	0	0	114.9	S239 I243 Q244 E245	S239-S241 VanDerWaalsContact C-N 3.29Å; S239-S241 PolarHBondContact O-N 3.44Å; S241-I243 PolarHBondContact O-N 3.18Å; S241-I243 VanDerWaalsContact O-N 3.12Å; S241-Q244 WeakPolarHBondContact O-CA 3.26Å; S241-Q244 VanDerWaalsContact O-CB 3.25Å; S241-Q244 WeakPolarHBondContact O-CB 3.48Å; S241-Q244 PolarHBondContact O-N 2.93Å; S241-E245 PolarHBondContact O-N 3.25Å
242	G	76.4	Confident	83.4	Confident	5 Å²	5	42.3 Å²	42.3	5%	0.052	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-29.6	-172.1	0	0	0	0	0	114.4	S239 T246	S239-G242 WeakPolarHBondContact OG-CA 3.34Å; S239-G242 PolarHBondContact OG-N 2.89Å; G242-T246 WeakPolarHBondContact O-CB 3.42Å; G242-T246 PolarHBondContact O-N 3.43Å; G242-T246 PolarHBondContact O-OG1 2.9Å
243	I	80.6	Confident	83.4	Confident	22 Å²	22	44.6 Å²	44.6	11%	0.113	23%	0.225	C	C	.	.	H	α-helix	trans	-69.2	-37.1	173	-61.4	154.6	0	0	0	110.8	N235 S241 E245 L247 V277 A278 L281	N235-I243 HydrophobicContact CB-CG1 3.72Å; S241-I243 PolarHBondContact O-N 3.18Å; S241-I243 VanDerWaalsContact O-N 3.12Å; I243-E245 VanDerWaalsContact C-N 3.28Å; I243-E245 PolarHBondContact O-N 2.91Å; I243-L247 VanDerWaalsContact O-CB 3.22Å; I243-L247 WeakPolarHBondContact O-CB 3.21Å; I243-L247 PolarHBondContact O-N 3.3Å; I243-V277 HydrophobicContact CD1-CG1 3.46Å; I243-V277 VanDerWaalsContact CD1-CG1 3.46Å; I243-V277 HydrophobicContact CG1-CG1 4.03Å; I243-V277 HydrophobicContact CG2-CG1 4.19Å; I243-A278 HydrophobicContact CG2-CB 3.79Å; I243-L281 HydrophobicContact CG2-CD1 4.12Å
244	Q	81.5	Confident	83.6	Confident	96 Å²	96	42 Å²	42	45%	0.449	21%	0.213	S	C	.	.	H	α-helix	trans	-65.3	-31.3	178.4	-57.5	-174.5	-20.2	0	0	112.3	S241 P248 L281	S241-Q244 WeakPolarHBondContact O-CA 3.26Å; S241-Q244 VanDerWaalsContact O-CB 3.25Å; S241-Q244 WeakPolarHBondContact O-CB 3.48Å; S241-Q244 PolarHBondContact O-N 2.93Å; Q244-P248 WeakPolarHBondContact O-CD 3.19Å; Q244-P248 WeakPolarHBondContact O-CG 3.37Å; Q244-L281 HydrophobicContact CB-CD1 4.36Å; Q244-L281 HydrophobicContact CG-CD1 3.77Å; Q244-L281 HydrophobicContact CG-CD2 3.75Å; Q244-L281 HydrophobicContact CG-CG 4.4Å
245	E	84.3	Confident	83.5	Confident	137 Å²	137	49.4 Å²	49.4	64%	0.64	24%	0.241	S	C	*	.	H	α-helix	trans	-88.2	-39.6	177	-66.1	173.2	-160.6	0	0	112.4	S241 I243 R249	S241-E245 PolarHBondContact O-N 3.25Å; I243-E245 VanDerWaalsContact C-N 3.28Å; I243-E245 PolarHBondContact O-N 2.91Å; E245-R249 PolarHBondContact O-N 3.48Å
246	T	86.7	Confident	83.5	Confident	15 Å²	15	51.7 Å²	51.7	9%	0.092	27%	0.267	C	S	.	.	H	α-helix	trans	-70.7	-39.6	-176.3	-62.9	0	0	0	0	112.2	L232 G242 R249 L250	L232-T246 HydrophobicContact CD1-CG2 3.59Å; G242-T246 WeakPolarHBondContact O-CB 3.42Å; G242-T246 PolarHBondContact O-N 3.43Å; G242-T246 PolarHBondContact O-OG1 2.9Å; T246-R249 PolarHBondContact O-N 3.29Å; T246-L250 HydrophobicContact CG2-CD1 3.82Å; T246-L250 HydrophobicContact CG2-CG 4.06Å; T246-L250 WeakPolarHBondContact O-CG 3.46Å; T246-L250 PolarHBondContact O-N 3.48Å
247	L	86.9	Confident	83.8	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.016	26%	0.257	C	S	.	.	H	α-helix	trans	-66.2	-44.5	-175.3	-174.6	65.3	0	0	0	113.2	L232 I243 L250 T251 L270	L232-L247 HydrophobicContact CD2-CD1 4.21Å; I243-L247 VanDerWaalsContact O-CB 3.22Å; I243-L247 WeakPolarHBondContact O-CB 3.21Å; I243-L247 PolarHBondContact O-N 3.3Å; L247-L250 PolarHBondContact O-N 3.3Å; L247-T251 WeakPolarHBondContact O-CB 3.26Å; L247-T251 PolarHBondContact O-N 3.01Å; L247-T251 PolarHBondContact O-OG1 3.25Å; L247-L270 HydrophobicContact CD1-CD1 3.65Å; L247-L270 HydrophobicContact CD1-CD2 4.28Å; L247-L270 HydrophobicContact CD1-CG 3.79Å
248	P	87.3	Confident	83.8	Confident	56 Å²	56	52.1 Å²	52.1	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-39.7	169.8	-24.9	35.1	0	0	0	113.2	Q244 T251 A252	Q244-P248 WeakPolarHBondContact O-CD 3.19Å; Q244-P248 WeakPolarHBondContact O-CG 3.37Å; P248-T251 WeakPolarHBondContact O-CB 3.46Å; P248-T251 PolarHBondContact O-N 3.43Å; P248-A252 PolarHBondContact O-N 3.22Å
249	R	90.9	Very high	84.1	Confident	94 Å²	94	52.2 Å²	52.2	36%	0.355	29%	0.293	S	S	.	.	H	α-helix	trans	-61.1	-48.6	176.5	177.7	-179	58.2	86.9	-8.8	111.5	E228 E245 T246 T251 A252 M253	E228-R249 IonicContact OE1-CZ 2.7Å; E228-R249 IonicContact OE1-NH1 3.71Å; E228-R249 PolarHBondContact OE1-NH1 3.14Å; E228-R249 IonicContact OE1-NH2 3.18Å; E228-R249 PolarHBondContact OE1-NH2 2.94Å; E228-R249 IonicContact OE2-CZ 2.92Å; E228-R249 IonicContact OE2-NH1 3.98Å; E228-R249 PolarHBondContact OE2-NH1 3.44Å; E228-R249 VanDerWaalsContact OE2-NH1 3.09Å; E228-R249 IonicContact OE2-NH2 3.37Å; E245-R249 PolarHBondContact O-N 3.48Å; T246-R249 PolarHBondContact O-N 3.29Å; R249-T251 VanDerWaalsContact C-N 3.27Å; R249-T251 PolarHBondContact O-N 3.38Å; R249-A252 PolarHBondContact O-N 2.7Å; R249-M253 HydrophobicContact CG-CE 3.98Å; R249-M253 VanDerWaalsContact NH1-CE 3.27Å; R249-M253 WeakPolarHBondContact O-CG 3.39Å; R249-M253 PolarHBondContact O-N 2.91Å
250	L	90.6	Very high	84.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.8	-39	176.7	-71.8	176.9	0	0	0	111	E228 A229 L232 T246 L247 A252 M253 I254 L270	E228-L250 HydrophobicContact CB-CD2 4.39Å; E228-L250 HydrophobicContact CG-CD1 4.49Å; E228-L250 HydrophobicContact CG-CD2 4.1Å; A229-L250 HydrophobicContact CB-CD1 4.43Å; L232-L250 HydrophobicContact CD1-CD1 4.29Å; T246-L250 HydrophobicContact CG2-CD1 3.82Å; T246-L250 HydrophobicContact CG2-CG 4.06Å; T246-L250 WeakPolarHBondContact O-CG 3.46Å; T246-L250 PolarHBondContact O-N 3.48Å; L247-L250 PolarHBondContact O-N 3.3Å; L250-A252 PolarHBondContact O-N 3.39Å; L250-M253 HydrophobicContact CD2-SD 4.26Å; L250-M253 WeakPolarHBondContact O-CB 3.48Å; L250-M253 PolarHBondContact O-N 2.95Å; L250-I254 WeakPolarHBondContact O-CG1 3.49Å; L250-I254 PolarHBondContact O-N 3.26Å; L250-L270 HydrophobicContact CB-CD1 3.93Å; L250-L270 HydrophobicContact CB-CD2 3.84Å; L250-L270 HydrophobicContact CD1-CD1 3.84Å
251	T	89.4	Confident	85.9	Confident	5 Å²	5	44.5 Å²	44.5	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-60.8	-44	174.9	-60.9	0	0	0	0	111.8	L247 P248 R249 M253 I254 L270 N288	L247-T251 WeakPolarHBondContact O-CB 3.26Å; L247-T251 PolarHBondContact O-N 3.01Å; L247-T251 PolarHBondContact O-OG1 3.25Å; P248-T251 WeakPolarHBondContact O-CB 3.46Å; P248-T251 PolarHBondContact O-N 3.43Å; R249-T251 VanDerWaalsContact C-N 3.27Å; R249-T251 PolarHBondContact O-N 3.38Å; T251-M253 PolarHBondContact O-N 3.45Å; T251-I254 PolarHBondContact O-N 3.36Å; T251-L270 WeakPolarHBondContact OG1-CD2 3.44Å; T251-N288 HydrophobicContact CG2-CB 3.88Å
252	A	88.8	Confident	86.9	Confident	42 Å²	42	42.6 Å²	42.6	35%	0.347	24%	0.243	S	C	.	.	H	α-helix	trans	-66.5	-34.7	176.3	0	0	0	0	0	112.7	P248 R249 L250 I254 R255	P248-A252 PolarHBondContact O-N 3.22Å; R249-A252 PolarHBondContact O-N 2.7Å; L250-A252 PolarHBondContact O-N 3.39Å; A252-I254 VanDerWaalsContact C-N 3.26Å; A252-I254 PolarHBondContact O-N 2.88Å; A252-R255 VanDerWaalsContact O-CB 3.28Å; A252-R255 WeakPolarHBondContact O-CB 3.48Å; A252-R255 WeakPolarHBondContact O-CG 3.38Å; A252-R255 PolarHBondContact O-N 3.44Å
253	M	90	Very high	87.7	Confident	48 Å²	48	42.9 Å²	42.9	24%	0.236	24%	0.244	C	C	.	.	H	α-helix	trans	-62.4	-31.2	176.7	-75.2	-176.4	173.6	0	0	112.9	L221 L225 R249 L250 T251 R255 G256	L221-M253 HydrophobicContact CD1-CB 4.36Å; L225-M253 HydrophobicContact CD1-CB 3.99Å; R249-M253 HydrophobicContact CG-CE 3.98Å; R249-M253 VanDerWaalsContact NH1-CE 3.27Å; R249-M253 WeakPolarHBondContact O-CG 3.39Å; R249-M253 PolarHBondContact O-N 2.91Å; L250-M253 HydrophobicContact CD2-SD 4.26Å; L250-M253 WeakPolarHBondContact O-CB 3.48Å; L250-M253 PolarHBondContact O-N 2.95Å; T251-M253 PolarHBondContact O-N 3.45Å; M253-R255 PolarHBondContact O-N 3.35Å; M253-G256 PolarHBondContact O-N 3.04Å; M253-G256 VanDerWaalsContact O-N 3.13Å
254	I	90.6	Very high	88.3	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-63.1	-24.4	178	-60.9	169.6	0	0	0	111.9	L225 L250 T251 A252 G256 M257 A263 R267 L270	L225-I254 HydrophobicContact CD1-CD1 4.47Å; L225-I254 HydrophobicContact CD1-CG1 3.53Å; L225-I254 HydrophobicContact CD2-CG1 4.43Å; L250-I254 WeakPolarHBondContact O-CG1 3.49Å; L250-I254 PolarHBondContact O-N 3.26Å; T251-I254 PolarHBondContact O-N 3.36Å; A252-I254 VanDerWaalsContact C-N 3.26Å; A252-I254 PolarHBondContact O-N 2.88Å; I254-G256 PolarHBondContact O-N 3.11Å; I254-G256 VanDerWaalsContact O-N 3.1Å; I254-M257 HydrophobicContact CB-SD 4.4Å; I254-M257 HydrophobicContact CG2-SD 3.87Å; I254-M257 WeakPolarHBondContact O-CB 3.41Å; I254-M257 WeakPolarHBondContact O-CG 3.28Å; I254-M257 PolarHBondContact O-N 3.47Å; I254-A263 HydrophobicContact CG2-CB 4.26Å; I254-R267 HydrophobicContact CD1-CB 4.5Å; I254-R267 HydrophobicContact CD1-CG 3.83Å; I254-R267 HydrophobicContact CG2-CG 3.85Å; I254-L270 HydrophobicContact CD1-CB 4.34Å; I254-L270 HydrophobicContact CD1-CD2 3.77Å
255	R	85.9	Confident	88.9	Confident	156 Å²	156	37.2 Å²	37.2	59%	0.589	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-59.9	-22.3	176.1	-59.1	174.6	-175.1	172.1	-4.1	113.1	A252 M253 M257 D291	A252-R255 VanDerWaalsContact O-CB 3.28Å; A252-R255 WeakPolarHBondContact O-CB 3.48Å; A252-R255 WeakPolarHBondContact O-CG 3.38Å; A252-R255 PolarHBondContact O-N 3.44Å; M253-R255 PolarHBondContact O-N 3.35Å; R255-M257 VanDerWaalsContact C-N 3.27Å; R255-M257 PolarHBondContact O-N 2.85Å; R255-D291 IonicContact CZ-OD1 2.98Å; R255-D291 IonicContact CZ-OD2 2.81Å; R255-D291 IonicContact NE-OD1 3.71Å; R255-D291 PolarHBondContact NE-OD1 2.98Å; R255-D291 IonicContact NE-OD2 3.97Å; R255-D291 PolarHBondContact NE-OD2 3.43Å; R255-D291 VanDerWaalsContact NH2-CG 3.33Å; R255-D291 IonicContact NH2-OD1 3.63Å; R255-D291 PolarHBondContact NH2-OD1 3.06Å; R255-D291 IonicContact NH2-OD2 3.71Å; R255-D291 PolarHBondContact NH2-OD2 2.87Å
256	G	84.8	Confident	89.3	Confident	58 Å²	58	30.7 Å²	30.7	60%	0.598	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-79.9	-1.2	177.3	0	0	0	0	0	114.8	M253 I254	M253-G256 PolarHBondContact O-N 3.04Å; M253-G256 VanDerWaalsContact O-N 3.13Å; I254-G256 PolarHBondContact O-N 3.11Å; I254-G256 VanDerWaalsContact O-N 3.1Å
257	M	88.7	Confident	89.7	Confident	21 Å²	21	30 Å²	30	10%	0.103	18%	0.183	C	C	.	.			trans	-87.4	118.9	-179.1	-61.1	179.7	59.7	0	0	110.4	L221 L222 I254 R255 V262 A263 A266	L221-M257 HydrophobicContact CD2-CG 4.43Å; L222-M257 HydrophobicContact CD1-CE 3.26Å; L222-M257 HydrophobicContact CD1-SD 4.06Å; I254-M257 HydrophobicContact CB-SD 4.4Å; I254-M257 HydrophobicContact CG2-SD 3.87Å; I254-M257 WeakPolarHBondContact O-CB 3.41Å; I254-M257 WeakPolarHBondContact O-CG 3.28Å; I254-M257 PolarHBondContact O-N 3.47Å; R255-M257 VanDerWaalsContact C-N 3.27Å; R255-M257 PolarHBondContact O-N 2.85Å; M257-V262 HydrophobicContact CE-CB 3.98Å; M257-V262 HydrophobicContact CE-CG1 3.26Å; M257-A263 HydrophobicContact CB-CB 4Å; M257-A266 HydrophobicContact CE-CB 3.82Å; M257-A266 HydrophobicContact SD-CB 3.77Å
258	G	82.6	Confident	90	Very high	73 Å²	73	30 Å²	30	75%	0.753	18%	0.183	S	C	*	.			trans	-80.2	-25.1	-174	0	0	0	0	0	115.4
259	D	87.4	Confident	90.3	Very high	39 Å²	39	27.3 Å²	27.3	21%	0.209	17%	0.165	C	C	.	.			trans	-88.2	120.2	176.3	-174.5	-60.5	0	0	0	110	T153 L261 V262 A263	T153-D259 WeakPolarHBondContact CG2-OD2 3.38Å; T153-D259 PolarHBondContact OG1-OD2 2.94Å; D259-L261 VanDerWaalsContact C-N 3.31Å; D259-L261 PolarHBondContact O-N 3.09Å; D259-L261 WeakPolarHBondContact OD1-CA 3.4Å; D259-L261 WeakPolarHBondContact OD1-CB 3.32Å; D259-L261 PolarHBondContact OD1-N 2.97Å; D259-V262 HydrophobicContact CB-CB 4.09Å; D259-V262 HydrophobicContact CB-CG2 3.75Å; D259-V262 PolarHBondContact O-N 3.37Å; D259-V262 PolarHBondContact OD1-N 3.15Å; D259-V262 VanDerWaalsContact OD1-N 3.1Å; D259-A263 WeakPolarHBondContact O-CB 3.41Å; D259-A263 PolarHBondContact O-N 2.73Å
260	P	89.5	Confident	90.4	Very high	15 Å²	15	23 Å²	23	10%	0.097	15%	0.149	C	C	.	.	H	α-helix	trans	-66.7	-29.2	-175.2	24.4	-32.2	0	0	0	113.6	A264 Q298 I299 V304 Y322	P260-A264 WeakPolarHBondContact O-CB 3.36Å; P260-A264 PolarHBondContact O-N 3.26Å; P260-Q298 HydrophobicContact CB-CB 4.45Å; P260-I299 HydrophobicContact CB-CG1 4.13Å; P260-V304 HydrophobicContact CG-CG2 3.93Å; P260-Y322 WeakPolarHBondContact CB-OH 3.3Å; P260-Y322 WeakPolarHBondContact CG-OH 3.22Å
261	L	90.6	Very high	90.4	Very high	2 Å²	2	23 Å²	23	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-73.3	-47.7	179	-176.4	65.1	0	0	0	110.1	I156 Y159 D259 A263 A264 Y265 L321 Y322	I156-L261 HydrophobicContact CG2-CD2 3.86Å; Y159-L261 HydrophobicContact CD1-CD2 3.84Å; Y159-L261 HydrophobicContact CD1-CG 3.8Å; Y159-L261 HydrophobicContact CE1-CG 4.2Å; Y159-L261 HydrophobicContact CG-CD2 3.81Å; Y159-L261 HydrophobicContact CG-CG 4.27Å; D259-L261 VanDerWaalsContact C-N 3.31Å; D259-L261 PolarHBondContact O-N 3.09Å; D259-L261 WeakPolarHBondContact OD1-CA 3.4Å; D259-L261 WeakPolarHBondContact OD1-CB 3.32Å; D259-L261 PolarHBondContact OD1-N 2.97Å; L261-A263 VanDerWaalsContact C-N 3.28Å; L261-A263 PolarHBondContact O-N 2.97Å; L261-A264 PolarHBondContact O-N 3.25Å; L261-Y265 HydrophobicContact CD1-CD2 3.96Å; L261-Y265 HydrophobicContact CD1-CE2 3.76Å; L261-Y265 HydrophobicContact CG-CD2 4.31Å; L261-Y265 HydrophobicContact CG-CE2 4.47Å; L261-Y265 WeakPolarHBondContact O-CD2 3.41Å; L261-Y265 PolarHBondContact O-N 3.29Å; L261-Y265 VanDerWaalsContact O-N 3.11Å; L261-L321 HydrophobicContact CD1-CB 4.02Å; L261-L321 HydrophobicContact CD2-CD1 4.44Å; L261-Y322 HydrophobicContact CB-CE1 4.23Å; L261-Y322 HydrophobicContact CD1-CD1 4.11Å; L261-Y322 HydrophobicContact CD1-CD2 4.06Å; L261-Y322 HydrophobicContact CD1-CE1 3.95Å; L261-Y322 HydrophobicContact CD1-CE2 3.88Å; L261-Y322 HydrophobicContact CD1-CG 4.17Å; L261-Y322 PolarHBondContact N-OH 3.43Å; L261-Y322 VanDerWaalsContact N-OH 3.15Å
262	V	92.4	Very high	90.4	Very high	7 Å²	7	23.8 Å²	23.8	4%	0.042	15%	0.152	C	C	.	.	H	α-helix	trans	-60.2	-41.7	175.7	-173.6	0	0	0	0	110.2	T153 Y159 L222 M257 D259 Y265 A266	T153-V262 HydrophobicContact CG2-CG2 3.63Å; Y159-V262 HydrophobicContact CE2-CG2 3.98Å; Y159-V262 WeakPolarHBondContact OH-CA 3.47Å; Y159-V262 WeakPolarHBondContact OH-CG1 3.21Å; L222-V262 HydrophobicContact CD1-CG1 4.06Å; L222-V262 HydrophobicContact CD2-CG1 4.05Å; M257-V262 HydrophobicContact CE-CB 3.98Å; M257-V262 HydrophobicContact CE-CG1 3.26Å; D259-V262 HydrophobicContact CB-CB 4.09Å; D259-V262 HydrophobicContact CB-CG2 3.75Å; D259-V262 PolarHBondContact O-N 3.37Å; D259-V262 PolarHBondContact OD1-N 3.15Å; D259-V262 VanDerWaalsContact OD1-N 3.1Å; V262-Y265 PolarHBondContact O-N 3.14Å; V262-A266 WeakPolarHBondContact O-CB 3.44Å; V262-A266 PolarHBondContact O-N 2.94Å
263	A	92.1	Very high	90.4	Very high	10 Å²	10	22 Å²	22	8%	0.083	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-44	177.3	0	0	0	0	0	112.3	I254 M257 D259 L261 Y265 A266 R267	I254-A263 HydrophobicContact CG2-CB 4.26Å; M257-A263 HydrophobicContact CB-CB 4Å; D259-A263 WeakPolarHBondContact O-CB 3.41Å; D259-A263 PolarHBondContact O-N 2.73Å; L261-A263 VanDerWaalsContact C-N 3.28Å; L261-A263 PolarHBondContact O-N 2.97Å; A263-Y265 PolarHBondContact O-N 3.36Å; A263-A266 PolarHBondContact O-N 3.44Å; A263-R267 VanDerWaalsContact O-CG 3.31Å; A263-R267 WeakPolarHBondContact O-CG 3.32Å; A263-R267 PolarHBondContact O-N 3.02Å
264	A	92.9	Very high	90.3	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.8	-41.7	178.2	0	0	0	0	0	112.4	P260 L261 R267 A268 Y322 A325	P260-A264 WeakPolarHBondContact O-CB 3.36Å; P260-A264 PolarHBondContact O-N 3.26Å; L261-A264 PolarHBondContact O-N 3.25Å; A264-R267 WeakPolarHBondContact O-CB 2.93Å; A264-R267 PolarHBondContact O-N 3.28Å; A264-A268 PolarHBondContact O-N 3.48Å; A264-Y322 HydrophobicContact CB-CD1 3.76Å; A264-Y322 HydrophobicContact CB-CE1 3.94Å; A264-A325 HydrophobicContact CB-CB 4.43Å
265	Y	94.3	Very high	90.1	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-72.8	-35.7	177.9	-87.5	-82.2	0	0	0	113.2	Y159 P160 F163 L261 V262 A263 R267 A268 Y269 L321 A325	Y159-Y265 AromaticContact CD1-CD2 3.79Å; Y159-Y265 HydrophobicContact CD1-CD2 3.79Å; Y159-Y265 HydrophobicContact CD1-CE2 4.08Å; Y159-Y265 HydrophobicContact CD1-CG 4.3Å; Y159-Y265 AromaticContact CE1-CD2 3.63Å; Y159-Y265 HydrophobicContact CE1-CD2 3.63Å; Y159-Y265 HydrophobicContact CE1-CE2 4.38Å; Y159-Y265 AromaticContact CE1-CG 3.83Å; Y159-Y265 HydrophobicContact CE1-CG 3.83Å; P160-Y265 WeakPolarHBondContact CB-OH 3.44Å; P160-Y265 HydrophobicContact CG-CE2 4.42Å; P160-Y265 VanDerWaalsContact CG-OH 3.27Å; P160-Y265 WeakPolarHBondContact CG-OH 3.44Å; F163-Y265 HydrophobicContact CB-CD1 3.93Å; F163-Y265 HydrophobicContact CB-CE1 4.28Å; F163-Y265 AromaticContact CD1-CD1 3.41Å; F163-Y265 HydrophobicContact CD1-CD1 3.41Å; F163-Y265 VanDerWaalsContact CD1-CD1 3.41Å; F163-Y265 AromaticContact CD1-CE1 3.81Å; F163-Y265 HydrophobicContact CD1-CE1 3.81Å; F163-Y265 AromaticContact CD2-CD1 3.73Å; F163-Y265 HydrophobicContact CD2-CD1 3.73Å; F163-Y265 HydrophobicContact CD2-CG 4.1Å; F163-Y265 AromaticContact CE1-CD1 3.71Å; F163-Y265 HydrophobicContact CE1-CD1 3.71Å; F163-Y265 HydrophobicContact CE1-CE1 4.29Å; F163-Y265 AromaticContact CE2-CD1 3.99Å; F163-Y265 HydrophobicContact CE2-CD1 3.99Å; F163-Y265 HydrophobicContact CE2-CG 4.39Å; F163-Y265 VanDerWaalsContact CE2-O 3.3Å; F163-Y265 WeakPolarHBondContact CE2-O 3.34Å; F163-Y265 AromaticContact CG-CD1 3.4Å; F163-Y265 HydrophobicContact CG-CD1 3.4Å; F163-Y265 VanDerWaalsContact CG-CD1 3.4Å; F163-Y265 HydrophobicContact CG-CE1 4.05Å; F163-Y265 HydrophobicContact CG-CG 4.13Å; F163-Y265 AromaticContact CZ-CD1 3.96Å; F163-Y265 HydrophobicContact CZ-CD1 3.96Å; F163-Y265 WeakPolarHBondContact CZ-O 3.41Å; L261-Y265 HydrophobicContact CD1-CD2 3.96Å; L261-Y265 HydrophobicContact CD1-CE2 3.76Å; L261-Y265 HydrophobicContact CG-CD2 4.31Å; L261-Y265 HydrophobicContact CG-CE2 4.47Å; L261-Y265 WeakPolarHBondContact O-CD2 3.41Å; L261-Y265 PolarHBondContact O-N 3.29Å; L261-Y265 VanDerWaalsContact O-N 3.11Å; V262-Y265 PolarHBondContact O-N 3.14Å; A263-Y265 PolarHBondContact O-N 3.36Å; Y265-R267 VanDerWaalsContact C-N 3.3Å; Y265-R267 PolarHBondContact O-N 3.16Å; Y265-A268 PolarHBondContact O-N 3.46Å; Y265-Y269 PolarHBondContact O-N 3.42Å; Y265-L321 WeakPolarHBondContact CE2-O 3.35Å; Y265-L321 PolarHBondContact OH-O 3.21Å; Y265-A325 HydrophobicContact CD1-CB 4.04Å; Y265-A325 HydrophobicContact CD2-CB 4.09Å; Y265-A325 HydrophobicContact CE1-CB 4.02Å; Y265-A325 HydrophobicContact CE2-CB 4.03Å; Y265-A325 HydrophobicContact CG-CB 4.1Å
266	A	94.1	Very high	90	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62	-39.3	170.8	0	0	0	0	0	111.7	L225 Y226 M257 V262 A263 Y269 L270	L225-A266 HydrophobicContact CD2-CB 4.27Å; Y226-A266 VanDerWaalsContact OH-CA 3.31Å; Y226-A266 WeakPolarHBondContact OH-CA 3.35Å; Y226-A266 PolarHBondContact OH-N 3.44Å; M257-A266 HydrophobicContact CE-CB 3.82Å; M257-A266 HydrophobicContact SD-CB 3.77Å; V262-A266 WeakPolarHBondContact O-CB 3.44Å; V262-A266 PolarHBondContact O-N 2.94Å; A263-A266 PolarHBondContact O-N 3.44Å; A266-Y269 PolarHBondContact O-N 3.07Å; A266-L270 WeakPolarHBondContact O-CB 3.45Å; A266-L270 PolarHBondContact O-N 3.08Å
267	R	93.6	Very high	89.9	Confident	1 Å²	1	15.9 Å²	15.9	0%	0.004	10%	0.101	C	C	.	.	H	α-helix	trans	-62	-44.5	171.9	-72.9	179.6	-171.8	-70.5	-4.8	112	I254 A263 A264 Y265 L270 C271 N288 I329	I254-R267 HydrophobicContact CD1-CB 4.5Å; I254-R267 HydrophobicContact CD1-CG 3.83Å; I254-R267 HydrophobicContact CG2-CG 3.85Å; A263-R267 VanDerWaalsContact O-CG 3.31Å; A263-R267 WeakPolarHBondContact O-CG 3.32Å; A263-R267 PolarHBondContact O-N 3.02Å; A264-R267 WeakPolarHBondContact O-CB 2.93Å; A264-R267 PolarHBondContact O-N 3.28Å; Y265-R267 VanDerWaalsContact C-N 3.3Å; Y265-R267 PolarHBondContact O-N 3.16Å; R267-L270 PolarHBondContact O-N 2.96Å; R267-C271 PolarHBondContact O-N 2.66Å; R267-C271 PolarHBondContact O-SG 2.89Å; R267-N288 VanDerWaalsContact CB-OD1 3.27Å; R267-N288 WeakPolarHBondContact CB-OD1 3.39Å; R267-N288 WeakPolarHBondContact CD-OD1 3.24Å; R267-N288 VanDerWaalsContact CG-OD1 3.29Å; R267-N288 WeakPolarHBondContact CG-OD1 3.44Å; R267-N288 PolarHBondContact NH1-O 3.39Å; R267-I329 HydrophobicContact CB-CD1 3.7Å
268	A	93.3	Very high	89.6	Confident	1 Å²	1	15 Å²	15	1%	0.008	10%	0.097	C	C	.	.	H	α-helix	trans	-62.3	-43.4	177.9	0	0	0	0	0	111.9	A264 Y265 C271 R272 A325 I329	A264-A268 PolarHBondContact O-N 3.48Å; Y265-A268 PolarHBondContact O-N 3.46Å; A268-C271 PolarHBondContact O-N 3.16Å; A268-R272 WeakPolarHBondContact O-CB 3.32Å; A268-R272 PolarHBondContact O-N 3.46Å; A268-A325 HydrophobicContact CB-CB 3.9Å; A268-I329 HydrophobicContact CB-CD1 4.32Å; A268-I329 HydrophobicContact CB-CG1 4.14Å
269	Y	93.8	Very high	89.5	Confident	1 Å²	1	13 Å²	13	0%	0.004	7%	0.071	C	C	.	.	H	α-helix	trans	-60.3	-46.4	174.1	-172.8	-101	0	0	0	111.9	F163 T167 L170 D171 Y226 A229 A230 Y265 A266 C271 R272 V273	F163-Y269 HydrophobicContact CZ-CD2 4.34Å; T167-Y269 HydrophobicContact CG2-CD2 3.41Å; T167-Y269 VanDerWaalsContact CG2-CD2 3.41Å; T167-Y269 HydrophobicContact CG2-CE2 3.64Å; T167-Y269 HydrophobicContact CG2-CG 4.4Å; L170-Y269 HydrophobicContact CB-CE2 4.39Å; L170-Y269 VanDerWaalsContact CB-OH 3.29Å; L170-Y269 WeakPolarHBondContact CB-OH 3.25Å; L170-Y269 HydrophobicContact CD1-CE1 4.46Å; L170-Y269 HydrophobicContact CD1-CE2 4.07Å; D171-Y269 PolarHBondContact OD1-OH 3.25Å; Y226-Y269 AromaticContact CD1-CD1 3.58Å; Y226-Y269 HydrophobicContact CD1-CD1 3.58Å; Y226-Y269 HydrophobicContact CD1-CD2 4.42Å; Y226-Y269 AromaticContact CD1-CE1 3.92Å; Y226-Y269 HydrophobicContact CD1-CE1 3.92Å; Y226-Y269 AromaticContact CD1-CG 3.87Å; Y226-Y269 HydrophobicContact CD1-CG 3.87Å; Y226-Y269 AromaticContact CE1-CD1 3.87Å; Y226-Y269 HydrophobicContact CE1-CD1 3.87Å; Y226-Y269 HydrophobicContact CE1-CD2 4.33Å; Y226-Y269 AromaticContact CE1-CG 3.73Å; Y226-Y269 HydrophobicContact CE1-CG 3.73Å; A229-Y269 HydrophobicContact CB-CD1 3.96Å; A229-Y269 HydrophobicContact CB-CE1 3.67Å; A230-Y269 WeakPolarHBondContact CB-OH 3.26Å; Y265-Y269 PolarHBondContact O-N 3.42Å; A266-Y269 PolarHBondContact O-N 3.07Å; Y269-C271 VanDerWaalsContact C-N 3.34Å; Y269-C271 PolarHBondContact O-N 2.9Å; Y269-R272 WeakPolarHBondContact O-CB 3.48Å; Y269-R272 PolarHBondContact O-N 3.5Å; Y269-R272 VanDerWaalsContact O-N 3.16Å; Y269-V273 HydrophobicContact CD1-CG2 4.26Å; Y269-V273 HydrophobicContact CE1-CG2 3.86Å; Y269-V273 HydrophobicContact CE2-CG2 4.46Å; Y269-V273 PolarHBondContact O-N 3.46Å
270	L	92.4	Very high	89.1	Confident	2 Å²	2	17.4 Å²	17.4	1%	0.01	9%	0.09	C	C	.	.	H	α-helix	trans	-63.6	-39.7	178.8	-172	63	0	0	0	112	A229 L247 L250 T251 I254 A266 R267 R272 G274	A229-L270 HydrophobicContact CB-CD1 4.2Å; L247-L270 HydrophobicContact CD1-CD1 3.65Å; L247-L270 HydrophobicContact CD1-CD2 4.28Å; L247-L270 HydrophobicContact CD1-CG 3.79Å; L250-L270 HydrophobicContact CB-CD1 3.93Å; L250-L270 HydrophobicContact CB-CD2 3.84Å; L250-L270 HydrophobicContact CD1-CD1 3.84Å; T251-L270 WeakPolarHBondContact OG1-CD2 3.44Å; I254-L270 HydrophobicContact CD1-CB 4.34Å; I254-L270 HydrophobicContact CD1-CD2 3.77Å; A266-L270 WeakPolarHBondContact O-CB 3.45Å; A266-L270 PolarHBondContact O-N 3.08Å; R267-L270 PolarHBondContact O-N 2.96Å; L270-R272 VanDerWaalsContact C-N 3.34Å; L270-G274 WeakPolarHBondContact O-CA 3.47Å; L270-G274 PolarHBondContact O-N 3.5Å
271	C	91.3	Very high	88.7	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-65	-38.8	173.9	-67.4	0	0	0	0	111.7	R267 A268 Y269 G274 M275 L285 C332	R267-C271 PolarHBondContact O-N 2.66Å; R267-C271 PolarHBondContact O-SG 2.89Å; A268-C271 PolarHBondContact O-N 3.16Å; Y269-C271 VanDerWaalsContact C-N 3.34Å; Y269-C271 PolarHBondContact O-N 2.9Å; C271-G274 PolarHBondContact O-N 3.26Å; C271-M275 WeakPolarHBondContact O-CB 3.45Å; C271-M275 VanDerWaalsContact O-CG 3.32Å; C271-M275 WeakPolarHBondContact O-CG 3.47Å; C271-M275 PolarHBondContact O-N 2.73Å; C271-L285 HydrophobicContact CB-CD2 4.06Å; C271-C332 HydrophobicContact CB-CB 4.3Å
272	R	90.1	Very high	88.1	Confident	22 Å²	22	20.1 Å²	20.1	8%	0.083	10%	0.101	C	C	.	.	H	α-helix	trans	-60.3	-55	176.3	-171.5	174.9	66.6	84.1	-12.1	111.4	W48 D171 A268 Y269 L270 G274 M275 E276 W328	W48-R272 HydrophobicContact CB-CG 4.49Å; D171-R272 IonicContact OD1-CZ 3.41Å; D171-R272 IonicContact OD1-NH1 3.25Å; D171-R272 PolarHBondContact OD1-NH1 3.29Å; D171-R272 IonicContact OD1-NH2 2.78Å; D171-R272 PolarHBondContact OD1-NH2 3.38Å; D171-R272 IonicContact OD2-CZ 3.34Å; D171-R272 IonicContact OD2-NH1 3.6Å; D171-R272 PolarHBondContact OD2-NH1 3.44Å; D171-R272 IonicContact OD2-NH2 3.28Å; D171-R272 PolarHBondContact OD2-NH2 2.92Å; A268-R272 WeakPolarHBondContact O-CB 3.32Å; A268-R272 PolarHBondContact O-N 3.46Å; Y269-R272 WeakPolarHBondContact O-CB 3.48Å; Y269-R272 PolarHBondContact O-N 3.5Å; Y269-R272 VanDerWaalsContact O-N 3.16Å; L270-R272 VanDerWaalsContact C-N 3.34Å; R272-G274 VanDerWaalsContact C-N 3.33Å; R272-G274 PolarHBondContact O-N 2.84Å; R272-M275 PolarHBondContact O-N 2.93Å; R272-E276 PolarHBondContact O-N 3.12Å; R272-W328 HydrophobicContact CB-CZ2 4.33Å; R272-W328 HydrophobicContact CG-CZ2 3.93Å
273	V	88.6	Confident	87.6	Confident	6 Å²	6	27.7 Å²	27.7	4%	0.036	14%	0.136	C	C	.	.	H	α-helix	trans	-67.2	-37.2	179.4	-175.6	0	0	0	0	111	A229 L232 Y269 M275 E276 V277	A229-V273 WeakPolarHBondContact O-CG1 3.22Å; L232-V273 HydrophobicContact CB-CG1 3.96Å; L232-V273 HydrophobicContact CD2-CG1 4.14Å; Y269-V273 HydrophobicContact CD1-CG2 4.26Å; Y269-V273 HydrophobicContact CE1-CG2 3.86Å; Y269-V273 HydrophobicContact CE2-CG2 4.46Å; Y269-V273 PolarHBondContact O-N 3.46Å; V273-M275 VanDerWaalsContact C-N 3.34Å; V273-M275 PolarHBondContact O-N 3.32Å; V273-E276 PolarHBondContact O-N 3.23Å; V273-V277 HydrophobicContact CG1-CG2 4.02Å; V273-V277 WeakPolarHBondContact O-CB 3.32Å; V273-V277 WeakPolarHBondContact O-CG2 3.44Å; V273-V277 PolarHBondContact O-N 3.01Å
274	G	87.3	Confident	87	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.01	14%	0.136	C	C	.	.	H	α-helix	trans	-60.5	-40.8	176.2	0	0	0	0	0	113	L270 C271 R272 A278	L270-G274 WeakPolarHBondContact O-CA 3.47Å; L270-G274 PolarHBondContact O-N 3.5Å; C271-G274 PolarHBondContact O-N 3.26Å; R272-G274 VanDerWaalsContact C-N 3.33Å; R272-G274 PolarHBondContact O-N 2.84Å; G274-A278 CarbonylContact O-C 3.41Å; G274-A278 VanDerWaalsContact O-C 3.26Å; G274-A278 WeakPolarHBondContact O-CA 3Å; G274-A278 PolarHBondContact O-N 3.13Å
275	M	86.1	Confident	86.5	Confident	1 Å²	1	28 Å²	28	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-70.1	-33.2	176.2	-77.8	-58.6	-67.7	0	0	113.4	L41 F45 C271 R272 V273 P279 L285 C332 Y335	L41-M275 HydrophobicContact CD2-CE 3.57Å; F45-M275 HydrophobicContact CE2-CE 4.39Å; C271-M275 WeakPolarHBondContact O-CB 3.45Å; C271-M275 VanDerWaalsContact O-CG 3.32Å; C271-M275 WeakPolarHBondContact O-CG 3.47Å; C271-M275 PolarHBondContact O-N 2.73Å; R272-M275 PolarHBondContact O-N 2.93Å; V273-M275 VanDerWaalsContact C-N 3.34Å; V273-M275 PolarHBondContact O-N 3.32Å; M275-P279 HydrophobicContact CE-CB 4.08Å; M275-P279 WeakPolarHBondContact O-CD 3.38Å; M275-P279 HydrophobicContact SD-CB 4.43Å; M275-L285 HydrophobicContact CG-CD1 4.17Å; M275-L285 HydrophobicContact SD-CD1 3.41Å; M275-L285 WeakPolarHBondContact SD-CD1 3.44Å; M275-C332 HydrophobicContact CG-CB 3.67Å; M275-C332 HydrophobicContact SD-CB 4.26Å; M275-Y335 HydrophobicContact CE-CD1 3.77Å; M275-Y335 HydrophobicContact CE-CE1 4.42Å
276	E	84.7	Confident	86	Confident	100 Å²	100	29.1 Å²	29.1	47%	0.467	14%	0.143	S	C	.	.	H	α-helix	trans	-68.7	-42.4	174.8	-173.3	-174.7	157.9	0	0	111.6	R272 V273	R272-E276 PolarHBondContact O-N 3.12Å; V273-E276 PolarHBondContact O-N 3.23Å
277	V	82.9	Confident	85.6	Confident	31 Å²	31	31.1 Å²	31.1	19%	0.188	16%	0.159	C	C	.	.	H	α-helix	trans	-89.9	-37.7	-171.4	178.2	0	0	0	0	112.7	K233 I243 V273	K233-V277 HydrophobicContact CB-CG2 3.79Å; K233-V277 HydrophobicContact CG-CG2 4.17Å; I243-V277 HydrophobicContact CD1-CG1 3.46Å; I243-V277 VanDerWaalsContact CD1-CG1 3.46Å; I243-V277 HydrophobicContact CG1-CG1 4.03Å; I243-V277 HydrophobicContact CG2-CG1 4.19Å; V273-V277 HydrophobicContact CG1-CG2 4.02Å; V273-V277 WeakPolarHBondContact O-CB 3.32Å; V273-V277 WeakPolarHBondContact O-CG2 3.44Å; V273-V277 PolarHBondContact O-N 3.01Å
278	A	80.9	Confident	85.4	Confident	4 Å²	4	31.1 Å²	31.1	3%	0.033	16%	0.16	C	C	.	.			trans	-149.7	71.1	-174.2	0	0	0	0	0	112.8	I243 G274 H280 L281	I243-A278 HydrophobicContact CG2-CB 3.79Å; G274-A278 CarbonylContact O-C 3.41Å; G274-A278 VanDerWaalsContact O-C 3.26Å; G274-A278 WeakPolarHBondContact O-CA 3Å; G274-A278 PolarHBondContact O-N 3.13Å; A278-H280 PolarHBondContact O-N 2.96Å; A278-H280 VanDerWaalsContact O-N 3.09Å; A278-L281 HydrophobicContact CB-CB 4.48Å; A278-L281 HydrophobicContact CB-CD1 3.59Å; A278-L281 HydrophobicContact CB-CG 3.96Å; A278-L281 PolarHBondContact O-N 3.22Å; A278-L281 VanDerWaalsContact O-N 3.14Å
279	P	80.6	Confident	85.1	Confident	30 Å²	30	31.1 Å²	31.1	20%	0.195	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-16.1	-176.5	25.2	-34.2	0	0	0	114.6	A40 L41 M275	A40-P279 HydrophobicContact CB-CG 4.16Å; L41-P279 HydrophobicContact CD2-CB 3.97Å; M275-P279 HydrophobicContact CE-CB 4.08Å; M275-P279 WeakPolarHBondContact O-CD 3.38Å; M275-P279 HydrophobicContact SD-CB 4.43Å
280	H	79.2	Confident	84.8	Confident	132 Å²	132	33.2 Å²	33.2	61%	0.611	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-18.7	177.8	60.9	-84.3	0	0	0	113.3	A278 K282	A278-H280 PolarHBondContact O-N 2.96Å; A278-H280 VanDerWaalsContact O-N 3.09Å; H280-K282 PolarHBondContact O-N 3.42Å
281	L	80.7	Confident	84.5	Confident	25 Å²	25	34.2 Å²	34.2	13%	0.131	17%	0.174	C	C	.	.			trans	-83.1	61.9	-177.4	-61.8	177.6	0	0	0	112.4	I243 Q244 A278 E283 S284	I243-L281 HydrophobicContact CG2-CD1 4.12Å; Q244-L281 HydrophobicContact CB-CD1 4.36Å; Q244-L281 HydrophobicContact CG-CD1 3.77Å; Q244-L281 HydrophobicContact CG-CD2 3.75Å; Q244-L281 HydrophobicContact CG-CG 4.4Å; A278-L281 HydrophobicContact CB-CB 4.48Å; A278-L281 HydrophobicContact CB-CD1 3.59Å; A278-L281 HydrophobicContact CB-CG 3.96Å; A278-L281 PolarHBondContact O-N 3.22Å; A278-L281 VanDerWaalsContact O-N 3.14Å; L281-E283 VanDerWaalsContact C-N 3.3Å; L281-E283 PolarHBondContact O-N 2.89Å; L281-S284 PolarHBondContact O-N 3.17Å
282	K	79.3	Confident	84.3	Confident	49 Å²	49	34.5 Å²	34.5	21%	0.213	18%	0.175	C	C	.	.	H	α-helix	trans	-64.4	-30.7	-177.6	-68	-62.6	-168.7	163.3	0	113.7	H280 S284 L285 N286 C332 V333 Y335	H280-K282 PolarHBondContact O-N 3.42Å; K282-S284 VanDerWaalsContact C-N 3.32Å; K282-S284 PolarHBondContact O-N 3.32Å; K282-L285 HydrophobicContact CD-CD1 4.16Å; K282-L285 PolarHBondContact O-N 3.05Å; K282-N286 VanDerWaalsContact O-CG 3.23Å; K282-N286 PolarHBondContact O-N 3.38Å; K282-N286 PolarHBondContact O-ND2 3.33Å; K282-N286 PolarHBondContact O-OD1 3.28Å; K282-C332 PolarHBondContact NZ-O 3.08Å; K282-V333 PolarHBondContact NZ-O 3.3Å; K282-Y335 WeakPolarHBondContact CE-O 3.29Å; K282-Y335 PolarHBondContact NZ-O 3.13Å
283	E	80.7	Confident	84.1	Confident	166 Å²	166	34 Å²	34	78%	0.776	17%	0.174	S	C	*	.	H	α-helix	trans	-60.2	-40.7	178.9	-65.6	-179	178.5	0	0	112.5	L281 L285 N286 A287	L281-E283 VanDerWaalsContact C-N 3.3Å; L281-E283 PolarHBondContact O-N 2.89Å; E283-L285 VanDerWaalsContact C-N 3.34Å; E283-L285 PolarHBondContact O-N 2.98Å; E283-N286 PolarHBondContact O-N 2.92Å; E283-A287 PolarHBondContact O-N 2.99Å
284	S	79.6	Confident	84	Confident	13 Å²	13	39.2 Å²	39.2	9%	0.091	21%	0.207	C	C	.	.	H	α-helix	trans	-65.4	-36.9	176.9	-57.5	0	0	0	0	112.3	L281 K282 N288	L281-S284 PolarHBondContact O-N 3.17Å; K282-S284 VanDerWaalsContact C-N 3.32Å; K282-S284 PolarHBondContact O-N 3.32Å; S284-N288 PolarHBondContact O-N 3.5Å; S284-N288 VanDerWaalsContact O-N 3.1Å
285	L	82.9	Confident	83.8	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.021	22%	0.216	C	C	.	.	H	α-helix	trans	-70.9	-38.9	175.5	-61.2	173.2	0	0	0	111.4	C271 M275 K282 E283 N288 I289 C332 V333	C271-L285 HydrophobicContact CB-CD2 4.06Å; M275-L285 HydrophobicContact CG-CD1 4.17Å; M275-L285 HydrophobicContact SD-CD1 3.41Å; M275-L285 WeakPolarHBondContact SD-CD1 3.44Å; K282-L285 HydrophobicContact CD-CD1 4.16Å; K282-L285 PolarHBondContact O-N 3.05Å; E283-L285 VanDerWaalsContact C-N 3.34Å; E283-L285 PolarHBondContact O-N 2.98Å; L285-N288 WeakPolarHBondContact O-CB 3.48Å; L285-N288 PolarHBondContact O-N 2.69Å; L285-I289 PolarHBondContact O-N 2.89Å; L285-I289 VanDerWaalsContact O-N 3.13Å; L285-C332 HydrophobicContact CD1-CB 4.48Å; L285-V333 HydrophobicContact CB-CG2 4.05Å
286	N	84.3	Confident	83.8	Confident	23 Å²	23	41.2 Å²	41.2	12%	0.123	22%	0.218	C	C	.	.	H	α-helix	trans	-62.4	-44.3	174.2	-68.4	-15.7	0	0	0	111.1	K282 E283 N288 I289 F290 M345	K282-N286 VanDerWaalsContact O-CG 3.23Å; K282-N286 PolarHBondContact O-N 3.38Å; K282-N286 PolarHBondContact O-ND2 3.33Å; K282-N286 PolarHBondContact O-OD1 3.28Å; E283-N286 PolarHBondContact O-N 2.92Å; N286-N288 VanDerWaalsContact C-N 3.26Å; N286-N288 PolarHBondContact O-N 3.49Å; N286-I289 WeakPolarHBondContact O-CG2 3.49Å; N286-I289 PolarHBondContact O-N 3.31Å; N286-F290 HydrophobicContact CB-CD2 4.5Å; N286-F290 HydrophobicContact CB-CE2 4.05Å; N286-F290 WeakPolarHBondContact O-CD2 3.22Å; N286-F290 WeakPolarHBondContact O-CG 3.41Å; N286-F290 PolarHBondContact O-N 2.92Å; N286-M345 VanDerWaalsContact OD1-CE 3.28Å; N286-M345 WeakPolarHBondContact OD1-CE 3.33Å
287	A	85.3	Confident	83.7	Confident	41 Å²	41	45.5 Å²	45.5	34%	0.339	23%	0.23	S	C	.	.	H	α-helix	trans	-59.8	-38.3	173.9	0	0	0	0	0	111.8	E283 F290 D291	E283-A287 PolarHBondContact O-N 2.99Å; A287-F290 PolarHBondContact O-N 3.46Å; A287-D291 WeakPolarHBondContact O-CB 3.4Å; A287-D291 PolarHBondContact O-N 3.04Å
288	N	88.5	Confident	83.8	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.011	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-45.9	178.9	-166.1	-65.4	0	0	0	112.7	T251 R267 S284 L285 N286 L292	T251-N288 HydrophobicContact CG2-CB 3.88Å; R267-N288 VanDerWaalsContact CB-OD1 3.27Å; R267-N288 WeakPolarHBondContact CB-OD1 3.39Å; R267-N288 WeakPolarHBondContact CD-OD1 3.24Å; R267-N288 VanDerWaalsContact CG-OD1 3.29Å; R267-N288 WeakPolarHBondContact CG-OD1 3.44Å; R267-N288 PolarHBondContact NH1-O 3.39Å; S284-N288 PolarHBondContact O-N 3.5Å; S284-N288 VanDerWaalsContact O-N 3.1Å; L285-N288 WeakPolarHBondContact O-CB 3.48Å; L285-N288 PolarHBondContact O-N 2.69Å; N286-N288 VanDerWaalsContact C-N 3.26Å; N286-N288 PolarHBondContact O-N 3.49Å; N288-L292 PolarHBondContact O-N 3.26Å; N288-L292 VanDerWaalsContact O-N 3.07Å
289	I	87.4	Confident	84	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-69.9	-39.1	177.3	-175	63.5	0	0	0	111.7	L285 N286 D291 L292 L293 I329 L330 V333 M345	L285-I289 PolarHBondContact O-N 2.89Å; L285-I289 VanDerWaalsContact O-N 3.13Å; N286-I289 WeakPolarHBondContact O-CG2 3.49Å; N286-I289 PolarHBondContact O-N 3.31Å; I289-D291 VanDerWaalsContact C-N 3.33Å; I289-D291 PolarHBondContact O-N 3.45Å; I289-L292 HydrophobicContact CD1-CB 4.45Å; I289-L292 HydrophobicContact CD1-CD2 3.89Å; I289-L292 WeakPolarHBondContact O-CB 3.45Å; I289-L292 PolarHBondContact O-N 3.4Å; I289-L292 VanDerWaalsContact O-N 3.13Å; I289-L293 WeakPolarHBondContact O-CG 3.27Å; I289-L293 PolarHBondContact O-N 2.89Å; I289-I329 HydrophobicContact CB-CG2 4.22Å; I289-I329 HydrophobicContact CD1-CG2 4Å; I289-L330 HydrophobicContact CD1-CD2 3.87Å; I289-L330 HydrophobicContact CD1-CG 4.49Å; I289-L330 HydrophobicContact CG1-CD2 4.04Å; I289-V333 HydrophobicContact CG2-CG2 4.24Å; I289-M345 HydrophobicContact CG2-CE 4.31Å
290	F	87.1	Confident	84	Confident	45 Å²	45	49.7 Å²	49.7	20%	0.197	25%	0.25	C	C	.	.	H	α-helix	trans	-64.8	-38	177	-63.8	-33.2	0	0	0	112.5	N286 A287 L293 T294 R348	N286-F290 HydrophobicContact CB-CD2 4.5Å; N286-F290 HydrophobicContact CB-CE2 4.05Å; N286-F290 WeakPolarHBondContact O-CD2 3.22Å; N286-F290 WeakPolarHBondContact O-CG 3.41Å; N286-F290 PolarHBondContact O-N 2.92Å; A287-F290 PolarHBondContact O-N 3.46Å; F290-L293 HydrophobicContact CD1-CD1 4.44Å; F290-L293 PolarHBondContact O-N 3.37Å; F290-T294 PolarHBondContact O-N 3.44Å; F290-T294 PolarHBondContact O-OG1 3.1Å; F290-R348 VanDerWaalsContact CD1-NH1 3.33Å; F290-R348 VanDerWaalsContact CE1-NH1 3.29Å
291	D	86.3	Confident	84.1	Confident	22 Å²	22	44.6 Å²	44.6	12%	0.118	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-43.3	170.9	-81.9	-0.8	0	0	0	111.4	R255 A287 I289 L293 T294 T295	R255-D291 IonicContact CZ-OD1 2.98Å; R255-D291 IonicContact CZ-OD2 2.81Å; R255-D291 IonicContact NE-OD1 3.71Å; R255-D291 PolarHBondContact NE-OD1 2.98Å; R255-D291 IonicContact NE-OD2 3.97Å; R255-D291 PolarHBondContact NE-OD2 3.43Å; R255-D291 VanDerWaalsContact NH2-CG 3.33Å; R255-D291 IonicContact NH2-OD1 3.63Å; R255-D291 PolarHBondContact NH2-OD1 3.06Å; R255-D291 IonicContact NH2-OD2 3.71Å; R255-D291 PolarHBondContact NH2-OD2 2.87Å; A287-D291 WeakPolarHBondContact O-CB 3.4Å; A287-D291 PolarHBondContact O-N 3.04Å; I289-D291 VanDerWaalsContact C-N 3.33Å; I289-D291 PolarHBondContact O-N 3.45Å; D291-L293 PolarHBondContact O-N 3.45Å; D291-T294 WeakPolarHBondContact O-CB 3.27Å; D291-T294 PolarHBondContact O-N 2.92Å; D291-T295 PolarHBondContact O-N 3.45Å; D291-T295 VanDerWaalsContact O-N 3.11Å; D291-T295 PolarHBondContact O-OG1 3.38Å; D291-T295 VanDerWaalsContact O-OG1 3.12Å
292	L	87.7	Confident	84.1	Confident	6 Å²	6	49.4 Å²	49.4	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-58.4	-47.1	176	178.7	67	0	0	0	111.3	N288 I289 T294 T295 F296 I326 I329	N288-L292 PolarHBondContact O-N 3.26Å; N288-L292 VanDerWaalsContact O-N 3.07Å; I289-L292 HydrophobicContact CD1-CB 4.45Å; I289-L292 HydrophobicContact CD1-CD2 3.89Å; I289-L292 WeakPolarHBondContact O-CB 3.45Å; I289-L292 PolarHBondContact O-N 3.4Å; I289-L292 VanDerWaalsContact O-N 3.13Å; L292-T294 VanDerWaalsContact C-N 3.3Å; L292-T294 PolarHBondContact O-N 3.41Å; L292-T295 CarbonylContact O-C 3.56Å; L292-T295 PolarHBondContact O-N 2.94Å; L292-T295 PolarHBondContact O-OG1 3.47Å; L292-T295 VanDerWaalsContact O-OG1 3.04Å; L292-F296 PolarHBondContact O-N 3.07Å; L292-I326 HydrophobicContact CD2-CG1 4.22Å; L292-I329 HydrophobicContact CD2-CD1 4.21Å
293	L	86.8	Confident	84.1	Confident	12 Å²	12	51.5 Å²	51.5	6%	0.063	28%	0.28	C	S	.	.	H	α-helix	trans	-61.3	-38.8	178.3	-67.3	179.1	0	0	0	111.7	I289 F290 D291 T295 F296 R348 M352 L358	I289-L293 WeakPolarHBondContact O-CG 3.27Å; I289-L293 PolarHBondContact O-N 2.89Å; F290-L293 HydrophobicContact CD1-CD1 4.44Å; F290-L293 PolarHBondContact O-N 3.37Å; D291-L293 PolarHBondContact O-N 3.45Å; L293-T295 VanDerWaalsContact C-N 3.29Å; L293-T295 PolarHBondContact O-N 3.23Å; L293-F296 VanDerWaalsContact O-CB 3.24Å; L293-F296 WeakPolarHBondContact O-CB 3.48Å; L293-F296 PolarHBondContact O-N 2.92Å; L293-R348 HydrophobicContact CD1-CB 4.14Å; L293-M352 HydrophobicContact CD2-CG 4.3Å; L293-L358 HydrophobicContact CD2-CD1 3.65Å; L293-L358 HydrophobicContact CD2-CD2 4.1Å
294	T	86.1	Confident	84.2	Confident	116 Å²	116	44.2 Å²	44.2	71%	0.712	25%	0.246	S	C	*	.	H	α-helix	trans	-62.4	-38.6	176.7	-54.4	0	0	0	0	111.6	F290 D291 L292	F290-T294 PolarHBondContact O-N 3.44Å; F290-T294 PolarHBondContact O-OG1 3.1Å; D291-T294 WeakPolarHBondContact O-CB 3.27Å; D291-T294 PolarHBondContact O-N 2.92Å; L292-T294 VanDerWaalsContact C-N 3.3Å; L292-T294 PolarHBondContact O-N 3.41Å
295	T	83.6	Confident	84.4	Confident	35 Å²	35	47.3 Å²	47.3	22%	0.215	26%	0.259	C	S	.	.	H	α-helix	trans	-88.5	-1.8	177.4	54.4	0	0	0	0	114.1	D291 L292 L293 R297 Q298	D291-T295 PolarHBondContact O-N 3.45Å; D291-T295 VanDerWaalsContact O-N 3.11Å; D291-T295 PolarHBondContact O-OG1 3.38Å; D291-T295 VanDerWaalsContact O-OG1 3.12Å; L292-T295 CarbonylContact O-C 3.56Å; L292-T295 PolarHBondContact O-N 2.94Å; L292-T295 PolarHBondContact O-OG1 3.47Å; L292-T295 VanDerWaalsContact O-OG1 3.04Å; L293-T295 VanDerWaalsContact C-N 3.29Å; L293-T295 PolarHBondContact O-N 3.23Å; T295-R297 PolarHBondContact O-N 3.06Å; T295-R297 VanDerWaalsContact O-N 3.13Å; T295-Q298 WeakPolarHBondContact O-CB 3.31Å; T295-Q298 WeakPolarHBondContact O-CG 3.3Å; T295-Q298 PolarHBondContact O-N 3.32Å
296	F	84.8	Confident	84.3	Confident	9 Å²	9	54 Å²	54	4%	0.039	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-59.3	-33	-169.8	-170.8	-102.5	0	0	0	113.5	L292 L293 Q298 I299 I326 M352 A353 L357 L358	L292-F296 PolarHBondContact O-N 3.07Å; L293-F296 VanDerWaalsContact O-CB 3.24Å; L293-F296 WeakPolarHBondContact O-CB 3.48Å; L293-F296 PolarHBondContact O-N 2.92Å; F296-Q298 PolarHBondContact O-N 2.76Å; F296-Q298 VanDerWaalsContact O-N 3.12Å; F296-I299 HydrophobicContact CD2-CD1 3.54Å; F296-I299 HydrophobicContact CE2-CD1 3.5Å; F296-I299 VanDerWaalsContact CE2-CD1 3.5Å; F296-I299 HydrophobicContact CG-CD1 4.27Å; F296-I299 HydrophobicContact CZ-CD1 4.21Å; F296-I299 WeakPolarHBondContact O-CB 3.5Å; F296-I299 WeakPolarHBondContact O-CG1 3.15Å; F296-I299 PolarHBondContact O-N 3.01Å; F296-I299 VanDerWaalsContact O-N 3.13Å; F296-I326 HydrophobicContact CE2-CD1 4.48Å; F296-M352 HydrophobicContact CD1-CB 4.26Å; F296-A353 WeakPolarHBondContact CE1-O 3.18Å; F296-L357 HydrophobicContact CE2-CD2 4.36Å; F296-L357 HydrophobicContact CZ-CD2 4.45Å; F296-L358 HydrophobicContact CD1-CD1 4.14Å; F296-L358 HydrophobicContact CD2-CD1 4.11Å; F296-L358 HydrophobicContact CD2-CD2 4.07Å; F296-L358 HydrophobicContact CD2-CG 4.26Å; F296-L358 HydrophobicContact CE1-CD1 3.9Å; F296-L358 HydrophobicContact CE1-CG 4.24Å; F296-L358 HydrophobicContact CE2-CD1 3.87Å; F296-L358 HydrophobicContact CE2-CD2 3.61Å; F296-L358 HydrophobicContact CE2-CG 3.61Å; F296-L358 HydrophobicContact CG-CD1 4.25Å; F296-L358 HydrophobicContact CZ-CD1 3.76Å; F296-L358 HydrophobicContact CZ-CD2 4.16Å; F296-L358 HydrophobicContact CZ-CG 3.61Å
297	R	83.6	Confident	84.2	Confident	190 Å²	190	55.1 Å²	55.1	72%	0.717	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-59.9	-23.2	176.6	-64.6	-176	-176.7	177.5	0.3	113.3	T295 I299 S300	T295-R297 PolarHBondContact O-N 3.06Å; T295-R297 VanDerWaalsContact O-N 3.13Å; R297-I299 PolarHBondContact O-N 3.15Å; R297-S300 PolarHBondContact O-N 3.2Å
298	Q	84.8	Confident	84.2	Confident	96 Å²	96	53.4 Å²	53.4	45%	0.449	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-66.5	-24	179.1	-62.7	175.3	-12	0	0	112.7	P260 T295 F296 S300 G301	P260-Q298 HydrophobicContact CB-CB 4.45Å; T295-Q298 WeakPolarHBondContact O-CB 3.31Å; T295-Q298 WeakPolarHBondContact O-CG 3.3Å; T295-Q298 PolarHBondContact O-N 3.32Å; F296-Q298 PolarHBondContact O-N 2.76Å; F296-Q298 VanDerWaalsContact O-N 3.12Å; Q298-S300 PolarHBondContact O-N 3.43Å; Q298-G301 PolarHBondContact O-N 2.96Å
299	I	84.6	Confident	83.9	Confident	7 Å²	7	60.8 Å²	60.8	4%	0.036	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-59.9	-30.7	176	-60.8	175.4	0	0	0	111	P260 F296 R297 Y318 L319 Y322	P260-I299 HydrophobicContact CB-CG1 4.13Å; F296-I299 HydrophobicContact CD2-CD1 3.54Å; F296-I299 HydrophobicContact CE2-CD1 3.5Å; F296-I299 VanDerWaalsContact CE2-CD1 3.5Å; F296-I299 HydrophobicContact CG-CD1 4.27Å; F296-I299 HydrophobicContact CZ-CD1 4.21Å; F296-I299 WeakPolarHBondContact O-CB 3.5Å; F296-I299 WeakPolarHBondContact O-CG1 3.15Å; F296-I299 PolarHBondContact O-N 3.01Å; F296-I299 VanDerWaalsContact O-N 3.13Å; R297-I299 PolarHBondContact O-N 3.15Å; I299-Y318 HydrophobicContact CG2-CE1 3.73Å; I299-L319 HydrophobicContact CG2-CD2 3.77Å; I299-Y322 HydrophobicContact CD1-CD1 4.22Å; I299-Y322 HydrophobicContact CD1-CE1 3.99Å; I299-Y322 HydrophobicContact CG1-CE1 4.08Å; I299-Y322 HydrophobicContact CG2-CE2 3.99Å
300	S	80	Confident	83.7	Confident	49 Å²	49	67.8 Å²	67.8	34%	0.343	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-102.1	15.8	177.2	-54.8	0	0	0	0	113.3	R297 Q298 N354	R297-S300 PolarHBondContact O-N 3.2Å; Q298-S300 PolarHBondContact O-N 3.43Å; S300-N354 PolarHBondContact OG-ND2 3.2Å
301	G	82.9	Confident	83.5	Confident	25 Å²	25	67.4 Å²	67.4	26%	0.258	35%	0.348	S	S	.	.			trans	-71	156.2	-177.1	0	0	0	0	0	114.4	Q298 S303 V304 Q305	Q298-G301 PolarHBondContact O-N 2.96Å; G301-S303 VanDerWaalsContact C-N 3.27Å; G301-S303 PolarHBondContact O-N 3.24Å; G301-V304 WeakPolarHBondContact O-CB 3.43Å; G301-V304 PolarHBondContact O-N 3.18Å; G301-Q305 PolarHBondContact O-N 3.36Å; G301-Q305 VanDerWaalsContact O-N 3.11Å
302	D	80.9	Confident	83.3	Confident	127 Å²	127	75.6 Å²	75.6	68%	0.679	38%	0.382	S	S	*	.	H	α-helix	trans	-58.5	-33.8	-175.1	-63.3	-24.7	0	0	0	114.2	V304 Q305 K306	D302-V304 VanDerWaalsContact C-N 3.34Å; D302-Q305 PolarHBondContact O-N 3.12Å; D302-K306 WeakPolarHBondContact O-CG 3.12Å; D302-K306 PolarHBondContact O-N 3.45Å; D302-K306 VanDerWaalsContact O-N 3.11Å
303	S	79.3	Confident	83.1	Confident	93 Å²	93	75.9 Å²	75.9	65%	0.65	38%	0.384	S	S	*	.	H	α-helix	trans	-65.3	-40.1	177.1	-170.2	0	0	0	0	111.7	G301 K306 Q307	G301-S303 VanDerWaalsContact C-N 3.27Å; G301-S303 PolarHBondContact O-N 3.24Å; S303-K306 PolarHBondContact O-N 3.43Å; S303-Q307 PolarHBondContact O-N 2.96Å; S303-Q307 VanDerWaalsContact O-N 3.15Å
304	V	82.2	Confident	83	Confident	13 Å²	13	82.3 Å²	82.3	8%	0.079	41%	0.414	C	S	.	.	H	α-helix	trans	-68.9	-44	178.5	176.2	0	0	0	0	109.7	P260 G301 D302 K306 Q307 L308 Y318	P260-V304 HydrophobicContact CG-CG2 3.93Å; G301-V304 WeakPolarHBondContact O-CB 3.43Å; G301-V304 PolarHBondContact O-N 3.18Å; D302-V304 VanDerWaalsContact C-N 3.34Å; V304-K306 VanDerWaalsContact C-N 3.29Å; V304-K306 PolarHBondContact O-N 2.95Å; V304-Q307 WeakPolarHBondContact O-CB 3.2Å; V304-Q307 PolarHBondContact O-N 3.32Å; V304-L308 HydrophobicContact CG1-CD1 4.01Å; V304-L308 HydrophobicContact CG1-CG 4.17Å; V304-L308 WeakPolarHBondContact O-CG 3.32Å; V304-L308 PolarHBondContact O-N 3.31Å; V304-Y318 HydrophobicContact CG1-CE1 3.68Å; V304-Y318 HydrophobicContact CG1-CE2 4.25Å; V304-Y318 VanDerWaalsContact CG1-CZ 3.46Å; V304-Y318 WeakPolarHBondContact CG1-OH 3.42Å
305	Q	82.5	Confident	82.9	Confident	77 Å²	77	79.1 Å²	79.1	36%	0.36	39%	0.394	S	S	.	.	H	α-helix	trans	-58.3	-41	177.2	-66.9	-63.6	-20.2	0	0	112.3	G301 D302 L308 H309	G301-Q305 PolarHBondContact O-N 3.36Å; G301-Q305 VanDerWaalsContact O-N 3.11Å; D302-Q305 PolarHBondContact O-N 3.12Å; Q305-L308 PolarHBondContact O-N 3.2Å; Q305-H309 WeakPolarHBondContact O-CB 3.38Å; Q305-H309 PolarHBondContact O-N 2.76Å
306	K	82.2	Confident	82.9	Confident	146 Å²	146	79.3 Å²	79.3	64%	0.635	40%	0.396	S	S	*	.	H	α-helix	trans	-62.8	-41.8	174.1	-71.7	171.9	-174.9	176.6	0	112	D302 S303 V304 H309 L310	D302-K306 WeakPolarHBondContact O-CG 3.12Å; D302-K306 PolarHBondContact O-N 3.45Å; D302-K306 VanDerWaalsContact O-N 3.11Å; S303-K306 PolarHBondContact O-N 3.43Å; V304-K306 VanDerWaalsContact C-N 3.29Å; V304-K306 PolarHBondContact O-N 2.95Å; K306-H309 PolarHBondContact O-N 2.93Å; K306-L310 WeakPolarHBondContact O-CG 3.4Å; K306-L310 PolarHBondContact O-N 3.25Å; K306-L310 VanDerWaalsContact O-N 3.07Å
307	Q	81.8	Confident	82.8	Confident	45 Å²	45	80.8 Å²	80.8	21%	0.21	41%	0.41	C	S	.	.	H	α-helix	trans	-66.5	-42.2	177.9	-172.2	177.5	-11.2	0	0	112.1	T153 I156 S303 V304 H309 L310 Q311	T153-Q307 PolarHBondContact O-NE2 3.48Å; T153-Q307 PolarHBondContact OG1-NE2 3.1Å; I156-Q307 HydrophobicContact CD1-CG 3.85Å; I156-Q307 VanDerWaalsContact CD1-NE2 3.27Å; S303-Q307 PolarHBondContact O-N 2.96Å; S303-Q307 VanDerWaalsContact O-N 3.15Å; V304-Q307 WeakPolarHBondContact O-CB 3.2Å; V304-Q307 PolarHBondContact O-N 3.32Å; Q307-H309 VanDerWaalsContact C-N 3.32Å; Q307-H309 PolarHBondContact O-N 2.95Å; Q307-L310 PolarHBondContact O-N 3.33Å; Q307-Q311 WeakPolarHBondContact O-CG 3.21Å; Q307-Q311 PolarHBondContact O-N 3.43Å
308	L	84.6	Confident	83.1	Confident	6 Å²	6	72.1 Å²	72.1	3%	0.031	38%	0.377	C	S	.	.	H	α-helix	trans	-62.4	-39.7	175.5	-67.2	176.8	0	0	0	111.9	I156 V304 Q305 Q311 K312 V313 Y318	I156-L308 HydrophobicContact CD1-CD2 4.42Å; V304-L308 HydrophobicContact CG1-CD1 4.01Å; V304-L308 HydrophobicContact CG1-CG 4.17Å; V304-L308 WeakPolarHBondContact O-CG 3.32Å; V304-L308 PolarHBondContact O-N 3.31Å; Q305-L308 PolarHBondContact O-N 3.2Å; L308-Q311 CarbonylContact O-C 3.6Å; L308-Q311 PolarHBondContact O-N 2.76Å; L308-K312 WeakPolarHBondContact O-CA 3.24Å; L308-K312 PolarHBondContact O-N 2.99Å; L308-V313 HydrophobicContact CD2-CB 3.9Å; L308-V313 HydrophobicContact CD2-CG1 4.13Å; L308-V313 PolarHBondContact O-N 3.48Å; L308-Y318 HydrophobicContact CD1-CD1 3.84Å; L308-Y318 HydrophobicContact CD1-CD2 4.49Å; L308-Y318 HydrophobicContact CD1-CE1 4.29Å; L308-Y318 HydrophobicContact CD1-CG 3.92Å; L308-Y318 HydrophobicContact CD2-CD1 4.38Å; L308-Y318 HydrophobicContact CD2-CD2 3.57Å; L308-Y318 HydrophobicContact CD2-CE2 4.16Å; L308-Y318 HydrophobicContact CD2-CG 3.66Å; L308-Y318 HydrophobicContact CG-CG 4.4Å
309	H	83.3	Confident	83.2	Confident	157 Å²	157	68.1 Å²	68.1	73%	0.727	36%	0.359	S	S	*	.	H	α-helix	trans	-64.3	-43.1	175.6	-169.7	72.6	0	0	0	112.2	Q305 K306 Q307 Q311 K312	Q305-H309 WeakPolarHBondContact O-CB 3.38Å; Q305-H309 PolarHBondContact O-N 2.76Å; K306-H309 PolarHBondContact O-N 2.93Å; Q307-H309 VanDerWaalsContact C-N 3.32Å; Q307-H309 PolarHBondContact O-N 2.95Å; H309-Q311 PolarHBondContact O-N 3.28Å; H309-K312 PolarHBondContact O-N 3.07Å
310	L	83.4	Confident	83.3	Confident	147 Å²	147	69.9 Å²	69.9	77%	0.77	37%	0.367	S	S	*	.	H	α-helix	trans	-63.4	-40.1	176.9	-72.7	169.1	0	0	0	112.4	K306 Q307	K306-L310 WeakPolarHBondContact O-CG 3.4Å; K306-L310 PolarHBondContact O-N 3.25Å; K306-L310 VanDerWaalsContact O-N 3.07Å; Q307-L310 PolarHBondContact O-N 3.33Å
311	Q	81.7	Confident	83.8	Confident	38 Å²	38	67.8 Å²	67.8	18%	0.178	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	1.4	-179.8	-62.8	-173.9	16.6	0	0	113.6	T153 S154 Q307 L308 H309 V313	T153-Q311 PolarHBondContact O-NE2 2.62Å; T153-Q311 VanDerWaalsContact O-NE2 3.07Å; S154-Q311 VanDerWaalsContact O-CD 3.24Å; S154-Q311 PolarHBondContact O-NE2 3.46Å; S154-Q311 PolarHBondContact O-OE1 3.33Å; Q307-Q311 WeakPolarHBondContact O-CG 3.21Å; Q307-Q311 PolarHBondContact O-N 3.43Å; L308-Q311 CarbonylContact O-C 3.6Å; L308-Q311 PolarHBondContact O-N 2.76Å; H309-Q311 PolarHBondContact O-N 3.28Å; Q311-V313 VanDerWaalsContact C-N 3.25Å; Q311-V313 HydrophobicContact CB-CG2 3.96Å; Q311-V313 PolarHBondContact O-N 2.88Å
312	K	82.8	Confident	84.1	Confident	193 Å²	193	66.7 Å²	66.7	84%	0.839	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	38.7	-178.2	-57.1	-179.7	-179.4	178.1	0	113.9	L308 H309	L308-K312 WeakPolarHBondContact O-CA 3.24Å; L308-K312 PolarHBondContact O-N 2.99Å; H309-K312 PolarHBondContact O-N 3.07Å
313	V	83.9	Confident	84.6	Confident	12 Å²	12	60.8 Å²	60.8	7%	0.073	31%	0.309	C	S	.	.			trans	-98.3	126.2	178.3	-176.9	0	0	0	0	109.8	Q157 L308 Q311 A317	Q157-V313 HydrophobicContact CG-CG1 4.42Å; Q157-V313 HydrophobicContact CG-CG2 4.13Å; L308-V313 HydrophobicContact CD2-CB 3.9Å; L308-V313 HydrophobicContact CD2-CG1 4.13Å; L308-V313 PolarHBondContact O-N 3.48Å; Q311-V313 VanDerWaalsContact C-N 3.25Å; Q311-V313 HydrophobicContact CB-CG2 3.96Å; Q311-V313 PolarHBondContact O-N 2.88Å; V313-A317 HydrophobicContact CG1-CB 4.29Å
314	E	84.7	Confident	85.1	Confident	147 Å²	147	57 Å²	57	69%	0.687	28%	0.283	S	S	*	.			trans	-71.5	148.7	175.8	-58.6	-171.7	163.1	0	0	112	A317 Y318	E314-A317 PolarHBondContact O-N 3.08Å; E314-Y318 PolarHBondContact O-N 2.7Å
315	V	83.3	Confident	85.6	Confident	49 Å²	49	56.4 Å²	56.4	30%	0.297	28%	0.279	S	S	.	.	H	α-helix	trans	-56.6	-43.7	-178.9	178.8	0	0	0	0	112.9	A317 Y318 L319	V315-A317 PolarHBondContact O-N 2.94Å; V315-Y318 PolarHBondContact O-N 3.43Å; V315-L319 HydrophobicContact CG1-CD1 4.06Å; V315-L319 HydrophobicContact CG1-CG 4.27Å; V315-L319 WeakPolarHBondContact O-CG 3.35Å; V315-L319 PolarHBondContact O-N 3.24Å
316	P	83.6	Confident	86	Confident	39 Å²	39	52.8 Å²	52.8	25%	0.253	26%	0.262	S	S	.	.	H	α-helix	trans	-57.4	-45.8	175.1	-27.8	37	0	0	0	113.5	Y318 L319 M320 P391	P316-Y318 VanDerWaalsContact C-N 3.34Å; P316-Y318 PolarHBondContact O-N 3.15Å; P316-L319 PolarHBondContact O-N 3.05Å; P316-M320 WeakPolarHBondContact O-CG 3.31Å; P316-M320 PolarHBondContact O-N 3.15Å; P316-M320 VanDerWaalsContact O-N 3.14Å; P316-P391 HydrophobicContact CB-CG 4Å
317	A	83.5	Confident	86.4	Confident	40 Å²	40	46.4 Å²	46.4	33%	0.331	24%	0.235	S	C	.	.	H	α-helix	trans	-64.3	-41.2	179.5	0	0	0	0	0	111.2	V313 E314 V315 M320	V313-A317 HydrophobicContact CG1-CB 4.29Å; E314-A317 PolarHBondContact O-N 3.08Å; V315-A317 PolarHBondContact O-N 2.94Å; A317-M320 PolarHBondContact O-N 3.45Å
318	Y	88.4	Confident	86.8	Confident	8 Å²	8	44.5 Å²	44.5	3%	0.031	23%	0.226	C	C	.	.	H	α-helix	trans	-61.5	-47.1	174.6	173.4	-112.6	0	0	0	112.9	I156 I299 V304 L308 E314 V315 P316 M320 L321 Y322	I156-Y318 HydrophobicContact CG2-CD2 4.02Å; I156-Y318 HydrophobicContact CG2-CE2 4.21Å; I299-Y318 HydrophobicContact CG2-CE1 3.73Å; V304-Y318 HydrophobicContact CG1-CE1 3.68Å; V304-Y318 HydrophobicContact CG1-CE2 4.25Å; V304-Y318 VanDerWaalsContact CG1-CZ 3.46Å; V304-Y318 WeakPolarHBondContact CG1-OH 3.42Å; L308-Y318 HydrophobicContact CD1-CD1 3.84Å; L308-Y318 HydrophobicContact CD1-CD2 4.49Å; L308-Y318 HydrophobicContact CD1-CE1 4.29Å; L308-Y318 HydrophobicContact CD1-CG 3.92Å; L308-Y318 HydrophobicContact CD2-CD1 4.38Å; L308-Y318 HydrophobicContact CD2-CD2 3.57Å; L308-Y318 HydrophobicContact CD2-CE2 4.16Å; L308-Y318 HydrophobicContact CD2-CG 3.66Å; L308-Y318 HydrophobicContact CG-CG 4.4Å; E314-Y318 PolarHBondContact O-N 2.7Å; V315-Y318 PolarHBondContact O-N 3.43Å; P316-Y318 VanDerWaalsContact C-N 3.34Å; P316-Y318 PolarHBondContact O-N 3.15Å; Y318-M320 PolarHBondContact O-N 2.93Å; Y318-L321 HydrophobicContact CD2-CD1 4.03Å; Y318-L321 VanDerWaalsContact O-CB 3.27Å; Y318-L321 WeakPolarHBondContact O-CB 3.47Å; Y318-L321 WeakPolarHBondContact O-CG 3.05Å; Y318-L321 PolarHBondContact O-N 3.41Å; Y318-Y322 HydrophobicContact CD1-CE2 4.32Å; Y318-Y322 HydrophobicContact CD2-CE2 4.4Å; Y318-Y322 AromaticContact CE1-CE2 3.74Å; Y318-Y322 HydrophobicContact CE1-CE2 3.74Å; Y318-Y322 AromaticContact CE2-CE2 3.85Å; Y318-Y322 HydrophobicContact CE2-CE2 3.85Å; Y318-Y322 AromaticContact CZ-CE2 3.5Å; Y318-Y322 VanDerWaalsContact CZ-CE2 3.5Å; Y318-Y322 AromaticContact CZ-CZ 3.91Å; Y318-Y322 PolarHBondContact OH-OH 3.08Å
319	L	87.4	Confident	87.2	Confident	13 Å²	13	44.2 Å²	44.2	7%	0.068	22%	0.224	C	C	.	.	H	α-helix	trans	-62	-33	179	-69.3	176.1	0	0	0	112	I299 V315 P316 L321 Y322 L357 F390	I299-L319 HydrophobicContact CG2-CD2 3.77Å; V315-L319 HydrophobicContact CG1-CD1 4.06Å; V315-L319 HydrophobicContact CG1-CG 4.27Å; V315-L319 WeakPolarHBondContact O-CG 3.35Å; V315-L319 PolarHBondContact O-N 3.24Å; P316-L319 PolarHBondContact O-N 3.05Å; L319-L321 PolarHBondContact O-N 3.12Å; L319-Y322 PolarHBondContact O-N 2.95Å; L319-L357 HydrophobicContact CD2-CD2 4.25Å; L319-L357 WeakPolarHBondContact O-CD1 3.45Å; L319-F390 HydrophobicContact CB-CD2 4.17Å; L319-F390 HydrophobicContact CD1-CB 4.13Å
320	M	87.1	Confident	87.5	Confident	44 Å²	44	36.8 Å²	36.8	22%	0.217	19%	0.19	C	C	.	.	H	α-helix	trans	-64.1	-26.2	175.8	-72.3	-161.7	-10.1	0	0	113.8	R58 P316 A317 Y318 Y322 S323 F390 L394	R58-M320 PolarHBondContact NH2-SD 3.12Å; P316-M320 WeakPolarHBondContact O-CG 3.31Å; P316-M320 PolarHBondContact O-N 3.15Å; P316-M320 VanDerWaalsContact O-N 3.14Å; A317-M320 PolarHBondContact O-N 3.45Å; Y318-M320 PolarHBondContact O-N 2.93Å; M320-Y322 PolarHBondContact O-N 3.27Å; M320-S323 WeakPolarHBondContact O-CB 3.32Å; M320-S323 PolarHBondContact O-N 2.94Å; M320-F390 HydrophobicContact CG-CE2 3.97Å; M320-L394 HydrophobicContact CG-CD1 4.45Å; M320-L394 HydrophobicContact SD-CD1 3.79Å
321	L	89.7	Confident	87.8	Confident	5 Å²	5	30.7 Å²	30.7	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-63.1	-25.3	178.1	-55.8	172.3	0	0	0	112.2	F59 I156 P160 L261 Y265 Y318 L319	F59-L321 HydrophobicContact CD1-CD2 3.56Å; F59-L321 HydrophobicContact CE1-CD2 3.68Å; I156-L321 HydrophobicContact CB-CD1 4.47Å; I156-L321 HydrophobicContact CG2-CD1 3.25Å; P160-L321 HydrophobicContact CG-CB 4.24Å; P160-L321 HydrophobicContact CG-CD2 3.95Å; L261-L321 HydrophobicContact CD1-CB 4.02Å; L261-L321 HydrophobicContact CD2-CD1 4.44Å; Y265-L321 WeakPolarHBondContact CE2-O 3.35Å; Y265-L321 PolarHBondContact OH-O 3.21Å; Y318-L321 HydrophobicContact CD2-CD1 4.03Å; Y318-L321 VanDerWaalsContact O-CB 3.27Å; Y318-L321 WeakPolarHBondContact O-CB 3.47Å; Y318-L321 WeakPolarHBondContact O-CG 3.05Å; Y318-L321 PolarHBondContact O-N 3.41Å; L319-L321 PolarHBondContact O-N 3.12Å
322	Y	90.8	Very high	88.1	Confident	1 Å²	1	28.9 Å²	28.9	0%	0.004	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-19.8	177.2	-71.6	-93.9	0	0	0	113.2	P260 L261 A264 I299 Y318 L319 M320 A325 I326 L357	P260-Y322 WeakPolarHBondContact CB-OH 3.3Å; P260-Y322 WeakPolarHBondContact CG-OH 3.22Å; L261-Y322 HydrophobicContact CB-CE1 4.23Å; L261-Y322 HydrophobicContact CD1-CD1 4.11Å; L261-Y322 HydrophobicContact CD1-CD2 4.06Å; L261-Y322 HydrophobicContact CD1-CE1 3.95Å; L261-Y322 HydrophobicContact CD1-CE2 3.88Å; L261-Y322 HydrophobicContact CD1-CG 4.17Å; L261-Y322 PolarHBondContact N-OH 3.43Å; L261-Y322 VanDerWaalsContact N-OH 3.15Å; A264-Y322 HydrophobicContact CB-CD1 3.76Å; A264-Y322 HydrophobicContact CB-CE1 3.94Å; I299-Y322 HydrophobicContact CD1-CD1 4.22Å; I299-Y322 HydrophobicContact CD1-CE1 3.99Å; I299-Y322 HydrophobicContact CG1-CE1 4.08Å; I299-Y322 HydrophobicContact CG2-CE2 3.99Å; Y318-Y322 HydrophobicContact CD1-CE2 4.32Å; Y318-Y322 HydrophobicContact CD2-CE2 4.4Å; Y318-Y322 AromaticContact CE1-CE2 3.74Å; Y318-Y322 HydrophobicContact CE1-CE2 3.74Å; Y318-Y322 AromaticContact CE2-CE2 3.85Å; Y318-Y322 HydrophobicContact CE2-CE2 3.85Å; Y318-Y322 AromaticContact CZ-CE2 3.5Å; Y318-Y322 VanDerWaalsContact CZ-CE2 3.5Å; Y318-Y322 AromaticContact CZ-CZ 3.91Å; Y318-Y322 PolarHBondContact OH-OH 3.08Å; L319-Y322 PolarHBondContact O-N 2.95Å; M320-Y322 PolarHBondContact O-N 3.27Å; Y322-A325 PolarHBondContact O-N 3.26Å; Y322-I326 HydrophobicContact CD1-CD1 4.5Å; Y322-I326 WeakPolarHBondContact O-CG1 3.07Å; Y322-I326 PolarHBondContact O-N 2.88Å; Y322-L357 HydrophobicContact CG-CD2 4.25Å
323	S	89.6	Confident	88.3	Confident	4 Å²	4	19.7 Å²	19.7	3%	0.028	11%	0.109	C	C	.	.	H	α-helix	trans	-57	-46.3	-172.1	-171.5	0	0	0	0	112.6	M320 A325 I326 N327	M320-S323 WeakPolarHBondContact O-CB 3.32Å; M320-S323 PolarHBondContact O-N 2.94Å; S323-A325 VanDerWaalsContact C-N 3.34Å; S323-A325 PolarHBondContact O-N 3.5Å; S323-I326 PolarHBondContact O-N 2.88Å; S323-N327 WeakPolarHBondContact O-CB 3.43Å; S323-N327 PolarHBondContact O-N 2.87Å; S323-N327 PolarHBondContact O-ND2 3.38Å; S323-N327 PolarHBondContact O-OD1 2.92Å; S323-N327 PolarHBondContact OG-ND2 3.12Å; S323-N327 PolarHBondContact OG-OD1 3.46Å
324	P	91.3	Very high	88.4	Confident	14 Å²	14	19.3 Å²	19.3	9%	0.091	11%	0.107	C	C	.	.	H	α-helix	trans	-59.3	-43.4	178.8	-22.8	33.8	0	0	0	113.2	I55 F59 W328	I55-P324 HydrophobicContact CD1-CB 3.8Å; I55-P324 HydrophobicContact CD1-CG 4.48Å; I55-P324 HydrophobicContact CG1-CB 3.95Å; I55-P324 HydrophobicContact CG1-CG 4.1Å; F59-P324 HydrophobicContact CE2-CG 3.49Å; F59-P324 VanDerWaalsContact CE2-CG 3.49Å; F59-P324 HydrophobicContact CZ-CG 3.84Å; P324-W328 WeakPolarHBondContact O-CB 3.38Å; P324-W328 PolarHBondContact O-N 3.08Å
325	A	91.5	Very high	88.4	Confident	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-67.9	-50.3	-179.4	0	0	0	0	0	111.8	A264 Y265 A268 Y322 S323 W328 I329	A264-A325 HydrophobicContact CB-CB 4.43Å; Y265-A325 HydrophobicContact CD1-CB 4.04Å; Y265-A325 HydrophobicContact CD2-CB 4.09Å; Y265-A325 HydrophobicContact CE1-CB 4.02Å; Y265-A325 HydrophobicContact CE2-CB 4.03Å; Y265-A325 HydrophobicContact CG-CB 4.1Å; A268-A325 HydrophobicContact CB-CB 3.9Å; Y322-A325 PolarHBondContact O-N 3.26Å; S323-A325 VanDerWaalsContact C-N 3.34Å; S323-A325 PolarHBondContact O-N 3.5Å; A325-W328 PolarHBondContact O-N 2.98Å; A325-I329 VanDerWaalsContact O-CG1 3.28Å; A325-I329 WeakPolarHBondContact O-CG1 3.47Å; A325-I329 PolarHBondContact O-N 3.33Å
326	I	91.6	Very high	88.4	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-69	-40.6	-177.5	-59.5	-179.1	0	0	0	111.1	L292 F296 Y322 S323 W328 I329 L330 L357 L358	L292-I326 HydrophobicContact CD2-CG1 4.22Å; F296-I326 HydrophobicContact CE2-CD1 4.48Å; Y322-I326 HydrophobicContact CD1-CD1 4.5Å; Y322-I326 WeakPolarHBondContact O-CG1 3.07Å; Y322-I326 PolarHBondContact O-N 2.88Å; S323-I326 PolarHBondContact O-N 2.88Å; I326-W328 PolarHBondContact O-N 2.85Å; I326-I329 PolarHBondContact O-N 3.34Å; I326-L330 HydrophobicContact CG2-CD1 4.01Å; I326-L330 HydrophobicContact CG2-CG 4.31Å; I326-L330 WeakPolarHBondContact O-CB 3.35Å; I326-L330 WeakPolarHBondContact O-CG 3.36Å; I326-L330 PolarHBondContact O-N 2.97Å; I326-L357 HydrophobicContact CD1-CD2 3.83Å; I326-L357 HydrophobicContact CD1-CG 4.15Å; I326-L358 HydrophobicContact CD1-CD2 4.36Å; I326-L358 HydrophobicContact CG2-CD2 4.16Å
327	N	90.5	Very high	88.4	Confident	12 Å²	12	16.9 Å²	16.9	6%	0.064	8%	0.083	C	C	.	.	H	α-helix	trans	-57.6	-41.6	175.3	-64.1	-4.9	0	0	0	110.5	S323 Q331 S361	S323-N327 WeakPolarHBondContact O-CB 3.43Å; S323-N327 PolarHBondContact O-N 2.87Å; S323-N327 PolarHBondContact O-ND2 3.38Å; S323-N327 PolarHBondContact O-OD1 2.92Å; S323-N327 PolarHBondContact OG-ND2 3.12Å; S323-N327 PolarHBondContact OG-OD1 3.46Å; N327-Q331 VanDerWaalsContact O-CB 3.31Å; N327-Q331 WeakPolarHBondContact O-CB 3.5Å; N327-Q331 PolarHBondContact O-N 3.26Å; N327-S361 WeakPolarHBondContact OD1-CA 3.39Å; N327-S361 WeakPolarHBondContact OD1-CB 3.38Å; N327-S361 PolarHBondContact OD1-OG 3.31Å
328	W	90.8	Very high	88.5	Confident	6 Å²	6	18.9 Å²	18.9	2%	0.023	9%	0.092	C	C	.	.	H	α-helix	trans	-67.5	-48.1	178.6	-174	-105	0	0	0	112.6	F45 E46 W48 K51 R272 P324 A325 I326 L330 Q331 C332	F45-W328 AromaticContact CE1-CH2 3.67Å; F45-W328 HydrophobicContact CE1-CH2 3.67Å; F45-W328 HydrophobicContact CE1-CZ2 4.15Å; F45-W328 HydrophobicContact CE1-CZ3 4.4Å; F45-W328 AromaticContact CZ-CH2 3.89Å; F45-W328 HydrophobicContact CZ-CH2 3.89Å; F45-W328 HydrophobicContact CZ-CZ2 4.15Å; F45-W328 HydrophobicContact CZ-CZ3 4.41Å; E46-W328 WeakPolarHBondContact O-CZ3 3.29Å; W48-W328 HydrophobicContact CB-CH2 3.65Å; W48-W328 HydrophobicContact CB-CZ2 3.91Å; W48-W328 HydrophobicContact CB-CZ3 4.07Å; W48-W328 HydrophobicContact CD2-CD2 4.48Å; W48-W328 HydrophobicContact CE3-CB 4.3Å; W48-W328 AromaticContact CE3-CD2 3.4Å; W48-W328 HydrophobicContact CE3-CD2 3.4Å; W48-W328 AromaticContact CE3-CE2 3.85Å; W48-W328 AromaticContact CE3-CE3 3.5Å; W48-W328 HydrophobicContact CE3-CE3 3.5Å; W48-W328 VanDerWaalsContact CE3-CE3 3.5Å; W48-W328 AromaticContact CE3-CG 3.77Å; W48-W328 HydrophobicContact CE3-CG 3.77Å; W48-W328 HydrophobicContact CE3-CH2 4.38Å; W48-W328 HydrophobicContact CE3-CZ2 4.33Å; W48-W328 AromaticContact CE3-CZ3 3.98Å; W48-W328 HydrophobicContact CE3-CZ3 3.98Å; W48-W328 HydrophobicContact CZ3-CB 3.75Å; W48-W328 AromaticContact CZ3-CD2 3.81Å; W48-W328 HydrophobicContact CZ3-CD2 3.81Å; W48-W328 HydrophobicContact CZ3-CE3 4.07Å; W48-W328 AromaticContact CZ3-CG 3.66Å; W48-W328 HydrophobicContact CZ3-CG 3.66Å; W48-W328 VanDerWaalsContact N-CH2 3.29Å; K51-W328 HydrophobicContact CD-CE3 4.02Å; K51-W328 HydrophobicContact CD-CZ3 4.41Å; R272-W328 HydrophobicContact CB-CZ2 4.33Å; R272-W328 HydrophobicContact CG-CZ2 3.93Å; P324-W328 WeakPolarHBondContact O-CB 3.38Å; P324-W328 PolarHBondContact O-N 3.08Å; A325-W328 PolarHBondContact O-N 2.98Å; I326-W328 PolarHBondContact O-N 2.85Å; W328-L330 VanDerWaalsContact C-N 3.3Å; W328-L330 PolarHBondContact O-N 3.3Å; W328-Q331 PolarHBondContact O-N 3.26Å; W328-Q331 VanDerWaalsContact O-N 3.13Å; W328-C332 PolarHBondContact NE1-SG 2.85Å; W328-C332 PolarHBondContact O-N 3.22Å; W328-C332 PolarHBondContact O-SG 2.81Å
329	I	91.4	Very high	88.4	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-55.7	-48.6	177.2	-65.6	163.5	0	0	0	110	R267 A268 I289 L292 A325 I326 Q331 C332 V333	R267-I329 HydrophobicContact CB-CD1 3.7Å; A268-I329 HydrophobicContact CB-CD1 4.32Å; A268-I329 HydrophobicContact CB-CG1 4.14Å; I289-I329 HydrophobicContact CB-CG2 4.22Å; I289-I329 HydrophobicContact CD1-CG2 4Å; L292-I329 HydrophobicContact CD2-CD1 4.21Å; A325-I329 VanDerWaalsContact O-CG1 3.28Å; A325-I329 WeakPolarHBondContact O-CG1 3.47Å; A325-I329 PolarHBondContact O-N 3.33Å; I326-I329 PolarHBondContact O-N 3.34Å; I329-Q331 PolarHBondContact O-N 2.89Å; I329-C332 PolarHBondContact O-N 3.44Å; I329-V333 VanDerWaalsContact O-CG2 3.27Å; I329-V333 WeakPolarHBondContact O-CG2 3.48Å; I329-V333 PolarHBondContact O-N 3.4Å; I329-V333 VanDerWaalsContact O-N 3.09Å
330	L	90.6	Very high	88.5	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-66.7	-34.2	179.3	-71.5	178	0	0	0	112.7	I289 I326 W328 V333 A334 I362 A365 F366	I289-L330 HydrophobicContact CD1-CD2 3.87Å; I289-L330 HydrophobicContact CD1-CG 4.49Å; I289-L330 HydrophobicContact CG1-CD2 4.04Å; I326-L330 HydrophobicContact CG2-CD1 4.01Å; I326-L330 HydrophobicContact CG2-CG 4.31Å; I326-L330 WeakPolarHBondContact O-CB 3.35Å; I326-L330 WeakPolarHBondContact O-CG 3.36Å; I326-L330 PolarHBondContact O-N 2.97Å; W328-L330 VanDerWaalsContact C-N 3.3Å; W328-L330 PolarHBondContact O-N 3.3Å; L330-V333 PolarHBondContact O-N 3.2Å; L330-A334 WeakPolarHBondContact O-CB 3.48Å; L330-A334 PolarHBondContact O-N 2.99Å; L330-I362 HydrophobicContact CD1-CG1 3.94Å; L330-A365 HydrophobicContact CB-CB 3.57Å; L330-F366 HydrophobicContact CD2-CE1 4.41Å
331	Q	89.9	Confident	88.4	Confident	18 Å²	18	26.7 Å²	26.7	8%	0.084	14%	0.138	C	C	.	.	H	α-helix	trans	-66.2	-44.4	175.5	-176.9	-166.9	-22.8	0	0	110.9	F45 E46 N327 W328 I329 V333 A334 Y335 A365	F45-Q331 HydrophobicContact CD2-CG 4.5Å; F45-Q331 HydrophobicContact CE2-CG 3.93Å; E46-Q331 PolarHBondContact O-NE2 3.43Å; N327-Q331 VanDerWaalsContact O-CB 3.31Å; N327-Q331 WeakPolarHBondContact O-CB 3.5Å; N327-Q331 PolarHBondContact O-N 3.26Å; W328-Q331 PolarHBondContact O-N 3.26Å; W328-Q331 VanDerWaalsContact O-N 3.13Å; I329-Q331 PolarHBondContact O-N 2.89Å; Q331-V333 PolarHBondContact O-N 2.96Å; Q331-A334 PolarHBondContact O-N 3.02Å; Q331-Y335 WeakPolarHBondContact O-CB 3.19Å; Q331-Y335 PolarHBondContact O-N 3.46Å; Q331-A365 HydrophobicContact CB-CB 4.26Å
332	C	87.8	Confident	88.3	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-57	-40.8	175.3	-66	0	0	0	0	111.4	C271 M275 K282 L285 W328 I329	C271-C332 HydrophobicContact CB-CB 4.3Å; M275-C332 HydrophobicContact CG-CB 3.67Å; M275-C332 HydrophobicContact SD-CB 4.26Å; K282-C332 PolarHBondContact NZ-O 3.08Å; L285-C332 HydrophobicContact CD1-CB 4.48Å; W328-C332 PolarHBondContact NE1-SG 2.85Å; W328-C332 PolarHBondContact O-N 3.22Å; W328-C332 PolarHBondContact O-SG 2.81Å; I329-C332 PolarHBondContact O-N 3.44Å
333	V	86.8	Confident	88.1	Confident	1 Å²	1	29 Å²	29	1%	0.006	15%	0.152	C	C	.	.	H	α-helix	trans	-70.9	-51	178.6	171.9	0	0	0	0	111.2	K282 L285 I289 I329 L330 Q331 Y335 M345	K282-V333 PolarHBondContact NZ-O 3.3Å; L285-V333 HydrophobicContact CB-CG2 4.05Å; I289-V333 HydrophobicContact CG2-CG2 4.24Å; I329-V333 VanDerWaalsContact O-CG2 3.27Å; I329-V333 WeakPolarHBondContact O-CG2 3.48Å; I329-V333 PolarHBondContact O-N 3.4Å; I329-V333 VanDerWaalsContact O-N 3.09Å; L330-V333 PolarHBondContact O-N 3.2Å; Q331-V333 PolarHBondContact O-N 2.96Å; V333-Y335 VanDerWaalsContact C-N 3.31Å; V333-Y335 PolarHBondContact O-N 3.44Å; V333-M345 HydrophobicContact CG1-CE 3.12Å; V333-M345 HydrophobicContact CG1-SD 3.29Å; V333-M345 WeakPolarHBondContact CG1-SD 3.45Å
334	A	86.3	Confident	88	Confident	4 Å²	4	32.6 Å²	32.6	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-68.9	-24.6	-174.8	0	0	0	0	0	114.2	L330 Q331 R336 A337 L342 F366	L330-A334 WeakPolarHBondContact O-CB 3.48Å; L330-A334 PolarHBondContact O-N 2.99Å; Q331-A334 PolarHBondContact O-N 3.02Å; A334-R336 PolarHBondContact O-N 2.91Å; A334-R336 VanDerWaalsContact O-N 3.09Å; A334-A337 WeakPolarHBondContact O-CB 3.14Å; A334-A337 PolarHBondContact O-N 3.06Å; A334-L342 HydrophobicContact CB-CD2 3.81Å; A334-F366 HydrophobicContact CB-CD1 3.68Å; A334-F366 HydrophobicContact CB-CE1 4.02Å; A334-F366 HydrophobicContact CB-CG 4.48Å
335	Y	85.6	Confident	87.8	Confident	23 Å²	23	32 Å²	32	9%	0.09	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	116	178.8	178.4	-111.4	0	0	0	111.6	L41 G42 D44 F45 M275 K282 Q331 V333 A337	L41-Y335 HydrophobicContact CD2-CD1 4.32Å; L41-Y335 HydrophobicContact CD2-CE1 3.79Å; G42-Y335 PolarHBondContact N-OH 3.15Å; D44-Y335 WeakPolarHBondContact OD2-CE2 3.38Å; F45-Y335 HydrophobicContact CB-CD2 4.07Å; F45-Y335 HydrophobicContact CB-CE2 3.74Å; F45-Y335 HydrophobicContact CD2-CD1 4.23Å; F45-Y335 AromaticContact CD2-CD2 3.59Å; F45-Y335 HydrophobicContact CD2-CD2 3.59Å; F45-Y335 HydrophobicContact CD2-CE2 4.11Å; F45-Y335 AromaticContact CD2-CG 3.64Å; F45-Y335 HydrophobicContact CD2-CG 3.64Å; F45-Y335 HydrophobicContact CE2-CG 4.21Å; F45-Y335 HydrophobicContact CG-CD2 4.28Å; F45-Y335 HydrophobicContact CG-CE2 4.37Å; M275-Y335 HydrophobicContact CE-CD1 3.77Å; M275-Y335 HydrophobicContact CE-CE1 4.42Å; K282-Y335 WeakPolarHBondContact CE-O 3.29Å; K282-Y335 PolarHBondContact NZ-O 3.13Å; Q331-Y335 WeakPolarHBondContact O-CB 3.19Å; Q331-Y335 PolarHBondContact O-N 3.46Å; V333-Y335 VanDerWaalsContact C-N 3.31Å; V333-Y335 PolarHBondContact O-N 3.44Å; Y335-A337 PolarHBondContact O-N 2.93Å; Y335-A337 VanDerWaalsContact O-N 3.11Å
336	R	81.9	Confident	87.5	Confident	154 Å²	154	32.6 Å²	32.6	58%	0.581	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	20.4	-174.8	-57.1	-175	-178.5	-178.7	2.3	115	D44 A334	D44-R336 IonicContact OD1-NH2 2.99Å; A334-R336 PolarHBondContact O-N 2.91Å; A334-R336 VanDerWaalsContact O-N 3.09Å
337	A	84.4	Confident	87.3	Confident	7 Å²	7	36.4 Å²	36.4	6%	0.058	19%	0.185	C	C	.	.			trans	-70.1	147.6	174.7	0	0	0	0	0	111.7	A334 Y335 L341 L342 R367	A334-A337 WeakPolarHBondContact O-CB 3.14Å; A334-A337 PolarHBondContact O-N 3.06Å; Y335-A337 PolarHBondContact O-N 2.93Å; Y335-A337 VanDerWaalsContact O-N 3.11Å; A337-L341 HydrophobicContact CB-CD2 4.22Å; A337-L342 HydrophobicContact CB-CD2 3.97Å; A337-L342 HydrophobicContact CB-CG 4.25Å; A337-R367 PolarHBondContact O-NH2 3.5Å
338	P	86.1	Confident	87	Confident	81 Å²	81	40.8 Å²	40.8	53%	0.526	20%	0.201	S	C	.	.			trans	-73.9	148.2	171.6	33.8	-35.9	0	0	0	110.5	P340 L341 L342	P338-P340 VanDerWaalsContact C-CD 3.44Å; P338-L341 HydrophobicContact CG-CB 4Å; P338-L341 WeakPolarHBondContact O-CB 3.3Å; P338-L341 PolarHBondContact O-N 3.4Å; P338-L341 VanDerWaalsContact O-N 3.08Å; P338-L342 PolarHBondContact O-N 3.36Å
339	E	85.4	Confident	86.7	Confident	101 Å²	101	40.6 Å²	40.6	47%	0.472	20%	0.2	S	C	.	.	H	α-helix	trans	-57	-36.3	-176.7	-170.7	171.4	-175	0	0	115.2	L341 L342 T343 F370 R374	E339-L341 VanDerWaalsContact C-N 3.29Å; E339-L341 PolarHBondContact O-N 3.18Å; E339-L342 PolarHBondContact O-N 3.36Å; E339-T343 PolarHBondContact O-N 3.49Å; E339-T343 PolarHBondContact O-OG1 3.42Å; E339-F370 HydrophobicContact CG-CD2 3.91Å; E339-F370 HydrophobicContact CG-CE2 3.8Å; E339-R374 IonicContact OE1-CZ 3.83Å; E339-R374 VanDerWaalsContact OE1-CZ 3.28Å; E339-R374 IonicContact OE1-NH1 3.84Å; E339-R374 PolarHBondContact OE1-NH1 3.44Å; E339-R374 IonicContact OE1-NH2 3.86Å; E339-R374 PolarHBondContact OE1-NH2 3Å
340	P	88.6	Confident	86.3	Confident	98 Å²	98	44.6 Å²	44.6	64%	0.636	22%	0.217	S	C	*	.	H	α-helix	trans	-58.7	-37.9	173.9	-26.9	36	0	0	0	113.6	P338 T343 E344	P338-P340 VanDerWaalsContact C-CD 3.44Å; P340-T343 PolarHBondContact O-N 3.08Å; P340-E344 WeakPolarHBondContact O-CB 3.39Å; P340-E344 PolarHBondContact O-N 3.29Å
341	L	85.8	Confident	85.9	Confident	31 Å²	31	51.2 Å²	51.2	16%	0.162	25%	0.25	C	C	.	.	H	α-helix	trans	-68.1	-41	178.2	-177.8	64.5	0	0	0	111.1	A337 P338 E339 T343 E344 M345	A337-L341 HydrophobicContact CB-CD2 4.22Å; P338-L341 HydrophobicContact CG-CB 4Å; P338-L341 WeakPolarHBondContact O-CB 3.3Å; P338-L341 PolarHBondContact O-N 3.4Å; P338-L341 VanDerWaalsContact O-N 3.08Å; E339-L341 VanDerWaalsContact C-N 3.29Å; E339-L341 PolarHBondContact O-N 3.18Å; L341-T343 VanDerWaalsContact C-N 3.31Å; L341-T343 PolarHBondContact O-N 3.42Å; L341-E344 PolarHBondContact O-N 3.13Å; L341-M345 HydrophobicContact CD1-CE 3.58Å; L341-M345 HydrophobicContact CD2-CE 3.97Å; L341-M345 HydrophobicContact CG-CE 3.6Å; L341-M345 HydrophobicContact CG-SD 4.2Å; L341-M345 WeakPolarHBondContact O-CB 3.31Å; L341-M345 VanDerWaalsContact O-CG 3.27Å; L341-M345 WeakPolarHBondContact O-CG 3.38Å; L341-M345 PolarHBondContact O-N 3.23Å
342	L	86.9	Confident	85.5	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-63.1	-40.1	175.2	-62.2	-179.9	0	0	0	111.4	A334 A337 P338 E339 M345 M346 F366 F370	A334-L342 HydrophobicContact CB-CD2 3.81Å; A337-L342 HydrophobicContact CB-CD2 3.97Å; A337-L342 HydrophobicContact CB-CG 4.25Å; P338-L342 PolarHBondContact O-N 3.36Å; E339-L342 PolarHBondContact O-N 3.36Å; L342-M345 PolarHBondContact O-N 2.83Å; L342-M346 WeakPolarHBondContact O-CB 3.45Å; L342-M346 PolarHBondContact O-N 3.37Å; L342-F366 HydrophobicContact CB-CD2 4.19Å; L342-F366 HydrophobicContact CB-CE2 3.83Å; L342-F366 HydrophobicContact CB-CZ 4.45Å; L342-F366 HydrophobicContact CD2-CD1 4.18Å; L342-F366 HydrophobicContact CD2-CD2 4.06Å; L342-F366 HydrophobicContact CD2-CE1 3.96Å; L342-F366 HydrophobicContact CD2-CE2 3.85Å; L342-F366 HydrophobicContact CD2-CG 4.24Å; L342-F366 HydrophobicContact CD2-CZ 3.79Å; L342-F366 HydrophobicContact CG-CE2 4.38Å; L342-F370 HydrophobicContact CB-CD2 4.29Å; L342-F370 HydrophobicContact CB-CE1 4.49Å; L342-F370 HydrophobicContact CB-CE2 3.84Å; L342-F370 HydrophobicContact CB-CZ 3.97Å; L342-F370 HydrophobicContact CD1-CD2 4.17Å; L342-F370 HydrophobicContact CD1-CG 4.39Å
343	T	87.8	Confident	84.6	Confident	50 Å²	50	55.6 Å²	55.6	31%	0.307	28%	0.282	S	S	.	.	H	α-helix	trans	-66	-44.4	177.3	-52.6	0	0	0	0	111.3	E339 P340 L341 M345 M346 E347	E339-T343 PolarHBondContact O-N 3.49Å; E339-T343 PolarHBondContact O-OG1 3.42Å; P340-T343 PolarHBondContact O-N 3.08Å; L341-T343 VanDerWaalsContact C-N 3.31Å; L341-T343 PolarHBondContact O-N 3.42Å; T343-M345 VanDerWaalsContact C-N 3.34Å; T343-M345 PolarHBondContact O-N 2.9Å; T343-M346 PolarHBondContact O-N 3.16Å; T343-E347 PolarHBondContact O-N 2.99Å
344	E	88	Confident	84	Confident	79 Å²	79	59 Å²	59	37%	0.369	30%	0.3	S	S	.	.	H	α-helix	trans	-60.4	-43.6	174.9	-174.4	-173.4	172.3	0	0	111.6	P340 L341 E347 R348	P340-E344 WeakPolarHBondContact O-CB 3.39Å; P340-E344 PolarHBondContact O-N 3.29Å; L341-E344 PolarHBondContact O-N 3.13Å; E344-E347 PolarHBondContact O-N 3.05Å; E344-R348 WeakPolarHBondContact O-CB 3.44Å; E344-R348 WeakPolarHBondContact O-CG 3.41Å; E344-R348 PolarHBondContact O-N 2.92Å; E344-R348 IonicContact OE1-CZ 2.88Å; E344-R348 IonicContact OE1-NE 2.71Å; E344-R348 PolarHBondContact OE1-NE 2.77Å; E344-R348 IonicContact OE1-NH2 3.98Å; E344-R348 PolarHBondContact OE1-NH2 3.31Å
345	M	85.2	Confident	83.9	Confident	2 Å²	2	59.9 Å²	59.9	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-64	-41.9	177.1	-74.5	172.7	-179.2	0	0	112.3	N286 I289 V333 L341 L342 T343 R348 C349 F366	N286-M345 VanDerWaalsContact OD1-CE 3.28Å; N286-M345 WeakPolarHBondContact OD1-CE 3.33Å; I289-M345 HydrophobicContact CG2-CE 4.31Å; V333-M345 HydrophobicContact CG1-CE 3.12Å; V333-M345 HydrophobicContact CG1-SD 3.29Å; V333-M345 WeakPolarHBondContact CG1-SD 3.45Å; L341-M345 HydrophobicContact CD1-CE 3.58Å; L341-M345 HydrophobicContact CD2-CE 3.97Å; L341-M345 HydrophobicContact CG-CE 3.6Å; L341-M345 HydrophobicContact CG-SD 4.2Å; L341-M345 WeakPolarHBondContact O-CB 3.31Å; L341-M345 VanDerWaalsContact O-CG 3.27Å; L341-M345 WeakPolarHBondContact O-CG 3.38Å; L341-M345 PolarHBondContact O-N 3.23Å; L342-M345 PolarHBondContact O-N 2.83Å; T343-M345 VanDerWaalsContact C-N 3.34Å; T343-M345 PolarHBondContact O-N 2.9Å; M345-R348 PolarHBondContact O-N 3.31Å; M345-C349 WeakPolarHBondContact O-CB 3.25Å; M345-C349 PolarHBondContact O-N 3.34Å; M345-C349 PolarHBondContact O-SG 3.32Å; M345-F366 HydrophobicContact CB-CZ 4.11Å
346	M	87.1	Confident	83.9	Confident	12 Å²	12	59.1 Å²	59.1	6%	0.059	30%	0.303	C	S	.	.	H	α-helix	trans	-59.5	-48.1	175.4	-174.4	-178.3	70.9	0	0	111	L342 T343 R348 C349 K350 F370 F378 M381	L342-M346 WeakPolarHBondContact O-CB 3.45Å; L342-M346 PolarHBondContact O-N 3.37Å; T343-M346 PolarHBondContact O-N 3.16Å; M346-R348 PolarHBondContact O-N 2.92Å; M346-C349 PolarHBondContact O-N 3.47Å; M346-K350 WeakPolarHBondContact O-CB 3.37Å; M346-K350 PolarHBondContact O-N 3.27Å; M346-F370 HydrophobicContact SD-CE1 4.08Å; M346-F370 HydrophobicContact SD-CZ 4.35Å; M346-F378 HydrophobicContact CG-CZ 4.41Å; M346-F378 HydrophobicContact SD-CE1 4.29Å; M346-F378 HydrophobicContact SD-CE2 4.09Å; M346-F378 HydrophobicContact SD-CZ 3.67Å; M346-M381 HydrophobicContact CG-CE 4.36Å; M346-M381 HydrophobicContact SD-CE 4.06Å
347	E	86.8	Confident	84.1	Confident	81 Å²	81	51.9 Å²	51.9	38%	0.379	28%	0.276	S	S	.	.	H	α-helix	trans	-66.5	-39.6	-179.2	-165.8	60.2	-152.2	0	0	112	T343 E344 C349 K350 M351	T343-E347 PolarHBondContact O-N 2.99Å; E344-E347 PolarHBondContact O-N 3.05Å; E347-C349 PolarHBondContact O-N 2.89Å; E347-K350 WeakPolarHBondContact O-CB 3.24Å; E347-K350 PolarHBondContact O-N 3.43Å; E347-K350 IonicContact OE1-NZ 2.97Å; E347-K350 IonicContact OE2-NZ 3.6Å; E347-M351 WeakPolarHBondContact O-CG 3.35Å; E347-M351 PolarHBondContact O-N 3.36Å; E347-M351 VanDerWaalsContact O-N 3.16Å
348	R	84.3	Confident	84.3	Confident	104 Å²	104	51.5 Å²	51.5	39%	0.392	27%	0.273	S	S	.	.	H	α-helix	trans	-63.4	-41.7	174.7	-73.4	179.2	-177.6	-142.6	-1.6	112.2	F290 L293 E344 M345 M346 M351	F290-R348 VanDerWaalsContact CD1-NH1 3.33Å; F290-R348 VanDerWaalsContact CE1-NH1 3.29Å; L293-R348 HydrophobicContact CD1-CB 4.14Å; E344-R348 WeakPolarHBondContact O-CB 3.44Å; E344-R348 WeakPolarHBondContact O-CG 3.41Å; E344-R348 PolarHBondContact O-N 2.92Å; E344-R348 IonicContact OE1-CZ 2.88Å; E344-R348 IonicContact OE1-NE 2.71Å; E344-R348 PolarHBondContact OE1-NE 2.77Å; E344-R348 IonicContact OE1-NH2 3.98Å; E344-R348 PolarHBondContact OE1-NH2 3.31Å; M345-R348 PolarHBondContact O-N 3.31Å; M346-R348 PolarHBondContact O-N 2.92Å; R348-M351 PolarHBondContact O-N 2.86Å
349	C	84.6	Confident	84.4	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.007	25%	0.248	C	C	.	.	H	α-helix	trans	-66.9	-37.2	175.8	-73.8	0	0	0	0	112.1	M345 M346 E347 M351 M352 N355 L358 I362	M345-C349 WeakPolarHBondContact O-CB 3.25Å; M345-C349 PolarHBondContact O-N 3.34Å; M345-C349 PolarHBondContact O-SG 3.32Å; M346-C349 PolarHBondContact O-N 3.47Å; E347-C349 PolarHBondContact O-N 2.89Å; C349-M351 VanDerWaalsContact C-N 3.32Å; C349-M351 PolarHBondContact O-N 3.46Å; C349-M352 WeakPolarHBondContact O-CB 3.31Å; C349-M352 PolarHBondContact O-N 3.41Å; C349-N355 VanDerWaalsContact O-CB 3.3Å; C349-N355 WeakPolarHBondContact O-CB 3.47Å; C349-L358 HydrophobicContact CB-CB 4.13Å; C349-L358 HydrophobicContact CB-CD1 4.26Å; C349-I362 HydrophobicContact CB-CD1 3.58Å
350	K	82.9	Confident	84.6	Confident	84 Å²	84	43 Å²	43	37%	0.365	23%	0.226	S	C	.	.	H	α-helix	trans	-60.3	-40.1	176.5	-179.4	-174.2	174.6	-170.9	0	112.3	M346 E347 M352 N355 M381	M346-K350 WeakPolarHBondContact O-CB 3.37Å; M346-K350 PolarHBondContact O-N 3.27Å; E347-K350 WeakPolarHBondContact O-CB 3.24Å; E347-K350 PolarHBondContact O-N 3.43Å; E347-K350 IonicContact OE1-NZ 2.97Å; E347-K350 IonicContact OE2-NZ 3.6Å; K350-M352 PolarHBondContact O-N 3.06Å; K350-N355 PolarHBondContact O-ND2 3.1Å; K350-N355 VanDerWaalsContact O-ND2 3.08Å; K350-M381 HydrophobicContact CB-SD 4.28Å; K350-M381 HydrophobicContact CD-CG 4.35Å; K350-M381 HydrophobicContact CD-SD 3.89Å; K350-M381 HydrophobicContact CG-CG 4.45Å; K350-M381 HydrophobicContact CG-SD 4.04Å
351	M	82.6	Confident	84.6	Confident	140 Å²	140	38.3 Å²	38.3	69%	0.69	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-7.8	179.9	-68.8	-67.1	-125	0	0	114.6	E347 R348 C349	E347-M351 WeakPolarHBondContact O-CG 3.35Å; E347-M351 PolarHBondContact O-N 3.36Å; E347-M351 VanDerWaalsContact O-N 3.16Å; R348-M351 PolarHBondContact O-N 2.86Å; C349-M351 VanDerWaalsContact C-N 3.32Å; C349-M351 PolarHBondContact O-N 3.46Å
352	M	80.6	Confident	84.8	Confident	45 Å²	45	36.9 Å²	36.9	22%	0.222	19%	0.188	C	C	.	.	S	Bend	trans	-80.1	144.5	178.2	-63.5	-62.6	96.7	0	0	111.7	L293 F296 C349 K350 N355 L358	L293-M352 HydrophobicContact CD2-CG 4.3Å; F296-M352 HydrophobicContact CD1-CB 4.26Å; C349-M352 WeakPolarHBondContact O-CB 3.31Å; C349-M352 PolarHBondContact O-N 3.41Å; K350-M352 PolarHBondContact O-N 3.06Å; M352-N355 WeakPolarHBondContact O-CB 3.37Å; M352-L358 HydrophobicContact CB-CD1 4.07Å; M352-L358 HydrophobicContact CG-CD1 4.05Å
353	A	69.9	Low	84.9	Confident	65 Å²	65	36.9 Å²	36.9	54%	0.537	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	142.9	167.9	0	0	0	0	0	109.7	F296 N355	F296-A353 WeakPolarHBondContact CE1-O 3.18Å; A353-N355 VanDerWaalsContact C-N 3.3Å; A353-N355 PolarHBondContact O-N 3.01Å
354	N	74.2	Confident	84.9	Confident	73 Å²	73	38 Å²	38	39%	0.39	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	40.8	-176.2	-60.5	-21.7	0	0	0	113.4	S300 A356	S300-N354 PolarHBondContact OG-ND2 3.2Å; N354-A356 PolarHBondContact O-N 2.8Å; N354-A356 VanDerWaalsContact O-N 3.12Å
355	N	82.9	Confident	84.9	Confident	23 Å²	23	34.9 Å²	34.9	12%	0.123	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-11.7	-177.7	60.8	5	0	0	0	115.3	C349 K350 M352 A353 L357 L358 L359 C385	C349-N355 VanDerWaalsContact O-CB 3.3Å; C349-N355 WeakPolarHBondContact O-CB 3.47Å; K350-N355 PolarHBondContact O-ND2 3.1Å; K350-N355 VanDerWaalsContact O-ND2 3.08Å; M352-N355 WeakPolarHBondContact O-CB 3.37Å; A353-N355 VanDerWaalsContact C-N 3.3Å; A353-N355 PolarHBondContact O-N 3.01Å; N355-L357 VanDerWaalsContact C-N 3.3Å; N355-L357 PolarHBondContact O-N 3.39Å; N355-L358 CarbonylContact O-C 3.19Å; N355-L358 WeakPolarHBondContact O-CA 3.45Å; N355-L358 WeakPolarHBondContact O-CB 3.43Å; N355-L358 PolarHBondContact O-N 3.47Å; N355-L359 HydrophobicContact CB-CG 4.47Å; N355-L359 WeakPolarHBondContact O-CG 3.15Å; N355-L359 PolarHBondContact O-N 3.22Å; N355-C385 PolarHBondContact OD1-SG 3.08Å
356	A	85.4	Confident	85.1	Confident	7 Å²	7	35.2 Å²	35.2	6%	0.058	18%	0.176	C	C	.	.	H	α-helix	trans	-52.8	-43.4	-175.9	0	0	0	0	0	113.3	N354 L358 L359 N360 C385 F390 L395	N354-A356 PolarHBondContact O-N 2.8Å; N354-A356 VanDerWaalsContact O-N 3.12Å; A356-L358 PolarHBondContact O-N 2.81Å; A356-L359 PolarHBondContact O-N 3.15Å; A356-N360 WeakPolarHBondContact O-CB 3.41Å; A356-N360 PolarHBondContact O-N 3.34Å; A356-C385 HydrophobicContact CB-CB 4.22Å; A356-F390 HydrophobicContact CB-CB 3.67Å; A356-F390 HydrophobicContact CB-CD1 4.46Å; A356-F390 HydrophobicContact CB-CG 4.46Å; A356-L395 HydrophobicContact CB-CD1 4.04Å; A356-L395 WeakPolarHBondContact O-CD2 3.46Å
357	L	86.5	Confident	85.2	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-60.7	-43.6	174.7	173	63.7	0	0	0	112.2	F296 L319 Y322 I326 N355 N360 S361 F390	F296-L357 HydrophobicContact CE2-CD2 4.36Å; F296-L357 HydrophobicContact CZ-CD2 4.45Å; L319-L357 HydrophobicContact CD2-CD2 4.25Å; L319-L357 WeakPolarHBondContact O-CD1 3.45Å; Y322-L357 HydrophobicContact CG-CD2 4.25Å; I326-L357 HydrophobicContact CD1-CD2 3.83Å; I326-L357 HydrophobicContact CD1-CG 4.15Å; N355-L357 VanDerWaalsContact C-N 3.3Å; N355-L357 PolarHBondContact O-N 3.39Å; L357-N360 WeakPolarHBondContact O-CB 3.31Å; L357-N360 PolarHBondContact O-N 2.88Å; L357-S361 PolarHBondContact O-N 3.43Å; L357-S361 PolarHBondContact O-OG 3.03Å; L357-F390 HydrophobicContact CD1-CD2 4.33Å; L357-F390 HydrophobicContact CD1-CE2 4.2Å
358	L	88.4	Confident	85.3	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.9	-41.9	178.9	-64.2	172	0	0	0	111.1	L293 F296 I326 C349 M352 N355 A356 S361 I362	L293-L358 HydrophobicContact CD2-CD1 3.65Å; L293-L358 HydrophobicContact CD2-CD2 4.1Å; F296-L358 HydrophobicContact CD1-CD1 4.14Å; F296-L358 HydrophobicContact CD2-CD1 4.11Å; F296-L358 HydrophobicContact CD2-CD2 4.07Å; F296-L358 HydrophobicContact CD2-CG 4.26Å; F296-L358 HydrophobicContact CE1-CD1 3.9Å; F296-L358 HydrophobicContact CE1-CG 4.24Å; F296-L358 HydrophobicContact CE2-CD1 3.87Å; F296-L358 HydrophobicContact CE2-CD2 3.61Å; F296-L358 HydrophobicContact CE2-CG 3.61Å; F296-L358 HydrophobicContact CG-CD1 4.25Å; F296-L358 HydrophobicContact CZ-CD1 3.76Å; F296-L358 HydrophobicContact CZ-CD2 4.16Å; F296-L358 HydrophobicContact CZ-CG 3.61Å; I326-L358 HydrophobicContact CD1-CD2 4.36Å; I326-L358 HydrophobicContact CG2-CD2 4.16Å; C349-L358 HydrophobicContact CB-CB 4.13Å; C349-L358 HydrophobicContact CB-CD1 4.26Å; M352-L358 HydrophobicContact CB-CD1 4.07Å; M352-L358 HydrophobicContact CG-CD1 4.05Å; N355-L358 CarbonylContact O-C 3.19Å; N355-L358 WeakPolarHBondContact O-CA 3.45Å; N355-L358 WeakPolarHBondContact O-CB 3.43Å; N355-L358 PolarHBondContact O-N 3.47Å; A356-L358 PolarHBondContact O-N 2.81Å; L358-S361 PolarHBondContact O-N 2.99Å; L358-I362 VanDerWaalsContact O-CG1 3.31Å; L358-I362 WeakPolarHBondContact O-CG1 3.15Å; L358-I362 PolarHBondContact O-N 3.37Å
359	L	88.6	Confident	85.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-61.5	-43.6	175.7	-68.5	174.9	0	0	0	111.3	N355 A356 S361 I362 M363 M381 L395	N355-L359 HydrophobicContact CB-CG 4.47Å; N355-L359 WeakPolarHBondContact O-CG 3.15Å; N355-L359 PolarHBondContact O-N 3.22Å; A356-L359 PolarHBondContact O-N 3.15Å; L359-S361 VanDerWaalsContact C-N 3.3Å; L359-S361 PolarHBondContact O-N 3.47Å; L359-I362 PolarHBondContact O-N 3.13Å; L359-M363 WeakPolarHBondContact O-CE 3.46Å; L359-M363 WeakPolarHBondContact O-CG 3.45Å; L359-M363 PolarHBondContact O-N 3.06Å; L359-M381 HydrophobicContact CD1-CB 4Å; L359-M381 HydrophobicContact CD2-CB 4.48Å; L359-M381 HydrophobicContact CD2-CE 4.36Å; L359-M381 HydrophobicContact CD2-SD 4.01Å; L359-L395 HydrophobicContact CB-CD2 4.44Å
360	N	89.6	Confident	85.8	Confident	3 Å²	3	39 Å²	39	2%	0.016	20%	0.196	C	C	.	.	H	α-helix	trans	-56.4	-46.3	173.1	-177	62.8	0	0	0	111.6	A356 L357 M363 R364 F390 L395 S398	A356-N360 WeakPolarHBondContact O-CB 3.41Å; A356-N360 PolarHBondContact O-N 3.34Å; L357-N360 WeakPolarHBondContact O-CB 3.31Å; L357-N360 PolarHBondContact O-N 2.88Å; N360-M363 PolarHBondContact O-N 3.01Å; N360-R364 WeakPolarHBondContact O-CG 3.39Å; N360-R364 PolarHBondContact O-N 3.07Å; N360-F390 HydrophobicContact CB-CE1 3.76Å; N360-F390 HydrophobicContact CB-CZ 3.93Å; N360-L395 HydrophobicContact CB-CD2 3.59Å; N360-S398 WeakPolarHBondContact OD1-CB 3.17Å; N360-S398 PolarHBondContact OD1-OG 2.98Å
361	S	88.3	Confident	86.2	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.4	-34.9	-179.7	-65.5	0	0	0	0	113	N327 L357 L358 L359 R364 A365	N327-S361 WeakPolarHBondContact OD1-CA 3.39Å; N327-S361 WeakPolarHBondContact OD1-CB 3.38Å; N327-S361 PolarHBondContact OD1-OG 3.31Å; L357-S361 PolarHBondContact O-N 3.43Å; L357-S361 PolarHBondContact O-OG 3.03Å; L358-S361 PolarHBondContact O-N 2.99Å; L359-S361 VanDerWaalsContact C-N 3.3Å; L359-S361 PolarHBondContact O-N 3.47Å; S361-R364 PolarHBondContact O-N 3.33Å; S361-A365 WeakPolarHBondContact O-CB 3.36Å; S361-A365 PolarHBondContact O-N 3.31Å
362	I	90.1	Very high	86.6	Confident	1 Å²	1	28.4 Å²	28.4	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-60.7	-52.3	172.4	-74.2	165.7	0	0	0	110.2	L330 C349 L358 L359 R364 A365 F366 F378	L330-I362 HydrophobicContact CD1-CG1 3.94Å; C349-I362 HydrophobicContact CB-CD1 3.58Å; L358-I362 VanDerWaalsContact O-CG1 3.31Å; L358-I362 WeakPolarHBondContact O-CG1 3.15Å; L358-I362 PolarHBondContact O-N 3.37Å; L359-I362 PolarHBondContact O-N 3.13Å; I362-R364 PolarHBondContact O-N 3.17Å; I362-A365 PolarHBondContact O-N 3.43Å; I362-A365 VanDerWaalsContact O-N 3.17Å; I362-F366 HydrophobicContact CG1-CE1 4.45Å; I362-F366 HydrophobicContact CG1-CZ 4.24Å; I362-F366 HydrophobicContact CG2-CD1 4.39Å; I362-F366 HydrophobicContact CG2-CD2 3.62Å; I362-F366 HydrophobicContact CG2-CE2 3.76Å; I362-F366 HydrophobicContact CG2-CG 3.96Å; I362-F366 HydrophobicContact CG2-CZ 4.22Å; I362-F366 WeakPolarHBondContact O-CB 3.24Å; I362-F366 PolarHBondContact O-N 3.41Å; I362-F378 HydrophobicContact CG2-CE1 3.97Å; I362-F378 HydrophobicContact CG2-CZ 3.91Å
363	M	90	Very high	87	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.015	16%	0.16	C	C	.	.	H	α-helix	trans	-61.5	-30.9	-178.1	-68.9	-177.1	-70.7	0	0	112.6	L359 N360 V371 F378 I382 L395 L399 S402	L359-M363 WeakPolarHBondContact O-CE 3.46Å; L359-M363 WeakPolarHBondContact O-CG 3.45Å; L359-M363 PolarHBondContact O-N 3.06Å; N360-M363 PolarHBondContact O-N 3.01Å; M363-V371 HydrophobicContact CG-CG1 4.15Å; M363-F378 HydrophobicContact CG-CD1 3.91Å; M363-F378 HydrophobicContact CG-CE1 3.94Å; M363-F378 HydrophobicContact SD-CD1 4.06Å; M363-F378 HydrophobicContact SD-CG 4.44Å; M363-I382 HydrophobicContact CE-CD1 4.23Å; M363-I382 HydrophobicContact SD-CD1 4.27Å; M363-L395 HydrophobicContact CE-CB 4.02Å; M363-L395 HydrophobicContact CE-CD2 3.95Å; M363-L395 WeakPolarHBondContact CE-O 3.46Å; M363-L399 HydrophobicContact SD-CB 3.73Å; M363-L399 HydrophobicContact SD-CD1 4.24Å; M363-S402 PolarHBondContact O-OG 3.09Å
364	R	87	Confident	88.1	Confident	73 Å²	73	29.4 Å²	29.4	28%	0.275	14%	0.143	S	C	.	.	H	α-helix	trans	-81	-31.1	176.7	-73.9	-178.7	167.8	-130.8	-1.1	114.4	N360 S361 I362 S398	N360-R364 WeakPolarHBondContact O-CG 3.39Å; N360-R364 PolarHBondContact O-N 3.07Å; S361-R364 PolarHBondContact O-N 3.33Å; I362-R364 PolarHBondContact O-N 3.17Å; R364-S398 PolarHBondContact NE-OG 3.38Å
365	A	87.3	Confident	88.9	Confident	15 Å²	15	25.9 Å²	25.9	12%	0.124	12%	0.124	C	C	.	.	H	α-helix	trans	-100.8	-27	-170.5	0	0	0	0	0	113.9	L330 Q331 S361 I362	L330-A365 HydrophobicContact CB-CB 3.57Å; Q331-A365 HydrophobicContact CB-CB 4.26Å; S361-A365 WeakPolarHBondContact O-CB 3.36Å; S361-A365 PolarHBondContact O-N 3.31Å; I362-A365 PolarHBondContact O-N 3.43Å; I362-A365 VanDerWaalsContact O-N 3.17Å
366	F	89.9	Confident	89.2	Confident	8 Å²	8	27 Å²	27	4%	0.035	13%	0.132	C	C	.	.	S	Bend	trans	-80.2	164.1	-179.9	-74.9	17.7	0	0	0	110.7	L330 A334 L342 M345 I362 F370 V371	L330-F366 HydrophobicContact CD2-CE1 4.41Å; A334-F366 HydrophobicContact CB-CD1 3.68Å; A334-F366 HydrophobicContact CB-CE1 4.02Å; A334-F366 HydrophobicContact CB-CG 4.48Å; L342-F366 HydrophobicContact CB-CD2 4.19Å; L342-F366 HydrophobicContact CB-CE2 3.83Å; L342-F366 HydrophobicContact CB-CZ 4.45Å; L342-F366 HydrophobicContact CD2-CD1 4.18Å; L342-F366 HydrophobicContact CD2-CD2 4.06Å; L342-F366 HydrophobicContact CD2-CE1 3.96Å; L342-F366 HydrophobicContact CD2-CE2 3.85Å; L342-F366 HydrophobicContact CD2-CG 4.24Å; L342-F366 HydrophobicContact CD2-CZ 3.79Å; L342-F366 HydrophobicContact CG-CE2 4.38Å; M345-F366 HydrophobicContact CB-CZ 4.11Å; I362-F366 HydrophobicContact CG1-CE1 4.45Å; I362-F366 HydrophobicContact CG1-CZ 4.24Å; I362-F366 HydrophobicContact CG2-CD1 4.39Å; I362-F366 HydrophobicContact CG2-CD2 3.62Å; I362-F366 HydrophobicContact CG2-CE2 3.76Å; I362-F366 HydrophobicContact CG2-CG 3.96Å; I362-F366 HydrophobicContact CG2-CZ 4.22Å; I362-F366 WeakPolarHBondContact O-CB 3.24Å; I362-F366 PolarHBondContact O-N 3.41Å; F366-F370 AromaticContact CD2-CD1 3.8Å; F366-F370 HydrophobicContact CD2-CD1 3.8Å; F366-F370 AromaticContact CD2-CE1 3.8Å; F366-F370 HydrophobicContact CD2-CE1 3.8Å; F366-F370 HydrophobicContact CE2-CE1 4.21Å; F366-V371 HydrophobicContact CB-CG2 4.34Å
367	R	89	Confident	89.4	Confident	118 Å²	118	31 Å²	31	45%	0.445	15%	0.153	S	C	.	.			trans	-61.3	132.3	177.2	-58.3	-172.5	-158.6	174	9.9	109.9	A337 E369 F370 V371	A337-R367 PolarHBondContact O-NH2 3.5Å; R367-E369 WeakPolarHBondContact CB-OE2 3.36Å; R367-E369 PolarHBondContact O-N 3.01Å; R367-E369 VanDerWaalsContact O-N 3.16Å; R367-F370 WeakPolarHBondContact O-CB 3.17Å; R367-F370 PolarHBondContact O-N 2.91Å; R367-V371 PolarHBondContact O-N 3.15Å
368	P	88.6	Confident	89.6	Confident	39 Å²	39	31 Å²	31	25%	0.253	15%	0.152	S	C	.	.	H	α-helix	trans	-54.3	-35.4	-179.1	-27.9	36	0	0	0	113.5	F370 V371 A372 C405 A406	P368-F370 VanDerWaalsContact C-N 3.32Å; P368-F370 PolarHBondContact O-N 2.96Å; P368-V371 PolarHBondContact O-N 3.39Å; P368-A372 WeakPolarHBondContact O-CB 3.11Å; P368-A372 PolarHBondContact O-N 3.48Å; P368-C405 HydrophobicContact CB-CB 3.71Å; P368-C405 HydrophobicContact CG-CB 3.8Å; P368-A406 HydrophobicContact CB-CB 3.81Å
369	E	89.8	Confident	89.7	Confident	110 Å²	110	31.4 Å²	31.4	51%	0.514	15%	0.154	S	C	.	.	H	α-helix	trans	-64.1	-36.6	179.7	-55.7	75.9	-164.4	0	0	112.2	R367 V371 T373 A406	R367-E369 WeakPolarHBondContact CB-OE2 3.36Å; R367-E369 PolarHBondContact O-N 3.01Å; R367-E369 VanDerWaalsContact O-N 3.16Å; E369-V371 VanDerWaalsContact C-N 3.34Å; E369-T373 WeakPolarHBondContact O-CB 3.36Å; E369-T373 PolarHBondContact O-N 2.94Å; E369-T373 VanDerWaalsContact O-N 3.1Å; E369-T373 PolarHBondContact O-OG1 3.25Å; E369-A406 HydrophobicContact CB-CB 4.45Å; E369-A406 HydrophobicContact CG-CB 4.05Å
370	F	90.6	Very high	89.6	Confident	12 Å²	12	32.8 Å²	32.8	5%	0.053	17%	0.169	C	C	.	.	H	α-helix	trans	-65.1	-40.7	176.5	178.1	-87.5	0	0	0	111.1	E339 L342 M346 F366 R367 P368	E339-F370 HydrophobicContact CG-CD2 3.91Å; E339-F370 HydrophobicContact CG-CE2 3.8Å; L342-F370 HydrophobicContact CB-CD2 4.29Å; L342-F370 HydrophobicContact CB-CE1 4.49Å; L342-F370 HydrophobicContact CB-CE2 3.84Å; L342-F370 HydrophobicContact CB-CZ 3.97Å; L342-F370 HydrophobicContact CD1-CD2 4.17Å; L342-F370 HydrophobicContact CD1-CG 4.39Å; M346-F370 HydrophobicContact SD-CE1 4.08Å; M346-F370 HydrophobicContact SD-CZ 4.35Å; F366-F370 AromaticContact CD2-CD1 3.8Å; F366-F370 HydrophobicContact CD2-CD1 3.8Å; F366-F370 AromaticContact CD2-CE1 3.8Å; F366-F370 HydrophobicContact CD2-CE1 3.8Å; F366-F370 HydrophobicContact CE2-CE1 4.21Å; R367-F370 WeakPolarHBondContact O-CB 3.17Å; R367-F370 PolarHBondContact O-N 2.91Å; P368-F370 VanDerWaalsContact C-N 3.32Å; P368-F370 PolarHBondContact O-N 2.96Å
371	V	91.2	Very high	89.5	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-72.4	-44.8	179.2	-178.5	0	0	0	0	110.7	M363 F366 R367 P368 E369 T373 R374 A375 F378 L399	M363-V371 HydrophobicContact CG-CG1 4.15Å; F366-V371 HydrophobicContact CB-CG2 4.34Å; R367-V371 PolarHBondContact O-N 3.15Å; P368-V371 PolarHBondContact O-N 3.39Å; E369-V371 VanDerWaalsContact C-N 3.34Å; V371-T373 PolarHBondContact O-N 2.72Å; V371-R374 CarbonylContact O-C 3.59Å; V371-R374 PolarHBondContact O-N 2.81Å; V371-R374 VanDerWaalsContact O-N 3.14Å; V371-A375 WeakPolarHBondContact O-CA 3.27Å; V371-A375 PolarHBondContact O-N 3.24Å; V371-F378 HydrophobicContact CB-CE2 4.28Å; V371-F378 HydrophobicContact CG1-CD2 3.94Å; V371-F378 HydrophobicContact CG1-CE2 3.97Å; V371-F378 HydrophobicContact CG2-CE2 4.34Å; V371-L399 HydrophobicContact CG1-CD1 3.8Å
372	A	89.9	Confident	89.5	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-63	-40.8	-178.5	0	0	0	0	0	112.6	P368 R374 A375 L403 A406 P408	P368-A372 WeakPolarHBondContact O-CB 3.11Å; P368-A372 PolarHBondContact O-N 3.48Å; A372-R374 PolarHBondContact O-N 3.32Å; A372-A375 WeakPolarHBondContact O-CB 3.5Å; A372-A375 PolarHBondContact O-N 2.84Å; A372-L403 HydrophobicContact CB-CD2 3.88Å; A372-A406 HydrophobicContact CB-CB 3.95Å; A372-A406 WeakPolarHBondContact CB-O 3.4Å; A372-P408 VanDerWaalsContact O-CB 3.3Å; A372-P408 WeakPolarHBondContact O-CB 3.31Å
373	T	90.7	Very high	89.3	Confident	82 Å²	82	37.2 Å²	37.2	50%	0.503	19%	0.188	S	C	.	.	H	α-helix	trans	-63.3	-25.8	177	-53.1	0	0	0	0	112.6	E369 V371	E369-T373 WeakPolarHBondContact O-CB 3.36Å; E369-T373 PolarHBondContact O-N 2.94Å; E369-T373 VanDerWaalsContact O-N 3.1Å; E369-T373 PolarHBondContact O-OG1 3.25Å; V371-T373 PolarHBondContact O-N 2.72Å
374	R	91.2	Very high	89.1	Confident	48 Å²	48	43.7 Å²	43.7	18%	0.181	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.5	24	-176.8	-64.4	176.8	179	80.1	-0.2	112.4	E339 V371 A372 T376 D377 F378	E339-R374 IonicContact OE1-CZ 3.83Å; E339-R374 VanDerWaalsContact OE1-CZ 3.28Å; E339-R374 IonicContact OE1-NH1 3.84Å; E339-R374 PolarHBondContact OE1-NH1 3.44Å; E339-R374 IonicContact OE1-NH2 3.86Å; E339-R374 PolarHBondContact OE1-NH2 3Å; V371-R374 CarbonylContact O-C 3.59Å; V371-R374 PolarHBondContact O-N 2.81Å; V371-R374 VanDerWaalsContact O-N 3.14Å; A372-R374 PolarHBondContact O-N 3.32Å; R374-T376 PolarHBondContact O-N 3.28Å; R374-D377 HydrophobicContact CB-CB 4.37Å; R374-D377 WeakPolarHBondContact O-CB 3.39Å; R374-D377 PolarHBondContact O-N 3.47Å; R374-F378 HydrophobicContact CB-CD2 4.25Å; R374-F378 HydrophobicContact CB-CE2 4.24Å; R374-F378 VanDerWaalsContact O-CD2 3.31Å; R374-F378 WeakPolarHBondContact O-CD2 3.48Å; R374-F378 PolarHBondContact O-N 3.26Å
375	A	91.1	Very high	88.9	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-59.5	-34.9	-172.4	0	0	0	0	0	112.7	V371 A372 F378 I379 L399 L403 P408 I416	V371-A375 WeakPolarHBondContact O-CA 3.27Å; V371-A375 PolarHBondContact O-N 3.24Å; A372-A375 WeakPolarHBondContact O-CB 3.5Å; A372-A375 PolarHBondContact O-N 2.84Å; A375-F378 PolarHBondContact O-N 3.46Å; A375-I379 WeakPolarHBondContact O-CG1 3.27Å; A375-I379 PolarHBondContact O-N 2.89Å; A375-L399 HydrophobicContact CB-CD1 4.37Å; A375-L403 HydrophobicContact CB-CD2 3.97Å; A375-P408 HydrophobicContact CB-CB 4.43Å; A375-I416 HydrophobicContact CB-CD1 3.64Å; A375-I416 HydrophobicContact CB-CG1 4.17Å
376	T	90.3	Very high	88.1	Confident	47 Å²	47	44.4 Å²	44.4	29%	0.288	23%	0.23	S	C	.	.	H	α-helix	trans	-65.4	-41.3	175.1	41.3	0	0	0	0	112.5	R374 I379 G380 E412 I416	R374-T376 PolarHBondContact O-N 3.28Å; T376-I379 PolarHBondContact O-N 3.49Å; T376-G380 PolarHBondContact O-N 3.49Å; T376-E412 HydrophobicContact CG2-CB 4.09Å; T376-E412 HydrophobicContact CG2-CG 4.19Å; T376-E412 WeakPolarHBondContact CG2-OE2 3.39Å; T376-E412 PolarHBondContact OG1-OE2 3.09Å; T376-I416 HydrophobicContact CG2-CD1 4.47Å; T376-I416 HydrophobicContact CG2-CG1 4.01Å
377	D	89.1	Confident	86.9	Confident	90 Å²	90	51.2 Å²	51.2	48%	0.481	26%	0.263	S	S	.	.	H	α-helix	trans	-62.4	-44.1	173.1	-63.5	-26.8	0	0	0	111.1	R374 I379 G380 M381	R374-D377 HydrophobicContact CB-CB 4.37Å; R374-D377 WeakPolarHBondContact O-CB 3.39Å; R374-D377 PolarHBondContact O-N 3.47Å; D377-I379 VanDerWaalsContact C-N 3.34Å; D377-I379 PolarHBondContact O-N 3.2Å; D377-G380 PolarHBondContact O-N 3.07Å; D377-M381 WeakPolarHBondContact O-CG 3.15Å; D377-M381 PolarHBondContact O-N 2.87Å
378	F	90.6	Very high	85.5	Confident	1 Å²	1	49.7 Å²	49.7	0%	0.004	27%	0.27	C	S	.	.	H	α-helix	trans	-61.5	-40.5	175.5	-80.7	-74.1	0	0	0	112.2	M346 I362 M363 V371 R374 A375 G380 M381 I382 L399	M346-F378 HydrophobicContact CG-CZ 4.41Å; M346-F378 HydrophobicContact SD-CE1 4.29Å; M346-F378 HydrophobicContact SD-CE2 4.09Å; M346-F378 HydrophobicContact SD-CZ 3.67Å; I362-F378 HydrophobicContact CG2-CE1 3.97Å; I362-F378 HydrophobicContact CG2-CZ 3.91Å; M363-F378 HydrophobicContact CG-CD1 3.91Å; M363-F378 HydrophobicContact CG-CE1 3.94Å; M363-F378 HydrophobicContact SD-CD1 4.06Å; M363-F378 HydrophobicContact SD-CG 4.44Å; V371-F378 HydrophobicContact CB-CE2 4.28Å; V371-F378 HydrophobicContact CG1-CD2 3.94Å; V371-F378 HydrophobicContact CG1-CE2 3.97Å; V371-F378 HydrophobicContact CG2-CE2 4.34Å; R374-F378 HydrophobicContact CB-CD2 4.25Å; R374-F378 HydrophobicContact CB-CE2 4.24Å; R374-F378 VanDerWaalsContact O-CD2 3.31Å; R374-F378 WeakPolarHBondContact O-CD2 3.48Å; R374-F378 PolarHBondContact O-N 3.26Å; A375-F378 PolarHBondContact O-N 3.46Å; F378-G380 VanDerWaalsContact C-N 3.33Å; F378-G380 PolarHBondContact O-N 3.32Å; F378-M381 HydrophobicContact CB-CE 4.33Å; F378-M381 HydrophobicContact CD1-CE 3.44Å; F378-M381 VanDerWaalsContact CD1-CE 3.44Å; F378-M381 HydrophobicContact CD2-CE 4.42Å; F378-M381 HydrophobicContact CE1-CE 3.71Å; F378-M381 HydrophobicContact CG-CE 3.82Å; F378-M381 HydrophobicContact CZ-CE 4.3Å; F378-M381 PolarHBondContact O-N 3.45Å; F378-I382 WeakPolarHBondContact O-CB 3.34Å; F378-I382 WeakPolarHBondContact O-CD1 3.35Å; F378-I382 WeakPolarHBondContact O-CG1 3.48Å; F378-I382 PolarHBondContact O-N 2.98Å; F378-L399 HydrophobicContact CB-CD1 4.23Å
379	I	89.9	Confident	84.8	Confident	8 Å²	8	48.2 Å²	48.2	4%	0.041	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-43.5	173.8	-72.7	163.7	0	0	0	111.2	A375 T376 D377 I382 K383 Y396 L399 I416 E419	A375-I379 WeakPolarHBondContact O-CG1 3.27Å; A375-I379 PolarHBondContact O-N 2.89Å; T376-I379 PolarHBondContact O-N 3.49Å; D377-I379 VanDerWaalsContact C-N 3.34Å; D377-I379 PolarHBondContact O-N 3.2Å; I379-I382 PolarHBondContact O-N 3.48Å; I379-K383 HydrophobicContact CG2-CD 4.25Å; I379-K383 WeakPolarHBondContact O-CG 3.33Å; I379-K383 PolarHBondContact O-N 3.35Å; I379-Y396 HydrophobicContact CG1-CE1 4.25Å; I379-L399 HydrophobicContact CD1-CD2 4.34Å; I379-L399 HydrophobicContact CG1-CD2 3.77Å; I379-I416 HydrophobicContact CD1-CB 3.99Å; I379-I416 HydrophobicContact CD1-CG1 3.96Å; I379-I416 HydrophobicContact CD1-CG2 3.85Å; I379-E419 HydrophobicContact CD1-CB 4.43Å; I379-E419 HydrophobicContact CG2-CB 3.82Å; I379-E419 HydrophobicContact CG2-CG 4.46Å
380	G	87.8	Confident	84.4	Confident	29 Å²	29	43.3 Å²	43.3	30%	0.299	24%	0.239	S	C	.	.	H	α-helix	trans	-56.5	-51.6	174	0	0	0	0	0	111.5	T376 D377 F378 I382 K383 D384	T376-G380 PolarHBondContact O-N 3.49Å; D377-G380 PolarHBondContact O-N 3.07Å; F378-G380 VanDerWaalsContact C-N 3.33Å; F378-G380 PolarHBondContact O-N 3.32Å; G380-I382 VanDerWaalsContact C-N 3.33Å; G380-I382 PolarHBondContact O-N 2.85Å; G380-K383 WeakPolarHBondContact O-CB 3.49Å; G380-K383 PolarHBondContact O-N 3.17Å; G380-K383 VanDerWaalsContact O-N 3.16Å; G380-D384 PolarHBondContact O-N 3.25Å
381	M	87.1	Confident	84.1	Confident	12 Å²	12	44.1 Å²	44.1	6%	0.059	25%	0.246	C	C	.	.	H	α-helix	trans	-60.1	-39.8	178.3	-68.2	-173.8	-73.2	0	0	112.9	M346 K350 L359 D377 F378 K383 D384 C385	M346-M381 HydrophobicContact CG-CE 4.36Å; M346-M381 HydrophobicContact SD-CE 4.06Å; K350-M381 HydrophobicContact CB-SD 4.28Å; K350-M381 HydrophobicContact CD-CG 4.35Å; K350-M381 HydrophobicContact CD-SD 3.89Å; K350-M381 HydrophobicContact CG-CG 4.45Å; K350-M381 HydrophobicContact CG-SD 4.04Å; L359-M381 HydrophobicContact CD1-CB 4Å; L359-M381 HydrophobicContact CD2-CB 4.48Å; L359-M381 HydrophobicContact CD2-CE 4.36Å; L359-M381 HydrophobicContact CD2-SD 4.01Å; D377-M381 WeakPolarHBondContact O-CG 3.15Å; D377-M381 PolarHBondContact O-N 2.87Å; F378-M381 HydrophobicContact CB-CE 4.33Å; F378-M381 HydrophobicContact CD1-CE 3.44Å; F378-M381 VanDerWaalsContact CD1-CE 3.44Å; F378-M381 HydrophobicContact CD2-CE 4.42Å; F378-M381 HydrophobicContact CE1-CE 3.71Å; F378-M381 HydrophobicContact CG-CE 3.82Å; F378-M381 HydrophobicContact CZ-CE 4.3Å; F378-M381 PolarHBondContact O-N 3.45Å; M381-K383 VanDerWaalsContact C-N 3.34Å; M381-K383 PolarHBondContact O-N 3.07Å; M381-D384 PolarHBondContact O-N 3.12Å; M381-C385 PolarHBondContact O-N 3.42Å; M381-C385 PolarHBondContact O-SG 3.21Å
382	I	88.8	Confident	83.9	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-66.9	-35.2	178.7	-68.1	164.5	0	0	0	111.5	M363 F378 I379 G380 D384 C385 L395 Y396 L399	M363-I382 HydrophobicContact CE-CD1 4.23Å; M363-I382 HydrophobicContact SD-CD1 4.27Å; F378-I382 WeakPolarHBondContact O-CB 3.34Å; F378-I382 WeakPolarHBondContact O-CD1 3.35Å; F378-I382 WeakPolarHBondContact O-CG1 3.48Å; F378-I382 PolarHBondContact O-N 2.98Å; I379-I382 PolarHBondContact O-N 3.48Å; G380-I382 VanDerWaalsContact C-N 3.33Å; G380-I382 PolarHBondContact O-N 2.85Å; I382-D384 VanDerWaalsContact C-N 3.35Å; I382-C385 WeakPolarHBondContact O-CB 3.47Å; I382-C385 PolarHBondContact O-N 3.43Å; I382-L395 HydrophobicContact CB-CD1 4.46Å; I382-L395 HydrophobicContact CD1-CB 3.94Å; I382-L395 HydrophobicContact CG1-CB 3.91Å; I382-L395 HydrophobicContact CG1-CD1 4.14Å; I382-L395 HydrophobicContact CG2-CB 4.03Å; I382-L395 HydrophobicContact CG2-CD1 3.95Å; I382-Y396 HydrophobicContact CD1-CE1 4.46Å; I382-Y396 HydrophobicContact CG2-CD2 3.96Å; I382-Y396 HydrophobicContact CG2-CE1 4.35Å; I382-Y396 HydrophobicContact CG2-CE2 3.38Å; I382-L399 HydrophobicContact CD1-CD2 4.33Å
383	K	86.2	Confident	83.7	Confident	86 Å²	86	47.3 Å²	47.3	37%	0.374	26%	0.259	S	S	.	.	H	α-helix	trans	-66.6	-39	176.8	-74.7	170.6	177	177.6	0	112	I379 G380 M381 C385 E419	I379-K383 HydrophobicContact CG2-CD 4.25Å; I379-K383 WeakPolarHBondContact O-CG 3.33Å; I379-K383 PolarHBondContact O-N 3.35Å; G380-K383 WeakPolarHBondContact O-CB 3.49Å; G380-K383 PolarHBondContact O-N 3.17Å; G380-K383 VanDerWaalsContact O-N 3.16Å; M381-K383 VanDerWaalsContact C-N 3.34Å; M381-K383 PolarHBondContact O-N 3.07Å; K383-C385 PolarHBondContact O-N 3.05Å; K383-E419 WeakPolarHBondContact CE-OE2 3.42Å; K383-E419 IonicContact NZ-OE1 3.53Å; K383-E419 IonicContact NZ-OE2 2.8Å; K383-E419 PolarHBondContact NZ-OE2 3.04Å
384	D	84.3	Confident	83.6	Confident	139 Å²	139	45.1 Å²	45.1	74%	0.743	25%	0.245	S	C	*	.	H	α-helix	trans	-73.2	-13.5	-179.3	-64.4	-18.5	0	0	0	113.1	G380 M381 I382	G380-D384 PolarHBondContact O-N 3.25Å; M381-D384 PolarHBondContact O-N 3.12Å; I382-D384 VanDerWaalsContact C-N 3.35Å
385	C	82.7	Confident	83.5	Confident	7 Å²	7	42.9 Å²	42.9	5%	0.047	24%	0.236	C	C	.	.	S	Bend	trans	-67.8	142.4	174	-65.6	0	0	0	0	112.4	N355 A356 M381 I382 K383 K392	N355-C385 PolarHBondContact OD1-SG 3.08Å; A356-C385 HydrophobicContact CB-CB 4.22Å; M381-C385 PolarHBondContact O-N 3.42Å; M381-C385 PolarHBondContact O-SG 3.21Å; I382-C385 WeakPolarHBondContact O-CB 3.47Å; I382-C385 PolarHBondContact O-N 3.43Å; K383-C385 PolarHBondContact O-N 3.05Å; C385-K392 WeakPolarHBondContact O-CE 3.34Å; C385-K392 PolarHBondContact O-NZ 3.2Å
386	D	71.9	Confident	83.5	Confident	95 Å²	95	42.9 Å²	42.9	51%	0.508	24%	0.236	S	C	.	.			trans	-68	141.2	172.7	-168.9	2.3	0	0	0	111.7	S388	D386-S388 VanDerWaalsContact C-N 3.33Å; D386-S388 VanDerWaalsContact CG-OG 3.23Å; D386-S388 PolarHBondContact OD1-N 3.48Å; D386-S388 VanDerWaalsContact OD1-N 3.16Å; D386-S388 PolarHBondContact OD2-OG 3.34Å
387	E	63.3	Low	83.5	Confident	152 Å²	152	40.9 Å²	40.9	71%	0.71	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-17.9	177.7	-66.5	-175	177.2	0	0	112.7	G389 K392	E387-G389 PolarHBondContact O-N 3.2Å; E387-K392 HydrophobicContact CG-CD 3.99Å; E387-K392 VanDerWaalsContact CG-CE 3.47Å; E387-K392 VanDerWaalsContact CG-NZ 3.26Å; E387-K392 IonicContact OE1-NZ 3.39Å; E387-K392 PolarHBondContact OE1-NZ 3.18Å; E387-K392 VanDerWaalsContact OE1-NZ 3.12Å
388	S	61.6	Low	83.6	Confident	85 Å²	85	36.8 Å²	36.8	59%	0.594	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-15.1	178	77.5	0	0	0	0	114.1	D386	D386-S388 VanDerWaalsContact C-N 3.33Å; D386-S388 VanDerWaalsContact CG-OG 3.23Å; D386-S388 PolarHBondContact OD1-N 3.48Å; D386-S388 VanDerWaalsContact OD1-N 3.16Å; D386-S388 PolarHBondContact OD2-OG 3.34Å
389	G	73.4	Confident	83.7	Confident	9 Å²	9	36.7 Å²	36.7	9%	0.093	20%	0.203	C	C	.	.	S	Bend	trans	-100.6	-129	-175.1	0	0	0	0	0	114.2	E387	E387-G389 PolarHBondContact O-N 3.2Å
390	F	80.7	Confident	83.7	Confident	6 Å²	6	36.3 Å²	36.3	3%	0.026	20%	0.201	C	C	.	.	S	Bend	trans	-69.6	135.1	-178.4	-173	-92.1	0	0	0	111	L319 M320 A356 L357 N360 K392 L394 L395	L319-F390 HydrophobicContact CB-CD2 4.17Å; L319-F390 HydrophobicContact CD1-CB 4.13Å; M320-F390 HydrophobicContact CG-CE2 3.97Å; A356-F390 HydrophobicContact CB-CB 3.67Å; A356-F390 HydrophobicContact CB-CD1 4.46Å; A356-F390 HydrophobicContact CB-CG 4.46Å; L357-F390 HydrophobicContact CD1-CD2 4.33Å; L357-F390 HydrophobicContact CD1-CE2 4.2Å; N360-F390 HydrophobicContact CB-CE1 3.76Å; N360-F390 HydrophobicContact CB-CZ 3.93Å; F390-K392 PolarHBondContact O-N 3.23Å; F390-L394 HydrophobicContact CD1-CB 4.42Å; F390-L394 HydrophobicContact CE1-CB 3.5Å; F390-L394 HydrophobicContact CE1-CD1 3.97Å; F390-L394 HydrophobicContact CE1-CG 4.38Å; F390-L394 HydrophobicContact CE2-CD1 4.18Å; F390-L394 HydrophobicContact CZ-CB 3.87Å; F390-L394 HydrophobicContact CZ-CD1 3.65Å; F390-L394 HydrophobicContact CZ-CG 4.43Å; F390-L395 HydrophobicContact CD1-CD2 3.9Å; F390-L395 HydrophobicContact CD1-CG 4.07Å; F390-L395 HydrophobicContact CE1-CD2 3.9Å; F390-L395 HydrophobicContact CE1-CG 4.23Å
391	P	84.4	Confident	83.8	Confident	30 Å²	30	40.9 Å²	40.9	20%	0.195	21%	0.209	C	C	.	.			trans	-62	126.8	-173.1	-22.8	31.9	0	0	0	113.6	P316 H393 L394	P316-P391 HydrophobicContact CB-CG 4Å; P391-H393 VanDerWaalsContact C-N 3.25Å; P391-H393 WeakPolarHBondContact CB-CE1 3.2Å; P391-H393 WeakPolarHBondContact CB-ND1 3.47Å; P391-H393 PolarHBondContact O-N 3.23Å; P391-L394 HydrophobicContact CB-CD1 4.24Å; P391-L394 HydrophobicContact CB-CG 4.24Å; P391-L394 HydrophobicContact CG-CD1 4.08Å; P391-L394 WeakPolarHBondContact O-CB 3.32Å; P391-L394 PolarHBondContact O-N 3.32Å; P391-L394 VanDerWaalsContact O-N 3.12Å
392	K	86.9	Confident	84	Confident	37 Å²	37	40.6 Å²	40.6	16%	0.161	21%	0.208	C	C	.	.	H	α-helix	trans	-59.1	-33.1	-179.6	-69.8	-176.6	176.9	174.3	0	113.5	C385 E387 F390 L394 L395 Y396 V423	C385-K392 WeakPolarHBondContact O-CE 3.34Å; C385-K392 PolarHBondContact O-NZ 3.2Å; E387-K392 HydrophobicContact CG-CD 3.99Å; E387-K392 VanDerWaalsContact CG-CE 3.47Å; E387-K392 VanDerWaalsContact CG-NZ 3.26Å; E387-K392 IonicContact OE1-NZ 3.39Å; E387-K392 PolarHBondContact OE1-NZ 3.18Å; E387-K392 VanDerWaalsContact OE1-NZ 3.12Å; F390-K392 PolarHBondContact O-N 3.23Å; K392-L394 VanDerWaalsContact C-N 3.26Å; K392-L394 PolarHBondContact O-N 3.4Å; K392-L395 WeakPolarHBondContact O-CB 3.34Å; K392-L395 PolarHBondContact O-N 3.09Å; K392-L395 VanDerWaalsContact O-N 3.09Å; K392-Y396 VanDerWaalsContact O-CD2 3.31Å; K392-Y396 WeakPolarHBondContact O-CD2 3.28Å; K392-Y396 PolarHBondContact O-N 3.07Å; K392-Y396 VanDerWaalsContact O-N 3.1Å; K392-V423 HydrophobicContact CB-CG1 4.49Å
393	H	86.6	Confident	84.1	Confident	30 Å²	30	40.6 Å²	40.6	14%	0.139	21%	0.208	C	C	.	.	H	α-helix	trans	-61.9	-35	178.9	68.8	-98	0	0	0	112	P391 L395 Y396 G397 V427 C436	P391-H393 VanDerWaalsContact C-N 3.25Å; P391-H393 WeakPolarHBondContact CB-CE1 3.2Å; P391-H393 WeakPolarHBondContact CB-ND1 3.47Å; P391-H393 PolarHBondContact O-N 3.23Å; H393-L395 VanDerWaalsContact C-N 3.31Å; H393-L395 PolarHBondContact O-N 3.49Å; H393-Y396 PolarHBondContact O-N 3.35Å; H393-G397 PolarHBondContact O-N 2.96Å; H393-V427 HydrophobicContact CB-CG2 3.72Å; H393-C436 PolarHBondContact O-SG 2.91Å
394	L	87.1	Confident	84.2	Confident	37 Å²	37	37.1 Å²	37.1	19%	0.194	20%	0.196	C	C	.	.	H	α-helix	trans	-67.2	-32.9	175.5	-64.1	178.8	0	0	0	112.2	M320 F390 P391 K392 G397 S398	M320-L394 HydrophobicContact CG-CD1 4.45Å; M320-L394 HydrophobicContact SD-CD1 3.79Å; F390-L394 HydrophobicContact CD1-CB 4.42Å; F390-L394 HydrophobicContact CE1-CB 3.5Å; F390-L394 HydrophobicContact CE1-CD1 3.97Å; F390-L394 HydrophobicContact CE1-CG 4.38Å; F390-L394 HydrophobicContact CE2-CD1 4.18Å; F390-L394 HydrophobicContact CZ-CB 3.87Å; F390-L394 HydrophobicContact CZ-CD1 3.65Å; F390-L394 HydrophobicContact CZ-CG 4.43Å; P391-L394 HydrophobicContact CB-CD1 4.24Å; P391-L394 HydrophobicContact CB-CG 4.24Å; P391-L394 HydrophobicContact CG-CD1 4.08Å; P391-L394 WeakPolarHBondContact O-CB 3.32Å; P391-L394 PolarHBondContact O-N 3.32Å; P391-L394 VanDerWaalsContact O-N 3.12Å; K392-L394 VanDerWaalsContact C-N 3.26Å; K392-L394 PolarHBondContact O-N 3.4Å; L394-G397 PolarHBondContact O-N 3.43Å; L394-S398 PolarHBondContact O-N 3.32Å; L394-S398 PolarHBondContact O-OG 3.22Å
395	L	89.8	Confident	84.3	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-66.5	-48.3	174.4	-59.1	174.4	0	0	0	111.1	A356 L359 N360 M363 I382 F390 K392 H393 G397 S398 L399	A356-L395 HydrophobicContact CB-CD1 4.04Å; A356-L395 WeakPolarHBondContact O-CD2 3.46Å; L359-L395 HydrophobicContact CB-CD2 4.44Å; N360-L395 HydrophobicContact CB-CD2 3.59Å; M363-L395 HydrophobicContact CE-CB 4.02Å; M363-L395 HydrophobicContact CE-CD2 3.95Å; M363-L395 WeakPolarHBondContact CE-O 3.46Å; I382-L395 HydrophobicContact CB-CD1 4.46Å; I382-L395 HydrophobicContact CD1-CB 3.94Å; I382-L395 HydrophobicContact CG1-CB 3.91Å; I382-L395 HydrophobicContact CG1-CD1 4.14Å; I382-L395 HydrophobicContact CG2-CB 4.03Å; I382-L395 HydrophobicContact CG2-CD1 3.95Å; F390-L395 HydrophobicContact CD1-CD2 3.9Å; F390-L395 HydrophobicContact CD1-CG 4.07Å; F390-L395 HydrophobicContact CE1-CD2 3.9Å; F390-L395 HydrophobicContact CE1-CG 4.23Å; K392-L395 WeakPolarHBondContact O-CB 3.34Å; K392-L395 PolarHBondContact O-N 3.09Å; K392-L395 VanDerWaalsContact O-N 3.09Å; H393-L395 VanDerWaalsContact C-N 3.31Å; H393-L395 PolarHBondContact O-N 3.49Å; L395-G397 VanDerWaalsContact C-N 3.28Å; L395-G397 PolarHBondContact O-N 3.21Å; L395-S398 PolarHBondContact O-N 3.45Å; L395-L399 PolarHBondContact O-N 2.85Å
396	Y	91.7	Very high	84.6	Confident	1 Å²	1	35.1 Å²	35.1	0%	0.004	19%	0.192	C	C	.	.	H	α-helix	trans	-64.2	-33.8	174.8	-75.9	-70.9	0	0	0	112.3	I379 I382 K392 H393 L399 G400 A420 V423 W440	I379-Y396 HydrophobicContact CG1-CE1 4.25Å; I382-Y396 HydrophobicContact CD1-CE1 4.46Å; I382-Y396 HydrophobicContact CG2-CD2 3.96Å; I382-Y396 HydrophobicContact CG2-CE1 4.35Å; I382-Y396 HydrophobicContact CG2-CE2 3.38Å; K392-Y396 VanDerWaalsContact O-CD2 3.31Å; K392-Y396 WeakPolarHBondContact O-CD2 3.28Å; K392-Y396 PolarHBondContact O-N 3.07Å; K392-Y396 VanDerWaalsContact O-N 3.1Å; H393-Y396 PolarHBondContact O-N 3.35Å; Y396-L399 HydrophobicContact CD1-CD2 4.48Å; Y396-G400 PolarHBondContact O-N 3.27Å; Y396-A420 HydrophobicContact CD1-CB 3.63Å; Y396-A420 HydrophobicContact CE1-CB 3.88Å; Y396-V423 HydrophobicContact CD2-CB 4.1Å; Y396-V423 HydrophobicContact CD2-CG1 3.98Å; Y396-V423 HydrophobicContact CE2-CB 3.68Å; Y396-V423 HydrophobicContact CE2-CG1 3.71Å; Y396-V423 HydrophobicContact CE2-CG2 3.72Å; Y396-W440 PolarHBondContact O-NE1 3.17Å
397	G	90.3	Very high	85.3	Confident	5 Å²	5	34.7 Å²	34.7	5%	0.052	19%	0.19	C	C	.	.	H	α-helix	trans	-62.7	-45.6	171.7	0	0	0	0	0	112.3	H393 L394 L395 G400 R401	H393-G397 PolarHBondContact O-N 2.96Å; L394-G397 PolarHBondContact O-N 3.43Å; L395-G397 VanDerWaalsContact C-N 3.28Å; L395-G397 PolarHBondContact O-N 3.21Å; G397-G400 PolarHBondContact O-N 2.99Å; G397-R401 WeakPolarHBondContact O-CG 3.41Å; G397-R401 PolarHBondContact O-N 3.41Å; G397-R401 VanDerWaalsContact O-N 3.08Å
398	S	89.9	Confident	86.6	Confident	3 Å²	3	27.6 Å²	27.6	2%	0.021	16%	0.157	C	C	.	.	H	α-helix	trans	-66.1	-41.9	176.4	-69	0	0	0	0	112.2	N360 R364 L394 L395 R401 S402	N360-S398 WeakPolarHBondContact OD1-CB 3.17Å; N360-S398 PolarHBondContact OD1-OG 2.98Å; R364-S398 PolarHBondContact NE-OG 3.38Å; L394-S398 PolarHBondContact O-N 3.32Å; L394-S398 PolarHBondContact O-OG 3.22Å; L395-S398 PolarHBondContact O-N 3.45Å; S398-R401 PolarHBondContact O-N 3.21Å; S398-S402 PolarHBondContact O-N 3.23Å; S398-S402 PolarHBondContact O-OG 2.97Å
399	L	92.5	Very high	88	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-58.2	-48.7	172.6	-179.7	61.2	0	0	0	111.1	M363 V371 A375 F378 I379 I382 L395 Y396 R401 S402 L403 W440	M363-L399 HydrophobicContact SD-CB 3.73Å; M363-L399 HydrophobicContact SD-CD1 4.24Å; V371-L399 HydrophobicContact CG1-CD1 3.8Å; A375-L399 HydrophobicContact CB-CD1 4.37Å; F378-L399 HydrophobicContact CB-CD1 4.23Å; I379-L399 HydrophobicContact CD1-CD2 4.34Å; I379-L399 HydrophobicContact CG1-CD2 3.77Å; I382-L399 HydrophobicContact CD1-CD2 4.33Å; L395-L399 PolarHBondContact O-N 2.85Å; Y396-L399 HydrophobicContact CD1-CD2 4.48Å; L399-R401 VanDerWaalsContact C-N 3.26Å; L399-R401 PolarHBondContact O-N 3.43Å; L399-S402 WeakPolarHBondContact O-CB 3.42Å; L399-S402 PolarHBondContact O-N 3.45Å; L399-S402 VanDerWaalsContact O-N 3.11Å; L399-L403 HydrophobicContact CD1-CD1 4.33Å; L399-L403 HydrophobicContact CD1-CG 4.32Å; L399-L403 HydrophobicContact CG-CD1 4.01Å; L399-L403 HydrophobicContact CG-CG 4.39Å; L399-L403 WeakPolarHBondContact O-CG 3.12Å; L399-L403 PolarHBondContact O-N 3.25Å; L399-W440 HydrophobicContact CD2-CH2 4.47Å; L399-W440 HydrophobicContact CD2-CZ2 4.33Å; L399-W440 HydrophobicContact CG-CZ2 4.37Å
400	G	91.3	Very high	88.7	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-57.7	-36.9	178.5	0	0	0	0	0	112.9	Y396 G397 L403 A404	Y396-G400 PolarHBondContact O-N 3.27Å; G397-G400 PolarHBondContact O-N 2.99Å; G400-L403 PolarHBondContact O-N 3.49Å; G400-A404 WeakPolarHBondContact O-CB 3.43Å; G400-A404 PolarHBondContact O-N 2.85Å
401	R	89.8	Confident	89	Confident	124 Å²	124	36.9 Å²	36.9	47%	0.468	20%	0.204	S	C	.	.	H	α-helix	trans	-65.3	-44.3	175.3	-69.4	177	-162.9	-154.5	-1.4	111.6	G397 S398 L399 L403 A404 C405 I439	G397-R401 WeakPolarHBondContact O-CG 3.41Å; G397-R401 PolarHBondContact O-N 3.41Å; G397-R401 VanDerWaalsContact O-N 3.08Å; S398-R401 PolarHBondContact O-N 3.21Å; L399-R401 VanDerWaalsContact C-N 3.26Å; L399-R401 PolarHBondContact O-N 3.43Å; R401-L403 VanDerWaalsContact C-N 3.27Å; R401-L403 PolarHBondContact O-N 2.88Å; R401-A404 PolarHBondContact O-N 3.27Å; R401-C405 PolarHBondContact O-N 2.77Å; R401-I439 HydrophobicContact CG-CD1 3.89Å; R401-I439 HydrophobicContact CG-CG1 4.31Å; R401-I439 HydrophobicContact CG-CG2 3.89Å; R401-I439 VanDerWaalsContact N-CG2 3.34Å
402	S	90.4	Very high	89.3	Confident	7 Å²	7	38.1 Å²	38.1	5%	0.049	21%	0.207	C	C	.	.	H	α-helix	trans	-61.1	-40.6	176	-49.5	0	0	0	0	111	M363 S398 L399 A404 C405 A406	M363-S402 PolarHBondContact O-OG 3.09Å; S398-S402 PolarHBondContact O-N 3.23Å; S398-S402 PolarHBondContact O-OG 2.97Å; L399-S402 WeakPolarHBondContact O-CB 3.42Å; L399-S402 PolarHBondContact O-N 3.45Å; L399-S402 VanDerWaalsContact O-N 3.11Å; S402-A404 VanDerWaalsContact C-N 3.34Å; S402-C405 PolarHBondContact O-N 3.49Å; S402-C405 VanDerWaalsContact O-N 3.17Å; S402-A406 PolarHBondContact O-N 3.32Å
403	L	91.1	Very high	89.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-71.2	-26	177.2	-63	177.8	0	0	0	113.8	A372 A375 L399 G400 R401 C405 A406 P408 I416 W440 F443	A372-L403 HydrophobicContact CB-CD2 3.88Å; A375-L403 HydrophobicContact CB-CD2 3.97Å; L399-L403 HydrophobicContact CD1-CD1 4.33Å; L399-L403 HydrophobicContact CD1-CG 4.32Å; L399-L403 HydrophobicContact CG-CD1 4.01Å; L399-L403 HydrophobicContact CG-CG 4.39Å; L399-L403 WeakPolarHBondContact O-CG 3.12Å; L399-L403 PolarHBondContact O-N 3.25Å; G400-L403 PolarHBondContact O-N 3.49Å; R401-L403 VanDerWaalsContact C-N 3.27Å; R401-L403 PolarHBondContact O-N 2.88Å; L403-C405 VanDerWaalsContact C-N 3.28Å; L403-A406 CarbonylContact C-O 3.26Å; L403-A406 WeakPolarHBondContact CA-O 3.38Å; L403-A406 VanDerWaalsContact O-O 3.07Å; L403-P408 HydrophobicContact CD2-CB 3.99Å; L403-P408 HydrophobicContact CD2-CG 3.89Å; L403-I416 HydrophobicContact CD1-CG2 3.72Å; L403-W440 HydrophobicContact CD1-CH2 3.6Å; L403-W440 HydrophobicContact CD1-CZ2 4.35Å; L403-W440 HydrophobicContact CD1-CZ3 4.04Å; L403-F443 HydrophobicContact CB-CD2 3.82Å; L403-F443 HydrophobicContact CB-CE2 4.1Å; L403-F443 HydrophobicContact CD1-CE2 4.32Å
404	A	87.6	Confident	89.7	Confident	13 Å²	13	40.8 Å²	40.8	11%	0.107	22%	0.221	C	C	.	.	H	α-helix	trans	-71.1	-26.2	171.1	0	0	0	0	0	111.7	G400 R401 S402 R446	G400-A404 WeakPolarHBondContact O-CB 3.43Å; G400-A404 PolarHBondContact O-N 2.85Å; R401-A404 PolarHBondContact O-N 3.27Å; S402-A404 VanDerWaalsContact C-N 3.34Å; A404-R446 PolarHBondContact O-NH1 2.54Å; A404-R446 PolarHBondContact O-NH2 2.85Å
405	C	86.8	Confident	89.9	Confident	94 Å²	94	42.8 Å²	42.8	64%	0.635	24%	0.235	S	C	*	.	H	α-helix	trans	-90.2	-30.1	177.3	-67.5	0	0	0	0	113.8	P368 R401 S402 L403	P368-C405 HydrophobicContact CB-CB 3.71Å; P368-C405 HydrophobicContact CG-CB 3.8Å; R401-C405 PolarHBondContact O-N 2.77Å; S402-C405 PolarHBondContact O-N 3.49Å; S402-C405 VanDerWaalsContact O-N 3.17Å; L403-C405 VanDerWaalsContact C-N 3.28Å
406	A	88.8	Confident	90	Very high	10 Å²	10	42.8 Å²	42.8	8%	0.083	24%	0.235	C	C	.	.	S	Bend	trans	-142.3	140.3	-179	0	0	0	0	0	111.9	P368 E369 A372 S402 L403	P368-A406 HydrophobicContact CB-CB 3.81Å; E369-A406 HydrophobicContact CB-CB 4.45Å; E369-A406 HydrophobicContact CG-CB 4.05Å; A372-A406 HydrophobicContact CB-CB 3.95Å; A372-A406 WeakPolarHBondContact CB-O 3.4Å; S402-A406 PolarHBondContact O-N 3.32Å; L403-A406 CarbonylContact C-O 3.26Å; L403-A406 WeakPolarHBondContact CA-O 3.38Å; L403-A406 VanDerWaalsContact O-O 3.07Å
407	D	88.3	Confident	90	Very high	85 Å²	85	43.1 Å²	43.1	46%	0.455	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-84.5	131.8	-172.8	-61.9	-17.5	0	0	0	111.6	R446 H447	D407-R446 IonicContact OD1-NH1 2.85Å; D407-R446 PolarHBondContact OD1-NH1 2.49Å; D407-H447 IonicContact OD1-CE1 3.12Å; D407-H447 PolarHBondContact OD1-CE1 3.37Å; D407-H447 VanDerWaalsContact OD1-CE1 3.25Å; D407-H447 IonicContact OD1-NE2 3.41Å; D407-H447 PolarHBondContact OD1-NE2 3.04Å; D407-H447 IonicContact OD2-CE1 3.55Å
408	P	90.7	Very high	90.1	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.019	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-77.2	165.7	171.8	34	-35.3	0	0	0	111.2	A372 A375 L403 E410 R413 I416 F443	A372-P408 VanDerWaalsContact O-CB 3.3Å; A372-P408 WeakPolarHBondContact O-CB 3.31Å; A375-P408 HydrophobicContact CB-CB 4.43Å; L403-P408 HydrophobicContact CD2-CB 3.99Å; L403-P408 HydrophobicContact CD2-CG 3.89Å; P408-E410 PolarHBondContact O-N 2.64Å; P408-R413 HydrophobicContact CG-CG 3.94Å; P408-R413 PolarHBondContact O-NE 2.53Å; P408-I416 HydrophobicContact CB-CD1 3.71Å; P408-I416 HydrophobicContact CG-CD1 3.94Å; P408-F443 HydrophobicContact CG-CE2 3.66Å; P408-F443 HydrophobicContact CG-CZ 3.85Å
409	P	90.1	Very high	90.2	Very high	47 Å²	47	49.7 Å²	49.7	31%	0.305	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-53.4	136.5	177.2	-25.4	34.3	0	0	0	112.9	S411 E412 R413	P409-S411 VanDerWaalsContact C-N 3.28Å; P409-S411 PolarHBondContact O-N 3.4Å; P409-E412 HydrophobicContact CB-CG 4.49Å; P409-E412 PolarHBondContact O-N 2.81Å; P409-R413 PolarHBondContact O-N 3.24Å
410	E	87.4	Confident	90.1	Very high	146 Å²	146	49.7 Å²	49.7	68%	0.682	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-37.8	-170.4	-48.2	-150.6	123.6	0	0	113.5	P408 E412 R413	P408-E410 PolarHBondContact O-N 2.64Å; E410-E412 PolarHBondContact O-N 2.92Å; E410-R413 PolarHBondContact O-N 2.95Å; E410-R413 IonicContact OE1-CZ 2.68Å; E410-R413 IonicContact OE1-NH1 3.95Å; E410-R413 PolarHBondContact OE1-NH1 3.17Å; E410-R413 IonicContact OE1-NH2 3.45Å
411	S	88.6	Confident	90.1	Very high	102 Å²	102	51 Å²	51	71%	0.713	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.4	178.6	49.7	0	0	0	0	113.5	P409	P409-S411 VanDerWaalsContact C-N 3.28Å; P409-S411 PolarHBondContact O-N 3.4Å
412	E	90.1	Very high	90.2	Very high	57 Å²	57	51.1 Å²	51.1	27%	0.266	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-17.8	-173.9	-63.9	-177.7	-160.9	0	0	112.9	T376 P409 E410 L414 T415 I416	T376-E412 HydrophobicContact CG2-CB 4.09Å; T376-E412 HydrophobicContact CG2-CG 4.19Å; T376-E412 WeakPolarHBondContact CG2-OE2 3.39Å; T376-E412 PolarHBondContact OG1-OE2 3.09Å; P409-E412 HydrophobicContact CB-CG 4.49Å; P409-E412 PolarHBondContact O-N 2.81Å; E410-E412 PolarHBondContact O-N 2.92Å; E412-L414 PolarHBondContact O-N 3.21Å; E412-T415 WeakPolarHBondContact O-CB 3.25Å; E412-T415 PolarHBondContact O-N 2.76Å; E412-T415 VanDerWaalsContact O-N 3.08Å; E412-I416 HydrophobicContact CB-CD1 3.87Å; E412-I416 HydrophobicContact CB-CG1 4.39Å; E412-I416 VanDerWaalsContact O-CG1 3.27Å; E412-I416 WeakPolarHBondContact O-CG1 3.19Å; E412-I416 PolarHBondContact O-N 2.84Å
413	R	91.6	Very high	90.1	Very high	39 Å²	39	52.8 Å²	52.8	15%	0.147	29%	0.287	C	S	.	.	H	α-helix	trans	-49.6	-50.4	-174.5	-73.2	173.2	-174.6	162.3	-1.3	113.4	P408 P409 E410 I416 L417 F443 F448	P408-R413 HydrophobicContact CG-CG 3.94Å; P408-R413 PolarHBondContact O-NE 2.53Å; P409-R413 PolarHBondContact O-N 3.24Å; E410-R413 PolarHBondContact O-N 2.95Å; E410-R413 IonicContact OE1-CZ 2.68Å; E410-R413 IonicContact OE1-NH1 3.95Å; E410-R413 PolarHBondContact OE1-NH1 3.17Å; E410-R413 IonicContact OE1-NH2 3.45Å; R413-I416 PolarHBondContact O-N 3.1Å; R413-L417 PolarHBondContact O-N 3.42Å; R413-F443 HydrophobicContact CB-CZ 4.36Å; R413-F443 HydrophobicContact CG-CZ 4.29Å; R413-F448 HydrophobicContact CB-CZ 3.95Å
414	L	89.6	Confident	90.1	Very high	84 Å²	84	52.8 Å²	52.8	44%	0.44	29%	0.287	S	S	.	.	H	α-helix	trans	-66	-40.5	-177.9	-176.7	64.1	0	0	0	111.9	E412 L417 N418 F448	E412-L414 PolarHBondContact O-N 3.21Å; L414-L417 PolarHBondContact O-N 3.32Å; L414-N418 WeakPolarHBondContact O-CB 3.47Å; L414-N418 VanDerWaalsContact O-CG 3.29Å; L414-N418 PolarHBondContact O-N 3.25Å; L414-N418 PolarHBondContact O-ND2 3.45Å; L414-F448 HydrophobicContact CB-CE1 4Å; L414-F448 HydrophobicContact CB-CZ 4.5Å; L414-F448 HydrophobicContact CD1-CD1 4.39Å; L414-F448 HydrophobicContact CD1-CE1 3.75Å; L414-F448 HydrophobicContact CG-CE1 4.5Å
415	T	91.5	Very high	90.3	Very high	78 Å²	78	54.2 Å²	54.2	48%	0.479	30%	0.295	S	S	.	.	H	α-helix	trans	-64.2	-43.8	177.1	-52.6	0	0	0	0	110.6	E412 N418 E419	E412-T415 WeakPolarHBondContact O-CB 3.25Å; E412-T415 PolarHBondContact O-N 2.76Å; E412-T415 VanDerWaalsContact O-N 3.08Å; T415-N418 PolarHBondContact O-N 3.22Å; T415-E419 HydrophobicContact CG2-CG 4.42Å; T415-E419 WeakPolarHBondContact O-CB 3.47Å; T415-E419 WeakPolarHBondContact O-CG 3.38Å; T415-E419 PolarHBondContact O-N 2.98Å
416	I	92.6	Very high	90.5	Very high	0 Å²	0	57 Å²	57	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58.1	-50.1	176.5	-68.4	162.1	0	0	0	110.4	A375 T376 I379 L403 P408 E412 R413 E419 A420 W440 F443	A375-I416 HydrophobicContact CB-CD1 3.64Å; A375-I416 HydrophobicContact CB-CG1 4.17Å; T376-I416 HydrophobicContact CG2-CD1 4.47Å; T376-I416 HydrophobicContact CG2-CG1 4.01Å; I379-I416 HydrophobicContact CD1-CB 3.99Å; I379-I416 HydrophobicContact CD1-CG1 3.96Å; I379-I416 HydrophobicContact CD1-CG2 3.85Å; L403-I416 HydrophobicContact CD1-CG2 3.72Å; P408-I416 HydrophobicContact CB-CD1 3.71Å; P408-I416 HydrophobicContact CG-CD1 3.94Å; E412-I416 HydrophobicContact CB-CD1 3.87Å; E412-I416 HydrophobicContact CB-CG1 4.39Å; E412-I416 VanDerWaalsContact O-CG1 3.27Å; E412-I416 WeakPolarHBondContact O-CG1 3.19Å; E412-I416 PolarHBondContact O-N 2.84Å; R413-I416 PolarHBondContact O-N 3.1Å; I416-E419 PolarHBondContact O-N 3.45Å; I416-A420 WeakPolarHBondContact O-CB 3.41Å; I416-A420 PolarHBondContact O-N 3.06Å; I416-W440 HydrophobicContact CG2-CH2 3.84Å; I416-W440 HydrophobicContact CG2-CZ3 4.07Å; I416-F443 HydrophobicContact CG2-CZ 4.48Å
417	L	91.6	Very high	90.5	Very high	9 Å²	9	57.4 Å²	57.4	5%	0.047	30%	0.297	C	S	.	.	H	α-helix	trans	-60.2	-49.6	178.8	-179.3	63.5	0	0	0	111.3	R413 L414 E419 A420 W421 W440 F443 T444 F448 E452	R413-L417 PolarHBondContact O-N 3.42Å; L414-L417 PolarHBondContact O-N 3.32Å; L417-E419 PolarHBondContact O-N 2.87Å; L417-A420 PolarHBondContact O-N 3.3Å; L417-W421 HydrophobicContact CD1-CE3 4.44Å; L417-W421 WeakPolarHBondContact O-CB 3.46Å; L417-W421 PolarHBondContact O-N 3Å; L417-W440 HydrophobicContact CD1-CE3 4.07Å; L417-W440 HydrophobicContact CD1-CZ3 4.47Å; L417-F443 HydrophobicContact CB-CE1 4.31Å; L417-F443 HydrophobicContact CD1-CD1 4.47Å; L417-T444 HydrophobicContact CD2-CG2 4.28Å; L417-F448 HydrophobicContact CB-CE2 4.28Å; L417-F448 HydrophobicContact CB-CZ 4.08Å; L417-F448 HydrophobicContact CD2-CD2 4.05Å; L417-F448 HydrophobicContact CD2-CE1 4.37Å; L417-F448 HydrophobicContact CD2-CE2 3.75Å; L417-F448 HydrophobicContact CD2-CG 4.46Å; L417-F448 HydrophobicContact CD2-CZ 3.9Å; L417-E452 HydrophobicContact CD2-CB 4.45Å
418	N	91.7	Very high	90.5	Very high	91 Å²	91	64.7 Å²	64.7	49%	0.487	32%	0.319	S	S	.	.	H	α-helix	trans	-62.2	-42.5	-177.3	-75.2	-29.4	0	0	0	112.5	L414 T415 K422	L414-N418 WeakPolarHBondContact O-CB 3.47Å; L414-N418 VanDerWaalsContact O-CG 3.29Å; L414-N418 PolarHBondContact O-N 3.25Å; L414-N418 PolarHBondContact O-ND2 3.45Å; T415-N418 PolarHBondContact O-N 3.22Å; N418-K422 VanDerWaalsContact O-CB 3.29Å; N418-K422 WeakPolarHBondContact O-CB 3.4Å; N418-K422 PolarHBondContact O-N 3.44Å; N418-K422 VanDerWaalsContact O-N 3.07Å
419	E	91.4	Very high	90.4	Very high	55 Å²	55	68 Å²	68	26%	0.257	34%	0.336	S	S	.	.	H	α-helix	trans	-70.8	-39.6	-179.8	-69.8	-59.8	158	0	0	112.5	I379 K383 T415 I416 L417	I379-E419 HydrophobicContact CD1-CB 4.43Å; I379-E419 HydrophobicContact CG2-CB 3.82Å; I379-E419 HydrophobicContact CG2-CG 4.46Å; K383-E419 WeakPolarHBondContact CE-OE2 3.42Å; K383-E419 IonicContact NZ-OE1 3.53Å; K383-E419 IonicContact NZ-OE2 2.8Å; K383-E419 PolarHBondContact NZ-OE2 3.04Å; T415-E419 HydrophobicContact CG2-CG 4.42Å; T415-E419 WeakPolarHBondContact O-CB 3.47Å; T415-E419 WeakPolarHBondContact O-CG 3.38Å; T415-E419 PolarHBondContact O-N 2.98Å; I416-E419 PolarHBondContact O-N 3.45Å; L417-E419 PolarHBondContact O-N 2.87Å
420	A	91.3	Very high	90.5	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-66.3	-49	173.9	0	0	0	0	0	111.5	Y396 I416 L417 K422 V423 I424 W440	Y396-A420 HydrophobicContact CD1-CB 3.63Å; Y396-A420 HydrophobicContact CE1-CB 3.88Å; I416-A420 WeakPolarHBondContact O-CB 3.41Å; I416-A420 PolarHBondContact O-N 3.06Å; L417-A420 PolarHBondContact O-N 3.3Å; A420-K422 VanDerWaalsContact C-N 3.3Å; A420-K422 PolarHBondContact O-N 2.89Å; A420-V423 PolarHBondContact O-N 3.37Å; A420-I424 HydrophobicContact CB-CD1 4.32Å; A420-I424 WeakPolarHBondContact O-CG1 3.4Å; A420-I424 PolarHBondContact O-N 3.44Å; A420-W440 HydrophobicContact CB-CD2 4.45Å; A420-W440 HydrophobicContact CB-CE3 4.42Å; A420-W440 HydrophobicContact CB-CH2 3.46Å; A420-W440 VanDerWaalsContact CB-CH2 3.46Å; A420-W440 HydrophobicContact CB-CZ2 3.49Å; A420-W440 VanDerWaalsContact CB-CZ2 3.49Å; A420-W440 HydrophobicContact CB-CZ3 3.96Å
421	W	92.2	Very high	90.6	Very high	27 Å²	27	62.7 Å²	62.7	10%	0.102	31%	0.31	C	S	.	.	H	α-helix	trans	-63.8	-34.9	-175.8	-153.8	-97.8	0	0	0	112.2	L417 V423 I424 T425 A437 W440 V456 D459	L417-W421 HydrophobicContact CD1-CE3 4.44Å; L417-W421 WeakPolarHBondContact O-CB 3.46Å; L417-W421 PolarHBondContact O-N 3Å; W421-V423 PolarHBondContact O-N 3.08Å; W421-V423 VanDerWaalsContact O-N 3.13Å; W421-I424 HydrophobicContact CE3-CD1 4.27Å; W421-I424 HydrophobicContact CZ3-CG2 4.44Å; W421-I424 PolarHBondContact O-N 3.24Å; W421-T425 PolarHBondContact NE1-OG1 3.07Å; W421-T425 VanDerWaalsContact NE1-OG1 3.08Å; W421-T425 WeakPolarHBondContact O-CB 3.04Å; W421-T425 PolarHBondContact O-N 3.06Å; W421-T425 PolarHBondContact O-OG1 3.22Å; W421-T425 VanDerWaalsContact O-OG1 3.1Å; W421-A437 HydrophobicContact CH2-CB 4.15Å; W421-W440 HydrophobicContact CE3-CB 4.35Å; W421-W440 HydrophobicContact CZ3-CB 3.81Å; W421-V456 HydrophobicContact CD2-CG2 4.29Å; W421-V456 HydrophobicContact CE3-CG2 4.33Å; W421-V456 HydrophobicContact CH2-CB 4.14Å; W421-V456 HydrophobicContact CH2-CG1 3.45Å; W421-V456 VanDerWaalsContact CH2-CG1 3.45Å; W421-V456 HydrophobicContact CH2-CG2 3.89Å; W421-V456 HydrophobicContact CZ2-CB 4.03Å; W421-V456 HydrophobicContact CZ2-CG1 3.76Å; W421-V456 HydrophobicContact CZ2-CG2 3.81Å; W421-V456 HydrophobicContact CZ3-CG1 4.21Å; W421-V456 HydrophobicContact CZ3-CG2 4.13Å; W421-D459 HydrophobicContact CZ2-CB 4.16Å; W421-D459 PolarHBondContact NE1-OD2 3.3Å
422	K	90.7	Very high	90.6	Very high	127 Å²	127	60.2 Å²	60.2	55%	0.552	29%	0.289	S	S	*	.	H	α-helix	trans	-56.4	-29.3	174.3	-176.4	177.9	-179.7	-178.9	0	113.7	N418 A420 K426	N418-K422 VanDerWaalsContact O-CB 3.29Å; N418-K422 WeakPolarHBondContact O-CB 3.4Å; N418-K422 PolarHBondContact O-N 3.44Å; N418-K422 VanDerWaalsContact O-N 3.07Å; A420-K422 VanDerWaalsContact C-N 3.3Å; A420-K422 PolarHBondContact O-N 2.89Å; K422-K426 WeakPolarHBondContact O-CE 3.29Å
423	V	89	Confident	90.8	Very high	42 Å²	42	57.5 Å²	57.5	26%	0.255	28%	0.277	S	S	.	.	H	α-helix	trans	-90.4	-43.2	175.8	-177.3	0	0	0	0	110.8	K392 Y396 A420 W421 T425 K426	K392-V423 HydrophobicContact CB-CG1 4.49Å; Y396-V423 HydrophobicContact CD2-CB 4.1Å; Y396-V423 HydrophobicContact CD2-CG1 3.98Å; Y396-V423 HydrophobicContact CE2-CB 3.68Å; Y396-V423 HydrophobicContact CE2-CG1 3.71Å; Y396-V423 HydrophobicContact CE2-CG2 3.72Å; A420-V423 PolarHBondContact O-N 3.37Å; W421-V423 PolarHBondContact O-N 3.08Å; W421-V423 VanDerWaalsContact O-N 3.13Å; V423-T425 PolarHBondContact O-N 3.01Å; V423-K426 WeakPolarHBondContact O-CB 3.36Å; V423-K426 PolarHBondContact O-N 2.98Å; V423-K426 VanDerWaalsContact O-N 3.09Å
424	I	90.8	Very high	90.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.6	-45.2	-177.9	-64.8	165.2	0	0	0	111.4	A420 W421 K426 V427 Y433 C436 W440	A420-I424 HydrophobicContact CB-CD1 4.32Å; A420-I424 WeakPolarHBondContact O-CG1 3.4Å; A420-I424 PolarHBondContact O-N 3.44Å; W421-I424 HydrophobicContact CE3-CD1 4.27Å; W421-I424 HydrophobicContact CZ3-CG2 4.44Å; W421-I424 PolarHBondContact O-N 3.24Å; I424-K426 PolarHBondContact O-N 3.35Å; I424-V427 WeakPolarHBondContact O-CB 3.32Å; I424-V427 VanDerWaalsContact O-CG2 3.29Å; I424-V427 WeakPolarHBondContact O-CG2 3.27Å; I424-V427 PolarHBondContact O-N 2.82Å; I424-Y433 HydrophobicContact CG2-CD2 4.01Å; I424-Y433 HydrophobicContact CG2-CE2 3.94Å; I424-Y433 WeakPolarHBondContact O-CD2 3.37Å; I424-C436 HydrophobicContact CG1-CB 4.46Å; I424-C436 HydrophobicContact CG2-CB 4.13Å; I424-W440 VanDerWaalsContact CD1-CD1 3.46Å; I424-W440 HydrophobicContact CD1-CD2 4.23Å; I424-W440 HydrophobicContact CD1-CG 3.88Å
425	T	92.2	Very high	91	Very high	43 Å²	43	55.1 Å²	55.1	26%	0.264	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-12.8	176.9	-61.2	0	0	0	0	114.1	W421 V423 D459 H463	W421-T425 PolarHBondContact NE1-OG1 3.07Å; W421-T425 VanDerWaalsContact NE1-OG1 3.08Å; W421-T425 WeakPolarHBondContact O-CB 3.04Å; W421-T425 PolarHBondContact O-N 3.06Å; W421-T425 PolarHBondContact O-OG1 3.22Å; W421-T425 VanDerWaalsContact O-OG1 3.1Å; V423-T425 PolarHBondContact O-N 3.01Å; T425-D459 WeakPolarHBondContact CB-OD2 3.49Å; T425-D459 WeakPolarHBondContact CG2-OD2 3.42Å; T425-D459 PolarHBondContact OG1-OD2 3.14Å; T425-H463 PolarHBondContact O-CE1 3.25Å; T425-H463 PolarHBondContact O-NE2 2.94Å; T425-H463 VanDerWaalsContact O-NE2 3.15Å
426	K	91.2	Very high	91	Very high	152 Å²	152	51.5 Å²	51.5	66%	0.661	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-3.9	177.9	-63.2	179.9	-179.3	-179	0	113.3	K422 V423 I424 R428	K422-K426 WeakPolarHBondContact O-CE 3.29Å; V423-K426 WeakPolarHBondContact O-CB 3.36Å; V423-K426 PolarHBondContact O-N 2.98Å; V423-K426 VanDerWaalsContact O-N 3.09Å; I424-K426 PolarHBondContact O-N 3.35Å; K426-R428 PolarHBondContact O-N 3.42Å
427	V	88.4	Confident	91.1	Very high	19 Å²	19	51.5 Å²	51.5	12%	0.115	25%	0.245	C	C	.	.			trans	-69.5	120.3	179.5	179.2	0	0	0	0	109.2	H393 I424 D432	H393-V427 HydrophobicContact CB-CG2 3.72Å; I424-V427 WeakPolarHBondContact O-CB 3.32Å; I424-V427 VanDerWaalsContact O-CG2 3.29Å; I424-V427 WeakPolarHBondContact O-CG2 3.27Å; I424-V427 PolarHBondContact O-N 2.82Å; V427-D432 HydrophobicContact CG1-CB 3.87Å
428	R	88.2	Confident	91.1	Very high	238 Å²	238	53.2 Å²	53.2	90%	0.898	25%	0.253	S	S	*	.			trans	-80.8	-34.1	-173.9	-64.5	-176.9	-177.7	174.4	0.9	113.7	K426 P430	K426-R428 PolarHBondContact O-N 3.42Å; R428-P430 WeakPolarHBondContact O-CD 3.35Å
429	N	89.1	Confident	91.2	Very high	72 Å²	72	49.6 Å²	49.6	39%	0.385	23%	0.233	S	C	.	.	S	Bend	trans	-76.6	119.1	179.7	-178.9	-12	0	0	0	109.2	Q431 D432 Y433	N429-Q431 VanDerWaalsContact C-N 3.28Å; N429-Q431 PolarHBondContact O-N 3.41Å; N429-Q431 PolarHBondContact OD1-N 3.07Å; N429-D432 HydrophobicContact CB-CB 4.08Å; N429-D432 WeakPolarHBondContact CB-OD2 3.46Å; N429-D432 PolarHBondContact ND2-OD2 3.39Å; N429-D432 PolarHBondContact O-N 2.84Å; N429-Y433 WeakPolarHBondContact O-CB 3.4Å; N429-Y433 PolarHBondContact O-N 3.37Å
430	P	90.8	Very high	91.3	Very high	38 Å²	38	47 Å²	47	25%	0.247	22%	0.221	C	C	.	.	H	α-helix	trans	-57.5	-37.3	-179	-25.9	35.3	0	0	0	113.7	R428 Y433 M434 M464 A469	R428-P430 WeakPolarHBondContact O-CD 3.35Å; P430-Y433 PolarHBondContact O-N 2.95Å; P430-M434 VanDerWaalsContact O-CB 3.31Å; P430-M434 WeakPolarHBondContact O-CB 3.49Å; P430-M434 PolarHBondContact O-N 2.88Å; P430-M464 HydrophobicContact CB-SD 4Å; P430-A469 HydrophobicContact CB-CB 3.62Å; P430-A469 HydrophobicContact CG-CB 3.84Å
431	Q	89.9	Confident	91.4	Very high	43 Å²	43	47.1 Å²	47.1	20%	0.201	22%	0.222	C	C	.	.	H	α-helix	trans	-69	-45	-179.4	-65.3	-61.3	-20	0	0	111.7	N429 Y433 M434 N435 E472	N429-Q431 VanDerWaalsContact C-N 3.28Å; N429-Q431 PolarHBondContact O-N 3.41Å; N429-Q431 PolarHBondContact OD1-N 3.07Å; Q431-Y433 VanDerWaalsContact C-N 3.32Å; Q431-Y433 PolarHBondContact O-N 3.12Å; Q431-M434 PolarHBondContact O-N 3.26Å; Q431-N435 WeakPolarHBondContact O-CB 3.14Å; Q431-N435 PolarHBondContact O-N 2.87Å; Q431-N435 PolarHBondContact O-ND2 3.39Å; Q431-N435 VanDerWaalsContact O-ND2 3.11Å; Q431-E472 PolarHBondContact NE2-OE2 3.2Å; Q431-E472 VanDerWaalsContact NE2-OE2 3.15Å
432	D	89.3	Confident	91.4	Very high	51 Å²	51	47.5 Å²	47.5	27%	0.273	23%	0.225	S	C	.	.	H	α-helix	trans	-66.2	-37.3	177.6	-63.7	-31.6	0	0	0	111.6	V427 N429 C436	V427-D432 HydrophobicContact CG1-CB 3.87Å; N429-D432 HydrophobicContact CB-CB 4.08Å; N429-D432 WeakPolarHBondContact CB-OD2 3.46Å; N429-D432 PolarHBondContact ND2-OD2 3.39Å; N429-D432 PolarHBondContact O-N 2.84Å; D432-C436 PolarHBondContact O-N 2.93Å; D432-C436 PolarHBondContact O-SG 3.22Å
433	Y	94.1	Very high	91.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.5	-51.8	172.5	170.4	-92.8	0	0	0	110.8	I424 N429 P430 Q431 N435 C436 A437 D459 I460 H463	I424-Y433 HydrophobicContact CG2-CD2 4.01Å; I424-Y433 HydrophobicContact CG2-CE2 3.94Å; I424-Y433 WeakPolarHBondContact O-CD2 3.37Å; N429-Y433 WeakPolarHBondContact O-CB 3.4Å; N429-Y433 PolarHBondContact O-N 3.37Å; P430-Y433 PolarHBondContact O-N 2.95Å; Q431-Y433 VanDerWaalsContact C-N 3.32Å; Q431-Y433 PolarHBondContact O-N 3.12Å; Y433-N435 VanDerWaalsContact C-N 3.34Å; Y433-N435 PolarHBondContact O-N 3.26Å; Y433-C436 WeakPolarHBondContact O-CB 3.44Å; Y433-C436 PolarHBondContact O-N 2.82Å; Y433-A437 HydrophobicContact CD1-CB 4.42Å; Y433-A437 HydrophobicContact CE1-CB 3.94Å; Y433-A437 WeakPolarHBondContact O-CB 3.4Å; Y433-A437 PolarHBondContact O-N 3.42Å; Y433-D459 VanDerWaalsContact OH-C 3.25Å; Y433-D459 PolarHBondContact OH-O 2.89Å; Y433-D459 PolarHBondContact OH-OD2 2.97Å; Y433-I460 HydrophobicContact CE1-CB 4.48Å; Y433-I460 HydrophobicContact CE1-CG1 4.11Å; Y433-I460 PolarHBondContact OH-N 3.33Å; Y433-H463 HydrophobicContact CD1-CB 3.68Å; Y433-H463 AromaticContact CD1-CG 3.99Å; Y433-H463 HydrophobicContact CE1-CB 3.68Å; Y433-H463 AromaticContact CE1-CG 3.91Å; Y433-H463 AromaticContact CE2-CE1 3.85Å; Y433-H463 AromaticContact CE2-CG 3.95Å; Y433-H463 AromaticContact CE2-ND1 3.71Å; Y433-H463 HydrophobicContact CG-CB 4.18Å; Y433-H463 AromaticContact CZ-CG 3.89Å; Y433-H463 AromaticContact CZ-ND1 3.62Å
434	M	93.8	Very high	91.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.6	-40.5	-175.5	-168.6	63.3	-147.9	0	0	111.9	P430 Q431 C436 A437 E438 I460 M464 A473 Q476 L477 V480	P430-M434 VanDerWaalsContact O-CB 3.31Å; P430-M434 WeakPolarHBondContact O-CB 3.49Å; P430-M434 PolarHBondContact O-N 2.88Å; Q431-M434 PolarHBondContact O-N 3.26Å; M434-C436 PolarHBondContact O-N 3.17Å; M434-A437 PolarHBondContact O-N 3.31Å; M434-E438 HydrophobicContact CE-CB 4.26Å; M434-E438 WeakPolarHBondContact O-CB 3.4Å; M434-E438 PolarHBondContact O-N 3.12Å; M434-I460 HydrophobicContact SD-CG2 4.02Å; M434-M464 HydrophobicContact CB-CE 4.41Å; M434-M464 HydrophobicContact CB-SD 4.1Å; M434-M464 HydrophobicContact CG-CE 4.48Å; M434-M464 HydrophobicContact CG-SD 4.49Å; M434-M464 HydrophobicContact SD-CG 4.42Å; M434-M464 HydrophobicContact SD-SD 4.36Å; M434-A473 HydrophobicContact CG-CB 4.26Å; M434-Q476 HydrophobicContact CE-CB 3.87Å; M434-Q476 HydrophobicContact CG-CB 3.7Å; M434-Q476 HydrophobicContact CG-CG 4.32Å; M434-L477 HydrophobicContact CE-CD2 3.82Å; M434-L477 HydrophobicContact CE-CG 4.41Å; M434-L477 HydrophobicContact SD-CD2 3.87Å; M434-V480 HydrophobicContact CE-CG2 3.51Å
435	N	90.9	Very high	91.8	Very high	72 Å²	72	39.8 Å²	39.8	39%	0.385	19%	0.189	S	C	.	.	H	α-helix	trans	-57.9	-30.7	174.4	-73.2	-29.9	0	0	0	112.8	Q431 Y433 I439	Q431-N435 WeakPolarHBondContact O-CB 3.14Å; Q431-N435 PolarHBondContact O-N 2.87Å; Q431-N435 PolarHBondContact O-ND2 3.39Å; Q431-N435 VanDerWaalsContact O-ND2 3.11Å; Y433-N435 VanDerWaalsContact C-N 3.34Å; Y433-N435 PolarHBondContact O-N 3.26Å; N435-I439 WeakPolarHBondContact O-CD1 3.26Å; N435-I439 WeakPolarHBondContact O-CG1 3.3Å
436	C	92.3	Very high	91.7	Very high	3 Å²	3	41 Å²	41	2%	0.02	19%	0.188	C	C	.	.	H	α-helix	trans	-83.6	-46.9	174.5	-61.5	0	0	0	0	111.4	H393 I424 D432 Y433 M434 E438 I439 W440	H393-C436 PolarHBondContact O-SG 2.91Å; I424-C436 HydrophobicContact CG1-CB 4.46Å; I424-C436 HydrophobicContact CG2-CB 4.13Å; D432-C436 PolarHBondContact O-N 2.93Å; D432-C436 PolarHBondContact O-SG 3.22Å; Y433-C436 WeakPolarHBondContact O-CB 3.44Å; Y433-C436 PolarHBondContact O-N 2.82Å; M434-C436 PolarHBondContact O-N 3.17Å; C436-E438 VanDerWaalsContact C-N 3.32Å; C436-E438 PolarHBondContact O-N 3Å; C436-I439 PolarHBondContact O-N 3.12Å; C436-I439 VanDerWaalsContact O-N 3.15Å; C436-W440 PolarHBondContact O-N 3.49Å; C436-W440 VanDerWaalsContact O-N 3.12Å
437	A	93.6	Very high	91.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59	-42.4	-178.3	0	0	0	0	0	111.7	W421 Y433 M434 I439 W440 V441 I460	W421-A437 HydrophobicContact CH2-CB 4.15Å; Y433-A437 HydrophobicContact CD1-CB 4.42Å; Y433-A437 HydrophobicContact CE1-CB 3.94Å; Y433-A437 WeakPolarHBondContact O-CB 3.4Å; Y433-A437 PolarHBondContact O-N 3.42Å; M434-A437 PolarHBondContact O-N 3.31Å; A437-I439 PolarHBondContact O-N 3.02Å; A437-W440 PolarHBondContact O-N 2.89Å; A437-V441 WeakPolarHBondContact O-CB 3.35Å; A437-V441 WeakPolarHBondContact O-CG2 3.27Å; A437-V441 PolarHBondContact O-N 3.41Å; A437-I460 HydrophobicContact CB-CD1 4.3Å; A437-I460 HydrophobicContact CB-CG1 4.11Å
438	E	93.5	Very high	91.9	Very high	44 Å²	44	36.2 Å²	36.2	21%	0.206	17%	0.167	C	C	.	.	H	α-helix	trans	-55.1	-38.4	177	-171.7	-165.3	165.3	0	0	112.8	M434 C436 Q476 S479 V480 K483	M434-E438 HydrophobicContact CE-CB 4.26Å; M434-E438 WeakPolarHBondContact O-CB 3.4Å; M434-E438 PolarHBondContact O-N 3.12Å; C436-E438 VanDerWaalsContact C-N 3.32Å; C436-E438 PolarHBondContact O-N 3Å; E438-Q476 WeakPolarHBondContact OE2-CG 3.33Å; E438-S479 WeakPolarHBondContact OE1-CB 3.44Å; E438-S479 PolarHBondContact OE1-OG 3.37Å; E438-V480 HydrophobicContact CB-CG2 4.47Å; E438-V480 HydrophobicContact CG-CG2 4.41Å; E438-K483 PolarHBondContact O-NZ 3Å
439	I	92.3	Very high	92	Very high	16 Å²	16	27.9 Å²	27.9	8%	0.082	15%	0.148	C	C	.	.	H	α-helix	trans	-73.4	-48.1	179.7	-60.6	164.6	0	0	0	109.7	R401 N435 C436 A437 V441 E442	R401-I439 HydrophobicContact CG-CD1 3.89Å; R401-I439 HydrophobicContact CG-CG1 4.31Å; R401-I439 HydrophobicContact CG-CG2 3.89Å; R401-I439 VanDerWaalsContact N-CG2 3.34Å; N435-I439 WeakPolarHBondContact O-CD1 3.26Å; N435-I439 WeakPolarHBondContact O-CG1 3.3Å; C436-I439 PolarHBondContact O-N 3.12Å; C436-I439 VanDerWaalsContact O-N 3.15Å; A437-I439 PolarHBondContact O-N 3.02Å; I439-V441 PolarHBondContact O-N 3.39Å; I439-E442 WeakPolarHBondContact O-CB 3.45Å; I439-E442 PolarHBondContact O-N 3.35Å
440	W	94.1	Very high	92.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-74.7	-22.6	-175.1	-80.9	92.3	0	0	0	114.3	Y396 L399 L403 I416 L417 A420 W421 I424 C436 A437 E442 F443 T444	Y396-W440 PolarHBondContact O-NE1 3.17Å; L399-W440 HydrophobicContact CD2-CH2 4.47Å; L399-W440 HydrophobicContact CD2-CZ2 4.33Å; L399-W440 HydrophobicContact CG-CZ2 4.37Å; L403-W440 HydrophobicContact CD1-CH2 3.6Å; L403-W440 HydrophobicContact CD1-CZ2 4.35Å; L403-W440 HydrophobicContact CD1-CZ3 4.04Å; I416-W440 HydrophobicContact CG2-CH2 3.84Å; I416-W440 HydrophobicContact CG2-CZ3 4.07Å; L417-W440 HydrophobicContact CD1-CE3 4.07Å; L417-W440 HydrophobicContact CD1-CZ3 4.47Å; A420-W440 HydrophobicContact CB-CD2 4.45Å; A420-W440 HydrophobicContact CB-CE3 4.42Å; A420-W440 HydrophobicContact CB-CH2 3.46Å; A420-W440 VanDerWaalsContact CB-CH2 3.46Å; A420-W440 HydrophobicContact CB-CZ2 3.49Å; A420-W440 VanDerWaalsContact CB-CZ2 3.49Å; A420-W440 HydrophobicContact CB-CZ3 3.96Å; W421-W440 HydrophobicContact CE3-CB 4.35Å; W421-W440 HydrophobicContact CZ3-CB 3.81Å; I424-W440 VanDerWaalsContact CD1-CD1 3.46Å; I424-W440 HydrophobicContact CD1-CD2 4.23Å; I424-W440 HydrophobicContact CD1-CG 3.88Å; C436-W440 PolarHBondContact O-N 3.49Å; C436-W440 VanDerWaalsContact O-N 3.12Å; A437-W440 PolarHBondContact O-N 2.89Å; W440-E442 PolarHBondContact O-N 3.34Å; W440-F443 HydrophobicContact CE3-CB 4.36Å; W440-F443 AromaticContact CE3-CD1 3.85Å; W440-F443 HydrophobicContact CE3-CD1 3.85Å; W440-F443 HydrophobicContact CE3-CG 4.31Å; W440-F443 AromaticContact CZ3-CD1 3.75Å; W440-F443 HydrophobicContact CZ3-CD1 3.75Å; W440-F443 HydrophobicContact CZ3-CE1 4.06Å; W440-F443 HydrophobicContact CZ3-CG 4.33Å; W440-F443 PolarHBondContact O-N 2.86Å; W440-T444 PolarHBondContact O-N 3.39Å; W440-T444 PolarHBondContact O-OG1 2.94Å
441	V	93.8	Very high	92.2	Very high	3 Å²	3	36.1 Å²	36.1	2%	0.018	17%	0.172	C	C	.	.	H	α-helix	trans	-56.9	-40.8	170.6	161.6	0	0	0	0	110.4	A437 I439 T444 C445 V456 I460 V480 K483 I484	A437-V441 WeakPolarHBondContact O-CB 3.35Å; A437-V441 WeakPolarHBondContact O-CG2 3.27Å; A437-V441 PolarHBondContact O-N 3.41Å; I439-V441 PolarHBondContact O-N 3.39Å; V441-T444 PolarHBondContact O-N 2.96Å; V441-C445 WeakPolarHBondContact O-CB 3.33Å; V441-C445 PolarHBondContact O-N 3.5Å; V441-C445 PolarHBondContact O-SG 2.91Å; V441-V456 HydrophobicContact CG2-CG1 3.54Å; V441-I460 HydrophobicContact CG2-CD1 3.86Å; V441-V480 HydrophobicContact CB-CG2 4.31Å; V441-V480 HydrophobicContact CG1-CG1 4.09Å; V441-V480 HydrophobicContact CG1-CG2 4.36Å; V441-V480 HydrophobicContact CG2-CG1 4.23Å; V441-V480 HydrophobicContact CG2-CG2 4Å; V441-K483 HydrophobicContact CG1-CB 4.35Å; V441-I484 HydrophobicContact CG1-CG1 4.19Å
442	E	92.6	Very high	92.3	Very high	35 Å²	35	36.4 Å²	36.4	16%	0.164	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-48.5	-179.7	-160.3	176.8	148.8	0	0	111.7	I439 W440 T444 C445 R446 K483 Y487	I439-E442 WeakPolarHBondContact O-CB 3.45Å; I439-E442 PolarHBondContact O-N 3.35Å; W440-E442 PolarHBondContact O-N 3.34Å; E442-T444 VanDerWaalsContact C-N 3.28Å; E442-T444 PolarHBondContact O-N 2.85Å; E442-C445 PolarHBondContact O-N 3.43Å; E442-R446 WeakPolarHBondContact O-CB 2.99Å; E442-R446 PolarHBondContact O-N 3.33Å; E442-R446 IonicContact OE1-NH2 3.47Å; E442-R446 PolarHBondContact OE1-NH2 3.34Å; E442-K483 HydrophobicContact CB-CD 4Å; E442-K483 HydrophobicContact CG-CD 4.33Å; E442-K483 HydrophobicContact CG-CG 4.39Å; E442-K483 WeakPolarHBondContact OE2-CE 3.31Å; E442-K483 IonicContact OE2-NZ 2.85Å; E442-K483 PolarHBondContact OE2-NZ 3.25Å; E442-Y487 HydrophobicContact CG-CE2 3.98Å
443	F	92.4	Very high	92.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-59	-41.6	175.2	-178.7	-101.1	0	0	0	111.6	L403 P408 R413 I416 L417 W440 H447 F448	L403-F443 HydrophobicContact CB-CD2 3.82Å; L403-F443 HydrophobicContact CB-CE2 4.1Å; L403-F443 HydrophobicContact CD1-CE2 4.32Å; P408-F443 HydrophobicContact CG-CE2 3.66Å; P408-F443 HydrophobicContact CG-CZ 3.85Å; R413-F443 HydrophobicContact CB-CZ 4.36Å; R413-F443 HydrophobicContact CG-CZ 4.29Å; I416-F443 HydrophobicContact CG2-CZ 4.48Å; L417-F443 HydrophobicContact CB-CE1 4.31Å; L417-F443 HydrophobicContact CD1-CD1 4.47Å; W440-F443 HydrophobicContact CE3-CB 4.36Å; W440-F443 AromaticContact CE3-CD1 3.85Å; W440-F443 HydrophobicContact CE3-CD1 3.85Å; W440-F443 HydrophobicContact CE3-CG 4.31Å; W440-F443 AromaticContact CZ3-CD1 3.75Å; W440-F443 HydrophobicContact CZ3-CD1 3.75Å; W440-F443 HydrophobicContact CZ3-CE1 4.06Å; W440-F443 HydrophobicContact CZ3-CG 4.33Å; W440-F443 PolarHBondContact O-N 2.86Å; F443-H447 AromaticContact CD2-CD2 3.49Å; F443-H447 VanDerWaalsContact CD2-CD2 3.49Å; F443-H447 WeakPolarHBondContact CD2-CD2 3.48Å; F443-H447 AromaticContact CD2-NE2 3.87Å; F443-H447 AromaticContact CE2-CD2 3.37Å; F443-H447 WeakPolarHBondContact CE2-CD2 3.44Å; F443-H447 AromaticContact CE2-NE2 3.75Å; F443-H447 AromaticContact CZ-CD2 3.98Å; F443-H447 PolarHBondContact O-CD2 2.94Å; F443-H447 PolarHBondContact O-N 3.14Å; F443-F448 HydrophobicContact CD1-CE2 4.2Å; F443-F448 AromaticContact CE1-CE2 3.8Å; F443-F448 HydrophobicContact CE1-CE2 3.8Å; F443-F448 HydrophobicContact CE1-CZ 4.38Å
444	T	92.8	Very high	92.5	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-64.8	-45.5	178.2	-51.4	0	0	0	0	111.1	L417 W440 V441 E442 F448 E452 V453 V456	L417-T444 HydrophobicContact CD2-CG2 4.28Å; W440-T444 PolarHBondContact O-N 3.39Å; W440-T444 PolarHBondContact O-OG1 2.94Å; V441-T444 PolarHBondContact O-N 2.96Å; E442-T444 VanDerWaalsContact C-N 3.28Å; E442-T444 PolarHBondContact O-N 2.85Å; T444-F448 HydrophobicContact CG2-CD2 4.41Å; T444-F448 WeakPolarHBondContact O-CB 3.41Å; T444-F448 PolarHBondContact O-N 2.75Å; T444-E452 HydrophobicContact CG2-CB 3.84Å; T444-V453 HydrophobicContact CG2-CG2 3.95Å; T444-V456 HydrophobicContact CG2-CG2 4.07Å
445	C	92.6	Very high	92.5	Very high	6 Å²	6	39.3 Å²	39.3	4%	0.041	19%	0.192	C	C	.	.	H	α-helix	trans	-70.3	-32.8	-177.6	-64.9	0	0	0	0	113.1	V441 E442 I484 Y487 F488	V441-C445 WeakPolarHBondContact O-CB 3.33Å; V441-C445 PolarHBondContact O-N 3.5Å; V441-C445 PolarHBondContact O-SG 2.91Å; E442-C445 PolarHBondContact O-N 3.43Å; C445-I484 VanDerWaalsContact SG-CG1 3.59Å; C445-Y487 HydrophobicContact CB-CD2 3.69Å; C445-Y487 HydrophobicContact CB-CG 4.31Å; C445-F488 HydrophobicContact CB-CD2 4.38Å; C445-F488 HydrophobicContact CB-CE2 3.93Å
446	R	91.5	Very high	92.7	Very high	67 Å²	67	36.1 Å²	36.1	25%	0.253	18%	0.175	S	C	.	.	H	α-helix	trans	-72.1	-36.9	-179.3	-172.8	-178.1	-61.7	173.1	2.1	113.1	A404 D407 E442 Y487	A404-R446 PolarHBondContact O-NH1 2.54Å; A404-R446 PolarHBondContact O-NH2 2.85Å; D407-R446 IonicContact OD1-NH1 2.85Å; D407-R446 PolarHBondContact OD1-NH1 2.49Å; E442-R446 WeakPolarHBondContact O-CB 2.99Å; E442-R446 PolarHBondContact O-N 3.33Å; E442-R446 IonicContact OE1-NH2 3.47Å; E442-R446 PolarHBondContact OE1-NH2 3.34Å; R446-Y487 HydrophobicContact CB-CD1 4.37Å; R446-Y487 HydrophobicContact CB-CE1 4.01Å; R446-Y487 HydrophobicContact CB-CE2 4.17Å; R446-Y487 HydrophobicContact CG-CD1 4.42Å; R446-Y487 HydrophobicContact CG-CE1 3.85Å; R446-Y487 VanDerWaalsContact CZ-OH 3.29Å; R446-Y487 PolarHBondContact NE-OH 3.13Å; R446-Y487 PolarHBondContact NH2-OH 3.22Å
447	H	90.1	Very high	92.8	Very high	39 Å²	39	36 Å²	36	18%	0.181	17%	0.174	C	C	.	.	H	α-helix	trans	-113.5	-15.4	-167.8	-62.6	-54.5	0	0	0	115.6	D407 F443	D407-H447 IonicContact OD1-CE1 3.12Å; D407-H447 PolarHBondContact OD1-CE1 3.37Å; D407-H447 VanDerWaalsContact OD1-CE1 3.25Å; D407-H447 IonicContact OD1-NE2 3.41Å; D407-H447 PolarHBondContact OD1-NE2 3.04Å; D407-H447 IonicContact OD2-CE1 3.55Å; F443-H447 AromaticContact CD2-CD2 3.49Å; F443-H447 VanDerWaalsContact CD2-CD2 3.49Å; F443-H447 WeakPolarHBondContact CD2-CD2 3.48Å; F443-H447 AromaticContact CD2-NE2 3.87Å; F443-H447 AromaticContact CE2-CD2 3.37Å; F443-H447 WeakPolarHBondContact CE2-CD2 3.44Å; F443-H447 AromaticContact CE2-NE2 3.75Å; F443-H447 AromaticContact CZ-CD2 3.98Å; F443-H447 PolarHBondContact O-CD2 2.94Å; F443-H447 PolarHBondContact O-N 3.14Å
448	F	91.7	Very high	92.9	Very high	33 Å²	33	37.6 Å²	37.6	15%	0.145	19%	0.187	C	C	.	.	S	Bend	trans	-121.6	165.5	-173.6	-58.1	-89.2	0	0	0	112.4	R413 L414 L417 F443 T444 E452	R413-F448 HydrophobicContact CB-CZ 3.95Å; L414-F448 HydrophobicContact CB-CE1 4Å; L414-F448 HydrophobicContact CB-CZ 4.5Å; L414-F448 HydrophobicContact CD1-CD1 4.39Å; L414-F448 HydrophobicContact CD1-CE1 3.75Å; L414-F448 HydrophobicContact CG-CE1 4.5Å; L417-F448 HydrophobicContact CB-CE2 4.28Å; L417-F448 HydrophobicContact CB-CZ 4.08Å; L417-F448 HydrophobicContact CD2-CD2 4.05Å; L417-F448 HydrophobicContact CD2-CE1 4.37Å; L417-F448 HydrophobicContact CD2-CE2 3.75Å; L417-F448 HydrophobicContact CD2-CG 4.46Å; L417-F448 HydrophobicContact CD2-CZ 3.9Å; F443-F448 HydrophobicContact CD1-CE2 4.2Å; F443-F448 AromaticContact CE1-CE2 3.8Å; F443-F448 HydrophobicContact CE1-CE2 3.8Å; F443-F448 HydrophobicContact CE1-CZ 4.38Å; T444-F448 HydrophobicContact CG2-CD2 4.41Å; T444-F448 WeakPolarHBondContact O-CB 3.41Å; T444-F448 PolarHBondContact O-N 2.75Å; F448-E452 HydrophobicContact CB-CB 3.73Å; F448-E452 HydrophobicContact CB-CG 3.87Å; F448-E452 HydrophobicContact CD1-CG 3.91Å; F448-E452 HydrophobicContact CG-CB 4.18Å; F448-E452 HydrophobicContact CG-CG 4.03Å
449	A	90.8	Very high	93	Very high	62 Å²	62	36.2 Å²	36.2	51%	0.512	18%	0.181	S	C	.	.			trans	-85.3	-173.8	179.9	0	0	0	0	0	111.2	R451 E452	A449-R451 PolarHBondContact O-N 2.76Å; A449-E452 PolarHBondContact N-OE2 2.93Å; A449-E452 PolarHBondContact O-N 2.92Å
450	K	91.5	Very high	93.1	Very high	93 Å²	93	35.4 Å²	35.4	40%	0.404	18%	0.177	S	C	.	.	H	α-helix	trans	-57.8	-24.9	-176.7	73.2	-174.2	-166.5	173.2	0	115.1	N454 V493 S496 M497	K450-N454 WeakPolarHBondContact O-CB 3.11Å; K450-N454 PolarHBondContact O-N 2.81Å; K450-V493 HydrophobicContact CB-CG1 3.88Å; K450-V493 HydrophobicContact CD-CG1 3.86Å; K450-V493 HydrophobicContact CG-CG1 4.46Å; K450-S496 PolarHBondContact NZ-OG 3.41Å; K450-M497 HydrophobicContact CB-CE 3.68Å; K450-M497 HydrophobicContact CB-CG 4.08Å; K450-M497 HydrophobicContact CB-SD 4.43Å
451	R	92.4	Very high	93.1	Very high	191 Å²	191	36.7 Å²	36.7	72%	0.721	18%	0.183	S	C	*	.	H	α-helix	trans	-69.8	-47.4	-174.4	-177.7	-175.5	179.5	178.8	-0.7	111.6	A449 N454 T455	A449-R451 PolarHBondContact O-N 2.76Å; R451-N454 PolarHBondContact O-N 2.81Å; R451-T455 PolarHBondContact O-N 2.98Å; R451-T455 PolarHBondContact O-OG1 2.84Å
452	E	92.6	Very high	93.2	Very high	48 Å²	48	43.1 Å²	43.1	22%	0.224	21%	0.211	C	C	.	.	H	α-helix	trans	-68.7	-43.4	-178.3	-67.2	66.7	-143.8	0	0	110.1	L417 T444 F448 A449 N454 T455 V456	L417-E452 HydrophobicContact CD2-CB 4.45Å; T444-E452 HydrophobicContact CG2-CB 3.84Å; F448-E452 HydrophobicContact CB-CB 3.73Å; F448-E452 HydrophobicContact CB-CG 3.87Å; F448-E452 HydrophobicContact CD1-CG 3.91Å; F448-E452 HydrophobicContact CG-CB 4.18Å; F448-E452 HydrophobicContact CG-CG 4.03Å; A449-E452 PolarHBondContact N-OE2 2.93Å; A449-E452 PolarHBondContact O-N 2.92Å; E452-N454 PolarHBondContact O-N 3.45Å; E452-T455 WeakPolarHBondContact O-CB 3.24Å; E452-T455 PolarHBondContact O-N 3.26Å; E452-T455 VanDerWaalsContact O-N 3.1Å; E452-V456 PolarHBondContact O-N 3.4Å
453	V	93.9	Very high	93.2	Very high	3 Å²	3	43 Å²	43	2%	0.018	21%	0.211	C	C	.	.	H	α-helix	trans	-59.7	-45.4	174.5	-179.9	0	0	0	0	111.3	T444 T455 V456 L457 I484 F488 M497	T444-V453 HydrophobicContact CG2-CG2 3.95Å; V453-T455 PolarHBondContact O-N 2.88Å; V453-V456 PolarHBondContact O-N 2.86Å; V453-L457 HydrophobicContact CG1-CD1 4.2Å; V453-L457 HydrophobicContact CG1-CG 4.41Å; V453-L457 WeakPolarHBondContact O-CG 3.47Å; V453-L457 PolarHBondContact O-N 3.07Å; V453-I484 HydrophobicContact CG1-CD1 4.46Å; V453-I484 HydrophobicContact CG1-CG1 4.36Å; V453-F488 HydrophobicContact CG2-CE2 3.73Å; V453-F488 HydrophobicContact CG2-CZ 3.72Å; V453-M497 HydrophobicContact CB-SD 4.47Å; V453-M497 HydrophobicContact CG1-SD 4.15Å
454	N	94.2	Very high	93.2	Very high	31 Å²	31	43 Å²	43	17%	0.166	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-32.1	176.9	-170.6	67.9	0	0	0	112.6	K450 R451 E452 A458 M497 E498 R499	K450-N454 WeakPolarHBondContact O-CB 3.11Å; K450-N454 PolarHBondContact O-N 2.81Å; R451-N454 PolarHBondContact O-N 2.81Å; E452-N454 PolarHBondContact O-N 3.45Å; N454-A458 WeakPolarHBondContact O-CB 3.45Å; N454-A458 PolarHBondContact O-N 2.55Å; N454-M497 HydrophobicContact CB-CB 4.49Å; N454-E498 PolarHBondContact OD1-N 3.17Å; N454-R499 VanDerWaalsContact OD1-CB 3.25Å; N454-R499 WeakPolarHBondContact OD1-CB 3.49Å; N454-R499 WeakPolarHBondContact OD1-CG 3.35Å; N454-R499 PolarHBondContact OD1-N 3.07Å
455	T	94.1	Very high	93.2	Very high	78 Å²	78	46.4 Å²	46.4	48%	0.479	23%	0.232	S	C	.	.	H	α-helix	trans	-70.7	-43.9	176.1	-54.5	0	0	0	0	111.3	R451 E452 V453 A458 D459	R451-T455 PolarHBondContact O-N 2.98Å; R451-T455 PolarHBondContact O-OG1 2.84Å; E452-T455 WeakPolarHBondContact O-CB 3.24Å; E452-T455 PolarHBondContact O-N 3.26Å; E452-T455 VanDerWaalsContact O-N 3.1Å; V453-T455 PolarHBondContact O-N 2.88Å; T455-A458 WeakPolarHBondContact O-CB 3.11Å; T455-A458 PolarHBondContact O-N 3.39Å; T455-D459 PolarHBondContact O-N 3.14Å; T455-D459 VanDerWaalsContact O-N 3.12Å
456	V	94.1	Very high	93.2	Very high	6 Å²	6	49.4 Å²	49.4	4%	0.036	25%	0.251	C	S	.	.	H	α-helix	trans	-62.3	-45.4	175.1	168.3	0	0	0	0	110.9	W421 V441 T444 E452 V453 A458 D459 I460	W421-V456 HydrophobicContact CD2-CG2 4.29Å; W421-V456 HydrophobicContact CE3-CG2 4.33Å; W421-V456 HydrophobicContact CH2-CB 4.14Å; W421-V456 HydrophobicContact CH2-CG1 3.45Å; W421-V456 VanDerWaalsContact CH2-CG1 3.45Å; W421-V456 HydrophobicContact CH2-CG2 3.89Å; W421-V456 HydrophobicContact CZ2-CB 4.03Å; W421-V456 HydrophobicContact CZ2-CG1 3.76Å; W421-V456 HydrophobicContact CZ2-CG2 3.81Å; W421-V456 HydrophobicContact CZ3-CG1 4.21Å; W421-V456 HydrophobicContact CZ3-CG2 4.13Å; V441-V456 HydrophobicContact CG2-CG1 3.54Å; T444-V456 HydrophobicContact CG2-CG2 4.07Å; E452-V456 PolarHBondContact O-N 3.4Å; V453-V456 PolarHBondContact O-N 2.86Å; V456-A458 VanDerWaalsContact C-N 3.33Å; V456-A458 PolarHBondContact O-N 3.04Å; V456-D459 PolarHBondContact O-N 3.12Å; V456-D459 VanDerWaalsContact O-N 3.14Å; V456-I460 HydrophobicContact CG1-CD1 3.89Å; V456-I460 HydrophobicContact CG1-CG1 4.43Å; V456-I460 WeakPolarHBondContact O-CG1 3.39Å; V456-I460 PolarHBondContact O-N 2.64Å
457	L	95.2	Very high	93	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-59.6	-42.3	175.2	-72.9	177.6	0	0	0	112.1	V453 D459 I460 I461 V480 I484 R499 F500 F503	V453-L457 HydrophobicContact CG1-CD1 4.2Å; V453-L457 HydrophobicContact CG1-CG 4.41Å; V453-L457 WeakPolarHBondContact O-CG 3.47Å; V453-L457 PolarHBondContact O-N 3.07Å; L457-D459 VanDerWaalsContact C-N 3.27Å; L457-D459 PolarHBondContact O-N 3.36Å; L457-I460 PolarHBondContact O-N 3.08Å; L457-I461 WeakPolarHBondContact O-CD1 3.48Å; L457-I461 VanDerWaalsContact O-CG1 3.26Å; L457-I461 WeakPolarHBondContact O-CG1 3.38Å; L457-I461 PolarHBondContact O-N 3.27Å; L457-V480 HydrophobicContact CD2-CG1 4.26Å; L457-I484 HydrophobicContact CD1-CD1 4.24Å; L457-I484 HydrophobicContact CD2-CD1 3.82Å; L457-I484 HydrophobicContact CG-CD1 4.37Å; L457-R499 HydrophobicContact CB-CB 4.01Å; L457-F500 HydrophobicContact CD1-CB 4.44Å; L457-F500 HydrophobicContact CD1-CD2 4.28Å; L457-F503 HydrophobicContact CD2-CB 4.35Å; L457-F503 HydrophobicContact CD2-CD1 4.19Å; L457-F503 HydrophobicContact CD2-CD2 3.82Å; L457-F503 HydrophobicContact CD2-CE1 4.48Å; L457-F503 HydrophobicContact CD2-CE2 4.12Å; L457-F503 HydrophobicContact CD2-CG 3.85Å; L457-F503 HydrophobicContact CD2-CZ 4.44Å
458	A	95.4	Very high	92.9	Very high	32 Å²	32	58.3 Å²	58.3	26%	0.264	30%	0.296	S	S	.	.	H	α-helix	trans	-57.1	-42.4	175.1	0	0	0	0	0	112	N454 T455 V456 K462 R499	N454-A458 WeakPolarHBondContact O-CB 3.45Å; N454-A458 PolarHBondContact O-N 2.55Å; T455-A458 WeakPolarHBondContact O-CB 3.11Å; T455-A458 PolarHBondContact O-N 3.39Å; V456-A458 VanDerWaalsContact C-N 3.33Å; V456-A458 PolarHBondContact O-N 3.04Å; A458-K462 WeakPolarHBondContact O-CB 3.26Å; A458-K462 PolarHBondContact O-N 3.41Å; A458-R499 HydrophobicContact CB-CG 3.9Å
459	D	94.4	Very high	92.9	Very high	15 Å²	15	57.3 Å²	57.3	8%	0.08	29%	0.293	C	S	.	.	H	α-helix	trans	-73.7	-36.7	-178	-157.6	37.5	0	0	0	112	W421 T425 Y433 T455 V456 L457 K462 H463	W421-D459 HydrophobicContact CZ2-CB 4.16Å; W421-D459 PolarHBondContact NE1-OD2 3.3Å; T425-D459 WeakPolarHBondContact CB-OD2 3.49Å; T425-D459 WeakPolarHBondContact CG2-OD2 3.42Å; T425-D459 PolarHBondContact OG1-OD2 3.14Å; Y433-D459 VanDerWaalsContact OH-C 3.25Å; Y433-D459 PolarHBondContact OH-O 2.89Å; Y433-D459 PolarHBondContact OH-OD2 2.97Å; T455-D459 PolarHBondContact O-N 3.14Å; T455-D459 VanDerWaalsContact O-N 3.12Å; V456-D459 PolarHBondContact O-N 3.12Å; V456-D459 VanDerWaalsContact O-N 3.14Å; L457-D459 VanDerWaalsContact C-N 3.27Å; L457-D459 PolarHBondContact O-N 3.36Å; D459-K462 WeakPolarHBondContact O-CB 3.22Å; D459-K462 PolarHBondContact O-N 2.99Å; D459-H463 PolarHBondContact O-N 2.93Å; D459-H463 PolarHBondContact O-ND1 3.42Å; D459-H463 IonicContact OD1-CE1 3.32Å; D459-H463 PolarHBondContact OD1-CE1 3.31Å; D459-H463 IonicContact OD1-ND1 3Å; D459-H463 PolarHBondContact OD1-ND1 3.23Å; D459-H463 IonicContact OD2-CE1 2.78Å; D459-H463 IonicContact OD2-ND1 3.39Å
460	I	95.5	Very high	92.8	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.7	-48	172.1	-63.1	166.4	0	0	0	110.6	Y433 M434 A437 V441 V456 L457 K462 H463 M464 L477 V480 F503	Y433-I460 HydrophobicContact CE1-CB 4.48Å; Y433-I460 HydrophobicContact CE1-CG1 4.11Å; Y433-I460 PolarHBondContact OH-N 3.33Å; M434-I460 HydrophobicContact SD-CG2 4.02Å; A437-I460 HydrophobicContact CB-CD1 4.3Å; A437-I460 HydrophobicContact CB-CG1 4.11Å; V441-I460 HydrophobicContact CG2-CD1 3.86Å; V456-I460 HydrophobicContact CG1-CD1 3.89Å; V456-I460 HydrophobicContact CG1-CG1 4.43Å; V456-I460 WeakPolarHBondContact O-CG1 3.39Å; V456-I460 PolarHBondContact O-N 2.64Å; L457-I460 PolarHBondContact O-N 3.08Å; I460-K462 PolarHBondContact O-N 3.42Å; I460-H463 PolarHBondContact O-N 2.98Å; I460-M464 HydrophobicContact CG2-CG 3.87Å; I460-M464 WeakPolarHBondContact O-CB 3.29Å; I460-M464 VanDerWaalsContact O-CG 3.25Å; I460-M464 WeakPolarHBondContact O-CG 3.43Å; I460-M464 PolarHBondContact O-N 3.02Å; I460-L477 HydrophobicContact CG2-CD2 3.86Å; I460-V480 HydrophobicContact CD1-CG1 4.43Å; I460-F503 HydrophobicContact CB-CE2 4.37Å; I460-F503 HydrophobicContact CG2-CD2 4.42Å; I460-F503 HydrophobicContact CG2-CE2 3.75Å
461	I	94.8	Very high	92.8	Very high	26 Å²	26	54.4 Å²	54.4	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-55.2	-45.8	175.3	-65.6	161.5	0	0	0	109.8	L457 H463 T465 R499 P502 F503 M506	L457-I461 WeakPolarHBondContact O-CD1 3.48Å; L457-I461 VanDerWaalsContact O-CG1 3.26Å; L457-I461 WeakPolarHBondContact O-CG1 3.38Å; L457-I461 PolarHBondContact O-N 3.27Å; I461-H463 PolarHBondContact O-N 3.21Å; I461-T465 VanDerWaalsContact O-CB 3.23Å; I461-T465 WeakPolarHBondContact O-CB 3.17Å; I461-T465 PolarHBondContact O-N 3.44Å; I461-T465 PolarHBondContact O-OG1 2.98Å; I461-R499 HydrophobicContact CD1-CB 4.11Å; I461-P502 HydrophobicContact CD1-CB 4.09Å; I461-F503 HydrophobicContact CD1-CB 4.08Å; I461-F503 HydrophobicContact CG1-CB 4.25Å; I461-F503 HydrophobicContact CG1-CD2 4.14Å; I461-M506 HydrophobicContact CB-SD 4.2Å; I461-M506 HydrophobicContact CG1-SD 3.64Å; I461-M506 HydrophobicContact CG2-SD 4.47Å
462	K	94.5	Very high	92.7	Very high	139 Å²	139	52.4 Å²	52.4	60%	0.604	27%	0.269	S	S	*	.	H	α-helix	trans	-61.9	-38.9	-178.4	-176.3	-172.5	173.2	-165.8	0	113.4	A458 D459 I460 P466	A458-K462 WeakPolarHBondContact O-CB 3.26Å; A458-K462 PolarHBondContact O-N 3.41Å; D459-K462 WeakPolarHBondContact O-CB 3.22Å; D459-K462 PolarHBondContact O-N 2.99Å; I460-K462 PolarHBondContact O-N 3.42Å; K462-P466 WeakPolarHBondContact O-CD 3.35Å; K462-P466 WeakPolarHBondContact O-CG 3.46Å
463	H	92.9	Very high	92.7	Very high	32 Å²	32	50.1 Å²	50.1	15%	0.148	26%	0.259	C	S	.	.	H	α-helix	trans	-82.7	-30.1	-177.7	-75	84.7	0	0	0	113.9	T425 Y433 D459 I460 I461	T425-H463 PolarHBondContact O-CE1 3.25Å; T425-H463 PolarHBondContact O-NE2 2.94Å; T425-H463 VanDerWaalsContact O-NE2 3.15Å; Y433-H463 HydrophobicContact CD1-CB 3.68Å; Y433-H463 AromaticContact CD1-CG 3.99Å; Y433-H463 HydrophobicContact CE1-CB 3.68Å; Y433-H463 AromaticContact CE1-CG 3.91Å; Y433-H463 AromaticContact CE2-CE1 3.85Å; Y433-H463 AromaticContact CE2-CG 3.95Å; Y433-H463 AromaticContact CE2-ND1 3.71Å; Y433-H463 HydrophobicContact CG-CB 4.18Å; Y433-H463 AromaticContact CZ-CG 3.89Å; Y433-H463 AromaticContact CZ-ND1 3.62Å; D459-H463 PolarHBondContact O-N 2.93Å; D459-H463 PolarHBondContact O-ND1 3.42Å; D459-H463 IonicContact OD1-CE1 3.32Å; D459-H463 PolarHBondContact OD1-CE1 3.31Å; D459-H463 IonicContact OD1-ND1 3Å; D459-H463 PolarHBondContact OD1-ND1 3.23Å; D459-H463 IonicContact OD2-CE1 2.78Å; D459-H463 IonicContact OD2-ND1 3.39Å; I460-H463 PolarHBondContact O-N 2.98Å; I461-H463 PolarHBondContact O-N 3.21Å
464	M	93.3	Very high	92.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-95.3	-20.8	-172.8	-60.5	-54.9	-64.6	0	0	113.3	P430 M434 I460 A469 F470 A473 M506	P430-M464 HydrophobicContact CB-SD 4Å; M434-M464 HydrophobicContact CB-CE 4.41Å; M434-M464 HydrophobicContact CB-SD 4.1Å; M434-M464 HydrophobicContact CG-CE 4.48Å; M434-M464 HydrophobicContact CG-SD 4.49Å; M434-M464 HydrophobicContact SD-CG 4.42Å; M434-M464 HydrophobicContact SD-SD 4.36Å; I460-M464 HydrophobicContact CG2-CG 3.87Å; I460-M464 WeakPolarHBondContact O-CB 3.29Å; I460-M464 VanDerWaalsContact O-CG 3.25Å; I460-M464 WeakPolarHBondContact O-CG 3.43Å; I460-M464 PolarHBondContact O-N 3.02Å; M464-A469 HydrophobicContact CE-CB 4.24Å; M464-A469 WeakPolarHBondContact CE-O 3.4Å; M464-A469 PolarHBondContact O-N 3.49Å; M464-F470 HydrophobicContact CB-CB 4.16Å; M464-F470 VanDerWaalsContact O-CD1 3.29Å; M464-F470 WeakPolarHBondContact O-CD1 3.44Å; M464-F470 PolarHBondContact O-N 3.28Å; M464-F470 VanDerWaalsContact O-N 3.16Å; M464-A473 HydrophobicContact CE-CB 3.35Å; M464-M506 HydrophobicContact CB-CE 3.5Å; M464-M506 VanDerWaalsContact CB-CE 3.5Å; M464-M506 HydrophobicContact CG-CE 4.35Å
465	T	91.5	Very high	92.6	Very high	73 Å²	73	53.4 Å²	53.4	45%	0.448	28%	0.279	S	S	.	.	S	Bend	trans	-65.6	-44.1	176.9	-57.3	0	0	0	0	113.7	I461 D467 R468	I461-T465 VanDerWaalsContact O-CB 3.23Å; I461-T465 WeakPolarHBondContact O-CB 3.17Å; I461-T465 PolarHBondContact O-N 3.44Å; I461-T465 PolarHBondContact O-OG1 2.98Å; T465-D467 PolarHBondContact O-N 3.38Å; T465-R468 PolarHBondContact O-N 2.82Å
466	P	92	Very high	92.6	Very high	69 Å²	69	51.4 Å²	51.4	45%	0.448	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-55.4	138	176.3	-24.7	35.1	0	0	0	111.6	K462 R468 A469	K462-P466 WeakPolarHBondContact O-CD 3.35Å; K462-P466 WeakPolarHBondContact O-CG 3.46Å; P466-R468 PolarHBondContact O-N 3.41Å; P466-A469 PolarHBondContact O-N 3Å; P466-A469 VanDerWaalsContact O-N 3.16Å
467	D	87.6	Confident	92.6	Very high	168 Å²	168	51.1 Å²	51.1	90%	0.898	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	53.4	16.1	179.8	-54.6	-40.2	0	0	0	115.3	T465 A469	T465-D467 PolarHBondContact O-N 3.38Å; D467-A469 PolarHBondContact O-N 3.12Å
468	R	89.6	Confident	92.6	Very high	125 Å²	125	53.4 Å²	53.4	47%	0.472	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	54.6	35.9	-174.6	-53.9	177.7	77	-164	-2.8	112.9	T465 P466 F470 E471	T465-R468 PolarHBondContact O-N 2.82Å; P466-R468 PolarHBondContact O-N 3.41Å; R468-F470 HydrophobicContact CB-CE1 3.89Å; R468-F470 HydrophobicContact CB-CZ 3.86Å; R468-F470 HydrophobicContact CG-CE1 4.11Å; R468-F470 HydrophobicContact CG-CZ 4.04Å; R468-F470 PolarHBondContact O-N 3.42Å; R468-E471 HydrophobicContact CB-CG 4.34Å; R468-E471 IonicContact CZ-OE1 3.95Å; R468-E471 IonicContact NE-OE1 2.62Å; R468-E471 PolarHBondContact NE-OE1 2.94Å; R468-E471 IonicContact NH1-OE1 3.25Å; R468-E471 PolarHBondContact NH1-OE1 3.38Å; R468-E471 IonicContact NH2-OE1 3.85Å; R468-E471 PolarHBondContact NH2-OE1 3.34Å; R468-E471 PolarHBondContact O-N 2.8Å
469	A	90	Very high	92.6	Very high	12 Å²	12	53.3 Å²	53.3	10%	0.099	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-56	-21.8	179	0	0	0	0	0	113.8	P430 M464 P466 D467 E471 E472	P430-A469 HydrophobicContact CB-CB 3.62Å; P430-A469 HydrophobicContact CG-CB 3.84Å; M464-A469 HydrophobicContact CE-CB 4.24Å; M464-A469 WeakPolarHBondContact CE-O 3.4Å; M464-A469 PolarHBondContact O-N 3.49Å; P466-A469 PolarHBondContact O-N 3Å; P466-A469 VanDerWaalsContact O-N 3.16Å; D467-A469 PolarHBondContact O-N 3.12Å; A469-E471 PolarHBondContact O-N 3.21Å; A469-E472 PolarHBondContact O-N 3.37Å
470	F	90.4	Very high	92.6	Very high	7 Å²	7	52.6 Å²	52.6	3%	0.031	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-58.2	-25.6	172.9	60.2	-102.1	0	0	0	114.3	M464 R468 E472 A473 Y474 L477 M506 Q508	M464-F470 HydrophobicContact CB-CB 4.16Å; M464-F470 VanDerWaalsContact O-CD1 3.29Å; M464-F470 WeakPolarHBondContact O-CD1 3.44Å; M464-F470 PolarHBondContact O-N 3.28Å; M464-F470 VanDerWaalsContact O-N 3.16Å; R468-F470 HydrophobicContact CB-CE1 3.89Å; R468-F470 HydrophobicContact CB-CZ 3.86Å; R468-F470 HydrophobicContact CG-CE1 4.11Å; R468-F470 HydrophobicContact CG-CZ 4.04Å; R468-F470 PolarHBondContact O-N 3.42Å; F470-E472 VanDerWaalsContact C-N 3.31Å; F470-E472 PolarHBondContact O-N 3.06Å; F470-A473 PolarHBondContact O-N 3Å; F470-Y474 HydrophobicContact CD2-CE1 4.06Å; F470-Y474 PolarHBondContact O-N 3.29Å; F470-L477 HydrophobicContact CB-CD1 3.74Å; F470-M506 HydrophobicContact CB-CE 3.63Å; F470-M506 HydrophobicContact CD1-CE 4.33Å; F470-M506 WeakPolarHBondContact CD2-O 3.34Å; F470-M506 WeakPolarHBondContact CE2-O 3.3Å; F470-M506 HydrophobicContact CG-CE 4.25Å; F470-Q508 HydrophobicContact CE2-CB 4.37Å; F470-Q508 HydrophobicContact CE2-CG 4.07Å; F470-Q508 HydrophobicContact CZ-CG 4.28Å
471	E	91.5	Very high	92.6	Very high	86 Å²	86	52.7 Å²	52.7	40%	0.402	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-66	-34.1	-178	-68.3	-170.5	163.5	0	0	112.9	R468 A469 A473 Y474	R468-E471 HydrophobicContact CB-CG 4.34Å; R468-E471 IonicContact CZ-OE1 3.95Å; R468-E471 IonicContact NE-OE1 2.62Å; R468-E471 PolarHBondContact NE-OE1 2.94Å; R468-E471 IonicContact NH1-OE1 3.25Å; R468-E471 PolarHBondContact NH1-OE1 3.38Å; R468-E471 IonicContact NH2-OE1 3.85Å; R468-E471 PolarHBondContact NH2-OE1 3.34Å; R468-E471 PolarHBondContact O-N 2.8Å; A469-E471 PolarHBondContact O-N 3.21Å; E471-A473 VanDerWaalsContact C-N 3.34Å; E471-Y474 HydrophobicContact CB-CE2 4.23Å; E471-Y474 HydrophobicContact CG-CE2 4.37Å; E471-Y474 WeakPolarHBondContact O-CD2 3.33Å
472	E	89.8	Confident	92.6	Very high	150 Å²	150	55.2 Å²	55.2	70%	0.701	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-17.4	177.2	-65.3	-177.7	170.2	0	0	112.5	Q431 A469 F470	Q431-E472 PolarHBondContact NE2-OE2 3.2Å; Q431-E472 VanDerWaalsContact NE2-OE2 3.15Å; A469-E472 PolarHBondContact O-N 3.37Å; F470-E472 VanDerWaalsContact C-N 3.31Å; F470-E472 PolarHBondContact O-N 3.06Å
473	A	92.1	Very high	92.6	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	17.4	-171.8	0	0	0	0	0	114	M434 M464 F470 E471 P475 Q476 L477	M434-A473 HydrophobicContact CG-CB 4.26Å; M464-A473 HydrophobicContact CE-CB 3.35Å; F470-A473 PolarHBondContact O-N 3Å; E471-A473 VanDerWaalsContact C-N 3.34Å; A473-P475 VanDerWaalsContact C-CD 3.44Å; A473-Q476 VanDerWaalsContact C-OE1 3.29Å; A473-Q476 VanDerWaalsContact CA-OE1 3.27Å; A473-Q476 PolarHBondContact O-N 3.48Å; A473-Q476 VanDerWaalsContact O-N 3.16Å; A473-Q476 PolarHBondContact O-OE1 3.12Å; A473-L477 WeakPolarHBondContact O-CG 3.42Å; A473-L477 PolarHBondContact O-N 3.13Å
474	Y	93.4	Very high	92.7	Very high	19 Å²	19	48.5 Å²	48.5	8%	0.075	26%	0.255	C	S	.	.	H	α-helix	trans	-52.3	-43.3	178.9	-75.7	-48.7	0	0	0	114.3	F470 E471 Q476 L477 Q478 F507 Q508 K509 V512	F470-Y474 HydrophobicContact CD2-CE1 4.06Å; F470-Y474 PolarHBondContact O-N 3.29Å; E471-Y474 HydrophobicContact CB-CE2 4.23Å; E471-Y474 HydrophobicContact CG-CE2 4.37Å; E471-Y474 WeakPolarHBondContact O-CD2 3.33Å; Y474-Q476 VanDerWaalsContact C-N 3.32Å; Y474-Q476 PolarHBondContact O-N 2.84Å; Y474-L477 PolarHBondContact O-N 3.14Å; Y474-Q478 WeakPolarHBondContact O-CB 3.21Å; Y474-Q478 WeakPolarHBondContact O-CG 3.46Å; Y474-Q478 PolarHBondContact O-N 2.95Å; Y474-F507 AromaticContact CD1-CD1 3.73Å; Y474-F507 HydrophobicContact CD1-CD1 3.73Å; Y474-F507 HydrophobicContact CD1-CE1 4.16Å; Y474-F507 HydrophobicContact CE1-CD1 4.03Å; Y474-Q508 PolarHBondContact OH-N 3.13Å; Y474-K509 HydrophobicContact CE2-CB 3.88Å; Y474-K509 HydrophobicContact CE2-CD 4.47Å; Y474-K509 PolarHBondContact OH-N 3.31Å; Y474-V512 HydrophobicContact CD1-CG1 3.96Å; Y474-V512 HydrophobicContact CD2-CG2 4.36Å; Y474-V512 HydrophobicContact CG-CG1 4.01Å; Y474-V512 HydrophobicContact CG-CG2 4.4Å
475	P	93.5	Very high	92.7	Very high	84 Å²	84	48.7 Å²	48.7	55%	0.545	26%	0.256	S	S	.	.	H	α-helix	trans	-59.3	-41.5	178.1	-24.6	35.1	0	0	0	113	A473 Q478 S479	A473-P475 VanDerWaalsContact C-CD 3.44Å; P475-Q478 PolarHBondContact O-N 3.36Å; P475-S479 PolarHBondContact O-N 3.35Å
476	Q	93.4	Very high	92.8	Very high	36 Å²	36	49.7 Å²	49.7	17%	0.168	26%	0.256	C	S	.	.	H	α-helix	trans	-70.4	-38.2	178.8	-61.3	88.7	-27.4	0	0	111.2	M434 E438 A473 Y474 S479 V480	M434-Q476 HydrophobicContact CE-CB 3.87Å; M434-Q476 HydrophobicContact CG-CB 3.7Å; M434-Q476 HydrophobicContact CG-CG 4.32Å; E438-Q476 WeakPolarHBondContact OE2-CG 3.33Å; A473-Q476 VanDerWaalsContact C-OE1 3.29Å; A473-Q476 VanDerWaalsContact CA-OE1 3.27Å; A473-Q476 PolarHBondContact O-N 3.48Å; A473-Q476 VanDerWaalsContact O-N 3.16Å; A473-Q476 PolarHBondContact O-OE1 3.12Å; Y474-Q476 VanDerWaalsContact C-N 3.32Å; Y474-Q476 PolarHBondContact O-N 2.84Å; Q476-S479 WeakPolarHBondContact O-CB 3.33Å; Q476-S479 PolarHBondContact O-N 3.39Å; Q476-V480 PolarHBondContact O-N 3.3Å
477	L	94.8	Very high	92.7	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-67	-38.1	175.5	-65.7	171.9	0	0	0	111.9	M434 I460 F470 A473 Y474 V480 I481 F503 M506 F507	M434-L477 HydrophobicContact CE-CD2 3.82Å; M434-L477 HydrophobicContact CE-CG 4.41Å; M434-L477 HydrophobicContact SD-CD2 3.87Å; I460-L477 HydrophobicContact CG2-CD2 3.86Å; F470-L477 HydrophobicContact CB-CD1 3.74Å; A473-L477 WeakPolarHBondContact O-CG 3.42Å; A473-L477 PolarHBondContact O-N 3.13Å; Y474-L477 PolarHBondContact O-N 3.14Å; L477-V480 WeakPolarHBondContact O-CB 3.38Å; L477-V480 PolarHBondContact O-N 2.94Å; L477-I481 PolarHBondContact O-N 3.38Å; L477-I481 VanDerWaalsContact O-N 3.13Å; L477-F503 HydrophobicContact CB-CZ 4.22Å; L477-F503 HydrophobicContact CD2-CE2 3.64Å; L477-F503 HydrophobicContact CD2-CZ 3.65Å; L477-M506 HydrophobicContact CD1-CE 4.13Å; L477-M506 HydrophobicContact CD2-CE 4.38Å; L477-F507 HydrophobicContact CB-CE1 3.73Å; L477-F507 HydrophobicContact CB-CZ 3.72Å
478	Q	94.3	Very high	92.9	Very high	49 Å²	49	43 Å²	43	23%	0.229	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-44.7	171.2	-75.6	-178.4	-32	0	0	111.1	Y474 P475 V480 I481 T482 F507 V512 E515 V516	Y474-Q478 WeakPolarHBondContact O-CB 3.21Å; Y474-Q478 WeakPolarHBondContact O-CG 3.46Å; Y474-Q478 PolarHBondContact O-N 2.95Å; P475-Q478 PolarHBondContact O-N 3.36Å; Q478-V480 VanDerWaalsContact C-N 3.29Å; Q478-V480 PolarHBondContact O-N 3.19Å; Q478-I481 PolarHBondContact O-N 2.96Å; Q478-I481 VanDerWaalsContact O-N 3.12Å; Q478-T482 PolarHBondContact O-N 3.43Å; Q478-T482 PolarHBondContact O-OG1 3.04Å; Q478-T482 VanDerWaalsContact O-OG1 3.14Å; Q478-F507 HydrophobicContact CG-CE1 4.12Å; Q478-V512 HydrophobicContact CG-CG1 4.15Å; Q478-E515 PolarHBondContact NE2-OE2 3.5Å; Q478-V516 HydrophobicContact CG-CG2 3.78Å
479	S	94.8	Very high	93	Very high	29 Å²	29	40.3 Å²	40.3	20%	0.203	20%	0.204	C	C	.	.	H	α-helix	trans	-56.4	-41.6	174.1	179	0	0	0	0	112	E438 P475 Q476 T482 K483	E438-S479 WeakPolarHBondContact OE1-CB 3.44Å; E438-S479 PolarHBondContact OE1-OG 3.37Å; P475-S479 PolarHBondContact O-N 3.35Å; Q476-S479 WeakPolarHBondContact O-CB 3.33Å; Q476-S479 PolarHBondContact O-N 3.39Å; S479-T482 PolarHBondContact O-N 2.86Å; S479-K483 WeakPolarHBondContact O-CB 3.32Å; S479-K483 VanDerWaalsContact O-CG 3.27Å; S479-K483 WeakPolarHBondContact O-CG 3.49Å; S479-K483 PolarHBondContact O-N 3.36Å; S479-K483 WeakPolarHBondContact OG-CE 3.42Å
480	V	95.5	Very high	92.9	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-45.9	173.6	162.9	0	0	0	0	112.2	M434 E438 V441 L457 I460 Q476 L477 Q478 K483 I484 F503	M434-V480 HydrophobicContact CE-CG2 3.51Å; E438-V480 HydrophobicContact CB-CG2 4.47Å; E438-V480 HydrophobicContact CG-CG2 4.41Å; V441-V480 HydrophobicContact CB-CG2 4.31Å; V441-V480 HydrophobicContact CG1-CG1 4.09Å; V441-V480 HydrophobicContact CG1-CG2 4.36Å; V441-V480 HydrophobicContact CG2-CG1 4.23Å; V441-V480 HydrophobicContact CG2-CG2 4Å; L457-V480 HydrophobicContact CD2-CG1 4.26Å; I460-V480 HydrophobicContact CD1-CG1 4.43Å; Q476-V480 PolarHBondContact O-N 3.3Å; L477-V480 WeakPolarHBondContact O-CB 3.38Å; L477-V480 PolarHBondContact O-N 2.94Å; Q478-V480 VanDerWaalsContact C-N 3.29Å; Q478-V480 PolarHBondContact O-N 3.19Å; V480-K483 PolarHBondContact O-N 2.65Å; V480-I484 HydrophobicContact CG1-CD1 3.83Å; V480-I484 VanDerWaalsContact O-CG1 3.29Å; V480-I484 WeakPolarHBondContact O-CG1 3.31Å; V480-I484 PolarHBondContact O-N 3.03Å; V480-F503 HydrophobicContact CB-CZ 4.23Å; V480-F503 HydrophobicContact CG1-CE1 4.14Å; V480-F503 HydrophobicContact CG1-CE2 4.41Å; V480-F503 HydrophobicContact CG1-CZ 3.71Å
481	I	95.1	Very high	92.9	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-60	-49.4	175	-67.8	-60.1	0	0	0	111	L477 Q478 K483 I484 L485 F500 F503 L504 F507 V516 I520	L477-I481 PolarHBondContact O-N 3.38Å; L477-I481 VanDerWaalsContact O-N 3.13Å; Q478-I481 PolarHBondContact O-N 2.96Å; Q478-I481 VanDerWaalsContact O-N 3.12Å; I481-K483 VanDerWaalsContact C-N 3.27Å; I481-K483 PolarHBondContact O-N 3.14Å; I481-I484 PolarHBondContact O-N 3.24Å; I481-I484 VanDerWaalsContact O-N 3.12Å; I481-L485 HydrophobicContact CG2-CD1 3.53Å; I481-L485 HydrophobicContact CG2-CG 3.99Å; I481-L485 WeakPolarHBondContact O-CB 3.45Å; I481-L485 WeakPolarHBondContact O-CG 3.44Å; I481-L485 PolarHBondContact O-N 2.96Å; I481-F500 HydrophobicContact CD1-CE2 4.01Å; I481-F503 HydrophobicContact CD1-CD1 3.59Å; I481-F503 HydrophobicContact CD1-CE1 3.41Å; I481-F503 VanDerWaalsContact CD1-CE1 3.41Å; I481-F503 HydrophobicContact CG1-CD1 4.37Å; I481-F503 HydrophobicContact CG1-CE1 3.75Å; I481-L504 HydrophobicContact CD1-CD2 3.66Å; I481-L504 HydrophobicContact CG1-CD2 4.28Å; I481-F507 HydrophobicContact CG1-CE2 4.07Å; I481-F507 HydrophobicContact CG1-CZ 4.15Å; I481-V516 HydrophobicContact CG1-CG1 4.06Å; I481-V516 HydrophobicContact CG2-CG1 4.17Å; I481-I520 HydrophobicContact CG2-CG1 4.33Å
482	T	94.3	Very high	92.8	Very high	80 Å²	80	41.7 Å²	41.7	49%	0.491	22%	0.216	S	C	.	.	H	α-helix	trans	-57.9	-41.9	-178.9	-57.9	0	0	0	0	111.4	Q478 S479 L485 M486	Q478-T482 PolarHBondContact O-N 3.43Å; Q478-T482 PolarHBondContact O-OG1 3.04Å; Q478-T482 VanDerWaalsContact O-OG1 3.14Å; S479-T482 PolarHBondContact O-N 2.86Å; T482-L485 PolarHBondContact O-N 3.43Å; T482-M486 WeakPolarHBondContact O-CB 3.5Å; T482-M486 PolarHBondContact O-N 3.34Å
483	K	94.1	Very high	92.7	Very high	30 Å²	30	36.6 Å²	36.6	13%	0.13	20%	0.195	C	C	.	.	H	α-helix	trans	-65.6	-41.1	176.2	-71.8	169.8	177.8	-143.4	0	112.6	E438 V441 E442 S479 V480 I481 M486 Y487	E438-K483 PolarHBondContact O-NZ 3Å; V441-K483 HydrophobicContact CG1-CB 4.35Å; E442-K483 HydrophobicContact CB-CD 4Å; E442-K483 HydrophobicContact CG-CD 4.33Å; E442-K483 HydrophobicContact CG-CG 4.39Å; E442-K483 WeakPolarHBondContact OE2-CE 3.31Å; E442-K483 IonicContact OE2-NZ 2.85Å; E442-K483 PolarHBondContact OE2-NZ 3.25Å; S479-K483 WeakPolarHBondContact O-CB 3.32Å; S479-K483 VanDerWaalsContact O-CG 3.27Å; S479-K483 WeakPolarHBondContact O-CG 3.49Å; S479-K483 PolarHBondContact O-N 3.36Å; S479-K483 WeakPolarHBondContact OG-CE 3.42Å; V480-K483 PolarHBondContact O-N 2.65Å; I481-K483 VanDerWaalsContact C-N 3.27Å; I481-K483 PolarHBondContact O-N 3.14Å; K483-M486 PolarHBondContact O-N 2.86Å; K483-Y487 VanDerWaalsContact O-CD2 3.26Å; K483-Y487 WeakPolarHBondContact O-CD2 3.33Å
484	I	94.9	Very high	92.7	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62	-49.5	174.9	-68.3	162.8	0	0	0	109.9	V441 C445 V453 L457 V480 I481 M486 Y487 F488 L494 F500	V441-I484 HydrophobicContact CG1-CG1 4.19Å; C445-I484 VanDerWaalsContact SG-CG1 3.59Å; V453-I484 HydrophobicContact CG1-CD1 4.46Å; V453-I484 HydrophobicContact CG1-CG1 4.36Å; L457-I484 HydrophobicContact CD1-CD1 4.24Å; L457-I484 HydrophobicContact CD2-CD1 3.82Å; L457-I484 HydrophobicContact CG-CD1 4.37Å; V480-I484 HydrophobicContact CG1-CD1 3.83Å; V480-I484 VanDerWaalsContact O-CG1 3.29Å; V480-I484 WeakPolarHBondContact O-CG1 3.31Å; V480-I484 PolarHBondContact O-N 3.03Å; I481-I484 PolarHBondContact O-N 3.24Å; I481-I484 VanDerWaalsContact O-N 3.12Å; I484-M486 PolarHBondContact O-N 3.14Å; I484-Y487 PolarHBondContact O-N 3.46Å; I484-F488 HydrophobicContact CG2-CB 4.41Å; I484-F488 HydrophobicContact CG2-CD2 4.19Å; I484-F488 WeakPolarHBondContact O-CB 3.36Å; I484-F488 PolarHBondContact O-N 2.9Å; I484-L494 HydrophobicContact CG2-CD1 3.63Å; I484-F500 HydrophobicContact CG2-CE2 4.38Å
485	L	93.9	Very high	92.5	Very high	4 Å²	4	36.3 Å²	36.3	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-66.2	-22.6	-178.8	-66.9	176.1	0	0	0	113.6	I481 T482 Y487 H489 L494 I520 V523	I481-L485 HydrophobicContact CG2-CD1 3.53Å; I481-L485 HydrophobicContact CG2-CG 3.99Å; I481-L485 WeakPolarHBondContact O-CB 3.45Å; I481-L485 WeakPolarHBondContact O-CG 3.44Å; I481-L485 PolarHBondContact O-N 2.96Å; T482-L485 PolarHBondContact O-N 3.43Å; L485-Y487 VanDerWaalsContact C-N 3.32Å; L485-H489 PolarHBondContact O-CE1 2.93Å; L485-H489 VanDerWaalsContact O-CE1 3.23Å; L485-H489 PolarHBondContact O-ND1 2.95Å; L485-L494 HydrophobicContact CD2-CD2 3.87Å; L485-I520 HydrophobicContact CD1-CB 4.39Å; L485-I520 HydrophobicContact CD1-CG1 3.83Å; L485-I520 HydrophobicContact CD2-CG1 4.34Å; L485-V523 HydrophobicContact CB-CG1 4.28Å; L485-V523 HydrophobicContact CB-CG2 4.12Å; L485-V523 HydrophobicContact CD1-CG2 4.33Å
486	M	93.3	Very high	92.3	Very high	94 Å²	94	34.7 Å²	34.7	46%	0.463	19%	0.185	S	C	.	.	H	α-helix	trans	-69.7	-27.7	175.7	-169.8	170.6	73.5	0	0	112.9	T482 K483 I484 H489	T482-M486 WeakPolarHBondContact O-CB 3.5Å; T482-M486 PolarHBondContact O-N 3.34Å; K483-M486 PolarHBondContact O-N 2.86Å; I484-M486 PolarHBondContact O-N 3.14Å; M486-H489 PolarHBondContact O-CE1 3.3Å; M486-H489 PolarHBondContact O-NE2 2.88Å
487	Y	91.3	Very high	92.2	Very high	72 Å²	72	33.3 Å²	33.3	28%	0.282	18%	0.178	S	C	.	.	H	α-helix	trans	-113.1	-29.6	-177.8	-62.7	-70	0	0	0	113.6	E442 C445 R446 K483 I484 L485	E442-Y487 HydrophobicContact CG-CE2 3.98Å; C445-Y487 HydrophobicContact CB-CD2 3.69Å; C445-Y487 HydrophobicContact CB-CG 4.31Å; R446-Y487 HydrophobicContact CB-CD1 4.37Å; R446-Y487 HydrophobicContact CB-CE1 4.01Å; R446-Y487 HydrophobicContact CB-CE2 4.17Å; R446-Y487 HydrophobicContact CG-CD1 4.42Å; R446-Y487 HydrophobicContact CG-CE1 3.85Å; R446-Y487 VanDerWaalsContact CZ-OH 3.29Å; R446-Y487 PolarHBondContact NE-OH 3.13Å; R446-Y487 PolarHBondContact NH2-OH 3.22Å; K483-Y487 VanDerWaalsContact O-CD2 3.26Å; K483-Y487 WeakPolarHBondContact O-CD2 3.33Å; I484-Y487 PolarHBondContact O-N 3.46Å; L485-Y487 VanDerWaalsContact C-N 3.32Å
488	F	90.6	Very high	92	Very high	24 Å²	24	40.4 Å²	40.4	11%	0.105	21%	0.212	C	C	.	.			trans	-99	100.4	178.5	-72.2	-94.6	0	0	0	110.7	C445 V453 I484 V493 L494 M497	C445-F488 HydrophobicContact CB-CD2 4.38Å; C445-F488 HydrophobicContact CB-CE2 3.93Å; V453-F488 HydrophobicContact CG2-CE2 3.73Å; V453-F488 HydrophobicContact CG2-CZ 3.72Å; I484-F488 HydrophobicContact CG2-CB 4.41Å; I484-F488 HydrophobicContact CG2-CD2 4.19Å; I484-F488 WeakPolarHBondContact O-CB 3.36Å; I484-F488 PolarHBondContact O-N 2.9Å; F488-V493 HydrophobicContact CD1-CG1 4.32Å; F488-V493 HydrophobicContact CE1-CG1 4.44Å; F488-L494 HydrophobicContact CB-CD1 4.22Å; F488-M497 HydrophobicContact CD1-CE 3.61Å; F488-M497 HydrophobicContact CE1-CE 3.59Å; F488-M497 HydrophobicContact CG-CE 4.19Å; F488-M497 HydrophobicContact CZ-CE 4.16Å
489	H	91.2	Very high	91.9	Very high	69 Å²	69	43.3 Å²	43.3	32%	0.319	22%	0.22	S	C	.	.			trans	-102.8	-14.1	177.5	-56.8	-40.2	0	0	0	113.7	L485 M486 F491 H527	L485-H489 PolarHBondContact O-CE1 2.93Å; L485-H489 VanDerWaalsContact O-CE1 3.23Å; L485-H489 PolarHBondContact O-ND1 2.95Å; M486-H489 PolarHBondContact O-CE1 3.3Å; M486-H489 PolarHBondContact O-NE2 2.88Å; H489-F491 VanDerWaalsContact O-CD2 3.31Å; H489-F491 WeakPolarHBondContact O-CD2 3.46Å; H489-F491 PolarHBondContact O-N 2.98Å; H489-H527 HydrophobicContact CB-CB 4.02Å; H489-H527 AromaticContact CD2-CE1 3.97Å; H489-H527 AromaticContact CD2-ND1 3.79Å; H489-H527 AromaticContact CE1-CE1 3.68Å; H489-H527 AromaticContact CE1-NE2 3.78Å; H489-H527 AromaticContact CG-CG 3.89Å; H489-H527 AromaticContact CG-ND1 3.74Å; H489-H527 AromaticContact ND1-CD2 3.88Å; H489-H527 AromaticContact ND1-CE1 3.96Å; H489-H527 AromaticContact ND1-CG 3.84Å; H489-H527 AromaticContact ND1-ND1 3.9Å; H489-H527 AromaticContact NE2-CE1 3.66Å; H489-H527 AromaticContact NE2-ND1 3.96Å
490	D	89.6	Confident	91.9	Very high	88 Å²	88	42 Å²	42	47%	0.471	21%	0.211	S	C	.	.			trans	-82.6	103.9	171.6	-176.4	-18.6	0	0	0	109.6	S492 V493 L494	D490-S492 VanDerWaalsContact C-N 3.3Å; D490-S492 PolarHBondContact O-N 3.25Å; D490-S492 WeakPolarHBondContact OD1-CA 3.43Å; D490-S492 VanDerWaalsContact OD1-CB 3.3Å; D490-S492 WeakPolarHBondContact OD1-CB 3.3Å; D490-S492 PolarHBondContact OD1-N 3.41Å; D490-V493 HydrophobicContact CB-CB 4.14Å; D490-V493 HydrophobicContact CB-CG2 4.18Å; D490-V493 PolarHBondContact O-N 2.78Å; D490-V493 PolarHBondContact OD1-N 2.7Å; D490-V493 WeakPolarHBondContact OD2-CG2 3.39Å; D490-L494 PolarHBondContact O-N 2.92Å
491	F	90.3	Very high	91.6	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-70	-23.2	-178.8	-79.3	-95.4	0	0	0	113.6	H489 L494 F495 I520 V523 F524 I537 M541	H489-F491 VanDerWaalsContact O-CD2 3.31Å; H489-F491 WeakPolarHBondContact O-CD2 3.46Å; H489-F491 PolarHBondContact O-N 2.98Å; F491-L494 HydrophobicContact CD1-CD2 4.05Å; F491-L494 HydrophobicContact CE1-CD2 4.07Å; F491-L494 PolarHBondContact O-N 2.98Å; F491-F495 HydrophobicContact CB-CD2 4.19Å; F491-F495 HydrophobicContact CB-CE2 4.08Å; F491-F495 HydrophobicContact CD1-CD2 4.34Å; F491-F495 AromaticContact CD1-CE2 3.58Å; F491-F495 HydrophobicContact CD1-CE2 3.58Å; F491-F495 AromaticContact CD1-CZ 3.83Å; F491-F495 HydrophobicContact CD1-CZ 3.83Å; F491-F495 HydrophobicContact CE1-CZ 4.41Å; F491-F495 HydrophobicContact CG-CE2 4.31Å; F491-F495 WeakPolarHBondContact O-CB 3.49Å; F491-F495 WeakPolarHBondContact O-CD2 3.47Å; F491-F495 WeakPolarHBondContact O-CG 3.27Å; F491-F495 PolarHBondContact O-N 3.45Å; F491-I520 HydrophobicContact CE1-CG2 3.8Å; F491-V523 HydrophobicContact CE2-CG1 4.4Å; F491-V523 HydrophobicContact CZ-CB 4.49Å; F491-V523 HydrophobicContact CZ-CG1 4.19Å; F491-F524 HydrophobicContact CB-CD2 4.38Å; F491-F524 AromaticContact CD1-CD2 3.85Å; F491-F524 HydrophobicContact CD1-CD2 3.85Å; F491-F524 AromaticContact CD2-CD2 3.7Å; F491-F524 HydrophobicContact CD2-CD2 3.7Å; F491-F524 HydrophobicContact CD2-CE2 4.45Å; F491-F524 HydrophobicContact CE1-CB 3.92Å; F491-F524 AromaticContact CE1-CD2 3.99Å; F491-F524 HydrophobicContact CE1-CD2 3.99Å; F491-F524 HydrophobicContact CE1-CG 4.46Å; F491-F524 VanDerWaalsContact CE2-CA 3.46Å; F491-F524 HydrophobicContact CE2-CB 3.93Å; F491-F524 AromaticContact CE2-CD2 3.89Å; F491-F524 HydrophobicContact CE2-CD2 3.89Å; F491-F524 HydrophobicContact CE2-CG 4.39Å; F491-F524 AromaticContact CG-CD2 3.7Å; F491-F524 HydrophobicContact CG-CD2 3.7Å; F491-F524 HydrophobicContact CG-CE2 4.29Å; F491-F524 VanDerWaalsContact CZ-CA 3.41Å; F491-F524 HydrophobicContact CZ-CB 3.54Å; F491-F524 HydrophobicContact CZ-CD2 4.03Å; F491-F524 HydrophobicContact CZ-CG 4.3Å; F491-I537 HydrophobicContact CB-CD1 4.37Å; F491-I537 HydrophobicContact CB-CG1 4.4Å; F491-M541 HydrophobicContact CD1-SD 4.47Å
492	S	87.5	Confident	91.5	Very high	45 Å²	45	47.2 Å²	47.2	32%	0.315	24%	0.241	S	C	.	.	H	α-helix	trans	-67.1	-44.1	172.7	-167.5	0	0	0	0	109.5	D490 S496 D534	D490-S492 VanDerWaalsContact C-N 3.3Å; D490-S492 PolarHBondContact O-N 3.25Å; D490-S492 WeakPolarHBondContact OD1-CA 3.43Å; D490-S492 VanDerWaalsContact OD1-CB 3.3Å; D490-S492 WeakPolarHBondContact OD1-CB 3.3Å; D490-S492 PolarHBondContact OD1-N 3.41Å; S492-S496 VanDerWaalsContact O-CB 3.22Å; S492-S496 WeakPolarHBondContact O-CB 3.39Å; S492-S496 PolarHBondContact O-N 3.1Å; S492-S496 PolarHBondContact O-OG 3.4Å; S492-D534 PolarHBondContact OG-OD2 3.44Å
493	V	89.5	Confident	91.5	Very high	44 Å²	44	43.5 Å²	43.5	27%	0.267	22%	0.218	S	C	.	.	H	α-helix	trans	-64.4	-45.6	174.4	171.4	0	0	0	0	111.3	K450 F488 D490 S496 M497	K450-V493 HydrophobicContact CB-CG1 3.88Å; K450-V493 HydrophobicContact CD-CG1 3.86Å; K450-V493 HydrophobicContact CG-CG1 4.46Å; F488-V493 HydrophobicContact CD1-CG1 4.32Å; F488-V493 HydrophobicContact CE1-CG1 4.44Å; D490-V493 HydrophobicContact CB-CB 4.14Å; D490-V493 HydrophobicContact CB-CG2 4.18Å; D490-V493 PolarHBondContact O-N 2.78Å; D490-V493 PolarHBondContact OD1-N 2.7Å; D490-V493 WeakPolarHBondContact OD2-CG2 3.39Å; V493-S496 PolarHBondContact O-N 2.83Å; V493-S496 PolarHBondContact O-OG 3.04Å; V493-M497 HydrophobicContact CG1-CE 4.43Å
494	L	91.3	Very high	91.4	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-51.6	-179.3	-172.9	65.4	0	0	0	112.2	I484 L485 F488 D490 F491 S496 M497 F500	I484-L494 HydrophobicContact CG2-CD1 3.63Å; L485-L494 HydrophobicContact CD2-CD2 3.87Å; F488-L494 HydrophobicContact CB-CD1 4.22Å; D490-L494 PolarHBondContact O-N 2.92Å; F491-L494 HydrophobicContact CD1-CD2 4.05Å; F491-L494 HydrophobicContact CE1-CD2 4.07Å; F491-L494 PolarHBondContact O-N 2.98Å; L494-S496 VanDerWaalsContact C-N 3.28Å; L494-S496 PolarHBondContact O-N 3.19Å; L494-M497 HydrophobicContact CD1-CE 4.16Å; L494-M497 HydrophobicContact CD1-SD 4.42Å; L494-M497 VanDerWaalsContact O-CB 3.31Å; L494-M497 WeakPolarHBondContact O-CB 3.36Å; L494-M497 WeakPolarHBondContact O-CG 3.46Å; L494-M497 PolarHBondContact O-N 3.16Å; L494-F500 HydrophobicContact CD1-CD1 4.49Å; L494-F500 HydrophobicContact CD1-CD2 3.84Å; L494-F500 HydrophobicContact CD1-CE1 4.36Å; L494-F500 HydrophobicContact CD1-CE2 3.71Å; L494-F500 HydrophobicContact CD1-CG 4.24Å; L494-F500 HydrophobicContact CD1-CZ 3.99Å; L494-F500 HydrophobicContact CD2-CE1 3.97Å; L494-F500 HydrophobicContact CD2-CE2 4.33Å; L494-F500 HydrophobicContact CD2-CZ 3.77Å; L494-F500 HydrophobicContact CG-CD1 4.11Å; L494-F500 HydrophobicContact CG-CD2 4.34Å; L494-F500 HydrophobicContact CG-CE1 3.87Å; L494-F500 HydrophobicContact CG-CE2 4.12Å; L494-F500 HydrophobicContact CG-CG 4.34Å; L494-F500 HydrophobicContact CG-CZ 3.88Å
495	F	90.1	Very high	91.1	Very high	13 Å²	13	47.1 Å²	47.1	6%	0.057	24%	0.239	C	C	.	.	H	α-helix	trans	-75	-16.8	179.8	-64.9	-50.1	0	0	0	113.6	F491 M497 F500 L501 V536 I537 A540 M541 I544	F491-F495 HydrophobicContact CB-CD2 4.19Å; F491-F495 HydrophobicContact CB-CE2 4.08Å; F491-F495 HydrophobicContact CD1-CD2 4.34Å; F491-F495 AromaticContact CD1-CE2 3.58Å; F491-F495 HydrophobicContact CD1-CE2 3.58Å; F491-F495 AromaticContact CD1-CZ 3.83Å; F491-F495 HydrophobicContact CD1-CZ 3.83Å; F491-F495 HydrophobicContact CE1-CZ 4.41Å; F491-F495 HydrophobicContact CG-CE2 4.31Å; F491-F495 WeakPolarHBondContact O-CB 3.49Å; F491-F495 WeakPolarHBondContact O-CD2 3.47Å; F491-F495 WeakPolarHBondContact O-CG 3.27Å; F491-F495 PolarHBondContact O-N 3.45Å; F495-M497 PolarHBondContact O-N 2.97Å; F495-F500 HydrophobicContact CD1-CD1 4.01Å; F495-F500 HydrophobicContact CD1-CE1 4.04Å; F495-F500 HydrophobicContact CE1-CD1 4.26Å; F495-F500 AromaticContact CE1-CE1 3.82Å; F495-F500 HydrophobicContact CE1-CE1 3.82Å; F495-L501 HydrophobicContact CD1-CD2 4.08Å; F495-L501 HydrophobicContact CE1-CD2 4.28Å; F495-V536 HydrophobicContact CB-CG1 3.76Å; F495-I537 HydrophobicContact CD2-CG1 4.29Å; F495-A540 HydrophobicContact CB-CB 4.38Å; F495-A540 HydrophobicContact CD1-CB 3.64Å; F495-A540 HydrophobicContact CD2-CB 3.81Å; F495-A540 HydrophobicContact CE1-CB 3.73Å; F495-A540 HydrophobicContact CE2-CB 3.89Å; F495-A540 HydrophobicContact CG-CB 3.69Å; F495-A540 HydrophobicContact CZ-CB 3.86Å; F495-M541 HydrophobicContact CE2-CG 3.85Å; F495-M541 HydrophobicContact CE2-SD 3.74Å; F495-M541 HydrophobicContact CZ-CG 4.19Å; F495-M541 HydrophobicContact CZ-SD 3.59Å; F495-M541 VanDerWaalsContact CZ-SD 3.59Å; F495-I544 HydrophobicContact CE1-CD1 3.94Å; F495-I544 HydrophobicContact CZ-CD1 3.81Å
496	S	88.7	Confident	91	Very high	50 Å²	50	47.4 Å²	47.4	35%	0.35	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-11.2	169.5	78.9	0	0	0	0	113.7	K450 S492 V493 L494 E498	K450-S496 PolarHBondContact NZ-OG 3.41Å; S492-S496 VanDerWaalsContact O-CB 3.22Å; S492-S496 WeakPolarHBondContact O-CB 3.39Å; S492-S496 PolarHBondContact O-N 3.1Å; S492-S496 PolarHBondContact O-OG 3.4Å; V493-S496 PolarHBondContact O-N 2.83Å; V493-S496 PolarHBondContact O-OG 3.04Å; L494-S496 VanDerWaalsContact C-N 3.28Å; L494-S496 PolarHBondContact O-N 3.19Å; S496-E498 PolarHBondContact O-N 3.22Å
497	M	91.1	Very high	90.9	Very high	6 Å²	6	43 Å²	43	3%	0.03	22%	0.219	C	C	.	.			trans	-74.7	113.2	175.7	-61.4	-177	-160.8	0	0	110.1	K450 V453 N454 F488 V493 L494 F495 R499 F500	K450-M497 HydrophobicContact CB-CE 3.68Å; K450-M497 HydrophobicContact CB-CG 4.08Å; K450-M497 HydrophobicContact CB-SD 4.43Å; V453-M497 HydrophobicContact CB-SD 4.47Å; V453-M497 HydrophobicContact CG1-SD 4.15Å; N454-M497 HydrophobicContact CB-CB 4.49Å; F488-M497 HydrophobicContact CD1-CE 3.61Å; F488-M497 HydrophobicContact CE1-CE 3.59Å; F488-M497 HydrophobicContact CG-CE 4.19Å; F488-M497 HydrophobicContact CZ-CE 4.16Å; V493-M497 HydrophobicContact CG1-CE 4.43Å; L494-M497 HydrophobicContact CD1-CE 4.16Å; L494-M497 HydrophobicContact CD1-SD 4.42Å; L494-M497 VanDerWaalsContact O-CB 3.31Å; L494-M497 WeakPolarHBondContact O-CB 3.36Å; L494-M497 WeakPolarHBondContact O-CG 3.46Å; L494-M497 PolarHBondContact O-N 3.16Å; F495-M497 PolarHBondContact O-N 2.97Å; M497-R499 PolarHBondContact O-N 3.24Å; M497-F500 HydrophobicContact CB-CB 3.85Å; M497-F500 PolarHBondContact O-N 3.03Å
498	E	90.3	Very high	90.8	Very high	150 Å²	150	44.2 Å²	44.2	70%	0.701	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-29.6	-177.8	-64.2	179.1	178.8	0	0	114.1	N454 S496 P502	N454-E498 PolarHBondContact OD1-N 3.17Å; S496-E498 PolarHBondContact O-N 3.22Å; E498-P502 WeakPolarHBondContact O-CD 3.42Å; E498-P502 VanDerWaalsContact O-CG 3.31Å; E498-P502 WeakPolarHBondContact O-CG 3.5Å
499	R	93.6	Very high	90.7	Very high	110 Å²	110	48.7 Å²	48.7	42%	0.415	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-6.6	-176.5	-57.2	-63.8	-179	-175.8	-3	114	N454 L457 A458 I461 M497 F503	N454-R499 VanDerWaalsContact OD1-CB 3.25Å; N454-R499 WeakPolarHBondContact OD1-CB 3.49Å; N454-R499 WeakPolarHBondContact OD1-CG 3.35Å; N454-R499 PolarHBondContact OD1-N 3.07Å; L457-R499 HydrophobicContact CB-CB 4.01Å; A458-R499 HydrophobicContact CB-CG 3.9Å; I461-R499 HydrophobicContact CD1-CB 4.11Å; M497-R499 PolarHBondContact O-N 3.24Å; R499-F503 VanDerWaalsContact O-CB 3.22Å; R499-F503 WeakPolarHBondContact O-CB 3.42Å; R499-F503 PolarHBondContact O-N 3.18Å
500	F	93.4	Very high	90.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-69.4	-50.7	-178.6	-177.5	-103.7	0	0	0	112.4	L457 I481 I484 L494 F495 M497 F503 L504 I520	L457-F500 HydrophobicContact CD1-CB 4.44Å; L457-F500 HydrophobicContact CD1-CD2 4.28Å; I481-F500 HydrophobicContact CD1-CE2 4.01Å; I484-F500 HydrophobicContact CG2-CE2 4.38Å; L494-F500 HydrophobicContact CD1-CD1 4.49Å; L494-F500 HydrophobicContact CD1-CD2 3.84Å; L494-F500 HydrophobicContact CD1-CE1 4.36Å; L494-F500 HydrophobicContact CD1-CE2 3.71Å; L494-F500 HydrophobicContact CD1-CG 4.24Å; L494-F500 HydrophobicContact CD1-CZ 3.99Å; L494-F500 HydrophobicContact CD2-CE1 3.97Å; L494-F500 HydrophobicContact CD2-CE2 4.33Å; L494-F500 HydrophobicContact CD2-CZ 3.77Å; L494-F500 HydrophobicContact CG-CD1 4.11Å; L494-F500 HydrophobicContact CG-CD2 4.34Å; L494-F500 HydrophobicContact CG-CE1 3.87Å; L494-F500 HydrophobicContact CG-CE2 4.12Å; L494-F500 HydrophobicContact CG-CG 4.34Å; L494-F500 HydrophobicContact CG-CZ 3.88Å; F495-F500 HydrophobicContact CD1-CD1 4.01Å; F495-F500 HydrophobicContact CD1-CE1 4.04Å; F495-F500 HydrophobicContact CE1-CD1 4.26Å; F495-F500 AromaticContact CE1-CE1 3.82Å; F495-F500 HydrophobicContact CE1-CE1 3.82Å; M497-F500 HydrophobicContact CB-CB 3.85Å; M497-F500 PolarHBondContact O-N 3.03Å; F500-F503 WeakPolarHBondContact O-CB 3.45Å; F500-F503 PolarHBondContact O-N 3.25Å; F500-L504 HydrophobicContact CD1-CD1 4.23Å; F500-L504 HydrophobicContact CE1-CD1 3.7Å; F500-L504 HydrophobicContact CE1-CG 4.33Å; F500-L504 HydrophobicContact CZ-CD1 4.11Å; F500-L504 HydrophobicContact CZ-CD2 4.49Å; F500-L504 HydrophobicContact CZ-CG 4.43Å; F500-L504 PolarHBondContact O-N 3.29Å; F500-I520 HydrophobicContact CZ-CD1 4.45Å
501	L	90.7	Very high	90.3	Very high	65 Å²	65	49.9 Å²	49.9	34%	0.34	26%	0.26	S	S	.	.	H	α-helix	trans	-64.1	-45.5	176.4	-61.7	178.6	0	0	0	112.5	F495 F503 L504 D505	F495-L501 HydrophobicContact CD1-CD2 4.08Å; F495-L501 HydrophobicContact CE1-CD2 4.28Å; L501-F503 PolarHBondContact O-N 3.37Å; L501-L504 HydrophobicContact CD2-CD1 4.16Å; L501-L504 WeakPolarHBondContact O-CA 3.49Å; L501-L504 WeakPolarHBondContact O-CB 3.23Å; L501-L504 PolarHBondContact O-N 3.05Å; L501-D505 PolarHBondContact O-N 3.25Å
502	P	92.5	Very high	90.4	Very high	48 Å²	48	50.4 Å²	50.4	31%	0.312	26%	0.263	S	S	.	.	H	α-helix	trans	-58	-31.1	172.7	-28.5	36.3	0	0	0	114.5	I461 E498 D505	I461-P502 HydrophobicContact CD1-CB 4.09Å; E498-P502 WeakPolarHBondContact O-CD 3.42Å; E498-P502 VanDerWaalsContact O-CG 3.31Å; E498-P502 WeakPolarHBondContact O-CG 3.5Å; P502-D505 PolarHBondContact O-N 3.34Å
503	F	93.9	Very high	90.5	Very high	1 Å²	1	51.6 Å²	51.6	0%	0.004	26%	0.261	C	S	.	.	H	α-helix	trans	-69.3	-39.9	173.4	-180	-92.7	0	0	0	111.4	L457 I460 I461 L477 V480 I481 R499 F500 L501 D505 M506 F507	L457-F503 HydrophobicContact CD2-CB 4.35Å; L457-F503 HydrophobicContact CD2-CD1 4.19Å; L457-F503 HydrophobicContact CD2-CD2 3.82Å; L457-F503 HydrophobicContact CD2-CE1 4.48Å; L457-F503 HydrophobicContact CD2-CE2 4.12Å; L457-F503 HydrophobicContact CD2-CG 3.85Å; L457-F503 HydrophobicContact CD2-CZ 4.44Å; I460-F503 HydrophobicContact CB-CE2 4.37Å; I460-F503 HydrophobicContact CG2-CD2 4.42Å; I460-F503 HydrophobicContact CG2-CE2 3.75Å; I461-F503 HydrophobicContact CD1-CB 4.08Å; I461-F503 HydrophobicContact CG1-CB 4.25Å; I461-F503 HydrophobicContact CG1-CD2 4.14Å; L477-F503 HydrophobicContact CB-CZ 4.22Å; L477-F503 HydrophobicContact CD2-CE2 3.64Å; L477-F503 HydrophobicContact CD2-CZ 3.65Å; V480-F503 HydrophobicContact CB-CZ 4.23Å; V480-F503 HydrophobicContact CG1-CE1 4.14Å; V480-F503 HydrophobicContact CG1-CE2 4.41Å; V480-F503 HydrophobicContact CG1-CZ 3.71Å; I481-F503 HydrophobicContact CD1-CD1 3.59Å; I481-F503 HydrophobicContact CD1-CE1 3.41Å; I481-F503 VanDerWaalsContact CD1-CE1 3.41Å; I481-F503 HydrophobicContact CG1-CD1 4.37Å; I481-F503 HydrophobicContact CG1-CE1 3.75Å; R499-F503 VanDerWaalsContact O-CB 3.22Å; R499-F503 WeakPolarHBondContact O-CB 3.42Å; R499-F503 PolarHBondContact O-N 3.18Å; F500-F503 WeakPolarHBondContact O-CB 3.45Å; F500-F503 PolarHBondContact O-N 3.25Å; L501-F503 PolarHBondContact O-N 3.37Å; F503-D505 VanDerWaalsContact C-N 3.27Å; F503-D505 PolarHBondContact O-N 3.06Å; F503-M506 HydrophobicContact CD2-SD 3.86Å; F503-M506 HydrophobicContact CE2-SD 4.31Å; F503-M506 VanDerWaalsContact O-CB 3.3Å; F503-M506 WeakPolarHBondContact O-CB 3.25Å; F503-M506 PolarHBondContact O-N 2.58Å; F503-F507 HydrophobicContact CD1-CE2 4.39Å; F503-F507 HydrophobicContact CE1-CE2 4.04Å; F503-F507 HydrophobicContact CE1-CZ 4.23Å
504	L	91.5	Very high	90.7	Very high	19 Å²	19	50.2 Å²	50.2	10%	0.099	25%	0.252	C	S	.	.	H	α-helix	trans	-63.2	-33.5	172.8	-65.9	179.3	0	0	0	112.4	I481 F500 L501 M506 F507 V516 I520	I481-L504 HydrophobicContact CD1-CD2 3.66Å; I481-L504 HydrophobicContact CG1-CD2 4.28Å; F500-L504 HydrophobicContact CD1-CD1 4.23Å; F500-L504 HydrophobicContact CE1-CD1 3.7Å; F500-L504 HydrophobicContact CE1-CG 4.33Å; F500-L504 HydrophobicContact CZ-CD1 4.11Å; F500-L504 HydrophobicContact CZ-CD2 4.49Å; F500-L504 HydrophobicContact CZ-CG 4.43Å; F500-L504 PolarHBondContact O-N 3.29Å; L501-L504 HydrophobicContact CD2-CD1 4.16Å; L501-L504 WeakPolarHBondContact O-CA 3.49Å; L501-L504 WeakPolarHBondContact O-CB 3.23Å; L501-L504 PolarHBondContact O-N 3.05Å; L504-M506 PolarHBondContact O-N 3.19Å; L504-F507 HydrophobicContact CD2-CD2 4.46Å; L504-F507 HydrophobicContact CD2-CE2 4.27Å; L504-F507 WeakPolarHBondContact O-CD2 3.34Å; L504-F507 PolarHBondContact O-N 3.3Å; L504-F507 VanDerWaalsContact O-N 3.12Å; L504-V516 HydrophobicContact CD2-CG1 3.65Å; L504-I520 HydrophobicContact CD1-CD1 3.78Å; L504-I520 HydrophobicContact CD2-CD1 3.78Å; L504-I520 HydrophobicContact CG-CD1 4.47Å
505	D	89.6	Confident	90.7	Very high	88 Å²	88	54.7 Å²	54.7	47%	0.471	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-12.8	177.4	-66.2	-28.8	0	0	0	113.3	L501 P502 F503 F507	L501-D505 PolarHBondContact O-N 3.25Å; P502-D505 PolarHBondContact O-N 3.34Å; F503-D505 VanDerWaalsContact C-N 3.27Å; F503-D505 PolarHBondContact O-N 3.06Å; D505-F507 VanDerWaalsContact C-N 3.26Å; D505-F507 PolarHBondContact O-N 3.38Å
506	M	90.6	Very high	90.9	Very high	10 Å²	10	54.3 Å²	54.3	5%	0.049	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-21.2	172.2	-62.9	174.9	55.5	0	0	112.9	I461 M464 F470 L477 F503 L504 Q508	I461-M506 HydrophobicContact CB-SD 4.2Å; I461-M506 HydrophobicContact CG1-SD 3.64Å; I461-M506 HydrophobicContact CG2-SD 4.47Å; M464-M506 HydrophobicContact CB-CE 3.5Å; M464-M506 VanDerWaalsContact CB-CE 3.5Å; M464-M506 HydrophobicContact CG-CE 4.35Å; F470-M506 HydrophobicContact CB-CE 3.63Å; F470-M506 HydrophobicContact CD1-CE 4.33Å; F470-M506 WeakPolarHBondContact CD2-O 3.34Å; F470-M506 WeakPolarHBondContact CE2-O 3.3Å; F470-M506 HydrophobicContact CG-CE 4.25Å; L477-M506 HydrophobicContact CD1-CE 4.13Å; L477-M506 HydrophobicContact CD2-CE 4.38Å; F503-M506 HydrophobicContact CD2-SD 3.86Å; F503-M506 HydrophobicContact CE2-SD 4.31Å; F503-M506 VanDerWaalsContact O-CB 3.3Å; F503-M506 WeakPolarHBondContact O-CB 3.25Å; F503-M506 PolarHBondContact O-N 2.58Å; L504-M506 PolarHBondContact O-N 3.19Å; M506-Q508 VanDerWaalsContact C-N 3.34Å; M506-Q508 PolarHBondContact O-N 3.03Å
507	F	92.4	Very high	91.2	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.009	26%	0.258	C	S	.	.			trans	-77.2	84.3	176.5	-62.1	-75.9	0	0	0	110.4	Y474 L477 Q478 I481 F503 L504 D505 V512 R513 V516	Y474-F507 AromaticContact CD1-CD1 3.73Å; Y474-F507 HydrophobicContact CD1-CD1 3.73Å; Y474-F507 HydrophobicContact CD1-CE1 4.16Å; Y474-F507 HydrophobicContact CE1-CD1 4.03Å; L477-F507 HydrophobicContact CB-CE1 3.73Å; L477-F507 HydrophobicContact CB-CZ 3.72Å; Q478-F507 HydrophobicContact CG-CE1 4.12Å; I481-F507 HydrophobicContact CG1-CE2 4.07Å; I481-F507 HydrophobicContact CG1-CZ 4.15Å; F503-F507 HydrophobicContact CD1-CE2 4.39Å; F503-F507 HydrophobicContact CE1-CE2 4.04Å; F503-F507 HydrophobicContact CE1-CZ 4.23Å; L504-F507 HydrophobicContact CD2-CD2 4.46Å; L504-F507 HydrophobicContact CD2-CE2 4.27Å; L504-F507 WeakPolarHBondContact O-CD2 3.34Å; L504-F507 PolarHBondContact O-N 3.3Å; L504-F507 VanDerWaalsContact O-N 3.12Å; D505-F507 VanDerWaalsContact C-N 3.26Å; D505-F507 PolarHBondContact O-N 3.38Å; F507-V512 HydrophobicContact CD1-CG1 3.62Å; F507-V512 HydrophobicContact CE1-CG1 4.15Å; F507-R513 HydrophobicContact CB-CB 4.02Å; F507-R513 HydrophobicContact CB-CG 4.22Å; F507-R513 WeakPolarHBondContact O-CB 3.36Å; F507-R513 WeakPolarHBondContact O-CD 3.48Å; F507-V516 HydrophobicContact CD1-CG2 4.1Å; F507-V516 HydrophobicContact CD2-CG1 4.27Å; F507-V516 HydrophobicContact CD2-CG2 4.21Å; F507-V516 HydrophobicContact CE1-CG2 3.89Å; F507-V516 HydrophobicContact CE2-CG1 4.08Å; F507-V516 HydrophobicContact CE2-CG2 4.04Å; F507-V516 HydrophobicContact CG-CG2 4.25Å; F507-V516 HydrophobicContact CZ-CG2 3.87Å
508	Q	88.7	Confident	91.3	Very high	96 Å²	96	54.4 Å²	54.4	45%	0.449	27%	0.267	S	S	.	.			trans	-86.2	-20.8	-176.5	-64.5	-177.7	-2.5	0	0	113.4	F470 Y474 M506 D510	F470-Q508 HydrophobicContact CE2-CB 4.37Å; F470-Q508 HydrophobicContact CE2-CG 4.07Å; F470-Q508 HydrophobicContact CZ-CG 4.28Å; Y474-Q508 PolarHBondContact OH-N 3.13Å; M506-Q508 VanDerWaalsContact C-N 3.34Å; M506-Q508 PolarHBondContact O-N 3.03Å; Q508-D510 PolarHBondContact O-N 2.93Å
509	K	88.6	Confident	91.5	Very high	118 Å²	118	49.1 Å²	49.1	51%	0.513	25%	0.246	S	C	.	.	S	Bend	trans	-79	116.5	174.6	-175.5	174.2	176.8	-174.1	0	110	Y474 S511 V512 R513	Y474-K509 HydrophobicContact CE2-CB 3.88Å; Y474-K509 HydrophobicContact CE2-CD 4.47Å; Y474-K509 PolarHBondContact OH-N 3.31Å; K509-S511 VanDerWaalsContact C-N 3.32Å; K509-S511 WeakPolarHBondContact CE-OG 3.35Å; K509-S511 PolarHBondContact O-N 3.06Å; K509-V512 HydrophobicContact CB-CB 4.34Å; K509-V512 HydrophobicContact CB-CG2 4.14Å; K509-V512 HydrophobicContact CD-CG2 3.86Å; K509-V512 HydrophobicContact CG-CG2 4.12Å; K509-V512 PolarHBondContact O-N 3.32Å; K509-R513 PolarHBondContact O-N 3.1Å
510	D	85.7	Confident	91.6	Very high	120 Å²	120	43.9 Å²	43.9	64%	0.642	23%	0.226	S	C	*	.	H	α-helix	trans	-50.8	-46	-173.7	-67.9	-26.2	0	0	0	113.7	Q508 V512 R513 V514	Q508-D510 PolarHBondContact O-N 2.93Å; D510-V512 VanDerWaalsContact C-N 3.34Å; D510-V512 PolarHBondContact O-N 2.63Å; D510-R513 PolarHBondContact O-N 3.32Å; D510-V514 VanDerWaalsContact O-CG2 3.22Å; D510-V514 WeakPolarHBondContact O-CG2 3.48Å; D510-V514 PolarHBondContact O-N 3.45Å
511	S	87	Confident	91.7	Very high	62 Å²	62	43.9 Å²	43.9	43%	0.434	23%	0.226	S	C	.	.	H	α-helix	trans	-60.1	-44.1	-179.4	68.2	0	0	0	0	112.4	K509 E515	K509-S511 VanDerWaalsContact C-N 3.32Å; K509-S511 WeakPolarHBondContact CE-OG 3.35Å; K509-S511 PolarHBondContact O-N 3.06Å; S511-E515 WeakPolarHBondContact O-CG 3.35Å; S511-E515 PolarHBondContact O-N 2.85Å
512	V	91.3	Very high	91.9	Very high	12 Å²	12	46 Å²	46	7%	0.073	24%	0.235	C	C	.	.	H	α-helix	trans	-70.7	-41.6	-178.7	179.5	0	0	0	0	110.1	Y474 Q478 F507 K509 D510 V514 E515 V516	Y474-V512 HydrophobicContact CD1-CG1 3.96Å; Y474-V512 HydrophobicContact CD2-CG2 4.36Å; Y474-V512 HydrophobicContact CG-CG1 4.01Å; Y474-V512 HydrophobicContact CG-CG2 4.4Å; Q478-V512 HydrophobicContact CG-CG1 4.15Å; F507-V512 HydrophobicContact CD1-CG1 3.62Å; F507-V512 HydrophobicContact CE1-CG1 4.15Å; K509-V512 HydrophobicContact CB-CB 4.34Å; K509-V512 HydrophobicContact CB-CG2 4.14Å; K509-V512 HydrophobicContact CD-CG2 3.86Å; K509-V512 HydrophobicContact CG-CG2 4.12Å; K509-V512 PolarHBondContact O-N 3.32Å; D510-V512 VanDerWaalsContact C-N 3.34Å; D510-V512 PolarHBondContact O-N 2.63Å; V512-V514 VanDerWaalsContact C-N 3.32Å; V512-V514 PolarHBondContact O-N 3.46Å; V512-E515 PolarHBondContact O-N 3.24Å; V512-V516 WeakPolarHBondContact O-CG2 3.49Å; V512-V516 PolarHBondContact O-N 3.04Å
513	R	91.2	Very high	92	Very high	70 Å²	70	45.1 Å²	45.1	26%	0.264	23%	0.228	S	C	.	.	H	α-helix	trans	-59.5	-44.3	177.4	-169.8	-178.3	177.7	177.9	-1.2	111.3	F507 K509 D510 V516 C517 H543 T547	F507-R513 HydrophobicContact CB-CB 4.02Å; F507-R513 HydrophobicContact CB-CG 4.22Å; F507-R513 WeakPolarHBondContact O-CB 3.36Å; F507-R513 WeakPolarHBondContact O-CD 3.48Å; K509-R513 PolarHBondContact O-N 3.1Å; D510-R513 PolarHBondContact O-N 3.32Å; R513-V516 PolarHBondContact O-N 2.99Å; R513-C517 PolarHBondContact O-N 3.18Å; R513-C517 PolarHBondContact O-SG 3.35Å; R513-H543 PolarHBondContact NH2-NE2 3.15Å; R513-T547 HydrophobicContact CG-CG2 3.88Å; R513-T547 VanDerWaalsContact NE-CG2 3.31Å
514	V	92.1	Very high	92	Very high	14 Å²	14	45 Å²	45	9%	0.085	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-41.1	178.4	173.1	0	0	0	0	111.6	D510 V512 V516 C517 K518	D510-V514 VanDerWaalsContact O-CG2 3.22Å; D510-V514 WeakPolarHBondContact O-CG2 3.48Å; D510-V514 PolarHBondContact O-N 3.45Å; V512-V514 VanDerWaalsContact C-N 3.32Å; V512-V514 PolarHBondContact O-N 3.46Å; V514-V516 PolarHBondContact O-N 3.22Å; V514-C517 PolarHBondContact O-N 3.46Å; V514-K518 HydrophobicContact CG1-CD 4.31Å; V514-K518 HydrophobicContact CG1-CG 4.47Å; V514-K518 WeakPolarHBondContact O-CG 3.37Å; V514-K518 PolarHBondContact O-N 3.44Å
515	E	91.9	Very high	92	Very high	95 Å²	95	47.2 Å²	47.2	44%	0.444	24%	0.239	S	C	.	.	H	α-helix	trans	-61.4	-41.9	175.2	-73.7	171.7	-178.5	0	0	112.6	Q478 S511 V512 K518 S519	Q478-E515 PolarHBondContact NE2-OE2 3.5Å; S511-E515 WeakPolarHBondContact O-CG 3.35Å; S511-E515 PolarHBondContact O-N 2.85Å; V512-E515 PolarHBondContact O-N 3.24Å; E515-K518 PolarHBondContact O-N 3.19Å; E515-S519 PolarHBondContact O-N 2.95Å; E515-S519 PolarHBondContact O-OG 3.05Å
516	V	94.1	Very high	92.1	Very high	4 Å²	4	50.2 Å²	50.2	2%	0.024	25%	0.248	C	C	.	.	H	α-helix	trans	-63.6	-46.2	174.9	172.6	0	0	0	0	110.4	Q478 I481 L504 F507 V512 R513 V514 K518 S519 I520	Q478-V516 HydrophobicContact CG-CG2 3.78Å; I481-V516 HydrophobicContact CG1-CG1 4.06Å; I481-V516 HydrophobicContact CG2-CG1 4.17Å; L504-V516 HydrophobicContact CD2-CG1 3.65Å; F507-V516 HydrophobicContact CD1-CG2 4.1Å; F507-V516 HydrophobicContact CD2-CG1 4.27Å; F507-V516 HydrophobicContact CD2-CG2 4.21Å; F507-V516 HydrophobicContact CE1-CG2 3.89Å; F507-V516 HydrophobicContact CE2-CG1 4.08Å; F507-V516 HydrophobicContact CE2-CG2 4.04Å; F507-V516 HydrophobicContact CG-CG2 4.25Å; F507-V516 HydrophobicContact CZ-CG2 3.87Å; V512-V516 WeakPolarHBondContact O-CG2 3.49Å; V512-V516 PolarHBondContact O-N 3.04Å; R513-V516 PolarHBondContact O-N 2.99Å; V514-V516 PolarHBondContact O-N 3.22Å; V516-K518 VanDerWaalsContact C-N 3.34Å; V516-K518 PolarHBondContact O-N 2.95Å; V516-S519 WeakPolarHBondContact O-CB 3.42Å; V516-S519 PolarHBondContact O-N 3.19Å; V516-I520 HydrophobicContact CG1-CD1 4.06Å; V516-I520 WeakPolarHBondContact O-CG1 3.45Å; V516-I520 PolarHBondContact O-N 3.29Å
517	C	94.6	Very high	92.1	Very high	9 Å²	9	53 Å²	53	6%	0.061	26%	0.26	C	S	.	.	H	α-helix	trans	-59	-42.9	175.5	-70.9	0	0	0	0	112.3	R513 V514 S519 I520 M521 I544 M548	R513-C517 PolarHBondContact O-N 3.18Å; R513-C517 PolarHBondContact O-SG 3.35Å; V514-C517 PolarHBondContact O-N 3.46Å; C517-S519 PolarHBondContact O-N 3.06Å; C517-I520 PolarHBondContact O-N 2.91Å; C517-M521 WeakPolarHBondContact O-CB 3.43Å; C517-M521 WeakPolarHBondContact O-CG 3.34Å; C517-M521 PolarHBondContact O-N 2.86Å; C517-I544 HydrophobicContact CB-CG2 3.76Å; C517-M548 HydrophobicContact CB-CG 3.59Å; C517-M548 HydrophobicContact CB-SD 4.17Å
518	K	94.1	Very high	91.8	Very high	50 Å²	50	54.3 Å²	54.3	22%	0.217	27%	0.267	C	S	.	.	H	α-helix	trans	-58.6	-46.8	174.2	-74	172.5	179	175.4	0	111.3	V514 E515 V516 I520 M521 E522 M548 L564 L567	V514-K518 HydrophobicContact CG1-CD 4.31Å; V514-K518 HydrophobicContact CG1-CG 4.47Å; V514-K518 WeakPolarHBondContact O-CG 3.37Å; V514-K518 PolarHBondContact O-N 3.44Å; E515-K518 PolarHBondContact O-N 3.19Å; V516-K518 VanDerWaalsContact C-N 3.34Å; V516-K518 PolarHBondContact O-N 2.95Å; K518-I520 VanDerWaalsContact C-N 3.33Å; K518-I520 PolarHBondContact O-N 3.47Å; K518-M521 WeakPolarHBondContact O-CB 3.39Å; K518-M521 PolarHBondContact O-N 3.03Å; K518-M521 VanDerWaalsContact O-N 3.12Å; K518-E522 WeakPolarHBondContact O-CG 3.13Å; K518-E522 PolarHBondContact O-N 2.89Å; K518-M548 HydrophobicContact CG-SD 3.97Å; K518-L564 HydrophobicContact CD-CD2 4.27Å; K518-L564 HydrophobicContact CG-CD2 4.03Å; K518-L567 HydrophobicContact CB-CD1 4.22Å; K518-L567 HydrophobicContact CG-CD1 3.95Å
519	S	94.8	Very high	91.5	Very high	38 Å²	38	57 Å²	57	27%	0.266	28%	0.283	S	S	.	.	H	α-helix	trans	-59.3	-43.3	179.1	-55.6	0	0	0	0	112	E515 V516 C517 V523	E515-S519 PolarHBondContact O-N 2.95Å; E515-S519 PolarHBondContact O-OG 3.05Å; V516-S519 WeakPolarHBondContact O-CB 3.42Å; V516-S519 PolarHBondContact O-N 3.19Å; C517-S519 PolarHBondContact O-N 3.06Å; S519-V523 WeakPolarHBondContact O-CG2 3.39Å; S519-V523 PolarHBondContact O-N 3.12Å
520	I	95.3	Very high	91.3	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.9	-43.7	175.8	-62.6	165.4	0	0	0	110.7	I481 L485 F491 F500 L504 V516 C517 K518 V523 F524 I544	I481-I520 HydrophobicContact CG2-CG1 4.33Å; L485-I520 HydrophobicContact CD1-CB 4.39Å; L485-I520 HydrophobicContact CD1-CG1 3.83Å; L485-I520 HydrophobicContact CD2-CG1 4.34Å; F491-I520 HydrophobicContact CE1-CG2 3.8Å; F500-I520 HydrophobicContact CZ-CD1 4.45Å; L504-I520 HydrophobicContact CD1-CD1 3.78Å; L504-I520 HydrophobicContact CD2-CD1 3.78Å; L504-I520 HydrophobicContact CG-CD1 4.47Å; V516-I520 HydrophobicContact CG1-CD1 4.06Å; V516-I520 WeakPolarHBondContact O-CG1 3.45Å; V516-I520 PolarHBondContact O-N 3.29Å; C517-I520 PolarHBondContact O-N 2.91Å; K518-I520 VanDerWaalsContact C-N 3.33Å; K518-I520 PolarHBondContact O-N 3.47Å; I520-V523 PolarHBondContact O-N 3.18Å; I520-F524 WeakPolarHBondContact O-CB 3.41Å; I520-F524 PolarHBondContact O-N 3.46Å; I520-I544 HydrophobicContact CD1-CD1 4.31Å; I520-I544 HydrophobicContact CG2-CD1 3.95Å
521	M	94.9	Very high	91.4	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67.1	-40.2	-179.1	-71.1	-74.7	-38	0	0	113.3	C517 K518 V523 F524 I525 M541 I544 M548 L567 F571	C517-M521 WeakPolarHBondContact O-CB 3.43Å; C517-M521 WeakPolarHBondContact O-CG 3.34Å; C517-M521 PolarHBondContact O-N 2.86Å; K518-M521 WeakPolarHBondContact O-CB 3.39Å; K518-M521 PolarHBondContact O-N 3.03Å; K518-M521 VanDerWaalsContact O-N 3.12Å; M521-V523 VanDerWaalsContact C-N 3.35Å; M521-F524 PolarHBondContact O-N 3.15Å; M521-I525 HydrophobicContact CE-CD1 4.31Å; M521-I525 WeakPolarHBondContact O-CD1 3.37Å; M521-I525 VanDerWaalsContact O-CG1 3.27Å; M521-I525 WeakPolarHBondContact O-CG1 3.22Å; M521-I525 PolarHBondContact O-N 3.23Å; M521-M541 HydrophobicContact CE-CE 3.95Å; M521-M541 HydrophobicContact CG-CE 4.48Å; M521-M541 HydrophobicContact SD-CE 3.17Å; M521-M541 WeakPolarHBondContact SD-CE 3.45Å; M521-I544 HydrophobicContact CG-CG2 3.81Å; M521-I544 HydrophobicContact SD-CG2 3.96Å; M521-M548 HydrophobicContact CB-CE 4.35Å; M521-M548 HydrophobicContact CE-CE 4.32Å; M521-M548 HydrophobicContact CG-CE 3.45Å; M521-M548 VanDerWaalsContact CG-CE 3.45Å; M521-M548 HydrophobicContact CG-SD 3.94Å; M521-M548 HydrophobicContact SD-CE 3.91Å; M521-L567 HydrophobicContact CB-CB 4.3Å; M521-L567 HydrophobicContact CB-CD1 4.3Å; M521-L567 HydrophobicContact CB-CD2 4.25Å; M521-L567 HydrophobicContact CE-CB 4.26Å; M521-L567 WeakPolarHBondContact CE-O 3.37Å; M521-F571 HydrophobicContact CE-CB 3.76Å
522	E	94.5	Very high	91.4	Very high	111 Å²	111	55.7 Å²	55.7	52%	0.519	27%	0.272	S	S	.	.	H	α-helix	trans	-61.7	-44.4	176.1	-74.4	172.8	-174.9	0	0	111.1	K518 K526 L567	K518-E522 WeakPolarHBondContact O-CG 3.13Å; K518-E522 PolarHBondContact O-N 2.89Å; E522-K526 VanDerWaalsContact O-CB 3.27Å; E522-K526 WeakPolarHBondContact O-CB 3.5Å; E522-K526 PolarHBondContact O-N 2.85Å; E522-K526 VanDerWaalsContact O-N 3.09Å; E522-L567 HydrophobicContact CG-CD2 3.91Å
523	V	94.5	Very high	91.3	Very high	28 Å²	28	64 Å²	64	17%	0.17	30%	0.302	C	S	.	.	H	α-helix	trans	-67.3	-40.5	175.8	175.6	0	0	0	0	110.9	L485 F491 S519 I520 M521 K526 H527	L485-V523 HydrophobicContact CB-CG1 4.28Å; L485-V523 HydrophobicContact CB-CG2 4.12Å; L485-V523 HydrophobicContact CD1-CG2 4.33Å; F491-V523 HydrophobicContact CE2-CG1 4.4Å; F491-V523 HydrophobicContact CZ-CB 4.49Å; F491-V523 HydrophobicContact CZ-CG1 4.19Å; S519-V523 WeakPolarHBondContact O-CG2 3.39Å; S519-V523 PolarHBondContact O-N 3.12Å; I520-V523 PolarHBondContact O-N 3.18Å; M521-V523 VanDerWaalsContact C-N 3.35Å; V523-K526 PolarHBondContact O-N 3.19Å; V523-H527 WeakPolarHBondContact O-CB 3.42Å; V523-H527 PolarHBondContact O-CD2 3.22Å; V523-H527 PolarHBondContact O-N 2.88Å
524	F	94	Very high	91.1	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-57.9	-53	175.7	179.4	-96.4	0	0	0	111.7	F491 I520 M521 K526 H527 Q528 I537 M541 F571 M574	F491-F524 HydrophobicContact CB-CD2 4.38Å; F491-F524 AromaticContact CD1-CD2 3.85Å; F491-F524 HydrophobicContact CD1-CD2 3.85Å; F491-F524 AromaticContact CD2-CD2 3.7Å; F491-F524 HydrophobicContact CD2-CD2 3.7Å; F491-F524 HydrophobicContact CD2-CE2 4.45Å; F491-F524 HydrophobicContact CE1-CB 3.92Å; F491-F524 AromaticContact CE1-CD2 3.99Å; F491-F524 HydrophobicContact CE1-CD2 3.99Å; F491-F524 HydrophobicContact CE1-CG 4.46Å; F491-F524 VanDerWaalsContact CE2-CA 3.46Å; F491-F524 HydrophobicContact CE2-CB 3.93Å; F491-F524 AromaticContact CE2-CD2 3.89Å; F491-F524 HydrophobicContact CE2-CD2 3.89Å; F491-F524 HydrophobicContact CE2-CG 4.39Å; F491-F524 AromaticContact CG-CD2 3.7Å; F491-F524 HydrophobicContact CG-CD2 3.7Å; F491-F524 HydrophobicContact CG-CE2 4.29Å; F491-F524 VanDerWaalsContact CZ-CA 3.41Å; F491-F524 HydrophobicContact CZ-CB 3.54Å; F491-F524 HydrophobicContact CZ-CD2 4.03Å; F491-F524 HydrophobicContact CZ-CG 4.3Å; I520-F524 WeakPolarHBondContact O-CB 3.41Å; I520-F524 PolarHBondContact O-N 3.46Å; M521-F524 PolarHBondContact O-N 3.15Å; F524-K526 PolarHBondContact O-N 3.39Å; F524-H527 PolarHBondContact O-N 2.86Å; F524-Q528 HydrophobicContact CD2-CB 4.1Å; F524-Q528 HydrophobicContact CD2-CG 4.5Å; F524-Q528 HydrophobicContact CE1-CB 4.41Å; F524-Q528 HydrophobicContact CE1-CG 4.47Å; F524-Q528 HydrophobicContact CE2-CB 3.94Å; F524-Q528 HydrophobicContact CE2-CG 3.84Å; F524-Q528 HydrophobicContact CG-CB 4.42Å; F524-Q528 HydrophobicContact CZ-CB 4.11Å; F524-Q528 HydrophobicContact CZ-CG 3.83Å; F524-Q528 WeakPolarHBondContact O-CA 3.49Å; F524-Q528 WeakPolarHBondContact O-CB 3.41Å; F524-Q528 PolarHBondContact O-N 2.99Å; F524-I537 HydrophobicContact CE2-CG2 3.97Å; F524-I537 HydrophobicContact CZ-CG2 4.42Å; F524-M541 HydrophobicContact CB-CE 3.8Å; F524-M541 HydrophobicContact CD1-CE 3.56Å; F524-M541 HydrophobicContact CD2-CE 3.8Å; F524-M541 HydrophobicContact CD2-CG 4.43Å; F524-M541 HydrophobicContact CD2-SD 4.02Å; F524-M541 HydrophobicContact CE1-CE 4.05Å; F524-M541 HydrophobicContact CE2-CE 4.26Å; F524-M541 HydrophobicContact CE2-CG 4.22Å; F524-M541 HydrophobicContact CE2-SD 4.4Å; F524-M541 HydrophobicContact CG-CE 3.42Å; F524-M541 VanDerWaalsContact CG-CE 3.42Å; F524-M541 HydrophobicContact CG-SD 4.21Å; F524-M541 HydrophobicContact CZ-CE 4.37Å; F524-M541 HydrophobicContact CZ-CG 4.49Å; F524-F571 HydrophobicContact CE1-CB 4.47Å; F524-F571 HydrophobicContact CE1-CD2 4.03Å; F524-F571 HydrophobicContact CZ-CD2 4.24Å; F524-M574 HydrophobicContact CE1-CB 4.1Å; F524-M574 HydrophobicContact CE1-CG 4.01Å; F524-M574 HydrophobicContact CZ-CB 4.26Å
525	I	92.2	Very high	90.9	Very high	65 Å²	65	66 Å²	66	33%	0.333	32%	0.322	S	S	.	.	H	α-helix	trans	-63.7	-33.6	-178.7	-66.7	164.3	0	0	0	111.4	M521 L567	M521-I525 HydrophobicContact CE-CD1 4.31Å; M521-I525 WeakPolarHBondContact O-CD1 3.37Å; M521-I525 VanDerWaalsContact O-CG1 3.27Å; M521-I525 WeakPolarHBondContact O-CG1 3.22Å; M521-I525 PolarHBondContact O-N 3.23Å; I525-L567 HydrophobicContact CD1-CB 4.34Å; I525-L567 HydrophobicContact CD1-CD2 3.67Å
526	K	91.9	Very high	90.7	Very high	150 Å²	150	64.8 Å²	64.8	65%	0.652	32%	0.321	S	S	*	.	H	α-helix	trans	-74.3	-39.7	-179.1	-177	-179.7	175.2	-169.8	0	113.2	E522 V523 F524	E522-K526 VanDerWaalsContact O-CB 3.27Å; E522-K526 WeakPolarHBondContact O-CB 3.5Å; E522-K526 PolarHBondContact O-N 2.85Å; E522-K526 VanDerWaalsContact O-N 3.09Å; V523-K526 PolarHBondContact O-N 3.19Å; F524-K526 PolarHBondContact O-N 3.39Å
527	H	90.3	Very high	90.6	Very high	68 Å²	68	64.9 Å²	64.9	32%	0.315	32%	0.321	S	S	.	.	H	α-helix	trans	-107.6	-25.4	-169.2	-69.8	-85.2	0	0	0	114.3	H489 V523 F524 L529	H489-H527 HydrophobicContact CB-CB 4.02Å; H489-H527 AromaticContact CD2-CE1 3.97Å; H489-H527 AromaticContact CD2-ND1 3.79Å; H489-H527 AromaticContact CE1-CE1 3.68Å; H489-H527 AromaticContact CE1-NE2 3.78Å; H489-H527 AromaticContact CG-CG 3.89Å; H489-H527 AromaticContact CG-ND1 3.74Å; H489-H527 AromaticContact ND1-CD2 3.88Å; H489-H527 AromaticContact ND1-CE1 3.96Å; H489-H527 AromaticContact ND1-CG 3.84Å; H489-H527 AromaticContact ND1-ND1 3.9Å; H489-H527 AromaticContact NE2-CE1 3.66Å; H489-H527 AromaticContact NE2-ND1 3.96Å; V523-H527 WeakPolarHBondContact O-CB 3.42Å; V523-H527 PolarHBondContact O-CD2 3.22Å; V523-H527 PolarHBondContact O-N 2.88Å; F524-H527 PolarHBondContact O-N 2.86Å; H527-L529 PolarHBondContact O-N 3.3Å
528	Q	86.5	Confident	90.4	Very high	31 Å²	31	65.1 Å²	65.1	15%	0.145	32%	0.322	C	S	.	.			trans	-74.3	109.8	171.3	-171.2	71	26.8	0	0	108.1	F524 E530 M574	F524-Q528 HydrophobicContact CD2-CB 4.1Å; F524-Q528 HydrophobicContact CD2-CG 4.5Å; F524-Q528 HydrophobicContact CE1-CB 4.41Å; F524-Q528 HydrophobicContact CE1-CG 4.47Å; F524-Q528 HydrophobicContact CE2-CB 3.94Å; F524-Q528 HydrophobicContact CE2-CG 3.84Å; F524-Q528 HydrophobicContact CG-CB 4.42Å; F524-Q528 HydrophobicContact CZ-CB 4.11Å; F524-Q528 HydrophobicContact CZ-CG 3.83Å; F524-Q528 WeakPolarHBondContact O-CA 3.49Å; F524-Q528 WeakPolarHBondContact O-CB 3.41Å; F524-Q528 PolarHBondContact O-N 2.99Å; Q528-E530 PolarHBondContact NE2-O 3.31Å; Q528-M574 VanDerWaalsContact C-CE 3.49Å; Q528-M574 HydrophobicContact CB-CE 4Å; Q528-M574 HydrophobicContact CG-CE 3.57Å; Q528-M574 WeakPolarHBondContact O-CE 3.32Å
529	L	81.1	Confident	90.3	Very high	152 Å²	152	67.7 Å²	67.7	80%	0.796	34%	0.338	S	S	*	.			trans	-102.9	-30.2	177.1	-62.3	177.8	0	0	0	112.5	H527	H527-L529 PolarHBondContact O-N 3.3Å
530	E	84.8	Confident	90.1	Very high	155 Å²	155	66.3 Å²	66.3	72%	0.724	33%	0.329	S	S	*	.	S	Bend	trans	-90.5	142.1	-179.3	-63.6	-171.4	172.6	0	0	111.6	Q528 T532	Q528-E530 PolarHBondContact NE2-O 3.31Å; E530-T532 PolarHBondContact O-N 2.87Å
531	L	87.9	Confident	90	Very high	107 Å²	107	66.3 Å²	66.3	56%	0.56	33%	0.329	S	S	*	.			trans	-63	134.7	173.9	-60.5	170.3	0	0	0	109.9	R573 M574	L531-R573 WeakPolarHBondContact CD2-O 3.15Å; L531-M574 CarbonylContact C-O 3.58Å; L531-M574 VanDerWaalsContact CA-O 3.32Å; L531-M574 WeakPolarHBondContact CA-O 3.47Å
532	T	87.8	Confident	89.9	Confident	10 Å²	10	67.1 Å²	67.1	6%	0.061	33%	0.333	C	S	.	.	B	Isolated β-bridge	trans	-109	143.2	-176.7	-172.1	0	0	0	0	112.3	E530 D534 I537 L538 M574 S576	E530-T532 PolarHBondContact O-N 2.87Å; T532-D534 PolarHBondContact OG1-N 3.26Å; T532-I537 HydrophobicContact CG2-CG2 4.04Å; T532-L538 HydrophobicContact CG2-CD2 4.04Å; T532-M574 PolarHBondContact N-O 2.89Å; T532-S576 PolarHBondContact O-N 3.46Å; T532-S576 VanDerWaalsContact O-N 3.14Å
533	R	88.2	Confident	89.8	Confident	187 Å²	187	66.1 Å²	66.1	71%	0.706	33%	0.328	S	S	*	.			trans	-126.9	5	170.9	64	-179.1	176.6	175.9	-1.1	112.1	P535 F577	R533-P535 VanDerWaalsContact O-CD 3.28Å; R533-P535 WeakPolarHBondContact O-CD 3.44Å; R533-F577 HydrophobicContact CB-CD1 4.31Å
534	D	88.6	Confident	89.7	Confident	42 Å²	42	65 Å²	65	23%	0.225	32%	0.321	C	S	.	.			trans	-69.5	116.1	-177.2	-178.5	-9.4	0	0	0	109.1	S492 T532 V536 I537 L538	S492-D534 PolarHBondContact OG-OD2 3.44Å; T532-D534 PolarHBondContact OG1-N 3.26Å; D534-V536 PolarHBondContact O-N 2.97Å; D534-V536 VanDerWaalsContact O-N 3.12Å; D534-V536 WeakPolarHBondContact OD1-CB 3.39Å; D534-V536 PolarHBondContact OD1-N 3.29Å; D534-I537 HydrophobicContact CB-CB 4.29Å; D534-I537 HydrophobicContact CB-CD1 4.03Å; D534-I537 HydrophobicContact CB-CG1 4.16Å; D534-I537 PolarHBondContact O-N 2.99Å; D534-I537 VanDerWaalsContact O-N 3.15Å; D534-L538 VanDerWaalsContact O-CG 3.31Å; D534-L538 WeakPolarHBondContact O-CG 3.42Å; D534-L538 PolarHBondContact O-N 2.99Å
535	P	87.6	Confident	89.8	Confident	83 Å²	83	65 Å²	65	54%	0.539	32%	0.321	S	S	.	.	H	α-helix	trans	-56.3	-29.5	179.9	-24.7	34.9	0	0	0	113.6	R533 N539	R533-P535 VanDerWaalsContact O-CD 3.28Å; R533-P535 WeakPolarHBondContact O-CD 3.44Å; P535-N539 VanDerWaalsContact O-CB 3.27Å; P535-N539 WeakPolarHBondContact O-CB 3.47Å; P535-N539 PolarHBondContact O-N 3.42Å; P535-N539 PolarHBondContact O-ND2 2.93Å; P535-N539 VanDerWaalsContact O-ND2 3.08Å
536	V	88.1	Confident	89.8	Confident	71 Å²	71	66.5 Å²	66.5	43%	0.43	33%	0.325	S	S	.	.	H	α-helix	trans	-66.5	-50	178.9	180	0	0	0	0	110.1	F495 D534 A540	F495-V536 HydrophobicContact CB-CG1 3.76Å; D534-V536 PolarHBondContact O-N 2.97Å; D534-V536 VanDerWaalsContact O-N 3.12Å; D534-V536 WeakPolarHBondContact OD1-CB 3.39Å; D534-V536 PolarHBondContact OD1-N 3.29Å; V536-A540 VanDerWaalsContact O-CB 3.27Å; V536-A540 WeakPolarHBondContact O-CB 3.37Å; V536-A540 PolarHBondContact O-N 3.19Å; V536-A540 VanDerWaalsContact O-N 3.08Å
537	I	90.7	Very high	89.8	Confident	6 Å²	6	60.2 Å²	60.2	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-47.6	176.6	-63.3	173	0	0	0	109.9	F491 F495 F524 T532 D534 N539 A540 M541	F491-I537 HydrophobicContact CB-CD1 4.37Å; F491-I537 HydrophobicContact CB-CG1 4.4Å; F495-I537 HydrophobicContact CD2-CG1 4.29Å; F524-I537 HydrophobicContact CE2-CG2 3.97Å; F524-I537 HydrophobicContact CZ-CG2 4.42Å; T532-I537 HydrophobicContact CG2-CG2 4.04Å; D534-I537 HydrophobicContact CB-CB 4.29Å; D534-I537 HydrophobicContact CB-CD1 4.03Å; D534-I537 HydrophobicContact CB-CG1 4.16Å; D534-I537 PolarHBondContact O-N 2.99Å; D534-I537 VanDerWaalsContact O-N 3.15Å; I537-N539 PolarHBondContact O-N 3.29Å; I537-A540 PolarHBondContact O-N 3.11Å; I537-M541 HydrophobicContact CG2-CG 3.9Å; I537-M541 WeakPolarHBondContact O-CB 3.38Å; I537-M541 WeakPolarHBondContact O-CG 3.4Å; I537-M541 PolarHBondContact O-N 3.33Å
538	L	91.8	Very high	89.9	Confident	13 Å²	13	57 Å²	57	7%	0.068	29%	0.285	C	S	.	.	H	α-helix	trans	-60.1	-47.9	-176.7	-66.9	-180	0	0	0	112.1	T532 D534 L542 F571 V575 F577	T532-L538 HydrophobicContact CG2-CD2 4.04Å; D534-L538 VanDerWaalsContact O-CG 3.31Å; D534-L538 WeakPolarHBondContact O-CG 3.42Å; D534-L538 PolarHBondContact O-N 2.99Å; L538-L542 WeakPolarHBondContact O-CB 3.25Å; L538-L542 PolarHBondContact O-N 3.38Å; L538-F571 HydrophobicContact CD2-CE2 4.14Å; L538-F571 HydrophobicContact CD2-CZ 4.21Å; L538-V575 HydrophobicContact CD1-CG1 4.42Å; L538-V575 HydrophobicContact CD2-CB 4.09Å; L538-V575 HydrophobicContact CD2-CG1 3.7Å; L538-V575 HydrophobicContact CD2-CG2 3.42Å; L538-V575 VanDerWaalsContact CD2-CG2 3.42Å; L538-F577 HydrophobicContact CD1-CE1 3.81Å; L538-F577 HydrophobicContact CD1-CE2 4.5Å; L538-F577 HydrophobicContact CD1-CZ 3.52Å
539	N	90.3	Very high	90.2	Very high	104 Å²	104	55.9 Å²	55.9	56%	0.556	28%	0.279	S	S	*	.	H	α-helix	trans	-68.1	-42.8	-179.4	-70.9	-30.1	0	0	0	112.2	P535 I537 L542 H543	P535-N539 VanDerWaalsContact O-CB 3.27Å; P535-N539 WeakPolarHBondContact O-CB 3.47Å; P535-N539 PolarHBondContact O-N 3.42Å; P535-N539 PolarHBondContact O-ND2 2.93Å; P535-N539 VanDerWaalsContact O-ND2 3.08Å; I537-N539 PolarHBondContact O-N 3.29Å; N539-L542 PolarHBondContact O-N 2.87Å; N539-H543 PolarHBondContact O-N 3.47Å
540	A	90.7	Very high	90.7	Very high	9 Å²	9	53.3 Å²	53.3	7%	0.074	27%	0.267	C	S	.	.	H	α-helix	trans	-65.5	-46.3	179.2	0	0	0	0	0	111.5	F495 V536 I537 H543 I544	F495-A540 HydrophobicContact CB-CB 4.38Å; F495-A540 HydrophobicContact CD1-CB 3.64Å; F495-A540 HydrophobicContact CD2-CB 3.81Å; F495-A540 HydrophobicContact CE1-CB 3.73Å; F495-A540 HydrophobicContact CE2-CB 3.89Å; F495-A540 HydrophobicContact CG-CB 3.69Å; F495-A540 HydrophobicContact CZ-CB 3.86Å; V536-A540 VanDerWaalsContact O-CB 3.27Å; V536-A540 WeakPolarHBondContact O-CB 3.37Å; V536-A540 PolarHBondContact O-N 3.19Å; V536-A540 VanDerWaalsContact O-N 3.08Å; I537-A540 PolarHBondContact O-N 3.11Å; A540-H543 WeakPolarHBondContact O-CB 3.29Å; A540-H543 PolarHBondContact O-N 3.19Å; A540-I544 WeakPolarHBondContact O-CG1 3.43Å; A540-I544 PolarHBondContact O-N 3.39Å
541	M	93.6	Very high	90.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-67.5	-37.6	178	-68.7	-59.5	-65.3	0	0	112	F491 F495 M521 F524 I537 H543 I544 C545 F571	F491-M541 HydrophobicContact CD1-SD 4.47Å; F495-M541 HydrophobicContact CE2-CG 3.85Å; F495-M541 HydrophobicContact CE2-SD 3.74Å; F495-M541 HydrophobicContact CZ-CG 4.19Å; F495-M541 HydrophobicContact CZ-SD 3.59Å; F495-M541 VanDerWaalsContact CZ-SD 3.59Å; M521-M541 HydrophobicContact CE-CE 3.95Å; M521-M541 HydrophobicContact CG-CE 4.48Å; M521-M541 HydrophobicContact SD-CE 3.17Å; M521-M541 WeakPolarHBondContact SD-CE 3.45Å; F524-M541 HydrophobicContact CB-CE 3.8Å; F524-M541 HydrophobicContact CD1-CE 3.56Å; F524-M541 HydrophobicContact CD2-CE 3.8Å; F524-M541 HydrophobicContact CD2-CG 4.43Å; F524-M541 HydrophobicContact CD2-SD 4.02Å; F524-M541 HydrophobicContact CE1-CE 4.05Å; F524-M541 HydrophobicContact CE2-CE 4.26Å; F524-M541 HydrophobicContact CE2-CG 4.22Å; F524-M541 HydrophobicContact CE2-SD 4.4Å; F524-M541 HydrophobicContact CG-CE 3.42Å; F524-M541 VanDerWaalsContact CG-CE 3.42Å; F524-M541 HydrophobicContact CG-SD 4.21Å; F524-M541 HydrophobicContact CZ-CE 4.37Å; F524-M541 HydrophobicContact CZ-CG 4.49Å; I537-M541 HydrophobicContact CG2-CG 3.9Å; I537-M541 WeakPolarHBondContact O-CB 3.38Å; I537-M541 WeakPolarHBondContact O-CG 3.4Å; I537-M541 PolarHBondContact O-N 3.33Å; M541-H543 VanDerWaalsContact C-N 3.3Å; M541-H543 PolarHBondContact O-N 3.28Å; M541-I544 PolarHBondContact O-N 3.24Å; M541-I544 HydrophobicContact SD-CD1 4.1Å; M541-C545 WeakPolarHBondContact O-CB 3.14Å; M541-C545 PolarHBondContact O-N 3.26Å; M541-C545 PolarHBondContact O-SG 3.08Å; M541-C545 VanDerWaalsContact O-SG 3.32Å; M541-F571 HydrophobicContact CB-CD2 3.64Å; M541-F571 HydrophobicContact CB-CE1 4.41Å; M541-F571 HydrophobicContact CB-CE2 3.32Å; M541-F571 HydrophobicContact CB-CG 4.32Å; M541-F571 HydrophobicContact CB-CZ 3.74Å; M541-F571 HydrophobicContact CE-CD2 4.4Å; M541-F571 HydrophobicContact CG-CD2 4.25Å; M541-F571 HydrophobicContact CG-CE2 4.11Å
542	L	92.9	Very high	90.9	Very high	18 Å²	18	43.7 Å²	43.7	9%	0.094	23%	0.225	C	C	.	.	H	α-helix	trans	-61.2	-41.1	173.2	-174.8	66.1	0	0	0	111.1	L538 N539 C545 K546 F571 E590 F595	L538-L542 WeakPolarHBondContact O-CB 3.25Å; L538-L542 PolarHBondContact O-N 3.38Å; N539-L542 PolarHBondContact O-N 2.87Å; L542-C545 PolarHBondContact O-N 2.62Å; L542-K546 VanDerWaalsContact O-CB 3.24Å; L542-K546 WeakPolarHBondContact O-CB 3.48Å; L542-K546 PolarHBondContact O-N 2.99Å; L542-F571 HydrophobicContact CB-CE1 4.49Å; L542-F571 HydrophobicContact CD1-CE1 4.5Å; L542-E590 HydrophobicContact CD2-CG 4.36Å; L542-E590 WeakPolarHBondContact CD2-OE1 3.37Å; L542-F595 HydrophobicContact CD1-CE2 3.99Å; L542-F595 HydrophobicContact CD1-CZ 3.79Å
543	H	91.6	Very high	90.9	Very high	89 Å²	89	47.6 Å²	47.6	41%	0.412	25%	0.245	S	C	.	.	H	α-helix	trans	-63.6	-41.8	174.8	-176.3	61.7	0	0	0	112.7	R513 N539 A540 M541 K546 T547	R513-H543 PolarHBondContact NH2-NE2 3.15Å; N539-H543 PolarHBondContact O-N 3.47Å; A540-H543 WeakPolarHBondContact O-CB 3.29Å; A540-H543 PolarHBondContact O-N 3.19Å; M541-H543 VanDerWaalsContact C-N 3.3Å; M541-H543 PolarHBondContact O-N 3.28Å; H543-K546 PolarHBondContact O-N 3.31Å; H543-T547 PolarHBondContact O-N 2.91Å; H543-T547 PolarHBondContact O-OG1 3.26Å
544	I	93.6	Very high	90.5	Very high	5 Å²	5	43.6 Å²	43.6	3%	0.026	25%	0.252	C	S	.	.	H	α-helix	trans	-63.8	-48.6	175.6	-69.5	166.5	0	0	0	110.7	F495 C517 I520 M521 A540 M541 K546 T547 M548	F495-I544 HydrophobicContact CE1-CD1 3.94Å; F495-I544 HydrophobicContact CZ-CD1 3.81Å; C517-I544 HydrophobicContact CB-CG2 3.76Å; I520-I544 HydrophobicContact CD1-CD1 4.31Å; I520-I544 HydrophobicContact CG2-CD1 3.95Å; M521-I544 HydrophobicContact CG-CG2 3.81Å; M521-I544 HydrophobicContact SD-CG2 3.96Å; A540-I544 WeakPolarHBondContact O-CG1 3.43Å; A540-I544 PolarHBondContact O-N 3.39Å; M541-I544 PolarHBondContact O-N 3.24Å; M541-I544 HydrophobicContact SD-CD1 4.1Å; I544-K546 VanDerWaalsContact C-N 3.31Å; I544-K546 PolarHBondContact O-N 3.46Å; I544-T547 WeakPolarHBondContact O-CB 3.43Å; I544-T547 PolarHBondContact O-N 3.4Å; I544-M548 PolarHBondContact O-N 3.19Å; I544-M548 VanDerWaalsContact O-N 3.07Å
545	C	95.1	Very high	90.5	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.4	-40.3	176	-71.7	0	0	0	0	112	M541 L542 M548 H549 I568 F595	M541-C545 WeakPolarHBondContact O-CB 3.14Å; M541-C545 PolarHBondContact O-N 3.26Å; M541-C545 PolarHBondContact O-SG 3.08Å; M541-C545 VanDerWaalsContact O-SG 3.32Å; L542-C545 PolarHBondContact O-N 2.62Å; C545-M548 PolarHBondContact O-N 2.89Å; C545-H549 WeakPolarHBondContact O-CB 3.29Å; C545-H549 PolarHBondContact O-N 2.99Å; C545-I568 HydrophobicContact CB-CG1 4.05Å; C545-F595 HydrophobicContact CB-CE1 3.83Å; C545-F595 HydrophobicContact CB-CZ 3.56Å
546	K	93.3	Very high	90.3	Very high	96 Å²	96	46.1 Å²	46.1	42%	0.417	26%	0.261	S	S	.	.	H	α-helix	trans	-63.6	-44.3	176	-178.8	173.7	177.2	175.8	0	111.5	L542 H543 I544 M548 H549 D550 T594	L542-K546 VanDerWaalsContact O-CB 3.24Å; L542-K546 WeakPolarHBondContact O-CB 3.48Å; L542-K546 PolarHBondContact O-N 2.99Å; H543-K546 PolarHBondContact O-N 3.31Å; I544-K546 VanDerWaalsContact C-N 3.31Å; I544-K546 PolarHBondContact O-N 3.46Å; K546-M548 VanDerWaalsContact C-N 3.29Å; K546-M548 PolarHBondContact O-N 2.92Å; K546-H549 PolarHBondContact O-N 3.4Å; K546-H549 VanDerWaalsContact O-N 3.14Å; K546-D550 WeakPolarHBondContact CE-OD2 3.31Å; K546-D550 WeakPolarHBondContact CG-OD2 3.49Å; K546-D550 WeakPolarHBondContact O-CB 3.47Å; K546-D550 PolarHBondContact O-N 2.96Å; K546-T594 HydrophobicContact CB-CG2 4.01Å; K546-T594 HydrophobicContact CD-CG2 4.04Å; K546-T594 HydrophobicContact CG-CG2 3.95Å
547	T	92	Very high	90.3	Very high	18 Å²	18	48.2 Å²	48.2	11%	0.11	27%	0.269	C	S	.	.	H	α-helix	trans	-57.4	-43.3	175.6	-58.2	0	0	0	0	111.6	R513 H543 I544 S551	R513-T547 HydrophobicContact CG-CG2 3.88Å; R513-T547 VanDerWaalsContact NE-CG2 3.31Å; H543-T547 PolarHBondContact O-N 2.91Å; H543-T547 PolarHBondContact O-OG1 3.26Å; I544-T547 WeakPolarHBondContact O-CB 3.43Å; I544-T547 PolarHBondContact O-N 3.4Å; T547-S551 PolarHBondContact O-N 3.36Å
548	M	92.4	Very high	90.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-65.9	-42.7	175	-69.5	-168.1	-57.4	0	0	112.6	C517 K518 M521 I544 C545 K546 S551 L564 L567 I568	C517-M548 HydrophobicContact CB-CG 3.59Å; C517-M548 HydrophobicContact CB-SD 4.17Å; K518-M548 HydrophobicContact CG-SD 3.97Å; M521-M548 HydrophobicContact CB-CE 4.35Å; M521-M548 HydrophobicContact CE-CE 4.32Å; M521-M548 HydrophobicContact CG-CE 3.45Å; M521-M548 VanDerWaalsContact CG-CE 3.45Å; M521-M548 HydrophobicContact CG-SD 3.94Å; M521-M548 HydrophobicContact SD-CE 3.91Å; I544-M548 PolarHBondContact O-N 3.19Å; I544-M548 VanDerWaalsContact O-N 3.07Å; C545-M548 PolarHBondContact O-N 2.89Å; K546-M548 VanDerWaalsContact C-N 3.29Å; K546-M548 PolarHBondContact O-N 2.92Å; M548-S551 PolarHBondContact O-N 2.95Å; M548-S551 PolarHBondContact O-OG 3.38Å; M548-L564 HydrophobicContact CB-CD2 4.04Å; M548-L564 HydrophobicContact CG-CD2 4.29Å; M548-L564 HydrophobicContact SD-CD2 3.97Å; M548-L567 HydrophobicContact CE-CB 4.25Å; M548-L567 HydrophobicContact SD-CD1 4.16Å; M548-I568 HydrophobicContact CE-CG1 4Å
549	H	92.3	Very high	89.8	Confident	8 Å²	8	58.4 Å²	58.4	4%	0.037	32%	0.319	C	S	.	.	H	α-helix	trans	-62	-46.2	177.5	168.3	-88.5	0	0	0	111.7	C545 K546 S551 V552 I568 T594 F595	C545-H549 WeakPolarHBondContact O-CB 3.29Å; C545-H549 PolarHBondContact O-N 2.99Å; K546-H549 PolarHBondContact O-N 3.4Å; K546-H549 VanDerWaalsContact O-N 3.14Å; H549-S551 PolarHBondContact O-N 3.48Å; H549-S551 VanDerWaalsContact O-N 3.14Å; H549-V552 VanDerWaalsContact O-CB 3.31Å; H549-V552 WeakPolarHBondContact O-CB 3.47Å; H549-V552 WeakPolarHBondContact O-CG2 3.43Å; H549-V552 PolarHBondContact O-N 3.35Å; H549-I568 HydrophobicContact CB-CD1 4.27Å; H549-T594 PolarHBondContact CE1-O 3.36Å; H549-T594 PolarHBondContact ND1-O 3.49Å; H549-F595 HydrophobicContact CB-CD1 3.83Å; H549-F595 HydrophobicContact CB-CE1 4.15Å; H549-F595 AromaticContact CG-CD1 3.94Å
550	D	91.1	Very high	89.7	Confident	99 Å²	99	57.8 Å²	57.8	53%	0.529	31%	0.313	S	S	.	.	H	α-helix	trans	-66.7	-16.5	-176.4	-66.4	-8.7	0	0	0	112.3	K546 V552	K546-D550 WeakPolarHBondContact CE-OD2 3.31Å; K546-D550 WeakPolarHBondContact CG-OD2 3.49Å; K546-D550 WeakPolarHBondContact O-CB 3.47Å; K546-D550 PolarHBondContact O-N 2.96Å; D550-V552 VanDerWaalsContact C-N 3.31Å
551	S	89.9	Confident	89.6	Confident	38 Å²	38	59.7 Å²	59.7	27%	0.266	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-15.5	171.6	79.1	0	0	0	0	114.6	T547 M548 H549 N553	T547-S551 PolarHBondContact O-N 3.36Å; M548-S551 PolarHBondContact O-N 2.95Å; M548-S551 PolarHBondContact O-OG 3.38Å; H549-S551 PolarHBondContact O-N 3.48Å; H549-S551 VanDerWaalsContact O-N 3.14Å; S551-N553 PolarHBondContact O-N 3.24Å
552	V	88.2	Confident	89.5	Confident	22 Å²	22	66.3 Å²	66.3	13%	0.133	35%	0.345	C	S	.	.			trans	-76.9	119.6	-179.4	179.1	0	0	0	0	109.8	H549 D550 T556 K561 L564 L598	H549-V552 VanDerWaalsContact O-CB 3.31Å; H549-V552 WeakPolarHBondContact O-CB 3.47Å; H549-V552 WeakPolarHBondContact O-CG2 3.43Å; H549-V552 PolarHBondContact O-N 3.35Å; D550-V552 VanDerWaalsContact C-N 3.31Å; V552-T556 HydrophobicContact CG1-CG2 4.47Å; V552-K561 HydrophobicContact CG1-CD 4.1Å; V552-K561 HydrophobicContact CG1-CG 3.81Å; V552-L564 HydrophobicContact CG2-CD1 3.6Å; V552-L598 HydrophobicContact CG2-CD2 4.38Å
553	N	86.4	Confident	89.4	Confident	92 Å²	92	68.1 Å²	68.1	49%	0.492	36%	0.359	S	S	.	.			trans	-130.7	-176.8	178.7	66.1	46.8	0	0	0	111.5	S551 L555 T556	S551-N553 PolarHBondContact O-N 3.24Å; N553-L555 PolarHBondContact O-N 2.71Å; N553-L555 WeakPolarHBondContact OD1-CA 3.31Å; N553-L555 WeakPolarHBondContact OD1-CB 3.42Å; N553-L555 PolarHBondContact OD1-N 3.11Å; N553-T556 PolarHBondContact N-OG1 3.08Å; N553-T556 WeakPolarHBondContact O-CB 3.16Å; N553-T556 PolarHBondContact O-N 3.03Å; N553-T556 VanDerWaalsContact O-N 3.15Å; N553-T556 PolarHBondContact O-OG1 2.99Å; N553-T556 PolarHBondContact OD1-N 3Å; N553-T556 PolarHBondContact OD1-OG1 3.09Å
554	A	81.2	Confident	89.5	Confident	103 Å²	103	64 Å²	64	85%	0.851	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-19.9	-177.4	0	0	0	0	0	114.3
555	L	87.1	Confident	89.5	Confident	159 Å²	159	63.9 Å²	63.9	83%	0.832	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-9.1	179.3	-57	175.3	0	0	0	112.7	N553 L557	N553-L555 PolarHBondContact O-N 2.71Å; N553-L555 WeakPolarHBondContact OD1-CA 3.31Å; N553-L555 WeakPolarHBondContact OD1-CB 3.42Å; N553-L555 PolarHBondContact OD1-N 3.11Å; L555-L557 PolarHBondContact O-N 2.97Å
556	T	85.1	Confident	89.5	Confident	19 Å²	19	69 Å²	69	12%	0.117	37%	0.366	C	S	.	.	S	Bend	trans	-66.8	130.2	178.4	-51.1	0	0	0	0	110.3	V552 N553 E560 K561	V552-T556 HydrophobicContact CG1-CG2 4.47Å; N553-T556 PolarHBondContact N-OG1 3.08Å; N553-T556 WeakPolarHBondContact O-CB 3.16Å; N553-T556 PolarHBondContact O-N 3.03Å; N553-T556 VanDerWaalsContact O-N 3.15Å; N553-T556 PolarHBondContact O-OG1 2.99Å; N553-T556 PolarHBondContact OD1-N 3Å; N553-T556 PolarHBondContact OD1-OG1 3.09Å; T556-E560 HydrophobicContact CG2-CB 3.87Å; T556-K561 HydrophobicContact CG2-CG 3.83Å; T556-K561 VanDerWaalsContact O-CE 3.3Å; T556-K561 WeakPolarHBondContact O-CE 3.35Å
557	L	88	Confident	89.6	Confident	115 Å²	115	65.2 Å²	65.2	60%	0.602	35%	0.351	S	S	*	.			trans	-65.8	147	179.4	-63.8	172.4	0	0	0	111	L555 D559 E560 K561	L555-L557 PolarHBondContact O-N 2.97Å; L557-D559 PolarHBondContact O-N 3.47Å; L557-E560 HydrophobicContact CB-CB 4.47Å; L557-E560 HydrophobicContact CB-CG 4.23Å; L557-E560 WeakPolarHBondContact O-CB 3.35Å; L557-E560 PolarHBondContact O-N 3.23Å; L557-E560 VanDerWaalsContact O-N 3.07Å; L557-K561 PolarHBondContact O-N 2.98Å
558	E	84.8	Confident	89.8	Confident	122 Å²	122	64.4 Å²	64.4	57%	0.57	35%	0.346	S	S	*	.	H	α-helix	trans	-59.4	-34.3	179.7	-71.7	-58	131	0	0	113	K561 R562	E558-K561 PolarHBondContact O-N 3.15Å; E558-K561 IonicContact OE1-NZ 3.1Å; E558-K561 PolarHBondContact OE1-NZ 3.48Å; E558-R562 WeakPolarHBondContact O-CB 3.41Å; E558-R562 PolarHBondContact O-N 3.16Å
559	D	86.9	Confident	90	Very high	110 Å²	110	65 Å²	65	59%	0.588	35%	0.348	S	S	*	.	H	α-helix	trans	-70.1	-35.4	176.6	-69.4	-31.5	0	0	0	112.4	L557 R562 S563	L557-D559 PolarHBondContact O-N 3.47Å; D559-R562 PolarHBondContact O-N 2.98Å; D559-R562 IonicContact OD1-CZ 2.81Å; D559-R562 IonicContact OD1-NH1 3.53Å; D559-R562 PolarHBondContact OD1-NH1 3.22Å; D559-S563 WeakPolarHBondContact O-CB 3.14Å; D559-S563 PolarHBondContact O-N 3.2Å
560	E	87.6	Confident	90.1	Very high	92 Å²	92	65.2 Å²	65.2	43%	0.43	35%	0.354	S	S	.	.	H	α-helix	trans	-68.2	-43.1	173.7	-69	-174.8	152.8	0	0	111.3	T556 L557 R562 S563 L564	T556-E560 HydrophobicContact CG2-CB 3.87Å; L557-E560 HydrophobicContact CB-CB 4.47Å; L557-E560 HydrophobicContact CB-CG 4.23Å; L557-E560 WeakPolarHBondContact O-CB 3.35Å; L557-E560 PolarHBondContact O-N 3.23Å; L557-E560 VanDerWaalsContact O-N 3.07Å; E560-R562 VanDerWaalsContact C-N 3.29Å; E560-R562 PolarHBondContact O-N 3.09Å; E560-S563 PolarHBondContact O-N 3.01Å; E560-L564 WeakPolarHBondContact O-CG 3.41Å; E560-L564 PolarHBondContact O-N 3.39Å
561	K	89.6	Confident	90.2	Very high	48 Å²	48	60.5 Å²	60.5	21%	0.209	33%	0.328	C	S	.	.	H	α-helix	trans	-57.3	-44	172.9	-67.4	-177.9	-169.7	162.7	0	111.1	V552 T556 L557 E558 L564 A565	V552-K561 HydrophobicContact CG1-CD 4.1Å; V552-K561 HydrophobicContact CG1-CG 3.81Å; T556-K561 HydrophobicContact CG2-CG 3.83Å; T556-K561 VanDerWaalsContact O-CE 3.3Å; T556-K561 WeakPolarHBondContact O-CE 3.35Å; L557-K561 PolarHBondContact O-N 2.98Å; E558-K561 PolarHBondContact O-N 3.15Å; E558-K561 IonicContact OE1-NZ 3.1Å; E558-K561 PolarHBondContact OE1-NZ 3.48Å; K561-L564 PolarHBondContact O-N 3.16Å; K561-A565 VanDerWaalsContact O-CB 3.27Å; K561-A565 WeakPolarHBondContact O-CB 3.41Å; K561-A565 PolarHBondContact O-N 3.49Å
562	R	89.7	Confident	90.4	Very high	139 Å²	139	58.8 Å²	58.8	53%	0.525	32%	0.316	S	S	.	.	H	α-helix	trans	-62.8	-45.9	177.4	-170.1	-176.1	-63.4	128.1	5.8	111.3	E558 D559 E560 A565 L566	E558-R562 WeakPolarHBondContact O-CB 3.41Å; E558-R562 PolarHBondContact O-N 3.16Å; D559-R562 PolarHBondContact O-N 2.98Å; D559-R562 IonicContact OD1-CZ 2.81Å; D559-R562 IonicContact OD1-NH1 3.53Å; D559-R562 PolarHBondContact OD1-NH1 3.22Å; E560-R562 VanDerWaalsContact C-N 3.29Å; E560-R562 PolarHBondContact O-N 3.09Å; R562-A565 PolarHBondContact O-N 3.44Å; R562-L566 HydrophobicContact CG-CD1 4.49Å; R562-L566 WeakPolarHBondContact O-CG 3.35Å; R562-L566 PolarHBondContact O-N 3.35Å
563	S	91.6	Very high	90.6	Very high	56 Å²	56	64.9 Å²	64.9	39%	0.392	34%	0.337	S	S	.	.	H	α-helix	trans	-59.2	-49.2	177.5	179.5	0	0	0	0	111.9	D559 E560 A565 L566 L567	D559-S563 WeakPolarHBondContact O-CB 3.14Å; D559-S563 PolarHBondContact O-N 3.2Å; E560-S563 PolarHBondContact O-N 3.01Å; S563-A565 PolarHBondContact O-N 3.37Å; S563-L566 PolarHBondContact O-N 2.87Å; S563-L567 PolarHBondContact O-N 3.03Å
564	L	93.1	Very high	90.9	Very high	4 Å²	4	61.9 Å²	61.9	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-43	176.5	-71.7	178.8	0	0	0	112.4	K518 M548 V552 E560 K561 L566 L567 I568	K518-L564 HydrophobicContact CD-CD2 4.27Å; K518-L564 HydrophobicContact CG-CD2 4.03Å; M548-L564 HydrophobicContact CB-CD2 4.04Å; M548-L564 HydrophobicContact CG-CD2 4.29Å; M548-L564 HydrophobicContact SD-CD2 3.97Å; V552-L564 HydrophobicContact CG2-CD1 3.6Å; E560-L564 WeakPolarHBondContact O-CG 3.41Å; E560-L564 PolarHBondContact O-N 3.39Å; K561-L564 PolarHBondContact O-N 3.16Å; L564-L566 VanDerWaalsContact C-N 3.32Å; L564-L566 PolarHBondContact O-N 3.32Å; L564-L567 PolarHBondContact O-N 3.4Å; L564-I568 WeakPolarHBondContact O-CG1 3.45Å; L564-I568 PolarHBondContact O-N 2.83Å
565	A	94.1	Very high	91.4	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-61.7	-39.5	177.1	0	0	0	0	0	112	K561 R562 S563 I568 I569 L598 P600 V601	K561-A565 VanDerWaalsContact O-CB 3.27Å; K561-A565 WeakPolarHBondContact O-CB 3.41Å; K561-A565 PolarHBondContact O-N 3.49Å; R562-A565 PolarHBondContact O-N 3.44Å; S563-A565 PolarHBondContact O-N 3.37Å; A565-I568 PolarHBondContact O-N 3.49Å; A565-I569 WeakPolarHBondContact O-CB 3.4Å; A565-I569 WeakPolarHBondContact O-CD1 3.46Å; A565-I569 WeakPolarHBondContact O-CG1 3.46Å; A565-I569 PolarHBondContact O-N 3.41Å; A565-L598 HydrophobicContact CB-CD1 4.46Å; A565-P600 HydrophobicContact CB-CB 3.99Å; A565-P600 HydrophobicContact CB-CG 4.04Å; A565-V601 HydrophobicContact CB-CG2 4.06Å
566	L	94.9	Very high	91.6	Very high	107 Å²	107	51.4 Å²	51.4	56%	0.56	25%	0.254	S	S	*	.	H	α-helix	trans	-63.3	-40.2	176.4	-72.4	172.3	0	0	0	112.4	R562 S563 L564 I569 G570	R562-L566 HydrophobicContact CG-CD1 4.49Å; R562-L566 WeakPolarHBondContact O-CG 3.35Å; R562-L566 PolarHBondContact O-N 3.35Å; S563-L566 PolarHBondContact O-N 2.87Å; L564-L566 VanDerWaalsContact C-N 3.32Å; L564-L566 PolarHBondContact O-N 3.32Å; L566-I569 PolarHBondContact O-N 3.27Å; L566-G570 PolarHBondContact O-N 3.18Å
567	L	95.9	Very high	91.8	Very high	18 Å²	18	51.7 Å²	51.7	9%	0.094	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-46.3	175.2	-66.4	175.8	0	0	0	111.3	K518 M521 E522 I525 M548 S563 L564 I569 G570 F571	K518-L567 HydrophobicContact CB-CD1 4.22Å; K518-L567 HydrophobicContact CG-CD1 3.95Å; M521-L567 HydrophobicContact CB-CB 4.3Å; M521-L567 HydrophobicContact CB-CD1 4.3Å; M521-L567 HydrophobicContact CB-CD2 4.25Å; M521-L567 HydrophobicContact CE-CB 4.26Å; M521-L567 WeakPolarHBondContact CE-O 3.37Å; E522-L567 HydrophobicContact CG-CD2 3.91Å; I525-L567 HydrophobicContact CD1-CB 4.34Å; I525-L567 HydrophobicContact CD1-CD2 3.67Å; M548-L567 HydrophobicContact CE-CB 4.25Å; M548-L567 HydrophobicContact SD-CD1 4.16Å; S563-L567 PolarHBondContact O-N 3.03Å; L564-L567 PolarHBondContact O-N 3.4Å; L567-I569 PolarHBondContact O-N 3.24Å; L567-G570 WeakPolarHBondContact O-CA 3.44Å; L567-G570 PolarHBondContact O-N 3.42Å; L567-G570 VanDerWaalsContact O-N 3.15Å; L567-F571 PolarHBondContact O-N 3.29Å; L567-F571 VanDerWaalsContact O-N 3.13Å
568	I	96.3	Very high	91.8	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64.6	-41	178.4	-64.7	169.2	0	0	0	111.1	C545 M548 H549 L564 A565 G570 F571 I572 F595 L598 V601	C545-I568 HydrophobicContact CB-CG1 4.05Å; M548-I568 HydrophobicContact CE-CG1 4Å; H549-I568 HydrophobicContact CB-CD1 4.27Å; L564-I568 WeakPolarHBondContact O-CG1 3.45Å; L564-I568 PolarHBondContact O-N 2.83Å; A565-I568 PolarHBondContact O-N 3.49Å; I568-G570 VanDerWaalsContact C-N 3.28Å; I568-G570 PolarHBondContact O-N 3.47Å; I568-F571 PolarHBondContact O-N 2.97Å; I568-I572 HydrophobicContact CG2-CD1 3.92Å; I568-I572 WeakPolarHBondContact O-CG1 3.48Å; I568-I572 PolarHBondContact O-N 3.24Å; I568-F595 HydrophobicContact CD1-CD1 4.21Å; I568-F595 HydrophobicContact CD1-CE1 4.24Å; I568-F595 HydrophobicContact CG2-CD1 4.32Å; I568-F595 HydrophobicContact CG2-CD2 3.98Å; I568-F595 HydrophobicContact CG2-CE1 4.22Å; I568-F595 HydrophobicContact CG2-CE2 3.88Å; I568-F595 HydrophobicContact CG2-CG 4.2Å; I568-F595 HydrophobicContact CG2-CZ 4Å; I568-L598 HydrophobicContact CD1-CD1 3.59Å; I568-V601 HydrophobicContact CB-CG2 4.13Å; I568-V601 HydrophobicContact CG2-CG1 4.07Å; I568-V601 HydrophobicContact CG2-CG2 3.93Å
569	I	95.6	Very high	91.8	Very high	12 Å²	12	52.8 Å²	52.8	6%	0.062	26%	0.259	C	S	.	.	H	α-helix	trans	-59.2	-41.7	173.1	-74.2	164.2	0	0	0	110.8	A565 L566 L567 F571 I572 R573 P600 V601 Q604	A565-I569 WeakPolarHBondContact O-CB 3.4Å; A565-I569 WeakPolarHBondContact O-CD1 3.46Å; A565-I569 WeakPolarHBondContact O-CG1 3.46Å; A565-I569 PolarHBondContact O-N 3.41Å; L566-I569 PolarHBondContact O-N 3.27Å; L567-I569 PolarHBondContact O-N 3.24Å; I569-F571 VanDerWaalsContact C-N 3.34Å; I569-F571 PolarHBondContact O-N 3.4Å; I569-I572 PolarHBondContact O-N 3.42Å; I569-R573 HydrophobicContact CG2-CG 4.42Å; I569-R573 WeakPolarHBondContact O-CG 3.38Å; I569-R573 PolarHBondContact O-N 3.44Å; I569-P600 HydrophobicContact CD1-CB 3.98Å; I569-V601 HydrophobicContact CG1-CG2 4.25Å; I569-Q604 HydrophobicContact CD1-CB 4.37Å; I569-Q604 HydrophobicContact CG1-CB 3.95Å; I569-Q604 HydrophobicContact CG1-CG 4.21Å; I569-Q604 HydrophobicContact CG2-CB 4.48Å; I569-Q604 HydrophobicContact CG2-CG 3.95Å
570	G	94.1	Very high	91.9	Very high	14 Å²	14	51.4 Å²	51.4	14%	0.144	25%	0.251	C	S	.	.	H	α-helix	trans	-53.6	-50.4	174.2	0	0	0	0	0	111.4	L566 L567 I568 R573 M574	L566-G570 PolarHBondContact O-N 3.18Å; L567-G570 WeakPolarHBondContact O-CA 3.44Å; L567-G570 PolarHBondContact O-N 3.42Å; L567-G570 VanDerWaalsContact O-N 3.15Å; I568-G570 VanDerWaalsContact C-N 3.28Å; I568-G570 PolarHBondContact O-N 3.47Å; G570-R573 PolarHBondContact O-N 2.83Å; G570-M574 WeakPolarHBondContact O-CG 3.31Å; G570-M574 PolarHBondContact O-N 3.38Å
571	F	94.9	Very high	92	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.2	-49.2	175.2	165.5	-115.5	0	0	0	113.1	M521 F524 L538 M541 L542 L567 I568 I569 R573 M574 V575 F587	M521-F571 HydrophobicContact CE-CB 3.76Å; F524-F571 HydrophobicContact CE1-CB 4.47Å; F524-F571 HydrophobicContact CE1-CD2 4.03Å; F524-F571 HydrophobicContact CZ-CD2 4.24Å; L538-F571 HydrophobicContact CD2-CE2 4.14Å; L538-F571 HydrophobicContact CD2-CZ 4.21Å; M541-F571 HydrophobicContact CB-CD2 3.64Å; M541-F571 HydrophobicContact CB-CE1 4.41Å; M541-F571 HydrophobicContact CB-CE2 3.32Å; M541-F571 HydrophobicContact CB-CG 4.32Å; M541-F571 HydrophobicContact CB-CZ 3.74Å; M541-F571 HydrophobicContact CE-CD2 4.4Å; M541-F571 HydrophobicContact CG-CD2 4.25Å; M541-F571 HydrophobicContact CG-CE2 4.11Å; L542-F571 HydrophobicContact CB-CE1 4.49Å; L542-F571 HydrophobicContact CD1-CE1 4.5Å; L567-F571 PolarHBondContact O-N 3.29Å; L567-F571 VanDerWaalsContact O-N 3.13Å; I568-F571 PolarHBondContact O-N 2.97Å; I569-F571 VanDerWaalsContact C-N 3.34Å; I569-F571 PolarHBondContact O-N 3.4Å; F571-R573 PolarHBondContact O-N 3.45Å; F571-M574 WeakPolarHBondContact O-CB 3.33Å; F571-M574 PolarHBondContact O-N 3.1Å; F571-V575 HydrophobicContact CD2-CG2 4.22Å; F571-V575 HydrophobicContact CE1-CG2 4.38Å; F571-V575 HydrophobicContact CE2-CG2 3.73Å; F571-V575 HydrophobicContact CZ-CG2 3.83Å; F571-V575 PolarHBondContact O-N 3.44Å; F571-F587 HydrophobicContact CE1-CE2 4.31Å; F571-F587 HydrophobicContact CE1-CZ 4.06Å; F571-F587 HydrophobicContact CZ-CE2 4.38Å; F571-F587 HydrophobicContact CZ-CZ 4.36Å
572	I	93.9	Very high	92.1	Very high	2 Å²	2	53 Å²	53	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-56.5	-38.3	-178.7	-70.6	166.6	0	0	0	111.6	I568 I569 M574 V575 F595 V601 L605	I568-I572 HydrophobicContact CG2-CD1 3.92Å; I568-I572 WeakPolarHBondContact O-CG1 3.48Å; I568-I572 PolarHBondContact O-N 3.24Å; I569-I572 PolarHBondContact O-N 3.42Å; I572-M574 VanDerWaalsContact C-N 3.25Å; I572-M574 PolarHBondContact O-N 3.22Å; I572-V575 PolarHBondContact O-N 3.09Å; I572-F595 HydrophobicContact CD1-CD2 4.46Å; I572-V601 HydrophobicContact CD1-CG1 3.51Å; I572-L605 HydrophobicContact CD1-CD2 4.08Å; I572-L605 HydrophobicContact CD1-CG 4.38Å; I572-L605 HydrophobicContact CG2-CD2 4.03Å
573	R	92.8	Very high	92.2	Very high	149 Å²	149	51 Å²	51	56%	0.562	26%	0.255	S	S	*	.	H	α-helix	trans	-67.8	-23.5	177.7	-72.8	176.1	179	-179.6	2.9	113.6	L531 I569 G570 F571	L531-R573 WeakPolarHBondContact CD2-O 3.15Å; I569-R573 HydrophobicContact CG2-CG 4.42Å; I569-R573 WeakPolarHBondContact O-CG 3.38Å; I569-R573 PolarHBondContact O-N 3.44Å; G570-R573 PolarHBondContact O-N 2.83Å; F571-R573 PolarHBondContact O-N 3.45Å
574	M	91.3	Very high	92.3	Very high	29 Å²	29	49.1 Å²	49.1	14%	0.143	24%	0.241	C	C	.	.	H	α-helix	trans	-84.3	-11.8	178.1	-59.6	-54.3	-75.6	0	0	113.1	F524 Q528 L531 T532 G570 F571 I572	F524-M574 HydrophobicContact CE1-CB 4.1Å; F524-M574 HydrophobicContact CE1-CG 4.01Å; F524-M574 HydrophobicContact CZ-CB 4.26Å; Q528-M574 VanDerWaalsContact C-CE 3.49Å; Q528-M574 HydrophobicContact CB-CE 4Å; Q528-M574 HydrophobicContact CG-CE 3.57Å; Q528-M574 WeakPolarHBondContact O-CE 3.32Å; L531-M574 CarbonylContact C-O 3.58Å; L531-M574 VanDerWaalsContact CA-O 3.32Å; L531-M574 WeakPolarHBondContact CA-O 3.47Å; T532-M574 PolarHBondContact N-O 2.89Å; G570-M574 WeakPolarHBondContact O-CG 3.31Å; G570-M574 PolarHBondContact O-N 3.38Å; F571-M574 WeakPolarHBondContact O-CB 3.33Å; F571-M574 PolarHBondContact O-N 3.1Å; I572-M574 VanDerWaalsContact C-N 3.25Å; I572-M574 PolarHBondContact O-N 3.22Å
575	V	92.4	Very high	92.3	Very high	6 Å²	6	50 Å²	50	4%	0.036	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-84.9	117.4	-179.7	-178.2	0	0	0	0	110.5	L538 F571 I572 F577 Q584 F587	L538-V575 HydrophobicContact CD1-CG1 4.42Å; L538-V575 HydrophobicContact CD2-CB 4.09Å; L538-V575 HydrophobicContact CD2-CG1 3.7Å; L538-V575 HydrophobicContact CD2-CG2 3.42Å; L538-V575 VanDerWaalsContact CD2-CG2 3.42Å; F571-V575 HydrophobicContact CD2-CG2 4.22Å; F571-V575 HydrophobicContact CE1-CG2 4.38Å; F571-V575 HydrophobicContact CE2-CG2 3.73Å; F571-V575 HydrophobicContact CZ-CG2 3.83Å; F571-V575 PolarHBondContact O-N 3.44Å; I572-V575 PolarHBondContact O-N 3.09Å; V575-F577 HydrophobicContact CG1-CD2 4.33Å; V575-F577 HydrophobicContact CG1-CE2 3.68Å; V575-F577 HydrophobicContact CG1-CZ 4.24Å; V575-Q584 PolarHBondContact O-NE2 3.27Å; V575-Q584 VanDerWaalsContact O-NE2 3.12Å; V575-F587 HydrophobicContact CB-CD1 4.33Å; V575-F587 HydrophobicContact CB-CE1 3.81Å; V575-F587 HydrophobicContact CB-CZ 3.97Å; V575-F587 HydrophobicContact CG1-CD1 3.84Å; V575-F587 HydrophobicContact CG1-CD2 4.25Å; V575-F587 HydrophobicContact CG1-CE1 3.79Å; V575-F587 HydrophobicContact CG1-CE2 4.2Å; V575-F587 HydrophobicContact CG1-CG 4.08Å; V575-F587 HydrophobicContact CG1-CZ 3.98Å; V575-F587 HydrophobicContact CG2-CE1 3.96Å; V575-F587 HydrophobicContact CG2-CE2 4.18Å; V575-F587 HydrophobicContact CG2-CZ 3.6Å
576	S	90.7	Very high	92.3	Very high	37 Å²	37	53.5 Å²	53.5	26%	0.259	27%	0.27	S	S	.	.			trans	-141.8	123.5	173.9	-171.9	0	0	0	0	112.6	T532 G578	T532-S576 PolarHBondContact O-N 3.46Å; T532-S576 VanDerWaalsContact O-N 3.14Å; S576-G578 VanDerWaalsContact C-N 3.29Å; S576-G578 PolarHBondContact OG-N 2.93Å
577	F	90.6	Very high	92.3	Very high	25 Å²	25	49 Å²	49	11%	0.11	25%	0.246	C	C	.	.			trans	-91.2	11.5	171	-60.7	-82.7	0	0	0	113	R533 L538 V575 R579 D580 Q583 Q584 F587	R533-F577 HydrophobicContact CB-CD1 4.31Å; L538-F577 HydrophobicContact CD1-CE1 3.81Å; L538-F577 HydrophobicContact CD1-CE2 4.5Å; L538-F577 HydrophobicContact CD1-CZ 3.52Å; V575-F577 HydrophobicContact CG1-CD2 4.33Å; V575-F577 HydrophobicContact CG1-CE2 3.68Å; V575-F577 HydrophobicContact CG1-CZ 4.24Å; F577-R579 PolarHBondContact O-N 3.3Å; F577-R579 VanDerWaalsContact O-N 3.15Å; F577-D580 HydrophobicContact CB-CB 4.19Å; F577-D580 PolarHBondContact O-N 3.34Å; F577-Q583 HydrophobicContact CB-CB 4.3Å; F577-Q583 HydrophobicContact CD1-CB 4.24Å; F577-Q583 HydrophobicContact CD1-CG 3.62Å; F577-Q583 HydrophobicContact CD2-CB 4.42Å; F577-Q583 HydrophobicContact CD2-CG 4.16Å; F577-Q583 HydrophobicContact CE1-CG 3.68Å; F577-Q583 HydrophobicContact CE2-CG 4.23Å; F577-Q583 HydrophobicContact CG-CB 4.06Å; F577-Q583 HydrophobicContact CG-CG 3.87Å; F577-Q583 HydrophobicContact CZ-CG 3.98Å; F577-Q584 HydrophobicContact CD2-CB 4.11Å; F577-Q584 VanDerWaalsContact CD2-OE1 3.28Å; F577-F587 HydrophobicContact CE2-CB 3.77Å; F577-F587 HydrophobicContact CE2-CG 4.2Å; F577-F587 HydrophobicContact CZ-CB 4.46Å
578	G	86.8	Confident	92.3	Very high	46 Å²	46	48.2 Å²	48.2	47%	0.474	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	-113.6	179.2	0	0	0	0	0	112.2	S576	S576-G578 VanDerWaalsContact C-N 3.29Å; S576-G578 PolarHBondContact OG-N 2.93Å
579	R	84.3	Confident	92.2	Very high	214 Å²	214	51.9 Å²	51.9	81%	0.808	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-4.7	-179.1	-66.6	-171.9	179.7	-177.2	1.3	114.1	F577 F581	F577-R579 PolarHBondContact O-N 3.3Å; F577-R579 VanDerWaalsContact O-N 3.15Å; R579-F581 VanDerWaalsContact C-N 3.26Å; R579-F581 PolarHBondContact O-N 3.2Å
580	D	89.7	Confident	92.2	Very high	81 Å²	81	55.5 Å²	55.5	43%	0.433	28%	0.281	S	S	.	.			trans	-81.7	80	173.8	-161.3	-30.2	0	0	0	109.9	F577 E582 Q583 Q584	F577-D580 HydrophobicContact CB-CB 4.19Å; F577-D580 PolarHBondContact O-N 3.34Å; D580-E582 VanDerWaalsContact C-N 3.28Å; D580-E582 PolarHBondContact O-N 3.18Å; D580-E582 PolarHBondContact OD1-N 3.38Å; D580-Q583 HydrophobicContact CB-CB 4.17Å; D580-Q583 PolarHBondContact O-N 3.5Å; D580-Q583 WeakPolarHBondContact OD1-CB 3.27Å; D580-Q583 PolarHBondContact OD1-N 3.31Å; D580-Q584 PolarHBondContact O-N 3.31Å; D580-Q584 VanDerWaalsContact O-N 3.16Å
581	F	89.6	Confident	92.2	Very high	31 Å²	31	54.9 Å²	54.9	14%	0.136	27%	0.274	C	S	.	.	H	α-helix	trans	-67.2	-30	-176.6	-56.4	-52.1	0	0	0	112.6	R579 L585 L612 E615 V619 F631	R579-F581 VanDerWaalsContact C-N 3.26Å; R579-F581 PolarHBondContact O-N 3.2Å; F581-L585 WeakPolarHBondContact O-CB 3.12Å; F581-L585 PolarHBondContact O-N 3.5Å; F581-L612 HydrophobicContact CB-CD1 4.06Å; F581-L612 HydrophobicContact CD1-CD1 3.41Å; F581-L612 VanDerWaalsContact CD1-CD1 3.41Å; F581-L612 HydrophobicContact CE1-CD1 4.2Å; F581-L612 HydrophobicContact CG-CD1 4.14Å; F581-E615 HydrophobicContact CE1-CB 4.35Å; F581-V619 HydrophobicContact CZ-CG2 4.05Å; F581-F631 HydrophobicContact CB-CE1 3.73Å; F581-F631 HydrophobicContact CB-CE2 4.03Å; F581-F631 HydrophobicContact CB-CZ 3.45Å; F581-F631 VanDerWaalsContact CB-CZ 3.45Å; F581-F631 HydrophobicContact CG-CE1 4.47Å; F581-F631 WeakPolarHBondContact O-CE2 3.41Å; F581-F631 VanDerWaalsContact O-CZ 3.32Å; F581-F631 WeakPolarHBondContact O-CZ 3.28Å
582	E	90.9	Very high	92.2	Very high	143 Å²	143	57.6 Å²	57.6	67%	0.668	28%	0.284	S	S	*	.	H	α-helix	trans	-68.8	-43.7	178.1	-70.9	-174.9	-175.6	0	0	110.8	D580 L585 S586 F631	D580-E582 VanDerWaalsContact C-N 3.28Å; D580-E582 PolarHBondContact O-N 3.18Å; D580-E582 PolarHBondContact OD1-N 3.38Å; E582-L585 PolarHBondContact O-N 3.16Å; E582-S586 WeakPolarHBondContact O-CB 3.29Å; E582-S586 PolarHBondContact O-N 3.16Å; E582-F631 HydrophobicContact CG-CD2 4.18Å; E582-F631 HydrophobicContact CG-CE2 4.34Å
583	Q	91.9	Very high	92.1	Very high	95 Å²	95	61.6 Å²	61.6	44%	0.444	31%	0.312	S	S	.	.	H	α-helix	trans	-64.9	-40	176.2	-165.6	172.5	22.3	0	0	112.1	F577 D580 L585 S586 F587	F577-Q583 HydrophobicContact CB-CB 4.3Å; F577-Q583 HydrophobicContact CD1-CB 4.24Å; F577-Q583 HydrophobicContact CD1-CG 3.62Å; F577-Q583 HydrophobicContact CD2-CB 4.42Å; F577-Q583 HydrophobicContact CD2-CG 4.16Å; F577-Q583 HydrophobicContact CE1-CG 3.68Å; F577-Q583 HydrophobicContact CE2-CG 4.23Å; F577-Q583 HydrophobicContact CG-CB 4.06Å; F577-Q583 HydrophobicContact CG-CG 3.87Å; F577-Q583 HydrophobicContact CZ-CG 3.98Å; D580-Q583 HydrophobicContact CB-CB 4.17Å; D580-Q583 PolarHBondContact O-N 3.5Å; D580-Q583 WeakPolarHBondContact OD1-CB 3.27Å; D580-Q583 PolarHBondContact OD1-N 3.31Å; Q583-L585 PolarHBondContact O-N 2.9Å; Q583-S586 WeakPolarHBondContact O-CB 3.47Å; Q583-S586 PolarHBondContact O-N 3.02Å; Q583-F587 PolarHBondContact O-N 3.17Å
584	Q	93.6	Very high	92.2	Very high	17 Å²	17	55.7 Å²	55.7	8%	0.079	29%	0.293	C	S	.	.	H	α-helix	trans	-60.9	-43.8	174.1	-170	76.4	36.7	0	0	112	V575 F577 D580 F587 C588 L612	V575-Q584 PolarHBondContact O-NE2 3.27Å; V575-Q584 VanDerWaalsContact O-NE2 3.12Å; F577-Q584 HydrophobicContact CD2-CB 4.11Å; F577-Q584 VanDerWaalsContact CD2-OE1 3.28Å; D580-Q584 PolarHBondContact O-N 3.31Å; D580-Q584 VanDerWaalsContact O-N 3.16Å; Q584-F587 PolarHBondContact O-N 3.46Å; Q584-C588 PolarHBondContact O-N 3.39Å; Q584-C588 VanDerWaalsContact O-N 3.08Å; Q584-C588 PolarHBondContact O-SG 3.28Å; Q584-L612 HydrophobicContact CB-CD1 4.18Å; Q584-L612 HydrophobicContact CB-CD2 4.13Å; Q584-L612 HydrophobicContact CG-CD1 4.1Å; Q584-L612 HydrophobicContact CG-CD2 4.1Å
585	L	94.3	Very high	92.3	Very high	22 Å²	22	54.3 Å²	54.3	12%	0.115	29%	0.286	C	S	.	.	H	α-helix	trans	-65.6	-40.3	177	-177.3	60.8	0	0	0	111.4	F581 E582 Q583 F587 C588 V589 V609 L612 F631 A634	F581-L585 WeakPolarHBondContact O-CB 3.12Å; F581-L585 PolarHBondContact O-N 3.5Å; E582-L585 PolarHBondContact O-N 3.16Å; Q583-L585 PolarHBondContact O-N 2.9Å; L585-F587 VanDerWaalsContact C-N 3.31Å; L585-F587 PolarHBondContact O-N 3.46Å; L585-C588 PolarHBondContact O-N 2.96Å; L585-C588 VanDerWaalsContact O-N 3.16Å; L585-V589 WeakPolarHBondContact O-CG2 2.88Å; L585-V589 PolarHBondContact O-N 3.41Å; L585-V609 HydrophobicContact CD1-CG1 4.17Å; L585-V609 HydrophobicContact CD1-CG2 4.05Å; L585-L612 HydrophobicContact CB-CD2 4.05Å; L585-F631 HydrophobicContact CB-CE2 3.94Å; L585-F631 HydrophobicContact CB-CZ 4.25Å; L585-F631 HydrophobicContact CD2-CD2 4.26Å; L585-F631 HydrophobicContact CD2-CE2 3.7Å; L585-F631 HydrophobicContact CD2-CZ 4.33Å; L585-F631 HydrophobicContact CG-CE2 4.47Å; L585-A634 HydrophobicContact CD2-CB 4.18Å
586	S	94.6	Very high	92.1	Very high	75 Å²	75	57.2 Å²	57.2	52%	0.524	31%	0.306	S	S	.	.	H	α-helix	trans	-59	-43	175.5	-170	0	0	0	0	111.7	E582 Q583 V589 E590	E582-S586 WeakPolarHBondContact O-CB 3.29Å; E582-S586 PolarHBondContact O-N 3.16Å; Q583-S586 WeakPolarHBondContact O-CB 3.47Å; Q583-S586 PolarHBondContact O-N 3.02Å; S586-V589 WeakPolarHBondContact O-CB 3.17Å; S586-V589 PolarHBondContact O-N 3.3Å; S586-E590 PolarHBondContact O-N 2.65Å
587	F	95	Very high	91.9	Very high	14 Å²	14	60.8 Å²	60.8	6%	0.061	32%	0.322	C	S	.	.	H	α-helix	trans	-61.1	-43.8	173.9	170.8	-99.6	0	0	0	112.1	F571 V575 F577 Q583 Q584 L585 V589 E590 A591	F571-F587 HydrophobicContact CE1-CE2 4.31Å; F571-F587 HydrophobicContact CE1-CZ 4.06Å; F571-F587 HydrophobicContact CZ-CE2 4.38Å; F571-F587 HydrophobicContact CZ-CZ 4.36Å; V575-F587 HydrophobicContact CB-CD1 4.33Å; V575-F587 HydrophobicContact CB-CE1 3.81Å; V575-F587 HydrophobicContact CB-CZ 3.97Å; V575-F587 HydrophobicContact CG1-CD1 3.84Å; V575-F587 HydrophobicContact CG1-CD2 4.25Å; V575-F587 HydrophobicContact CG1-CE1 3.79Å; V575-F587 HydrophobicContact CG1-CE2 4.2Å; V575-F587 HydrophobicContact CG1-CG 4.08Å; V575-F587 HydrophobicContact CG1-CZ 3.98Å; V575-F587 HydrophobicContact CG2-CE1 3.96Å; V575-F587 HydrophobicContact CG2-CE2 4.18Å; V575-F587 HydrophobicContact CG2-CZ 3.6Å; F577-F587 HydrophobicContact CE2-CB 3.77Å; F577-F587 HydrophobicContact CE2-CG 4.2Å; F577-F587 HydrophobicContact CZ-CB 4.46Å; Q583-F587 PolarHBondContact O-N 3.17Å; Q584-F587 PolarHBondContact O-N 3.46Å; L585-F587 VanDerWaalsContact C-N 3.31Å; L585-F587 PolarHBondContact O-N 3.46Å; F587-V589 VanDerWaalsContact C-N 3.29Å; F587-V589 PolarHBondContact O-N 2.96Å; F587-E590 PolarHBondContact O-N 3.48Å; F587-A591 WeakPolarHBondContact O-CB 3.43Å; F587-A591 PolarHBondContact O-N 3.18Å
588	C	95	Very high	92	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-61.9	-36.8	176	-67.9	0	0	0	0	112.5	Q584 L585 R592 L605 V609 Y638	Q584-C588 PolarHBondContact O-N 3.39Å; Q584-C588 VanDerWaalsContact O-N 3.08Å; Q584-C588 PolarHBondContact O-SG 3.28Å; L585-C588 PolarHBondContact O-N 2.96Å; L585-C588 VanDerWaalsContact O-N 3.16Å; C588-R592 WeakPolarHBondContact O-CB 3.36Å; C588-R592 PolarHBondContact O-N 2.79Å; C588-L605 HydrophobicContact CB-CD2 4.36Å; C588-V609 HydrophobicContact CB-CG2 3.84Å; C588-Y638 PolarHBondContact O-OH 2.99Å; C588-Y638 VanDerWaalsContact O-OH 3.12Å
589	V	95.1	Very high	92.2	Very high	77 Å²	77	60.5 Å²	60.5	47%	0.467	31%	0.308	S	S	.	.	H	α-helix	trans	-63.6	-46.6	175	172.1	0	0	0	0	111.3	L585 S586 F587 R592 S593 Y638	L585-V589 WeakPolarHBondContact O-CG2 2.88Å; L585-V589 PolarHBondContact O-N 3.41Å; S586-V589 WeakPolarHBondContact O-CB 3.17Å; S586-V589 PolarHBondContact O-N 3.3Å; F587-V589 VanDerWaalsContact C-N 3.29Å; F587-V589 PolarHBondContact O-N 2.96Å; V589-R592 PolarHBondContact O-N 3.17Å; V589-S593 PolarHBondContact O-N 2.94Å; V589-S593 VanDerWaalsContact O-N 3.12Å; V589-Y638 HydrophobicContact CG2-CD2 3.88Å; V589-Y638 HydrophobicContact CG2-CE2 4Å
590	E	94.6	Very high	92.6	Very high	89 Å²	89	53.1 Å²	53.1	42%	0.416	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-46.7	175.8	-175.8	175.6	-171.4	0	0	111.6	L542 S586 F587 R592 S593 T594	L542-E590 HydrophobicContact CD2-CG 4.36Å; L542-E590 WeakPolarHBondContact CD2-OE1 3.37Å; S586-E590 PolarHBondContact O-N 2.65Å; F587-E590 PolarHBondContact O-N 3.48Å; E590-R592 VanDerWaalsContact C-N 3.33Å; E590-R592 PolarHBondContact O-N 2.89Å; E590-S593 PolarHBondContact O-N 3.22Å; E590-S593 VanDerWaalsContact O-N 3.15Å; E590-S593 PolarHBondContact O-OG 2.82Å; E590-T594 PolarHBondContact O-N 3.43Å; E590-T594 PolarHBondContact O-OG1 3.46Å
591	A	94.6	Very high	92.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-60.3	-40.8	177.9	0	0	0	0	0	112.1	F587 S593 T594 F595 L605	F587-A591 WeakPolarHBondContact O-CB 3.43Å; F587-A591 PolarHBondContact O-N 3.18Å; A591-S593 PolarHBondContact O-N 2.63Å; A591-T594 PolarHBondContact O-N 3.05Å; A591-F595 HydrophobicContact CB-CD2 4.11Å; A591-F595 HydrophobicContact CB-CE2 4.21Å; A591-F595 WeakPolarHBondContact O-CB 3.37Å; A591-F595 WeakPolarHBondContact O-CD2 3.39Å; A591-F595 PolarHBondContact O-N 2.95Å; A591-L605 HydrophobicContact CB-CD1 4.09Å; A591-L605 HydrophobicContact CB-CD2 3.87Å
592	R	94.6	Very high	93.1	Very high	58 Å²	58	48 Å²	48	22%	0.219	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-42.3	174.9	176.5	-179.8	169.1	-145.5	2.4	112.4	C588 V589 E590 T594 C596 L602 L605 Y638 I641 T642	C588-R592 WeakPolarHBondContact O-CB 3.36Å; C588-R592 PolarHBondContact O-N 2.79Å; V589-R592 PolarHBondContact O-N 3.17Å; E590-R592 VanDerWaalsContact C-N 3.33Å; E590-R592 PolarHBondContact O-N 2.89Å; R592-T594 VanDerWaalsContact C-N 3.27Å; R592-T594 PolarHBondContact O-N 3.5Å; R592-C596 PolarHBondContact O-N 3.36Å; R592-L602 HydrophobicContact CG-CD2 4.05Å; R592-L605 HydrophobicContact CB-CD1 4.08Å; R592-Y638 HydrophobicContact CB-CE2 4.17Å; R592-Y638 WeakPolarHBondContact CB-OH 3.37Å; R592-I641 PolarHBondContact NH2-O 3.14Å; R592-T642 VanDerWaalsContact CD-OG1 3.24Å; R592-T642 WeakPolarHBondContact CD-OG1 3.35Å; R592-T642 HydrophobicContact CG-CG2 4.41Å; R592-T642 PolarHBondContact NE-OG1 3.01Å; R592-T642 VanDerWaalsContact NE-OG1 3.08Å; R592-T642 PolarHBondContact NH1-OG1 3.16Å
593	S	92.9	Very high	93.4	Very high	86 Å²	86	42.9 Å²	42.9	60%	0.601	24%	0.241	S	C	*	.	H	α-helix	trans	-66.9	-32.6	178.4	73.9	0	0	0	0	112.1	V589 E590 A591	V589-S593 PolarHBondContact O-N 2.94Å; V589-S593 VanDerWaalsContact O-N 3.12Å; E590-S593 PolarHBondContact O-N 3.22Å; E590-S593 VanDerWaalsContact O-N 3.15Å; E590-S593 PolarHBondContact O-OG 2.82Å; A591-S593 PolarHBondContact O-N 2.63Å
594	T	93.6	Very high	93.6	Very high	25 Å²	25	39.8 Å²	39.8	15%	0.153	23%	0.227	C	C	.	.	H	α-helix	trans	-79.6	-40.6	-178.6	-54	0	0	0	0	112.4	K546 H549 E590 A591 R592	K546-T594 HydrophobicContact CB-CG2 4.01Å; K546-T594 HydrophobicContact CD-CG2 4.04Å; K546-T594 HydrophobicContact CG-CG2 3.95Å; H549-T594 PolarHBondContact CE1-O 3.36Å; H549-T594 PolarHBondContact ND1-O 3.49Å; E590-T594 PolarHBondContact O-N 3.43Å; E590-T594 PolarHBondContact O-OG1 3.46Å; A591-T594 PolarHBondContact O-N 3.05Å; R592-T594 VanDerWaalsContact C-N 3.27Å; R592-T594 PolarHBondContact O-N 3.5Å
595	F	93.8	Very high	93.7	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	-108.8	33.5	-170.6	-52.4	-54.4	0	0	0	114	L542 C545 H549 I568 I572 A591 N597 L598 V601	L542-F595 HydrophobicContact CD1-CE2 3.99Å; L542-F595 HydrophobicContact CD1-CZ 3.79Å; C545-F595 HydrophobicContact CB-CE1 3.83Å; C545-F595 HydrophobicContact CB-CZ 3.56Å; H549-F595 HydrophobicContact CB-CD1 3.83Å; H549-F595 HydrophobicContact CB-CE1 4.15Å; H549-F595 AromaticContact CG-CD1 3.94Å; I568-F595 HydrophobicContact CD1-CD1 4.21Å; I568-F595 HydrophobicContact CD1-CE1 4.24Å; I568-F595 HydrophobicContact CG2-CD1 4.32Å; I568-F595 HydrophobicContact CG2-CD2 3.98Å; I568-F595 HydrophobicContact CG2-CE1 4.22Å; I568-F595 HydrophobicContact CG2-CE2 3.88Å; I568-F595 HydrophobicContact CG2-CG 4.2Å; I568-F595 HydrophobicContact CG2-CZ 4Å; I572-F595 HydrophobicContact CD1-CD2 4.46Å; A591-F595 HydrophobicContact CB-CD2 4.11Å; A591-F595 HydrophobicContact CB-CE2 4.21Å; A591-F595 WeakPolarHBondContact O-CB 3.37Å; A591-F595 WeakPolarHBondContact O-CD2 3.39Å; A591-F595 PolarHBondContact O-N 2.95Å; F595-N597 PolarHBondContact O-N 3.35Å; F595-N597 VanDerWaalsContact O-N 3.12Å; F595-L598 PolarHBondContact O-N 3.09Å; F595-V601 HydrophobicContact CB-CB 4.4Å; F595-V601 HydrophobicContact CB-CG1 3.8Å; F595-V601 HydrophobicContact CD2-CG1 4.05Å; F595-V601 HydrophobicContact CG-CG1 4.2Å
596	C	87.5	Confident	93.8	Very high	67 Å²	67	38 Å²	38	45%	0.453	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.9	-170.7	60.7	0	0	0	0	114.6	R592	R592-C596 PolarHBondContact O-N 3.36Å
597	N	87.1	Confident	93.9	Very high	112 Å²	112	37.9 Å²	37.9	60%	0.599	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-7	-174.8	-59.5	-20.9	0	0	0	113.4	F595	F595-N597 PolarHBondContact O-N 3.35Å; F595-N597 VanDerWaalsContact O-N 3.12Å
598	L	91.6	Very high	93.9	Very high	4 Å²	4	38.2 Å²	38.2	2%	0.021	21%	0.212	C	C	.	.			trans	-107.6	96.5	-177.7	-66.8	178	0	0	0	111	V552 A565 I568 F595 P600 V601 L602	V552-L598 HydrophobicContact CG2-CD2 4.38Å; A565-L598 HydrophobicContact CB-CD1 4.46Å; I568-L598 HydrophobicContact CD1-CD1 3.59Å; F595-L598 PolarHBondContact O-N 3.09Å; L598-P600 VanDerWaalsContact C-CD 3.49Å; L598-V601 HydrophobicContact CB-CB 4.08Å; L598-V601 HydrophobicContact CB-CG2 3.74Å; L598-V601 HydrophobicContact CD1-CG2 4.11Å; L598-V601 WeakPolarHBondContact O-CB 3.37Å; L598-V601 PolarHBondContact O-N 3.33Å; L598-L602 PolarHBondContact O-N 3.26Å; L598-L602 VanDerWaalsContact O-N 3.17Å
599	E	90.9	Very high	94	Very high	60 Å²	60	38.2 Å²	38.2	28%	0.28	21%	0.212	S	C	.	.	H	α-helix	trans	-54.7	-43.6	-179.3	-64	-171.5	-175.9	0	0	114.8	V601 L602 V603 L646 S647	E599-V601 PolarHBondContact O-N 2.94Å; E599-L602 WeakPolarHBondContact O-CB 2.95Å; E599-L602 PolarHBondContact O-N 3.08Å; E599-L602 VanDerWaalsContact O-N 3.07Å; E599-V603 WeakPolarHBondContact O-CG2 3.45Å; E599-V603 PolarHBondContact O-N 3.19Å; E599-L646 HydrophobicContact CB-CD2 4.14Å; E599-L646 HydrophobicContact CG-CD2 4.32Å; E599-S647 WeakPolarHBondContact OE1-CA 3.47Å; E599-S647 WeakPolarHBondContact OE1-CB 3.22Å; E599-S647 PolarHBondContact OE1-N 2.97Å; E599-S647 PolarHBondContact OE1-OG 2.76Å; E599-S647 PolarHBondContact OE2-OG 2.87Å; E599-S647 VanDerWaalsContact OE2-OG 3.13Å
600	P	93.3	Very high	94	Very high	60 Å²	60	35 Å²	35	39%	0.39	19%	0.192	S	C	.	.	H	α-helix	trans	-60.7	-32.1	179.1	-22.1	33.6	0	0	0	112.5	A565 I569 L598 Q604	A565-P600 HydrophobicContact CB-CB 3.99Å; A565-P600 HydrophobicContact CB-CG 4.04Å; I569-P600 HydrophobicContact CD1-CB 3.98Å; L598-P600 VanDerWaalsContact C-CD 3.49Å; P600-Q604 PolarHBondContact O-N 3.2Å
601	V	95.4	Very high	94	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-68.5	-45.2	175.5	180	0	0	0	0	110.1	A565 I568 I569 I572 F595 L598 E599 V603 Q604 L605	A565-V601 HydrophobicContact CB-CG2 4.06Å; I568-V601 HydrophobicContact CB-CG2 4.13Å; I568-V601 HydrophobicContact CG2-CG1 4.07Å; I568-V601 HydrophobicContact CG2-CG2 3.93Å; I569-V601 HydrophobicContact CG1-CG2 4.25Å; I572-V601 HydrophobicContact CD1-CG1 3.51Å; F595-V601 HydrophobicContact CB-CB 4.4Å; F595-V601 HydrophobicContact CB-CG1 3.8Å; F595-V601 HydrophobicContact CD2-CG1 4.05Å; F595-V601 HydrophobicContact CG-CG1 4.2Å; L598-V601 HydrophobicContact CB-CB 4.08Å; L598-V601 HydrophobicContact CB-CG2 3.74Å; L598-V601 HydrophobicContact CD1-CG2 4.11Å; L598-V601 WeakPolarHBondContact O-CB 3.37Å; L598-V601 PolarHBondContact O-N 3.33Å; E599-V601 PolarHBondContact O-N 2.94Å; V601-V603 VanDerWaalsContact C-N 3.34Å; V601-V603 PolarHBondContact O-N 3.14Å; V601-Q604 PolarHBondContact O-N 3.09Å; V601-L605 HydrophobicContact CG1-CD1 4.25Å; V601-L605 HydrophobicContact CG1-CG 4.45Å; V601-L605 WeakPolarHBondContact O-CG 3.34Å; V601-L605 PolarHBondContact O-N 3.09Å
602	L	95.3	Very high	94	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-60	-42.9	176.1	-64.1	-177.5	0	0	0	112.3	R592 L598 E599 L605 I606 T642 L646	R592-L602 HydrophobicContact CG-CD2 4.05Å; L598-L602 PolarHBondContact O-N 3.26Å; L598-L602 VanDerWaalsContact O-N 3.17Å; E599-L602 WeakPolarHBondContact O-CB 2.95Å; E599-L602 PolarHBondContact O-N 3.08Å; E599-L602 VanDerWaalsContact O-N 3.07Å; L602-L605 HydrophobicContact CD2-CD1 4.44Å; L602-L605 PolarHBondContact O-N 3.09Å; L602-I606 WeakPolarHBondContact O-CG1 3.27Å; L602-I606 PolarHBondContact O-N 2.9Å; L602-T642 HydrophobicContact CB-CG2 4.41Å; L602-T642 HydrophobicContact CD2-CG2 4.26Å; L602-L646 HydrophobicContact CB-CD2 3.86Å; L602-L646 HydrophobicContact CD1-CD2 4.2Å
603	V	95.8	Very high	94	Very high	36 Å²	36	33.6 Å²	33.6	22%	0.218	19%	0.188	C	C	.	.	H	α-helix	trans	-59.3	-47.4	175.1	173.1	0	0	0	0	110.6	E599 V601 L605 I606 H607 L646 L655	E599-V603 WeakPolarHBondContact O-CG2 3.45Å; E599-V603 PolarHBondContact O-N 3.19Å; V601-V603 VanDerWaalsContact C-N 3.34Å; V601-V603 PolarHBondContact O-N 3.14Å; V603-L605 VanDerWaalsContact C-N 3.34Å; V603-L605 PolarHBondContact O-N 3.47Å; V603-I606 PolarHBondContact O-N 3.12Å; V603-H607 PolarHBondContact O-CD2 2.99Å; V603-H607 PolarHBondContact O-N 3.33Å; V603-L646 HydrophobicContact CG2-CD1 4.01Å; V603-L646 HydrophobicContact CG2-CD2 3.97Å; V603-L655 HydrophobicContact CG1-CD1 4.29Å; V603-L655 HydrophobicContact CG2-CD1 4.08Å
604	Q	96.3	Very high	94.1	Very high	30 Å²	30	32.2 Å²	32.2	14%	0.14	17%	0.173	C	C	.	.	H	α-helix	trans	-62.2	-39.4	176.9	-179	64.7	42.3	0	0	112.4	I569 P600 V601 H607 T608	I569-Q604 HydrophobicContact CD1-CB 4.37Å; I569-Q604 HydrophobicContact CG1-CB 3.95Å; I569-Q604 HydrophobicContact CG1-CG 4.21Å; I569-Q604 HydrophobicContact CG2-CB 4.48Å; I569-Q604 HydrophobicContact CG2-CG 3.95Å; P600-Q604 PolarHBondContact O-N 3.2Å; V601-Q604 PolarHBondContact O-N 3.09Å; Q604-H607 PolarHBondContact O-N 3.31Å; Q604-T608 WeakPolarHBondContact O-CB 3.42Å; Q604-T608 PolarHBondContact O-N 3.36Å; Q604-T608 PolarHBondContact O-OG1 3.04Å
605	L	96.4	Very high	94	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.4	-41.2	176.5	-72.2	172.8	0	0	0	111.6	I572 C588 A591 R592 V601 L602 V603 T608 V609	I572-L605 HydrophobicContact CD1-CD2 4.08Å; I572-L605 HydrophobicContact CD1-CG 4.38Å; I572-L605 HydrophobicContact CG2-CD2 4.03Å; C588-L605 HydrophobicContact CB-CD2 4.36Å; A591-L605 HydrophobicContact CB-CD1 4.09Å; A591-L605 HydrophobicContact CB-CD2 3.87Å; R592-L605 HydrophobicContact CB-CD1 4.08Å; V601-L605 HydrophobicContact CG1-CD1 4.25Å; V601-L605 HydrophobicContact CG1-CG 4.45Å; V601-L605 WeakPolarHBondContact O-CG 3.34Å; V601-L605 PolarHBondContact O-N 3.09Å; L602-L605 HydrophobicContact CD2-CD1 4.44Å; L602-L605 PolarHBondContact O-N 3.09Å; V603-L605 VanDerWaalsContact C-N 3.34Å; V603-L605 PolarHBondContact O-N 3.47Å; L605-T608 PolarHBondContact O-N 3.16Å; L605-V609 WeakPolarHBondContact O-CG2 3.17Å; L605-V609 PolarHBondContact O-N 3.34Å
606	I	96.6	Very high	93.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-45.5	174.8	-67.7	160.4	0	0	0	110.5	L602 V603 T608 V609 N610 C639 T642 I643 L646 L655	L602-I606 WeakPolarHBondContact O-CG1 3.27Å; L602-I606 PolarHBondContact O-N 2.9Å; V603-I606 PolarHBondContact O-N 3.12Å; I606-T608 VanDerWaalsContact C-N 3.31Å; I606-T608 PolarHBondContact O-N 2.68Å; I606-V609 PolarHBondContact O-N 3.23Å; I606-N610 WeakPolarHBondContact O-CB 3.47Å; I606-N610 PolarHBondContact O-N 3.31Å; I606-C639 HydrophobicContact CG2-CB 4.31Å; I606-T642 HydrophobicContact CD1-CG2 3.92Å; I606-T642 HydrophobicContact CG1-CG2 3.98Å; I606-I643 HydrophobicContact CD1-CG1 3.7Å; I606-L646 HydrophobicContact CD1-CD1 4.39Å; I606-L655 HydrophobicContact CD1-CD1 3.9Å; I606-L655 HydrophobicContact CG2-CD2 3.95Å
607	H	96.4	Very high	94	Very high	74 Å²	74	34.4 Å²	34.4	34%	0.343	17%	0.172	S	C	.	.	H	α-helix	trans	-60.4	-41.1	174.9	-76.3	-64.4	0	0	0	112.4	V603 Q604 N610 Q611 L658	V603-H607 PolarHBondContact O-CD2 2.99Å; V603-H607 PolarHBondContact O-N 3.33Å; Q604-H607 PolarHBondContact O-N 3.31Å; H607-N610 PolarHBondContact O-N 2.85Å; H607-Q611 WeakPolarHBondContact O-CB 3.47Å; H607-Q611 PolarHBondContact O-N 3.11Å; H607-L658 VanDerWaalsContact CE1-CD2 3.45Å; H607-L658 WeakPolarHBondContact CE1-CD2 3.43Å
608	T	95.3	Very high	94.1	Very high	20 Å²	20	35.8 Å²	35.8	12%	0.123	18%	0.177	C	C	.	.	H	α-helix	trans	-63.6	-42.4	178.5	-52.6	0	0	0	0	111.1	Q604 L605 I606 Q611 L612	Q604-T608 WeakPolarHBondContact O-CB 3.42Å; Q604-T608 PolarHBondContact O-N 3.36Å; Q604-T608 PolarHBondContact O-OG1 3.04Å; L605-T608 PolarHBondContact O-N 3.16Å; I606-T608 VanDerWaalsContact C-N 3.31Å; I606-T608 PolarHBondContact O-N 2.68Å; T608-Q611 PolarHBondContact O-N 3.45Å; T608-L612 WeakPolarHBondContact O-CB 3.41Å; T608-L612 PolarHBondContact O-N 2.98Å
609	V	96.3	Very high	94	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-71.3	-36.5	177.4	173.3	0	0	0	0	112.3	L585 C588 L605 I606 Q611 L612 A613 C635 Y638	L585-V609 HydrophobicContact CD1-CG1 4.17Å; L585-V609 HydrophobicContact CD1-CG2 4.05Å; C588-V609 HydrophobicContact CB-CG2 3.84Å; L605-V609 WeakPolarHBondContact O-CG2 3.17Å; L605-V609 PolarHBondContact O-N 3.34Å; I606-V609 PolarHBondContact O-N 3.23Å; V609-Q611 VanDerWaalsContact C-N 3.35Å; V609-L612 WeakPolarHBondContact O-CB 3.45Å; V609-L612 PolarHBondContact O-N 3.07Å; V609-A613 PolarHBondContact O-N 3.29Å; V609-C635 HydrophobicContact CG1-CB 3.54Å; V609-C635 WeakPolarHBondContact CG1-O 3.38Å; V609-Y638 HydrophobicContact CB-CD1 3.95Å; V609-Y638 HydrophobicContact CB-CE1 4.17Å; V609-Y638 HydrophobicContact CG1-CD1 3.86Å; V609-Y638 HydrophobicContact CG1-CG 4.43Å; V609-Y638 HydrophobicContact CG2-CD1 3.63Å; V609-Y638 HydrophobicContact CG2-CE1 3.56Å; V609-Y638 HydrophobicContact CG2-CG 4.37Å
610	N	96.3	Very high	93.8	Very high	9 Å²	9	39.4 Å²	39.4	5%	0.048	20%	0.199	C	C	.	.	H	α-helix	trans	-64.5	-40.3	172.4	-80.5	-21.4	0	0	0	111.7	I606 H607 A613 M614 C639 S659 V662	I606-N610 WeakPolarHBondContact O-CB 3.47Å; I606-N610 PolarHBondContact O-N 3.31Å; H607-N610 PolarHBondContact O-N 2.85Å; N610-A613 PolarHBondContact O-N 3.15Å; N610-M614 WeakPolarHBondContact O-CG 3.45Å; N610-M614 PolarHBondContact O-N 3.08Å; N610-M614 VanDerWaalsContact O-N 3.09Å; N610-C639 PolarHBondContact OD1-SG 3.31Å; N610-C639 VanDerWaalsContact OD1-SG 3.39Å; N610-S659 PolarHBondContact ND2-OG 3.13Å; N610-V662 HydrophobicContact CB-CG2 4.22Å
611	Q	95.1	Very high	93.4	Very high	110 Å²	110	45.1 Å²	45.1	51%	0.514	22%	0.218	S	C	.	.	H	α-helix	trans	-62.1	-44.3	172.8	179.9	176.4	-12.3	0	0	111.1	H607 T608 V609 A613 M614 E615	H607-Q611 WeakPolarHBondContact O-CB 3.47Å; H607-Q611 PolarHBondContact O-N 3.11Å; T608-Q611 PolarHBondContact O-N 3.45Å; V609-Q611 VanDerWaalsContact C-N 3.35Å; Q611-A613 VanDerWaalsContact C-N 3.31Å; Q611-A613 PolarHBondContact O-N 3.41Å; Q611-M614 CarbonylContact O-C 3.47Å; Q611-M614 WeakPolarHBondContact O-CA 3.3Å; Q611-M614 PolarHBondContact O-N 3.21Å; Q611-E615 HydrophobicContact CG-CG 4.27Å; Q611-E615 WeakPolarHBondContact CG-OE1 3.12Å; Q611-E615 PolarHBondContact NE2-OE1 3.24Å; Q611-E615 WeakPolarHBondContact O-CG 3.49Å; Q611-E615 PolarHBondContact O-N 3.12Å
612	L	94.1	Very high	92.6	Very high	6 Å²	6	45.3 Å²	45.3	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-58	-41.1	176.9	-170.8	61.5	0	0	0	112.6	F581 Q584 L585 T608 V609 E615 T616 F631	F581-L612 HydrophobicContact CB-CD1 4.06Å; F581-L612 HydrophobicContact CD1-CD1 3.41Å; F581-L612 VanDerWaalsContact CD1-CD1 3.41Å; F581-L612 HydrophobicContact CE1-CD1 4.2Å; F581-L612 HydrophobicContact CG-CD1 4.14Å; Q584-L612 HydrophobicContact CB-CD1 4.18Å; Q584-L612 HydrophobicContact CB-CD2 4.13Å; Q584-L612 HydrophobicContact CG-CD1 4.1Å; Q584-L612 HydrophobicContact CG-CD2 4.1Å; L585-L612 HydrophobicContact CB-CD2 4.05Å; T608-L612 WeakPolarHBondContact O-CB 3.41Å; T608-L612 PolarHBondContact O-N 2.98Å; V609-L612 WeakPolarHBondContact O-CB 3.45Å; V609-L612 PolarHBondContact O-N 3.07Å; L612-E615 PolarHBondContact O-N 3.41Å; L612-T616 WeakPolarHBondContact O-CB 3.22Å; L612-T616 PolarHBondContact O-N 3.44Å; L612-T616 PolarHBondContact O-OG1 2.85Å; L612-F631 HydrophobicContact CD2-CE1 4.36Å; L612-F631 HydrophobicContact CD2-CZ 3.68Å; L612-F631 HydrophobicContact CG-CE1 4.08Å; L612-F631 HydrophobicContact CG-CZ 3.87Å
613	A	94.5	Very high	92.2	Very high	2 Å²	2	49.4 Å²	49.4	2%	0.017	24%	0.242	C	C	.	.	H	α-helix	trans	-63.5	-42.2	173.6	0	0	0	0	0	111.7	V609 N610 Q611 T616 R617 V632 C635 V662 N666	V609-A613 PolarHBondContact O-N 3.29Å; N610-A613 PolarHBondContact O-N 3.15Å; Q611-A613 VanDerWaalsContact C-N 3.31Å; Q611-A613 PolarHBondContact O-N 3.41Å; A613-T616 WeakPolarHBondContact O-CB 3.2Å; A613-T616 PolarHBondContact O-N 3.48Å; A613-R617 PolarHBondContact O-N 3.37Å; A613-V632 HydrophobicContact CB-CG1 4.17Å; A613-C635 HydrophobicContact CB-CB 4.19Å; A613-V662 HydrophobicContact CB-CG1 3.86Å; A613-N666 PolarHBondContact O-OD1 2.89Å
614	M	94	Very high	91.7	Very high	57 Å²	57	49.4 Å²	49.4	28%	0.281	24%	0.239	S	C	.	.	H	α-helix	trans	-69.5	-37.5	177.1	-69.7	-59.2	-68	0	0	113.2	N610 Q611 T616 R617 M618 V662 A665	N610-M614 WeakPolarHBondContact O-CG 3.45Å; N610-M614 PolarHBondContact O-N 3.08Å; N610-M614 VanDerWaalsContact O-N 3.09Å; Q611-M614 CarbonylContact O-C 3.47Å; Q611-M614 WeakPolarHBondContact O-CA 3.3Å; Q611-M614 PolarHBondContact O-N 3.21Å; M614-T616 VanDerWaalsContact C-N 3.33Å; M614-R617 VanDerWaalsContact O-CB 3.27Å; M614-R617 WeakPolarHBondContact O-CB 3.12Å; M614-R617 PolarHBondContact O-N 2.93Å; M614-M618 WeakPolarHBondContact O-CG 3.47Å; M614-M618 PolarHBondContact O-N 3.45Å; M614-V662 HydrophobicContact CG-CG1 3.99Å; M614-V662 HydrophobicContact CG-CG2 4.13Å; M614-V662 HydrophobicContact SD-CG1 4.05Å; M614-V662 HydrophobicContact SD-CG2 4.35Å; M614-A665 HydrophobicContact CE-CB 4.4Å; M614-A665 HydrophobicContact SD-CB 4.06Å
615	E	92.1	Very high	91.4	Very high	77 Å²	77	50.7 Å²	50.7	36%	0.36	25%	0.252	S	S	.	.	H	α-helix	trans	-63.7	-41.2	173.2	-74	175.9	-173.7	0	0	111.1	F581 Q611 L612 R617 M618 V619	F581-E615 HydrophobicContact CE1-CB 4.35Å; Q611-E615 HydrophobicContact CG-CG 4.27Å; Q611-E615 WeakPolarHBondContact CG-OE1 3.12Å; Q611-E615 PolarHBondContact NE2-OE1 3.24Å; Q611-E615 WeakPolarHBondContact O-CG 3.49Å; Q611-E615 PolarHBondContact O-N 3.12Å; L612-E615 PolarHBondContact O-N 3.41Å; E615-R617 VanDerWaalsContact C-N 3.29Å; E615-R617 PolarHBondContact O-N 3.12Å; E615-M618 PolarHBondContact O-N 3.25Å; E615-M618 VanDerWaalsContact O-N 3.14Å; E615-V619 WeakPolarHBondContact O-CG2 3.31Å; E615-V619 PolarHBondContact O-N 2.93Å
616	T	91.1	Very high	90.9	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-58	-43.3	172.8	-57.2	0	0	0	0	111	L612 A613 M614 M620 T628 F631 V632	L612-T616 WeakPolarHBondContact O-CB 3.22Å; L612-T616 PolarHBondContact O-N 3.44Å; L612-T616 PolarHBondContact O-OG1 2.85Å; A613-T616 WeakPolarHBondContact O-CB 3.2Å; A613-T616 PolarHBondContact O-N 3.48Å; M614-T616 VanDerWaalsContact C-N 3.33Å; T616-M620 WeakPolarHBondContact O-CB 3.09Å; T616-M620 WeakPolarHBondContact O-CG 3.27Å; T616-M620 PolarHBondContact O-N 3.06Å; T616-T628 HydrophobicContact CG2-CG2 4.18Å; T616-F631 HydrophobicContact CG2-CD1 4.28Å; T616-F631 WeakPolarHBondContact OG1-CE1 3.5Å; T616-V632 HydrophobicContact CG2-CG2 4Å
617	R	90.1	Very high	90.6	Very high	61 Å²	61	70 Å²	70	23%	0.23	33%	0.329	C	S	.	.	H	α-helix	trans	-60.7	-45	174.3	-168.3	-176.9	173.5	-126.4	3.5	112.4	A613 M614 E615 M620 K621 G622 A665 N666	A613-R617 PolarHBondContact O-N 3.37Å; M614-R617 VanDerWaalsContact O-CB 3.27Å; M614-R617 WeakPolarHBondContact O-CB 3.12Å; M614-R617 PolarHBondContact O-N 2.93Å; E615-R617 VanDerWaalsContact C-N 3.29Å; E615-R617 PolarHBondContact O-N 3.12Å; R617-M620 CarbonylContact O-C 3.6Å; R617-M620 PolarHBondContact O-N 2.63Å; R617-K621 WeakPolarHBondContact O-CA 3.35Å; R617-K621 PolarHBondContact O-N 3.29Å; R617-G622 PolarHBondContact O-N 3.02Å; R617-A665 VanDerWaalsContact CD-O 3.32Å; R617-A665 WeakPolarHBondContact CD-O 3.41Å; R617-A665 PolarHBondContact NE-O 3.22Å; R617-N666 WeakPolarHBondContact CB-OD1 3.48Å
618	M	90	Very high	90.2	Very high	141 Å²	141	67.3 Å²	67.3	70%	0.695	32%	0.319	S	S	*	.	H	α-helix	trans	-62.6	-45	-179.2	-73.5	-63.9	-70.9	0	0	111.3	M614 E615 M620 K621	M614-M618 WeakPolarHBondContact O-CG 3.47Å; M614-M618 PolarHBondContact O-N 3.45Å; E615-M618 PolarHBondContact O-N 3.25Å; E615-M618 VanDerWaalsContact O-N 3.14Å; M618-M620 VanDerWaalsContact C-N 3.33Å; M618-M620 PolarHBondContact O-N 3.21Å; M618-K621 PolarHBondContact O-N 3.42Å
619	V	89.2	Confident	90	Very high	73 Å²	73	67.3 Å²	67.3	44%	0.442	32%	0.32	S	S	.	.	H	α-helix	trans	-62.9	-41.6	176.1	172.9	0	0	0	0	111.3	F581 E615 K621	F581-V619 HydrophobicContact CZ-CG2 4.05Å; E615-V619 WeakPolarHBondContact O-CG2 3.31Å; E615-V619 PolarHBondContact O-N 2.93Å; V619-K621 VanDerWaalsContact C-N 3.31Å; V619-K621 PolarHBondContact O-N 3.24Å
620	M	87.1	Confident	89.8	Confident	67 Å²	67	69.5 Å²	69.5	33%	0.33	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-1.1	-179.5	-66.4	-59.9	168.7	0	0	113.9	T616 R617 M618 G622 N623 T628	T616-M620 WeakPolarHBondContact O-CB 3.09Å; T616-M620 WeakPolarHBondContact O-CG 3.27Å; T616-M620 PolarHBondContact O-N 3.06Å; R617-M620 CarbonylContact O-C 3.6Å; R617-M620 PolarHBondContact O-N 2.63Å; M618-M620 VanDerWaalsContact C-N 3.33Å; M618-M620 PolarHBondContact O-N 3.21Å; M620-G622 PolarHBondContact O-N 3.17Å; M620-G622 VanDerWaalsContact O-N 3.12Å; M620-N623 PolarHBondContact O-N 3.19Å; M620-T628 HydrophobicContact CE-CG2 3.51Å; M620-T628 HydrophobicContact CG-CG2 4.15Å; M620-T628 HydrophobicContact SD-CG2 4.38Å
621	K	84	Confident	89.7	Confident	180 Å²	180	70.1 Å²	70.1	78%	0.783	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	35.6	-173.8	-58	-178.1	179.9	-178.9	0	113.1	R617 M618 V619 N623	R617-K621 WeakPolarHBondContact O-CA 3.35Å; R617-K621 PolarHBondContact O-N 3.29Å; M618-K621 PolarHBondContact O-N 3.42Å; V619-K621 VanDerWaalsContact C-N 3.31Å; V619-K621 PolarHBondContact O-N 3.24Å; K621-N623 VanDerWaalsContact C-N 3.32Å; K621-N623 PolarHBondContact O-N 3.04Å
622	G	79.6	Confident	89.6	Confident	4 Å²	4	65 Å²	65	4%	0.041	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	6.6	-176.9	0	0	0	0	0	116.1	R617 M620 Q667	R617-G622 PolarHBondContact O-N 3.02Å; M620-G622 PolarHBondContact O-N 3.17Å; M620-G622 VanDerWaalsContact O-N 3.12Å; G622-Q667 PolarHBondContact O-NE2 2.95Å
623	N	85.4	Confident	89.6	Confident	90 Å²	90	69.6 Å²	69.6	48%	0.481	33%	0.334	S	S	.	.			trans	-105.4	86.1	175.6	-69.3	-19.9	0	0	0	110.8	M620 K621 K773	M620-N623 PolarHBondContact O-N 3.19Å; K621-N623 VanDerWaalsContact C-N 3.32Å; K621-N623 PolarHBondContact O-N 3.04Å; N623-K773 WeakPolarHBondContact OD1-CE 3.45Å; N623-K773 PolarHBondContact OD1-NZ 3.24Å
624	H	87.1	Confident	89.6	Confident	35 Å²	35	71.6 Å²	71.6	16%	0.162	35%	0.35	C	S	.	.			trans	-75.4	129.7	-178.6	-60.9	-78.3	0	0	0	112.1	T628 A629 N666	H624-T628 WeakPolarHBondContact CA-OG1 3.48Å; H624-A629 HydrophobicContact CB-CB 4.01Å; H624-N666 PolarHBondContact CE1-OD1 2.97Å; H624-N666 PolarHBondContact NE2-OD1 3.16Å
625	S	88.4	Confident	89.7	Confident	58 Å²	58	68.9 Å²	68.9	41%	0.406	34%	0.337	S	S	.	.			trans	-67.6	166.1	161.2	73.8	0	0	0	0	111.4	K627 T628 A629	S625-K627 PolarHBondContact O-N 3.33Å; S625-K627 PolarHBondContact OG-N 3.36Å; S625-T628 PolarHBondContact N-OG1 3.46Å; S625-T628 PolarHBondContact O-N 3.29Å; S625-T628 PolarHBondContact O-OG1 3.13Å; S625-T628 VanDerWaalsContact O-OG1 3.04Å; S625-T628 PolarHBondContact OG-N 2.89Å; S625-T628 PolarHBondContact OG-OG1 3.33Å; S625-A629 VanDerWaalsContact O-CB 3.31Å; S625-A629 WeakPolarHBondContact O-CB 3.41Å; S625-A629 PolarHBondContact O-N 2.94Å
626	R	87.5	Confident	89.9	Confident	229 Å²	229	65.6 Å²	65.6	86%	0.864	32%	0.323	S	S	*	.	H	α-helix	trans	-54	-38.8	175.2	-171.8	177.3	-179.7	-178	0.7	112.7	A630	R626-A630 WeakPolarHBondContact O-CB 3.32Å; R626-A630 PolarHBondContact O-N 3.01Å; R626-A630 VanDerWaalsContact O-N 3.14Å
627	K	89.1	Confident	90.1	Very high	175 Å²	175	68 Å²	68	76%	0.761	34%	0.344	S	S	*	.	H	α-helix	trans	-69	-52.1	178.2	-69.9	-171.3	176.5	-172	0	111.6	S625 A629 A630 F631	S625-K627 PolarHBondContact O-N 3.33Å; S625-K627 PolarHBondContact OG-N 3.36Å; K627-A629 VanDerWaalsContact C-N 3.3Å; K627-A629 PolarHBondContact O-N 3.19Å; K627-A630 WeakPolarHBondContact O-CB 3.45Å; K627-A630 PolarHBondContact O-N 3.37Å; K627-A630 VanDerWaalsContact O-N 3.12Å; K627-F631 PolarHBondContact O-N 2.9Å
628	T	89.1	Confident	90.4	Very high	19 Å²	19	65.7 Å²	65.7	12%	0.117	34%	0.335	C	S	.	.	H	α-helix	trans	-65.6	-32.5	179.8	47.9	0	0	0	0	113.1	T616 M620 H624 S625 F631 V632	T616-T628 HydrophobicContact CG2-CG2 4.18Å; M620-T628 HydrophobicContact CE-CG2 3.51Å; M620-T628 HydrophobicContact CG-CG2 4.15Å; M620-T628 HydrophobicContact SD-CG2 4.38Å; H624-T628 WeakPolarHBondContact CA-OG1 3.48Å; S625-T628 PolarHBondContact N-OG1 3.46Å; S625-T628 PolarHBondContact O-N 3.29Å; S625-T628 PolarHBondContact O-OG1 3.13Å; S625-T628 VanDerWaalsContact O-OG1 3.04Å; S625-T628 PolarHBondContact OG-N 2.89Å; S625-T628 PolarHBondContact OG-OG1 3.33Å; T628-F631 PolarHBondContact O-N 3.13Å; T628-V632 WeakPolarHBondContact O-CG2 3.41Å; T628-V632 PolarHBondContact O-N 3.35Å
629	A	89.3	Confident	90.7	Very high	19 Å²	19	59 Å²	59	16%	0.157	30%	0.302	C	S	.	.	H	α-helix	trans	-67.6	-39.1	173.6	0	0	0	0	0	111.3	H624 S625 K627 F631 R633	H624-A629 HydrophobicContact CB-CB 4.01Å; S625-A629 VanDerWaalsContact O-CB 3.31Å; S625-A629 WeakPolarHBondContact O-CB 3.41Å; S625-A629 PolarHBondContact O-N 2.94Å; K627-A629 VanDerWaalsContact C-N 3.3Å; K627-A629 PolarHBondContact O-N 3.19Å; A629-F631 VanDerWaalsContact C-N 3.33Å; A629-R633 WeakPolarHBondContact O-CG 3.38Å; A629-R633 PolarHBondContact O-N 2.93Å; A629-R633 VanDerWaalsContact O-N 3.08Å
630	A	92.3	Very high	91	Very high	47 Å²	47	59.3 Å²	59.3	39%	0.388	30%	0.297	S	S	.	.	H	α-helix	trans	-64.3	-39.9	172.8	0	0	0	0	0	111.7	R626 K627 R633 A634	R626-A630 WeakPolarHBondContact O-CB 3.32Å; R626-A630 PolarHBondContact O-N 3.01Å; R626-A630 VanDerWaalsContact O-N 3.14Å; K627-A630 WeakPolarHBondContact O-CB 3.45Å; K627-A630 PolarHBondContact O-N 3.37Å; K627-A630 VanDerWaalsContact O-N 3.12Å; A630-R633 PolarHBondContact O-N 3.36Å; A630-A634 PolarHBondContact O-N 3.3Å
631	F	93.8	Very high	91.4	Very high	21 Å²	21	60.4 Å²	60.4	9%	0.092	30%	0.304	C	S	.	.	H	α-helix	trans	-61.8	-51.1	175.9	177.7	-98.7	0	0	0	112.7	F581 E582 L585 L612 T616 K627 T628 A629 R633 A634 C635	F581-F631 HydrophobicContact CB-CE1 3.73Å; F581-F631 HydrophobicContact CB-CE2 4.03Å; F581-F631 HydrophobicContact CB-CZ 3.45Å; F581-F631 VanDerWaalsContact CB-CZ 3.45Å; F581-F631 HydrophobicContact CG-CE1 4.47Å; F581-F631 WeakPolarHBondContact O-CE2 3.41Å; F581-F631 VanDerWaalsContact O-CZ 3.32Å; F581-F631 WeakPolarHBondContact O-CZ 3.28Å; E582-F631 HydrophobicContact CG-CD2 4.18Å; E582-F631 HydrophobicContact CG-CE2 4.34Å; L585-F631 HydrophobicContact CB-CE2 3.94Å; L585-F631 HydrophobicContact CB-CZ 4.25Å; L585-F631 HydrophobicContact CD2-CD2 4.26Å; L585-F631 HydrophobicContact CD2-CE2 3.7Å; L585-F631 HydrophobicContact CD2-CZ 4.33Å; L585-F631 HydrophobicContact CG-CE2 4.47Å; L612-F631 HydrophobicContact CD2-CE1 4.36Å; L612-F631 HydrophobicContact CD2-CZ 3.68Å; L612-F631 HydrophobicContact CG-CE1 4.08Å; L612-F631 HydrophobicContact CG-CZ 3.87Å; T616-F631 HydrophobicContact CG2-CD1 4.28Å; T616-F631 WeakPolarHBondContact OG1-CE1 3.5Å; K627-F631 PolarHBondContact O-N 2.9Å; T628-F631 PolarHBondContact O-N 3.13Å; A629-F631 VanDerWaalsContact C-N 3.33Å; F631-R633 VanDerWaalsContact C-N 3.26Å; F631-R633 PolarHBondContact O-N 3.07Å; F631-A634 CarbonylContact O-C 3.47Å; F631-A634 WeakPolarHBondContact O-CA 3.37Å; F631-A634 VanDerWaalsContact O-CB 3.29Å; F631-A634 WeakPolarHBondContact O-CB 3.46Å; F631-A634 PolarHBondContact O-N 3.18Å; F631-C635 VanDerWaalsContact CE1-SG 3.54Å; F631-C635 PolarHBondContact O-N 3.24Å; F631-C635 PolarHBondContact O-SG 3.49Å
632	V	94.1	Very high	91.9	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.012	27%	0.267	C	S	.	.	H	α-helix	trans	-61.4	-37.2	177.1	175.9	0	0	0	0	110.9	A613 T616 T628 A634 C635 A636 N666	A613-V632 HydrophobicContact CB-CG1 4.17Å; T616-V632 HydrophobicContact CG2-CG2 4Å; T628-V632 WeakPolarHBondContact O-CG2 3.41Å; T628-V632 PolarHBondContact O-N 3.35Å; V632-A634 VanDerWaalsContact C-N 3.3Å; V632-A634 PolarHBondContact O-N 3.19Å; V632-C635 WeakPolarHBondContact O-CB 3.24Å; V632-C635 PolarHBondContact O-N 3.14Å; V632-A636 PolarHBondContact O-N 3.4Å; V632-N666 HydrophobicContact CB-CB 4.49Å; V632-N666 HydrophobicContact CG1-CB 3.41Å; V632-N666 VanDerWaalsContact CG1-CB 3.41Å
633	R	93.8	Very high	92.7	Very high	103 Å²	103	51.7 Å²	51.7	39%	0.389	27%	0.265	S	S	.	.	H	α-helix	trans	-62.6	-35.3	171.5	-74.8	-170.9	-62.9	-91.3	1.2	112.8	A629 A630 F631 A636 A637	A629-R633 WeakPolarHBondContact O-CG 3.38Å; A629-R633 PolarHBondContact O-N 2.93Å; A629-R633 VanDerWaalsContact O-N 3.08Å; A630-R633 PolarHBondContact O-N 3.36Å; F631-R633 VanDerWaalsContact C-N 3.26Å; F631-R633 PolarHBondContact O-N 3.07Å; R633-A636 PolarHBondContact O-N 3.36Å; R633-A637 WeakPolarHBondContact O-CB 3.41Å; R633-A637 PolarHBondContact O-N 3.36Å
634	A	94.9	Very high	93.1	Very high	44 Å²	44	50.4 Å²	50.4	36%	0.364	26%	0.261	S	S	.	.	H	α-helix	trans	-67.5	-40.5	173.4	0	0	0	0	0	111.8	L585 A630 F631 V632 A637 Y638	L585-A634 HydrophobicContact CD2-CB 4.18Å; A630-A634 PolarHBondContact O-N 3.3Å; F631-A634 CarbonylContact O-C 3.47Å; F631-A634 WeakPolarHBondContact O-CA 3.37Å; F631-A634 VanDerWaalsContact O-CB 3.29Å; F631-A634 WeakPolarHBondContact O-CB 3.46Å; F631-A634 PolarHBondContact O-N 3.18Å; V632-A634 VanDerWaalsContact C-N 3.3Å; V632-A634 PolarHBondContact O-N 3.19Å; A634-A637 PolarHBondContact O-N 3.11Å; A634-Y638 WeakPolarHBondContact O-CB 3.33Å; A634-Y638 PolarHBondContact O-N 3.29Å
635	C	95.8	Very high	93.4	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.007	28%	0.277	C	S	.	.	H	α-helix	trans	-59.1	-46.7	171.7	-63.1	0	0	0	0	111.7	V609 A613 F631 V632 Y638 C639	V609-C635 HydrophobicContact CG1-CB 3.54Å; V609-C635 WeakPolarHBondContact CG1-O 3.38Å; A613-C635 HydrophobicContact CB-CB 4.19Å; F631-C635 VanDerWaalsContact CE1-SG 3.54Å; F631-C635 PolarHBondContact O-N 3.24Å; F631-C635 PolarHBondContact O-SG 3.49Å; V632-C635 WeakPolarHBondContact O-CB 3.24Å; V632-C635 PolarHBondContact O-N 3.14Å; C635-Y638 WeakPolarHBondContact O-CB 3.44Å; C635-Y638 PolarHBondContact O-N 3.47Å; C635-C639 PolarHBondContact O-N 3.17Å; C635-C639 PolarHBondContact O-SG 3.39Å; C635-C639 VanDerWaalsContact O-SG 3.41Å
636	A	95.7	Very high	93.6	Very high	8 Å²	8	49.6 Å²	49.6	7%	0.066	26%	0.259	C	S	.	.	H	α-helix	trans	-61.2	-44.9	175.5	0	0	0	0	0	111.7	V632 R633 Y638 C639 F640 Q671 F675	V632-A636 PolarHBondContact O-N 3.4Å; R633-A636 PolarHBondContact O-N 3.36Å; A636-Y638 VanDerWaalsContact C-N 3.33Å; A636-Y638 PolarHBondContact O-N 3.35Å; A636-C639 PolarHBondContact O-N 2.91Å; A636-F640 WeakPolarHBondContact O-CB 3.12Å; A636-F640 PolarHBondContact O-N 3.44Å; A636-Q671 HydrophobicContact CB-CB 4.04Å; A636-Q671 HydrophobicContact CB-CG 4.06Å; A636-F675 HydrophobicContact CB-CE2 3.98Å; A636-F675 HydrophobicContact CB-CZ 4.47Å; A636-F675 VanDerWaalsContact O-CZ 3.22Å; A636-F675 WeakPolarHBondContact O-CZ 3.37Å
637	A	95.4	Very high	93.7	Very high	52 Å²	52	43 Å²	43	43%	0.43	25%	0.248	S	C	.	.	H	α-helix	trans	-60	-43.4	176.5	0	0	0	0	0	111.6	R633 A634 C639 F640 I641	R633-A637 WeakPolarHBondContact O-CB 3.41Å; R633-A637 PolarHBondContact O-N 3.36Å; A634-A637 PolarHBondContact O-N 3.11Å; A637-C639 PolarHBondContact O-N 2.83Å; A637-F640 PolarHBondContact O-N 2.99Å; A637-I641 WeakPolarHBondContact O-CG1 3.2Å; A637-I641 PolarHBondContact O-N 3.27Å
638	Y	96.4	Very high	93.7	Very high	12 Å²	12	36.8 Å²	36.8	5%	0.047	23%	0.226	C	C	.	.	H	α-helix	trans	-56.7	-49.6	174.7	174.1	-84	0	0	0	111.8	C588 V589 R592 V609 A634 C635 A636 F640 I641 T642	C588-Y638 PolarHBondContact O-OH 2.99Å; C588-Y638 VanDerWaalsContact O-OH 3.12Å; V589-Y638 HydrophobicContact CG2-CD2 3.88Å; V589-Y638 HydrophobicContact CG2-CE2 4Å; R592-Y638 HydrophobicContact CB-CE2 4.17Å; R592-Y638 WeakPolarHBondContact CB-OH 3.37Å; V609-Y638 HydrophobicContact CB-CD1 3.95Å; V609-Y638 HydrophobicContact CB-CE1 4.17Å; V609-Y638 HydrophobicContact CG1-CD1 3.86Å; V609-Y638 HydrophobicContact CG1-CG 4.43Å; V609-Y638 HydrophobicContact CG2-CD1 3.63Å; V609-Y638 HydrophobicContact CG2-CE1 3.56Å; V609-Y638 HydrophobicContact CG2-CG 4.37Å; A634-Y638 WeakPolarHBondContact O-CB 3.33Å; A634-Y638 PolarHBondContact O-N 3.29Å; C635-Y638 WeakPolarHBondContact O-CB 3.44Å; C635-Y638 PolarHBondContact O-N 3.47Å; A636-Y638 VanDerWaalsContact C-N 3.33Å; A636-Y638 PolarHBondContact O-N 3.35Å; Y638-F640 VanDerWaalsContact C-N 3.34Å; Y638-F640 PolarHBondContact O-N 2.8Å; Y638-I641 VanDerWaalsContact O-CG1 3.3Å; Y638-I641 WeakPolarHBondContact O-CG1 3.45Å; Y638-I641 PolarHBondContact O-N 3.49Å; Y638-T642 WeakPolarHBondContact O-CB 3.45Å; Y638-T642 PolarHBondContact O-N 2.85Å; Y638-T642 VanDerWaalsContact O-N 3.16Å; Y638-T642 PolarHBondContact O-OG1 2.81Å
639	C	96.8	Very high	93.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.6	-44	177.6	-65.4	0	0	0	0	110.8	I606 N610 C635 A636 A637 I641 T642 I643 F675	I606-C639 HydrophobicContact CG2-CB 4.31Å; N610-C639 PolarHBondContact OD1-SG 3.31Å; N610-C639 VanDerWaalsContact OD1-SG 3.39Å; C635-C639 PolarHBondContact O-N 3.17Å; C635-C639 PolarHBondContact O-SG 3.39Å; C635-C639 VanDerWaalsContact O-SG 3.41Å; A636-C639 PolarHBondContact O-N 2.91Å; A637-C639 PolarHBondContact O-N 2.83Å; C639-I641 VanDerWaalsContact C-N 3.34Å; C639-I641 PolarHBondContact O-N 3.1Å; C639-T642 PolarHBondContact O-N 2.76Å; C639-T642 VanDerWaalsContact O-N 3.13Å; C639-I643 HydrophobicContact CB-CD1 4.45Å; C639-I643 WeakPolarHBondContact O-CD1 3.4Å; C639-I643 WeakPolarHBondContact O-CG1 3.28Å; C639-I643 PolarHBondContact O-N 2.98Å; C639-F675 HydrophobicContact CB-CE1 4.36Å; C639-F675 HydrophobicContact CB-CZ 3.95Å
640	F	95.9	Very high	93.9	Very high	79 Å²	79	38 Å²	38	35%	0.346	23%	0.228	S	C	.	.	H	α-helix	trans	-60.4	-38.2	-178.3	-167.9	-92	0	0	0	113.6	A636 A637 Y638 P644 A674 F675 A678	A636-F640 WeakPolarHBondContact O-CB 3.12Å; A636-F640 PolarHBondContact O-N 3.44Å; A637-F640 PolarHBondContact O-N 2.99Å; Y638-F640 VanDerWaalsContact C-N 3.34Å; Y638-F640 PolarHBondContact O-N 2.8Å; F640-P644 WeakPolarHBondContact O-CD 3.39Å; F640-P644 WeakPolarHBondContact O-CG 3.47Å; F640-A674 HydrophobicContact CE2-CB 4.02Å; F640-F675 HydrophobicContact CB-CE1 3.69Å; F640-F675 HydrophobicContact CB-CZ 3.86Å; F640-F675 AromaticContact CD2-CD1 3.61Å; F640-F675 HydrophobicContact CD2-CD1 3.61Å; F640-F675 AromaticContact CD2-CE1 3.63Å; F640-F675 HydrophobicContact CD2-CE1 3.63Å; F640-F675 HydrophobicContact CD2-CG 4.29Å; F640-F675 HydrophobicContact CD2-CZ 4.29Å; F640-F675 HydrophobicContact CE2-CD1 4.37Å; F640-F675 HydrophobicContact CG-CE1 4.16Å; F640-A678 HydrophobicContact CE2-CB 4.08Å; F640-A678 HydrophobicContact CZ-CB 4.48Å
641	I	95	Very high	93.8	Very high	91 Å²	91	37.7 Å²	37.7	47%	0.467	22%	0.223	S	C	.	.	H	α-helix	trans	-84.6	-15.7	178.2	64.2	175.6	0	0	0	113.5	R592 A637 Y638 C639	R592-I641 PolarHBondContact NH2-O 3.14Å; A637-I641 WeakPolarHBondContact O-CG1 3.2Å; A637-I641 PolarHBondContact O-N 3.27Å; Y638-I641 VanDerWaalsContact O-CG1 3.3Å; Y638-I641 WeakPolarHBondContact O-CG1 3.45Å; Y638-I641 PolarHBondContact O-N 3.49Å; C639-I641 VanDerWaalsContact C-N 3.34Å; C639-I641 PolarHBondContact O-N 3.1Å
642	T	95.3	Very high	93.9	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-91.9	-36.9	-177.9	-51.1	0	0	0	0	111.9	R592 L602 I606 Y638 C639 S645	R592-T642 VanDerWaalsContact CD-OG1 3.24Å; R592-T642 WeakPolarHBondContact CD-OG1 3.35Å; R592-T642 HydrophobicContact CG-CG2 4.41Å; R592-T642 PolarHBondContact NE-OG1 3.01Å; R592-T642 VanDerWaalsContact NE-OG1 3.08Å; R592-T642 PolarHBondContact NH1-OG1 3.16Å; L602-T642 HydrophobicContact CB-CG2 4.41Å; L602-T642 HydrophobicContact CD2-CG2 4.26Å; I606-T642 HydrophobicContact CD1-CG2 3.92Å; I606-T642 HydrophobicContact CG1-CG2 3.98Å; Y638-T642 WeakPolarHBondContact O-CB 3.45Å; Y638-T642 PolarHBondContact O-N 2.85Å; Y638-T642 VanDerWaalsContact O-N 3.16Å; Y638-T642 PolarHBondContact O-OG1 2.81Å; C639-T642 PolarHBondContact O-N 2.76Å; C639-T642 VanDerWaalsContact O-N 3.13Å; T642-S645 WeakPolarHBondContact O-CB 3.22Å; T642-S645 PolarHBondContact O-N 3.49Å; T642-S645 VanDerWaalsContact O-N 3.08Å
643	I	95.8	Very high	93.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-57.1	-42.9	-179.6	-66.1	161.3	0	0	0	113.1	I606 C639 S645 L646 R652 L655 Y656 F675	I606-I643 HydrophobicContact CD1-CG1 3.7Å; C639-I643 HydrophobicContact CB-CD1 4.45Å; C639-I643 WeakPolarHBondContact O-CD1 3.4Å; C639-I643 WeakPolarHBondContact O-CG1 3.28Å; C639-I643 PolarHBondContact O-N 2.98Å; I643-S645 PolarHBondContact O-N 2.63Å; I643-S645 VanDerWaalsContact O-N 3.08Å; I643-L646 WeakPolarHBondContact O-CG 3.29Å; I643-L646 PolarHBondContact O-N 3.38Å; I643-R652 HydrophobicContact CG2-CB 3.96Å; I643-R652 HydrophobicContact CG2-CG 4.05Å; I643-R652 WeakPolarHBondContact O-CG 3.18Å; I643-L655 HydrophobicContact CD1-CB 3.97Å; I643-L655 HydrophobicContact CG1-CB 3.94Å; I643-L655 HydrophobicContact CG2-CB 4.45Å; I643-Y656 HydrophobicContact CB-CD1 4.03Å; I643-Y656 HydrophobicContact CB-CE1 3.61Å; I643-Y656 HydrophobicContact CD1-CD1 3.48Å; I643-Y656 VanDerWaalsContact CD1-CD1 3.48Å; I643-Y656 HydrophobicContact CD1-CE1 3.85Å; I643-Y656 HydrophobicContact CD1-CG 4.3Å; I643-Y656 HydrophobicContact CG1-CD1 4.34Å; I643-Y656 HydrophobicContact CG1-CE1 4.34Å; I643-Y656 HydrophobicContact CG2-CD1 3.67Å; I643-Y656 HydrophobicContact CG2-CD2 3.95Å; I643-Y656 HydrophobicContact CG2-CE1 3.43Å; I643-Y656 VanDerWaalsContact CG2-CE1 3.43Å; I643-Y656 HydrophobicContact CG2-CE2 3.7Å; I643-Y656 HydrophobicContact CG2-CG 3.95Å; I643-Y656 VanDerWaalsContact CG2-CZ 3.45Å; I643-F675 HydrophobicContact CD1-CE1 4.01Å
644	P	94.2	Very high	93.9	Very high	64 Å²	64	37.5 Å²	37.5	42%	0.416	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-58.9	-20.1	176.9	-22.3	29.1	0	0	0	115	F640 L646 Y656	F640-P644 WeakPolarHBondContact O-CD 3.39Å; F640-P644 WeakPolarHBondContact O-CG 3.47Å; P644-L646 VanDerWaalsContact C-N 3.25Å; P644-L646 PolarHBondContact O-N 3.29Å; P644-Y656 WeakPolarHBondContact CG-OH 3.37Å
645	S	92.3	Very high	94	Very high	70 Å²	70	35.8 Å²	35.8	49%	0.49	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-77	-7.6	-179.2	-53.4	0	0	0	0	113.9	T642 I643	T642-S645 WeakPolarHBondContact O-CB 3.22Å; T642-S645 PolarHBondContact O-N 3.49Å; T642-S645 VanDerWaalsContact O-N 3.08Å; I643-S645 PolarHBondContact O-N 2.63Å; I643-S645 VanDerWaalsContact O-N 3.08Å
646	L	92.8	Very high	94	Very high	6 Å²	6	36.2 Å²	36.2	3%	0.031	21%	0.211	C	C	.	.			trans	-84.7	136.3	179.5	-56.5	174	0	0	0	110.9	E599 L602 V603 I606 I643 P644 R652 L655	E599-L646 HydrophobicContact CB-CD2 4.14Å; E599-L646 HydrophobicContact CG-CD2 4.32Å; L602-L646 HydrophobicContact CB-CD2 3.86Å; L602-L646 HydrophobicContact CD1-CD2 4.2Å; V603-L646 HydrophobicContact CG2-CD1 4.01Å; V603-L646 HydrophobicContact CG2-CD2 3.97Å; I606-L646 HydrophobicContact CD1-CD1 4.39Å; I643-L646 WeakPolarHBondContact O-CG 3.29Å; I643-L646 PolarHBondContact O-N 3.38Å; P644-L646 VanDerWaalsContact C-N 3.25Å; P644-L646 PolarHBondContact O-N 3.29Å; L646-R652 HydrophobicContact CB-CG 4.05Å; L646-R652 WeakPolarHBondContact O-CD 3.38Å; L646-L655 HydrophobicContact CD1-CD1 3.46Å; L646-L655 VanDerWaalsContact CD1-CD1 3.46Å
647	S	89.1	Confident	94	Very high	91 Å²	91	35.9 Å²	35.9	64%	0.636	21%	0.208	S	C	*	.	S	Bend	trans	-73.8	-34.6	174.3	67.9	0	0	0	0	112.6	E599 I649	E599-S647 WeakPolarHBondContact OE1-CA 3.47Å; E599-S647 WeakPolarHBondContact OE1-CB 3.22Å; E599-S647 PolarHBondContact OE1-N 2.97Å; E599-S647 PolarHBondContact OE1-OG 2.76Å; E599-S647 PolarHBondContact OE2-OG 2.87Å; E599-S647 VanDerWaalsContact OE2-OG 3.13Å; S647-I649 PolarHBondContact O-N 3.35Å; S647-I649 VanDerWaalsContact O-N 3.14Å
648	S	89.1	Confident	94.1	Very high	43 Å²	43	36.1 Å²	36.1	30%	0.301	20%	0.202	S	C	.	.			trans	-70.4	108.8	-179.1	177.4	0	0	0	0	111.9	F650 S651 R652	S648-F650 VanDerWaalsContact C-N 3.3Å; S648-F650 PolarHBondContact O-N 3.31Å; S648-S651 WeakPolarHBondContact CB-OG 3.46Å; S648-S651 WeakPolarHBondContact O-CB 3.4Å; S648-S651 PolarHBondContact O-N 3.21Å; S648-S651 VanDerWaalsContact O-N 3.13Å; S648-S651 PolarHBondContact OG-N 3.42Å; S648-S651 PolarHBondContact OG-OG 3.01Å; S648-R652 WeakPolarHBondContact O-CG 3.22Å; S648-R652 PolarHBondContact O-N 3.18Å
649	I	91.6	Very high	94.1	Very high	35 Å²	35	35.6 Å²	35.6	18%	0.179	20%	0.2	C	C	.	.	H	α-helix	trans	-59.5	-40.9	176.8	-64.6	157	0	0	0	111.4	S647 S651 R652 L653 V682 E685 V686	S647-I649 PolarHBondContact O-N 3.35Å; S647-I649 VanDerWaalsContact O-N 3.14Å; I649-S651 VanDerWaalsContact C-N 3.32Å; I649-S651 PolarHBondContact O-N 3.24Å; I649-R652 WeakPolarHBondContact O-CB 3.36Å; I649-R652 PolarHBondContact O-N 3.4Å; I649-R652 VanDerWaalsContact O-N 3.16Å; I649-L653 HydrophobicContact CG2-CD1 4.23Å; I649-L653 HydrophobicContact CG2-CG 4.37Å; I649-L653 WeakPolarHBondContact O-CG 3.27Å; I649-L653 PolarHBondContact O-N 3.36Å; I649-V682 HydrophobicContact CG2-CG1 3.81Å; I649-E685 HydrophobicContact CD1-CB 4.25Å; I649-E685 WeakPolarHBondContact CD1-O 3.44Å; I649-V686 HydrophobicContact CG2-CG2 3.71Å
650	F	90.8	Very high	94	Very high	29 Å²	29	35.6 Å²	35.6	13%	0.127	20%	0.2	C	C	.	.	H	α-helix	trans	-62.4	-40.1	176.3	-78.3	-72.3	0	0	0	112.1	S648 R652 L653 H654 V686 I690 F702	S648-F650 VanDerWaalsContact C-N 3.3Å; S648-F650 PolarHBondContact O-N 3.31Å; F650-R652 VanDerWaalsContact C-N 3.34Å; F650-L653 PolarHBondContact O-N 3.49Å; F650-H654 PolarHBondContact O-N 2.87Å; F650-H654 VanDerWaalsContact O-N 3.08Å; F650-H654 PolarHBondContact O-ND1 3.25Å; F650-V686 HydrophobicContact CE1-CG1 4.27Å; F650-V686 HydrophobicContact CE2-CG1 4.04Å; F650-V686 HydrophobicContact CZ-CG1 3.59Å; F650-I690 HydrophobicContact CD2-CG2 4.41Å; F650-I690 HydrophobicContact CE2-CG2 3.87Å; F650-F702 HydrophobicContact CD1-CB 4.12Å; F650-F702 HydrophobicContact CE1-CB 3.54Å; F650-F702 HydrophobicContact CZ-CB 3.91Å
651	S	92.1	Very high	93.9	Very high	41 Å²	41	34.6 Å²	34.6	29%	0.287	20%	0.197	S	C	.	.	H	α-helix	trans	-64.1	-41.4	174.6	-56.4	0	0	0	0	111	S648 I649 L655	S648-S651 WeakPolarHBondContact CB-OG 3.46Å; S648-S651 WeakPolarHBondContact O-CB 3.4Å; S648-S651 PolarHBondContact O-N 3.21Å; S648-S651 VanDerWaalsContact O-N 3.13Å; S648-S651 PolarHBondContact OG-N 3.42Å; S648-S651 PolarHBondContact OG-OG 3.01Å; I649-S651 VanDerWaalsContact C-N 3.32Å; I649-S651 PolarHBondContact O-N 3.24Å; S651-L655 VanDerWaalsContact O-CB 3.29Å; S651-L655 WeakPolarHBondContact O-CB 3.25Å; S651-L655 WeakPolarHBondContact O-CD1 3.02Å; S651-L655 WeakPolarHBondContact O-CG 3.38Å; S651-L655 PolarHBondContact O-N 3.06Å
652	R	94.9	Very high	93.9	Very high	39 Å²	39	31 Å²	31	15%	0.147	18%	0.179	C	C	.	.	H	α-helix	trans	-57.9	-50.7	174.6	-67.9	170.6	65.3	-156	2.7	111.9	I643 L646 S648 I649 F650 L655 Y656 V682 E685	I643-R652 HydrophobicContact CG2-CB 3.96Å; I643-R652 HydrophobicContact CG2-CG 4.05Å; I643-R652 WeakPolarHBondContact O-CG 3.18Å; L646-R652 HydrophobicContact CB-CG 4.05Å; L646-R652 WeakPolarHBondContact O-CD 3.38Å; S648-R652 WeakPolarHBondContact O-CG 3.22Å; S648-R652 PolarHBondContact O-N 3.18Å; I649-R652 WeakPolarHBondContact O-CB 3.36Å; I649-R652 PolarHBondContact O-N 3.4Å; I649-R652 VanDerWaalsContact O-N 3.16Å; F650-R652 VanDerWaalsContact C-N 3.34Å; R652-L655 PolarHBondContact O-N 2.94Å; R652-Y656 HydrophobicContact CB-CD2 4.41Å; R652-Y656 HydrophobicContact CB-CE2 4.24Å; R652-Y656 WeakPolarHBondContact O-CB 3.38Å; R652-Y656 WeakPolarHBondContact O-CD2 2.96Å; R652-Y656 PolarHBondContact O-N 2.97Å; R652-V682 VanDerWaalsContact NH2-CG2 3.26Å; R652-E685 IonicContact CZ-OE2 3.73Å; R652-E685 IonicContact NH1-OE2 3.98Å; R652-E685 PolarHBondContact NH1-OE2 3.19Å; R652-E685 IonicContact NH2-OE2 2.65Å
653	L	94	Very high	93.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-57.7	-52.6	-179.7	-73.2	175.3	0	0	0	111.9	I649 F650 L655 Y656 L657 A679 V682 V686 F706	I649-L653 HydrophobicContact CG2-CD1 4.23Å; I649-L653 HydrophobicContact CG2-CG 4.37Å; I649-L653 WeakPolarHBondContact O-CG 3.27Å; I649-L653 PolarHBondContact O-N 3.36Å; F650-L653 PolarHBondContact O-N 3.49Å; L653-L655 PolarHBondContact O-N 3.23Å; L653-Y656 PolarHBondContact O-N 3.31Å; L653-L657 PolarHBondContact O-N 3.44Å; L653-A679 VanDerWaalsContact CD2-O 3.31Å; L653-A679 WeakPolarHBondContact CD2-O 3.47Å; L653-V682 HydrophobicContact CD2-CB 4.22Å; L653-V682 HydrophobicContact CD2-CG1 4.14Å; L653-V682 HydrophobicContact CG-CG1 4.43Å; L653-V686 HydrophobicContact CD1-CG2 3.65Å; L653-F706 VanDerWaalsContact C-CE2 3.44Å; L653-F706 HydrophobicContact CB-CD1 4.47Å; L653-F706 HydrophobicContact CB-CD2 4.07Å; L653-F706 HydrophobicContact CB-CE1 4.16Å; L653-F706 HydrophobicContact CB-CE2 3.73Å; L653-F706 HydrophobicContact CB-CG 4.44Å; L653-F706 HydrophobicContact CB-CZ 3.77Å; L653-F706 HydrophobicContact CD1-CD1 4.32Å; L653-F706 HydrophobicContact CD1-CE1 4.36Å; L653-F706 HydrophobicContact CD2-CE1 3.95Å; L653-F706 HydrophobicContact CD2-CZ 4Å; L653-F706 HydrophobicContact CG-CE1 4.39Å; L653-F706 HydrophobicContact CG-CZ 4.38Å; L653-F706 VanDerWaalsContact O-CE2 3.24Å; L653-F706 WeakPolarHBondContact O-CE2 3.35Å
654	H	94.6	Very high	93.6	Very high	83 Å²	83	31.3 Å²	31.3	38%	0.384	18%	0.181	S	C	.	.	H	α-helix	trans	-64.2	-40.2	-178.8	-71.9	87.1	0	0	0	112.3	F650 L657 L658	F650-H654 PolarHBondContact O-N 2.87Å; F650-H654 VanDerWaalsContact O-N 3.08Å; F650-H654 PolarHBondContact O-ND1 3.25Å; H654-L657 PolarHBondContact O-N 3.39Å; H654-L658 VanDerWaalsContact O-CB 3.3Å; H654-L658 WeakPolarHBondContact O-CB 3.13Å; H654-L658 PolarHBondContact O-N 3.11Å
655	L	96.1	Very high	93.4	Very high	7 Å²	7	28.9 Å²	28.9	4%	0.037	17%	0.166	C	C	.	.	H	α-helix	trans	-72.7	-33.7	179.6	-68.5	171.1	0	0	0	112.7	V603 I606 I643 L646 S651 R652 L653 S659	V603-L655 HydrophobicContact CG1-CD1 4.29Å; V603-L655 HydrophobicContact CG2-CD1 4.08Å; I606-L655 HydrophobicContact CD1-CD1 3.9Å; I606-L655 HydrophobicContact CG2-CD2 3.95Å; I643-L655 HydrophobicContact CD1-CB 3.97Å; I643-L655 HydrophobicContact CG1-CB 3.94Å; I643-L655 HydrophobicContact CG2-CB 4.45Å; L646-L655 HydrophobicContact CD1-CD1 3.46Å; L646-L655 VanDerWaalsContact CD1-CD1 3.46Å; S651-L655 VanDerWaalsContact O-CB 3.29Å; S651-L655 WeakPolarHBondContact O-CB 3.25Å; S651-L655 WeakPolarHBondContact O-CD1 3.02Å; S651-L655 WeakPolarHBondContact O-CG 3.38Å; S651-L655 PolarHBondContact O-N 3.06Å; R652-L655 PolarHBondContact O-N 2.94Å; L653-L655 PolarHBondContact O-N 3.23Å; L655-S659 WeakPolarHBondContact O-CB 3.32Å; L655-S659 PolarHBondContact O-N 2.91Å; L655-S659 PolarHBondContact O-OG 3.07Å
656	Y	96.8	Very high	93.4	Very high	10 Å²	10	25.7 Å²	25.7	4%	0.039	14%	0.143	C	C	.	.	H	α-helix	trans	-64.4	-45.8	171.4	-76.1	-44.2	0	0	0	111.4	I643 P644 R652 L653 G660 F675 A678 V682	I643-Y656 HydrophobicContact CB-CD1 4.03Å; I643-Y656 HydrophobicContact CB-CE1 3.61Å; I643-Y656 HydrophobicContact CD1-CD1 3.48Å; I643-Y656 VanDerWaalsContact CD1-CD1 3.48Å; I643-Y656 HydrophobicContact CD1-CE1 3.85Å; I643-Y656 HydrophobicContact CD1-CG 4.3Å; I643-Y656 HydrophobicContact CG1-CD1 4.34Å; I643-Y656 HydrophobicContact CG1-CE1 4.34Å; I643-Y656 HydrophobicContact CG2-CD1 3.67Å; I643-Y656 HydrophobicContact CG2-CD2 3.95Å; I643-Y656 HydrophobicContact CG2-CE1 3.43Å; I643-Y656 VanDerWaalsContact CG2-CE1 3.43Å; I643-Y656 HydrophobicContact CG2-CE2 3.7Å; I643-Y656 HydrophobicContact CG2-CG 3.95Å; I643-Y656 VanDerWaalsContact CG2-CZ 3.45Å; P644-Y656 WeakPolarHBondContact CG-OH 3.37Å; R652-Y656 HydrophobicContact CB-CD2 4.41Å; R652-Y656 HydrophobicContact CB-CE2 4.24Å; R652-Y656 WeakPolarHBondContact O-CB 3.38Å; R652-Y656 WeakPolarHBondContact O-CD2 2.96Å; R652-Y656 PolarHBondContact O-N 2.97Å; L653-Y656 PolarHBondContact O-N 3.31Å; Y656-G660 PolarHBondContact O-N 3.45Å; Y656-F675 AromaticContact CD1-CD1 3.75Å; Y656-F675 HydrophobicContact CD1-CD1 3.75Å; Y656-F675 HydrophobicContact CD1-CE1 4.25Å; Y656-F675 HydrophobicContact CE1-CD1 4.4Å; Y656-A678 HydrophobicContact CD1-CB 4.37Å; Y656-A678 HydrophobicContact CD2-CB 4.45Å; Y656-A678 HydrophobicContact CE1-CB 4.11Å; Y656-A678 HydrophobicContact CE2-CB 4.22Å; Y656-V682 HydrophobicContact CE2-CG2 4.18Å
657	L	95.6	Very high	93.2	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-61.6	-49	176.8	178.8	57.7	0	0	0	111.4	L653 H654 S659 G660 Q661 L676 F706 N709 F710 T713	L653-L657 PolarHBondContact O-N 3.44Å; H654-L657 PolarHBondContact O-N 3.39Å; L657-S659 PolarHBondContact O-N 3.47Å; L657-G660 PolarHBondContact O-N 2.95Å; L657-Q661 HydrophobicContact CD1-CG 4.37Å; L657-Q661 WeakPolarHBondContact O-CG 3.49Å; L657-Q661 PolarHBondContact O-N 3.44Å; L657-L676 HydrophobicContact CD1-CD2 4.07Å; L657-F706 HydrophobicContact CB-CE2 3.84Å; L657-F706 HydrophobicContact CB-CZ 4.4Å; L657-F706 HydrophobicContact CD2-CD2 4.24Å; L657-F706 HydrophobicContact CD2-CE2 3.81Å; L657-F706 HydrophobicContact CG-CE2 4.47Å; L657-N709 HydrophobicContact CD2-CB 4.19Å; L657-F710 HydrophobicContact CD1-CD2 3.71Å; L657-F710 HydrophobicContact CD1-CE2 4.17Å; L657-F710 HydrophobicContact CD1-CG 4.39Å; L657-F710 HydrophobicContact CD2-CB 4.37Å; L657-F710 HydrophobicContact CD2-CD2 4.32Å; L657-F710 HydrophobicContact CG-CD2 4.4Å; L657-T713 HydrophobicContact CD1-CG2 4.06Å
658	L	96.1	Very high	93.3	Very high	56 Å²	56	24.5 Å²	24.5	29%	0.293	13%	0.128	S	C	.	.	H	α-helix	trans	-61.4	-46.2	179.3	179.7	63.7	0	0	0	112.1	H607 H654 G660 Q661 V662	H607-L658 VanDerWaalsContact CE1-CD2 3.45Å; H607-L658 WeakPolarHBondContact CE1-CD2 3.43Å; H654-L658 VanDerWaalsContact O-CB 3.3Å; H654-L658 WeakPolarHBondContact O-CB 3.13Å; H654-L658 PolarHBondContact O-N 3.11Å; L658-G660 VanDerWaalsContact C-N 3.3Å; L658-G660 PolarHBondContact O-N 2.82Å; L658-Q661 PolarHBondContact O-N 3.4Å; L658-V662 WeakPolarHBondContact O-CG2 3.35Å; L658-V662 PolarHBondContact O-N 3.44Å
659	S	96.5	Very high	93.4	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.007	13%	0.134	C	C	.	.	H	α-helix	trans	-67.5	-33.4	179.2	-52.4	0	0	0	0	111.4	N610 L655 L657 V662 A663	N610-S659 PolarHBondContact ND2-OG 3.13Å; L655-S659 WeakPolarHBondContact O-CB 3.32Å; L655-S659 PolarHBondContact O-N 2.91Å; L655-S659 PolarHBondContact O-OG 3.07Å; L657-S659 PolarHBondContact O-N 3.47Å; S659-V662 PolarHBondContact O-N 3.13Å; S659-A663 WeakPolarHBondContact O-CB 3.46Å; S659-A663 PolarHBondContact O-N 3.45Å
660	G	95.1	Very high	93.3	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62.7	-46.6	170.7	0	0	0	0	0	112.5	Y656 L657 L658 V662 A663 L664	Y656-G660 PolarHBondContact O-N 3.45Å; L657-G660 PolarHBondContact O-N 2.95Å; L658-G660 VanDerWaalsContact C-N 3.3Å; L658-G660 PolarHBondContact O-N 2.82Å; G660-V662 PolarHBondContact O-N 3.46Å; G660-A663 WeakPolarHBondContact O-CB 3.4Å; G660-A663 PolarHBondContact O-N 3.01Å; G660-L664 WeakPolarHBondContact O-CG 3.13Å; G660-L664 PolarHBondContact O-N 3.3Å
661	Q	93.8	Very high	93.4	Very high	59 Å²	59	29.2 Å²	29.2	28%	0.276	16%	0.156	S	C	.	.	H	α-helix	trans	-60.5	-42.5	175.2	-71.5	169.9	-12.3	0	0	112.1	L657 L658 L664 A665 T713	L657-Q661 HydrophobicContact CD1-CG 4.37Å; L657-Q661 WeakPolarHBondContact O-CG 3.49Å; L657-Q661 PolarHBondContact O-N 3.44Å; L658-Q661 PolarHBondContact O-N 3.4Å; Q661-L664 PolarHBondContact O-N 3.36Å; Q661-A665 WeakPolarHBondContact O-CB 3.38Å; Q661-A665 PolarHBondContact O-N 3.27Å; Q661-T713 HydrophobicContact CG-CG2 3.72Å; Q661-T713 PolarHBondContact NE2-OG1 3Å
662	V	94.7	Very high	93.5	Very high	15 Å²	15	27.3 Å²	27.3	9%	0.091	14%	0.143	C	C	.	.	H	α-helix	trans	-64.3	-40.9	175.3	171.4	0	0	0	0	111.2	N610 A613 M614 L658 S659 G660 A665 N666	N610-V662 HydrophobicContact CB-CG2 4.22Å; A613-V662 HydrophobicContact CB-CG1 3.86Å; M614-V662 HydrophobicContact CG-CG1 3.99Å; M614-V662 HydrophobicContact CG-CG2 4.13Å; M614-V662 HydrophobicContact SD-CG1 4.05Å; M614-V662 HydrophobicContact SD-CG2 4.35Å; L658-V662 WeakPolarHBondContact O-CG2 3.35Å; L658-V662 PolarHBondContact O-N 3.44Å; S659-V662 PolarHBondContact O-N 3.13Å; G660-V662 PolarHBondContact O-N 3.46Å; V662-A665 PolarHBondContact O-N 3.1Å; V662-N666 PolarHBondContact O-N 2.9Å; V662-N666 VanDerWaalsContact O-N 3.15Å; V662-N666 PolarHBondContact O-ND2 2.9Å
663	A	93.9	Very high	93.3	Very high	3 Å²	3	26.9 Å²	26.9	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-63.7	-42	175.6	0	0	0	0	0	112.1	S659 G660 N666 Q667 C668 Q671 A672 F675	S659-A663 WeakPolarHBondContact O-CB 3.46Å; S659-A663 PolarHBondContact O-N 3.45Å; G660-A663 WeakPolarHBondContact O-CB 3.4Å; G660-A663 PolarHBondContact O-N 3.01Å; A663-N666 CarbonylContact O-C 3.2Å; A663-N666 PolarHBondContact O-N 3.36Å; A663-Q667 PolarHBondContact O-N 3.48Å; A663-C668 HydrophobicContact CB-CB 4.27Å; A663-C668 PolarHBondContact O-N 3.23Å; A663-Q671 HydrophobicContact CB-CB 4.38Å; A663-A672 HydrophobicContact CB-CB 3.94Å; A663-F675 HydrophobicContact CB-CD2 4.33Å; A663-F675 HydrophobicContact CB-CE2 4.46Å
664	L	91.4	Very high	93.3	Very high	3 Å²	3	28.6 Å²	28.6	2%	0.016	16%	0.157	C	C	.	.	H	α-helix	trans	-60.8	-47.4	173.9	-70.2	169	0	0	0	111.3	G660 Q661 N666 Q667 L669 A672 T713 V717 I771	G660-L664 WeakPolarHBondContact O-CG 3.13Å; G660-L664 PolarHBondContact O-N 3.3Å; Q661-L664 PolarHBondContact O-N 3.36Å; L664-N666 PolarHBondContact O-N 3.31Å; L664-N666 VanDerWaalsContact O-N 3.14Å; L664-Q667 PolarHBondContact O-N 3.44Å; L664-L669 HydrophobicContact CD2-CD2 4.1Å; L664-A672 HydrophobicContact CD2-CB 3.46Å; L664-A672 VanDerWaalsContact CD2-CB 3.46Å; L664-A672 HydrophobicContact CG-CB 3.54Å; L664-T713 HydrophobicContact CD1-CG2 4.39Å; L664-V717 HydrophobicContact CD1-CG2 3.7Å; L664-I771 HydrophobicContact CB-CD1 3.82Å; L664-I771 HydrophobicContact CD1-CD1 4.46Å
665	A	91.4	Very high	93.4	Very high	13 Å²	13	24.7 Å²	24.7	11%	0.107	14%	0.139	C	C	.	.	H	α-helix	trans	-58.5	-29.4	178.4	0	0	0	0	0	112.7	M614 R617 Q661 V662	M614-A665 HydrophobicContact CE-CB 4.4Å; M614-A665 HydrophobicContact SD-CB 4.06Å; R617-A665 VanDerWaalsContact CD-O 3.32Å; R617-A665 WeakPolarHBondContact CD-O 3.41Å; R617-A665 PolarHBondContact NE-O 3.22Å; Q661-A665 WeakPolarHBondContact O-CB 3.38Å; Q661-A665 PolarHBondContact O-N 3.27Å; V662-A665 PolarHBondContact O-N 3.1Å
666	N	90.8	Very high	93.3	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.016	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	16.9	177.9	-74.7	-85.5	0	0	0	114.3	A613 R617 H624 V632 V662 A663 L664 C668	A613-N666 PolarHBondContact O-OD1 2.89Å; R617-N666 WeakPolarHBondContact CB-OD1 3.48Å; H624-N666 PolarHBondContact CE1-OD1 2.97Å; H624-N666 PolarHBondContact NE2-OD1 3.16Å; V632-N666 HydrophobicContact CB-CB 4.49Å; V632-N666 HydrophobicContact CG1-CB 3.41Å; V632-N666 VanDerWaalsContact CG1-CB 3.41Å; V662-N666 PolarHBondContact O-N 2.9Å; V662-N666 VanDerWaalsContact O-N 3.15Å; V662-N666 PolarHBondContact O-ND2 2.9Å; A663-N666 CarbonylContact O-C 3.2Å; A663-N666 PolarHBondContact O-N 3.36Å; L664-N666 PolarHBondContact O-N 3.31Å; L664-N666 VanDerWaalsContact O-N 3.14Å; N666-C668 PolarHBondContact O-N 2.8Å; N666-C668 VanDerWaalsContact O-N 3.16Å; N666-C668 PolarHBondContact O-SG 3.48Å
667	Q	90.1	Very high	93.1	Very high	67 Å²	67	26.6 Å²	26.6	31%	0.313	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	24.1	178	-59.1	155.6	21.9	0	0	114	G622 A663 L664 L669 K773 V774	G622-Q667 PolarHBondContact O-NE2 2.95Å; A663-Q667 PolarHBondContact O-N 3.48Å; L664-Q667 PolarHBondContact O-N 3.44Å; Q667-L669 PolarHBondContact O-N 2.83Å; Q667-K773 HydrophobicContact CG-CB 4.32Å; Q667-V774 HydrophobicContact CG-CG2 4.39Å
668	C	90.9	Very high	93.1	Very high	6 Å²	6	27.1 Å²	27.1	4%	0.041	15%	0.152	C	C	.	.			trans	-96.1	66.1	178.5	-67.7	0	0	0	0	110.8	A663 N666 S670 Q671 A672	A663-C668 HydrophobicContact CB-CB 4.27Å; A663-C668 PolarHBondContact O-N 3.23Å; N666-C668 PolarHBondContact O-N 2.8Å; N666-C668 VanDerWaalsContact O-N 3.16Å; N666-C668 PolarHBondContact O-SG 3.48Å; C668-S670 PolarHBondContact O-N 3.03Å; C668-Q671 HydrophobicContact CB-CB 4.3Å; C668-Q671 PolarHBondContact O-N 3.41Å; C668-A672 PolarHBondContact O-N 2.84Å
669	L	89.7	Confident	93	Very high	79 Å²	79	24.5 Å²	24.5	41%	0.414	14%	0.138	S	C	.	.	H	α-helix	trans	-58.5	-43.7	-170.6	-58.6	180	0	0	0	113.4	L664 Q667 Q671 A672 D673 P718 V774	L664-L669 HydrophobicContact CD2-CD2 4.1Å; Q667-L669 PolarHBondContact O-N 2.83Å; L669-Q671 VanDerWaalsContact C-N 3.31Å; L669-Q671 PolarHBondContact O-N 3.22Å; L669-A672 PolarHBondContact O-N 3.12Å; L669-D673 WeakPolarHBondContact O-CB 3.27Å; L669-D673 PolarHBondContact O-N 3.2Å; L669-P718 HydrophobicContact CD1-CG 4.37Å; L669-P718 HydrophobicContact CD2-CG 4.06Å; L669-V774 HydrophobicContact CD2-CG1 3.79Å; L669-V774 HydrophobicContact CD2-CG2 4.2Å
670	S	90.4	Very high	92.8	Very high	79 Å²	79	25 Å²	25	55%	0.552	14%	0.141	S	C	*	.	H	α-helix	trans	-62.2	-37.4	178.9	48.8	0	0	0	0	113.1	C668 A674	C668-S670 PolarHBondContact O-N 3.03Å; S670-A674 PolarHBondContact O-N 3Å; S670-A674 VanDerWaalsContact O-N 3.17Å
671	Q	93.2	Very high	92.6	Very high	47 Å²	47	28.4 Å²	28.4	22%	0.22	17%	0.165	C	C	.	.	H	α-helix	trans	-75.4	-39.3	178.9	-70.4	69.1	26.8	0	0	110.4	A636 A663 C668 L669 A674 F675	A636-Q671 HydrophobicContact CB-CB 4.04Å; A636-Q671 HydrophobicContact CB-CG 4.06Å; A663-Q671 HydrophobicContact CB-CB 4.38Å; C668-Q671 HydrophobicContact CB-CB 4.3Å; C668-Q671 PolarHBondContact O-N 3.41Å; L669-Q671 VanDerWaalsContact C-N 3.31Å; L669-Q671 PolarHBondContact O-N 3.22Å; Q671-A674 PolarHBondContact O-N 3.2Å; Q671-F675 WeakPolarHBondContact O-CD2 3.37Å; Q671-F675 PolarHBondContact O-N 3.11Å
672	A	93	Very high	92.5	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.008	15%	0.153	C	C	.	.	H	α-helix	trans	-59.2	-48.4	173.8	0	0	0	0	0	111.9	A663 L664 C668 L669 A674 F675 L676	A663-A672 HydrophobicContact CB-CB 3.94Å; L664-A672 HydrophobicContact CD2-CB 3.46Å; L664-A672 VanDerWaalsContact CD2-CB 3.46Å; L664-A672 HydrophobicContact CG-CB 3.54Å; C668-A672 PolarHBondContact O-N 2.84Å; L669-A672 PolarHBondContact O-N 3.12Å; A672-A674 VanDerWaalsContact C-N 3.32Å; A672-A674 PolarHBondContact O-N 3.06Å; A672-F675 WeakPolarHBondContact O-CB 3.18Å; A672-F675 PolarHBondContact O-N 3.29Å; A672-L676 VanDerWaalsContact O-CG 3.32Å; A672-L676 WeakPolarHBondContact O-CG 3.47Å; A672-L676 PolarHBondContact O-N 3.23Å
673	D	91.8	Very high	92.3	Very high	31 Å²	31	25.1 Å²	25.1	17%	0.166	15%	0.149	C	C	.	.	H	α-helix	trans	-59.3	-43.1	176.7	179.1	61.1	0	0	0	111.5	L669 F675 L676 K677	L669-D673 WeakPolarHBondContact O-CB 3.27Å; L669-D673 PolarHBondContact O-N 3.2Å; D673-F675 PolarHBondContact O-N 3.5Å; D673-L676 PolarHBondContact O-N 2.92Å; D673-K677 WeakPolarHBondContact O-CB 3.32Å; D673-K677 VanDerWaalsContact O-CG 3.31Å; D673-K677 WeakPolarHBondContact O-CG 3.22Å; D673-K677 PolarHBondContact O-N 3.5Å; D673-K677 WeakPolarHBondContact OD1-CE 3.33Å; D673-K677 IonicContact OD1-NZ 2.93Å; D673-K677 WeakPolarHBondContact OD2-CD 3.39Å; D673-K677 WeakPolarHBondContact OD2-CE 3.27Å; D673-K677 IonicContact OD2-NZ 3.12Å; D673-K677 PolarHBondContact OD2-NZ 3.14Å
674	A	94	Very high	92	Very high	35 Å²	35	27.5 Å²	27.5	29%	0.289	16%	0.164	S	C	.	.	H	α-helix	trans	-59.8	-43.2	175	0	0	0	0	0	112.7	F640 S670 Q671 A672 A678	F640-A674 HydrophobicContact CE2-CB 4.02Å; S670-A674 PolarHBondContact O-N 3Å; S670-A674 VanDerWaalsContact O-N 3.17Å; Q671-A674 PolarHBondContact O-N 3.2Å; A672-A674 VanDerWaalsContact C-N 3.32Å; A672-A674 PolarHBondContact O-N 3.06Å; A674-A678 VanDerWaalsContact O-CB 3.32Å; A674-A678 WeakPolarHBondContact O-CB 3.41Å; A674-A678 PolarHBondContact O-N 3.28Å
675	F	95.9	Very high	91.9	Very high	1 Å²	1	32.5 Å²	32.5	0%	0.004	19%	0.188	C	C	.	.	H	α-helix	trans	-63.2	-45.3	176.3	-80.2	-58.4	0	0	0	112.8	A636 C639 F640 I643 Y656 A663 Q671 A672 D673 A678 A679	A636-F675 HydrophobicContact CB-CE2 3.98Å; A636-F675 HydrophobicContact CB-CZ 4.47Å; A636-F675 VanDerWaalsContact O-CZ 3.22Å; A636-F675 WeakPolarHBondContact O-CZ 3.37Å; C639-F675 HydrophobicContact CB-CE1 4.36Å; C639-F675 HydrophobicContact CB-CZ 3.95Å; F640-F675 HydrophobicContact CB-CE1 3.69Å; F640-F675 HydrophobicContact CB-CZ 3.86Å; F640-F675 AromaticContact CD2-CD1 3.61Å; F640-F675 HydrophobicContact CD2-CD1 3.61Å; F640-F675 AromaticContact CD2-CE1 3.63Å; F640-F675 HydrophobicContact CD2-CE1 3.63Å; F640-F675 HydrophobicContact CD2-CG 4.29Å; F640-F675 HydrophobicContact CD2-CZ 4.29Å; F640-F675 HydrophobicContact CE2-CD1 4.37Å; F640-F675 HydrophobicContact CG-CE1 4.16Å; I643-F675 HydrophobicContact CD1-CE1 4.01Å; Y656-F675 AromaticContact CD1-CD1 3.75Å; Y656-F675 HydrophobicContact CD1-CD1 3.75Å; Y656-F675 HydrophobicContact CD1-CE1 4.25Å; Y656-F675 HydrophobicContact CE1-CD1 4.4Å; A663-F675 HydrophobicContact CB-CD2 4.33Å; A663-F675 HydrophobicContact CB-CE2 4.46Å; Q671-F675 WeakPolarHBondContact O-CD2 3.37Å; Q671-F675 PolarHBondContact O-N 3.11Å; A672-F675 WeakPolarHBondContact O-CB 3.18Å; A672-F675 PolarHBondContact O-N 3.29Å; D673-F675 PolarHBondContact O-N 3.5Å; F675-A678 PolarHBondContact O-N 2.87Å; F675-A679 PolarHBondContact O-N 3.32Å
676	L	94.4	Very high	91.7	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-67.4	-41.5	-179.6	-65.2	174.4	0	0	0	111.1	L657 A672 D673 A678 A679 V680 F710 V717 L728	L657-L676 HydrophobicContact CD1-CD2 4.07Å; A672-L676 VanDerWaalsContact O-CG 3.32Å; A672-L676 WeakPolarHBondContact O-CG 3.47Å; A672-L676 PolarHBondContact O-N 3.23Å; D673-L676 PolarHBondContact O-N 2.92Å; L676-A678 PolarHBondContact O-N 2.98Å; L676-A679 PolarHBondContact O-N 3.27Å; L676-V680 WeakPolarHBondContact O-CG2 3.47Å; L676-V680 PolarHBondContact O-N 3.3Å; L676-F710 HydrophobicContact CB-CZ 4.05Å; L676-F710 HydrophobicContact CD2-CE2 3.66Å; L676-F710 HydrophobicContact CD2-CZ 3.75Å; L676-F710 HydrophobicContact CG-CZ 4.47Å; L676-V717 HydrophobicContact CD1-CG1 3.98Å; L676-V717 HydrophobicContact CD1-CG2 3.7Å; L676-L728 HydrophobicContact CB-CD1 4.26Å; L676-L728 HydrophobicContact CB-CD2 4.49Å; L676-L728 HydrophobicContact CD1-CD1 4.01Å
677	K	93	Very high	91.4	Very high	57 Å²	57	34.7 Å²	34.7	25%	0.248	20%	0.201	C	C	.	.	H	α-helix	trans	-59.9	-44.7	172.3	-75.8	172.9	171.8	166.5	0	111.8	D673 A679 V680 S681 Y727 L728	D673-K677 WeakPolarHBondContact O-CB 3.32Å; D673-K677 VanDerWaalsContact O-CG 3.31Å; D673-K677 WeakPolarHBondContact O-CG 3.22Å; D673-K677 PolarHBondContact O-N 3.5Å; D673-K677 WeakPolarHBondContact OD1-CE 3.33Å; D673-K677 IonicContact OD1-NZ 2.93Å; D673-K677 WeakPolarHBondContact OD2-CD 3.39Å; D673-K677 WeakPolarHBondContact OD2-CE 3.27Å; D673-K677 IonicContact OD2-NZ 3.12Å; D673-K677 PolarHBondContact OD2-NZ 3.14Å; K677-A679 PolarHBondContact O-N 3.49Å; K677-V680 PolarHBondContact O-N 3Å; K677-S681 PolarHBondContact O-N 3.23Å; K677-S681 PolarHBondContact O-OG 3.12Å; K677-Y727 VanDerWaalsContact CE-CE1 3.46Å; K677-L728 HydrophobicContact CG-CD2 3.86Å
678	A	94.1	Very high	91	Very high	13 Å²	13	36.9 Å²	36.9	11%	0.107	21%	0.206	C	C	.	.	H	α-helix	trans	-63.3	-40.3	177.3	0	0	0	0	0	112.2	F640 Y656 A674 F675 L676 S681 V682	F640-A678 HydrophobicContact CE2-CB 4.08Å; F640-A678 HydrophobicContact CZ-CB 4.48Å; Y656-A678 HydrophobicContact CD1-CB 4.37Å; Y656-A678 HydrophobicContact CD2-CB 4.45Å; Y656-A678 HydrophobicContact CE1-CB 4.11Å; Y656-A678 HydrophobicContact CE2-CB 4.22Å; A674-A678 VanDerWaalsContact O-CB 3.32Å; A674-A678 WeakPolarHBondContact O-CB 3.41Å; A674-A678 PolarHBondContact O-N 3.28Å; F675-A678 PolarHBondContact O-N 2.87Å; L676-A678 PolarHBondContact O-N 2.98Å; A678-S681 WeakPolarHBondContact CA-OG 3.31Å; A678-S681 PolarHBondContact O-N 3.43Å; A678-S681 PolarHBondContact O-OG 3.36Å; A678-V682 VanDerWaalsContact O-CG2 3.3Å; A678-V682 WeakPolarHBondContact O-CG2 3.44Å; A678-V682 PolarHBondContact O-N 3.14Å
679	A	94.4	Very high	90.6	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-61.5	-44.8	174.1	0	0	0	0	0	111.8	L653 F675 L676 K677 S681 V682 L683 F706 F710	L653-A679 VanDerWaalsContact CD2-O 3.31Å; L653-A679 WeakPolarHBondContact CD2-O 3.47Å; F675-A679 PolarHBondContact O-N 3.32Å; L676-A679 PolarHBondContact O-N 3.27Å; K677-A679 PolarHBondContact O-N 3.49Å; A679-S681 PolarHBondContact O-N 3.17Å; A679-V682 PolarHBondContact O-N 2.95Å; A679-L683 PolarHBondContact O-N 3.12Å; A679-F706 HydrophobicContact CB-CZ 4.44Å; A679-F710 HydrophobicContact CB-CE2 3.72Å; A679-F710 HydrophobicContact CB-CZ 4.46Å
680	V	92.7	Very high	90.2	Very high	11 Å²	11	37.1 Å²	37.1	7%	0.067	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-41.8	176.9	171.4	0	0	0	0	111.2	L676 K677 V682 L683 F710 L732 M735	L676-V680 WeakPolarHBondContact O-CG2 3.47Å; L676-V680 PolarHBondContact O-N 3.3Å; K677-V680 PolarHBondContact O-N 3Å; V680-V682 VanDerWaalsContact C-N 3.29Å; V680-V682 PolarHBondContact O-N 2.94Å; V680-L683 WeakPolarHBondContact O-CB 3.5Å; V680-L683 PolarHBondContact O-N 3.23Å; V680-F710 HydrophobicContact CG2-CE1 3.96Å; V680-F710 HydrophobicContact CG2-CZ 3.71Å; V680-L732 HydrophobicContact CG2-CB 4.4Å; V680-L732 HydrophobicContact CG2-CD1 4.31Å; V680-M735 HydrophobicContact CG1-CB 4.34Å; V680-M735 HydrophobicContact CG1-CG 3.57Å
681	S	91.9	Very high	89.4	Confident	72 Å²	72	37.4 Å²	37.4	50%	0.503	21%	0.213	S	C	.	.	H	α-helix	trans	-68.2	-25.4	-179.6	62.1	0	0	0	0	114.4	K677 A678 A679 P684	K677-S681 PolarHBondContact O-N 3.23Å; K677-S681 PolarHBondContact O-OG 3.12Å; A678-S681 WeakPolarHBondContact CA-OG 3.31Å; A678-S681 PolarHBondContact O-N 3.43Å; A678-S681 PolarHBondContact O-OG 3.36Å; A679-S681 PolarHBondContact O-N 3.17Å; S681-P684 WeakPolarHBondContact O-CD 3.42Å
682	V	91.5	Very high	88.4	Confident	5 Å²	5	37.2 Å²	37.2	3%	0.03	22%	0.215	C	C	.	.	H	α-helix	trans	-87	-17.6	-179.7	171.8	0	0	0	0	112	I649 R652 L653 Y656 A678 A679 V680 P684 E685	I649-V682 HydrophobicContact CG2-CG1 3.81Å; R652-V682 VanDerWaalsContact NH2-CG2 3.26Å; L653-V682 HydrophobicContact CD2-CB 4.22Å; L653-V682 HydrophobicContact CD2-CG1 4.14Å; L653-V682 HydrophobicContact CG-CG1 4.43Å; Y656-V682 HydrophobicContact CE2-CG2 4.18Å; A678-V682 VanDerWaalsContact O-CG2 3.3Å; A678-V682 WeakPolarHBondContact O-CG2 3.44Å; A678-V682 PolarHBondContact O-N 3.14Å; A679-V682 PolarHBondContact O-N 2.95Å; V680-V682 VanDerWaalsContact C-N 3.29Å; V680-V682 PolarHBondContact O-N 2.94Å; V682-P684 VanDerWaalsContact C-CD 3.48Å; V682-E685 WeakPolarHBondContact O-CB 3.47Å; V682-E685 PolarHBondContact O-N 3.13Å
683	L	90.2	Very high	87	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-55.3	-41.4	-177.4	-164.3	153.4	0	0	0	113.9	A679 V680 E685 V686 L703 I707 L732 M735	A679-L683 PolarHBondContact O-N 3.12Å; V680-L683 WeakPolarHBondContact O-CB 3.5Å; V680-L683 PolarHBondContact O-N 3.23Å; L683-E685 PolarHBondContact O-N 3.33Å; L683-V686 VanDerWaalsContact O-CG2 3.25Å; L683-V686 WeakPolarHBondContact O-CG2 3.45Å; L683-V686 PolarHBondContact O-N 3.13Å; L683-L703 HydrophobicContact CD1-CD1 4.47Å; L683-L703 HydrophobicContact CD2-CD1 4.43Å; L683-L703 HydrophobicContact CG-CD1 4.12Å; L683-I707 HydrophobicContact CD1-CD1 4.14Å; L683-I707 HydrophobicContact CD1-CG1 4.07Å; L683-L732 HydrophobicContact CD1-CD1 3.68Å; L683-M735 HydrophobicContact CD2-CB 4.47Å
684	P	87.6	Confident	85.9	Confident	53 Å²	53	47.3 Å²	47.3	34%	0.344	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-64.5	-20.5	176.4	-22.6	35.3	0	0	0	114.6	S681 V682 V686 M735	S681-P684 WeakPolarHBondContact O-CD 3.42Å; V682-P684 VanDerWaalsContact C-CD 3.48Å; P684-V686 VanDerWaalsContact C-N 3.26Å; P684-V686 PolarHBondContact O-N 3.07Å; P684-M735 HydrophobicContact CG-CB 4.3Å; P684-M735 HydrophobicContact CG-CG 4.37Å; P684-M735 HydrophobicContact CG-SD 3.56Å; P684-M735 VanDerWaalsContact CG-SD 3.56Å
685	E	88.1	Confident	84.9	Confident	108 Å²	108	52.7 Å²	52.7	51%	0.505	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-77	-10.9	-178.6	-57.3	-179.8	172.7	0	0	112.7	I649 R652 V682 L683	I649-E685 HydrophobicContact CD1-CB 4.25Å; I649-E685 WeakPolarHBondContact CD1-O 3.44Å; R652-E685 IonicContact CZ-OE2 3.73Å; R652-E685 IonicContact NH1-OE2 3.98Å; R652-E685 PolarHBondContact NH1-OE2 3.19Å; R652-E685 IonicContact NH2-OE2 2.65Å; V682-E685 WeakPolarHBondContact O-CB 3.47Å; V682-E685 PolarHBondContact O-N 3.13Å; L683-E685 PolarHBondContact O-N 3.33Å
686	V	87.8	Confident	84	Confident	7 Å²	7	58.9 Å²	58.9	4%	0.042	33%	0.33	C	S	.	.			trans	-60.1	127	-175	174.8	0	0	0	0	111	I649 F650 L653 L683 P684 L703 Y739	I649-V686 HydrophobicContact CG2-CG2 3.71Å; F650-V686 HydrophobicContact CE1-CG1 4.27Å; F650-V686 HydrophobicContact CE2-CG1 4.04Å; F650-V686 HydrophobicContact CZ-CG1 3.59Å; L653-V686 HydrophobicContact CD1-CG2 3.65Å; L683-V686 VanDerWaalsContact O-CG2 3.25Å; L683-V686 WeakPolarHBondContact O-CG2 3.45Å; L683-V686 PolarHBondContact O-N 3.13Å; P684-V686 VanDerWaalsContact C-N 3.26Å; P684-V686 PolarHBondContact O-N 3.07Å; V686-L703 HydrophobicContact CG2-CD1 4.37Å; V686-Y739 HydrophobicContact CB-CE2 3.89Å; V686-Y739 HydrophobicContact CG1-CE2 4.43Å; V686-Y739 WeakPolarHBondContact O-CE2 3.45Å; V686-Y739 PolarHBondContact O-OH 2.83Å
687	P	85.6	Confident	83.2	Confident	55 Å²	55	64.9 Å²	64.9	36%	0.357	35%	0.352	S	S	.	.			trans	-71	147.2	178.5	30.3	-35.5	0	0	0	110.6	S689 I690 S699	P687-S689 PolarHBondContact O-N 3.45Å; P687-I690 HydrophobicContact CG-CG2 4.15Å; P687-S699 WeakPolarHBondContact O-CB 3.47Å; P687-S699 PolarHBondContact O-OG 2.91Å
688	R	81.7	Confident	82.7	Confident	114 Å²	114	64 Å²	64	43%	0.43	35%	0.353	S	S	.	.	S	Bend	trans	-64.9	-36	179.5	-64.5	-174.7	-175.3	174.6	4.6	113.7	S699 T740	R688-S699 WeakPolarHBondContact O-CB 3.45Å; R688-S699 PolarHBondContact O-N 3.46Å; R688-S699 PolarHBondContact O-OG 2.99Å; R688-S699 VanDerWaalsContact O-OG 3.09Å; R688-T740 PolarHBondContact NE-O 3.36Å; R688-T740 PolarHBondContact NE-OG1 3.44Å; R688-T740 PolarHBondContact NH2-OG1 3.37Å
689	S	81.1	Confident	82.2	Confident	55 Å²	55	63.4 Å²	63.4	39%	0.385	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	145.4	179	57.7	0	0	0	0	111.3	P687 R697	P687-S689 PolarHBondContact O-N 3.45Å; S689-R697 CarbonylContact C-O 3.54Å; S689-R697 VanDerWaalsContact CA-O 3.24Å; S689-R697 WeakPolarHBondContact CA-O 3.3Å
690	I	80.8	Confident	81.8	Confident	35 Å²	35	64 Å²	64	18%	0.179	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	143	176.5	54.2	165	0	0	0	109.5	F650 P687 V692 L696 R697 F702	F650-I690 HydrophobicContact CD2-CG2 4.41Å; F650-I690 HydrophobicContact CE2-CG2 3.87Å; P687-I690 HydrophobicContact CG-CG2 4.15Å; I690-V692 HydrophobicContact CD1-CG2 3.7Å; I690-V692 HydrophobicContact CG1-CG2 3.95Å; I690-V692 PolarHBondContact O-N 3.11Å; I690-L696 WeakPolarHBondContact O-CA 3.31Å; I690-R697 PolarHBondContact N-O 3.12Å; I690-R697 PolarHBondContact O-N 3.17Å; I690-F702 HydrophobicContact CD1-CD2 3.66Å; I690-F702 HydrophobicContact CD1-CE2 3.51Å; I690-F702 HydrophobicContact CD1-CG 4.46Å; I690-F702 HydrophobicContact CD1-CZ 4.18Å
691	S	74	Confident	81.5	Confident	84 Å²	84	66.6 Å²	66.6	59%	0.587	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	109.5	173.3	-174.2	0	0	0	0	109.3	K695	S691-K695 WeakPolarHBondContact CA-O 3.4Å
692	V	72	Confident	81.2	Confident	43 Å²	43	67.3 Å²	67.3	26%	0.261	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	117.1	173.9	-178	0	0	0	0	107.2	I690 G694 K695 R697	I690-V692 HydrophobicContact CD1-CG2 3.7Å; I690-V692 HydrophobicContact CG1-CG2 3.95Å; I690-V692 PolarHBondContact O-N 3.11Å; V692-G694 PolarHBondContact O-N 2.69Å; V692-K695 PolarHBondContact N-O 3.04Å; V692-K695 PolarHBondContact O-N 2.84Å; V692-R697 HydrophobicContact CB-CG 4.43Å
693	E	65.4	Low	81.1	Confident	174 Å²	174	67.1 Å²	67.1	81%	0.813	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	35.5	-177.8	-57.2	172.2	158.8	0	0	113.2	K695 R697	E693-K695 VanDerWaalsContact C-N 3.25Å; E693-K695 PolarHBondContact O-N 2.98Å; E693-R697 IonicContact OE2-NH2 3.23Å
694	G	67.6	Low	81.1	Confident	70 Å²	70	68.6 Å²	68.6	72%	0.722	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	1.2	-179	0	0	0	0	0	115	V692	V692-G694 PolarHBondContact O-N 2.69Å
695	K	73.1	Confident	81.3	Confident	148 Å²	148	71 Å²	71	64%	0.643	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	132.3	173.5	-66.6	-179.1	-178.2	174.9	0	110.5	S691 V692 E693 R697	S691-K695 WeakPolarHBondContact CA-O 3.4Å; V692-K695 PolarHBondContact N-O 3.04Å; V692-K695 PolarHBondContact O-N 2.84Å; E693-K695 VanDerWaalsContact C-N 3.25Å; E693-K695 PolarHBondContact O-N 2.98Å; K695-R697 PolarHBondContact O-N 3.37Å
696	L	76.3	Confident	81.5	Confident	132 Å²	132	65.9 Å²	65.9	69%	0.691	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	117.4	170.8	-74.7	159.3	0	0	0	109.2	I690	I690-L696 WeakPolarHBondContact O-CA 3.31Å
697	R	79.3	Confident	81.8	Confident	126 Å²	126	65.6 Å²	65.6	48%	0.475	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	150.9	173.5	-61.4	-167.5	-172.4	-158.5	6.4	110	S689 I690 V692 E693 K695 S699	S689-R697 CarbonylContact C-O 3.54Å; S689-R697 VanDerWaalsContact CA-O 3.24Å; S689-R697 WeakPolarHBondContact CA-O 3.3Å; I690-R697 PolarHBondContact N-O 3.12Å; I690-R697 PolarHBondContact O-N 3.17Å; V692-R697 HydrophobicContact CB-CG 4.43Å; E693-R697 IonicContact OE2-NH2 3.23Å; K695-R697 PolarHBondContact O-N 3.37Å; R697-S699 PolarHBondContact O-N 3.44Å
698	S	82.3	Confident	82.1	Confident	39 Å²	39	65.3 Å²	65.3	27%	0.273	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	132.8	174.3	178.9	0	0	0	0	110.7	E700 E742	S698-E700 VanDerWaalsContact C-N 3.28Å; S698-E700 WeakPolarHBondContact OG-CG 3.42Å; S698-E700 PolarHBondContact OG-N 3.38Å; S698-E742 VanDerWaalsContact CB-OE2 3.28Å; S698-E742 WeakPolarHBondContact CB-OE2 3.32Å; S698-E742 PolarHBondContact OG-OE1 2.98Å; S698-E742 PolarHBondContact OG-OE2 3.39Å
699	S	83.5	Confident	82.6	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	35%	0.349	C	S	.	.	S	Bend	trans	-81.5	-10.2	-179.4	74.8	0	0	0	0	113.1	P687 R688 R697 S701 F702 L703	P687-S699 WeakPolarHBondContact O-CB 3.47Å; P687-S699 PolarHBondContact O-OG 2.91Å; R688-S699 WeakPolarHBondContact O-CB 3.45Å; R688-S699 PolarHBondContact O-N 3.46Å; R688-S699 PolarHBondContact O-OG 2.99Å; R688-S699 VanDerWaalsContact O-OG 3.09Å; R697-S699 PolarHBondContact O-N 3.44Å; S699-S701 VanDerWaalsContact C-N 3.27Å; S699-S701 PolarHBondContact O-N 3.11Å; S699-F702 PolarHBondContact O-N 3.24Å; S699-L703 PolarHBondContact O-N 3.37Å
700	E	85.4	Confident	83.2	Confident	14 Å²	14	60.9 Å²	60.9	7%	0.065	33%	0.331	C	S	.	.	H	α-helix	trans	-62.3	-32.3	-172.8	-65.5	-174.4	154.2	0	0	113.3	S698 L703 L704 W741 E742 S745 A747	S698-E700 VanDerWaalsContact C-N 3.28Å; S698-E700 WeakPolarHBondContact OG-CG 3.42Å; S698-E700 PolarHBondContact OG-N 3.38Å; E700-L703 PolarHBondContact O-N 3.13Å; E700-L704 VanDerWaalsContact O-CB 3.24Å; E700-L704 WeakPolarHBondContact O-CB 3.46Å; E700-L704 PolarHBondContact O-N 3.24Å; E700-W741 HydrophobicContact CB-CZ3 4.49Å; E700-W741 HydrophobicContact CG-CE3 4.2Å; E700-W741 HydrophobicContact CG-CZ3 4.25Å; E700-E742 WeakPolarHBondContact OE1-CB 3.49Å; E700-E742 PolarHBondContact OE1-N 3.44Å; E700-S745 VanDerWaalsContact CD-OG 3.27Å; E700-S745 WeakPolarHBondContact OE1-CB 3.41Å; E700-S745 PolarHBondContact OE1-OG 3.31Å; E700-S745 WeakPolarHBondContact OE2-CB 3.48Å; E700-S745 PolarHBondContact OE2-OG 2.92Å; E700-A747 HydrophobicContact CB-CB 4Å; E700-A747 HydrophobicContact CG-CB 4.44Å
701	S	86.2	Confident	83.8	Confident	65 Å²	65	59.4 Å²	59.4	46%	0.455	32%	0.323	S	S	.	.	H	α-helix	trans	-62.1	-49.4	175.9	52.8	0	0	0	0	111.8	S699 L703 L704 D705	S699-S701 VanDerWaalsContact C-N 3.27Å; S699-S701 PolarHBondContact O-N 3.11Å; S701-L703 VanDerWaalsContact C-N 3.33Å; S701-L703 PolarHBondContact O-N 3.46Å; S701-L704 PolarHBondContact O-N 2.85Å; S701-D705 PolarHBondContact O-N 3.47Å
702	F	86.6	Confident	84.5	Confident	87 Å²	87	57.7 Å²	57.7	38%	0.382	31%	0.314	S	S	.	.	H	α-helix	trans	-63.8	-38.7	176.4	-62.3	-84.4	0	0	0	112.1	F650 I690 S699 F706	F650-F702 HydrophobicContact CD1-CB 4.12Å; F650-F702 HydrophobicContact CE1-CB 3.54Å; F650-F702 HydrophobicContact CZ-CB 3.91Å; I690-F702 HydrophobicContact CD1-CD2 3.66Å; I690-F702 HydrophobicContact CD1-CE2 3.51Å; I690-F702 HydrophobicContact CD1-CG 4.46Å; I690-F702 HydrophobicContact CD1-CZ 4.18Å; S699-F702 PolarHBondContact O-N 3.24Å; F702-F706 WeakPolarHBondContact O-CB 3.39Å; F702-F706 PolarHBondContact O-N 3Å
703	L	89.6	Confident	85.4	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-65.7	-41	176.5	-178.6	58.4	0	0	0	111.5	L683 V686 S699 E700 S701 F706 I707 Y739 W741	L683-L703 HydrophobicContact CD1-CD1 4.47Å; L683-L703 HydrophobicContact CD2-CD1 4.43Å; L683-L703 HydrophobicContact CG-CD1 4.12Å; V686-L703 HydrophobicContact CG2-CD1 4.37Å; S699-L703 PolarHBondContact O-N 3.37Å; E700-L703 PolarHBondContact O-N 3.13Å; S701-L703 VanDerWaalsContact C-N 3.33Å; S701-L703 PolarHBondContact O-N 3.46Å; L703-F706 PolarHBondContact O-N 2.78Å; L703-I707 HydrophobicContact CD1-CD1 3.81Å; L703-I707 HydrophobicContact CD1-CG1 4.1Å; L703-I707 HydrophobicContact CD2-CD1 4.43Å; L703-I707 HydrophobicContact CG-CD1 3.74Å; L703-I707 HydrophobicContact CG-CG1 4.42Å; L703-I707 WeakPolarHBondContact O-CB 3.15Å; L703-I707 VanDerWaalsContact O-CG1 3.26Å; L703-I707 WeakPolarHBondContact O-CG1 3.48Å; L703-I707 PolarHBondContact O-N 3.46Å; L703-Y739 HydrophobicContact CD2-CD1 4.25Å; L703-Y739 HydrophobicContact CD2-CE1 3.9Å; L703-Y739 HydrophobicContact CD2-CE2 4.3Å; L703-W741 HydrophobicContact CD2-CH2 3.84Å; L703-W741 HydrophobicContact CD2-CZ3 4.26Å
704	L	89.9	Confident	86.6	Confident	31 Å²	31	48 Å²	48	16%	0.162	27%	0.266	C	S	.	.	H	α-helix	trans	-63.1	-44	177.4	-178	143.7	0	0	0	111.5	E700 S701 I707 N708 R750	E700-L704 VanDerWaalsContact O-CB 3.24Å; E700-L704 WeakPolarHBondContact O-CB 3.46Å; E700-L704 PolarHBondContact O-N 3.24Å; S701-L704 PolarHBondContact O-N 2.85Å; L704-I707 PolarHBondContact O-N 2.9Å; L704-N708 WeakPolarHBondContact CD2-ND2 3.13Å; L704-N708 WeakPolarHBondContact O-CB 3.46Å; L704-N708 PolarHBondContact O-N 3.45Å; L704-N708 PolarHBondContact O-ND2 3.32Å; L704-N708 VanDerWaalsContact O-ND2 3.1Å; L704-R750 HydrophobicContact CD1-CB 3.69Å
705	D	90.4	Very high	87.7	Confident	104 Å²	104	45.2 Å²	45.2	56%	0.556	24%	0.235	S	C	*	.	H	α-helix	trans	-62.2	-44.4	176.2	-71	-20.5	0	0	0	111.8	S701 N708 N709	S701-D705 PolarHBondContact O-N 3.47Å; D705-N708 PolarHBondContact O-N 2.99Å; D705-N709 PolarHBondContact O-N 3.06Å; D705-N709 VanDerWaalsContact O-N 3.13Å
706	F	93.3	Very high	88.4	Confident	1 Å²	1	38.4 Å²	38.4	0%	0.004	21%	0.205	C	C	.	.	H	α-helix	trans	-59.9	-49.2	175.2	172.3	-99.7	0	0	0	111.9	L653 L657 A679 F702 L703 N708 N709 F710	L653-F706 VanDerWaalsContact C-CE2 3.44Å; L653-F706 HydrophobicContact CB-CD1 4.47Å; L653-F706 HydrophobicContact CB-CD2 4.07Å; L653-F706 HydrophobicContact CB-CE1 4.16Å; L653-F706 HydrophobicContact CB-CE2 3.73Å; L653-F706 HydrophobicContact CB-CG 4.44Å; L653-F706 HydrophobicContact CB-CZ 3.77Å; L653-F706 HydrophobicContact CD1-CD1 4.32Å; L653-F706 HydrophobicContact CD1-CE1 4.36Å; L653-F706 HydrophobicContact CD2-CE1 3.95Å; L653-F706 HydrophobicContact CD2-CZ 4Å; L653-F706 HydrophobicContact CG-CE1 4.39Å; L653-F706 HydrophobicContact CG-CZ 4.38Å; L653-F706 VanDerWaalsContact O-CE2 3.24Å; L653-F706 WeakPolarHBondContact O-CE2 3.35Å; L657-F706 HydrophobicContact CB-CE2 3.84Å; L657-F706 HydrophobicContact CB-CZ 4.4Å; L657-F706 HydrophobicContact CD2-CD2 4.24Å; L657-F706 HydrophobicContact CD2-CE2 3.81Å; L657-F706 HydrophobicContact CG-CE2 4.47Å; A679-F706 HydrophobicContact CB-CZ 4.44Å; F702-F706 WeakPolarHBondContact O-CB 3.39Å; F702-F706 PolarHBondContact O-N 3Å; L703-F706 PolarHBondContact O-N 2.78Å; F706-N708 VanDerWaalsContact C-N 3.34Å; F706-N708 PolarHBondContact O-N 3.34Å; F706-N709 PolarHBondContact O-N 3.49Å; F706-F710 HydrophobicContact CE1-CB 4.48Å; F706-F710 HydrophobicContact CE1-CD2 4.13Å; F706-F710 HydrophobicContact CE2-CD2 4.47Å; F706-F710 AromaticContact CZ-CD2 3.72Å; F706-F710 HydrophobicContact CZ-CD2 3.72Å; F706-F710 HydrophobicContact CZ-CE2 4.42Å; F706-F710 WeakPolarHBondContact O-CB 3.15Å; F706-F710 PolarHBondContact O-N 3.36Å
707	I	93	Very high	89	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.7	-39.5	-178.2	-69.8	168.5	0	0	0	110.9	L683 L703 L704 N709 F710 L711 L732 V736 I751	L683-I707 HydrophobicContact CD1-CD1 4.14Å; L683-I707 HydrophobicContact CD1-CG1 4.07Å; L703-I707 HydrophobicContact CD1-CD1 3.81Å; L703-I707 HydrophobicContact CD1-CG1 4.1Å; L703-I707 HydrophobicContact CD2-CD1 4.43Å; L703-I707 HydrophobicContact CG-CD1 3.74Å; L703-I707 HydrophobicContact CG-CG1 4.42Å; L703-I707 WeakPolarHBondContact O-CB 3.15Å; L703-I707 VanDerWaalsContact O-CG1 3.26Å; L703-I707 WeakPolarHBondContact O-CG1 3.48Å; L703-I707 PolarHBondContact O-N 3.46Å; L704-I707 PolarHBondContact O-N 2.9Å; I707-N709 VanDerWaalsContact C-N 3.32Å; I707-N709 PolarHBondContact O-N 3.2Å; I707-F710 WeakPolarHBondContact O-CB 3.17Å; I707-F710 PolarHBondContact O-N 3.41Å; I707-L711 HydrophobicContact CG2-CD1 3.93Å; I707-L711 HydrophobicContact CG2-CG 4.11Å; I707-L711 WeakPolarHBondContact O-CB 3.38Å; I707-L711 VanDerWaalsContact O-CG 3.28Å; I707-L711 WeakPolarHBondContact O-CG 3.36Å; I707-L711 PolarHBondContact O-N 3.34Å; I707-L732 HydrophobicContact CG2-CD2 4.38Å; I707-V736 HydrophobicContact CD1-CG2 3.86Å; I707-I751 HydrophobicContact CD1-CD1 3.52Å; I707-I751 HydrophobicContact CD1-CG1 4.23Å; I707-I751 HydrophobicContact CG2-CG1 4.19Å; I707-I751 HydrophobicContact CG2-CG2 3.69Å
708	N	92	Very high	89.3	Confident	49 Å²	49	27.8 Å²	27.8	26%	0.262	16%	0.161	S	C	.	.	H	α-helix	trans	-60.9	-42.3	176	-72.2	-32.3	0	0	0	111.6	L704 D705 F706 A712 S754	L704-N708 WeakPolarHBondContact CD2-ND2 3.13Å; L704-N708 WeakPolarHBondContact O-CB 3.46Å; L704-N708 PolarHBondContact O-N 3.45Å; L704-N708 PolarHBondContact O-ND2 3.32Å; L704-N708 VanDerWaalsContact O-ND2 3.1Å; D705-N708 PolarHBondContact O-N 2.99Å; F706-N708 VanDerWaalsContact C-N 3.34Å; F706-N708 PolarHBondContact O-N 3.34Å; N708-A712 PolarHBondContact O-N 3.18Å; N708-S754 WeakPolarHBondContact OD1-CB 3.36Å; N708-S754 PolarHBondContact OD1-OG 2.9Å
709	N	93.1	Very high	89.5	Confident	76 Å²	76	26.7 Å²	26.7	41%	0.406	15%	0.152	S	C	.	.	H	α-helix	trans	-67.1	-38.3	174.6	-171.4	12.3	0	0	0	112.2	L657 D705 F706 I707 A712 T713	L657-N709 HydrophobicContact CD2-CB 4.19Å; D705-N709 PolarHBondContact O-N 3.06Å; D705-N709 VanDerWaalsContact O-N 3.13Å; F706-N709 PolarHBondContact O-N 3.49Å; I707-N709 VanDerWaalsContact C-N 3.32Å; I707-N709 PolarHBondContact O-N 3.2Å; N709-A712 PolarHBondContact O-N 2.99Å; N709-T713 PolarHBondContact O-N 2.92Å; N709-T713 PolarHBondContact O-OG1 2.99Å
710	F	93.9	Very high	89.3	Confident	1 Å²	1	29.3 Å²	29.3	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-63.5	-47.7	176.1	-162.4	-81.4	0	0	0	111.2	L657 L676 A679 V680 F706 I707 A712 T713 L714 L732	L657-F710 HydrophobicContact CD1-CD2 3.71Å; L657-F710 HydrophobicContact CD1-CE2 4.17Å; L657-F710 HydrophobicContact CD1-CG 4.39Å; L657-F710 HydrophobicContact CD2-CB 4.37Å; L657-F710 HydrophobicContact CD2-CD2 4.32Å; L657-F710 HydrophobicContact CG-CD2 4.4Å; L676-F710 HydrophobicContact CB-CZ 4.05Å; L676-F710 HydrophobicContact CD2-CE2 3.66Å; L676-F710 HydrophobicContact CD2-CZ 3.75Å; L676-F710 HydrophobicContact CG-CZ 4.47Å; A679-F710 HydrophobicContact CB-CE2 3.72Å; A679-F710 HydrophobicContact CB-CZ 4.46Å; V680-F710 HydrophobicContact CG2-CE1 3.96Å; V680-F710 HydrophobicContact CG2-CZ 3.71Å; F706-F710 HydrophobicContact CE1-CB 4.48Å; F706-F710 HydrophobicContact CE1-CD2 4.13Å; F706-F710 HydrophobicContact CE2-CD2 4.47Å; F706-F710 AromaticContact CZ-CD2 3.72Å; F706-F710 HydrophobicContact CZ-CD2 3.72Å; F706-F710 HydrophobicContact CZ-CE2 4.42Å; F706-F710 WeakPolarHBondContact O-CB 3.15Å; F706-F710 PolarHBondContact O-N 3.36Å; I707-F710 WeakPolarHBondContact O-CB 3.17Å; I707-F710 PolarHBondContact O-N 3.41Å; F710-A712 VanDerWaalsContact C-N 3.33Å; F710-A712 PolarHBondContact O-N 2.88Å; F710-T713 WeakPolarHBondContact O-CB 3.37Å; F710-T713 PolarHBondContact O-N 3.47Å; F710-T713 VanDerWaalsContact O-N 3.11Å; F710-L714 HydrophobicContact CD1-CD1 3.82Å; F710-L714 HydrophobicContact CD1-CD2 4.31Å; F710-L714 HydrophobicContact CD1-CG 3.87Å; F710-L714 HydrophobicContact CE1-CD1 3.8Å; F710-L714 HydrophobicContact CE1-CD2 3.77Å; F710-L714 HydrophobicContact CE1-CG 3.83Å; F710-L714 WeakPolarHBondContact O-CG 3.49Å; F710-L714 PolarHBondContact O-N 3.47Å; F710-L732 HydrophobicContact CD1-CD1 4.09Å; F710-L732 HydrophobicContact CD1-CD2 3.73Å; F710-L732 HydrophobicContact CD1-CG 4.45Å; F710-L732 HydrophobicContact CE1-CD1 4.29Å; F710-L732 HydrophobicContact CE1-CD2 4.28Å
711	L	92.1	Very high	88.7	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-56.6	-46	174.8	-74.6	171	0	0	0	111.1	I707 T713 L714 L732 A755 L758	I707-L711 HydrophobicContact CG2-CD1 3.93Å; I707-L711 HydrophobicContact CG2-CG 4.11Å; I707-L711 WeakPolarHBondContact O-CB 3.38Å; I707-L711 VanDerWaalsContact O-CG 3.28Å; I707-L711 WeakPolarHBondContact O-CG 3.36Å; I707-L711 PolarHBondContact O-N 3.34Å; L711-T713 VanDerWaalsContact C-N 3.3Å; L711-T713 PolarHBondContact O-N 3.42Å; L711-L714 PolarHBondContact O-N 2.87Å; L711-L732 HydrophobicContact CD2-CD2 3.62Å; L711-L732 HydrophobicContact CG-CD2 4.01Å; L711-A755 HydrophobicContact CD1-CB 4.25Å; L711-A755 HydrophobicContact CD2-CB 4.25Å; L711-L758 HydrophobicContact CB-CD2 4.12Å; L711-L758 HydrophobicContact CD2-CD2 3.61Å; L711-L758 HydrophobicContact CG-CD2 4.49Å; L711-L758 VanDerWaalsContact O-CD1 3.24Å; L711-L758 WeakPolarHBondContact O-CD1 3.28Å; L711-L758 WeakPolarHBondContact O-CD2 3.45Å
712	A	90.3	Very high	88.3	Confident	47 Å²	47	39.4 Å²	39.4	39%	0.388	22%	0.215	S	C	.	.	H	α-helix	trans	-56.9	-46.3	175.8	0	0	0	0	0	111.1	N708 N709 F710 L714 L715 Y769	N708-A712 PolarHBondContact O-N 3.18Å; N709-A712 PolarHBondContact O-N 2.99Å; F710-A712 VanDerWaalsContact C-N 3.33Å; F710-A712 PolarHBondContact O-N 2.88Å; A712-L714 VanDerWaalsContact C-N 3.31Å; A712-L714 PolarHBondContact O-N 2.96Å; A712-L715 WeakPolarHBondContact O-CB 3.22Å; A712-L715 PolarHBondContact O-N 3.2Å; A712-Y769 PolarHBondContact O-OH 3.35Å
713	T	90.8	Very high	87.8	Confident	9 Å²	9	39.7 Å²	39.7	6%	0.055	22%	0.217	C	C	.	.	H	α-helix	trans	-62	-36.9	179.6	-55.2	0	0	0	0	112.6	L657 Q661 L664 N709 F710 L711 L715 V716 V717	L657-T713 HydrophobicContact CD1-CG2 4.06Å; Q661-T713 HydrophobicContact CG-CG2 3.72Å; Q661-T713 PolarHBondContact NE2-OG1 3Å; L664-T713 HydrophobicContact CD1-CG2 4.39Å; N709-T713 PolarHBondContact O-N 2.92Å; N709-T713 PolarHBondContact O-OG1 2.99Å; F710-T713 WeakPolarHBondContact O-CB 3.37Å; F710-T713 PolarHBondContact O-N 3.47Å; F710-T713 VanDerWaalsContact O-N 3.11Å; L711-T713 VanDerWaalsContact C-N 3.3Å; L711-T713 PolarHBondContact O-N 3.42Å; T713-L715 PolarHBondContact O-N 3.25Å; T713-L715 VanDerWaalsContact O-N 3.14Å; T713-V716 VanDerWaalsContact O-CG2 3.3Å; T713-V716 WeakPolarHBondContact O-CG2 3.39Å; T713-V716 PolarHBondContact O-N 3.23Å; T713-V717 WeakPolarHBondContact O-CG2 3.38Å
714	L	91	Very high	87.3	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-62.2	-19.9	-178.6	-71.7	179.9	0	0	0	114.1	F710 L711 A712 V716 V717 L728 V729 L732 L758 M762	F710-L714 HydrophobicContact CD1-CD1 3.82Å; F710-L714 HydrophobicContact CD1-CD2 4.31Å; F710-L714 HydrophobicContact CD1-CG 3.87Å; F710-L714 HydrophobicContact CE1-CD1 3.8Å; F710-L714 HydrophobicContact CE1-CD2 3.77Å; F710-L714 HydrophobicContact CE1-CG 3.83Å; F710-L714 WeakPolarHBondContact O-CG 3.49Å; F710-L714 PolarHBondContact O-N 3.47Å; L711-L714 PolarHBondContact O-N 2.87Å; A712-L714 VanDerWaalsContact C-N 3.31Å; A712-L714 PolarHBondContact O-N 2.96Å; L714-V716 VanDerWaalsContact C-N 3.29Å; L714-V716 PolarHBondContact O-N 2.71Å; L714-V717 HydrophobicContact CD2-CG2 4.44Å; L714-V717 PolarHBondContact O-N 2.69Å; L714-L728 HydrophobicContact CD2-CB 3.8Å; L714-L728 HydrophobicContact CD2-CD1 4.11Å; L714-V729 HydrophobicContact CB-CG2 4.41Å; L714-V729 HydrophobicContact CD1-CG2 3.91Å; L714-L732 HydrophobicContact CD1-CD2 4.05Å; L714-L758 HydrophobicContact CB-CD2 4.21Å; L714-M762 HydrophobicContact CB-CE 4.46Å; L714-M762 VanDerWaalsContact O-CE 3.25Å; L714-M762 WeakPolarHBondContact O-CE 3.42Å
715	L	89.4	Confident	87.1	Confident	12 Å²	12	41.8 Å²	41.8	6%	0.063	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-41.6	178.4	-178.3	62.6	0	0	0	112.2	A712 T713 L758 A761 M762 Y767 Y769	A712-L715 WeakPolarHBondContact O-CB 3.22Å; A712-L715 PolarHBondContact O-N 3.2Å; T713-L715 PolarHBondContact O-N 3.25Å; T713-L715 VanDerWaalsContact O-N 3.14Å; L715-L758 HydrophobicContact CB-CD1 3.73Å; L715-L758 HydrophobicContact CD1-CD1 4.2Å; L715-A761 HydrophobicContact CD1-CB 3.79Å; L715-A761 HydrophobicContact CD2-CB 4.19Å; L715-M762 HydrophobicContact CD1-CG 3.74Å; L715-Y767 HydrophobicContact CD1-CD1 4.18Å; L715-Y767 HydrophobicContact CD1-CD2 3.91Å; L715-Y767 HydrophobicContact CD1-CE1 4.17Å; L715-Y767 HydrophobicContact CD1-CE2 3.86Å; L715-Y767 HydrophobicContact CD1-CG 4.08Å; L715-Y767 HydrophobicContact CG-CD2 3.95Å; L715-Y767 HydrophobicContact CG-CE2 4.25Å; L715-Y767 HydrophobicContact CG-CG 4.26Å; L715-Y767 WeakPolarHBondContact O-CE2 3.48Å; L715-Y769 HydrophobicContact CD2-CD1 4.43Å; L715-Y769 HydrophobicContact CD2-CE1 3.77Å
716	V	88	Confident	86.8	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.03	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-3.2	-175.6	-67.6	0	0	0	0	113.5	T713 L714 Y769 I771 S776	T713-V716 VanDerWaalsContact O-CG2 3.3Å; T713-V716 WeakPolarHBondContact O-CG2 3.39Å; T713-V716 PolarHBondContact O-N 3.23Å; L714-V716 VanDerWaalsContact C-N 3.29Å; L714-V716 PolarHBondContact O-N 2.71Å; V716-Y769 HydrophobicContact CB-CE2 4.36Å; V716-Y769 HydrophobicContact CG1-CD2 3.59Å; V716-Y769 HydrophobicContact CG1-CE2 3.29Å; V716-Y769 WeakPolarHBondContact CG1-O 3.29Å; V716-Y769 HydrophobicContact CG2-CE2 4.14Å; V716-I771 HydrophobicContact CB-CD1 4.22Å; V716-I771 HydrophobicContact CB-CG1 4.24Å; V716-I771 HydrophobicContact CG2-CD1 3.7Å; V716-I771 HydrophobicContact CG2-CG1 4.12Å; V716-S776 WeakPolarHBondContact CA-OG 3.07Å; V716-S776 PolarHBondContact O-OG 3.28Å
717	V	88.4	Confident	86.6	Confident	8 Å²	8	41 Å²	41	5%	0.048	23%	0.229	C	C	.	.	S	Bend	trans	-81.1	124.8	-178.9	178.5	0	0	0	0	109.4	L664 L676 T713 L714 L728	L664-V717 HydrophobicContact CD1-CG2 3.7Å; L676-V717 HydrophobicContact CD1-CG1 3.98Å; L676-V717 HydrophobicContact CD1-CG2 3.7Å; T713-V717 WeakPolarHBondContact O-CG2 3.38Å; L714-V717 HydrophobicContact CD2-CG2 4.44Å; L714-V717 PolarHBondContact O-N 2.69Å; V717-L728 HydrophobicContact CG1-CD1 3.72Å
718	P	86.4	Confident	86.4	Confident	27 Å²	27	41.6 Å²	41.6	18%	0.175	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-67	140.8	174.1	23.9	-30.4	0	0	0	111.6	L669 V774 D775 N777 L780	L669-P718 HydrophobicContact CD1-CG 4.37Å; L669-P718 HydrophobicContact CD2-CG 4.06Å; P718-V774 HydrophobicContact CG-CG1 4.35Å; P718-D775 WeakPolarHBondContact CB-O 3.45Å; P718-N777 WeakPolarHBondContact CA-OD1 3.4Å; P718-L780 HydrophobicContact CB-CD1 3.85Å
719	D	85.6	Confident	86.3	Confident	17 Å²	17	39.5 Å²	39.5	9%	0.091	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-66.5	147.1	170.4	-83.6	-24.1	0	0	0	111.7	V725 L726 N777 Y781	D719-V725 WeakPolarHBondContact OD2-CA 3.47Å; D719-L726 VanDerWaalsContact CG-N 3.27Å; D719-L726 PolarHBondContact OD1-N 3.33Å; D719-L726 PolarHBondContact OD2-N 3.4Å; D719-N777 PolarHBondContact N-OD1 3.32Å; D719-N777 PolarHBondContact OD2-ND2 3.42Å; D719-Y781 HydrophobicContact CB-CE2 3.98Å; D719-Y781 VanDerWaalsContact CB-OH 3.31Å; D719-Y781 WeakPolarHBondContact CB-OH 3.44Å; D719-Y781 WeakPolarHBondContact OD2-CE2 3.43Å
720	H	79.3	Confident	86.2	Confident	54 Å²	54	39.8 Å²	39.8	25%	0.25	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-75.1	128.6	-179.6	-166	-79.4	0	0	0	110.4	E722 H723	H720-E722 IonicContact CE1-OE2 2.63Å; H720-E722 PolarHBondContact ND1-N 3.26Å; H720-E722 PolarHBondContact O-N 3.21Å; H720-H723 HydrophobicContact CB-CB 4.18Å; H720-H723 AromaticContact CD2-CD2 4Å; H720-H723 AromaticContact CE1-CD2 3.7Å; H720-H723 AromaticContact CG-CD2 3.55Å; H720-H723 AromaticContact ND1-CD2 3.34Å; H720-H723 PolarHBondContact ND1-CD2 3.41Å; H720-H723 VanDerWaalsContact ND1-CD2 3.34Å; H720-H723 PolarHBondContact O-N 2.93Å
721	P	74.1	Confident	86	Confident	127 Å²	127	40.6 Å²	40.6	83%	0.825	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-33.3	-176.4	-27.5	34.2	0	0	0	114.4
722	E	76.4	Confident	86	Confident	164 Å²	164	40.5 Å²	40.5	77%	0.766	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-20	-173.5	-56.6	-178.1	162.8	0	0	115.1	H720	H720-E722 IonicContact CE1-OE2 2.63Å; H720-E722 PolarHBondContact ND1-N 3.26Å; H720-E722 PolarHBondContact O-N 3.21Å
723	H	76.9	Confident	86.1	Confident	94 Å²	94	38.7 Å²	38.7	44%	0.435	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	6.2	-171.7	-67.4	-59.7	0	0	0	114.1	H720 Y727	H720-H723 HydrophobicContact CB-CB 4.18Å; H720-H723 AromaticContact CD2-CD2 4Å; H720-H723 AromaticContact CE1-CD2 3.7Å; H720-H723 AromaticContact CG-CD2 3.55Å; H720-H723 AromaticContact ND1-CD2 3.34Å; H720-H723 PolarHBondContact ND1-CD2 3.41Å; H720-H723 VanDerWaalsContact ND1-CD2 3.34Å; H720-H723 PolarHBondContact O-N 2.93Å; H723-Y727 HydrophobicContact CB-CD1 4.34Å; H723-Y727 HydrophobicContact CB-CD2 3.6Å; H723-Y727 HydrophobicContact CB-CE2 4.03Å; H723-Y727 HydrophobicContact CB-CG 3.75Å
724	G	79.1	Confident	86.1	Confident	40 Å²	40	42.3 Å²	42.3	41%	0.412	23%	0.227	S	C	.	.			trans	79.4	172	-178.6	0	0	0	0	0	113.4
725	V	85	Confident	86.1	Confident	34 Å²	34	44.8 Å²	44.8	21%	0.206	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	144.4	-177.9	-92.2	0	0	0	0	112.5	D719 Y727 Y781 F787 E790	D719-V725 WeakPolarHBondContact OD2-CA 3.47Å; V725-Y727 PolarHBondContact O-N 3.45Å; V725-Y781 HydrophobicContact CG1-CD1 4.25Å; V725-Y781 HydrophobicContact CG1-CD2 4.36Å; V725-Y781 HydrophobicContact CG1-CE1 3.55Å; V725-Y781 HydrophobicContact CG1-CE2 3.68Å; V725-Y781 VanDerWaalsContact CG1-OH 3.31Å; V725-Y781 WeakPolarHBondContact CG1-OH 3.36Å; V725-F787 HydrophobicContact CB-CD2 3.91Å; V725-F787 HydrophobicContact CB-CE2 4.07Å; V725-F787 HydrophobicContact CG1-CD2 3.46Å; V725-F787 VanDerWaalsContact CG1-CD2 3.46Å; V725-F787 HydrophobicContact CG1-CE2 3.76Å; V725-E790 HydrophobicContact CG2-CG 4.24Å
726	L	84.9	Confident	86.1	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	29.8	177.9	-55.2	172.2	0	0	0	113.7	D719 L728 V729 R730 M762 F787 I791 L794	D719-L726 VanDerWaalsContact CG-N 3.27Å; D719-L726 PolarHBondContact OD1-N 3.33Å; D719-L726 PolarHBondContact OD2-N 3.4Å; L726-L728 PolarHBondContact O-N 2.87Å; L726-V729 HydrophobicContact CB-CB 4.3Å; L726-V729 HydrophobicContact CD2-CG2 4.41Å; L726-V729 PolarHBondContact O-N 3.06Å; L726-R730 WeakPolarHBondContact O-CB 3.4Å; L726-R730 VanDerWaalsContact O-CG 3.29Å; L726-R730 WeakPolarHBondContact O-CG 3.3Å; L726-R730 PolarHBondContact O-N 3.26Å; L726-M762 HydrophobicContact CD2-CE 4.49Å; L726-M762 HydrophobicContact CD2-SD 3.58Å; L726-M762 VanDerWaalsContact CD2-SD 3.58Å; L726-F787 HydrophobicContact CD1-CE2 4.38Å; L726-F787 HydrophobicContact CD2-CE2 3.79Å; L726-F787 HydrophobicContact CD2-CZ 3.94Å; L726-F787 HydrophobicContact CG-CE2 3.86Å; L726-F787 HydrophobicContact CG-CZ 4.49Å; L726-I791 HydrophobicContact CD1-CG1 3.8Å; L726-L794 HydrophobicContact CB-CD1 4.27Å; L726-L794 HydrophobicContact CD1-CD1 3.48Å; L726-L794 VanDerWaalsContact CD1-CD1 3.48Å
727	Y	88.5	Confident	86	Confident	89 Å²	89	48.3 Å²	48.3	35%	0.349	26%	0.255	S	S	.	.	H	α-helix	trans	-56.6	-49.8	-173.9	172.5	-97.9	0	0	0	112.7	K677 H723 V725 R730 G731	K677-Y727 VanDerWaalsContact CE-CE1 3.46Å; H723-Y727 HydrophobicContact CB-CD1 4.34Å; H723-Y727 HydrophobicContact CB-CD2 3.6Å; H723-Y727 HydrophobicContact CB-CE2 4.03Å; H723-Y727 HydrophobicContact CB-CG 3.75Å; V725-Y727 PolarHBondContact O-N 3.45Å; Y727-R730 PolarHBondContact O-N 3.23Å; Y727-G731 PolarHBondContact O-N 3.18Å
728	L	88.4	Confident	85.9	Confident	13 Å²	13	53.1 Å²	53.1	7%	0.068	28%	0.281	C	S	.	.	H	α-helix	trans	-70	-35.8	-179.4	-70.4	174	0	0	0	112.5	L676 K677 L714 V717 L726 G731 L732	L676-L728 HydrophobicContact CB-CD1 4.26Å; L676-L728 HydrophobicContact CB-CD2 4.49Å; L676-L728 HydrophobicContact CD1-CD1 4.01Å; K677-L728 HydrophobicContact CG-CD2 3.86Å; L714-L728 HydrophobicContact CD2-CB 3.8Å; L714-L728 HydrophobicContact CD2-CD1 4.11Å; V717-L728 HydrophobicContact CG1-CD1 3.72Å; L726-L728 PolarHBondContact O-N 2.87Å; L728-G731 PolarHBondContact O-N 2.77Å; L728-L732 WeakPolarHBondContact O-CB 3.5Å; L728-L732 PolarHBondContact O-N 3.07Å
729	V	90.4	Very high	85.9	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.024	27%	0.274	C	S	.	.	H	α-helix	trans	-63.7	-46.2	175.4	178.6	0	0	0	0	110	L714 L726 L732 L733 L758 L759 M762	L714-V729 HydrophobicContact CB-CG2 4.41Å; L714-V729 HydrophobicContact CD1-CG2 3.91Å; L726-V729 HydrophobicContact CB-CB 4.3Å; L726-V729 HydrophobicContact CD2-CG2 4.41Å; L726-V729 PolarHBondContact O-N 3.06Å; V729-L732 PolarHBondContact O-N 3.2Å; V729-L733 HydrophobicContact CG1-CD1 4.07Å; V729-L733 VanDerWaalsContact O-CG 3.31Å; V729-L733 WeakPolarHBondContact O-CG 2.91Å; V729-L733 PolarHBondContact O-N 3.45Å; V729-L758 HydrophobicContact CG2-CD2 4.35Å; V729-L759 HydrophobicContact CG1-CD2 4.28Å; V729-M762 HydrophobicContact CG2-CE 3.88Å; V729-M762 HydrophobicContact CG2-SD 4.28Å
730	R	90.9	Very high	85.8	Confident	82 Å²	82	55.4 Å²	55.4	31%	0.309	29%	0.294	S	S	.	.	H	α-helix	trans	-62.2	-45	174.5	-72.4	173.6	175.7	-171.2	-2.7	111.5	L726 Y727 L732 L733 N734 E790 L794	L726-R730 WeakPolarHBondContact O-CB 3.4Å; L726-R730 VanDerWaalsContact O-CG 3.29Å; L726-R730 WeakPolarHBondContact O-CG 3.3Å; L726-R730 PolarHBondContact O-N 3.26Å; Y727-R730 PolarHBondContact O-N 3.23Å; R730-L732 VanDerWaalsContact C-N 3.34Å; R730-L732 PolarHBondContact O-N 3.48Å; R730-L733 PolarHBondContact O-N 3.27Å; R730-N734 WeakPolarHBondContact O-CB 3.33Å; R730-N734 PolarHBondContact O-N 3.02Å; R730-N734 PolarHBondContact O-ND2 3.47Å; R730-N734 PolarHBondContact O-OD1 2.79Å; R730-E790 IonicContact CZ-OE2 2.71Å; R730-E790 IonicContact NH1-OE2 3.14Å; R730-E790 IonicContact NH2-OE2 3.05Å; R730-E790 PolarHBondContact NH2-OE2 3.17Å; R730-L794 HydrophobicContact CG-CD1 4.19Å; R730-L794 HydrophobicContact CG-CD2 4.31Å
731	G	90	Very high	86.1	Confident	18 Å²	18	54.3 Å²	54.3	19%	0.186	29%	0.288	C	S	.	.	H	α-helix	trans	-56.5	-47.6	176.3	0	0	0	0	0	112.1	Y727 L728 N734 M735	Y727-G731 PolarHBondContact O-N 3.18Å; L728-G731 PolarHBondContact O-N 2.77Å; G731-N734 PolarHBondContact O-N 2.91Å; G731-M735 VanDerWaalsContact O-CG 3.32Å; G731-M735 WeakPolarHBondContact O-CG 3.2Å; G731-M735 PolarHBondContact O-N 3.42Å
732	L	92.3	Very high	86.5	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-61.9	-48.8	177.1	-178.5	70.3	0	0	0	112	V680 L683 I707 F710 L711 L714 L728 V729 R730 N734 M735 V736	V680-L732 HydrophobicContact CG2-CB 4.4Å; V680-L732 HydrophobicContact CG2-CD1 4.31Å; L683-L732 HydrophobicContact CD1-CD1 3.68Å; I707-L732 HydrophobicContact CG2-CD2 4.38Å; F710-L732 HydrophobicContact CD1-CD1 4.09Å; F710-L732 HydrophobicContact CD1-CD2 3.73Å; F710-L732 HydrophobicContact CD1-CG 4.45Å; F710-L732 HydrophobicContact CE1-CD1 4.29Å; F710-L732 HydrophobicContact CE1-CD2 4.28Å; L711-L732 HydrophobicContact CD2-CD2 3.62Å; L711-L732 HydrophobicContact CG-CD2 4.01Å; L714-L732 HydrophobicContact CD1-CD2 4.05Å; L728-L732 WeakPolarHBondContact O-CB 3.5Å; L728-L732 PolarHBondContact O-N 3.07Å; V729-L732 PolarHBondContact O-N 3.2Å; R730-L732 VanDerWaalsContact C-N 3.34Å; R730-L732 PolarHBondContact O-N 3.48Å; L732-N734 VanDerWaalsContact C-N 3.33Å; L732-N734 PolarHBondContact O-N 2.88Å; L732-M735 PolarHBondContact O-N 3.02Å; L732-V736 WeakPolarHBondContact O-CG2 3.48Å; L732-V736 PolarHBondContact O-N 3.14Å
733	L	91.7	Very high	86.2	Confident	10 Å²	10	51 Å²	51	5%	0.052	27%	0.266	C	S	.	.	H	α-helix	trans	-64.3	-37	-179.1	-69.5	173.5	0	0	0	112.4	V729 R730 V736 Q737 Y752 A755 L794 L798	V729-L733 HydrophobicContact CG1-CD1 4.07Å; V729-L733 VanDerWaalsContact O-CG 3.31Å; V729-L733 WeakPolarHBondContact O-CG 2.91Å; V729-L733 PolarHBondContact O-N 3.45Å; R730-L733 PolarHBondContact O-N 3.27Å; L733-V736 PolarHBondContact O-N 3.05Å; L733-Q737 WeakPolarHBondContact O-CB 3.49Å; L733-Q737 PolarHBondContact O-N 2.96Å; L733-Y752 HydrophobicContact CD2-CD1 4.12Å; L733-Y752 HydrophobicContact CD2-CE1 4.25Å; L733-A755 HydrophobicContact CD2-CB 4.17Å; L733-L794 HydrophobicContact CD1-CD2 4.28Å; L733-L798 HydrophobicContact CD1-CD1 4.14Å; L733-L798 HydrophobicContact CD1-CD2 4.21Å; L733-L798 HydrophobicContact CD2-CD2 4.17Å
734	N	91.7	Very high	86.1	Confident	85 Å²	85	52.1 Å²	52.1	46%	0.455	28%	0.275	S	S	.	.	H	α-helix	trans	-64.3	-45.2	174.3	-69.3	-12.5	0	0	0	111.1	R730 G731 L732 V736 Q737 D738	R730-N734 WeakPolarHBondContact O-CB 3.33Å; R730-N734 PolarHBondContact O-N 3.02Å; R730-N734 PolarHBondContact O-ND2 3.47Å; R730-N734 PolarHBondContact O-OD1 2.79Å; G731-N734 PolarHBondContact O-N 2.91Å; L732-N734 VanDerWaalsContact C-N 3.33Å; L732-N734 PolarHBondContact O-N 2.88Å; N734-V736 VanDerWaalsContact C-N 3.33Å; N734-V736 PolarHBondContact O-N 3.47Å; N734-Q737 WeakPolarHBondContact O-CA 3.44Å; N734-Q737 WeakPolarHBondContact O-CB 3.33Å; N734-Q737 PolarHBondContact O-N 3.35Å; N734-D738 PolarHBondContact O-N 3.3Å
735	M	90.6	Very high	86.3	Confident	56 Å²	56	51.5 Å²	51.5	28%	0.276	26%	0.264	S	S	.	.	H	α-helix	trans	-65.7	-35.7	177	-65.8	-61.5	147.4	0	0	112.4	V680 L683 P684 G731 L732 Q737 D738 Y739	V680-M735 HydrophobicContact CG1-CB 4.34Å; V680-M735 HydrophobicContact CG1-CG 3.57Å; L683-M735 HydrophobicContact CD2-CB 4.47Å; P684-M735 HydrophobicContact CG-CB 4.3Å; P684-M735 HydrophobicContact CG-CG 4.37Å; P684-M735 HydrophobicContact CG-SD 3.56Å; P684-M735 VanDerWaalsContact CG-SD 3.56Å; G731-M735 VanDerWaalsContact O-CG 3.32Å; G731-M735 WeakPolarHBondContact O-CG 3.2Å; G731-M735 PolarHBondContact O-N 3.42Å; L732-M735 PolarHBondContact O-N 3.02Å; M735-Q737 VanDerWaalsContact C-N 3.27Å; M735-Q737 PolarHBondContact O-N 2.86Å; M735-D738 PolarHBondContact O-N 3.21Å; M735-Y739 WeakPolarHBondContact O-CB 3.21Å; M735-Y739 PolarHBondContact O-N 3.19Å
736	V	88.6	Confident	86.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.3	-35.3	171.2	163.9	0	0	0	0	111.3	I707 L732 L733 N734 W741 K748 I751 Y752	I707-V736 HydrophobicContact CD1-CG2 3.86Å; L732-V736 WeakPolarHBondContact O-CG2 3.48Å; L732-V736 PolarHBondContact O-N 3.14Å; L733-V736 PolarHBondContact O-N 3.05Å; N734-V736 VanDerWaalsContact C-N 3.33Å; N734-V736 PolarHBondContact O-N 3.47Å; V736-W741 HydrophobicContact CG1-CZ2 3.96Å; V736-W741 PolarHBondContact O-NE1 3.41Å; V736-K748 HydrophobicContact CG1-CG 4.4Å; V736-I751 HydrophobicContact CG1-CD1 4.44Å; V736-I751 HydrophobicContact CG1-CG2 4.05Å; V736-I751 HydrophobicContact CG2-CG2 4.26Å; V736-Y752 HydrophobicContact CG1-CD1 4.49Å; V736-Y752 HydrophobicContact CG1-CE1 3.79Å
737	Q	87.4	Confident	86.5	Confident	91 Å²	91	51 Å²	51	43%	0.425	26%	0.262	S	S	.	.	H	α-helix	trans	-69.1	-41.6	176	179.5	172.5	-11	0	0	112	L733 N734 M735 K748	L733-Q737 WeakPolarHBondContact O-CB 3.49Å; L733-Q737 PolarHBondContact O-N 2.96Å; N734-Q737 WeakPolarHBondContact O-CA 3.44Å; N734-Q737 WeakPolarHBondContact O-CB 3.33Å; N734-Q737 PolarHBondContact O-N 3.35Å; M735-Q737 VanDerWaalsContact C-N 3.27Å; M735-Q737 PolarHBondContact O-N 2.86Å; Q737-K748 PolarHBondContact O-NZ 3.11Å
738	D	86.1	Confident	86.5	Confident	109 Å²	109	49.4 Å²	49.4	58%	0.583	26%	0.257	S	S	*	.	H	α-helix	trans	-77.3	-21	-179.2	-66.6	-21.8	0	0	0	113.3	N734 M735	N734-D738 PolarHBondContact O-N 3.3Å; M735-D738 PolarHBondContact O-N 3.21Å
739	Y	86.3	Confident	86.6	Confident	10 Å²	10	49 Å²	49	4%	0.039	26%	0.255	C	S	.	.	S	Bend	trans	-62.2	138	176	-177.5	-100.9	0	0	0	112.1	V686 L703 M735 W741	V686-Y739 HydrophobicContact CB-CE2 3.89Å; V686-Y739 HydrophobicContact CG1-CE2 4.43Å; V686-Y739 WeakPolarHBondContact O-CE2 3.45Å; V686-Y739 PolarHBondContact O-OH 2.83Å; L703-Y739 HydrophobicContact CD2-CD1 4.25Å; L703-Y739 HydrophobicContact CD2-CE1 3.9Å; L703-Y739 HydrophobicContact CD2-CE2 4.3Å; M735-Y739 WeakPolarHBondContact O-CB 3.21Å; M735-Y739 PolarHBondContact O-N 3.19Å; Y739-W741 AromaticContact CD1-CD2 3.66Å; Y739-W741 HydrophobicContact CD1-CD2 3.66Å; Y739-W741 AromaticContact CD1-CE2 3.52Å; Y739-W741 HydrophobicContact CD1-CE3 4.06Å; Y739-W741 AromaticContact CD1-CG 3.99Å; Y739-W741 HydrophobicContact CD1-CG 3.99Å; Y739-W741 HydrophobicContact CD1-CH2 4.12Å; Y739-W741 AromaticContact CD1-CZ2 3.76Å; Y739-W741 HydrophobicContact CD1-CZ2 3.76Å; Y739-W741 HydrophobicContact CD1-CZ3 4.29Å; Y739-W741 AromaticContact CD1-NE1 3.79Å; Y739-W741 HydrophobicContact CE1-CD2 4.09Å; Y739-W741 HydrophobicContact CE1-CE3 4.06Å; Y739-W741 HydrophobicContact CE1-CH2 4.41Å; Y739-W741 HydrophobicContact CE1-CZ2 4.48Å; Y739-W741 HydrophobicContact CE1-CZ3 4.23Å; Y739-W741 HydrophobicContact CG-CZ2 4.46Å; Y739-W741 PolarHBondContact O-N 3.14Å; Y739-W741 PolarHBondContact O-NE1 3.38Å
740	T	84.2	Confident	86.6	Confident	81 Å²	81	54.8 Å²	54.8	50%	0.497	28%	0.276	S	S	.	.			trans	-88.1	91.1	179.8	70.6	0	0	0	0	112	R688	R688-T740 PolarHBondContact NE-O 3.36Å; R688-T740 PolarHBondContact NE-OG1 3.44Å; R688-T740 PolarHBondContact NH2-OG1 3.37Å
741	W	84.9	Confident	86.6	Confident	32 Å²	32	51 Å²	51	12%	0.121	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-65.1	157.7	176.8	-60.3	88.8	0	0	0	113.1	E700 L703 V736 Y739 A747 K748 I751	E700-W741 HydrophobicContact CB-CZ3 4.49Å; E700-W741 HydrophobicContact CG-CE3 4.2Å; E700-W741 HydrophobicContact CG-CZ3 4.25Å; L703-W741 HydrophobicContact CD2-CH2 3.84Å; L703-W741 HydrophobicContact CD2-CZ3 4.26Å; V736-W741 HydrophobicContact CG1-CZ2 3.96Å; V736-W741 PolarHBondContact O-NE1 3.41Å; Y739-W741 AromaticContact CD1-CD2 3.66Å; Y739-W741 HydrophobicContact CD1-CD2 3.66Å; Y739-W741 AromaticContact CD1-CE2 3.52Å; Y739-W741 HydrophobicContact CD1-CE3 4.06Å; Y739-W741 AromaticContact CD1-CG 3.99Å; Y739-W741 HydrophobicContact CD1-CG 3.99Å; Y739-W741 HydrophobicContact CD1-CH2 4.12Å; Y739-W741 AromaticContact CD1-CZ2 3.76Å; Y739-W741 HydrophobicContact CD1-CZ2 3.76Å; Y739-W741 HydrophobicContact CD1-CZ3 4.29Å; Y739-W741 AromaticContact CD1-NE1 3.79Å; Y739-W741 HydrophobicContact CE1-CD2 4.09Å; Y739-W741 HydrophobicContact CE1-CE3 4.06Å; Y739-W741 HydrophobicContact CE1-CH2 4.41Å; Y739-W741 HydrophobicContact CE1-CZ2 4.48Å; Y739-W741 HydrophobicContact CE1-CZ3 4.23Å; Y739-W741 HydrophobicContact CG-CZ2 4.46Å; Y739-W741 PolarHBondContact O-N 3.14Å; Y739-W741 PolarHBondContact O-NE1 3.38Å; W741-A747 HydrophobicContact CE3-CB 3.66Å; W741-A747 HydrophobicContact CH2-CB 4.45Å; W741-A747 HydrophobicContact CZ3-CB 3.42Å; W741-A747 VanDerWaalsContact CZ3-CB 3.42Å; W741-K748 HydrophobicContact CD2-CB 3.74Å; W741-K748 HydrophobicContact CD2-CG 4.49Å; W741-K748 HydrophobicContact CE3-CB 4.39Å; W741-K748 HydrophobicContact CG-CB 3.97Å; W741-K748 HydrophobicContact CG-CD 4.41Å; W741-K748 HydrophobicContact CZ2-CB 4.25Å; W741-I751 HydrophobicContact CH2-CD1 3.21Å; W741-I751 HydrophobicContact CZ2-CD1 3.72Å; W741-I751 HydrophobicContact CZ3-CD1 4.11Å
742	E	81.4	Confident	86.8	Confident	66 Å²	66	50.3 Å²	50.3	31%	0.308	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-67.7	144.2	174.6	-67.8	-176.2	153.5	0	0	111.5	S698 E700 N744 S745	S698-E742 VanDerWaalsContact CB-OE2 3.28Å; S698-E742 WeakPolarHBondContact CB-OE2 3.32Å; S698-E742 PolarHBondContact OG-OE1 2.98Å; S698-E742 PolarHBondContact OG-OE2 3.39Å; E700-E742 WeakPolarHBondContact OE1-CB 3.49Å; E700-E742 PolarHBondContact OE1-N 3.44Å; E742-N744 PolarHBondContact O-N 3Å; E742-S745 WeakPolarHBondContact O-CB 3.49Å; E742-S745 PolarHBondContact O-N 2.92Å
743	D	70.5	Confident	86.8	Confident	155 Å²	155	50.5 Å²	50.5	83%	0.829	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	126.9	176.1	-66.1	-42.8	0	0	0	108.7
744	N	75.5	Confident	86.8	Confident	117 Å²	117	52 Å²	52	63%	0.626	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	20.2	-176.6	-118.2	-9	0	0	0	115.1	E742 R818	E742-N744 PolarHBondContact O-N 3Å; N744-R818 PolarHBondContact O-NH1 3.48Å; N744-R818 PolarHBondContact OD1-NH2 3.16Å
745	S	83.3	Confident	86.8	Confident	27 Å²	27	48 Å²	48	19%	0.189	25%	0.245	C	C	.	.			trans	-84.3	149	171.1	-179	0	0	0	0	114	E700 E742 A747	E700-S745 VanDerWaalsContact CD-OG 3.27Å; E700-S745 WeakPolarHBondContact OE1-CB 3.41Å; E700-S745 PolarHBondContact OE1-OG 3.31Å; E700-S745 WeakPolarHBondContact OE2-CB 3.48Å; E700-S745 PolarHBondContact OE2-OG 2.92Å; E742-S745 WeakPolarHBondContact O-CB 3.49Å; E742-S745 PolarHBondContact O-N 2.92Å; S745-A747 WeakPolarHBondContact OG-CB 3.46Å; S745-A747 PolarHBondContact OG-N 3.29Å
746	D	87.4	Confident	86.9	Confident	15 Å²	15	45.8 Å²	45.8	8%	0.08	23%	0.234	C	C	.	.			trans	-100.3	-0.2	171.3	-62.5	-39.2	0	0	0	112.9	K748 V749 R750 H805 R818 L822	D746-K748 PolarHBondContact O-N 2.9Å; D746-V749 PolarHBondContact O-N 3.33Å; D746-R750 WeakPolarHBondContact O-CG 3.2Å; D746-R750 PolarHBondContact O-N 3.18Å; D746-H805 IonicContact OD1-NE2 3.53Å; D746-H805 PolarHBondContact OD1-NE2 3.12Å; D746-H805 VanDerWaalsContact OD1-NE2 3.1Å; D746-R818 VanDerWaalsContact OD2-CD 3.31Å; D746-R818 WeakPolarHBondContact OD2-CD 3.33Å; D746-L822 HydrophobicContact CB-CD1 4.05Å; D746-L822 HydrophobicContact CB-CD2 4.38Å
747	A	86.4	Confident	87	Confident	8 Å²	8	47.6 Å²	47.6	7%	0.066	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-42.7	-170.2	0	0	0	0	0	112.8	E700 W741 S745 V749 R750 I751	E700-A747 HydrophobicContact CB-CB 4Å; E700-A747 HydrophobicContact CG-CB 4.44Å; W741-A747 HydrophobicContact CE3-CB 3.66Å; W741-A747 HydrophobicContact CH2-CB 4.45Å; W741-A747 HydrophobicContact CZ3-CB 3.42Å; W741-A747 VanDerWaalsContact CZ3-CB 3.42Å; S745-A747 WeakPolarHBondContact OG-CB 3.46Å; S745-A747 PolarHBondContact OG-N 3.29Å; A747-V749 VanDerWaalsContact C-N 3.32Å; A747-V749 PolarHBondContact O-N 3.34Å; A747-R750 PolarHBondContact O-N 2.85Å; A747-I751 WeakPolarHBondContact O-CG1 3.38Å; A747-I751 PolarHBondContact O-N 3.11Å
748	K	89.3	Confident	87.2	Confident	57 Å²	57	43.9 Å²	43.9	25%	0.248	23%	0.229	C	C	.	.	H	α-helix	trans	-54.1	-47.1	174.2	-172.8	176.9	-176.3	161	0	112.5	V736 Q737 W741 D746 I751 Y752	V736-K748 HydrophobicContact CG1-CG 4.4Å; Q737-K748 PolarHBondContact O-NZ 3.11Å; W741-K748 HydrophobicContact CD2-CB 3.74Å; W741-K748 HydrophobicContact CD2-CG 4.49Å; W741-K748 HydrophobicContact CE3-CB 4.39Å; W741-K748 HydrophobicContact CG-CB 3.97Å; W741-K748 HydrophobicContact CG-CD 4.41Å; W741-K748 HydrophobicContact CZ2-CB 4.25Å; D746-K748 PolarHBondContact O-N 2.9Å; K748-I751 WeakPolarHBondContact O-CB 3.34Å; K748-I751 PolarHBondContact O-N 3.24Å; K748-Y752 HydrophobicContact CD-CE2 4.35Å; K748-Y752 WeakPolarHBondContact CE-OH 3.38Å; K748-Y752 HydrophobicContact CG-CE2 3.92Å; K748-Y752 PolarHBondContact O-N 3.24Å; K748-Y752 VanDerWaalsContact O-N 3.15Å
749	V	90	Very high	87.4	Confident	4 Å²	4	38.7 Å²	38.7	2%	0.024	20%	0.201	C	C	.	.	H	α-helix	trans	-72	-36.5	-177.7	176.4	0	0	0	0	111.2	D746 A747 I751 Y752 I753 I802 H805 L822	D746-V749 PolarHBondContact O-N 3.33Å; A747-V749 VanDerWaalsContact C-N 3.32Å; A747-V749 PolarHBondContact O-N 3.34Å; V749-I751 VanDerWaalsContact C-N 3.29Å; V749-I751 PolarHBondContact O-N 3.03Å; V749-Y752 PolarHBondContact O-N 2.66Å; V749-I753 HydrophobicContact CG1-CD1 4.16Å; V749-I753 WeakPolarHBondContact O-CG1 3.43Å; V749-I753 PolarHBondContact O-N 3.39Å; V749-I802 HydrophobicContact CG1-CB 4.26Å; V749-I802 HydrophobicContact CG1-CG1 4.04Å; V749-I802 HydrophobicContact CG1-CG2 3.8Å; V749-H805 HydrophobicContact CG2-CB 3.63Å; V749-H805 VanDerWaalsContact CG2-CD2 3.48Å; V749-H805 WeakPolarHBondContact CG2-CD2 3.42Å; V749-H805 VanDerWaalsContact CG2-CG 3.48Å; V749-L822 HydrophobicContact CG1-CD1 4.28Å; V749-L822 HydrophobicContact CG1-CD2 4.42Å
750	R	90.6	Very high	87.5	Confident	126 Å²	126	39.1 Å²	39.1	48%	0.475	21%	0.206	S	C	.	.	H	α-helix	trans	-60	-40	172.5	-70.8	173.5	179.5	-112.7	0.9	111.6	L704 D746 A747 I753 S754 L822	L704-R750 HydrophobicContact CD1-CB 3.69Å; D746-R750 WeakPolarHBondContact O-CG 3.2Å; D746-R750 PolarHBondContact O-N 3.18Å; A747-R750 PolarHBondContact O-N 2.85Å; R750-I753 PolarHBondContact O-N 3.15Å; R750-S754 PolarHBondContact O-N 2.85Å; R750-S754 PolarHBondContact O-OG 3.37Å; R750-L822 HydrophobicContact CG-CD2 3.91Å
751	I	91.6	Very high	87.7	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-62.9	-43.6	174.4	-70.3	156.9	0	0	0	111.4	I707 V736 W741 A747 K748 V749 I753 S754 A755	I707-I751 HydrophobicContact CD1-CD1 3.52Å; I707-I751 HydrophobicContact CD1-CG1 4.23Å; I707-I751 HydrophobicContact CG2-CG1 4.19Å; I707-I751 HydrophobicContact CG2-CG2 3.69Å; V736-I751 HydrophobicContact CG1-CD1 4.44Å; V736-I751 HydrophobicContact CG1-CG2 4.05Å; V736-I751 HydrophobicContact CG2-CG2 4.26Å; W741-I751 HydrophobicContact CH2-CD1 3.21Å; W741-I751 HydrophobicContact CZ2-CD1 3.72Å; W741-I751 HydrophobicContact CZ3-CD1 4.11Å; A747-I751 WeakPolarHBondContact O-CG1 3.38Å; A747-I751 PolarHBondContact O-N 3.11Å; K748-I751 WeakPolarHBondContact O-CB 3.34Å; K748-I751 PolarHBondContact O-N 3.24Å; V749-I751 VanDerWaalsContact C-N 3.29Å; V749-I751 PolarHBondContact O-N 3.03Å; I751-I753 VanDerWaalsContact C-N 3.32Å; I751-I753 PolarHBondContact O-N 3.19Å; I751-S754 CarbonylContact O-C 3.54Å; I751-S754 WeakPolarHBondContact O-CB 3.37Å; I751-S754 PolarHBondContact O-N 3.02Å; I751-S754 VanDerWaalsContact O-N 3.15Å; I751-A755 PolarHBondContact O-N 3.01Å
752	Y	93	Very high	87.8	Confident	4 Å²	4	35 Å²	35	2%	0.016	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-39.5	175.9	-62.8	-23	0	0	0	112.5	L733 V736 K748 V749 S754 A755 L756 L798 Q801 I802	L733-Y752 HydrophobicContact CD2-CD1 4.12Å; L733-Y752 HydrophobicContact CD2-CE1 4.25Å; V736-Y752 HydrophobicContact CG1-CD1 4.49Å; V736-Y752 HydrophobicContact CG1-CE1 3.79Å; K748-Y752 HydrophobicContact CD-CE2 4.35Å; K748-Y752 WeakPolarHBondContact CE-OH 3.38Å; K748-Y752 HydrophobicContact CG-CE2 3.92Å; K748-Y752 PolarHBondContact O-N 3.24Å; K748-Y752 VanDerWaalsContact O-N 3.15Å; V749-Y752 PolarHBondContact O-N 2.66Å; Y752-S754 VanDerWaalsContact C-N 3.34Å; Y752-A755 PolarHBondContact O-N 3.1Å; Y752-L756 PolarHBondContact O-N 3.24Å; Y752-L798 HydrophobicContact CD1-CD2 3.65Å; Y752-L798 HydrophobicContact CE1-CD2 4.06Å; Y752-L798 HydrophobicContact CG-CD2 3.91Å; Y752-Q801 HydrophobicContact CD2-CB 4.26Å; Y752-Q801 HydrophobicContact CE2-CB 4.03Å; Y752-Q801 PolarHBondContact OH-OE1 2.99Å; Y752-I802 HydrophobicContact CD2-CG1 4.45Å
753	I	91.6	Very high	88	Confident	6 Å²	6	34.1 Å²	34.1	3%	0.031	19%	0.188	C	C	.	.	H	α-helix	trans	-62.4	-42.2	172.9	-66.2	169.2	0	0	0	110.3	V749 R750 I751 A755 L756 P757 I802 L822 L826 V829	V749-I753 HydrophobicContact CG1-CD1 4.16Å; V749-I753 WeakPolarHBondContact O-CG1 3.43Å; V749-I753 PolarHBondContact O-N 3.39Å; R750-I753 PolarHBondContact O-N 3.15Å; I751-I753 VanDerWaalsContact C-N 3.32Å; I751-I753 PolarHBondContact O-N 3.19Å; I753-A755 VanDerWaalsContact C-N 3.31Å; I753-A755 PolarHBondContact O-N 3.09Å; I753-L756 PolarHBondContact O-N 3.4Å; I753-P757 WeakPolarHBondContact O-CD 3.37Å; I753-I802 HydrophobicContact CD1-CG2 4.49Å; I753-I802 HydrophobicContact CG1-CD1 3.8Å; I753-I802 HydrophobicContact CG1-CG1 4.29Å; I753-I802 HydrophobicContact CG1-CG2 4.41Å; I753-L822 HydrophobicContact CD1-CD2 4.11Å; I753-L826 HydrophobicContact CD1-CB 4.41Å; I753-V829 HydrophobicContact CG2-CG2 3.73Å
754	S	91.8	Very high	88.7	Confident	42 Å²	42	31.2 Å²	31.2	29%	0.294	17%	0.169	S	C	.	.	H	α-helix	trans	-67.3	-25.7	175.9	-65.6	0	0	0	0	114.3	N708 R750 I751 Y752 P757	N708-S754 WeakPolarHBondContact OD1-CB 3.36Å; N708-S754 PolarHBondContact OD1-OG 2.9Å; R750-S754 PolarHBondContact O-N 2.85Å; R750-S754 PolarHBondContact O-OG 3.37Å; I751-S754 CarbonylContact O-C 3.54Å; I751-S754 WeakPolarHBondContact O-CB 3.37Å; I751-S754 PolarHBondContact O-N 3.02Å; I751-S754 VanDerWaalsContact O-N 3.15Å; Y752-S754 VanDerWaalsContact C-N 3.34Å; S754-P757 WeakPolarHBondContact O-CD 3.29Å
755	A	92.8	Very high	89	Confident	1 Å²	1	33 Å²	33	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-75.4	-25.6	177.3	0	0	0	0	0	112.8	L711 L733 I751 Y752 I753 L758 L759 L798	L711-A755 HydrophobicContact CD1-CB 4.25Å; L711-A755 HydrophobicContact CD2-CB 4.25Å; L733-A755 HydrophobicContact CD2-CB 4.17Å; I751-A755 PolarHBondContact O-N 3.01Å; Y752-A755 PolarHBondContact O-N 3.1Å; I753-A755 VanDerWaalsContact C-N 3.31Å; I753-A755 PolarHBondContact O-N 3.09Å; A755-L758 WeakPolarHBondContact O-CB 3.33Å; A755-L758 PolarHBondContact O-N 2.97Å; A755-L759 WeakPolarHBondContact O-CG 3.45Å; A755-L759 PolarHBondContact O-N 2.94Å; A755-L759 VanDerWaalsContact O-N 3.07Å; A755-L798 HydrophobicContact CB-CD1 4Å
756	L	92	Very high	89	Confident	10 Å²	10	36.7 Å²	36.7	5%	0.052	20%	0.196	C	C	.	.	H	α-helix	trans	-63.4	-45.1	179.6	-68.6	172.4	0	0	0	113.3	Y752 I753 L758 L759 A760 C795 L798 I799 I802 L826 V829	Y752-L756 PolarHBondContact O-N 3.24Å; I753-L756 PolarHBondContact O-N 3.4Å; L756-L758 VanDerWaalsContact C-N 3.29Å; L756-L758 PolarHBondContact O-N 3.46Å; L756-L759 PolarHBondContact O-N 2.83Å; L756-A760 WeakPolarHBondContact O-CB 3.46Å; L756-A760 PolarHBondContact O-N 3.39Å; L756-C795 HydrophobicContact CD2-CB 4.22Å; L756-L798 HydrophobicContact CD2-CB 4.27Å; L756-L798 HydrophobicContact CD2-CD1 4.38Å; L756-I799 HydrophobicContact CD1-CG1 4.12Å; L756-I799 HydrophobicContact CD2-CD1 4.5Å; L756-I799 HydrophobicContact CD2-CG1 4.15Å; L756-I802 HydrophobicContact CD1-CD1 4.06Å; L756-L826 HydrophobicContact CD1-CD1 3.55Å; L756-V829 HydrophobicContact CB-CG1 3.78Å; L756-V829 HydrophobicContact CD1-CG1 4.32Å
757	P	90.9	Very high	89	Confident	37 Å²	37	36.9 Å²	36.9	24%	0.24	20%	0.195	C	C	.	.	H	α-helix	trans	-56.8	-37.6	171.3	-27.7	33.5	0	0	0	114	I753 S754 A760 A761 V829	I753-P757 WeakPolarHBondContact O-CD 3.37Å; S754-P757 WeakPolarHBondContact O-CD 3.29Å; P757-A760 PolarHBondContact O-N 3.47Å; P757-A761 WeakPolarHBondContact O-CB 3.39Å; P757-A761 PolarHBondContact O-N 2.88Å; P757-V829 HydrophobicContact CG-CG1 4.03Å; P757-V829 HydrophobicContact CG-CG2 4.25Å
758	L	90.9	Very high	88.7	Confident	13 Å²	13	44.4 Å²	44.4	7%	0.068	23%	0.233	C	C	.	.	H	α-helix	trans	-63	-50	175.9	174.3	65.8	0	0	0	110.8	L711 L714 L715 V729 A755 L756 A760 A761 M762	L711-L758 HydrophobicContact CB-CD2 4.12Å; L711-L758 HydrophobicContact CD2-CD2 3.61Å; L711-L758 HydrophobicContact CG-CD2 4.49Å; L711-L758 VanDerWaalsContact O-CD1 3.24Å; L711-L758 WeakPolarHBondContact O-CD1 3.28Å; L711-L758 WeakPolarHBondContact O-CD2 3.45Å; L714-L758 HydrophobicContact CB-CD2 4.21Å; L715-L758 HydrophobicContact CB-CD1 3.73Å; L715-L758 HydrophobicContact CD1-CD1 4.2Å; V729-L758 HydrophobicContact CG2-CD2 4.35Å; A755-L758 WeakPolarHBondContact O-CB 3.33Å; A755-L758 PolarHBondContact O-N 2.97Å; L756-L758 VanDerWaalsContact C-N 3.29Å; L756-L758 PolarHBondContact O-N 3.46Å; L758-A760 VanDerWaalsContact C-N 3.27Å; L758-A760 PolarHBondContact O-N 3.39Å; L758-A761 WeakPolarHBondContact O-CB 3.42Å; L758-A761 PolarHBondContact O-N 3.28Å; L758-A761 VanDerWaalsContact O-N 3.11Å; L758-M762 HydrophobicContact CD1-CE 4Å; L758-M762 HydrophobicContact CD1-CG 4.41Å; L758-M762 HydrophobicContact CD1-SD 4.47Å; L758-M762 HydrophobicContact CD2-CE 4.36Å; L758-M762 HydrophobicContact CG-CE 4.19Å; L758-M762 HydrophobicContact CG-SD 4.25Å; L758-M762 WeakPolarHBondContact O-CG 3.2Å; L758-M762 PolarHBondContact O-N 3.2Å
759	L	90.1	Very high	88.4	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-61.3	-37.6	178.9	-69.7	176.6	0	0	0	111.8	V729 A755 L756 M762 S763 I791 L794 L798	V729-L759 HydrophobicContact CG1-CD2 4.28Å; A755-L759 WeakPolarHBondContact O-CG 3.45Å; A755-L759 PolarHBondContact O-N 2.94Å; A755-L759 VanDerWaalsContact O-N 3.07Å; L756-L759 PolarHBondContact O-N 2.83Å; L759-M762 PolarHBondContact O-N 3.34Å; L759-S763 PolarHBondContact O-N 3.03Å; L759-I791 HydrophobicContact CB-CG2 4.05Å; L759-I791 HydrophobicContact CD2-CG2 4.5Å; L759-L794 HydrophobicContact CD1-CB 4.09Å; L759-L798 HydrophobicContact CD1-CD1 3.78Å
760	A	88.6	Confident	88.1	Confident	18 Å²	18	50 Å²	50	15%	0.149	27%	0.265	C	S	.	.	H	α-helix	trans	-72	-29	174.8	0	0	0	0	0	113.5	L756 P757 L758 S763 H833	L756-A760 WeakPolarHBondContact O-CB 3.46Å; L756-A760 PolarHBondContact O-N 3.39Å; P757-A760 PolarHBondContact O-N 3.47Å; L758-A760 VanDerWaalsContact C-N 3.27Å; L758-A760 PolarHBondContact O-N 3.39Å; A760-S763 PolarHBondContact O-OG 3.13Å; A760-H833 HydrophobicContact CB-CB 3.68Å
761	A	88.4	Confident	87.7	Confident	22 Å²	22	45.6 Å²	45.6	18%	0.182	25%	0.25	C	S	.	.	H	α-helix	trans	-72	-39.6	170.5	0	0	0	0	0	110.8	L715 P757 L758 S763 Q764 Y767	L715-A761 HydrophobicContact CD1-CB 3.79Å; L715-A761 HydrophobicContact CD2-CB 4.19Å; P757-A761 WeakPolarHBondContact O-CB 3.39Å; P757-A761 PolarHBondContact O-N 2.88Å; L758-A761 WeakPolarHBondContact O-CB 3.42Å; L758-A761 PolarHBondContact O-N 3.28Å; L758-A761 VanDerWaalsContact O-N 3.11Å; A761-S763 PolarHBondContact O-N 3.1Å; A761-Q764 WeakPolarHBondContact O-CB 3.36Å; A761-Q764 PolarHBondContact O-N 2.91Å; A761-Q764 VanDerWaalsContact O-N 3.16Å; A761-Y767 WeakPolarHBondContact O-CD1 3.39Å; A761-Y767 VanDerWaalsContact O-CE1 3.25Å; A761-Y767 WeakPolarHBondContact O-CE1 3.36Å
762	M	88.1	Confident	87	Confident	4 Å²	4	51.1 Å²	51.1	2%	0.02	28%	0.276	C	S	.	.	H	α-helix	trans	-65.1	-23.6	177.6	-75.1	-179.8	164.4	0	0	113.8	L714 L715 L726 V729 L758 L759 Q764 Y767 I791	L714-M762 HydrophobicContact CB-CE 4.46Å; L714-M762 VanDerWaalsContact O-CE 3.25Å; L714-M762 WeakPolarHBondContact O-CE 3.42Å; L715-M762 HydrophobicContact CD1-CG 3.74Å; L726-M762 HydrophobicContact CD2-CE 4.49Å; L726-M762 HydrophobicContact CD2-SD 3.58Å; L726-M762 VanDerWaalsContact CD2-SD 3.58Å; V729-M762 HydrophobicContact CG2-CE 3.88Å; V729-M762 HydrophobicContact CG2-SD 4.28Å; L758-M762 HydrophobicContact CD1-CE 4Å; L758-M762 HydrophobicContact CD1-CG 4.41Å; L758-M762 HydrophobicContact CD1-SD 4.47Å; L758-M762 HydrophobicContact CD2-CE 4.36Å; L758-M762 HydrophobicContact CG-CE 4.19Å; L758-M762 HydrophobicContact CG-SD 4.25Å; L758-M762 WeakPolarHBondContact O-CG 3.2Å; L758-M762 PolarHBondContact O-N 3.2Å; L759-M762 PolarHBondContact O-N 3.34Å; M762-Q764 VanDerWaalsContact C-N 3.32Å; M762-Y767 PolarHBondContact O-OH 3.18Å; M762-I791 HydrophobicContact CB-CD1 4.07Å
763	S	85.9	Confident	86.3	Confident	48 Å²	48	56.6 Å²	56.6	34%	0.336	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-7.9	176.1	64.6	0	0	0	0	114.2	L759 A760 A761	L759-S763 PolarHBondContact O-N 3.03Å; A760-S763 PolarHBondContact O-OG 3.13Å; A761-S763 PolarHBondContact O-N 3.1Å
764	Q	85.4	Confident	85.9	Confident	94 Å²	94	56.7 Å²	56.7	44%	0.439	30%	0.301	S	S	.	.	S	Bend	trans	-75.5	146.9	177	-61.5	179.2	-3.4	0	0	110.8	A761 M762 T766	A761-Q764 WeakPolarHBondContact O-CB 3.36Å; A761-Q764 PolarHBondContact O-N 2.91Å; A761-Q764 VanDerWaalsContact O-N 3.16Å; M762-Q764 VanDerWaalsContact C-N 3.32Å; Q764-T766 PolarHBondContact O-N 3.21Å
765	E	81.9	Confident	85.5	Confident	156 Å²	156	59.5 Å²	59.5	73%	0.729	31%	0.312	S	S	*	.	S	Bend	trans	-67.4	-27.9	176	-65.4	-179.8	-178.2	0	0	112.3
766	T	81.9	Confident	85.1	Confident	104 Å²	104	59.5 Å²	59.5	64%	0.638	31%	0.312	S	S	*	.	S	Bend	trans	-138.6	128.9	176.4	55.2	0	0	0	0	110.3	Q764 E778	Q764-T766 PolarHBondContact O-N 3.21Å; T766-E778 VanDerWaalsContact CA-OE2 3.32Å; T766-E778 WeakPolarHBondContact CA-OE2 3.29Å
767	Y	86.9	Confident	84.8	Confident	19 Å²	19	59 Å²	59	8%	0.075	31%	0.31	C	S	.	.			trans	-79.8	152.9	178.4	-62.1	-11.2	0	0	0	111.1	L715 A761 M762 Y769 N777 E778	L715-Y767 HydrophobicContact CD1-CD1 4.18Å; L715-Y767 HydrophobicContact CD1-CD2 3.91Å; L715-Y767 HydrophobicContact CD1-CE1 4.17Å; L715-Y767 HydrophobicContact CD1-CE2 3.86Å; L715-Y767 HydrophobicContact CD1-CG 4.08Å; L715-Y767 HydrophobicContact CG-CD2 3.95Å; L715-Y767 HydrophobicContact CG-CE2 4.25Å; L715-Y767 HydrophobicContact CG-CG 4.26Å; L715-Y767 WeakPolarHBondContact O-CE2 3.48Å; A761-Y767 WeakPolarHBondContact O-CD1 3.39Å; A761-Y767 VanDerWaalsContact O-CE1 3.25Å; A761-Y767 WeakPolarHBondContact O-CE1 3.36Å; M762-Y767 PolarHBondContact O-OH 3.18Å; Y767-Y769 PolarHBondContact O-N 3.04Å; Y767-N777 HydrophobicContact CE2-CB 4.31Å; Y767-N777 VanDerWaalsContact OH-CB 3.28Å; Y767-N777 WeakPolarHBondContact OH-CB 3.39Å; Y767-E778 WeakPolarHBondContact CB-OE2 3.47Å; Y767-E778 HydrophobicContact CD1-CB 3.94Å; Y767-E778 HydrophobicContact CD2-CB 3.99Å; Y767-E778 HydrophobicContact CD2-CG 4.1Å; Y767-E778 HydrophobicContact CE1-CB 3.84Å; Y767-E778 HydrophobicContact CE2-CB 3.93Å; Y767-E778 HydrophobicContact CE2-CG 4.32Å; Y767-E778 HydrophobicContact CG-CB 4Å; Y767-E778 HydrophobicContact CG-CG 4.32Å; Y767-E778 PolarHBondContact N-OE2 2.88Å; Y767-E778 PolarHBondContact OH-N 3.05Å
768	L	80.8	Confident	84.3	Confident	166 Å²	166	58.7 Å²	58.7	87%	0.869	31%	0.305	S	S	*	.	S	Bend	trans	-65.9	-28.6	-179.2	-174.9	65	0	0	0	112.9
769	Y	83.7	Confident	84	Confident	103 Å²	103	62.5 Å²	62.5	40%	0.404	33%	0.329	S	S	.	.			trans	-146.7	147.4	177	70.1	-85.4	0	0	0	110.2	A712 L715 V716 Y767	A712-Y769 PolarHBondContact O-OH 3.35Å; L715-Y769 HydrophobicContact CD2-CD1 4.43Å; L715-Y769 HydrophobicContact CD2-CE1 3.77Å; V716-Y769 HydrophobicContact CB-CE2 4.36Å; V716-Y769 HydrophobicContact CG1-CD2 3.59Å; V716-Y769 HydrophobicContact CG1-CE2 3.29Å; V716-Y769 WeakPolarHBondContact CG1-O 3.29Å; V716-Y769 HydrophobicContact CG2-CE2 4.14Å; Y767-Y769 PolarHBondContact O-N 3.04Å
770	S	82.8	Confident	83.6	Confident	75 Å²	75	66.5 Å²	66.5	52%	0.524	35%	0.35	S	S	.	.			trans	-137.7	157.7	178.3	61.7	0	0	0	0	110.5
771	I	81.8	Confident	83.3	Confident	34 Å²	34	68.5 Å²	68.5	17%	0.174	35%	0.354	C	S	.	.			trans	-91.5	123.4	175.4	-62.2	175.3	0	0	0	107.9	L664 V716 K773 V774	L664-I771 HydrophobicContact CB-CD1 3.82Å; L664-I771 HydrophobicContact CD1-CD1 4.46Å; V716-I771 HydrophobicContact CB-CD1 4.22Å; V716-I771 HydrophobicContact CB-CG1 4.24Å; V716-I771 HydrophobicContact CG2-CD1 3.7Å; V716-I771 HydrophobicContact CG2-CG1 4.12Å; I771-K773 PolarHBondContact O-N 3.32Å; I771-K773 VanDerWaalsContact O-N 3.13Å; I771-V774 HydrophobicContact CB-CB 4.07Å; I771-V774 HydrophobicContact CB-CG2 4.26Å; I771-V774 HydrophobicContact CG2-CB 4.16Å; I771-V774 HydrophobicContact CG2-CG2 3.8Å; I771-V774 PolarHBondContact O-N 3.17Å
772	H	76.9	Confident	82.4	Confident	117 Å²	117	69.9 Å²	69.9	54%	0.542	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	120.8	179.7	-179	-91.4	0	0	0	111.8	V774	H772-V774 VanDerWaalsContact C-N 3.35Å
773	K	79.1	Confident	81.7	Confident	118 Å²	118	70.9 Å²	70.9	51%	0.513	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	21.7	-177.7	-63.1	176.5	164.7	-153.3	0	116.1	N623 Q667 I771	N623-K773 WeakPolarHBondContact OD1-CE 3.45Å; N623-K773 PolarHBondContact OD1-NZ 3.24Å; Q667-K773 HydrophobicContact CG-CB 4.32Å; I771-K773 PolarHBondContact O-N 3.32Å; I771-K773 VanDerWaalsContact O-N 3.13Å
774	V	83.6	Confident	81.6	Confident	9 Å²	9	71.6 Å²	71.6	6%	0.055	38%	0.382	C	S	.	.			trans	-116.5	118.9	166	175.1	0	0	0	0	107	Q667 L669 P718 I771 H772 S776	Q667-V774 HydrophobicContact CG-CG2 4.39Å; L669-V774 HydrophobicContact CD2-CG1 3.79Å; L669-V774 HydrophobicContact CD2-CG2 4.2Å; P718-V774 HydrophobicContact CG-CG1 4.35Å; I771-V774 HydrophobicContact CB-CB 4.07Å; I771-V774 HydrophobicContact CB-CG2 4.26Å; I771-V774 HydrophobicContact CG2-CB 4.16Å; I771-V774 HydrophobicContact CG2-CG2 3.8Å; I771-V774 PolarHBondContact O-N 3.17Å; H772-V774 VanDerWaalsContact C-N 3.35Å; V774-S776 PolarHBondContact O-N 2.92Å; V774-S776 VanDerWaalsContact O-N 3.16Å
775	D	83.5	Confident	81.6	Confident	101 Å²	101	72 Å²	72	54%	0.54	39%	0.393	S	S	.	.			trans	-74.6	105.4	177.6	-60.7	-33.7	0	0	0	108.3	P718 T779 L780	P718-D775 WeakPolarHBondContact CB-O 3.45Å; D775-T779 HydrophobicContact CB-CG2 4.37Å; D775-L780 HydrophobicContact CB-CD2 4.36Å
776	S	84.8	Confident	81.8	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	39%	0.392	C	S	.	.			trans	-77.7	171.4	174.9	-62.4	0	0	0	0	111.1	V716 V774 E778 T779 L780	V716-S776 WeakPolarHBondContact CA-OG 3.07Å; V716-S776 PolarHBondContact O-OG 3.28Å; V774-S776 PolarHBondContact O-N 2.92Å; V774-S776 VanDerWaalsContact O-N 3.16Å; S776-E778 PolarHBondContact O-N 3.13Å; S776-T779 PolarHBondContact O-N 3.08Å; S776-L780 PolarHBondContact O-N 3.06Å
777	N	83.9	Confident	82	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-58.1	-23.4	-177.3	-73.4	-11.4	0	0	0	114.1	P718 D719 Y767 T779 L780 Y781 F787	P718-N777 WeakPolarHBondContact CA-OD1 3.4Å; D719-N777 PolarHBondContact N-OD1 3.32Å; D719-N777 PolarHBondContact OD2-ND2 3.42Å; Y767-N777 HydrophobicContact CE2-CB 4.31Å; Y767-N777 VanDerWaalsContact OH-CB 3.28Å; Y767-N777 WeakPolarHBondContact OH-CB 3.39Å; N777-T779 VanDerWaalsContact C-N 3.31Å; N777-T779 PolarHBondContact O-N 3.21Å; N777-L780 PolarHBondContact O-N 2.62Å; N777-Y781 HydrophobicContact CB-CD2 3.97Å; N777-Y781 HydrophobicContact CB-CE2 4.26Å; N777-Y781 PolarHBondContact O-N 3.25Å; N777-F787 HydrophobicContact CB-CZ 4.42Å
778	E	81.7	Confident	82	Confident	30 Å²	30	69.1 Å²	69.1	14%	0.14	37%	0.371	C	S	.	.	H	α-helix	trans	-57	-42.3	169.6	67.4	-175.3	163.5	0	0	112.5	T766 Y767 S776 G782	T766-E778 VanDerWaalsContact CA-OE2 3.32Å; T766-E778 WeakPolarHBondContact CA-OE2 3.29Å; Y767-E778 WeakPolarHBondContact CB-OE2 3.47Å; Y767-E778 HydrophobicContact CD1-CB 3.94Å; Y767-E778 HydrophobicContact CD2-CB 3.99Å; Y767-E778 HydrophobicContact CD2-CG 4.1Å; Y767-E778 HydrophobicContact CE1-CB 3.84Å; Y767-E778 HydrophobicContact CE2-CB 3.93Å; Y767-E778 HydrophobicContact CE2-CG 4.32Å; Y767-E778 HydrophobicContact CG-CB 4Å; Y767-E778 HydrophobicContact CG-CG 4.32Å; Y767-E778 PolarHBondContact N-OE2 2.88Å; Y767-E778 PolarHBondContact OH-N 3.05Å; S776-E778 PolarHBondContact O-N 3.13Å; E778-G782 WeakPolarHBondContact O-CA 3.5Å; E778-G782 PolarHBondContact O-N 3.49Å
779	T	83.4	Confident	82.4	Confident	93 Å²	93	63.7 Å²	63.7	57%	0.571	35%	0.347	S	S	*	.	H	α-helix	trans	-82.4	-33.7	-177.4	-57.2	0	0	0	0	110.5	D775 S776 N777	D775-T779 HydrophobicContact CB-CG2 4.37Å; S776-T779 PolarHBondContact O-N 3.08Å; N777-T779 VanDerWaalsContact C-N 3.31Å; N777-T779 PolarHBondContact O-N 3.21Å
780	L	82.4	Confident	82.6	Confident	84 Å²	84	61 Å²	61	44%	0.44	34%	0.338	S	S	.	.	H	α-helix	trans	-73.4	-41	-178.9	-63	175.4	0	0	0	112.8	P718 D775 S776 N777	P718-L780 HydrophobicContact CB-CD1 3.85Å; D775-L780 HydrophobicContact CB-CD2 4.36Å; S776-L780 PolarHBondContact O-N 3.06Å; N777-L780 PolarHBondContact O-N 2.62Å
781	Y	83.3	Confident	82.9	Confident	60 Å²	60	57.6 Å²	57.6	24%	0.235	31%	0.314	C	S	.	.	H	α-helix	trans	-112.9	-23.8	-173.7	-57	-63.5	0	0	0	113.9	D719 V725 N777 G783 D784 F787	D719-Y781 HydrophobicContact CB-CE2 3.98Å; D719-Y781 VanDerWaalsContact CB-OH 3.31Å; D719-Y781 WeakPolarHBondContact CB-OH 3.44Å; D719-Y781 WeakPolarHBondContact OD2-CE2 3.43Å; V725-Y781 HydrophobicContact CG1-CD1 4.25Å; V725-Y781 HydrophobicContact CG1-CD2 4.36Å; V725-Y781 HydrophobicContact CG1-CE1 3.55Å; V725-Y781 HydrophobicContact CG1-CE2 3.68Å; V725-Y781 VanDerWaalsContact CG1-OH 3.31Å; V725-Y781 WeakPolarHBondContact CG1-OH 3.36Å; N777-Y781 HydrophobicContact CB-CD2 3.97Å; N777-Y781 HydrophobicContact CB-CE2 4.26Å; N777-Y781 PolarHBondContact O-N 3.25Å; Y781-G783 PolarHBondContact O-N 3.09Å; Y781-D784 VanDerWaalsContact O-CB 3.29Å; Y781-D784 WeakPolarHBondContact O-CB 3.4Å; Y781-D784 PolarHBondContact O-N 3.43Å; Y781-F787 HydrophobicContact CD2-CD1 4.24Å; Y781-F787 HydrophobicContact CD2-CD2 4Å; Y781-F787 HydrophobicContact CD2-CE1 4.11Å; Y781-F787 AromaticContact CD2-CE2 3.84Å; Y781-F787 HydrophobicContact CD2-CE2 3.84Å; Y781-F787 HydrophobicContact CD2-CG 4.18Å; Y781-F787 AromaticContact CD2-CZ 3.9Å; Y781-F787 HydrophobicContact CD2-CZ 3.9Å; Y781-F787 HydrophobicContact CE2-CD2 4.39Å; Y781-F787 HydrophobicContact CE2-CE2 4.09Å; Y781-F787 HydrophobicContact CE2-CZ 4.45Å; Y781-F787 HydrophobicContact CG-CB 4.35Å; Y781-F787 HydrophobicContact CG-CD1 4.17Å; Y781-F787 HydrophobicContact CG-CD2 4.15Å; Y781-F787 HydrophobicContact CG-CE1 4.47Å; Y781-F787 HydrophobicContact CG-CE2 4.44Å; Y781-F787 AromaticContact CG-CG 3.98Å; Y781-F787 HydrophobicContact CG-CG 3.98Å
782	G	68.4	Low	83.3	Confident	51 Å²	51	60.4 Å²	60.4	53%	0.526	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	35.5	168.7	0	0	0	0	0	115.8	E778	E778-G782 WeakPolarHBondContact O-CA 3.5Å; E778-G782 PolarHBondContact O-N 3.49Å
783	G	72.8	Confident	83.9	Confident	25 Å²	25	59.7 Å²	59.7	26%	0.258	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.7	20.9	-176.6	0	0	0	0	0	115.5	Y781 L788	Y781-G783 PolarHBondContact O-N 3.09Å; G783-L788 WeakPolarHBondContact O-CD1 3.32Å
784	D	85.4	Confident	84.5	Confident	63 Å²	63	55.2 Å²	55.2	34%	0.337	31%	0.307	S	S	.	.			trans	-49.6	125.5	177.4	-178.9	-15.5	0	0	0	111.1	Y781 K786 F787 L788	Y781-D784 VanDerWaalsContact O-CB 3.29Å; Y781-D784 WeakPolarHBondContact O-CB 3.4Å; Y781-D784 PolarHBondContact O-N 3.43Å; D784-K786 PolarHBondContact O-N 3.41Å; D784-K786 VanDerWaalsContact O-N 3.09Å; D784-K786 WeakPolarHBondContact OD1-CB 3.46Å; D784-K786 PolarHBondContact OD1-N 3.34Å; D784-F787 HydrophobicContact CB-CB 4.19Å; D784-F787 WeakPolarHBondContact O-CB 3.45Å; D784-F787 PolarHBondContact O-N 3Å; D784-L788 PolarHBondContact O-N 2.92Å
785	P	84.2	Confident	84.8	Confident	103 Å²	103	55.9 Å²	55.9	67%	0.669	31%	0.311	S	S	*	.	H	α-helix	trans	-55.9	-28.2	179.2	22.2	-34.8	0	0	0	113.9	S789	P785-S789 WeakPolarHBondContact O-CB 3.25Å; P785-S789 PolarHBondContact O-N 3.4Å
786	K	85.9	Confident	85.1	Confident	163 Å²	163	57.9 Å²	57.9	71%	0.709	32%	0.317	S	S	*	.	H	α-helix	trans	-69.3	-42.5	174.3	-68.6	179.3	-179.8	173.7	0	111.7	D784 S789 E790	D784-K786 PolarHBondContact O-N 3.41Å; D784-K786 VanDerWaalsContact O-N 3.09Å; D784-K786 WeakPolarHBondContact OD1-CB 3.46Å; D784-K786 PolarHBondContact OD1-N 3.34Å; K786-S789 WeakPolarHBondContact O-CB 3.1Å; K786-S789 PolarHBondContact O-N 2.91Å; K786-E790 PolarHBondContact O-N 3.31Å; K786-E790 VanDerWaalsContact O-N 3.16Å
787	F	86.8	Confident	85.5	Confident	5 Å²	5	61.6 Å²	61.6	2%	0.022	34%	0.34	C	S	.	.	H	α-helix	trans	-65.9	-45	176.6	-179.2	-120.6	0	0	0	111.1	V725 L726 N777 Y781 D784 S789 E790 I791	V725-F787 HydrophobicContact CB-CD2 3.91Å; V725-F787 HydrophobicContact CB-CE2 4.07Å; V725-F787 HydrophobicContact CG1-CD2 3.46Å; V725-F787 VanDerWaalsContact CG1-CD2 3.46Å; V725-F787 HydrophobicContact CG1-CE2 3.76Å; L726-F787 HydrophobicContact CD1-CE2 4.38Å; L726-F787 HydrophobicContact CD2-CE2 3.79Å; L726-F787 HydrophobicContact CD2-CZ 3.94Å; L726-F787 HydrophobicContact CG-CE2 3.86Å; L726-F787 HydrophobicContact CG-CZ 4.49Å; N777-F787 HydrophobicContact CB-CZ 4.42Å; Y781-F787 HydrophobicContact CD2-CD1 4.24Å; Y781-F787 HydrophobicContact CD2-CD2 4Å; Y781-F787 HydrophobicContact CD2-CE1 4.11Å; Y781-F787 AromaticContact CD2-CE2 3.84Å; Y781-F787 HydrophobicContact CD2-CE2 3.84Å; Y781-F787 HydrophobicContact CD2-CG 4.18Å; Y781-F787 AromaticContact CD2-CZ 3.9Å; Y781-F787 HydrophobicContact CD2-CZ 3.9Å; Y781-F787 HydrophobicContact CE2-CD2 4.39Å; Y781-F787 HydrophobicContact CE2-CE2 4.09Å; Y781-F787 HydrophobicContact CE2-CZ 4.45Å; Y781-F787 HydrophobicContact CG-CB 4.35Å; Y781-F787 HydrophobicContact CG-CD1 4.17Å; Y781-F787 HydrophobicContact CG-CD2 4.15Å; Y781-F787 HydrophobicContact CG-CE1 4.47Å; Y781-F787 HydrophobicContact CG-CE2 4.44Å; Y781-F787 AromaticContact CG-CG 3.98Å; Y781-F787 HydrophobicContact CG-CG 3.98Å; D784-F787 HydrophobicContact CB-CB 4.19Å; D784-F787 WeakPolarHBondContact O-CB 3.45Å; D784-F787 PolarHBondContact O-N 3Å; F787-S789 VanDerWaalsContact C-N 3.27Å; F787-S789 PolarHBondContact O-N 3.15Å; F787-E790 PolarHBondContact O-N 3.25Å; F787-E790 VanDerWaalsContact O-N 3.1Å; F787-I791 HydrophobicContact CD1-CD1 3.86Å; F787-I791 HydrophobicContact CE1-CD1 3.52Å; F787-I791 HydrophobicContact CE1-CG1 4.45Å; F787-I791 HydrophobicContact CE2-CD1 4.42Å; F787-I791 HydrophobicContact CG-CD1 4.45Å; F787-I791 HydrophobicContact CZ-CD1 3.84Å; F787-I791 HydrophobicContact CZ-CG1 4.39Å; F787-I791 PolarHBondContact O-N 2.88Å
788	L	87.2	Confident	85.9	Confident	50 Å²	50	61.8 Å²	61.8	26%	0.262	34%	0.341	S	S	.	.	H	α-helix	trans	-60.3	-36	174.1	-65.7	178	0	0	0	112.3	G783 D784 I791 N792	G783-L788 WeakPolarHBondContact O-CD1 3.32Å; D784-L788 PolarHBondContact O-N 2.92Å; L788-I791 HydrophobicContact CD2-CD1 4.5Å; L788-I791 PolarHBondContact O-N 3.36Å; L788-N792 WeakPolarHBondContact O-CB 3.46Å; L788-N792 VanDerWaalsContact O-CG 3.3Å; L788-N792 PolarHBondContact O-N 2.85Å; L788-N792 PolarHBondContact O-ND2 3.37Å
789	S	88.2	Confident	86.3	Confident	53 Å²	53	61.4 Å²	61.4	37%	0.371	34%	0.34	S	S	.	.	H	α-helix	trans	-63	-42.5	174	-174.4	0	0	0	0	112	P785 K786 F787 N792 K793	P785-S789 WeakPolarHBondContact O-CB 3.25Å; P785-S789 PolarHBondContact O-N 3.4Å; K786-S789 WeakPolarHBondContact O-CB 3.1Å; K786-S789 PolarHBondContact O-N 2.91Å; F787-S789 VanDerWaalsContact C-N 3.27Å; F787-S789 PolarHBondContact O-N 3.15Å; S789-N792 PolarHBondContact O-N 2.96Å; S789-K793 WeakPolarHBondContact O-CG 3.36Å; S789-K793 PolarHBondContact O-N 3.19Å
790	E	89.1	Confident	86.7	Confident	46 Å²	46	58.3 Å²	58.3	22%	0.215	33%	0.327	C	S	.	.	H	α-helix	trans	-68.7	-37.4	177.6	-67.2	-60.7	125	0	0	112.6	V725 R730 K786 F787 K793 L794	V725-E790 HydrophobicContact CG2-CG 4.24Å; R730-E790 IonicContact CZ-OE2 2.71Å; R730-E790 IonicContact NH1-OE2 3.14Å; R730-E790 IonicContact NH2-OE2 3.05Å; R730-E790 PolarHBondContact NH2-OE2 3.17Å; K786-E790 PolarHBondContact O-N 3.31Å; K786-E790 VanDerWaalsContact O-N 3.16Å; F787-E790 PolarHBondContact O-N 3.25Å; F787-E790 VanDerWaalsContact O-N 3.1Å; E790-K793 PolarHBondContact O-N 3.13Å; E790-K793 IonicContact OE1-NZ 3.06Å; E790-K793 PolarHBondContact OE1-NZ 3.36Å; E790-L794 PolarHBondContact O-N 3.1Å; E790-L794 VanDerWaalsContact O-N 3.17Å
791	I	89.1	Confident	87.1	Confident	3 Å²	3	57.1 Å²	57.1	2%	0.015	32%	0.319	C	S	.	.	H	α-helix	trans	-60.1	-49.1	171.2	-68.9	173.7	0	0	0	110.1	L726 L759 M762 F787 L788 K793 L794 C795	L726-I791 HydrophobicContact CD1-CG1 3.8Å; L759-I791 HydrophobicContact CB-CG2 4.05Å; L759-I791 HydrophobicContact CD2-CG2 4.5Å; M762-I791 HydrophobicContact CB-CD1 4.07Å; F787-I791 HydrophobicContact CD1-CD1 3.86Å; F787-I791 HydrophobicContact CE1-CD1 3.52Å; F787-I791 HydrophobicContact CE1-CG1 4.45Å; F787-I791 HydrophobicContact CE2-CD1 4.42Å; F787-I791 HydrophobicContact CG-CD1 4.45Å; F787-I791 HydrophobicContact CZ-CD1 3.84Å; F787-I791 HydrophobicContact CZ-CG1 4.39Å; F787-I791 PolarHBondContact O-N 2.88Å; L788-I791 HydrophobicContact CD2-CD1 4.5Å; L788-I791 PolarHBondContact O-N 3.36Å; I791-K793 VanDerWaalsContact C-N 3.35Å; I791-K793 PolarHBondContact O-N 3.26Å; I791-L794 WeakPolarHBondContact O-CB 3.35Å; I791-L794 PolarHBondContact O-N 3.48Å; I791-L794 VanDerWaalsContact O-N 3.15Å; I791-C795 PolarHBondContact O-N 3.48Å; I791-C795 PolarHBondContact O-SG 3.42Å
792	N	88.9	Confident	87.5	Confident	93 Å²	93	54.2 Å²	54.2	50%	0.497	31%	0.307	S	S	.	.	H	α-helix	trans	-61.6	-40.7	-179.1	-78	-42.5	0	0	0	112.3	L788 S789 L794 C795 E796	L788-N792 WeakPolarHBondContact O-CB 3.46Å; L788-N792 VanDerWaalsContact O-CG 3.3Å; L788-N792 PolarHBondContact O-N 2.85Å; L788-N792 PolarHBondContact O-ND2 3.37Å; S789-N792 PolarHBondContact O-N 2.96Å; N792-L794 VanDerWaalsContact C-N 3.33Å; N792-L794 PolarHBondContact O-N 3.38Å; N792-C795 PolarHBondContact O-N 2.87Å; N792-E796 WeakPolarHBondContact O-CG 3.46Å; N792-E796 PolarHBondContact O-N 3.5Å
793	K	90.7	Very high	88.5	Confident	102 Å²	102	54.1 Å²	54.1	44%	0.443	30%	0.295	S	S	.	.	H	α-helix	trans	-60.2	-41.2	174.5	-72.8	172.2	-169.8	171.9	0	112.4	S789 E790 I791 T797	S789-K793 WeakPolarHBondContact O-CG 3.36Å; S789-K793 PolarHBondContact O-N 3.19Å; E790-K793 PolarHBondContact O-N 3.13Å; E790-K793 IonicContact OE1-NZ 3.06Å; E790-K793 PolarHBondContact OE1-NZ 3.36Å; I791-K793 VanDerWaalsContact C-N 3.35Å; I791-K793 PolarHBondContact O-N 3.26Å; K793-T797 PolarHBondContact O-N 2.86Å; K793-T797 PolarHBondContact O-OG1 2.8Å
794	L	90.6	Very high	89.3	Confident	25 Å²	25	57.1 Å²	57.1	13%	0.131	31%	0.305	C	S	.	.	H	α-helix	trans	-65.6	-45.5	175.1	-84.8	162.4	0	0	0	111.4	L726 R730 L733 L759 E790 I791 N792 E796 T797 L798	L726-L794 HydrophobicContact CB-CD1 4.27Å; L726-L794 HydrophobicContact CD1-CD1 3.48Å; L726-L794 VanDerWaalsContact CD1-CD1 3.48Å; R730-L794 HydrophobicContact CG-CD1 4.19Å; R730-L794 HydrophobicContact CG-CD2 4.31Å; L733-L794 HydrophobicContact CD1-CD2 4.28Å; L759-L794 HydrophobicContact CD1-CB 4.09Å; E790-L794 PolarHBondContact O-N 3.1Å; E790-L794 VanDerWaalsContact O-N 3.17Å; I791-L794 WeakPolarHBondContact O-CB 3.35Å; I791-L794 PolarHBondContact O-N 3.48Å; I791-L794 VanDerWaalsContact O-N 3.15Å; N792-L794 VanDerWaalsContact C-N 3.33Å; N792-L794 PolarHBondContact O-N 3.38Å; L794-E796 PolarHBondContact O-N 3.01Å; L794-T797 PolarHBondContact O-N 3.08Å; L794-L798 WeakPolarHBondContact O-CG 3.39Å; L794-L798 PolarHBondContact O-N 2.88Å
795	C	90.5	Very high	89.4	Confident	23 Å²	23	56.3 Å²	56.3	16%	0.155	30%	0.299	C	S	.	.	H	α-helix	trans	-57.2	-46.2	174.4	-71.7	0	0	0	0	112.1	L756 I791 N792 T797 L798 I799	L756-C795 HydrophobicContact CD2-CB 4.22Å; I791-C795 PolarHBondContact O-N 3.48Å; I791-C795 PolarHBondContact O-SG 3.42Å; N792-C795 PolarHBondContact O-N 2.87Å; C795-T797 VanDerWaalsContact C-N 3.33Å; C795-T797 PolarHBondContact O-N 3.49Å; C795-L798 PolarHBondContact O-N 3.42Å; C795-I799 WeakPolarHBondContact O-CB 3.46Å; C795-I799 WeakPolarHBondContact O-CG1 3.18Å; C795-I799 PolarHBondContact O-N 3.34Å
796	E	90.6	Very high	89.6	Confident	142 Å²	142	51.5 Å²	51.5	66%	0.664	27%	0.268	S	S	*	.	H	α-helix	trans	-59.8	-42.7	176.7	-75.5	-179.8	176.1	0	0	111.9	N792 L794 G800	N792-E796 WeakPolarHBondContact O-CG 3.46Å; N792-E796 PolarHBondContact O-N 3.5Å; L794-E796 PolarHBondContact O-N 3.01Å; E796-G800 PolarHBondContact O-N 3.48Å
797	T	92.6	Very high	89.6	Confident	78 Å²	78	50.1 Å²	50.1	48%	0.479	26%	0.261	S	S	.	.	H	α-helix	trans	-63.9	-47.4	177.7	-55.3	0	0	0	0	111.4	K793 L794 C795 G800 Q801	K793-T797 PolarHBondContact O-N 2.86Å; K793-T797 PolarHBondContact O-OG1 2.8Å; L794-T797 PolarHBondContact O-N 3.08Å; C795-T797 VanDerWaalsContact C-N 3.33Å; C795-T797 PolarHBondContact O-N 3.49Å; T797-G800 PolarHBondContact O-N 3.11Å; T797-Q801 WeakPolarHBondContact O-CG 3.34Å; T797-Q801 PolarHBondContact O-N 3Å
798	L	92.3	Very high	89.5	Confident	6 Å²	6	53.7 Å²	53.7	3%	0.031	28%	0.284	C	S	.	.	H	α-helix	trans	-65.1	-45.8	179.4	-68.8	179.4	0	0	0	111.8	L733 Y752 A755 L756 L759 L794 C795 G800 Q801 I802	L733-L798 HydrophobicContact CD1-CD1 4.14Å; L733-L798 HydrophobicContact CD1-CD2 4.21Å; L733-L798 HydrophobicContact CD2-CD2 4.17Å; Y752-L798 HydrophobicContact CD1-CD2 3.65Å; Y752-L798 HydrophobicContact CE1-CD2 4.06Å; Y752-L798 HydrophobicContact CG-CD2 3.91Å; A755-L798 HydrophobicContact CB-CD1 4Å; L756-L798 HydrophobicContact CD2-CB 4.27Å; L756-L798 HydrophobicContact CD2-CD1 4.38Å; L759-L798 HydrophobicContact CD1-CD1 3.78Å; L794-L798 WeakPolarHBondContact O-CG 3.39Å; L794-L798 PolarHBondContact O-N 2.88Å; C795-L798 PolarHBondContact O-N 3.42Å; L798-G800 VanDerWaalsContact C-N 3.3Å; L798-G800 PolarHBondContact O-N 3.46Å; L798-Q801 PolarHBondContact O-N 3.45Å; L798-I802 WeakPolarHBondContact O-CD1 3.46Å; L798-I802 WeakPolarHBondContact O-CG1 3.41Å; L798-I802 PolarHBondContact O-N 2.85Å
799	I	90.9	Very high	89.3	Confident	22 Å²	22	51.6 Å²	51.6	11%	0.113	27%	0.273	C	S	.	.	H	α-helix	trans	-60.1	-43.1	175.7	-69.1	168.4	0	0	0	110.1	L756 C795 Q801 I802 L803 L830 L844	L756-I799 HydrophobicContact CD1-CG1 4.12Å; L756-I799 HydrophobicContact CD2-CD1 4.5Å; L756-I799 HydrophobicContact CD2-CG1 4.15Å; C795-I799 WeakPolarHBondContact O-CB 3.46Å; C795-I799 WeakPolarHBondContact O-CG1 3.18Å; C795-I799 PolarHBondContact O-N 3.34Å; I799-Q801 PolarHBondContact O-N 3.05Å; I799-I802 PolarHBondContact O-N 3.15Å; I799-L803 HydrophobicContact CG2-CD1 3.89Å; I799-L803 HydrophobicContact CG2-CG 4.24Å; I799-L803 WeakPolarHBondContact O-CB 3.45Å; I799-L803 VanDerWaalsContact O-CG 3.26Å; I799-L803 WeakPolarHBondContact O-CG 3.5Å; I799-L803 PolarHBondContact O-N 3.32Å; I799-L830 HydrophobicContact CD1-CD2 4.31Å; I799-L844 HydrophobicContact CG2-CD2 3.83Å
800	G	91	Very high	88.7	Confident	28 Å²	28	52.6 Å²	52.6	29%	0.289	28%	0.277	S	S	.	.	H	α-helix	trans	-55.5	-50.2	174.7	0	0	0	0	0	112.5	E796 T797 L798 I802 L803 D804	E796-G800 PolarHBondContact O-N 3.48Å; T797-G800 PolarHBondContact O-N 3.11Å; L798-G800 VanDerWaalsContact C-N 3.3Å; L798-G800 PolarHBondContact O-N 3.46Å; G800-I802 PolarHBondContact O-N 3.28Å; G800-L803 PolarHBondContact O-N 3.03Å; G800-D804 PolarHBondContact O-N 3.26Å
801	Q	90.3	Very high	87.9	Confident	58 Å²	58	61 Å²	61	27%	0.271	31%	0.306	S	S	.	.	H	α-helix	trans	-63.5	-38.9	178.1	-68.8	-171.9	18.6	0	0	112.8	Y752 T797 L798 I799 D804 H805	Y752-Q801 HydrophobicContact CD2-CB 4.26Å; Y752-Q801 HydrophobicContact CE2-CB 4.03Å; Y752-Q801 PolarHBondContact OH-OE1 2.99Å; T797-Q801 WeakPolarHBondContact O-CG 3.34Å; T797-Q801 PolarHBondContact O-N 3Å; L798-Q801 PolarHBondContact O-N 3.45Å; I799-Q801 PolarHBondContact O-N 3.05Å; Q801-D804 PolarHBondContact O-N 2.9Å; Q801-H805 PolarHBondContact O-N 3.42Å; Q801-H805 VanDerWaalsContact O-N 3.12Å
802	I	91.4	Very high	87.4	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-63.3	-45.1	175.6	-64.1	158.9	0	0	0	110.3	V749 Y752 I753 L756 L798 I799 G800 D804 H805 L806 L826	V749-I802 HydrophobicContact CG1-CB 4.26Å; V749-I802 HydrophobicContact CG1-CG1 4.04Å; V749-I802 HydrophobicContact CG1-CG2 3.8Å; Y752-I802 HydrophobicContact CD2-CG1 4.45Å; I753-I802 HydrophobicContact CD1-CG2 4.49Å; I753-I802 HydrophobicContact CG1-CD1 3.8Å; I753-I802 HydrophobicContact CG1-CG1 4.29Å; I753-I802 HydrophobicContact CG1-CG2 4.41Å; L756-I802 HydrophobicContact CD1-CD1 4.06Å; L798-I802 WeakPolarHBondContact O-CD1 3.46Å; L798-I802 WeakPolarHBondContact O-CG1 3.41Å; L798-I802 PolarHBondContact O-N 2.85Å; I799-I802 PolarHBondContact O-N 3.15Å; G800-I802 PolarHBondContact O-N 3.28Å; I802-D804 VanDerWaalsContact C-N 3.34Å; I802-D804 PolarHBondContact O-N 3.21Å; I802-H805 PolarHBondContact O-N 3.35Å; I802-L806 HydrophobicContact CG2-CD1 4.27Å; I802-L806 WeakPolarHBondContact O-CG 3.31Å; I802-L806 PolarHBondContact O-N 3Å; I802-L826 HydrophobicContact CD1-CD1 4.21Å; I802-L826 HydrophobicContact CG2-CD2 3.78Å
803	L	90.5	Very high	86.7	Confident	49 Å²	49	65 Å²	65	26%	0.257	33%	0.325	S	S	.	.	H	α-helix	trans	-65.1	-37.4	179	-69.4	175.5	0	0	0	112.3	I799 G800 L806 K807 L844 L848	I799-L803 HydrophobicContact CG2-CD1 3.89Å; I799-L803 HydrophobicContact CG2-CG 4.24Å; I799-L803 WeakPolarHBondContact O-CB 3.45Å; I799-L803 VanDerWaalsContact O-CG 3.26Å; I799-L803 WeakPolarHBondContact O-CG 3.5Å; I799-L803 PolarHBondContact O-N 3.32Å; G800-L803 PolarHBondContact O-N 3.03Å; L803-L806 HydrophobicContact CD2-CD1 4.27Å; L803-L806 PolarHBondContact O-N 3.34Å; L803-K807 WeakPolarHBondContact O-CG 3.4Å; L803-K807 PolarHBondContact O-N 2.93Å; L803-K807 VanDerWaalsContact O-N 3.1Å; L803-L844 HydrophobicContact CD1-CD1 4.04Å; L803-L844 HydrophobicContact CD2-CD1 4.1Å; L803-L848 HydrophobicContact CD2-CD2 4.14Å
804	D	89.8	Confident	86	Confident	88 Å²	88	67 Å²	67	47%	0.471	34%	0.335	S	S	.	.	H	α-helix	trans	-66.5	-37.9	176.5	-73.4	-22.3	0	0	0	112.1	G800 Q801 I802 K807 T808	G800-D804 PolarHBondContact O-N 3.26Å; Q801-D804 PolarHBondContact O-N 2.9Å; I802-D804 VanDerWaalsContact C-N 3.34Å; I802-D804 PolarHBondContact O-N 3.21Å; D804-K807 WeakPolarHBondContact O-CB 3.45Å; D804-K807 PolarHBondContact O-N 3.4Å; D804-K807 IonicContact OD1-NZ 3.36Å; D804-K807 PolarHBondContact OD1-NZ 3.4Å; D804-T808 PolarHBondContact O-N 3.34Å
805	H	87.9	Confident	85.5	Confident	45 Å²	45	66 Å²	66	21%	0.208	33%	0.33	C	S	.	.	H	α-helix	trans	-66.6	-40.7	170.8	-172.3	78.9	0	0	0	112.5	D746 V749 Q801 I802 K807 T808 L809	D746-H805 IonicContact OD1-NE2 3.53Å; D746-H805 PolarHBondContact OD1-NE2 3.12Å; D746-H805 VanDerWaalsContact OD1-NE2 3.1Å; V749-H805 HydrophobicContact CG2-CB 3.63Å; V749-H805 VanDerWaalsContact CG2-CD2 3.48Å; V749-H805 WeakPolarHBondContact CG2-CD2 3.42Å; V749-H805 VanDerWaalsContact CG2-CG 3.48Å; Q801-H805 PolarHBondContact O-N 3.42Å; Q801-H805 VanDerWaalsContact O-N 3.12Å; I802-H805 PolarHBondContact O-N 3.35Å; H805-K807 PolarHBondContact O-N 3.38Å; H805-T808 PolarHBondContact O-N 3.07Å; H805-T808 PolarHBondContact O-OG1 2.6Å; H805-L809 PolarHBondContact O-N 3.02Å
806	L	86.6	Confident	85.1	Confident	3 Å²	3	67.1 Å²	67.1	2%	0.016	33%	0.334	C	S	.	.	H	α-helix	trans	-59	-32.3	175.3	-72.3	173.6	0	0	0	112	I802 L803 T808 Q819 L822 A823 L848 L851	I802-L806 HydrophobicContact CG2-CD1 4.27Å; I802-L806 WeakPolarHBondContact O-CG 3.31Å; I802-L806 PolarHBondContact O-N 3Å; L803-L806 HydrophobicContact CD2-CD1 4.27Å; L803-L806 PolarHBondContact O-N 3.34Å; L806-T808 VanDerWaalsContact C-N 3.34Å; L806-Q819 HydrophobicContact CD2-CG 3.93Å; L806-Q819 PolarHBondContact O-NE2 3.02Å; L806-L822 HydrophobicContact CD2-CB 3.73Å; L806-L822 HydrophobicContact CD2-CD1 4.43Å; L806-A823 HydrophobicContact CD1-CB 4.37Å; L806-A823 HydrophobicContact CD2-CB 4.45Å; L806-L848 HydrophobicContact CD1-CD2 4.04Å; L806-L851 HydrophobicContact CD1-CD2 4.48Å
807	K	86.9	Confident	84.7	Confident	133 Å²	133	67 Å²	67	58%	0.578	33%	0.327	S	S	*	.	H	α-helix	trans	-68.4	-29.3	175.6	-68.6	169	-165.4	159.4	0	113.1	L803 D804 H805	L803-K807 WeakPolarHBondContact O-CG 3.4Å; L803-K807 PolarHBondContact O-N 2.93Å; L803-K807 VanDerWaalsContact O-N 3.1Å; D804-K807 WeakPolarHBondContact O-CB 3.45Å; D804-K807 PolarHBondContact O-N 3.4Å; D804-K807 IonicContact OD1-NZ 3.36Å; D804-K807 PolarHBondContact OD1-NZ 3.4Å; H805-K807 PolarHBondContact O-N 3.38Å
808	T	84.9	Confident	84.3	Confident	81 Å²	81	65.5 Å²	65.5	50%	0.497	31%	0.313	S	S	.	.	H	α-helix	trans	-78.1	-24.3	-179	64.6	0	0	0	0	112.5	D804 H805 L806 T810	D804-T808 PolarHBondContact O-N 3.34Å; H805-T808 PolarHBondContact O-N 3.07Å; H805-T808 PolarHBondContact O-OG1 2.6Å; L806-T808 VanDerWaalsContact C-N 3.34Å; T808-T810 PolarHBondContact O-N 3.14Å; T808-T810 VanDerWaalsContact O-N 3.13Å
809	L	82.2	Confident	84.1	Confident	5 Å²	5	65.5 Å²	65.5	3%	0.026	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	20.6	-176.3	-66.8	176.2	0	0	0	115.5	H805 S815 R818 Q819 L822	H805-L809 PolarHBondContact O-N 3.02Å; L809-S815 CarbonylContact O-C 3.52Å; L809-S815 WeakPolarHBondContact O-CB 3.44Å; L809-R818 HydrophobicContact CD1-CB 4.43Å; L809-Q819 HydrophobicContact CB-CB 3.93Å; L809-Q819 HydrophobicContact CB-CG 4.41Å; L809-Q819 HydrophobicContact CD1-CB 4.39Å; L809-L822 HydrophobicContact CD1-CD1 3.87Å
810	T	76.6	Confident	83.8	Confident	75 Å²	75	64.7 Å²	64.7	46%	0.46	31%	0.309	S	S	.	.			trans	-94.6	6.1	-175.6	59.8	0	0	0	0	114.9	T808 M816 Q819	T808-T810 PolarHBondContact O-N 3.14Å; T808-T810 VanDerWaalsContact O-N 3.13Å; T810-M816 WeakPolarHBondContact O-CE 3.35Å; T810-Q819 VanDerWaalsContact CG2-NE2 3.33Å
811	R	72.1	Confident	83.7	Confident	221 Å²	221	66 Å²	66	83%	0.834	32%	0.317	S	S	*	.	S	Bend	trans	-87.8	-36.5	-163.2	-66.1	-176.8	174.8	-174.3	-1	114.9
812	D	77.8	Confident	83.6	Confident	67 Å²	67	63.4 Å²	63.4	36%	0.358	31%	0.305	S	S	.	.	S	Bend	trans	-139.9	160.2	-173.6	61.5	-73.8	0	0	0	111.5	Q814 S815 M816	D812-Q814 PolarHBondContact O-N 3.48Å; D812-Q814 WeakPolarHBondContact OD2-CB 3.49Å; D812-Q814 PolarHBondContact OD2-N 2.84Å; D812-S815 CarbonylContact O-C 3.33Å; D812-S815 PolarHBondContact O-N 3.47Å; D812-S815 VanDerWaalsContact O-N 3.09Å; D812-S815 WeakPolarHBondContact OD1-CB 3.41Å; D812-S815 PolarHBondContact OD1-OG 3.5Å; D812-S815 PolarHBondContact OD2-N 2.98Å; D812-S815 PolarHBondContact OD2-OG 2.89Å; D812-M816 WeakPolarHBondContact O-CG 3.36Å; D812-M816 PolarHBondContact O-N 3.3Å
813	E	73.9	Confident	83.4	Confident	115 Å²	115	63.4 Å²	63.4	54%	0.537	31%	0.305	S	S	.	.	H	α-helix	trans	-58.8	-35.9	-175.4	-164.3	-169.6	151.9	0	0	112.4	M816 R817 H857	E813-M816 PolarHBondContact O-N 2.92Å; E813-R817 WeakPolarHBondContact O-CG 3.43Å; E813-R817 PolarHBondContact O-N 3.33Å; E813-R817 IonicContact OE1-CZ 2.67Å; E813-R817 IonicContact OE1-NE 2.76Å; E813-R817 IonicContact OE1-NH2 3.7Å; E813-R817 PolarHBondContact OE1-NH2 3.34Å; E813-H857 IonicContact OE1-CE1 3.86Å
814	Q	76.4	Confident	83.3	Confident	143 Å²	143	62.8 Å²	62.8	67%	0.668	30%	0.3	S	S	*	.	H	α-helix	trans	-71	-38.4	177.8	-171.8	163.6	-10.5	0	0	111.4	D812 R817 R818	D812-Q814 PolarHBondContact O-N 3.48Å; D812-Q814 WeakPolarHBondContact OD2-CB 3.49Å; D812-Q814 PolarHBondContact OD2-N 2.84Å; Q814-R817 PolarHBondContact O-N 3.38Å; Q814-R818 WeakPolarHBondContact O-CG 3.44Å; Q814-R818 PolarHBondContact O-N 2.99Å; Q814-R818 VanDerWaalsContact O-N 3.15Å
815	S	80.3	Confident	83.2	Confident	4 Å²	4	61.3 Å²	61.3	3%	0.028	30%	0.297	C	S	.	.	H	α-helix	trans	-65.5	-36	169.5	-61.9	0	0	0	0	113.4	L809 D812 R817 R818 Q819	L809-S815 CarbonylContact O-C 3.52Å; L809-S815 WeakPolarHBondContact O-CB 3.44Å; D812-S815 CarbonylContact O-C 3.33Å; D812-S815 PolarHBondContact O-N 3.47Å; D812-S815 VanDerWaalsContact O-N 3.09Å; D812-S815 WeakPolarHBondContact OD1-CB 3.41Å; D812-S815 PolarHBondContact OD1-OG 3.5Å; D812-S815 PolarHBondContact OD2-N 2.98Å; D812-S815 PolarHBondContact OD2-OG 2.89Å; S815-R817 VanDerWaalsContact C-N 3.35Å; S815-R817 PolarHBondContact O-N 3.32Å; S815-R818 PolarHBondContact O-N 3.27Å; S815-R818 PolarHBondContact OG-NH2 3.31Å; S815-Q819 WeakPolarHBondContact O-CB 3.4Å; S815-Q819 PolarHBondContact O-N 3.18Å
816	M	81.6	Confident	83.3	Confident	47 Å²	47	59.1 Å²	59.1	23%	0.232	29%	0.287	C	S	.	.	H	α-helix	trans	-65	-36.9	174.7	-69.5	179.4	-178	0	0	112.4	T810 D812 E813 S820	T810-M816 WeakPolarHBondContact O-CE 3.35Å; D812-M816 WeakPolarHBondContact O-CG 3.36Å; D812-M816 PolarHBondContact O-N 3.3Å; E813-M816 PolarHBondContact O-N 2.92Å; M816-S820 WeakPolarHBondContact O-CB 3.3Å; M816-S820 PolarHBondContact O-N 3.46Å
817	R	83.2	Confident	83.4	Confident	139 Å²	139	59.1 Å²	59.1	53%	0.525	29%	0.287	S	S	.	.	H	α-helix	trans	-62.9	-44.8	171.5	-71.5	177.7	-170.2	-169.4	6.1	111.8	E813 Q814 S815 S820 A821 H857	E813-R817 WeakPolarHBondContact O-CG 3.43Å; E813-R817 PolarHBondContact O-N 3.33Å; E813-R817 IonicContact OE1-CZ 2.67Å; E813-R817 IonicContact OE1-NE 2.76Å; E813-R817 IonicContact OE1-NH2 3.7Å; E813-R817 PolarHBondContact OE1-NH2 3.34Å; Q814-R817 PolarHBondContact O-N 3.38Å; S815-R817 VanDerWaalsContact C-N 3.35Å; S815-R817 PolarHBondContact O-N 3.32Å; R817-S820 WeakPolarHBondContact O-CB 3.45Å; R817-S820 PolarHBondContact O-N 3.23Å; R817-A821 PolarHBondContact O-N 3.48Å; R817-H857 HydrophobicContact CB-CB 4.45Å; R817-H857 HydrophobicContact CG-CB 3.88Å; R817-H857 VanDerWaalsContact CG-CG 3.42Å
818	R	84.3	Confident	83.4	Confident	46 Å²	46	54.3 Å²	54.3	17%	0.174	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-43.3	177.2	-68.4	-177.9	-64.8	162.7	1.7	112.3	N744 D746 L809 Q814 S815 S820 A821 L822	N744-R818 PolarHBondContact O-NH1 3.48Å; N744-R818 PolarHBondContact OD1-NH2 3.16Å; D746-R818 VanDerWaalsContact OD2-CD 3.31Å; D746-R818 WeakPolarHBondContact OD2-CD 3.33Å; L809-R818 HydrophobicContact CD1-CB 4.43Å; Q814-R818 WeakPolarHBondContact O-CG 3.44Å; Q814-R818 PolarHBondContact O-N 2.99Å; Q814-R818 VanDerWaalsContact O-N 3.15Å; S815-R818 PolarHBondContact O-N 3.27Å; S815-R818 PolarHBondContact OG-NH2 3.31Å; R818-S820 VanDerWaalsContact C-N 3.32Å; R818-S820 PolarHBondContact O-N 3.1Å; R818-A821 PolarHBondContact O-N 3.49Å; R818-L822 WeakPolarHBondContact O-CG 3.29Å; R818-L822 PolarHBondContact O-N 3.5Å
819	Q	88.1	Confident	83.5	Confident	7 Å²	7	51.5 Å²	51.5	3%	0.033	26%	0.257	C	S	.	.	H	α-helix	trans	-57.5	-45.6	174	-172.1	-171.5	52.5	0	0	111.3	L806 L809 T810 S815 A823 L851	L806-Q819 HydrophobicContact CD2-CG 3.93Å; L806-Q819 PolarHBondContact O-NE2 3.02Å; L809-Q819 HydrophobicContact CB-CB 3.93Å; L809-Q819 HydrophobicContact CB-CG 4.41Å; L809-Q819 HydrophobicContact CD1-CB 4.39Å; T810-Q819 VanDerWaalsContact CG2-NE2 3.33Å; S815-Q819 WeakPolarHBondContact O-CB 3.4Å; S815-Q819 PolarHBondContact O-N 3.18Å; Q819-A823 WeakPolarHBondContact O-CB 3.48Å; Q819-A823 PolarHBondContact O-N 3.29Å; Q819-L851 HydrophobicContact CG-CD2 4.43Å
820	S	85.2	Confident	83.7	Confident	5 Å²	5	51.8 Å²	51.8	4%	0.035	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-47.1	177.6	172.7	0	0	0	0	111.8	M816 R817 R818 F824 S852 S858	M816-S820 WeakPolarHBondContact O-CB 3.3Å; M816-S820 PolarHBondContact O-N 3.46Å; R817-S820 WeakPolarHBondContact O-CB 3.45Å; R817-S820 PolarHBondContact O-N 3.23Å; R818-S820 VanDerWaalsContact C-N 3.32Å; R818-S820 PolarHBondContact O-N 3.1Å; S820-F824 WeakPolarHBondContact O-CB 3.33Å; S820-F824 PolarHBondContact O-N 3.44Å; S820-S852 WeakPolarHBondContact CB-O 3.12Å; S820-S852 WeakPolarHBondContact O-CB 3.27Å; S820-S852 PolarHBondContact OG-O 3.23Å; S820-S858 PolarHBondContact OG-N 2.94Å
821	A	87.3	Confident	84.1	Confident	54 Å²	54	49.5 Å²	49.5	45%	0.446	24%	0.244	S	C	.	.	H	α-helix	trans	-64.8	-44.9	179.3	0	0	0	0	0	113.1	R817 R818 F824 S825	R817-A821 PolarHBondContact O-N 3.48Å; R818-A821 PolarHBondContact O-N 3.49Å; A821-F824 PolarHBondContact O-N 3.41Å; A821-S825 WeakPolarHBondContact O-CB 3.15Å; A821-S825 PolarHBondContact O-N 3.27Å
822	L	88.1	Confident	84.6	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-68.1	-40.8	178.8	-71.3	175.8	0	0	0	112.3	D746 V749 R750 I753 L806 L809 R818 F824 S825 L826	D746-L822 HydrophobicContact CB-CD1 4.05Å; D746-L822 HydrophobicContact CB-CD2 4.38Å; V749-L822 HydrophobicContact CG1-CD1 4.28Å; V749-L822 HydrophobicContact CG1-CD2 4.42Å; R750-L822 HydrophobicContact CG-CD2 3.91Å; I753-L822 HydrophobicContact CD1-CD2 4.11Å; L806-L822 HydrophobicContact CD2-CB 3.73Å; L806-L822 HydrophobicContact CD2-CD1 4.43Å; L809-L822 HydrophobicContact CD1-CD1 3.87Å; R818-L822 WeakPolarHBondContact O-CG 3.29Å; R818-L822 PolarHBondContact O-N 3.5Å; L822-F824 VanDerWaalsContact C-N 3.32Å; L822-F824 PolarHBondContact O-N 2.94Å; L822-S825 PolarHBondContact O-N 3.43Å; L822-L826 PolarHBondContact O-N 3.38Å
823	A	88.3	Confident	84.9	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-40.2	175.5	0	0	0	0	0	111.5	L806 Q819 F827 L848 L851	L806-A823 HydrophobicContact CD1-CB 4.37Å; L806-A823 HydrophobicContact CD2-CB 4.45Å; Q819-A823 WeakPolarHBondContact O-CB 3.48Å; Q819-A823 PolarHBondContact O-N 3.29Å; A823-F827 WeakPolarHBondContact O-CB 3.42Å; A823-F827 PolarHBondContact O-N 2.95Å; A823-L848 HydrophobicContact CB-CD2 4.22Å; A823-L851 HydrophobicContact CB-CB 4.46Å; A823-L851 HydrophobicContact CB-CD2 4.11Å; A823-L851 HydrophobicContact CB-CG 4.3Å
824	F	87.9	Confident	85.2	Confident	37 Å²	37	39.3 Å²	39.3	16%	0.162	22%	0.222	C	C	.	.	H	α-helix	trans	-67.4	-39.2	175.4	-166.3	-96.7	0	0	0	112.4	S820 A821 L822 F827 G828 W849 V862	S820-F824 WeakPolarHBondContact O-CB 3.33Å; S820-F824 PolarHBondContact O-N 3.44Å; A821-F824 PolarHBondContact O-N 3.41Å; L822-F824 VanDerWaalsContact C-N 3.32Å; L822-F824 PolarHBondContact O-N 2.94Å; F824-F827 WeakPolarHBondContact O-CB 3.39Å; F824-F827 PolarHBondContact O-N 3.27Å; F824-G828 PolarHBondContact O-N 3.37Å; F824-W849 HydrophobicContact CD2-CZ3 4.42Å; F824-W849 HydrophobicContact CE2-CE3 4.16Å; F824-W849 HydrophobicContact CE2-CH2 4.33Å; F824-W849 AromaticContact CE2-CZ3 3.61Å; F824-W849 HydrophobicContact CE2-CZ3 3.61Å; F824-W849 HydrophobicContact CZ-CZ3 4.41Å; F824-V862 HydrophobicContact CE1-CG1 3.75Å; F824-V862 HydrophobicContact CZ-CG1 3.95Å
825	S	88.1	Confident	85.4	Confident	56 Å²	56	36.9 Å²	36.9	39%	0.392	21%	0.213	S	C	.	.	H	α-helix	trans	-62.8	-48.2	175.3	-174.2	0	0	0	0	112	A821 L822 F827 G828 V829	A821-S825 WeakPolarHBondContact O-CB 3.15Å; A821-S825 PolarHBondContact O-N 3.27Å; L822-S825 PolarHBondContact O-N 3.43Å; S825-F827 VanDerWaalsContact C-N 3.34Å; S825-F827 PolarHBondContact O-N 3.03Å; S825-G828 PolarHBondContact O-N 3.11Å; S825-G828 VanDerWaalsContact O-N 3.14Å; S825-V829 PolarHBondContact O-N 3.39Å
826	L	89.5	Confident	85.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.1	-41.1	175.5	-180	61.7	0	0	0	111.6	I753 L756 I802 L822 G828 V829 L830 L848	I753-L826 HydrophobicContact CD1-CB 4.41Å; L756-L826 HydrophobicContact CD1-CD1 3.55Å; I802-L826 HydrophobicContact CD1-CD1 4.21Å; I802-L826 HydrophobicContact CG2-CD2 3.78Å; L822-L826 PolarHBondContact O-N 3.38Å; L826-G828 VanDerWaalsContact C-N 3.32Å; L826-G828 PolarHBondContact O-N 2.8Å; L826-V829 PolarHBondContact O-N 3.16Å; L826-L830 HydrophobicContact CD1-CG 4.32Å; L826-L830 HydrophobicContact CG-CD1 4.24Å; L826-L830 HydrophobicContact CG-CG 4.48Å; L826-L830 WeakPolarHBondContact O-CG 3.31Å; L826-L830 PolarHBondContact O-N 3Å; L826-L848 HydrophobicContact CB-CD1 4.28Å; L826-L848 HydrophobicContact CD2-CD1 3.61Å; L826-L848 HydrophobicContact CD2-CD2 4.01Å; L826-L848 HydrophobicContact CD2-CG 4.48Å; L826-L848 HydrophobicContact CG-CD1 3.71Å
827	F	88.8	Confident	84.9	Confident	3 Å²	3	41.4 Å²	41.4	1%	0.013	23%	0.231	C	C	.	.	H	α-helix	trans	-57.6	-45.4	172.8	170.6	-98	0	0	0	111.7	A823 F824 S825 V829 L830 L831 S845 L848 W849 T866 I870 L889	A823-F827 WeakPolarHBondContact O-CB 3.42Å; A823-F827 PolarHBondContact O-N 2.95Å; F824-F827 WeakPolarHBondContact O-CB 3.39Å; F824-F827 PolarHBondContact O-N 3.27Å; S825-F827 VanDerWaalsContact C-N 3.34Å; S825-F827 PolarHBondContact O-N 3.03Å; F827-V829 VanDerWaalsContact C-N 3.33Å; F827-V829 PolarHBondContact O-N 2.88Å; F827-L830 PolarHBondContact O-N 3.2Å; F827-L831 HydrophobicContact CE1-CD2 4.15Å; F827-L831 HydrophobicContact CZ-CD2 4.39Å; F827-L831 VanDerWaalsContact O-CB 3.27Å; F827-L831 WeakPolarHBondContact O-CB 3.28Å; F827-L831 PolarHBondContact O-N 3.37Å; F827-S845 VanDerWaalsContact CD2-O 3.22Å; F827-S845 WeakPolarHBondContact CD2-O 3.34Å; F827-L848 HydrophobicContact CB-CB 4.15Å; F827-W849 AromaticContact CD1-CE3 3.78Å; F827-W849 HydrophobicContact CD1-CE3 3.78Å; F827-W849 HydrophobicContact CD1-CZ3 4.22Å; F827-W849 HydrophobicContact CD2-CB 4.22Å; F827-W849 AromaticContact CE1-CE3 3.38Å; F827-W849 HydrophobicContact CE1-CE3 3.38Å; F827-W849 AromaticContact CE1-CZ3 3.66Å; F827-W849 HydrophobicContact CE1-CZ3 3.66Å; F827-W849 HydrophobicContact CE2-CB 4.17Å; F827-W849 HydrophobicContact CE2-CE3 4.27Å; F827-W849 HydrophobicContact CG-CE3 4.38Å; F827-W849 HydrophobicContact CZ-CD2 4.45Å; F827-W849 AromaticContact CZ-CE3 3.65Å; F827-W849 HydrophobicContact CZ-CE3 3.65Å; F827-W849 HydrophobicContact CZ-CZ3 4.19Å; F827-T866 HydrophobicContact CE1-CG2 4.12Å; F827-I870 HydrophobicContact CE1-CD1 4.35Å; F827-I870 HydrophobicContact CZ-CD1 4.05Å; F827-L889 HydrophobicContact CE2-CD1 4.5Å; F827-L889 HydrophobicContact CE2-CD2 4.1Å; F827-L889 HydrophobicContact CZ-CD1 4.18Å; F827-L889 HydrophobicContact CZ-CD2 4.3Å
828	G	86.7	Confident	84.7	Confident	32 Å²	32	38.3 Å²	38.3	33%	0.33	23%	0.226	S	C	.	.	H	α-helix	trans	-59	-42.6	177	0	0	0	0	0	112.9	F824 S825 L826 L831 A832	F824-G828 PolarHBondContact O-N 3.37Å; S825-G828 PolarHBondContact O-N 3.11Å; S825-G828 VanDerWaalsContact O-N 3.14Å; L826-G828 VanDerWaalsContact C-N 3.32Å; L826-G828 PolarHBondContact O-N 2.8Å; G828-L831 PolarHBondContact O-N 3.12Å; G828-A832 WeakPolarHBondContact O-CB 3.31Å; G828-A832 PolarHBondContact O-N 2.91Å
829	V	87.7	Confident	84.4	Confident	22 Å²	22	42 Å²	42	13%	0.133	25%	0.249	C	C	.	.	H	α-helix	trans	-65.4	-46.4	176.2	170.5	0	0	0	0	111.8	I753 L756 P757 S825 L826 F827 L831 A832 H833	I753-V829 HydrophobicContact CG2-CG2 3.73Å; L756-V829 HydrophobicContact CB-CG1 3.78Å; L756-V829 HydrophobicContact CD1-CG1 4.32Å; P757-V829 HydrophobicContact CG-CG1 4.03Å; P757-V829 HydrophobicContact CG-CG2 4.25Å; S825-V829 PolarHBondContact O-N 3.39Å; L826-V829 PolarHBondContact O-N 3.16Å; F827-V829 VanDerWaalsContact C-N 3.33Å; F827-V829 PolarHBondContact O-N 2.88Å; V829-L831 VanDerWaalsContact C-N 3.3Å; V829-L831 PolarHBondContact O-N 3.43Å; V829-A832 PolarHBondContact O-N 2.86Å; V829-H833 PolarHBondContact O-N 3.1Å
830	L	86.6	Confident	84.1	Confident	10 Å²	10	49.6 Å²	49.6	5%	0.052	28%	0.281	C	S	.	.	H	α-helix	trans	-64.8	-35.5	178.3	-69.8	177.2	0	0	0	112.3	I799 L826 F827 G834 L841 L844 L848	I799-L830 HydrophobicContact CD1-CD2 4.31Å; L826-L830 HydrophobicContact CD1-CG 4.32Å; L826-L830 HydrophobicContact CG-CD1 4.24Å; L826-L830 HydrophobicContact CG-CG 4.48Å; L826-L830 WeakPolarHBondContact O-CG 3.31Å; L826-L830 PolarHBondContact O-N 3Å; F827-L830 PolarHBondContact O-N 3.2Å; L830-G834 WeakPolarHBondContact O-CA 3.47Å; L830-G834 PolarHBondContact O-N 3.17Å; L830-L841 HydrophobicContact CD2-CD2 4.32Å; L830-L844 HydrophobicContact CD1-CD2 4Å; L830-L844 HydrophobicContact CD1-CG 4.22Å; L830-L848 HydrophobicContact CD1-CD1 3.62Å
831	L	84.7	Confident	83.9	Confident	28 Å²	28	51.4 Å²	51.4	15%	0.147	29%	0.291	C	S	.	.	H	α-helix	trans	-67.1	-40.5	175.1	177.8	69.5	0	0	0	112	F827 G828 V829 L836 T866 I870	F827-L831 HydrophobicContact CE1-CD2 4.15Å; F827-L831 HydrophobicContact CZ-CD2 4.39Å; F827-L831 VanDerWaalsContact O-CB 3.27Å; F827-L831 WeakPolarHBondContact O-CB 3.28Å; F827-L831 PolarHBondContact O-N 3.37Å; G828-L831 PolarHBondContact O-N 3.12Å; V829-L831 VanDerWaalsContact C-N 3.3Å; V829-L831 PolarHBondContact O-N 3.43Å; L831-L836 HydrophobicContact CD1-CD1 4.08Å; L831-T866 HydrophobicContact CD2-CG2 4.08Å; L831-I870 HydrophobicContact CD1-CD1 4.08Å; L831-I870 HydrophobicContact CD1-CG1 3.83Å; L831-I870 HydrophobicContact CD1-CG2 4.46Å; L831-I870 HydrophobicContact CD2-CD1 3.66Å; L831-I870 HydrophobicContact CD2-CG1 3.5Å; L831-I870 HydrophobicContact CG-CG1 4.25Å
832	A	83.1	Confident	83.6	Confident	66 Å²	66	49.6 Å²	49.6	55%	0.545	28%	0.275	S	S	.	.	H	α-helix	trans	-76.7	-34.3	-177.4	0	0	0	0	0	113.3	G828 V829	G828-A832 WeakPolarHBondContact O-CB 3.31Å; G828-A832 PolarHBondContact O-N 2.91Å; V829-A832 PolarHBondContact O-N 2.86Å
833	H	83.2	Confident	83.4	Confident	95 Å²	95	54.8 Å²	54.8	44%	0.44	30%	0.299	S	S	.	.	H	α-helix	trans	-129.1	-13.2	-167	-60	-62.1	0	0	0	115	A760 V829	A760-H833 HydrophobicContact CB-CB 3.68Å; V829-H833 PolarHBondContact O-N 3.1Å
834	G	80.7	Confident	83.3	Confident	27 Å²	27	56.4 Å²	56.4	28%	0.278	31%	0.307	S	S	.	.	S	Bend	trans	-83.6	145.6	-178.4	0	0	0	0	0	112.9	L830 L836	L830-G834 WeakPolarHBondContact O-CA 3.47Å; L830-G834 PolarHBondContact O-N 3.17Å; G834-L836 PolarHBondContact O-N 3.05Å; G834-L836 VanDerWaalsContact O-N 3.13Å
835	D	80	Confident	83.1	Confident	92 Å²	92	54.7 Å²	54.7	49%	0.492	30%	0.3	S	S	.	.			trans	-79.4	92.8	169.6	-176	11.8	0	0	0	110.6	K837 N838	D835-K837 PolarHBondContact O-N 3Å; D835-K837 WeakPolarHBondContact OD1-CB 3.36Å; D835-K837 VanDerWaalsContact OD1-CG 3.3Å; D835-K837 WeakPolarHBondContact OD1-CG 3.24Å; D835-K837 PolarHBondContact OD1-N 3.38Å; D835-K837 VanDerWaalsContact OD1-N 3.08Å; D835-N838 WeakPolarHBondContact O-CB 3.45Å; D835-N838 PolarHBondContact O-N 3.21Å; D835-N838 VanDerWaalsContact O-N 3.16Å
836	L	76.6	Confident	82.9	Confident	9 Å²	9	52.8 Å²	52.8	5%	0.047	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	1.4	179.5	-62.6	178.1	0	0	0	113.6	L831 G834 L841 S845 L882	L831-L836 HydrophobicContact CD1-CD1 4.08Å; G834-L836 PolarHBondContact O-N 3.05Å; G834-L836 VanDerWaalsContact O-N 3.13Å; L836-L841 HydrophobicContact CD2-CB 4.48Å; L836-S845 VanDerWaalsContact CD2-OG 3.27Å; L836-S845 WeakPolarHBondContact CD2-OG 3.4Å; L836-L882 HydrophobicContact CB-CD2 4.29Å; L836-L882 HydrophobicContact CD1-CD2 3.53Å
837	K	74.5	Confident	82.7	Confident	137 Å²	137	57.5 Å²	57.5	60%	0.596	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-24.7	164.6	-59.8	173.9	-177.1	174.6	0	111.3	D835 N839 H881	D835-K837 PolarHBondContact O-N 3Å; D835-K837 WeakPolarHBondContact OD1-CB 3.36Å; D835-K837 VanDerWaalsContact OD1-CG 3.3Å; D835-K837 WeakPolarHBondContact OD1-CG 3.24Å; D835-K837 PolarHBondContact OD1-N 3.38Å; D835-K837 VanDerWaalsContact OD1-N 3.08Å; K837-N839 PolarHBondContact O-N 3.3Å; K837-H881 HydrophobicContact CG-CB 4.49Å
838	N	79.8	Confident	82.5	Confident	75 Å²	75	57.5 Å²	57.5	40%	0.401	31%	0.311	S	S	.	.	S	Bend	trans	-73.7	115.8	173.4	-173.9	-20.9	0	0	0	110.3	D835 K840 L841 S842	D835-N838 WeakPolarHBondContact O-CB 3.45Å; D835-N838 PolarHBondContact O-N 3.21Å; D835-N838 VanDerWaalsContact O-N 3.16Å; N838-K840 PolarHBondContact O-N 3.44Å; N838-K840 VanDerWaalsContact O-N 3.07Å; N838-K840 PolarHBondContact OD1-N 2.9Å; N838-L841 HydrophobicContact CB-CB 4.38Å; N838-L841 HydrophobicContact CB-CD1 4.29Å; N838-L841 PolarHBondContact O-N 3.22Å; N838-S842 PolarHBondContact O-N 3.32Å
839	N	77.9	Confident	82.4	Confident	123 Å²	123	56 Å²	56	66%	0.658	30%	0.295	S	S	*	.	H	α-helix	trans	-51.8	-34.4	179.9	-74.5	-23.8	0	0	0	113.5	K837 Q843	K837-N839 PolarHBondContact O-N 3.3Å; N839-Q843 WeakPolarHBondContact O-CB 3.39Å; N839-Q843 WeakPolarHBondContact O-CG 3.21Å; N839-Q843 PolarHBondContact O-N 3.05Å
840	K	81.7	Confident	82.4	Confident	166 Å²	166	58.6 Å²	58.6	72%	0.722	31%	0.308	S	S	*	.	H	α-helix	trans	-69.3	-44.2	179.3	-65.2	-178.2	-179.9	178.7	0	112.1	N838 L844	N838-K840 PolarHBondContact O-N 3.44Å; N838-K840 VanDerWaalsContact O-N 3.07Å; N838-K840 PolarHBondContact OD1-N 2.9Å; K840-L844 WeakPolarHBondContact O-CB 3.42Å; K840-L844 PolarHBondContact O-N 3.42Å
841	L	81.3	Confident	82.2	Confident	43 Å²	43	60.3 Å²	60.3	23%	0.225	32%	0.317	C	S	.	.	H	α-helix	trans	-72.4	-36.3	178.9	-73.2	172.4	0	0	0	111.8	L830 L836 N838 L844 S845	L830-L841 HydrophobicContact CD2-CD2 4.32Å; L836-L841 HydrophobicContact CD2-CB 4.48Å; N838-L841 HydrophobicContact CB-CB 4.38Å; N838-L841 HydrophobicContact CB-CD1 4.29Å; N838-L841 PolarHBondContact O-N 3.22Å; L841-L844 HydrophobicContact CD2-CD2 4.49Å; L841-L844 PolarHBondContact O-N 2.86Å; L841-S845 WeakPolarHBondContact O-CB 3.43Å; L841-S845 PolarHBondContact O-N 3.42Å; L841-S845 PolarHBondContact O-OG 3.47Å
842	S	80.3	Confident	82.1	Confident	16 Å²	16	59 Å²	59	11%	0.112	31%	0.31	C	S	.	.	H	α-helix	trans	-61.3	-48.2	172.4	179.5	0	0	0	0	111.5	N838 L844 S845 I846	N838-S842 PolarHBondContact O-N 3.32Å; S842-L844 PolarHBondContact O-N 2.78Å; S842-S845 PolarHBondContact O-N 3.39Å; S842-I846 WeakPolarHBondContact O-CG1 3.17Å; S842-I846 PolarHBondContact O-N 2.82Å
843	Q	83.7	Confident	82.1	Confident	114 Å²	114	57.8 Å²	57.8	53%	0.533	29%	0.293	S	S	.	.	H	α-helix	trans	-61.8	-42.5	175.1	-75.7	177.3	-2.4	0	0	112.4	N839 S845 I846 N847	N839-Q843 WeakPolarHBondContact O-CB 3.39Å; N839-Q843 WeakPolarHBondContact O-CG 3.21Å; N839-Q843 PolarHBondContact O-N 3.05Å; Q843-S845 VanDerWaalsContact C-N 3.33Å; Q843-S845 PolarHBondContact O-N 2.95Å; Q843-I846 PolarHBondContact O-N 3.46Å; Q843-N847 WeakPolarHBondContact O-CB 3.39Å; Q843-N847 PolarHBondContact O-N 3.45Å; Q843-N847 PolarHBondContact O-ND2 3.48Å
844	L	85.8	Confident	81.9	Confident	34 Å²	34	60.2 Å²	60.2	18%	0.178	30%	0.302	C	S	.	.	H	α-helix	trans	-59.7	-44.3	175.7	179.8	61.6	0	0	0	111.6	I799 L803 L830 K840 L841 S842 I846 N847 L848	I799-L844 HydrophobicContact CG2-CD2 3.83Å; L803-L844 HydrophobicContact CD1-CD1 4.04Å; L803-L844 HydrophobicContact CD2-CD1 4.1Å; L830-L844 HydrophobicContact CD1-CD2 4Å; L830-L844 HydrophobicContact CD1-CG 4.22Å; K840-L844 WeakPolarHBondContact O-CB 3.42Å; K840-L844 PolarHBondContact O-N 3.42Å; L841-L844 HydrophobicContact CD2-CD2 4.49Å; L841-L844 PolarHBondContact O-N 2.86Å; S842-L844 PolarHBondContact O-N 2.78Å; L844-I846 PolarHBondContact O-N 3.34Å; L844-N847 PolarHBondContact O-N 3.31Å; L844-L848 HydrophobicContact CD1-CD1 4.26Å; L844-L848 HydrophobicContact CD1-CG 4.26Å; L844-L848 HydrophobicContact CG-CD1 3.99Å; L844-L848 HydrophobicContact CG-CG 4.43Å; L844-L848 VanDerWaalsContact O-CG 3.32Å; L844-L848 WeakPolarHBondContact O-CG 3.06Å; L844-L848 PolarHBondContact O-N 2.92Å
845	S	84.3	Confident	81.5	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.007	30%	0.304	C	S	.	.	H	α-helix	trans	-63	-42.2	179.4	-58.5	0	0	0	0	111.9	F827 L836 L841 S842 Q843 L848 W849	F827-S845 VanDerWaalsContact CD2-O 3.22Å; F827-S845 WeakPolarHBondContact CD2-O 3.34Å; L836-S845 VanDerWaalsContact CD2-OG 3.27Å; L836-S845 WeakPolarHBondContact CD2-OG 3.4Å; L841-S845 WeakPolarHBondContact O-CB 3.43Å; L841-S845 PolarHBondContact O-N 3.42Å; L841-S845 PolarHBondContact O-OG 3.47Å; S842-S845 PolarHBondContact O-N 3.39Å; Q843-S845 VanDerWaalsContact C-N 3.33Å; Q843-S845 PolarHBondContact O-N 2.95Å; S845-L848 PolarHBondContact O-N 2.88Å; S845-W849 PolarHBondContact O-N 3.3Å
846	I	83.9	Confident	80.9	Confident	15 Å²	15	59.2 Å²	59.2	8%	0.077	30%	0.295	C	S	.	.	H	α-helix	trans	-62.5	-43.4	173.8	-65.6	162.8	0	0	0	110.8	S842 Q843 L844 L848 W849 N850 T885 R888 L889	S842-I846 WeakPolarHBondContact O-CG1 3.17Å; S842-I846 PolarHBondContact O-N 2.82Å; Q843-I846 PolarHBondContact O-N 3.46Å; L844-I846 PolarHBondContact O-N 3.34Å; I846-L848 PolarHBondContact O-N 3.31Å; I846-W849 PolarHBondContact O-N 3.09Å; I846-N850 WeakPolarHBondContact O-CB 3.34Å; I846-N850 VanDerWaalsContact O-CG 3.3Å; I846-N850 PolarHBondContact O-N 3.01Å; I846-N850 PolarHBondContact O-ND2 3.49Å; I846-T885 HydrophobicContact CD1-CG2 4.26Å; I846-T885 HydrophobicContact CG1-CG2 4Å; I846-R888 HydrophobicContact CD1-CB 4Å; I846-R888 HydrophobicContact CD1-CG 4.49Å; I846-R888 HydrophobicContact CG1-CB 4.33Å; I846-R888 HydrophobicContact CG2-CB 4.36Å; I846-L889 HydrophobicContact CG1-CD2 4.43Å
847	N	86	Confident	80.7	Confident	100 Å²	100	61.7 Å²	61.7	54%	0.535	31%	0.307	S	S	.	.	H	α-helix	trans	-64.5	-40.1	178.9	-70.8	-22.1	0	0	0	112.2	Q843 L844 N850 L851	Q843-N847 WeakPolarHBondContact O-CB 3.39Å; Q843-N847 PolarHBondContact O-N 3.45Å; Q843-N847 PolarHBondContact O-ND2 3.48Å; L844-N847 PolarHBondContact O-N 3.31Å; N847-N850 PolarHBondContact O-N 2.9Å; N847-L851 VanDerWaalsContact O-CB 3.26Å; N847-L851 WeakPolarHBondContact O-CB 3.24Å; N847-L851 PolarHBondContact O-N 2.86Å
848	L	85.3	Confident	80.6	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.016	29%	0.285	C	S	.	.	H	α-helix	trans	-67.1	-40.3	176.2	-71.7	169.2	0	0	0	112	L803 L806 A823 L826 F827 L830 L844 S845 I846 L851 S852	L803-L848 HydrophobicContact CD2-CD2 4.14Å; L806-L848 HydrophobicContact CD1-CD2 4.04Å; A823-L848 HydrophobicContact CB-CD2 4.22Å; L826-L848 HydrophobicContact CB-CD1 4.28Å; L826-L848 HydrophobicContact CD2-CD1 3.61Å; L826-L848 HydrophobicContact CD2-CD2 4.01Å; L826-L848 HydrophobicContact CD2-CG 4.48Å; L826-L848 HydrophobicContact CG-CD1 3.71Å; F827-L848 HydrophobicContact CB-CB 4.15Å; L830-L848 HydrophobicContact CD1-CD1 3.62Å; L844-L848 HydrophobicContact CD1-CD1 4.26Å; L844-L848 HydrophobicContact CD1-CG 4.26Å; L844-L848 HydrophobicContact CG-CD1 3.99Å; L844-L848 HydrophobicContact CG-CG 4.43Å; L844-L848 VanDerWaalsContact O-CG 3.32Å; L844-L848 WeakPolarHBondContact O-CG 3.06Å; L844-L848 PolarHBondContact O-N 2.92Å; S845-L848 PolarHBondContact O-N 2.88Å; I846-L848 PolarHBondContact O-N 3.31Å; L848-L851 PolarHBondContact O-N 3.32Å; L848-S852 WeakPolarHBondContact O-CB 3.42Å; L848-S852 PolarHBondContact O-N 2.71Å; L848-S852 PolarHBondContact O-OG 2.87Å
849	W	84.4	Confident	80.3	Confident	1 Å²	1	59.2 Å²	59.2	0%	0.004	30%	0.297	C	S	.	.	H	α-helix	trans	-59	-49.7	172.5	178.8	-95.3	0	0	0	111.5	F824 F827 S845 I846 L851 S852 H853 T866 L867 L889 L891	F824-W849 HydrophobicContact CD2-CZ3 4.42Å; F824-W849 HydrophobicContact CE2-CE3 4.16Å; F824-W849 HydrophobicContact CE2-CH2 4.33Å; F824-W849 AromaticContact CE2-CZ3 3.61Å; F824-W849 HydrophobicContact CE2-CZ3 3.61Å; F824-W849 HydrophobicContact CZ-CZ3 4.41Å; F827-W849 AromaticContact CD1-CE3 3.78Å; F827-W849 HydrophobicContact CD1-CE3 3.78Å; F827-W849 HydrophobicContact CD1-CZ3 4.22Å; F827-W849 HydrophobicContact CD2-CB 4.22Å; F827-W849 AromaticContact CE1-CE3 3.38Å; F827-W849 HydrophobicContact CE1-CE3 3.38Å; F827-W849 AromaticContact CE1-CZ3 3.66Å; F827-W849 HydrophobicContact CE1-CZ3 3.66Å; F827-W849 HydrophobicContact CE2-CB 4.17Å; F827-W849 HydrophobicContact CE2-CE3 4.27Å; F827-W849 HydrophobicContact CG-CE3 4.38Å; F827-W849 HydrophobicContact CZ-CD2 4.45Å; F827-W849 AromaticContact CZ-CE3 3.65Å; F827-W849 HydrophobicContact CZ-CE3 3.65Å; F827-W849 HydrophobicContact CZ-CZ3 4.19Å; S845-W849 PolarHBondContact O-N 3.3Å; I846-W849 PolarHBondContact O-N 3.09Å; W849-L851 VanDerWaalsContact C-N 3.34Å; W849-L851 PolarHBondContact O-N 3.04Å; W849-S852 PolarHBondContact O-N 3.02Å; W849-S852 PolarHBondContact O-OG 2.92Å; W849-H853 AromaticContact CD2-CE1 3.69Å; W849-H853 AromaticContact CD2-ND1 3.87Å; W849-H853 AromaticContact CE2-CE1 3.51Å; W849-H853 AromaticContact CE2-ND1 3.76Å; W849-H853 AromaticContact CE3-CE1 3.86Å; W849-H853 AromaticContact CH2-CE1 3.75Å; W849-H853 AromaticContact CZ2-CE1 3.55Å; W849-H853 AromaticContact CZ2-NE2 3.96Å; W849-H853 AromaticContact CZ3-CE1 3.9Å; W849-H853 AromaticContact NE1-ND1 3.92Å; W849-H853 PolarHBondContact O-N 2.71Å; W849-H853 PolarHBondContact O-ND1 2.89Å; W849-T866 HydrophobicContact CZ3-CG2 4.42Å; W849-L867 HydrophobicContact CH2-CD1 4.15Å; W849-L867 HydrophobicContact CH2-CD2 4.17Å; W849-L867 HydrophobicContact CH2-CG 3.75Å; W849-L867 HydrophobicContact CZ2-CD1 3.8Å; W849-L867 HydrophobicContact CZ2-CD2 4.04Å; W849-L867 HydrophobicContact CZ2-CG 3.82Å; W849-L889 HydrophobicContact CB-CD2 3.35Å; W849-L889 HydrophobicContact CD2-CB 4.45Å; W849-L889 HydrophobicContact CD2-CD2 3.81Å; W849-L889 HydrophobicContact CE3-CD2 4.48Å; W849-L889 HydrophobicContact CG-CB 4.42Å; W849-L889 HydrophobicContact CG-CD2 3.27Å; W849-L889 HydrophobicContact CG-CG 4.42Å; W849-L889 PolarHBondContact NE1-O 2.83Å; W849-L891 HydrophobicContact CZ2-CD2 3.86Å; W849-L891 HydrophobicContact CZ2-CG 4.24Å
850	N	86.1	Confident	80.2	Confident	76 Å²	76	57.3 Å²	57.3	41%	0.406	29%	0.29	S	S	.	.	H	α-helix	trans	-63	-41.1	178.1	-69.7	-24.9	0	0	0	111.8	I846 N847 S852 H853 K854	I846-N850 WeakPolarHBondContact O-CB 3.34Å; I846-N850 VanDerWaalsContact O-CG 3.3Å; I846-N850 PolarHBondContact O-N 3.01Å; I846-N850 PolarHBondContact O-ND2 3.49Å; N847-N850 PolarHBondContact O-N 2.9Å; N850-S852 VanDerWaalsContact C-N 3.35Å; N850-S852 PolarHBondContact O-N 3.25Å; N850-H853 PolarHBondContact O-N 3.17Å; N850-K854 WeakPolarHBondContact O-CB 3.08Å; N850-K854 PolarHBondContact O-N 2.99Å
851	L	83.9	Confident	80.1	Confident	46 Å²	46	59.1 Å²	59.1	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-61.8	-42	176.6	-175.2	63.4	0	0	0	111.7	L806 Q819 A823 N847 L848 W849 H853 K854	L806-L851 HydrophobicContact CD1-CD2 4.48Å; Q819-L851 HydrophobicContact CG-CD2 4.43Å; A823-L851 HydrophobicContact CB-CB 4.46Å; A823-L851 HydrophobicContact CB-CD2 4.11Å; A823-L851 HydrophobicContact CB-CG 4.3Å; N847-L851 VanDerWaalsContact O-CB 3.26Å; N847-L851 WeakPolarHBondContact O-CB 3.24Å; N847-L851 PolarHBondContact O-N 2.86Å; L848-L851 PolarHBondContact O-N 3.32Å; W849-L851 VanDerWaalsContact C-N 3.34Å; W849-L851 PolarHBondContact O-N 3.04Å; L851-H853 VanDerWaalsContact C-N 3.28Å; L851-H853 PolarHBondContact O-N 3.26Å; L851-K854 PolarHBondContact O-N 3.24Å
852	S	82.8	Confident	79.9	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.1	-31.3	177.8	68.2	0	0	0	0	113.3	S820 L848 W849 N850	S820-S852 WeakPolarHBondContact CB-O 3.12Å; S820-S852 WeakPolarHBondContact O-CB 3.27Å; S820-S852 PolarHBondContact OG-O 3.23Å; L848-S852 WeakPolarHBondContact O-CB 3.42Å; L848-S852 PolarHBondContact O-N 2.71Å; L848-S852 PolarHBondContact O-OG 2.87Å; W849-S852 PolarHBondContact O-N 3.02Å; W849-S852 PolarHBondContact O-OG 2.92Å; N850-S852 VanDerWaalsContact C-N 3.35Å; N850-S852 PolarHBondContact O-N 3.25Å
853	H	82.8	Confident	79.9	Confident	41 Å²	41	59 Å²	59	19%	0.19	29%	0.292	C	S	.	.	H	α-helix	trans	-96.2	-12.8	-178	-66.2	83.7	0	0	0	114.3	W849 N850 L851 H855 G856 S863 L891	W849-H853 AromaticContact CD2-CE1 3.69Å; W849-H853 AromaticContact CD2-ND1 3.87Å; W849-H853 AromaticContact CE2-CE1 3.51Å; W849-H853 AromaticContact CE2-ND1 3.76Å; W849-H853 AromaticContact CE3-CE1 3.86Å; W849-H853 AromaticContact CH2-CE1 3.75Å; W849-H853 AromaticContact CZ2-CE1 3.55Å; W849-H853 AromaticContact CZ2-NE2 3.96Å; W849-H853 AromaticContact CZ3-CE1 3.9Å; W849-H853 AromaticContact NE1-ND1 3.92Å; W849-H853 PolarHBondContact O-N 2.71Å; W849-H853 PolarHBondContact O-ND1 2.89Å; N850-H853 PolarHBondContact O-N 3.17Å; L851-H853 VanDerWaalsContact C-N 3.28Å; L851-H853 PolarHBondContact O-N 3.26Å; H853-H855 VanDerWaalsContact C-N 3.28Å; H853-H855 PolarHBondContact O-N 3.07Å; H853-H855 VanDerWaalsContact O-N 3.15Å; H853-G856 PolarHBondContact O-N 2.72Å; H853-S863 PolarHBondContact CE1-OG 3.01Å; H853-S863 VanDerWaalsContact NE2-CB 3.34Å; H853-S863 WeakPolarHBondContact NE2-CB 3.08Å; H853-S863 PolarHBondContact NE2-OG 3.46Å; H853-L891 WeakPolarHBondContact NE2-CD2 3.29Å
854	K	79	Confident	79.8	Confident	145 Å²	145	57 Å²	57	63%	0.63	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-38.2	-173.6	-171.6	179.6	179.9	-174	0	114.6	N850 L851	N850-K854 WeakPolarHBondContact O-CB 3.08Å; N850-K854 PolarHBondContact O-N 2.99Å; L851-K854 PolarHBondContact O-N 3.24Å
855	H	72.4	Confident	79.6	Confident	69 Å²	69	64.4 Å²	64.4	32%	0.319	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	6.4	-177.2	-62.4	-71.1	0	0	0	113.2	H853 H857	H853-H855 VanDerWaalsContact C-N 3.28Å; H853-H855 PolarHBondContact O-N 3.07Å; H853-H855 VanDerWaalsContact O-N 3.15Å; H855-H857 PolarHBondContact O-N 2.83Å
856	G	67.4	Low	79.4	Confident	30 Å²	30	65.7 Å²	65.7	31%	0.309	32%	0.318	S	S	.	.	S	Bend	trans	67.1	18.9	175.9	0	0	0	0	0	115.4	H853 R894	H853-G856 PolarHBondContact O-N 2.72Å; G856-R894 PolarHBondContact O-NH2 3.08Å
857	H	71.3	Confident	79.3	Confident	61 Å²	61	65.8 Å²	65.8	28%	0.282	32%	0.319	S	S	.	.			trans	-92	-10	-179.4	-63.8	-51.9	0	0	0	114.4	E813 R817 H855	E813-H857 IonicContact OE1-CE1 3.86Å; R817-H857 HydrophobicContact CB-CB 4.45Å; R817-H857 HydrophobicContact CG-CB 3.88Å; R817-H857 VanDerWaalsContact CG-CG 3.42Å; H855-H857 PolarHBondContact O-N 2.83Å
858	S	73.1	Confident	79	Confident	19 Å²	19	66.3 Å²	66.3	13%	0.133	32%	0.318	C	S	.	.	S	Bend	trans	-74.9	139.7	174.9	-170	0	0	0	0	111.4	S820 T860 S863	S820-S858 PolarHBondContact OG-N 2.94Å; S858-T860 PolarHBondContact O-N 3.36Å; S858-T860 VanDerWaalsContact O-N 3.15Å; S858-S863 PolarHBondContact OG-OG 2.9Å
859	E	74.1	Confident	78.7	Confident	140 Å²	140	68.9 Å²	68.9	65%	0.654	34%	0.337	S	S	*	.			trans	-67.5	110.7	177.9	-72.4	-171.5	-179.5	0	0	111.5	R861 V862 S863	E859-R861 PolarHBondContact O-N 2.81Å; E859-R861 VanDerWaalsContact O-N 3.11Å; E859-V862 HydrophobicContact CB-CB 4.29Å; E859-V862 HydrophobicContact CB-CG2 4.02Å; E859-V862 PolarHBondContact O-N 2.99Å; E859-V862 WeakPolarHBondContact OE2-CG2 3.49Å; E859-S863 PolarHBondContact O-N 3.35Å; E859-S863 VanDerWaalsContact O-N 3.1Å; E859-S863 PolarHBondContact O-OG 2.99Å
860	T	75	Confident	78.5	Confident	84 Å²	84	68.9 Å²	68.9	52%	0.515	34%	0.337	S	S	.	.	H	α-helix	trans	-56.7	-33.8	-176.3	-41.3	0	0	0	0	113	S858 I864	S858-T860 PolarHBondContact O-N 3.36Å; S858-T860 VanDerWaalsContact O-N 3.15Å; T860-I864 HydrophobicContact CG2-CD1 4Å; T860-I864 HydrophobicContact CG2-CG1 4.49Å; T860-I864 WeakPolarHBondContact O-CD1 3.29Å; T860-I864 WeakPolarHBondContact O-CG1 3.25Å; T860-I864 PolarHBondContact O-N 2.86Å
861	R	78.3	Confident	78.2	Confident	203 Å²	203	72.3 Å²	72.3	77%	0.766	34%	0.344	S	S	*	.	H	α-helix	trans	-64.6	-43.1	177.5	-70.7	-178.2	180	175.3	0.7	112.5	E859 R865	E859-R861 PolarHBondContact O-N 2.81Å; E859-R861 VanDerWaalsContact O-N 3.11Å; R861-R865 WeakPolarHBondContact O-CG 3.42Å; R861-R865 PolarHBondContact O-N 2.64Å
862	V	78.8	Confident	77.8	Confident	57 Å²	57	75.8 Å²	75.8	35%	0.345	36%	0.358	S	S	.	.	H	α-helix	trans	-69.1	-44.3	179.3	-179.5	0	0	0	0	109.3	F824 E859 I864 R865 T866	F824-V862 HydrophobicContact CE1-CG1 3.75Å; F824-V862 HydrophobicContact CZ-CG1 3.95Å; E859-V862 HydrophobicContact CB-CB 4.29Å; E859-V862 HydrophobicContact CB-CG2 4.02Å; E859-V862 PolarHBondContact O-N 2.99Å; E859-V862 WeakPolarHBondContact OE2-CG2 3.49Å; V862-I864 PolarHBondContact O-N 3.25Å; V862-R865 PolarHBondContact O-N 2.66Å; V862-T866 PolarHBondContact O-N 3.24Å; V862-T866 PolarHBondContact O-OG1 3.29Å
863	S	80.3	Confident	77.4	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-60.2	-40.7	177	-56.6	0	0	0	0	113.5	H853 S858 E859 T866 L867	H853-S863 PolarHBondContact CE1-OG 3.01Å; H853-S863 VanDerWaalsContact NE2-CB 3.34Å; H853-S863 WeakPolarHBondContact NE2-CB 3.08Å; H853-S863 PolarHBondContact NE2-OG 3.46Å; S858-S863 PolarHBondContact OG-OG 2.9Å; E859-S863 PolarHBondContact O-N 3.35Å; E859-S863 VanDerWaalsContact O-N 3.1Å; E859-S863 PolarHBondContact O-OG 2.99Å; S863-T866 PolarHBondContact O-N 2.91Å; S863-L867 WeakPolarHBondContact O-CG 3.34Å; S863-L867 PolarHBondContact O-N 3.25Å
864	I	80.7	Confident	77	Confident	73 Å²	73	78 Å²	78	37%	0.374	37%	0.372	S	S	.	.	H	α-helix	trans	-63	-47.9	175.7	-69.7	164.3	0	0	0	110.6	T860 V862 T866 L867 E868 L891	T860-I864 HydrophobicContact CG2-CD1 4Å; T860-I864 HydrophobicContact CG2-CG1 4.49Å; T860-I864 WeakPolarHBondContact O-CD1 3.29Å; T860-I864 WeakPolarHBondContact O-CG1 3.25Å; T860-I864 PolarHBondContact O-N 2.86Å; V862-I864 PolarHBondContact O-N 3.25Å; I864-T866 VanDerWaalsContact C-N 3.33Å; I864-T866 PolarHBondContact O-N 3.01Å; I864-L867 PolarHBondContact O-N 2.92Å; I864-E868 HydrophobicContact CG2-CG 4.49Å; I864-E868 WeakPolarHBondContact O-CG 3.29Å; I864-E868 PolarHBondContact O-N 3.33Å; I864-L891 HydrophobicContact CG1-CD1 3.66Å
865	R	80.8	Confident	76.8	Confident	188 Å²	188	78.3 Å²	78.3	71%	0.709	38%	0.376	S	S	*	.	H	α-helix	trans	-61.7	-40.2	177.7	-74.4	-179.8	176.5	-178.7	-1	112.3	R861 V862 E868 S869	R861-R865 WeakPolarHBondContact O-CG 3.42Å; R861-R865 PolarHBondContact O-N 2.64Å; V862-R865 PolarHBondContact O-N 2.66Å; R865-E868 PolarHBondContact O-N 3.39Å; R865-S869 WeakPolarHBondContact O-CB 3.35Å; R865-S869 PolarHBondContact O-N 3.11Å
866	T	81.1	Confident	76.9	Confident	29 Å²	29	82.7 Å²	82.7	18%	0.178	39%	0.389	C	S	.	.	H	α-helix	trans	-62.6	-44.7	175.3	-57.5	0	0	0	0	110.5	F827 L831 W849 V862 S863 I864 E868 S869 I870	F827-T866 HydrophobicContact CE1-CG2 4.12Å; L831-T866 HydrophobicContact CD2-CG2 4.08Å; W849-T866 HydrophobicContact CZ3-CG2 4.42Å; V862-T866 PolarHBondContact O-N 3.24Å; V862-T866 PolarHBondContact O-OG1 3.29Å; S863-T866 PolarHBondContact O-N 2.91Å; I864-T866 VanDerWaalsContact C-N 3.33Å; I864-T866 PolarHBondContact O-N 3.01Å; T866-E868 PolarHBondContact O-N 3.08Å; T866-S869 WeakPolarHBondContact O-CB 3.43Å; T866-S869 PolarHBondContact O-N 3.08Å; T866-I870 HydrophobicContact CG2-CD1 4.06Å; T866-I870 WeakPolarHBondContact O-CG1 3.43Å; T866-I870 PolarHBondContact O-N 3.38Å
867	L	81.1	Confident	76.6	Confident	17 Å²	17	86.8 Å²	86.8	9%	0.089	41%	0.411	C	S	.	.	H	α-helix	trans	-62.8	-40.1	175.3	-77.8	173	0	0	0	113.2	W849 S863 I864 I870 R871 L889 L891	W849-L867 HydrophobicContact CH2-CD1 4.15Å; W849-L867 HydrophobicContact CH2-CD2 4.17Å; W849-L867 HydrophobicContact CH2-CG 3.75Å; W849-L867 HydrophobicContact CZ2-CD1 3.8Å; W849-L867 HydrophobicContact CZ2-CD2 4.04Å; W849-L867 HydrophobicContact CZ2-CG 3.82Å; S863-L867 WeakPolarHBondContact O-CG 3.34Å; S863-L867 PolarHBondContact O-N 3.25Å; I864-L867 PolarHBondContact O-N 2.92Å; L867-I870 PolarHBondContact O-N 2.63Å; L867-R871 WeakPolarHBondContact O-CB 3.48Å; L867-R871 WeakPolarHBondContact O-CG 3.36Å; L867-R871 PolarHBondContact O-N 3.29Å; L867-L889 HydrophobicContact CD2-CB 3.81Å; L867-L891 HydrophobicContact CD1-CD1 3.65Å; L867-L891 HydrophobicContact CD1-CG 3.71Å
868	E	79.8	Confident	76.3	Confident	110 Å²	110	90.2 Å²	90.2	51%	0.514	43%	0.431	S	S	.	.	H	α-helix	trans	-62.6	-42.9	174	-73.6	173.6	173.4	0	0	111.5	I864 R865 T866 R871 H872	I864-E868 HydrophobicContact CG2-CG 4.49Å; I864-E868 WeakPolarHBondContact O-CG 3.29Å; I864-E868 PolarHBondContact O-N 3.33Å; R865-E868 PolarHBondContact O-N 3.39Å; T866-E868 PolarHBondContact O-N 3.08Å; E868-R871 WeakPolarHBondContact O-CB 3.45Å; E868-R871 PolarHBondContact O-N 3.05Å; E868-H872 PolarHBondContact O-N 3.35Å
869	S	79.4	Confident	76.1	Confident	58 Å²	58	93.2 Å²	93.2	41%	0.406	44%	0.444	S	S	.	.	H	α-helix	trans	-61	-44.4	174.3	-177.5	0	0	0	0	111.8	R865 T866 H872 Q873	R865-S869 WeakPolarHBondContact O-CB 3.35Å; R865-S869 PolarHBondContact O-N 3.11Å; T866-S869 WeakPolarHBondContact O-CB 3.43Å; T866-S869 PolarHBondContact O-N 3.08Å; S869-H872 PolarHBondContact O-N 3.22Å; S869-Q873 WeakPolarHBondContact O-CG 3.26Å; S869-Q873 PolarHBondContact O-N 3.32Å
870	I	80.6	Confident	75.7	Confident	1 Å²	1	89.4 Å²	89.4	1%	0.005	44%	0.436	C	S	.	.	H	α-helix	trans	-64	-42.3	177.1	-59.7	162.9	0	0	0	110.2	F827 L831 T866 L867 H872 Q873 A874 L882 I886 L889	F827-I870 HydrophobicContact CE1-CD1 4.35Å; F827-I870 HydrophobicContact CZ-CD1 4.05Å; L831-I870 HydrophobicContact CD1-CD1 4.08Å; L831-I870 HydrophobicContact CD1-CG1 3.83Å; L831-I870 HydrophobicContact CD1-CG2 4.46Å; L831-I870 HydrophobicContact CD2-CD1 3.66Å; L831-I870 HydrophobicContact CD2-CG1 3.5Å; L831-I870 HydrophobicContact CG-CG1 4.25Å; T866-I870 HydrophobicContact CG2-CD1 4.06Å; T866-I870 WeakPolarHBondContact O-CG1 3.43Å; T866-I870 PolarHBondContact O-N 3.38Å; L867-I870 PolarHBondContact O-N 2.63Å; I870-H872 VanDerWaalsContact C-N 3.32Å; I870-H872 PolarHBondContact O-N 3.04Å; I870-Q873 PolarHBondContact O-N 3.26Å; I870-A874 WeakPolarHBondContact O-CB 3.38Å; I870-A874 PolarHBondContact O-N 3.47Å; I870-L882 HydrophobicContact CG2-CB 4.41Å; I870-I886 HydrophobicContact CB-CG1 4.34Å; I870-I886 HydrophobicContact CG2-CD1 3.86Å; I870-I886 HydrophobicContact CG2-CG1 3.5Å; I870-L889 HydrophobicContact CD1-CD1 4.22Å
871	R	79.2	Confident	75.4	Confident	147 Å²	147	87.7 Å²	87.7	56%	0.555	42%	0.422	S	S	*	.	H	α-helix	trans	-59.4	-42.2	175.3	-77.9	176.1	-178.4	172.9	1.6	112.1	L867 E868 A874 Q875 I886	L867-R871 WeakPolarHBondContact O-CB 3.48Å; L867-R871 WeakPolarHBondContact O-CG 3.36Å; L867-R871 PolarHBondContact O-N 3.29Å; E868-R871 WeakPolarHBondContact O-CB 3.45Å; E868-R871 PolarHBondContact O-N 3.05Å; R871-A874 PolarHBondContact O-N 2.95Å; R871-Q875 WeakPolarHBondContact O-CG 3.34Å; R871-Q875 PolarHBondContact O-N 3.14Å; R871-I886 HydrophobicContact CB-CD1 4.48Å; R871-I886 HydrophobicContact CG-CD1 4.01Å; R871-I886 HydrophobicContact CG-CG2 4.15Å
872	H	76.8	Confident	75	Confident	119 Å²	119	78.3 Å²	78.3	55%	0.551	39%	0.387	S	S	*	.	H	α-helix	trans	-68.5	-37.5	176.5	-170.9	-81.6	0	0	0	112	E868 S869 I870 Q875	E868-H872 PolarHBondContact O-N 3.35Å; S869-H872 PolarHBondContact O-N 3.22Å; I870-H872 VanDerWaalsContact C-N 3.32Å; I870-H872 PolarHBondContact O-N 3.04Å; H872-Q875 PolarHBondContact O-N 3.32Å
873	Q	73.5	Confident	74.4	Confident	70 Å²	70	78.3 Å²	78.3	33%	0.327	39%	0.39	S	S	.	.	H	α-helix	trans	-68.2	-37.5	175.3	-73.7	175.7	-4.6	0	0	112.5	S869 I870 Q875 R876 M879 L882	S869-Q873 WeakPolarHBondContact O-CG 3.26Å; S869-Q873 PolarHBondContact O-N 3.32Å; I870-Q873 PolarHBondContact O-N 3.26Å; Q873-Q875 PolarHBondContact O-N 2.84Å; Q873-R876 WeakPolarHBondContact O-CB 3.22Å; Q873-R876 PolarHBondContact O-N 3.17Å; Q873-R876 VanDerWaalsContact O-N 3.08Å; Q873-M879 WeakPolarHBondContact O-CB 3.29Å; Q873-L882 HydrophobicContact CB-CD1 4.16Å
874	A	75.1	Confident	73.8	Confident	17 Å²	17	83.4 Å²	83.4	14%	0.14	42%	0.417	C	S	.	.	H	α-helix	trans	-66.8	-17	178	0	0	0	0	0	114	I870 R871 R876 L882 I886	I870-A874 WeakPolarHBondContact O-CB 3.38Å; I870-A874 PolarHBondContact O-N 3.47Å; R871-A874 PolarHBondContact O-N 2.95Å; A874-R876 PolarHBondContact O-N 2.98Å; A874-L882 HydrophobicContact CB-CB 3.93Å; A874-I886 HydrophobicContact CB-CD1 3.56Å
875	Q	74.1	Confident	73.1	Confident	153 Å²	153	80.3 Å²	80.3	72%	0.715	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-13.4	173	-69.4	173	4.8	0	0	112.8	R871 H872 Q873	R871-Q875 WeakPolarHBondContact O-CG 3.34Å; R871-Q875 PolarHBondContact O-N 3.14Å; H872-Q875 PolarHBondContact O-N 3.32Å; Q873-Q875 PolarHBondContact O-N 2.84Å
876	R	74.8	Confident	72.6	Confident	160 Å²	160	72.7 Å²	72.7	60%	0.604	38%	0.375	S	S	*	.	S	Bend	trans	-79.2	136.4	174.7	-63.9	-176	177.7	-177.7	-0.7	110.3	Q873 A874 D878 M879	Q873-R876 WeakPolarHBondContact O-CB 3.22Å; Q873-R876 PolarHBondContact O-N 3.17Å; Q873-R876 VanDerWaalsContact O-N 3.08Å; A874-R876 PolarHBondContact O-N 2.98Å; R876-D878 VanDerWaalsContact C-N 3.27Å; R876-D878 PolarHBondContact O-N 2.85Å; R876-M879 HydrophobicContact CB-CB 4.48Å; R876-M879 PolarHBondContact O-N 3.28Å
877	P	61.6	Low	71.9	Confident	117 Å²	117	78.5 Å²	78.5	76%	0.76	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-59.1	-33.5	-174.5	20.1	-30.7	0	0	0	113.8	M879	P877-M879 PolarHBondContact O-N 3.29Å
878	D	64.2	Low	71.4	Confident	132 Å²	132	85.5 Å²	85.5	71%	0.706	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-74.3	-12.3	-179.9	-56.6	-35.4	0	0	0	113.9	R876	R876-D878 VanDerWaalsContact C-N 3.27Å; R876-D878 PolarHBondContact O-N 2.85Å
879	M	68.9	Low	70.9	Confident	82 Å²	82	80.3 Å²	80.3	40%	0.404	40%	0.401	S	S	.	.	G	3₁₀ helix	trans	-119.3	19.1	-171.2	-67.1	-67.4	-175.3	0	0	113.2	Q873 R876 P877 H881 L882	Q873-M879 WeakPolarHBondContact O-CB 3.29Å; R876-M879 HydrophobicContact CB-CB 4.48Å; R876-M879 PolarHBondContact O-N 3.28Å; P877-M879 PolarHBondContact O-N 3.29Å; M879-H881 PolarHBondContact O-N 3.17Å; M879-H881 VanDerWaalsContact O-N 3.1Å; M879-L882 HydrophobicContact CB-CD1 3.97Å; M879-L882 HydrophobicContact CB-CG 4.43Å; M879-L882 HydrophobicContact CG-CD1 4.44Å; M879-L882 WeakPolarHBondContact O-CB 3.39Å; M879-L882 WeakPolarHBondContact O-CG 3.33Å; M879-L882 PolarHBondContact O-N 3.42Å; M879-L882 HydrophobicContact SD-CD1 4.27Å
880	A	65.7	Low	70.3	Confident	60 Å²	60	81 Å²	81	50%	0.496	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.5	-177.7	0	0	0	0	0	114.1	L882 S883	A880-L882 PolarHBondContact O-N 3.35Å; A880-L882 VanDerWaalsContact O-N 3.15Å; A880-S883 VanDerWaalsContact O-CB 3.22Å; A880-S883 WeakPolarHBondContact O-CB 3.38Å; A880-S883 PolarHBondContact O-N 2.77Å
881	H	68.8	Low	69.5	Low	48 Å²	48	83.8 Å²	83.8	22%	0.222	43%	0.425	C	S	.	.	H	α-helix	trans	-61.2	-18.6	175.7	66.7	-81.1	0	0	0	113.9	K837 M879 S883 T885	K837-H881 HydrophobicContact CG-CB 4.49Å; M879-H881 PolarHBondContact O-N 3.17Å; M879-H881 VanDerWaalsContact O-N 3.1Å; H881-S883 VanDerWaalsContact C-N 3.29Å; H881-T885 PolarHBondContact O-OG1 2.75Å
882	L	69.6	Low	68.5	Low	6 Å²	6	85.4 Å²	85.4	3%	0.031	44%	0.439	C	S	.	.	H	α-helix	trans	-72.5	-22.6	173.6	-61.6	178.7	0	0	0	112.3	L836 I870 Q873 A874 M879 A880 D884 T885 I886	L836-L882 HydrophobicContact CB-CD2 4.29Å; L836-L882 HydrophobicContact CD1-CD2 3.53Å; I870-L882 HydrophobicContact CG2-CB 4.41Å; Q873-L882 HydrophobicContact CB-CD1 4.16Å; A874-L882 HydrophobicContact CB-CB 3.93Å; M879-L882 HydrophobicContact CB-CD1 3.97Å; M879-L882 HydrophobicContact CB-CG 4.43Å; M879-L882 HydrophobicContact CG-CD1 4.44Å; M879-L882 WeakPolarHBondContact O-CB 3.39Å; M879-L882 WeakPolarHBondContact O-CG 3.33Å; M879-L882 PolarHBondContact O-N 3.42Å; M879-L882 HydrophobicContact SD-CD1 4.27Å; A880-L882 PolarHBondContact O-N 3.35Å; A880-L882 VanDerWaalsContact O-N 3.15Å; L882-D884 PolarHBondContact O-N 2.9Å; L882-T885 WeakPolarHBondContact O-CB 3.28Å; L882-T885 PolarHBondContact O-N 2.75Å; L882-T885 VanDerWaalsContact O-N 3.14Å; L882-I886 VanDerWaalsContact O-CG1 3.27Å; L882-I886 WeakPolarHBondContact O-CG1 3.15Å; L882-I886 PolarHBondContact O-N 2.73Å
883	S	66.3	Low	66.8	Low	58 Å²	58	84.8 Å²	84.8	41%	0.406	45%	0.448	S	S	.	.	H	α-helix	trans	-61.6	-43.2	178.9	-173.4	0	0	0	0	112.5	A880 H881 T885 I886 Q887	A880-S883 VanDerWaalsContact O-CB 3.22Å; A880-S883 WeakPolarHBondContact O-CB 3.38Å; A880-S883 PolarHBondContact O-N 2.77Å; H881-S883 VanDerWaalsContact C-N 3.29Å; S883-T885 VanDerWaalsContact C-N 3.27Å; S883-T885 PolarHBondContact O-N 3.37Å; S883-I886 PolarHBondContact O-N 3.17Å; S883-Q887 PolarHBondContact O-N 3.12Å
884	D	67.2	Low	65.3	Low	107 Å²	107	91.2 Å²	91.2	57%	0.572	47%	0.469	S	S	*	.	H	α-helix	trans	-67.6	-31.6	175.6	-72.8	-7.5	0	0	0	112	L882	L882-D884 PolarHBondContact O-N 2.9Å
885	T	67.5	Low	63.2	Low	8 Å²	8	100.1 Å²	100.1	5%	0.049	52%	0.522	C	S	.	.	H	α-helix	trans	-72.7	-40.5	178.1	-42.1	0	0	0	0	110.6	I846 H881 L882 S883 Q887 R888 L889	I846-T885 HydrophobicContact CD1-CG2 4.26Å; I846-T885 HydrophobicContact CG1-CG2 4Å; H881-T885 PolarHBondContact O-OG1 2.75Å; L882-T885 WeakPolarHBondContact O-CB 3.28Å; L882-T885 PolarHBondContact O-N 2.75Å; L882-T885 VanDerWaalsContact O-N 3.14Å; S883-T885 VanDerWaalsContact C-N 3.27Å; S883-T885 PolarHBondContact O-N 3.37Å; T885-Q887 VanDerWaalsContact C-N 3.33Å; T885-Q887 PolarHBondContact O-N 3.2Å; T885-R888 PolarHBondContact O-N 3.43Å; T885-L889 HydrophobicContact CG2-CD1 4.12Å; T885-L889 VanDerWaalsContact O-CG 3.3Å; T885-L889 WeakPolarHBondContact O-CG 3.13Å; T885-L889 PolarHBondContact O-N 3.05Å
886	I	69.3	Low	62.6	Low	28 Å²	28	97.5 Å²	97.5	14%	0.144	51%	0.513	C	S	.	.	H	α-helix	trans	-57.5	-41.3	177.6	-70.8	160.2	0	0	0	112.2	I870 R871 A874 L882 S883 R888 L889	I870-I886 HydrophobicContact CB-CG1 4.34Å; I870-I886 HydrophobicContact CG2-CD1 3.86Å; I870-I886 HydrophobicContact CG2-CG1 3.5Å; R871-I886 HydrophobicContact CB-CD1 4.48Å; R871-I886 HydrophobicContact CG-CD1 4.01Å; R871-I886 HydrophobicContact CG-CG2 4.15Å; A874-I886 HydrophobicContact CB-CD1 3.56Å; L882-I886 VanDerWaalsContact O-CG1 3.27Å; L882-I886 WeakPolarHBondContact O-CG1 3.15Å; L882-I886 PolarHBondContact O-N 2.73Å; S883-I886 PolarHBondContact O-N 3.17Å; I886-R888 PolarHBondContact O-N 3.39Å; I886-R888 VanDerWaalsContact O-N 3.16Å; I886-L889 PolarHBondContact O-N 2.98Å; I886-L889 VanDerWaalsContact O-N 3.14Å
887	Q	66.9	Low	62	Low	151 Å²	151	94.2 Å²	94.2	71%	0.706	51%	0.508	S	S	*	.	H	α-helix	trans	-60.4	-26.3	179.8	-68.9	-177.3	5	0	0	112.5	S883 T885	S883-Q887 PolarHBondContact O-N 3.12Å; T885-Q887 VanDerWaalsContact C-N 3.33Å; T885-Q887 PolarHBondContact O-N 3.2Å
888	R	69.3	Low	62	Low	163 Å²	163	92.9 Å²	92.9	62%	0.615	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-4.3	-178	-60.9	-179.2	-178.5	-179.6	2.2	113.8	I846 T885 I886	I846-R888 HydrophobicContact CD1-CB 4Å; I846-R888 HydrophobicContact CD1-CG 4.49Å; I846-R888 HydrophobicContact CG1-CB 4.33Å; I846-R888 HydrophobicContact CG2-CB 4.36Å; T885-R888 PolarHBondContact O-N 3.43Å; I886-R888 PolarHBondContact O-N 3.39Å; I886-R888 VanDerWaalsContact O-N 3.16Å
889	L	71.1	Confident	61.9	Low	2 Å²	2	90.6 Å²	90.6	1%	0.01	48%	0.481	C	S	.	.			trans	-100.9	24.9	-179	-63.6	167.6	0	0	0	112.8	F827 I846 W849 L867 I870 T885 I886 L891	F827-L889 HydrophobicContact CE2-CD1 4.5Å; F827-L889 HydrophobicContact CE2-CD2 4.1Å; F827-L889 HydrophobicContact CZ-CD1 4.18Å; F827-L889 HydrophobicContact CZ-CD2 4.3Å; I846-L889 HydrophobicContact CG1-CD2 4.43Å; W849-L889 HydrophobicContact CB-CD2 3.35Å; W849-L889 HydrophobicContact CD2-CB 4.45Å; W849-L889 HydrophobicContact CD2-CD2 3.81Å; W849-L889 HydrophobicContact CE3-CD2 4.48Å; W849-L889 HydrophobicContact CG-CB 4.42Å; W849-L889 HydrophobicContact CG-CD2 3.27Å; W849-L889 HydrophobicContact CG-CG 4.42Å; W849-L889 PolarHBondContact NE1-O 2.83Å; L867-L889 HydrophobicContact CD2-CB 3.81Å; I870-L889 HydrophobicContact CD1-CD1 4.22Å; T885-L889 HydrophobicContact CG2-CD1 4.12Å; T885-L889 VanDerWaalsContact O-CG 3.3Å; T885-L889 WeakPolarHBondContact O-CG 3.13Å; T885-L889 PolarHBondContact O-N 3.05Å; I886-L889 PolarHBondContact O-N 2.98Å; I886-L889 VanDerWaalsContact O-N 3.14Å; L889-L891 PolarHBondContact O-N 2.62Å
890	A	65.5	Low	61.5	Low	73 Å²	73	91.2 Å²	91.2	60%	0.603	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-59.7	129.8	-176.8	0	0	0	0	0	112.3	Q892	A890-Q892 PolarHBondContact O-N 2.86Å
891	L	65.2	Low	61.2	Low	58 Å²	58	93.3 Å²	93.3	30%	0.304	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-71.9	123.6	170.9	-72.8	167.1	0	0	0	108.8	W849 H853 I864 L867 L889 S893	W849-L891 HydrophobicContact CZ2-CD2 3.86Å; W849-L891 HydrophobicContact CZ2-CG 4.24Å; H853-L891 WeakPolarHBondContact NE2-CD2 3.29Å; I864-L891 HydrophobicContact CG1-CD1 3.66Å; L867-L891 HydrophobicContact CD1-CD1 3.65Å; L867-L891 HydrophobicContact CD1-CG 3.71Å; L889-L891 PolarHBondContact O-N 2.62Å; L891-S893 PolarHBondContact O-N 3.46Å
892	Q	56.9	Low	60.6	Low	182 Å²	182	96.5 Å²	96.5	85%	0.85	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-65.8	117.4	169.7	-70.2	-179.3	-15	0	0	108.6	A890 R894	A890-Q892 PolarHBondContact O-N 2.86Å; Q892-R894 PolarHBondContact O-N 3.43Å
893	S	41.8	Very low	59.9	Low	106 Å²	106	103.5 Å²	103.5	74%	0.741	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-62.5	119.4	169.5	52	0	0	0	0	108.4	L891 T895	L891-S893 PolarHBondContact O-N 3.46Å; S893-T895 PolarHBondContact O-N 3.46Å; S893-T895 VanDerWaalsContact O-N 3.09Å
894	R	42	Very low	59.4	Low	204 Å²	204	107.3 Å²	107.3	77%	0.77	55%	0.552	S	S	*	*			trans	-60.1	113.8	167.9	-77.5	-175.6	176	-179.8	-0	108.3	G856 Q892	G856-R894 PolarHBondContact O-NH2 3.08Å; Q892-R894 PolarHBondContact O-N 3.43Å
895	T	30.3	Very low	58.7	Low	205 Å²	205	107.3 Å²	107.3	100%	1.258	55%	0.55	S	S	*	*			trans	-82.9	0	149.2	44.8	0	0	0	0	109	S893	S893-T895 PolarHBondContact O-N 3.46Å; S893-T895 VanDerWaalsContact O-N 3.09Å

Retrieved 895 of 895 residues in 1151.2 ms (Link to these results)

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