A0A096NWI2_PAPAN Loading...

Ras-associating and dilute domain-containing protein

Downstream effector of Rap required for cell adhesion and migration of neural crest precursors during development.

AlphaFold DB , UniProt , Accession A0A096NWI2, Species PAPAN (Papio anubis, Olive baboon), Gene RADIL, Length 1,071 aa.

						>A0A096NWI2_PAPAN|A0A096NWI2|RADIL
MFYGTHFIMSPPTKSKLKRQSQLLSSMLSRTLTYKYRDLDSTFSSLGASDDPAELSTQLSAPGVLKVFGDSVCTGTHYKSVLATGTSSARELVKEALERYALDPGQAGQYVLCDVVGQAGDTGQRWQAQCFRVFGDSEKPLLIQELWKPREGLSRRFELRKRSDVEELAAKEVDTITAGINAQARRLQRSRAKGTPALALGDARSSPPPRLRRTVSETSLSPVNALPAATQGSEEPGPDTMRYSLYHSPHLLLLQGYSQQHDSLVYVLNRDRHTVGQRTPSSKPSISLSAPDILPLHCTIRRHPLPDSSQPGGRLVLEPIPGAPISVNFSEVGRRTVVLHHGDLLSLGLYYLLLFKDPAQAQPLPARALARLRAVPQSCRLCGAALGARDAASPTQAALPRRQQLLLEFEPHLEDTLLQRIMTLIEPGGDDHKLTPAFLLCLCIQHSATHFEPGMFGQLLLKIARLIRETIWEKTKELAEKQAQLQEPISLAGCAMADLVPDLQPILFWMSNSIELLYFIQQKCPLYMQSMEEQLDVTGSKESLFSCTLTASEEAMAVLEEVVLYAFQQCVYYVSKSLYICLPALLECPPFQMERRESWCSAPELPEELRRVVSVYQAALDLLRQLQVHPEVASQMLAYLFFFSGTLLLNQLLDRGPSLSCFHWPRGVQACARLQQLLEWMRSAGFGAAGEHFFRKLSCTLNLLATPRAQLIQMSWTALRAAFPALSPAQLHRLLTHYQLASAMGPVSTWEPGAQDSPEAFRSEDVLESYENPPPIVLPSEGFQVDLEADCLDDSIYQHLLYIRHFLWGLRSRASPGSPGSGAPQPACPEGMHHAIPDGHPEAPSCPLASRDPGPAAREAAPERTLPLRGAPWAQAPPGRQPSRGGSQAGPPHTDSSCLLTPPSTPLGPEPGDPDWAESGGPCGKVLPERQRNGPSGLRGAALEGDSAAPEDESPPAPSSRSSSTEDFCYVFTVELERGPSGLGMGLIDGMHTRLGAPGLYIQTLLPGSPAAADGRLSLGDRILEVNGSSLLGLGYLRAVDLIRHGGKKMRFLVAKSDVETAKKIHFRTPP
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	26.3	Very low	26.3	Very low	232 Å²	232	136.9 Å²	136.9	100%	1.143	72%	0.72	S	S	*	*				0	89.3	0	-59.9	169.4	-171.3	0	0	108
2	F	25	Very low	26.1	Very low	174 Å²	174	130.8 Å²	130.8	76%	0.763	69%	0.694	S	S	*	*			trans	-140.2	-8.2	177.3	-92	-75.3	0	0	0	114.3	G4	F2-G4 VanDerWaalsContact C-N 3.34Å
3	Y	31.3	Very low	26.2	Very low	182 Å²	182	127.6 Å²	127.6	71%	0.714	68%	0.683	S	S	*	*			trans	-99.2	58	162.7	-65.6	-74.1	0	0	0	109.3
4	G	23.8	Very low	26.8	Very low	71 Å²	71	129.9 Å²	129.9	73%	0.732	68%	0.684	S	S	*	*	S	Bend	trans	-109.9	-7.1	-178	0	0	0	0	0	114.3	F2	F2-G4 VanDerWaalsContact C-N 3.34Å
5	T	23.1	Very low	27.1	Very low	122 Å²	122	127.3 Å²	127.3	75%	0.748	68%	0.68	S	S	*	*	S	Bend	trans	-137.6	140.9	169.6	40.4	0	0	0	0	107.4
6	H	27.7	Very low	27.3	Very low	166 Å²	166	128.4 Å²	128.4	77%	0.769	68%	0.677	S	S	*	*			trans	-66.1	140.1	170.3	-67	-99.6	0	0	0	108.9	I8	H6-I8 HydrophobicContact CB-CD1 4.01Å; H6-I8 HydrophobicContact CB-CG1 3.74Å; H6-I8 PolarHBondContact O-N 2.82Å
7	F	26.7	Very low	27.9	Very low	157 Å²	157	126.2 Å²	126.2	69%	0.689	67%	0.665	S	S	*	*			trans	-73.7	60.7	167.4	-120.8	-86.1	0	0	0	109.8	M9 Y572	F7-M9 VanDerWaalsContact C-N 3.25Å; F7-M9 PolarHBondContact O-N 3.3Å; F7-Y572 HydrophobicContact CB-CE2 4.11Å
8	I	27.1	Very low	28.4	Very low	121 Å²	121	128.3 Å²	128.3	62%	0.621	67%	0.668	S	S	*	*			trans	-71.3	90.7	169.1	-62.9	166.4	0	0	0	105.9	H6 S10	H6-I8 HydrophobicContact CB-CD1 4.01Å; H6-I8 HydrophobicContact CB-CG1 3.74Å; H6-I8 PolarHBondContact O-N 2.82Å; I8-S10 PolarHBondContact O-N 3.18Å
9	M	27.6	Very low	28.7	Very low	87 Å²	87	132.2 Å²	132.2	43%	0.429	67%	0.673	S	S	.	*			trans	-56.2	99.2	151.3	-72.3	-158.9	72.6	0	0	106.1	F7 P11 Q568	F7-M9 VanDerWaalsContact C-N 3.25Å; F7-M9 PolarHBondContact O-N 3.3Å; M9-P11 WeakPolarHBondContact O-CD 3.48Å; M9-Q568 HydrophobicContact CE-CG 4.5Å; M9-Q568 HydrophobicContact SD-CG 4.32Å
10	S	23	Very low	28.9	Very low	97 Å²	97	132.1 Å²	132.1	68%	0.678	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-63.8	120.6	-177.8	-68.4	0	0	0	0	107.2	I8	I8-S10 PolarHBondContact O-N 3.18Å
11	P	27.3	Very low	29.2	Very low	97 Å²	97	129.6 Å²	129.6	63%	0.63	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-57	135.4	179.1	23.2	-32.9	0	0	0	108.3	M9 T13	M9-P11 WeakPolarHBondContact O-CD 3.48Å; P11-T13 PolarHBondContact O-N 3.44Å; P11-T13 VanDerWaalsContact O-N 3.1Å
12	P	24.7	Very low	29.5	Very low	63 Å²	63	125.5 Å²	125.5	41%	0.409	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-54.9	123.9	-175.2	22	-33	0	0	0	109	K14 L17	P12-K14 PolarHBondContact O-N 3.47Å; P12-L17 HydrophobicContact CG-CD1 4.31Å
13	T	26.7	Very low	30	Very low	90 Å²	90	122.8 Å²	122.8	55%	0.552	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-54.8	130.8	-169.1	43.7	0	0	0	0	110.5	P11 S15 K16	P11-T13 PolarHBondContact O-N 3.44Å; P11-T13 VanDerWaalsContact O-N 3.1Å; T13-S15 PolarHBondContact O-N 2.99Å; T13-K16 PolarHBondContact O-N 3.4Å
14	K	35.4	Very low	30	Very low	160 Å²	160	120 Å²	120	70%	0.696	63%	0.632	S	S	*	*	H	α-helix	trans	-57.2	-11.9	-168.5	-59.3	-159.4	176.6	-145.5	0	114.4	P12 E561	P12-K14 PolarHBondContact O-N 3.47Å; K14-E561 IonicContact NZ-OE2 3.48Å; K14-E561 PolarHBondContact NZ-OE2 3.38Å
15	S	30.7	Very low	30.3	Very low	90 Å²	90	121 Å²	121	63%	0.629	63%	0.628	S	S	*	*	H	α-helix	trans	-75.1	-23	171.4	52.5	0	0	0	0	115.5	T13	T13-S15 PolarHBondContact O-N 2.99Å
16	K	31.1	Very low	30.7	Very low	146 Å²	146	118.7 Å²	118.7	64%	0.635	62%	0.617	S	S	*	*	H	α-helix	trans	-80.2	-49.3	177.2	-75.7	-171.4	175	-177.5	0	112.2	T13 K18 R19	T13-K16 PolarHBondContact O-N 3.4Å; K16-K18 PolarHBondContact O-N 3.04Å; K16-R19 PolarHBondContact O-N 3.36Å
17	L	37.3	Very low	30.7	Very low	91 Å²	91	117.6 Å²	117.6	48%	0.476	61%	0.614	S	S	.	*	H	α-helix	trans	-56.8	-44.9	-178.5	-76.6	164.6	0	0	0	112.8	P12 R19 Q20 S21	P12-L17 HydrophobicContact CG-CD1 4.31Å; L17-R19 PolarHBondContact O-N 3.5Å; L17-Q20 PolarHBondContact O-N 3.47Å; L17-S21 PolarHBondContact O-N 2.89Å; L17-S21 VanDerWaalsContact O-N 3.12Å
18	K	35.8	Very low	30.9	Very low	164 Å²	164	117.5 Å²	117.5	71%	0.713	62%	0.62	S	S	*	*	H	α-helix	trans	-57.9	-21.6	177.2	-103.9	-169.7	174.3	-172.3	0	114.2	K16 Q22	K16-K18 PolarHBondContact O-N 3.04Å; K18-Q22 WeakPolarHBondContact O-CG 3.5Å
19	R	34.3	Very low	30.9	Very low	201 Å²	201	116.6 Å²	116.6	76%	0.758	62%	0.624	S	S	*	*	H	α-helix	trans	-89.2	-17.6	179.5	-135.8	177.3	-169.9	-175.3	2.5	114	K16 L17	K16-R19 PolarHBondContact O-N 3.36Å; L17-R19 PolarHBondContact O-N 3.5Å
20	Q	33.3	Very low	31.1	Very low	130 Å²	130	123.2 Å²	123.2	61%	0.607	64%	0.644	S	S	*	*	H	α-helix	trans	-90.3	-39.8	171.7	-76.3	176.8	-85.6	0	0	111.9	L17 Q22 L23 L24	L17-Q20 PolarHBondContact O-N 3.47Å; Q20-Q22 VanDerWaalsContact C-N 3.31Å; Q20-Q22 PolarHBondContact O-N 3.08Å; Q20-L23 PolarHBondContact O-N 3.39Å; Q20-L24 PolarHBondContact O-N 3.26Å
21	S	34.2	Very low	31.2	Very low	80 Å²	80	125 Å²	125	56%	0.559	65%	0.651	S	S	*	*	H	α-helix	trans	-51.5	-47.6	173.8	161.1	0	0	0	0	112.2	L17 L23 L24 S25	L17-S21 PolarHBondContact O-N 2.89Å; L17-S21 VanDerWaalsContact O-N 3.12Å; S21-L23 VanDerWaalsContact C-N 3.3Å; S21-L23 PolarHBondContact O-N 3.08Å; S21-L24 PolarHBondContact O-N 2.83Å; S21-S25 PolarHBondContact O-N 3.47Å
22	Q	33.4	Very low	31.1	Very low	146 Å²	146	128.5 Å²	128.5	68%	0.682	66%	0.664	S	S	*	*	H	α-helix	trans	-65.9	-26	178.7	-71.4	-175.3	-32.7	0	0	114.4	K18 Q20	K18-Q22 WeakPolarHBondContact O-CG 3.5Å; Q20-Q22 VanDerWaalsContact C-N 3.31Å; Q20-Q22 PolarHBondContact O-N 3.08Å
23	L	34.6	Very low	31.2	Very low	117 Å²	117	132 Å²	132	61%	0.613	68%	0.684	S	S	*	*	H	α-helix	trans	-74.4	-42.5	177.1	-80.8	165.9	0	0	0	111.6	Q20 S21 S25 S26	Q20-L23 PolarHBondContact O-N 3.39Å; S21-L23 VanDerWaalsContact C-N 3.3Å; S21-L23 PolarHBondContact O-N 3.08Å; L23-S25 PolarHBondContact O-N 2.97Å; L23-S26 PolarHBondContact O-N 3.2Å; L23-S26 PolarHBondContact O-OG 3.1Å
24	L	32.3	Very low	31.1	Very low	123 Å²	123	137.7 Å²	137.7	64%	0.644	70%	0.697	S	S	*	*	H	α-helix	trans	-63.7	-40.6	178.6	-72.2	167.4	0	0	0	112.6	Q20 S21 S26 M27	Q20-L24 PolarHBondContact O-N 3.26Å; S21-L24 PolarHBondContact O-N 2.83Å; L24-S26 PolarHBondContact O-N 3.11Å; L24-M27 PolarHBondContact O-N 3.38Å; L24-M27 VanDerWaalsContact O-N 3.11Å
25	S	30.9	Very low	30.6	Very low	92 Å²	92	138.1 Å²	138.1	64%	0.643	70%	0.699	S	S	*	*	H	α-helix	trans	-52.4	-40.6	175.1	175.1	0	0	0	0	112.7	S21 L23	S21-S25 PolarHBondContact O-N 3.47Å; L23-S25 PolarHBondContact O-N 2.97Å
26	S	30.5	Very low	30.2	Very low	75 Å²	75	145 Å²	145	52%	0.524	71%	0.712	S	S	.	*	H	α-helix	trans	-74.9	-21.8	-179.1	68	0	0	0	0	115.6	L23 L24 S29	L23-S26 PolarHBondContact O-N 3.2Å; L23-S26 PolarHBondContact O-OG 3.1Å; L24-S26 PolarHBondContact O-N 3.11Å; S26-S29 PolarHBondContact O-OG 2.61Å
27	M	27.4	Very low	29.9	Very low	143 Å²	143	148.2 Å²	148.2	70%	0.704	72%	0.721	S	S	*	*	H	α-helix	trans	-77.9	-26.2	-176.8	-75.2	-73.3	-152.7	0	0	113.3	L24 S29	L24-M27 PolarHBondContact O-N 3.38Å; L24-M27 VanDerWaalsContact O-N 3.11Å; M27-S29 PolarHBondContact O-N 3.41Å
28	L	30.7	Very low	29.2	Very low	155 Å²	155	150 Å²	150	81%	0.812	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	0.2	-170.2	-73.9	168.6	0	0	0	115.4
29	S	27.8	Very low	28.7	Very low	102 Å²	102	150.1 Å²	150.1	71%	0.713	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-2.4	-176.5	60	0	0	0	0	115.4	S26 M27	S26-S29 PolarHBondContact O-OG 2.61Å; M27-S29 PolarHBondContact O-N 3.41Å
30	R	31.2	Very low	28.2	Very low	226 Å²	226	147.9 Å²	147.9	85%	0.853	74%	0.742	S	S	*	*	S	Bend	trans	-147.3	53.7	-172.9	-74.4	-166.9	168.5	-177.6	-2.7	117.5
31	T	25.7	Very low	27.9	Very low	134 Å²	134	146.1 Å²	146.1	82%	0.822	74%	0.743	S	S	*	*			trans	-151.8	75.4	165.1	3.9	0	0	0	0	114.4
32	L	25.5	Very low	27.3	Very low	170 Å²	170	148.7 Å²	148.7	89%	0.89	76%	0.756	S	S	*	*			trans	-134.9	77.6	168.3	-81.4	178.8	0	0	0	112.1
33	T	26.1	Very low	26.9	Very low	136 Å²	136	152.1 Å²	152.1	83%	0.834	77%	0.769	S	S	*	*			trans	-175.1	106.2	154.4	8	0	0	0	0	112
34	Y	25.2	Very low	26.5	Very low	210 Å²	210	152.2 Å²	152.2	82%	0.824	78%	0.78	S	S	*	*				-166.7	160.2	120.4	-125.1	-98.9	0	0	0	113.7
35	K	24	Very low	26.1	Very low	170 Å²	170	152 Å²	152	74%	0.739	79%	0.788	S	S	*	*			trans	-74.2	154.8	-156.4	-62.8	166.2	177.7	169.7	0	117.8
36	Y	22.8	Very low	25.9	Very low	233 Å²	233	156.1 Å²	156.1	91%	0.914	80%	0.802	S	S	*	*			trans	-46.8	142.2	154.8	-124.7	-107.1	0	0	0	115.3
37	R	24.4	Very low	25.9	Very low	214 Å²	214	156.3 Å²	156.3	81%	0.808	82%	0.816	S	S	*	*			trans	172.5	152	150.1	-99.4	-175.2	174.9	-117.4	5.4	108.2
38	D	23	Very low	26	Very low	128 Å²	128	154.9 Å²	154.9	68%	0.684	83%	0.827	S	S	*	*			cis	-137.4	174	1.3	-94	-52	0	0	0	109.4
39	L	26	Very low	26	Very low	168 Å²	168	152.7 Å²	152.7	88%	0.88	82%	0.824	S	S	*	*			trans	-97.9	150.6	168.7	-75.4	154	0	0	0	110.2
40	D	23.6	Very low	26.7	Very low	154 Å²	154	153.4 Å²	153.4	82%	0.824	82%	0.82	S	S	*	*				-168.5	-171	112.8	-136.9	-45	0	0	0	112.3
41	S	25.7	Very low	27.7	Very low	92 Å²	92	145.6 Å²	145.6	64%	0.643	80%	0.795	S	S	*	*			trans	-138.5	154.9	-148.3	59.3	0	0	0	0	114.8
42	T	23.1	Very low	29	Very low	135 Å²	135	144.8 Å²	144.8	83%	0.828	79%	0.792	S	S	*	*			trans	-169.6	130.5	152.8	-0.4	0	0	0	0	112
43	F	24.7	Very low	30.5	Very low	218 Å²	218	137.9 Å²	137.9	96%	0.956	76%	0.76	S	S	*	*			trans	-156.1	149.9	155.8	-107	-74.6	0	0	0	110.6
44	S	25.2	Very low	32.1	Very low	119 Å²	119	133 Å²	133	83%	0.832	73%	0.728	S	S	*	*			trans	-113.1	154.2	-166.3	-60.9	0	0	0	0	113.6
45	S	24.6	Very low	33.7	Very low	118 Å²	118	126.2 Å²	126.2	83%	0.825	71%	0.705	S	S	*	*			trans	-89	157.5	-178.4	56.8	0	0	0	0	114
46	L	27.6	Very low	35.5	Very low	179 Å²	179	118.1 Å²	118.1	94%	0.937	67%	0.67	S	S	*	*			trans	-153.2	122.7	173	-112.5	163.2	0	0	0	112.6
47	G	29.4	Very low	37.1	Very low	79 Å²	79	108.8 Å²	108.8	81%	0.814	64%	0.637	S	S	*	*			trans	68.8	118	151.2	0	0	0	0	0	120.1
48	A	29.1	Very low	38.3	Very low	112 Å²	112	103.6 Å²	103.6	93%	0.926	62%	0.622	S	S	*	*			trans	-135.3	150.6	161.1	0	0	0	0	0	110.2
49	S	31.2	Very low	39.4	Very low	109 Å²	109	103.3 Å²	103.3	76%	0.762	62%	0.62	S	S	*	*			trans	-115.9	154.9	-175.1	57	0	0	0	0	112.9
50	D	42.3	Very low	40	Very low	117 Å²	117	100 Å²	100	63%	0.626	61%	0.611	S	S	*	*			trans	-64.7	139.6	-179.3	-73.5	-20.9	0	0	0	113.5	L59	D50-L59 HydrophobicContact CB-CD1 4.41Å; D50-L59 WeakPolarHBondContact OD1-CB 3.47Å; D50-L59 WeakPolarHBondContact OD1-CD1 3.43Å
51	D	52.7	Low	41.1	Very low	62 Å²	62	94.7 Å²	94.7	33%	0.332	59%	0.588	S	S	.	*			trans	-93.4	118.2	179.7	-179	-9.2	0	0	0	111.6	A53 K148	D51-A53 VanDerWaalsContact C-N 3.27Å; D51-A53 PolarHBondContact O-N 3.02Å; D51-A53 VanDerWaalsContact OD1-CB 3.29Å; D51-A53 WeakPolarHBondContact OD1-CB 3.44Å; D51-A53 PolarHBondContact OD1-N 3.4Å; D51-K148 IonicContact OD2-NZ 3.79Å; D51-K148 PolarHBondContact OD2-NZ 3.3Å
52	P	52.9	Low	42.3	Very low	117 Å²	117	96.6 Å²	96.6	76%	0.76	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-9.6	-178.6	30.6	-36	0	0	0	114.9	E54	P52-E54 VanDerWaalsContact C-N 3.31Å; P52-E54 PolarHBondContact O-N 3.1Å
53	A	56.1	Low	44.2	Very low	25 Å²	25	91.7 Å²	91.7	21%	0.207	58%	0.575	C	S	.	*	T	Hydrogen-bonded Turn	trans	-73.1	-21.3	179.9	0	0	0	0	0	113.6	D51 S154 R155	D51-A53 VanDerWaalsContact C-N 3.27Å; D51-A53 PolarHBondContact O-N 3.02Å; D51-A53 VanDerWaalsContact OD1-CB 3.29Å; D51-A53 WeakPolarHBondContact OD1-CB 3.44Å; D51-A53 PolarHBondContact OD1-N 3.4Å; A53-S154 WeakPolarHBondContact O-CA 3.38Å; A53-S154 WeakPolarHBondContact O-CB 3.17Å; A53-R155 PolarHBondContact O-N 3.47Å
54	E	61.6	Low	46.6	Very low	35 Å²	35	83.5 Å²	83.5	16%	0.164	54%	0.543	C	S	.	.			trans	-111.2	78.5	-168.8	-56	-158.1	151.2	0	0	113.8	P52 S56 T57 Q144 K148	P52-E54 VanDerWaalsContact C-N 3.31Å; P52-E54 PolarHBondContact O-N 3.1Å; E54-S56 PolarHBondContact O-N 2.88Å; E54-T57 WeakPolarHBondContact CB-OG1 3.47Å; E54-T57 PolarHBondContact O-N 3.25Å; E54-T57 PolarHBondContact OE2-OG1 3.41Å; E54-Q144 PolarHBondContact OE1-NE2 2.72Å; E54-Q144 PolarHBondContact OE2-NE2 3.39Å; E54-K148 VanDerWaalsContact OE1-CE 3.28Å; E54-K148 WeakPolarHBondContact OE1-CE 3.17Å; E54-K148 IonicContact OE1-NZ 3.57Å
55	L	58.3	Low	49.2	Very low	66 Å²	66	77.9 Å²	77.9	35%	0.346	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-19	176.9	-63.3	174.1	0	0	0	114.5	K66 A119 W126	L55-K66 WeakPolarHBondContact O-CD 3.29Å; L55-K66 PolarHBondContact O-NZ 2.85Å; L55-A119 HydrophobicContact CD1-CB 4.34Å; L55-W126 HydrophobicContact CD1-CE3 4.2Å; L55-W126 HydrophobicContact CD1-CZ3 3.89Å
56	S	62.3	Low	52.2	Low	1 Å²	1	73.5 Å²	73.5	1%	0.007	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-11.4	-168.1	-56.3	0	0	0	0	115	E54 K66 R155 R156 F157	E54-S56 PolarHBondContact O-N 2.88Å; S56-K66 PolarHBondContact O-N 2.93Å; S56-R155 PolarHBondContact OG-O 2.96Å; S56-R156 WeakPolarHBondContact OG-CA 3.12Å; S56-F157 PolarHBondContact OG-N 3.22Å
57	T	55.3	Low	55	Low	37 Å²	37	65 Å²	65	23%	0.227	43%	0.425	C	S	.	.			trans	-118.2	162	-178	22.8	0	0	0	0	110.3	E54 Q144	E54-T57 WeakPolarHBondContact CB-OG1 3.47Å; E54-T57 PolarHBondContact O-N 3.25Å; E54-T57 PolarHBondContact OE2-OG1 3.41Å; T57-Q144 PolarHBondContact OG1-NE2 3.25Å
58	Q	49.6	Very low	57.7	Low	104 Å²	104	62.2 Å²	62.2	49%	0.486	39%	0.391	S	S	.	.			trans	-137.6	117.7	165.6	-79.3	179.6	-98	0	0	108.1	S60 A61	Q58-S60 PolarHBondContact O-N 3.46Å; Q58-S60 VanDerWaalsContact O-N 3.08Å; Q58-A61 PolarHBondContact O-N 3.28Å; Q58-A61 VanDerWaalsContact O-N 3.13Å
59	L	46.1	Very low	60.2	Low	122 Å²	122	56.9 Å²	56.9	64%	0.639	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-16.2	-178.5	-73.7	151.3	0	0	0	112.9	D50 A61	D50-L59 HydrophobicContact CB-CD1 4.41Å; D50-L59 WeakPolarHBondContact OD1-CB 3.47Å; D50-L59 WeakPolarHBondContact OD1-CD1 3.43Å; L59-A61 PolarHBondContact O-N 2.92Å
60	S	39.3	Very low	62.4	Low	98 Å²	98	55.1 Å²	55.1	69%	0.685	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.8	173.2	-25.3	0	0	0	0	114.6	Q58	Q58-S60 PolarHBondContact O-N 3.46Å; Q58-S60 VanDerWaalsContact O-N 3.08Å
61	A	45.4	Very low	63.7	Low	43 Å²	43	52.4 Å²	52.4	36%	0.355	32%	0.318	S	S	.	.	S	Bend	trans	-150.1	103.6	-179.4	0	0	0	0	0	111.7	Q58 L59 G63 V64	Q58-A61 PolarHBondContact O-N 3.28Å; Q58-A61 VanDerWaalsContact O-N 3.13Å; L59-A61 PolarHBondContact O-N 2.92Å; A61-G63 PolarHBondContact O-N 3.46Å; A61-V64 HydrophobicContact CB-CG2 4.16Å
62	P	52.8	Low	64.6	Low	133 Å²	133	50.6 Å²	50.6	86%	0.864	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	132.5	177.5	26.6	-33.7	0	0	0	111
63	G	62.3	Low	65.5	Low	32 Å²	32	46.5 Å²	46.5	33%	0.33	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.7	16.5	174.8	0	0	0	0	0	116.5	A61 L82 A83	A61-G63 PolarHBondContact O-N 3.46Å; G63-L82 WeakPolarHBondContact O-CA 3.31Å; G63-A83 CarbonylContact C-O 3.58Å; G63-A83 WeakPolarHBondContact CA-O 3.44Å; G63-A83 PolarHBondContact O-N 2.88Å
64	V	74.3	Confident	65.6	Low	46 Å²	46	52.4 Å²	52.4	28%	0.279	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	124.9	177.4	-173	0	0	0	0	111.1	A61 L82	A61-V64 HydrophobicContact CB-CG2 4.16Å; V64-L82 HydrophobicContact CG2-CD2 4.25Å
65	L	81	Confident	65.4	Low	0 Å²	0	54.6 Å²	54.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.8	-179.5	-179.5	65.5	0	0	0	111.1	V67 S80 V81 A83 L92 L141 F157	L65-V67 HydrophobicContact CD2-CG2 4.4Å; L65-V67 HydrophobicContact CG-CG2 4.42Å; L65-S80 CarbonylContact O-C 3.58Å; L65-S80 WeakPolarHBondContact O-CA 3.42Å; L65-V81 HydrophobicContact CB-CG2 4.01Å; L65-V81 HydrophobicContact CD2-CG2 4.44Å; L65-V81 HydrophobicContact CG-CG2 4.48Å; L65-V81 PolarHBondContact N-O 3.38Å; L65-V81 PolarHBondContact O-N 3.31Å; L65-A83 HydrophobicContact CB-CB 3.58Å; L65-A83 HydrophobicContact CD2-CB 4.04Å; L65-A83 HydrophobicContact CG-CB 4.46Å; L65-L92 HydrophobicContact CD2-CD1 4.19Å; L65-L141 HydrophobicContact CD1-CD2 4.07Å; L65-F157 HydrophobicContact CD1-CD2 3.59Å; L65-F157 HydrophobicContact CD1-CE2 3.68Å; L65-F157 HydrophobicContact CD1-CG 4.31Å; L65-F157 HydrophobicContact CD1-CZ 4.48Å; L65-F157 HydrophobicContact CG-CD2 4.45Å
66	K	87.1	Confident	65.3	Low	26 Å²	26	54.3 Å²	54.3	11%	0.113	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	113.5	175.6	-60	168.5	-176.9	154.4	0	110.4	L55 S56 F68 Y78	L55-K66 WeakPolarHBondContact O-CD 3.29Å; L55-K66 PolarHBondContact O-NZ 2.85Å; S56-K66 PolarHBondContact O-N 2.93Å; K66-F68 HydrophobicContact CB-CE2 3.91Å; K66-F68 HydrophobicContact CB-CZ 4.34Å; K66-F68 WeakPolarHBondContact O-CD2 3.35Å; K66-Y78 HydrophobicContact CB-CD2 3.73Å; K66-Y78 HydrophobicContact CB-CE2 4.22Å; K66-Y78 HydrophobicContact CB-CG 4.23Å; K66-Y78 HydrophobicContact CD-CD2 4.05Å; K66-Y78 HydrophobicContact CD-CE2 3.72Å; K66-Y78 HydrophobicContact CG-CD2 3.66Å; K66-Y78 HydrophobicContact CG-CE2 3.61Å; K66-Y78 HydrophobicContact CG-CG 4.49Å
67	V	86.5	Confident	65.4	Low	0 Å²	0	60.8 Å²	60.8	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	117.2	174.4	178.3	0	0	0	0	109.2	L65 Y78 K79 V81 A96 Y100 L112 L159	L65-V67 HydrophobicContact CD2-CG2 4.4Å; L65-V67 HydrophobicContact CG-CG2 4.42Å; V67-Y78 WeakPolarHBondContact O-CA 3.5Å; V67-K79 PolarHBondContact N-O 3.03Å; V67-K79 PolarHBondContact O-N 3.49Å; V67-V81 HydrophobicContact CG2-CG1 4.23Å; V67-V81 HydrophobicContact CG2-CG2 3.78Å; V67-A96 HydrophobicContact CB-CB 4.29Å; V67-A96 HydrophobicContact CG1-CB 3.93Å; V67-Y100 PolarHBondContact O-OH 3.38Å; V67-L112 HydrophobicContact CG1-CD1 3.76Å; V67-L112 HydrophobicContact CG2-CD1 4.12Å; V67-L159 HydrophobicContact CG1-CB 3.88Å
68	F	86.3	Confident	66.8	Low	22 Å²	22	63.8 Å²	63.8	10%	0.096	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	137.9	-175.5	-64.1	-102.2	0	0	0	110.9	K66 H77 Y78 R156 F157 E158 L159	K66-F68 HydrophobicContact CB-CE2 3.91Å; K66-F68 HydrophobicContact CB-CZ 4.34Å; K66-F68 WeakPolarHBondContact O-CD2 3.35Å; F68-H77 WeakPolarHBondContact CA-O 3.4Å; F68-H77 WeakPolarHBondContact CB-O 3.49Å; F68-H77 VanDerWaalsContact CD1-O 3.27Å; F68-H77 WeakPolarHBondContact CD1-O 3.38Å; F68-Y78 HydrophobicContact CD1-CD1 4.33Å; F68-Y78 HydrophobicContact CD1-CG 4.36Å; F68-Y78 AromaticContact CE1-CD1 3.83Å; F68-Y78 HydrophobicContact CE1-CD1 3.83Å; F68-Y78 HydrophobicContact CE1-CG 4.13Å; F68-Y78 HydrophobicContact CZ-CD1 4.33Å; F68-Y78 HydrophobicContact CZ-CG 4.43Å; F68-R156 HydrophobicContact CB-CG 4.26Å; F68-R156 HydrophobicContact CD1-CG 4.32Å; F68-R156 HydrophobicContact CD2-CG 3.4Å; F68-R156 VanDerWaalsContact CD2-CG 3.4Å; F68-R156 HydrophobicContact CE2-CG 3.68Å; F68-R156 HydrophobicContact CG-CG 3.75Å; F68-R156 HydrophobicContact CZ-CG 4.24Å; F68-F157 WeakPolarHBondContact CD2-O 3.5Å; F68-F157 PolarHBondContact N-O 3.01Å; F68-E158 HydrophobicContact CB-CG 4.32Å; F68-E158 WeakPolarHBondContact O-CA 3.47Å; F68-L159 PolarHBondContact O-N 3.01Å
69	G	82.2	Confident	68.4	Low	0 Å²	0	61.9 Å²	61.9	0%	0	38%	0.378	C	S	.	.			trans	-129.6	19	-164.4	0	0	0	0	0	115.2	S71 V72 C73 H77 Y100	G69-S71 PolarHBondContact O-N 3.27Å; G69-V72 PolarHBondContact O-N 2.87Å; G69-C73 PolarHBondContact O-N 2.88Å; G69-H77 PolarHBondContact N-O 2.79Å; G69-Y100 WeakPolarHBondContact CA-OH 3.29Å; G69-Y100 PolarHBondContact N-OH 3.39Å
70	D	76.9	Confident	70.3	Confident	72 Å²	72	58.3 Å²	58.3	39%	0.385	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-28.7	-174.1	-61.1	-40.3	0	0	0	113.9	H77 R156	D70-H77 IonicContact OD1-ND1 3.57Å; D70-R156 IonicContact OD2-CZ 2.72Å; D70-R156 IonicContact OD2-NH1 3.61Å; D70-R156 PolarHBondContact OD2-NH1 3.23Å; D70-R156 VanDerWaalsContact OD2-NH1 3.08Å; D70-R156 IonicContact OD2-NH2 2.81Å; D70-R156 PolarHBondContact OD2-NH2 3.36Å
71	S	68.9	Low	72.4	Confident	59 Å²	59	53.7 Å²	53.7	41%	0.413	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-10.9	178.1	71.6	0	0	0	0	114.6	G69 L159	G69-S71 PolarHBondContact O-N 3.27Å; S71-L159 PolarHBondContact OG-O 2.84Å
72	V	71.9	Confident	74	Confident	25 Å²	25	56.8 Å²	56.8	15%	0.152	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-38.2	-169.4	173.5	0	0	0	0	112	G69 L102 Y110 L159	G69-V72 PolarHBondContact O-N 2.87Å; V72-L102 HydrophobicContact CG1-CD1 3.29Å; V72-Y110 HydrophobicContact CB-CE1 4.46Å; V72-Y110 HydrophobicContact CG1-CE1 3.74Å; V72-Y110 HydrophobicContact CG2-CD1 4.11Å; V72-Y110 HydrophobicContact CG2-CE1 3.82Å; V72-L159 HydrophobicContact CG1-CD2 4.33Å; V72-L159 HydrophobicContact CG2-CD2 4.49Å; V72-L159 HydrophobicContact CG2-CG 4.28Å
73	C	71.4	Confident	75.2	Confident	31 Å²	31	50.5 Å²	50.5	21%	0.209	30%	0.3	C	S	.	.	S	Bend	trans	-139.6	117	175.8	-70.7	0	0	0	0	111.4	G69 Y100	G69-C73 PolarHBondContact O-N 2.88Å; C73-Y100 HydrophobicContact CB-CD1 3.8Å; C73-Y100 HydrophobicContact CB-CE1 4.4Å
74	T	57.8	Low	75.8	Confident	148 Å²	148	52.5 Å²	52.5	91%	0.908	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	124.6	177.1	44.8	0	0	0	0	111.4
75	G	57.4	Low	75.6	Confident	81 Å²	81	52.1 Å²	52.1	84%	0.835	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	121.1	-10	172.1	0	0	0	0	0	116.3
76	T	56.5	Low	75.2	Confident	60 Å²	60	56.8 Å²	56.8	37%	0.368	34%	0.34	S	S	.	.			trans	-135.6	118.2	172.8	58.7	0	0	0	0	111.3	Y78	T76-Y78 PolarHBondContact O-N 2.89Å
77	H	65.7	Low	75.1	Confident	137 Å²	137	56.4 Å²	56.4	63%	0.634	34%	0.341	S	S	*	.	S	Bend	trans	-62.7	-40.4	-173	-64.7	-55.1	0	0	0	114.5	F68 G69 D70	F68-H77 WeakPolarHBondContact CA-O 3.4Å; F68-H77 WeakPolarHBondContact CB-O 3.49Å; F68-H77 VanDerWaalsContact CD1-O 3.27Å; F68-H77 WeakPolarHBondContact CD1-O 3.38Å; G69-H77 PolarHBondContact N-O 2.79Å; D70-H77 IonicContact OD1-ND1 3.57Å
78	Y	82.8	Confident	75.1	Confident	100 Å²	100	57.4 Å²	57.4	39%	0.392	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	165.8	176.8	68.4	-88.6	0	0	0	113.1	K66 V67 F68 T76 Y100	K66-Y78 HydrophobicContact CB-CD2 3.73Å; K66-Y78 HydrophobicContact CB-CE2 4.22Å; K66-Y78 HydrophobicContact CB-CG 4.23Å; K66-Y78 HydrophobicContact CD-CD2 4.05Å; K66-Y78 HydrophobicContact CD-CE2 3.72Å; K66-Y78 HydrophobicContact CG-CD2 3.66Å; K66-Y78 HydrophobicContact CG-CE2 3.61Å; K66-Y78 HydrophobicContact CG-CG 4.49Å; V67-Y78 WeakPolarHBondContact O-CA 3.5Å; F68-Y78 HydrophobicContact CD1-CD1 4.33Å; F68-Y78 HydrophobicContact CD1-CG 4.36Å; F68-Y78 AromaticContact CE1-CD1 3.83Å; F68-Y78 HydrophobicContact CE1-CD1 3.83Å; F68-Y78 HydrophobicContact CE1-CG 4.13Å; F68-Y78 HydrophobicContact CZ-CD1 4.33Å; F68-Y78 HydrophobicContact CZ-CG 4.43Å; T76-Y78 PolarHBondContact O-N 2.89Å; Y78-Y100 VanDerWaalsContact CA-OH 3.31Å; Y78-Y100 WeakPolarHBondContact CA-OH 3.24Å
79	K	83.9	Confident	75.1	Confident	64 Å²	64	56.4 Å²	56.4	28%	0.278	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	137.8	165.9	-61.6	-71.2	177.1	135.7	0	108.2	V67 R99 Y100	V67-K79 PolarHBondContact N-O 3.03Å; V67-K79 PolarHBondContact O-N 3.49Å; K79-R99 HydrophobicContact CB-CB 4.03Å; K79-R99 HydrophobicContact CD-CB 4.32Å; K79-R99 WeakPolarHBondContact CD-O 3.47Å; K79-R99 VanDerWaalsContact CE-O 3.27Å; K79-R99 WeakPolarHBondContact CE-O 3.46Å; K79-R99 HydrophobicContact CG-CB 4.15Å; K79-R99 PolarHBondContact NZ-O 3.29Å; K79-Y100 HydrophobicContact CB-CE2 3.94Å; K79-Y100 HydrophobicContact CD-CE1 4.47Å; K79-Y100 HydrophobicContact CG-CD1 3.86Å; K79-Y100 HydrophobicContact CG-CD2 4Å; K79-Y100 HydrophobicContact CG-CE1 3.52Å; K79-Y100 HydrophobicContact CG-CE2 3.65Å; K79-Y100 HydrophobicContact CG-CG 4.07Å; K79-Y100 PolarHBondContact N-OH 3.32Å
80	S	85.4	Confident	75.3	Confident	48 Å²	48	63 Å²	63	34%	0.336	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	124.1	174.2	-56.9	0	0	0	0	109.9	L65 R99	L65-S80 CarbonylContact O-C 3.58Å; L65-S80 WeakPolarHBondContact O-CA 3.42Å; S80-R99 WeakPolarHBondContact O-CD 3.31Å; S80-R99 VanDerWaalsContact O-CZ 3.31Å; S80-R99 PolarHBondContact O-NE 3.38Å
81	V	83.8	Confident	75.8	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.006	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	157.6	172.5	-54.2	0	0	0	0	110.3	L65 V67 L92 E95 A96	L65-V81 HydrophobicContact CB-CG2 4.01Å; L65-V81 HydrophobicContact CD2-CG2 4.44Å; L65-V81 HydrophobicContact CG-CG2 4.48Å; L65-V81 PolarHBondContact N-O 3.38Å; L65-V81 PolarHBondContact O-N 3.31Å; V67-V81 HydrophobicContact CG2-CG1 4.23Å; V67-V81 HydrophobicContact CG2-CG2 3.78Å; V81-L92 HydrophobicContact CG2-CD2 3.73Å; V81-E95 HydrophobicContact CB-CB 4.5Å; V81-E95 HydrophobicContact CG1-CB 4.45Å; V81-A96 HydrophobicContact CG1-CB 3.98Å
82	L	78.8	Confident	76.7	Confident	108 Å²	108	62.1 Å²	62.1	57%	0.565	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	116.7	174.9	-68	175.6	0	0	0	108.9	G63 V64 E95	G63-L82 WeakPolarHBondContact O-CA 3.31Å; V64-L82 HydrophobicContact CG2-CD2 4.25Å; L82-E95 PolarHBondContact N-OE1 2.6Å
83	A	78.8	Confident	77.6	Confident	1 Å²	1	61 Å²	61	1%	0.008	35%	0.349	C	S	.	.			trans	-125.9	129.1	-174.2	0	0	0	0	0	110.2	G63 L65 L92 L141	G63-A83 CarbonylContact C-O 3.58Å; G63-A83 WeakPolarHBondContact CA-O 3.44Å; G63-A83 PolarHBondContact O-N 2.88Å; L65-A83 HydrophobicContact CB-CB 3.58Å; L65-A83 HydrophobicContact CD2-CB 4.04Å; L65-A83 HydrophobicContact CG-CB 4.46Å; A83-L92 HydrophobicContact CB-CD1 4.39Å; A83-L92 HydrophobicContact CB-CD2 3.65Å; A83-L141 HydrophobicContact CB-CD1 3.56Å; A83-L141 HydrophobicContact CB-CG 4.04Å; A83-L141 VanDerWaalsContact O-CD1 3.31Å; A83-L141 WeakPolarHBondContact O-CD1 3.28Å
84	T	74.8	Confident	78.4	Confident	74 Å²	74	64.8 Å²	64.8	45%	0.454	36%	0.362	S	S	.	.			trans	-112.2	162.8	173.4	64.7	0	0	0	0	109.5	T86 S87	T84-T86 PolarHBondContact O-N 2.92Å; T84-T86 PolarHBondContact OG1-N 3.05Å; T84-T86 PolarHBondContact OG1-OG1 3.36Å; T84-T86 VanDerWaalsContact OG1-OG1 3.05Å; T84-S87 PolarHBondContact N-OG 3.48Å; T84-S87 WeakPolarHBondContact O-CB 3.41Å; T84-S87 PolarHBondContact O-N 2.99Å; T84-S87 PolarHBondContact OG1-N 2.68Å; T84-S87 PolarHBondContact OG1-OG 2.93Å
85	G	69	Low	79.8	Confident	37 Å²	37	60.2 Å²	60.2	38%	0.381	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-10.6	173.8	0	0	0	0	0	114.3
86	T	74.3	Confident	81.3	Confident	99 Å²	99	56.3 Å²	56.3	61%	0.607	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-15.9	172.7	48.7	0	0	0	0	114.8	T84 S88 K139	T84-T86 PolarHBondContact O-N 2.92Å; T84-T86 PolarHBondContact OG1-N 3.05Å; T84-T86 PolarHBondContact OG1-OG1 3.36Å; T84-T86 VanDerWaalsContact OG1-OG1 3.05Å; T86-S88 PolarHBondContact O-N 3.38Å; T86-K139 VanDerWaalsContact O-CE 3.3Å; T86-K139 WeakPolarHBondContact O-CE 3.47Å
87	S	83.8	Confident	82.8	Confident	18 Å²	18	53.5 Å²	53.5	13%	0.126	27%	0.273	C	S	.	.			trans	-62.3	126	-177.1	-61.1	0	0	0	0	111.9	T84 P140	T84-S87 PolarHBondContact N-OG 3.48Å; T84-S87 WeakPolarHBondContact O-CB 3.41Å; T84-S87 PolarHBondContact O-N 2.99Å; T84-S87 PolarHBondContact OG1-N 2.68Å; T84-S87 PolarHBondContact OG1-OG 2.93Å; S87-P140 WeakPolarHBondContact O-CD 3.42Å
88	S	86.6	Confident	83.8	Confident	20 Å²	20	52.9 Å²	52.9	14%	0.14	27%	0.27	C	S	.	.			trans	-79.9	156.5	176.1	67	0	0	0	0	112.5	T86 R90 E91 L92 E138	T86-S88 PolarHBondContact O-N 3.38Å; S88-R90 PolarHBondContact O-N 3.1Å; S88-E91 VanDerWaalsContact CB-OE2 3.28Å; S88-E91 WeakPolarHBondContact CB-OE2 3.43Å; S88-E91 PolarHBondContact N-OE2 3.42Å; S88-E91 PolarHBondContact O-N 3.44Å; S88-E91 VanDerWaalsContact OG-CG 3.29Å; S88-E91 WeakPolarHBondContact OG-CG 3.27Å; S88-E91 PolarHBondContact OG-N 2.84Å; S88-E91 PolarHBondContact OG-OE2 2.79Å; S88-L92 WeakPolarHBondContact O-CG 3.19Å; S88-L92 PolarHBondContact O-N 2.95Å; S88-E138 CarbonylContact C-O 3.53Å; S88-E138 WeakPolarHBondContact CA-O 3.28Å
89	A	85.9	Confident	83.9	Confident	2 Å²	2	52.3 Å²	52.3	2%	0.017	27%	0.267	C	S	.	.	H	α-helix	trans	-56.9	-37.6	176	0	0	0	0	0	112	L92 V93 F134 G135 E138 P140	A89-L92 PolarHBondContact O-N 2.9Å; A89-V93 WeakPolarHBondContact O-CB 3.13Å; A89-V93 VanDerWaalsContact O-CG2 3.23Å; A89-V93 WeakPolarHBondContact O-CG2 3.18Å; A89-V93 PolarHBondContact O-N 2.71Å; A89-F134 HydrophobicContact CB-CB 3.72Å; A89-F134 HydrophobicContact CB-CG 4.42Å; A89-G135 WeakPolarHBondContact CB-O 3.43Å; A89-E138 PolarHBondContact N-O 2.9Å; A89-P140 HydrophobicContact CB-CG 4Å
90	R	86.9	Confident	84	Confident	138 Å²	138	49.9 Å²	49.9	52%	0.521	26%	0.256	S	S	.	.	H	α-helix	trans	-69.1	-35.5	178.1	-176.4	171.3	175.7	173.3	-1.3	113.6	S88 K94 D136	S88-R90 PolarHBondContact O-N 3.1Å; R90-K94 WeakPolarHBondContact O-CB 3.23Å; R90-K94 PolarHBondContact O-N 3.04Å; R90-K94 VanDerWaalsContact O-N 3.07Å; R90-D136 HydrophobicContact CB-CB 3.96Å; R90-D136 WeakPolarHBondContact CB-O 3.49Å; R90-D136 PolarHBondContact N-O 3.07Å
91	E	87.6	Confident	83.8	Confident	111 Å²	111	52.1 Å²	52.1	52%	0.519	28%	0.278	S	S	.	.	H	α-helix	trans	-66.6	-45.9	172.9	-71.9	159.1	142.2	0	0	110.5	S88 V93 K94 E95	S88-E91 VanDerWaalsContact CB-OE2 3.28Å; S88-E91 WeakPolarHBondContact CB-OE2 3.43Å; S88-E91 PolarHBondContact N-OE2 3.42Å; S88-E91 PolarHBondContact O-N 3.44Å; S88-E91 VanDerWaalsContact OG-CG 3.29Å; S88-E91 WeakPolarHBondContact OG-CG 3.27Å; S88-E91 PolarHBondContact OG-N 2.84Å; S88-E91 PolarHBondContact OG-OE2 2.79Å; E91-V93 PolarHBondContact O-N 2.89Å; E91-K94 WeakPolarHBondContact O-CB 3.4Å; E91-K94 PolarHBondContact O-N 3.18Å; E91-K94 VanDerWaalsContact O-N 3.1Å; E91-E95 PolarHBondContact O-N 3.07Å
92	L	88.9	Confident	83.8	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-66.1	-34.5	178.4	-64.1	168.4	0	0	0	112.7	L65 V81 A83 S88 A89 A96 P140	L65-L92 HydrophobicContact CD2-CD1 4.19Å; V81-L92 HydrophobicContact CG2-CD2 3.73Å; A83-L92 HydrophobicContact CB-CD1 4.39Å; A83-L92 HydrophobicContact CB-CD2 3.65Å; S88-L92 WeakPolarHBondContact O-CG 3.19Å; S88-L92 PolarHBondContact O-N 2.95Å; A89-L92 PolarHBondContact O-N 2.9Å; L92-A96 WeakPolarHBondContact O-CB 3.2Å; L92-A96 PolarHBondContact O-N 2.82Å; L92-P140 HydrophobicContact CD1-CB 4.31Å; L92-P140 HydrophobicContact CD1-CG 3.76Å
93	V	89.2	Confident	84	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	29%	0.285	C	S	.	.	H	α-helix	trans	-61.5	-45.8	169.1	162.9	0	0	0	0	110.8	A89 E91 A96 L97 A107 L112 L159	A89-V93 WeakPolarHBondContact O-CB 3.13Å; A89-V93 VanDerWaalsContact O-CG2 3.23Å; A89-V93 WeakPolarHBondContact O-CG2 3.18Å; A89-V93 PolarHBondContact O-N 2.71Å; E91-V93 PolarHBondContact O-N 2.89Å; V93-A96 PolarHBondContact O-N 3.25Å; V93-L97 HydrophobicContact CG1-CD1 3.94Å; V93-L97 HydrophobicContact CG1-CG 4.47Å; V93-L97 WeakPolarHBondContact O-CB 3.28Å; V93-L97 VanDerWaalsContact O-CG 3.29Å; V93-L97 WeakPolarHBondContact O-CG 3.29Å; V93-L97 PolarHBondContact O-N 3.27Å; V93-A107 HydrophobicContact CG1-CB 4.06Å; V93-L112 HydrophobicContact CG2-CB 4.01Å; V93-L159 HydrophobicContact CB-CD1 4.34Å; V93-L159 HydrophobicContact CG1-CD1 4.09Å; V93-L159 HydrophobicContact CG2-CD1 3.86Å
94	K	87.9	Confident	84.2	Confident	111 Å²	111	55.1 Å²	55.1	48%	0.483	30%	0.296	S	S	.	.	H	α-helix	trans	-61.9	-46.9	178.5	-169.4	-170.6	176.5	-163.4	0	111.5	R90 E91 A96 L97 E98 P104 A107	R90-K94 WeakPolarHBondContact O-CB 3.23Å; R90-K94 PolarHBondContact O-N 3.04Å; R90-K94 VanDerWaalsContact O-N 3.07Å; E91-K94 WeakPolarHBondContact O-CB 3.4Å; E91-K94 PolarHBondContact O-N 3.18Å; E91-K94 VanDerWaalsContact O-N 3.1Å; K94-A96 VanDerWaalsContact C-N 3.32Å; K94-A96 PolarHBondContact O-N 3.33Å; K94-L97 PolarHBondContact O-N 3.28Å; K94-E98 PolarHBondContact O-N 3.25Å; K94-E98 VanDerWaalsContact O-N 3.11Å; K94-P104 HydrophobicContact CD-CB 4.37Å; K94-P104 HydrophobicContact CG-CB 3.61Å; K94-A107 HydrophobicContact CB-CB 4.43Å
95	E	88.2	Confident	84.1	Confident	51 Å²	51	54.8 Å²	54.8	24%	0.238	31%	0.307	C	S	.	.	H	α-helix	trans	-70.5	-26.4	-179.6	-139.1	-160.7	111.5	0	0	113.2	V81 L82 E91 R99	V81-E95 HydrophobicContact CB-CB 4.5Å; V81-E95 HydrophobicContact CG1-CB 4.45Å; L82-E95 PolarHBondContact N-OE1 2.6Å; E91-E95 PolarHBondContact O-N 3.07Å; E95-R99 VanDerWaalsContact CG-NH1 3.33Å; E95-R99 PolarHBondContact O-N 3.26Å; E95-R99 PolarHBondContact O-NH1 3.48Å; E95-R99 IonicContact OE1-CZ 3.16Å; E95-R99 IonicContact OE1-NH1 2.68Å; E95-R99 PolarHBondContact OE1-NH1 3.43Å; E95-R99 IonicContact OE1-NH2 2.71Å; E95-R99 PolarHBondContact OE1-NH2 2.67Å
96	A	88.3	Confident	84.7	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-72.9	-50.2	170.5	0	0	0	0	0	111	V67 V81 L92 V93 K94 E98 R99 Y100 L159	V67-A96 HydrophobicContact CB-CB 4.29Å; V67-A96 HydrophobicContact CG1-CB 3.93Å; V81-A96 HydrophobicContact CG1-CB 3.98Å; L92-A96 WeakPolarHBondContact O-CB 3.2Å; L92-A96 PolarHBondContact O-N 2.82Å; V93-A96 PolarHBondContact O-N 3.25Å; K94-A96 VanDerWaalsContact C-N 3.32Å; K94-A96 PolarHBondContact O-N 3.33Å; A96-E98 VanDerWaalsContact C-N 3.27Å; A96-E98 PolarHBondContact O-N 3.46Å; A96-R99 CarbonylContact O-C 3.57Å; A96-R99 PolarHBondContact O-N 3.31Å; A96-Y100 HydrophobicContact CB-CD2 4.46Å; A96-Y100 WeakPolarHBondContact O-CD2 3.27Å; A96-Y100 PolarHBondContact O-N 3.08Å; A96-L159 HydrophobicContact CB-CD2 4.24Å
97	L	88.8	Confident	85.1	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-54.3	-44.8	178.3	-74.2	168.8	0	0	0	111.4	V93 K94 R99 Y100 A101 L102 A107 Y110 L159	V93-L97 HydrophobicContact CG1-CD1 3.94Å; V93-L97 HydrophobicContact CG1-CG 4.47Å; V93-L97 WeakPolarHBondContact O-CB 3.28Å; V93-L97 VanDerWaalsContact O-CG 3.29Å; V93-L97 WeakPolarHBondContact O-CG 3.29Å; V93-L97 PolarHBondContact O-N 3.27Å; K94-L97 PolarHBondContact O-N 3.28Å; L97-R99 VanDerWaalsContact C-N 3.35Å; L97-R99 PolarHBondContact O-N 3.39Å; L97-Y100 CarbonylContact O-C 3.49Å; L97-Y100 WeakPolarHBondContact O-CA 3.47Å; L97-Y100 PolarHBondContact O-N 3.31Å; L97-Y100 VanDerWaalsContact O-N 3.08Å; L97-A101 PolarHBondContact O-N 3.4Å; L97-L102 CarbonylContact C-O 3.52Å; L97-L102 HydrophobicContact CB-CB 4.3Å; L97-L102 HydrophobicContact CD2-CB 3.8Å; L97-L102 HydrophobicContact CD2-CD1 3.8Å; L97-L102 HydrophobicContact CD2-CG 4.46Å; L97-L102 PolarHBondContact O-N 3.39Å; L97-A107 HydrophobicContact CD1-CB 4.08Å; L97-Y110 HydrophobicContact CD1-CD2 3.85Å; L97-Y110 HydrophobicContact CD1-CE2 4.37Å; L97-Y110 HydrophobicContact CD1-CG 4.31Å; L97-Y110 HydrophobicContact CD2-CD1 4.16Å; L97-Y110 HydrophobicContact CD2-CD2 3.84Å; L97-Y110 HydrophobicContact CD2-CE1 4.12Å; L97-Y110 HydrophobicContact CD2-CE2 3.81Å; L97-Y110 HydrophobicContact CD2-CG 4.04Å; L97-Y110 HydrophobicContact CG-CD2 4.45Å; L97-L159 HydrophobicContact CD2-CD2 4.07Å; L97-L159 HydrophobicContact CG-CD2 4.39Å
98	E	87.1	Confident	84.9	Confident	124 Å²	124	53.4 Å²	53.4	58%	0.579	29%	0.294	S	S	*	.	H	α-helix	trans	-57.3	-43.5	175.5	-170.1	168	-176.5	0	0	112.4	K94 A96 Y100 A101 P104	K94-E98 PolarHBondContact O-N 3.25Å; K94-E98 VanDerWaalsContact O-N 3.11Å; A96-E98 VanDerWaalsContact C-N 3.27Å; A96-E98 PolarHBondContact O-N 3.46Å; E98-Y100 PolarHBondContact O-N 2.97Å; E98-A101 PolarHBondContact O-N 3.43Å; E98-A101 VanDerWaalsContact O-N 3.08Å; E98-P104 HydrophobicContact CB-CG 4.12Å; E98-P104 HydrophobicContact CG-CG 4.49Å
99	R	84.6	Confident	84.8	Confident	88 Å²	88	57.7 Å²	57.7	33%	0.332	31%	0.312	S	S	.	.	H	α-helix	trans	-76.3	-16.6	175.6	-71.7	-168.9	-169.8	81.5	-13.7	115	K79 S80 E95 A96 L97 A101	K79-R99 HydrophobicContact CB-CB 4.03Å; K79-R99 HydrophobicContact CD-CB 4.32Å; K79-R99 WeakPolarHBondContact CD-O 3.47Å; K79-R99 VanDerWaalsContact CE-O 3.27Å; K79-R99 WeakPolarHBondContact CE-O 3.46Å; K79-R99 HydrophobicContact CG-CB 4.15Å; K79-R99 PolarHBondContact NZ-O 3.29Å; S80-R99 WeakPolarHBondContact O-CD 3.31Å; S80-R99 VanDerWaalsContact O-CZ 3.31Å; S80-R99 PolarHBondContact O-NE 3.38Å; E95-R99 VanDerWaalsContact CG-NH1 3.33Å; E95-R99 PolarHBondContact O-N 3.26Å; E95-R99 PolarHBondContact O-NH1 3.48Å; E95-R99 IonicContact OE1-CZ 3.16Å; E95-R99 IonicContact OE1-NH1 2.68Å; E95-R99 PolarHBondContact OE1-NH1 3.43Å; E95-R99 IonicContact OE1-NH2 2.71Å; E95-R99 PolarHBondContact OE1-NH2 2.67Å; A96-R99 CarbonylContact O-C 3.57Å; A96-R99 PolarHBondContact O-N 3.31Å; L97-R99 VanDerWaalsContact C-N 3.35Å; L97-R99 PolarHBondContact O-N 3.39Å; R99-A101 VanDerWaalsContact C-N 3.3Å
100	Y	84.9	Confident	84.9	Confident	13 Å²	13	58.4 Å²	58.4	5%	0.051	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	2.7	166.1	-76.4	-70.6	0	0	0	112.7	V67 G69 C73 Y78 K79 A96 L97 E98 L102 L159	V67-Y100 PolarHBondContact O-OH 3.38Å; G69-Y100 WeakPolarHBondContact CA-OH 3.29Å; G69-Y100 PolarHBondContact N-OH 3.39Å; C73-Y100 HydrophobicContact CB-CD1 3.8Å; C73-Y100 HydrophobicContact CB-CE1 4.4Å; Y78-Y100 VanDerWaalsContact CA-OH 3.31Å; Y78-Y100 WeakPolarHBondContact CA-OH 3.24Å; K79-Y100 HydrophobicContact CB-CE2 3.94Å; K79-Y100 HydrophobicContact CD-CE1 4.47Å; K79-Y100 HydrophobicContact CG-CD1 3.86Å; K79-Y100 HydrophobicContact CG-CD2 4Å; K79-Y100 HydrophobicContact CG-CE1 3.52Å; K79-Y100 HydrophobicContact CG-CE2 3.65Å; K79-Y100 HydrophobicContact CG-CG 4.07Å; K79-Y100 PolarHBondContact N-OH 3.32Å; A96-Y100 HydrophobicContact CB-CD2 4.46Å; A96-Y100 WeakPolarHBondContact O-CD2 3.27Å; A96-Y100 PolarHBondContact O-N 3.08Å; L97-Y100 CarbonylContact O-C 3.49Å; L97-Y100 WeakPolarHBondContact O-CA 3.47Å; L97-Y100 PolarHBondContact O-N 3.31Å; L97-Y100 VanDerWaalsContact O-N 3.08Å; E98-Y100 PolarHBondContact O-N 2.97Å; Y100-L102 VanDerWaalsContact C-N 3.29Å; Y100-L102 PolarHBondContact O-N 3.02Å; Y100-L159 HydrophobicContact CD2-CD2 4.16Å; Y100-L159 HydrophobicContact CE2-CD2 4.44Å
101	A	82.8	Confident	84.9	Confident	95 Å²	95	52.4 Å²	52.4	79%	0.785	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	36.3	-176.7	0	0	0	0	0	113.8	L97 E98 R99	L97-A101 PolarHBondContact O-N 3.4Å; E98-A101 PolarHBondContact O-N 3.43Å; E98-A101 VanDerWaalsContact O-N 3.08Å; R99-A101 VanDerWaalsContact C-N 3.3Å
102	L	83.3	Confident	85	Confident	52 Å²	52	47.1 Å²	47.1	27%	0.272	27%	0.268	S	S	.	.			trans	-109.5	153.1	174.9	-63.1	178.8	0	0	0	110.8	V72 L97 Y100 P104	V72-L102 HydrophobicContact CG1-CD1 3.29Å; L97-L102 CarbonylContact C-O 3.52Å; L97-L102 HydrophobicContact CB-CB 4.3Å; L97-L102 HydrophobicContact CD2-CB 3.8Å; L97-L102 HydrophobicContact CD2-CD1 3.8Å; L97-L102 HydrophobicContact CD2-CG 4.46Å; L97-L102 PolarHBondContact O-N 3.39Å; Y100-L102 VanDerWaalsContact C-N 3.29Å; Y100-L102 PolarHBondContact O-N 3.02Å; L102-P104 WeakPolarHBondContact O-CD 3.49Å; L102-P104 VanDerWaalsContact O-N 3.17Å
103	D	82.4	Confident	84.9	Confident	84 Å²	84	47.1 Å²	47.1	45%	0.449	27%	0.268	S	S	.	.			trans	-59	112.6	-176.8	177.2	12.1	0	0	0	112.2	G105 Q106	D103-G105 PolarHBondContact O-N 3.2Å; D103-G105 WeakPolarHBondContact OD1-CA 3.36Å; D103-G105 PolarHBondContact OD1-N 2.73Å; D103-Q106 HydrophobicContact CB-CG 4.16Å; D103-Q106 WeakPolarHBondContact O-CB 3.43Å; D103-Q106 PolarHBondContact O-N 2.87Å; D103-Q106 WeakPolarHBondContact OD2-CG 3.48Å; D103-Q106 PolarHBondContact OD2-NE2 2.97Å
104	P	82.6	Confident	84.8	Confident	38 Å²	38	47.5 Å²	47.5	25%	0.247	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-66.9	-15.7	178.5	-17.9	32.7	0	0	0	113.2	K94 E98 L102 Q106 A107	K94-P104 HydrophobicContact CD-CB 4.37Å; K94-P104 HydrophobicContact CG-CB 3.61Å; E98-P104 HydrophobicContact CB-CG 4.12Å; E98-P104 HydrophobicContact CG-CG 4.49Å; L102-P104 WeakPolarHBondContact O-CD 3.49Å; L102-P104 VanDerWaalsContact O-N 3.17Å; P104-Q106 PolarHBondContact O-N 2.69Å; P104-A107 WeakPolarHBondContact O-CB 3.4Å; P104-A107 PolarHBondContact O-N 3.02Å
105	G	74.3	Confident	84.6	Confident	67 Å²	67	42.2 Å²	42.2	69%	0.691	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-65.5	-25.8	169.7	0	0	0	0	0	113.3	D103 A107	D103-G105 PolarHBondContact O-N 3.2Å; D103-G105 WeakPolarHBondContact OD1-CA 3.36Å; D103-G105 PolarHBondContact OD1-N 2.73Å; G105-A107 VanDerWaalsContact C-N 3.29Å; G105-A107 PolarHBondContact O-N 2.88Å
106	Q	81.4	Confident	84.4	Confident	77 Å²	77	40.2 Å²	40.2	36%	0.36	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-85	8	178.8	-66.9	174.8	24.1	0	0	113.8	D103 P104 G108 Q109 Y110	D103-Q106 HydrophobicContact CB-CG 4.16Å; D103-Q106 WeakPolarHBondContact O-CB 3.43Å; D103-Q106 PolarHBondContact O-N 2.87Å; D103-Q106 WeakPolarHBondContact OD2-CG 3.48Å; D103-Q106 PolarHBondContact OD2-NE2 2.97Å; P104-Q106 PolarHBondContact O-N 2.69Å; Q106-G108 PolarHBondContact O-N 2.85Å; Q106-Q109 WeakPolarHBondContact O-CB 3.14Å; Q106-Q109 PolarHBondContact O-N 2.92Å; Q106-Y110 HydrophobicContact CB-CE2 4.39Å; Q106-Y110 WeakPolarHBondContact O-CD2 3.45Å
107	A	81.8	Confident	84.1	Confident	8 Å²	8	40.2 Å²	40.2	7%	0.066	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-50.7	-30.2	-179.1	0	0	0	0	0	114.4	V93 K94 L97 P104 G105 Q109 Y110	V93-A107 HydrophobicContact CG1-CB 4.06Å; K94-A107 HydrophobicContact CB-CB 4.43Å; L97-A107 HydrophobicContact CD1-CB 4.08Å; P104-A107 WeakPolarHBondContact O-CB 3.4Å; P104-A107 PolarHBondContact O-N 3.02Å; G105-A107 VanDerWaalsContact C-N 3.29Å; G105-A107 PolarHBondContact O-N 2.88Å; A107-Q109 PolarHBondContact O-N 2.82Å; A107-Y110 PolarHBondContact O-N 2.91Å
108	G	79.3	Confident	83.6	Confident	39 Å²	39	44.4 Å²	44.4	40%	0.402	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-69.9	-6.2	174.8	0	0	0	0	0	116	Q106 R162	Q106-G108 PolarHBondContact O-N 2.85Å; G108-R162 VanDerWaalsContact O-CD 3.29Å; G108-R162 WeakPolarHBondContact O-CD 3.43Å; G108-R162 PolarHBondContact O-NE 3.12Å; G108-R162 VanDerWaalsContact O-NE 3.1Å; G108-R162 PolarHBondContact O-NH1 2.82Å
109	Q	84.1	Confident	82.7	Confident	111 Å²	111	40.9 Å²	40.9	52%	0.519	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-95.8	-8.9	172.9	-59.4	-177.3	0.7	0	0	112.7	Q106 A107 R162	Q106-Q109 WeakPolarHBondContact O-CB 3.14Å; Q106-Q109 PolarHBondContact O-N 2.92Å; A107-Q109 PolarHBondContact O-N 2.82Å; Q109-R162 PolarHBondContact O-N 2.87Å
110	Y	87.7	Confident	81.4	Confident	16 Å²	16	38.2 Å²	38.2	6%	0.063	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	164	-177.2	-65.8	-94	0	0	0	111.1	V72 L97 Q106 A107 L159 R160 K161 R162	V72-Y110 HydrophobicContact CB-CE1 4.46Å; V72-Y110 HydrophobicContact CG1-CE1 3.74Å; V72-Y110 HydrophobicContact CG2-CD1 4.11Å; V72-Y110 HydrophobicContact CG2-CE1 3.82Å; L97-Y110 HydrophobicContact CD1-CD2 3.85Å; L97-Y110 HydrophobicContact CD1-CE2 4.37Å; L97-Y110 HydrophobicContact CD1-CG 4.31Å; L97-Y110 HydrophobicContact CD2-CD1 4.16Å; L97-Y110 HydrophobicContact CD2-CD2 3.84Å; L97-Y110 HydrophobicContact CD2-CE1 4.12Å; L97-Y110 HydrophobicContact CD2-CE2 3.81Å; L97-Y110 HydrophobicContact CD2-CG 4.04Å; L97-Y110 HydrophobicContact CG-CD2 4.45Å; Q106-Y110 HydrophobicContact CB-CE2 4.39Å; Q106-Y110 WeakPolarHBondContact O-CD2 3.45Å; A107-Y110 PolarHBondContact O-N 2.91Å; Y110-L159 HydrophobicContact CD1-CD1 4.47Å; Y110-L159 HydrophobicContact CD1-CG 4.32Å; Y110-R160 CarbonylContact C-O 3.38Å; Y110-R160 WeakPolarHBondContact CA-O 3.39Å; Y110-K161 HydrophobicContact CD1-CG 3.87Å; Y110-K161 HydrophobicContact CE1-CD 4.42Å; Y110-K161 HydrophobicContact CE1-CG 3.46Å; Y110-K161 VanDerWaalsContact CE1-CG 3.46Å; Y110-R162 PolarHBondContact O-NE 2.87Å; Y110-R162 PolarHBondContact O-NH2 2.79Å
111	V	88.8	Confident	79.7	Confident	12 Å²	12	44.4 Å²	44.4	7%	0.073	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	147.3	173.3	-82.9	0	0	0	0	110.1	V133 R160 R162 V165	V111-V133 HydrophobicContact CB-CG1 3.72Å; V111-V133 HydrophobicContact CG1-CG1 3.69Å; V111-V133 HydrophobicContact CG2-CG1 3.94Å; V111-R160 PolarHBondContact N-O 3.16Å; V111-R160 PolarHBondContact O-N 2.68Å; V111-R162 HydrophobicContact CG1-CG 3.78Å; V111-R162 HydrophobicContact CG2-CG 4.2Å; V111-V165 HydrophobicContact CG2-CG2 4.14Å
112	L	89.4	Confident	78	Confident	1 Å²	1	47.3 Å²	47.3	1%	0.005	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	142.2	164.8	-164.1	71.1	0	0	0	109	V67 V93 F134 P140 F157 E158	V67-L112 HydrophobicContact CG1-CD1 3.76Å; V67-L112 HydrophobicContact CG2-CD1 4.12Å; V93-L112 HydrophobicContact CG2-CB 4.01Å; L112-F134 HydrophobicContact CB-CD2 4.08Å; L112-F134 HydrophobicContact CD2-CD2 4.05Å; L112-F134 HydrophobicContact CD2-CE2 4.33Å; L112-F134 HydrophobicContact CG-CD2 4.06Å; L112-F134 PolarHBondContact O-N 2.91Å; L112-P140 HydrophobicContact CD2-CB 3.93Å; L112-P140 HydrophobicContact CD2-CG 3.57Å; L112-F157 HydrophobicContact CD1-CB 4.29Å; L112-F157 HydrophobicContact CD2-CD1 4Å; L112-F157 HydrophobicContact CG-CD1 4.35Å; L112-E158 CarbonylContact C-O 3.54Å
113	C	86.8	Confident	76.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	136.3	175.7	-62.5	0	0	0	0	111.1	V115 F131 R132 F157 E158	C113-V115 HydrophobicContact CB-CG2 3.91Å; C113-F131 HydrophobicContact CB-CD2 4.31Å; C113-R132 CarbonylContact C-O 3.52Å; C113-R132 WeakPolarHBondContact CA-O 3.44Å; C113-R132 WeakPolarHBondContact CB-O 3.38Å; C113-F157 WeakPolarHBondContact O-CA 3.5Å; C113-E158 PolarHBondContact N-O 3.48Å; C113-E158 PolarHBondContact O-N 2.93Å
114	D	86.3	Confident	75	Confident	10 Å²	10	51.9 Å²	51.9	5%	0.053	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	114.2	162.1	-166	1.8	0	0	0	107	F131 R132 F134 R155	D114-F131 CarbonylContact O-C 3.55Å; D114-F131 WeakPolarHBondContact O-CA 3.43Å; D114-R132 PolarHBondContact N-O 3.17Å; D114-R132 PolarHBondContact O-N 3.47Å; D114-F134 HydrophobicContact CB-CE2 3.66Å; D114-F134 HydrophobicContact CB-CZ 3.74Å; D114-R155 WeakPolarHBondContact OD1-CG 3.41Å; D114-R155 IonicContact OD1-CZ 3.67Å; D114-R155 IonicContact OD1-NE 2.74Å; D114-R155 PolarHBondContact OD1-NE 3.02Å; D114-R155 IonicContact OD1-NH2 3.74Å; D114-R155 IonicContact OD2-CZ 3.67Å; D114-R155 IonicContact OD2-NE 3.88Å; D114-R155 PolarHBondContact OD2-NE 3.05Å; D114-R155 IonicContact OD2-NH2 2.77Å; D114-R155 PolarHBondContact OD2-NH2 3.17Å
115	V	84.3	Confident	74.1	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	122.4	-176.3	-170.9	0	0	0	0	109	C113 W126 A128 F131 R156 E158	C113-V115 HydrophobicContact CB-CG2 3.91Å; V115-W126 HydrophobicContact CG1-CZ2 4.11Å; V115-A128 HydrophobicContact CG1-CB 3.45Å; V115-A128 VanDerWaalsContact CG1-CB 3.45Å; V115-F131 HydrophobicContact CB-CB 4.3Å; V115-F131 HydrophobicContact CG1-CB 4.25Å; V115-F131 HydrophobicContact CG2-CB 3.84Å; V115-R156 WeakPolarHBondContact CA-O 3.48Å; V115-R156 HydrophobicContact CB-CB 4.44Å; V115-R156 VanDerWaalsContact CB-O 3.3Å; V115-R156 WeakPolarHBondContact CB-O 3.34Å; V115-R156 PolarHBondContact N-O 3.35Å; V115-R156 PolarHBondContact O-N 2.91Å; V115-E158 HydrophobicContact CB-CG 4.28Å; V115-E158 HydrophobicContact CG2-CB 3.76Å; V115-E158 HydrophobicContact CG2-CG 3.67Å
116	V	83.3	Confident	74.1	Confident	10 Å²	10	60.5 Å²	60.5	6%	0.061	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.5	179.9	-176.6	0	0	0	0	108.4	Q129 C130 W147 P149 L153 S154	V116-Q129 PolarHBondContact O-N 2.95Å; V116-C130 PolarHBondContact N-O 2.95Å; V116-C130 PolarHBondContact O-N 3.39Å; V116-C130 VanDerWaalsContact O-N 3.12Å; V116-W147 HydrophobicContact CG2-CH2 3.94Å; V116-W147 HydrophobicContact CG2-CZ3 3.91Å; V116-P149 HydrophobicContact CG1-CB 4.12Å; V116-P149 HydrophobicContact CG1-CG 4.34Å; V116-L153 HydrophobicContact CG1-CB 3.98Å; V116-L153 HydrophobicContact CG1-CD1 4.02Å; V116-S154 WeakPolarHBondContact CA-O 3.31Å
117	G	81.8	Confident	73.7	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	-177	-170	0	0	0	0	0	112.7	W126 Q127 L153 S154	G117-W126 VanDerWaalsContact C-CZ3 3.49Å; G117-W126 VanDerWaalsContact CA-CH2 3.48Å; G117-W126 WeakPolarHBondContact O-CZ3 3.44Å; G117-Q127 CarbonylContact C-O 3.59Å; G117-Q127 WeakPolarHBondContact CA-O 3.38Å; G117-L153 WeakPolarHBondContact O-CA 3.38Å; G117-S154 PolarHBondContact N-O 3.38Å; G117-S154 PolarHBondContact O-N 3.11Å
118	Q	78	Confident	73.3	Confident	87 Å²	87	64.6 Å²	64.6	41%	0.407	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	126.4	178.7	-73.3	179.4	-40.7	0	0	110.6	G120 W126 Q127 G152 L153	Q118-G120 PolarHBondContact O-N 3.3Å; Q118-W126 VanDerWaalsContact O-CE3 3.25Å; Q118-Q127 PolarHBondContact N-O 3.27Å; Q118-Q127 PolarHBondContact O-N 2.96Å; Q118-G152 WeakPolarHBondContact CG-O 3.44Å; Q118-L153 HydrophobicContact CG-CD2 3.68Å
119	A	68.1	Low	73.1	Confident	51 Å²	51	67.8 Å²	67.8	42%	0.421	37%	0.366	S	S	.	.			trans	-65.7	125.8	161.7	0	0	0	0	0	108.3	L55	L55-A119 HydrophobicContact CD1-CB 4.34Å
120	G	58.6	Low	72.4	Confident	32 Å²	32	65 Å²	65	33%	0.33	36%	0.358	S	S	.	.			trans	-83.2	115.6	178.2	0	0	0	0	0	110.7	Q118	Q118-G120 PolarHBondContact O-N 3.3Å
121	D	48.8	Very low	71.8	Confident	143 Å²	143	67.8 Å²	67.8	77%	0.765	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-57.5	140.5	172.7	-76.2	-45.4	0	0	0	111.4	G123 Q124	D121-G123 VanDerWaalsContact C-N 3.3Å; D121-G123 PolarHBondContact O-N 3.41Å; D121-Q124 PolarHBondContact O-N 3.43Å
122	T	46.7	Very low	71.5	Confident	156 Å²	156	72.4 Å²	72.4	96%	0.957	39%	0.387	S	S	*	.	G	3₁₀ helix	trans	39.6	47.4	170.1	51.9	0	0	0	0	116.6
123	G	53	Low	71.1	Confident	76 Å²	76	74.9 Å²	74.9	78%	0.784	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	110.4	1.6	163.7	0	0	0	0	0	115.9	D121	D121-G123 VanDerWaalsContact C-N 3.3Å; D121-G123 PolarHBondContact O-N 3.41Å
124	Q	50.8	Low	70.8	Confident	155 Å²	155	75.1 Å²	75.1	72%	0.724	40%	0.403	S	S	*	.			trans	-71.1	145.9	164	-65.8	-145.8	7.5	0	0	111.3	D121	D121-Q124 PolarHBondContact O-N 3.43Å
125	R	62.1	Low	70.4	Confident	235 Å²	235	76.2 Å²	76.2	89%	0.887	42%	0.417	S	S	*	.			trans	-75.7	142.1	177.9	-72.6	-179.2	173.7	168.5	-2.4	110.4	Q127	R125-Q127 PolarHBondContact O-N 3.13Å
126	W	74.9	Confident	70.1	Confident	51 Å²	51	78.6 Å²	78.6	19%	0.193	43%	0.43	C	S	.	.			trans	-42.5	127	170.1	167	-106	0	0	0	112.2	L55 V115 G117 Q118 S154 R156 E158	L55-W126 HydrophobicContact CD1-CE3 4.2Å; L55-W126 HydrophobicContact CD1-CZ3 3.89Å; V115-W126 HydrophobicContact CG1-CZ2 4.11Å; G117-W126 VanDerWaalsContact C-CZ3 3.49Å; G117-W126 VanDerWaalsContact CA-CH2 3.48Å; G117-W126 WeakPolarHBondContact O-CZ3 3.44Å; Q118-W126 VanDerWaalsContact O-CE3 3.25Å; W126-S154 WeakPolarHBondContact CH2-O 3.45Å; W126-R156 VanDerWaalsContact CE2-CD 3.45Å; W126-R156 HydrophobicContact CH2-CB 3.92Å; W126-R156 HydrophobicContact CZ2-CB 3.47Å; W126-R156 VanDerWaalsContact CZ2-CB 3.47Å; W126-R156 HydrophobicContact CZ2-CG 4.35Å; W126-R156 VanDerWaalsContact NE1-CD 3.27Å; W126-E158 PolarHBondContact NE1-OE1 3.08Å
127	Q	74	Confident	70	Confident	129 Å²	129	83.2 Å²	83.2	60%	0.603	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	104.3	176.8	-170.6	171.8	13.5	0	0	110.6	G117 Q118 R125 Q129	G117-Q127 CarbonylContact C-O 3.59Å; G117-Q127 WeakPolarHBondContact CA-O 3.38Å; Q118-Q127 PolarHBondContact N-O 3.27Å; Q118-Q127 PolarHBondContact O-N 2.96Å; R125-Q127 PolarHBondContact O-N 3.13Å; Q127-Q129 PolarHBondContact O-N 3.35Å
128	A	73.4	Confident	69.8	Low	43 Å²	43	86.2 Å²	86.2	36%	0.355	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	130.1	170.1	0	0	0	0	0	110.5	V115	V115-A128 HydrophobicContact CG1-CB 3.45Å; V115-A128 VanDerWaalsContact CG1-CB 3.45Å
129	Q	74.5	Confident	70	Confident	105 Å²	105	85.9 Å²	85.9	49%	0.491	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	-35.2	173.6	-67.4	-172.2	0.9	0	0	111.6	V116 Q127	V116-Q129 PolarHBondContact O-N 2.95Å; Q127-Q129 PolarHBondContact O-N 3.35Å
130	C	69.4	Low	70.5	Confident	52 Å²	52	83.4 Å²	83.4	35%	0.351	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	163.8	170.6	63.7	0	0	0	0	111.2	V116	V116-C130 PolarHBondContact N-O 2.95Å; V116-C130 PolarHBondContact O-N 3.39Å; V116-C130 VanDerWaalsContact O-N 3.12Å
131	F	75.2	Confident	71.3	Confident	75 Å²	75	83 Å²	83	33%	0.329	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	158.3	170.9	68.1	-79.8	0	0	0	111.8	C113 D114 V115 V133 V165 L168	C113-F131 HydrophobicContact CB-CD2 4.31Å; D114-F131 CarbonylContact O-C 3.55Å; D114-F131 WeakPolarHBondContact O-CA 3.43Å; V115-F131 HydrophobicContact CB-CB 4.3Å; V115-F131 HydrophobicContact CG1-CB 4.25Å; V115-F131 HydrophobicContact CG2-CB 3.84Å; F131-V133 HydrophobicContact CE2-CG2 4.28Å; F131-V165 HydrophobicContact CE2-CG1 4.34Å; F131-V165 HydrophobicContact CE2-CG2 4.44Å; F131-L168 HydrophobicContact CZ-CD1 4.18Å
132	R	81.4	Confident	72.2	Confident	109 Å²	109	79.8 Å²	79.8	41%	0.411	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	136.7	168.9	165.8	-178.4	166.9	-171.5	-1.3	108.6	C113 D114 E138	C113-R132 CarbonylContact C-O 3.52Å; C113-R132 WeakPolarHBondContact CA-O 3.44Å; C113-R132 WeakPolarHBondContact CB-O 3.38Å; D114-R132 PolarHBondContact N-O 3.17Å; D114-R132 PolarHBondContact O-N 3.47Å; R132-E138 IonicContact CZ-OE2 3.2Å; R132-E138 IonicContact NH2-OE1 3.27Å; R132-E138 PolarHBondContact NH2-OE1 3.34Å; R132-E138 IonicContact NH2-OE2 2.78Å; R132-E138 PolarHBondContact NH2-OE2 3.22Å
133	V	81.2	Confident	73	Confident	54 Å²	54	73.8 Å²	73.8	33%	0.327	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	135.4	169.7	-167.9	0	0	0	0	109.3	V111 F131 V165	V111-V133 HydrophobicContact CB-CG1 3.72Å; V111-V133 HydrophobicContact CG1-CG1 3.69Å; V111-V133 HydrophobicContact CG2-CG1 3.94Å; F131-V133 HydrophobicContact CE2-CG2 4.28Å; V133-V165 HydrophobicContact CG2-CG1 3.63Å
134	F	81.1	Confident	73.7	Confident	5 Å²	5	70.7 Å²	70.7	2%	0.022	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-82.8	138.2	169.1	-74.1	-75.3	0	0	0	111.3	A89 L112 D114 E138 P140 I143 F157	A89-F134 HydrophobicContact CB-CB 3.72Å; A89-F134 HydrophobicContact CB-CG 4.42Å; L112-F134 HydrophobicContact CB-CD2 4.08Å; L112-F134 HydrophobicContact CD2-CD2 4.05Å; L112-F134 HydrophobicContact CD2-CE2 4.33Å; L112-F134 HydrophobicContact CG-CD2 4.06Å; L112-F134 PolarHBondContact O-N 2.91Å; D114-F134 HydrophobicContact CB-CE2 3.66Å; D114-F134 HydrophobicContact CB-CZ 3.74Å; F134-E138 WeakPolarHBondContact CA-OE2 3.3Å; F134-E138 HydrophobicContact CD1-CB 4.09Å; F134-P140 HydrophobicContact CD1-CG 4.45Å; F134-P140 HydrophobicContact CD2-CG 4.46Å; F134-P140 HydrophobicContact CE1-CB 4.25Å; F134-P140 HydrophobicContact CE1-CG 4.49Å; F134-P140 HydrophobicContact CE2-CB 4.16Å; F134-P140 HydrophobicContact CG-CG 4.43Å; F134-P140 HydrophobicContact CZ-CB 3.97Å; F134-I143 HydrophobicContact CD1-CD1 4.02Å; F134-I143 HydrophobicContact CE1-CB 4.02Å; F134-I143 HydrophobicContact CE1-CD1 3.65Å; F134-I143 HydrophobicContact CE1-CG1 4.42Å; F134-I143 HydrophobicContact CE1-CG2 3.91Å; F134-I143 HydrophobicContact CZ-CG2 4.33Å; F134-F157 AromaticContact CE2-CD1 3.75Å; F134-F157 HydrophobicContact CE2-CD1 3.75Å; F134-F157 AromaticContact CE2-CE1 3.58Å; F134-F157 HydrophobicContact CE2-CE1 3.58Å; F134-F157 HydrophobicContact CZ-CD1 4.35Å; F134-F157 AromaticContact CZ-CE1 3.7Å; F134-F157 HydrophobicContact CZ-CE1 3.7Å
135	G	77.5	Confident	74.2	Confident	32 Å²	32	70.1 Å²	70.1	33%	0.33	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-70.3	149	164.7	0	0	0	0	0	111.5	A89 S137 E138	A89-G135 WeakPolarHBondContact CB-O 3.43Å; G135-S137 PolarHBondContact O-N 2.73Å; G135-E138 PolarHBondContact N-OE2 3.16Å; G135-E138 WeakPolarHBondContact O-CB 3.48Å; G135-E138 PolarHBondContact O-N 3.09Å
136	D	79.3	Confident	73.7	Confident	51 Å²	51	64.2 Å²	64.2	27%	0.273	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-30.4	-172.3	-80.4	-27	0	0	0	114.7	R90 R162	R90-D136 HydrophobicContact CB-CB 3.96Å; R90-D136 WeakPolarHBondContact CB-O 3.49Å; R90-D136 PolarHBondContact N-O 3.07Å; D136-R162 IonicContact OD1-NH2 2.79Å; D136-R162 PolarHBondContact OD1-NH2 3.28Å; D136-R162 IonicContact OD2-CZ 3.86Å; D136-R162 IonicContact OD2-NH1 3.84Å; D136-R162 IonicContact OD2-NH2 2.95Å; D136-R162 PolarHBondContact OD2-NH2 3.34Å
137	S	79.8	Confident	72.8	Confident	106 Å²	106	67.3 Å²	67.3	74%	0.741	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-0.2	179	55.3	0	0	0	0	114.8	G135	G135-S137 PolarHBondContact O-N 2.73Å
138	E	77.2	Confident	72.4	Confident	63 Å²	63	66 Å²	66	29%	0.294	34%	0.339	S	S	.	.			trans	-72.4	154.3	175.8	-59.6	-162.5	120	0	0	110.9	S88 A89 R132 F134 G135 P140 I143	S88-E138 CarbonylContact C-O 3.53Å; S88-E138 WeakPolarHBondContact CA-O 3.28Å; A89-E138 PolarHBondContact N-O 2.9Å; R132-E138 IonicContact CZ-OE2 3.2Å; R132-E138 IonicContact NH2-OE1 3.27Å; R132-E138 PolarHBondContact NH2-OE1 3.34Å; R132-E138 IonicContact NH2-OE2 2.78Å; R132-E138 PolarHBondContact NH2-OE2 3.22Å; F134-E138 WeakPolarHBondContact CA-OE2 3.3Å; F134-E138 HydrophobicContact CD1-CB 4.09Å; G135-E138 PolarHBondContact N-OE2 3.16Å; G135-E138 WeakPolarHBondContact O-CB 3.48Å; G135-E138 PolarHBondContact O-N 3.09Å; E138-P140 WeakPolarHBondContact O-CD 3.49Å; E138-I143 HydrophobicContact CB-CD1 4.07Å
139	K	83.6	Confident	72.2	Confident	80 Å²	80	64.7 Å²	64.7	35%	0.348	33%	0.327	S	S	.	.			trans	-109.9	101.9	-174.9	-69.9	175.1	171.2	-170.5	0	110	T86 L141 L142 I143	T86-K139 VanDerWaalsContact O-CE 3.3Å; T86-K139 WeakPolarHBondContact O-CE 3.47Å; K139-L141 PolarHBondContact O-N 2.87Å; K139-L142 HydrophobicContact CB-CB 3.96Å; K139-L142 HydrophobicContact CB-CD2 4.5Å; K139-L142 HydrophobicContact CD-CD2 4.35Å; K139-L142 PolarHBondContact O-N 2.77Å; K139-I143 PolarHBondContact O-N 3.48Å; K139-I143 VanDerWaalsContact O-N 3.13Å
140	P	78.1	Confident	71.6	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-64.2	-38.6	-168	-27.1	38.3	0	0	0	114.2	S87 A89 L92 L112 F134 E138 I143 Q144 F157	S87-P140 WeakPolarHBondContact O-CD 3.42Å; A89-P140 HydrophobicContact CB-CG 4Å; L92-P140 HydrophobicContact CD1-CB 4.31Å; L92-P140 HydrophobicContact CD1-CG 3.76Å; L112-P140 HydrophobicContact CD2-CB 3.93Å; L112-P140 HydrophobicContact CD2-CG 3.57Å; F134-P140 HydrophobicContact CD1-CG 4.45Å; F134-P140 HydrophobicContact CD2-CG 4.46Å; F134-P140 HydrophobicContact CE1-CB 4.25Å; F134-P140 HydrophobicContact CE1-CG 4.49Å; F134-P140 HydrophobicContact CE2-CB 4.16Å; F134-P140 HydrophobicContact CG-CG 4.43Å; F134-P140 HydrophobicContact CZ-CB 3.97Å; E138-P140 WeakPolarHBondContact O-CD 3.49Å; P140-I143 PolarHBondContact O-N 3Å; P140-Q144 PolarHBondContact O-N 2.86Å; P140-F157 HydrophobicContact CB-CD1 4.3Å; P140-F157 HydrophobicContact CB-CE1 3.7Å; P140-F157 HydrophobicContact CB-CZ 4.38Å
141	L	75.6	Confident	71.3	Confident	24 Å²	24	76.7 Å²	76.7	13%	0.126	37%	0.369	C	S	.	.	H	α-helix	trans	-66.2	-42.2	176.4	-73.2	-175.7	0	0	0	112.8	L65 A83 K139 I143 Q144 E145	L65-L141 HydrophobicContact CD1-CD2 4.07Å; A83-L141 HydrophobicContact CB-CD1 3.56Å; A83-L141 HydrophobicContact CB-CG 4.04Å; A83-L141 VanDerWaalsContact O-CD1 3.31Å; A83-L141 WeakPolarHBondContact O-CD1 3.28Å; K139-L141 PolarHBondContact O-N 2.87Å; L141-I143 PolarHBondContact O-N 3.24Å; L141-Q144 WeakPolarHBondContact O-CA 3.37Å; L141-Q144 WeakPolarHBondContact O-CB 3.44Å; L141-Q144 PolarHBondContact O-N 2.89Å; L141-E145 WeakPolarHBondContact O-CG 3.42Å; L141-E145 PolarHBondContact O-N 2.95Å
142	L	67.9	Low	71	Confident	74 Å²	74	76.1 Å²	76.1	39%	0.387	38%	0.384	S	S	.	.	H	α-helix	trans	-62.4	-33.4	175.6	-177	67.4	0	0	0	111.4	K139 L146	K139-L142 HydrophobicContact CB-CB 3.96Å; K139-L142 HydrophobicContact CB-CD2 4.5Å; K139-L142 HydrophobicContact CD-CD2 4.35Å; K139-L142 PolarHBondContact O-N 2.77Å; L142-L146 HydrophobicContact CG-CD1 4.32Å; L142-L146 WeakPolarHBondContact O-CB 3.3Å; L142-L146 WeakPolarHBondContact O-CD1 3.2Å; L142-L146 WeakPolarHBondContact O-CG 3.43Å; L142-L146 PolarHBondContact O-N 2.85Å
143	I	63.8	Low	70.6	Confident	31 Å²	31	72.5 Å²	72.5	16%	0.159	37%	0.373	C	S	.	.	H	α-helix	trans	-76.7	-24.8	175.5	-68	166.6	0	0	0	111.8	F134 E138 K139 P140 L141	F134-I143 HydrophobicContact CD1-CD1 4.02Å; F134-I143 HydrophobicContact CE1-CB 4.02Å; F134-I143 HydrophobicContact CE1-CD1 3.65Å; F134-I143 HydrophobicContact CE1-CG1 4.42Å; F134-I143 HydrophobicContact CE1-CG2 3.91Å; F134-I143 HydrophobicContact CZ-CG2 4.33Å; E138-I143 HydrophobicContact CB-CD1 4.07Å; K139-I143 PolarHBondContact O-N 3.48Å; K139-I143 VanDerWaalsContact O-N 3.13Å; P140-I143 PolarHBondContact O-N 3Å; L141-I143 PolarHBondContact O-N 3.24Å
144	Q	67.1	Low	70.5	Confident	10 Å²	10	70.5 Å²	70.5	5%	0.047	36%	0.361	C	S	.	.	H	α-helix	trans	-70.1	-44.6	168.5	166.3	174	-5.1	0	0	112	E54 T57 P140 L141 L146 W147 F157	E54-Q144 PolarHBondContact OE1-NE2 2.72Å; E54-Q144 PolarHBondContact OE2-NE2 3.39Å; T57-Q144 PolarHBondContact OG1-NE2 3.25Å; P140-Q144 PolarHBondContact O-N 2.86Å; L141-Q144 WeakPolarHBondContact O-CA 3.37Å; L141-Q144 WeakPolarHBondContact O-CB 3.44Å; L141-Q144 PolarHBondContact O-N 2.89Å; Q144-L146 VanDerWaalsContact C-N 3.27Å; Q144-L146 PolarHBondContact O-N 2.93Å; Q144-W147 PolarHBondContact O-N 2.82Å; Q144-W147 VanDerWaalsContact O-O 3.12Å; Q144-F157 HydrophobicContact CB-CZ 4.24Å; Q144-F157 VanDerWaalsContact OE1-CE2 3.32Å
145	E	61.4	Low	70.6	Confident	144 Å²	144	70.3 Å²	70.3	67%	0.673	36%	0.361	S	S	*	.	H	α-helix	trans	-60.6	-34.2	175.5	-70.3	166.4	-175.7	0	0	112.7	L141	L141-E145 WeakPolarHBondContact O-CG 3.42Å; L141-E145 PolarHBondContact O-N 2.95Å
146	L	50.3	Low	71	Confident	110 Å²	110	69.8 Å²	69.8	58%	0.576	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-17.7	-177.3	-75.1	167.7	0	0	0	115.3	L142 Q144	L142-L146 HydrophobicContact CG-CD1 4.32Å; L142-L146 WeakPolarHBondContact O-CB 3.3Å; L142-L146 WeakPolarHBondContact O-CD1 3.2Å; L142-L146 WeakPolarHBondContact O-CG 3.43Å; L142-L146 PolarHBondContact O-N 2.85Å; Q144-L146 VanDerWaalsContact C-N 3.27Å; Q144-L146 PolarHBondContact O-N 2.93Å
147	W	57.8	Low	71.5	Confident	116 Å²	116	67.3 Å²	67.3	44%	0.439	34%	0.335	S	S	.	.			trans	-161.9	133.2	-179.4	176.6	72.2	0	0	0	112.8	V116 Q144 P149 R155 L264	V116-W147 HydrophobicContact CG2-CH2 3.94Å; V116-W147 HydrophobicContact CG2-CZ3 3.91Å; Q144-W147 PolarHBondContact O-N 2.82Å; Q144-W147 VanDerWaalsContact O-O 3.12Å; W147-P149 HydrophobicContact CH2-CB 4.45Å; W147-P149 HydrophobicContact CH2-CG 4.43Å; W147-R155 PolarHBondContact O-NH1 2.86Å; W147-R155 PolarHBondContact O-NH2 3.43Å; W147-L264 HydrophobicContact CB-CD1 4.32Å
148	K	65.9	Low	71.9	Confident	102 Å²	102	63 Å²	63	44%	0.443	30%	0.304	S	S	.	.			trans	-108.1	149.4	173	-71.4	-169.7	173.3	-172.3	0	112.8	D51 E54	D51-K148 IonicContact OD2-NZ 3.79Å; D51-K148 PolarHBondContact OD2-NZ 3.3Å; E54-K148 VanDerWaalsContact OE1-CE 3.28Å; E54-K148 WeakPolarHBondContact OE1-CE 3.17Å; E54-K148 IonicContact OE1-NZ 3.57Å
149	P	68.5	Low	72.5	Confident	16 Å²	16	60 Å²	60	10%	0.104	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-54.2	160.4	169.8	-25.1	34.9	0	0	0	113.8	V116 W147 L153 R155	V116-P149 HydrophobicContact CG1-CB 4.12Å; V116-P149 HydrophobicContact CG1-CG 4.34Å; W147-P149 HydrophobicContact CH2-CB 4.45Å; W147-P149 HydrophobicContact CH2-CG 4.43Å; P149-L153 HydrophobicContact CB-CB 3.96Å; P149-R155 HydrophobicContact CG-CB 3.95Å
150	R	61.8	Low	72.7	Confident	206 Å²	206	58 Å²	58	78%	0.777	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-73.3	158.4	171.1	-65.3	-177.1	177.4	-177.8	-0.9	110.8	G152 L153	R150-G152 PolarHBondContact O-N 3.13Å; R150-L153 HydrophobicContact CB-CD1 4.49Å; R150-L153 WeakPolarHBondContact O-CB 3.5Å; R150-L153 PolarHBondContact O-N 3.29Å
151	E	63.8	Low	73	Confident	203 Å²	203	61.6 Å²	61.6	95%	0.949	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	137.7	175.1	-63.8	-179.1	163	0	0	112.3	L153	E151-L153 PolarHBondContact O-N 3.1Å
152	G	67.9	Low	73.4	Confident	62 Å²	62	63.6 Å²	63.6	64%	0.639	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	2.3	-174.6	0	0	0	0	0	115.2	Q118 R150	Q118-G152 WeakPolarHBondContact CG-O 3.44Å; R150-G152 PolarHBondContact O-N 3.13Å
153	L	73.4	Confident	74	Confident	34 Å²	34	63.2 Å²	63.2	18%	0.178	31%	0.305	C	S	.	.			trans	-117.9	148.2	169.8	-55.3	177.5	0	0	0	110.4	V116 G117 Q118 P149 R150 E151	V116-L153 HydrophobicContact CG1-CB 3.98Å; V116-L153 HydrophobicContact CG1-CD1 4.02Å; G117-L153 WeakPolarHBondContact O-CA 3.38Å; Q118-L153 HydrophobicContact CG-CD2 3.68Å; P149-L153 HydrophobicContact CB-CB 3.96Å; R150-L153 HydrophobicContact CB-CD1 4.49Å; R150-L153 WeakPolarHBondContact O-CB 3.5Å; R150-L153 PolarHBondContact O-N 3.29Å; E151-L153 PolarHBondContact O-N 3.1Å
154	S	79.2	Confident	74.7	Confident	12 Å²	12	64.4 Å²	64.4	8%	0.084	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	165.3	176.1	-41.6	0	0	0	0	111.5	A53 V116 G117 W126	A53-S154 WeakPolarHBondContact O-CA 3.38Å; A53-S154 WeakPolarHBondContact O-CB 3.17Å; V116-S154 WeakPolarHBondContact CA-O 3.31Å; G117-S154 PolarHBondContact N-O 3.38Å; G117-S154 PolarHBondContact O-N 3.11Å; W126-S154 WeakPolarHBondContact CH2-O 3.45Å
155	R	83	Confident	75.2	Confident	1 Å²	1	64.9 Å²	64.9	0%	0.004	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.7	172.8	165.4	173.6	-81	139.9	-14.3	112.5	A53 S56 D114 W147 P149 F157	A53-R155 PolarHBondContact O-N 3.47Å; S56-R155 PolarHBondContact OG-O 2.96Å; D114-R155 WeakPolarHBondContact OD1-CG 3.41Å; D114-R155 IonicContact OD1-CZ 3.67Å; D114-R155 IonicContact OD1-NE 2.74Å; D114-R155 PolarHBondContact OD1-NE 3.02Å; D114-R155 IonicContact OD1-NH2 3.74Å; D114-R155 IonicContact OD2-CZ 3.67Å; D114-R155 IonicContact OD2-NE 3.88Å; D114-R155 PolarHBondContact OD2-NE 3.05Å; D114-R155 IonicContact OD2-NH2 2.77Å; D114-R155 PolarHBondContact OD2-NH2 3.17Å; W147-R155 PolarHBondContact O-NH1 2.86Å; W147-R155 PolarHBondContact O-NH2 3.43Å; P149-R155 HydrophobicContact CG-CB 3.95Å; R155-F157 HydrophobicContact CG-CD2 4.36Å; R155-F157 HydrophobicContact CG-CE2 3.96Å; R155-F157 HydrophobicContact CG-CZ 4.45Å
156	R	85.9	Confident	75.8	Confident	20 Å²	20	64 Å²	64	8%	0.075	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	126.9	175.2	-168.3	-175.4	-166.2	-148.4	12.1	110.7	S56 F68 D70 V115 W126 E158	S56-R156 WeakPolarHBondContact OG-CA 3.12Å; F68-R156 HydrophobicContact CB-CG 4.26Å; F68-R156 HydrophobicContact CD1-CG 4.32Å; F68-R156 HydrophobicContact CD2-CG 3.4Å; F68-R156 VanDerWaalsContact CD2-CG 3.4Å; F68-R156 HydrophobicContact CE2-CG 3.68Å; F68-R156 HydrophobicContact CG-CG 3.75Å; F68-R156 HydrophobicContact CZ-CG 4.24Å; D70-R156 IonicContact OD2-CZ 2.72Å; D70-R156 IonicContact OD2-NH1 3.61Å; D70-R156 PolarHBondContact OD2-NH1 3.23Å; D70-R156 VanDerWaalsContact OD2-NH1 3.08Å; D70-R156 IonicContact OD2-NH2 2.81Å; D70-R156 PolarHBondContact OD2-NH2 3.36Å; V115-R156 WeakPolarHBondContact CA-O 3.48Å; V115-R156 HydrophobicContact CB-CB 4.44Å; V115-R156 VanDerWaalsContact CB-O 3.3Å; V115-R156 WeakPolarHBondContact CB-O 3.34Å; V115-R156 PolarHBondContact N-O 3.35Å; V115-R156 PolarHBondContact O-N 2.91Å; W126-R156 VanDerWaalsContact CE2-CD 3.45Å; W126-R156 HydrophobicContact CH2-CB 3.92Å; W126-R156 HydrophobicContact CZ2-CB 3.47Å; W126-R156 VanDerWaalsContact CZ2-CB 3.47Å; W126-R156 HydrophobicContact CZ2-CG 4.35Å; W126-R156 VanDerWaalsContact NE1-CD 3.27Å; R156-E158 WeakPolarHBondContact CD-OE1 3.49Å; R156-E158 HydrophobicContact CG-CG 4.15Å; R156-E158 IonicContact CZ-OE1 3.08Å; R156-E158 IonicContact NE-OE1 3.02Å; R156-E158 IonicContact NH1-OE1 2.69Å; R156-E158 PolarHBondContact NH1-OE1 3.48Å
157	F	88.6	Confident	76.7	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	115.2	171.2	-68.4	-89.3	0	0	0	110.7	S56 L65 F68 L112 C113 F134 P140 Q144 R155	S56-F157 PolarHBondContact OG-N 3.22Å; L65-F157 HydrophobicContact CD1-CD2 3.59Å; L65-F157 HydrophobicContact CD1-CE2 3.68Å; L65-F157 HydrophobicContact CD1-CG 4.31Å; L65-F157 HydrophobicContact CD1-CZ 4.48Å; L65-F157 HydrophobicContact CG-CD2 4.45Å; F68-F157 WeakPolarHBondContact CD2-O 3.5Å; F68-F157 PolarHBondContact N-O 3.01Å; L112-F157 HydrophobicContact CD1-CB 4.29Å; L112-F157 HydrophobicContact CD2-CD1 4Å; L112-F157 HydrophobicContact CG-CD1 4.35Å; C113-F157 WeakPolarHBondContact O-CA 3.5Å; F134-F157 AromaticContact CE2-CD1 3.75Å; F134-F157 HydrophobicContact CE2-CD1 3.75Å; F134-F157 AromaticContact CE2-CE1 3.58Å; F134-F157 HydrophobicContact CE2-CE1 3.58Å; F134-F157 HydrophobicContact CZ-CD1 4.35Å; F134-F157 AromaticContact CZ-CE1 3.7Å; F134-F157 HydrophobicContact CZ-CE1 3.7Å; P140-F157 HydrophobicContact CB-CD1 4.3Å; P140-F157 HydrophobicContact CB-CE1 3.7Å; P140-F157 HydrophobicContact CB-CZ 4.38Å; Q144-F157 HydrophobicContact CB-CZ 4.24Å; Q144-F157 VanDerWaalsContact OE1-CE2 3.32Å; R155-F157 HydrophobicContact CG-CD2 4.36Å; R155-F157 HydrophobicContact CG-CE2 3.96Å; R155-F157 HydrophobicContact CG-CZ 4.45Å
158	E	88.9	Confident	77.2	Confident	16 Å²	16	62.3 Å²	62.3	8%	0.075	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	134.3	-179.9	-67	-175.9	-175.1	0	0	111.8	F68 L112 C113 V115 W126 R156 R160	F68-E158 HydrophobicContact CB-CG 4.32Å; F68-E158 WeakPolarHBondContact O-CA 3.47Å; L112-E158 CarbonylContact C-O 3.54Å; C113-E158 PolarHBondContact N-O 3.48Å; C113-E158 PolarHBondContact O-N 2.93Å; V115-E158 HydrophobicContact CB-CG 4.28Å; V115-E158 HydrophobicContact CG2-CB 3.76Å; V115-E158 HydrophobicContact CG2-CG 3.67Å; W126-E158 PolarHBondContact NE1-OE1 3.08Å; R156-E158 WeakPolarHBondContact CD-OE1 3.49Å; R156-E158 HydrophobicContact CG-CG 4.15Å; R156-E158 IonicContact CZ-OE1 3.08Å; R156-E158 IonicContact NE-OE1 3.02Å; R156-E158 IonicContact NH1-OE1 2.69Å; R156-E158 PolarHBondContact NH1-OE1 3.48Å; E158-R160 HydrophobicContact CB-CG 4.48Å; E158-R160 IonicContact OE2-CZ 3.86Å; E158-R160 VanDerWaalsContact OE2-CZ 3.27Å; E158-R160 IonicContact OE2-NE 2.67Å; E158-R160 PolarHBondContact OE2-NE 3.29Å; E158-R160 IonicContact OE2-NH2 3.34Å; E158-R160 PolarHBondContact OE2-NH2 2.93Å
159	L	89.2	Confident	76.9	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	126.9	166.5	-175.6	68.4	0	0	0	108.7	V67 F68 S71 V72 V93 A96 L97 Y100 Y110	V67-L159 HydrophobicContact CG1-CB 3.88Å; F68-L159 PolarHBondContact O-N 3.01Å; S71-L159 PolarHBondContact OG-O 2.84Å; V72-L159 HydrophobicContact CG1-CD2 4.33Å; V72-L159 HydrophobicContact CG2-CD2 4.49Å; V72-L159 HydrophobicContact CG2-CG 4.28Å; V93-L159 HydrophobicContact CB-CD1 4.34Å; V93-L159 HydrophobicContact CG1-CD1 4.09Å; V93-L159 HydrophobicContact CG2-CD1 3.86Å; A96-L159 HydrophobicContact CB-CD2 4.24Å; L97-L159 HydrophobicContact CD2-CD2 4.07Å; L97-L159 HydrophobicContact CG-CD2 4.39Å; Y100-L159 HydrophobicContact CD2-CD2 4.16Å; Y100-L159 HydrophobicContact CE2-CD2 4.44Å; Y110-L159 HydrophobicContact CD1-CD1 4.47Å; Y110-L159 HydrophobicContact CD1-CG 4.32Å
160	R	88.1	Confident	76.3	Confident	37 Å²	37	62 Å²	62	14%	0.14	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	158.6	178.5	-62.2	-174.7	176.9	-167.6	-0	110.5	Y110 V111 E158 V165	Y110-R160 CarbonylContact C-O 3.38Å; Y110-R160 WeakPolarHBondContact CA-O 3.39Å; V111-R160 PolarHBondContact N-O 3.16Å; V111-R160 PolarHBondContact O-N 2.68Å; E158-R160 HydrophobicContact CB-CG 4.48Å; E158-R160 IonicContact OE2-CZ 3.86Å; E158-R160 VanDerWaalsContact OE2-CZ 3.27Å; E158-R160 IonicContact OE2-NE 2.67Å; E158-R160 PolarHBondContact OE2-NE 3.29Å; E158-R160 IonicContact OE2-NH2 3.34Å; E158-R160 PolarHBondContact OE2-NH2 2.93Å; R160-V165 HydrophobicContact CB-CG2 4.06Å
161	K	85.7	Confident	76	Confident	76 Å²	76	57.8 Å²	57.8	33%	0.33	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	149.9	169.6	-64.1	171.4	-178.9	172.1	0	110.3	Y110 S163 D164 V165	Y110-K161 HydrophobicContact CD1-CG 3.87Å; Y110-K161 HydrophobicContact CE1-CD 4.42Å; Y110-K161 HydrophobicContact CE1-CG 3.46Å; Y110-K161 VanDerWaalsContact CE1-CG 3.46Å; K161-S163 WeakPolarHBondContact CB-OG 3.46Å; K161-D164 PolarHBondContact O-N 3.06Å; K161-V165 PolarHBondContact O-N 2.95Å
162	R	83.4	Confident	75.3	Confident	66 Å²	66	54 Å²	54	25%	0.249	29%	0.294	C	S	.	.	H	α-helix	trans	-63.4	-41.1	176.9	-69.3	179	-171.5	-156.2	-1.7	111.8	G108 Q109 Y110 V111 D136 D164 V165 E166	G108-R162 VanDerWaalsContact O-CD 3.29Å; G108-R162 WeakPolarHBondContact O-CD 3.43Å; G108-R162 PolarHBondContact O-NE 3.12Å; G108-R162 VanDerWaalsContact O-NE 3.1Å; G108-R162 PolarHBondContact O-NH1 2.82Å; Q109-R162 PolarHBondContact O-N 2.87Å; Y110-R162 PolarHBondContact O-NE 2.87Å; Y110-R162 PolarHBondContact O-NH2 2.79Å; V111-R162 HydrophobicContact CG1-CG 3.78Å; V111-R162 HydrophobicContact CG2-CG 4.2Å; D136-R162 IonicContact OD1-NH2 2.79Å; D136-R162 PolarHBondContact OD1-NH2 3.28Å; D136-R162 IonicContact OD2-CZ 3.86Å; D136-R162 IonicContact OD2-NH1 3.84Å; D136-R162 IonicContact OD2-NH2 2.95Å; D136-R162 PolarHBondContact OD2-NH2 3.34Å; R162-D164 VanDerWaalsContact C-N 3.29Å; R162-D164 PolarHBondContact O-N 3.28Å; R162-V165 PolarHBondContact O-N 3.04Å; R162-E166 WeakPolarHBondContact O-CB 3.33Å; R162-E166 VanDerWaalsContact O-CG 3.28Å; R162-E166 WeakPolarHBondContact O-CG 3.19Å; R162-E166 PolarHBondContact O-N 3.26Å
163	S	79.8	Confident	74.2	Confident	66 Å²	66	54.3 Å²	54.3	46%	0.462	28%	0.284	S	S	.	.	H	α-helix	trans	-49.5	-47.1	173.4	46.4	0	0	0	0	113.4	K161 V165 E166 E167	K161-S163 WeakPolarHBondContact CB-OG 3.46Å; S163-V165 VanDerWaalsContact C-N 3.34Å; S163-V165 PolarHBondContact O-N 3.25Å; S163-E166 PolarHBondContact O-N 3.16Å; S163-E167 WeakPolarHBondContact O-CB 3.49Å; S163-E167 PolarHBondContact O-N 3.28Å
164	D	79.4	Confident	72.7	Confident	56 Å²	56	58.4 Å²	58.4	30%	0.299	31%	0.306	S	S	.	.	H	α-helix	trans	-75.6	-31.5	-170.4	-46.1	-0.8	0	0	0	110.3	K161 R162 L168	K161-D164 PolarHBondContact O-N 3.06Å; R162-D164 VanDerWaalsContact C-N 3.29Å; R162-D164 PolarHBondContact O-N 3.28Å; D164-L168 WeakPolarHBondContact O-CB 3.32Å; D164-L168 WeakPolarHBondContact O-CD1 3.45Å; D164-L168 VanDerWaalsContact O-CG 3.28Å; D164-L168 WeakPolarHBondContact O-CG 3.36Å; D164-L168 PolarHBondContact O-N 3.34Å; D164-L168 VanDerWaalsContact O-N 3.1Å
165	V	76.8	Confident	71.1	Confident	19 Å²	19	63 Å²	63	12%	0.115	33%	0.333	C	S	.	.	H	α-helix	trans	-73.1	-40.7	173.2	171.1	0	0	0	0	111.3	V111 F131 V133 R160 K161 R162 S163 L168 A169	V111-V165 HydrophobicContact CG2-CG2 4.14Å; F131-V165 HydrophobicContact CE2-CG1 4.34Å; F131-V165 HydrophobicContact CE2-CG2 4.44Å; V133-V165 HydrophobicContact CG2-CG1 3.63Å; R160-V165 HydrophobicContact CB-CG2 4.06Å; K161-V165 PolarHBondContact O-N 2.95Å; R162-V165 PolarHBondContact O-N 3.04Å; S163-V165 VanDerWaalsContact C-N 3.34Å; S163-V165 PolarHBondContact O-N 3.25Å; V165-L168 PolarHBondContact O-N 3.08Å; V165-A169 WeakPolarHBondContact O-CB 3.28Å; V165-A169 PolarHBondContact O-N 2.99Å
166	E	74.1	Confident	69.1	Low	127 Å²	127	67.7 Å²	67.7	59%	0.593	36%	0.357	S	S	*	.	H	α-helix	trans	-65.6	-39.9	174.7	-72.5	162.2	-159.6	0	0	111.4	R162 S163 A169 A170	R162-E166 WeakPolarHBondContact O-CB 3.33Å; R162-E166 VanDerWaalsContact O-CG 3.28Å; R162-E166 WeakPolarHBondContact O-CG 3.19Å; R162-E166 PolarHBondContact O-N 3.26Å; S163-E166 PolarHBondContact O-N 3.16Å; E166-A169 PolarHBondContact O-N 2.91Å; E166-A170 WeakPolarHBondContact O-CB 3.37Å; E166-A170 PolarHBondContact O-N 2.76Å
167	E	70.6	Confident	67	Low	111 Å²	111	70 Å²	70	52%	0.519	37%	0.374	S	S	.	.	H	α-helix	trans	-67.6	-36.4	175.1	-160.2	-164.7	155.4	0	0	112.3	S163 K171	S163-E167 WeakPolarHBondContact O-CB 3.49Å; S163-E167 PolarHBondContact O-N 3.28Å; E167-K171 VanDerWaalsContact CD-NZ 3.29Å; E167-K171 WeakPolarHBondContact O-CD 3.41Å; E167-K171 VanDerWaalsContact O-CG 3.31Å; E167-K171 WeakPolarHBondContact O-CG 3.45Å; E167-K171 PolarHBondContact O-N 3.21Å; E167-K171 VanDerWaalsContact OE1-CE 3.24Å; E167-K171 WeakPolarHBondContact OE1-CE 3.3Å; E167-K171 IonicContact OE1-NZ 2.61Å; E167-K171 PolarHBondContact OE1-NZ 3.5Å
168	L	67.6	Low	64.9	Low	78 Å²	78	73.2 Å²	73.2	41%	0.408	40%	0.4	S	S	.	.	H	α-helix	trans	-63.5	-47.5	171.6	-80.8	164.9	0	0	0	111.5	F131 D164 V165 A170 K171 E172	F131-L168 HydrophobicContact CZ-CD1 4.18Å; D164-L168 WeakPolarHBondContact O-CB 3.32Å; D164-L168 WeakPolarHBondContact O-CD1 3.45Å; D164-L168 VanDerWaalsContact O-CG 3.28Å; D164-L168 WeakPolarHBondContact O-CG 3.36Å; D164-L168 PolarHBondContact O-N 3.34Å; D164-L168 VanDerWaalsContact O-N 3.1Å; V165-L168 PolarHBondContact O-N 3.08Å; L168-A170 PolarHBondContact O-N 3.36Å; L168-K171 PolarHBondContact O-N 3.23Å; L168-E172 PolarHBondContact O-N 3.13Å
169	A	59.9	Low	62.8	Low	52 Å²	52	74.3 Å²	74.3	43%	0.43	42%	0.417	S	S	.	.	H	α-helix	trans	-63.1	-39.3	178.3	0	0	0	0	0	112.4	V165 E166 K171 E172 V173	V165-A169 WeakPolarHBondContact O-CB 3.28Å; V165-A169 PolarHBondContact O-N 2.99Å; E166-A169 PolarHBondContact O-N 2.91Å; A169-K171 VanDerWaalsContact C-N 3.31Å; A169-K171 PolarHBondContact O-N 3.18Å; A169-E172 PolarHBondContact O-N 2.72Å; A169-V173 PolarHBondContact O-N 3.25Å
170	A	56.3	Low	60.7	Low	59 Å²	59	79.5 Å²	79.5	49%	0.488	44%	0.443	S	S	.	.	H	α-helix	trans	-60.9	-39	176	0	0	0	0	0	112.4	E166 L168 E172 V173 D174	E166-A170 WeakPolarHBondContact O-CB 3.37Å; E166-A170 PolarHBondContact O-N 2.76Å; L168-A170 PolarHBondContact O-N 3.36Å; A170-E172 PolarHBondContact O-N 3.06Å; A170-V173 PolarHBondContact O-N 2.82Å; A170-D174 PolarHBondContact O-N 3.03Å
171	K	55.6	Low	58.5	Low	119 Å²	119	82.3 Å²	82.3	52%	0.517	46%	0.461	S	S	.	.	H	α-helix	trans	-67.4	-30.9	179.3	-72.9	164.9	-175.1	166	0	113.4	E167 L168 A169 T175	E167-K171 VanDerWaalsContact CD-NZ 3.29Å; E167-K171 WeakPolarHBondContact O-CD 3.41Å; E167-K171 VanDerWaalsContact O-CG 3.31Å; E167-K171 WeakPolarHBondContact O-CG 3.45Å; E167-K171 PolarHBondContact O-N 3.21Å; E167-K171 VanDerWaalsContact OE1-CE 3.24Å; E167-K171 WeakPolarHBondContact OE1-CE 3.3Å; E167-K171 IonicContact OE1-NZ 2.61Å; E167-K171 PolarHBondContact OE1-NZ 3.5Å; L168-K171 PolarHBondContact O-N 3.23Å; A169-K171 VanDerWaalsContact C-N 3.31Å; A169-K171 PolarHBondContact O-N 3.18Å; K171-T175 PolarHBondContact O-OG1 3.4Å
172	E	48.7	Very low	56.6	Low	122 Å²	122	81.3 Å²	81.3	57%	0.57	47%	0.467	S	S	*	.	H	α-helix	trans	-71.3	-33.5	174.4	-67.2	-171.2	147.8	0	0	112.3	L168 A169 A170 T175	L168-E172 PolarHBondContact O-N 3.13Å; A169-E172 PolarHBondContact O-N 2.72Å; A170-E172 PolarHBondContact O-N 3.06Å; E172-T175 PolarHBondContact O-OG1 3.41Å
173	V	44.8	Very low	54.9	Low	69 Å²	69	84.7 Å²	84.7	42%	0.418	49%	0.485	S	S	.	.	H	α-helix	trans	-69.2	-41	-179.6	174.4	0	0	0	0	112.2	A169 A170 T175 I176	A169-V173 PolarHBondContact O-N 3.25Å; A170-V173 PolarHBondContact O-N 2.82Å; V173-T175 VanDerWaalsContact C-N 3.28Å; V173-T175 PolarHBondContact O-N 2.92Å; V173-I176 WeakPolarHBondContact O-CB 3.35Å; V173-I176 PolarHBondContact O-N 3.26Å; V173-I176 VanDerWaalsContact O-N 3.09Å
174	D	40.8	Very low	53.1	Low	121 Å²	121	83.9 Å²	83.9	65%	0.647	48%	0.483	S	S	*	.	H	α-helix	trans	-63	-33.8	-177.8	-113.4	-17.8	0	0	0	112.8	A170 I176 T177 A178	A170-D174 PolarHBondContact O-N 3.03Å; D174-I176 PolarHBondContact O-N 3.13Å; D174-T177 PolarHBondContact O-N 3.03Å; D174-A178 PolarHBondContact O-N 3.26Å
175	T	45.4	Very low	51.6	Low	107 Å²	107	90 Å²	90	66%	0.656	50%	0.501	S	S	*	.	H	α-helix	trans	-60.9	-27.6	175	20.3	0	0	0	0	113.9	K171 E172 V173	K171-T175 PolarHBondContact O-OG1 3.4Å; E172-T175 PolarHBondContact O-OG1 3.41Å; V173-T175 VanDerWaalsContact C-N 3.28Å; V173-T175 PolarHBondContact O-N 2.92Å
176	I	41.3	Very low	50.3	Low	100 Å²	100	98.7 Å²	98.7	51%	0.513	53%	0.532	S	S	.	.	H	α-helix	trans	-75.8	-43.3	179.5	-57.1	173.1	0	0	0	110.2	V173 D174 A178	V173-I176 WeakPolarHBondContact O-CB 3.35Å; V173-I176 PolarHBondContact O-N 3.26Å; V173-I176 VanDerWaalsContact O-N 3.09Å; D174-I176 PolarHBondContact O-N 3.13Å; I176-A178 PolarHBondContact O-N 3.03Å
177	T	42.6	Very low	48.8	Very low	68 Å²	68	98.8 Å²	98.8	42%	0.417	54%	0.536	S	S	.	.	H	α-helix	trans	-73.3	-29.2	-174.2	-39.5	0	0	0	0	113	D174 N181	D174-T177 PolarHBondContact O-N 3.03Å; T177-N181 PolarHBondContact O-ND2 2.91Å
178	A	44.7	Very low	47.6	Very low	68 Å²	68	101.6 Å²	101.6	56%	0.562	55%	0.549	S	S	*	.	H	α-helix	trans	-64.5	-39.7	-179.9	0	0	0	0	0	113.4	D174 I176 A182	D174-A178 PolarHBondContact O-N 3.26Å; I176-A178 PolarHBondContact O-N 3.03Å; A178-A182 PolarHBondContact O-N 3.31Å
179	G	44.6	Very low	46.5	Very low	40 Å²	40	108.2 Å²	108.2	41%	0.412	57%	0.569	S	S	.	*	H	α-helix	trans	-66.3	-39.2	-176.9	0	0	0	0	0	113.7	A182 Q183	G179-A182 WeakPolarHBondContact O-CB 3.43Å; G179-A182 PolarHBondContact O-N 3.32Å; G179-Q183 PolarHBondContact O-N 3.44Å
180	I	44.6	Very low	45.4	Very low	109 Å²	109	110.2 Å²	110.2	56%	0.559	58%	0.58	S	S	*	*	H	α-helix	trans	-66.1	-45.3	-176	-58.4	171.5	0	0	0	110.6	A182 Q183 A184	I180-A182 VanDerWaalsContact C-N 3.26Å; I180-A182 PolarHBondContact O-N 3.2Å; I180-Q183 PolarHBondContact O-N 2.8Å; I180-A184 PolarHBondContact O-N 3.18Å; I180-A184 VanDerWaalsContact O-N 3.16Å
181	N	42	Very low	44.7	Very low	95 Å²	95	119 Å²	119	51%	0.508	60%	0.6	S	S	.	*	H	α-helix	trans	-64.8	-27.3	177.6	-82.5	-59.7	0	0	0	113.4	T177 R185	T177-N181 PolarHBondContact O-ND2 2.91Å; N181-R185 WeakPolarHBondContact O-CG 3.38Å
182	A	45.3	Very low	43.6	Very low	56 Å²	56	117.1 Å²	117.1	46%	0.463	61%	0.607	S	S	.	*	H	α-helix	trans	-71.4	-34.9	174.6	0	0	0	0	0	112.7	A178 G179 I180	A178-A182 PolarHBondContact O-N 3.31Å; G179-A182 WeakPolarHBondContact O-CB 3.43Å; G179-A182 PolarHBondContact O-N 3.32Å; I180-A182 VanDerWaalsContact C-N 3.26Å; I180-A182 PolarHBondContact O-N 3.2Å
183	Q	47.9	Very low	42.9	Very low	136 Å²	136	121.7 Å²	121.7	64%	0.636	62%	0.624	S	S	*	*	H	α-helix	trans	-73.5	-42.8	177	-68.7	-174.9	-8.5	0	0	112.3	G179 I180 R185 R186 L187	G179-Q183 PolarHBondContact O-N 3.44Å; I180-Q183 PolarHBondContact O-N 2.8Å; Q183-R185 VanDerWaalsContact C-N 3.27Å; Q183-R185 PolarHBondContact O-N 3.27Å; Q183-R186 WeakPolarHBondContact O-CB 3.49Å; Q183-R186 PolarHBondContact O-N 2.77Å; Q183-L187 PolarHBondContact O-N 3.26Å; Q183-L187 VanDerWaalsContact O-N 3.13Å
184	A	42.8	Very low	42.1	Very low	49 Å²	49	122 Å²	122	41%	0.405	64%	0.641	S	S	.	*	H	α-helix	trans	-54.8	-41.8	177.9	0	0	0	0	0	112.6	I180 R186 L187 Q188	I180-A184 PolarHBondContact O-N 3.18Å; I180-A184 VanDerWaalsContact O-N 3.16Å; A184-R186 VanDerWaalsContact C-N 3.28Å; A184-R186 PolarHBondContact O-N 3.03Å; A184-L187 PolarHBondContact O-N 3.45Å; A184-Q188 PolarHBondContact O-N 3.48Å
185	R	47.9	Very low	41.5	Very low	184 Å²	184	122.9 Å²	122.9	69%	0.694	65%	0.651	S	S	*	*	H	α-helix	trans	-69.5	-17.8	177.3	-69	177	179.7	178	1.4	114.4	N181 Q183	N181-R185 WeakPolarHBondContact O-CG 3.38Å; Q183-R185 VanDerWaalsContact C-N 3.27Å; Q183-R185 PolarHBondContact O-N 3.27Å
186	R	48	Very low	41.5	Very low	203 Å²	203	123.3 Å²	123.3	77%	0.766	66%	0.656	S	S	*	*	H	α-helix	trans	-84.8	-43.6	173.1	-70.5	-176.9	176.6	-165	-0.7	111.6	Q183 A184 Q188 R189	Q183-R186 WeakPolarHBondContact O-CB 3.49Å; Q183-R186 PolarHBondContact O-N 2.77Å; A184-R186 VanDerWaalsContact C-N 3.28Å; A184-R186 PolarHBondContact O-N 3.03Å; R186-Q188 VanDerWaalsContact C-N 3.27Å; R186-Q188 PolarHBondContact O-N 3.06Å; R186-R189 PolarHBondContact O-N 3.48Å; R186-R189 VanDerWaalsContact O-N 3.08Å
187	L	43.2	Very low	40.7	Very low	128 Å²	128	122.6 Å²	122.6	67%	0.67	67%	0.665	S	S	*	*	H	α-helix	trans	-63.5	-27.4	-177.3	-76.2	164.2	0	0	0	113.9	Q183 A184 R189	Q183-L187 PolarHBondContact O-N 3.26Å; Q183-L187 VanDerWaalsContact O-N 3.13Å; A184-L187 PolarHBondContact O-N 3.45Å; L187-R189 VanDerWaalsContact C-N 3.27Å; L187-R189 PolarHBondContact O-N 2.89Å
188	Q	45.8	Very low	40	Very low	170 Å²	170	127.8 Å²	127.8	79%	0.794	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-9.8	175.4	-70.8	-175.9	-18.2	0	0	114.6	A184 R186	A184-Q188 PolarHBondContact O-N 3.48Å; R186-Q188 VanDerWaalsContact C-N 3.27Å; R186-Q188 PolarHBondContact O-N 3.06Å
189	R	44.1	Very low	39.1	Very low	218 Å²	218	129 Å²	129	82%	0.823	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-13.8	-173.8	-67.2	-175.3	178.7	-176.2	-1	115.4	R186 L187	R186-R189 PolarHBondContact O-N 3.48Å; R186-R189 VanDerWaalsContact O-N 3.08Å; L187-R189 VanDerWaalsContact C-N 3.27Å; L187-R189 PolarHBondContact O-N 2.89Å
190	S	37.6	Very low	38.2	Very low	94 Å²	94	135.9 Å²	135.9	66%	0.657	73%	0.726	S	S	*	*	S	Bend	trans	-91.1	-0.4	-177.3	51.2	0	0	0	0	114.6	A192	S190-A192 VanDerWaalsContact C-N 3.3Å; S190-A192 PolarHBondContact O-N 2.98Å; S190-A192 VanDerWaalsContact O-N 3.17Å
191	R	40.2	Very low	37.2	Very low	244 Å²	244	134.4 Å²	134.4	92%	0.921	74%	0.737	S	S	*	*			trans	-89.8	44.4	-173.9	-141.2	176.9	-166	-177.4	4.2	113.7
192	A	33.2	Very low	36.4	Very low	78 Å²	78	137.8 Å²	137.8	65%	0.645	76%	0.756	S	S	*	*			trans	-155.1	126	175.4	0	0	0	0	0	113.6	S190	S190-A192 VanDerWaalsContact C-N 3.3Å; S190-A192 PolarHBondContact O-N 2.98Å; S190-A192 VanDerWaalsContact O-N 3.17Å
193	K	33.2	Very low	35.4	Very low	218 Å²	218	138.8 Å²	138.8	95%	0.948	76%	0.764	S	S	*	*			trans	63.9	151.8	177.6	-55.7	179	179.6	-179	0	114.9
194	G	29.1	Very low	34.3	Very low	75 Å²	75	144 Å²	144	77%	0.773	78%	0.777	S	S	*	*			cis	147.9	111.5	-4.4	0	0	0	0	0	111.6
195	T	28.9	Very low	33.4	Very low	140 Å²	140	147 Å²	147	86%	0.859	80%	0.795	S	S	*	*			trans	-70.3	169.2	176.1	11.9	0	0	0	0	112.7
196	P	44.5	Very low	32.3	Very low	117 Å²	117	143.2 Å²	143.2	76%	0.76	80%	0.797	S	S	*	*			cis	-138.7	-171.5	2.9	38.8	-18.3	0	0	0	117
197	A	24.6	Very low	31.6	Very low	84 Å²	84	139.2 Å²	139.2	69%	0.694	80%	0.798	S	S	*	*			trans	102.2	120	139.9	0	0	0	0	0	123.2
198	L	27.5	Very low	31.4	Very low	177 Å²	177	138.4 Å²	138.4	93%	0.927	80%	0.8	S	S	*	*			trans	66	149.8	135.2	-69.5	171.5	0	0	0	124.9
199	A	25.1	Very low	30.7	Very low	94 Å²	94	135.6 Å²	135.6	78%	0.777	80%	0.797	S	S	*	*			trans	88.8	107.8	151.4	0	0	0	0	0	122.3
200	L	26.6	Very low	29.8	Very low	185 Å²	185	136.2 Å²	136.2	97%	0.969	80%	0.799	S	S	*	*			trans	6.3	136.2	132.7	-168.8	73.9	0	0	0	120
201	G	23.9	Very low	29.4	Very low	77 Å²	77	139.7 Å²	139.7	79%	0.794	81%	0.809	S	S	*	*			trans	171.8	114.7	163	0	0	0	0	0	116.4
202	D	25.1	Very low	28.7	Very low	167 Å²	167	137.4 Å²	137.4	89%	0.893	80%	0.801	S	S	*	*			trans	-73.6	-179.3	-168.7	-143.2	-33.2	0	0	0	118.2
203	A	25.4	Very low	28.4	Very low	77 Å²	77	140.2 Å²	140.2	64%	0.636	80%	0.795	S	S	*	*			trans	74.8	88.8	146.2	0	0	0	0	0	123.1
204	R	23.7	Very low	28.2	Very low	244 Å²	244	132.7 Å²	132.7	92%	0.921	77%	0.767	S	S	*	*				37.3	121.2	124.3	-62.9	174.9	171.3	176.7	-2.6	121.3
205	S	23.3	Very low	28.1	Very low	112 Å²	112	134.2 Å²	134.2	78%	0.783	76%	0.761	S	S	*	*				-173.6	130.6	123.8	48	0	0	0	0	115.4
206	S	25.3	Very low	28.1	Very low	105 Å²	105	130.5 Å²	130.5	73%	0.734	74%	0.741	S	S	*	*			trans	26.5	161.2	139.3	64.2	0	0	0	0	124.5
207	P	34	Very low	27.7	Very low	120 Å²	120	134.2 Å²	134.2	78%	0.779	75%	0.748	S	S	*	*			cis	-130.4	-122.7	-22.9	30.2	-4.2	0	0	0	113.9
208	P	38.2	Very low	29	Very low	111 Å²	111	135.7 Å²	135.7	72%	0.721	75%	0.749	S	S	*	*				-134.1	-158.1	-126.6	47.5	-25.8	0	0	0	113.6
209	P	32.2	Very low	29	Very low	111 Å²	111	132.2 Å²	132.2	72%	0.721	74%	0.739	S	S	*	*			cis	-127.3	-165.2	-13.9	30.2	-7.5	0	0	0	113.9
210	R	24.3	Very low	28.9	Very low	230 Å²	230	132.7 Å²	132.7	87%	0.868	73%	0.728	S	S	*	*			trans	89.5	55.8	165.2	-54.2	-167.7	-179.9	-130.2	-1.3	118.7
211	L	29	Very low	28.7	Very low	167 Å²	167	128.1 Å²	128.1	87%	0.874	71%	0.712	S	S	*	*				48.2	107.4	126.3	-74.8	164	0	0	0	119.8
212	R	26.4	Very low	29.1	Very low	197 Å²	197	127.9 Å²	127.9	74%	0.743	70%	0.696	S	S	*	*			trans	-134.8	108	143.4	-67.9	-178.7	162.9	177	-5.9	109.9	V223	R212-V223 HydrophobicContact CB-CB 4.13Å; R212-V223 HydrophobicContact CB-CG1 3.72Å; R212-V223 HydrophobicContact CB-CG2 4Å; R212-V223 HydrophobicContact CG-CG2 4.39Å
213	R	27.1	Very low	29.1	Very low	137 Å²	137	121.3 Å²	121.3	52%	0.517	66%	0.662	S	S	.	*			trans	-27.4	-170	159.7	11.5	163.7	-166.8	65	-2.7	116.7	P222 V223	R213-P222 CarbonylContact C-O 3.59Å; R213-P222 WeakPolarHBondContact CB-O 3.23Å; R213-P222 WeakPolarHBondContact CD-O 3.43Å; R213-P222 WeakPolarHBondContact CG-O 3.47Å; R213-P222 PolarHBondContact NH1-O 2.97Å; R213-V223 CarbonylContact C-O 3.58Å; R213-V223 WeakPolarHBondContact O-CB 3.45Å; R213-V223 WeakPolarHBondContact O-CG1 3.29Å; R213-V223 VanDerWaalsContact O-O 3.09Å
214	T	28.1	Very low	29.2	Very low	59 Å²	59	123.4 Å²	123.4	36%	0.362	66%	0.662	S	S	.	*			cis	-86.2	-130.4	21.9	-41	0	0	0	0	115.4	L220 S221 V223	T214-L220 WeakPolarHBondContact CG2-O 3.49Å; T214-S221 VanDerWaalsContact CA-O 3.23Å; T214-S221 WeakPolarHBondContact CA-O 3.33Å; T214-S221 WeakPolarHBondContact CG2-O 3.37Å; T214-V223 PolarHBondContact N-O 3.07Å; T214-V223 VanDerWaalsContact N-O 3.13Å; T214-V223 WeakPolarHBondContact OG1-CA 3.44Å; T214-V223 PolarHBondContact OG1-N 2.99Å; T214-V223 PolarHBondContact OG1-O 3.03Å
215	V	26.8	Very low	29.3	Very low	107 Å²	107	116.1 Å²	116.1	65%	0.648	66%	0.655	S	S	*	*			cis	-145.9	123.6	15.6	-175.3	0	0	0	0	113.3	L220	V215-L220 WeakPolarHBondContact O-CD1 3.44Å
216	S	28.8	Very low	29.9	Very low	63 Å²	63	118.5 Å²	118.5	44%	0.441	66%	0.658	S	S	.	*	B	Isolated β-bridge	trans	153.9	153.2	139.7	-67.8	0	0	0	0	115.4	T218 S219 L220	S216-T218 VanDerWaalsContact C-CA 3.45Å; S216-T218 CarbonylContact O-C 3.38Å; S216-S219 PolarHBondContact O-N 3.24Å; S216-L220 PolarHBondContact O-N 2.77Å
217	E	36.8	Very low	30.9	Very low	195 Å²	195	119.4 Å²	119.4	91%	0.911	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	-53.3	177.8	-62.8	179.1	115.1	0	0	119.3	S219	E217-S219 PolarHBondContact O-N 2.87Å; E217-S219 VanDerWaalsContact O-N 3.09Å
218	T	51	Low	30.4	Very low	115 Å²	115	118 Å²	118	71%	0.706	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn		77.1	-9.9	54.7	56.6	0	0	0	0	110.6	S216	S216-T218 VanDerWaalsContact C-CA 3.45Å; S216-T218 CarbonylContact O-C 3.38Å
219	S	27.1	Very low	29.8	Very low	104 Å²	104	116.5 Å²	116.5	73%	0.727	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	104.4	-2.7	158.6	52.1	0	0	0	0	114.8	S216 E217	S216-S219 PolarHBondContact O-N 3.24Å; E217-S219 PolarHBondContact O-N 2.87Å; E217-S219 VanDerWaalsContact O-N 3.09Å
220	L	23.4	Very low	29.4	Very low	103 Å²	103	117.5 Å²	117.5	54%	0.539	66%	0.661	S	S	.	*	B	Isolated β-bridge	trans	-131.8	107.5	-152.4	-65.6	176.2	0	0	0	116.4	T214 V215 S216	T214-L220 WeakPolarHBondContact CG2-O 3.49Å; V215-L220 WeakPolarHBondContact O-CD1 3.44Å; S216-L220 PolarHBondContact O-N 2.77Å
221	S	22.3	Very low	29.5	Very low	89 Å²	89	115.7 Å²	115.7	62%	0.622	66%	0.662	S	S	*	*			trans	3	145.8	139.2	-66.5	0	0	0	0	121.2	T214	T214-S221 VanDerWaalsContact CA-O 3.23Å; T214-S221 WeakPolarHBondContact CA-O 3.33Å; T214-S221 WeakPolarHBondContact CG2-O 3.37Å
222	P	33.4	Very low	29.3	Very low	73 Å²	73	111.3 Å²	111.3	47%	0.474	66%	0.657	S	S	.	*			trans	-96	167.8	-138.4	34.9	-37.9	0	0	0	120.7	R213	R213-P222 CarbonylContact C-O 3.59Å; R213-P222 WeakPolarHBondContact CB-O 3.23Å; R213-P222 WeakPolarHBondContact CD-O 3.43Å; R213-P222 WeakPolarHBondContact CG-O 3.47Å; R213-P222 PolarHBondContact NH1-O 2.97Å
223	V	25.3	Very low	29.3	Very low	28 Å²	28	107.9 Å²	107.9	17%	0.17	66%	0.664	C	S	.	*			trans	131.6	121.7	166.4	159.4	0	0	0	0	117	R212 R213 T214	R212-V223 HydrophobicContact CB-CB 4.13Å; R212-V223 HydrophobicContact CB-CG1 3.72Å; R212-V223 HydrophobicContact CB-CG2 4Å; R212-V223 HydrophobicContact CG-CG2 4.39Å; R213-V223 CarbonylContact C-O 3.58Å; R213-V223 WeakPolarHBondContact O-CB 3.45Å; R213-V223 WeakPolarHBondContact O-CG1 3.29Å; R213-V223 VanDerWaalsContact O-O 3.09Å; T214-V223 PolarHBondContact N-O 3.07Å; T214-V223 VanDerWaalsContact N-O 3.13Å; T214-V223 WeakPolarHBondContact OG1-CA 3.44Å; T214-V223 PolarHBondContact OG1-N 2.99Å; T214-V223 PolarHBondContact OG1-O 3.03Å
224	N	26	Very low	29.4	Very low	121 Å²	121	110.6 Å²	110.6	65%	0.647	68%	0.682	S	S	*	*				17.6	160.8	128.7	-17.7	-9.9	0	0	0	121.1
225	A	27.1	Very low	29.5	Very low	92 Å²	92	115.4 Å²	115.4	76%	0.76	70%	0.701	S	S	*	*			cis	-152.4	151.3	10.3	0	0	0	0	0	114.9
226	L	36.3	Very low	29.7	Very low	162 Å²	162	114.7 Å²	114.7	85%	0.848	70%	0.698	S	S	*	*			trans	-39.1	155.1	145.9	-72.2	148.7	0	0	0	113
227	P	45.6	Very low	29.8	Very low	123 Å²	123	113.5 Å²	113.5	80%	0.799	70%	0.696	S	S	*	*			cis	-131.8	-174.8	45.4	42.2	-25.3	0	0	0	113.5
228	A	23.9	Very low	29.9	Very low	92 Å²	92	109.3 Å²	109.3	76%	0.76	69%	0.686	S	S	*	*			cis	-160.1	172.7	22.8	0	0	0	0	0	109.5
229	A	24.2	Very low	29	Very low	78 Å²	78	108.6 Å²	108.6	65%	0.645	68%	0.678	S	S	*	*			cis	-161.2	169.7	-7.6	0	0	0	0	0	108.4
230	T	24.2	Very low	29.3	Very low	133 Å²	133	107.4 Å²	107.4	82%	0.816	67%	0.666	S	S	*	*			trans	58.4	129.4	161.2	37.4	0	0	0	0	118.2
231	Q	27.9	Very low	29.8	Very low	192 Å²	192	109.5 Å²	109.5	90%	0.897	68%	0.675	S	S	*	*			cis	-132	161	-3.5	-78.8	162.4	-21.6	0	0	108.1
232	G	24.3	Very low	30.4	Very low	75 Å²	75	111 Å²	111	77%	0.773	67%	0.667	S	S	*	*			trans	-117.7	172.5	-170	0	0	0	0	0	115.6
233	S	25.6	Very low	30.4	Very low	125 Å²	125	114.6 Å²	114.6	87%	0.874	67%	0.672	S	S	*	*			trans	-127.7	120.9	153.2	-73	0	0	0	0	107
234	E	29.5	Very low	31.3	Very low	194 Å²	194	115.1 Å²	115.1	91%	0.907	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-80.5	133.9	179	-62.5	179.8	130.9	0	0	110.3
235	E	30.4	Very low	32.2	Very low	160 Å²	160	112.4 Å²	112.4	75%	0.748	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-82.5	131.1	159.9	-70.7	-130.4	120.8	0	0	108.8	R270	E235-R270 IonicContact OE1-NH2 3.83Å
236	P	30.6	Very low	33.2	Very low	91 Å²	91	116.5 Å²	116.5	59%	0.591	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-71.5	135.1	-178.7	28.9	-34.1	0	0	0	111.2	T240	P236-T240 HydrophobicContact CB-CG2 4.09Å
237	G	31.5	Very low	34.1	Very low	39 Å²	39	116.1 Å²	116.1	40%	0.402	65%	0.652	S	S	.	*	P	Polyproline II helix	trans	-63.7	161.3	176.9	0	0	0	0	0	113.4	D239 T240	G237-D239 VanDerWaalsContact C-N 3.26Å; G237-D239 PolarHBondContact O-N 3.26Å; G237-D239 VanDerWaalsContact O-N 3.16Å; G237-T240 VanDerWaalsContact O-CB 3.32Å; G237-T240 WeakPolarHBondContact O-CB 3.46Å; G237-T240 PolarHBondContact O-N 3.47Å; G237-T240 PolarHBondContact O-OG1 3.4Å
238	P	38.2	Very low	35	Very low	107 Å²	107	110.9 Å²	110.9	70%	0.695	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-58.9	-33.2	-171.1	22.5	-33.7	0	0	0	113.9	T240 M241	P238-T240 PolarHBondContact O-N 3.31Å; P238-M241 WeakPolarHBondContact O-CB 3.32Å; P238-M241 PolarHBondContact O-N 2.74Å; P238-M241 VanDerWaalsContact O-N 3.16Å
239	D	33.3	Very low	37.6	Very low	100 Å²	100	106.9 Å²	106.9	54%	0.535	59%	0.585	S	S	.	*	G	3₁₀ helix	trans	-68.5	-21.7	-179.1	-54.9	-66.2	0	0	0	113.2	G237 M241 R242	G237-D239 VanDerWaalsContact C-N 3.26Å; G237-D239 PolarHBondContact O-N 3.26Å; G237-D239 VanDerWaalsContact O-N 3.16Å; D239-M241 PolarHBondContact O-N 2.86Å; D239-R242 PolarHBondContact O-N 3.37Å; D239-R242 IonicContact OD1-CZ 3Å; D239-R242 IonicContact OD1-NH1 2.74Å; D239-R242 PolarHBondContact OD1-NH1 3.42Å; D239-R242 IonicContact OD1-NH2 2.69Å
240	T	32.7	Very low	40.4	Very low	79 Å²	79	104.3 Å²	104.3	49%	0.485	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-64.2	-22.8	173.9	-49.6	0	0	0	0	112.5	P236 G237 P238 R242	P236-T240 HydrophobicContact CB-CG2 4.09Å; G237-T240 VanDerWaalsContact O-CB 3.32Å; G237-T240 WeakPolarHBondContact O-CB 3.46Å; G237-T240 PolarHBondContact O-N 3.47Å; G237-T240 PolarHBondContact O-OG1 3.4Å; P238-T240 PolarHBondContact O-N 3.31Å; T240-R242 VanDerWaalsContact C-N 3.29Å; T240-R242 PolarHBondContact O-N 3.42Å
241	M	32.6	Very low	43.2	Very low	146 Å²	146	98 Å²	98	72%	0.719	52%	0.521	S	S	*	.	H	α-helix	trans	-61.7	-33.8	176.4	-77.1	-162	172.9	0	0	113.1	P238 D239 Y243 S244	P238-M241 WeakPolarHBondContact O-CB 3.32Å; P238-M241 PolarHBondContact O-N 2.74Å; P238-M241 VanDerWaalsContact O-N 3.16Å; D239-M241 PolarHBondContact O-N 2.86Å; M241-Y243 VanDerWaalsContact C-N 3.26Å; M241-Y243 PolarHBondContact O-N 3.15Å; M241-S244 PolarHBondContact O-N 2.82Å
242	R	35.3	Very low	45.7	Very low	121 Å²	121	91 Å²	91	46%	0.457	49%	0.489	S	S	.	.	H	α-helix	trans	-62.9	-29.4	-172.9	-64	-164.1	-174.4	86.5	6.3	113.5	D239 T240	D239-R242 PolarHBondContact O-N 3.37Å; D239-R242 IonicContact OD1-CZ 3Å; D239-R242 IonicContact OD1-NH1 2.74Å; D239-R242 PolarHBondContact OD1-NH1 3.42Å; D239-R242 IonicContact OD1-NH2 2.69Å; T240-R242 VanDerWaalsContact C-N 3.29Å; T240-R242 PolarHBondContact O-N 3.42Å
243	Y	34.1	Very low	48.3	Very low	149 Å²	149	88.7 Å²	88.7	58%	0.584	46%	0.459	S	S	*	.	H	α-helix	trans	-97	-21.1	179.1	-71.7	-83	0	0	0	114.3	M241 H247	M241-Y243 VanDerWaalsContact C-N 3.26Å; M241-Y243 PolarHBondContact O-N 3.15Å; Y243-H247 PolarHBondContact O-ND1 3.48Å
244	S	44.9	Very low	50.6	Low	38 Å²	38	86.3 Å²	86.3	27%	0.266	44%	0.436	S	S	.	.	H	α-helix	trans	-77.3	-34.3	-169	-163.6	0	0	0	0	113.8	M241 Y246 H247 S248	M241-S244 PolarHBondContact O-N 2.82Å; S244-Y246 PolarHBondContact O-N 2.91Å; S244-H247 PolarHBondContact O-N 3.04Å; S244-H247 VanDerWaalsContact O-N 3.13Å; S244-S248 PolarHBondContact O-N 2.86Å; S244-S248 PolarHBondContact O-OG 2.86Å; S244-S248 PolarHBondContact OG-OG 2.89Å
245	L	44	Very low	52.7	Low	65 Å²	65	80.8 Å²	80.8	34%	0.34	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-29.5	-177.6	-68.2	173.2	0	0	0	114	H250 V265 V267	L245-H250 PolarHBondContact O-CE1 3.39Å; L245-H250 PolarHBondContact O-ND1 2.88Å; L245-V265 HydrophobicContact CD2-CB 4.34Å; L245-V265 HydrophobicContact CD2-CG1 3.84Å; L245-V267 HydrophobicContact CD2-CG2 3.68Å
246	Y	48.9	Very low	54.8	Low	178 Å²	178	74.8 Å²	74.8	70%	0.698	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-5.6	-178.1	-62.4	-77.8	0	0	0	114.1	S244 P358	S244-Y246 PolarHBondContact O-N 2.91Å; Y246-P358 WeakPolarHBondContact O-CB 3.43Å
247	H	53.5	Low	56.9	Low	153 Å²	153	76 Å²	76	71%	0.708	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.6	-7	-175.8	-66.8	97	0	0	0	114.3	Y243 S244	Y243-H247 PolarHBondContact O-ND1 3.48Å; S244-H247 PolarHBondContact O-N 3.04Å; S244-H247 VanDerWaalsContact O-N 3.13Å
248	S	64.7	Low	58.8	Low	13 Å²	13	75.2 Å²	75.2	9%	0.091	37%	0.374	C	S	.	.	S	Bend	trans	-121.9	142.5	-179.5	61	0	0	0	0	112.3	S244 H250 V267 P358	S244-S248 PolarHBondContact O-N 2.86Å; S244-S248 PolarHBondContact O-OG 2.86Å; S244-S248 PolarHBondContact OG-OG 2.89Å; S248-H250 PolarHBondContact O-ND1 2.79Å; S248-V267 WeakPolarHBondContact OG-CG1 3.26Å; S248-P358 VanDerWaalsContact O-CD 3.28Å; S248-P358 WeakPolarHBondContact O-CD 3.36Å; S248-P358 WeakPolarHBondContact O-CG 3.28Å
249	P	79.4	Confident	59.8	Low	8 Å²	8	79.9 Å²	79.9	5%	0.052	39%	0.386	C	S	.	.			trans	-64.2	145.1	177.1	26.4	-33.7	0	0	0	110.8	L268 L315 F355 K356 D357	P249-L268 HydrophobicContact CG-CB 4.4Å; P249-L268 WeakPolarHBondContact O-CA 3.2Å; P249-L268 WeakPolarHBondContact O-CB 3.35Å; P249-L268 PolarHBondContact O-N 2.88Å; P249-L315 HydrophobicContact CB-CD1 3.84Å; P249-L315 HydrophobicContact CG-CD1 3.74Å; P249-F355 HydrophobicContact CB-CE2 3.88Å; P249-F355 HydrophobicContact CB-CZ 4.21Å; P249-K356 CarbonylContact C-O 3.56Å; P249-K356 VanDerWaalsContact CA-O 3.3Å; P249-K356 WeakPolarHBondContact CA-O 3.45Å; P249-D357 HydrophobicContact CB-CB 4.27Å
250	H	82	Confident	60.8	Low	24 Å²	24	83.3 Å²	83.3	11%	0.111	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	159.3	-172.5	55.4	-96.2	0	0	0	112.6	L245 S248 V265 Y266 K356	L245-H250 PolarHBondContact O-CE1 3.39Å; L245-H250 PolarHBondContact O-ND1 2.88Å; S248-H250 PolarHBondContact O-ND1 2.79Å; H250-V265 HydrophobicContact CB-CG1 3.7Å; H250-Y266 CarbonylContact C-O 3.45Å; H250-Y266 VanDerWaalsContact CA-O 3.26Å; H250-Y266 WeakPolarHBondContact CA-O 3.46Å; H250-Y266 WeakPolarHBondContact CB-O 3.29Å; H250-K356 PolarHBondContact N-O 3.45Å; H250-K356 PolarHBondContact O-N 2.88Å
251	L	84.4	Confident	62.3	Low	1 Å²	1	85.6 Å²	85.6	1%	0.005	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	122.4	169.4	-56.8	173.4	0	0	0	108.5	V265 Y266 L268 I286 I300 L345 L353 F355	L251-V265 CarbonylContact O-C 3.53Å; L251-V265 WeakPolarHBondContact O-CA 3.36Å; L251-Y266 PolarHBondContact N-O 3.28Å; L251-Y266 PolarHBondContact O-N 3.28Å; L251-L268 HydrophobicContact CD2-CD1 4.34Å; L251-L268 HydrophobicContact CG-CD1 4.1Å; L251-I286 HydrophobicContact CD1-CD1 4.37Å; L251-I300 HydrophobicContact CD1-CD1 3.99Å; L251-L345 HydrophobicContact CD2-CD1 4.19Å; L251-L345 HydrophobicContact CD2-CD2 4.02Å; L251-L353 HydrophobicContact CB-CB 4.38Å; L251-L353 HydrophobicContact CB-CD2 4Å; L251-F355 HydrophobicContact CD2-CB 3.8Å; L251-F355 HydrophobicContact CD2-CD2 3.95Å; L251-F355 HydrophobicContact CD2-CG 4.32Å
252	L	79.4	Confident	64.4	Low	45 Å²	45	79.8 Å²	79.8	24%	0.236	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124.7	174	175.1	72.6	0	0	0	109.3	L254 V265 L353 L354	L252-L254 HydrophobicContact CD2-CD2 4.17Å; L252-L254 HydrophobicContact CG-CD2 4.37Å; L252-L254 PolarHBondContact O-N 2.79Å; L252-V265 HydrophobicContact CD1-CG2 3.94Å; L252-L353 CarbonylContact O-C 3.48Å; L252-L353 WeakPolarHBondContact O-CA 3.42Å; L252-L354 HydrophobicContact CB-CB 4.36Å; L252-L354 HydrophobicContact CD2-CD2 4.35Å; L252-L354 PolarHBondContact N-O 3.2Å; L252-L354 PolarHBondContact O-N 2.72Å
253	L	79.1	Confident	66.2	Low	26 Å²	26	76.8 Å²	76.8	14%	0.136	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	127.6	175.3	-166.2	70	0	0	0	110.3	Q255 D262 L264 Y351 L353	L253-Q255 WeakPolarHBondContact CD1-O 3.47Å; L253-D262 HydrophobicContact CD2-CB 3.91Å; L253-L264 PolarHBondContact N-O 3.03Å; L253-Y351 HydrophobicContact CD1-CD1 3.86Å; L253-Y351 HydrophobicContact CD1-CE1 4.41Å; L253-L353 HydrophobicContact CB-CD2 4.33Å; L253-L353 HydrophobicContact CD1-CD2 3.82Å; L253-L353 HydrophobicContact CD1-CG 4.33Å
254	L	74.2	Confident	67.9	Low	75 Å²	75	73.6 Å²	73.6	39%	0.393	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	-32.7	171.9	-56.9	-175.7	0	0	0	111.8	L252 L344 L352 L354 L372	L252-L254 HydrophobicContact CD2-CD2 4.17Å; L252-L254 HydrophobicContact CG-CD2 4.37Å; L252-L254 PolarHBondContact O-N 2.79Å; L254-L344 HydrophobicContact CD1-CD2 3.52Å; L254-L352 HydrophobicContact CB-CB 4.41Å; L254-L352 HydrophobicContact CB-CD2 4.32Å; L254-L352 HydrophobicContact CB-CG 4.33Å; L254-L352 WeakPolarHBondContact CB-O 3.3Å; L254-L352 HydrophobicContact CD1-CD2 4.18Å; L254-L352 HydrophobicContact CD1-CG 4.3Å; L254-L352 PolarHBondContact N-O 2.85Å; L254-L354 HydrophobicContact CD1-CB 3.99Å; L254-L354 HydrophobicContact CD2-CB 4.34Å; L254-L354 HydrophobicContact CG-CB 4.14Å; L254-L372 HydrophobicContact CD1-CD2 3.51Å
255	Q	74.2	Confident	69.4	Low	79 Å²	79	74.1 Å²	74.1	37%	0.369	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	139.9	174.6	-167.1	-168.5	-48.1	0	0	107.5	L253 Y350 Y351 L352	L253-Q255 WeakPolarHBondContact CD1-O 3.47Å; Q255-Y350 CarbonylContact C-O 3.35Å; Q255-Y350 WeakPolarHBondContact CG-O 3.47Å; Q255-Y350 PolarHBondContact NE2-O 3.03Å; Q255-Y350 VanDerWaalsContact NE2-O 3.11Å; Q255-Y351 WeakPolarHBondContact O-CA 3.34Å; Q255-L352 HydrophobicContact CB-CB 3.76Å; Q255-L352 PolarHBondContact N-O 2.99Å; Q255-L352 VanDerWaalsContact N-O 3.13Å; Q255-L352 PolarHBondContact O-N 3.13Å
256	G	74.8	Confident	71.2	Confident	34 Å²	34	71.9 Å²	71.9	35%	0.351	36%	0.355	S	S	.	.			trans	-144.5	-172.4	177.9	0	0	0	0	0	111.5
257	Y	74.3	Confident	72.6	Confident	115 Å²	115	65.2 Å²	65.2	45%	0.451	33%	0.333	S	S	.	.	S	Bend	trans	-114.2	-47.2	-172.9	178.9	-101.3	0	0	0	113.1	D262 A290 Y350	Y257-D262 PolarHBondContact N-OD2 3.46Å; Y257-A290 VanDerWaalsContact CD1-CA 3.49Å; Y257-A290 HydrophobicContact CD1-CB 3.9Å; Y257-A290 HydrophobicContact CD2-CB 3.82Å; Y257-A290 HydrophobicContact CE1-CB 4.47Å; Y257-A290 HydrophobicContact CE2-CB 4.4Å; Y257-A290 HydrophobicContact CG-CB 3.54Å; Y257-Y350 AromaticContact CD2-CD1 3.67Å; Y257-Y350 HydrophobicContact CD2-CD1 3.67Å; Y257-Y350 HydrophobicContact CD2-CD2 4.16Å; Y257-Y350 HydrophobicContact CD2-CE1 4.04Å; Y257-Y350 HydrophobicContact CD2-CE2 4.49Å; Y257-Y350 AromaticContact CD2-CG 3.73Å; Y257-Y350 HydrophobicContact CD2-CG 3.73Å; Y257-Y350 HydrophobicContact CE2-CD1 4.28Å; Y257-Y350 HydrophobicContact CE2-CE1 4.17Å; Y257-Y350 HydrophobicContact CE2-CG 4.49Å
258	S	71.9	Confident	74	Confident	24 Å²	24	58 Å²	58	17%	0.168	30%	0.299	C	S	.	.			trans	-120.4	108.5	-177.6	-179.6	0	0	0	0	111.5	Q260 H261 D262 S289	S258-Q260 PolarHBondContact O-N 3.2Å; S258-Q260 PolarHBondContact OG-N 3.45Å; S258-H261 PolarHBondContact O-N 3.04Å; S258-H261 VanDerWaalsContact O-N 3.07Å; S258-D262 PolarHBondContact N-OD2 2.9Å; S258-D262 VanDerWaalsContact O-CB 3.27Å; S258-D262 WeakPolarHBondContact O-CB 3.35Å; S258-D262 PolarHBondContact O-N 2.96Å; S258-S289 WeakPolarHBondContact CB-OG 3.3Å
259	Q	59.1	Low	74.5	Confident	204 Å²	204	61.7 Å²	61.7	95%	0.953	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-17.6	174.9	-62.2	-178.3	-2.5	0	0	113.4
260	Q	54.1	Low	74.3	Confident	172 Å²	172	67.6 Å²	67.6	80%	0.804	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-16.9	178.1	-66	-176.1	-12.1	0	0	114	S258	S258-Q260 PolarHBondContact O-N 3.2Å; S258-Q260 PolarHBondContact OG-N 3.45Å
261	H	62.9	Low	73.9	Confident	127 Å²	127	72 Å²	72	59%	0.588	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.5	-25.5	-172	-62.3	-16	0	0	0	113.6	S258	S258-H261 PolarHBondContact O-N 3.04Å; S258-H261 VanDerWaalsContact O-N 3.07Å
262	D	76.9	Confident	73.9	Confident	24 Å²	24	79.3 Å²	79.3	13%	0.128	39%	0.391	C	S	.	.			trans	-80.2	138.8	-177	-59.3	-19	0	0	0	110.8	L253 Y257 S258 S289 Y351	L253-D262 HydrophobicContact CD2-CB 3.91Å; Y257-D262 PolarHBondContact N-OD2 3.46Å; S258-D262 PolarHBondContact N-OD2 2.9Å; S258-D262 VanDerWaalsContact O-CB 3.27Å; S258-D262 WeakPolarHBondContact O-CB 3.35Å; S258-D262 PolarHBondContact O-N 2.96Å; D262-S289 PolarHBondContact OD1-OG 2.84Å; D262-Y351 HydrophobicContact CB-CE1 4.33Å; D262-Y351 VanDerWaalsContact CG-CE1 3.43Å; D262-Y351 VanDerWaalsContact CG-OH 3.25Å; D262-Y351 WeakPolarHBondContact OD1-CE1 3.3Å; D262-Y351 PolarHBondContact OD1-OH 3.3Å; D262-Y351 WeakPolarHBondContact OD2-CE1 3.45Å; D262-Y351 PolarHBondContact OD2-OH 3.09Å
263	S	72.6	Confident	74.1	Confident	59 Å²	59	77.4 Å²	77.4	41%	0.413	38%	0.381	S	S	.	.			trans	-102.4	133	179.9	-62.5	0	0	0	0	110	V265 Y266	S263-V265 PolarHBondContact O-N 2.89Å; S263-V265 VanDerWaalsContact O-N 3.15Å; S263-Y266 PolarHBondContact N-OH 3.44Å; S263-Y266 WeakPolarHBondContact O-CE2 3.36Å
264	L	70.8	Confident	74.5	Confident	81 Å²	81	77.8 Å²	77.8	42%	0.424	38%	0.384	S	S	.	.	S	Bend	trans	-60	-27	179.4	-70.2	173.9	0	0	0	113.1	W147 L253	W147-L264 HydrophobicContact CB-CD1 4.32Å; L253-L264 PolarHBondContact N-O 3.03Å
265	V	75.8	Confident	75.2	Confident	49 Å²	49	74.3 Å²	74.3	30%	0.297	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	131.4	175.2	-172.2	0	0	0	0	110.9	L245 H250 L251 L252 S263 V267	L245-V265 HydrophobicContact CD2-CB 4.34Å; L245-V265 HydrophobicContact CD2-CG1 3.84Å; H250-V265 HydrophobicContact CB-CG1 3.7Å; L251-V265 CarbonylContact O-C 3.53Å; L251-V265 WeakPolarHBondContact O-CA 3.36Å; L252-V265 HydrophobicContact CD1-CG2 3.94Å; S263-V265 PolarHBondContact O-N 2.89Å; S263-V265 VanDerWaalsContact O-N 3.15Å; V265-V267 HydrophobicContact CG1-CG2 4.49Å
266	Y	81.4	Confident	75.8	Confident	18 Å²	18	70.5 Å²	70.5	7%	0.071	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	118.9	172	-57.4	-86.7	0	0	0	110	H250 L251 S263 I286 L288 L353	H250-Y266 CarbonylContact C-O 3.45Å; H250-Y266 VanDerWaalsContact CA-O 3.26Å; H250-Y266 WeakPolarHBondContact CA-O 3.46Å; H250-Y266 WeakPolarHBondContact CB-O 3.29Å; L251-Y266 PolarHBondContact N-O 3.28Å; L251-Y266 PolarHBondContact O-N 3.28Å; S263-Y266 PolarHBondContact N-OH 3.44Å; S263-Y266 WeakPolarHBondContact O-CE2 3.36Å; Y266-I286 HydrophobicContact CD1-CB 4.38Å; Y266-I286 HydrophobicContact CD1-CG1 4.14Å; Y266-I286 HydrophobicContact CD1-CG2 3.63Å; Y266-I286 HydrophobicContact CE1-CG2 3.76Å; Y266-I286 HydrophobicContact CG-CD1 4.41Å; Y266-I286 HydrophobicContact CG-CG1 4.46Å; Y266-I286 HydrophobicContact CG-CG2 4.07Å; Y266-L288 HydrophobicContact CE1-CD2 4.33Å; Y266-L288 HydrophobicContact CE2-CD2 4.28Å; Y266-L288 VanDerWaalsContact OH-CD2 3.28Å; Y266-L288 WeakPolarHBondContact OH-CD2 3.13Å; Y266-L353 HydrophobicContact CD2-CD2 3.92Å; Y266-L353 HydrophobicContact CE2-CD2 4Å
267	V	80.1	Confident	76.3	Confident	39 Å²	39	72.1 Å²	72.1	24%	0.236	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	126.1	-172	-178.3	0	0	0	0	111.9	L245 S248 V265 N269 H273	L245-V267 HydrophobicContact CD2-CG2 3.68Å; S248-V267 WeakPolarHBondContact OG-CG1 3.26Å; V265-V267 HydrophobicContact CG1-CG2 4.49Å; V267-N269 HydrophobicContact CG1-CB 4.02Å; V267-N269 PolarHBondContact O-N 3.41Å; V267-H273 PolarHBondContact O-CE1 2.86Å; V267-H273 VanDerWaalsContact O-CE1 3.32Å
268	L	81.4	Confident	76.7	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	36%	0.358	C	S	.	.			trans	-94.2	59.5	-177.9	-59.2	175.6	0	0	0	111.8	P249 L251 H273 I286 I300 L315 F355	P249-L268 HydrophobicContact CG-CB 4.4Å; P249-L268 WeakPolarHBondContact O-CA 3.2Å; P249-L268 WeakPolarHBondContact O-CB 3.35Å; P249-L268 PolarHBondContact O-N 2.88Å; L251-L268 HydrophobicContact CD2-CD1 4.34Å; L251-L268 HydrophobicContact CG-CD1 4.1Å; L268-H273 VanDerWaalsContact CA-NE2 3.35Å; L268-H273 WeakPolarHBondContact CA-NE2 3.38Å; L268-H273 HydrophobicContact CD2-CB 4.2Å; L268-I286 HydrophobicContact CD2-CD1 4.05Å; L268-I300 HydrophobicContact CD1-CG2 4.33Å; L268-I300 HydrophobicContact CD2-CD1 4.3Å; L268-L315 HydrophobicContact CB-CD1 4.39Å; L268-L315 HydrophobicContact CD1-CD1 4.12Å; L268-F355 HydrophobicContact CD1-CD2 4.08Å; L268-F355 HydrophobicContact CD1-CE2 3.93Å
269	N	75.2	Confident	76.9	Confident	91 Å²	91	75.6 Å²	75.6	49%	0.487	36%	0.359	S	S	.	.			trans	-87.5	-22.5	-176.6	60.2	0.1	0	0	0	115.5	V267 H273	V267-N269 HydrophobicContact CG1-CB 4.02Å; V267-N269 PolarHBondContact O-N 3.41Å; N269-H273 PolarHBondContact N-NE2 2.86Å
270	R	75.8	Confident	77.4	Confident	133 Å²	133	72.3 Å²	72.3	50%	0.502	36%	0.355	S	S	.	.	S	Bend	trans	-85.8	155.4	174.2	-56.8	173.9	-180	-177.1	-3	112.3	E235 R272 H273	E235-R270 IonicContact OE1-NH2 3.83Å; R270-R272 PolarHBondContact O-N 3.48Å; R270-H273 PolarHBondContact N-NE2 2.98Å; R270-H273 PolarHBondContact O-CD2 3Å; R270-H273 PolarHBondContact O-NE2 3.4Å
271	D	74.6	Confident	77.8	Confident	117 Å²	117	69.9 Å²	69.9	63%	0.626	36%	0.358	S	S	*	.	S	Bend	trans	-67.2	-22.3	176.4	-64.4	-50.5	0	0	0	114.1	R301 R302	D271-R301 CarbonylContact O-C 3.51Å; D271-R301 VanDerWaalsContact O-CA 3.31Å; D271-R301 WeakPolarHBondContact O-CA 3.35Å; D271-R302 PolarHBondContact O-N 2.89Å
272	R	82.6	Confident	78.2	Confident	153 Å²	153	64.9 Å²	64.9	58%	0.577	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.6	129.9	171.2	179.3	169.1	67.6	177.5	1.3	110.6	R270 T299 I300 R301	R270-R272 PolarHBondContact O-N 3.48Å; R272-T299 HydrophobicContact CG-CG2 4.42Å; R272-I300 CarbonylContact C-O 3.38Å; R272-I300 WeakPolarHBondContact CA-O 3.07Å; R272-R301 HydrophobicContact CB-CG 4.27Å; R272-R301 HydrophobicContact CG-CG 3.96Å
273	H	85.4	Confident	78.2	Confident	5 Å²	5	71.8 Å²	71.8	2%	0.023	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.8	169	-64.3	-94.8	0	0	0	109.7	V267 L268 N269 R270 S285 T299 I300	V267-H273 PolarHBondContact O-CE1 2.86Å; V267-H273 VanDerWaalsContact O-CE1 3.32Å; L268-H273 VanDerWaalsContact CA-NE2 3.35Å; L268-H273 WeakPolarHBondContact CA-NE2 3.38Å; L268-H273 HydrophobicContact CD2-CB 4.2Å; N269-H273 PolarHBondContact N-NE2 2.86Å; R270-H273 PolarHBondContact N-NE2 2.98Å; R270-H273 PolarHBondContact O-CD2 3Å; R270-H273 PolarHBondContact O-NE2 3.4Å; H273-S285 VanDerWaalsContact CA-OG 3.27Å; H273-S285 WeakPolarHBondContact CA-OG 3.34Å; H273-S285 WeakPolarHBondContact CB-OG 3.39Å; H273-T299 CarbonylContact O-C 3.55Å; H273-T299 VanDerWaalsContact O-CA 3.32Å; H273-T299 WeakPolarHBondContact O-CA 3.43Å; H273-I300 HydrophobicContact CB-CB 4.48Å; H273-I300 PolarHBondContact N-O 3.06Å; H273-I300 PolarHBondContact O-N 2.64Å
274	T	87.2	Confident	78.7	Confident	35 Å²	35	69.4 Å²	69.4	22%	0.215	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	129.6	170.2	41.5	0	0	0	0	108.3	P284 S285 I286 L296 T299	T274-P284 WeakPolarHBondContact OG1-CA 3.37Å; T274-S285 PolarHBondContact N-OG 3.1Å; T274-S285 PolarHBondContact O-N 2.74Å; T274-S285 PolarHBondContact O-OG 3.44Å; T274-S285 PolarHBondContact OG1-N 3.17Å; T274-I286 PolarHBondContact O-N 3.13Å; T274-L296 HydrophobicContact CG2-CD1 3.84Å; T274-T299 HydrophobicContact CG2-CG2 3.58Å
275	V	89.2	Confident	79.3	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.006	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	135.3	174.7	-167.2	0	0	0	0	108.5	I286 L288 H297 C298 I300 L347	V275-I286 WeakPolarHBondContact CA-O 2.99Å; V275-I286 HydrophobicContact CB-CB 4.42Å; V275-I286 HydrophobicContact CG1-CB 4.19Å; V275-I286 HydrophobicContact CG1-CG2 3.86Å; V275-I286 HydrophobicContact CG2-CB 4.13Å; V275-I286 HydrophobicContact CG2-CD1 4.18Å; V275-I286 HydrophobicContact CG2-CG2 4.45Å; V275-L288 HydrophobicContact CG1-CD1 3.66Å; V275-L288 HydrophobicContact CG1-CG 4.06Å; V275-H297 PolarHBondContact O-N 3.06Å; V275-C298 VanDerWaalsContact CG2-SG 3.57Å; V275-C298 PolarHBondContact N-O 2.88Å; V275-C298 PolarHBondContact O-N 3.32Å; V275-I300 HydrophobicContact CG2-CD1 4.35Å; V275-L347 HydrophobicContact CG1-CD1 3.82Å
276	G	86.9	Confident	79.7	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.9	-174.6	177.7	0	0	0	0	0	113	P284 I286 S287 L288 L294	G276-P284 WeakPolarHBondContact O-CG 3.46Å; G276-I286 PolarHBondContact N-O 3.37Å; G276-I286 VanDerWaalsContact N-O 3.13Å; G276-S287 WeakPolarHBondContact O-CA 3.07Å; G276-L288 PolarHBondContact O-N 3.08Å; G276-L294 CarbonylContact C-O 3.59Å; G276-L294 WeakPolarHBondContact CA-O 3.13Å
277	Q	85.2	Confident	79.9	Confident	67 Å²	67	67 Å²	67	31%	0.313	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	144.4	173.5	-159	-175.9	50.3	0	0	111.7	S282 L288 I293 L294 P295	Q277-S282 PolarHBondContact O-OG 3.23Å; Q277-S282 VanDerWaalsContact O-OG 3.12Å; Q277-L288 WeakPolarHBondContact CA-O 3.11Å; Q277-I293 WeakPolarHBondContact CB-O 3.27Å; Q277-L294 PolarHBondContact N-O 3.32Å; Q277-P295 WeakPolarHBondContact O-CA 3.34Å
278	R	81.3	Confident	80.2	Confident	180 Å²	180	65.4 Å²	65.4	68%	0.679	33%	0.333	S	S	*	.			trans	-84.6	121.5	178.4	-164.5	-174.9	-160.7	-166.8	7.9	110.2
279	T	76.1	Confident	80.2	Confident	32 Å²	32	66.7 Å²	66.7	20%	0.196	34%	0.342	C	S	.	.			trans	-129	172.6	179.7	72.9	0	0	0	0	110.6	S281 S282 P295	T279-S281 PolarHBondContact O-N 3.33Å; T279-S281 PolarHBondContact OG1-N 2.83Å; T279-S281 PolarHBondContact OG1-OG 2.95Å; T279-S282 PolarHBondContact N-O 2.84Å; T279-S282 PolarHBondContact O-N 2.81Å; T279-S282 WeakPolarHBondContact OG1-CB 3.48Å; T279-S282 PolarHBondContact OG1-N 3.13Å; T279-S282 PolarHBondContact OG1-OG 2.82Å; T279-P295 HydrophobicContact CG2-CB 3.9Å; T279-P295 HydrophobicContact CG2-CG 3.97Å
280	P	71.1	Confident	80.4	Confident	135 Å²	135	62.4 Å²	62.4	88%	0.877	32%	0.319	S	S	*	.	S	Bend	trans	-58.7	-30.7	173.7	-26.1	36.5	0	0	0	113.4
281	S	61.4	Low	80.4	Confident	122 Å²	122	58.1 Å²	58.1	85%	0.853	31%	0.309	S	S	*	.	S	Bend	trans	-97.5	-20.7	-179.3	53.5	0	0	0	0	114.4	T279	T279-S281 PolarHBondContact O-N 3.33Å; T279-S281 PolarHBondContact OG1-N 2.83Å; T279-S281 PolarHBondContact OG1-OG 2.95Å
282	S	70.8	Confident	80.5	Confident	22 Å²	22	53.1 Å²	53.1	15%	0.154	28%	0.282	C	S	.	.			trans	-121.7	125.8	178.9	70.2	0	0	0	0	113.1	Q277 T279 P284 P295	Q277-S282 PolarHBondContact O-OG 3.23Å; Q277-S282 VanDerWaalsContact O-OG 3.12Å; T279-S282 PolarHBondContact N-O 2.84Å; T279-S282 PolarHBondContact O-N 2.81Å; T279-S282 WeakPolarHBondContact OG1-CB 3.48Å; T279-S282 PolarHBondContact OG1-N 3.13Å; T279-S282 PolarHBondContact OG1-OG 2.82Å; S282-P284 WeakPolarHBondContact O-CD 3.3Å; S282-P295 PolarHBondContact OG-O 3.07Å
283	K	76.8	Confident	80.6	Confident	168 Å²	168	46 Å²	46	73%	0.73	26%	0.255	S	S	*	.			trans	-119.9	77.1	174.4	-67	176.6	-176.3	172.8	0	109.5
284	P	84.3	Confident	80.4	Confident	10 Å²	10	48.4 Å²	48.4	7%	0.065	27%	0.268	C	S	.	.			trans	-67.3	146	179.5	27.4	-32.5	0	0	0	111.4	T274 G276 S282 I286 S287	T274-P284 WeakPolarHBondContact OG1-CA 3.37Å; G276-P284 WeakPolarHBondContact O-CG 3.46Å; S282-P284 WeakPolarHBondContact O-CD 3.3Å; P284-I286 VanDerWaalsContact C-N 3.26Å; P284-I286 PolarHBondContact O-N 2.76Å; P284-S287 PolarHBondContact O-OG 2.89Å
285	S	82.1	Confident	80.2	Confident	49 Å²	49	49.5 Å²	49.5	34%	0.343	28%	0.276	S	S	.	.	S	Bend	trans	-69.4	-25.3	-178.2	64.9	0	0	0	0	113.2	H273 T274	H273-S285 VanDerWaalsContact CA-OG 3.27Å; H273-S285 WeakPolarHBondContact CA-OG 3.34Å; H273-S285 WeakPolarHBondContact CB-OG 3.39Å; T274-S285 PolarHBondContact N-OG 3.1Å; T274-S285 PolarHBondContact O-N 2.74Å; T274-S285 PolarHBondContact O-OG 3.44Å; T274-S285 PolarHBondContact OG1-N 3.17Å
286	I	85.8	Confident	80.1	Confident	7 Å²	7	53.2 Å²	53.2	4%	0.036	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	101.9	166.1	-64.5	174	0	0	0	105.9	L251 Y266 L268 T274 V275 G276 P284 L288	L251-I286 HydrophobicContact CD1-CD1 4.37Å; Y266-I286 HydrophobicContact CD1-CB 4.38Å; Y266-I286 HydrophobicContact CD1-CG1 4.14Å; Y266-I286 HydrophobicContact CD1-CG2 3.63Å; Y266-I286 HydrophobicContact CE1-CG2 3.76Å; Y266-I286 HydrophobicContact CG-CD1 4.41Å; Y266-I286 HydrophobicContact CG-CG1 4.46Å; Y266-I286 HydrophobicContact CG-CG2 4.07Å; L268-I286 HydrophobicContact CD2-CD1 4.05Å; T274-I286 PolarHBondContact O-N 3.13Å; V275-I286 WeakPolarHBondContact CA-O 2.99Å; V275-I286 HydrophobicContact CB-CB 4.42Å; V275-I286 HydrophobicContact CG1-CB 4.19Å; V275-I286 HydrophobicContact CG1-CG2 3.86Å; V275-I286 HydrophobicContact CG2-CB 4.13Å; V275-I286 HydrophobicContact CG2-CD1 4.18Å; V275-I286 HydrophobicContact CG2-CG2 4.45Å; G276-I286 PolarHBondContact N-O 3.37Å; G276-I286 VanDerWaalsContact N-O 3.13Å; P284-I286 VanDerWaalsContact C-N 3.26Å; P284-I286 PolarHBondContact O-N 2.76Å; I286-L288 HydrophobicContact CG2-CD2 4Å; I286-L288 HydrophobicContact CG2-CG 4.22Å
287	S	85.1	Confident	80	Confident	41 Å²	41	53.2 Å²	53.2	29%	0.287	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.7	174.7	-63.9	0	0	0	0	109.4	G276 P284	G276-S287 WeakPolarHBondContact O-CA 3.07Å; P284-S287 PolarHBondContact O-OG 2.89Å
288	L	87.1	Confident	80.1	Confident	6 Å²	6	50 Å²	50	3%	0.031	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	160.3	172	-56.4	-178.6	0	0	0	109.3	Y266 V275 G276 Q277 I286 I293 L347 Y351	Y266-L288 HydrophobicContact CE1-CD2 4.33Å; Y266-L288 HydrophobicContact CE2-CD2 4.28Å; Y266-L288 VanDerWaalsContact OH-CD2 3.28Å; Y266-L288 WeakPolarHBondContact OH-CD2 3.13Å; V275-L288 HydrophobicContact CG1-CD1 3.66Å; V275-L288 HydrophobicContact CG1-CG 4.06Å; G276-L288 PolarHBondContact O-N 3.08Å; Q277-L288 WeakPolarHBondContact CA-O 3.11Å; I286-L288 HydrophobicContact CG2-CD2 4Å; I286-L288 HydrophobicContact CG2-CG 4.22Å; L288-I293 HydrophobicContact CB-CG1 4.25Å; L288-I293 HydrophobicContact CB-CG2 4.16Å; L288-I293 HydrophobicContact CD1-CD1 4.41Å; L288-I293 HydrophobicContact CD1-CG1 4.46Å; L288-L347 HydrophobicContact CD1-CD1 3.89Å; L288-Y351 HydrophobicContact CB-CD2 4.47Å; L288-Y351 HydrophobicContact CB-CE1 4.37Å; L288-Y351 HydrophobicContact CB-CE2 3.78Å; L288-Y351 HydrophobicContact CD1-CD1 4.31Å; L288-Y351 HydrophobicContact CD1-CD2 4.03Å; L288-Y351 HydrophobicContact CD1-CE1 4.46Å; L288-Y351 HydrophobicContact CD1-CE2 4.17Å; L288-Y351 HydrophobicContact CD1-CG 4.1Å; L288-Y351 HydrophobicContact CD2-CD1 4.17Å; L288-Y351 HydrophobicContact CD2-CE1 3.8Å; L288-Y351 HydrophobicContact CG-CE1 4.43Å; L288-Y351 HydrophobicContact CG-CE2 4.4Å
289	S	79.6	Confident	80.5	Confident	27 Å²	27	42.3 Å²	42.3	19%	0.189	25%	0.253	C	S	.	.			trans	-117.1	-14.9	-163.6	58.8	0	0	0	0	116.1	S258 D262 Y351	S258-S289 WeakPolarHBondContact CB-OG 3.3Å; D262-S289 PolarHBondContact OD1-OG 2.84Å; S289-Y351 PolarHBondContact N-OH 2.82Å; S289-Y351 PolarHBondContact OG-OH 3.02Å
290	A	81.1	Confident	81.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.244	C	C	.	.			trans	-66.4	149.7	-178.2	0	0	0	0	0	113.9	Y257 D292 I293 Y350 Y351	Y257-A290 VanDerWaalsContact CD1-CA 3.49Å; Y257-A290 HydrophobicContact CD1-CB 3.9Å; Y257-A290 HydrophobicContact CD2-CB 3.82Å; Y257-A290 HydrophobicContact CE1-CB 4.47Å; Y257-A290 HydrophobicContact CE2-CB 4.4Å; Y257-A290 HydrophobicContact CG-CB 3.54Å; A290-D292 VanDerWaalsContact CB-OD1 3.3Å; A290-D292 WeakPolarHBondContact CB-OD1 3.36Å; A290-D292 PolarHBondContact O-N 2.76Å; A290-I293 HydrophobicContact CB-CG1 4.18Å; A290-I293 PolarHBondContact O-N 3.04Å; A290-I293 VanDerWaalsContact O-N 3.14Å; A290-Y350 HydrophobicContact CB-CD2 3.74Å; A290-Y350 HydrophobicContact CB-CG 4.17Å; A290-Y351 HydrophobicContact CB-CD2 4.23Å; A290-Y351 HydrophobicContact CB-CE2 3.54Å
291	P	73.9	Confident	81.8	Confident	44 Å²	44	39.2 Å²	39.2	29%	0.286	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-16.1	-173.9	27.7	-36.5	0	0	0	114.7	Y350	P291-Y350 HydrophobicContact CG-CE2 4.34Å
292	D	76.9	Confident	82.8	Confident	11 Å²	11	36.9 Å²	36.9	6%	0.059	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-5.4	176.2	64	-13.2	0	0	0	113.6	A290 L294 G348 L349 Y350	A290-D292 VanDerWaalsContact CB-OD1 3.3Å; A290-D292 WeakPolarHBondContact CB-OD1 3.36Å; A290-D292 PolarHBondContact O-N 2.76Å; D292-L294 PolarHBondContact O-N 2.7Å; D292-G348 WeakPolarHBondContact OD2-CA 3.16Å; D292-L349 PolarHBondContact OD2-N 3.32Å; D292-Y350 WeakPolarHBondContact OD1-CD2 3.44Å; D292-Y350 WeakPolarHBondContact OD2-CD2 3.16Å
293	I	84.9	Confident	83	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.015	21%	0.211	C	C	.	.	S	Bend	trans	-87.6	109.4	174.3	-57.1	-60.3	0	0	0	110	Q277 L288 A290 H297 L347 Y351	Q277-I293 WeakPolarHBondContact CB-O 3.27Å; L288-I293 HydrophobicContact CB-CG1 4.25Å; L288-I293 HydrophobicContact CB-CG2 4.16Å; L288-I293 HydrophobicContact CD1-CD1 4.41Å; L288-I293 HydrophobicContact CD1-CG1 4.46Å; A290-I293 HydrophobicContact CB-CG1 4.18Å; A290-I293 PolarHBondContact O-N 3.04Å; A290-I293 VanDerWaalsContact O-N 3.14Å; I293-H297 HydrophobicContact CG2-CB 3.82Å; I293-L347 HydrophobicContact CD1-CB 3.97Å; I293-Y351 HydrophobicContact CD1-CD2 4.02Å; I293-Y351 HydrophobicContact CD1-CE2 4.47Å; I293-Y351 HydrophobicContact CG1-CD2 3.91Å; I293-Y351 HydrophobicContact CG1-CE2 3.86Å
294	L	82.1	Confident	82.2	Confident	57 Å²	57	38 Å²	38	30%	0.298	21%	0.206	S	C	.	.			trans	-56	151.1	173.8	-55.7	-179.6	0	0	0	112.7	G276 Q277 D292 L296 H297 A323	G276-L294 CarbonylContact C-O 3.59Å; G276-L294 WeakPolarHBondContact CA-O 3.13Å; Q277-L294 PolarHBondContact N-O 3.32Å; D292-L294 PolarHBondContact O-N 2.7Å; L294-L296 WeakPolarHBondContact CB-O 3.32Å; L294-L296 PolarHBondContact O-N 3.45Å; L294-H297 HydrophobicContact CB-CB 4.29Å; L294-A323 HydrophobicContact CD1-CB 4.08Å
295	P	83.5	Confident	80.9	Confident	58 Å²	58	41.9 Å²	41.9	38%	0.377	23%	0.226	S	C	.	.	S	Bend	trans	-53.8	-22.9	174.1	-29.3	36.8	0	0	0	115	Q277 T279 S282	Q277-P295 WeakPolarHBondContact O-CA 3.34Å; T279-P295 HydrophobicContact CG2-CB 3.9Å; T279-P295 HydrophobicContact CG2-CG 3.97Å; S282-P295 PolarHBondContact OG-O 3.07Å
296	L	85.8	Confident	79.3	Confident	79 Å²	79	45.3 Å²	45.3	41%	0.414	25%	0.247	S	C	.	.	S	Bend	trans	-138.8	110.2	161.4	-157.6	76.4	0	0	0	106.9	T274 L294 I320	T274-L296 HydrophobicContact CG2-CD1 3.84Å; L294-L296 WeakPolarHBondContact CB-O 3.32Å; L294-L296 PolarHBondContact O-N 3.45Å; L296-I320 VanDerWaalsContact C-CD1 3.49Å; L296-I320 HydrophobicContact CB-CD1 3.85Å; L296-I320 HydrophobicContact CD2-CD1 3.58Å; L296-I320 HydrophobicContact CG-CD1 3.44Å; L296-I320 VanDerWaalsContact CG-CD1 3.44Å; L296-I320 VanDerWaalsContact O-CD1 3.3Å; L296-I320 WeakPolarHBondContact O-CD1 3.37Å
297	H	84.5	Confident	77.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.282	C	S	.	.			trans	-106.9	-40.9	-170.8	-176.2	96.9	0	0	0	112	V275 I293 L294 I320 A323 I325	V275-H297 PolarHBondContact O-N 3.06Å; I293-H297 HydrophobicContact CG2-CB 3.82Å; L294-H297 HydrophobicContact CB-CB 4.29Å; H297-I320 WeakPolarHBondContact O-CB 3.31Å; H297-I320 PolarHBondContact O-N 3.06Å; H297-A323 WeakPolarHBondContact O-CB 3.27Å; H297-I325 WeakPolarHBondContact NE2-CG1 3.17Å
298	C	88.9	Confident	75.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	165.5	165.6	67.8	0	0	0	0	113.5	V275 L317 E318 I325	V275-C298 VanDerWaalsContact CG2-SG 3.57Å; V275-C298 PolarHBondContact N-O 2.88Å; V275-C298 PolarHBondContact O-N 3.32Å; C298-L317 HydrophobicContact CB-CD2 4.47Å; C298-L317 HydrophobicContact CB-CG 4.46Å; C298-E318 WeakPolarHBondContact CA-O 3.47Å; C298-E318 WeakPolarHBondContact CB-O 3.28Å; C298-I325 HydrophobicContact CB-CD1 3.69Å
299	T	88.5	Confident	73.5	Confident	17 Å²	17	60.1 Å²	60.1	10%	0.104	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.8	167	28.9	0	0	0	0	111.2	R272 H273 T274 E318	R272-T299 HydrophobicContact CG-CG2 4.42Å; H273-T299 CarbonylContact O-C 3.55Å; H273-T299 VanDerWaalsContact O-CA 3.32Å; H273-T299 WeakPolarHBondContact O-CA 3.43Å; T274-T299 HydrophobicContact CG2-CG2 3.58Å; T299-E318 WeakPolarHBondContact CB-OE2 3.3Å; T299-E318 PolarHBondContact N-O 2.88Å; T299-E318 WeakPolarHBondContact O-CB 3.38Å; T299-E318 PolarHBondContact O-N 2.93Å; T299-E318 PolarHBondContact OG1-OE2 3.33Å
300	I	89.3	Confident	71.8	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.01	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	122.1	172.6	-57.1	174.7	0	0	0	107.5	L251 L268 R272 H273 V275 L315 V316 L317 L339	L251-I300 HydrophobicContact CD1-CD1 3.99Å; L268-I300 HydrophobicContact CD1-CG2 4.33Å; L268-I300 HydrophobicContact CD2-CD1 4.3Å; R272-I300 CarbonylContact C-O 3.38Å; R272-I300 WeakPolarHBondContact CA-O 3.07Å; H273-I300 HydrophobicContact CB-CB 4.48Å; H273-I300 PolarHBondContact N-O 3.06Å; H273-I300 PolarHBondContact O-N 2.64Å; V275-I300 HydrophobicContact CG2-CD1 4.35Å; I300-L315 HydrophobicContact CG2-CD2 4.11Å; I300-V316 CarbonylContact C-O 3.58Å; I300-V316 WeakPolarHBondContact CA-O 3.36Å; I300-L317 HydrophobicContact CG1-CD1 4.33Å; I300-L317 HydrophobicContact CG1-CG 4.39Å; I300-L339 HydrophobicContact CG2-CD1 4.23Å
301	R	86	Confident	70	Confident	100 Å²	100	73.3 Å²	73.3	38%	0.377	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	145.1	-177.7	-59.8	-167.9	-163.9	176.5	18.4	112.2	D271 R272 L315 V316 E318	D271-R301 CarbonylContact O-C 3.51Å; D271-R301 VanDerWaalsContact O-CA 3.31Å; D271-R301 WeakPolarHBondContact O-CA 3.35Å; R272-R301 HydrophobicContact CB-CG 4.27Å; R272-R301 HydrophobicContact CG-CG 3.96Å; R301-L315 CarbonylContact O-C 3.39Å; R301-L315 WeakPolarHBondContact O-CA 3.32Å; R301-V316 PolarHBondContact N-O 3.23Å; R301-V316 PolarHBondContact O-N 3.16Å; R301-E318 WeakPolarHBondContact CD-OE1 3.47Å; R301-E318 VanDerWaalsContact CZ-CD 3.45Å; R301-E318 IonicContact CZ-OE1 3.82Å; R301-E318 IonicContact CZ-OE2 2.68Å; R301-E318 IonicContact NE-OE1 3.64Å; R301-E318 PolarHBondContact NE-OE1 2.78Å; R301-E318 IonicContact NE-OE2 2.98Å; R301-E318 PolarHBondContact NE-OE2 2.77Å; R301-E318 IonicContact NH1-OE1 2.81Å; R301-E318 IonicContact NH2-OE1 3.9Å; R301-E318 PolarHBondContact NH2-OE1 3.11Å; R301-E318 IonicContact NH2-OE2 3.83Å; R301-E318 PolarHBondContact NH2-OE2 2.92Å
302	R	82.1	Confident	69	Low	74 Å²	74	73.6 Å²	73.6	28%	0.279	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	114	169.7	-173.3	179	-71.6	-93.8	9.6	109.1	D271 G313 L315	D271-R302 PolarHBondContact O-N 2.89Å; R302-G313 PolarHBondContact NH1-O 2.9Å; R302-L315 HydrophobicContact CB-CD2 4.01Å
303	H	74.6	Confident	68.2	Low	116 Å²	116	74 Å²	74	54%	0.537	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125.4	176.7	-158	-62.8	0	0	0	109.9	G313 R314 V316	H303-G313 CarbonylContact O-C 3.56Å; H303-R314 PolarHBondContact N-O 2.6Å; H303-R314 PolarHBondContact O-N 3.2Å; H303-V316 HydrophobicContact CB-CG2 4.13Å
304	P	59.7	Low	67.7	Low	96 Å²	96	79.4 Å²	79.4	62%	0.623	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-68.5	143.7	170	29.4	-33.6	0	0	0	110
305	L	56.5	Low	67.7	Low	92 Å²	92	77.1 Å²	77.1	48%	0.482	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-80.8	142.8	168.7	-76.6	82.1	0	0	0	109.1	R314	L305-R314 HydrophobicContact CD1-CB 4.07Å
306	P	49.9	Very low	67.8	Low	121 Å²	121	75.3 Å²	75.3	79%	0.786	43%	0.425	S	S	*	.	S	Bend	trans	-62.4	-42.1	176	-24.2	34.9	0	0	0	113.2
307	D	51.1	Low	67.9	Low	143 Å²	143	71.6 Å²	71.6	77%	0.765	41%	0.406	S	S	*	.	S	Bend	trans	-134.8	106.4	-172.7	-69.2	-73.7	0	0	0	111.9
308	S	42	Very low	68	Low	95 Å²	95	73.6 Å²	73.6	66%	0.664	42%	0.415	S	S	*	.			trans	165.9	151.9	143.6	44	0	0	0	0	111.5	Q310	S308-Q310 VanDerWaalsContact C-N 3.3Å; S308-Q310 PolarHBondContact O-N 2.83Å
309	S	42.4	Very low	67.8	Low	127 Å²	127	74.6 Å²	74.6	89%	0.888	42%	0.421	S	S	*	.	S	Bend	trans	-84.3	50.2	-170.3	47.9	0	0	0	0	114.8
310	Q	43.8	Very low	67.4	Low	166 Å²	166	75.6 Å²	75.6	78%	0.776	43%	0.426	S	S	*	.	S	Bend	trans	-132.1	143.9	170.2	-68.7	-158.7	3	0	0	112.7	S308 G312	S308-Q310 VanDerWaalsContact C-N 3.3Å; S308-Q310 PolarHBondContact O-N 2.83Å; Q310-G312 PolarHBondContact O-N 2.84Å
311	P	43.4	Very low	66.5	Low	138 Å²	138	78.5 Å²	78.5	90%	0.896	45%	0.445	S	S	*	.			trans	-75.2	21.4	-175.3	32.5	-37.1	0	0	0	114.7	G313	P311-G313 PolarHBondContact O-N 2.83Å
312	G	53.3	Low	65.5	Low	51 Å²	51	77 Å²	77	53%	0.526	46%	0.461	S	S	.	.			trans	-90.8	70.6	-173.1	0	0	0	0	0	114.3	Q310 R314	Q310-G312 PolarHBondContact O-N 2.84Å; G312-R314 PolarHBondContact O-N 2.77Å
313	G	60.9	Low	65.4	Low	19 Å²	19	74 Å²	74	20%	0.196	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-62.1	127	171.7	0	0	0	0	0	111.7	R302 H303 P311	R302-G313 PolarHBondContact NH1-O 2.9Å; H303-G313 CarbonylContact O-C 3.56Å; P311-G313 PolarHBondContact O-N 2.83Å
314	R	72.6	Confident	65.4	Low	117 Å²	117	71.3 Å²	71.3	44%	0.442	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	130.1	-167.6	-159.5	177.2	177.1	-149.4	-7.3	111.2	H303 L305 G312 V338 H340	H303-R314 PolarHBondContact N-O 2.6Å; H303-R314 PolarHBondContact O-N 3.2Å; L305-R314 HydrophobicContact CD1-CB 4.07Å; G312-R314 PolarHBondContact O-N 2.77Å; R314-V338 HydrophobicContact CG-CG1 3.54Å; R314-V338 VanDerWaalsContact CZ-CG1 3.47Å; R314-H340 PolarHBondContact NH2-CE1 2.96Å; R314-H340 PolarHBondContact NH2-NE2 3.01Å
315	L	83.6	Confident	66.6	Low	9 Å²	9	67 Å²	67	5%	0.047	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126.7	-176.5	-75.2	166.4	0	0	0	112	P249 L268 I300 R301 R302 V338 L339 F355	P249-L315 HydrophobicContact CB-CD1 3.84Å; P249-L315 HydrophobicContact CG-CD1 3.74Å; L268-L315 HydrophobicContact CB-CD1 4.39Å; L268-L315 HydrophobicContact CD1-CD1 4.12Å; I300-L315 HydrophobicContact CG2-CD2 4.11Å; R301-L315 CarbonylContact O-C 3.39Å; R301-L315 WeakPolarHBondContact O-CA 3.32Å; R302-L315 HydrophobicContact CB-CD2 4.01Å; L315-V338 WeakPolarHBondContact O-CG1 3.43Å; L315-L339 PolarHBondContact O-N 3.4Å; L315-F355 HydrophobicContact CB-CZ 4.48Å; L315-F355 HydrophobicContact CD1-CE2 3.71Å; L315-F355 HydrophobicContact CD1-CZ 3.74Å
316	V	85.8	Confident	67.7	Low	20 Å²	20	63.6 Å²	63.6	12%	0.121	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	129.4	-179	-174.4	0	0	0	0	109.2	I300 R301 H303 V338	I300-V316 CarbonylContact C-O 3.58Å; I300-V316 WeakPolarHBondContact CA-O 3.36Å; R301-V316 PolarHBondContact N-O 3.23Å; R301-V316 PolarHBondContact O-N 3.16Å; H303-V316 HydrophobicContact CB-CG2 4.13Å; V316-V338 HydrophobicContact CG2-CG1 4.15Å; V316-V338 HydrophobicContact CG2-CG2 4.31Å
317	L	87.2	Confident	69.3	Low	0 Å²	0	58.3 Å²	58.3	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	124.6	169.3	-174.8	149.2	0	0	0	109.6	C298 I300 P319 I325 T336 V337 L339 L345	C298-L317 HydrophobicContact CB-CD2 4.47Å; C298-L317 HydrophobicContact CB-CG 4.46Å; I300-L317 HydrophobicContact CG1-CD1 4.33Å; I300-L317 HydrophobicContact CG1-CG 4.39Å; L317-P319 HydrophobicContact CD2-CB 4.21Å; L317-I325 HydrophobicContact CD2-CG2 4.18Å; L317-T336 WeakPolarHBondContact O-CA 3.44Å; L317-V337 PolarHBondContact N-O 3.13Å; L317-V337 PolarHBondContact O-N 2.83Å; L317-L339 HydrophobicContact CB-CD1 4.31Å; L317-L339 HydrophobicContact CB-CD2 4.09Å; L317-L339 HydrophobicContact CB-CG 4.2Å; L317-L339 HydrophobicContact CD1-CD2 4.48Å; L317-L345 HydrophobicContact CD1-CD2 3.6Å
318	E	86.6	Confident	70.7	Confident	43 Å²	43	52.5 Å²	52.5	20%	0.201	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	107.2	172.2	-57.5	171.1	155.2	0	0	107.7	C298 T299 R301 T336	C298-E318 WeakPolarHBondContact CA-O 3.47Å; C298-E318 WeakPolarHBondContact CB-O 3.28Å; T299-E318 WeakPolarHBondContact CB-OE2 3.3Å; T299-E318 PolarHBondContact N-O 2.88Å; T299-E318 WeakPolarHBondContact O-CB 3.38Å; T299-E318 PolarHBondContact O-N 2.93Å; T299-E318 PolarHBondContact OG1-OE2 3.33Å; R301-E318 WeakPolarHBondContact CD-OE1 3.47Å; R301-E318 VanDerWaalsContact CZ-CD 3.45Å; R301-E318 IonicContact CZ-OE1 3.82Å; R301-E318 IonicContact CZ-OE2 2.68Å; R301-E318 IonicContact NE-OE1 3.64Å; R301-E318 PolarHBondContact NE-OE1 2.78Å; R301-E318 IonicContact NE-OE2 2.98Å; R301-E318 PolarHBondContact NE-OE2 2.77Å; R301-E318 IonicContact NH1-OE1 2.81Å; R301-E318 IonicContact NH2-OE1 3.9Å; R301-E318 PolarHBondContact NH2-OE1 3.11Å; R301-E318 IonicContact NH2-OE2 3.83Å; R301-E318 PolarHBondContact NH2-OE2 2.92Å; E318-T336 HydrophobicContact CB-CG2 4.44Å; E318-T336 HydrophobicContact CG-CG2 3.94Å
319	P	85.3	Confident	72.2	Confident	20 Å²	20	52.4 Å²	52.4	13%	0.13	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	147.5	176.9	33.5	-34.7	0	0	0	110.2	L317 I325 V332 G333 R335	L317-P319 HydrophobicContact CD2-CB 4.21Å; P319-I325 HydrophobicContact CB-CD1 3.75Å; P319-V332 HydrophobicContact CG-CG1 4.06Å; P319-G333 WeakPolarHBondContact CG-O 3.03Å; P319-R335 WeakPolarHBondContact CD-O 3.19Å; P319-R335 WeakPolarHBondContact CG-O 3.23Å
320	I	80.4	Confident	73.6	Confident	39 Å²	39	50 Å²	50	20%	0.2	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-92.6	140.5	177	-70.1	168.4	0	0	0	109.2	L296 H297 G322 A323	L296-I320 VanDerWaalsContact C-CD1 3.49Å; L296-I320 HydrophobicContact CB-CD1 3.85Å; L296-I320 HydrophobicContact CD2-CD1 3.58Å; L296-I320 HydrophobicContact CG-CD1 3.44Å; L296-I320 VanDerWaalsContact CG-CD1 3.44Å; L296-I320 VanDerWaalsContact O-CD1 3.3Å; L296-I320 WeakPolarHBondContact O-CD1 3.37Å; H297-I320 WeakPolarHBondContact O-CB 3.31Å; H297-I320 PolarHBondContact O-N 3.06Å; I320-G322 PolarHBondContact O-N 2.95Å; I320-G322 VanDerWaalsContact O-N 3.16Å; I320-A323 HydrophobicContact CB-CB 4.39Å; I320-A323 VanDerWaalsContact O-CB 3.25Å; I320-A323 WeakPolarHBondContact O-CB 3.44Å; I320-A323 PolarHBondContact O-N 3.05Å
321	P	69	Low	75.1	Confident	62 Å²	62	49.4 Å²	49.4	40%	0.403	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	121.5	-178.9	-25.6	35.1	0	0	0	111.9
322	G	64.5	Low	76.6	Confident	70 Å²	70	43.5 Å²	43.5	72%	0.722	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	-1.8	-175.7	0	0	0	0	0	115.1	I320 P324	I320-G322 PolarHBondContact O-N 2.95Å; I320-G322 VanDerWaalsContact O-N 3.16Å; G322-P324 VanDerWaalsContact O-CD 3.3Å; G322-P324 WeakPolarHBondContact O-CD 3.26Å
323	A	80.1	Confident	77.3	Confident	11 Å²	11	43.2 Å²	43.2	9%	0.091	26%	0.261	C	S	.	.			trans	-80.9	115.8	170.3	0	0	0	0	0	110.5	L294 H297 I320 I325	L294-A323 HydrophobicContact CD1-CB 4.08Å; H297-A323 WeakPolarHBondContact O-CB 3.27Å; I320-A323 HydrophobicContact CB-CB 4.39Å; I320-A323 VanDerWaalsContact O-CB 3.25Å; I320-A323 WeakPolarHBondContact O-CB 3.44Å; I320-A323 PolarHBondContact O-N 3.05Å; A323-I325 HydrophobicContact CB-CD1 3.78Å; A323-I325 HydrophobicContact CB-CG1 4.16Å; A323-I325 PolarHBondContact O-N 3.06Å
324	P	76.3	Confident	77.5	Confident	59 Å²	59	53 Å²	53	38%	0.383	29%	0.292	S	S	.	.			trans	-69.3	100.9	176.8	26	-33.8	0	0	0	110.7	G322 G348	G322-P324 VanDerWaalsContact O-CD 3.3Å; G322-P324 WeakPolarHBondContact O-CD 3.26Å; P324-G348 PolarHBondContact O-N 2.7Å
325	I	83.8	Confident	77.6	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.021	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	133.9	-176.5	-64	167.3	0	0	0	109.3	H297 C298 L317 P319 A323 V332 S346 L347	H297-I325 WeakPolarHBondContact NE2-CG1 3.17Å; C298-I325 HydrophobicContact CB-CD1 3.69Å; L317-I325 HydrophobicContact CD2-CG2 4.18Å; P319-I325 HydrophobicContact CB-CD1 3.75Å; A323-I325 HydrophobicContact CB-CD1 3.78Å; A323-I325 HydrophobicContact CB-CG1 4.16Å; A323-I325 PolarHBondContact O-N 3.06Å; I325-V332 HydrophobicContact CG2-CB 4.37Å; I325-V332 PolarHBondContact O-N 2.83Å; I325-S346 WeakPolarHBondContact CA-O 3.37Å; I325-L347 HydrophobicContact CD1-CD2 4.39Å; I325-L347 HydrophobicContact CG1-CD2 3.92Å; I325-L347 HydrophobicContact CG2-CD2 4.11Å
326	S	80.8	Confident	77.5	Confident	22 Å²	22	61.3 Å²	61.3	15%	0.154	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	143.1	167.5	70.7	0	0	0	0	111.7	S330 L345 S346	S326-S330 CarbonylContact C-O 3.54Å; S326-S330 VanDerWaalsContact CA-O 3.26Å; S326-S330 WeakPolarHBondContact CA-O 3.38Å; S326-S330 VanDerWaalsContact CB-O 3.29Å; S326-S330 WeakPolarHBondContact CB-O 3.47Å; S326-L345 WeakPolarHBondContact O-CA 3.32Å; S326-S346 PolarHBondContact N-O 2.7Å; S326-S346 PolarHBondContact O-N 2.87Å; S326-S346 WeakPolarHBondContact OG-CB 3.4Å
327	V	82.8	Confident	77.4	Confident	10 Å²	10	62.1 Å²	62.1	6%	0.061	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.6	174	176.1	0	0	0	0	107.5	F329 S330 V332 V337 D343 L344 L345	V327-F329 VanDerWaalsContact C-N 3.27Å; V327-F329 PolarHBondContact O-N 2.95Å; V327-S330 PolarHBondContact N-O 2.87Å; V327-S330 WeakPolarHBondContact O-CB 3.29Å; V327-S330 PolarHBondContact O-N 3.45Å; V327-V332 HydrophobicContact CB-CG2 3.85Å; V327-V332 HydrophobicContact CG2-CG2 3.74Å; V327-V337 HydrophobicContact CB-CG1 4.34Å; V327-V337 HydrophobicContact CG1-CG1 4.27Å; V327-V337 HydrophobicContact CG2-CG1 4.16Å; V327-D343 HydrophobicContact CG1-CB 4.27Å; V327-L344 CarbonylContact C-O 3.56Å; V327-L344 VanDerWaalsContact CA-O 3.3Å; V327-L344 WeakPolarHBondContact CA-O 3.35Å; V327-L345 HydrophobicContact CG2-CG 4.45Å
328	N	80.9	Confident	77.2	Confident	21 Å²	21	63.9 Å²	63.9	11%	0.112	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	42.8	-171	-62	-63.4	0	0	0	113.4	S330 D343 L344 R371	N328-S330 PolarHBondContact O-N 2.88Å; N328-S330 VanDerWaalsContact O-N 3.08Å; N328-D343 PolarHBondContact ND2-OD1 2.9Å; N328-L344 PolarHBondContact N-O 2.95Å; N328-L344 PolarHBondContact OD1-N 3.18Å; N328-R371 VanDerWaalsContact CB-CZ 3.48Å; N328-R371 VanDerWaalsContact CG-CZ 3.44Å; N328-R371 PolarHBondContact ND2-NH1 2.89Å; N328-R371 PolarHBondContact OD1-NH1 3.4Å
329	F	73	Confident	77.1	Confident	92 Å²	92	62.2 Å²	62.2	40%	0.404	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	9.2	-175.4	-42	-67	0	0	0	114.9	V327 L344 L352 R371 V375	V327-F329 VanDerWaalsContact C-N 3.27Å; V327-F329 PolarHBondContact O-N 2.95Å; F329-L344 HydrophobicContact CE2-CD1 3.86Å; F329-L344 HydrophobicContact CZ-CD1 3.69Å; F329-L352 HydrophobicContact CE1-CD1 4.11Å; F329-R371 HydrophobicContact CE2-CB 4.25Å; F329-V375 HydrophobicContact CZ-CG2 4.12Å
330	S	71.3	Confident	76.9	Confident	78 Å²	78	65.6 Å²	65.6	55%	0.545	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	122.8	170.4	-53.7	0	0	0	0	108.4	S326 V327 N328	S326-S330 CarbonylContact C-O 3.54Å; S326-S330 VanDerWaalsContact CA-O 3.26Å; S326-S330 WeakPolarHBondContact CA-O 3.38Å; S326-S330 VanDerWaalsContact CB-O 3.29Å; S326-S330 WeakPolarHBondContact CB-O 3.47Å; V327-S330 PolarHBondContact N-O 2.87Å; V327-S330 WeakPolarHBondContact O-CB 3.29Å; V327-S330 PolarHBondContact O-N 3.45Å; N328-S330 PolarHBondContact O-N 2.88Å; N328-S330 VanDerWaalsContact O-N 3.08Å
331	E	75.6	Confident	77	Confident	153 Å²	153	65 Å²	65	72%	0.715	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.2	135.7	-175.8	-167.6	179.1	161.1	0	0	111.8
332	V	75.1	Confident	77.2	Confident	13 Å²	13	62.1 Å²	62.1	8%	0.079	33%	0.334	C	S	.	.			trans	-111	90.9	179.4	-171.3	0	0	0	0	108.5	P319 I325 V327 R335 V337	P319-V332 HydrophobicContact CG-CG1 4.06Å; I325-V332 HydrophobicContact CG2-CB 4.37Å; I325-V332 PolarHBondContact O-N 2.83Å; V327-V332 HydrophobicContact CB-CG2 3.85Å; V327-V332 HydrophobicContact CG2-CG2 3.74Å; V332-R335 WeakPolarHBondContact CG1-O 3.04Å; V332-V337 HydrophobicContact CB-CG2 4.36Å; V332-V337 HydrophobicContact CG1-CB 4.11Å; V332-V337 HydrophobicContact CG1-CG2 3.38Å; V332-V337 HydrophobicContact CG2-CG2 3.97Å
333	G	68.7	Low	78.1	Confident	45 Å²	45	59.6 Å²	59.6	46%	0.464	30%	0.304	S	S	.	.			trans	-66.3	-149.8	167.3	0	0	0	0	0	112	P319 R335	P319-G333 WeakPolarHBondContact CG-O 3.03Å; G333-R335 PolarHBondContact O-N 3.22Å
334	R	65.2	Low	78.1	Confident	224 Å²	224	59.2 Å²	59.2	85%	0.845	30%	0.3	S	S	*	.	S	Bend	trans	-65.4	19.3	-172.1	-52.3	-174.4	-170.6	-176.8	4.5	117.1
335	R	72.9	Confident	78.5	Confident	206 Å²	206	56.4 Å²	56.4	78%	0.777	28%	0.282	S	S	*	.	S	Bend	trans	-98.7	135.3	-179.2	-65.8	-178.2	179.3	172.5	1	110.6	P319 V332 G333 V337	P319-R335 WeakPolarHBondContact CD-O 3.19Å; P319-R335 WeakPolarHBondContact CG-O 3.23Å; V332-R335 WeakPolarHBondContact CG1-O 3.04Å; G333-R335 PolarHBondContact O-N 3.22Å; R335-V337 PolarHBondContact O-N 2.62Å
336	T	81.3	Confident	78.5	Confident	95 Å²	95	57.5 Å²	57.5	58%	0.583	29%	0.29	S	S	*	.			trans	-69.7	126.3	168.8	52	0	0	0	0	109.5	L317 E318	L317-T336 WeakPolarHBondContact O-CA 3.44Å; E318-T336 HydrophobicContact CB-CG2 4.44Å; E318-T336 HydrophobicContact CG-CG2 3.94Å
337	V	83.7	Confident	78.7	Confident	37 Å²	37	56.5 Å²	56.5	22%	0.224	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.1	-177.6	165.3	0	0	0	0	109.6	L317 V327 V332 R335	L317-V337 PolarHBondContact N-O 3.13Å; L317-V337 PolarHBondContact O-N 2.83Å; V327-V337 HydrophobicContact CB-CG1 4.34Å; V327-V337 HydrophobicContact CG1-CG1 4.27Å; V327-V337 HydrophobicContact CG2-CG1 4.16Å; V332-V337 HydrophobicContact CB-CG2 4.36Å; V332-V337 HydrophobicContact CG1-CB 4.11Å; V332-V337 HydrophobicContact CG1-CG2 3.38Å; V332-V337 HydrophobicContact CG2-CG2 3.97Å; R335-V337 PolarHBondContact O-N 2.62Å
338	V	84.7	Confident	78.5	Confident	38 Å²	38	56.3 Å²	56.3	23%	0.23	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	127.2	-179.4	-159.8	0	0	0	0	109.6	R314 L315 V316 H340	R314-V338 HydrophobicContact CG-CG1 3.54Å; R314-V338 VanDerWaalsContact CZ-CG1 3.47Å; L315-V338 WeakPolarHBondContact O-CG1 3.43Å; V316-V338 HydrophobicContact CG2-CG1 4.15Å; V316-V338 HydrophobicContact CG2-CG2 4.31Å; V338-H340 PolarHBondContact O-CE1 3.13Å; V338-H340 PolarHBondContact O-ND1 3.27Å
339	L	83.4	Confident	78	Confident	7 Å²	7	59.6 Å²	59.6	4%	0.037	30%	0.3	C	S	.	.			trans	-84.9	136.2	-175.2	-57.3	178.9	0	0	0	111	I300 L315 L317 L345 F355	I300-L339 HydrophobicContact CG2-CD1 4.23Å; L315-L339 PolarHBondContact O-N 3.4Å; L317-L339 HydrophobicContact CB-CD1 4.31Å; L317-L339 HydrophobicContact CB-CD2 4.09Å; L317-L339 HydrophobicContact CB-CG 4.2Å; L317-L339 HydrophobicContact CD1-CD2 4.48Å; L339-L345 HydrophobicContact CD1-CD2 4.27Å; L339-L345 HydrophobicContact CD2-CD1 4.22Å; L339-L345 HydrophobicContact CD2-CD2 4.18Å; L339-L345 HydrophobicContact CD2-CG 4.31Å; L339-F355 HydrophobicContact CB-CD1 3.73Å; L339-F355 HydrophobicContact CB-CE1 3.75Å; L339-F355 HydrophobicContact CB-CG 4.31Å; L339-F355 HydrophobicContact CB-CZ 4.34Å
340	H	82.1	Confident	78	Confident	91 Å²	91	57.8 Å²	57.8	42%	0.421	29%	0.291	S	S	.	.			trans	-123.6	149.5	178.7	-55.8	83.7	0	0	0	110.6	R314 V338 G342 D343 F355	R314-H340 PolarHBondContact NH2-CE1 2.96Å; R314-H340 PolarHBondContact NH2-NE2 3.01Å; V338-H340 PolarHBondContact O-CE1 3.13Å; V338-H340 PolarHBondContact O-ND1 3.27Å; H340-G342 PolarHBondContact O-N 3.03Å; H340-G342 VanDerWaalsContact O-N 3.13Å; H340-D343 PolarHBondContact N-OD2 2.79Å; H340-D343 IonicContact ND1-OD2 3.54Å; H340-D343 WeakPolarHBondContact O-CB 3.12Å; H340-D343 VanDerWaalsContact O-CG 3.3Å; H340-D343 PolarHBondContact O-N 3.03Å; H340-F355 VanDerWaalsContact O-CD1 3.3Å; H340-F355 WeakPolarHBondContact O-CD1 3.37Å
341	H	80.9	Confident	78.4	Confident	27 Å²	27	54.1 Å²	54.1	13%	0.125	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	121.9	-178	-177.9	120.7	0	0	0	111.3	D357	H341-D357 HydrophobicContact CB-CB 4.42Å; H341-D357 PolarHBondContact CE1-O 3.12Å; H341-D357 PolarHBondContact ND1-N 3.26Å; H341-D357 PolarHBondContact ND1-O 2.92Å
342	G	74	Confident	78.7	Confident	2 Å²	2	47.3 Å²	47.3	2%	0.021	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	4.4	-179	0	0	0	0	0	115.2	H340 F355 A368	H340-G342 PolarHBondContact O-N 3.03Å; H340-G342 VanDerWaalsContact O-N 3.13Å; G342-F355 PolarHBondContact N-O 3.19Å; G342-A368 VanDerWaalsContact O-CB 3.3Å; G342-A368 WeakPolarHBondContact O-CB 3.49Å
343	D	83.3	Confident	79.1	Confident	17 Å²	17	46.7 Å²	46.7	9%	0.091	23%	0.23	C	C	.	.			trans	-67.2	135.6	171	-78.1	-23.4	0	0	0	111.7	V327 N328 H340 L345 F355	V327-D343 HydrophobicContact CG1-CB 4.27Å; N328-D343 PolarHBondContact ND2-OD1 2.9Å; H340-D343 PolarHBondContact N-OD2 2.79Å; H340-D343 IonicContact ND1-OD2 3.54Å; H340-D343 WeakPolarHBondContact O-CB 3.12Å; H340-D343 VanDerWaalsContact O-CG 3.3Å; H340-D343 PolarHBondContact O-N 3.03Å; D343-L345 HydrophobicContact CB-CD1 4.47Å; D343-F355 PolarHBondContact O-N 2.95Å
344	L	81	Confident	79.8	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.01	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	130.9	170.4	-68.9	170.6	0	0	0	110	L254 V327 N328 F329 L352 L353 L354 R371 L372	L254-L344 HydrophobicContact CD1-CD2 3.52Å; V327-L344 CarbonylContact C-O 3.56Å; V327-L344 VanDerWaalsContact CA-O 3.3Å; V327-L344 WeakPolarHBondContact CA-O 3.35Å; N328-L344 PolarHBondContact N-O 2.95Å; N328-L344 PolarHBondContact OD1-N 3.18Å; F329-L344 HydrophobicContact CE2-CD1 3.86Å; F329-L344 HydrophobicContact CZ-CD1 3.69Å; L344-L352 HydrophobicContact CB-CD1 4.35Å; L344-L353 CarbonylContact C-O 3.51Å; L344-L353 WeakPolarHBondContact CA-O 3.36Å; L344-L354 HydrophobicContact CD2-CB 4.06Å; L344-L354 HydrophobicContact CD2-CD1 3.8Å; L344-L354 HydrophobicContact CD2-CG 4.5Å; L344-L354 HydrophobicContact CG-CD1 4.37Å; L344-R371 HydrophobicContact CD1-CB 3.89Å; L344-L372 HydrophobicContact CD2-CD2 3.98Å
345	L	84.6	Confident	80.8	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	117.6	175.3	-67.5	73.9	0	0	0	108.1	L251 L317 S326 V327 L339 D343 L353 F355	L251-L345 HydrophobicContact CD2-CD1 4.19Å; L251-L345 HydrophobicContact CD2-CD2 4.02Å; L317-L345 HydrophobicContact CD1-CD2 3.6Å; S326-L345 WeakPolarHBondContact O-CA 3.32Å; V327-L345 HydrophobicContact CG2-CG 4.45Å; L339-L345 HydrophobicContact CD1-CD2 4.27Å; L339-L345 HydrophobicContact CD2-CD1 4.22Å; L339-L345 HydrophobicContact CD2-CD2 4.18Å; L339-L345 HydrophobicContact CD2-CG 4.31Å; D343-L345 HydrophobicContact CB-CD1 4.47Å; L345-L353 HydrophobicContact CB-CB 4.31Å; L345-L353 PolarHBondContact N-O 3.33Å; L345-L353 PolarHBondContact O-N 2.7Å; L345-F355 HydrophobicContact CD1-CB 3.7Å
346	S	83	Confident	81.2	Confident	26 Å²	26	27.4 Å²	27.4	18%	0.182	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	125.6	162.4	-152.9	0	0	0	0	107.9	I325 S326 G348 Y351	I325-S346 WeakPolarHBondContact CA-O 3.37Å; S326-S346 PolarHBondContact N-O 2.7Å; S326-S346 PolarHBondContact O-N 2.87Å; S326-S346 WeakPolarHBondContact OG-CB 3.4Å; S346-G348 PolarHBondContact OG-O 2.73Å; S346-G348 VanDerWaalsContact OG-O 3.05Å; S346-Y351 VanDerWaalsContact CA-O 3.3Å; S346-Y351 WeakPolarHBondContact CA-O 3.44Å
347	L	85.2	Confident	81.1	Confident	2 Å²	2	24.2 Å²	24.2	1%	0.01	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	110	170	-55.9	-178.4	0	0	0	106.7	V275 L288 I293 I325 Y351 L353	V275-L347 HydrophobicContact CG1-CD1 3.82Å; L288-L347 HydrophobicContact CD1-CD1 3.89Å; I293-L347 HydrophobicContact CD1-CB 3.97Å; I325-L347 HydrophobicContact CD1-CD2 4.39Å; I325-L347 HydrophobicContact CG1-CD2 3.92Å; I325-L347 HydrophobicContact CG2-CD2 4.11Å; L347-Y351 PolarHBondContact N-O 2.72Å; L347-Y351 WeakPolarHBondContact O-CB 3.46Å; L347-Y351 PolarHBondContact O-N 3.35Å; L347-L353 HydrophobicContact CD1-CD1 3.63Å; L347-L353 HydrophobicContact CG-CD1 4.11Å
348	G	78	Confident	80.2	Confident	6 Å²	6	24.2 Å²	24.2	6%	0.062	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	62	-159.7	-164.6	0	0	0	0	0	113.7	D292 P324 S346	D292-G348 WeakPolarHBondContact OD2-CA 3.16Å; P324-G348 PolarHBondContact O-N 2.7Å; S346-G348 PolarHBondContact OG-O 2.73Å; S346-G348 VanDerWaalsContact OG-O 3.05Å
349	L	71.9	Confident	79.3	Confident	89 Å²	89	26.4 Å²	26.4	47%	0.466	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-25.1	179.2	-55.9	177.1	0	0	0	112.2	D292 Q403	D292-L349 PolarHBondContact OD2-N 3.32Å; L349-Q403 HydrophobicContact CD1-CG 4.23Å
350	Y	71.3	Confident	78.2	Confident	55 Å²	55	30.1 Å²	30.1	22%	0.216	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-31.9	-169.9	-58.1	-81.1	0	0	0	114.7	Q255 Y257 A290 P291 D292	Q255-Y350 CarbonylContact C-O 3.35Å; Q255-Y350 WeakPolarHBondContact CG-O 3.47Å; Q255-Y350 PolarHBondContact NE2-O 3.03Å; Q255-Y350 VanDerWaalsContact NE2-O 3.11Å; Y257-Y350 AromaticContact CD2-CD1 3.67Å; Y257-Y350 HydrophobicContact CD2-CD1 3.67Å; Y257-Y350 HydrophobicContact CD2-CD2 4.16Å; Y257-Y350 HydrophobicContact CD2-CE1 4.04Å; Y257-Y350 HydrophobicContact CD2-CE2 4.49Å; Y257-Y350 AromaticContact CD2-CG 3.73Å; Y257-Y350 HydrophobicContact CD2-CG 3.73Å; Y257-Y350 HydrophobicContact CE2-CD1 4.28Å; Y257-Y350 HydrophobicContact CE2-CE1 4.17Å; Y257-Y350 HydrophobicContact CE2-CG 4.49Å; A290-Y350 HydrophobicContact CB-CD2 3.74Å; A290-Y350 HydrophobicContact CB-CG 4.17Å; P291-Y350 HydrophobicContact CG-CE2 4.34Å; D292-Y350 WeakPolarHBondContact OD1-CD2 3.44Å; D292-Y350 WeakPolarHBondContact OD2-CD2 3.16Å
351	Y	79.7	Confident	76.7	Confident	1 Å²	1	30.3 Å²	30.3	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	122.4	-177.4	-66.6	-85.3	0	0	0	112.9	L253 Q255 D262 L288 S289 A290 I293 S346 L347	L253-Y351 HydrophobicContact CD1-CD1 3.86Å; L253-Y351 HydrophobicContact CD1-CE1 4.41Å; Q255-Y351 WeakPolarHBondContact O-CA 3.34Å; D262-Y351 HydrophobicContact CB-CE1 4.33Å; D262-Y351 VanDerWaalsContact CG-CE1 3.43Å; D262-Y351 VanDerWaalsContact CG-OH 3.25Å; D262-Y351 WeakPolarHBondContact OD1-CE1 3.3Å; D262-Y351 PolarHBondContact OD1-OH 3.3Å; D262-Y351 WeakPolarHBondContact OD2-CE1 3.45Å; D262-Y351 PolarHBondContact OD2-OH 3.09Å; L288-Y351 HydrophobicContact CB-CD2 4.47Å; L288-Y351 HydrophobicContact CB-CE1 4.37Å; L288-Y351 HydrophobicContact CB-CE2 3.78Å; L288-Y351 HydrophobicContact CD1-CD1 4.31Å; L288-Y351 HydrophobicContact CD1-CD2 4.03Å; L288-Y351 HydrophobicContact CD1-CE1 4.46Å; L288-Y351 HydrophobicContact CD1-CE2 4.17Å; L288-Y351 HydrophobicContact CD1-CG 4.1Å; L288-Y351 HydrophobicContact CD2-CD1 4.17Å; L288-Y351 HydrophobicContact CD2-CE1 3.8Å; L288-Y351 HydrophobicContact CG-CE1 4.43Å; L288-Y351 HydrophobicContact CG-CE2 4.4Å; S289-Y351 PolarHBondContact N-OH 2.82Å; S289-Y351 PolarHBondContact OG-OH 3.02Å; A290-Y351 HydrophobicContact CB-CD2 4.23Å; A290-Y351 HydrophobicContact CB-CE2 3.54Å; I293-Y351 HydrophobicContact CD1-CD2 4.02Å; I293-Y351 HydrophobicContact CD1-CE2 4.47Å; I293-Y351 HydrophobicContact CG1-CD2 3.91Å; I293-Y351 HydrophobicContact CG1-CE2 3.86Å; S346-Y351 VanDerWaalsContact CA-O 3.3Å; S346-Y351 WeakPolarHBondContact CA-O 3.44Å; L347-Y351 PolarHBondContact N-O 2.72Å; L347-Y351 WeakPolarHBondContact O-CB 3.46Å; L347-Y351 PolarHBondContact O-N 3.35Å
352	L	81.9	Confident	75.6	Confident	9 Å²	9	35.5 Å²	35.5	5%	0.047	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	122.5	165.4	-172.3	66.7	0	0	0	109.2	L254 Q255 F329 L344 V375	L254-L352 HydrophobicContact CB-CB 4.41Å; L254-L352 HydrophobicContact CB-CD2 4.32Å; L254-L352 HydrophobicContact CB-CG 4.33Å; L254-L352 WeakPolarHBondContact CB-O 3.3Å; L254-L352 HydrophobicContact CD1-CD2 4.18Å; L254-L352 HydrophobicContact CD1-CG 4.3Å; L254-L352 PolarHBondContact N-O 2.85Å; Q255-L352 HydrophobicContact CB-CB 3.76Å; Q255-L352 PolarHBondContact N-O 2.99Å; Q255-L352 VanDerWaalsContact N-O 3.13Å; Q255-L352 PolarHBondContact O-N 3.13Å; F329-L352 HydrophobicContact CE1-CD1 4.11Å; L344-L352 HydrophobicContact CB-CD1 4.35Å; L352-V375 HydrophobicContact CD2-CG1 4.22Å; L352-V375 HydrophobicContact CD2-CG2 4.02Å
353	L	84.9	Confident	74.7	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.005	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	136.1	-174	-71	151.5	0	0	0	109.9	L251 L252 L253 Y266 L344 L345 L347	L251-L353 HydrophobicContact CB-CB 4.38Å; L251-L353 HydrophobicContact CB-CD2 4Å; L252-L353 CarbonylContact O-C 3.48Å; L252-L353 WeakPolarHBondContact O-CA 3.42Å; L253-L353 HydrophobicContact CB-CD2 4.33Å; L253-L353 HydrophobicContact CD1-CD2 3.82Å; L253-L353 HydrophobicContact CD1-CG 4.33Å; Y266-L353 HydrophobicContact CD2-CD2 3.92Å; Y266-L353 HydrophobicContact CE2-CD2 4Å; L344-L353 CarbonylContact C-O 3.51Å; L344-L353 WeakPolarHBondContact CA-O 3.36Å; L345-L353 HydrophobicContact CB-CB 4.31Å; L345-L353 PolarHBondContact N-O 3.33Å; L345-L353 PolarHBondContact O-N 2.7Å; L347-L353 HydrophobicContact CD1-CD1 3.63Å; L347-L353 HydrophobicContact CG-CD1 4.11Å
354	L	83.5	Confident	73.7	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.021	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	117.4	174.2	176.1	64.7	0	0	0	110	L252 L254 L344 K356 L364 L372	L252-L354 HydrophobicContact CB-CB 4.36Å; L252-L354 HydrophobicContact CD2-CD2 4.35Å; L252-L354 PolarHBondContact N-O 3.2Å; L252-L354 PolarHBondContact O-N 2.72Å; L254-L354 HydrophobicContact CD1-CB 3.99Å; L254-L354 HydrophobicContact CD2-CB 4.34Å; L254-L354 HydrophobicContact CG-CB 4.14Å; L344-L354 HydrophobicContact CD2-CB 4.06Å; L344-L354 HydrophobicContact CD2-CD1 3.8Å; L344-L354 HydrophobicContact CD2-CG 4.5Å; L344-L354 HydrophobicContact CG-CD1 4.37Å; L354-K356 HydrophobicContact CD2-CG 4.49Å; L354-K356 HydrophobicContact CG-CG 4.34Å; L354-L364 HydrophobicContact CD1-CD2 4.39Å; L354-L364 HydrophobicContact CD2-CD1 4.13Å; L354-L364 HydrophobicContact CD2-CD2 4.31Å; L354-L372 HydrophobicContact CD2-CD1 4.35Å
355	F	86.1	Confident	73	Confident	3 Å²	3	44.3 Å²	44.3	1%	0.013	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	123.3	174.4	174.2	-115.7	0	0	0	111.1	P249 L251 L268 L315 L339 H340 G342 D343 L345 D357	P249-F355 HydrophobicContact CB-CE2 3.88Å; P249-F355 HydrophobicContact CB-CZ 4.21Å; L251-F355 HydrophobicContact CD2-CB 3.8Å; L251-F355 HydrophobicContact CD2-CD2 3.95Å; L251-F355 HydrophobicContact CD2-CG 4.32Å; L268-F355 HydrophobicContact CD1-CD2 4.08Å; L268-F355 HydrophobicContact CD1-CE2 3.93Å; L315-F355 HydrophobicContact CB-CZ 4.48Å; L315-F355 HydrophobicContact CD1-CE2 3.71Å; L315-F355 HydrophobicContact CD1-CZ 3.74Å; L339-F355 HydrophobicContact CB-CD1 3.73Å; L339-F355 HydrophobicContact CB-CE1 3.75Å; L339-F355 HydrophobicContact CB-CG 4.31Å; L339-F355 HydrophobicContact CB-CZ 4.34Å; H340-F355 VanDerWaalsContact O-CD1 3.3Å; H340-F355 WeakPolarHBondContact O-CD1 3.37Å; G342-F355 PolarHBondContact N-O 3.19Å; D343-F355 PolarHBondContact O-N 2.95Å; L345-F355 HydrophobicContact CD1-CB 3.7Å; F355-D357 HydrophobicContact CE1-CB 4.5Å; F355-D357 HydrophobicContact CZ-CB 4.18Å
356	K	80.4	Confident	71.8	Confident	62 Å²	62	48.2 Å²	48.2	27%	0.27	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	133.3	174.9	-71.9	-176.1	177.2	179.6	0	110.1	P249 H250 L354	P249-K356 CarbonylContact C-O 3.56Å; P249-K356 VanDerWaalsContact CA-O 3.3Å; P249-K356 WeakPolarHBondContact CA-O 3.45Å; H250-K356 PolarHBondContact N-O 3.45Å; H250-K356 PolarHBondContact O-N 2.88Å; L354-K356 HydrophobicContact CD2-CG 4.49Å; L354-K356 HydrophobicContact CG-CG 4.34Å
357	D	79.3	Confident	70.7	Confident	29 Å²	29	56.8 Å²	56.8	16%	0.155	32%	0.323	C	S	.	.			trans	-115.8	103.7	169.4	-178	6.9	0	0	0	109.3	P249 H341 F355 A359 Q360	P249-D357 HydrophobicContact CB-CB 4.27Å; H341-D357 HydrophobicContact CB-CB 4.42Å; H341-D357 PolarHBondContact CE1-O 3.12Å; H341-D357 PolarHBondContact ND1-N 3.26Å; H341-D357 PolarHBondContact ND1-O 2.92Å; F355-D357 HydrophobicContact CE1-CB 4.5Å; F355-D357 HydrophobicContact CZ-CB 4.18Å; D357-A359 PolarHBondContact O-N 2.95Å; D357-A359 WeakPolarHBondContact OD1-CB 3.1Å; D357-A359 PolarHBondContact OD1-N 2.99Å; D357-Q360 HydrophobicContact CB-CG 4.32Å; D357-Q360 PolarHBondContact O-N 3.24Å; D357-Q360 PolarHBondContact OD2-NE2 3.32Å
358	P	65.9	Low	69.4	Low	37 Å²	37	56.8 Å²	56.8	24%	0.24	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-69	-20.8	-176.4	29.4	-34.4	0	0	0	112.7	Y246 S248 Q360 A361	Y246-P358 WeakPolarHBondContact O-CB 3.43Å; S248-P358 VanDerWaalsContact O-CD 3.28Å; S248-P358 WeakPolarHBondContact O-CD 3.36Å; S248-P358 WeakPolarHBondContact O-CG 3.28Å; P358-Q360 PolarHBondContact O-N 2.74Å; P358-Q360 VanDerWaalsContact O-N 3.11Å; P358-A361 PolarHBondContact O-N 3.14Å; P358-A361 VanDerWaalsContact O-N 3.1Å
359	A	64.1	Low	68.5	Low	83 Å²	83	60.4 Å²	60.4	69%	0.686	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-63.6	-18.1	178.7	0	0	0	0	0	113.2	D357	D357-A359 PolarHBondContact O-N 2.95Å; D357-A359 WeakPolarHBondContact OD1-CB 3.1Å; D357-A359 PolarHBondContact OD1-N 2.99Å
360	Q	60.9	Low	67.9	Low	85 Å²	85	58.8 Å²	58.8	40%	0.397	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-85.8	-13	179.1	-60.9	-179.3	32.2	0	0	113.3	D357 P358 Q362	D357-Q360 HydrophobicContact CB-CG 4.32Å; D357-Q360 PolarHBondContact O-N 3.24Å; D357-Q360 PolarHBondContact OD2-NE2 3.32Å; P358-Q360 PolarHBondContact O-N 2.74Å; P358-Q360 VanDerWaalsContact O-N 3.11Å; Q360-Q362 WeakPolarHBondContact O-CG 3.35Å; Q360-Q362 PolarHBondContact O-N 3.48Å
361	A	50.3	Low	67.5	Low	95 Å²	95	60.3 Å²	60.3	79%	0.785	35%	0.346	S	S	*	.			trans	49.9	16.2	173.3	0	0	0	0	0	117.6	P358	P358-A361 PolarHBondContact O-N 3.14Å; P358-A361 VanDerWaalsContact O-N 3.1Å
362	Q	57.4	Low	66.4	Low	137 Å²	137	62.7 Å²	62.7	64%	0.64	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-97.5	150.6	-178.8	-76.2	173.2	30.5	0	0	111.9	Q360	Q360-Q362 WeakPolarHBondContact O-CG 3.35Å; Q360-Q362 PolarHBondContact O-N 3.48Å
363	P	56.5	Low	65.1	Low	113 Å²	113	72.9 Å²	72.9	73%	0.734	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-63.2	149.1	166.4	29.3	-34.7	0	0	0	110.2
364	L	62.2	Low	63.5	Low	34 Å²	34	76.3 Å²	76.3	18%	0.178	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-49.2	127.6	177.4	-77.5	169	0	0	0	110.4	L354 L369 L372	L354-L364 HydrophobicContact CD1-CD2 4.39Å; L354-L364 HydrophobicContact CD2-CD1 4.13Å; L354-L364 HydrophobicContact CD2-CD2 4.31Å; L364-L369 HydrophobicContact CB-CD2 3.93Å; L364-L369 HydrophobicContact CB-CG 3.97Å; L364-L369 HydrophobicContact CD1-CD2 4.1Å; L364-L369 WeakPolarHBondContact O-CD1 3.47Å; L364-L372 HydrophobicContact CD1-CD1 4.18Å
365	P	66.6	Low	61.9	Low	58 Å²	58	77.8 Å²	77.8	38%	0.377	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-52.7	144.5	-176.6	-29.5	34.9	0	0	0	112.3	R367 A368 L369	P365-R367 PolarHBondContact O-N 3.16Å; P365-A368 HydrophobicContact CB-CB 4.41Å; P365-A368 WeakPolarHBondContact O-CA 3.37Å; P365-A368 WeakPolarHBondContact O-CB 3.47Å; P365-A368 PolarHBondContact O-N 3.21Å; P365-L369 PolarHBondContact O-N 3.21Å
366	A	57.9	Low	60	Low	84 Å²	84	80.2 Å²	80.2	69%	0.694	45%	0.449	S	S	*	.	H	α-helix	trans	-54.3	-30	-179.3	0	0	0	0	0	113.1	A370	A366-A370 VanDerWaalsContact O-CB 3.29Å; A366-A370 WeakPolarHBondContact O-CB 3.17Å; A366-A370 PolarHBondContact O-N 2.76Å
367	R	59.8	Low	58.4	Low	205 Å²	205	84.2 Å²	84.2	77%	0.774	47%	0.469	S	S	*	.	H	α-helix	trans	-69.7	-35.8	172.3	-67.6	-179.1	175.9	178.5	-2.1	113.5	P365 R371	P365-R367 PolarHBondContact O-N 3.16Å; R367-R371 WeakPolarHBondContact O-CB 3.43Å; R367-R371 WeakPolarHBondContact O-CD 3.44Å; R367-R371 VanDerWaalsContact O-CG 3.23Å; R367-R371 WeakPolarHBondContact O-CG 3.06Å; R367-R371 PolarHBondContact O-N 2.93Å
368	A	58.9	Low	56.6	Low	3 Å²	3	85.5 Å²	85.5	3%	0.025	48%	0.48	C	S	.	.	H	α-helix	trans	-69.8	-42.5	173	0	0	0	0	0	111.1	G342 P365 A370 R371 L372	G342-A368 VanDerWaalsContact O-CB 3.3Å; G342-A368 WeakPolarHBondContact O-CB 3.49Å; P365-A368 HydrophobicContact CB-CB 4.41Å; P365-A368 WeakPolarHBondContact O-CA 3.37Å; P365-A368 WeakPolarHBondContact O-CB 3.47Å; P365-A368 PolarHBondContact O-N 3.21Å; A368-A370 PolarHBondContact O-N 2.75Å; A368-R371 PolarHBondContact O-N 3.34Å; A368-L372 WeakPolarHBondContact O-CG 3.3Å; A368-L372 PolarHBondContact O-N 2.93Å
369	L	59.7	Low	55.4	Low	82 Å²	82	86.5 Å²	86.5	43%	0.429	49%	0.487	S	S	.	.	H	α-helix	trans	-63.9	-37.7	173.8	-66.9	174.1	0	0	0	112.5	L364 P365 L372 R373	L364-L369 HydrophobicContact CB-CD2 3.93Å; L364-L369 HydrophobicContact CB-CG 3.97Å; L364-L369 HydrophobicContact CD1-CD2 4.1Å; L364-L369 WeakPolarHBondContact O-CD1 3.47Å; P365-L369 PolarHBondContact O-N 3.21Å; L369-L372 HydrophobicContact CD2-CD1 4.34Å; L369-L372 PolarHBondContact O-N 2.82Å; L369-R373 WeakPolarHBondContact O-CG 3.25Å; L369-R373 PolarHBondContact O-N 3.42Å
370	A	59	Low	54.4	Low	55 Å²	55	90 Å²	90	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-65.8	-41.6	172.3	0	0	0	0	0	112.3	A366 A368 R373 A374	A366-A370 VanDerWaalsContact O-CB 3.29Å; A366-A370 WeakPolarHBondContact O-CB 3.17Å; A366-A370 PolarHBondContact O-N 2.76Å; A368-A370 PolarHBondContact O-N 2.75Å; A370-R373 PolarHBondContact O-N 2.86Å; A370-A374 WeakPolarHBondContact O-CB 3.43Å; A370-A374 PolarHBondContact O-N 3.38Å; A370-A374 VanDerWaalsContact O-N 3.07Å
371	R	63.1	Low	53.3	Low	87 Å²	87	90.1 Å²	90.1	33%	0.328	49%	0.486	S	S	.	.	H	α-helix	trans	-62.1	-41	173.4	-75.7	166.2	179	162.1	-3.3	112.3	N328 F329 L344 R367 A368 R373 A374 V375	N328-R371 VanDerWaalsContact CB-CZ 3.48Å; N328-R371 VanDerWaalsContact CG-CZ 3.44Å; N328-R371 PolarHBondContact ND2-NH1 2.89Å; N328-R371 PolarHBondContact OD1-NH1 3.4Å; F329-R371 HydrophobicContact CE2-CB 4.25Å; L344-R371 HydrophobicContact CD1-CB 3.89Å; R367-R371 WeakPolarHBondContact O-CB 3.43Å; R367-R371 WeakPolarHBondContact O-CD 3.44Å; R367-R371 VanDerWaalsContact O-CG 3.23Å; R367-R371 WeakPolarHBondContact O-CG 3.06Å; R367-R371 PolarHBondContact O-N 2.93Å; A368-R371 PolarHBondContact O-N 3.34Å; R371-R373 VanDerWaalsContact C-N 3.33Å; R371-R373 PolarHBondContact O-N 3.04Å; R371-A374 CarbonylContact O-C 3.5Å; R371-A374 WeakPolarHBondContact O-CA 3.46Å; R371-A374 PolarHBondContact O-N 3.09Å; R371-V375 PolarHBondContact O-N 3.09Å; R371-V375 VanDerWaalsContact O-N 3.09Å
372	L	55.8	Low	52.7	Low	50 Å²	50	89.9 Å²	89.9	26%	0.262	48%	0.477	S	S	.	.	H	α-helix	trans	-62.9	-37.2	174.7	-75.2	165.6	0	0	0	112.3	L254 L344 L354 L364 A368 L369 A374 V375	L254-L372 HydrophobicContact CD1-CD2 3.51Å; L344-L372 HydrophobicContact CD2-CD2 3.98Å; L354-L372 HydrophobicContact CD2-CD1 4.35Å; L364-L372 HydrophobicContact CD1-CD1 4.18Å; A368-L372 WeakPolarHBondContact O-CG 3.3Å; A368-L372 PolarHBondContact O-N 2.93Å; L369-L372 HydrophobicContact CD2-CD1 4.34Å; L369-L372 PolarHBondContact O-N 2.82Å; L372-A374 PolarHBondContact O-N 3.27Å; L372-V375 PolarHBondContact O-N 2.74Å
373	R	54.4	Low	51.8	Low	223 Å²	223	85.9 Å²	85.9	84%	0.842	47%	0.473	S	S	*	.	H	α-helix	trans	-72	-15.3	171.5	-70.9	176.8	179.2	-179.5	-0.8	114.1	L369 A370 R371	L369-R373 WeakPolarHBondContact O-CG 3.25Å; L369-R373 PolarHBondContact O-N 3.42Å; A370-R373 PolarHBondContact O-N 2.86Å; R371-R373 VanDerWaalsContact C-N 3.33Å; R371-R373 PolarHBondContact O-N 3.04Å
374	A	50.8	Low	50.6	Low	73 Å²	73	83.4 Å²	83.4	60%	0.603	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	6.9	177.5	0	0	0	0	0	113.2	A370 R371 L372	A370-A374 WeakPolarHBondContact O-CB 3.43Å; A370-A374 PolarHBondContact O-N 3.38Å; A370-A374 VanDerWaalsContact O-N 3.07Å; R371-A374 CarbonylContact O-C 3.5Å; R371-A374 WeakPolarHBondContact O-CA 3.46Å; R371-A374 PolarHBondContact O-N 3.09Å; L372-A374 PolarHBondContact O-N 3.27Å
375	V	51.6	Low	49.3	Very low	36 Å²	36	85.4 Å²	85.4	22%	0.218	48%	0.483	C	S	.	.	S	Bend	trans	-62.5	130.6	164.3	174.8	0	0	0	0	107.4	F329 L352 R371 L372 Q377	F329-V375 HydrophobicContact CZ-CG2 4.12Å; L352-V375 HydrophobicContact CD2-CG1 4.22Å; L352-V375 HydrophobicContact CD2-CG2 4.02Å; R371-V375 PolarHBondContact O-N 3.09Å; R371-V375 VanDerWaalsContact O-N 3.09Å; L372-V375 PolarHBondContact O-N 2.74Å; V375-Q377 PolarHBondContact O-N 2.9Å
376	P	45.6	Very low	47.9	Very low	53 Å²	53	89.7 Å²	89.7	34%	0.344	50%	0.502	S	S	.	.			trans	-59.7	129.2	177.8	24.9	-34	0	0	0	110	S378	P376-S378 PolarHBondContact O-N 3.22Å; P376-S378 VanDerWaalsContact O-N 3.13Å
377	Q	45.7	Very low	46.5	Very low	147 Å²	147	89.1 Å²	89.1	69%	0.687	51%	0.505	S	S	*	.	S	Bend	trans	-74.4	3.4	-177	-67.7	-176.7	-21.6	0	0	113.8	V375 A385 L386	V375-Q377 PolarHBondContact O-N 2.9Å; Q377-A385 CarbonylContact O-C 3.48Å; Q377-A385 WeakPolarHBondContact O-CA 3.18Å; Q377-L386 PolarHBondContact O-N 3.48Å
378	S	43.2	Very low	44.9	Very low	56 Å²	56	84 Å²	84	39%	0.392	51%	0.507	S	S	.	.	B	Isolated β-bridge	trans	-128.4	143.4	179.8	53	0	0	0	0	112	P376 R380 A384	P376-S378 PolarHBondContact O-N 3.22Å; P376-S378 VanDerWaalsContact O-N 3.13Å; S378-R380 PolarHBondContact O-N 2.94Å; S378-A384 WeakPolarHBondContact CA-O 3.4Å
379	C	39.8	Very low	43.5	Very low	57 Å²	57	95.5 Å²	95.5	39%	0.385	55%	0.549	S	S	.	.			trans	-63.3	130.3	172.1	178.7	0	0	0	0	110.6	L381 C382 G383 A384	C379-L381 VanDerWaalsContact C-N 3.27Å; C379-L381 PolarHBondContact O-N 3Å; C379-C382 VanDerWaalsContact CB-SG 3.51Å; C379-G383 WeakPolarHBondContact O-CA 3.3Å; C379-G383 PolarHBondContact O-N 3.29Å; C379-A384 PolarHBondContact N-O 2.79Å; C379-A384 VanDerWaalsContact N-O 3.1Å
380	R	42.8	Very low	41.9	Very low	158 Å²	158	99.7 Å²	99.7	60%	0.596	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-10	-172.5	-74.9	-171.6	175.2	178.5	1.3	116	S378	S378-R380 PolarHBondContact O-N 2.94Å
381	L	37.3	Very low	40.9	Very low	86 Å²	86	102.1 Å²	102.1	45%	0.45	59%	0.592	S	S	.	*	T	Hydrogen-bonded Turn	trans	-111.3	-25.2	174.4	-90.2	77.8	0	0	0	114.3	C379	C379-L381 VanDerWaalsContact C-N 3.27Å; C379-L381 PolarHBondContact O-N 3Å
382	C	38.7	Very low	39.3	Very low	91 Å²	91	102.7 Å²	102.7	62%	0.615	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	2.3	-176.1	69.5	0	0	0	0	115	C379 A384	C379-C382 VanDerWaalsContact CB-SG 3.51Å; C382-A384 PolarHBondContact O-N 3.17Å
383	G	38.2	Very low	38	Very low	52 Å²	52	105 Å²	105	54%	0.536	64%	0.636	S	S	.	*			trans	67.8	-9.2	175.4	0	0	0	0	0	116.1	C379 A385	C379-G383 WeakPolarHBondContact O-CA 3.3Å; C379-G383 PolarHBondContact O-N 3.29Å; G383-A385 PolarHBondContact O-N 3.15Å
384	A	31.4	Very low	37.1	Very low	62 Å²	62	100.8 Å²	100.8	51%	0.512	64%	0.637	S	S	.	*			trans	-54.2	119.4	-178	0	0	0	0	0	111.4	S378 C379 C382	S378-A384 WeakPolarHBondContact CA-O 3.4Å; C379-A384 PolarHBondContact N-O 2.79Å; C379-A384 VanDerWaalsContact N-O 3.1Å; C382-A384 PolarHBondContact O-N 3.17Å
385	A	35.9	Very low	36.1	Very low	76 Å²	76	103.1 Å²	103.1	63%	0.628	64%	0.644	S	S	*	*	B	Isolated β-bridge	trans	-89.5	133.8	-175.8	0	0	0	0	0	111.9	Q377 G383 G387	Q377-A385 CarbonylContact O-C 3.48Å; Q377-A385 WeakPolarHBondContact O-CA 3.18Å; G383-A385 PolarHBondContact O-N 3.15Å; A385-G387 VanDerWaalsContact C-N 3.32Å; A385-G387 PolarHBondContact O-N 3.14Å
386	L	35.6	Very low	35.5	Very low	147 Å²	147	111.1 Å²	111.1	77%	0.77	68%	0.679	S	S	*	*			trans	-72.6	88.5	168	-69.2	170.9	0	0	0	108.5	Q377	Q377-L386 PolarHBondContact O-N 3.48Å
387	G	28.6	Very low	34.6	Very low	73 Å²	73	113.3 Å²	113.3	75%	0.753	70%	0.702	S	S	*	*			trans	-75.3	130.8	-157.3	0	0	0	0	0	116.6	A385	A385-G387 VanDerWaalsContact C-N 3.32Å; A385-G387 PolarHBondContact O-N 3.14Å
388	A	26.6	Very low	34	Very low	98 Å²	98	111.1 Å²	111.1	81%	0.81	71%	0.709	S	S	*	*			trans	-146.3	143.2	135.5	0	0	0	0	0	108.7
389	R	30.8	Very low	33.4	Very low	244 Å²	244	116 Å²	116	92%	0.921	73%	0.73	S	S	*	*			trans	-72.7	132.8	172	-80.3	176.2	166.7	165.6	-5.6	109.8
390	D	25	Very low	33.2	Very low	170 Å²	170	117.6 Å²	117.6	91%	0.909	74%	0.739	S	S	*	*			trans	-149.3	149.8	132.7	-103.5	-37	0	0	0	109.4
391	A	38	Very low	33	Very low	105 Å²	105	120.3 Å²	120.3	87%	0.868	75%	0.75	S	S	*	*			trans	-101.2	115.3	-163	0	0	0	0	0	113.5
392	A	28.9	Very low	33.1	Very low	100 Å²	100	123.7 Å²	123.7	83%	0.826	76%	0.756	S	S	*	*			trans	-148.7	152.6	163.8	0	0	0	0	0	111.4
393	S	29.7	Very low	33.6	Very low	98 Å²	98	121.9 Å²	121.9	69%	0.685	74%	0.739	S	S	*	*			trans	-62.5	140.7	-173.1	51.1	0	0	0	0	115.1	T395	S393-T395 PolarHBondContact O-N 3.44Å
394	P	35	Very low	34.3	Very low	134 Å²	134	126.6 Å²	126.6	87%	0.87	75%	0.747	S	S	*	*			trans	-81.6	101	172.4	32.7	-33.1	0	0	0	111.9
395	T	29.7	Very low	36.1	Very low	122 Å²	122	124.4 Å²	124.4	75%	0.748	73%	0.726	S	S	*	*			trans	-98.1	110.5	160.9	47.1	0	0	0	0	110.1	S393	S393-T395 PolarHBondContact O-N 3.44Å
396	Q	38.5	Very low	37.9	Very low	204 Å²	204	122.5 Å²	122.5	95%	0.953	71%	0.706	S	S	*	*			trans	37.9	83.5	162.4	-67.5	179.1	-19	0	0	116.5
397	A	28.1	Very low	40.2	Very low	99 Å²	99	115.5 Å²	115.5	82%	0.818	67%	0.669	S	S	*	*			trans	-109.4	142.4	160.5	0	0	0	0	0	109.6
398	A	33.3	Very low	42.9	Very low	102 Å²	102	117.5 Å²	117.5	84%	0.843	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-71	151	-172.9	0	0	0	0	0	113.3
399	L	30.6	Very low	45.8	Very low	157 Å²	157	113.1 Å²	113.1	82%	0.822	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-61.1	158.4	176.6	-78.8	79.8	0	0	0	112.1
400	P	34.1	Very low	48.5	Very low	91 Å²	91	105.1 Å²	105.1	59%	0.591	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-54.6	145.9	168.6	-22	33.6	0	0	0	111.7	R402	P400-R402 PolarHBondContact O-N 3.28Å
401	R	38.2	Very low	51.4	Low	216 Å²	216	99.9 Å²	99.9	82%	0.815	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-69	122.4	166.8	-81.6	-175.1	172.7	176.9	-4.4	108.7
402	R	40.3	Very low	53.7	Low	156 Å²	156	101 Å²	101	59%	0.589	56%	0.556	S	S	*	*			trans	-43	146	167.5	-63.8	173.8	176.4	-178.8	-14.9	111	P400 Q404 E788	P400-R402 PolarHBondContact O-N 3.28Å; R402-Q404 PolarHBondContact O-N 2.96Å; R402-E788 IonicContact CZ-OE1 2.72Å; R402-E788 IonicContact CZ-OE2 2.82Å; R402-E788 IonicContact NE-OE2 3.93Å; R402-E788 PolarHBondContact NE-OE2 3.32Å; R402-E788 IonicContact NH1-OE1 3.86Å; R402-E788 PolarHBondContact NH1-OE1 2.9Å; R402-E788 IonicContact NH1-OE2 3.71Å; R402-E788 PolarHBondContact NH1-OE2 2.87Å; R402-E788 IonicContact NH2-OE1 3.64Å; R402-E788 PolarHBondContact NH2-OE1 3.25Å; R402-E788 IonicContact NH2-OE2 2.68Å; R402-E788 PolarHBondContact NH2-OE2 3.32Å
403	Q	49.4	Very low	56.5	Low	53 Å²	53	96.9 Å²	96.9	25%	0.248	52%	0.521	C	S	.	.			trans	-60.6	128.7	160.8	-63.4	-168.5	9.9	0	0	108.2	L349 L405	L349-Q403 HydrophobicContact CD1-CG 4.23Å; Q403-L405 VanDerWaalsContact C-N 3.34Å; Q403-L405 PolarHBondContact O-N 3.38Å
404	Q	53.3	Low	59.4	Low	151 Å²	151	92.7 Å²	92.7	71%	0.706	49%	0.49	S	S	*	.			trans	-79.1	88.7	178.8	-80.5	-177.7	-67.6	0	0	110.8	R402 L406 R804	R402-Q404 PolarHBondContact O-N 2.96Å; Q404-L406 PolarHBondContact O-N 3.25Å; Q404-R804 PolarHBondContact O-NH2 3.33Å
405	L	68.5	Low	62.1	Low	16 Å²	16	90.9 Å²	90.9	8%	0.084	47%	0.473	C	S	.	.			trans	-72.2	71	164.8	-54.5	179.6	0	0	0	108.5	Q403 F438 L442 L792 L800	Q403-L405 VanDerWaalsContact C-N 3.34Å; Q403-L405 PolarHBondContact O-N 3.38Å; L405-F438 HydrophobicContact CD1-CZ 4.34Å; L405-L442 HydrophobicContact CB-CD2 4.25Å; L405-L442 WeakPolarHBondContact O-CD2 3.47Å; L405-L792 HydrophobicContact CD1-CD1 3.75Å; L405-L792 HydrophobicContact CD1-CD2 4.16Å; L405-L792 HydrophobicContact CD1-CG 4.07Å; L405-L792 HydrophobicContact CD2-CD1 3.49Å; L405-L792 VanDerWaalsContact CD2-CD1 3.49Å; L405-L792 HydrophobicContact CD2-CG 4.43Å; L405-L792 HydrophobicContact CG-CD1 4.25Å; L405-L800 HydrophobicContact CD2-CD2 4.35Å
406	L	73.6	Confident	65	Low	36 Å²	36	87.9 Å²	87.9	19%	0.188	46%	0.455	C	S	.	.			trans	-120.8	136.1	-179.7	-173.4	66.3	0	0	0	110.5	Q404 E408 R804	Q404-L406 PolarHBondContact O-N 3.25Å; L406-E408 HydrophobicContact CD2-CG 3.89Å; L406-E408 HydrophobicContact CG-CG 4.09Å; L406-R804 PolarHBondContact O-NE 3.11Å; L406-R804 PolarHBondContact O-NH2 3.49Å
407	L	83.7	Confident	67.6	Low	1 Å²	1	78.2 Å²	78.2	1%	0.005	41%	0.41	C	S	.	.			trans	-118.1	85.3	-179	-179.4	52.2	0	0	0	110.7	F409 L442 H446 L800 I803 R804 L807	L407-F409 WeakPolarHBondContact O-CD1 3.07Å; L407-F409 PolarHBondContact O-N 2.91Å; L407-L442 HydrophobicContact CB-CB 4Å; L407-L442 HydrophobicContact CD2-CB 4.22Å; L407-H446 WeakPolarHBondContact O-CB 3.23Å; L407-H446 PolarHBondContact O-ND1 3.3Å; L407-L800 HydrophobicContact CD1-CD1 4.31Å; L407-I803 HydrophobicContact CD1-CG2 3.93Å; L407-I803 HydrophobicContact CD2-CG2 4.29Å; L407-R804 HydrophobicContact CD1-CG 4.22Å; L407-L807 HydrophobicContact CD1-CD1 3.69Å
408	E	84.6	Confident	70.8	Confident	114 Å²	114	73.6 Å²	73.6	53%	0.533	37%	0.372	S	S	.	.			trans	-77.5	107.3	-175.8	-65.9	-178.1	-175	0	0	113.9	L406 R811	L406-E408 HydrophobicContact CD2-CG 3.89Å; L406-E408 HydrophobicContact CG-CG 4.09Å; E408-R811 PolarHBondContact O-NH1 2.92Å; E408-R811 PolarHBondContact O-NH2 3.2Å
409	F	89.5	Confident	73.7	Confident	7 Å²	7	75.3 Å²	75.3	3%	0.031	36%	0.362	C	S	.	.			trans	-125.6	165.3	170	68.7	-76	0	0	0	112.5	L407 E414 L417 C443 H446 F451 L459 L807	L407-F409 WeakPolarHBondContact O-CD1 3.07Å; L407-F409 PolarHBondContact O-N 2.91Å; F409-E414 HydrophobicContact CE2-CB 4.03Å; F409-E414 HydrophobicContact CE2-CG 4.09Å; F409-L417 HydrophobicContact CB-CD2 3.93Å; F409-L417 HydrophobicContact CD1-CD2 3.59Å; F409-L417 HydrophobicContact CD2-CD2 3.78Å; F409-L417 HydrophobicContact CE1-CD2 4Å; F409-L417 HydrophobicContact CE2-CD2 4.14Å; F409-L417 HydrophobicContact CG-CD2 3.49Å; F409-L417 VanDerWaalsContact CG-CD2 3.49Å; F409-L417 HydrophobicContact CZ-CD2 4.26Å; F409-C443 HydrophobicContact CE1-CB 4.09Å; F409-C443 HydrophobicContact CZ-CB 4.28Å; F409-H446 AromaticContact CD1-CD2 3.49Å; F409-H446 VanDerWaalsContact CD1-CD2 3.49Å; F409-H446 WeakPolarHBondContact CD1-CD2 3.48Å; F409-H446 HydrophobicContact CE1-CB 4.16Å; F409-H446 AromaticContact CE1-CD2 3.48Å; F409-H446 VanDerWaalsContact CE1-CD2 3.48Å; F409-H446 WeakPolarHBondContact CE1-CD2 3.39Å; F409-H446 PolarHBondContact N-NE2 3.44Å; F409-H446 PolarHBondContact O-NE2 3.42Å; F409-F451 AromaticContact CD2-CZ 3.87Å; F409-F451 HydrophobicContact CD2-CZ 3.87Å; F409-F451 HydrophobicContact CE1-CZ 4.37Å; F409-F451 AromaticContact CE2-CE2 3.78Å; F409-F451 HydrophobicContact CE2-CE2 3.78Å; F409-F451 AromaticContact CE2-CZ 3.47Å; F409-F451 HydrophobicContact CE2-CZ 3.47Å; F409-F451 VanDerWaalsContact CE2-CZ 3.47Å; F409-F451 HydrophobicContact CG-CZ 4.47Å; F409-F451 AromaticContact CZ-CE2 3.96Å; F409-F451 HydrophobicContact CZ-CE2 3.96Å; F409-F451 AromaticContact CZ-CZ 3.75Å; F409-F451 HydrophobicContact CZ-CZ 3.75Å; F409-L459 HydrophobicContact CZ-CD2 4.47Å; F409-L807 HydrophobicContact CB-CD1 3.99Å; F409-L807 HydrophobicContact CB-CD2 3.93Å
410	E	86.2	Confident	76.7	Confident	76 Å²	76	71.3 Å²	71.3	36%	0.355	34%	0.336	S	S	.	.			trans	-100.5	148	171.8	-75.1	142.2	119.5	0	0	109.8	H412 L413 R811	E410-H412 PolarHBondContact O-N 3.14Å; E410-H412 IonicContact OE1-CE1 3.98Å; E410-L413 WeakPolarHBondContact O-CB 3.44Å; E410-L413 PolarHBondContact O-N 3.47Å; E410-R811 IonicContact OE2-CZ 2.91Å; E410-R811 IonicContact OE2-NE 2.82Å; E410-R811 PolarHBondContact OE2-NE 2.53Å; E410-R811 IonicContact OE2-NH2 3.46Å; E410-R811 PolarHBondContact OE2-NH2 3.28Å
411	P	86.8	Confident	79.6	Confident	59 Å²	59	67 Å²	67	38%	0.383	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-54.5	-33.5	-174.1	-27.6	33.4	0	0	0	114.8	L413 E414 F451	P411-L413 PolarHBondContact O-N 3.34Å; P411-E414 WeakPolarHBondContact O-CB 3.46Å; P411-E414 PolarHBondContact O-N 2.72Å; P411-F451 HydrophobicContact CB-CE2 4.17Å; P411-F451 HydrophobicContact CB-CZ 4.29Å; P411-F451 HydrophobicContact CG-CD1 4Å; P411-F451 HydrophobicContact CG-CD2 4.09Å; P411-F451 HydrophobicContact CG-CE1 3.79Å; P411-F451 HydrophobicContact CG-CE2 3.89Å; P411-F451 HydrophobicContact CG-CG 4.17Å; P411-F451 HydrophobicContact CG-CZ 3.74Å
412	H	85.5	Confident	82.2	Confident	128 Å²	128	58 Å²	58	59%	0.593	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-71	-9.6	179.5	71.6	-95	0	0	0	114.5	E410	E410-H412 PolarHBondContact O-N 3.14Å; E410-H412 IonicContact OE1-CE1 3.98Å
413	L	88.7	Confident	84.7	Confident	14 Å²	14	54.6 Å²	54.6	7%	0.073	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-96.8	-5.4	175.1	-58.5	178.3	0	0	0	112.6	E410 P411 D415 T416 L417 L807 L810 R811	E410-L413 WeakPolarHBondContact O-CB 3.44Å; E410-L413 PolarHBondContact O-N 3.47Å; P411-L413 PolarHBondContact O-N 3.34Å; L413-D415 PolarHBondContact O-N 2.89Å; L413-T416 PolarHBondContact O-N 3.23Å; L413-L417 WeakPolarHBondContact O-CB 3.41Å; L413-L417 PolarHBondContact O-N 3.24Å; L413-L807 HydrophobicContact CB-CD2 4.3Å; L413-L807 HydrophobicContact CD1-CD2 4.12Å; L413-L810 HydrophobicContact CD2-CB 4.18Å; L413-L810 HydrophobicContact CD2-CD1 4.25Å; L413-R811 HydrophobicContact CD1-CG 4.2Å
414	E	89.9	Confident	86.6	Confident	10 Å²	10	53.1 Å²	53.1	5%	0.047	27%	0.266	C	S	.	.	H	α-helix	trans	-57.2	-51.4	-170.3	-173.8	-176.5	93.5	0	0	113.3	F409 P411 T416 L417 L418 L459 K462	F409-E414 HydrophobicContact CE2-CB 4.03Å; F409-E414 HydrophobicContact CE2-CG 4.09Å; P411-E414 WeakPolarHBondContact O-CB 3.46Å; P411-E414 PolarHBondContact O-N 2.72Å; E414-T416 VanDerWaalsContact C-N 3.28Å; E414-T416 PolarHBondContact O-N 3.4Å; E414-L417 PolarHBondContact O-N 2.95Å; E414-L418 HydrophobicContact CG-CD1 4.1Å; E414-L418 HydrophobicContact CG-CG 4.38Å; E414-L418 WeakPolarHBondContact O-CB 3.3Å; E414-L418 WeakPolarHBondContact O-CG 3.41Å; E414-L418 PolarHBondContact O-N 2.94Å; E414-L459 HydrophobicContact CG-CD1 3.79Å; E414-K462 WeakPolarHBondContact OE1-CD 3.37Å; E414-K462 WeakPolarHBondContact OE1-CE 3.39Å; E414-K462 IonicContact OE1-NZ 3Å; E414-K462 PolarHBondContact OE1-NZ 3.48Å
415	D	91.1	Very high	88.4	Confident	96 Å²	96	46.6 Å²	46.6	51%	0.513	24%	0.235	S	C	.	.	H	α-helix	trans	-57.2	-42	178.1	-66.1	-90.1	0	0	0	112.5	L413 Q419 K462	L413-D415 PolarHBondContact O-N 2.89Å; D415-Q419 VanDerWaalsContact O-CB 3.25Å; D415-Q419 WeakPolarHBondContact O-CB 3.43Å; D415-Q419 PolarHBondContact O-N 2.97Å; D415-K462 VanDerWaalsContact CG-CE 3.44Å; D415-K462 WeakPolarHBondContact OD1-CE 3.44Å; D415-K462 IonicContact OD1-NZ 2.65Å; D415-K462 PolarHBondContact OD1-NZ 3.27Å; D415-K462 IonicContact OD2-NZ 3.21Å; D415-K462 PolarHBondContact OD2-NZ 3.39Å
416	T	91.9	Very high	89.3	Confident	60 Å²	60	53 Å²	53	37%	0.368	27%	0.265	S	S	.	.	H	α-helix	trans	-72.1	-35.5	-179	-57	0	0	0	0	111.5	L413 E414 R420 F806 L810	L413-T416 PolarHBondContact O-N 3.23Å; E414-T416 VanDerWaalsContact C-N 3.28Å; E414-T416 PolarHBondContact O-N 3.4Å; T416-R420 WeakPolarHBondContact O-CB 3.48Å; T416-R420 PolarHBondContact O-N 3.46Å; T416-R420 VanDerWaalsContact O-N 3.13Å; T416-F806 HydrophobicContact CG2-CE1 4.08Å; T416-F806 HydrophobicContact CG2-CZ 3.79Å; T416-L810 HydrophobicContact CG2-CD1 3.71Å; T416-L810 HydrophobicContact CG2-CD2 4.48Å
417	L	93.4	Very high	89.8	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-67.3	-50.7	174.3	176.6	57.5	0	0	0	111.2	F409 L413 E414 R420 I421 I803 L807	F409-L417 HydrophobicContact CB-CD2 3.93Å; F409-L417 HydrophobicContact CD1-CD2 3.59Å; F409-L417 HydrophobicContact CD2-CD2 3.78Å; F409-L417 HydrophobicContact CE1-CD2 4Å; F409-L417 HydrophobicContact CE2-CD2 4.14Å; F409-L417 HydrophobicContact CG-CD2 3.49Å; F409-L417 VanDerWaalsContact CG-CD2 3.49Å; F409-L417 HydrophobicContact CZ-CD2 4.26Å; L413-L417 WeakPolarHBondContact O-CB 3.41Å; L413-L417 PolarHBondContact O-N 3.24Å; E414-L417 PolarHBondContact O-N 2.95Å; L417-R420 PolarHBondContact O-N 2.96Å; L417-I421 HydrophobicContact CD1-CD1 3.85Å; L417-I421 HydrophobicContact CD1-CG1 4.28Å; L417-I421 HydrophobicContact CG-CD1 3.97Å; L417-I421 WeakPolarHBondContact O-CG1 3.5Å; L417-I421 PolarHBondContact O-N 3.48Å; L417-I803 HydrophobicContact CD1-CG2 3.44Å; L417-I803 VanDerWaalsContact CD1-CG2 3.44Å; L417-L807 HydrophobicContact CB-CD2 4.38Å; L417-L807 HydrophobicContact CD1-CD1 4.16Å; L417-L807 HydrophobicContact CD1-CD2 4.22Å; L417-L807 HydrophobicContact CD1-CG 4.28Å; L417-L807 HydrophobicContact CD2-CD1 4.29Å; L417-L807 HydrophobicContact CD2-CD2 4.3Å
418	L	94.3	Very high	89.7	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-61.2	-48.9	178.8	-68.2	-178.5	0	0	0	111.2	E414 R420 I421 M422 L440 L459 K462 I463 L466	E414-L418 HydrophobicContact CG-CD1 4.1Å; E414-L418 HydrophobicContact CG-CG 4.38Å; E414-L418 WeakPolarHBondContact O-CB 3.3Å; E414-L418 WeakPolarHBondContact O-CG 3.41Å; E414-L418 PolarHBondContact O-N 2.94Å; L418-R420 PolarHBondContact O-N 3.12Å; L418-I421 PolarHBondContact O-N 3.5Å; L418-I421 VanDerWaalsContact O-N 3.11Å; L418-M422 WeakPolarHBondContact O-CG 3.43Å; L418-M422 PolarHBondContact O-N 2.9Å; L418-L440 HydrophobicContact CD2-CD2 3.6Å; L418-L459 HydrophobicContact CD1-CD1 3.89Å; L418-L459 HydrophobicContact CD2-CD1 4.3Å; L418-L459 HydrophobicContact CG-CD1 4.47Å; L418-K462 HydrophobicContact CD1-CD 3.9Å; L418-K462 HydrophobicContact CD1-CG 3.94Å; L418-I463 HydrophobicContact CD1-CG1 4.07Å; L418-I463 HydrophobicContact CD2-CD1 4.17Å; L418-I463 HydrophobicContact CD2-CG1 3.73Å; L418-L466 HydrophobicContact CB-CD1 3.94Å; L418-L466 HydrophobicContact CD1-CD1 3.95Å
419	Q	93.8	Very high	89.7	Confident	137 Å²	137	50.9 Å²	50.9	64%	0.64	28%	0.278	S	S	*	.	H	α-helix	trans	-59.5	-34.6	177	-169	179.9	24.4	0	0	112	D415 T423	D415-Q419 VanDerWaalsContact O-CB 3.25Å; D415-Q419 WeakPolarHBondContact O-CB 3.43Å; D415-Q419 PolarHBondContact O-N 2.97Å; Q419-T423 PolarHBondContact O-N 2.68Å; Q419-T423 PolarHBondContact O-OG1 2.9Å
420	R	93.9	Very high	89.5	Confident	74 Å²	74	59 Å²	59	28%	0.279	32%	0.321	S	S	.	.	H	α-helix	trans	-71.4	-38.9	175	-168.3	67.7	-167	120.5	2.2	112.7	T416 L417 L418 T423 L424 Y802 I803 F806	T416-R420 WeakPolarHBondContact O-CB 3.48Å; T416-R420 PolarHBondContact O-N 3.46Å; T416-R420 VanDerWaalsContact O-N 3.13Å; L417-R420 PolarHBondContact O-N 2.96Å; L418-R420 PolarHBondContact O-N 3.12Å; R420-T423 PolarHBondContact NH1-O 3.13Å; R420-T423 PolarHBondContact NH1-OG1 3.4Å; R420-T423 CarbonylContact O-C 3.2Å; R420-T423 PolarHBondContact O-N 3.31Å; R420-T423 PolarHBondContact O-OG1 3.45Å; R420-L424 WeakPolarHBondContact O-CB 3.35Å; R420-L424 PolarHBondContact O-N 3.2Å; R420-L424 VanDerWaalsContact O-N 3.08Å; R420-Y802 HydrophobicContact CG-CE1 4.48Å; R420-Y802 PolarHBondContact NE-OH 3.31Å; R420-Y802 VanDerWaalsContact NE-OH 3.08Å; R420-Y802 PolarHBondContact NH2-OH 3.33Å; R420-I803 HydrophobicContact CG-CD1 4.06Å; R420-F806 HydrophobicContact CB-CD1 4.34Å; R420-F806 HydrophobicContact CB-CE1 3.7Å; R420-F806 HydrophobicContact CB-CZ 3.97Å; R420-F806 HydrophobicContact CG-CD1 4.16Å; R420-F806 HydrophobicContact CG-CE1 3.88Å; R420-F806 HydrophobicContact CG-CE2 4.37Å; R420-F806 HydrophobicContact CG-CZ 3.99Å
421	I	94.6	Very high	89.5	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-65.8	-43	175.5	-65.7	164.4	0	0	0	110.8	L417 L418 T423 L424 P436 L439 L440 I803	L417-I421 HydrophobicContact CD1-CD1 3.85Å; L417-I421 HydrophobicContact CD1-CG1 4.28Å; L417-I421 HydrophobicContact CG-CD1 3.97Å; L417-I421 WeakPolarHBondContact O-CG1 3.5Å; L417-I421 PolarHBondContact O-N 3.48Å; L418-I421 PolarHBondContact O-N 3.5Å; L418-I421 VanDerWaalsContact O-N 3.11Å; I421-T423 PolarHBondContact O-N 2.85Å; I421-T423 VanDerWaalsContact O-N 3.09Å; I421-L424 WeakPolarHBondContact O-CB 3.5Å; I421-L424 PolarHBondContact O-N 3.27Å; I421-P436 HydrophobicContact CG2-CB 4.17Å; I421-L439 HydrophobicContact CD1-CB 4.1Å; I421-L439 HydrophobicContact CG1-CB 4.32Å; I421-L439 HydrophobicContact CG1-CD1 4.45Å; I421-L439 HydrophobicContact CG2-CB 4.14Å; I421-L439 HydrophobicContact CG2-CD1 4.49Å; I421-L440 HydrophobicContact CG2-CD2 4.17Å; I421-L440 HydrophobicContact CG2-CG 4.05Å; I421-I803 HydrophobicContact CG1-CD1 4.22Å
422	M	93.4	Very high	89.7	Confident	26 Å²	26	56.9 Å²	56.9	13%	0.128	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-16.2	175.7	-64.3	-72.5	142.1	0	0	113.7	L418 L440 L466 I467 W509	L418-M422 WeakPolarHBondContact O-CG 3.43Å; L418-M422 PolarHBondContact O-N 2.9Å; M422-L440 HydrophobicContact CE-CD1 3.66Å; M422-L440 HydrophobicContact CE-CD2 3.87Å; M422-L440 HydrophobicContact CE-CG 4.37Å; M422-L466 HydrophobicContact SD-CB 4.43Å; M422-I467 HydrophobicContact CE-CD1 4.22Å; M422-I467 HydrophobicContact CE-CG1 3.72Å; M422-I467 HydrophobicContact SD-CG1 3.98Å; M422-W509 HydrophobicContact CB-CZ2 4.46Å; M422-W509 HydrophobicContact CE-CH2 3.97Å; M422-W509 HydrophobicContact CE-CZ3 4.14Å; M422-W509 HydrophobicContact SD-CH2 3.39Å; M422-W509 WeakPolarHBondContact SD-CH2 3.3Å; M422-W509 HydrophobicContact SD-CZ2 3.79Å; M422-W509 HydrophobicContact SD-CZ3 3.91Å
423	T	91.9	Very high	90	Very high	85 Å²	85	51.8 Å²	51.8	52%	0.521	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.8	21.7	-178.8	58.3	0	0	0	0	112.7	Q419 R420 I421	Q419-T423 PolarHBondContact O-N 2.68Å; Q419-T423 PolarHBondContact O-OG1 2.9Å; R420-T423 PolarHBondContact NH1-O 3.13Å; R420-T423 PolarHBondContact NH1-OG1 3.4Å; R420-T423 CarbonylContact O-C 3.2Å; R420-T423 PolarHBondContact O-N 3.31Å; R420-T423 PolarHBondContact O-OG1 3.45Å; I421-T423 PolarHBondContact O-N 2.85Å; I421-T423 VanDerWaalsContact O-N 3.09Å
424	L	90.4	Very high	90.2	Very high	22 Å²	22	51.2 Å²	51.2	12%	0.115	28%	0.281	C	S	.	.	S	Bend	trans	-85.9	-41	-175.2	-171.9	62.5	0	0	0	113	R420 I421 L439 H799 Y802 I803	R420-L424 WeakPolarHBondContact O-CB 3.35Å; R420-L424 PolarHBondContact O-N 3.2Å; R420-L424 VanDerWaalsContact O-N 3.08Å; I421-L424 WeakPolarHBondContact O-CB 3.5Å; I421-L424 PolarHBondContact O-N 3.27Å; L424-L439 HydrophobicContact CD2-CD1 3.44Å; L424-L439 VanDerWaalsContact CD2-CD1 3.44Å; L424-H799 HydrophobicContact CD2-CB 4.09Å; L424-Y802 HydrophobicContact CD1-CD1 3.62Å; L424-Y802 HydrophobicContact CD1-CE1 3.58Å; L424-I803 HydrophobicContact CD1-CD1 4.27Å; L424-I803 HydrophobicContact CD2-CD1 4.09Å; L424-I803 HydrophobicContact CD2-CG1 3.99Å
425	I	91.6	Very high	90.4	Very high	13 Å²	13	50.7 Å²	50.7	7%	0.067	28%	0.279	C	S	.	.	S	Bend	trans	-115.9	129.5	-172	-56	-58	0	0	0	109.2	D431 T435 P436 F508 H799	I425-D431 HydrophobicContact CD1-CB 3.9Å; I425-D431 HydrophobicContact CG2-CB 4.16Å; I425-T435 HydrophobicContact CD1-CG2 4.25Å; I425-T435 HydrophobicContact CG1-CG2 4.4Å; I425-P436 HydrophobicContact CB-CG 4.39Å; I425-P436 HydrophobicContact CG1-CG 4.11Å; I425-F508 HydrophobicContact CB-CZ 3.98Å; I425-F508 HydrophobicContact CG2-CE2 3.89Å; I425-F508 HydrophobicContact CG2-CZ 3.85Å; I425-H799 WeakPolarHBondContact CD1-NE2 3.37Å
426	E	85.9	Confident	90.5	Very high	151 Å²	151	46.2 Å²	46.2	71%	0.706	26%	0.255	S	S	*	.			trans	-83.9	126.9	171	-64.4	-170.7	173.8	0	0	109.7	G428 G429	E426-G428 PolarHBondContact O-N 3.42Å; E426-G429 PolarHBondContact O-N 3.16Å
427	P	85	Confident	90.7	Very high	30 Å²	30	43.3 Å²	43.3	20%	0.195	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-33.2	-176.8	-31.1	36.9	0	0	0	114.5	K433 Q504 P505 F508	P427-K433 PolarHBondContact O-NZ 2.99Å; P427-Q504 HydrophobicContact CB-CB 4.22Å; P427-P505 HydrophobicContact CG-CB 4.39Å; P427-P505 HydrophobicContact CG-CG 4.37Å; P427-F508 HydrophobicContact CB-CB 4.03Å; P427-F508 HydrophobicContact CB-CD2 4.19Å; P427-F508 HydrophobicContact CB-CG 4.04Å; P427-F508 HydrophobicContact CG-CB 4.19Å; P427-F508 HydrophobicContact CG-CD1 4.02Å; P427-F508 HydrophobicContact CG-CD2 4.38Å; P427-F508 HydrophobicContact CG-CG 3.95Å
428	G	80.4	Confident	90.7	Very high	53 Å²	53	43.6 Å²	43.6	55%	0.546	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-0.6	178.5	0	0	0	0	0	116.6	E426	E426-G428 PolarHBondContact O-N 3.42Å
429	G	85.6	Confident	90.7	Very high	24 Å²	24	43.5 Å²	43.5	25%	0.247	24%	0.238	C	C	.	.	S	Bend	trans	-77.3	-177.5	178.6	0	0	0	0	0	114	E426 K433	E426-G429 PolarHBondContact O-N 3.16Å; G429-K433 PolarHBondContact O-NZ 3.26Å
430	D	84.6	Confident	90.7	Very high	176 Å²	176	37 Å²	37	94%	0.941	21%	0.207	S	C	*	.	S	Bend	trans	-85.4	-6.7	178.7	-67.3	-42.7	0	0	0	113.8
431	D	87.8	Confident	90.7	Very high	62 Å²	62	33.5 Å²	33.5	33%	0.332	19%	0.194	S	C	.	.	S	Bend	trans	-70.8	153.7	-175.5	-59.1	-66.5	0	0	0	114.4	I425 K433 H799	I425-D431 HydrophobicContact CD1-CB 3.9Å; I425-D431 HydrophobicContact CG2-CB 4.16Å; D431-K433 WeakPolarHBondContact O-CD 3.36Å; D431-K433 WeakPolarHBondContact O-CE 3.25Å; D431-K433 PolarHBondContact O-N 3.09Å; D431-H799 IonicContact OD1-CE1 3.23Å; D431-H799 PolarHBondContact OD1-CE1 2.99Å; D431-H799 VanDerWaalsContact OD1-CE1 3.31Å
432	H	89.1	Confident	90.6	Very high	30 Å²	30	33.5 Å²	33.5	14%	0.139	19%	0.194	C	C	.	.			trans	-63.5	124.4	-178.2	-170.9	-79.1	0	0	0	112	L434 T435 Q627 D793 S795 I796	H432-L434 PolarHBondContact ND1-N 2.97Å; H432-L434 PolarHBondContact O-N 3.48Å; H432-T435 VanDerWaalsContact O-CB 3.28Å; H432-T435 WeakPolarHBondContact O-CB 3.48Å; H432-T435 PolarHBondContact O-N 3.25Å; H432-T435 PolarHBondContact O-OG1 2.95Å; H432-Q627 PolarHBondContact CD2-NE2 3.03Å; H432-Q627 PolarHBondContact CE1-OE1 3.09Å; H432-Q627 PolarHBondContact NE2-NE2 3.23Å; H432-Q627 PolarHBondContact NE2-OE1 2.95Å; H432-D793 IonicContact CD2-OD2 3.48Å; H432-D793 PolarHBondContact CD2-OD2 2.99Å; H432-D793 IonicContact NE2-OD2 2.77Å; H432-S795 WeakPolarHBondContact CB-OG 3.22Å; H432-I796 HydrophobicContact CB-CG1 4.06Å
433	K	92.5	Very high	90.6	Very high	20 Å²	20	32.3 Å²	32.3	9%	0.087	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-29	-160.9	-52.6	-64.7	172.3	-176.8	0	114.1	P427 G429 D431 T435 P436 F508 N512 Q625 L626 Q627	P427-K433 PolarHBondContact O-NZ 2.99Å; G429-K433 PolarHBondContact O-NZ 3.26Å; D431-K433 WeakPolarHBondContact O-CD 3.36Å; D431-K433 WeakPolarHBondContact O-CE 3.25Å; D431-K433 PolarHBondContact O-N 3.09Å; K433-T435 VanDerWaalsContact C-N 3.3Å; K433-T435 PolarHBondContact O-N 3.26Å; K433-P436 WeakPolarHBondContact O-CD 3.45Å; K433-F508 HydrophobicContact CB-CD2 4.32Å; K433-F508 HydrophobicContact CB-CE2 4.22Å; K433-F508 HydrophobicContact CD-CD2 4.28Å; K433-F508 HydrophobicContact CD-CE2 4.22Å; K433-F508 VanDerWaalsContact O-CE2 3.31Å; K433-F508 WeakPolarHBondContact O-CE2 3.47Å; K433-N512 PolarHBondContact O-ND2 3.37Å; K433-N512 PolarHBondContact O-OD1 3.38Å; K433-Q625 WeakPolarHBondContact CG-O 3.5Å; K433-L626 HydrophobicContact CD-CD2 4.29Å; K433-Q627 HydrophobicContact CB-CB 4.36Å; K433-Q627 HydrophobicContact CB-CG 4.24Å; K433-Q627 HydrophobicContact CG-CG 4.31Å
434	L	93.7	Very high	90.6	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.01	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	8.4	176.9	-57.5	173.8	0	0	0	113.9	H432 P436 A437 F438 E515 Q627 Q784 V785	H432-L434 PolarHBondContact ND1-N 2.97Å; H432-L434 PolarHBondContact O-N 3.48Å; L434-P436 VanDerWaalsContact C-CD 3.5Å; L434-A437 PolarHBondContact O-N 3.38Å; L434-F438 PolarHBondContact O-N 3.14Å; L434-E515 HydrophobicContact CD1-CG 3.85Å; L434-E515 HydrophobicContact CD2-CG 3.83Å; L434-E515 HydrophobicContact CG-CG 4.37Å; L434-Q627 HydrophobicContact CD1-CB 4.21Å; L434-Q627 HydrophobicContact CG-CB 4.15Å; L434-Q784 HydrophobicContact CD1-CB 3.85Å; L434-Q784 HydrophobicContact CD1-CG 4.48Å; L434-V785 HydrophobicContact CB-CG2 4.17Å
435	T	92.6	Very high	90.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-55.8	-41.3	175.8	-57.7	0	0	0	0	113.3	I425 H432 K433 F438 L439 H799	I425-T435 HydrophobicContact CD1-CG2 4.25Å; I425-T435 HydrophobicContact CG1-CG2 4.4Å; H432-T435 VanDerWaalsContact O-CB 3.28Å; H432-T435 WeakPolarHBondContact O-CB 3.48Å; H432-T435 PolarHBondContact O-N 3.25Å; H432-T435 PolarHBondContact O-OG1 2.95Å; K433-T435 VanDerWaalsContact C-N 3.3Å; K433-T435 PolarHBondContact O-N 3.26Å; T435-F438 PolarHBondContact O-N 3.28Å; T435-L439 HydrophobicContact CG2-CD1 3.84Å; T435-L439 HydrophobicContact CG2-CG 4.32Å; T435-L439 WeakPolarHBondContact O-CB 3.42Å; T435-L439 VanDerWaalsContact O-CG 3.29Å; T435-L439 WeakPolarHBondContact O-CG 3.48Å; T435-L439 PolarHBondContact O-N 3.02Å; T435-H799 HydrophobicContact CG2-CB 3.59Å
436	P	95.2	Very high	90.5	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-61.6	-48	174.9	-20.6	32.1	0	0	0	112.4	I421 I425 K433 L434 F438 L439 L440 F508 W509 N512	I421-P436 HydrophobicContact CG2-CB 4.17Å; I425-P436 HydrophobicContact CB-CG 4.39Å; I425-P436 HydrophobicContact CG1-CG 4.11Å; K433-P436 WeakPolarHBondContact O-CD 3.45Å; L434-P436 VanDerWaalsContact C-CD 3.5Å; P436-F438 VanDerWaalsContact C-N 3.35Å; P436-F438 PolarHBondContact O-N 3.4Å; P436-L439 PolarHBondContact O-N 2.69Å; P436-L440 WeakPolarHBondContact O-CB 3.45Å; P436-L440 WeakPolarHBondContact O-CD1 3.47Å; P436-L440 WeakPolarHBondContact O-CG 3.28Å; P436-L440 PolarHBondContact O-N 3.03Å; P436-F508 HydrophobicContact CG-CE1 4.15Å; P436-F508 HydrophobicContact CG-CZ 3.71Å; P436-W509 HydrophobicContact CB-CH2 3.81Å; P436-W509 HydrophobicContact CB-CZ3 4.07Å; P436-W509 HydrophobicContact CG-CH2 4.39Å; P436-N512 WeakPolarHBondContact CD-OD1 3.32Å
437	A	94.9	Very high	90.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-56.5	-48	176.3	0	0	0	0	0	111.4	L434 L439 L440 C441 N512 E515 V785	L434-A437 PolarHBondContact O-N 3.38Å; A437-L439 PolarHBondContact O-N 2.74Å; A437-L440 PolarHBondContact O-N 3.08Å; A437-C441 WeakPolarHBondContact O-CB 3.27Å; A437-C441 PolarHBondContact O-N 3.04Å; A437-C441 PolarHBondContact O-SG 3.34Å; A437-N512 HydrophobicContact CB-CB 4.09Å; A437-N512 VanDerWaalsContact CB-OD1 3.29Å; A437-N512 WeakPolarHBondContact CB-OD1 3.46Å; A437-N512 PolarHBondContact N-OD1 3.46Å; A437-E515 HydrophobicContact CB-CB 4.21Å; A437-V785 HydrophobicContact CB-CG2 4.14Å
438	F	93.6	Very high	90.8	Very high	6 Å²	6	21.3 Å²	21.3	3%	0.026	13%	0.129	C	C	.	.	H	α-helix	trans	-56.8	-46.9	176.4	-176.4	-89.3	0	0	0	112.9	L405 L434 T435 P436 C441 L442 V785 L787 L792 I796	L405-F438 HydrophobicContact CD1-CZ 4.34Å; L434-F438 PolarHBondContact O-N 3.14Å; T435-F438 PolarHBondContact O-N 3.28Å; P436-F438 VanDerWaalsContact C-N 3.35Å; P436-F438 PolarHBondContact O-N 3.4Å; F438-C441 PolarHBondContact O-N 2.94Å; F438-L442 HydrophobicContact CD1-CD1 3.96Å; F438-L442 HydrophobicContact CE1-CD1 3.47Å; F438-L442 VanDerWaalsContact CE1-CD1 3.47Å; F438-L442 HydrophobicContact CE1-CG 4.19Å; F438-L442 HydrophobicContact CZ-CD1 4.19Å; F438-L442 PolarHBondContact O-N 2.92Å; F438-V785 HydrophobicContact CB-CG1 4.3Å; F438-V785 HydrophobicContact CD2-CG1 4.21Å; F438-L787 HydrophobicContact CD2-CD2 3.73Å; F438-L787 HydrophobicContact CE2-CD2 3.48Å; F438-L787 VanDerWaalsContact CE2-CD2 3.48Å; F438-L787 HydrophobicContact CG-CD2 4.36Å; F438-L787 HydrophobicContact CZ-CD2 3.92Å; F438-L792 HydrophobicContact CE1-CD1 4.11Å; F438-L792 HydrophobicContact CE2-CD1 4.29Å; F438-L792 HydrophobicContact CE2-CD2 3.62Å; F438-L792 HydrophobicContact CZ-CD1 3.54Å; F438-L792 HydrophobicContact CZ-CD2 3.74Å; F438-L792 HydrophobicContact CZ-CG 4.31Å; F438-I796 HydrophobicContact CB-CG2 4.33Å; F438-I796 HydrophobicContact CD1-CG2 3.33Å; F438-I796 HydrophobicContact CD2-CG2 4.34Å; F438-I796 HydrophobicContact CE1-CG2 3.61Å; F438-I796 HydrophobicContact CG-CG2 3.75Å; F438-I796 HydrophobicContact CZ-CG2 4.26Å
439	L	93.4	Very high	91.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-67.2	-34.9	177.8	-68.4	170.1	0	0	0	112.8	I421 L424 T435 P436 A437 L442 C443 L800 I803	I421-L439 HydrophobicContact CD1-CB 4.1Å; I421-L439 HydrophobicContact CG1-CB 4.32Å; I421-L439 HydrophobicContact CG1-CD1 4.45Å; I421-L439 HydrophobicContact CG2-CB 4.14Å; I421-L439 HydrophobicContact CG2-CD1 4.49Å; L424-L439 HydrophobicContact CD2-CD1 3.44Å; L424-L439 VanDerWaalsContact CD2-CD1 3.44Å; T435-L439 HydrophobicContact CG2-CD1 3.84Å; T435-L439 HydrophobicContact CG2-CG 4.32Å; T435-L439 WeakPolarHBondContact O-CB 3.42Å; T435-L439 VanDerWaalsContact O-CG 3.29Å; T435-L439 WeakPolarHBondContact O-CG 3.48Å; T435-L439 PolarHBondContact O-N 3.02Å; P436-L439 PolarHBondContact O-N 2.69Å; A437-L439 PolarHBondContact O-N 2.74Å; L439-L442 WeakPolarHBondContact O-CB 3.5Å; L439-L442 PolarHBondContact O-N 3.35Å; L439-C443 PolarHBondContact O-N 3.31Å; L439-C443 PolarHBondContact O-SG 3.12Å; L439-C443 VanDerWaalsContact O-SG 3.42Å; L439-L800 HydrophobicContact CD2-CB 4.18Å; L439-L800 HydrophobicContact CD2-CD1 3.99Å; L439-I803 HydrophobicContact CD1-CG1 4.16Å
440	L	95.1	Very high	90.9	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-69.7	-40.8	175.1	-67.8	166.3	0	0	0	111.5	L418 I421 M422 P436 A437 L442 C443 I444 I463 I467 W509 L516	L418-L440 HydrophobicContact CD2-CD2 3.6Å; I421-L440 HydrophobicContact CG2-CD2 4.17Å; I421-L440 HydrophobicContact CG2-CG 4.05Å; M422-L440 HydrophobicContact CE-CD1 3.66Å; M422-L440 HydrophobicContact CE-CD2 3.87Å; M422-L440 HydrophobicContact CE-CG 4.37Å; P436-L440 WeakPolarHBondContact O-CB 3.45Å; P436-L440 WeakPolarHBondContact O-CD1 3.47Å; P436-L440 WeakPolarHBondContact O-CG 3.28Å; P436-L440 PolarHBondContact O-N 3.03Å; A437-L440 PolarHBondContact O-N 3.08Å; L440-L442 VanDerWaalsContact C-N 3.29Å; L440-L442 PolarHBondContact O-N 3.46Å; L440-C443 WeakPolarHBondContact O-CB 3.49Å; L440-C443 PolarHBondContact O-N 3.06Å; L440-C443 VanDerWaalsContact O-N 3.1Å; L440-I444 VanDerWaalsContact O-CG1 3.27Å; L440-I444 WeakPolarHBondContact O-CG1 3.49Å; L440-I444 PolarHBondContact O-N 2.92Å; L440-I463 HydrophobicContact CD1-CG2 4.03Å; L440-I463 HydrophobicContact CD2-CD1 4.06Å; L440-I463 HydrophobicContact CD2-CG1 4.06Å; L440-I463 HydrophobicContact CD2-CG2 3.99Å; L440-I463 HydrophobicContact CG-CG2 4.42Å; L440-I467 HydrophobicContact CD1-CD1 4.24Å; L440-W509 HydrophobicContact CD1-CZ3 4.47Å; L440-L516 HydrophobicContact CB-CD1 4.22Å; L440-L516 HydrophobicContact CD1-CD2 4.46Å
441	C	93.9	Very high	90.9	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.1	-38	173.2	-65.9	0	0	0	0	111.4	A437 F438 I444 Q445 F519 V785 L787	A437-C441 WeakPolarHBondContact O-CB 3.27Å; A437-C441 PolarHBondContact O-N 3.04Å; A437-C441 PolarHBondContact O-SG 3.34Å; F438-C441 PolarHBondContact O-N 2.94Å; C441-I444 PolarHBondContact O-N 3.44Å; C441-Q445 WeakPolarHBondContact O-CB 3.29Å; C441-Q445 PolarHBondContact O-N 3.38Å; C441-F519 HydrophobicContact CB-CD1 3.85Å; C441-F519 HydrophobicContact CB-CD2 3.91Å; C441-F519 HydrophobicContact CB-CE1 3.79Å; C441-F519 HydrophobicContact CB-CE2 3.85Å; C441-F519 HydrophobicContact CB-CG 3.92Å; C441-F519 HydrophobicContact CB-CZ 3.79Å; C441-F519 VanDerWaalsContact SG-CD1 3.52Å; C441-F519 WeakPolarHBondContact SG-CG 3.5Å; C441-V785 HydrophobicContact CB-CG1 4.21Å; C441-L787 HydrophobicContact CB-CD1 3.97Å; C441-L787 HydrophobicContact CB-CD2 4.21Å; C441-L787 HydrophobicContact CB-CG 4.38Å
442	L	91.7	Very high	90.4	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.01	12%	0.115	C	C	.	.	H	α-helix	trans	-64.8	-39.7	170.1	-74.4	176.3	0	0	0	113.4	L405 L407 F438 L439 L440 I444 Q445 H446 L787 L800	L405-L442 HydrophobicContact CB-CD2 4.25Å; L405-L442 WeakPolarHBondContact O-CD2 3.47Å; L407-L442 HydrophobicContact CB-CB 4Å; L407-L442 HydrophobicContact CD2-CB 4.22Å; F438-L442 HydrophobicContact CD1-CD1 3.96Å; F438-L442 HydrophobicContact CE1-CD1 3.47Å; F438-L442 VanDerWaalsContact CE1-CD1 3.47Å; F438-L442 HydrophobicContact CE1-CG 4.19Å; F438-L442 HydrophobicContact CZ-CD1 4.19Å; F438-L442 PolarHBondContact O-N 2.92Å; L439-L442 WeakPolarHBondContact O-CB 3.5Å; L439-L442 PolarHBondContact O-N 3.35Å; L440-L442 VanDerWaalsContact C-N 3.29Å; L440-L442 PolarHBondContact O-N 3.46Å; L442-I444 VanDerWaalsContact C-N 3.33Å; L442-Q445 PolarHBondContact O-N 3.2Å; L442-H446 WeakPolarHBondContact O-CB 3.44Å; L442-H446 PolarHBondContact O-N 3.29Å; L442-L787 HydrophobicContact CD2-CD1 4.15Å; L442-L787 HydrophobicContact CD2-CD2 4.05Å; L442-L787 HydrophobicContact CG-CD2 4.01Å; L442-L800 HydrophobicContact CD1-CD1 3.74Å; L442-L800 HydrophobicContact CD1-CD2 4.12Å
443	C	92.9	Very high	89.5	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.9	-42.1	173	-73.4	0	0	0	0	111.9	F409 L439 L440 H446 S447 L459	F409-C443 HydrophobicContact CE1-CB 4.09Å; F409-C443 HydrophobicContact CZ-CB 4.28Å; L439-C443 PolarHBondContact O-N 3.31Å; L439-C443 PolarHBondContact O-SG 3.12Å; L439-C443 VanDerWaalsContact O-SG 3.42Å; L440-C443 WeakPolarHBondContact O-CB 3.49Å; L440-C443 PolarHBondContact O-N 3.06Å; L440-C443 VanDerWaalsContact O-N 3.1Å; C443-H446 PolarHBondContact O-N 3.39Å; C443-S447 WeakPolarHBondContact O-CB 3.49Å; C443-S447 PolarHBondContact O-N 3.42Å; C443-L459 HydrophobicContact CB-CD2 4.49Å
444	I	92.1	Very high	88.7	Confident	2 Å²	2	24.3 Å²	24.3	1%	0.01	13%	0.128	C	C	.	.	H	α-helix	trans	-64.8	-45.4	178.1	-70.2	166.7	0	0	0	110.6	L440 C441 L442 S447 A448 F456 L460 I463 L516 F519 I520 Y527	L440-I444 VanDerWaalsContact O-CG1 3.27Å; L440-I444 WeakPolarHBondContact O-CG1 3.49Å; L440-I444 PolarHBondContact O-N 2.92Å; C441-I444 PolarHBondContact O-N 3.44Å; L442-I444 VanDerWaalsContact C-N 3.33Å; I444-S447 PolarHBondContact O-N 3.49Å; I444-A448 WeakPolarHBondContact O-CB 3.49Å; I444-A448 PolarHBondContact O-N 2.68Å; I444-F456 HydrophobicContact CG2-CE2 3.65Å; I444-F456 HydrophobicContact CG2-CZ 4.37Å; I444-L460 HydrophobicContact CD1-CD2 3.68Å; I444-L460 HydrophobicContact CG1-CD2 3.86Å; I444-L460 HydrophobicContact CG2-CD2 3.93Å; I444-I463 HydrophobicContact CD1-CD1 3.93Å; I444-I463 HydrophobicContact CG1-CD1 3.76Å; I444-L516 HydrophobicContact CD1-CD1 3.6Å; I444-F519 HydrophobicContact CB-CE1 4.31Å; I444-F519 HydrophobicContact CG2-CE1 3.96Å; I444-I520 HydrophobicContact CD1-CD1 4.34Å; I444-I520 HydrophobicContact CD1-CG1 4.27Å; I444-Y527 HydrophobicContact CG2-CE2 4.49Å
445	Q	90.9	Very high	88.1	Confident	48 Å²	48	27 Å²	27	22%	0.224	14%	0.141	C	C	.	.	H	α-helix	trans	-60.1	-49.2	174.9	179.8	178.3	-7.5	0	0	111.8	C441 L442 S447 A448 T449 L787	C441-Q445 WeakPolarHBondContact O-CB 3.29Å; C441-Q445 PolarHBondContact O-N 3.38Å; L442-Q445 PolarHBondContact O-N 3.2Å; Q445-S447 VanDerWaalsContact C-N 3.32Å; Q445-S447 PolarHBondContact O-N 3.19Å; Q445-A448 WeakPolarHBondContact O-CB 3.37Å; Q445-A448 PolarHBondContact O-N 3.49Å; Q445-T449 PolarHBondContact O-N 3.38Å; Q445-T449 VanDerWaalsContact O-N 3.09Å; Q445-T449 PolarHBondContact O-OG1 2.99Å; Q445-L787 HydrophobicContact CB-CD1 4.34Å
446	H	89.9	Confident	87.9	Confident	11 Å²	11	27 Å²	27	5%	0.051	14%	0.141	C	C	.	.	H	α-helix	trans	-61.4	-41.2	179.2	178.2	77	0	0	0	112	L407 F409 L442 C443 T449 H450 F451	L407-H446 WeakPolarHBondContact O-CB 3.23Å; L407-H446 PolarHBondContact O-ND1 3.3Å; F409-H446 AromaticContact CD1-CD2 3.49Å; F409-H446 VanDerWaalsContact CD1-CD2 3.49Å; F409-H446 WeakPolarHBondContact CD1-CD2 3.48Å; F409-H446 HydrophobicContact CE1-CB 4.16Å; F409-H446 AromaticContact CE1-CD2 3.48Å; F409-H446 VanDerWaalsContact CE1-CD2 3.48Å; F409-H446 WeakPolarHBondContact CE1-CD2 3.39Å; F409-H446 PolarHBondContact N-NE2 3.44Å; F409-H446 PolarHBondContact O-NE2 3.42Å; L442-H446 WeakPolarHBondContact O-CB 3.44Å; L442-H446 PolarHBondContact O-N 3.29Å; C443-H446 PolarHBondContact O-N 3.39Å; H446-T449 PolarHBondContact O-N 3.26Å; H446-H450 AromaticContact CE1-CD2 3.45Å; H446-H450 PolarHBondContact CE1-CD2 2.97Å; H446-H450 VanDerWaalsContact CE1-CD2 3.45Å; H446-H450 AromaticContact CE1-CG 3.76Å; H446-H450 AromaticContact ND1-CD2 3.2Å; H446-H450 PolarHBondContact ND1-CD2 3.04Å; H446-H450 AromaticContact ND1-CG 3.95Å; H446-H450 WeakPolarHBondContact O-CB 3.33Å; H446-H450 PolarHBondContact O-CD2 3Å; H446-H450 PolarHBondContact O-N 3.2Å; H446-F451 AromaticContact CD2-CE1 3.76Å; H446-F451 AromaticContact NE2-CE1 3.61Å
447	S	90.3	Very high	87.5	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-63.1	-44.2	176.2	-169.8	0	0	0	0	112.1	C443 I444 Q445 T449 F451 F456	C443-S447 WeakPolarHBondContact O-CB 3.49Å; C443-S447 PolarHBondContact O-N 3.42Å; I444-S447 PolarHBondContact O-N 3.49Å; Q445-S447 VanDerWaalsContact C-N 3.32Å; Q445-S447 PolarHBondContact O-N 3.19Å; S447-T449 VanDerWaalsContact C-N 3.31Å; S447-T449 PolarHBondContact O-N 2.87Å; S447-F451 WeakPolarHBondContact O-CB 3.48Å; S447-F451 PolarHBondContact O-N 3.44Å; S447-F451 WeakPolarHBondContact OG-CD2 3.27Å; S447-F456 WeakPolarHBondContact OG-CA 3.48Å
448	A	87.1	Confident	87.2	Confident	9 Å²	9	32.6 Å²	32.6	7%	0.074	17%	0.168	C	C	.	.	H	α-helix	trans	-60.8	-35.6	176.7	0	0	0	0	0	113.6	I444 Q445 F456 Y527	I444-A448 WeakPolarHBondContact O-CB 3.49Å; I444-A448 PolarHBondContact O-N 2.68Å; Q445-A448 WeakPolarHBondContact O-CB 3.37Å; Q445-A448 PolarHBondContact O-N 3.49Å; A448-F456 HydrophobicContact CB-CD2 3.72Å; A448-F456 HydrophobicContact CB-CE2 3.69Å; A448-Y527 HydrophobicContact CB-CD1 4.04Å; A448-Y527 HydrophobicContact CB-CD2 3.79Å; A448-Y527 HydrophobicContact CB-CE2 4.35Å; A448-Y527 HydrophobicContact CB-CG 3.64Å
449	T	85.6	Confident	87.2	Confident	72 Å²	72	32.3 Å²	32.3	44%	0.442	17%	0.166	S	C	.	.	H	α-helix	trans	-98.3	-12.1	-174.6	61.2	0	0	0	0	114.9	Q445 H446 S447	Q445-T449 PolarHBondContact O-N 3.38Å; Q445-T449 VanDerWaalsContact O-N 3.09Å; Q445-T449 PolarHBondContact O-OG1 2.99Å; H446-T449 PolarHBondContact O-N 3.26Å; S447-T449 VanDerWaalsContact C-N 3.31Å; S447-T449 PolarHBondContact O-N 2.87Å
450	H	82.2	Confident	87.2	Confident	112 Å²	112	32.4 Å²	32.4	52%	0.519	17%	0.167	S	C	.	.	H	α-helix	trans	-134.5	-11.2	-173.5	-61.8	-68.3	0	0	0	116.5	H446	H446-H450 AromaticContact CE1-CD2 3.45Å; H446-H450 PolarHBondContact CE1-CD2 2.97Å; H446-H450 VanDerWaalsContact CE1-CD2 3.45Å; H446-H450 AromaticContact CE1-CG 3.76Å; H446-H450 AromaticContact ND1-CD2 3.2Å; H446-H450 PolarHBondContact ND1-CD2 3.04Å; H446-H450 AromaticContact ND1-CG 3.95Å; H446-H450 WeakPolarHBondContact O-CB 3.33Å; H446-H450 PolarHBondContact O-CD2 3Å; H446-H450 PolarHBondContact O-N 3.2Å
451	F	84.2	Confident	87.1	Confident	24 Å²	24	33.4 Å²	33.4	11%	0.105	17%	0.172	C	C	.	.	S	Bend	trans	-100.2	163	179.8	-66.7	1.7	0	0	0	112.4	F409 P411 H446 S447 M455	F409-F451 AromaticContact CD2-CZ 3.87Å; F409-F451 HydrophobicContact CD2-CZ 3.87Å; F409-F451 HydrophobicContact CE1-CZ 4.37Å; F409-F451 AromaticContact CE2-CE2 3.78Å; F409-F451 HydrophobicContact CE2-CE2 3.78Å; F409-F451 AromaticContact CE2-CZ 3.47Å; F409-F451 HydrophobicContact CE2-CZ 3.47Å; F409-F451 VanDerWaalsContact CE2-CZ 3.47Å; F409-F451 HydrophobicContact CG-CZ 4.47Å; F409-F451 AromaticContact CZ-CE2 3.96Å; F409-F451 HydrophobicContact CZ-CE2 3.96Å; F409-F451 AromaticContact CZ-CZ 3.75Å; F409-F451 HydrophobicContact CZ-CZ 3.75Å; P411-F451 HydrophobicContact CB-CE2 4.17Å; P411-F451 HydrophobicContact CB-CZ 4.29Å; P411-F451 HydrophobicContact CG-CD1 4Å; P411-F451 HydrophobicContact CG-CD2 4.09Å; P411-F451 HydrophobicContact CG-CE1 3.79Å; P411-F451 HydrophobicContact CG-CE2 3.89Å; P411-F451 HydrophobicContact CG-CG 4.17Å; P411-F451 HydrophobicContact CG-CZ 3.74Å; H446-F451 AromaticContact CD2-CE1 3.76Å; H446-F451 AromaticContact NE2-CE1 3.61Å; S447-F451 WeakPolarHBondContact O-CB 3.48Å; S447-F451 PolarHBondContact O-N 3.44Å; S447-F451 WeakPolarHBondContact OG-CD2 3.27Å; F451-M455 HydrophobicContact CB-CB 4Å; F451-M455 HydrophobicContact CD2-CB 4.29Å
452	E	77.5	Confident	87.1	Confident	153 Å²	153	35.8 Å²	35.8	72%	0.715	18%	0.182	S	C	*	.	P	Polyproline II helix	trans	-67.4	147.2	179.4	-63.2	-174.1	161.9	0	0	112.3	G454 M455	E452-G454 PolarHBondContact O-N 3.24Å; E452-M455 HydrophobicContact CB-CG 4.37Å; E452-M455 WeakPolarHBondContact O-CB 3.44Å; E452-M455 PolarHBondContact O-N 3.41Å
453	P	70.4	Confident	87.3	Confident	55 Å²	55	35.8 Å²	35.8	36%	0.357	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	125.9	179.5	-28.3	35.8	0	0	0	113.2	M531 L535	P453-M531 HydrophobicContact CB-CE 4.3Å; P453-M531 HydrophobicContact CG-CE 4.25Å; P453-L535 HydrophobicContact CG-CD1 3.82Å
454	G	74.6	Confident	87.5	Confident	13 Å²	13	35.9 Å²	35.9	13%	0.134	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.9	-28.9	-175.3	0	0	0	0	0	114.6	E452 F456 G457 Q458	E452-G454 PolarHBondContact O-N 3.24Å; G454-F456 VanDerWaalsContact C-N 3.32Å; G454-F456 PolarHBondContact O-N 2.99Å; G454-G457 PolarHBondContact O-N 2.84Å; G454-Q458 PolarHBondContact O-N 2.84Å
455	M	82.8	Confident	87.7	Confident	57 Å²	57	40.7 Å²	40.7	28%	0.281	20%	0.201	S	C	.	.	H	α-helix	trans	-64.4	-38.3	176.5	-65.9	-58.3	-60.9	0	0	111.9	F451 E452 G457 Q458 L459	F451-M455 HydrophobicContact CB-CB 4Å; F451-M455 HydrophobicContact CD2-CB 4.29Å; E452-M455 HydrophobicContact CB-CG 4.37Å; E452-M455 WeakPolarHBondContact O-CB 3.44Å; E452-M455 PolarHBondContact O-N 3.41Å; M455-G457 PolarHBondContact O-N 3.04Å; M455-Q458 WeakPolarHBondContact O-CB 3.4Å; M455-Q458 PolarHBondContact O-N 3.4Å; M455-Q458 VanDerWaalsContact O-N 3.15Å; M455-L459 PolarHBondContact O-N 3.42Å
456	F	86.9	Confident	87.9	Confident	1 Å²	1	41 Å²	41	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-55.1	-44.7	174.1	167.3	-101.8	0	0	0	113.1	I444 S447 A448 G454 Q458 L459 L460 C524 Y527 T548	I444-F456 HydrophobicContact CG2-CE2 3.65Å; I444-F456 HydrophobicContact CG2-CZ 4.37Å; S447-F456 WeakPolarHBondContact OG-CA 3.48Å; A448-F456 HydrophobicContact CB-CD2 3.72Å; A448-F456 HydrophobicContact CB-CE2 3.69Å; G454-F456 VanDerWaalsContact C-N 3.32Å; G454-F456 PolarHBondContact O-N 2.99Å; F456-Q458 VanDerWaalsContact C-N 3.34Å; F456-Q458 PolarHBondContact O-N 3.42Å; F456-L459 PolarHBondContact O-N 2.93Å; F456-L460 HydrophobicContact CD1-CD1 4.3Å; F456-L460 HydrophobicContact CE1-CD1 3.72Å; F456-L460 HydrophobicContact CE2-CD1 4.37Å; F456-L460 HydrophobicContact CE2-CG 4.5Å; F456-L460 HydrophobicContact CZ-CD1 3.77Å; F456-L460 HydrophobicContact CZ-CG 4.36Å; F456-L460 WeakPolarHBondContact O-CG 3.21Å; F456-L460 PolarHBondContact O-N 3.07Å; F456-L460 VanDerWaalsContact O-N 3.09Å; F456-C524 HydrophobicContact CZ-CB 4.49Å; F456-Y527 HydrophobicContact CE2-CD2 4.19Å; F456-Y527 HydrophobicContact CZ-CD2 4.17Å; F456-T548 HydrophobicContact CD1-CG2 3.73Å; F456-T548 HydrophobicContact CE1-CG2 4.23Å
457	G	87.4	Confident	88.3	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-65.6	-35.9	176.8	0	0	0	0	0	112.8	G454 M455 L460 L461	G454-G457 PolarHBondContact O-N 2.84Å; M455-G457 PolarHBondContact O-N 3.04Å; G457-L460 PolarHBondContact O-N 3.14Å; G457-L461 WeakPolarHBondContact O-CG 3.4Å; G457-L461 PolarHBondContact O-N 2.84Å
458	Q	89.8	Confident	88.5	Confident	118 Å²	118	44 Å²	44	55%	0.551	22%	0.215	S	C	*	.	H	α-helix	trans	-66.5	-41.4	175	-63.3	177.7	32.5	0	0	111.6	G454 M455 F456 L461 K462	G454-Q458 PolarHBondContact O-N 2.84Å; M455-Q458 WeakPolarHBondContact O-CB 3.4Å; M455-Q458 PolarHBondContact O-N 3.4Å; M455-Q458 VanDerWaalsContact O-N 3.15Å; F456-Q458 VanDerWaalsContact C-N 3.34Å; F456-Q458 PolarHBondContact O-N 3.42Å; Q458-L461 PolarHBondContact O-N 3.36Å; Q458-K462 VanDerWaalsContact O-CB 3.24Å; Q458-K462 WeakPolarHBondContact O-CB 3.32Å; Q458-K462 PolarHBondContact O-N 2.88Å
459	L	92.5	Very high	88.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60	-46.7	174.7	175.5	64	0	0	0	111.9	F409 E414 L418 C443 M455 F456 L461 K462 I463	F409-L459 HydrophobicContact CZ-CD2 4.47Å; E414-L459 HydrophobicContact CG-CD1 3.79Å; L418-L459 HydrophobicContact CD1-CD1 3.89Å; L418-L459 HydrophobicContact CD2-CD1 4.3Å; L418-L459 HydrophobicContact CG-CD1 4.47Å; C443-L459 HydrophobicContact CB-CD2 4.49Å; M455-L459 PolarHBondContact O-N 3.42Å; F456-L459 PolarHBondContact O-N 2.93Å; L459-L461 PolarHBondContact O-N 3.32Å; L459-K462 WeakPolarHBondContact O-CB 3.46Å; L459-K462 PolarHBondContact O-N 3.42Å; L459-I463 HydrophobicContact CD1-CD1 3.79Å; L459-I463 HydrophobicContact CD1-CG1 3.99Å; L459-I463 HydrophobicContact CD2-CD1 4.49Å; L459-I463 HydrophobicContact CG-CD1 3.84Å; L459-I463 HydrophobicContact CG-CG1 4.42Å; L459-I463 WeakPolarHBondContact O-CG1 3.3Å; L459-I463 PolarHBondContact O-N 2.98Å
460	L	93.3	Very high	89.4	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-55.9	-50.2	177.2	-72.1	177.1	0	0	0	111.8	I444 F456 G457 K462 I463 A464 I520 A555	I444-L460 HydrophobicContact CD1-CD2 3.68Å; I444-L460 HydrophobicContact CG1-CD2 3.86Å; I444-L460 HydrophobicContact CG2-CD2 3.93Å; F456-L460 HydrophobicContact CD1-CD1 4.3Å; F456-L460 HydrophobicContact CE1-CD1 3.72Å; F456-L460 HydrophobicContact CE2-CD1 4.37Å; F456-L460 HydrophobicContact CE2-CG 4.5Å; F456-L460 HydrophobicContact CZ-CD1 3.77Å; F456-L460 HydrophobicContact CZ-CG 4.36Å; F456-L460 WeakPolarHBondContact O-CG 3.21Å; F456-L460 PolarHBondContact O-N 3.07Å; F456-L460 VanDerWaalsContact O-N 3.09Å; G457-L460 PolarHBondContact O-N 3.14Å; L460-K462 VanDerWaalsContact C-N 3.32Å; L460-K462 PolarHBondContact O-N 3.48Å; L460-I463 PolarHBondContact O-N 2.9Å; L460-A464 WeakPolarHBondContact O-CB 3.29Å; L460-A464 PolarHBondContact O-N 3.4Å; L460-I520 HydrophobicContact CD2-CD1 3.81Å; L460-I520 HydrophobicContact CD2-CG1 3.86Å; L460-I520 HydrophobicContact CD2-CG2 4.5Å; L460-A555 HydrophobicContact CB-CB 3.85Å
461	L	93.3	Very high	90	Very high	21 Å²	21	41.6 Å²	41.6	11%	0.11	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-41.1	176.8	-75.2	175	0	0	0	112.6	G457 Q458 L459 A464 R465 A551 E554 A555	G457-L461 WeakPolarHBondContact O-CG 3.4Å; G457-L461 PolarHBondContact O-N 2.84Å; Q458-L461 PolarHBondContact O-N 3.36Å; L459-L461 PolarHBondContact O-N 3.32Å; L461-A464 PolarHBondContact O-N 2.94Å; L461-R465 VanDerWaalsContact O-CB 3.29Å; L461-R465 WeakPolarHBondContact O-CB 3.33Å; L461-R465 WeakPolarHBondContact O-CD 3.28Å; L461-R465 WeakPolarHBondContact O-CG 3.3Å; L461-R465 PolarHBondContact O-N 2.95Å; L461-A551 HydrophobicContact CD1-CB 3.71Å; L461-A551 WeakPolarHBondContact CD2-O 3.13Å; L461-A551 HydrophobicContact CG-CB 4.05Å; L461-E554 HydrophobicContact CD2-CB 3.77Å; L461-E554 VanDerWaalsContact CD2-CD 3.42Å; L461-E554 HydrophobicContact CD2-CG 3.64Å; L461-E554 WeakPolarHBondContact CD2-OE1 3.48Å; L461-A555 HydrophobicContact CD2-CB 4.19Å
462	K	94.7	Very high	90.4	Very high	51 Å²	51	46.9 Å²	46.9	22%	0.222	22%	0.22	C	C	.	.	H	α-helix	trans	-66	-45.3	-179	-171.1	176.5	-174.4	166.4	0	111.6	E414 D415 L418 Q458 L459 L460 R465 L466	E414-K462 WeakPolarHBondContact OE1-CD 3.37Å; E414-K462 WeakPolarHBondContact OE1-CE 3.39Å; E414-K462 IonicContact OE1-NZ 3Å; E414-K462 PolarHBondContact OE1-NZ 3.48Å; D415-K462 VanDerWaalsContact CG-CE 3.44Å; D415-K462 WeakPolarHBondContact OD1-CE 3.44Å; D415-K462 IonicContact OD1-NZ 2.65Å; D415-K462 PolarHBondContact OD1-NZ 3.27Å; D415-K462 IonicContact OD2-NZ 3.21Å; D415-K462 PolarHBondContact OD2-NZ 3.39Å; L418-K462 HydrophobicContact CD1-CD 3.9Å; L418-K462 HydrophobicContact CD1-CG 3.94Å; Q458-K462 VanDerWaalsContact O-CB 3.24Å; Q458-K462 WeakPolarHBondContact O-CB 3.32Å; Q458-K462 PolarHBondContact O-N 2.88Å; L459-K462 WeakPolarHBondContact O-CB 3.46Å; L459-K462 PolarHBondContact O-N 3.42Å; L460-K462 VanDerWaalsContact C-N 3.32Å; L460-K462 PolarHBondContact O-N 3.48Å; K462-R465 PolarHBondContact O-N 2.97Å; K462-L466 HydrophobicContact CG-CD1 4.36Å; K462-L466 WeakPolarHBondContact O-CB 3.48Å; K462-L466 VanDerWaalsContact O-CG 3.27Å; K462-L466 WeakPolarHBondContact O-CG 3.32Å; K462-L466 PolarHBondContact O-N 3.1Å
463	I	96.1	Very high	91.2	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-60	-50.9	173.8	-65.2	168.9	0	0	0	110.2	L418 L440 I444 L459 L460 R465 L466 I467 L516	L418-I463 HydrophobicContact CD1-CG1 4.07Å; L418-I463 HydrophobicContact CD2-CD1 4.17Å; L418-I463 HydrophobicContact CD2-CG1 3.73Å; L440-I463 HydrophobicContact CD1-CG2 4.03Å; L440-I463 HydrophobicContact CD2-CD1 4.06Å; L440-I463 HydrophobicContact CD2-CG1 4.06Å; L440-I463 HydrophobicContact CD2-CG2 3.99Å; L440-I463 HydrophobicContact CG-CG2 4.42Å; I444-I463 HydrophobicContact CD1-CD1 3.93Å; I444-I463 HydrophobicContact CG1-CD1 3.76Å; L459-I463 HydrophobicContact CD1-CD1 3.79Å; L459-I463 HydrophobicContact CD1-CG1 3.99Å; L459-I463 HydrophobicContact CD2-CD1 4.49Å; L459-I463 HydrophobicContact CG-CD1 3.84Å; L459-I463 HydrophobicContact CG-CG1 4.42Å; L459-I463 WeakPolarHBondContact O-CG1 3.3Å; L459-I463 PolarHBondContact O-N 2.98Å; L460-I463 PolarHBondContact O-N 2.9Å; I463-R465 VanDerWaalsContact C-N 3.34Å; I463-R465 PolarHBondContact O-N 3.16Å; I463-L466 PolarHBondContact O-N 3.39Å; I463-I467 HydrophobicContact CG2-CD1 3.81Å; I463-I467 WeakPolarHBondContact O-CG1 3.48Å; I463-I467 PolarHBondContact O-N 2.93Å; I463-I467 VanDerWaalsContact O-N 3.07Å; I463-L516 HydrophobicContact CG2-CD2 3.67Å
464	A	96.6	Very high	92.3	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-60.8	-40.7	-179	0	0	0	0	0	112.6	L460 L461 R468 A555 V558 L559	L460-A464 WeakPolarHBondContact O-CB 3.29Å; L460-A464 PolarHBondContact O-N 3.4Å; L461-A464 PolarHBondContact O-N 2.94Å; A464-R468 WeakPolarHBondContact O-CB 3.4Å; A464-R468 PolarHBondContact O-N 3.49Å; A464-A555 HydrophobicContact CB-CB 4.17Å; A464-V558 HydrophobicContact CB-CB 4.09Å; A464-V558 HydrophobicContact CB-CG1 3.82Å; A464-V558 WeakPolarHBondContact O-CG1 3.45Å; A464-L559 HydrophobicContact CB-CD2 4.27Å; A464-L559 HydrophobicContact CB-CG 4.02Å
465	R	95.1	Very high	93.1	Very high	103 Å²	103	43.7 Å²	43.7	39%	0.389	20%	0.196	S	C	.	.	H	α-helix	trans	-69.1	-40.4	177.8	-70.6	167.1	-175.2	179.5	2.9	112.6	L461 K462 I463 R468 E469 E554	L461-R465 VanDerWaalsContact O-CB 3.29Å; L461-R465 WeakPolarHBondContact O-CB 3.33Å; L461-R465 WeakPolarHBondContact O-CD 3.28Å; L461-R465 WeakPolarHBondContact O-CG 3.3Å; L461-R465 PolarHBondContact O-N 2.95Å; K462-R465 PolarHBondContact O-N 2.97Å; I463-R465 VanDerWaalsContact C-N 3.34Å; I463-R465 PolarHBondContact O-N 3.16Å; R465-R468 PolarHBondContact O-N 3.23Å; R465-E469 WeakPolarHBondContact O-CB 3.17Å; R465-E469 WeakPolarHBondContact O-CG 3.36Å; R465-E469 PolarHBondContact O-N 2.95Å; R465-E554 IonicContact CZ-OE1 3.62Å; R465-E554 IonicContact NE-OE1 3.32Å; R465-E554 IonicContact NH2-OE1 2.87Å; R465-E554 PolarHBondContact NH2-OE1 3.41Å; R465-E554 IonicContact NH2-OE2 3.03Å
466	L	96.6	Very high	93.5	Very high	54 Å²	54	45 Å²	45	28%	0.283	20%	0.199	S	C	.	.	H	α-helix	trans	-62.1	-42.8	175.1	-75.5	169.5	0	0	0	112.3	L418 M422 K462 I463 E469 T470	L418-L466 HydrophobicContact CB-CD1 3.94Å; L418-L466 HydrophobicContact CD1-CD1 3.95Å; M422-L466 HydrophobicContact SD-CB 4.43Å; K462-L466 HydrophobicContact CG-CD1 4.36Å; K462-L466 WeakPolarHBondContact O-CB 3.48Å; K462-L466 VanDerWaalsContact O-CG 3.27Å; K462-L466 WeakPolarHBondContact O-CG 3.32Å; K462-L466 PolarHBondContact O-N 3.1Å; I463-L466 PolarHBondContact O-N 3.39Å; L466-E469 PolarHBondContact O-N 3.07Å; L466-T470 WeakPolarHBondContact O-CB 3.3Å; L466-T470 PolarHBondContact O-N 3.17Å; L466-T470 PolarHBondContact O-OG1 2.87Å
467	I	96.5	Very high	93.7	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-67.8	-42.2	177.6	-60.1	166.9	0	0	0	110.4	M422 L440 I463 E469 T470 I471 W509 S513 L516 L559 V562	M422-I467 HydrophobicContact CE-CD1 4.22Å; M422-I467 HydrophobicContact CE-CG1 3.72Å; M422-I467 HydrophobicContact SD-CG1 3.98Å; L440-I467 HydrophobicContact CD1-CD1 4.24Å; I463-I467 HydrophobicContact CG2-CD1 3.81Å; I463-I467 WeakPolarHBondContact O-CG1 3.48Å; I463-I467 PolarHBondContact O-N 2.93Å; I463-I467 VanDerWaalsContact O-N 3.07Å; I467-E469 VanDerWaalsContact C-N 3.35Å; I467-E469 PolarHBondContact O-N 3.29Å; I467-T470 PolarHBondContact O-N 2.96Å; I467-I471 HydrophobicContact CG2-CD1 4.4Å; I467-I471 PolarHBondContact O-N 3.42Å; I467-W509 HydrophobicContact CD1-CE3 4.35Å; I467-W509 HydrophobicContact CD1-CZ3 4.23Å; I467-W509 HydrophobicContact CG1-CE3 3.99Å; I467-W509 HydrophobicContact CG1-CZ3 3.99Å; I467-W509 HydrophobicContact CG2-CB 4.22Å; I467-W509 HydrophobicContact CG2-CD2 4.27Å; I467-W509 HydrophobicContact CG2-CE3 3.85Å; I467-W509 HydrophobicContact CG2-CG 4.45Å; I467-S513 WeakPolarHBondContact CG2-OG 3.41Å; I467-L516 HydrophobicContact CD1-CD2 3.66Å; I467-L559 HydrophobicContact CD1-CD2 4.2Å; I467-V562 HydrophobicContact CG2-CG1 4.3Å
468	R	96.3	Very high	93.7	Very high	75 Å²	75	48.4 Å²	48.4	28%	0.283	22%	0.215	S	C	.	.	H	α-helix	trans	-56.4	-46.8	173.8	-178.3	-173.5	52	64	11.5	112.1	A464 R465 W472 V558 V562	A464-R468 WeakPolarHBondContact O-CB 3.4Å; A464-R468 PolarHBondContact O-N 3.49Å; R465-R468 PolarHBondContact O-N 3.23Å; R468-W472 VanDerWaalsContact O-CB 3.27Å; R468-W472 WeakPolarHBondContact O-CB 3.31Å; R468-W472 PolarHBondContact O-N 3.48Å; R468-V558 HydrophobicContact CB-CG1 4.09Å; R468-V562 HydrophobicContact CB-CG2 3.49Å; R468-V562 VanDerWaalsContact CB-CG2 3.49Å; R468-V562 HydrophobicContact CG-CG2 3.76Å
469	E	95.4	Very high	93.6	Very high	95 Å²	95	44.7 Å²	44.7	44%	0.444	21%	0.205	S	C	.	.	H	α-helix	trans	-66.9	-37.6	179.6	-77.2	159.5	-161.9	0	0	111.9	R465 L466 I467 W472 E473	R465-E469 WeakPolarHBondContact O-CB 3.17Å; R465-E469 WeakPolarHBondContact O-CG 3.36Å; R465-E469 PolarHBondContact O-N 2.95Å; L466-E469 PolarHBondContact O-N 3.07Å; I467-E469 VanDerWaalsContact C-N 3.35Å; I467-E469 PolarHBondContact O-N 3.29Å; E469-W472 PolarHBondContact O-N 2.98Å; E469-E473 PolarHBondContact O-N 3.43Å
470	T	94.9	Very high	93.4	Very high	43 Å²	43	49.5 Å²	49.5	26%	0.264	23%	0.227	S	C	.	.	H	α-helix	trans	-64.3	-46.1	175.7	-56	0	0	0	0	112.1	L466 I467 K474	L466-T470 WeakPolarHBondContact O-CB 3.3Å; L466-T470 PolarHBondContact O-N 3.17Å; L466-T470 PolarHBondContact O-OG1 2.87Å; I467-T470 PolarHBondContact O-N 2.96Å; T470-K474 WeakPolarHBondContact O-CB 3.35Å; T470-K474 VanDerWaalsContact O-CG 3.26Å; T470-K474 WeakPolarHBondContact O-CG 3.43Å; T470-K474 PolarHBondContact O-N 3Å; T470-K474 VanDerWaalsContact O-N 3.16Å
471	I	94.7	Very high	92.9	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.015	24%	0.244	C	C	.	.	H	α-helix	trans	-67.2	-37.6	175.2	-84.5	170	0	0	0	111.7	I467 T475 W509 V562 Y565 A566	I467-I471 HydrophobicContact CG2-CD1 4.4Å; I467-I471 PolarHBondContact O-N 3.42Å; I471-T475 WeakPolarHBondContact O-CB 3.42Å; I471-T475 PolarHBondContact O-N 2.83Å; I471-T475 PolarHBondContact O-OG1 3.21Å; I471-W509 HydrophobicContact CD1-CB 3.39Å; I471-W509 HydrophobicContact CG1-CB 3.61Å; I471-W509 HydrophobicContact CG1-CG 4.45Å; I471-V562 HydrophobicContact CD1-CG1 3.38Å; I471-V562 HydrophobicContact CG1-CG1 4.49Å; I471-Y565 HydrophobicContact CG2-CD1 3.88Å; I471-Y565 HydrophobicContact CG2-CE1 4.16Å; I471-A566 HydrophobicContact CD1-CB 4.27Å
472	W	93.4	Very high	92.3	Very high	136 Å²	136	53 Å²	53	52%	0.515	24%	0.242	S	C	.	.	H	α-helix	trans	-62.9	-52.4	179.4	-178.3	-93.2	0	0	0	112	R468 E469 K474 T475 K476 Y565	R468-W472 VanDerWaalsContact O-CB 3.27Å; R468-W472 WeakPolarHBondContact O-CB 3.31Å; R468-W472 PolarHBondContact O-N 3.48Å; E469-W472 PolarHBondContact O-N 2.98Å; W472-K474 PolarHBondContact O-N 3.46Å; W472-T475 PolarHBondContact O-N 2.99Å; W472-K476 WeakPolarHBondContact O-CB 3.4Å; W472-K476 PolarHBondContact O-N 3.08Å; W472-Y565 HydrophobicContact CE3-CE1 4.37Å; W472-Y565 AromaticContact CE3-CZ 3.99Å; W472-Y565 HydrophobicContact CZ3-CE2 4.25Å
473	E	93.9	Very high	91.5	Very high	80 Å²	80	53.2 Å²	53.2	37%	0.374	25%	0.254	S	S	.	.	H	α-helix	trans	-65.5	-37.9	179	-69.7	-60.3	131	0	0	111.8	E469 T475 K476 E477	E469-E473 PolarHBondContact O-N 3.43Å; E473-T475 PolarHBondContact O-N 3.06Å; E473-K476 WeakPolarHBondContact O-CB 3.35Å; E473-K476 PolarHBondContact O-N 2.98Å; E473-K476 IonicContact OE1-NZ 3.38Å; E473-K476 IonicContact OE2-NZ 2.75Å; E473-K476 PolarHBondContact OE2-NZ 3.47Å; E473-E477 WeakPolarHBondContact O-CG 3.29Å; E473-E477 PolarHBondContact O-N 2.77Å
474	K	92.8	Very high	90.3	Very high	70 Å²	70	60.1 Å²	60.1	30%	0.304	29%	0.286	S	S	.	.	H	α-helix	trans	-66	-35.8	175.1	-70.9	-75.8	164.3	-110.9	0	113.2	T470 W472 E477 L478 P505 I506	T470-K474 WeakPolarHBondContact O-CB 3.35Å; T470-K474 VanDerWaalsContact O-CG 3.26Å; T470-K474 WeakPolarHBondContact O-CG 3.43Å; T470-K474 PolarHBondContact O-N 3Å; T470-K474 VanDerWaalsContact O-N 3.16Å; W472-K474 PolarHBondContact O-N 3.46Å; K474-E477 IonicContact NZ-OE1 2.72Å; K474-E477 PolarHBondContact NZ-OE1 3.06Å; K474-E477 IonicContact NZ-OE2 3.96Å; K474-E477 PolarHBondContact NZ-OE2 3.3Å; K474-L478 PolarHBondContact O-N 2.64Å; K474-L478 VanDerWaalsContact O-N 3.14Å; K474-P505 HydrophobicContact CB-CB 4.41Å; K474-P505 HydrophobicContact CD-CB 3.93Å; K474-P505 HydrophobicContact CD-CG 4.16Å; K474-P505 HydrophobicContact CG-CB 4.06Å; K474-I506 HydrophobicContact CB-CG1 4.32Å
475	T	92.1	Very high	88.8	Confident	4 Å²	4	65.1 Å²	65.1	3%	0.025	31%	0.312	C	S	.	.	H	α-helix	trans	-68.3	-38.1	173.4	-55.5	0	0	0	0	111.5	I471 W472 E473 L478 A479 Y565 Q569	I471-T475 WeakPolarHBondContact O-CB 3.42Å; I471-T475 PolarHBondContact O-N 2.83Å; I471-T475 PolarHBondContact O-OG1 3.21Å; W472-T475 PolarHBondContact O-N 2.99Å; E473-T475 PolarHBondContact O-N 3.06Å; T475-L478 PolarHBondContact O-N 3.05Å; T475-A479 WeakPolarHBondContact O-CB 3.38Å; T475-A479 PolarHBondContact O-N 3.17Å; T475-Y565 HydrophobicContact CG2-CE1 3.98Å; T475-Y565 WeakPolarHBondContact CG2-OH 3.36Å; T475-Q569 HydrophobicContact CG2-CB 4.3Å; T475-Q569 HydrophobicContact CG2-CG 3.6Å
476	K	90.6	Very high	86.9	Confident	83 Å²	83	66 Å²	66	36%	0.361	32%	0.32	S	S	.	.	H	α-helix	trans	-66.5	-44.9	175.9	173.9	-177.6	145.1	-138.8	0	112	W472 E473 L478 A479 E480	W472-K476 WeakPolarHBondContact O-CB 3.4Å; W472-K476 PolarHBondContact O-N 3.08Å; E473-K476 WeakPolarHBondContact O-CB 3.35Å; E473-K476 PolarHBondContact O-N 2.98Å; E473-K476 IonicContact OE1-NZ 3.38Å; E473-K476 IonicContact OE2-NZ 2.75Å; E473-K476 PolarHBondContact OE2-NZ 3.47Å; K476-L478 VanDerWaalsContact C-N 3.32Å; K476-L478 PolarHBondContact O-N 3.45Å; K476-A479 PolarHBondContact O-N 3.45Å; K476-A479 VanDerWaalsContact O-N 3.12Å; K476-E480 WeakPolarHBondContact CE-OE1 3.37Å; K476-E480 WeakPolarHBondContact CG-OE1 3.43Å; K476-E480 WeakPolarHBondContact O-CG 3.22Å; K476-E480 PolarHBondContact O-N 3.02Å
477	E	91.1	Very high	84.3	Confident	73 Å²	73	71.3 Å²	71.3	34%	0.341	34%	0.344	S	S	.	.	H	α-helix	trans	-54.9	-46.8	172.4	-75.4	168.2	-140.9	0	0	111.5	E473 K474 E480 K481	E473-E477 WeakPolarHBondContact O-CG 3.29Å; E473-E477 PolarHBondContact O-N 2.77Å; K474-E477 IonicContact NZ-OE1 2.72Å; K474-E477 PolarHBondContact NZ-OE1 3.06Å; K474-E477 IonicContact NZ-OE2 3.96Å; K474-E477 PolarHBondContact NZ-OE2 3.3Å; E477-E480 PolarHBondContact O-N 2.71Å; E477-K481 VanDerWaalsContact O-CG 3.31Å; E477-K481 WeakPolarHBondContact O-CG 3.16Å; E477-K481 PolarHBondContact O-N 3.47Å
478	L	89.1	Confident	82.2	Confident	1 Å²	1	77.4 Å²	77.4	1%	0.005	38%	0.383	C	S	.	.	H	α-helix	trans	-61.5	-43.8	174.6	167.4	57.2	0	0	0	111.8	K474 T475 K476 E480 K481 Q482 L499 D502 L503 I506 Y573	K474-L478 PolarHBondContact O-N 2.64Å; K474-L478 VanDerWaalsContact O-N 3.14Å; T475-L478 PolarHBondContact O-N 3.05Å; K476-L478 VanDerWaalsContact C-N 3.32Å; K476-L478 PolarHBondContact O-N 3.45Å; L478-E480 PolarHBondContact O-N 3.22Å; L478-K481 PolarHBondContact O-N 2.81Å; L478-Q482 HydrophobicContact CD1-CG 3.56Å; L478-Q482 HydrophobicContact CG-CG 4.43Å; L478-Q482 VanDerWaalsContact O-CB 3.24Å; L478-Q482 WeakPolarHBondContact O-CB 3.48Å; L478-Q482 WeakPolarHBondContact O-CG 3.34Å; L478-Q482 PolarHBondContact O-N 3.04Å; L478-L499 HydrophobicContact CD1-CD1 3.82Å; L478-D502 HydrophobicContact CB-CB 4.33Å; L478-D502 HydrophobicContact CD1-CB 3.72Å; L478-D502 HydrophobicContact CD2-CB 4.46Å; L478-D502 HydrophobicContact CG-CB 4.37Å; L478-L503 HydrophobicContact CD2-CD2 3.74Å; L478-I506 HydrophobicContact CD2-CD1 3.82Å; L478-Y573 HydrophobicContact CD1-CD1 4.44Å; L478-Y573 HydrophobicContact CD1-CE1 4.35Å; L478-Y573 HydrophobicContact CD2-CD2 3.51Å; L478-Y573 HydrophobicContact CD2-CE2 3.48Å; L478-Y573 VanDerWaalsContact CD2-CE2 3.48Å; L478-Y573 HydrophobicContact CD2-CG 4.12Å; L478-Y573 HydrophobicContact CG-CD2 4.15Å; L478-Y573 HydrophobicContact CG-CE1 4.19Å; L478-Y573 HydrophobicContact CG-CE2 3.77Å
479	A	87.4	Confident	79.2	Confident	41 Å²	41	81 Å²	81	34%	0.339	41%	0.407	S	S	.	.	H	α-helix	trans	-63.2	-40.7	177.5	0	0	0	0	0	112.6	T475 K476 Q482 A483 Y573	T475-A479 WeakPolarHBondContact O-CB 3.38Å; T475-A479 PolarHBondContact O-N 3.17Å; K476-A479 PolarHBondContact O-N 3.45Å; K476-A479 VanDerWaalsContact O-N 3.12Å; A479-Q482 PolarHBondContact O-N 3.44Å; A479-A483 WeakPolarHBondContact O-CB 3.41Å; A479-A483 PolarHBondContact O-N 3.09Å; A479-Y573 WeakPolarHBondContact CA-OH 3.37Å
480	E	87.8	Confident	76.5	Confident	100 Å²	100	81.3 Å²	81.3	47%	0.467	42%	0.419	S	S	.	.	H	α-helix	trans	-65.9	-46	177.8	-72.7	173	-166.8	0	0	111.4	K476 E477 L478 Q482 A483 Q484	K476-E480 WeakPolarHBondContact CE-OE1 3.37Å; K476-E480 WeakPolarHBondContact CG-OE1 3.43Å; K476-E480 WeakPolarHBondContact O-CG 3.22Å; K476-E480 PolarHBondContact O-N 3.02Å; E477-E480 PolarHBondContact O-N 2.71Å; L478-E480 PolarHBondContact O-N 3.22Å; E480-Q482 VanDerWaalsContact C-N 3.34Å; E480-Q482 PolarHBondContact O-N 2.88Å; E480-A483 PolarHBondContact O-N 2.93Å; E480-Q484 WeakPolarHBondContact O-CG 3.46Å; E480-Q484 PolarHBondContact O-N 3.26Å; E480-Q484 VanDerWaalsContact O-N 3.1Å
481	K	83.7	Confident	74.1	Confident	82 Å²	82	87.8 Å²	87.8	36%	0.357	45%	0.451	S	S	.	.	H	α-helix	trans	-57.7	-45.3	171.5	-69.1	172.3	-173.9	-171.6	0	111.9	E477 L478 A483 Q484 L485 D502	E477-K481 VanDerWaalsContact O-CG 3.31Å; E477-K481 WeakPolarHBondContact O-CG 3.16Å; E477-K481 PolarHBondContact O-N 3.47Å; L478-K481 PolarHBondContact O-N 2.81Å; K481-A483 VanDerWaalsContact C-N 3.26Å; K481-A483 PolarHBondContact O-N 3.11Å; K481-Q484 PolarHBondContact O-N 3.19Å; K481-L485 WeakPolarHBondContact O-CG 3.49Å; K481-L485 PolarHBondContact O-N 3.13Å; K481-L485 VanDerWaalsContact O-N 3.15Å; K481-D502 WeakPolarHBondContact CD-OD2 3.46Å; K481-D502 IonicContact NZ-OD1 3.33Å; K481-D502 PolarHBondContact NZ-OD1 3.23Å; K481-D502 IonicContact NZ-OD2 3.92Å; K481-D502 PolarHBondContact NZ-OD2 3.49Å
482	Q	79.9	Confident	71.6	Confident	14 Å²	14	91.4 Å²	91.4	7%	0.065	48%	0.482	C	S	.	.	H	α-helix	trans	-71.8	-17.2	-177.9	-72.1	-73.2	-39	0	0	113.9	L478 A479 E480 Q486 Y573	L478-Q482 HydrophobicContact CD1-CG 3.56Å; L478-Q482 HydrophobicContact CG-CG 4.43Å; L478-Q482 VanDerWaalsContact O-CB 3.24Å; L478-Q482 WeakPolarHBondContact O-CB 3.48Å; L478-Q482 WeakPolarHBondContact O-CG 3.34Å; L478-Q482 PolarHBondContact O-N 3.04Å; A479-Q482 PolarHBondContact O-N 3.44Å; E480-Q482 VanDerWaalsContact C-N 3.34Å; E480-Q482 PolarHBondContact O-N 2.88Å; Q482-Q486 WeakPolarHBondContact O-CG 3.41Å; Q482-Y573 HydrophobicContact CB-CE1 4.11Å; Q482-Y573 HydrophobicContact CG-CD1 4.18Å; Q482-Y573 HydrophobicContact CG-CE1 3.79Å
483	A	77	Confident	69.3	Low	57 Å²	57	87.4 Å²	87.4	47%	0.471	48%	0.482	S	S	.	.	H	α-helix	trans	-82.6	-40.6	169.4	0	0	0	0	0	111.8	A479 E480 K481 L485 Q486	A479-A483 WeakPolarHBondContact O-CB 3.41Å; A479-A483 PolarHBondContact O-N 3.09Å; E480-A483 PolarHBondContact O-N 2.93Å; K481-A483 VanDerWaalsContact C-N 3.26Å; K481-A483 PolarHBondContact O-N 3.11Å; A483-L485 PolarHBondContact O-N 3.19Å; A483-Q486 WeakPolarHBondContact O-CB 3.18Å; A483-Q486 PolarHBondContact O-N 2.89Å
484	Q	70.6	Confident	67.4	Low	146 Å²	146	84.6 Å²	84.6	68%	0.682	47%	0.472	S	S	*	.	H	α-helix	trans	-60.6	-33.5	175.4	-67.9	165	15.6	0	0	112	E480 K481 Q486	E480-Q484 WeakPolarHBondContact O-CG 3.46Å; E480-Q484 PolarHBondContact O-N 3.26Å; E480-Q484 VanDerWaalsContact O-N 3.1Å; K481-Q484 PolarHBondContact O-N 3.19Å; Q484-Q486 PolarHBondContact O-N 3.25Å
485	L	66.3	Low	66.3	Low	107 Å²	107	83.5 Å²	83.5	56%	0.56	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	3.3	175	-68.2	171.1	0	0	0	115.1	K481 A483	K481-L485 WeakPolarHBondContact O-CG 3.49Å; K481-L485 PolarHBondContact O-N 3.13Å; K481-L485 VanDerWaalsContact O-N 3.15Å; A483-L485 PolarHBondContact O-N 3.19Å
486	Q	55.4	Low	65.7	Low	120 Å²	120	84 Å²	84	56%	0.561	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	1.6	178.8	-71.4	-172.9	-48.5	0	0	114.9	Q482 A483 Q484	Q482-Q486 WeakPolarHBondContact O-CG 3.41Å; A483-Q486 WeakPolarHBondContact O-CB 3.18Å; A483-Q486 PolarHBondContact O-N 2.89Å; Q484-Q486 PolarHBondContact O-N 3.25Å
487	E	42.4	Very low	65.3	Low	167 Å²	167	83.7 Å²	83.7	78%	0.78	49%	0.491	S	S	*	.	S	Bend	trans	-69.2	143.8	170.5	-67.3	-158.1	159.7	0	0	111.9	I489	E487-I489 PolarHBondContact O-N 2.72Å
488	P	51	Low	64.9	Low	129 Å²	129	84.7 Å²	84.7	84%	0.838	50%	0.498	S	S	*	.	S	Bend	trans	-88.6	62.2	-149.1	35.6	-39.3	0	0	0	115
489	I	34.8	Very low	64.9	Low	151 Å²	151	84.7 Å²	84.7	77%	0.774	50%	0.498	S	S	*	.			trans	-131.5	125	171.7	-54.4	-177.7	0	0	0	111.7	E487	E487-I489 PolarHBondContact O-N 2.72Å
490	S	38.1	Very low	65	Low	100 Å²	100	84.2 Å²	84.2	70%	0.699	49%	0.491	S	S	*	.			trans	70.8	122.3	173.3	-64.2	0	0	0	0	118	A492	S490-A492 PolarHBondContact O-N 2.81Å
491	L	43.7	Very low	65.1	Low	179 Å²	179	82.6 Å²	82.6	94%	0.937	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	28.1	177.1	-155.6	79.5	0	0	0	114.2
492	A	42.7	Very low	65.5	Low	80 Å²	80	80.2 Å²	80.2	66%	0.661	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.7	-12.9	-169.4	0	0	0	0	0	114.2	S490 C494	S490-A492 PolarHBondContact O-N 2.81Å; A492-C494 PolarHBondContact O-N 3.46Å
493	G	44.3	Very low	66.1	Low	51 Å²	51	79.6 Å²	79.6	53%	0.526	48%	0.477	S	S	.	.	S	Bend	trans	-76.4	37.2	-167.5	0	0	0	0	0	117.3
494	C	54.2	Low	66.9	Low	22 Å²	22	78.8 Å²	78.8	15%	0.149	46%	0.464	C	S	.	.			trans	-159.1	66.9	171.7	-164.6	0	0	0	0	111.6	A492 I580	A492-C494 PolarHBondContact O-N 3.46Å; C494-I580 HydrophobicContact CB-CD1 3.9Å
495	A	69.8	Low	68.1	Low	46 Å²	46	73.1 Å²	73.1	38%	0.38	44%	0.44	S	S	.	.			trans	-76.4	150.2	165.8	0	0	0	0	0	109.5	A497 D498 L499	A495-A497 PolarHBondContact O-N 3.45Å; A495-D498 WeakPolarHBondContact CB-OD2 3.34Å; A495-D498 PolarHBondContact N-OD2 2.91Å; A495-D498 WeakPolarHBondContact O-CB 3.33Å; A495-D498 PolarHBondContact O-N 3.32Å; A495-L499 PolarHBondContact O-N 3.08Å
496	M	80.8	Confident	69.5	Low	14 Å²	14	68 Å²	68	7%	0.069	41%	0.413	C	S	.	.	H	α-helix	trans	-59.2	-29.2	174.3	-81.3	-73.2	-74.3	0	0	112.6	D498 L499 V500 V574 V615 A618 A619	M496-D498 PolarHBondContact O-N 3.37Å; M496-L499 PolarHBondContact O-N 2.92Å; M496-L499 VanDerWaalsContact O-N 3.11Å; M496-L499 HydrophobicContact SD-CD2 3.97Å; M496-V500 VanDerWaalsContact O-CG2 3.29Å; M496-V500 WeakPolarHBondContact O-CG2 3.35Å; M496-V500 PolarHBondContact O-N 3.26Å; M496-V574 HydrophobicContact CE-CG1 3.96Å; M496-V574 HydrophobicContact CE-CG2 3.92Å; M496-V574 HydrophobicContact SD-CG1 4.16Å; M496-V574 HydrophobicContact SD-CG2 4.21Å; M496-V615 HydrophobicContact CE-CG1 4.21Å; M496-V615 HydrophobicContact CG-CB 4Å; M496-V615 HydrophobicContact CG-CG1 3.7Å; M496-V615 HydrophobicContact CG-CG2 3.72Å; M496-V615 HydrophobicContact SD-CG1 3.96Å; M496-A618 HydrophobicContact CB-CB 4.4Å; M496-A618 HydrophobicContact CE-CB 4.28Å; M496-A619 HydrophobicContact CE-CB 4.04Å
497	A	81.6	Confident	71.4	Confident	78 Å²	78	62.5 Å²	62.5	65%	0.645	39%	0.387	S	S	*	.	H	α-helix	trans	-58.5	-35.4	174.9	0	0	0	0	0	112.8	A495 L499 P501	A495-A497 PolarHBondContact O-N 3.45Å; A497-L499 VanDerWaalsContact C-N 3.35Å; A497-P501 WeakPolarHBondContact O-CD 3.14Å
498	D	83.2	Confident	74	Confident	93 Å²	93	54.7 Å²	54.7	50%	0.497	35%	0.351	S	S	.	.	H	α-helix	trans	-74.9	-28.8	178.3	-44.7	-45.8	0	0	0	111.5	A495 M496	A495-D498 WeakPolarHBondContact CB-OD2 3.34Å; A495-D498 PolarHBondContact N-OD2 2.91Å; A495-D498 WeakPolarHBondContact O-CB 3.33Å; A495-D498 PolarHBondContact O-N 3.32Å; M496-D498 PolarHBondContact O-N 3.37Å
499	L	87.7	Confident	76.2	Confident	2 Å²	2	49 Å²	49	1%	0.01	31%	0.313	C	S	.	.	H	α-helix	trans	-88.5	-31.3	-174.9	179.2	62.2	0	0	0	113.5	L478 A495 M496 A497 D502 L503 Y573	L478-L499 HydrophobicContact CD1-CD1 3.82Å; A495-L499 PolarHBondContact O-N 3.08Å; M496-L499 PolarHBondContact O-N 2.92Å; M496-L499 VanDerWaalsContact O-N 3.11Å; M496-L499 HydrophobicContact SD-CD2 3.97Å; A497-L499 VanDerWaalsContact C-N 3.35Å; L499-D502 PolarHBondContact O-N 3Å; L499-L503 HydrophobicContact CD1-CD1 4.2Å; L499-L503 HydrophobicContact CD1-CD2 4.38Å; L499-L503 HydrophobicContact CD1-CG 3.92Å; L499-L503 HydrophobicContact CD2-CD1 3.94Å; L499-L503 HydrophobicContact CG-CD1 3.72Å; L499-L503 HydrophobicContact CG-CG 3.91Å; L499-L503 PolarHBondContact O-N 3.22Å; L499-Y573 HydrophobicContact CD1-CG 4.33Å
500	V	89.9	Confident	79.1	Confident	31 Å²	31	41.9 Å²	41.9	19%	0.188	28%	0.276	C	S	.	.	H	α-helix	trans	-47.5	-52.6	176.9	161.5	0	0	0	0	113.7	M496 D502 L503 Q504 L622	M496-V500 VanDerWaalsContact O-CG2 3.29Å; M496-V500 WeakPolarHBondContact O-CG2 3.35Å; M496-V500 PolarHBondContact O-N 3.26Å; V500-D502 VanDerWaalsContact C-N 3.27Å; V500-D502 PolarHBondContact O-N 3.43Å; V500-L503 PolarHBondContact O-N 3.46Å; V500-Q504 HydrophobicContact CG1-CG 4.46Å; V500-Q504 WeakPolarHBondContact O-CG 3.26Å; V500-Q504 PolarHBondContact O-N 2.83Å; V500-L622 HydrophobicContact CG1-CD1 4.3Å; V500-L622 HydrophobicContact CG2-CD2 4.29Å
501	P	90.8	Very high	81.9	Confident	65 Å²	65	37.1 Å²	37.1	42%	0.422	24%	0.243	S	C	.	.	H	α-helix	trans	-66.1	-25.8	-176.8	25.6	-35.4	0	0	0	113.8	A497 P505	A497-P501 WeakPolarHBondContact O-CD 3.14Å; P501-P505 VanDerWaalsContact O-CD 3.32Å; P501-P505 WeakPolarHBondContact O-CD 3.38Å
502	D	90.6	Very high	84.4	Confident	32 Å²	32	28.7 Å²	28.7	17%	0.171	20%	0.199	C	C	.	.	H	α-helix	trans	-84.7	-28.4	177.2	-74.7	-21.6	0	0	0	112.9	L478 K481 L499 V500	L478-D502 HydrophobicContact CB-CB 4.33Å; L478-D502 HydrophobicContact CD1-CB 3.72Å; L478-D502 HydrophobicContact CD2-CB 4.46Å; L478-D502 HydrophobicContact CG-CB 4.37Å; K481-D502 WeakPolarHBondContact CD-OD2 3.46Å; K481-D502 IonicContact NZ-OD1 3.33Å; K481-D502 PolarHBondContact NZ-OD1 3.23Å; K481-D502 IonicContact NZ-OD2 3.92Å; K481-D502 PolarHBondContact NZ-OD2 3.49Å; L499-D502 PolarHBondContact O-N 3Å; V500-D502 VanDerWaalsContact C-N 3.27Å; V500-D502 PolarHBondContact O-N 3.43Å
503	L	93.3	Very high	87	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-78.1	-24.4	171.3	-68.6	-177.6	0	0	0	113	L478 L499 V500 I506 L507 Y573 V574 L622	L478-L503 HydrophobicContact CD2-CD2 3.74Å; L499-L503 HydrophobicContact CD1-CD1 4.2Å; L499-L503 HydrophobicContact CD1-CD2 4.38Å; L499-L503 HydrophobicContact CD1-CG 3.92Å; L499-L503 HydrophobicContact CD2-CD1 3.94Å; L499-L503 HydrophobicContact CG-CD1 3.72Å; L499-L503 HydrophobicContact CG-CG 3.91Å; L499-L503 PolarHBondContact O-N 3.22Å; V500-L503 PolarHBondContact O-N 3.46Å; L503-I506 HydrophobicContact CD2-CD1 4.48Å; L503-I506 PolarHBondContact O-N 2.84Å; L503-I506 VanDerWaalsContact O-N 3.12Å; L503-L507 HydrophobicContact CB-CD1 4.49Å; L503-L507 PolarHBondContact O-N 3.01Å; L503-Y573 HydrophobicContact CD2-CD2 4.35Å; L503-V574 HydrophobicContact CD1-CG2 3.8Å; L503-L622 HydrophobicContact CB-CD2 4.03Å
504	Q	94.6	Very high	89.4	Confident	41 Å²	41	22.7 Å²	22.7	19%	0.192	14%	0.143	C	C	.	.	H	α-helix	trans	-51.3	-52.3	-178.4	-92	178.7	-7.4	0	0	113.5	P427 V500 I506 F508 L622 L626	P427-Q504 HydrophobicContact CB-CB 4.22Å; V500-Q504 HydrophobicContact CG1-CG 4.46Å; V500-Q504 WeakPolarHBondContact O-CG 3.26Å; V500-Q504 PolarHBondContact O-N 2.83Å; Q504-I506 VanDerWaalsContact C-N 3.3Å; Q504-I506 PolarHBondContact O-N 2.84Å; Q504-F508 WeakPolarHBondContact O-CB 3.5Å; Q504-F508 PolarHBondContact O-N 3.18Å; Q504-L622 HydrophobicContact CG-CD1 3.5Å; Q504-L622 VanDerWaalsContact CG-CD1 3.5Å; Q504-L626 HydrophobicContact CB-CD1 4.49Å; Q504-L626 HydrophobicContact CG-CD1 4.27Å; Q504-L626 WeakPolarHBondContact O-CD1 3.34Å
505	P	94.4	Very high	91.4	Very high	26 Å²	26	21.8 Å²	21.8	17%	0.169	14%	0.137	C	C	.	.	H	α-helix	trans	-63.8	-32.1	178.9	-23.6	34.8	0	0	0	114.1	P427 K474 P501 W509	P427-P505 HydrophobicContact CG-CB 4.39Å; P427-P505 HydrophobicContact CG-CG 4.37Å; K474-P505 HydrophobicContact CB-CB 4.41Å; K474-P505 HydrophobicContact CD-CB 3.93Å; K474-P505 HydrophobicContact CD-CG 4.16Å; K474-P505 HydrophobicContact CG-CB 4.06Å; P501-P505 VanDerWaalsContact O-CD 3.32Å; P501-P505 WeakPolarHBondContact O-CD 3.38Å; P505-W509 PolarHBondContact O-N 2.85Å; P505-W509 VanDerWaalsContact O-N 3.16Å
506	I	95.9	Very high	92.6	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-72.5	-48.7	-177.9	-59.4	173.2	0	0	0	109.7	K474 L478 L503 Q504 M510 A566	K474-I506 HydrophobicContact CB-CG1 4.32Å; L478-I506 HydrophobicContact CD2-CD1 3.82Å; L503-I506 HydrophobicContact CD2-CD1 4.48Å; L503-I506 PolarHBondContact O-N 2.84Å; L503-I506 VanDerWaalsContact O-N 3.12Å; Q504-I506 VanDerWaalsContact C-N 3.3Å; Q504-I506 PolarHBondContact O-N 2.84Å; I506-M510 WeakPolarHBondContact O-CB 2.97Å; I506-M510 PolarHBondContact O-N 3.39Å; I506-A566 HydrophobicContact CG2-CB 3.74Å
507	L	96.2	Very high	93.3	Very high	4 Å²	4	19.3 Å²	19.3	2%	0.021	12%	0.118	C	C	.	.	H	α-helix	trans	-69	-34	177.2	-72.2	174.1	0	0	0	112.8	L503 M510 S511 C570 L622 L623 L626 V628 M636	L503-L507 HydrophobicContact CB-CD1 4.49Å; L503-L507 PolarHBondContact O-N 3.01Å; L507-M510 HydrophobicContact CD2-CE 3.52Å; L507-M510 HydrophobicContact CD2-SD 4.21Å; L507-M510 WeakPolarHBondContact O-CB 3.35Å; L507-M510 PolarHBondContact O-N 3.07Å; L507-S511 PolarHBondContact O-N 3.34Å; L507-C570 HydrophobicContact CD2-CB 4.03Å; L507-C570 WeakPolarHBondContact CD2-SG 3.2Å; L507-C570 VanDerWaalsContact CG-SG 3.56Å; L507-L622 HydrophobicContact CD1-CD2 3.66Å; L507-L622 HydrophobicContact CD1-CG 3.72Å; L507-L623 HydrophobicContact CD1-CD2 4.21Å; L507-L623 HydrophobicContact CD2-CD2 3.82Å; L507-L626 HydrophobicContact CB-CD1 3.49Å; L507-L626 VanDerWaalsContact CB-CD1 3.49Å; L507-L626 HydrophobicContact CD1-CD1 4.41Å; L507-V628 HydrophobicContact CB-CG2 4.44Å; L507-M636 HydrophobicContact CD2-CE 4.14Å
508	F	96.8	Very high	93.8	Very high	3 Å²	3	18.5 Å²	18.5	1%	0.013	10%	0.098	C	C	.	.	H	α-helix	trans	-61.8	-47.1	174.8	174.1	-94.9	0	0	0	112.2	I425 P427 K433 P436 Q504 M510 S511 N512 L626	I425-F508 HydrophobicContact CB-CZ 3.98Å; I425-F508 HydrophobicContact CG2-CE2 3.89Å; I425-F508 HydrophobicContact CG2-CZ 3.85Å; P427-F508 HydrophobicContact CB-CB 4.03Å; P427-F508 HydrophobicContact CB-CD2 4.19Å; P427-F508 HydrophobicContact CB-CG 4.04Å; P427-F508 HydrophobicContact CG-CB 4.19Å; P427-F508 HydrophobicContact CG-CD1 4.02Å; P427-F508 HydrophobicContact CG-CD2 4.38Å; P427-F508 HydrophobicContact CG-CG 3.95Å; K433-F508 HydrophobicContact CB-CD2 4.32Å; K433-F508 HydrophobicContact CB-CE2 4.22Å; K433-F508 HydrophobicContact CD-CD2 4.28Å; K433-F508 HydrophobicContact CD-CE2 4.22Å; K433-F508 VanDerWaalsContact O-CE2 3.31Å; K433-F508 WeakPolarHBondContact O-CE2 3.47Å; P436-F508 HydrophobicContact CG-CE1 4.15Å; P436-F508 HydrophobicContact CG-CZ 3.71Å; Q504-F508 WeakPolarHBondContact O-CB 3.5Å; Q504-F508 PolarHBondContact O-N 3.18Å; F508-M510 VanDerWaalsContact C-N 3.34Å; F508-S511 PolarHBondContact O-OG 3.25Å; F508-N512 PolarHBondContact O-N 3.21Å; F508-N512 PolarHBondContact O-ND2 3.06Å; F508-L626 HydrophobicContact CB-CD2 4.22Å; F508-L626 HydrophobicContact CD2-CD2 4.33Å
509	W	96.4	Very high	94.3	Very high	11 Å²	11	14.4 Å²	14.4	4%	0.042	8%	0.076	C	C	.	.	H	α-helix	trans	-73.3	-28.6	175.4	-79.2	112.6	0	0	0	112.2	M422 P436 L440 I467 I471 P505 N512 S513	M422-W509 HydrophobicContact CB-CZ2 4.46Å; M422-W509 HydrophobicContact CE-CH2 3.97Å; M422-W509 HydrophobicContact CE-CZ3 4.14Å; M422-W509 HydrophobicContact SD-CH2 3.39Å; M422-W509 WeakPolarHBondContact SD-CH2 3.3Å; M422-W509 HydrophobicContact SD-CZ2 3.79Å; M422-W509 HydrophobicContact SD-CZ3 3.91Å; P436-W509 HydrophobicContact CB-CH2 3.81Å; P436-W509 HydrophobicContact CB-CZ3 4.07Å; P436-W509 HydrophobicContact CG-CH2 4.39Å; L440-W509 HydrophobicContact CD1-CZ3 4.47Å; I467-W509 HydrophobicContact CD1-CE3 4.35Å; I467-W509 HydrophobicContact CD1-CZ3 4.23Å; I467-W509 HydrophobicContact CG1-CE3 3.99Å; I467-W509 HydrophobicContact CG1-CZ3 3.99Å; I467-W509 HydrophobicContact CG2-CB 4.22Å; I467-W509 HydrophobicContact CG2-CD2 4.27Å; I467-W509 HydrophobicContact CG2-CE3 3.85Å; I467-W509 HydrophobicContact CG2-CG 4.45Å; I471-W509 HydrophobicContact CD1-CB 3.39Å; I471-W509 HydrophobicContact CG1-CB 3.61Å; I471-W509 HydrophobicContact CG1-CG 4.45Å; P505-W509 PolarHBondContact O-N 2.85Å; P505-W509 VanDerWaalsContact O-N 3.16Å; W509-N512 HydrophobicContact CE3-CB 4.01Å; W509-N512 HydrophobicContact CZ3-CB 4.25Å; W509-N512 PolarHBondContact O-N 3.4Å; W509-S513 WeakPolarHBondContact O-CB 3.38Å; W509-S513 PolarHBondContact O-N 3.47Å; W509-S513 PolarHBondContact O-OG 3.21Å; W509-S513 VanDerWaalsContact O-OG 3.09Å
510	M	96.7	Very high	94.4	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-61.6	-45.9	171.3	-167.8	-177	76.1	0	0	112.5	I506 L507 F508 S513 I514 V563 A566 F567 V628 V632 M636	I506-M510 WeakPolarHBondContact O-CB 2.97Å; I506-M510 PolarHBondContact O-N 3.39Å; L507-M510 HydrophobicContact CD2-CE 3.52Å; L507-M510 HydrophobicContact CD2-SD 4.21Å; L507-M510 WeakPolarHBondContact O-CB 3.35Å; L507-M510 PolarHBondContact O-N 3.07Å; F508-M510 VanDerWaalsContact C-N 3.34Å; M510-S513 PolarHBondContact O-N 2.87Å; M510-I514 HydrophobicContact CG-CD1 4.15Å; M510-I514 WeakPolarHBondContact O-CD1 3.42Å; M510-I514 VanDerWaalsContact O-CG1 3.27Å; M510-I514 WeakPolarHBondContact O-CG1 3.49Å; M510-I514 PolarHBondContact O-N 3.42Å; M510-V563 HydrophobicContact CG-CG1 4.16Å; M510-A566 HydrophobicContact CB-CB 3.85Å; M510-A566 HydrophobicContact CG-CB 3.89Å; M510-A566 HydrophobicContact SD-CB 3.96Å; M510-F567 HydrophobicContact SD-CB 4.01Å; M510-V628 HydrophobicContact CE-CB 4.46Å; M510-V628 HydrophobicContact CE-CG1 3.54Å; M510-V628 HydrophobicContact CE-CG2 4.01Å; M510-V632 HydrophobicContact CE-CG1 4.04Å; M510-M636 HydrophobicContact CE-CE 4.26Å
511	S	96.4	Very high	94.5	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.007	9%	0.085	C	C	.	.	H	α-helix	trans	-64.3	-44.9	177.1	60.5	0	0	0	0	111.8	L507 F508 S513 I514 E515 L626	L507-S511 PolarHBondContact O-N 3.34Å; F508-S511 PolarHBondContact O-OG 3.25Å; S511-S513 VanDerWaalsContact C-N 3.33Å; S511-S513 PolarHBondContact O-N 3.04Å; S511-I514 PolarHBondContact O-N 2.88Å; S511-E515 PolarHBondContact O-N 3.3Å; S511-L626 WeakPolarHBondContact CB-O 3.35Å; S511-L626 PolarHBondContact OG-O 3.04Å
512	N	96.6	Very high	94.3	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-61.8	-37.1	175	-79.1	-91.4	0	0	0	112.7	K433 P436 A437 F508 W509 L516	K433-N512 PolarHBondContact O-ND2 3.37Å; K433-N512 PolarHBondContact O-OD1 3.38Å; P436-N512 WeakPolarHBondContact CD-OD1 3.32Å; A437-N512 HydrophobicContact CB-CB 4.09Å; A437-N512 VanDerWaalsContact CB-OD1 3.29Å; A437-N512 WeakPolarHBondContact CB-OD1 3.46Å; A437-N512 PolarHBondContact N-OD1 3.46Å; F508-N512 PolarHBondContact O-N 3.21Å; F508-N512 PolarHBondContact O-ND2 3.06Å; W509-N512 HydrophobicContact CE3-CB 4.01Å; W509-N512 HydrophobicContact CZ3-CB 4.25Å; W509-N512 PolarHBondContact O-N 3.4Å; N512-L516 WeakPolarHBondContact O-CB 3.32Å; N512-L516 PolarHBondContact O-N 3.37Å
513	S	97	Very high	94.2	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-68.6	-34.3	174.6	-72.9	0	0	0	0	113.6	I467 W509 M510 S511 L517	I467-S513 WeakPolarHBondContact CG2-OG 3.41Å; W509-S513 WeakPolarHBondContact O-CB 3.38Å; W509-S513 PolarHBondContact O-N 3.47Å; W509-S513 PolarHBondContact O-OG 3.21Å; W509-S513 VanDerWaalsContact O-OG 3.09Å; M510-S513 PolarHBondContact O-N 2.87Å; S511-S513 VanDerWaalsContact C-N 3.33Å; S511-S513 PolarHBondContact O-N 3.04Å; S513-L517 WeakPolarHBondContact O-CB 3.24Å; S513-L517 PolarHBondContact O-N 3.21Å
514	I	95.6	Very high	93.9	Very high	5 Å²	5	19.2 Å²	19.2	3%	0.026	9%	0.09	C	C	.	.	H	α-helix	trans	-64.4	-49.9	177.5	-72.7	159	0	0	0	110.5	M510 S511 Y518 V563 H629 V632 P779 F783	M510-I514 HydrophobicContact CG-CD1 4.15Å; M510-I514 WeakPolarHBondContact O-CD1 3.42Å; M510-I514 VanDerWaalsContact O-CG1 3.27Å; M510-I514 WeakPolarHBondContact O-CG1 3.49Å; M510-I514 PolarHBondContact O-N 3.42Å; S511-I514 PolarHBondContact O-N 2.88Å; I514-Y518 PolarHBondContact O-N 3Å; I514-V563 HydrophobicContact CD1-CG1 4.16Å; I514-V563 HydrophobicContact CG1-CG1 3.8Å; I514-V563 HydrophobicContact CG1-CG2 3.85Å; I514-H629 HydrophobicContact CG2-CB 4.1Å; I514-V632 HydrophobicContact CD1-CB 4.28Å; I514-V632 HydrophobicContact CD1-CG1 4.19Å; I514-V632 HydrophobicContact CD1-CG2 3.93Å; I514-P779 HydrophobicContact CG2-CG 3.89Å; I514-F783 HydrophobicContact CG2-CD1 4.45Å; I514-F783 HydrophobicContact CG2-CE1 3.7Å
515	E	95.1	Very high	93.4	Very high	4 Å²	4	20.2 Å²	20.2	2%	0.019	10%	0.1	C	C	.	.	H	α-helix	trans	-63.1	-44.3	176.9	-63.3	-73.7	144.5	0	0	111.9	L434 A437 S511 Y518 F519 Q784 V785	L434-E515 HydrophobicContact CD1-CG 3.85Å; L434-E515 HydrophobicContact CD2-CG 3.83Å; L434-E515 HydrophobicContact CG-CG 4.37Å; A437-E515 HydrophobicContact CB-CB 4.21Å; S511-E515 PolarHBondContact O-N 3.3Å; E515-Y518 PolarHBondContact O-N 3.46Å; E515-F519 WeakPolarHBondContact O-CB 3.19Å; E515-F519 PolarHBondContact O-N 3.44Å; E515-Q784 PolarHBondContact OE1-N 2.87Å; E515-Q784 PolarHBondContact OE2-N 2.95Å; E515-V785 HydrophobicContact CB-CB 4.23Å; E515-V785 HydrophobicContact CB-CG2 3.77Å; E515-V785 HydrophobicContact CG-CG2 3.95Å; E515-V785 PolarHBondContact OE2-N 2.91Å
516	L	95.4	Very high	93	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-64.3	-41.8	179.6	-177.8	65.8	0	0	0	112.4	L440 I444 I463 I467 N512 F519 I520 L559	L440-L516 HydrophobicContact CB-CD1 4.22Å; L440-L516 HydrophobicContact CD1-CD2 4.46Å; I444-L516 HydrophobicContact CD1-CD1 3.6Å; I463-L516 HydrophobicContact CG2-CD2 3.67Å; I467-L516 HydrophobicContact CD1-CD2 3.66Å; N512-L516 WeakPolarHBondContact O-CB 3.32Å; N512-L516 PolarHBondContact O-N 3.37Å; L516-F519 PolarHBondContact O-N 2.99Å; L516-I520 HydrophobicContact CD1-CD1 4.2Å; L516-I520 HydrophobicContact CG-CD1 3.98Å; L516-I520 WeakPolarHBondContact O-CD1 3.28Å; L516-I520 VanDerWaalsContact O-CG1 3.26Å; L516-I520 WeakPolarHBondContact O-CG1 3.44Å; L516-I520 PolarHBondContact O-N 3.31Å; L516-L559 HydrophobicContact CD2-CD1 3.92Å; L516-L559 HydrophobicContact CD2-CD2 4.05Å; L516-L559 HydrophobicContact CG-CD1 3.96Å
517	L	94.5	Very high	92.5	Very high	6 Å²	6	25.4 Å²	25.4	3%	0.031	12%	0.123	C	C	.	.	H	α-helix	trans	-60.2	-48.4	176.7	174.3	61.9	0	0	0	110.9	S513 I520 Q521 M556 L559 E560 L778	S513-L517 WeakPolarHBondContact O-CB 3.24Å; S513-L517 PolarHBondContact O-N 3.21Å; L517-I520 PolarHBondContact O-N 3.15Å; L517-Q521 HydrophobicContact CD1-CG 4.31Å; L517-Q521 VanDerWaalsContact O-CG 3.3Å; L517-Q521 WeakPolarHBondContact O-CG 3.42Å; L517-Q521 PolarHBondContact O-N 2.91Å; L517-M556 HydrophobicContact CD1-CB 3.8Å; L517-M556 HydrophobicContact CD1-CG 3.93Å; L517-L559 HydrophobicContact CB-CB 4.28Å; L517-L559 HydrophobicContact CB-CD1 4.44Å; L517-L559 HydrophobicContact CD1-CB 4.25Å; L517-E560 HydrophobicContact CD1-CG 4.11Å; L517-E560 HydrophobicContact CD2-CG 3.57Å; L517-L778 HydrophobicContact CD2-CD1 3.87Å
518	Y	93.3	Very high	91.8	Very high	61 Å²	61	26.5 Å²	26.5	24%	0.239	13%	0.129	C	C	.	.	H	α-helix	trans	-63.5	-42.9	177.4	176.9	-102.6	0	0	0	112.4	I514 E515 I520 Q521 Q522 S780 F783	I514-Y518 PolarHBondContact O-N 3Å; E515-Y518 PolarHBondContact O-N 3.46Å; Y518-I520 VanDerWaalsContact C-N 3.3Å; Y518-I520 PolarHBondContact O-N 3.41Å; Y518-Q521 PolarHBondContact O-N 3.09Å; Y518-Q522 HydrophobicContact CD1-CG 4.23Å; Y518-Q522 HydrophobicContact CD2-CG 4.03Å; Y518-Q522 HydrophobicContact CE1-CG 3.87Å; Y518-Q522 HydrophobicContact CE2-CG 3.68Å; Y518-Q522 VanDerWaalsContact CE2-NE2 3.34Å; Y518-Q522 HydrophobicContact CG-CG 4.32Å; Y518-Q522 WeakPolarHBondContact O-CG 3.22Å; Y518-Q522 PolarHBondContact O-N 3.3Å; Y518-S780 VanDerWaalsContact CE2-O 3.32Å; Y518-S780 WeakPolarHBondContact CE2-O 3.26Å; Y518-F783 VanDerWaalsContact CB-CZ 3.44Å; Y518-F783 HydrophobicContact CD1-CB 3.87Å; Y518-F783 AromaticContact CD1-CD1 3.88Å; Y518-F783 HydrophobicContact CD1-CD1 3.88Å; Y518-F783 AromaticContact CD1-CD2 3.38Å; Y518-F783 HydrophobicContact CD1-CD2 3.38Å; Y518-F783 HydrophobicContact CD1-CE1 4.24Å; Y518-F783 AromaticContact CD1-CE2 3.81Å; Y518-F783 HydrophobicContact CD1-CE2 3.81Å; Y518-F783 AromaticContact CD1-CG 3.41Å; Y518-F783 HydrophobicContact CD1-CG 3.41Å; Y518-F783 VanDerWaalsContact CD1-CG 3.41Å; Y518-F783 HydrophobicContact CD1-CZ 4.2Å; Y518-F783 AromaticContact CD2-CD2 3.62Å; Y518-F783 HydrophobicContact CD2-CD2 3.62Å; Y518-F783 HydrophobicContact CD2-CE1 4.25Å; Y518-F783 AromaticContact CD2-CE2 3.16Å; Y518-F783 HydrophobicContact CD2-CE2 3.16Å; Y518-F783 HydrophobicContact CD2-CG 4.34Å; Y518-F783 AromaticContact CD2-CZ 3.51Å; Y518-F783 HydrophobicContact CD2-CZ 3.51Å; Y518-F783 HydrophobicContact CE1-CB 4Å; Y518-F783 AromaticContact CE1-CD2 3.42Å; Y518-F783 HydrophobicContact CE1-CD2 3.42Å; Y518-F783 VanDerWaalsContact CE1-CD2 3.42Å; Y518-F783 HydrophobicContact CE1-CE2 4.05Å; Y518-F783 AromaticContact CE1-CG 3.78Å; Y518-F783 HydrophobicContact CE1-CG 3.78Å; Y518-F783 AromaticContact CE2-CD2 3.64Å; Y518-F783 HydrophobicContact CE2-CD2 3.64Å; Y518-F783 AromaticContact CE2-CE2 3.42Å; Y518-F783 HydrophobicContact CE2-CE2 3.42Å; Y518-F783 VanDerWaalsContact CE2-CE2 3.42Å; Y518-F783 HydrophobicContact CE2-CZ 4.24Å; Y518-F783 AromaticContact CG-CD1 3.85Å; Y518-F783 HydrophobicContact CG-CD1 3.85Å; Y518-F783 AromaticContact CG-CD2 3.46Å; Y518-F783 HydrophobicContact CG-CD2 3.46Å; Y518-F783 VanDerWaalsContact CG-CD2 3.46Å; Y518-F783 AromaticContact CG-CE1 3.72Å; Y518-F783 HydrophobicContact CG-CE1 3.72Å; Y518-F783 AromaticContact CG-CE2 3.34Å; Y518-F783 HydrophobicContact CG-CE2 3.34Å; Y518-F783 AromaticContact CG-CG 3.71Å; Y518-F783 HydrophobicContact CG-CG 3.71Å; Y518-F783 AromaticContact CG-CZ 3.46Å; Y518-F783 HydrophobicContact CG-CZ 3.46Å; Y518-F783 VanDerWaalsContact CG-CZ 3.46Å; Y518-F783 AromaticContact CZ-CD2 3.53Å; Y518-F783 AromaticContact CZ-CE2 3.85Å
519	F	92.7	Very high	91	Very high	7 Å²	7	31.5 Å²	31.5	3%	0.031	15%	0.152	C	C	.	.	H	α-helix	trans	-57.3	-44.1	175.2	-179.9	-89.8	0	0	0	111.7	C441 I444 E515 L516 Q522 K523 Y527 L787	C441-F519 HydrophobicContact CB-CD1 3.85Å; C441-F519 HydrophobicContact CB-CD2 3.91Å; C441-F519 HydrophobicContact CB-CE1 3.79Å; C441-F519 HydrophobicContact CB-CE2 3.85Å; C441-F519 HydrophobicContact CB-CG 3.92Å; C441-F519 HydrophobicContact CB-CZ 3.79Å; C441-F519 VanDerWaalsContact SG-CD1 3.52Å; C441-F519 WeakPolarHBondContact SG-CG 3.5Å; I444-F519 HydrophobicContact CB-CE1 4.31Å; I444-F519 HydrophobicContact CG2-CE1 3.96Å; E515-F519 WeakPolarHBondContact O-CB 3.19Å; E515-F519 PolarHBondContact O-N 3.44Å; L516-F519 PolarHBondContact O-N 2.99Å; F519-Q522 PolarHBondContact O-N 3.04Å; F519-K523 HydrophobicContact CD1-CG 4.49Å; F519-K523 HydrophobicContact CD2-CG 3.88Å; F519-K523 HydrophobicContact CE1-CB 4.28Å; F519-K523 HydrophobicContact CE1-CG 4.32Å; F519-K523 HydrophobicContact CE2-CB 4.48Å; F519-K523 HydrophobicContact CE2-CD 4.41Å; F519-K523 HydrophobicContact CE2-CG 3.68Å; F519-K523 HydrophobicContact CG-CG 4.28Å; F519-K523 HydrophobicContact CZ-CB 4.22Å; F519-K523 HydrophobicContact CZ-CG 3.91Å; F519-K523 VanDerWaalsContact O-CB 3.29Å; F519-K523 WeakPolarHBondContact O-CB 3.43Å; F519-K523 WeakPolarHBondContact O-CG 3.11Å; F519-K523 PolarHBondContact O-N 2.94Å; F519-Y527 HydrophobicContact CE1-CE2 4.33Å; F519-Y527 HydrophobicContact CZ-CE2 4.39Å; F519-L787 HydrophobicContact CE2-CD1 3.41Å; F519-L787 VanDerWaalsContact CE2-CD1 3.41Å; F519-L787 HydrophobicContact CE2-CG 3.77Å; F519-L787 HydrophobicContact CZ-CD1 3.48Å; F519-L787 VanDerWaalsContact CZ-CD1 3.48Å; F519-L787 HydrophobicContact CZ-CG 4.34Å
520	I	91.6	Very high	90.2	Very high	4 Å²	4	33.3 Å²	33.3	2%	0.021	17%	0.166	C	C	.	.	H	α-helix	trans	-65	-47.8	176.3	-65.5	163.1	0	0	0	110.4	I444 L460 L516 L517 Y518 Q522 C524 M556 L559	I444-I520 HydrophobicContact CD1-CD1 4.34Å; I444-I520 HydrophobicContact CD1-CG1 4.27Å; L460-I520 HydrophobicContact CD2-CD1 3.81Å; L460-I520 HydrophobicContact CD2-CG1 3.86Å; L460-I520 HydrophobicContact CD2-CG2 4.5Å; L516-I520 HydrophobicContact CD1-CD1 4.2Å; L516-I520 HydrophobicContact CG-CD1 3.98Å; L516-I520 WeakPolarHBondContact O-CD1 3.28Å; L516-I520 VanDerWaalsContact O-CG1 3.26Å; L516-I520 WeakPolarHBondContact O-CG1 3.44Å; L516-I520 PolarHBondContact O-N 3.31Å; L517-I520 PolarHBondContact O-N 3.15Å; Y518-I520 VanDerWaalsContact C-N 3.3Å; Y518-I520 PolarHBondContact O-N 3.41Å; I520-Q522 VanDerWaalsContact C-N 3.29Å; I520-Q522 PolarHBondContact O-N 3.26Å; I520-C524 HydrophobicContact CG2-CB 4.03Å; I520-C524 WeakPolarHBondContact O-CB 3.19Å; I520-C524 PolarHBondContact O-N 2.84Å; I520-M556 HydrophobicContact CB-CG 4.34Å; I520-M556 HydrophobicContact CG2-CG 3.6Å; I520-M556 HydrophobicContact CG2-SD 3.91Å; I520-L559 HydrophobicContact CD1-CD1 3.67Å
521	Q	90.1	Very high	89.1	Confident	77 Å²	77	34.2 Å²	34.2	36%	0.36	17%	0.171	S	C	.	.	H	α-helix	trans	-55.8	-40.4	178.1	-74.6	172.8	-6	0	0	112.7	L517 Y518 P525 M556	L517-Q521 HydrophobicContact CD1-CG 4.31Å; L517-Q521 VanDerWaalsContact O-CG 3.3Å; L517-Q521 WeakPolarHBondContact O-CG 3.42Å; L517-Q521 PolarHBondContact O-N 2.91Å; Y518-Q521 PolarHBondContact O-N 3.09Å; Q521-P525 WeakPolarHBondContact O-CD 3.3Å; Q521-M556 HydrophobicContact CB-SD 4.41Å; Q521-M556 HydrophobicContact CG-SD 3.57Å; Q521-M556 VanDerWaalsContact CG-SD 3.57Å
522	Q	88.3	Confident	87.9	Confident	97 Å²	97	40.2 Å²	40.2	45%	0.453	20%	0.199	S	C	.	.	H	α-helix	trans	-83.8	-42.5	-178.2	-64.7	-63.4	-21.8	0	0	113.8	Y518 F519 I520	Y518-Q522 HydrophobicContact CD1-CG 4.23Å; Y518-Q522 HydrophobicContact CD2-CG 4.03Å; Y518-Q522 HydrophobicContact CE1-CG 3.87Å; Y518-Q522 HydrophobicContact CE2-CG 3.68Å; Y518-Q522 VanDerWaalsContact CE2-NE2 3.34Å; Y518-Q522 HydrophobicContact CG-CG 4.32Å; Y518-Q522 WeakPolarHBondContact O-CG 3.22Å; Y518-Q522 PolarHBondContact O-N 3.3Å; F519-Q522 PolarHBondContact O-N 3.04Å; I520-Q522 VanDerWaalsContact C-N 3.29Å; I520-Q522 PolarHBondContact O-N 3.26Å
523	K	87.1	Confident	86.6	Confident	50 Å²	50	47.9 Å²	47.9	22%	0.217	23%	0.234	C	C	.	.	H	α-helix	trans	-97.4	-28.5	-169.2	-53.7	-75.3	-171.6	171.5	0	113.4	F519 L526 Y527	F519-K523 HydrophobicContact CD1-CG 4.49Å; F519-K523 HydrophobicContact CD2-CG 3.88Å; F519-K523 HydrophobicContact CE1-CB 4.28Å; F519-K523 HydrophobicContact CE1-CG 4.32Å; F519-K523 HydrophobicContact CE2-CB 4.48Å; F519-K523 HydrophobicContact CE2-CD 4.41Å; F519-K523 HydrophobicContact CE2-CG 3.68Å; F519-K523 HydrophobicContact CG-CG 4.28Å; F519-K523 HydrophobicContact CZ-CB 4.22Å; F519-K523 HydrophobicContact CZ-CG 3.91Å; F519-K523 VanDerWaalsContact O-CB 3.29Å; F519-K523 WeakPolarHBondContact O-CB 3.43Å; F519-K523 WeakPolarHBondContact O-CG 3.11Å; F519-K523 PolarHBondContact O-N 2.94Å; K523-L526 PolarHBondContact O-N 2.75Å; K523-L526 VanDerWaalsContact O-N 3.17Å; K523-Y527 HydrophobicContact CB-CD2 4.18Å; K523-Y527 HydrophobicContact CB-CE2 3.6Å; K523-Y527 VanDerWaalsContact O-CD2 3.3Å; K523-Y527 WeakPolarHBondContact O-CD2 3.4Å; K523-Y527 PolarHBondContact O-N 3.29Å
524	C	86.6	Confident	84.9	Confident	5 Å²	5	54.7 Å²	54.7	3%	0.034	27%	0.266	C	S	.	.	H	α-helix	trans	-58.7	-42.4	-180	-170.3	0	0	0	0	113.4	F456 I520 L526 Y527 M528	F456-C524 HydrophobicContact CZ-CB 4.49Å; I520-C524 HydrophobicContact CG2-CB 4.03Å; I520-C524 WeakPolarHBondContact O-CB 3.19Å; I520-C524 PolarHBondContact O-N 2.84Å; C524-L526 VanDerWaalsContact C-N 3.33Å; C524-L526 PolarHBondContact O-N 3.01Å; C524-Y527 PolarHBondContact O-N 2.91Å; C524-M528 WeakPolarHBondContact O-CG 3.48Å; C524-M528 PolarHBondContact O-N 3.48Å
525	P	86	Confident	83.3	Confident	62 Å²	62	57.4 Å²	57.4	40%	0.403	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-39.8	175.6	-23.7	35.3	0	0	0	112.8	Q521 M528 Q529	Q521-P525 WeakPolarHBondContact O-CD 3.3Å; P525-M528 PolarHBondContact O-N 3.11Å; P525-Q529 WeakPolarHBondContact O-CB 3.25Å; P525-Q529 VanDerWaalsContact O-CG 3.28Å; P525-Q529 WeakPolarHBondContact O-CG 3.37Å; P525-Q529 PolarHBondContact O-N 3.22Å
526	L	85.8	Confident	81.2	Confident	99 Å²	99	64.3 Å²	64.3	52%	0.518	32%	0.317	S	S	.	.	H	α-helix	trans	-68.1	-40.4	179.3	-58.5	175.4	0	0	0	111.8	K523 C524 S530	K523-L526 PolarHBondContact O-N 2.75Å; K523-L526 VanDerWaalsContact O-N 3.17Å; C524-L526 VanDerWaalsContact C-N 3.33Å; C524-L526 PolarHBondContact O-N 3.01Å; L526-S530 WeakPolarHBondContact O-CB 3.48Å; L526-S530 PolarHBondContact O-N 2.89Å
527	Y	85.4	Confident	79.1	Confident	35 Å²	35	70 Å²	70	14%	0.137	35%	0.352	C	S	.	.	H	α-helix	trans	-64.2	-44.8	174.3	-65	-35.1	0	0	0	111.5	I444 A448 F456 F519 K523 C524 Q529 S530 M531	I444-Y527 HydrophobicContact CG2-CE2 4.49Å; A448-Y527 HydrophobicContact CB-CD1 4.04Å; A448-Y527 HydrophobicContact CB-CD2 3.79Å; A448-Y527 HydrophobicContact CB-CE2 4.35Å; A448-Y527 HydrophobicContact CB-CG 3.64Å; F456-Y527 HydrophobicContact CE2-CD2 4.19Å; F456-Y527 HydrophobicContact CZ-CD2 4.17Å; F519-Y527 HydrophobicContact CE1-CE2 4.33Å; F519-Y527 HydrophobicContact CZ-CE2 4.39Å; K523-Y527 HydrophobicContact CB-CD2 4.18Å; K523-Y527 HydrophobicContact CB-CE2 3.6Å; K523-Y527 VanDerWaalsContact O-CD2 3.3Å; K523-Y527 WeakPolarHBondContact O-CD2 3.4Å; K523-Y527 PolarHBondContact O-N 3.29Å; C524-Y527 PolarHBondContact O-N 2.91Å; Y527-Q529 PolarHBondContact O-N 2.71Å; Y527-S530 PolarHBondContact O-N 2.95Å; Y527-M531 VanDerWaalsContact O-CG 3.3Å; Y527-M531 WeakPolarHBondContact O-CG 3.49Å; Y527-M531 PolarHBondContact O-N 3.16Å
528	M	80.6	Confident	76.9	Confident	28 Å²	28	76 Å²	76	14%	0.138	39%	0.389	C	S	.	.	H	α-helix	trans	-62.2	-43	177.3	-71.2	174.8	64.9	0	0	112.2	C524 P525 M531 E532 L549	C524-M528 WeakPolarHBondContact O-CG 3.48Å; C524-M528 PolarHBondContact O-N 3.48Å; P525-M528 PolarHBondContact O-N 3.11Å; M528-M531 PolarHBondContact O-N 3.19Å; M528-E532 PolarHBondContact O-N 3.03Å; M528-L549 HydrophobicContact CE-CB 3.84Å; M528-L549 HydrophobicContact CE-CD1 4.09Å; M528-L549 HydrophobicContact SD-CD1 4.46Å
529	Q	79.9	Confident	75	Confident	107 Å²	107	75.5 Å²	75.5	50%	0.5	40%	0.403	S	S	.	.	H	α-helix	trans	-60.3	-44.8	173.8	-74.5	168	-4.8	0	0	111.9	P525 Y527 M531 E532 E533	P525-Q529 WeakPolarHBondContact O-CB 3.25Å; P525-Q529 VanDerWaalsContact O-CG 3.28Å; P525-Q529 WeakPolarHBondContact O-CG 3.37Å; P525-Q529 PolarHBondContact O-N 3.22Å; Y527-Q529 PolarHBondContact O-N 2.71Å; Q529-M531 VanDerWaalsContact C-N 3.31Å; Q529-M531 PolarHBondContact O-N 3.14Å; Q529-E532 WeakPolarHBondContact O-CB 3.34Å; Q529-E532 PolarHBondContact O-N 2.77Å; Q529-E532 VanDerWaalsContact O-N 3.14Å; Q529-E533 WeakPolarHBondContact O-CG 3.37Å; Q529-E533 PolarHBondContact O-N 3.34Å
530	S	80.1	Confident	73.1	Confident	50 Å²	50	80 Å²	80	35%	0.35	44%	0.435	S	S	.	.	H	α-helix	trans	-67.4	-30.4	178	-166.3	0	0	0	0	113.2	L526 Y527 Q534	L526-S530 WeakPolarHBondContact O-CB 3.48Å; L526-S530 PolarHBondContact O-N 2.89Å; Y527-S530 PolarHBondContact O-N 2.95Å; S530-Q534 WeakPolarHBondContact O-CB 3.44Å; S530-Q534 VanDerWaalsContact O-CG 3.23Å; S530-Q534 WeakPolarHBondContact O-CG 2.91Å; S530-Q534 PolarHBondContact O-N 3.39Å; S530-Q534 PolarHBondContact O-NE2 3.23Å; S530-Q534 PolarHBondContact OG-NE2 3.44Å
531	M	73.6	Confident	71.3	Confident	19 Å²	19	82.1 Å²	82.1	9%	0.094	44%	0.444	C	S	.	.	H	α-helix	trans	-71.8	-32.9	171.6	-68.3	176.6	85.2	0	0	112.2	P453 Y527 M528 Q529 L535 F545	P453-M531 HydrophobicContact CB-CE 4.3Å; P453-M531 HydrophobicContact CG-CE 4.25Å; Y527-M531 VanDerWaalsContact O-CG 3.3Å; Y527-M531 WeakPolarHBondContact O-CG 3.49Å; Y527-M531 PolarHBondContact O-N 3.16Å; M528-M531 PolarHBondContact O-N 3.19Å; Q529-M531 VanDerWaalsContact C-N 3.31Å; Q529-M531 PolarHBondContact O-N 3.14Å; M531-L535 WeakPolarHBondContact O-CB 3.39Å; M531-L535 WeakPolarHBondContact O-CD1 3.39Å; M531-L535 VanDerWaalsContact O-CG 3.25Å; M531-L535 WeakPolarHBondContact O-CG 3.32Å; M531-F545 HydrophobicContact CB-CE1 3.99Å
532	E	71.9	Confident	69.9	Low	127 Å²	127	85.5 Å²	85.5	59%	0.593	46%	0.46	S	S	*	.	H	α-helix	trans	-68.4	-48.8	174.2	-170.6	172.6	-165	0	0	111.1	M528 Q529 Q534 L535 F545	M528-E532 PolarHBondContact O-N 3.03Å; Q529-E532 WeakPolarHBondContact O-CB 3.34Å; Q529-E532 PolarHBondContact O-N 2.77Å; Q529-E532 VanDerWaalsContact O-N 3.14Å; E532-Q534 VanDerWaalsContact C-N 3.26Å; E532-Q534 PolarHBondContact O-N 2.85Å; E532-L535 PolarHBondContact O-N 2.76Å; E532-F545 HydrophobicContact CB-CE1 4.38Å; E532-F545 HydrophobicContact CB-CZ 4.13Å
533	E	69.2	Low	68.7	Low	161 Å²	161	85 Å²	85	75%	0.752	47%	0.467	S	S	*	.	H	α-helix	trans	-59.2	-31.3	176.4	-72.5	-179	164.7	0	0	113.7	Q529 L535	Q529-E533 WeakPolarHBondContact O-CG 3.37Å; Q529-E533 PolarHBondContact O-N 3.34Å; E533-L535 VanDerWaalsContact C-N 3.32Å
534	Q	61.1	Low	67.6	Low	143 Å²	143	86.5 Å²	86.5	67%	0.668	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-9.2	177.5	-74	175.4	56.4	0	0	113.7	S530 E532	S530-Q534 WeakPolarHBondContact O-CB 3.44Å; S530-Q534 VanDerWaalsContact O-CG 3.23Å; S530-Q534 WeakPolarHBondContact O-CG 2.91Å; S530-Q534 PolarHBondContact O-N 3.39Å; S530-Q534 PolarHBondContact O-NE2 3.23Å; S530-Q534 PolarHBondContact OG-NE2 3.44Å; E532-Q534 VanDerWaalsContact C-N 3.26Å; E532-Q534 PolarHBondContact O-N 2.85Å
535	L	61.8	Low	66.9	Low	62 Å²	62	88.1 Å²	88.1	33%	0.325	48%	0.484	S	S	.	.			trans	-121.7	55.4	-168.6	-71.3	177.6	0	0	0	113	P453 M531 E532 E533 K541 F545	P453-L535 HydrophobicContact CG-CD1 3.82Å; M531-L535 WeakPolarHBondContact O-CB 3.39Å; M531-L535 WeakPolarHBondContact O-CD1 3.39Å; M531-L535 VanDerWaalsContact O-CG 3.25Å; M531-L535 WeakPolarHBondContact O-CG 3.32Å; E532-L535 PolarHBondContact O-N 2.76Å; E533-L535 VanDerWaalsContact C-N 3.32Å; L535-K541 HydrophobicContact CB-CD 4.2Å; L535-K541 PolarHBondContact O-NZ 3Å; L535-F545 HydrophobicContact CD1-CZ 4.08Å
536	D	51.2	Low	66.5	Low	149 Å²	149	88.4 Å²	88.4	80%	0.797	49%	0.487	S	S	*	.			trans	-47.4	151.7	160.6	-99.1	-36	0	0	0	112.4	K541	D536-K541 PolarHBondContact O-NZ 3.46Å
537	V	49.9	Very low	66.2	Low	120 Å²	120	87.2 Å²	87.2	73%	0.727	49%	0.486	S	S	*	.	S	Bend	trans	86.6	136.2	-172.7	-173.6	0	0	0	0	115.2	K541	V537-K541 WeakPolarHBondContact O-CD 3.44Å; V537-K541 WeakPolarHBondContact O-CE 3.43Å; V537-K541 PolarHBondContact O-NZ 2.93Å
538	T	49.8	Very low	66	Low	132 Å²	132	85.8 Å²	85.8	81%	0.81	48%	0.481	S	S	*	.			trans	-89.9	170.1	-155.2	44.8	0	0	0	0	116.8
539	G	51.5	Low	66.2	Low	52 Å²	52	88 Å²	88	54%	0.536	49%	0.493	S	S	.	.	S	Bend	trans	103.6	-94.4	156.3	0	0	0	0	0	114.8	K541	G539-K541 PolarHBondContact O-N 3Å
540	S	53.6	Low	66.6	Low	100 Å²	100	86.7 Å²	86.7	70%	0.699	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-10.3	-168.3	58.2	0	0	0	0	115.3
541	K	53.8	Low	67	Low	50 Å²	50	84.8 Å²	84.8	22%	0.217	48%	0.48	C	S	.	.	H	α-helix	trans	-74.6	-30.7	-173.1	-65.4	175.9	-178.4	162	0	114.1	L535 D536 V537 G539 S543 L544 F545	L535-K541 HydrophobicContact CB-CD 4.2Å; L535-K541 PolarHBondContact O-NZ 3Å; D536-K541 PolarHBondContact O-NZ 3.46Å; V537-K541 WeakPolarHBondContact O-CD 3.44Å; V537-K541 WeakPolarHBondContact O-CE 3.43Å; V537-K541 PolarHBondContact O-NZ 2.93Å; G539-K541 PolarHBondContact O-N 3Å; K541-S543 PolarHBondContact O-N 2.92Å; K541-S543 VanDerWaalsContact O-N 3.16Å; K541-L544 PolarHBondContact O-N 2.88Å; K541-F545 HydrophobicContact CB-CD2 4.16Å; K541-F545 HydrophobicContact CB-CE2 4.02Å; K541-F545 WeakPolarHBondContact O-CD2 3.35Å; K541-F545 PolarHBondContact O-N 3.21Å
542	E	60.8	Low	67.7	Low	147 Å²	147	84 Å²	84	69%	0.687	48%	0.476	S	S	*	.	H	α-helix	trans	-56	-35	-179.7	-67.4	175.3	-166.1	0	0	112.1	S546	E542-S546 VanDerWaalsContact O-CB 3.24Å; E542-S546 WeakPolarHBondContact O-CB 3.42Å; E542-S546 PolarHBondContact O-N 3.35Å; E542-S546 PolarHBondContact O-OG 3.36Å
543	S	63.3	Low	68.6	Low	87 Å²	87	83.2 Å²	83.2	61%	0.608	47%	0.472	S	S	*	.	H	α-helix	trans	-63.2	-43	174.2	-177.7	0	0	0	0	112.7	K541 S546 C547	K541-S543 PolarHBondContact O-N 2.92Å; K541-S543 VanDerWaalsContact O-N 3.16Å; S543-S546 PolarHBondContact O-N 3.28Å; S543-C547 VanDerWaalsContact O-CB 3.29Å; S543-C547 WeakPolarHBondContact O-CB 3.43Å; S543-C547 PolarHBondContact O-N 2.84Å
544	L	64.9	Low	69.8	Low	81 Å²	81	79.5 Å²	79.5	42%	0.424	46%	0.455	S	S	.	.	H	α-helix	trans	-72.8	-38.7	-179.6	-64.3	174.9	0	0	0	112	K541 C547 T548	K541-L544 PolarHBondContact O-N 2.88Å; L544-C547 PolarHBondContact O-N 2.93Å; L544-T548 WeakPolarHBondContact O-CB 3.16Å; L544-T548 PolarHBondContact O-N 3.3Å; L544-T548 PolarHBondContact O-OG1 3.36Å
545	F	71.3	Confident	71.3	Confident	39 Å²	39	72.7 Å²	72.7	17%	0.171	42%	0.423	C	S	.	.	H	α-helix	trans	-66.1	-41.9	172	-72.3	-64.5	0	0	0	111.7	M531 E532 L535 K541 T548 L549	M531-F545 HydrophobicContact CB-CE1 3.99Å; E532-F545 HydrophobicContact CB-CE1 4.38Å; E532-F545 HydrophobicContact CB-CZ 4.13Å; L535-F545 HydrophobicContact CD1-CZ 4.08Å; K541-F545 HydrophobicContact CB-CD2 4.16Å; K541-F545 HydrophobicContact CB-CE2 4.02Å; K541-F545 WeakPolarHBondContact O-CD2 3.35Å; K541-F545 PolarHBondContact O-N 3.21Å; F545-T548 PolarHBondContact O-N 2.78Å; F545-L549 WeakPolarHBondContact O-CB 3.47Å; F545-L549 PolarHBondContact O-N 2.87Å
546	S	76.3	Confident	72.8	Confident	68 Å²	68	71.6 Å²	71.6	48%	0.476	42%	0.417	S	S	.	.	H	α-helix	trans	-61.7	-44.3	174	-60.4	0	0	0	0	111.9	E542 S543 T548 L549 T550	E542-S546 VanDerWaalsContact O-CB 3.24Å; E542-S546 WeakPolarHBondContact O-CB 3.42Å; E542-S546 PolarHBondContact O-N 3.35Å; E542-S546 PolarHBondContact O-OG 3.36Å; S543-S546 PolarHBondContact O-N 3.28Å; S546-T548 PolarHBondContact O-N 2.93Å; S546-L549 WeakPolarHBondContact O-CB 3.48Å; S546-L549 PolarHBondContact O-N 2.85Å; S546-T550 WeakPolarHBondContact O-CG2 3.4Å; S546-T550 PolarHBondContact O-N 2.96Å; S546-T550 PolarHBondContact O-OG1 3.32Å
547	C	79.7	Confident	74.9	Confident	74 Å²	74	67 Å²	67	50%	0.5	40%	0.399	S	S	.	.	H	α-helix	trans	-60.9	-45.1	175.4	-176	0	0	0	0	111.2	S543 L544 L549 T550 A551	S543-C547 VanDerWaalsContact O-CB 3.29Å; S543-C547 WeakPolarHBondContact O-CB 3.43Å; S543-C547 PolarHBondContact O-N 2.84Å; L544-C547 PolarHBondContact O-N 2.93Å; C547-L549 PolarHBondContact O-N 3.36Å; C547-T550 WeakPolarHBondContact CA-OG1 3.27Å; C547-T550 PolarHBondContact O-N 3.3Å; C547-T550 PolarHBondContact O-OG1 3.31Å; C547-A551 WeakPolarHBondContact O-CB 3.37Å; C547-A551 PolarHBondContact O-N 2.97Å
548	T	82.4	Confident	77	Confident	5 Å²	5	62.2 Å²	62.2	3%	0.031	37%	0.371	C	S	.	.	H	α-helix	trans	-62.6	-40.4	177	-56.6	0	0	0	0	112	F456 L544 F545 S546 A551 S552	F456-T548 HydrophobicContact CD1-CG2 3.73Å; F456-T548 HydrophobicContact CE1-CG2 4.23Å; L544-T548 WeakPolarHBondContact O-CB 3.16Å; L544-T548 PolarHBondContact O-N 3.3Å; L544-T548 PolarHBondContact O-OG1 3.36Å; F545-T548 PolarHBondContact O-N 2.78Å; S546-T548 PolarHBondContact O-N 2.93Å; T548-A551 PolarHBondContact O-N 3.09Å; T548-S552 PolarHBondContact O-N 2.74Å
549	L	84.3	Confident	79.2	Confident	75 Å²	75	56 Å²	56	39%	0.393	33%	0.332	S	S	.	.	H	α-helix	trans	-61.2	-51.7	173.1	-175.2	59.1	0	0	0	111.1	M528 F545 S546 C547 A551 S552 E553	M528-L549 HydrophobicContact CE-CB 3.84Å; M528-L549 HydrophobicContact CE-CD1 4.09Å; M528-L549 HydrophobicContact SD-CD1 4.46Å; F545-L549 WeakPolarHBondContact O-CB 3.47Å; F545-L549 PolarHBondContact O-N 2.87Å; S546-L549 WeakPolarHBondContact O-CB 3.48Å; S546-L549 PolarHBondContact O-N 2.85Å; C547-L549 PolarHBondContact O-N 3.36Å; L549-A551 PolarHBondContact O-N 2.83Å; L549-S552 PolarHBondContact O-N 3Å; L549-S552 VanDerWaalsContact O-N 3.12Å; L549-S552 PolarHBondContact O-OG 2.84Å; L549-E553 HydrophobicContact CD1-CG 4.44Å; L549-E553 WeakPolarHBondContact O-CG 3.31Å; L549-E553 PolarHBondContact O-N 3.26Å
550	T	87.5	Confident	81.3	Confident	80 Å²	80	56.5 Å²	56.5	49%	0.491	32%	0.321	S	S	.	.	H	α-helix	trans	-62.5	-32	179.5	54.3	0	0	0	0	112.8	S546 C547 E554	S546-T550 WeakPolarHBondContact O-CG2 3.4Å; S546-T550 PolarHBondContact O-N 2.96Å; S546-T550 PolarHBondContact O-OG1 3.32Å; C547-T550 WeakPolarHBondContact CA-OG1 3.27Å; C547-T550 PolarHBondContact O-N 3.3Å; C547-T550 PolarHBondContact O-OG1 3.31Å; T550-E554 WeakPolarHBondContact O-CB 3.2Å; T550-E554 PolarHBondContact O-N 3.37Å
551	A	88.7	Confident	83.2	Confident	9 Å²	9	56.9 Å²	56.9	7%	0.074	31%	0.312	C	S	.	.	H	α-helix	trans	-71.2	-37.4	175.1	0	0	0	0	0	112.4	L461 C547 T548 L549 A555	L461-A551 HydrophobicContact CD1-CB 3.71Å; L461-A551 WeakPolarHBondContact CD2-O 3.13Å; L461-A551 HydrophobicContact CG-CB 4.05Å; C547-A551 WeakPolarHBondContact O-CB 3.37Å; C547-A551 PolarHBondContact O-N 2.97Å; T548-A551 PolarHBondContact O-N 3.09Å; L549-A551 PolarHBondContact O-N 2.83Å; A551-A555 VanDerWaalsContact O-CB 3.24Å; A551-A555 WeakPolarHBondContact O-CB 3.42Å; A551-A555 PolarHBondContact O-N 2.97Å
552	S	88.6	Confident	85.2	Confident	3 Å²	3	54.7 Å²	54.7	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-72	-39	174.1	69.9	0	0	0	0	111.9	T548 L549 A555 M556	T548-S552 PolarHBondContact O-N 2.74Å; L549-S552 PolarHBondContact O-N 3Å; L549-S552 VanDerWaalsContact O-N 3.12Å; L549-S552 PolarHBondContact O-OG 2.84Å; S552-A555 PolarHBondContact O-N 3.08Å; S552-M556 WeakPolarHBondContact O-CB 3.45Å; S552-M556 WeakPolarHBondContact O-CE 3.24Å; S552-M556 WeakPolarHBondContact O-CG 3.47Å; S552-M556 PolarHBondContact O-N 3.36Å
553	E	90.9	Very high	86.8	Confident	110 Å²	110	47.8 Å²	47.8	51%	0.514	27%	0.271	S	S	.	.	H	α-helix	trans	-60.7	-46.2	172.2	-72.6	-176.2	168.4	0	0	112.3	L549 A557	L549-E553 HydrophobicContact CD1-CG 4.44Å; L549-E553 WeakPolarHBondContact O-CG 3.31Å; L549-E553 PolarHBondContact O-N 3.26Å; E553-A557 WeakPolarHBondContact O-CB 3.43Å; E553-A557 PolarHBondContact O-N 3.5Å
554	E	94.1	Very high	88.2	Confident	84 Å²	84	46 Å²	46	39%	0.393	25%	0.254	S	S	.	.	H	α-helix	trans	-65.3	-41.3	174.8	179.7	-167.2	146.3	0	0	111.3	L461 R465 T550 A557 V558	L461-E554 HydrophobicContact CD2-CB 3.77Å; L461-E554 VanDerWaalsContact CD2-CD 3.42Å; L461-E554 HydrophobicContact CD2-CG 3.64Å; L461-E554 WeakPolarHBondContact CD2-OE1 3.48Å; R465-E554 IonicContact CZ-OE1 3.62Å; R465-E554 IonicContact NE-OE1 3.32Å; R465-E554 IonicContact NH2-OE1 2.87Å; R465-E554 PolarHBondContact NH2-OE1 3.41Å; R465-E554 IonicContact NH2-OE2 3.03Å; T550-E554 WeakPolarHBondContact O-CB 3.2Å; T550-E554 PolarHBondContact O-N 3.37Å; E554-A557 PolarHBondContact O-N 3.24Å; E554-V558 HydrophobicContact CG-CG2 4.44Å; E554-V558 WeakPolarHBondContact O-CB 3.32Å; E554-V558 VanDerWaalsContact O-CG2 3.32Å; E554-V558 WeakPolarHBondContact O-CG2 3.47Å; E554-V558 PolarHBondContact O-N 3.36Å
555	A	93.9	Very high	89.5	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.7	-43.4	177.4	0	0	0	0	0	112.4	L460 L461 A464 A551 S552 V558 L559	L460-A555 HydrophobicContact CB-CB 3.85Å; L461-A555 HydrophobicContact CD2-CB 4.19Å; A464-A555 HydrophobicContact CB-CB 4.17Å; A551-A555 VanDerWaalsContact O-CB 3.24Å; A551-A555 WeakPolarHBondContact O-CB 3.42Å; A551-A555 PolarHBondContact O-N 2.97Å; S552-A555 PolarHBondContact O-N 3.08Å; A555-V558 PolarHBondContact O-N 3.26Å; A555-L559 WeakPolarHBondContact O-CG 3.49Å; A555-L559 PolarHBondContact O-N 2.9Å
556	M	93	Very high	90.7	Very high	38 Å²	38	43.1 Å²	43.1	19%	0.187	24%	0.236	C	C	.	.	H	α-helix	trans	-62.3	-47.2	173.6	-71.9	-175.4	-68.5	0	0	111.1	L517 I520 Q521 S552 V558 L559 E560	L517-M556 HydrophobicContact CD1-CB 3.8Å; L517-M556 HydrophobicContact CD1-CG 3.93Å; I520-M556 HydrophobicContact CB-CG 4.34Å; I520-M556 HydrophobicContact CG2-CG 3.6Å; I520-M556 HydrophobicContact CG2-SD 3.91Å; Q521-M556 HydrophobicContact CB-SD 4.41Å; Q521-M556 HydrophobicContact CG-SD 3.57Å; Q521-M556 VanDerWaalsContact CG-SD 3.57Å; S552-M556 WeakPolarHBondContact O-CB 3.45Å; S552-M556 WeakPolarHBondContact O-CE 3.24Å; S552-M556 WeakPolarHBondContact O-CG 3.47Å; S552-M556 PolarHBondContact O-N 3.36Å; M556-V558 VanDerWaalsContact C-N 3.29Å; M556-V558 PolarHBondContact O-N 3.1Å; M556-L559 PolarHBondContact O-N 2.94Å; M556-L559 VanDerWaalsContact O-N 3.12Å; M556-E560 WeakPolarHBondContact O-CG 3.24Å; M556-E560 PolarHBondContact O-N 3.02Å
557	A	93.9	Very high	91.6	Very high	52 Å²	52	40 Å²	40	43%	0.43	21%	0.214	S	C	.	.	H	α-helix	trans	-62.4	-33.2	178.2	0	0	0	0	0	113.2	E553 E554 E561	E553-A557 WeakPolarHBondContact O-CB 3.43Å; E553-A557 PolarHBondContact O-N 3.5Å; E554-A557 PolarHBondContact O-N 3.24Å; A557-E561 WeakPolarHBondContact O-CB 3.4Å; A557-E561 PolarHBondContact O-N 2.9Å
558	V	95.8	Very high	92.2	Very high	21 Å²	21	38.1 Å²	38.1	13%	0.127	20%	0.198	C	C	.	.	H	α-helix	trans	-69.4	-42.4	172.8	168.6	0	0	0	0	111.2	A464 R468 E554 A555 M556 E561 V562	A464-V558 HydrophobicContact CB-CB 4.09Å; A464-V558 HydrophobicContact CB-CG1 3.82Å; A464-V558 WeakPolarHBondContact O-CG1 3.45Å; R468-V558 HydrophobicContact CB-CG1 4.09Å; E554-V558 HydrophobicContact CG-CG2 4.44Å; E554-V558 WeakPolarHBondContact O-CB 3.32Å; E554-V558 VanDerWaalsContact O-CG2 3.32Å; E554-V558 WeakPolarHBondContact O-CG2 3.47Å; E554-V558 PolarHBondContact O-N 3.36Å; A555-V558 PolarHBondContact O-N 3.26Å; M556-V558 VanDerWaalsContact C-N 3.29Å; M556-V558 PolarHBondContact O-N 3.1Å; V558-E561 PolarHBondContact O-N 3.31Å; V558-V562 WeakPolarHBondContact O-CB 3.36Å; V558-V562 WeakPolarHBondContact O-CG2 3.43Å; V558-V562 PolarHBondContact O-N 3.47Å
559	L	95.6	Very high	92.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.6	-38	175.5	-70.2	171.9	0	0	0	112	A464 I467 L516 L517 I520 A555 M556 V562 V563	A464-L559 HydrophobicContact CB-CD2 4.27Å; A464-L559 HydrophobicContact CB-CG 4.02Å; I467-L559 HydrophobicContact CD1-CD2 4.2Å; L516-L559 HydrophobicContact CD2-CD1 3.92Å; L516-L559 HydrophobicContact CD2-CD2 4.05Å; L516-L559 HydrophobicContact CG-CD1 3.96Å; L517-L559 HydrophobicContact CB-CB 4.28Å; L517-L559 HydrophobicContact CB-CD1 4.44Å; L517-L559 HydrophobicContact CD1-CB 4.25Å; I520-L559 HydrophobicContact CD1-CD1 3.67Å; A555-L559 WeakPolarHBondContact O-CG 3.49Å; A555-L559 PolarHBondContact O-N 2.9Å; M556-L559 PolarHBondContact O-N 2.94Å; M556-L559 VanDerWaalsContact O-N 3.12Å; L559-V562 PolarHBondContact O-N 3.03Å; L559-V563 WeakPolarHBondContact O-CG2 3.5Å; L559-V563 PolarHBondContact O-N 2.97Å
560	E	94.7	Very high	93.1	Very high	64 Å²	64	36.1 Å²	36.1	30%	0.299	19%	0.187	S	C	.	.	H	α-helix	trans	-61.3	-50.3	170.6	-72.3	178.3	-169.9	0	0	111.6	L517 M556 V562 V563 L564 L778	L517-E560 HydrophobicContact CD1-CG 4.11Å; L517-E560 HydrophobicContact CD2-CG 3.57Å; M556-E560 WeakPolarHBondContact O-CG 3.24Å; M556-E560 PolarHBondContact O-N 3.02Å; E560-V562 PolarHBondContact O-N 3.33Å; E560-V563 PolarHBondContact O-N 3.45Å; E560-L564 HydrophobicContact CB-CD1 4.47Å; E560-L564 WeakPolarHBondContact O-CD1 3.47Å; E560-L564 PolarHBondContact O-N 2.69Å; E560-L778 HydrophobicContact CG-CD1 3.95Å
561	E	93.8	Very high	93.3	Very high	107 Å²	107	32.9 Å²	32.9	50%	0.5	17%	0.167	S	C	.	.	H	α-helix	trans	-56.1	-40.4	176.9	-167.3	175.9	119.3	0	0	110.9	K14 A557 V558 Y565	K14-E561 IonicContact NZ-OE2 3.48Å; K14-E561 PolarHBondContact NZ-OE2 3.38Å; A557-E561 WeakPolarHBondContact O-CB 3.4Å; A557-E561 PolarHBondContact O-N 2.9Å; V558-E561 PolarHBondContact O-N 3.31Å; E561-Y565 WeakPolarHBondContact O-CB 3.48Å; E561-Y565 PolarHBondContact O-N 3.06Å
562	V	95	Very high	93.4	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.03	18%	0.18	C	C	.	.	H	α-helix	trans	-66.4	-46.4	176.8	167.3	0	0	0	0	113	I467 R468 I471 V558 L559 E560 Y565 A566	I467-V562 HydrophobicContact CG2-CG1 4.3Å; R468-V562 HydrophobicContact CB-CG2 3.49Å; R468-V562 VanDerWaalsContact CB-CG2 3.49Å; R468-V562 HydrophobicContact CG-CG2 3.76Å; I471-V562 HydrophobicContact CD1-CG1 3.38Å; I471-V562 HydrophobicContact CG1-CG1 4.49Å; V558-V562 WeakPolarHBondContact O-CB 3.36Å; V558-V562 WeakPolarHBondContact O-CG2 3.43Å; V558-V562 PolarHBondContact O-N 3.47Å; L559-V562 PolarHBondContact O-N 3.03Å; E560-V562 PolarHBondContact O-N 3.33Å; V562-Y565 PolarHBondContact O-N 2.93Å; V562-A566 VanDerWaalsContact O-CB 3.29Å; V562-A566 WeakPolarHBondContact O-CB 3.42Å; V562-A566 PolarHBondContact O-N 3.44Å
563	V	95.1	Very high	93.5	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-65	-46.1	178.9	170.5	0	0	0	0	110.8	M510 I514 L559 E560 Y565 A566 F567 L778	M510-V563 HydrophobicContact CG-CG1 4.16Å; I514-V563 HydrophobicContact CD1-CG1 4.16Å; I514-V563 HydrophobicContact CG1-CG1 3.8Å; I514-V563 HydrophobicContact CG1-CG2 3.85Å; L559-V563 WeakPolarHBondContact O-CG2 3.5Å; L559-V563 PolarHBondContact O-N 2.97Å; E560-V563 PolarHBondContact O-N 3.45Å; V563-Y565 PolarHBondContact O-N 3.19Å; V563-A566 PolarHBondContact O-N 3.45Å; V563-F567 WeakPolarHBondContact O-CB 3.4Å; V563-F567 PolarHBondContact O-N 3.23Å; V563-L778 HydrophobicContact CG1-CD2 3.82Å
564	L	92.4	Very high	93.6	Very high	48 Å²	48	32.3 Å²	32.3	25%	0.251	16%	0.159	S	C	.	.	H	α-helix	trans	-64.3	-38.9	176.9	-84.1	100.6	0	0	0	112.2	E560 Q568 I776	E560-L564 HydrophobicContact CB-CD1 4.47Å; E560-L564 WeakPolarHBondContact O-CD1 3.47Å; E560-L564 PolarHBondContact O-N 2.69Å; L564-Q568 WeakPolarHBondContact O-CB 3.4Å; L564-Q568 VanDerWaalsContact O-CG 3.22Å; L564-Q568 WeakPolarHBondContact O-CG 3.29Å; L564-Q568 PolarHBondContact O-N 3.36Å; L564-I776 HydrophobicContact CD2-CD1 4.35Å
565	Y	93.6	Very high	93.4	Very high	60 Å²	60	28.9 Å²	28.9	24%	0.235	14%	0.144	C	C	.	.	H	α-helix	trans	-65.6	-51.1	176.1	-179.7	-100.7	0	0	0	111.5	I471 W472 T475 E561 V562 V563 F567 Q568 Q569	I471-Y565 HydrophobicContact CG2-CD1 3.88Å; I471-Y565 HydrophobicContact CG2-CE1 4.16Å; W472-Y565 HydrophobicContact CE3-CE1 4.37Å; W472-Y565 AromaticContact CE3-CZ 3.99Å; W472-Y565 HydrophobicContact CZ3-CE2 4.25Å; T475-Y565 HydrophobicContact CG2-CE1 3.98Å; T475-Y565 WeakPolarHBondContact CG2-OH 3.36Å; E561-Y565 WeakPolarHBondContact O-CB 3.48Å; E561-Y565 PolarHBondContact O-N 3.06Å; V562-Y565 PolarHBondContact O-N 2.93Å; V563-Y565 PolarHBondContact O-N 3.19Å; Y565-F567 VanDerWaalsContact C-N 3.3Å; Y565-F567 PolarHBondContact O-N 2.99Å; Y565-Q568 PolarHBondContact O-N 2.91Å; Y565-Q568 VanDerWaalsContact O-N 3.11Å; Y565-Q569 HydrophobicContact CD1-CG 4.13Å; Y565-Q569 HydrophobicContact CD2-CG 4.5Å; Y565-Q569 HydrophobicContact CE1-CG 3.87Å; Y565-Q569 HydrophobicContact CE2-CG 4.27Å; Y565-Q569 HydrophobicContact CG-CG 4.45Å; Y565-Q569 WeakPolarHBondContact O-CG 3.35Å; Y565-Q569 PolarHBondContact O-N 3.39Å
566	A	94.8	Very high	93.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.9	-43.9	178.4	0	0	0	0	0	111.8	I471 I506 M510 V562 V563 Q569 C570	I471-A566 HydrophobicContact CD1-CB 4.27Å; I506-A566 HydrophobicContact CG2-CB 3.74Å; M510-A566 HydrophobicContact CB-CB 3.85Å; M510-A566 HydrophobicContact CG-CB 3.89Å; M510-A566 HydrophobicContact SD-CB 3.96Å; V562-A566 VanDerWaalsContact O-CB 3.29Å; V562-A566 WeakPolarHBondContact O-CB 3.42Å; V562-A566 PolarHBondContact O-N 3.44Å; V563-A566 PolarHBondContact O-N 3.45Å; A566-Q569 PolarHBondContact O-N 2.92Å; A566-C570 PolarHBondContact O-N 2.94Å; A566-C570 PolarHBondContact O-SG 3.33Å
567	F	95.3	Very high	92.9	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.009	15%	0.145	C	C	.	.	H	α-helix	trans	-57.6	-49.7	174.1	-176.9	-80.4	0	0	0	111.9	M510 V563 Y565 Q569 C570 V571 V632 Q635 M636 Y639 I776	M510-F567 HydrophobicContact SD-CB 4.01Å; V563-F567 WeakPolarHBondContact O-CB 3.4Å; V563-F567 PolarHBondContact O-N 3.23Å; Y565-F567 VanDerWaalsContact C-N 3.3Å; Y565-F567 PolarHBondContact O-N 2.99Å; F567-Q569 PolarHBondContact O-N 3.01Å; F567-C570 PolarHBondContact O-N 3.42Å; F567-V571 HydrophobicContact CD1-CG2 3.97Å; F567-V571 HydrophobicContact CE1-CG2 3.69Å; F567-V571 HydrophobicContact CZ-CG2 4.21Å; F567-V571 WeakPolarHBondContact O-CG2 3.32Å; F567-V571 PolarHBondContact O-N 2.88Å; F567-V632 HydrophobicContact CD2-CG1 3.82Å; F567-V632 HydrophobicContact CE2-CG1 4.11Å; F567-Q635 HydrophobicContact CE2-CB 4.29Å; F567-Q635 HydrophobicContact CZ-CB 4.33Å; F567-M636 HydrophobicContact CB-CE 4.31Å; F567-M636 HydrophobicContact CD2-CB 4.43Å; F567-M636 HydrophobicContact CD2-CE 3.54Å; F567-M636 HydrophobicContact CE2-CB 3.72Å; F567-M636 HydrophobicContact CE2-CE 4Å; F567-M636 HydrophobicContact CE2-CG 4.36Å; F567-M636 HydrophobicContact CG-CE 3.92Å; F567-M636 HydrophobicContact CZ-CB 4.1Å; F567-Y639 HydrophobicContact CE1-CD1 4.42Å; F567-Y639 AromaticContact CE1-CD2 3.64Å; F567-Y639 HydrophobicContact CE1-CD2 3.64Å; F567-Y639 HydrophobicContact CE1-CE1 4.47Å; F567-Y639 AromaticContact CE1-CE2 3.7Å; F567-Y639 HydrophobicContact CE1-CE2 3.7Å; F567-Y639 AromaticContact CE1-CG 4Å; F567-Y639 HydrophobicContact CE1-CG 4Å; F567-Y639 AromaticContact CZ-CD2 3.64Å; F567-Y639 HydrophobicContact CZ-CD2 3.64Å; F567-Y639 AromaticContact CZ-CE2 3.97Å; F567-Y639 HydrophobicContact CZ-CE2 3.97Å; F567-Y639 HydrophobicContact CZ-CG 4.23Å; F567-I776 HydrophobicContact CD1-CD1 3.45Å; F567-I776 VanDerWaalsContact CD1-CD1 3.45Å; F567-I776 HydrophobicContact CD1-CG1 4.08Å; F567-I776 HydrophobicContact CE1-CD1 3.62Å; F567-I776 HydrophobicContact CE1-CG1 3.76Å; F567-I776 HydrophobicContact CG-CD1 4.15Å; F567-I776 HydrophobicContact CZ-CD1 4.42Å; F567-I776 HydrophobicContact CZ-CG1 4.16Å
568	Q	92.2	Very high	92.7	Very high	35 Å²	35	26.7 Å²	26.7	16%	0.164	12%	0.124	C	C	.	.	H	α-helix	trans	-62.6	-41.1	-179.7	-74.2	169.4	16.9	0	0	112.6	M9 L564 Y565 Y572	M9-Q568 HydrophobicContact CE-CG 4.5Å; M9-Q568 HydrophobicContact SD-CG 4.32Å; L564-Q568 WeakPolarHBondContact O-CB 3.4Å; L564-Q568 VanDerWaalsContact O-CG 3.22Å; L564-Q568 WeakPolarHBondContact O-CG 3.29Å; L564-Q568 PolarHBondContact O-N 3.36Å; Y565-Q568 PolarHBondContact O-N 2.91Å; Y565-Q568 VanDerWaalsContact O-N 3.11Å; Q568-Y572 WeakPolarHBondContact O-CB 3.38Å; Q568-Y572 PolarHBondContact O-N 2.87Å
569	Q	92.1	Very high	92.4	Very high	38 Å²	38	29.7 Å²	29.7	18%	0.178	13%	0.134	C	C	.	.	H	α-helix	trans	-63.8	-45.6	176.6	-63.7	-60.2	-34.9	0	0	111.3	T475 Y565 A566 F567 Y572 Y573	T475-Q569 HydrophobicContact CG2-CB 4.3Å; T475-Q569 HydrophobicContact CG2-CG 3.6Å; Y565-Q569 HydrophobicContact CD1-CG 4.13Å; Y565-Q569 HydrophobicContact CD2-CG 4.5Å; Y565-Q569 HydrophobicContact CE1-CG 3.87Å; Y565-Q569 HydrophobicContact CE2-CG 4.27Å; Y565-Q569 HydrophobicContact CG-CG 4.45Å; Y565-Q569 WeakPolarHBondContact O-CG 3.35Å; Y565-Q569 PolarHBondContact O-N 3.39Å; A566-Q569 PolarHBondContact O-N 2.92Å; F567-Q569 PolarHBondContact O-N 3.01Å; Q569-Y572 PolarHBondContact O-N 3.12Å; Q569-Y573 WeakPolarHBondContact O-CD2 3.37Å; Q569-Y573 PolarHBondContact O-N 3.42Å
570	C	93.6	Very high	91.9	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.007	16%	0.156	C	C	.	.	H	α-helix	trans	-63.7	-45.2	178.5	-62.6	0	0	0	0	111.7	L507 A566 F567 Y572 Y573 V574 M636	L507-C570 HydrophobicContact CD2-CB 4.03Å; L507-C570 WeakPolarHBondContact CD2-SG 3.2Å; L507-C570 VanDerWaalsContact CG-SG 3.56Å; A566-C570 PolarHBondContact O-N 2.94Å; A566-C570 PolarHBondContact O-SG 3.33Å; F567-C570 PolarHBondContact O-N 3.42Å; C570-Y572 VanDerWaalsContact C-N 3.32Å; C570-Y572 PolarHBondContact O-N 3.18Å; C570-Y573 PolarHBondContact O-N 3.48Å; C570-V574 WeakPolarHBondContact O-CB 3.44Å; C570-V574 VanDerWaalsContact O-CG2 3.32Å; C570-V574 WeakPolarHBondContact O-CG2 3.44Å; C570-V574 PolarHBondContact O-N 3.4Å; C570-M636 HydrophobicContact CB-CE 3.78Å; C570-M636 HydrophobicContact CB-SD 3.99Å
571	V	92.9	Very high	91.4	Very high	12 Å²	12	32.1 Å²	32.1	7%	0.073	15%	0.149	C	C	.	.	H	α-helix	trans	-58	-44	173	169.5	0	0	0	0	111.1	F567 S575 M636 Y639 L640	F567-V571 HydrophobicContact CD1-CG2 3.97Å; F567-V571 HydrophobicContact CE1-CG2 3.69Å; F567-V571 HydrophobicContact CZ-CG2 4.21Å; F567-V571 WeakPolarHBondContact O-CG2 3.32Å; F567-V571 PolarHBondContact O-N 2.88Å; V571-S575 WeakPolarHBondContact O-CB 3.29Å; V571-S575 PolarHBondContact O-N 3.33Å; V571-S575 PolarHBondContact O-OG 2.93Å; V571-M636 HydrophobicContact CG2-CE 4.4Å; V571-M636 HydrophobicContact CG2-CG 3.77Å; V571-M636 HydrophobicContact CG2-SD 4.48Å; V571-Y639 HydrophobicContact CG1-CD1 4.06Å; V571-Y639 HydrophobicContact CG2-CG 4.45Å; V571-L640 HydrophobicContact CG1-CD2 4.34Å
572	Y	90.3	Very high	91.2	Very high	92 Å²	92	27 Å²	27	36%	0.361	13%	0.125	S	C	.	.	H	α-helix	trans	-61.3	-52.3	179.7	170.9	-102.6	0	0	0	112.5	F7 Q568 Q569 C570 S575 K576	F7-Y572 HydrophobicContact CB-CE2 4.11Å; Q568-Y572 WeakPolarHBondContact O-CB 3.38Å; Q568-Y572 PolarHBondContact O-N 2.87Å; Q569-Y572 PolarHBondContact O-N 3.12Å; C570-Y572 VanDerWaalsContact C-N 3.32Å; C570-Y572 PolarHBondContact O-N 3.18Å; Y572-S575 PolarHBondContact O-N 3.47Å; Y572-K576 PolarHBondContact O-N 3.32Å
573	Y	90.8	Very high	90.8	Very high	14 Å²	14	27.8 Å²	27.8	6%	0.055	13%	0.131	C	C	.	.	H	α-helix	trans	-70.5	-37.5	-177.1	-70.5	-71.7	0	0	0	112.8	L478 A479 Q482 L499 L503 Q569 C570 S575 K576 S577	L478-Y573 HydrophobicContact CD1-CD1 4.44Å; L478-Y573 HydrophobicContact CD1-CE1 4.35Å; L478-Y573 HydrophobicContact CD2-CD2 3.51Å; L478-Y573 HydrophobicContact CD2-CE2 3.48Å; L478-Y573 VanDerWaalsContact CD2-CE2 3.48Å; L478-Y573 HydrophobicContact CD2-CG 4.12Å; L478-Y573 HydrophobicContact CG-CD2 4.15Å; L478-Y573 HydrophobicContact CG-CE1 4.19Å; L478-Y573 HydrophobicContact CG-CE2 3.77Å; A479-Y573 WeakPolarHBondContact CA-OH 3.37Å; Q482-Y573 HydrophobicContact CB-CE1 4.11Å; Q482-Y573 HydrophobicContact CG-CD1 4.18Å; Q482-Y573 HydrophobicContact CG-CE1 3.79Å; L499-Y573 HydrophobicContact CD1-CG 4.33Å; L503-Y573 HydrophobicContact CD2-CD2 4.35Å; Q569-Y573 WeakPolarHBondContact O-CD2 3.37Å; Q569-Y573 PolarHBondContact O-N 3.42Å; C570-Y573 PolarHBondContact O-N 3.48Å; Y573-S575 VanDerWaalsContact C-N 3.33Å; Y573-S575 PolarHBondContact O-N 2.98Å; Y573-K576 WeakPolarHBondContact O-CB 3.42Å; Y573-K576 PolarHBondContact O-N 3.26Å; Y573-S577 PolarHBondContact O-N 3.49Å; Y573-S577 VanDerWaalsContact O-N 3.15Å
574	V	91.9	Very high	90.2	Very high	4 Å²	4	29.1 Å²	29.1	2%	0.024	14%	0.142	C	C	.	.	H	α-helix	trans	-67.5	-35.7	173.2	-179.9	0	0	0	0	111.1	M496 L503 C570 K576 S577 L578 V615 A619 L640	M496-V574 HydrophobicContact CE-CG1 3.96Å; M496-V574 HydrophobicContact CE-CG2 3.92Å; M496-V574 HydrophobicContact SD-CG1 4.16Å; M496-V574 HydrophobicContact SD-CG2 4.21Å; L503-V574 HydrophobicContact CD1-CG2 3.8Å; C570-V574 WeakPolarHBondContact O-CB 3.44Å; C570-V574 VanDerWaalsContact O-CG2 3.32Å; C570-V574 WeakPolarHBondContact O-CG2 3.44Å; C570-V574 PolarHBondContact O-N 3.4Å; V574-K576 VanDerWaalsContact C-N 3.33Å; V574-K576 PolarHBondContact O-N 2.91Å; V574-S577 PolarHBondContact O-N 3.3Å; V574-L578 HydrophobicContact CG1-CD1 4.38Å; V574-L578 WeakPolarHBondContact O-CG 3.49Å; V574-L578 PolarHBondContact O-N 2.92Å; V574-V615 HydrophobicContact CG1-CG1 4.13Å; V574-A619 HydrophobicContact CG1-CB 4.24Å; V574-L640 HydrophobicContact CB-CD1 4.28Å; V574-L640 HydrophobicContact CB-CD2 4.09Å; V574-L640 HydrophobicContact CG1-CD1 3.6Å; V574-L640 HydrophobicContact CG1-CD2 3.96Å; V574-L640 HydrophobicContact CG1-CG 4.45Å
575	S	91.3	Very high	89.8	Confident	11 Å²	11	27.4 Å²	27.4	8%	0.077	13%	0.133	C	C	.	.	H	α-helix	trans	-64.9	-34.2	171.8	-61.3	0	0	0	0	112.5	V571 Y572 Y573 L578 Y579 L640 F643	V571-S575 WeakPolarHBondContact O-CB 3.29Å; V571-S575 PolarHBondContact O-N 3.33Å; V571-S575 PolarHBondContact O-OG 2.93Å; Y572-S575 PolarHBondContact O-N 3.47Å; Y573-S575 VanDerWaalsContact C-N 3.33Å; Y573-S575 PolarHBondContact O-N 2.98Å; S575-L578 PolarHBondContact O-N 2.84Å; S575-Y579 WeakPolarHBondContact O-CB 3.35Å; S575-Y579 PolarHBondContact O-N 3.21Å; S575-L640 WeakPolarHBondContact OG-CD2 3.49Å; S575-F643 WeakPolarHBondContact O-CE1 3.25Å
576	K	88.3	Confident	89.2	Confident	39 Å²	39	25.1 Å²	25.1	17%	0.17	13%	0.125	C	C	.	.	H	α-helix	trans	-62	-43	172.6	-174.1	-173.2	176.7	-173.3	0	111.3	Y572 Y573 V574	Y572-K576 PolarHBondContact O-N 3.32Å; Y573-K576 WeakPolarHBondContact O-CB 3.42Å; Y573-K576 PolarHBondContact O-N 3.26Å; V574-K576 VanDerWaalsContact C-N 3.33Å; V574-K576 PolarHBondContact O-N 2.91Å
577	S	88.3	Confident	88.2	Confident	5 Å²	5	29.5 Å²	29.5	4%	0.035	15%	0.145	C	C	.	.	H	α-helix	trans	-67.7	-42.9	174.2	-58.4	0	0	0	0	112.4	Y573 V574 Y579 I580	Y573-S577 PolarHBondContact O-N 3.49Å; Y573-S577 VanDerWaalsContact O-N 3.15Å; V574-S577 PolarHBondContact O-N 3.3Å; S577-Y579 VanDerWaalsContact C-N 3.35Å; S577-Y579 PolarHBondContact O-N 3.27Å; S577-I580 PolarHBondContact O-N 3.37Å
578	L	89.8	Confident	86.6	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-60.4	-40.5	175	-78.2	171.6	0	0	0	112.6	V574 S575 I580 C581 L582 V615 Y616 L640 F643	V574-L578 HydrophobicContact CG1-CD1 4.38Å; V574-L578 WeakPolarHBondContact O-CG 3.49Å; V574-L578 PolarHBondContact O-N 2.92Å; S575-L578 PolarHBondContact O-N 2.84Å; L578-I580 PolarHBondContact O-N 2.86Å; L578-I580 VanDerWaalsContact O-N 3.15Å; L578-C581 PolarHBondContact O-N 3.31Å; L578-C581 VanDerWaalsContact O-N 3.13Å; L578-L582 HydrophobicContact CB-CD1 3.81Å; L578-L582 HydrophobicContact CB-CG 4.27Å; L578-L582 HydrophobicContact CD2-CD1 4.48Å; L578-L582 HydrophobicContact CD2-CG 4.38Å; L578-L582 VanDerWaalsContact O-CB 3.31Å; L578-L582 WeakPolarHBondContact O-CB 3.27Å; L578-L582 WeakPolarHBondContact O-CG 3.42Å; L578-L582 PolarHBondContact O-N 3.5Å; L578-V615 HydrophobicContact CD2-CB 3.94Å; L578-V615 HydrophobicContact CD2-CG1 3.46Å; L578-V615 VanDerWaalsContact CD2-CG1 3.46Å; L578-V615 HydrophobicContact CG-CG1 3.61Å; L578-Y616 HydrophobicContact CD1-CD1 4.34Å; L578-Y616 HydrophobicContact CD1-CE1 3.7Å; L578-Y616 HydrophobicContact CD2-CD1 4.32Å; L578-Y616 HydrophobicContact CD2-CE1 3.84Å; L578-Y616 HydrophobicContact CD2-CE2 4.41Å; L578-Y616 HydrophobicContact CG-CE1 4.45Å; L578-L640 HydrophobicContact CD1-CB 4.06Å; L578-L640 HydrophobicContact CD1-CD2 4Å; L578-L640 HydrophobicContact CD1-CG 4.43Å; L578-F643 HydrophobicContact CB-CE1 4.18Å
579	Y	88.8	Confident	84.9	Confident	84 Å²	84	32 Å²	32	33%	0.329	17%	0.165	S	C	.	.	H	α-helix	trans	-56.3	-31.9	179.8	-177.4	-91	0	0	0	113	S575 S577 P583 F643 L647	S575-Y579 WeakPolarHBondContact O-CB 3.35Å; S575-Y579 PolarHBondContact O-N 3.21Å; S577-Y579 VanDerWaalsContact C-N 3.35Å; S577-Y579 PolarHBondContact O-N 3.27Å; Y579-P583 VanDerWaalsContact O-CD 3.29Å; Y579-P583 WeakPolarHBondContact O-CD 3.17Å; Y579-F643 HydrophobicContact CD2-CZ 4.29Å; Y579-L647 HydrophobicContact CD2-CD1 3.89Å; Y579-L647 HydrophobicContact CD2-CD2 3.71Å; Y579-L647 HydrophobicContact CD2-CG 4.48Å; Y579-L647 HydrophobicContact CE2-CD1 3.82Å; Y579-L647 HydrophobicContact CE2-CD2 4.42Å; Y579-L647 HydrophobicContact CG-CD2 4.4Å
580	I	84.9	Confident	82.6	Confident	93 Å²	93	33.1 Å²	33.1	48%	0.477	18%	0.175	S	C	.	.	H	α-helix	trans	-75.9	-39.3	179.7	-60.7	167.4	0	0	0	111.3	C494 S577 L578	C494-I580 HydrophobicContact CB-CD1 3.9Å; S577-I580 PolarHBondContact O-N 3.37Å; L578-I580 PolarHBondContact O-N 2.86Å; L578-I580 VanDerWaalsContact O-N 3.15Å
581	C	85.1	Confident	80.6	Confident	22 Å²	22	40.4 Å²	40.4	15%	0.149	21%	0.207	C	C	.	.	H	α-helix	trans	-97	-26.3	-172.5	65.6	0	0	0	0	115	L578 A584 V612	L578-C581 PolarHBondContact O-N 3.31Å; L578-C581 VanDerWaalsContact O-N 3.13Å; C581-A584 WeakPolarHBondContact O-CB 3.17Å; C581-A584 PolarHBondContact O-N 3.31Å; C581-V612 HydrophobicContact CB-CG2 4.26Å
582	L	88.9	Confident	78.4	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-44.5	-178.6	-77.4	168.9	0	0	0	114.6	L578 A584 L585 V612 F643 S644 L647 L648	L578-L582 HydrophobicContact CB-CD1 3.81Å; L578-L582 HydrophobicContact CB-CG 4.27Å; L578-L582 HydrophobicContact CD2-CD1 4.48Å; L578-L582 HydrophobicContact CD2-CG 4.38Å; L578-L582 VanDerWaalsContact O-CB 3.31Å; L578-L582 WeakPolarHBondContact O-CB 3.27Å; L578-L582 WeakPolarHBondContact O-CG 3.42Å; L578-L582 PolarHBondContact O-N 3.5Å; L582-A584 PolarHBondContact O-N 3.47Å; L582-A584 VanDerWaalsContact O-N 3.1Å; L582-L585 HydrophobicContact CD2-CD1 4.01Å; L582-L585 WeakPolarHBondContact O-CB 3.45Å; L582-L585 WeakPolarHBondContact O-CG 3.39Å; L582-L585 PolarHBondContact O-N 2.77Å; L582-V612 HydrophobicContact CD2-CG1 3.88Å; L582-V612 HydrophobicContact CD2-CG2 4.18Å; L582-F643 HydrophobicContact CD1-CE1 4.38Å; L582-S644 WeakPolarHBondContact CD1-OG 3.46Å; L582-L647 HydrophobicContact CB-CD2 4.37Å; L582-L647 HydrophobicContact CD1-CD2 3.88Å; L582-L648 HydrophobicContact CB-CD2 4.08Å; L582-L648 HydrophobicContact CD2-CD1 4.26Å; L582-L648 WeakPolarHBondContact O-CD2 3.39Å
583	P	86.8	Confident	75.9	Confident	21 Å²	21	50.4 Å²	50.4	14%	0.136	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-30.1	-177.5	-27	36.3	0	0	0	114.1	Y579 L585 L586 E587	Y579-P583 VanDerWaalsContact O-CD 3.29Å; Y579-P583 WeakPolarHBondContact O-CD 3.17Å; P583-L585 PolarHBondContact O-N 3.29Å; P583-L585 VanDerWaalsContact O-N 3.14Å; P583-L586 PolarHBondContact O-N 2.77Å; P583-E587 PolarHBondContact O-N 2.74Å; P583-E587 VanDerWaalsContact O-N 3.1Å
584	A	82.5	Confident	73.4	Confident	30 Å²	30	57.3 Å²	57.3	25%	0.248	29%	0.291	C	S	.	.	H	α-helix	trans	-62.6	-19.8	177.8	0	0	0	0	0	113.6	C581 L582 L586 C588 E608 R673	C581-A584 WeakPolarHBondContact O-CB 3.17Å; C581-A584 PolarHBondContact O-N 3.31Å; L582-A584 PolarHBondContact O-N 3.47Å; L582-A584 VanDerWaalsContact O-N 3.1Å; A584-L586 PolarHBondContact O-N 2.89Å; A584-C588 PolarHBondContact O-SG 3.29Å; A584-E608 HydrophobicContact CB-CB 3.96Å; A584-E608 HydrophobicContact CB-CG 4.15Å; A584-R673 PolarHBondContact O-NH1 2.93Å
585	L	83.7	Confident	70.7	Confident	12 Å²	12	66.6 Å²	66.6	6%	0.063	33%	0.326	C	S	.	.	H	α-helix	trans	-61.3	-31.7	171.5	-63.9	177.5	0	0	0	112.1	L582 P583 L609 V612 L648 R673 L677	L582-L585 HydrophobicContact CD2-CD1 4.01Å; L582-L585 WeakPolarHBondContact O-CB 3.45Å; L582-L585 WeakPolarHBondContact O-CG 3.39Å; L582-L585 PolarHBondContact O-N 2.77Å; P583-L585 PolarHBondContact O-N 3.29Å; P583-L585 VanDerWaalsContact O-N 3.14Å; L585-L609 HydrophobicContact CD2-CB 4.04Å; L585-L609 HydrophobicContact CD2-CD1 3.98Å; L585-V612 HydrophobicContact CD1-CG1 4.37Å; L585-V612 HydrophobicContact CD1-CG2 4.12Å; L585-V612 HydrophobicContact CD2-CG2 4.14Å; L585-V612 HydrophobicContact CG-CG2 4.07Å; L585-L648 HydrophobicContact CD1-CD1 4Å; L585-R673 WeakPolarHBondContact O-CD 3.45Å; L585-R673 PolarHBondContact O-NH1 3.4Å; L585-L677 HydrophobicContact CD1-CD2 4.42Å
586	L	81.8	Confident	68.1	Low	12 Å²	12	74.9 Å²	74.9	6%	0.063	36%	0.356	C	S	.	.	H	α-helix	trans	-97.6	-39.6	-178.1	-59.3	178.3	0	0	0	113.1	P583 A584 C588 L648 L652 L659 C661 A670 L701	P583-L586 PolarHBondContact O-N 2.77Å; A584-L586 PolarHBondContact O-N 2.89Å; L586-C588 VanDerWaalsContact C-N 3.34Å; L586-C588 PolarHBondContact O-N 3.24Å; L586-L648 HydrophobicContact CD1-CD2 3.99Å; L586-L648 HydrophobicContact CG-CD2 4.14Å; L586-L652 HydrophobicContact CD1-CB 4.25Å; L586-L652 HydrophobicContact CD2-CD1 4.41Å; L586-L659 HydrophobicContact CD1-CD1 4.43Å; L586-C661 PolarHBondContact O-SG 2.95Å; L586-C661 VanDerWaalsContact O-SG 3.41Å; L586-A670 HydrophobicContact CD2-CB 4.09Å; L586-L701 HydrophobicContact CD2-CD2 4.48Å
587	E	73.3	Confident	65.7	Low	92 Å²	92	80.2 Å²	80.2	43%	0.43	38%	0.381	S	S	.	.	H	α-helix	trans	-75.8	-8.6	-165.1	-74.9	-179	174.8	0	0	116.3	P583 L659	P583-E587 PolarHBondContact O-N 2.74Å; P583-E587 VanDerWaalsContact O-N 3.1Å; E587-L659 HydrophobicContact CG-CD2 3.31Å; E587-L659 WeakPolarHBondContact OE1-CD2 3.31Å
588	C	62.4	Low	63.2	Low	12 Å²	12	83.9 Å²	83.9	8%	0.081	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-64.8	155	-165.6	-73.2	0	0	0	0	116.4	A584 L586 E608 R666 R673	A584-C588 PolarHBondContact O-SG 3.29Å; L586-C588 VanDerWaalsContact C-N 3.34Å; L586-C588 PolarHBondContact O-N 3.24Å; C588-E608 PolarHBondContact SG-OE1 3Å; C588-R666 PolarHBondContact O-NH1 2.93Å; C588-R673 VanDerWaalsContact CB-NH1 3.3Å; C588-R673 PolarHBondContact SG-NH1 3.47Å; C588-R673 PolarHBondContact SG-NH2 2.95Å
589	P	55	Low	61.1	Low	79 Å²	79	96.2 Å²	96.2	51%	0.513	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-61.9	150.9	168	27.6	-35.1	0	0	0	111.8	Q669	P589-Q669 PolarHBondContact O-NE2 3.35Å; P589-Q669 VanDerWaalsContact O-NE2 3.15Å
590	P	45.3	Very low	58.4	Low	60 Å²	60	97.5 Å²	97.5	39%	0.39	47%	0.473	S	S	.	.	S	Bend	trans	-74.1	132.1	179.2	31.6	-33.2	0	0	0	110.4
591	F	50	Low	56.2	Low	155 Å²	155	98.3 Å²	98.3	68%	0.68	49%	0.488	S	S	*	.			trans	42.9	88.2	173	-54.2	-78.4	0	0	0	115.1	M593 P665	F591-M593 PolarHBondContact O-N 2.83Å; F591-P665 HydrophobicContact CE2-CB 4.28Å
592	Q	47.1	Very low	54.3	Low	130 Å²	130	101 Å²	101	61%	0.607	51%	0.512	S	S	*	.			trans	-60.3	106.5	156.3	-69.9	-155.1	44.8	0	0	108	E594	Q592-E594 HydrophobicContact CB-CG 4.41Å; Q592-E594 PolarHBondContact O-N 3.44Å
593	M	37.8	Very low	52.5	Low	184 Å²	184	106.5 Å²	106.5	91%	0.906	55%	0.547	S	S	*	.			trans	-78.1	63.6	173.9	-168.8	-176.8	-67.8	0	0	108.8	F591 R595	F591-M593 PolarHBondContact O-N 2.83Å; M593-R595 PolarHBondContact O-N 2.67Å
594	E	37.6	Very low	51.3	Low	158 Å²	158	113.3 Å²	113.3	74%	0.738	58%	0.577	S	S	*	*			trans	-59.8	106.5	167.4	-72	-168.6	130.2	0	0	107.9	Q592 R596	Q592-E594 HydrophobicContact CB-CG 4.41Å; Q592-E594 PolarHBondContact O-N 3.44Å; E594-R596 VanDerWaalsContact C-N 3.34Å; E594-R596 PolarHBondContact O-N 3.24Å
595	R	35.8	Very low	50.6	Low	199 Å²	199	114.4 Å²	114.4	75%	0.751	58%	0.578	S	S	*	*			trans	-67.5	96.7	175.1	-173.4	-159.1	-69.9	175.4	-0.5	107.3	M593 E597	M593-R595 PolarHBondContact O-N 2.67Å; R595-E597 VanDerWaalsContact C-N 3.26Å; R595-E597 WeakPolarHBondContact CD-OE1 3.49Å; R595-E597 HydrophobicContact CG-CG 4.19Å; R595-E597 IonicContact CZ-OE1 3.1Å; R595-E597 IonicContact NE-OE1 2.82Å; R595-E597 IonicContact NH1-OE1 3.21Å; R595-E597 PolarHBondContact NH1-OE1 2.89Å; R595-E597 PolarHBondContact O-N 3.44Å
596	R	38	Very low	50.5	Low	186 Å²	186	115.8 Å²	115.8	70%	0.702	59%	0.588	S	S	*	*			trans	-66.8	79	-175.7	-173.8	-179.5	-76	-133.3	-5.6	111.8	E594 S598	E594-R596 VanDerWaalsContact C-N 3.34Å; E594-R596 PolarHBondContact O-N 3.24Å; R596-S598 WeakPolarHBondContact CG-O 3.49Å; R596-S598 PolarHBondContact O-N 3.23Å; R596-S598 VanDerWaalsContact O-N 3.14Å
597	E	37.3	Very low	50.3	Low	150 Å²	150	119.3 Å²	119.3	70%	0.701	60%	0.604	S	S	*	*			trans	-83.1	50.8	171.1	-68	-174.5	-162	0	0	111.3	R595	R595-E597 VanDerWaalsContact C-N 3.26Å; R595-E597 WeakPolarHBondContact CD-OE1 3.49Å; R595-E597 HydrophobicContact CG-CG 4.19Å; R595-E597 IonicContact CZ-OE1 3.1Å; R595-E597 IonicContact NE-OE1 2.82Å; R595-E597 IonicContact NH1-OE1 3.21Å; R595-E597 PolarHBondContact NH1-OE1 2.89Å; R595-E597 PolarHBondContact O-N 3.44Å
598	S	36.5	Very low	50.7	Low	83 Å²	83	116 Å²	116	58%	0.58	59%	0.589	S	S	*	*			trans	-167.7	145.9	161.9	55.5	0	0	0	0	112.6	R596	R596-S598 WeakPolarHBondContact CG-O 3.49Å; R596-S598 PolarHBondContact O-N 3.23Å; R596-S598 VanDerWaalsContact O-N 3.14Å
599	W	45	Very low	51.8	Low	258 Å²	258	115.5 Å²	115.5	98%	0.977	59%	0.586	S	S	*	*			trans	-108.4	92.7	172.1	-74.9	76.2	0	0	0	109.7
600	C	31.7	Very low	53.3	Low	111 Å²	111	116.7 Å²	116.7	75%	0.75	58%	0.58	S	S	*	*			trans	-166.9	159.4	157.6	-118.5	0	0	0	0	112.7
601	S	39.3	Very low	55.3	Low	111 Å²	111	120 Å²	120	78%	0.776	59%	0.585	S	S	*	*	S	Bend	trans	65.3	165.5	166.6	-60.4	0	0	0	0	117.9
602	A	44.2	Very low	57.2	Low	79 Å²	79	112.7 Å²	112.7	65%	0.653	55%	0.552	S	S	*	*	S	Bend	trans	-63	155.5	-172.7	0	0	0	0	0	112.7	E604	A602-E604 PolarHBondContact O-N 3.17Å
603	P	50.8	Low	59.3	Low	114 Å²	114	107.3 Å²	107.3	74%	0.74	53%	0.528	S	S	*	.			trans	-63.3	110.2	176.7	26.7	-34.4	0	0	0	110.5
604	E	61.2	Low	61.9	Low	165 Å²	165	101.6 Å²	101.6	77%	0.771	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-62.6	143.5	177.3	-64.1	-168.1	172.5	0	0	111.6	A602	A602-E604 PolarHBondContact O-N 3.17Å
605	L	69.6	Low	64.5	Low	52 Å²	52	94.7 Å²	94.7	27%	0.272	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-68.8	134.3	-179.2	-148.6	67	0	0	0	109.8	L609 R610 V613 Q676	L605-L609 HydrophobicContact CD1-CD2 3.78Å; L605-L609 HydrophobicContact CD1-CG 4.34Å; L605-L609 HydrophobicContact CD2-CD2 4.18Å; L605-L609 HydrophobicContact CD2-CG 3.83Å; L605-L609 HydrophobicContact CG-CB 4.33Å; L605-L609 HydrophobicContact CG-CD2 3.82Å; L605-L609 HydrophobicContact CG-CG 3.85Å; L605-R610 PolarHBondContact O-NE 3.09Å; L605-R610 PolarHBondContact O-NH2 3Å; L605-V613 HydrophobicContact CD2-CB 4.28Å; L605-V613 HydrophobicContact CD2-CG2 3.91Å; L605-Q676 HydrophobicContact CD1-CB 4.36Å
606	P	79.8	Confident	67.3	Low	42 Å²	42	85.2 Å²	85.2	27%	0.273	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-53.1	141.1	179.2	-28.1	34.8	0	0	0	112.4	E608 L609 R610	P606-E608 PolarHBondContact O-N 3.29Å; P606-L609 HydrophobicContact CB-CB 4.47Å; P606-L609 CarbonylContact O-C 3.44Å; P606-L609 PolarHBondContact O-N 3.02Å; P606-R610 WeakPolarHBondContact O-CB 3.4Å; P606-R610 PolarHBondContact O-N 3.36Å
607	E	79.1	Confident	69.9	Low	85 Å²	85	79.2 Å²	79.2	40%	0.397	42%	0.419	S	S	.	.	H	α-helix	trans	-38.6	-46.3	-177.8	-77.7	-93.5	120.5	0	0	115.4	R610 R611	E607-R610 IonicContact OE1-CZ 2.73Å; E607-R610 IonicContact OE1-NH1 3.07Å; E607-R610 PolarHBondContact OE1-NH1 3.12Å; E607-R610 IonicContact OE1-NH2 2.7Å; E607-R611 WeakPolarHBondContact O-CG 3.32Å; E607-R611 PolarHBondContact O-N 3.24Å; E607-R611 VanDerWaalsContact O-N 3.14Å; E607-R611 PolarHBondContact O-NE 3.49Å; E607-R611 IonicContact OE2-CZ 3.53Å; E607-R611 IonicContact OE2-NH2 2.81Å; E607-R611 PolarHBondContact OE2-NH2 2.96Å
608	E	81.3	Confident	72.6	Confident	24 Å²	24	73.5 Å²	73.5	11%	0.112	40%	0.398	C	S	.	.	H	α-helix	trans	-79.6	-37.7	-173.3	-44.2	88	163.2	0	0	110.9	A584 C588 P606 R611 V612 R673	A584-E608 HydrophobicContact CB-CB 3.96Å; A584-E608 HydrophobicContact CB-CG 4.15Å; C588-E608 PolarHBondContact SG-OE1 3Å; P606-E608 PolarHBondContact O-N 3.29Å; E608-R611 PolarHBondContact O-N 3.27Å; E608-V612 PolarHBondContact O-N 2.97Å; E608-V612 VanDerWaalsContact O-N 3.1Å; E608-R673 IonicContact OE1-NH2 2.76Å; E608-R673 PolarHBondContact OE1-NH2 3.32Å; E608-R673 IonicContact OE2-CZ 2.67Å; E608-R673 IonicContact OE2-NH2 2.64Å; E608-R673 PolarHBondContact OE2-NH2 3.43Å
609	L	85.3	Confident	75.3	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.005	37%	0.373	C	S	.	.	H	α-helix	trans	-70.4	-36.9	173.4	-179.5	57.2	0	0	0	111.4	L585 L605 P606 R611 V612 V613 Q676 L677	L585-L609 HydrophobicContact CD2-CB 4.04Å; L585-L609 HydrophobicContact CD2-CD1 3.98Å; L605-L609 HydrophobicContact CD1-CD2 3.78Å; L605-L609 HydrophobicContact CD1-CG 4.34Å; L605-L609 HydrophobicContact CD2-CD2 4.18Å; L605-L609 HydrophobicContact CD2-CG 3.83Å; L605-L609 HydrophobicContact CG-CB 4.33Å; L605-L609 HydrophobicContact CG-CD2 3.82Å; L605-L609 HydrophobicContact CG-CG 3.85Å; P606-L609 HydrophobicContact CB-CB 4.47Å; P606-L609 CarbonylContact O-C 3.44Å; P606-L609 PolarHBondContact O-N 3.02Å; L609-R611 VanDerWaalsContact C-N 3.32Å; L609-R611 PolarHBondContact O-N 2.88Å; L609-V612 PolarHBondContact O-N 3.27Å; L609-V613 HydrophobicContact CD1-CG2 4.1Å; L609-V613 HydrophobicContact CG-CG2 4.42Å; L609-V613 WeakPolarHBondContact O-CB 3.29Å; L609-V613 WeakPolarHBondContact O-CG2 3.21Å; L609-V613 PolarHBondContact O-N 3.39Å; L609-Q676 HydrophobicContact CD2-CB 3.48Å; L609-Q676 VanDerWaalsContact CD2-CB 3.48Å; L609-L677 HydrophobicContact CD1-CB 3.75Å; L609-L677 HydrophobicContact CD1-CD1 3.73Å; L609-L677 HydrophobicContact CD1-CG 4.2Å
610	R	86.4	Confident	77.7	Confident	103 Å²	103	57.8 Å²	57.8	39%	0.389	33%	0.327	S	S	.	.	H	α-helix	trans	-58.8	-43.2	172.2	-162.4	-168.5	-48.8	134.7	4.7	111.1	L605 P606 E607 S614	L605-R610 PolarHBondContact O-NE 3.09Å; L605-R610 PolarHBondContact O-NH2 3Å; P606-R610 WeakPolarHBondContact O-CB 3.4Å; P606-R610 PolarHBondContact O-N 3.36Å; E607-R610 IonicContact OE1-CZ 2.73Å; E607-R610 IonicContact OE1-NH1 3.07Å; E607-R610 PolarHBondContact OE1-NH1 3.12Å; E607-R610 IonicContact OE1-NH2 2.7Å; R610-S614 WeakPolarHBondContact O-CB 3.29Å; R610-S614 PolarHBondContact O-N 2.9Å; R610-S614 PolarHBondContact O-OG 2.77Å
611	R	86.5	Confident	80.7	Confident	131 Å²	131	55 Å²	55	49%	0.494	31%	0.305	S	S	.	.	H	α-helix	trans	-61.2	-50.9	173.5	-74.3	172.4	-124.8	-175.8	-5	111.6	E607 E608 L609 V613 S614 V615	E607-R611 WeakPolarHBondContact O-CG 3.32Å; E607-R611 PolarHBondContact O-N 3.24Å; E607-R611 VanDerWaalsContact O-N 3.14Å; E607-R611 PolarHBondContact O-NE 3.49Å; E607-R611 IonicContact OE2-CZ 3.53Å; E607-R611 IonicContact OE2-NH2 2.81Å; E607-R611 PolarHBondContact OE2-NH2 2.96Å; E608-R611 PolarHBondContact O-N 3.27Å; L609-R611 VanDerWaalsContact C-N 3.32Å; L609-R611 PolarHBondContact O-N 2.88Å; R611-V613 PolarHBondContact O-N 3.16Å; R611-S614 PolarHBondContact O-N 2.88Å; R611-S614 PolarHBondContact O-OG 3.26Å; R611-V615 PolarHBondContact O-N 2.98Å
612	V	90.9	Very high	83.3	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-60.5	-45.8	178.1	171.3	0	0	0	0	112.3	C581 L582 L585 E608 L609 S614 V615 Y616 L677	C581-V612 HydrophobicContact CB-CG2 4.26Å; L582-V612 HydrophobicContact CD2-CG1 3.88Å; L582-V612 HydrophobicContact CD2-CG2 4.18Å; L585-V612 HydrophobicContact CD1-CG1 4.37Å; L585-V612 HydrophobicContact CD1-CG2 4.12Å; L585-V612 HydrophobicContact CD2-CG2 4.14Å; L585-V612 HydrophobicContact CG-CG2 4.07Å; E608-V612 PolarHBondContact O-N 2.97Å; E608-V612 VanDerWaalsContact O-N 3.1Å; L609-V612 PolarHBondContact O-N 3.27Å; V612-S614 VanDerWaalsContact C-N 3.34Å; V612-S614 PolarHBondContact O-N 3.12Å; V612-V615 WeakPolarHBondContact O-CB 3.42Å; V612-V615 PolarHBondContact O-N 3.43Å; V612-V615 VanDerWaalsContact O-N 3.17Å; V612-Y616 HydrophobicContact CG1-CD2 4.13Å; V612-Y616 HydrophobicContact CG1-CE2 3.53Å; V612-Y616 WeakPolarHBondContact O-CD2 3.48Å; V612-Y616 PolarHBondContact O-N 3.43Å; V612-L677 HydrophobicContact CG1-CD1 4.28Å
613	V	91.6	Very high	85.7	Confident	17 Å²	17	46.3 Å²	46.3	10%	0.103	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-40.8	176	165.7	0	0	0	0	111.3	L605 L609 R611 V615 Y616 Q617 L677 W680	L605-V613 HydrophobicContact CD2-CB 4.28Å; L605-V613 HydrophobicContact CD2-CG2 3.91Å; L609-V613 HydrophobicContact CD1-CG2 4.1Å; L609-V613 HydrophobicContact CG-CG2 4.42Å; L609-V613 WeakPolarHBondContact O-CB 3.29Å; L609-V613 WeakPolarHBondContact O-CG2 3.21Å; L609-V613 PolarHBondContact O-N 3.39Å; R611-V613 PolarHBondContact O-N 3.16Å; V613-V615 PolarHBondContact O-N 3.07Å; V613-Y616 PolarHBondContact O-N 3.25Å; V613-Q617 VanDerWaalsContact O-CB 3.28Å; V613-Q617 WeakPolarHBondContact O-CB 3.28Å; V613-Q617 PolarHBondContact O-N 3.36Å; V613-L677 HydrophobicContact CG2-CD1 3.78Å; V613-W680 HydrophobicContact CG1-CD2 3.89Å; V613-W680 HydrophobicContact CG1-CG 4Å; V613-W680 HydrophobicContact CG1-CZ2 4.26Å; V613-W680 HydrophobicContact CG2-CB 4.39Å; V613-W680 HydrophobicContact CG2-CD2 4.01Å; V613-W680 HydrophobicContact CG2-CE3 4.25Å; V613-W680 HydrophobicContact CG2-CG 4.02Å
614	S	91.4	Very high	87.8	Confident	65 Å²	65	47.3 Å²	47.3	46%	0.455	23%	0.228	S	C	.	.	H	α-helix	trans	-60.9	-29.5	176.8	73.7	0	0	0	0	113.5	R610 R611 V612 A618	R610-S614 WeakPolarHBondContact O-CB 3.29Å; R610-S614 PolarHBondContact O-N 2.9Å; R610-S614 PolarHBondContact O-OG 2.77Å; R611-S614 PolarHBondContact O-N 2.88Å; R611-S614 PolarHBondContact O-OG 3.26Å; V612-S614 VanDerWaalsContact C-N 3.34Å; V612-S614 PolarHBondContact O-N 3.12Å; S614-A618 WeakPolarHBondContact O-CB 3.05Å; S614-A618 PolarHBondContact O-N 2.96Å
615	V	92.7	Very high	89.4	Confident	12 Å²	12	45 Å²	45	7%	0.073	22%	0.217	C	C	.	.	H	α-helix	trans	-70.1	-49	175.7	173.7	0	0	0	0	111.6	M496 V574 L578 R611 V612 V613 A619	M496-V615 HydrophobicContact CE-CG1 4.21Å; M496-V615 HydrophobicContact CG-CB 4Å; M496-V615 HydrophobicContact CG-CG1 3.7Å; M496-V615 HydrophobicContact CG-CG2 3.72Å; M496-V615 HydrophobicContact SD-CG1 3.96Å; V574-V615 HydrophobicContact CG1-CG1 4.13Å; L578-V615 HydrophobicContact CD2-CB 3.94Å; L578-V615 HydrophobicContact CD2-CG1 3.46Å; L578-V615 VanDerWaalsContact CD2-CG1 3.46Å; L578-V615 HydrophobicContact CG-CG1 3.61Å; R611-V615 PolarHBondContact O-N 2.98Å; V612-V615 WeakPolarHBondContact O-CB 3.42Å; V612-V615 PolarHBondContact O-N 3.43Å; V612-V615 VanDerWaalsContact O-N 3.17Å; V613-V615 PolarHBondContact O-N 3.07Å; V615-A619 PolarHBondContact O-N 3.44Å; V615-A619 VanDerWaalsContact O-N 3.09Å
616	Y	93.9	Very high	90.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.3	-39.6	175.9	-60.8	-60.1	0	0	0	112.3	L578 V612 V613 A619 L620 L640 F641 S644 L677 W680	L578-Y616 HydrophobicContact CD1-CD1 4.34Å; L578-Y616 HydrophobicContact CD1-CE1 3.7Å; L578-Y616 HydrophobicContact CD2-CD1 4.32Å; L578-Y616 HydrophobicContact CD2-CE1 3.84Å; L578-Y616 HydrophobicContact CD2-CE2 4.41Å; L578-Y616 HydrophobicContact CG-CE1 4.45Å; V612-Y616 HydrophobicContact CG1-CD2 4.13Å; V612-Y616 HydrophobicContact CG1-CE2 3.53Å; V612-Y616 WeakPolarHBondContact O-CD2 3.48Å; V612-Y616 PolarHBondContact O-N 3.43Å; V613-Y616 PolarHBondContact O-N 3.25Å; Y616-A619 PolarHBondContact O-N 2.96Å; Y616-L620 WeakPolarHBondContact O-CB 3.49Å; Y616-L620 PolarHBondContact O-N 3.34Å; Y616-L640 HydrophobicContact CD1-CB 4.47Å; Y616-L640 HydrophobicContact CE1-CB 4.1Å; Y616-F641 HydrophobicContact CD1-CD1 4.28Å; Y616-F641 AromaticContact CD1-CE1 3.8Å; Y616-F641 HydrophobicContact CD1-CE1 3.8Å; Y616-F641 HydrophobicContact CD2-CE1 4.35Å; Y616-F641 AromaticContact CE1-CD1 3.79Å; Y616-F641 HydrophobicContact CE1-CD1 3.79Å; Y616-F641 AromaticContact CE1-CE1 3.78Å; Y616-F641 HydrophobicContact CE1-CE1 3.78Å; Y616-F641 HydrophobicContact CE2-CE1 4.31Å; Y616-F641 HydrophobicContact CG-CE1 4.1Å; Y616-F641 AromaticContact CZ-CD1 3.95Å; Y616-S644 WeakPolarHBondContact OH-CB 3.39Å; Y616-S644 PolarHBondContact OH-OG 3.18Å; Y616-L677 HydrophobicContact CD2-CD1 4.4Å; Y616-L677 HydrophobicContact CE2-CD1 4.07Å; Y616-W680 VanDerWaalsContact CB-CH2 3.43Å; Y616-W680 HydrophobicContact CD2-CH2 4.47Å; Y616-W680 AromaticContact CD2-CZ3 3.92Å; Y616-W680 HydrophobicContact CD2-CZ3 3.92Å; Y616-W680 HydrophobicContact CG-CH2 4.33Å; Y616-W680 HydrophobicContact CG-CZ3 4.13Å
617	Q	93.1	Very high	91.2	Very high	60 Å²	60	42.8 Å²	42.8	28%	0.28	20%	0.202	S	C	.	.	H	α-helix	trans	-63.8	-47.7	178.5	-173.2	65.1	49.7	0	0	111.1	V613 A619 L620 D621 W680	V613-Q617 VanDerWaalsContact O-CB 3.28Å; V613-Q617 WeakPolarHBondContact O-CB 3.28Å; V613-Q617 PolarHBondContact O-N 3.36Å; Q617-A619 VanDerWaalsContact C-N 3.32Å; Q617-A619 PolarHBondContact O-N 3.45Å; Q617-L620 PolarHBondContact O-N 3.33Å; Q617-D621 WeakPolarHBondContact CG-OD2 3.14Å; Q617-D621 PolarHBondContact NE2-OD1 2.93Å; Q617-D621 PolarHBondContact NE2-OD2 3.4Å; Q617-D621 WeakPolarHBondContact O-CB 3.44Å; Q617-D621 PolarHBondContact O-N 3.39Å; Q617-W680 HydrophobicContact CB-CZ2 4.35Å
618	A	93.4	Very high	92	Very high	31 Å²	31	39.2 Å²	39.2	26%	0.256	19%	0.185	S	C	.	.	H	α-helix	trans	-61.5	-38.5	176.4	0	0	0	0	0	112.6	M496 S614 L622	M496-A618 HydrophobicContact CB-CB 4.4Å; M496-A618 HydrophobicContact CE-CB 4.28Å; S614-A618 WeakPolarHBondContact O-CB 3.05Å; S614-A618 PolarHBondContact O-N 2.96Å; A618-L622 WeakPolarHBondContact O-CB 3.33Å; A618-L622 PolarHBondContact O-N 2.91Å
619	A	94.5	Very high	92.7	Very high	6 Å²	6	38.6 Å²	38.6	5%	0.05	18%	0.183	C	C	.	.	H	α-helix	trans	-65.5	-45.2	174.4	0	0	0	0	0	112.1	M496 V574 V615 Y616 Q617 L622 L623	M496-A619 HydrophobicContact CE-CB 4.04Å; V574-A619 HydrophobicContact CG1-CB 4.24Å; V615-A619 PolarHBondContact O-N 3.44Å; V615-A619 VanDerWaalsContact O-N 3.09Å; Y616-A619 PolarHBondContact O-N 2.96Å; Q617-A619 VanDerWaalsContact C-N 3.32Å; Q617-A619 PolarHBondContact O-N 3.45Å; A619-L622 PolarHBondContact O-N 3.29Å; A619-L623 WeakPolarHBondContact O-CD1 3.32Å; A619-L623 WeakPolarHBondContact O-CG 3.12Å; A619-L623 PolarHBondContact O-N 2.83Å
620	L	94.7	Very high	93	Very high	5 Å²	5	43 Å²	43	3%	0.026	21%	0.211	C	C	.	.	H	α-helix	trans	-64.3	-42.5	178.5	177.3	56.4	0	0	0	112.4	Y616 Q617 L623 R624 L637 F686	Y616-L620 WeakPolarHBondContact O-CB 3.49Å; Y616-L620 PolarHBondContact O-N 3.34Å; Q617-L620 PolarHBondContact O-N 3.33Å; L620-L623 PolarHBondContact O-N 3.11Å; L620-R624 HydrophobicContact CD1-CG 4.49Å; L620-R624 VanDerWaalsContact O-CG 3.3Å; L620-R624 WeakPolarHBondContact O-CG 3.4Å; L620-R624 PolarHBondContact O-N 3.1Å; L620-L637 HydrophobicContact CB-CD1 4.24Å; L620-L637 HydrophobicContact CD1-CD1 4.03Å; L620-L637 HydrophobicContact CD2-CD1 4.26Å; L620-L637 HydrophobicContact CG-CD1 4.4Å; L620-F686 HydrophobicContact CD1-CE2 4.17Å; L620-F686 HydrophobicContact CD1-CZ 4.11Å; L620-F686 HydrophobicContact CD2-CE2 3.88Å
621	D	94.3	Very high	93.3	Very high	53 Å²	53	42.5 Å²	42.5	28%	0.283	21%	0.213	S	C	.	.	H	α-helix	trans	-71.8	-36.1	179.1	-67	-26.6	0	0	0	111.4	Q617 R624 Q625	Q617-D621 WeakPolarHBondContact CG-OD2 3.14Å; Q617-D621 PolarHBondContact NE2-OD1 2.93Å; Q617-D621 PolarHBondContact NE2-OD2 3.4Å; Q617-D621 WeakPolarHBondContact O-CB 3.44Å; Q617-D621 PolarHBondContact O-N 3.39Å; D621-R624 PolarHBondContact O-N 2.99Å; D621-R624 IonicContact OD1-NH1 3.67Å; D621-R624 PolarHBondContact OD1-NH1 3.48Å; D621-Q625 VanDerWaalsContact O-CB 3.3Å; D621-Q625 WeakPolarHBondContact O-CB 3.36Å; D621-Q625 WeakPolarHBondContact O-CG 2.9Å; D621-Q625 PolarHBondContact O-N 3.22Å
622	L	94.9	Very high	93.6	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.026	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-44.2	171.4	177.7	59.3	0	0	0	112.1	V500 L503 Q504 L507 A618 A619 R624 Q625 L626	V500-L622 HydrophobicContact CG1-CD1 4.3Å; V500-L622 HydrophobicContact CG2-CD2 4.29Å; L503-L622 HydrophobicContact CB-CD2 4.03Å; Q504-L622 HydrophobicContact CG-CD1 3.5Å; Q504-L622 VanDerWaalsContact CG-CD1 3.5Å; L507-L622 HydrophobicContact CD1-CD2 3.66Å; L507-L622 HydrophobicContact CD1-CG 3.72Å; A618-L622 WeakPolarHBondContact O-CB 3.33Å; A618-L622 PolarHBondContact O-N 2.91Å; A619-L622 PolarHBondContact O-N 3.29Å; L622-R624 VanDerWaalsContact C-N 3.32Å; L622-R624 PolarHBondContact O-N 3.34Å; L622-Q625 PolarHBondContact O-N 2.92Å; L622-L626 HydrophobicContact CD1-CD1 3.56Å; L622-L626 HydrophobicContact CD1-CG 4.13Å; L622-L626 HydrophobicContact CG-CD1 4.17Å; L622-L626 WeakPolarHBondContact O-CG 3.48Å; L622-L626 PolarHBondContact O-N 2.88Å
623	L	95.2	Very high	93.8	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-60.1	-41.9	175.3	-72.4	163.4	0	0	0	111.7	L507 A619 L620 Q627 V628 A633 M636	L507-L623 HydrophobicContact CD1-CD2 4.21Å; L507-L623 HydrophobicContact CD2-CD2 3.82Å; A619-L623 WeakPolarHBondContact O-CD1 3.32Å; A619-L623 WeakPolarHBondContact O-CG 3.12Å; A619-L623 PolarHBondContact O-N 2.83Å; L620-L623 PolarHBondContact O-N 3.11Å; L623-Q627 PolarHBondContact O-N 3.37Å; L623-V628 HydrophobicContact CB-CB 4.43Å; L623-V628 HydrophobicContact CD2-CB 4.01Å; L623-V628 HydrophobicContact CD2-CG1 3.93Å; L623-V628 HydrophobicContact CD2-CG2 3.97Å; L623-V628 WeakPolarHBondContact O-CB 3.41Å; L623-V628 PolarHBondContact O-N 3.27Å; L623-A633 HydrophobicContact CB-CB 4.11Å; L623-A633 HydrophobicContact CD1-CB 4.07Å; L623-A633 HydrophobicContact CG-CB 4.5Å; L623-M636 HydrophobicContact CD1-CB 4.28Å; L623-M636 HydrophobicContact CD1-CG 4.44Å; L623-M636 HydrophobicContact CD1-SD 4.06Å; L623-M636 HydrophobicContact CD2-CE 4.41Å; L623-M636 HydrophobicContact CD2-SD 3.91Å; L623-M636 HydrophobicContact CG-SD 4.46Å
624	R	94	Very high	93.8	Very high	135 Å²	135	37.4 Å²	37.4	51%	0.509	20%	0.199	S	C	.	.	H	α-helix	trans	-68.6	-46.7	176.7	-72.7	166.3	170.9	166.7	-3.7	112.8	L620 D621 L622 L626 Q627	L620-R624 HydrophobicContact CD1-CG 4.49Å; L620-R624 VanDerWaalsContact O-CG 3.3Å; L620-R624 WeakPolarHBondContact O-CG 3.4Å; L620-R624 PolarHBondContact O-N 3.1Å; D621-R624 PolarHBondContact O-N 2.99Å; D621-R624 IonicContact OD1-NH1 3.67Å; D621-R624 PolarHBondContact OD1-NH1 3.48Å; L622-R624 VanDerWaalsContact C-N 3.32Å; L622-R624 PolarHBondContact O-N 3.34Å; R624-L626 PolarHBondContact O-N 3.41Å; R624-Q627 PolarHBondContact O-N 3.49Å
625	Q	93.9	Very high	93.9	Very high	116 Å²	116	35 Å²	35	54%	0.542	18%	0.181	S	C	.	.	H	α-helix	trans	-59.3	-29.2	179.3	-77.8	169.4	6.7	0	0	112.7	K433 D621 L622	K433-Q625 WeakPolarHBondContact CG-O 3.5Å; D621-Q625 VanDerWaalsContact O-CB 3.3Å; D621-Q625 WeakPolarHBondContact O-CB 3.36Å; D621-Q625 WeakPolarHBondContact O-CG 2.9Å; D621-Q625 PolarHBondContact O-N 3.22Å; L622-Q625 PolarHBondContact O-N 2.92Å
626	L	94.9	Very high	94	Very high	2 Å²	2	34.7 Å²	34.7	1%	0.01	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	9.9	179.1	-62.1	175.7	0	0	0	113.8	K433 Q504 L507 F508 S511 L622 R624 V628	K433-L626 HydrophobicContact CD-CD2 4.29Å; Q504-L626 HydrophobicContact CB-CD1 4.49Å; Q504-L626 HydrophobicContact CG-CD1 4.27Å; Q504-L626 WeakPolarHBondContact O-CD1 3.34Å; L507-L626 HydrophobicContact CB-CD1 3.49Å; L507-L626 VanDerWaalsContact CB-CD1 3.49Å; L507-L626 HydrophobicContact CD1-CD1 4.41Å; F508-L626 HydrophobicContact CB-CD2 4.22Å; F508-L626 HydrophobicContact CD2-CD2 4.33Å; S511-L626 WeakPolarHBondContact CB-O 3.35Å; S511-L626 PolarHBondContact OG-O 3.04Å; L622-L626 HydrophobicContact CD1-CD1 3.56Å; L622-L626 HydrophobicContact CD1-CG 4.13Å; L622-L626 HydrophobicContact CG-CD1 4.17Å; L622-L626 WeakPolarHBondContact O-CG 3.48Å; L622-L626 PolarHBondContact O-N 2.88Å; R624-L626 PolarHBondContact O-N 3.41Å; L626-V628 HydrophobicContact CB-CG2 4.39Å; L626-V628 PolarHBondContact O-N 3.39Å
627	Q	94.1	Very high	94.1	Very high	46 Å²	46	34.7 Å²	34.7	22%	0.215	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	35.1	179.9	-61.2	176.5	-38.8	0	0	113.2	H432 K433 L434 L623 R624 H629	H432-Q627 PolarHBondContact CD2-NE2 3.03Å; H432-Q627 PolarHBondContact CE1-OE1 3.09Å; H432-Q627 PolarHBondContact NE2-NE2 3.23Å; H432-Q627 PolarHBondContact NE2-OE1 2.95Å; K433-Q627 HydrophobicContact CB-CB 4.36Å; K433-Q627 HydrophobicContact CB-CG 4.24Å; K433-Q627 HydrophobicContact CG-CG 4.31Å; L434-Q627 HydrophobicContact CD1-CB 4.21Å; L434-Q627 HydrophobicContact CG-CB 4.15Å; L623-Q627 PolarHBondContact O-N 3.37Å; R624-Q627 PolarHBondContact O-N 3.49Å; Q627-H629 PolarHBondContact O-N 2.9Å
628	V	95.2	Very high	94.1	Very high	9 Å²	9	32.5 Å²	32.5	6%	0.055	17%	0.171	C	C	.	.			trans	-65.4	131.6	173.1	176.8	0	0	0	0	109.1	L507 M510 L623 L626 V632	L507-V628 HydrophobicContact CB-CG2 4.44Å; M510-V628 HydrophobicContact CE-CB 4.46Å; M510-V628 HydrophobicContact CE-CG1 3.54Å; M510-V628 HydrophobicContact CE-CG2 4.01Å; L623-V628 HydrophobicContact CB-CB 4.43Å; L623-V628 HydrophobicContact CD2-CB 4.01Å; L623-V628 HydrophobicContact CD2-CG1 3.93Å; L623-V628 HydrophobicContact CD2-CG2 3.97Å; L623-V628 WeakPolarHBondContact O-CB 3.41Å; L623-V628 PolarHBondContact O-N 3.27Å; L626-V628 HydrophobicContact CB-CG2 4.39Å; L626-V628 PolarHBondContact O-N 3.39Å; V628-V632 HydrophobicContact CG1-CB 4.18Å; V628-V632 HydrophobicContact CG1-CG1 4.19Å
629	H	95	Very high	94.1	Very high	12 Å²	12	32.3 Å²	32.3	6%	0.056	16%	0.164	C	C	.	.			trans	-50.8	131.9	-175	-170.3	-89.4	0	0	0	111.8	I514 Q627 E631 V632 A633 P779 E781	I514-H629 HydrophobicContact CG2-CB 4.1Å; Q627-H629 PolarHBondContact O-N 2.9Å; H629-E631 PolarHBondContact ND1-N 2.88Å; H629-E631 PolarHBondContact O-N 3.12Å; H629-V632 HydrophobicContact CB-CG2 4.34Å; H629-V632 PolarHBondContact O-N 2.94Å; H629-A633 PolarHBondContact O-N 3.36Å; H629-P779 HydrophobicContact CB-CG 4.26Å; H629-P779 WeakPolarHBondContact CE1-CB 3.36Å; H629-P779 VanDerWaalsContact ND1-CB 3.35Å; H629-P779 WeakPolarHBondContact ND1-CB 3.49Å; H629-E781 PolarHBondContact CE1-O 3.34Å; H629-E781 PolarHBondContact NE2-O 3.01Å; H629-E781 VanDerWaalsContact NE2-O 3.16Å
630	P	92.6	Very high	94.1	Very high	93 Å²	93	32 Å²	32	60%	0.604	16%	0.161	S	C	*	.	H	α-helix	trans	-53.9	-36.8	-170.4	-30	35.8	0	0	0	114.7	A633 S634	P630-A633 PolarHBondContact O-N 2.94Å; P630-S634 WeakPolarHBondContact O-CB 3.35Å; P630-S634 PolarHBondContact O-N 2.85Å
631	E	91.8	Very high	94.1	Very high	92 Å²	92	31.8 Å²	31.8	43%	0.43	16%	0.16	S	C	.	.	H	α-helix	trans	-70.7	-28.5	178.6	-172.9	49.9	-147.2	0	0	113.4	H629 S634 Q635	H629-E631 PolarHBondContact ND1-N 2.88Å; H629-E631 PolarHBondContact O-N 3.12Å; E631-S634 PolarHBondContact O-OG 3.03Å; E631-S634 PolarHBondContact OE2-OG 3.32Å; E631-Q635 WeakPolarHBondContact O-CB 3.15Å; E631-Q635 WeakPolarHBondContact O-CG 3.48Å; E631-Q635 PolarHBondContact O-N 3.05Å; E631-Q635 PolarHBondContact O-NE2 3.33Å; E631-Q635 PolarHBondContact OE1-NE2 2.98Å
632	V	93.9	Very high	94.1	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.012	15%	0.152	C	C	.	.	H	α-helix	trans	-79.6	-34.5	173.1	-179.3	0	0	0	0	110.3	M510 I514 F567 V628 H629 M636 P779	M510-V632 HydrophobicContact CE-CG1 4.04Å; I514-V632 HydrophobicContact CD1-CB 4.28Å; I514-V632 HydrophobicContact CD1-CG1 4.19Å; I514-V632 HydrophobicContact CD1-CG2 3.93Å; F567-V632 HydrophobicContact CD2-CG1 3.82Å; F567-V632 HydrophobicContact CE2-CG1 4.11Å; V628-V632 HydrophobicContact CG1-CB 4.18Å; V628-V632 HydrophobicContact CG1-CG1 4.19Å; H629-V632 HydrophobicContact CB-CG2 4.34Å; H629-V632 PolarHBondContact O-N 2.94Å; V632-M636 WeakPolarHBondContact O-CB 3.48Å; V632-M636 PolarHBondContact O-N 2.68Å; V632-P779 HydrophobicContact CG2-CG 4.26Å
633	A	93.9	Very high	94	Very high	9 Å²	9	31.8 Å²	31.8	7%	0.074	16%	0.157	C	C	.	.	H	α-helix	trans	-66.7	-39.7	173.6	0	0	0	0	0	112.5	L623 H629 P630 M636 L637	L623-A633 HydrophobicContact CB-CB 4.11Å; L623-A633 HydrophobicContact CD1-CB 4.07Å; L623-A633 HydrophobicContact CG-CB 4.5Å; H629-A633 PolarHBondContact O-N 3.36Å; P630-A633 PolarHBondContact O-N 2.94Å; A633-M636 PolarHBondContact O-N 3.32Å; A633-L637 PolarHBondContact O-N 2.95Å; A633-L637 VanDerWaalsContact O-N 3.1Å
634	S	92.5	Very high	94	Very high	30 Å²	30	31.7 Å²	31.7	21%	0.21	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-44.1	175.3	71.7	0	0	0	0	111.5	P630 E631 M636 L637 A638	P630-S634 WeakPolarHBondContact O-CB 3.35Å; P630-S634 PolarHBondContact O-N 2.85Å; E631-S634 PolarHBondContact O-OG 3.03Å; E631-S634 PolarHBondContact OE2-OG 3.32Å; S634-M636 PolarHBondContact O-N 2.95Å; S634-L637 PolarHBondContact O-N 3.12Å; S634-A638 WeakPolarHBondContact O-CB 3.39Å; S634-A638 PolarHBondContact O-N 3.06Å
635	Q	93.9	Very high	94	Very high	15 Å²	15	25.4 Å²	25.4	7%	0.07	13%	0.134	C	C	.	.	H	α-helix	trans	-63.5	-38.5	174.5	-72.1	170.5	33.5	0	0	112.3	F567 E631 A638 Y639 V777	F567-Q635 HydrophobicContact CE2-CB 4.29Å; F567-Q635 HydrophobicContact CZ-CB 4.33Å; E631-Q635 WeakPolarHBondContact O-CB 3.15Å; E631-Q635 WeakPolarHBondContact O-CG 3.48Å; E631-Q635 PolarHBondContact O-N 3.05Å; E631-Q635 PolarHBondContact O-NE2 3.33Å; E631-Q635 PolarHBondContact OE1-NE2 2.98Å; Q635-A638 WeakPolarHBondContact O-CB 3.48Å; Q635-A638 PolarHBondContact O-N 3.04Å; Q635-Y639 WeakPolarHBondContact O-CD2 3.42Å; Q635-Y639 PolarHBondContact O-N 3.01Å; Q635-V777 PolarHBondContact NE2-O 2.96Å; Q635-V777 PolarHBondContact OE1-O 2.89Å
636	M	94.8	Very high	93.9	Very high	5 Å²	5	20.3 Å²	20.3	3%	0.025	11%	0.111	C	C	.	.	H	α-helix	trans	-63.3	-44.8	176.1	-170.1	168.5	-68.5	0	0	111.5	L507 M510 F567 C570 V571 L623 V632 A633 S634 Y639 L640	L507-M636 HydrophobicContact CD2-CE 4.14Å; M510-M636 HydrophobicContact CE-CE 4.26Å; F567-M636 HydrophobicContact CB-CE 4.31Å; F567-M636 HydrophobicContact CD2-CB 4.43Å; F567-M636 HydrophobicContact CD2-CE 3.54Å; F567-M636 HydrophobicContact CE2-CB 3.72Å; F567-M636 HydrophobicContact CE2-CE 4Å; F567-M636 HydrophobicContact CE2-CG 4.36Å; F567-M636 HydrophobicContact CG-CE 3.92Å; F567-M636 HydrophobicContact CZ-CB 4.1Å; C570-M636 HydrophobicContact CB-CE 3.78Å; C570-M636 HydrophobicContact CB-SD 3.99Å; V571-M636 HydrophobicContact CG2-CE 4.4Å; V571-M636 HydrophobicContact CG2-CG 3.77Å; V571-M636 HydrophobicContact CG2-SD 4.48Å; L623-M636 HydrophobicContact CD1-CB 4.28Å; L623-M636 HydrophobicContact CD1-CG 4.44Å; L623-M636 HydrophobicContact CD1-SD 4.06Å; L623-M636 HydrophobicContact CD2-CE 4.41Å; L623-M636 HydrophobicContact CD2-SD 3.91Å; L623-M636 HydrophobicContact CG-SD 4.46Å; V632-M636 WeakPolarHBondContact O-CB 3.48Å; V632-M636 PolarHBondContact O-N 2.68Å; A633-M636 PolarHBondContact O-N 3.32Å; S634-M636 PolarHBondContact O-N 2.95Å; M636-Y639 WeakPolarHBondContact O-CB 3.32Å; M636-Y639 PolarHBondContact O-N 3.1Å; M636-L640 WeakPolarHBondContact O-CG 3.39Å; M636-L640 PolarHBondContact O-N 3.24Å; M636-L640 VanDerWaalsContact O-N 3.1Å
637	L	94.7	Very high	93.7	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-65.8	-38.6	174	-68.8	-167.4	0	0	0	112.4	L620 A633 S634 Y639 L640 F641 F686	L620-L637 HydrophobicContact CB-CD1 4.24Å; L620-L637 HydrophobicContact CD1-CD1 4.03Å; L620-L637 HydrophobicContact CD2-CD1 4.26Å; L620-L637 HydrophobicContact CG-CD1 4.4Å; A633-L637 PolarHBondContact O-N 2.95Å; A633-L637 VanDerWaalsContact O-N 3.1Å; S634-L637 PolarHBondContact O-N 3.12Å; L637-Y639 VanDerWaalsContact C-N 3.31Å; L637-Y639 PolarHBondContact O-N 3.42Å; L637-L640 HydrophobicContact CD2-CD1 4.12Å; L637-L640 PolarHBondContact O-N 2.81Å; L637-L640 VanDerWaalsContact O-N 3.11Å; L637-F641 HydrophobicContact CB-CD2 4.43Å; L637-F641 HydrophobicContact CB-CE2 3.79Å; L637-F641 HydrophobicContact CB-CZ 3.98Å; L637-F641 HydrophobicContact CD1-CZ 4.27Å; L637-F641 WeakPolarHBondContact O-CD2 3.49Å; L637-F641 WeakPolarHBondContact O-CG 3.36Å; L637-F641 PolarHBondContact O-N 3.33Å; L637-F686 HydrophobicContact CD1-CD1 4.42Å; L637-F686 HydrophobicContact CD1-CD2 3.81Å; L637-F686 HydrophobicContact CD1-CE1 4.16Å; L637-F686 HydrophobicContact CD1-CE2 3.52Å; L637-F686 HydrophobicContact CD1-CG 4.26Å; L637-F686 HydrophobicContact CD1-CZ 3.72Å
638	A	92.9	Very high	93.5	Very high	15 Å²	15	18.5 Å²	18.5	12%	0.124	10%	0.102	C	C	.	.	H	α-helix	trans	-58	-41.8	174	0	0	0	0	0	112.3	S634 Q635 F641 F642 F693	S634-A638 WeakPolarHBondContact O-CB 3.39Å; S634-A638 PolarHBondContact O-N 3.06Å; Q635-A638 WeakPolarHBondContact O-CB 3.48Å; Q635-A638 PolarHBondContact O-N 3.04Å; A638-F641 PolarHBondContact O-N 2.77Å; A638-F642 WeakPolarHBondContact O-CB 3.45Å; A638-F642 PolarHBondContact O-N 2.78Å; A638-F693 HydrophobicContact CB-CE2 3.81Å; A638-F693 HydrophobicContact CB-CZ 4.36Å
639	Y	94.1	Very high	93.3	Very high	26 Å²	26	18.2 Å²	18.2	10%	0.102	10%	0.101	C	C	.	.	H	α-helix	trans	-59.6	-45.6	171.7	-103.7	-95.7	0	0	0	112.5	F567 V571 Q635 M636 L637 F642 F643 P773 P774 I776	F567-Y639 HydrophobicContact CE1-CD1 4.42Å; F567-Y639 AromaticContact CE1-CD2 3.64Å; F567-Y639 HydrophobicContact CE1-CD2 3.64Å; F567-Y639 HydrophobicContact CE1-CE1 4.47Å; F567-Y639 AromaticContact CE1-CE2 3.7Å; F567-Y639 HydrophobicContact CE1-CE2 3.7Å; F567-Y639 AromaticContact CE1-CG 4Å; F567-Y639 HydrophobicContact CE1-CG 4Å; F567-Y639 AromaticContact CZ-CD2 3.64Å; F567-Y639 HydrophobicContact CZ-CD2 3.64Å; F567-Y639 AromaticContact CZ-CE2 3.97Å; F567-Y639 HydrophobicContact CZ-CE2 3.97Å; F567-Y639 HydrophobicContact CZ-CG 4.23Å; V571-Y639 HydrophobicContact CG1-CD1 4.06Å; V571-Y639 HydrophobicContact CG2-CG 4.45Å; Q635-Y639 WeakPolarHBondContact O-CD2 3.42Å; Q635-Y639 PolarHBondContact O-N 3.01Å; M636-Y639 WeakPolarHBondContact O-CB 3.32Å; M636-Y639 PolarHBondContact O-N 3.1Å; L637-Y639 VanDerWaalsContact C-N 3.31Å; L637-Y639 PolarHBondContact O-N 3.42Å; Y639-F642 PolarHBondContact O-N 2.93Å; Y639-F643 PolarHBondContact O-N 3.48Å; Y639-P773 HydrophobicContact CD1-CB 4.2Å; Y639-P773 HydrophobicContact CE1-CB 3.56Å; Y639-P773 HydrophobicContact CE1-CG 4.19Å; Y639-P774 HydrophobicContact CD2-CB 4.16Å; Y639-P774 HydrophobicContact CD2-CG 4.25Å; Y639-P774 HydrophobicContact CE2-CB 4.18Å; Y639-P774 WeakPolarHBondContact CE2-O 3.26Å; Y639-P774 PolarHBondContact OH-O 3.03Å; Y639-I776 HydrophobicContact CE2-CD1 4.39Å; Y639-I776 HydrophobicContact CE2-CG1 3.64Å
640	L	94.8	Very high	93.1	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-67.7	-36.6	178.7	-63.2	175.3	0	0	0	111.8	V571 V574 S575 L578 Y616 M636 L637 S644	V571-L640 HydrophobicContact CG1-CD2 4.34Å; V574-L640 HydrophobicContact CB-CD1 4.28Å; V574-L640 HydrophobicContact CB-CD2 4.09Å; V574-L640 HydrophobicContact CG1-CD1 3.6Å; V574-L640 HydrophobicContact CG1-CD2 3.96Å; V574-L640 HydrophobicContact CG1-CG 4.45Å; S575-L640 WeakPolarHBondContact OG-CD2 3.49Å; L578-L640 HydrophobicContact CD1-CB 4.06Å; L578-L640 HydrophobicContact CD1-CD2 4Å; L578-L640 HydrophobicContact CD1-CG 4.43Å; Y616-L640 HydrophobicContact CD1-CB 4.47Å; Y616-L640 HydrophobicContact CE1-CB 4.1Å; M636-L640 WeakPolarHBondContact O-CG 3.39Å; M636-L640 PolarHBondContact O-N 3.24Å; M636-L640 VanDerWaalsContact O-N 3.1Å; L637-L640 HydrophobicContact CD2-CD1 4.12Å; L637-L640 PolarHBondContact O-N 2.81Å; L637-L640 VanDerWaalsContact O-N 3.11Å; L640-S644 VanDerWaalsContact O-CB 3.25Å; L640-S644 WeakPolarHBondContact O-CB 3.42Å; L640-S644 PolarHBondContact O-N 3.14Å; L640-S644 PolarHBondContact O-OG 3.48Å
641	F	94.8	Very high	92.9	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-68	-40.7	174.1	-59.4	-33.4	0	0	0	112.1	Y616 L637 A638 S644 G645 M681 F686 A689 F693 F694	Y616-F641 HydrophobicContact CD1-CD1 4.28Å; Y616-F641 AromaticContact CD1-CE1 3.8Å; Y616-F641 HydrophobicContact CD1-CE1 3.8Å; Y616-F641 HydrophobicContact CD2-CE1 4.35Å; Y616-F641 AromaticContact CE1-CD1 3.79Å; Y616-F641 HydrophobicContact CE1-CD1 3.79Å; Y616-F641 AromaticContact CE1-CE1 3.78Å; Y616-F641 HydrophobicContact CE1-CE1 3.78Å; Y616-F641 HydrophobicContact CE2-CE1 4.31Å; Y616-F641 HydrophobicContact CG-CE1 4.1Å; Y616-F641 AromaticContact CZ-CD1 3.95Å; L637-F641 HydrophobicContact CB-CD2 4.43Å; L637-F641 HydrophobicContact CB-CE2 3.79Å; L637-F641 HydrophobicContact CB-CZ 3.98Å; L637-F641 HydrophobicContact CD1-CZ 4.27Å; L637-F641 WeakPolarHBondContact O-CD2 3.49Å; L637-F641 WeakPolarHBondContact O-CG 3.36Å; L637-F641 PolarHBondContact O-N 3.33Å; A638-F641 PolarHBondContact O-N 2.77Å; F641-S644 PolarHBondContact O-N 3.48Å; F641-G645 PolarHBondContact O-N 3.19Å; F641-M681 HydrophobicContact CD1-SD 3.61Å; F641-M681 HydrophobicContact CD2-SD 4.04Å; F641-M681 HydrophobicContact CE1-CG 3.9Å; F641-M681 HydrophobicContact CE1-SD 3.53Å; F641-M681 VanDerWaalsContact CE1-SD 3.53Å; F641-M681 HydrophobicContact CE2-CG 4.41Å; F641-M681 HydrophobicContact CE2-SD 3.97Å; F641-M681 HydrophobicContact CG-SD 3.88Å; F641-M681 HydrophobicContact CZ-CG 3.82Å; F641-M681 HydrophobicContact CZ-SD 3.72Å; F641-F686 HydrophobicContact CE2-CB 3.79Å; F641-F686 HydrophobicContact CE2-CG 4.26Å; F641-F686 HydrophobicContact CZ-CB 4.36Å; F641-A689 HydrophobicContact CD2-CB 4.47Å; F641-F693 HydrophobicContact CB-CB 4.3Å; F641-F693 HydrophobicContact CB-CD2 3.94Å; F641-F693 HydrophobicContact CB-CG 4.46Å; F641-F694 HydrophobicContact CB-CE2 3.89Å; F641-F694 HydrophobicContact CD1-CE2 4.13Å; F641-F694 HydrophobicContact CG-CE2 4.26Å
642	F	93.8	Very high	92.7	Very high	27 Å²	27	10.6 Å²	10.6	12%	0.118	6%	0.058	C	C	.	.	H	α-helix	trans	-57	-54.5	170.5	169.9	-107.5	0	0	0	111.3	A638 Y639 S644 G645 T646 F693 P773 P774	A638-F642 WeakPolarHBondContact O-CB 3.45Å; A638-F642 PolarHBondContact O-N 2.78Å; Y639-F642 PolarHBondContact O-N 2.93Å; F642-S644 VanDerWaalsContact C-N 3.27Å; F642-S644 PolarHBondContact O-N 3.05Å; F642-G645 PolarHBondContact O-N 2.6Å; F642-T646 WeakPolarHBondContact O-CB 3.12Å; F642-T646 PolarHBondContact O-N 2.63Å; F642-T646 PolarHBondContact O-OG1 3.11Å; F642-F693 HydrophobicContact CB-CD1 3.75Å; F642-F693 HydrophobicContact CB-CE1 4.02Å; F642-F693 HydrophobicContact CB-CG 4.12Å; F642-F693 HydrophobicContact CD2-CD1 4.02Å; F642-F693 HydrophobicContact CD2-CE1 4.35Å; F642-F693 HydrophobicContact CG-CD1 4.37Å; F642-P773 HydrophobicContact CD1-CB 4.15Å; F642-P773 HydrophobicContact CE1-CB 3.97Å; F642-P774 HydrophobicContact CB-CG 4.3Å
643	F	94.3	Very high	92.2	Very high	32 Å²	32	10.5 Å²	10.5	14%	0.14	6%	0.057	C	C	.	.	H	α-helix	trans	-53.9	-45.2	176.7	170.6	-102.5	0	0	0	111.9	S575 L578 Y579 L582 Y639 L647 Y770	S575-F643 WeakPolarHBondContact O-CE1 3.25Å; L578-F643 HydrophobicContact CB-CE1 4.18Å; Y579-F643 HydrophobicContact CD2-CZ 4.29Å; L582-F643 HydrophobicContact CD1-CE1 4.38Å; Y639-F643 PolarHBondContact O-N 3.48Å; F643-L647 HydrophobicContact CE1-CD2 4.04Å; F643-L647 HydrophobicContact CZ-CD2 3.95Å; F643-L647 WeakPolarHBondContact O-CB 3.34Å; F643-L647 PolarHBondContact O-N 2.96Å; F643-Y770 HydrophobicContact CD2-CD1 4.47Å; F643-Y770 AromaticContact CD2-CE1 3.95Å; F643-Y770 HydrophobicContact CD2-CE1 3.95Å; F643-Y770 HydrophobicContact CE2-CE1 4.33Å
644	S	94.3	Very high	91.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-71.4	-41.8	-175.1	-55.6	0	0	0	0	113.1	L582 Y616 L640 F641 F642 L648	L582-S644 WeakPolarHBondContact CD1-OG 3.46Å; Y616-S644 WeakPolarHBondContact OH-CB 3.39Å; Y616-S644 PolarHBondContact OH-OG 3.18Å; L640-S644 VanDerWaalsContact O-CB 3.25Å; L640-S644 WeakPolarHBondContact O-CB 3.42Å; L640-S644 PolarHBondContact O-N 3.14Å; L640-S644 PolarHBondContact O-OG 3.48Å; F641-S644 PolarHBondContact O-N 3.48Å; F642-S644 VanDerWaalsContact C-N 3.27Å; F642-S644 PolarHBondContact O-N 3.05Å; S644-L648 WeakPolarHBondContact O-CB 3.27Å; S644-L648 VanDerWaalsContact O-CG 3.28Å; S644-L648 WeakPolarHBondContact O-CG 3.43Å; S644-L648 PolarHBondContact O-N 3.3Å
645	G	92.9	Very high	90.7	Very high	3 Å²	3	18.1 Å²	18.1	3%	0.031	9%	0.086	C	C	.	.	H	α-helix	trans	-63.6	-47	175.5	0	0	0	0	0	111.8	F641 F642 L649	F641-G645 PolarHBondContact O-N 3.19Å; F642-G645 PolarHBondContact O-N 2.6Å; G645-L649 VanDerWaalsContact O-CB 3.28Å; G645-L649 WeakPolarHBondContact O-CB 3.48Å; G645-L649 PolarHBondContact O-N 2.69Å
646	T	91.9	Very high	89.4	Confident	8 Å²	8	17.4 Å²	17.4	5%	0.049	8%	0.082	C	C	.	.	H	α-helix	trans	-63.6	-44.1	177	-60.8	0	0	0	0	111.8	F642 L649 N650 E768 Y770	F642-T646 WeakPolarHBondContact O-CB 3.12Å; F642-T646 PolarHBondContact O-N 2.63Å; F642-T646 PolarHBondContact O-OG1 3.11Å; T646-L649 PolarHBondContact O-N 3.36Å; T646-N650 WeakPolarHBondContact O-CB 3.41Å; T646-N650 VanDerWaalsContact O-CG 3.27Å; T646-N650 PolarHBondContact O-N 3.48Å; T646-N650 PolarHBondContact O-ND2 3.15Å; T646-E768 HydrophobicContact CG2-CB 4.04Å; T646-E768 HydrophobicContact CG2-CG 4.1Å; T646-E768 WeakPolarHBondContact CG2-O 3.13Å; T646-Y770 HydrophobicContact CG2-CD1 3.69Å; T646-Y770 HydrophobicContact CG2-CD2 4.35Å; T646-Y770 HydrophobicContact CG2-CE1 3.43Å; T646-Y770 VanDerWaalsContact CG2-CE1 3.43Å; T646-Y770 HydrophobicContact CG2-CE2 4.14Å; T646-Y770 HydrophobicContact CG2-CG 4.15Å
647	L	91.4	Very high	87.8	Confident	7 Å²	7	21.1 Å²	21.1	4%	0.037	11%	0.107	C	C	.	.	H	α-helix	trans	-62.1	-49.5	177.5	179.4	65	0	0	0	111.9	Y579 L582 F643 L649 N650 Q651 Y770	Y579-L647 HydrophobicContact CD2-CD1 3.89Å; Y579-L647 HydrophobicContact CD2-CD2 3.71Å; Y579-L647 HydrophobicContact CD2-CG 4.48Å; Y579-L647 HydrophobicContact CE2-CD1 3.82Å; Y579-L647 HydrophobicContact CE2-CD2 4.42Å; Y579-L647 HydrophobicContact CG-CD2 4.4Å; L582-L647 HydrophobicContact CB-CD2 4.37Å; L582-L647 HydrophobicContact CD1-CD2 3.88Å; F643-L647 HydrophobicContact CE1-CD2 4.04Å; F643-L647 HydrophobicContact CZ-CD2 3.95Å; F643-L647 WeakPolarHBondContact O-CB 3.34Å; F643-L647 PolarHBondContact O-N 2.96Å; L647-L649 VanDerWaalsContact C-N 3.34Å; L647-L649 PolarHBondContact O-N 3.36Å; L647-N650 PolarHBondContact O-N 2.9Å; L647-Q651 HydrophobicContact CD1-CG 4.15Å; L647-Q651 HydrophobicContact CG-CG 4.39Å; L647-Q651 WeakPolarHBondContact O-CB 3.39Å; L647-Q651 WeakPolarHBondContact O-CG 3.47Å; L647-Q651 PolarHBondContact O-N 3.03Å; L647-Y770 WeakPolarHBondContact CA-OH 3.34Å
648	L	91	Very high	86.3	Confident	3 Å²	3	25.7 Å²	25.7	2%	0.016	14%	0.139	C	C	.	.	H	α-helix	trans	-64.4	-38.6	-179.8	-71.8	175.9	0	0	0	112.2	L582 L585 L586 S644 L652 F694 L697	L582-L648 HydrophobicContact CB-CD2 4.08Å; L582-L648 HydrophobicContact CD2-CD1 4.26Å; L582-L648 WeakPolarHBondContact O-CD2 3.39Å; L585-L648 HydrophobicContact CD1-CD1 4Å; L586-L648 HydrophobicContact CD1-CD2 3.99Å; L586-L648 HydrophobicContact CG-CD2 4.14Å; S644-L648 WeakPolarHBondContact O-CB 3.27Å; S644-L648 VanDerWaalsContact O-CG 3.28Å; S644-L648 WeakPolarHBondContact O-CG 3.43Å; S644-L648 PolarHBondContact O-N 3.3Å; L648-L652 WeakPolarHBondContact O-CB 3.14Å; L648-L652 PolarHBondContact O-N 3.46Å; L648-L652 VanDerWaalsContact O-N 3.09Å; L648-F694 HydrophobicContact CD1-CE1 4.17Å; L648-L697 HydrophobicContact CB-CD1 4.12Å; L648-L697 HydrophobicContact CB-CD2 3.61Å; L648-L697 HydrophobicContact CD1-CD2 3.71Å; L648-L697 HydrophobicContact CG-CD2 4.33Å
649	L	90.8	Very high	84.9	Confident	3 Å²	3	25.3 Å²	25.3	2%	0.016	14%	0.135	C	C	.	.	H	α-helix	trans	-63.9	-47.7	176	-179.7	60.6	0	0	0	111.1	G645 T646 L647 L652 L653 K696 L697 E768	G645-L649 VanDerWaalsContact O-CB 3.28Å; G645-L649 WeakPolarHBondContact O-CB 3.48Å; G645-L649 PolarHBondContact O-N 2.69Å; T646-L649 PolarHBondContact O-N 3.36Å; L647-L649 VanDerWaalsContact C-N 3.34Å; L647-L649 PolarHBondContact O-N 3.36Å; L649-L652 PolarHBondContact O-N 3.28Å; L649-L653 HydrophobicContact CD1-CD1 3.92Å; L649-L653 HydrophobicContact CD1-CG 4.37Å; L649-L653 HydrophobicContact CG-CD1 3.86Å; L649-L653 VanDerWaalsContact O-CG 3.31Å; L649-L653 WeakPolarHBondContact O-CG 3.32Å; L649-L653 PolarHBondContact O-N 3.28Å; L649-K696 HydrophobicContact CD2-CB 3.74Å; L649-K696 HydrophobicContact CD2-CD 4.21Å; L649-L697 HydrophobicContact CB-CD1 4.37Å; L649-E768 HydrophobicContact CD2-CB 4.02Å; L649-E768 HydrophobicContact CD2-CG 4.26Å
650	N	90.8	Very high	83.6	Confident	16 Å²	16	25 Å²	25	9%	0.086	14%	0.137	C	C	.	.	H	α-helix	trans	-66.7	-42	-180	-72	-15.3	0	0	0	112.2	T646 L647 L652 L653 D654 L767 E768	T646-N650 WeakPolarHBondContact O-CB 3.41Å; T646-N650 VanDerWaalsContact O-CG 3.27Å; T646-N650 PolarHBondContact O-N 3.48Å; T646-N650 PolarHBondContact O-ND2 3.15Å; L647-N650 PolarHBondContact O-N 2.9Å; N650-L652 VanDerWaalsContact C-N 3.28Å; N650-L652 PolarHBondContact O-N 2.9Å; N650-L653 PolarHBondContact O-N 3.14Å; N650-D654 PolarHBondContact O-N 3.16Å; N650-L767 HydrophobicContact CB-CD2 4.14Å; N650-E768 PolarHBondContact ND2-O 3Å; N650-E768 WeakPolarHBondContact OD1-CB 3.18Å; N650-E768 PolarHBondContact OD1-N 3.24Å
651	Q	87.8	Confident	82.2	Confident	22 Å²	22	25 Å²	25	10%	0.103	14%	0.137	C	C	.	.	H	α-helix	trans	-57.3	-42.6	172.6	-70.1	-72.9	-0.2	0	0	111.4	L647 R655 L659	L647-Q651 HydrophobicContact CD1-CG 4.15Å; L647-Q651 HydrophobicContact CG-CG 4.39Å; L647-Q651 WeakPolarHBondContact O-CB 3.39Å; L647-Q651 WeakPolarHBondContact O-CG 3.47Å; L647-Q651 PolarHBondContact O-N 3.03Å; Q651-R655 WeakPolarHBondContact O-CA 3.25Å; Q651-R655 WeakPolarHBondContact O-CB 3.03Å; Q651-R655 PolarHBondContact O-N 2.84Å; Q651-R655 VanDerWaalsContact OE1-CD 3.24Å; Q651-L659 VanDerWaalsContact O-CD1 3.22Å; Q651-L659 WeakPolarHBondContact O-CD1 3.13Å
652	L	86.9	Confident	81.2	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-68.1	-33.3	178.9	-173.6	150.6	0	0	0	113.1	L586 L648 L649 N650 G656 F662 T700 L701 L704 L734	L586-L652 HydrophobicContact CD1-CB 4.25Å; L586-L652 HydrophobicContact CD2-CD1 4.41Å; L648-L652 WeakPolarHBondContact O-CB 3.14Å; L648-L652 PolarHBondContact O-N 3.46Å; L648-L652 VanDerWaalsContact O-N 3.09Å; L649-L652 PolarHBondContact O-N 3.28Å; N650-L652 VanDerWaalsContact C-N 3.28Å; N650-L652 PolarHBondContact O-N 2.9Å; L652-G656 WeakPolarHBondContact O-CA 3.39Å; L652-G656 PolarHBondContact O-N 3.15Å; L652-G656 VanDerWaalsContact O-N 3.16Å; L652-F662 HydrophobicContact CD2-CE2 4Å; L652-F662 HydrophobicContact CD2-CZ 3.79Å; L652-F662 HydrophobicContact CG-CE2 4.16Å; L652-F662 HydrophobicContact CG-CZ 4.45Å; L652-T700 HydrophobicContact CD1-CG2 4.41Å; L652-T700 HydrophobicContact CD2-CG2 3.48Å; L652-T700 VanDerWaalsContact CD2-CG2 3.48Å; L652-L701 HydrophobicContact CD1-CD2 3.62Å; L652-L704 HydrophobicContact CD1-CD1 4.08Å; L652-L704 HydrophobicContact CD2-CD1 4.24Å; L652-L734 HydrophobicContact CD2-CD2 3.63Å
653	L	84.9	Confident	80.4	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-79.1	-35.9	178.9	-70.7	165.5	0	0	0	113.5	L649 N650 Q730 R733 L734 H737 V766 L767	L649-L653 HydrophobicContact CD1-CD1 3.92Å; L649-L653 HydrophobicContact CD1-CG 4.37Å; L649-L653 HydrophobicContact CG-CD1 3.86Å; L649-L653 VanDerWaalsContact O-CG 3.31Å; L649-L653 WeakPolarHBondContact O-CG 3.32Å; L649-L653 PolarHBondContact O-N 3.28Å; N650-L653 PolarHBondContact O-N 3.14Å; L653-Q730 HydrophobicContact CD1-CG 4.23Å; L653-R733 HydrophobicContact CD2-CG 4.42Å; L653-L734 HydrophobicContact CD2-CD1 4.34Å; L653-L734 HydrophobicContact CD2-CD2 3.69Å; L653-L734 HydrophobicContact CD2-CG 3.75Å; L653-H737 PolarHBondContact O-NE2 3.46Å; L653-V766 WeakPolarHBondContact CD1-O 3.22Å; L653-L767 HydrophobicContact CB-CD2 3.99Å
654	D	82.1	Confident	79.6	Confident	85 Å²	85	32.1 Å²	32.1	46%	0.455	17%	0.165	S	C	.	.	H	α-helix	trans	-82.4	-56.1	176.6	-85	-26.3	0	0	0	112.4	N650	N650-D654 PolarHBondContact O-N 3.16Å
655	R	72.7	Confident	78.8	Confident	114 Å²	114	34.7 Å²	34.7	43%	0.43	18%	0.182	S	C	.	.	S	Bend	trans	-92.4	2.8	-173.7	-58.8	-170.5	179.1	-173	0.7	113.7	Q651 P657 S658 L659	Q651-R655 WeakPolarHBondContact O-CA 3.25Å; Q651-R655 WeakPolarHBondContact O-CB 3.03Å; Q651-R655 PolarHBondContact O-N 2.84Å; Q651-R655 VanDerWaalsContact OE1-CD 3.24Å; R655-P657 VanDerWaalsContact C-CD 3.42Å; R655-P657 VanDerWaalsContact C-N 3.31Å; R655-S658 PolarHBondContact O-N 3.22Å; R655-S658 PolarHBondContact O-OG 2.92Å; R655-L659 HydrophobicContact CB-CD1 3.85Å; R655-L659 HydrophobicContact CB-CD2 4.32Å; R655-L659 HydrophobicContact CB-CG 3.72Å; R655-L659 WeakPolarHBondContact O-CG 3.49Å; R655-L659 PolarHBondContact O-N 2.94Å
656	G	65.8	Low	78	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-38.6	-48	-175.4	0	0	0	0	0	116.7	L652 S658 L659 S660 F662	L652-G656 WeakPolarHBondContact O-CA 3.39Å; L652-G656 PolarHBondContact O-N 3.15Å; L652-G656 VanDerWaalsContact O-N 3.16Å; G656-S658 PolarHBondContact O-N 3.28Å; G656-L659 PolarHBondContact O-N 2.99Å; G656-S660 PolarHBondContact O-N 2.6Å; G656-F662 WeakPolarHBondContact O-CD2 3.33Å
657	P	62.4	Low	77.5	Confident	82 Å²	82	37.2 Å²	37.2	53%	0.532	19%	0.19	S	C	.	.	H	α-helix	trans	-63.2	-36.9	177.6	-24.6	36.1	0	0	0	114.6	R655	R655-P657 VanDerWaalsContact C-CD 3.42Å; R655-P657 VanDerWaalsContact C-N 3.31Å
658	S	62.4	Low	77.1	Confident	97 Å²	97	39.5 Å²	39.5	68%	0.678	20%	0.204	S	C	*	.	H	α-helix	trans	-84.8	-26.4	177	53.3	0	0	0	0	113.1	R655 G656 S660	R655-S658 PolarHBondContact O-N 3.22Å; R655-S658 PolarHBondContact O-OG 2.92Å; G656-S658 PolarHBondContact O-N 3.28Å; S658-S660 PolarHBondContact O-N 2.66Å
659	L	63.9	Low	76.7	Confident	7 Å²	7	41.2 Å²	41.2	4%	0.037	21%	0.212	C	C	.	.	H	α-helix	trans	-69	-15.4	172.7	-65.9	175.6	0	0	0	113.3	L586 E587 Q651 R655 G656 C661	L586-L659 HydrophobicContact CD1-CD1 4.43Å; E587-L659 HydrophobicContact CG-CD2 3.31Å; E587-L659 WeakPolarHBondContact OE1-CD2 3.31Å; Q651-L659 VanDerWaalsContact O-CD1 3.22Å; Q651-L659 WeakPolarHBondContact O-CD1 3.13Å; R655-L659 HydrophobicContact CB-CD1 3.85Å; R655-L659 HydrophobicContact CB-CD2 4.32Å; R655-L659 HydrophobicContact CB-CG 3.72Å; R655-L659 WeakPolarHBondContact O-CG 3.49Å; R655-L659 PolarHBondContact O-N 2.94Å; G656-L659 PolarHBondContact O-N 2.99Å; L659-C661 PolarHBondContact O-N 2.74Å
660	S	65.9	Low	76.4	Confident	20 Å²	20	41.4 Å²	41.4	14%	0.14	21%	0.213	C	C	.	.			trans	57.9	5.4	-179.4	72.9	0	0	0	0	116.5	G656 S658 F662 H663 R666	G656-S660 PolarHBondContact O-N 2.6Å; S658-S660 PolarHBondContact O-N 2.66Å; S660-F662 PolarHBondContact O-N 2.89Å; S660-F662 VanDerWaalsContact O-N 3.09Å; S660-H663 PolarHBondContact O-CD2 3.22Å; S660-H663 VanDerWaalsContact O-CD2 3.3Å; S660-H663 PolarHBondContact O-N 3.49Å; S660-R666 WeakPolarHBondContact OG-CD 3.34Å; S660-R666 PolarHBondContact OG-NE 3.37Å; S660-R666 PolarHBondContact OG-NH1 3.02Å; S660-R666 VanDerWaalsContact OG-NH1 3.16Å
661	C	65.6	Low	76.3	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.9	178.5	-69.9	0	0	0	0	113.7	L586 L659 H663 G667 L704	L586-C661 PolarHBondContact O-SG 2.95Å; L586-C661 VanDerWaalsContact O-SG 3.41Å; L659-C661 PolarHBondContact O-N 2.74Å; C661-H663 PolarHBondContact O-N 3.41Å; C661-G667 PolarHBondContact O-N 2.94Å; C661-L704 HydrophobicContact CB-CD1 4.5Å
662	F	74.8	Confident	76.2	Confident	1 Å²	1	42 Å²	42	0%	0.004	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-1.8	-179.7	-70.1	-104.4	0	0	0	113.2	L652 G656 S660 L704 L734 H737 A741	L652-F662 HydrophobicContact CD2-CE2 4Å; L652-F662 HydrophobicContact CD2-CZ 3.79Å; L652-F662 HydrophobicContact CG-CE2 4.16Å; L652-F662 HydrophobicContact CG-CZ 4.45Å; G656-F662 WeakPolarHBondContact O-CD2 3.33Å; S660-F662 PolarHBondContact O-N 2.89Å; S660-F662 VanDerWaalsContact O-N 3.09Å; F662-L704 HydrophobicContact CD1-CD2 3.59Å; F662-L704 HydrophobicContact CD2-CD1 4.45Å; F662-L704 HydrophobicContact CE1-CD1 4.44Å; F662-L704 HydrophobicContact CE1-CD2 3.8Å; F662-L704 HydrophobicContact CE2-CD1 4.32Å; F662-L704 HydrophobicContact CG-CD2 4.15Å; F662-L704 HydrophobicContact CZ-CD1 4.35Å; F662-L704 HydrophobicContact CZ-CD2 4.49Å; F662-L734 HydrophobicContact CE1-CD2 3.84Å; F662-L734 HydrophobicContact CZ-CD2 3.7Å; F662-H737 HydrophobicContact CD1-CB 3.69Å; F662-H737 HydrophobicContact CE1-CB 3.41Å; F662-H737 VanDerWaalsContact CE1-CB 3.41Å; F662-H737 AromaticContact CE1-CE1 3.91Å; F662-H737 AromaticContact CE2-CE1 3.86Å; F662-H737 HydrophobicContact CG-CB 4.42Å; F662-H737 HydrophobicContact CZ-CB 3.98Å; F662-H737 AromaticContact CZ-CE1 3.39Å; F662-H737 WeakPolarHBondContact CZ-CE1 3.38Å; F662-A741 HydrophobicContact CB-CB 3.57Å
663	H	76	Confident	76.2	Confident	89 Å²	89	43 Å²	43	41%	0.412	23%	0.227	S	C	.	.	S	Bend	trans	-86.7	126.7	162.6	-54.4	-54	0	0	0	110.4	S660 C661 P665 R666 G667 A741	S660-H663 PolarHBondContact O-CD2 3.22Å; S660-H663 VanDerWaalsContact O-CD2 3.3Å; S660-H663 PolarHBondContact O-N 3.49Å; C661-H663 PolarHBondContact O-N 3.41Å; H663-P665 VanDerWaalsContact C-CD 3.44Å; H663-P665 VanDerWaalsContact O-N 3.1Å; H663-R666 PolarHBondContact O-N 3.41Å; H663-G667 PolarHBondContact O-N 3.29Å; H663-G667 VanDerWaalsContact O-N 3.12Å; H663-A741 PolarHBondContact CE1-O 2.93Å; H663-A741 PolarHBondContact ND1-O 2.9Å
664	W	78.2	Confident	76.5	Confident	117 Å²	117	43.5 Å²	43.5	44%	0.443	23%	0.23	S	C	.	.	H	α-helix	trans	-42.8	-47	-174.7	177.1	80	0	0	0	115.8	R666 G667 V668 A705	W664-R666 VanDerWaalsContact C-N 3.31Å; W664-R666 PolarHBondContact O-N 2.73Å; W664-G667 PolarHBondContact O-N 3.34Å; W664-V668 HydrophobicContact CD2-CG2 4.24Å; W664-V668 HydrophobicContact CZ2-CG2 3.86Å; W664-V668 WeakPolarHBondContact O-CG2 3.39Å; W664-V668 PolarHBondContact O-N 2.93Å; W664-A705 PolarHBondContact NE1-O 3.04Å
665	P	77.6	Confident	76.9	Confident	54 Å²	54	44.6 Å²	44.6	35%	0.351	23%	0.233	S	C	.	.	H	α-helix	trans	-62	-35.2	179.4	-21.1	32.6	0	0	0	113.9	F591 H663 Q669	F591-P665 HydrophobicContact CE2-CB 4.28Å; H663-P665 VanDerWaalsContact C-CD 3.44Å; H663-P665 VanDerWaalsContact O-N 3.1Å; P665-Q669 WeakPolarHBondContact O-CB 3.46Å; P665-Q669 PolarHBondContact O-N 3Å
666	R	76.3	Confident	77.7	Confident	64 Å²	64	43.2 Å²	43.2	24%	0.242	23%	0.231	C	C	.	.	H	α-helix	trans	-77.5	-35.2	177.9	-62.2	-161.9	-165.7	-148.9	21.5	111.6	C588 S660 H663 W664 V668 Q669 A670	C588-R666 PolarHBondContact O-NH1 2.93Å; S660-R666 WeakPolarHBondContact OG-CD 3.34Å; S660-R666 PolarHBondContact OG-NE 3.37Å; S660-R666 PolarHBondContact OG-NH1 3.02Å; S660-R666 VanDerWaalsContact OG-NH1 3.16Å; H663-R666 PolarHBondContact O-N 3.41Å; W664-R666 VanDerWaalsContact C-N 3.31Å; W664-R666 PolarHBondContact O-N 2.73Å; R666-V668 VanDerWaalsContact C-N 3.35Å; R666-Q669 PolarHBondContact O-N 3.42Å; R666-A670 WeakPolarHBondContact O-CB 3.4Å; R666-A670 PolarHBondContact O-N 3.41Å
667	G	81	Confident	79	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-57.9	-45.2	169.7	0	0	0	0	0	112.3	C661 H663 W664 A670 C671	C661-G667 PolarHBondContact O-N 2.94Å; H663-G667 PolarHBondContact O-N 3.29Å; H663-G667 VanDerWaalsContact O-N 3.12Å; W664-G667 PolarHBondContact O-N 3.34Å; G667-A670 PolarHBondContact O-N 3.45Å; G667-C671 WeakPolarHBondContact O-CB 3.31Å; G667-C671 PolarHBondContact O-N 2.82Å
668	V	83.4	Confident	80.4	Confident	56 Å²	56	40.6 Å²	40.6	34%	0.339	21%	0.213	S	C	.	.	H	α-helix	trans	-62.6	-45.6	173.5	174.4	0	0	0	0	111.7	W664 R666 A670 C671 A672 A705	W664-V668 HydrophobicContact CD2-CG2 4.24Å; W664-V668 HydrophobicContact CZ2-CG2 3.86Å; W664-V668 WeakPolarHBondContact O-CG2 3.39Å; W664-V668 PolarHBondContact O-N 2.93Å; R666-V668 VanDerWaalsContact C-N 3.35Å; V668-A670 PolarHBondContact O-N 3.34Å; V668-C671 PolarHBondContact O-N 3.41Å; V668-A672 WeakPolarHBondContact O-CB 3.34Å; V668-A672 PolarHBondContact O-N 3.35Å; V668-A705 HydrophobicContact CG2-CB 3.8Å
669	Q	82.4	Confident	81.8	Confident	39 Å²	39	40.5 Å²	40.5	18%	0.182	20%	0.201	C	C	.	.	H	α-helix	trans	-61.7	-41.9	178.2	-177.6	177.3	-14.6	0	0	112.5	P589 P665 R666 R673	P589-Q669 PolarHBondContact O-NE2 3.35Å; P589-Q669 VanDerWaalsContact O-NE2 3.15Å; P665-Q669 WeakPolarHBondContact O-CB 3.46Å; P665-Q669 PolarHBondContact O-N 3Å; R666-Q669 PolarHBondContact O-N 3.42Å; Q669-R673 WeakPolarHBondContact O-CG 3.21Å; Q669-R673 PolarHBondContact O-N 2.89Å; Q669-R673 VanDerWaalsContact O-N 3.15Å
670	A	84.3	Confident	83.2	Confident	6 Å²	6	42 Å²	42	5%	0.05	21%	0.206	C	C	.	.	H	α-helix	trans	-66.6	-41.9	174.9	0	0	0	0	0	111.9	L586 R666 G667 V668 R673 L674 L701	L586-A670 HydrophobicContact CD2-CB 4.09Å; R666-A670 WeakPolarHBondContact O-CB 3.4Å; R666-A670 PolarHBondContact O-N 3.41Å; G667-A670 PolarHBondContact O-N 3.45Å; V668-A670 PolarHBondContact O-N 3.34Å; A670-R673 PolarHBondContact O-N 3.47Å; A670-L674 PolarHBondContact O-N 3.29Å; A670-L701 HydrophobicContact CB-CD1 4.19Å; A670-L701 HydrophobicContact CB-CD2 3.84Å
671	C	87.7	Confident	84.5	Confident	8 Å²	8	41 Å²	41	5%	0.054	20%	0.2	C	C	.	.	H	α-helix	trans	-60.4	-48	175.5	-173.5	0	0	0	0	111.7	G667 V668 R673 L674 Q675 L701 N702	G667-C671 WeakPolarHBondContact O-CB 3.31Å; G667-C671 PolarHBondContact O-N 2.82Å; V668-C671 PolarHBondContact O-N 3.41Å; C671-R673 VanDerWaalsContact C-N 3.32Å; C671-R673 PolarHBondContact O-N 2.94Å; C671-L674 PolarHBondContact O-N 2.88Å; C671-L674 VanDerWaalsContact O-N 3.15Å; C671-Q675 WeakPolarHBondContact O-CG 3.34Å; C671-Q675 PolarHBondContact O-N 3.49Å; C671-Q675 PolarHBondContact SG-NE2 3.03Å; C671-Q675 VanDerWaalsContact SG-NE2 3.43Å; C671-L701 HydrophobicContact CB-CB 4.1Å; C671-N702 PolarHBondContact SG-OD1 2.79Å
672	A	86.6	Confident	85.8	Confident	42 Å²	42	47.7 Å²	47.7	35%	0.347	23%	0.225	S	C	.	.	H	α-helix	trans	-60.6	-38.4	178.3	0	0	0	0	0	112.7	V668 Q675 Q676	V668-A672 WeakPolarHBondContact O-CB 3.34Å; V668-A672 PolarHBondContact O-N 3.35Å; A672-Q675 PolarHBondContact O-N 2.95Å; A672-Q676 WeakPolarHBondContact O-CG 3.17Å; A672-Q676 PolarHBondContact O-N 2.93Å
673	R	86	Confident	86.5	Confident	21 Å²	21	52 Å²	52	8%	0.079	26%	0.256	C	S	.	.	H	α-helix	trans	-66.1	-41.3	173.5	-76	169.9	162	-168.3	-7.2	112.7	A584 L585 C588 E608 Q669 A670 C671 Q675 Q676 L677	A584-R673 PolarHBondContact O-NH1 2.93Å; L585-R673 WeakPolarHBondContact O-CD 3.45Å; L585-R673 PolarHBondContact O-NH1 3.4Å; C588-R673 VanDerWaalsContact CB-NH1 3.3Å; C588-R673 PolarHBondContact SG-NH1 3.47Å; C588-R673 PolarHBondContact SG-NH2 2.95Å; E608-R673 IonicContact OE1-NH2 2.76Å; E608-R673 PolarHBondContact OE1-NH2 3.32Å; E608-R673 IonicContact OE2-CZ 2.67Å; E608-R673 IonicContact OE2-NH2 2.64Å; E608-R673 PolarHBondContact OE2-NH2 3.43Å; Q669-R673 WeakPolarHBondContact O-CG 3.21Å; Q669-R673 PolarHBondContact O-N 2.89Å; Q669-R673 VanDerWaalsContact O-N 3.15Å; A670-R673 PolarHBondContact O-N 3.47Å; C671-R673 VanDerWaalsContact C-N 3.32Å; C671-R673 PolarHBondContact O-N 2.94Å; R673-Q675 VanDerWaalsContact C-N 3.33Å; R673-Q676 PolarHBondContact O-N 3.11Å; R673-L677 PolarHBondContact O-N 3.07Å
674	L	91.1	Very high	87	Confident	12 Å²	12	48.8 Å²	48.8	6%	0.063	24%	0.244	C	C	.	.	H	α-helix	trans	-65	-38.7	175.3	-179	61.5	0	0	0	111.4	A670 C671 L677 L678 F694 L697 L701	A670-L674 PolarHBondContact O-N 3.29Å; C671-L674 PolarHBondContact O-N 2.88Å; C671-L674 VanDerWaalsContact O-N 3.15Å; L674-L677 PolarHBondContact O-N 3.36Å; L674-L678 HydrophobicContact CD1-CD1 4.43Å; L674-L678 HydrophobicContact CD1-CG 4.48Å; L674-L678 HydrophobicContact CG-CD1 4.03Å; L674-L678 WeakPolarHBondContact O-CB 3.24Å; L674-L678 WeakPolarHBondContact O-CG 3.44Å; L674-L678 PolarHBondContact O-N 3.44Å; L674-F694 HydrophobicContact CD1-CB 4.16Å; L674-F694 HydrophobicContact CD1-CD1 3.66Å; L674-F694 HydrophobicContact CD1-CE1 4.26Å; L674-F694 HydrophobicContact CD1-CG 4.04Å; L674-L697 HydrophobicContact CD1-CD2 4.19Å; L674-L697 HydrophobicContact CD2-CB 4.34Å; L674-L697 HydrophobicContact CD2-CD2 3.92Å; L674-L697 HydrophobicContact CD2-CG 3.96Å; L674-L701 HydrophobicContact CB-CD1 4.13Å; L674-L701 HydrophobicContact CD2-CD1 3.86Å
675	Q	90.7	Very high	87.6	Confident	108 Å²	108	46.3 Å²	46.3	51%	0.505	26%	0.255	S	S	.	.	H	α-helix	trans	-62.2	-42.1	173.4	-70.8	172.2	0.1	0	0	111.7	C671 A672 R673 L677 L678 E679	C671-Q675 WeakPolarHBondContact O-CG 3.34Å; C671-Q675 PolarHBondContact O-N 3.49Å; C671-Q675 PolarHBondContact SG-NE2 3.03Å; C671-Q675 VanDerWaalsContact SG-NE2 3.43Å; A672-Q675 PolarHBondContact O-N 2.95Å; R673-Q675 VanDerWaalsContact C-N 3.33Å; Q675-L677 PolarHBondContact O-N 3.33Å; Q675-L678 PolarHBondContact O-N 3.18Å; Q675-E679 WeakPolarHBondContact O-CB 3.08Å; Q675-E679 PolarHBondContact O-N 3.49Å
676	Q	90.4	Very high	88.2	Confident	85 Å²	85	45.4 Å²	45.4	40%	0.397	25%	0.246	S	C	.	.	H	α-helix	trans	-63.9	-37	173.5	-72.7	174.5	-10.6	0	0	112.8	L605 L609 A672 R673 W680	L605-Q676 HydrophobicContact CD1-CB 4.36Å; L609-Q676 HydrophobicContact CD2-CB 3.48Å; L609-Q676 VanDerWaalsContact CD2-CB 3.48Å; A672-Q676 WeakPolarHBondContact O-CG 3.17Å; A672-Q676 PolarHBondContact O-N 2.93Å; R673-Q676 PolarHBondContact O-N 3.11Å; Q676-W680 PolarHBondContact O-N 3.2Å
677	L	91.3	Very high	88.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-67.4	-41.9	174.5	-174.6	62.4	0	0	0	112.1	L585 L609 V612 V613 Y616 R673 L674 Q675 W680 M681 F694	L585-L677 HydrophobicContact CD1-CD2 4.42Å; L609-L677 HydrophobicContact CD1-CB 3.75Å; L609-L677 HydrophobicContact CD1-CD1 3.73Å; L609-L677 HydrophobicContact CD1-CG 4.2Å; V612-L677 HydrophobicContact CG1-CD1 4.28Å; V613-L677 HydrophobicContact CG2-CD1 3.78Å; Y616-L677 HydrophobicContact CD2-CD1 4.4Å; Y616-L677 HydrophobicContact CE2-CD1 4.07Å; R673-L677 PolarHBondContact O-N 3.07Å; L674-L677 PolarHBondContact O-N 3.36Å; Q675-L677 PolarHBondContact O-N 3.33Å; L677-W680 HydrophobicContact CD1-CE3 4.35Å; L677-W680 PolarHBondContact O-N 2.92Å; L677-M681 HydrophobicContact CD2-CE 4.2Å; L677-M681 HydrophobicContact CG-CE 3.79Å; L677-M681 WeakPolarHBondContact O-CG 3.4Å; L677-M681 PolarHBondContact O-N 2.9Å; L677-F694 HydrophobicContact CD2-CE1 4.41Å; L677-F694 HydrophobicContact CD2-CZ 4.18Å
678	L	93.3	Very high	89.4	Confident	27 Å²	27	46.9 Å²	46.9	14%	0.141	27%	0.272	C	S	.	.	H	α-helix	trans	-64.6	-39.5	175.1	-76.6	164.8	0	0	0	111.8	L674 Q675 M681 R682 G690 E691 F694	L674-L678 HydrophobicContact CD1-CD1 4.43Å; L674-L678 HydrophobicContact CD1-CG 4.48Å; L674-L678 HydrophobicContact CG-CD1 4.03Å; L674-L678 WeakPolarHBondContact O-CB 3.24Å; L674-L678 WeakPolarHBondContact O-CG 3.44Å; L674-L678 PolarHBondContact O-N 3.44Å; Q675-L678 PolarHBondContact O-N 3.18Å; L678-M681 HydrophobicContact CD2-CE 3.75Å; L678-M681 HydrophobicContact CG-CE 4.15Å; L678-M681 PolarHBondContact O-N 2.92Å; L678-R682 WeakPolarHBondContact O-CB 3.41Å; L678-R682 PolarHBondContact O-N 3.19Å; L678-G690 VanDerWaalsContact CD2-C 3.42Å; L678-E691 HydrophobicContact CD2-CG 4.32Å; L678-F694 HydrophobicContact CD2-CB 4.3Å
679	E	91.4	Very high	89.6	Confident	95 Å²	95	45.5 Å²	45.5	44%	0.444	27%	0.267	S	S	.	.	H	α-helix	trans	-64.4	-41.1	174.4	-176.7	61.4	-171.9	0	0	111.8	Q675 R682 S683	Q675-E679 WeakPolarHBondContact O-CB 3.08Å; Q675-E679 PolarHBondContact O-N 3.49Å; E679-R682 WeakPolarHBondContact O-CB 3.39Å; E679-R682 PolarHBondContact O-N 3.02Å; E679-R682 IonicContact OE1-CZ 2.6Å; E679-R682 IonicContact OE1-NE 2.69Å; E679-R682 IonicContact OE1-NH2 2.64Å; E679-R682 PolarHBondContact OE1-NH2 3.41Å; E679-R682 IonicContact OE2-CZ 2.63Å; E679-R682 IonicContact OE2-NE 3.2Å; E679-R682 PolarHBondContact OE2-NE 3.02Å; E679-R682 IonicContact OE2-NH2 3.55Å; E679-R682 PolarHBondContact OE2-NH2 3.05Å; E679-S683 PolarHBondContact O-N 3.48Å
680	W	92.6	Very high	90	Very high	37 Å²	37	43.7 Å²	43.7	14%	0.14	26%	0.258	C	S	.	.	H	α-helix	trans	-61	-49.1	171.2	174.9	79.6	0	0	0	111.6	V613 Y616 Q617 Q676 L677 R682 S683 A684	V613-W680 HydrophobicContact CG1-CD2 3.89Å; V613-W680 HydrophobicContact CG1-CG 4Å; V613-W680 HydrophobicContact CG1-CZ2 4.26Å; V613-W680 HydrophobicContact CG2-CB 4.39Å; V613-W680 HydrophobicContact CG2-CD2 4.01Å; V613-W680 HydrophobicContact CG2-CE3 4.25Å; V613-W680 HydrophobicContact CG2-CG 4.02Å; Y616-W680 VanDerWaalsContact CB-CH2 3.43Å; Y616-W680 HydrophobicContact CD2-CH2 4.47Å; Y616-W680 AromaticContact CD2-CZ3 3.92Å; Y616-W680 HydrophobicContact CD2-CZ3 3.92Å; Y616-W680 HydrophobicContact CG-CH2 4.33Å; Y616-W680 HydrophobicContact CG-CZ3 4.13Å; Q617-W680 HydrophobicContact CB-CZ2 4.35Å; Q676-W680 PolarHBondContact O-N 3.2Å; L677-W680 HydrophobicContact CD1-CE3 4.35Å; L677-W680 PolarHBondContact O-N 2.92Å; W680-R682 VanDerWaalsContact C-N 3.25Å; W680-R682 PolarHBondContact O-N 3.18Å; W680-S683 PolarHBondContact O-N 2.87Å; W680-S683 VanDerWaalsContact O-N 3.08Å; W680-S683 PolarHBondContact O-OG 3.28Å; W680-A684 HydrophobicContact CH2-CB 4.39Å; W680-A684 HydrophobicContact CZ2-CB 4.15Å; W680-A684 WeakPolarHBondContact O-CB 3.39Å; W680-A684 PolarHBondContact O-N 2.87Å
681	M	93.3	Very high	90.4	Very high	0 Å²	0	49 Å²	49	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-56.9	-39	175.9	-76.8	-173.1	-93.6	0	0	112.1	F641 L677 L678 A684 G685 F686 G687 G690 F694	F641-M681 HydrophobicContact CD1-SD 3.61Å; F641-M681 HydrophobicContact CD2-SD 4.04Å; F641-M681 HydrophobicContact CE1-CG 3.9Å; F641-M681 HydrophobicContact CE1-SD 3.53Å; F641-M681 VanDerWaalsContact CE1-SD 3.53Å; F641-M681 HydrophobicContact CE2-CG 4.41Å; F641-M681 HydrophobicContact CE2-SD 3.97Å; F641-M681 HydrophobicContact CG-SD 3.88Å; F641-M681 HydrophobicContact CZ-CG 3.82Å; F641-M681 HydrophobicContact CZ-SD 3.72Å; L677-M681 HydrophobicContact CD2-CE 4.2Å; L677-M681 HydrophobicContact CG-CE 3.79Å; L677-M681 WeakPolarHBondContact O-CG 3.4Å; L677-M681 PolarHBondContact O-N 2.9Å; L678-M681 HydrophobicContact CD2-CE 3.75Å; L678-M681 HydrophobicContact CG-CE 4.15Å; L678-M681 PolarHBondContact O-N 2.92Å; M681-A684 PolarHBondContact O-N 3.2Å; M681-G685 PolarHBondContact O-N 2.97Å; M681-F686 CarbonylContact O-C 3.59Å; M681-F686 WeakPolarHBondContact O-CA 3.28Å; M681-F686 PolarHBondContact O-N 3.15Å; M681-G687 PolarHBondContact O-N 3.21Å; M681-G690 VanDerWaalsContact SD-CA 3.51Å; M681-F694 HydrophobicContact CE-CD2 3.48Å; M681-F694 VanDerWaalsContact CE-CD2 3.48Å; M681-F694 HydrophobicContact CE-CE2 3.33Å; M681-F694 HydrophobicContact CE-CG 4.4Å; M681-F694 HydrophobicContact CE-CZ 4.15Å; M681-F694 HydrophobicContact SD-CD2 4.22Å; M681-F694 HydrophobicContact SD-CE2 3.86Å
682	R	92.8	Very high	90.6	Very high	140 Å²	140	53.7 Å²	53.7	53%	0.528	30%	0.303	S	S	.	.	H	α-helix	trans	-63.8	-44.8	175.2	-167	172.3	73.3	91.5	-3.6	111.5	L678 E679 W680 A684 G685	L678-R682 WeakPolarHBondContact O-CB 3.41Å; L678-R682 PolarHBondContact O-N 3.19Å; E679-R682 WeakPolarHBondContact O-CB 3.39Å; E679-R682 PolarHBondContact O-N 3.02Å; E679-R682 IonicContact OE1-CZ 2.6Å; E679-R682 IonicContact OE1-NE 2.69Å; E679-R682 IonicContact OE1-NH2 2.64Å; E679-R682 PolarHBondContact OE1-NH2 3.41Å; E679-R682 IonicContact OE2-CZ 2.63Å; E679-R682 IonicContact OE2-NE 3.2Å; E679-R682 PolarHBondContact OE2-NE 3.02Å; E679-R682 IonicContact OE2-NH2 3.55Å; E679-R682 PolarHBondContact OE2-NH2 3.05Å; W680-R682 VanDerWaalsContact C-N 3.25Å; W680-R682 PolarHBondContact O-N 3.18Å; R682-A684 VanDerWaalsContact C-N 3.31Å; R682-A684 PolarHBondContact O-N 3.03Å; R682-G685 PolarHBondContact O-N 3.04Å
683	S	89.8	Confident	90.9	Very high	93 Å²	93	54 Å²	54	65%	0.65	30%	0.296	S	S	*	.	H	α-helix	trans	-65.9	-30.7	176	76.1	0	0	0	0	113.6	E679 W680 G685	E679-S683 PolarHBondContact O-N 3.48Å; W680-S683 PolarHBondContact O-N 2.87Å; W680-S683 VanDerWaalsContact O-N 3.08Å; W680-S683 PolarHBondContact O-OG 3.28Å; S683-G685 VanDerWaalsContact C-N 3.29Å; S683-G685 PolarHBondContact O-N 3.48Å
684	A	87.5	Confident	91.2	Very high	21 Å²	21	53 Å²	53	17%	0.174	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-7	177.6	0	0	0	0	0	114	W680 M681 R682 F686	W680-A684 HydrophobicContact CH2-CB 4.39Å; W680-A684 HydrophobicContact CZ2-CB 4.15Å; W680-A684 WeakPolarHBondContact O-CB 3.39Å; W680-A684 PolarHBondContact O-N 2.87Å; M681-A684 PolarHBondContact O-N 3.2Å; R682-A684 VanDerWaalsContact C-N 3.31Å; R682-A684 PolarHBondContact O-N 3.03Å; A684-F686 HydrophobicContact CB-CD2 3.97Å; A684-F686 HydrophobicContact CB-CE2 4.36Å; A684-F686 WeakPolarHBondContact O-CD2 3.41Å; A684-F686 WeakPolarHBondContact O-CE2 3.38Å
685	G	89.8	Confident	91.3	Very high	65 Å²	65	58.7 Å²	58.7	67%	0.67	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.8	-0.3	179.7	0	0	0	0	0	115.6	M681 R682 S683	M681-G685 PolarHBondContact O-N 2.97Å; R682-G685 PolarHBondContact O-N 3.04Å; S683-G685 VanDerWaalsContact C-N 3.29Å; S683-G685 PolarHBondContact O-N 3.48Å
686	F	91.3	Very high	91.3	Very high	35 Å²	35	56.3 Å²	56.3	15%	0.154	30%	0.301	C	S	.	.			trans	-109.7	17.6	-171.3	-55.8	-77.1	0	0	0	114.4	L620 L637 F641 M681 A684 A688 A689 G690	L620-F686 HydrophobicContact CD1-CE2 4.17Å; L620-F686 HydrophobicContact CD1-CZ 4.11Å; L620-F686 HydrophobicContact CD2-CE2 3.88Å; L637-F686 HydrophobicContact CD1-CD1 4.42Å; L637-F686 HydrophobicContact CD1-CD2 3.81Å; L637-F686 HydrophobicContact CD1-CE1 4.16Å; L637-F686 HydrophobicContact CD1-CE2 3.52Å; L637-F686 HydrophobicContact CD1-CG 4.26Å; L637-F686 HydrophobicContact CD1-CZ 3.72Å; F641-F686 HydrophobicContact CE2-CB 3.79Å; F641-F686 HydrophobicContact CE2-CG 4.26Å; F641-F686 HydrophobicContact CZ-CB 4.36Å; M681-F686 CarbonylContact O-C 3.59Å; M681-F686 WeakPolarHBondContact O-CA 3.28Å; M681-F686 PolarHBondContact O-N 3.15Å; A684-F686 HydrophobicContact CB-CD2 3.97Å; A684-F686 HydrophobicContact CB-CE2 4.36Å; A684-F686 WeakPolarHBondContact O-CD2 3.41Å; A684-F686 WeakPolarHBondContact O-CE2 3.38Å; F686-A688 PolarHBondContact O-N 3.32Å; F686-A689 PolarHBondContact O-N 3Å; F686-A689 VanDerWaalsContact O-N 3.08Å; F686-G690 PolarHBondContact O-N 3.14Å
687	G	89.8	Confident	91.4	Very high	9 Å²	9	52.4 Å²	52.4	9%	0.093	28%	0.283	C	S	.	.	H	α-helix	trans	-50.2	-49.5	-172.7	0	0	0	0	0	114.5	M681 A689 G690 E691	M681-G687 PolarHBondContact O-N 3.21Å; G687-A689 VanDerWaalsContact C-N 3.34Å; G687-A689 PolarHBondContact O-N 3.1Å; G687-G690 PolarHBondContact O-N 3.4Å; G687-E691 WeakPolarHBondContact O-CB 3.32Å; G687-E691 WeakPolarHBondContact O-CG 3.42Å; G687-E691 PolarHBondContact O-N 2.89Å
688	A	91.1	Very high	91.4	Very high	85 Å²	85	53.8 Å²	53.8	70%	0.702	29%	0.293	S	S	*	.	H	α-helix	trans	-63.6	-35.6	-179.3	0	0	0	0	0	113.6	F686 H692	F686-A688 PolarHBondContact O-N 3.32Å; A688-H692 VanDerWaalsContact O-CB 3.31Å; A688-H692 WeakPolarHBondContact O-CB 3.21Å; A688-H692 PolarHBondContact O-N 3.13Å
689	A	89.6	Confident	91.4	Very high	28 Å²	28	53.9 Å²	53.9	23%	0.231	30%	0.295	C	S	.	.	H	α-helix	trans	-71.2	-45	175.4	0	0	0	0	0	110.9	F641 F686 G687 H692 F693	F641-A689 HydrophobicContact CD2-CB 4.47Å; F686-A689 PolarHBondContact O-N 3Å; F686-A689 VanDerWaalsContact O-N 3.08Å; G687-A689 VanDerWaalsContact C-N 3.34Å; G687-A689 PolarHBondContact O-N 3.1Å; A689-H692 PolarHBondContact O-N 3.39Å; A689-F693 HydrophobicContact CB-CD2 4.47Å; A689-F693 HydrophobicContact CB-CE2 4.25Å; A689-F693 WeakPolarHBondContact O-CD2 3.28Å; A689-F693 PolarHBondContact O-N 3.15Å
690	G	90.5	Very high	91.3	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-57	-52.1	174.5	0	0	0	0	0	112.1	L678 M681 F686 G687 H692 F693 F694	L678-G690 VanDerWaalsContact CD2-C 3.42Å; M681-G690 VanDerWaalsContact SD-CA 3.51Å; F686-G690 PolarHBondContact O-N 3.14Å; G687-G690 PolarHBondContact O-N 3.4Å; G690-H692 VanDerWaalsContact C-N 3.29Å; G690-H692 PolarHBondContact O-N 3.15Å; G690-F693 PolarHBondContact O-N 3.31Å; G690-F694 WeakPolarHBondContact O-CB 3.25Å; G690-F694 WeakPolarHBondContact O-CD2 3.5Å; G690-F694 PolarHBondContact O-N 3.45Å
691	E	91.6	Very high	91.2	Very high	117 Å²	117	47.7 Å²	47.7	55%	0.547	27%	0.268	S	S	.	.	H	α-helix	trans	-57.4	-40.7	176	-75.4	178	-151.7	0	0	112.1	L678 G687 R695	L678-E691 HydrophobicContact CD2-CG 4.32Å; G687-E691 WeakPolarHBondContact O-CB 3.32Å; G687-E691 WeakPolarHBondContact O-CG 3.42Å; G687-E691 PolarHBondContact O-N 2.89Å; E691-R695 WeakPolarHBondContact O-CA 3.43Å; E691-R695 VanDerWaalsContact O-CB 3.28Å; E691-R695 WeakPolarHBondContact O-CB 3.39Å; E691-R695 PolarHBondContact O-N 2.85Å; E691-R695 VanDerWaalsContact O-N 3.09Å
692	H	91.9	Very high	91	Very high	107 Å²	107	50.5 Å²	50.5	50%	0.495	28%	0.283	S	S	.	.	H	α-helix	trans	-63.8	-53.4	179.3	-173.5	97.3	0	0	0	112.9	A688 A689 G690 R695	A688-H692 VanDerWaalsContact O-CB 3.31Å; A688-H692 WeakPolarHBondContact O-CB 3.21Å; A688-H692 PolarHBondContact O-N 3.13Å; A689-H692 PolarHBondContact O-N 3.39Å; G690-H692 VanDerWaalsContact C-N 3.29Å; G690-H692 PolarHBondContact O-N 3.15Å; H692-R695 VanDerWaalsContact O-CB 3.25Å; H692-R695 WeakPolarHBondContact O-CB 3.19Å; H692-R695 PolarHBondContact O-N 3.5Å
693	F	92.4	Very high	90.8	Very high	48 Å²	48	43.9 Å²	43.9	21%	0.211	26%	0.258	C	S	.	.	H	α-helix	trans	-75.7	-37.7	-174.3	-64.1	-59.7	0	0	0	112.9	A638 F641 F642 A689 G690 R695 P774	A638-F693 HydrophobicContact CB-CE2 3.81Å; A638-F693 HydrophobicContact CB-CZ 4.36Å; F641-F693 HydrophobicContact CB-CB 4.3Å; F641-F693 HydrophobicContact CB-CD2 3.94Å; F641-F693 HydrophobicContact CB-CG 4.46Å; F642-F693 HydrophobicContact CB-CD1 3.75Å; F642-F693 HydrophobicContact CB-CE1 4.02Å; F642-F693 HydrophobicContact CB-CG 4.12Å; F642-F693 HydrophobicContact CD2-CD1 4.02Å; F642-F693 HydrophobicContact CD2-CE1 4.35Å; F642-F693 HydrophobicContact CG-CD1 4.37Å; A689-F693 HydrophobicContact CB-CD2 4.47Å; A689-F693 HydrophobicContact CB-CE2 4.25Å; A689-F693 WeakPolarHBondContact O-CD2 3.28Å; A689-F693 PolarHBondContact O-N 3.15Å; G690-F693 PolarHBondContact O-N 3.31Å; F693-R695 VanDerWaalsContact C-N 3.28Å; F693-R695 PolarHBondContact O-N 2.91Å; F693-P774 HydrophobicContact CE1-CG 3.93Å; F693-P774 HydrophobicContact CE2-CG 4.48Å; F693-P774 HydrophobicContact CZ-CB 4.49Å; F693-P774 HydrophobicContact CZ-CG 3.61Å
694	F	93.7	Very high	90.6	Very high	1 Å²	1	39.4 Å²	39.4	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-82.9	-0.8	176.3	-67.8	-85.9	0	0	0	113.4	F641 L648 L674 L677 L678 M681 G690 K696 L697 S698	F641-F694 HydrophobicContact CB-CE2 3.89Å; F641-F694 HydrophobicContact CD1-CE2 4.13Å; F641-F694 HydrophobicContact CG-CE2 4.26Å; L648-F694 HydrophobicContact CD1-CE1 4.17Å; L674-F694 HydrophobicContact CD1-CB 4.16Å; L674-F694 HydrophobicContact CD1-CD1 3.66Å; L674-F694 HydrophobicContact CD1-CE1 4.26Å; L674-F694 HydrophobicContact CD1-CG 4.04Å; L677-F694 HydrophobicContact CD2-CE1 4.41Å; L677-F694 HydrophobicContact CD2-CZ 4.18Å; L678-F694 HydrophobicContact CD2-CB 4.3Å; M681-F694 HydrophobicContact CE-CD2 3.48Å; M681-F694 VanDerWaalsContact CE-CD2 3.48Å; M681-F694 HydrophobicContact CE-CE2 3.33Å; M681-F694 HydrophobicContact CE-CG 4.4Å; M681-F694 HydrophobicContact CE-CZ 4.15Å; M681-F694 HydrophobicContact SD-CD2 4.22Å; M681-F694 HydrophobicContact SD-CE2 3.86Å; G690-F694 WeakPolarHBondContact O-CB 3.25Å; G690-F694 WeakPolarHBondContact O-CD2 3.5Å; G690-F694 PolarHBondContact O-N 3.45Å; F694-K696 PolarHBondContact O-N 3.12Å; F694-L697 HydrophobicContact CD1-CD2 4Å; F694-L697 PolarHBondContact O-N 3.2Å; F694-S698 WeakPolarHBondContact O-CB 3.22Å; F694-S698 PolarHBondContact O-N 2.87Å
695	R	92.6	Very high	90.5	Very high	131 Å²	131	39.4 Å²	39.4	49%	0.494	23%	0.227	S	C	.	.	H	α-helix	trans	-48.9	-50.6	180	-175.4	166.1	52.1	137.8	0.6	113.6	E691 H692 F693 S698 C699 A725	E691-R695 WeakPolarHBondContact O-CA 3.43Å; E691-R695 VanDerWaalsContact O-CB 3.28Å; E691-R695 WeakPolarHBondContact O-CB 3.39Å; E691-R695 PolarHBondContact O-N 2.85Å; E691-R695 VanDerWaalsContact O-N 3.09Å; H692-R695 VanDerWaalsContact O-CB 3.25Å; H692-R695 WeakPolarHBondContact O-CB 3.19Å; H692-R695 PolarHBondContact O-N 3.5Å; F693-R695 VanDerWaalsContact C-N 3.28Å; F693-R695 PolarHBondContact O-N 2.91Å; R695-S698 PolarHBondContact O-N 2.94Å; R695-C699 PolarHBondContact O-N 3.38Å; R695-C699 PolarHBondContact O-SG 2.9Å; R695-C699 VanDerWaalsContact O-SG 3.4Å; R695-A725 HydrophobicContact CG-CB 4.41Å
696	K	91.3	Very high	90.3	Very high	58 Å²	58	37.3 Å²	37.3	25%	0.252	20%	0.201	S	C	.	.	H	α-helix	trans	-63.6	-46.5	-179.3	-75.2	-173.1	165.8	-178.5	0	111.5	L649 F694 S698 C699 T700 A725 E768	L649-K696 HydrophobicContact CD2-CB 3.74Å; L649-K696 HydrophobicContact CD2-CD 4.21Å; F694-K696 PolarHBondContact O-N 3.12Å; K696-S698 VanDerWaalsContact C-N 3.34Å; K696-S698 PolarHBondContact O-N 2.65Å; K696-C699 PolarHBondContact O-N 3.12Å; K696-T700 PolarHBondContact O-N 3.3Å; K696-T700 PolarHBondContact O-OG1 3.09Å; K696-A725 VanDerWaalsContact CE-O 3.24Å; K696-A725 WeakPolarHBondContact CE-O 3.49Å; K696-A725 HydrophobicContact CG-CB 4.5Å; K696-E768 VanDerWaalsContact CD-OE2 3.31Å; K696-E768 WeakPolarHBondContact CD-OE2 3.33Å; K696-E768 IonicContact NZ-OE1 3.4Å; K696-E768 PolarHBondContact NZ-OE1 3.49Å; K696-E768 IonicContact NZ-OE2 3.57Å; K696-E768 PolarHBondContact NZ-OE2 3.45Å
697	L	91.8	Very high	89.8	Confident	3 Å²	3	38.5 Å²	38.5	2%	0.016	21%	0.213	C	C	.	.	H	α-helix	trans	-61	-41.9	175.7	-175.8	68.5	0	0	0	111.9	L648 L649 L674 F694 T700 L701	L648-L697 HydrophobicContact CB-CD1 4.12Å; L648-L697 HydrophobicContact CB-CD2 3.61Å; L648-L697 HydrophobicContact CD1-CD2 3.71Å; L648-L697 HydrophobicContact CG-CD2 4.33Å; L649-L697 HydrophobicContact CB-CD1 4.37Å; L674-L697 HydrophobicContact CD1-CD2 4.19Å; L674-L697 HydrophobicContact CD2-CB 4.34Å; L674-L697 HydrophobicContact CD2-CD2 3.92Å; L674-L697 HydrophobicContact CD2-CG 3.96Å; F694-L697 HydrophobicContact CD1-CD2 4Å; F694-L697 PolarHBondContact O-N 3.2Å; L697-T700 PolarHBondContact O-N 3.4Å; L697-L701 HydrophobicContact CD1-CD1 4.39Å; L697-L701 HydrophobicContact CD1-CG 4.34Å; L697-L701 HydrophobicContact CG-CD1 4.08Å; L697-L701 HydrophobicContact CG-CG 4.37Å; L697-L701 WeakPolarHBondContact O-CG 3.35Å; L697-L701 PolarHBondContact O-N 3.02Å
698	S	92.6	Very high	89.4	Confident	30 Å²	30	43.6 Å²	43.6	21%	0.21	23%	0.229	C	C	.	.	H	α-helix	trans	-60.9	-47.4	176	-175.7	0	0	0	0	111.5	F694 R695 K696 T700 L701 N702	F694-S698 WeakPolarHBondContact O-CB 3.22Å; F694-S698 PolarHBondContact O-N 2.87Å; R695-S698 PolarHBondContact O-N 2.94Å; K696-S698 VanDerWaalsContact C-N 3.34Å; K696-S698 PolarHBondContact O-N 2.65Å; S698-T700 VanDerWaalsContact C-N 3.34Å; S698-T700 PolarHBondContact O-N 2.8Å; S698-L701 PolarHBondContact O-N 2.97Å; S698-N702 WeakPolarHBondContact O-CB 3.34Å; S698-N702 VanDerWaalsContact O-CG 3.24Å; S698-N702 PolarHBondContact O-N 3.24Å; S698-N702 PolarHBondContact O-ND2 2.85Å; S698-N702 PolarHBondContact OG-ND2 3.48Å
699	C	91.6	Very high	89	Confident	28 Å²	28	42.9 Å²	42.9	19%	0.189	22%	0.223	C	C	.	.	H	α-helix	trans	-57.6	-44.4	173.1	-70.7	0	0	0	0	112.3	R695 K696 N702 L703 A725 L726	R695-C699 PolarHBondContact O-N 3.38Å; R695-C699 PolarHBondContact O-SG 2.9Å; R695-C699 VanDerWaalsContact O-SG 3.4Å; K696-C699 PolarHBondContact O-N 3.12Å; C699-N702 PolarHBondContact O-N 3.4Å; C699-L703 PolarHBondContact O-N 3.33Å; C699-A725 HydrophobicContact CB-CB 4.29Å; C699-L726 HydrophobicContact CB-CD2 4.42Å; C699-L726 HydrophobicContact CB-CG 4.46Å
700	T	90.4	Very high	88.7	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-45.9	177	-63.1	0	0	0	0	112.8	L652 K696 L697 S698 L703 L704 L726 L734	L652-T700 HydrophobicContact CD1-CG2 4.41Å; L652-T700 HydrophobicContact CD2-CG2 3.48Å; L652-T700 VanDerWaalsContact CD2-CG2 3.48Å; K696-T700 PolarHBondContact O-N 3.3Å; K696-T700 PolarHBondContact O-OG1 3.09Å; L697-T700 PolarHBondContact O-N 3.4Å; S698-T700 VanDerWaalsContact C-N 3.34Å; S698-T700 PolarHBondContact O-N 2.8Å; T700-L703 WeakPolarHBondContact O-CB 3.4Å; T700-L703 PolarHBondContact O-N 3.44Å; T700-L704 WeakPolarHBondContact O-CG 3.13Å; T700-L704 PolarHBondContact O-N 3.43Å; T700-L704 VanDerWaalsContact O-N 3.07Å; T700-L726 WeakPolarHBondContact OG1-CD2 3.19Å; T700-L734 HydrophobicContact CG2-CD1 3.68Å; T700-L734 HydrophobicContact CG2-CD2 3.64Å; T700-L734 HydrophobicContact CG2-CG 4.33Å
701	L	89.6	Confident	88.4	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.01	24%	0.236	C	C	.	.	H	α-helix	trans	-69.1	-33.7	178.8	-68.1	179.4	0	0	0	112.1	L586 L652 A670 C671 L674 L697 S698 L703 L704 A705	L586-L701 HydrophobicContact CD2-CD2 4.48Å; L652-L701 HydrophobicContact CD1-CD2 3.62Å; A670-L701 HydrophobicContact CB-CD1 4.19Å; A670-L701 HydrophobicContact CB-CD2 3.84Å; C671-L701 HydrophobicContact CB-CB 4.1Å; L674-L701 HydrophobicContact CB-CD1 4.13Å; L674-L701 HydrophobicContact CD2-CD1 3.86Å; L697-L701 HydrophobicContact CD1-CD1 4.39Å; L697-L701 HydrophobicContact CD1-CG 4.34Å; L697-L701 HydrophobicContact CG-CD1 4.08Å; L697-L701 HydrophobicContact CG-CG 4.37Å; L697-L701 WeakPolarHBondContact O-CG 3.35Å; L697-L701 PolarHBondContact O-N 3.02Å; S698-L701 PolarHBondContact O-N 2.97Å; L701-L703 VanDerWaalsContact C-N 3.35Å; L701-L704 PolarHBondContact O-N 2.84Å; L701-A705 WeakPolarHBondContact O-CB 3.45Å; L701-A705 PolarHBondContact O-N 3.24Å
702	N	89	Confident	88.1	Confident	60 Å²	60	44.2 Å²	44.2	32%	0.321	23%	0.226	S	C	.	.	H	α-helix	trans	-65.5	-35.7	171.7	-73.9	-41.4	0	0	0	112.2	C671 S698 C699 A705 T706 F723	C671-N702 PolarHBondContact SG-OD1 2.79Å; S698-N702 WeakPolarHBondContact O-CB 3.34Å; S698-N702 VanDerWaalsContact O-CG 3.24Å; S698-N702 PolarHBondContact O-N 3.24Å; S698-N702 PolarHBondContact O-ND2 2.85Å; S698-N702 PolarHBondContact OG-ND2 3.48Å; C699-N702 PolarHBondContact O-N 3.4Å; N702-A705 CarbonylContact O-C 3.57Å; N702-A705 PolarHBondContact O-N 3.26Å; N702-T706 PolarHBondContact O-N 3.04Å; N702-T706 PolarHBondContact O-OG1 3.44Å; N702-F723 HydrophobicContact CB-CE1 4.48Å
703	L	89	Confident	87.8	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.8	-47.8	171.3	-171.6	158.9	0	0	0	110.9	C699 T700 L701 A705 T706 L711 F723 L731 L735	C699-L703 PolarHBondContact O-N 3.33Å; T700-L703 WeakPolarHBondContact O-CB 3.4Å; T700-L703 PolarHBondContact O-N 3.44Å; L701-L703 VanDerWaalsContact C-N 3.35Å; L703-A705 VanDerWaalsContact C-N 3.3Å; L703-A705 PolarHBondContact O-N 3.02Å; L703-T706 VanDerWaalsContact O-CB 3.25Å; L703-T706 WeakPolarHBondContact O-CB 3.45Å; L703-T706 PolarHBondContact O-N 2.86Å; L703-T706 VanDerWaalsContact O-N 3.09Å; L703-T706 PolarHBondContact O-OG1 3.07Å; L703-L711 HydrophobicContact CD2-CD1 4.47Å; L703-L711 HydrophobicContact CG-CD1 4.42Å; L703-F723 HydrophobicContact CB-CD1 4.13Å; L703-F723 HydrophobicContact CB-CE1 3.72Å; L703-F723 HydrophobicContact CB-CE2 4.21Å; L703-F723 HydrophobicContact CB-CZ 3.76Å; L703-F723 HydrophobicContact CD1-CD2 3.86Å; L703-F723 HydrophobicContact CD1-CE2 4.01Å; L703-F723 HydrophobicContact CD1-CG 4.13Å; L703-F723 HydrophobicContact CD1-CZ 4.41Å; L703-F723 HydrophobicContact CG-CD2 4.35Å; L703-F723 HydrophobicContact CG-CE1 4.42Å; L703-F723 HydrophobicContact CG-CE2 4Å; L703-F723 HydrophobicContact CG-CZ 4.04Å; L703-L731 HydrophobicContact CD1-CD1 3.5Å; L703-L735 HydrophobicContact CD2-CD2 4.45Å
704	L	85.7	Confident	87.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67.6	-28.4	178	-62.3	-178.4	0	0	0	113.5	L652 C661 F662 T700 L701 T706 Y738	L652-L704 HydrophobicContact CD1-CD1 4.08Å; L652-L704 HydrophobicContact CD2-CD1 4.24Å; C661-L704 HydrophobicContact CB-CD1 4.5Å; F662-L704 HydrophobicContact CD1-CD2 3.59Å; F662-L704 HydrophobicContact CD2-CD1 4.45Å; F662-L704 HydrophobicContact CE1-CD1 4.44Å; F662-L704 HydrophobicContact CE1-CD2 3.8Å; F662-L704 HydrophobicContact CE2-CD1 4.32Å; F662-L704 HydrophobicContact CG-CD2 4.15Å; F662-L704 HydrophobicContact CZ-CD1 4.35Å; F662-L704 HydrophobicContact CZ-CD2 4.49Å; T700-L704 WeakPolarHBondContact O-CG 3.13Å; T700-L704 PolarHBondContact O-N 3.43Å; T700-L704 VanDerWaalsContact O-N 3.07Å; L701-L704 PolarHBondContact O-N 2.84Å; L704-T706 VanDerWaalsContact C-N 3.33Å; L704-Y738 HydrophobicContact CD2-CD2 3.94Å
705	A	84.6	Confident	87.4	Confident	21 Å²	21	48.5 Å²	48.5	17%	0.174	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-7.1	172.7	0	0	0	0	0	113.8	W664 V668 L701 N702 L703	W664-A705 PolarHBondContact NE1-O 3.04Å; V668-A705 HydrophobicContact CG2-CB 3.8Å; L701-A705 WeakPolarHBondContact O-CB 3.45Å; L701-A705 PolarHBondContact O-N 3.24Å; N702-A705 CarbonylContact O-C 3.57Å; N702-A705 PolarHBondContact O-N 3.26Å; L703-A705 VanDerWaalsContact C-N 3.3Å; L703-A705 PolarHBondContact O-N 3.02Å
706	T	85.6	Confident	87.2	Confident	20 Å²	20	42.7 Å²	42.7	12%	0.123	23%	0.231	C	C	.	.	S	Bend	trans	-70.4	131.4	176	-63.2	0	0	0	0	109.9	N702 L703 L704 R708 Q710 L711	N702-T706 PolarHBondContact O-N 3.04Å; N702-T706 PolarHBondContact O-OG1 3.44Å; L703-T706 VanDerWaalsContact O-CB 3.25Å; L703-T706 WeakPolarHBondContact O-CB 3.45Å; L703-T706 PolarHBondContact O-N 2.86Å; L703-T706 VanDerWaalsContact O-N 3.09Å; L703-T706 PolarHBondContact O-OG1 3.07Å; L704-T706 VanDerWaalsContact C-N 3.33Å; T706-R708 PolarHBondContact O-N 3.03Å; T706-Q710 HydrophobicContact CG2-CB 4.25Å; T706-Q710 HydrophobicContact CG2-CG 4.27Å; T706-L711 HydrophobicContact CG2-CB 4.32Å; T706-L711 HydrophobicContact CG2-CD1 4.17Å
707	P	82.7	Confident	86.9	Confident	61 Å²	61	44.9 Å²	44.9	40%	0.396	25%	0.249	S	C	.	.			trans	-60	134.9	179.5	-25.7	35.3	0	0	0	112.7	A709 Q710 L711	P707-A709 PolarHBondContact O-N 3.31Å; P707-A709 VanDerWaalsContact O-N 3.07Å; P707-Q710 WeakPolarHBondContact O-CB 3.42Å; P707-Q710 PolarHBondContact O-N 3.41Å; P707-L711 PolarHBondContact O-N 3.29Å
708	R	79.8	Confident	86.8	Confident	115 Å²	115	46.5 Å²	46.5	43%	0.434	26%	0.263	S	S	.	.	H	α-helix	trans	-49.1	-38.7	179.5	177	172.5	166.5	168.1	-3.9	113.3	T706 Q710 L711 I712 S742 M744	T706-R708 PolarHBondContact O-N 3.03Å; R708-Q710 VanDerWaalsContact C-N 3.29Å; R708-Q710 PolarHBondContact O-N 3.08Å; R708-L711 PolarHBondContact O-N 2.81Å; R708-I712 HydrophobicContact CG-CD1 3.66Å; R708-I712 HydrophobicContact CG-CG1 4.43Å; R708-I712 WeakPolarHBondContact O-CD1 3.27Å; R708-I712 VanDerWaalsContact O-CG1 3.25Å; R708-I712 WeakPolarHBondContact O-CG1 3.46Å; R708-I712 PolarHBondContact O-N 3.26Å; R708-S742 PolarHBondContact NH1-O 3.04Å; R708-S742 VanDerWaalsContact NH1-O 3.11Å; R708-M744 PolarHBondContact NE-SD 3.01Å; R708-M744 VanDerWaalsContact NE-SD 3.41Å; R708-M744 PolarHBondContact NH2-SD 3Å
709	A	82.4	Confident	86.6	Confident	70 Å²	70	45.1 Å²	45.1	58%	0.579	25%	0.253	S	S	*	.	H	α-helix	trans	-64.4	-30.5	179	0	0	0	0	0	113.6	P707 Q713	P707-A709 PolarHBondContact O-N 3.31Å; P707-A709 VanDerWaalsContact O-N 3.07Å; A709-Q713 WeakPolarHBondContact O-CG 3.24Å; A709-Q713 PolarHBondContact O-NE2 3.3Å
710	Q	84.1	Confident	86.5	Confident	109 Å²	109	47 Å²	47	51%	0.509	26%	0.256	S	S	.	.	H	α-helix	trans	-83.4	-45.5	176.2	-177.2	177.9	-3.6	0	0	110.7	T706 P707 R708 I712 Q713	T706-Q710 HydrophobicContact CG2-CB 4.25Å; T706-Q710 HydrophobicContact CG2-CG 4.27Å; P707-Q710 WeakPolarHBondContact O-CB 3.42Å; P707-Q710 PolarHBondContact O-N 3.41Å; R708-Q710 VanDerWaalsContact C-N 3.29Å; R708-Q710 PolarHBondContact O-N 3.08Å; Q710-I712 VanDerWaalsContact C-N 3.28Å; Q710-I712 PolarHBondContact O-N 3.11Å; Q710-Q713 PolarHBondContact O-N 3.2Å
711	L	84.7	Confident	86.3	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-58.2	-38.4	-177.5	-162.7	75.2	0	0	0	112.6	L703 T706 P707 R708 Q713 M714 L719 L735 Y738 W750	L703-L711 HydrophobicContact CD2-CD1 4.47Å; L703-L711 HydrophobicContact CG-CD1 4.42Å; T706-L711 HydrophobicContact CG2-CB 4.32Å; T706-L711 HydrophobicContact CG2-CD1 4.17Å; P707-L711 PolarHBondContact O-N 3.29Å; R708-L711 PolarHBondContact O-N 2.81Å; L711-Q713 VanDerWaalsContact C-N 3.29Å; L711-Q713 PolarHBondContact O-N 3.01Å; L711-M714 PolarHBondContact O-N 3.15Å; L711-L719 HydrophobicContact CD1-CD2 3.88Å; L711-L735 HydrophobicContact CD2-CD2 4.45Å; L711-Y738 HydrophobicContact CD2-CD1 3.92Å; L711-Y738 HydrophobicContact CD2-CE1 3.7Å; L711-Y738 HydrophobicContact CD2-CE2 4.44Å; L711-Y738 HydrophobicContact CD2-CG 4.39Å; L711-W750 HydrophobicContact CB-CZ2 4.22Å; L711-W750 HydrophobicContact CD2-CH2 3.65Å; L711-W750 HydrophobicContact CD2-CZ2 3.84Å; L711-W750 HydrophobicContact CD2-CZ3 4.47Å; L711-W750 HydrophobicContact CG-CH2 4.09Å; L711-W750 HydrophobicContact CG-CZ2 3.72Å; L711-W750 PolarHBondContact O-NE1 2.98Å
712	I	84	Confident	86.1	Confident	64 Å²	64	53.1 Å²	53.1	33%	0.328	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-27.1	178.8	-66.3	166.7	0	0	0	112.4	R708 Q710 M714 M744 W750	R708-I712 HydrophobicContact CG-CD1 3.66Å; R708-I712 HydrophobicContact CG-CG1 4.43Å; R708-I712 WeakPolarHBondContact O-CD1 3.27Å; R708-I712 VanDerWaalsContact O-CG1 3.25Å; R708-I712 WeakPolarHBondContact O-CG1 3.46Å; R708-I712 PolarHBondContact O-N 3.26Å; Q710-I712 VanDerWaalsContact C-N 3.28Å; Q710-I712 PolarHBondContact O-N 3.11Å; I712-M714 VanDerWaalsContact C-N 3.29Å; I712-M714 PolarHBondContact O-N 3.32Å; I712-M744 HydrophobicContact CD1-CE 3.48Å; I712-M744 VanDerWaalsContact CD1-CE 3.48Å; I712-M744 HydrophobicContact CD1-SD 3.94Å; I712-M744 HydrophobicContact CG1-CE 3.64Å; I712-W750 HydrophobicContact CG1-CZ2 4.03Å
713	Q	86.3	Confident	86.1	Confident	166 Å²	166	51.1 Å²	51.1	78%	0.776	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-11.1	179.5	-64.2	176.1	18.5	0	0	112.9	A709 Q710 L711	A709-Q713 WeakPolarHBondContact O-CG 3.24Å; A709-Q713 PolarHBondContact O-NE2 3.3Å; Q710-Q713 PolarHBondContact O-N 3.2Å; L711-Q713 VanDerWaalsContact C-N 3.29Å; L711-Q713 PolarHBondContact O-N 3.01Å
714	M	89	Confident	86	Confident	33 Å²	33	55.8 Å²	55.8	16%	0.163	33%	0.326	C	S	.	.			trans	-88.5	134.5	-179.6	-60.4	179.3	70.3	0	0	111.2	L711 I712 A718 L719 A722 W750	L711-M714 PolarHBondContact O-N 3.15Å; I712-M714 VanDerWaalsContact C-N 3.29Å; I712-M714 PolarHBondContact O-N 3.32Å; M714-A718 HydrophobicContact CB-CB 4.25Å; M714-A718 HydrophobicContact CE-CB 4.23Å; M714-L719 HydrophobicContact CB-CD1 4.38Å; M714-L719 HydrophobicContact CB-CD2 3.9Å; M714-L719 HydrophobicContact CB-CG 3.81Å; M714-L719 HydrophobicContact CE-CD2 3.82Å; M714-L719 HydrophobicContact CE-CG 4.29Å; M714-L719 HydrophobicContact CG-CD2 4.48Å; M714-L719 HydrophobicContact SD-CD2 3.82Å; M714-A722 HydrophobicContact CE-CB 3.68Å; M714-W750 PolarHBondContact O-NE1 3.43Å
715	S	89.2	Confident	86.1	Confident	47 Å²	47	56.9 Å²	56.9	33%	0.329	34%	0.335	S	S	.	.			trans	-75.5	161.7	166.4	60.9	0	0	0	0	111.3	T717 A718 L719 T749	S715-T717 PolarHBondContact O-N 2.64Å; S715-T717 PolarHBondContact OG-OG1 2.93Å; S715-A718 PolarHBondContact O-N 3.26Å; S715-A718 WeakPolarHBondContact OG-CB 3.35Å; S715-A718 PolarHBondContact OG-N 3.28Å; S715-A718 VanDerWaalsContact OG-N 3.13Å; S715-L719 WeakPolarHBondContact O-CG 3.48Å; S715-L719 PolarHBondContact O-N 2.91Å; S715-T749 CarbonylContact C-O 3.57Å; S715-T749 WeakPolarHBondContact CA-O 3.31Å
716	W	87.3	Confident	86.2	Confident	10 Å²	10	56.1 Å²	56.1	4%	0.038	33%	0.328	C	S	.	.	H	α-helix	trans	-46.8	-45.5	167.9	176.7	-98.8	0	0	0	112.5	A718 L719 R720 P728 L731 H732 L735 T749 W750 E751 P752 D756 A760	W716-A718 PolarHBondContact O-N 3.1Å; W716-L719 PolarHBondContact O-N 3.43Å; W716-R720 HydrophobicContact CD2-CG 4.36Å; W716-R720 HydrophobicContact CZ2-CG 4.16Å; W716-R720 WeakPolarHBondContact O-CG 3.21Å; W716-R720 PolarHBondContact O-N 3.28Å; W716-P728 HydrophobicContact CZ2-CB 4.28Å; W716-L731 HydrophobicContact CE3-CD2 4.36Å; W716-L731 HydrophobicContact CH2-CB 4.28Å; W716-L731 HydrophobicContact CH2-CD2 4.01Å; W716-L731 HydrophobicContact CH2-CG 4.17Å; W716-L731 HydrophobicContact CZ2-CD2 4.47Å; W716-L731 HydrophobicContact CZ3-CD2 3.95Å; W716-L731 HydrophobicContact CZ3-CG 3.98Å; W716-H732 HydrophobicContact CH2-CB 3.92Å; W716-H732 HydrophobicContact CZ3-CB 4.06Å; W716-L735 HydrophobicContact CE3-CD1 4.35Å; W716-L735 HydrophobicContact CZ3-CD1 4.15Å; W716-T749 PolarHBondContact N-O 3.11Å; W716-W750 VanDerWaalsContact CE3-O 3.29Å; W716-E751 WeakPolarHBondContact CB-O 3.39Å; W716-P752 HydrophobicContact CD2-CB 4.47Å; W716-P752 HydrophobicContact CE3-CG 4.48Å; W716-P752 HydrophobicContact CH2-CB 4.48Å; W716-P752 HydrophobicContact CH2-CG 4.1Å; W716-P752 HydrophobicContact CZ2-CB 4.09Å; W716-P752 HydrophobicContact CZ2-CG 4.21Å; W716-P752 HydrophobicContact CZ3-CG 4.24Å; W716-D756 HydrophobicContact CZ2-CB 4.31Å; W716-D756 PolarHBondContact NE1-OD2 2.67Å; W716-A760 HydrophobicContact CH2-CB 4.23Å; W716-A760 HydrophobicContact CZ2-CB 4.27Å
717	T	86.8	Confident	86.4	Confident	103 Å²	103	56.6 Å²	56.6	63%	0.632	33%	0.332	S	S	*	.	H	α-helix	trans	-63.6	-38.7	177	48.5	0	0	0	0	113.4	S715 A721	S715-T717 PolarHBondContact O-N 2.64Å; S715-T717 PolarHBondContact OG-OG1 2.93Å; T717-A721 WeakPolarHBondContact O-CB 3.42Å; T717-A721 PolarHBondContact O-N 2.9Å; T717-A721 VanDerWaalsContact O-N 3.08Å
718	A	88.3	Confident	86.6	Confident	38 Å²	38	54.2 Å²	54.2	31%	0.314	32%	0.316	S	S	.	.	H	α-helix	trans	-70.5	-35.5	175	0	0	0	0	0	112.1	M714 S715 W716 A721 A722	M714-A718 HydrophobicContact CB-CB 4.25Å; M714-A718 HydrophobicContact CE-CB 4.23Å; S715-A718 PolarHBondContact O-N 3.26Å; S715-A718 WeakPolarHBondContact OG-CB 3.35Å; S715-A718 PolarHBondContact OG-N 3.28Å; S715-A718 VanDerWaalsContact OG-N 3.13Å; W716-A718 PolarHBondContact O-N 3.1Å; A718-A721 PolarHBondContact O-N 3.16Å; A718-A722 VanDerWaalsContact O-CB 3.27Å; A718-A722 WeakPolarHBondContact O-CB 3.45Å; A718-A722 PolarHBondContact O-N 3.27Å
719	L	88	Confident	87	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-68.5	-43.2	175.3	-68.8	164.1	0	0	0	111.5	L711 M714 S715 W716 A721 A722 F723 L731 L735 W750	L711-L719 HydrophobicContact CD1-CD2 3.88Å; M714-L719 HydrophobicContact CB-CD1 4.38Å; M714-L719 HydrophobicContact CB-CD2 3.9Å; M714-L719 HydrophobicContact CB-CG 3.81Å; M714-L719 HydrophobicContact CE-CD2 3.82Å; M714-L719 HydrophobicContact CE-CG 4.29Å; M714-L719 HydrophobicContact CG-CD2 4.48Å; M714-L719 HydrophobicContact SD-CD2 3.82Å; S715-L719 WeakPolarHBondContact O-CG 3.48Å; S715-L719 PolarHBondContact O-N 2.91Å; W716-L719 PolarHBondContact O-N 3.43Å; L719-A721 VanDerWaalsContact C-N 3.31Å; L719-A721 PolarHBondContact O-N 3.08Å; L719-A722 PolarHBondContact O-N 2.85Å; L719-F723 HydrophobicContact CD2-CD2 4.35Å; L719-F723 HydrophobicContact CD2-CE2 4.09Å; L719-F723 WeakPolarHBondContact O-CD2 3.35Å; L719-F723 PolarHBondContact O-N 2.79Å; L719-L731 HydrophobicContact CB-CD2 4.16Å; L719-L735 HydrophobicContact CD1-CD1 3.9Å; L719-L735 HydrophobicContact CD1-CD2 4.3Å; L719-W750 HydrophobicContact CD1-CG 4.18Å
720	R	89.3	Confident	87.3	Confident	68 Å²	68	45.7 Å²	45.7	26%	0.257	27%	0.27	S	S	.	.	H	α-helix	trans	-58.8	-40.6	172	-72.1	-68	-65.4	134.1	-3.8	112.1	W716 L726 L731 D756	W716-R720 HydrophobicContact CD2-CG 4.36Å; W716-R720 HydrophobicContact CZ2-CG 4.16Å; W716-R720 WeakPolarHBondContact O-CG 3.21Å; W716-R720 PolarHBondContact O-N 3.28Å; R720-L726 PolarHBondContact NH1-O 2.84Å; R720-L731 HydrophobicContact CG-CD2 4.01Å; R720-D756 IonicContact NE-OD2 3.2Å
721	A	87.4	Confident	87.5	Confident	79 Å²	79	40.5 Å²	40.5	65%	0.653	25%	0.246	S	C	*	.	H	α-helix	trans	-72.4	-35.4	177.5	0	0	0	0	0	113.5	T717 A718 L719	T717-A721 WeakPolarHBondContact O-CB 3.42Å; T717-A721 PolarHBondContact O-N 2.9Å; T717-A721 VanDerWaalsContact O-N 3.08Å; A718-A721 PolarHBondContact O-N 3.16Å; L719-A721 VanDerWaalsContact C-N 3.31Å; L719-A721 PolarHBondContact O-N 3.08Å
722	A	86.1	Confident	87.7	Confident	52 Å²	52	42.4 Å²	42.4	43%	0.43	25%	0.254	S	S	.	.	H	α-helix	trans	-78.6	-29.8	179.4	0	0	0	0	0	113.6	M714 A718 L719 P724	M714-A722 HydrophobicContact CE-CB 3.68Å; A718-A722 VanDerWaalsContact O-CB 3.27Å; A718-A722 WeakPolarHBondContact O-CB 3.45Å; A718-A722 PolarHBondContact O-N 3.27Å; L719-A722 PolarHBondContact O-N 2.85Å; A722-P724 WeakPolarHBondContact O-CD 3.49Å
723	F	88.4	Confident	87.8	Confident	18 Å²	18	44 Å²	44	8%	0.079	26%	0.256	C	S	.	.			trans	-121.6	57.8	-178.1	-56.9	-76.2	0	0	0	112.4	N702 L703 L719 A725 L726	N702-F723 HydrophobicContact CB-CE1 4.48Å; L703-F723 HydrophobicContact CB-CD1 4.13Å; L703-F723 HydrophobicContact CB-CE1 3.72Å; L703-F723 HydrophobicContact CB-CE2 4.21Å; L703-F723 HydrophobicContact CB-CZ 3.76Å; L703-F723 HydrophobicContact CD1-CD2 3.86Å; L703-F723 HydrophobicContact CD1-CE2 4.01Å; L703-F723 HydrophobicContact CD1-CG 4.13Å; L703-F723 HydrophobicContact CD1-CZ 4.41Å; L703-F723 HydrophobicContact CG-CD2 4.35Å; L703-F723 HydrophobicContact CG-CE1 4.42Å; L703-F723 HydrophobicContact CG-CE2 4Å; L703-F723 HydrophobicContact CG-CZ 4.04Å; L719-F723 HydrophobicContact CD2-CD2 4.35Å; L719-F723 HydrophobicContact CD2-CE2 4.09Å; L719-F723 WeakPolarHBondContact O-CD2 3.35Å; L719-F723 PolarHBondContact O-N 2.79Å; F723-A725 PolarHBondContact O-N 3.32Å; F723-A725 VanDerWaalsContact O-N 3.11Å; F723-L726 HydrophobicContact CB-CD1 4.15Å; F723-L726 PolarHBondContact O-N 3.15Å
724	P	87.1	Confident	87.9	Confident	98 Å²	98	36.1 Å²	36.1	64%	0.636	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-12.1	-170.6	30.4	-37.8	0	0	0	114.4	A722 L726	A722-P724 WeakPolarHBondContact O-CD 3.49Å; P724-L726 VanDerWaalsContact C-N 3.3Å
725	A	86.8	Confident	87.8	Confident	22 Å²	22	34.7 Å²	34.7	18%	0.182	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-11.9	178.2	0	0	0	0	0	113.9	R695 K696 C699 F723	R695-A725 HydrophobicContact CG-CB 4.41Å; K696-A725 VanDerWaalsContact CE-O 3.24Å; K696-A725 WeakPolarHBondContact CE-O 3.49Å; K696-A725 HydrophobicContact CG-CB 4.5Å; C699-A725 HydrophobicContact CB-CB 4.29Å; F723-A725 PolarHBondContact O-N 3.32Å; F723-A725 VanDerWaalsContact O-N 3.11Å
726	L	88.1	Confident	87.6	Confident	6 Å²	6	34.8 Å²	34.8	3%	0.031	21%	0.211	C	C	.	.	S	Bend	trans	-98.1	144.3	-177.2	-55.1	-179.9	0	0	0	111.2	C699 T700 R720 F723 P724 Q730 L734	C699-L726 HydrophobicContact CB-CD2 4.42Å; C699-L726 HydrophobicContact CB-CG 4.46Å; T700-L726 WeakPolarHBondContact OG1-CD2 3.19Å; R720-L726 PolarHBondContact NH1-O 2.84Å; F723-L726 HydrophobicContact CB-CD1 4.15Å; F723-L726 PolarHBondContact O-N 3.15Å; P724-L726 VanDerWaalsContact C-N 3.3Å; L726-Q730 HydrophobicContact CB-CB 4.34Å; L726-L734 HydrophobicContact CD1-CD1 3.89Å
727	S	88.9	Confident	87.4	Confident	29 Å²	29	34.9 Å²	34.9	20%	0.203	21%	0.212	C	C	.	.			trans	-67.1	157.6	169.8	80.1	0	0	0	0	110.9	A729 Q730 L731 D765	S727-A729 PolarHBondContact O-N 3.26Å; S727-A729 PolarHBondContact OG-N 3.35Å; S727-Q730 PolarHBondContact O-N 3.1Å; S727-Q730 WeakPolarHBondContact OG-CB 3.33Å; S727-Q730 VanDerWaalsContact OG-CG 3.26Å; S727-Q730 WeakPolarHBondContact OG-CG 3.45Å; S727-Q730 PolarHBondContact OG-N 3.27Å; S727-L731 WeakPolarHBondContact O-CB 3.22Å; S727-L731 PolarHBondContact O-N 3.36Å; S727-D765 PolarHBondContact OG-O 2.98Å
728	P	87.3	Confident	87.2	Confident	11 Å²	11	30.2 Å²	30.2	7%	0.071	18%	0.183	C	C	.	.	H	α-helix	trans	-54.2	-41	171	-26.8	36.4	0	0	0	112.3	W716 H732 E759 A760	W716-P728 HydrophobicContact CZ2-CB 4.28Å; P728-H732 VanDerWaalsContact O-CB 3.27Å; P728-H732 WeakPolarHBondContact O-CB 3.47Å; P728-H732 PolarHBondContact O-N 2.92Å; P728-E759 HydrophobicContact CB-CB 4.11Å; P728-E759 HydrophobicContact CG-CB 4.06Å; P728-A760 HydrophobicContact CB-CB 4.01Å
729	A	86.8	Confident	87	Confident	2 Å²	2	30.1 Å²	30.1	2%	0.017	18%	0.176	C	C	.	.	H	α-helix	trans	-65.5	-45.2	177.7	0	0	0	0	0	112.5	S727 H732 R733 R762 D765 V766	S727-A729 PolarHBondContact O-N 3.26Å; S727-A729 PolarHBondContact OG-N 3.35Å; A729-H732 PolarHBondContact O-N 3.48Å; A729-R733 WeakPolarHBondContact O-CB 3.23Å; A729-R733 PolarHBondContact O-N 3.31Å; A729-R762 WeakPolarHBondContact CB-O 3.29Å; A729-D765 HydrophobicContact CB-CB 3.98Å; A729-V766 HydrophobicContact CB-CG2 3.93Å
730	Q	89.4	Confident	86.5	Confident	5 Å²	5	36.2 Å²	36.2	2%	0.023	21%	0.208	C	C	.	.	H	α-helix	trans	-59	-49.5	174.5	-77.2	169	-10.9	0	0	111.5	L653 L726 S727 R733 L734 V766 E768	L653-Q730 HydrophobicContact CD1-CG 4.23Å; L726-Q730 HydrophobicContact CB-CB 4.34Å; S727-Q730 PolarHBondContact O-N 3.1Å; S727-Q730 WeakPolarHBondContact OG-CB 3.33Å; S727-Q730 VanDerWaalsContact OG-CG 3.26Å; S727-Q730 WeakPolarHBondContact OG-CG 3.45Å; S727-Q730 PolarHBondContact OG-N 3.27Å; Q730-R733 PolarHBondContact O-N 3.44Å; Q730-L734 WeakPolarHBondContact O-CB 3.44Å; Q730-L734 WeakPolarHBondContact O-CD1 3.31Å; Q730-L734 WeakPolarHBondContact O-CG 3.34Å; Q730-L734 PolarHBondContact O-N 3.1Å; Q730-V766 WeakPolarHBondContact CG-O 3.28Å; Q730-V766 PolarHBondContact NE2-O 3.48Å; Q730-E768 PolarHBondContact NE2-OE2 3.45Å
731	L	89.4	Confident	86	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.9	-47.2	179.6	179.4	62.2	0	0	0	111.6	L703 W716 L719 R720 S727 L734 L735	L703-L731 HydrophobicContact CD1-CD1 3.5Å; W716-L731 HydrophobicContact CE3-CD2 4.36Å; W716-L731 HydrophobicContact CH2-CB 4.28Å; W716-L731 HydrophobicContact CH2-CD2 4.01Å; W716-L731 HydrophobicContact CH2-CG 4.17Å; W716-L731 HydrophobicContact CZ2-CD2 4.47Å; W716-L731 HydrophobicContact CZ3-CD2 3.95Å; W716-L731 HydrophobicContact CZ3-CG 3.98Å; L719-L731 HydrophobicContact CB-CD2 4.16Å; R720-L731 HydrophobicContact CG-CD2 4.01Å; S727-L731 WeakPolarHBondContact O-CB 3.22Å; S727-L731 PolarHBondContact O-N 3.36Å; L731-L734 PolarHBondContact O-N 3.41Å; L731-L735 HydrophobicContact CD1-CD1 3.96Å; L731-L735 HydrophobicContact CD1-CG 4.27Å; L731-L735 HydrophobicContact CG-CD1 3.93Å; L731-L735 VanDerWaalsContact O-CG 3.28Å; L731-L735 WeakPolarHBondContact O-CG 3.43Å; L731-L735 PolarHBondContact O-N 3.05Å
732	H	87.7	Confident	85.4	Confident	39 Å²	39	31.8 Å²	31.8	18%	0.181	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-48.8	178.8	-179.3	-121.6	0	0	0	111.4	W716 P728 A729 L734 L735 T736 A760 F761	W716-H732 HydrophobicContact CH2-CB 3.92Å; W716-H732 HydrophobicContact CZ3-CB 4.06Å; P728-H732 VanDerWaalsContact O-CB 3.27Å; P728-H732 WeakPolarHBondContact O-CB 3.47Å; P728-H732 PolarHBondContact O-N 2.92Å; A729-H732 PolarHBondContact O-N 3.48Å; H732-L734 VanDerWaalsContact C-N 3.34Å; H732-L734 PolarHBondContact O-N 3.34Å; H732-L735 PolarHBondContact O-N 2.88Å; H732-T736 PolarHBondContact O-N 3.24Å; H732-T736 PolarHBondContact O-OG1 3.35Å; H732-A760 HydrophobicContact CB-CB 4.17Å; H732-A760 PolarHBondContact ND1-O 2.91Å; H732-F761 AromaticContact CE1-CD1 3.87Å; H732-F761 AromaticContact CE1-CE1 3.33Å; H732-F761 WeakPolarHBondContact CE1-CE1 3.38Å; H732-F761 AromaticContact CE1-CZ 3.93Å
733	R	86.3	Confident	84.9	Confident	98 Å²	98	33.7 Å²	33.7	37%	0.37	20%	0.2	S	C	.	.	H	α-helix	trans	-54.4	-46.5	175.7	-179.1	66.9	165.2	-178.5	-1.6	112.5	L653 A729 Q730 T736 H737 V766	L653-R733 HydrophobicContact CD2-CG 4.42Å; A729-R733 WeakPolarHBondContact O-CB 3.23Å; A729-R733 PolarHBondContact O-N 3.31Å; Q730-R733 PolarHBondContact O-N 3.44Å; R733-T736 PolarHBondContact O-N 3.09Å; R733-H737 VanDerWaalsContact CZ-NE2 3.35Å; R733-H737 PolarHBondContact NE-NE2 2.9Å; R733-H737 PolarHBondContact NH2-NE2 3.38Å; R733-H737 VanDerWaalsContact NH2-NE2 3.17Å; R733-H737 WeakPolarHBondContact O-CB 3.48Å; R733-H737 PolarHBondContact O-N 3.21Å; R733-V766 HydrophobicContact CB-CG1 4.25Å; R733-V766 HydrophobicContact CG-CG1 3.88Å
734	L	87.5	Confident	84.2	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-62.5	-44.2	178.5	-73	167.4	0	0	0	112	L652 L653 F662 T700 L726 Q730 L731 H732 H737 Y738	L652-L734 HydrophobicContact CD2-CD2 3.63Å; L653-L734 HydrophobicContact CD2-CD1 4.34Å; L653-L734 HydrophobicContact CD2-CD2 3.69Å; L653-L734 HydrophobicContact CD2-CG 3.75Å; F662-L734 HydrophobicContact CE1-CD2 3.84Å; F662-L734 HydrophobicContact CZ-CD2 3.7Å; T700-L734 HydrophobicContact CG2-CD1 3.68Å; T700-L734 HydrophobicContact CG2-CD2 3.64Å; T700-L734 HydrophobicContact CG2-CG 4.33Å; L726-L734 HydrophobicContact CD1-CD1 3.89Å; Q730-L734 WeakPolarHBondContact O-CB 3.44Å; Q730-L734 WeakPolarHBondContact O-CD1 3.31Å; Q730-L734 WeakPolarHBondContact O-CG 3.34Å; Q730-L734 PolarHBondContact O-N 3.1Å; L731-L734 PolarHBondContact O-N 3.41Å; H732-L734 VanDerWaalsContact C-N 3.34Å; H732-L734 PolarHBondContact O-N 3.34Å; L734-H737 PolarHBondContact O-N 3.07Å; L734-Y738 WeakPolarHBondContact O-CB 3.39Å; L734-Y738 PolarHBondContact O-N 2.95Å
735	L	87	Confident	83.5	Confident	2 Å²	2	32.2 Å²	32.2	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-66.7	-41.1	178.7	-68	168.5	0	0	0	111.7	L703 L711 W716 L719 L731 H732 Y738 Q739 W750	L703-L735 HydrophobicContact CD2-CD2 4.45Å; L711-L735 HydrophobicContact CD2-CD2 4.45Å; W716-L735 HydrophobicContact CE3-CD1 4.35Å; W716-L735 HydrophobicContact CZ3-CD1 4.15Å; L719-L735 HydrophobicContact CD1-CD1 3.9Å; L719-L735 HydrophobicContact CD1-CD2 4.3Å; L731-L735 HydrophobicContact CD1-CD1 3.96Å; L731-L735 HydrophobicContact CD1-CG 4.27Å; L731-L735 HydrophobicContact CG-CD1 3.93Å; L731-L735 VanDerWaalsContact O-CG 3.28Å; L731-L735 WeakPolarHBondContact O-CG 3.43Å; L731-L735 PolarHBondContact O-N 3.05Å; H732-L735 PolarHBondContact O-N 2.88Å; L735-Y738 PolarHBondContact O-N 3Å; L735-Q739 WeakPolarHBondContact O-CG 3.35Å; L735-Q739 PolarHBondContact O-N 3.43Å; L735-W750 HydrophobicContact CB-CE3 4Å; L735-W750 HydrophobicContact CD1-CB 4.34Å; L735-W750 HydrophobicContact CD2-CD2 4.11Å; L735-W750 HydrophobicContact CD2-CE3 3.84Å; L735-W750 HydrophobicContact CD2-CZ3 4.09Å; L735-W750 HydrophobicContact CG-CE3 4.39Å
736	T	85.4	Confident	82.8	Confident	49 Å²	49	36.9 Å²	36.9	30%	0.301	23%	0.227	S	C	.	.	H	α-helix	trans	-60.2	-47.5	173.1	-47.6	0	0	0	0	111.5	H732 R733 Y738 Q739 L740	H732-T736 PolarHBondContact O-N 3.24Å; H732-T736 PolarHBondContact O-OG1 3.35Å; R733-T736 PolarHBondContact O-N 3.09Å; T736-Y738 VanDerWaalsContact C-N 3.31Å; T736-Y738 PolarHBondContact O-N 3.47Å; T736-Q739 PolarHBondContact O-N 2.8Å; T736-L740 HydrophobicContact CG2-CD1 4.28Å; T736-L740 WeakPolarHBondContact O-CG 3.4Å; T736-L740 PolarHBondContact O-N 2.92Å; T736-L740 VanDerWaalsContact O-N 3.11Å
737	H	83.2	Confident	82.5	Confident	12 Å²	12	37.5 Å²	37.5	6%	0.056	23%	0.231	C	C	.	.	H	α-helix	trans	-62.9	-37.2	177	-77.9	-167.9	0	0	0	112.2	L653 F662 R733 L734 A741	L653-H737 PolarHBondContact O-NE2 3.46Å; F662-H737 HydrophobicContact CD1-CB 3.69Å; F662-H737 HydrophobicContact CE1-CB 3.41Å; F662-H737 VanDerWaalsContact CE1-CB 3.41Å; F662-H737 AromaticContact CE1-CE1 3.91Å; F662-H737 AromaticContact CE2-CE1 3.86Å; F662-H737 HydrophobicContact CG-CB 4.42Å; F662-H737 HydrophobicContact CZ-CB 3.98Å; F662-H737 AromaticContact CZ-CE1 3.39Å; F662-H737 WeakPolarHBondContact CZ-CE1 3.38Å; R733-H737 VanDerWaalsContact CZ-NE2 3.35Å; R733-H737 PolarHBondContact NE-NE2 2.9Å; R733-H737 PolarHBondContact NH2-NE2 3.38Å; R733-H737 VanDerWaalsContact NH2-NE2 3.17Å; R733-H737 WeakPolarHBondContact O-CB 3.48Å; R733-H737 PolarHBondContact O-N 3.21Å; L734-H737 PolarHBondContact O-N 3.07Å; H737-A741 VanDerWaalsContact O-CB 3.27Å; H737-A741 WeakPolarHBondContact O-CB 3.46Å; H737-A741 PolarHBondContact O-N 3.12Å
738	Y	83.3	Confident	81.9	Confident	5 Å²	5	40.3 Å²	40.3	2%	0.02	25%	0.25	C	S	.	.	H	α-helix	trans	-66.5	-41.6	175.2	-171	-87	0	0	0	112.2	L704 L711 L734 L735 T736 A741 S742 W750	L704-Y738 HydrophobicContact CD2-CD2 3.94Å; L711-Y738 HydrophobicContact CD2-CD1 3.92Å; L711-Y738 HydrophobicContact CD2-CE1 3.7Å; L711-Y738 HydrophobicContact CD2-CE2 4.44Å; L711-Y738 HydrophobicContact CD2-CG 4.39Å; L734-Y738 WeakPolarHBondContact O-CB 3.39Å; L734-Y738 PolarHBondContact O-N 2.95Å; L735-Y738 PolarHBondContact O-N 3Å; T736-Y738 VanDerWaalsContact C-N 3.31Å; T736-Y738 PolarHBondContact O-N 3.47Å; Y738-A741 PolarHBondContact O-N 3.45Å; Y738-S742 VanDerWaalsContact O-CB 3.28Å; Y738-S742 WeakPolarHBondContact O-CB 3.23Å; Y738-S742 PolarHBondContact O-N 3.03Å; Y738-S742 PolarHBondContact O-OG 3.34Å; Y738-W750 HydrophobicContact CD1-CH2 4.08Å; Y738-W750 HydrophobicContact CD1-CZ3 4.26Å; Y738-W750 HydrophobicContact CE1-CH2 4.37Å
739	Q	82.7	Confident	81.6	Confident	37 Å²	37	43.2 Å²	43.2	17%	0.173	27%	0.268	C	S	.	.	H	α-helix	trans	-58.3	-50	175.1	-73.1	176.2	-2.3	0	0	111	L735 T736 S742 A743 M744 W750	L735-Q739 WeakPolarHBondContact O-CG 3.35Å; L735-Q739 PolarHBondContact O-N 3.43Å; T736-Q739 PolarHBondContact O-N 2.8Å; Q739-S742 PolarHBondContact O-N 3.47Å; Q739-A743 PolarHBondContact O-N 3.12Å; Q739-M744 HydrophobicContact CB-CB 4.26Å; Q739-M744 HydrophobicContact CG-CB 4.41Å; Q739-M744 PolarHBondContact O-N 3.45Å; Q739-W750 HydrophobicContact CG-CE3 3.93Å; Q739-W750 HydrophobicContact CG-CZ3 3.61Å; Q739-W750 VanDerWaalsContact NE2-CE3 3.3Å
740	L	79.5	Confident	81.5	Confident	128 Å²	128	43.3 Å²	43.3	67%	0.67	27%	0.268	S	S	*	.	H	α-helix	trans	-61	-49.2	178.9	-66.9	169.3	0	0	0	111.9	T736 S742 A743	T736-L740 HydrophobicContact CG2-CD1 4.28Å; T736-L740 WeakPolarHBondContact O-CG 3.4Å; T736-L740 PolarHBondContact O-N 2.92Å; T736-L740 VanDerWaalsContact O-N 3.11Å; L740-S742 VanDerWaalsContact C-N 3.31Å; L740-S742 PolarHBondContact O-N 3.1Å; L740-A743 PolarHBondContact O-N 3.28Å
741	A	77.3	Confident	81	Confident	31 Å²	31	48.9 Å²	48.9	26%	0.256	29%	0.294	S	S	.	.	H	α-helix	trans	-70.5	-21.9	-178	0	0	0	0	0	114.2	F662 H663 H737 Y738	F662-A741 HydrophobicContact CB-CB 3.57Å; H663-A741 PolarHBondContact CE1-O 2.93Å; H663-A741 PolarHBondContact ND1-O 2.9Å; H737-A741 VanDerWaalsContact O-CB 3.27Å; H737-A741 WeakPolarHBondContact O-CB 3.46Å; H737-A741 PolarHBondContact O-N 3.12Å; Y738-A741 PolarHBondContact O-N 3.45Å
742	S	75.3	Confident	80.6	Confident	22 Å²	22	49.9 Å²	49.9	15%	0.154	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	8.1	179.3	65.3	0	0	0	0	114.3	R708 Y738 Q739 L740 M744	R708-S742 PolarHBondContact NH1-O 3.04Å; R708-S742 VanDerWaalsContact NH1-O 3.11Å; Y738-S742 VanDerWaalsContact O-CB 3.28Å; Y738-S742 WeakPolarHBondContact O-CB 3.23Å; Y738-S742 PolarHBondContact O-N 3.03Å; Y738-S742 PolarHBondContact O-OG 3.34Å; Q739-S742 PolarHBondContact O-N 3.47Å; L740-S742 VanDerWaalsContact C-N 3.31Å; L740-S742 PolarHBondContact O-N 3.1Å; S742-M744 PolarHBondContact O-N 2.84Å; S742-M744 WeakPolarHBondContact OG-CG 3.39Å
743	A	75.3	Confident	80.1	Confident	93 Å²	93	49.8 Å²	49.8	77%	0.769	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	50	42.1	-175.6	0	0	0	0	0	112.7	Q739 L740	Q739-A743 PolarHBondContact O-N 3.12Å; L740-A743 PolarHBondContact O-N 3.28Å
744	M	73.9	Confident	79.3	Confident	36 Å²	36	49.8 Å²	49.8	18%	0.177	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-82.7	146.2	176	-77.3	-85.1	-72.8	0	0	111.1	R708 I712 Q739 S742 V747 W750	R708-M744 PolarHBondContact NE-SD 3.01Å; R708-M744 VanDerWaalsContact NE-SD 3.41Å; R708-M744 PolarHBondContact NH2-SD 3Å; I712-M744 HydrophobicContact CD1-CE 3.48Å; I712-M744 VanDerWaalsContact CD1-CE 3.48Å; I712-M744 HydrophobicContact CD1-SD 3.94Å; I712-M744 HydrophobicContact CG1-CE 3.64Å; Q739-M744 HydrophobicContact CB-CB 4.26Å; Q739-M744 HydrophobicContact CG-CB 4.41Å; Q739-M744 PolarHBondContact O-N 3.45Å; S742-M744 PolarHBondContact O-N 2.84Å; S742-M744 WeakPolarHBondContact OG-CG 3.39Å; M744-V747 HydrophobicContact CE-CG2 3.34Å; M744-W750 HydrophobicContact CE-CH2 4.47Å
745	G	72.3	Confident	78.4	Confident	48 Å²	48	58.1 Å²	58.1	50%	0.495	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-68.5	165.1	158.9	0	0	0	0	0	111.3	V747	G745-V747 PolarHBondContact O-N 2.72Å
746	P	73.3	Confident	77.7	Confident	121 Å²	121	60.1 Å²	60.1	79%	0.786	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-59.7	131	179	25.1	-34.1	0	0	0	111.3
747	V	81.1	Confident	77	Confident	18 Å²	18	59.5 Å²	59.5	11%	0.109	38%	0.378	C	S	.	.			trans	-105.3	98.9	-178.9	-176.2	0	0	0	0	109.4	M744 G745 T749 W750	M744-V747 HydrophobicContact CE-CG2 3.34Å; G745-V747 PolarHBondContact O-N 2.72Å; V747-T749 WeakPolarHBondContact CG1-OG1 3.25Å; V747-T749 PolarHBondContact O-N 3.32Å; V747-W750 HydrophobicContact CB-CD2 3.92Å; V747-W750 HydrophobicContact CB-CE3 4.14Å; V747-W750 HydrophobicContact CB-CG 4.13Å; V747-W750 HydrophobicContact CG1-CB 4.48Å; V747-W750 HydrophobicContact CG1-CD2 3.83Å; V747-W750 HydrophobicContact CG1-CG 3.81Å; V747-W750 HydrophobicContact CG1-CZ2 4.47Å; V747-W750 HydrophobicContact CG2-CD2 4.44Å; V747-W750 HydrophobicContact CG2-CE3 4.37Å; V747-W750 HydrophobicContact CG2-CZ3 4.43Å; V747-W750 PolarHBondContact O-N 3.17Å
748	S	76.4	Confident	76.6	Confident	88 Å²	88	62.8 Å²	62.8	62%	0.615	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-64.1	-21.7	-176.9	53.9	0	0	0	0	114.2	W750 E751	S748-W750 PolarHBondContact O-N 3.4Å; S748-E751 PolarHBondContact O-N 3.26Å
749	T	80.6	Confident	76.3	Confident	72 Å²	72	66.6 Å²	66.6	44%	0.442	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-70	-12.1	173.2	54	0	0	0	0	113.6	S715 W716 V747	S715-T749 CarbonylContact C-O 3.57Å; S715-T749 WeakPolarHBondContact CA-O 3.31Å; W716-T749 PolarHBondContact N-O 3.11Å; V747-T749 WeakPolarHBondContact CG1-OG1 3.25Å; V747-T749 PolarHBondContact O-N 3.32Å
750	W	83.9	Confident	75.9	Confident	5 Å²	5	65 Å²	65	2%	0.019	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-101.4	3.1	177.1	-60	-6.4	0	0	0	113.3	L711 I712 M714 W716 L719 L735 Y738 Q739 M744 V747 S748	L711-W750 HydrophobicContact CB-CZ2 4.22Å; L711-W750 HydrophobicContact CD2-CH2 3.65Å; L711-W750 HydrophobicContact CD2-CZ2 3.84Å; L711-W750 HydrophobicContact CD2-CZ3 4.47Å; L711-W750 HydrophobicContact CG-CH2 4.09Å; L711-W750 HydrophobicContact CG-CZ2 3.72Å; L711-W750 PolarHBondContact O-NE1 2.98Å; I712-W750 HydrophobicContact CG1-CZ2 4.03Å; M714-W750 PolarHBondContact O-NE1 3.43Å; W716-W750 VanDerWaalsContact CE3-O 3.29Å; L719-W750 HydrophobicContact CD1-CG 4.18Å; L735-W750 HydrophobicContact CB-CE3 4Å; L735-W750 HydrophobicContact CD1-CB 4.34Å; L735-W750 HydrophobicContact CD2-CD2 4.11Å; L735-W750 HydrophobicContact CD2-CE3 3.84Å; L735-W750 HydrophobicContact CD2-CZ3 4.09Å; L735-W750 HydrophobicContact CG-CE3 4.39Å; Y738-W750 HydrophobicContact CD1-CH2 4.08Å; Y738-W750 HydrophobicContact CD1-CZ3 4.26Å; Y738-W750 HydrophobicContact CE1-CH2 4.37Å; Q739-W750 HydrophobicContact CG-CE3 3.93Å; Q739-W750 HydrophobicContact CG-CZ3 3.61Å; Q739-W750 VanDerWaalsContact NE2-CE3 3.3Å; M744-W750 HydrophobicContact CE-CH2 4.47Å; V747-W750 HydrophobicContact CB-CD2 3.92Å; V747-W750 HydrophobicContact CB-CE3 4.14Å; V747-W750 HydrophobicContact CB-CG 4.13Å; V747-W750 HydrophobicContact CG1-CB 4.48Å; V747-W750 HydrophobicContact CG1-CD2 3.83Å; V747-W750 HydrophobicContact CG1-CG 3.81Å; V747-W750 HydrophobicContact CG1-CZ2 4.47Å; V747-W750 HydrophobicContact CG2-CD2 4.44Å; V747-W750 HydrophobicContact CG2-CE3 4.37Å; V747-W750 HydrophobicContact CG2-CZ3 4.43Å; V747-W750 PolarHBondContact O-N 3.17Å; S748-W750 PolarHBondContact O-N 3.4Å
751	E	80	Confident	76	Confident	122 Å²	122	65.4 Å²	65.4	57%	0.57	41%	0.408	S	S	*	.	S	Bend	trans	-72.6	138.6	176.7	-70.5	178	-177.9	0	0	111.1	W716 S748 G753	W716-E751 WeakPolarHBondContact CB-O 3.39Å; S748-E751 PolarHBondContact O-N 3.26Å; E751-G753 PolarHBondContact O-N 3.22Å
752	P	81.9	Confident	76.1	Confident	20 Å²	20	69.5 Å²	69.5	13%	0.13	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-61.7	132.3	177.6	-23.4	33.8	0	0	0	112.5	W716 D756 A760 F761	W716-P752 HydrophobicContact CD2-CB 4.47Å; W716-P752 HydrophobicContact CE3-CG 4.48Å; W716-P752 HydrophobicContact CH2-CB 4.48Å; W716-P752 HydrophobicContact CH2-CG 4.1Å; W716-P752 HydrophobicContact CZ2-CB 4.09Å; W716-P752 HydrophobicContact CZ2-CG 4.21Å; W716-P752 HydrophobicContact CZ3-CG 4.24Å; P752-D756 HydrophobicContact CB-CB 4.42Å; P752-A760 HydrophobicContact CB-CB 3.71Å; P752-A760 HydrophobicContact CG-CB 3.44Å; P752-A760 VanDerWaalsContact CG-CB 3.44Å; P752-F761 HydrophobicContact CG-CE2 4.49Å
753	G	76.2	Confident	75.9	Confident	37 Å²	37	73.6 Å²	73.6	38%	0.381	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-62.3	158.6	172.7	0	0	0	0	0	112.2	E751 Q755 D756 S757	E751-G753 PolarHBondContact O-N 3.22Å; G753-Q755 PolarHBondContact O-N 3.05Å; G753-D756 PolarHBondContact O-N 3.32Å; G753-S757 PolarHBondContact O-N 3.41Å
754	A	68.8	Low	75.8	Confident	98 Å²	98	77.9 Å²	77.9	81%	0.81	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-14.2	-173.7	0	0	0	0	0	115.9
755	Q	69.3	Low	76	Confident	176 Å²	176	79.6 Å²	79.6	82%	0.822	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-35.8	172.4	-68.2	176.4	-18.4	0	0	112.5	G753	G753-Q755 PolarHBondContact O-N 3.05Å
756	D	72.7	Confident	76.4	Confident	44 Å²	44	78.3 Å²	78.3	24%	0.235	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-21.7	-176.3	-72.8	7	0	0	0	112.6	W716 R720 P752 G753 P758 E759 A760	W716-D756 HydrophobicContact CZ2-CB 4.31Å; W716-D756 PolarHBondContact NE1-OD2 2.67Å; R720-D756 IonicContact NE-OD2 3.2Å; P752-D756 HydrophobicContact CB-CB 4.42Å; G753-D756 PolarHBondContact O-N 3.32Å; D756-P758 VanDerWaalsContact C-CD 3.49Å; D756-E759 PolarHBondContact O-N 3.48Å; D756-A760 WeakPolarHBondContact O-CB 3.47Å; D756-A760 PolarHBondContact O-N 2.86Å
757	S	70	Confident	77	Confident	37 Å²	37	75.9 Å²	75.9	26%	0.259	42%	0.422	S	S	.	.	H	α-helix	trans	-55.7	-41.8	-176.5	70.1	0	0	0	0	115.4	G753 E759 A760 F761	G753-S757 PolarHBondContact O-N 3.41Å; S757-E759 PolarHBondContact O-N 3.03Å; S757-E759 VanDerWaalsContact O-N 3.1Å; S757-A760 PolarHBondContact O-N 3.26Å; S757-F761 VanDerWaalsContact O-CD2 3.24Å; S757-F761 WeakPolarHBondContact O-CD2 3.2Å; S757-F761 PolarHBondContact O-N 2.89Å
758	P	76.1	Confident	77.2	Confident	80 Å²	80	77.1 Å²	77.1	52%	0.519	43%	0.427	S	S	.	.	H	α-helix	trans	-70.2	-4.7	177.5	31.3	-37.9	0	0	0	114.1	D756 R762	D756-P758 VanDerWaalsContact C-CD 3.49Å; P758-R762 WeakPolarHBondContact O-CG 3.41Å; P758-R762 PolarHBondContact O-NE 2.81Å
759	E	75.4	Confident	77.6	Confident	86 Å²	86	75.4 Å²	75.4	40%	0.402	42%	0.415	S	S	.	.	H	α-helix	trans	-105	-40.2	170.4	-59.2	-169.7	164.6	0	0	111.3	P728 D756 S757 F761 R762	P728-E759 HydrophobicContact CB-CB 4.11Å; P728-E759 HydrophobicContact CG-CB 4.06Å; D756-E759 PolarHBondContact O-N 3.48Å; S757-E759 PolarHBondContact O-N 3.03Å; S757-E759 VanDerWaalsContact O-N 3.1Å; E759-F761 PolarHBondContact O-N 2.87Å; E759-R762 WeakPolarHBondContact O-CB 3.43Å; E759-R762 PolarHBondContact O-N 2.81Å; E759-R762 VanDerWaalsContact O-N 3.13Å
760	A	75.9	Confident	77.8	Confident	3 Å²	3	76 Å²	76	3%	0.025	41%	0.409	C	S	.	.	H	α-helix	trans	-66.3	-18.4	-178.6	0	0	0	0	0	115	W716 P728 H732 P752 D756 S757	W716-A760 HydrophobicContact CH2-CB 4.23Å; W716-A760 HydrophobicContact CZ2-CB 4.27Å; P728-A760 HydrophobicContact CB-CB 4.01Å; H732-A760 HydrophobicContact CB-CB 4.17Å; H732-A760 PolarHBondContact ND1-O 2.91Å; P752-A760 HydrophobicContact CB-CB 3.71Å; P752-A760 HydrophobicContact CG-CB 3.44Å; P752-A760 VanDerWaalsContact CG-CB 3.44Å; D756-A760 WeakPolarHBondContact O-CB 3.47Å; D756-A760 PolarHBondContact O-N 2.86Å; S757-A760 PolarHBondContact O-N 3.26Å
761	F	79.8	Confident	77.2	Confident	136 Å²	136	83.4 Å²	83.4	60%	0.596	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	6.5	175.1	-68.1	-69.9	0	0	0	114.3	H732 P752 S757 E759 S763	H732-F761 AromaticContact CE1-CD1 3.87Å; H732-F761 AromaticContact CE1-CE1 3.33Å; H732-F761 WeakPolarHBondContact CE1-CE1 3.38Å; H732-F761 AromaticContact CE1-CZ 3.93Å; P752-F761 HydrophobicContact CG-CE2 4.49Å; S757-F761 VanDerWaalsContact O-CD2 3.24Å; S757-F761 WeakPolarHBondContact O-CD2 3.2Å; S757-F761 PolarHBondContact O-N 2.89Å; E759-F761 PolarHBondContact O-N 2.87Å; F761-S763 PolarHBondContact O-N 3.14Å
762	R	79.6	Confident	77	Confident	118 Å²	118	83.8 Å²	83.8	45%	0.445	45%	0.45	S	S	.	.			trans	-78.9	107.1	176.5	-67.3	177.9	-173.7	179	6.3	111.1	A729 P758 E759 E764 D765	A729-R762 WeakPolarHBondContact CB-O 3.29Å; P758-R762 WeakPolarHBondContact O-CG 3.41Å; P758-R762 PolarHBondContact O-NE 2.81Å; E759-R762 WeakPolarHBondContact O-CB 3.43Å; E759-R762 PolarHBondContact O-N 2.81Å; E759-R762 VanDerWaalsContact O-N 3.13Å; R762-E764 PolarHBondContact O-N 3.38Å; R762-D765 HydrophobicContact CB-CB 4.11Å; R762-D765 WeakPolarHBondContact CD-OD2 3.48Å; R762-D765 IonicContact NE-OD2 3.02Å; R762-D765 IonicContact NH1-OD2 3.68Å; R762-D765 PolarHBondContact NH1-OD2 2.91Å; R762-D765 PolarHBondContact O-N 3.03Å
763	S	71.5	Confident	77	Confident	107 Å²	107	85.1 Å²	85.1	75%	0.748	46%	0.459	S	S	*	.	S	Bend	trans	-60.1	-27.6	176.2	-56	0	0	0	0	113.7	F761	F761-S763 PolarHBondContact O-N 3.14Å
764	E	73.1	Confident	77.3	Confident	183 Å²	183	84.4 Å²	84.4	86%	0.855	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-39.5	178.4	-67.2	168	-150.6	0	0	111.9	R762 V766	R762-E764 PolarHBondContact O-N 3.38Å; E764-V766 PolarHBondContact O-N 2.58Å
765	D	78.6	Confident	77.8	Confident	73 Å²	73	84.6 Å²	84.6	39%	0.39	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	9.5	-178.2	-68.5	-42.7	0	0	0	113.8	S727 A729 R762	S727-D765 PolarHBondContact OG-O 2.98Å; A729-D765 HydrophobicContact CB-CB 3.98Å; R762-D765 HydrophobicContact CB-CB 4.11Å; R762-D765 WeakPolarHBondContact CD-OD2 3.48Å; R762-D765 IonicContact NE-OD2 3.02Å; R762-D765 IonicContact NH1-OD2 3.68Å; R762-D765 PolarHBondContact NH1-OD2 2.91Å; R762-D765 PolarHBondContact O-N 3.03Å
766	V	79.9	Confident	78.6	Confident	20 Å²	20	78.1 Å²	78.1	12%	0.121	41%	0.411	C	S	.	.	S	Bend	trans	-81.2	-53.6	177.6	176.6	0	0	0	0	111.1	L653 A729 Q730 R733 E764	L653-V766 WeakPolarHBondContact CD1-O 3.22Å; A729-V766 HydrophobicContact CB-CG2 3.93Å; Q730-V766 WeakPolarHBondContact CG-O 3.28Å; Q730-V766 PolarHBondContact NE2-O 3.48Å; R733-V766 HydrophobicContact CB-CG1 4.25Å; R733-V766 HydrophobicContact CG-CG1 3.88Å; E764-V766 PolarHBondContact O-N 2.58Å
767	L	86.4	Confident	79.3	Confident	70 Å²	70	80 Å²	80	37%	0.366	42%	0.424	S	S	.	.	S	Bend	trans	-86.2	143	-176.6	-64.1	-179.7	0	0	0	111.2	N650 L653	N650-L767 HydrophobicContact CB-CD2 4.14Å; L653-L767 HydrophobicContact CB-CD2 3.99Å
768	E	86.1	Confident	80.1	Confident	44 Å²	44	80.8 Å²	80.8	21%	0.206	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-79.5	121.9	179.6	-166	72.9	-161.2	0	0	110	T646 L649 N650 K696 Q730	T646-E768 HydrophobicContact CG2-CB 4.04Å; T646-E768 HydrophobicContact CG2-CG 4.1Å; T646-E768 WeakPolarHBondContact CG2-O 3.13Å; L649-E768 HydrophobicContact CD2-CB 4.02Å; L649-E768 HydrophobicContact CD2-CG 4.26Å; N650-E768 PolarHBondContact ND2-O 3Å; N650-E768 WeakPolarHBondContact OD1-CB 3.18Å; N650-E768 PolarHBondContact OD1-N 3.24Å; K696-E768 VanDerWaalsContact CD-OE2 3.31Å; K696-E768 WeakPolarHBondContact CD-OE2 3.33Å; K696-E768 IonicContact NZ-OE1 3.4Å; K696-E768 PolarHBondContact NZ-OE1 3.49Å; K696-E768 IonicContact NZ-OE2 3.57Å; K696-E768 PolarHBondContact NZ-OE2 3.45Å; Q730-E768 PolarHBondContact NE2-OE2 3.45Å
769	S	84.4	Confident	80.7	Confident	52 Å²	52	77.7 Å²	77.7	36%	0.364	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-74.6	140.4	-176.6	179.1	0	0	0	0	112.7	E771	S769-E771 VanDerWaalsContact C-N 3.3Å; S769-E771 WeakPolarHBondContact OG-CB 3.09Å; S769-E771 VanDerWaalsContact OG-CG 3.27Å; S769-E771 WeakPolarHBondContact OG-CG 3.47Å; S769-E771 PolarHBondContact OG-N 2.94Å; S769-E771 VanDerWaalsContact OG-N 3.13Å; S769-E771 PolarHBondContact OG-OE2 3.29Å
770	Y	83.8	Confident	81	Confident	84 Å²	84	77.8 Å²	77.8	33%	0.329	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-2.8	172.4	-64.2	-85.4	0	0	0	113.5	F643 T646 L647 N772	F643-Y770 HydrophobicContact CD2-CD1 4.47Å; F643-Y770 AromaticContact CD2-CE1 3.95Å; F643-Y770 HydrophobicContact CD2-CE1 3.95Å; F643-Y770 HydrophobicContact CE2-CE1 4.33Å; T646-Y770 HydrophobicContact CG2-CD1 3.69Å; T646-Y770 HydrophobicContact CG2-CD2 4.35Å; T646-Y770 HydrophobicContact CG2-CE1 3.43Å; T646-Y770 VanDerWaalsContact CG2-CE1 3.43Å; T646-Y770 HydrophobicContact CG2-CE2 4.14Å; T646-Y770 HydrophobicContact CG2-CG 4.15Å; L647-Y770 WeakPolarHBondContact CA-OH 3.34Å; Y770-N772 VanDerWaalsContact C-N 3.26Å; Y770-N772 PolarHBondContact O-N 3.5Å
771	E	72.2	Confident	81.3	Confident	162 Å²	162	84.9 Å²	84.9	76%	0.757	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-12.7	-171.5	-67.5	170.2	131.6	0	0	114.9	S769 P773	S769-E771 VanDerWaalsContact C-N 3.3Å; S769-E771 WeakPolarHBondContact OG-CB 3.09Å; S769-E771 VanDerWaalsContact OG-CG 3.27Å; S769-E771 WeakPolarHBondContact OG-CG 3.47Å; S769-E771 PolarHBondContact OG-N 2.94Å; S769-E771 VanDerWaalsContact OG-N 3.13Å; S769-E771 PolarHBondContact OG-OE2 3.29Å; E771-P773 WeakPolarHBondContact O-CD 3.42Å
772	N	76.1	Confident	81.4	Confident	130 Å²	130	81 Å²	81	70%	0.695	45%	0.447	S	S	*	.			trans	-116.7	63.8	179.7	-62.8	-77.9	0	0	0	111.8	Y770	Y770-N772 VanDerWaalsContact C-N 3.26Å; Y770-N772 PolarHBondContact O-N 3.5Å
773	P	80.4	Confident	81.8	Confident	48 Å²	48	77.2 Å²	77.2	31%	0.312	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-68.6	166.4	172.1	33.4	-36.4	0	0	0	111.2	Y639 F642 E771	Y639-P773 HydrophobicContact CD1-CB 4.2Å; Y639-P773 HydrophobicContact CE1-CB 3.56Å; Y639-P773 HydrophobicContact CE1-CG 4.19Å; F642-P773 HydrophobicContact CD1-CB 4.15Å; F642-P773 HydrophobicContact CE1-CB 3.97Å; E771-P773 WeakPolarHBondContact O-CD 3.42Å
774	P	84.4	Confident	82.4	Confident	21 Å²	21	77 Å²	77	14%	0.136	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-55.7	145.4	171.5	-22.5	34.3	0	0	0	111.5	Y639 F642 F693	Y639-P774 HydrophobicContact CD2-CB 4.16Å; Y639-P774 HydrophobicContact CD2-CG 4.25Å; Y639-P774 HydrophobicContact CE2-CB 4.18Å; Y639-P774 WeakPolarHBondContact CE2-O 3.26Å; Y639-P774 PolarHBondContact OH-O 3.03Å; F642-P774 HydrophobicContact CB-CG 4.3Å; F693-P774 HydrophobicContact CE1-CG 3.93Å; F693-P774 HydrophobicContact CE2-CG 4.48Å; F693-P774 HydrophobicContact CZ-CB 4.49Å; F693-P774 HydrophobicContact CZ-CG 3.61Å
775	P	78.9	Confident	82.8	Confident	102 Å²	102	69.1 Å²	69.1	66%	0.662	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-69.8	135.3	173	29.3	-33.5	0	0	0	110.6	V777	P775-V777 HydrophobicContact CB-CG2 4.45Å
776	I	85.9	Confident	82.9	Confident	40 Å²	40	69 Å²	69	21%	0.205	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-75.9	126.1	165.9	-56	170.8	0	0	0	107.6	L564 F567 Y639	L564-I776 HydrophobicContact CD2-CD1 4.35Å; F567-I776 HydrophobicContact CD1-CD1 3.45Å; F567-I776 VanDerWaalsContact CD1-CD1 3.45Å; F567-I776 HydrophobicContact CD1-CG1 4.08Å; F567-I776 HydrophobicContact CE1-CD1 3.62Å; F567-I776 HydrophobicContact CE1-CG1 3.76Å; F567-I776 HydrophobicContact CG-CD1 4.15Å; F567-I776 HydrophobicContact CZ-CD1 4.42Å; F567-I776 HydrophobicContact CZ-CG1 4.16Å; Y639-I776 HydrophobicContact CE2-CD1 4.39Å; Y639-I776 HydrophobicContact CE2-CG1 3.64Å
777	V	87.1	Confident	82.9	Confident	83 Å²	83	68.5 Å²	68.5	50%	0.503	38%	0.381	S	S	.	.			trans	-126.8	118.4	178.5	-177.2	0	0	0	0	108.2	Q635 P775	Q635-V777 PolarHBondContact NE2-O 2.96Å; Q635-V777 PolarHBondContact OE1-O 2.89Å; P775-V777 HydrophobicContact CB-CG2 4.45Å
778	L	87.1	Confident	82.2	Confident	54 Å²	54	69 Å²	69	28%	0.283	38%	0.381	S	S	.	.			trans	-68.2	141.4	177	-63.2	174.1	0	0	0	110.2	L517 E560 V563	L517-L778 HydrophobicContact CD2-CD1 3.87Å; E560-L778 HydrophobicContact CG-CD1 3.95Å; V563-L778 HydrophobicContact CG1-CD2 3.82Å
779	P	88.6	Confident	81.3	Confident	15 Å²	15	68.8 Å²	68.8	10%	0.097	39%	0.387	C	S	.	.			trans	-67.2	152.6	-178.6	26.1	-32.9	0	0	0	112.5	I514 H629 V632 F783	I514-P779 HydrophobicContact CG2-CG 3.89Å; H629-P779 HydrophobicContact CB-CG 4.26Å; H629-P779 WeakPolarHBondContact CE1-CB 3.36Å; H629-P779 VanDerWaalsContact ND1-CB 3.35Å; H629-P779 WeakPolarHBondContact ND1-CB 3.49Å; V632-P779 HydrophobicContact CG2-CG 4.26Å; P779-F783 HydrophobicContact CB-CE2 4.41Å; P779-F783 HydrophobicContact CB-CZ 4.01Å; P779-F783 HydrophobicContact CG-CE1 4.07Å; P779-F783 HydrophobicContact CG-CZ 3.71Å; P779-F783 WeakPolarHBondContact O-CZ 3.37Å
780	S	81.7	Confident	79.9	Confident	89 Å²	89	72.8 Å²	72.8	62%	0.622	40%	0.404	S	S	*	.	S	Bend	trans	-113.6	-18	178.6	58.8	0	0	0	0	114.2	Y518	Y518-S780 VanDerWaalsContact CE2-O 3.32Å; Y518-S780 WeakPolarHBondContact CE2-O 3.26Å
781	E	80.9	Confident	78.7	Confident	151 Å²	151	73.3 Å²	73.3	71%	0.706	42%	0.42	S	S	*	.	S	Bend	trans	-148.7	159.1	-178.1	-61.3	-179.4	-168.4	0	0	108.7	H629	H629-E781 PolarHBondContact CE1-O 3.34Å; H629-E781 PolarHBondContact NE2-O 3.01Å; H629-E781 VanDerWaalsContact NE2-O 3.16Å
782	G	81.9	Confident	78.5	Confident	56 Å²	56	67.7 Å²	67.7	58%	0.577	39%	0.394	S	S	*	.			trans	104.3	4.9	177.8	0	0	0	0	0	116.2
783	F	88.1	Confident	78.6	Confident	38 Å²	38	65.6 Å²	65.6	17%	0.167	38%	0.383	C	S	.	.			trans	-67.3	152.9	179.6	-61.3	-85.8	0	0	0	113.6	I514 Y518 P779	I514-F783 HydrophobicContact CG2-CD1 4.45Å; I514-F783 HydrophobicContact CG2-CE1 3.7Å; Y518-F783 VanDerWaalsContact CB-CZ 3.44Å; Y518-F783 HydrophobicContact CD1-CB 3.87Å; Y518-F783 AromaticContact CD1-CD1 3.88Å; Y518-F783 HydrophobicContact CD1-CD1 3.88Å; Y518-F783 AromaticContact CD1-CD2 3.38Å; Y518-F783 HydrophobicContact CD1-CD2 3.38Å; Y518-F783 HydrophobicContact CD1-CE1 4.24Å; Y518-F783 AromaticContact CD1-CE2 3.81Å; Y518-F783 HydrophobicContact CD1-CE2 3.81Å; Y518-F783 AromaticContact CD1-CG 3.41Å; Y518-F783 HydrophobicContact CD1-CG 3.41Å; Y518-F783 VanDerWaalsContact CD1-CG 3.41Å; Y518-F783 HydrophobicContact CD1-CZ 4.2Å; Y518-F783 AromaticContact CD2-CD2 3.62Å; Y518-F783 HydrophobicContact CD2-CD2 3.62Å; Y518-F783 HydrophobicContact CD2-CE1 4.25Å; Y518-F783 AromaticContact CD2-CE2 3.16Å; Y518-F783 HydrophobicContact CD2-CE2 3.16Å; Y518-F783 HydrophobicContact CD2-CG 4.34Å; Y518-F783 AromaticContact CD2-CZ 3.51Å; Y518-F783 HydrophobicContact CD2-CZ 3.51Å; Y518-F783 HydrophobicContact CE1-CB 4Å; Y518-F783 AromaticContact CE1-CD2 3.42Å; Y518-F783 HydrophobicContact CE1-CD2 3.42Å; Y518-F783 VanDerWaalsContact CE1-CD2 3.42Å; Y518-F783 HydrophobicContact CE1-CE2 4.05Å; Y518-F783 AromaticContact CE1-CG 3.78Å; Y518-F783 HydrophobicContact CE1-CG 3.78Å; Y518-F783 AromaticContact CE2-CD2 3.64Å; Y518-F783 HydrophobicContact CE2-CD2 3.64Å; Y518-F783 AromaticContact CE2-CE2 3.42Å; Y518-F783 HydrophobicContact CE2-CE2 3.42Å; Y518-F783 VanDerWaalsContact CE2-CE2 3.42Å; Y518-F783 HydrophobicContact CE2-CZ 4.24Å; Y518-F783 AromaticContact CG-CD1 3.85Å; Y518-F783 HydrophobicContact CG-CD1 3.85Å; Y518-F783 AromaticContact CG-CD2 3.46Å; Y518-F783 HydrophobicContact CG-CD2 3.46Å; Y518-F783 VanDerWaalsContact CG-CD2 3.46Å; Y518-F783 AromaticContact CG-CE1 3.72Å; Y518-F783 HydrophobicContact CG-CE1 3.72Å; Y518-F783 AromaticContact CG-CE2 3.34Å; Y518-F783 HydrophobicContact CG-CE2 3.34Å; Y518-F783 AromaticContact CG-CG 3.71Å; Y518-F783 HydrophobicContact CG-CG 3.71Å; Y518-F783 AromaticContact CG-CZ 3.46Å; Y518-F783 HydrophobicContact CG-CZ 3.46Å; Y518-F783 VanDerWaalsContact CG-CZ 3.46Å; Y518-F783 AromaticContact CZ-CD2 3.53Å; Y518-F783 AromaticContact CZ-CE2 3.85Å; P779-F783 HydrophobicContact CB-CE2 4.41Å; P779-F783 HydrophobicContact CB-CZ 4.01Å; P779-F783 HydrophobicContact CG-CE1 4.07Å; P779-F783 HydrophobicContact CG-CZ 3.71Å; P779-F783 WeakPolarHBondContact O-CZ 3.37Å
784	Q	83.9	Confident	78.5	Confident	101 Å²	101	69 Å²	69	47%	0.472	40%	0.398	S	S	.	.			trans	-109.3	-22	-174.5	-71.3	164.1	95.6	0	0	113.4	L434 E515 D786	L434-Q784 HydrophobicContact CD1-CB 3.85Å; L434-Q784 HydrophobicContact CD1-CG 4.48Å; E515-Q784 PolarHBondContact OE1-N 2.87Å; E515-Q784 PolarHBondContact OE2-N 2.95Å; Q784-D786 PolarHBondContact O-N 3.46Å; Q784-D786 VanDerWaalsContact O-N 3.13Å
785	V	83.1	Confident	78.5	Confident	18 Å²	18	69.6 Å²	69.6	11%	0.109	40%	0.404	C	S	.	.			trans	-83.9	86.2	-179.8	180	0	0	0	0	110.7	L434 A437 F438 C441 E515	L434-V785 HydrophobicContact CB-CG2 4.17Å; A437-V785 HydrophobicContact CB-CG2 4.14Å; F438-V785 HydrophobicContact CB-CG1 4.3Å; F438-V785 HydrophobicContact CD2-CG1 4.21Å; C441-V785 HydrophobicContact CB-CG1 4.21Å; E515-V785 HydrophobicContact CB-CB 4.23Å; E515-V785 HydrophobicContact CB-CG2 3.77Å; E515-V785 HydrophobicContact CG-CG2 3.95Å; E515-V785 PolarHBondContact OE2-N 2.91Å
786	D	79.6	Confident	78.8	Confident	70 Å²	70	65.4 Å²	65.4	37%	0.374	38%	0.375	S	S	.	.			trans	-107.8	132.5	163.9	-169.4	15.8	0	0	0	111.6	Q784 E788 A789	Q784-D786 PolarHBondContact O-N 3.46Å; Q784-D786 VanDerWaalsContact O-N 3.13Å; D786-E788 PolarHBondContact OD1-N 3.13Å; D786-A789 HydrophobicContact CB-CB 4.41Å
787	L	80.9	Confident	78.6	Confident	10 Å²	10	65.1 Å²	65.1	5%	0.052	37%	0.372	C	S	.	.	S	Bend	trans	-91.5	-6.8	176.7	-54.2	-175.5	0	0	0	112.4	F438 C441 L442 Q445 F519	F438-L787 HydrophobicContact CD2-CD2 3.73Å; F438-L787 HydrophobicContact CE2-CD2 3.48Å; F438-L787 VanDerWaalsContact CE2-CD2 3.48Å; F438-L787 HydrophobicContact CG-CD2 4.36Å; F438-L787 HydrophobicContact CZ-CD2 3.92Å; C441-L787 HydrophobicContact CB-CD1 3.97Å; C441-L787 HydrophobicContact CB-CD2 4.21Å; C441-L787 HydrophobicContact CB-CG 4.38Å; L442-L787 HydrophobicContact CD2-CD1 4.15Å; L442-L787 HydrophobicContact CD2-CD2 4.05Å; L442-L787 HydrophobicContact CG-CD2 4.01Å; Q445-L787 HydrophobicContact CB-CD1 4.34Å; F519-L787 HydrophobicContact CE2-CD1 3.41Å; F519-L787 VanDerWaalsContact CE2-CD1 3.41Å; F519-L787 HydrophobicContact CE2-CG 3.77Å; F519-L787 HydrophobicContact CZ-CD1 3.48Å; F519-L787 VanDerWaalsContact CZ-CD1 3.48Å; F519-L787 HydrophobicContact CZ-CG 4.34Å
788	E	70.4	Confident	78.5	Confident	81 Å²	81	67.1 Å²	67.1	38%	0.379	38%	0.376	S	S	.	.	S	Bend	trans	-104.3	3.2	-179.5	-62.4	-79.3	-133.3	0	0	113.1	R402 D786	R402-E788 IonicContact CZ-OE1 2.72Å; R402-E788 IonicContact CZ-OE2 2.82Å; R402-E788 IonicContact NE-OE2 3.93Å; R402-E788 PolarHBondContact NE-OE2 3.32Å; R402-E788 IonicContact NH1-OE1 3.86Å; R402-E788 PolarHBondContact NH1-OE1 2.9Å; R402-E788 IonicContact NH1-OE2 3.71Å; R402-E788 PolarHBondContact NH1-OE2 2.87Å; R402-E788 IonicContact NH2-OE1 3.64Å; R402-E788 PolarHBondContact NH2-OE1 3.25Å; R402-E788 IonicContact NH2-OE2 2.68Å; R402-E788 PolarHBondContact NH2-OE2 3.32Å; D786-E788 PolarHBondContact OD1-N 3.13Å
789	A	68.3	Low	78.4	Confident	40 Å²	40	65.7 Å²	65.7	33%	0.331	37%	0.368	S	S	.	.			trans	-68.8	134.8	179.7	0	0	0	0	0	112.6	D786 C791	D786-A789 HydrophobicContact CB-CB 4.41Å; A789-C791 PolarHBondContact O-N 3.4Å
790	D	54.4	Low	78.3	Confident	135 Å²	135	65 Å²	65	72%	0.722	36%	0.363	S	S	*	.	S	Bend	trans	-69.7	-10.8	179.8	-76.6	-50	0	0	0	114
791	C	58.2	Low	78.3	Confident	96 Å²	96	63.3 Å²	63.3	65%	0.649	35%	0.347	S	S	*	.			trans	-140.2	136.3	177.9	-69.8	0	0	0	0	110.2	A789	A789-C791 PolarHBondContact O-N 3.4Å
792	L	69.6	Low	78.5	Confident	44 Å²	44	60.5 Å²	60.5	23%	0.23	33%	0.33	C	S	.	.			trans	-118.3	157.4	170.5	-63.2	-178.1	0	0	0	109.9	L405 F438	L405-L792 HydrophobicContact CD1-CD1 3.75Å; L405-L792 HydrophobicContact CD1-CD2 4.16Å; L405-L792 HydrophobicContact CD1-CG 4.07Å; L405-L792 HydrophobicContact CD2-CD1 3.49Å; L405-L792 VanDerWaalsContact CD2-CD1 3.49Å; L405-L792 HydrophobicContact CD2-CG 4.43Å; L405-L792 HydrophobicContact CG-CD1 4.25Å; F438-L792 HydrophobicContact CE1-CD1 4.11Å; F438-L792 HydrophobicContact CE2-CD1 4.29Å; F438-L792 HydrophobicContact CE2-CD2 3.62Å; F438-L792 HydrophobicContact CZ-CD1 3.54Å; F438-L792 HydrophobicContact CZ-CD2 3.74Å; F438-L792 HydrophobicContact CZ-CG 4.31Å
793	D	77.9	Confident	78.8	Confident	86 Å²	86	57.9 Å²	57.9	46%	0.46	30%	0.303	S	S	.	.			trans	-63.6	137.6	166.6	-74.1	-48.8	0	0	0	111.8	H432 S795 I796 Y797	H432-D793 IonicContact CD2-OD2 3.48Å; H432-D793 PolarHBondContact CD2-OD2 2.99Å; H432-D793 IonicContact NE2-OD2 2.77Å; D793-S795 PolarHBondContact O-N 2.86Å; D793-S795 VanDerWaalsContact O-N 3.14Å; D793-I796 HydrophobicContact CB-CD1 4.14Å; D793-I796 HydrophobicContact CB-CG1 4.27Å; D793-I796 PolarHBondContact O-N 2.85Å; D793-I796 VanDerWaalsContact O-N 3.09Å; D793-Y797 PolarHBondContact O-N 2.86Å
794	D	78.4	Confident	78.6	Confident	118 Å²	118	59.8 Å²	59.8	63%	0.631	31%	0.309	S	S	*	.	H	α-helix	trans	-54.9	-33.7	178.7	-79	-46.1	0	0	0	112.6	Y797 Q798	D794-Y797 PolarHBondContact O-N 2.82Å; D794-Q798 WeakPolarHBondContact O-CB 3.27Å; D794-Q798 WeakPolarHBondContact O-CG 3.47Å; D794-Q798 PolarHBondContact O-N 3.13Å
795	S	83.9	Confident	78.5	Confident	35 Å²	35	60.8 Å²	60.8	25%	0.245	31%	0.314	C	S	.	.	H	α-helix	trans	-69.5	-42	178.6	54.8	0	0	0	0	112.4	H432 D793 Y797 Q798 H799	H432-S795 WeakPolarHBondContact CB-OG 3.22Å; D793-S795 PolarHBondContact O-N 2.86Å; D793-S795 VanDerWaalsContact O-N 3.14Å; S795-Y797 VanDerWaalsContact C-N 3.32Å; S795-Q798 PolarHBondContact O-N 3.25Å; S795-H799 PolarHBondContact O-N 2.88Å; S795-H799 VanDerWaalsContact O-N 3.15Å; S795-H799 PolarHBondContact O-ND1 3.47Å
796	I	84.9	Confident	78.6	Confident	13 Å²	13	62.2 Å²	62.2	7%	0.067	32%	0.318	C	S	.	.	H	α-helix	trans	-62.9	-43.3	172.8	-61.8	169.4	0	0	0	109.4	H432 F438 D793 H799 L800	H432-I796 HydrophobicContact CB-CG1 4.06Å; F438-I796 HydrophobicContact CB-CG2 4.33Å; F438-I796 HydrophobicContact CD1-CG2 3.33Å; F438-I796 HydrophobicContact CD2-CG2 4.34Å; F438-I796 HydrophobicContact CE1-CG2 3.61Å; F438-I796 HydrophobicContact CG-CG2 3.75Å; F438-I796 HydrophobicContact CZ-CG2 4.26Å; D793-I796 HydrophobicContact CB-CD1 4.14Å; D793-I796 HydrophobicContact CB-CG1 4.27Å; D793-I796 PolarHBondContact O-N 2.85Å; D793-I796 VanDerWaalsContact O-N 3.09Å; I796-H799 PolarHBondContact O-N 2.86Å; I796-L800 PolarHBondContact O-N 2.92Å
797	Y	82.3	Confident	78.9	Confident	35 Å²	35	59 Å²	59	14%	0.137	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-42.1	179.6	-172.3	-102.3	0	0	0	112.8	D793 D794 S795 H799 L800 L801	D793-Y797 PolarHBondContact O-N 2.86Å; D794-Y797 PolarHBondContact O-N 2.82Å; S795-Y797 VanDerWaalsContact C-N 3.32Å; Y797-H799 VanDerWaalsContact C-N 3.33Å; Y797-H799 PolarHBondContact O-N 2.87Å; Y797-L800 PolarHBondContact O-N 3.28Å; Y797-L801 HydrophobicContact CD1-CD1 3.96Å; Y797-L801 HydrophobicContact CD1-CG 4.28Å; Y797-L801 HydrophobicContact CE1-CD1 3.56Å; Y797-L801 HydrophobicContact CE1-CD2 4.37Å; Y797-L801 HydrophobicContact CE1-CG 3.96Å; Y797-L801 WeakPolarHBondContact O-CG 3.47Å; Y797-L801 PolarHBondContact O-N 3Å
798	Q	83.9	Confident	78.8	Confident	124 Å²	124	64.5 Å²	64.5	58%	0.579	32%	0.321	S	S	*	.	H	α-helix	trans	-59.4	-42	173.6	-75.9	169.5	35.7	0	0	111.9	D794 S795 L801 Y802	D794-Q798 WeakPolarHBondContact O-CB 3.27Å; D794-Q798 WeakPolarHBondContact O-CG 3.47Å; D794-Q798 PolarHBondContact O-N 3.13Å; S795-Q798 PolarHBondContact O-N 3.25Å; Q798-L801 PolarHBondContact O-N 3.23Å; Q798-Y802 PolarHBondContact O-N 2.81Å
799	H	85.2	Confident	79.2	Confident	25 Å²	25	61.6 Å²	61.6	12%	0.116	31%	0.313	C	S	.	.	H	α-helix	trans	-67.6	-37.3	176	-76	95.2	0	0	0	113	L424 I425 D431 T435 S795 I796 Y797 Y802 I803	L424-H799 HydrophobicContact CD2-CB 4.09Å; I425-H799 WeakPolarHBondContact CD1-NE2 3.37Å; D431-H799 IonicContact OD1-CE1 3.23Å; D431-H799 PolarHBondContact OD1-CE1 2.99Å; D431-H799 VanDerWaalsContact OD1-CE1 3.31Å; T435-H799 HydrophobicContact CG2-CB 3.59Å; S795-H799 PolarHBondContact O-N 2.88Å; S795-H799 VanDerWaalsContact O-N 3.15Å; S795-H799 PolarHBondContact O-ND1 3.47Å; I796-H799 PolarHBondContact O-N 2.86Å; Y797-H799 VanDerWaalsContact C-N 3.33Å; Y797-H799 PolarHBondContact O-N 2.87Å; H799-Y802 PolarHBondContact O-N 3.3Å; H799-I803 WeakPolarHBondContact O-CG1 3.4Å; H799-I803 PolarHBondContact O-N 2.9Å
800	L	85.9	Confident	79.8	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-42.2	171.5	177.4	59.2	0	0	0	111.9	L405 L407 L439 L442 I796 Y797 I803 R804	L405-L800 HydrophobicContact CD2-CD2 4.35Å; L407-L800 HydrophobicContact CD1-CD1 4.31Å; L439-L800 HydrophobicContact CD2-CB 4.18Å; L439-L800 HydrophobicContact CD2-CD1 3.99Å; L442-L800 HydrophobicContact CD1-CD1 3.74Å; L442-L800 HydrophobicContact CD1-CD2 4.12Å; I796-L800 PolarHBondContact O-N 2.92Å; Y797-L800 PolarHBondContact O-N 3.28Å; L800-I803 PolarHBondContact O-N 3.43Å; L800-R804 HydrophobicContact CD1-CG 4.41Å; L800-R804 WeakPolarHBondContact O-CB 3.35Å; L800-R804 VanDerWaalsContact O-CG 3.3Å; L800-R804 WeakPolarHBondContact O-CG 3.27Å; L800-R804 PolarHBondContact O-N 2.92Å
801	L	81.6	Confident	80.9	Confident	53 Å²	53	59.3 Å²	59.3	28%	0.277	29%	0.289	S	S	.	.	H	α-helix	trans	-63.8	-41.9	173.8	-70.3	-178.9	0	0	0	112.1	Y797 Q798 R804 H805	Y797-L801 HydrophobicContact CD1-CD1 3.96Å; Y797-L801 HydrophobicContact CD1-CG 4.28Å; Y797-L801 HydrophobicContact CE1-CD1 3.56Å; Y797-L801 HydrophobicContact CE1-CD2 4.37Å; Y797-L801 HydrophobicContact CE1-CG 3.96Å; Y797-L801 WeakPolarHBondContact O-CG 3.47Å; Y797-L801 PolarHBondContact O-N 3Å; Q798-L801 PolarHBondContact O-N 3.23Å; L801-R804 PolarHBondContact O-N 3.06Å; L801-H805 PolarHBondContact O-N 3.12Å
802	Y	86.3	Confident	81.2	Confident	93 Å²	93	58 Å²	58	37%	0.365	28%	0.281	S	S	.	.	H	α-helix	trans	-58.8	-47.9	175.1	171.6	-92.1	0	0	0	111.8	R420 L424 Q798 H799 H805 F806	R420-Y802 HydrophobicContact CG-CE1 4.48Å; R420-Y802 PolarHBondContact NE-OH 3.31Å; R420-Y802 VanDerWaalsContact NE-OH 3.08Å; R420-Y802 PolarHBondContact NH2-OH 3.33Å; L424-Y802 HydrophobicContact CD1-CD1 3.62Å; L424-Y802 HydrophobicContact CD1-CE1 3.58Å; Q798-Y802 PolarHBondContact O-N 2.81Å; H799-Y802 PolarHBondContact O-N 3.3Å; Y802-H805 PolarHBondContact O-N 3.09Å; Y802-F806 WeakPolarHBondContact O-CB 3.34Å; Y802-F806 PolarHBondContact O-N 3.17Å
803	I	88.5	Confident	80.6	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-66.3	-39.9	179.4	-68.4	-65	0	0	0	111.6	L407 L417 R420 I421 L424 L439 H799 L800 H805 F806 L807	L407-I803 HydrophobicContact CD1-CG2 3.93Å; L407-I803 HydrophobicContact CD2-CG2 4.29Å; L417-I803 HydrophobicContact CD1-CG2 3.44Å; L417-I803 VanDerWaalsContact CD1-CG2 3.44Å; R420-I803 HydrophobicContact CG-CD1 4.06Å; I421-I803 HydrophobicContact CG1-CD1 4.22Å; L424-I803 HydrophobicContact CD1-CD1 4.27Å; L424-I803 HydrophobicContact CD2-CD1 4.09Å; L424-I803 HydrophobicContact CD2-CG1 3.99Å; L439-I803 HydrophobicContact CD1-CG1 4.16Å; H799-I803 WeakPolarHBondContact O-CG1 3.4Å; H799-I803 PolarHBondContact O-N 2.9Å; L800-I803 PolarHBondContact O-N 3.43Å; I803-H805 VanDerWaalsContact C-N 3.33Å; I803-H805 PolarHBondContact O-N 3.16Å; I803-F806 WeakPolarHBondContact O-CB 3.22Å; I803-F806 PolarHBondContact O-N 2.85Å; I803-L807 HydrophobicContact CG2-CD1 4.26Å; I803-L807 WeakPolarHBondContact O-CG 3.39Å; I803-L807 PolarHBondContact O-N 3.1Å
804	R	83.9	Confident	79.1	Confident	78 Å²	78	65.6 Å²	65.6	29%	0.294	31%	0.314	S	S	.	.	H	α-helix	trans	-58.4	-43	172.1	-76.3	169.2	166.9	178.4	-5.8	111.8	Q404 L406 L407 L800 L801 W808	Q404-R804 PolarHBondContact O-NH2 3.33Å; L406-R804 PolarHBondContact O-NE 3.11Å; L406-R804 PolarHBondContact O-NH2 3.49Å; L407-R804 HydrophobicContact CD1-CG 4.22Å; L800-R804 HydrophobicContact CD1-CG 4.41Å; L800-R804 WeakPolarHBondContact O-CB 3.35Å; L800-R804 VanDerWaalsContact O-CG 3.3Å; L800-R804 WeakPolarHBondContact O-CG 3.27Å; L800-R804 PolarHBondContact O-N 2.92Å; L801-R804 PolarHBondContact O-N 3.06Å; R804-W808 PolarHBondContact O-N 3.3Å; R804-W808 VanDerWaalsContact O-N 3.12Å
805	H	80.7	Confident	77	Confident	123 Å²	123	64.4 Å²	64.4	57%	0.569	32%	0.315	S	S	*	.	H	α-helix	trans	-67.5	-39.3	175.5	176.4	-97.5	0	0	0	112.7	L801 Y802 I803 W808 G809	L801-H805 PolarHBondContact O-N 3.12Å; Y802-H805 PolarHBondContact O-N 3.09Å; I803-H805 VanDerWaalsContact C-N 3.33Å; I803-H805 PolarHBondContact O-N 3.16Å; H805-W808 PolarHBondContact O-N 2.98Å; H805-G809 PolarHBondContact O-N 2.87Å
806	F	85.9	Confident	75.2	Confident	48 Å²	48	69.1 Å²	69.1	21%	0.211	35%	0.345	C	S	.	.	H	α-helix	trans	-59.2	-47.6	175	174.7	-108.7	0	0	0	111.9	T416 R420 Y802 I803 W808 G809 L810	T416-F806 HydrophobicContact CG2-CE1 4.08Å; T416-F806 HydrophobicContact CG2-CZ 3.79Å; R420-F806 HydrophobicContact CB-CD1 4.34Å; R420-F806 HydrophobicContact CB-CE1 3.7Å; R420-F806 HydrophobicContact CB-CZ 3.97Å; R420-F806 HydrophobicContact CG-CD1 4.16Å; R420-F806 HydrophobicContact CG-CE1 3.88Å; R420-F806 HydrophobicContact CG-CE2 4.37Å; R420-F806 HydrophobicContact CG-CZ 3.99Å; Y802-F806 WeakPolarHBondContact O-CB 3.34Å; Y802-F806 PolarHBondContact O-N 3.17Å; I803-F806 WeakPolarHBondContact O-CB 3.22Å; I803-F806 PolarHBondContact O-N 2.85Å; F806-W808 PolarHBondContact O-N 3.46Å; F806-G809 WeakPolarHBondContact O-CA 3.08Å; F806-G809 PolarHBondContact O-N 3.49Å; F806-G809 VanDerWaalsContact O-N 3.14Å; F806-L810 HydrophobicContact CD1-CD1 4.31Å; F806-L810 HydrophobicContact CE1-CD1 3.85Å; F806-L810 HydrophobicContact CZ-CD1 4.04Å; F806-L810 PolarHBondContact O-N 2.89Å
807	L	85.1	Confident	72.8	Confident	3 Å²	3	71.5 Å²	71.5	2%	0.016	37%	0.373	C	S	.	.	H	α-helix	trans	-61.6	-40.1	175.5	-72.8	168.1	0	0	0	112.6	L407 F409 L413 L417 I803 G809 L810 R811	L407-L807 HydrophobicContact CD1-CD1 3.69Å; F409-L807 HydrophobicContact CB-CD1 3.99Å; F409-L807 HydrophobicContact CB-CD2 3.93Å; L413-L807 HydrophobicContact CB-CD2 4.3Å; L413-L807 HydrophobicContact CD1-CD2 4.12Å; L417-L807 HydrophobicContact CB-CD2 4.38Å; L417-L807 HydrophobicContact CD1-CD1 4.16Å; L417-L807 HydrophobicContact CD1-CD2 4.22Å; L417-L807 HydrophobicContact CD1-CG 4.28Å; L417-L807 HydrophobicContact CD2-CD1 4.29Å; L417-L807 HydrophobicContact CD2-CD2 4.3Å; I803-L807 HydrophobicContact CG2-CD1 4.26Å; I803-L807 WeakPolarHBondContact O-CG 3.39Å; I803-L807 PolarHBondContact O-N 3.1Å; L807-G809 VanDerWaalsContact C-N 3.34Å; L807-L810 PolarHBondContact O-N 3.29Å; L807-R811 WeakPolarHBondContact O-CG 3.34Å; L807-R811 PolarHBondContact O-N 3.41Å
808	W	79.6	Confident	70.2	Confident	124 Å²	124	75.4 Å²	75.4	47%	0.47	41%	0.405	S	S	.	.	H	α-helix	trans	-61.8	-41.8	172.7	-178.2	91.7	0	0	0	111.9	R804 H805 F806 L810 R811 S812	R804-W808 PolarHBondContact O-N 3.3Å; R804-W808 VanDerWaalsContact O-N 3.12Å; H805-W808 PolarHBondContact O-N 2.98Å; F806-W808 PolarHBondContact O-N 3.46Å; W808-L810 PolarHBondContact O-N 2.64Å; W808-R811 PolarHBondContact O-N 2.92Å; W808-S812 WeakPolarHBondContact O-CB 3.33Å; W808-S812 PolarHBondContact O-N 3.29Å
809	G	77.8	Confident	68.1	Low	20 Å²	20	76.2 Å²	76.2	21%	0.206	42%	0.421	C	S	.	.	H	α-helix	trans	-58.4	-44.7	174.9	0	0	0	0	0	113	H805 F806 L807 S812 R813	H805-G809 PolarHBondContact O-N 2.87Å; F806-G809 WeakPolarHBondContact O-CA 3.08Å; F806-G809 PolarHBondContact O-N 3.49Å; F806-G809 VanDerWaalsContact O-N 3.14Å; L807-G809 VanDerWaalsContact C-N 3.34Å; G809-S812 PolarHBondContact O-N 3.47Å; G809-S812 PolarHBondContact O-OG 3.46Å; G809-R813 PolarHBondContact O-N 3.42Å
810	L	81.4	Confident	65.5	Low	42 Å²	42	78.4 Å²	78.4	22%	0.22	45%	0.451	C	S	.	.	H	α-helix	trans	-62.4	-50.2	175	-64.3	175.6	0	0	0	111.6	L413 T416 F806 L807 W808 S812 R813 A814	L413-L810 HydrophobicContact CD2-CB 4.18Å; L413-L810 HydrophobicContact CD2-CD1 4.25Å; T416-L810 HydrophobicContact CG2-CD1 3.71Å; T416-L810 HydrophobicContact CG2-CD2 4.48Å; F806-L810 HydrophobicContact CD1-CD1 4.31Å; F806-L810 HydrophobicContact CE1-CD1 3.85Å; F806-L810 HydrophobicContact CZ-CD1 4.04Å; F806-L810 PolarHBondContact O-N 2.89Å; L807-L810 PolarHBondContact O-N 3.29Å; W808-L810 PolarHBondContact O-N 2.64Å; L810-S812 VanDerWaalsContact C-N 3.26Å; L810-S812 PolarHBondContact O-N 3.26Å; L810-R813 PolarHBondContact O-N 2.93Å; L810-A814 PolarHBondContact O-N 3.04Å
811	R	77.3	Confident	62.8	Low	86 Å²	86	84.4 Å²	84.4	33%	0.325	49%	0.493	S	S	.	.	H	α-helix	trans	-55.4	-39.6	176	-75.1	171.6	163.2	152.7	1.2	112.6	E408 E410 L413 L807 W808 R813 A814	E408-R811 PolarHBondContact O-NH1 2.92Å; E408-R811 PolarHBondContact O-NH2 3.2Å; E410-R811 IonicContact OE2-CZ 2.91Å; E410-R811 IonicContact OE2-NE 2.82Å; E410-R811 PolarHBondContact OE2-NE 2.53Å; E410-R811 IonicContact OE2-NH2 3.46Å; E410-R811 PolarHBondContact OE2-NH2 3.28Å; L413-R811 HydrophobicContact CD1-CG 4.2Å; L807-R811 WeakPolarHBondContact O-CG 3.34Å; L807-R811 PolarHBondContact O-N 3.41Å; W808-R811 PolarHBondContact O-N 2.92Å; R811-R813 VanDerWaalsContact C-N 3.3Å; R811-R813 PolarHBondContact O-N 3.18Å; R811-A814 PolarHBondContact O-N 3.4Å
812	S	64.8	Low	60.2	Low	69 Å²	69	85.5 Å²	85.5	48%	0.483	52%	0.517	S	S	.	.	H	α-helix	trans	-65.7	-29.2	178.9	79.4	0	0	0	0	113.7	W808 G809 L810	W808-S812 WeakPolarHBondContact O-CB 3.33Å; W808-S812 PolarHBondContact O-N 3.29Å; G809-S812 PolarHBondContact O-N 3.47Å; G809-S812 PolarHBondContact O-OG 3.46Å; L810-S812 VanDerWaalsContact C-N 3.26Å; L810-S812 PolarHBondContact O-N 3.26Å
813	R	57.9	Low	57.6	Low	221 Å²	221	85.6 Å²	85.6	83%	0.834	54%	0.537	S	S	*	.	H	α-helix	trans	-84.3	-20.6	177.2	-69.4	178.6	175.2	-172.5	-1.5	113.3	G809 L810 R811	G809-R813 PolarHBondContact O-N 3.42Å; L810-R813 PolarHBondContact O-N 2.93Å; R811-R813 VanDerWaalsContact C-N 3.3Å; R811-R813 PolarHBondContact O-N 3.18Å
814	A	46.7	Very low	55.1	Low	67 Å²	67	91.6 Å²	91.6	55%	0.554	58%	0.576	S	S	*	*	S	Bend	trans	-87.6	4.5	-174.2	0	0	0	0	0	114.9	L810 R811 P816	L810-A814 PolarHBondContact O-N 3.04Å; R811-A814 PolarHBondContact O-N 3.4Å; A814-P816 VanDerWaalsContact O-CD 3.27Å; A814-P816 WeakPolarHBondContact O-CD 3.43Å
815	S	32.8	Very low	52.5	Low	93 Å²	93	96.5 Å²	96.5	65%	0.65	60%	0.602	S	S	*	*			trans	-99	107.7	-174.7	-163.9	0	0	0	0	113	G817	S815-G817 PolarHBondContact O-N 3.35Å
816	P	45.8	Very low	50.1	Low	134 Å²	134	96.6 Å²	96.6	87%	0.87	61%	0.614	S	S	*	*			trans	-80.9	99.2	177.3	31.7	-33.2	0	0	0	110.5	A814	A814-P816 VanDerWaalsContact O-CD 3.27Å; A814-P816 WeakPolarHBondContact O-CD 3.43Å
817	G	36.1	Very low	47.1	Very low	63 Å²	63	98.9 Å²	98.9	65%	0.649	64%	0.641	S	S	*	*			trans	-146.6	15	-160.7	0	0	0	0	0	119.6	S815	S815-G817 PolarHBondContact O-N 3.35Å
818	S	27.8	Very low	44.2	Very low	118 Å²	118	104.7 Å²	104.7	83%	0.825	68%	0.681	S	S	*	*			trans	-162.8	129.8	167.2	-83.5	0	0	0	0	113.8
819	P	39.4	Very low	41.9	Very low	140 Å²	140	104.9 Å²	104.9	91%	0.909	70%	0.698	S	S	*	*			trans	-88.3	116.8	169.2	33.2	-29.7	0	0	0	111.1
820	G	29.5	Very low	39.3	Very low	72 Å²	72	113.3 Å²	113.3	74%	0.742	73%	0.732	S	S	*	*			trans	173	97.9	174.1	0	0	0	0	0	116.8
821	S	29.9	Very low	36.6	Very low	126 Å²	126	114.8 Å²	114.8	88%	0.881	76%	0.757	S	S	*	*			trans	63.1	109.4	155.7	-175	0	0	0	0	120.5
822	G	26.6	Very low	34.2	Very low	76 Å²	76	120 Å²	120	78%	0.784	79%	0.788	S	S	*	*			trans	91.1	103	131	0	0	0	0	0	118.1
823	A	32.8	Very low	32.3	Very low	95 Å²	95	125 Å²	125	79%	0.785	80%	0.803	S	S	*	*			trans	-82.2	173.2	163.6	0	0	0	0	0	110.8
824	P	34.8	Very low	30.7	Very low	126 Å²	126	124.2 Å²	124.2	82%	0.818	81%	0.808	S	S	*	*				-132.1	154	65.8	36.8	-23.2	0	0	0	115.3
825	Q	28.8	Very low	29.6	Very low	180 Å²	180	125 Å²	125	84%	0.841	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-86.2	147.9	159.1	-70	179.6	-23.6	0	0	110
826	P	30.3	Very low	29.2	Very low	126 Å²	126	127.9 Å²	127.9	82%	0.818	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-75.6	125.1	160	31.6	-30.6	0	0	0	109.7
827	A	24.1	Very low	28.5	Very low	95 Å²	95	126.8 Å²	126.8	79%	0.785	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-83.8	144.2	174.8	0	0	0	0	0	111.4
828	C	24.2	Very low	27.9	Very low	126 Å²	126	131.4 Å²	131.4	85%	0.851	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-80.5	132.6	166.4	-66.4	0	0	0	0	109.7
829	P	30.1	Very low	27.7	Very low	127 Å²	127	129.5 Å²	129.5	83%	0.825	82%	0.824	S	S	*	*			trans	-96.1	102.7	179.9	34.5	-31.3	0	0	0	113.1
830	E	23.8	Very low	27	Very low	197 Å²	197	132 Å²	132	92%	0.921	82%	0.822	S	S	*	*			trans	-109.8	141.1	145.1	-62.8	179.9	163.1	0	0	106.1
831	G	25.9	Very low	27.3	Very low	73 Å²	73	133.2 Å²	133.2	75%	0.753	82%	0.818	S	S	*	*			cis	164.5	125.8	-4.7	0	0	0	0	0	107.1
832	M	25.2	Very low	27	Very low	196 Å²	196	136 Å²	136	97%	0.966	82%	0.817	S	S	*	*			trans	-150.5	145.9	-174.3	-144.2	165.9	-174.3	0	0	113.5
833	H	24.8	Very low	26.9	Very low	175 Å²	175	136.7 Å²	136.7	81%	0.81	82%	0.815	S	S	*	*			trans	-92.5	144.3	-161.3	-51.5	-98.9	0	0	0	114.3
834	H	25.6	Very low	26.8	Very low	203 Å²	203	138.3 Å²	138.3	94%	0.94	82%	0.817	S	S	*	*			trans	-144.8	157.5	141.3	-88.2	-69	0	0	0	108.7
835	A	22.7	Very low	26.2	Very low	84 Å²	84	137.7 Å²	137.7	69%	0.694	82%	0.816	S	S	*	*			trans	-119.8	148.4	-167.2	0	0	0	0	0	113.3
836	I	23.9	Very low	26.1	Very low	154 Å²	154	134.8 Å²	134.8	79%	0.79	82%	0.815	S	S	*	*			trans	44.5	123	134.5	-65.7	176.5	0	0	0	116.6
837	P	32.8	Very low	25.9	Very low	110 Å²	110	134.6 Å²	134.6	71%	0.714	81%	0.813	S	S	*	*				-141.7	161.4	56.8	36	-16.8	0	0	0	119.5
838	D	23.8	Very low	25.9	Very low	160 Å²	160	138.2 Å²	138.2	86%	0.856	82%	0.819	S	S	*	*			trans	16.7	134.9	147.2	-52.3	-52.4	0	0	0	121.9
839	G	23.5	Very low	25.9	Very low	79 Å²	79	136 Å²	136	81%	0.814	81%	0.809	S	S	*	*			trans	167.7	82	164	0	0	0	0	0	117.3
840	H	23.3	Very low	25.7	Very low	191 Å²	191	135 Å²	135	88%	0.884	81%	0.805	S	S	*	*			trans	-83.7	162.2	144.6	-81.4	-50.7	0	0	0	108.5
841	P	36.1	Very low	25.7	Very low	99 Å²	99	136.8 Å²	136.8	64%	0.643	80%	0.803	S	S	*	*			cis	-139.8	-164.2	20.5	44.2	-25.2	0	0	0	115.5
842	E	23.6	Very low	25.5	Very low	184 Å²	184	140.2 Å²	140.2	86%	0.86	81%	0.805	S	S	*	*			trans	69.5	139.4	150.4	-77.9	163.8	-158.8	0	0	121.6
843	A	24.9	Very low	26.6	Very low	90 Å²	90	136.9 Å²	136.9	74%	0.744	80%	0.798	S	S	*	*			trans	-99.6	156	162.4	0	0	0	0	0	109.2
844	P	31	Very low	26.4	Very low	129 Å²	129	131.8 Å²	131.8	84%	0.838	79%	0.792	S	S	*	*				-143.6	-174.2	102.6	38.4	-24	0	0	0	115.2
845	S	22.6	Very low	27.1	Very low	114 Å²	114	128.1 Å²	128.1	80%	0.797	79%	0.786	S	S	*	*			trans	-66.9	160.9	-169.9	50.9	0	0	0	0	117.8
846	C	26.2	Very low	27.3	Very low	119 Å²	119	128.8 Å²	128.8	80%	0.804	79%	0.792	S	S	*	*			trans	-58.3	165.3	176.7	-40.3	0	0	0	0	116
847	P	26	Very low	27.5	Very low	122 Å²	122	125.3 Å²	125.3	79%	0.792	79%	0.786	S	S	*	*			trans	-118.5	162.7	142.1	37	-29.3	0	0	0	113.9
848	L	23.9	Very low	27.3	Very low	171 Å²	171	129.9 Å²	129.9	90%	0.895	79%	0.789	S	S	*	*			trans	-85.7	-170.1	171	-61.2	84.9	0	0	0	109.3
849	A	24.5	Very low	27.3	Very low	79 Å²	79	129.2 Å²	129.2	65%	0.653	78%	0.781	S	S	*	*			cis	-165.6	145.5	20	0	0	0	0	0	111
850	S	25	Very low	27.3	Very low	105 Å²	105	129.8 Å²	129.8	73%	0.734	78%	0.778	S	S	*	*				80.3	134.9	94	76.7	0	0	0	0	118.8
851	R	23.8	Very low	27.3	Very low	235 Å²	235	124.8 Å²	124.8	89%	0.887	77%	0.769	S	S	*	*			trans	-174.9	113	131.8	-108.9	179.5	166.6	169.6	-3.1	113.9
852	D	21.6	Very low	27.5	Very low	146 Å²	146	126.2 Å²	126.2	78%	0.781	78%	0.779	S	S	*	*				36.5	152.2	108.2	-69.8	14.5	0	0	0	121.1
853	P	48.3	Very low	27.6	Very low	126 Å²	126	124.4 Å²	124.4	82%	0.818	77%	0.771	S	S	*	*			cis	-139.5	175.1	31.7	40.6	-21.5	0	0	0	119
854	G	21.9	Very low	27.6	Very low	68 Å²	68	129.8 Å²	129.8	70%	0.701	77%	0.772	S	S	*	*			trans	-86.2	-155.2	171.9	0	0	0	0	0	114.7
855	P	40.2	Very low	27.2	Very low	125 Å²	125	129.6 Å²	129.6	81%	0.812	77%	0.768	S	S	*	*				-151.4	168	55.2	42.6	-23.6	0	0	0	119.3
856	A	25.8	Very low	27.6	Very low	99 Å²	99	132 Å²	132	82%	0.818	77%	0.771	S	S	*	*			trans	58.4	147.1	141.1	0	0	0	0	0	123.3
857	A	29.3	Very low	28.4	Very low	80 Å²	80	131.9 Å²	131.9	66%	0.661	77%	0.769	S	S	*	*			cis	-172.6	159.3	-17.1	0	0	0	0	0	112.8
858	R	27.2	Very low	28.7	Very low	207 Å²	207	133.9 Å²	133.9	78%	0.781	77%	0.772	S	S	*	*			trans	69.6	147.9	153.4	-75.9	176	175.3	-117.9	2.4	118.5
859	E	24.9	Very low	29.2	Very low	145 Å²	145	137.2 Å²	137.2	68%	0.678	77%	0.773	S	S	*	*			cis	-156.9	171.9	-9.4	-131	147.7	-169.6	0	0	107.5
860	A	23.6	Very low	29.1	Very low	91 Å²	91	137 Å²	137	75%	0.752	78%	0.778	S	S	*	*			cis	-152.8	-168.3	11.4	0	0	0	0	0	111.6
861	A	23.8	Very low	29.2	Very low	86 Å²	86	136.7 Å²	136.7	71%	0.711	78%	0.782	S	S	*	*			trans	-134.1	179.1	165	0	0	0	0	0	109.7
862	P	40.2	Very low	30.8	Very low	130 Å²	130	130 Å²	130	84%	0.844	77%	0.769	S	S	*	*				-149.9	178.4	95.1	39.9	-22.5	0	0	0	116.4
863	E	24.2	Very low	31.2	Very low	146 Å²	146	135 Å²	135	68%	0.682	78%	0.777	S	S	*	*			trans	-93.2	-179.2	178.2	-48	178.3	124	0	0	114
864	R	26.1	Very low	30	Very low	202 Å²	202	132.8 Å²	132.8	76%	0.762	77%	0.77	S	S	*	*				118.7	120.3	117.5	-112.5	179	-136.2	-137.8	-4.4	122.7
865	T	22.2	Very low	30.2	Very low	126 Å²	126	139 Å²	139	77%	0.773	78%	0.781	S	S	*	*			trans	81.7	161.1	138	30.3	0	0	0	0	124.7
866	L	31.8	Very low	29.4	Very low	163 Å²	163	137.5 Å²	137.5	85%	0.853	78%	0.778	S	S	*	*			trans	-80.9	-173.2	-170.5	-59.6	166.2	0	0	0	113
867	P	42.7	Very low	30.9	Very low	117 Å²	117	138.7 Å²	138.7	76%	0.76	78%	0.778	S	S	*	*			cis	-151.3	170.5	15.2	44.8	-23.1	0	0	0	121.9
868	L	32.6	Very low	31.9	Very low	164 Å²	164	140.7 Å²	140.7	86%	0.859	78%	0.784	S	S	*	*			trans	20.8	140.7	139.6	-146.4	81.1	0	0	0	124.3
869	R	32.8	Very low	31.7	Very low	242 Å²	242	134.3 Å²	134.3	91%	0.913	78%	0.783	S	S	*	*				155.2	143.1	110.7	-164.6	174.2	-159.8	-146.3	6.1	117.3
870	G	23	Very low	31.8	Very low	74 Å²	74	139.4 Å²	139.4	76%	0.763	80%	0.796	S	S	*	*			trans	-175.2	148.5	166.2	0	0	0	0	0	114
871	A	26.8	Very low	31.8	Very low	98 Å²	98	143.8 Å²	143.8	81%	0.81	80%	0.801	S	S	*	*			trans	-169.8	-170.2	-175.6	0	0	0	0	0	110.4
872	P	57.1	Low	32.7	Very low	94 Å²	94	144.6 Å²	144.6	61%	0.61	80%	0.799	S	S	*	*			cis	-145.4	-171.8	-0.3	45.7	-26.3	0	0	0	118.6
873	W	29.8	Very low	32.1	Very low	251 Å²	251	143.4 Å²	143.4	95%	0.951	79%	0.793	S	S	*	*			trans	81	149	155.7	-63.8	-18.5	0	0	0	120
874	A	24.7	Very low	32.3	Very low	81 Å²	81	148.2 Å²	148.2	67%	0.669	81%	0.805	S	S	*	*			cis	-149.5	142.9	16.6	0	0	0	0	0	117.9
875	Q	25.4	Very low	32.3	Very low	199 Å²	199	142 Å²	142	93%	0.93	80%	0.804	S	S	*	*			trans	69.4	163.4	140.8	-63.9	179.8	39.9	0	0	123.6
876	A	22.5	Very low	32.4	Very low	92 Å²	92	139.7 Å²	139.7	76%	0.76	81%	0.805	S	S	*	*			trans	-166.2	-156.4	-161.3	0	0	0	0	0	112.1
877	P	57.4	Low	32.2	Very low	125 Å²	125	137 Å²	137	81%	0.812	80%	0.8	S	S	*	*			cis	-120.6	-64.4	-28.8	29.1	-20.4	0	0	0	124.9
878	P	51.5	Low	31.5	Very low	121 Å²	121	140.2 Å²	140.2	79%	0.786	81%	0.805	S	S	*	*				-130.7	165.3	-121.1	42.7	-28.9	0	0	0	120.5
879	G	23.5	Very low	31.3	Very low	74 Å²	74	137 Å²	137	76%	0.763	80%	0.802	S	S	*	*			trans	157.7	137.4	146	0	0	0	0	0	120.8
880	R	25.5	Very low	30.9	Very low	251 Å²	251	129 Å²	129	95%	0.947	80%	0.795	S	S	*	*			trans	75.7	115.8	156.2	-63.9	-173	176.7	-175.2	-0.6	122.7
881	Q	25.2	Very low	31.8	Very low	184 Å²	184	131.4 Å²	131.4	86%	0.86	80%	0.797	S	S	*	*			trans	-93.6	-162.5	145.9	-62.4	-173.2	-33.6	0	0	108.7
882	P	42.4	Very low	32.7	Very low	102 Å²	102	131.6 Å²	131.6	66%	0.662	79%	0.79	S	S	*	*			cis	-147.1	-172	1	45.5	-25.8	0	0	0	118.8
883	S	26.1	Very low	31.1	Very low	105 Å²	105	134.8 Å²	134.8	73%	0.734	80%	0.796	S	S	*	*			trans	75.7	155	149.5	-72.8	0	0	0	0	118.1
884	R	29.1	Very low	31	Very low	248 Å²	248	128 Å²	128	94%	0.936	78%	0.782	S	S	*	*			cis	-158.6	154.5	6	-126.4	170.5	-175.1	-173.3	0.8	107
885	G	25.8	Very low	31	Very low	72 Å²	72	130.8 Å²	130.8	74%	0.742	79%	0.786	S	S	*	*			cis	-165.6	153.8	-8.5	0	0	0	0	0	106.5
886	G	25.6	Very low	31.1	Very low	77 Å²	77	126.3 Å²	126.3	79%	0.794	78%	0.777	S	S	*	*				74.6	122.8	77.5	0	0	0	0	0	111.6
887	S	27.5	Very low	31.4	Very low	105 Å²	105	127 Å²	127	73%	0.734	78%	0.777	S	S	*	*			cis	-156.9	-167.3	3.8	-60.3	0	0	0	0	108.3
888	Q	27.3	Very low	30.1	Very low	186 Å²	186	127.1 Å²	127.1	87%	0.869	78%	0.778	S	S	*	*			cis	-150.4	-115	10.8	-156.3	132.2	-83.3	0	0	114.8
889	A	27.5	Very low	28.9	Very low	97 Å²	97	129.1 Å²	129.1	80%	0.802	78%	0.782	S	S	*	*			trans	-134.3	158.3	-159.2	0	0	0	0	0	115.5
890	G	24.8	Very low	29.1	Very low	73 Å²	73	132.3 Å²	132.3	75%	0.753	78%	0.78	S	S	*	*			trans	114.7	124.9	136.1	0	0	0	0	0	119
891	P	41.6	Very low	29.2	Very low	125 Å²	125	126.2 Å²	126.2	81%	0.812	77%	0.772	S	S	*	*			trans	-103.2	-160.8	165	44.6	-36.2	0	0	0	110.2
892	P	45.9	Very low	30.5	Very low	102 Å²	102	122.8 Å²	122.8	66%	0.662	77%	0.765	S	S	*	*			cis	-130.6	-155.3	-12.2	26.2	-0.1	0	0	0	113.3
893	H	25.2	Very low	30.5	Very low	161 Å²	161	123.1 Å²	123.1	75%	0.745	77%	0.767	S	S	*	*			trans	104.8	107.5	155.3	-73.9	-68.1	0	0	0	122.6
894	T	26.2	Very low	30.5	Very low	107 Å²	107	123.7 Å²	123.7	66%	0.656	77%	0.771	S	S	*	*				26	147	125.6	51.4	0	0	0	0	124.8
895	D	24.6	Very low	30.5	Very low	140 Å²	140	118.5 Å²	118.5	75%	0.749	77%	0.767	S	S	*	*			trans	100.5	100.8	147.5	-57.7	-38.6	0	0	0	123.3
896	S	27	Very low	31.5	Very low	105 Å²	105	120.1 Å²	120.1	73%	0.734	77%	0.765	S	S	*	*				49.9	126.5	119.6	-55.5	0	0	0	0	125.2
897	S	29.8	Very low	31.4	Very low	108 Å²	108	124.7 Å²	124.7	76%	0.755	77%	0.77	S	S	*	*			trans	73.3	105.2	138.4	55.9	0	0	0	0	123.8
898	C	29.3	Very low	31.1	Very low	126 Å²	126	123 Å²	123	85%	0.851	77%	0.769	S	S	*	*				32.9	133.2	127.7	-52.2	0	0	0	0	123.5
899	L	28.1	Very low	31.8	Very low	163 Å²	163	119.8 Å²	119.8	85%	0.853	77%	0.765	S	S	*	*			trans	-167.2	113.3	140.2	-106.5	178	0	0	0	116.7
900	L	27.2	Very low	31.8	Very low	141 Å²	141	123.1 Å²	123.1	74%	0.738	76%	0.763	S	S	*	*			trans	24.2	125.7	142.7	-59.6	176.6	0	0	0	127.1
901	T	26.2	Very low	32.8	Very low	124 Å²	124	125.1 Å²	125.1	76%	0.761	76%	0.763	S	S	*	*				86.6	-172.9	127.8	65.3	0	0	0	0	121.9
902	P	52.5	Low	31.9	Very low	112 Å²	112	122.7 Å²	122.7	73%	0.727	76%	0.761	S	S	*	*				-127.9	-145.3	-97.3	45.2	-25.6	0	0	0	113
903	P	43.2	Very low	31.1	Very low	108 Å²	108	125.6 Å²	125.6	70%	0.701	77%	0.771	S	S	*	*			cis	-139.1	-167.7	-15.8	36.2	-12.6	0	0	0	117
904	S	25.6	Very low	32.1	Very low	117 Å²	117	122.8 Å²	122.8	82%	0.818	77%	0.767	S	S	*	*			trans	98.9	147.2	147.6	-53.5	0	0	0	0	123.8
905	T	30.4	Very low	32.2	Very low	139 Å²	139	123.8 Å²	123.8	85%	0.853	77%	0.768	S	S	*	*			trans	-100.2	-170.4	-171.8	17.1	0	0	0	0	113.9
906	P	45.7	Very low	32.3	Very low	107 Å²	107	127.7 Å²	127.7	70%	0.695	77%	0.773	S	S	*	*			cis	-146.2	-169.8	19.3	35.3	-8.9	0	0	0	119.8
907	L	24.4	Very low	32.3	Very low	172 Å²	172	126.3 Å²	126.3	90%	0.901	77%	0.768	S	S	*	*			trans	111.9	145.1	153.5	-57.1	-179.4	0	0	0	120.2
908	G	21.3	Very low	32.1	Very low	70 Å²	70	129.6 Å²	129.6	72%	0.722	77%	0.771	S	S	*	*			trans	-125.6	-144.9	171.4	0	0	0	0	0	110.9
909	P	41.7	Very low	32	Very low	118 Å²	118	128 Å²	128	77%	0.766	76%	0.762	S	S	*	*			cis	-144.1	177.5	5.4	45.7	-28	0	0	0	117.7
910	E	26.2	Very low	31.8	Very low	167 Å²	167	124.4 Å²	124.4	78%	0.78	76%	0.763	S	S	*	*			trans	58.5	167.1	151.8	-73.9	-39	101.1	0	0	122.8
911	P	46.1	Very low	31.8	Very low	115 Å²	115	121.2 Å²	121.2	75%	0.747	77%	0.765	S	S	*	*			cis	-135.2	178.9	-26.3	36.2	-19.1	0	0	0	115.1
912	G	23.8	Very low	32.6	Very low	74 Å²	74	121.4 Å²	121.4	76%	0.763	77%	0.768	S	S	*	*			trans	139.6	108.9	140.4	0	0	0	0	0	118.8
913	D	28.5	Very low	31.3	Very low	163 Å²	163	122.7 Å²	122.7	87%	0.872	78%	0.778	S	S	*	*			trans	-157.6	151.5	173.7	-128.3	-9.7	0	0	0	111.5
914	P	46.7	Very low	30.4	Very low	102 Å²	102	120.7 Å²	120.7	66%	0.662	78%	0.777	S	S	*	*			trans	-139.9	148.9	164.2	37.3	-22.2	0	0	0	113.9
915	D	27.8	Very low	30.3	Very low	128 Å²	128	125 Å²	125	68%	0.684	78%	0.781	S	S	*	*			cis	-155.1	-158.7	-8.8	-66.9	-45.5	0	0	0	105.5
916	W	26.2	Very low	29.9	Very low	222 Å²	222	124.9 Å²	124.9	84%	0.841	78%	0.78	S	S	*	*			cis	-155.2	161.5	-1.2	-108.6	117	0	0	0	109
917	A	26.9	Very low	28.8	Very low	77 Å²	77	127 Å²	127	64%	0.636	79%	0.785	S	S	*	*			trans	21.1	146.8	145.9	0	0	0	0	0	123.7
918	E	25.5	Very low	29.3	Very low	177 Å²	177	124.6 Å²	124.6	83%	0.827	78%	0.779	S	S	*	*			cis	-178.5	166.4	-11.1	-98	-125.1	-68.7	0	0	107.2
919	S	27.9	Very low	29.3	Very low	93 Å²	93	128 Å²	128	65%	0.65	78%	0.777	S	S	*	*			cis	-172.6	151.3	-29.3	-95.2	0	0	0	0	111
920	G	24.7	Very low	28.4	Very low	86 Å²	86	131.9 Å²	131.9	89%	0.887	78%	0.776	S	S	*	*			trans	80.4	153.3	167.6	0	0	0	0	0	116.8
921	G	26.6	Very low	28.2	Very low	75 Å²	75	131 Å²	131	77%	0.773	77%	0.772	S	S	*	*			cis	-165.3	177.9	-0.5	0	0	0	0	0	112.6
922	P	43.4	Very low	27.1	Very low	128 Å²	128	134.8 Å²	134.8	83%	0.831	77%	0.771	S	S	*	*			trans	-114.8	157.5	-155.3	40.3	-33.6	0	0	0	118.5
923	C	24.9	Very low	27.1	Very low	138 Å²	138	137.8 Å²	137.8	93%	0.932	77%	0.77	S	S	*	*			trans	31.1	121.4	146.9	-164.8	0	0	0	0	121.9
924	G	23.7	Very low	26.9	Very low	66 Å²	66	133.2 Å²	133.2	68%	0.68	76%	0.761	S	S	*	*			trans	150.3	108.9	139.5	0	0	0	0	0	120.5
925	K	24.3	Very low	26.6	Very low	207 Å²	207	134 Å²	134	90%	0.9	77%	0.766	S	S	*	*			trans	60.9	148.9	142.2	-85.7	-175.2	178.9	179.5	0	123.3
926	V	21	Very low	26.6	Very low	138 Å²	138	133.4 Å²	133.4	84%	0.836	77%	0.772	S	S	*	*			trans	88.7	139.2	151.7	164.8	0	0	0	0	119.9
927	L	23.4	Very low	26.7	Very low	150 Å²	150	126.2 Å²	126.2	79%	0.785	77%	0.767	S	S	*	*			trans	-81.3	159.6	176.2	-112.3	96.2	0	0	0	111.2
928	P	34.2	Very low	26.7	Very low	122 Å²	122	130.3 Å²	130.3	79%	0.792	78%	0.777	S	S	*	*				-152.5	167.2	73.7	40	-19.4	0	0	0	119.7
929	E	21.7	Very low	26.9	Very low	142 Å²	142	133 Å²	133	66%	0.664	78%	0.78	S	S	*	*			trans	-2.3	134.6	154.6	-93.8	-168.4	101.9	0	0	122.8
930	R	22.5	Very low	26.7	Very low	199 Å²	199	132.3 Å²	132.3	75%	0.751	79%	0.787	S	S	*	*				72.1	112.5	117.9	-171.9	-163.1	-164.3	156	-5.2	121
931	Q	22.1	Very low	26.8	Very low	150 Å²	150	133 Å²	133	70%	0.701	78%	0.784	S	S	*	*				-172.4	100.7	122.2	-154.2	64.5	-35.6	0	0	108.6
932	R	23.5	Very low	26.7	Very low	194 Å²	194	133.2 Å²	133.2	73%	0.732	78%	0.779	S	S	*	*				64.5	109.4	86.7	-167.1	-154.6	-155.8	-120.7	13.7	114.4
933	N	23.8	Very low	26.1	Very low	136 Å²	136	133.7 Å²	133.7	73%	0.727	77%	0.774	S	S	*	*				175.2	141.3	125.4	-85	-22.4	0	0	0	112.3
934	G	24.4	Very low	26.2	Very low	67 Å²	67	135.4 Å²	135.4	69%	0.691	77%	0.768	S	S	*	*			trans	-92.1	-142.1	157.7	0	0	0	0	0	110.3
935	P	40.6	Very low	26.4	Very low	119 Å²	119	135.7 Å²	135.7	77%	0.773	77%	0.771	S	S	*	*			cis	-145.1	177.5	27.8	40.8	-20.4	0	0	0	117.5
936	S	27.7	Very low	26.5	Very low	116 Å²	116	133 Å²	133	81%	0.811	77%	0.766	S	S	*	*			trans	44.9	139.3	145	59.7	0	0	0	0	122.3
937	G	27.8	Very low	26.6	Very low	70 Å²	70	131 Å²	131	72%	0.722	76%	0.759	S	S	*	*			cis	127.4	147.2	-0.9	0	0	0	0	0	113.9
938	L	27.9	Very low	26.7	Very low	163 Å²	163	128.9 Å²	128.9	85%	0.853	76%	0.762	S	S	*	*			trans	170.7	158.4	168.6	-93.9	170	0	0	0	106.8
939	R	28.1	Very low	26.2	Very low	235 Å²	235	127.4 Å²	127.4	89%	0.887	76%	0.761	S	S	*	*			cis	-168.1	133.9	-43.2	171.9	-168.7	-74.5	-113.6	5	107.1
940	G	24.8	Very low	27	Very low	78 Å²	78	125.8 Å²	125.8	80%	0.804	76%	0.762	S	S	*	*			trans	-175.5	135.2	171.2	0	0	0	0	0	112.5
941	A	26.8	Very low	27.2	Very low	99 Å²	99	125.3 Å²	125.3	82%	0.818	77%	0.769	S	S	*	*			trans	-106.8	176.2	179.8	0	0	0	0	0	110.1
942	A	24.6	Very low	27.3	Very low	80 Å²	80	126.3 Å²	126.3	66%	0.661	78%	0.779	S	S	*	*			cis	-147.6	147.7	14.8	0	0	0	0	0	110.6
943	L	29.8	Very low	27.3	Very low	139 Å²	139	125 Å²	125	73%	0.728	78%	0.781	S	S	*	*				59.1	140	92	-48.9	-178.7	0	0	0	114.2
944	E	27.9	Very low	27.3	Very low	173 Å²	173	123.1 Å²	123.1	81%	0.808	78%	0.779	S	S	*	*			cis	-157.3	158.2	-5.2	-110.5	155.6	173	0	0	106.2
945	G	27.4	Very low	28.4	Very low	72 Å²	72	125.4 Å²	125.4	74%	0.742	78%	0.782	S	S	*	*				107.5	151.2	58.7	0	0	0	0	0	109.5
946	D	26.1	Very low	28.3	Very low	151 Å²	151	125.9 Å²	125.9	81%	0.807	78%	0.784	S	S	*	*			cis	-165.7	164.2	-10.7	-172.2	39	0	0	0	111.9
947	S	23.9	Very low	28.2	Very low	96 Å²	96	124.7 Å²	124.7	67%	0.671	78%	0.782	S	S	*	*			trans	57.7	137	150.9	-78.1	0	0	0	0	126.2
948	A	25.9	Very low	29	Very low	105 Å²	105	127.1 Å²	127.1	87%	0.868	79%	0.785	S	S	*	*			trans	87.7	157.4	137.5	0	0	0	0	0	123.4
949	A	22.3	Very low	28.9	Very low	92 Å²	92	125.4 Å²	125.4	76%	0.76	79%	0.787	S	S	*	*			trans	-129.2	-170.3	-178.7	0	0	0	0	0	108.6
950	P	39.6	Very low	29.1	Very low	107 Å²	107	119.4 Å²	119.4	70%	0.695	78%	0.78	S	S	*	*			cis	-140.1	-172.3	5.4	44.6	-24.6	0	0	0	116.8
951	E	26	Very low	29.6	Very low	189 Å²	189	127 Å²	127	88%	0.883	79%	0.785	S	S	*	*			trans	36	126.9	145.1	-70.3	162.4	-149.8	0	0	123.9
952	D	25.2	Very low	29.6	Very low	172 Å²	172	127.5 Å²	127.5	92%	0.92	78%	0.783	S	S	*	*				-161.8	165.6	126.7	-157.3	-1.1	0	0	0	110.8
953	E	22.8	Very low	30	Very low	165 Å²	165	129 Å²	129	77%	0.771	79%	0.788	S	S	*	*			trans	-136.8	134.4	-158.1	-153.6	-161.6	129.2	0	0	118
954	S	23.6	Very low	30.2	Very low	98 Å²	98	126.9 Å²	126.9	69%	0.685	79%	0.785	S	S	*	*			trans	71.8	178.6	153.9	81.3	0	0	0	0	119.6
955	P	47.1	Very low	30.4	Very low	115 Å²	115	124.5 Å²	124.5	75%	0.747	78%	0.783	S	S	*	*				-126.3	-158.6	-61.4	36.7	-16.9	0	0	0	110.5
956	P	38.3	Very low	30.9	Very low	128 Å²	128	129.2 Å²	129.2	83%	0.831	79%	0.785	S	S	*	*			cis	-129.7	-167.9	-5.2	42.8	-23.8	0	0	0	115.7
957	A	26.3	Very low	31.6	Very low	91 Å²	91	128.3 Å²	128.3	75%	0.752	78%	0.781	S	S	*	*			trans	-105.9	-165.4	-169	0	0	0	0	0	112.8
958	P	45.3	Very low	32.5	Very low	121 Å²	121	133.7 Å²	133.7	79%	0.786	79%	0.792	S	S	*	*			cis	-140.2	169	-2.9	42.3	-24.6	0	0	0	117.8
959	S	25.9	Very low	34.1	Very low	128 Å²	128	133.3 Å²	133.3	90%	0.895	78%	0.782	S	S	*	*			trans	-164.6	157.2	142.1	36.8	0	0	0	0	113.2
960	S	32.4	Very low	36.7	Very low	108 Å²	108	136.4 Å²	136.4	76%	0.755	78%	0.775	S	S	*	*			trans	-84	162	-173.5	-64.8	0	0	0	0	113.7
961	R	33.8	Very low	39.1	Very low	237 Å²	237	134.6 Å²	134.6	89%	0.894	76%	0.762	S	S	*	*			cis	-170.3	128.6	-14.7	-106.7	177.2	176.4	-173.3	-2.3	107.3
962	S	27.8	Very low	42.1	Very low	111 Å²	111	126.5 Å²	126.5	78%	0.776	72%	0.724	S	S	*	*			trans	-164.2	155.6	167	55.4	0	0	0	0	113
963	S	33.3	Very low	45.2	Very low	111 Å²	111	121.5 Å²	121.5	78%	0.776	70%	0.7	S	S	*	*			trans	64.5	151.3	166.3	44.1	0	0	0	0	120.2
964	S	33.1	Very low	48.5	Very low	95 Å²	95	113.7 Å²	113.7	66%	0.664	66%	0.663	S	S	*	*			trans	49.8	103	160.3	56.1	0	0	0	0	119.7	E966	S964-E966 PolarHBondContact O-N 3.38Å
965	T	31.4	Very low	51.7	Low	123 Å²	123	114.2 Å²	114.2	76%	0.755	66%	0.655	S	S	*	*			trans	-87.5	81.6	146.9	49.4	0	0	0	0	109.2	D967	T965-D967 PolarHBondContact O-N 3Å
966	E	38.5	Very low	53.7	Low	170 Å²	170	109 Å²	109	79%	0.794	62%	0.62	S	S	*	*			trans	-81.5	90	157.9	-72.5	-167.8	148.2	0	0	107.6	S964 F968	S964-E966 PolarHBondContact O-N 3.38Å; E966-F968 PolarHBondContact O-N 3Å
967	D	41.7	Very low	56	Low	133 Å²	133	107.4 Å²	107.4	71%	0.711	60%	0.602	S	S	*	*			trans	-72.2	116.8	179.9	-71.6	-44.8	0	0	0	110.4	T965 C969	T965-D967 PolarHBondContact O-N 3Å; D967-C969 PolarHBondContact O-N 3.2Å
968	F	42.1	Very low	58.8	Low	209 Å²	209	107.5 Å²	107.5	92%	0.917	58%	0.583	S	S	*	*			trans	-58.1	94.6	-173.5	-70.1	-94.8	0	0	0	112.9	E966 Y970	E966-F968 PolarHBondContact O-N 3Å; F968-Y970 PolarHBondContact O-N 3.47Å
969	C	59.2	Low	60.5	Low	97 Å²	97	102.8 Å²	102.8	66%	0.655	56%	0.556	S	S	*	*			trans	-72.6	92.5	175.8	-71.4	0	0	0	0	110.8	D967 V971	D967-C969 PolarHBondContact O-N 3.2Å; C969-V971 PolarHBondContact O-N 2.98Å
970	Y	77.7	Confident	62.7	Low	157 Å²	157	103.6 Å²	103.6	62%	0.616	56%	0.558	S	S	*	*			trans	-64.8	112.2	176.1	176.4	-98.5	0	0	0	111.2	F968 F972 K1056	F968-Y970 PolarHBondContact O-N 3.47Å; Y970-F972 HydrophobicContact CD1-CB 4.46Å; Y970-F972 AromaticContact CD1-CD1 3.76Å; Y970-F972 HydrophobicContact CD1-CD1 3.76Å; Y970-F972 HydrophobicContact CD1-CE1 4.46Å; Y970-F972 HydrophobicContact CD1-CG 4.41Å; Y970-F972 HydrophobicContact CE1-CB 3.75Å; Y970-F972 AromaticContact CE1-CD1 3.66Å; Y970-F972 HydrophobicContact CE1-CD1 3.66Å; Y970-F972 AromaticContact CE1-CG 3.87Å; Y970-F972 HydrophobicContact CE1-CG 3.87Å; Y970-K1056 HydrophobicContact CD1-CB 4.04Å; Y970-K1056 VanDerWaalsContact O-CB 3.32Å; Y970-K1056 WeakPolarHBondContact O-CB 3.47Å; Y970-K1056 PolarHBondContact O-N 3.1Å
971	V	88.9	Confident	64.5	Low	68 Å²	68	103.8 Å²	103.8	41%	0.412	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-101.7	133.1	178.7	-175.1	0	0	0	0	110.7	C969 L1024 L1053 V1054 A1055	C969-V971 PolarHBondContact O-N 2.98Å; V971-L1024 HydrophobicContact CG1-CD1 4.02Å; V971-L1024 HydrophobicContact CG2-CD1 4.13Å; V971-L1053 HydrophobicContact CG1-CD1 3.68Å; V971-L1053 HydrophobicContact CG1-CD2 4.05Å; V971-L1053 HydrophobicContact CG1-CG 3.64Å; V971-V1054 CarbonylContact C-O 3.59Å; V971-V1054 WeakPolarHBondContact CA-O 3.14Å; V971-A1055 HydrophobicContact CG2-CB 4.13Å
972	F	89.4	Confident	66.9	Low	20 Å²	20	93.6 Å²	93.6	9%	0.088	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	159.1	-178.2	65	-74.3	0	0	0	112.5	Y970 V974 R1016 L1017 V1054 K1056	Y970-F972 HydrophobicContact CD1-CB 4.46Å; Y970-F972 AromaticContact CD1-CD1 3.76Å; Y970-F972 HydrophobicContact CD1-CD1 3.76Å; Y970-F972 HydrophobicContact CD1-CE1 4.46Å; Y970-F972 HydrophobicContact CD1-CG 4.41Å; Y970-F972 HydrophobicContact CE1-CB 3.75Å; Y970-F972 AromaticContact CE1-CD1 3.66Å; Y970-F972 HydrophobicContact CE1-CD1 3.66Å; Y970-F972 AromaticContact CE1-CG 3.87Å; Y970-F972 HydrophobicContact CE1-CG 3.87Å; F972-V974 HydrophobicContact CD2-CG2 3.66Å; F972-V974 HydrophobicContact CE2-CG2 3.44Å; F972-V974 VanDerWaalsContact CE2-CG2 3.44Å; F972-R1016 HydrophobicContact CD2-CB 4.4Å; F972-R1016 HydrophobicContact CE2-CB 3.78Å; F972-L1017 HydrophobicContact CE2-CD2 4.28Å; F972-L1017 HydrophobicContact CZ-CD2 4.31Å; F972-V1054 VanDerWaalsContact CD1-O 3.32Å; F972-V1054 WeakPolarHBondContact CD1-O 3.3Å; F972-V1054 HydrophobicContact CE1-CB 4.07Å; F972-V1054 HydrophobicContact CE1-CG1 3.9Å; F972-V1054 HydrophobicContact CE2-CB 4.49Å; F972-V1054 HydrophobicContact CZ-CB 4.07Å; F972-V1054 HydrophobicContact CZ-CG1 3.89Å; F972-V1054 PolarHBondContact N-O 3.44Å; F972-V1054 PolarHBondContact O-N 3.1Å; F972-K1056 HydrophobicContact CE1-CB 4.06Å; F972-K1056 HydrophobicContact CE1-CD 3.64Å; F972-K1056 HydrophobicContact CZ-CD 4.06Å
973	T	90.4	Very high	69.7	Low	67 Å²	67	89 Å²	89	41%	0.411	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	132.6	-179.3	-55.8	0	0	0	0	111.2	R1016 R1051 F1052 L1053	T973-R1016 PolarHBondContact O-NH1 3.26Å; T973-R1051 HydrophobicContact CG2-CG 3.57Å; T973-F1052 WeakPolarHBondContact CA-O 3.46Å; T973-L1053 WeakPolarHBondContact OG1-CD1 3.34Å
974	V	91.8	Very high	72	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.4	176.1	-178.6	0	0	0	0	109.6	F972 L976 D1014 L1017 R1051 F1052	F972-V974 HydrophobicContact CD2-CG2 3.66Å; F972-V974 HydrophobicContact CE2-CG2 3.44Å; F972-V974 VanDerWaalsContact CE2-CG2 3.44Å; V974-L976 HydrophobicContact CG1-CD2 3.67Å; V974-L976 HydrophobicContact CG1-CG 3.91Å; V974-D1014 HydrophobicContact CG1-CB 4.4Å; V974-L1017 HydrophobicContact CB-CD2 4.39Å; V974-L1017 HydrophobicContact CG1-CD1 4.35Å; V974-L1017 HydrophobicContact CG1-CG 4.39Å; V974-L1017 HydrophobicContact CG2-CD2 3.79Å; V974-L1017 HydrophobicContact CG2-CG 4.26Å; V974-R1051 CarbonylContact O-C 3.58Å; V974-R1051 WeakPolarHBondContact O-CA 3.45Å; V974-F1052 PolarHBondContact N-O 3.38Å; V974-F1052 PolarHBondContact O-N 2.65Å
975	E	90.5	Very high	74.6	Confident	109 Å²	109	81 Å²	81	51%	0.509	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	122	170.2	-64.2	-163.2	161.6	0	0	109.3	M1050 R1051	E975-M1050 CarbonylContact C-O 3.55Å; E975-M1050 WeakPolarHBondContact CA-O 3.33Å; E975-R1051 HydrophobicContact CG-CB 4.21Å; E975-R1051 HydrophobicContact CG-CG 4.17Å; E975-R1051 IonicContact OE1-CZ 3.31Å; E975-R1051 IonicContact OE1-NE 3.95Å; E975-R1051 PolarHBondContact OE1-NE 3.13Å; E975-R1051 IonicContact OE1-NH2 2.63Å; E975-R1051 PolarHBondContact OE1-NH2 2.91Å
976	L	89.8	Confident	77.2	Confident	6 Å²	6	76.2 Å²	76.2	3%	0.031	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	137.2	180	-59.8	-177.5	0	0	0	110.5	V974 L983 A1011 D1014 L1017 M1050 F1052	V974-L976 HydrophobicContact CG1-CD2 3.67Å; V974-L976 HydrophobicContact CG1-CG 3.91Å; L976-L983 HydrophobicContact CB-CD2 3.75Å; L976-L983 HydrophobicContact CD1-CD2 4.2Å; L976-A1011 HydrophobicContact CD1-CB 3.8Å; L976-D1014 HydrophobicContact CD2-CB 3.86Å; L976-L1017 HydrophobicContact CD1-CD1 4.03Å; L976-M1050 PolarHBondContact N-O 2.92Å; L976-M1050 PolarHBondContact O-N 2.79Å; L976-F1052 HydrophobicContact CB-CE2 4.41Å; L976-F1052 HydrophobicContact CD1-CD2 4.26Å; L976-F1052 HydrophobicContact CD1-CE2 4.02Å; L976-F1052 HydrophobicContact CG-CD2 4.37Å; L976-F1052 HydrophobicContact CG-CE2 4.36Å
977	E	87	Confident	79.6	Confident	95 Å²	95	69.2 Å²	69.2	44%	0.444	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	137.4	165.7	-59.4	-154.3	-166.1	0	0	110.5	G979 P1010 K1048 K1049	E977-G979 PolarHBondContact O-N 2.84Å; E977-P1010 WeakPolarHBondContact O-CB 3.37Å; E977-P1010 WeakPolarHBondContact O-CG 3.37Å; E977-K1048 CarbonylContact C-O 3.6Å; E977-K1048 WeakPolarHBondContact CA-O 3.28Å; E977-K1049 HydrophobicContact CG-CD 4.19Å; E977-K1049 HydrophobicContact CG-CG 4.07Å; E977-K1049 WeakPolarHBondContact OE1-CE 3.32Å; E977-K1049 IonicContact OE1-NZ 3.47Å; E977-K1049 PolarHBondContact OE1-NZ 2.93Å
978	R	85.3	Confident	81.6	Confident	92 Å²	92	63.9 Å²	63.9	35%	0.347	35%	0.352	S	S	.	.			trans	-72.4	114.5	179.4	-173.4	-179.9	-74.4	-175.8	0.3	110.1	L983 I1043 R1044 K1048	R978-L983 HydrophobicContact CB-CD2 4.43Å; R978-I1043 PolarHBondContact NH2-O 3.22Å; R978-R1044 PolarHBondContact NH1-O 2.93Å; R978-R1044 VanDerWaalsContact NH1-O 3.1Å; R978-R1044 PolarHBondContact NH2-O 3.32Å; R978-K1048 PolarHBondContact N-O 3.14Å
979	G	81.4	Confident	83.7	Confident	22 Å²	22	55.1 Å²	55.1	23%	0.227	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-77.5	179.6	173.7	0	0	0	0	0	113.1	E977 S981 G982	E977-G979 PolarHBondContact O-N 2.84Å; G979-S981 VanDerWaalsContact C-N 3.25Å; G979-S981 PolarHBondContact O-N 3.41Å; G979-G982 WeakPolarHBondContact CA-O 3.38Å; G979-G982 PolarHBondContact N-O 3.02Å; G979-G982 PolarHBondContact O-N 3.21Å
980	P	70.9	Confident	84.7	Confident	145 Å²	145	50.5 Å²	50.5	94%	0.942	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-33.6	-177	24.4	-34	0	0	0	113
981	S	70.8	Confident	84.7	Confident	113 Å²	113	47.9 Å²	47.9	79%	0.79	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	21.9	176.1	-46.5	0	0	0	0	113.2	G979	G979-S981 VanDerWaalsContact C-N 3.25Å; G979-S981 PolarHBondContact O-N 3.41Å
982	G	84.3	Confident	84	Confident	23 Å²	23	51.1 Å²	51.1	24%	0.237	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	86.9	-148.6	-175.8	0	0	0	0	0	113.5	G979	G979-G982 WeakPolarHBondContact CA-O 3.38Å; G979-G982 PolarHBondContact N-O 3.02Å; G979-G982 PolarHBondContact O-N 3.21Å
983	L	85.6	Confident	83.4	Confident	15 Å²	15	50.9 Å²	50.9	8%	0.079	29%	0.289	C	S	.	.			trans	-86.4	-24.1	177.6	-64.8	170.3	0	0	0	113	L976 R978 A1011 I1043 M1050 F1052	L976-L983 HydrophobicContact CB-CD2 3.75Å; L976-L983 HydrophobicContact CD1-CD2 4.2Å; R978-L983 HydrophobicContact CB-CD2 4.43Å; L983-A1011 VanDerWaalsContact O-CB 3.24Å; L983-A1011 WeakPolarHBondContact O-CB 3.5Å; L983-A1011 PolarHBondContact O-N 3.27Å; L983-A1011 VanDerWaalsContact O-N 3.1Å; L983-I1043 HydrophobicContact CD1-CG2 3.97Å; L983-M1050 HydrophobicContact CD1-CG 4.32Å; L983-M1050 HydrophobicContact CD2-CG 4.37Å; L983-F1052 HydrophobicContact CD1-CE2 4Å; L983-F1052 HydrophobicContact CD1-CZ 3.65Å
984	G	82.7	Confident	82.6	Confident	9 Å²	9	56.9 Å²	56.9	9%	0.093	30%	0.304	C	S	.	.			trans	72.2	26.6	-177.6	0	0	0	0	0	115.6	L1006 S1009	G984-L1006 PolarHBondContact O-N 3.21Å; G984-S1009 PolarHBondContact O-OG 3.48Å
985	M	87.7	Confident	81.8	Confident	28 Å²	28	58.8 Å²	58.8	14%	0.138	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	117	176.8	-179	171.1	58.8	0	0	109.2	L987 I1002 L1005 A1011 L1017 I1023 F1052	M985-L987 HydrophobicContact CE-CD1 4.34Å; M985-L987 HydrophobicContact CE-CD2 4.13Å; M985-L987 HydrophobicContact CG-CD2 3.73Å; M985-L987 HydrophobicContact CG-CG 4.28Å; M985-L987 HydrophobicContact SD-CD2 4Å; M985-I1002 HydrophobicContact CG-CD1 4.34Å; M985-I1002 HydrophobicContact CG-CG1 4.18Å; M985-I1002 HydrophobicContact CG-CG2 4.15Å; M985-I1002 HydrophobicContact SD-CD1 3.49Å; M985-I1002 WeakPolarHBondContact SD-CD1 3.14Å; M985-I1002 HydrophobicContact SD-CG1 3.72Å; M985-L1005 HydrophobicContact CB-CD2 4.14Å; M985-L1005 HydrophobicContact CG-CD2 3.99Å; M985-A1011 HydrophobicContact CB-CB 3.85Å; M985-L1017 HydrophobicContact SD-CD1 4.16Å; M985-I1023 HydrophobicContact CE-CD1 3.66Å; M985-I1023 HydrophobicContact SD-CD1 4.18Å; M985-F1052 HydrophobicContact CE-CE1 4.2Å; M985-F1052 HydrophobicContact CE-CZ 4.16Å
986	G	85.4	Confident	81.1	Confident	22 Å²	22	56 Å²	56	23%	0.227	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	132.9	171.5	0	0	0	0	0	110.2	Q1003 T1004	G986-Q1003 PolarHBondContact O-N 2.97Å; G986-T1004 WeakPolarHBondContact CA-OG1 3.22Å; G986-T1004 PolarHBondContact N-O 3.47Å; G986-T1004 PolarHBondContact O-N 3.35Å
987	L	88.3	Confident	80.6	Confident	23 Å²	23	57.2 Å²	57.2	12%	0.12	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	146.2	-173.3	-60.6	174.5	0	0	0	110.3	M985 L1000 Y1001 I1002 I1023 Y1036 I1043	M985-L987 HydrophobicContact CE-CD1 4.34Å; M985-L987 HydrophobicContact CE-CD2 4.13Å; M985-L987 HydrophobicContact CG-CD2 3.73Å; M985-L987 HydrophobicContact CG-CG 4.28Å; M985-L987 HydrophobicContact SD-CD2 4Å; L987-L1000 HydrophobicContact CB-CD1 3.92Å; L987-L1000 HydrophobicContact CB-CG 4.26Å; L987-L1000 HydrophobicContact CD1-CD2 3.92Å; L987-L1000 HydrophobicContact CD1-CG 4.27Å; L987-Y1001 WeakPolarHBondContact CA-O 3.34Å; L987-I1002 HydrophobicContact CD2-CG1 4.11Å; L987-I1023 HydrophobicContact CD1-CD1 4.03Å; L987-I1023 HydrophobicContact CD2-CD1 3.64Å; L987-Y1036 PolarHBondContact O-OH 3.01Å; L987-Y1036 VanDerWaalsContact O-OH 3.11Å; L987-I1043 HydrophobicContact CD1-CD1 3.48Å; L987-I1043 VanDerWaalsContact CD1-CD1 3.48Å
988	I	85.4	Confident	80.1	Confident	22 Å²	22	57 Å²	57	11%	0.113	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	149.2	177.7	-166.1	157.6	0	0	0	110.3	H992 T993 Y1001 Q1003 I1065 F1067	I988-H992 HydrophobicContact CG1-CB 4.43Å; I988-T993 HydrophobicContact CB-CG2 4.43Å; I988-T993 HydrophobicContact CD1-CG2 3.76Å; I988-T993 HydrophobicContact CG1-CG2 3.9Å; I988-T993 HydrophobicContact CG2-CG2 3.66Å; I988-Y1001 PolarHBondContact N-O 3.21Å; I988-Y1001 PolarHBondContact O-N 2.94Å; I988-Q1003 HydrophobicContact CB-CB 4.14Å; I988-Q1003 HydrophobicContact CB-CG 4.44Å; I988-Q1003 HydrophobicContact CG2-CB 3.85Å; I988-Q1003 HydrophobicContact CG2-CG 4.16Å; I988-I1065 HydrophobicContact CG2-CG2 3.98Å; I988-F1067 HydrophobicContact CD1-CE2 4.4Å
989	D	85	Confident	80	Confident	25 Å²	25	53.3 Å²	53.3	13%	0.134	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	129.9	167.2	-160.9	-47.8	0	0	0	109	M991 H992 G999 Y1036	D989-M991 PolarHBondContact O-N 3.22Å; D989-M991 VanDerWaalsContact O-N 3.14Å; D989-M991 WeakPolarHBondContact OD1-CB 3.28Å; D989-M991 WeakPolarHBondContact OD1-CG 3.41Å; D989-M991 PolarHBondContact OD1-N 3.24Å; D989-H992 PolarHBondContact O-N 2.89Å; D989-G999 WeakPolarHBondContact CA-O 3.39Å; D989-Y1036 HydrophobicContact CB-CD2 4.12Å; D989-Y1036 HydrophobicContact CB-CG 4.41Å
990	G	80.3	Confident	80.3	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-59.2	-25.3	178.8	0	0	0	0	0	113.2	H992 T993 G996 A997 G999	G990-H992 PolarHBondContact O-N 3.17Å; G990-T993 PolarHBondContact O-N 3.37Å; G990-T993 VanDerWaalsContact O-N 3.12Å; G990-T993 PolarHBondContact O-OG1 3Å; G990-G996 PolarHBondContact O-N 2.81Å; G990-A997 CarbonylContact C-O 3.6Å; G990-A997 WeakPolarHBondContact CA-O 3.23Å; G990-G999 PolarHBondContact N-O 2.92Å
991	M	77.9	Confident	81.2	Confident	102 Å²	102	46.4 Å²	46.4	50%	0.502	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-63.7	-19.3	171.7	-61.4	-55.5	-60.3	0	0	113.9	D989 A997 P998	D989-M991 PolarHBondContact O-N 3.22Å; D989-M991 VanDerWaalsContact O-N 3.14Å; D989-M991 WeakPolarHBondContact OD1-CB 3.28Å; D989-M991 WeakPolarHBondContact OD1-CG 3.41Å; D989-M991 PolarHBondContact OD1-N 3.24Å; M991-A997 PolarHBondContact N-O 3.04Å; M991-P998 HydrophobicContact CG-CB 4.18Å; M991-P998 HydrophobicContact SD-CB 3.96Å; M991-P998 HydrophobicContact SD-CG 4.39Å
992	H	74.5	Confident	82.2	Confident	135 Å²	135	41 Å²	41	63%	0.625	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-102.9	15.9	176.7	-61.4	-39.2	0	0	0	112.8	I988 D989 G990 F1067	I988-H992 HydrophobicContact CG1-CB 4.43Å; D989-H992 PolarHBondContact O-N 2.89Å; G990-H992 PolarHBondContact O-N 3.17Å; H992-F1067 WeakPolarHBondContact O-CE2 3.05Å
993	T	77.3	Confident	82.4	Confident	15 Å²	15	42.4 Å²	42.4	9%	0.092	24%	0.235	C	C	.	.	S	Bend	trans	-124.5	174.9	177.3	72.2	0	0	0	0	111.2	I988 G990 L995 G996 I1065	I988-T993 HydrophobicContact CB-CG2 4.43Å; I988-T993 HydrophobicContact CD1-CG2 3.76Å; I988-T993 HydrophobicContact CG1-CG2 3.9Å; I988-T993 HydrophobicContact CG2-CG2 3.66Å; G990-T993 PolarHBondContact O-N 3.37Å; G990-T993 VanDerWaalsContact O-N 3.12Å; G990-T993 PolarHBondContact O-OG1 3Å; T993-L995 PolarHBondContact O-N 2.86Å; T993-L995 VanDerWaalsContact O-N 3.08Å; T993-L995 VanDerWaalsContact OG1-CB 3.28Å; T993-L995 WeakPolarHBondContact OG1-CB 3.21Å; T993-L995 PolarHBondContact OG1-N 3.01Å; T993-G996 PolarHBondContact O-N 2.84Å; T993-I1065 HydrophobicContact CG2-CG1 4.34Å; T993-I1065 HydrophobicContact CG2-CG2 4.49Å
994	R	72.2	Confident	82.5	Confident	194 Å²	194	44.6 Å²	44.6	73%	0.732	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	2.3	174.2	-55.8	179.7	172.5	-151.6	-6.5	113.4	K1064	R994-K1064 HydrophobicContact CB-CB 4.36Å; R994-K1064 WeakPolarHBondContact CB-O 3.07Å; R994-K1064 PolarHBondContact N-O 3.42Å
995	L	76.5	Confident	82.7	Confident	39 Å²	39	46 Å²	46	20%	0.204	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-32.9	172.9	-167.1	68.5	0	0	0	112	T993 A997 Y1001 T1061 K1064 I1065	T993-L995 PolarHBondContact O-N 2.86Å; T993-L995 VanDerWaalsContact O-N 3.08Å; T993-L995 VanDerWaalsContact OG1-CB 3.28Å; T993-L995 WeakPolarHBondContact OG1-CB 3.21Å; T993-L995 PolarHBondContact OG1-N 3.01Å; L995-A997 HydrophobicContact CD2-CB 4.22Å; L995-A997 HydrophobicContact CG-CB 4.06Å; L995-A997 PolarHBondContact O-N 3.43Å; L995-A997 VanDerWaalsContact O-N 3.11Å; L995-Y1001 HydrophobicContact CD2-CD1 4.35Å; L995-Y1001 HydrophobicContact CD2-CD2 4.48Å; L995-Y1001 HydrophobicContact CD2-CE1 3.66Å; L995-Y1001 HydrophobicContact CD2-CE2 3.86Å; L995-Y1001 WeakPolarHBondContact CD2-OH 3.41Å; L995-T1061 HydrophobicContact CD1-CG2 3.98Å; L995-T1061 HydrophobicContact CD2-CG2 3.93Å; L995-K1064 HydrophobicContact CB-CB 4.19Å; L995-K1064 HydrophobicContact CD1-CB 4.16Å; L995-K1064 HydrophobicContact CD1-CD 3.89Å; L995-I1065 HydrophobicContact CD2-CD1 4.21Å; L995-I1065 HydrophobicContact CD2-CG1 4.42Å
996	G	74.1	Confident	82.6	Confident	50 Å²	50	49.1 Å²	49.1	52%	0.515	27%	0.27	S	S	.	.			trans	62.8	13.7	178.4	0	0	0	0	0	115.6	G990 T993	G990-G996 PolarHBondContact O-N 2.81Å; T993-G996 PolarHBondContact O-N 2.84Å
997	A	79.9	Confident	82.4	Confident	32 Å²	32	54 Å²	54	26%	0.264	30%	0.298	S	S	.	.			trans	-113.8	138.5	-173.3	0	0	0	0	0	111.8	G990 M991 L995 G999	G990-A997 CarbonylContact C-O 3.6Å; G990-A997 WeakPolarHBondContact CA-O 3.23Å; M991-A997 PolarHBondContact N-O 3.04Å; L995-A997 HydrophobicContact CD2-CB 4.22Å; L995-A997 HydrophobicContact CG-CB 4.06Å; L995-A997 PolarHBondContact O-N 3.43Å; L995-A997 VanDerWaalsContact O-N 3.11Å; A997-G999 PolarHBondContact O-N 3.31Å
998	P	77	Confident	81.9	Confident	91 Å²	91	57 Å²	57	59%	0.591	33%	0.334	S	S	*	.			trans	-74.3	124.1	-175.4	28.5	-34.2	0	0	0	111.9	M991 R1022	M991-P998 HydrophobicContact CG-CB 4.18Å; M991-P998 HydrophobicContact SD-CB 3.96Å; M991-P998 HydrophobicContact SD-CG 4.39Å; P998-R1022 VanDerWaalsContact O-CZ 3.23Å; P998-R1022 PolarHBondContact O-NH1 3.33Å; P998-R1022 PolarHBondContact O-NH2 2.74Å
999	G	83.3	Confident	82	Confident	15 Å²	15	56.7 Å²	56.7	16%	0.155	33%	0.334	C	S	.	.	S	Bend	trans	166.4	164.7	178.9	0	0	0	0	0	112.5	D989 G990 A997 Y1001	D989-G999 WeakPolarHBondContact CA-O 3.39Å; G990-G999 PolarHBondContact N-O 2.92Å; A997-G999 PolarHBondContact O-N 3.31Å; G999-Y1001 WeakPolarHBondContact O-CD2 3.45Å; G999-Y1001 WeakPolarHBondContact O-CE2 3.42Å
1000	L	88.1	Confident	82	Confident	9 Å²	9	57.4 Å²	57.4	5%	0.047	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.9	176.8	-169.2	67.4	0	0	0	109.8	L987 I1023 L1031 Y1036 A1039 I1043	L987-L1000 HydrophobicContact CB-CD1 3.92Å; L987-L1000 HydrophobicContact CB-CG 4.26Å; L987-L1000 HydrophobicContact CD1-CD2 3.92Å; L987-L1000 HydrophobicContact CD1-CG 4.27Å; L1000-I1023 HydrophobicContact CD2-CD1 4.48Å; L1000-I1023 PolarHBondContact O-N 2.86Å; L1000-L1031 HydrophobicContact CB-CD1 4.32Å; L1000-L1031 HydrophobicContact CD2-CD1 3.66Å; L1000-Y1036 HydrophobicContact CD1-CD2 3.45Å; L1000-Y1036 VanDerWaalsContact CD1-CD2 3.45Å; L1000-Y1036 HydrophobicContact CD1-CE2 3.66Å; L1000-A1039 HydrophobicContact CD2-CB 3.85Å; L1000-I1043 HydrophobicContact CD2-CD1 3.92Å
1001	Y	89.9	Confident	82.4	Confident	13 Å²	13	57.4 Å²	57.4	5%	0.051	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	148.8	-171.5	-65.6	-92.6	0	0	0	112.6	L987 I988 L995 G999 Q1003 G1020 D1021 R1022 T1061 I1065	L987-Y1001 WeakPolarHBondContact CA-O 3.34Å; I988-Y1001 PolarHBondContact N-O 3.21Å; I988-Y1001 PolarHBondContact O-N 2.94Å; L995-Y1001 HydrophobicContact CD2-CD1 4.35Å; L995-Y1001 HydrophobicContact CD2-CD2 4.48Å; L995-Y1001 HydrophobicContact CD2-CE1 3.66Å; L995-Y1001 HydrophobicContact CD2-CE2 3.86Å; L995-Y1001 WeakPolarHBondContact CD2-OH 3.41Å; G999-Y1001 WeakPolarHBondContact O-CD2 3.45Å; G999-Y1001 WeakPolarHBondContact O-CE2 3.42Å; Y1001-Q1003 PolarHBondContact O-N 3.13Å; Y1001-G1020 WeakPolarHBondContact CD1-O 3.32Å; Y1001-D1021 CarbonylContact C-O 3.58Å; Y1001-D1021 WeakPolarHBondContact CA-O 3.33Å; Y1001-R1022 HydrophobicContact CD1-CB 3.76Å; Y1001-R1022 HydrophobicContact CD1-CG 4.18Å; Y1001-R1022 HydrophobicContact CE1-CB 3.6Å; Y1001-R1022 HydrophobicContact CE1-CG 3.84Å; Y1001-R1022 PolarHBondContact OH-NH1 2.85Å; Y1001-T1061 HydrophobicContact CE1-CG2 4.3Å; Y1001-I1065 HydrophobicContact CD1-CD1 3.49Å; Y1001-I1065 VanDerWaalsContact CD1-CD1 3.49Å; Y1001-I1065 HydrophobicContact CE1-CD1 4.19Å; Y1001-I1065 HydrophobicContact CG-CD1 3.71Å; Y1001-I1065 HydrophobicContact CG-CG1 4.49Å
1002	I	90.9	Very high	82.8	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	107.6	176.1	-58.8	-174.7	0	0	0	109.7	M985 L987 L1005 L1017 L1019 G1020 D1021	M985-I1002 HydrophobicContact CG-CD1 4.34Å; M985-I1002 HydrophobicContact CG-CG1 4.18Å; M985-I1002 HydrophobicContact CG-CG2 4.15Å; M985-I1002 HydrophobicContact SD-CD1 3.49Å; M985-I1002 WeakPolarHBondContact SD-CD1 3.14Å; M985-I1002 HydrophobicContact SD-CG1 3.72Å; L987-I1002 HydrophobicContact CD2-CG1 4.11Å; I1002-L1005 HydrophobicContact CG2-CD1 4.3Å; I1002-L1005 HydrophobicContact CG2-CD2 3.97Å; I1002-L1005 HydrophobicContact CG2-CG 3.83Å; I1002-L1017 HydrophobicContact CD1-CB 4.11Å; I1002-L1017 HydrophobicContact CD1-CD1 4.48Å; I1002-L1017 HydrophobicContact CD1-CD2 4.07Å; I1002-L1017 HydrophobicContact CD1-CG 4.45Å; I1002-L1019 HydrophobicContact CG2-CD2 4.23Å; I1002-G1020 PolarHBondContact O-N 3.17Å; I1002-D1021 HydrophobicContact CD1-CB 4.08Å; I1002-D1021 HydrophobicContact CG1-CB 4.41Å; I1002-D1021 PolarHBondContact N-O 3.33Å
1003	Q	88.6	Confident	83.3	Confident	52 Å²	52	51.8 Å²	51.8	24%	0.243	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	-43.1	175.9	-162.8	-172.8	24.8	0	0	111.7	G986 I988 Y1001 I1065 H1066	G986-Q1003 PolarHBondContact O-N 2.97Å; I988-Q1003 HydrophobicContact CB-CB 4.14Å; I988-Q1003 HydrophobicContact CB-CG 4.44Å; I988-Q1003 HydrophobicContact CG2-CB 3.85Å; I988-Q1003 HydrophobicContact CG2-CG 4.16Å; Y1001-Q1003 PolarHBondContact O-N 3.13Å; Q1003-I1065 HydrophobicContact CG-CG2 4.49Å; Q1003-H1066 PolarHBondContact O-CE1 3.26Å; Q1003-H1066 VanDerWaalsContact O-CE1 3.28Å
1004	T	86.8	Confident	83.6	Confident	60 Å²	60	53.2 Å²	53.2	37%	0.368	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	151.3	-176.6	61.8	0	0	0	0	111.9	G986	G986-T1004 WeakPolarHBondContact CA-OG1 3.22Å; G986-T1004 PolarHBondContact N-O 3.47Å; G986-T1004 PolarHBondContact O-N 3.35Å
1005	L	87.8	Confident	84.1	Confident	38 Å²	38	46.8 Å²	46.8	20%	0.199	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	119.2	171.4	-69.5	168.4	0	0	0	107.5	M985 I1002 A1011 A1012 L1017 L1019	M985-L1005 HydrophobicContact CB-CD2 4.14Å; M985-L1005 HydrophobicContact CG-CD2 3.99Å; I1002-L1005 HydrophobicContact CG2-CD1 4.3Å; I1002-L1005 HydrophobicContact CG2-CD2 3.97Å; I1002-L1005 HydrophobicContact CG2-CG 3.83Å; L1005-A1011 HydrophobicContact CD2-CB 3.73Å; L1005-A1012 HydrophobicContact CB-CB 4.47Å; L1005-L1017 HydrophobicContact CD1-CB 4.29Å; L1005-L1019 HydrophobicContact CB-CD2 4.13Å; L1005-L1019 HydrophobicContact CD1-CD2 4.08Å; L1005-L1019 HydrophobicContact CG-CD2 3.89Å
1006	L	84.8	Confident	84.5	Confident	95 Å²	95	50.4 Å²	50.4	50%	0.497	35%	0.346	S	S	.	.			trans	-76.1	126.2	-177.2	-62.9	-176.9	0	0	0	110.1	G984 G1008 S1009 A1012	G984-L1006 PolarHBondContact O-N 3.21Å; L1006-G1008 PolarHBondContact O-N 3.01Å; L1006-S1009 WeakPolarHBondContact O-CB 3.42Å; L1006-S1009 PolarHBondContact O-N 3.15Å; L1006-S1009 VanDerWaalsContact O-N 3.1Å; L1006-S1009 PolarHBondContact O-OG 2.97Å; L1006-A1012 WeakPolarHBondContact O-CB 3.27Å
1007	P	81.3	Confident	85.2	Confident	125 Å²	125	48.4 Å²	48.4	81%	0.812	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	136.8	176.5	-27.5	35.8	0	0	0	112.3	S1009	P1007-S1009 PolarHBondContact O-N 2.82Å
1008	G	78.1	Confident	85.6	Confident	85 Å²	85	49.2 Å²	49.2	88%	0.876	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.6	2.1	-177.9	0	0	0	0	0	115.8	L1006	L1006-G1008 PolarHBondContact O-N 3.01Å
1009	S	87.4	Confident	86.1	Confident	15 Å²	15	48.2 Å²	48.2	11%	0.105	32%	0.316	C	S	.	.	S	Bend	trans	-81.4	161.5	173.7	71.8	0	0	0	0	113.2	G984 L1006 P1007 A1011 A1012 A1013	G984-S1009 PolarHBondContact O-OG 3.48Å; L1006-S1009 WeakPolarHBondContact O-CB 3.42Å; L1006-S1009 PolarHBondContact O-N 3.15Å; L1006-S1009 VanDerWaalsContact O-N 3.1Å; L1006-S1009 PolarHBondContact O-OG 2.97Å; P1007-S1009 PolarHBondContact O-N 2.82Å; S1009-A1011 VanDerWaalsContact C-N 3.3Å; S1009-A1011 PolarHBondContact O-N 3.1Å; S1009-A1012 PolarHBondContact O-N 2.86Å; S1009-A1012 VanDerWaalsContact O-N 3.13Å; S1009-A1012 PolarHBondContact OG-N 2.89Å; S1009-A1013 WeakPolarHBondContact O-CB 3.43Å; S1009-A1013 PolarHBondContact O-N 3.19Å
1010	P	86.3	Confident	86.2	Confident	40 Å²	40	47.5 Å²	47.5	26%	0.26	31%	0.309	S	S	.	.	H	α-helix	trans	-54.5	-41.1	175.7	-27.1	35.3	0	0	0	113.9	E977 A1012 A1013 D1014	E977-P1010 WeakPolarHBondContact O-CB 3.37Å; E977-P1010 WeakPolarHBondContact O-CG 3.37Å; P1010-A1012 PolarHBondContact O-N 2.81Å; P1010-A1013 PolarHBondContact O-N 2.93Å; P1010-D1014 PolarHBondContact O-N 3.03Å
1011	A	87.6	Confident	86.4	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.6	-31.7	179.2	0	0	0	0	0	113.3	L976 L983 M985 L1005 S1009 L1017	L976-A1011 HydrophobicContact CD1-CB 3.8Å; L983-A1011 VanDerWaalsContact O-CB 3.24Å; L983-A1011 WeakPolarHBondContact O-CB 3.5Å; L983-A1011 PolarHBondContact O-N 3.27Å; L983-A1011 VanDerWaalsContact O-N 3.1Å; M985-A1011 HydrophobicContact CB-CB 3.85Å; L1005-A1011 HydrophobicContact CD2-CB 3.73Å; S1009-A1011 VanDerWaalsContact C-N 3.3Å; S1009-A1011 PolarHBondContact O-N 3.1Å; A1011-L1017 HydrophobicContact CB-CD1 4.09Å
1012	A	85.8	Confident	86.5	Confident	36 Å²	36	49.1 Å²	49.1	30%	0.298	31%	0.314	S	S	.	.	H	α-helix	trans	-78.5	-32	173.2	0	0	0	0	0	112.5	L1005 L1006 S1009 P1010 G1015	L1005-A1012 HydrophobicContact CB-CB 4.47Å; L1006-A1012 WeakPolarHBondContact O-CB 3.27Å; S1009-A1012 PolarHBondContact O-N 2.86Å; S1009-A1012 VanDerWaalsContact O-N 3.13Å; S1009-A1012 PolarHBondContact OG-N 2.89Å; P1010-A1012 PolarHBondContact O-N 2.81Å; A1012-G1015 PolarHBondContact O-N 3.37Å
1013	A	84.8	Confident	86.5	Confident	84 Å²	84	49.2 Å²	49.2	69%	0.694	32%	0.315	S	S	*	.	H	α-helix	trans	-73.9	-25	-178.2	0	0	0	0	0	114	S1009 P1010 G1015	S1009-A1013 WeakPolarHBondContact O-CB 3.43Å; S1009-A1013 PolarHBondContact O-N 3.19Å; P1010-A1013 PolarHBondContact O-N 2.93Å; A1013-G1015 VanDerWaalsContact C-N 3.27Å; A1013-G1015 PolarHBondContact O-N 3.41Å
1014	D	84.6	Confident	86.6	Confident	44 Å²	44	48.2 Å²	48.2	24%	0.235	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-27.1	172.1	176.5	83.7	0	0	0	112.8	V974 L976 P1010 R1016	V974-D1014 HydrophobicContact CG1-CB 4.4Å; L976-D1014 HydrophobicContact CD2-CB 3.86Å; P1010-D1014 PolarHBondContact O-N 3.03Å; D1014-R1016 PolarHBondContact O-N 2.99Å; D1014-R1016 IonicContact OD1-CZ 3.14Å; D1014-R1016 VanDerWaalsContact OD1-CZ 3.32Å; D1014-R1016 IonicContact OD1-NE 2.69Å; D1014-R1016 PolarHBondContact OD1-NE 3.25Å; D1014-R1016 VanDerWaalsContact OD1-NE 3.1Å; D1014-R1016 IonicContact OD1-NH2 2.74Å; D1014-R1016 PolarHBondContact OD1-NH2 3.4Å; D1014-R1016 VanDerWaalsContact OD2-CB 3.3Å; D1014-R1016 WeakPolarHBondContact OD2-CB 3.36Å; D1014-R1016 IonicContact OD2-CZ 3.32Å; D1014-R1016 PolarHBondContact OD2-N 3.01Å; D1014-R1016 IonicContact OD2-NE 3.1Å; D1014-R1016 PolarHBondContact OD2-NE 3.3Å; D1014-R1016 IonicContact OD2-NH2 2.7Å
1015	G	81.7	Confident	86.8	Confident	60 Å²	60	48.3 Å²	48.3	62%	0.619	31%	0.307	S	S	*	.			trans	69.4	-14.8	173.3	0	0	0	0	0	116.8	A1012 A1013	A1012-G1015 PolarHBondContact O-N 3.37Å; A1013-G1015 VanDerWaalsContact C-N 3.27Å; A1013-G1015 PolarHBondContact O-N 3.41Å
1016	R	85.3	Confident	86.9	Confident	114 Å²	114	46.7 Å²	46.7	43%	0.43	30%	0.299	S	S	.	.	S	Bend	trans	-85.5	-28.1	179.6	-56	174.5	-71.5	161.6	-9.5	112.8	F972 T973 D1014 K1056	F972-R1016 HydrophobicContact CD2-CB 4.4Å; F972-R1016 HydrophobicContact CE2-CB 3.78Å; T973-R1016 PolarHBondContact O-NH1 3.26Å; D1014-R1016 PolarHBondContact O-N 2.99Å; D1014-R1016 IonicContact OD1-CZ 3.14Å; D1014-R1016 VanDerWaalsContact OD1-CZ 3.32Å; D1014-R1016 IonicContact OD1-NE 2.69Å; D1014-R1016 PolarHBondContact OD1-NE 3.25Å; D1014-R1016 VanDerWaalsContact OD1-NE 3.1Å; D1014-R1016 IonicContact OD1-NH2 2.74Å; D1014-R1016 PolarHBondContact OD1-NH2 3.4Å; D1014-R1016 VanDerWaalsContact OD2-CB 3.3Å; D1014-R1016 WeakPolarHBondContact OD2-CB 3.36Å; D1014-R1016 IonicContact OD2-CZ 3.32Å; D1014-R1016 PolarHBondContact OD2-N 3.01Å; D1014-R1016 IonicContact OD2-NE 3.1Å; D1014-R1016 PolarHBondContact OD2-NE 3.3Å; D1014-R1016 IonicContact OD2-NH2 2.7Å; R1016-K1056 PolarHBondContact O-NZ 3.49Å
1017	L	89	Confident	87	Confident	9 Å²	9	45.6 Å²	45.6	5%	0.047	29%	0.294	C	S	.	.			trans	-70.6	143.7	172.8	-61.6	179.2	0	0	0	110.9	F972 V974 L976 M985 I1002 L1005 A1011 V1054	F972-L1017 HydrophobicContact CE2-CD2 4.28Å; F972-L1017 HydrophobicContact CZ-CD2 4.31Å; V974-L1017 HydrophobicContact CB-CD2 4.39Å; V974-L1017 HydrophobicContact CG1-CD1 4.35Å; V974-L1017 HydrophobicContact CG1-CG 4.39Å; V974-L1017 HydrophobicContact CG2-CD2 3.79Å; V974-L1017 HydrophobicContact CG2-CG 4.26Å; L976-L1017 HydrophobicContact CD1-CD1 4.03Å; M985-L1017 HydrophobicContact SD-CD1 4.16Å; I1002-L1017 HydrophobicContact CD1-CB 4.11Å; I1002-L1017 HydrophobicContact CD1-CD1 4.48Å; I1002-L1017 HydrophobicContact CD1-CD2 4.07Å; I1002-L1017 HydrophobicContact CD1-CG 4.45Å; L1005-L1017 HydrophobicContact CD1-CB 4.29Å; A1011-L1017 HydrophobicContact CB-CD1 4.09Å; L1017-V1054 HydrophobicContact CD2-CB 4.45Å; L1017-V1054 HydrophobicContact CD2-CG1 4.21Å; L1017-V1054 HydrophobicContact CD2-CG2 3.91Å
1018	S	88.3	Confident	87	Confident	48 Å²	48	42.4 Å²	42.4	34%	0.336	28%	0.283	S	S	.	.			trans	-142.6	161	176.5	-55.2	0	0	0	0	112	G1020 D1021 K1056	S1018-G1020 PolarHBondContact O-N 3.21Å; S1018-D1021 PolarHBondContact N-OD2 2.93Å; S1018-D1021 WeakPolarHBondContact O-CB 3.33Å; S1018-D1021 PolarHBondContact O-N 3.38Å; S1018-K1056 PolarHBondContact OG-NZ 3.11Å
1019	L	87.9	Confident	87.4	Confident	70 Å²	70	41.1 Å²	41.1	37%	0.366	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	130.2	176.3	-50.3	-179.7	0	0	0	109.1	I1002 L1005 A1062	I1002-L1019 HydrophobicContact CG2-CD2 4.23Å; L1005-L1019 HydrophobicContact CB-CD2 4.13Å; L1005-L1019 HydrophobicContact CD1-CD2 4.08Å; L1005-L1019 HydrophobicContact CG-CD2 3.89Å; L1019-A1062 VanDerWaalsContact O-CB 3.23Å; L1019-A1062 WeakPolarHBondContact O-CB 3.24Å
1020	G	86.3	Confident	87.2	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	98.1	-19.1	-174.5	0	0	0	0	0	115.5	Y1001 I1002 S1018 S1057 I1065	Y1001-G1020 WeakPolarHBondContact CD1-O 3.32Å; I1002-G1020 PolarHBondContact O-N 3.17Å; S1018-G1020 PolarHBondContact O-N 3.21Å; G1020-S1057 WeakPolarHBondContact O-CB 3.47Å; G1020-S1057 PolarHBondContact O-OG 3.24Å; G1020-S1057 VanDerWaalsContact O-OG 3.14Å; G1020-I1065 WeakPolarHBondContact O-CD1 3.41Å
1021	D	92.1	Very high	87.1	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-63.1	148.9	-178.5	-70	-25.9	0	0	0	112.4	Y1001 I1002 S1018 V1054 K1056 S1057	Y1001-D1021 CarbonylContact C-O 3.58Å; Y1001-D1021 WeakPolarHBondContact CA-O 3.33Å; I1002-D1021 HydrophobicContact CD1-CB 4.08Å; I1002-D1021 HydrophobicContact CG1-CB 4.41Å; I1002-D1021 PolarHBondContact N-O 3.33Å; S1018-D1021 PolarHBondContact N-OD2 2.93Å; S1018-D1021 WeakPolarHBondContact O-CB 3.33Å; S1018-D1021 PolarHBondContact O-N 3.38Å; D1021-V1054 HydrophobicContact CB-CG1 3.73Å; D1021-K1056 WeakPolarHBondContact OD1-CA 3.5Å; D1021-K1056 WeakPolarHBondContact OD1-CD 3.46Å; D1021-K1056 WeakPolarHBondContact OD1-CE 3.49Å; D1021-K1056 IonicContact OD1-NZ 2.68Å; D1021-K1056 PolarHBondContact OD1-NZ 3.13Å; D1021-K1056 IonicContact OD2-NZ 2.85Å; D1021-K1056 PolarHBondContact OD2-NZ 3.3Å; D1021-S1057 PolarHBondContact OD1-N 3.2Å
1022	R	91.3	Very high	86.5	Confident	56 Å²	56	46.5 Å²	46.5	21%	0.211	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	126.4	-177.5	-175.4	-175.4	171.8	124.2	2.5	111.4	P998 Y1001 L1024 V1054 A1055	P998-R1022 VanDerWaalsContact O-CZ 3.23Å; P998-R1022 PolarHBondContact O-NH1 3.33Å; P998-R1022 PolarHBondContact O-NH2 2.74Å; Y1001-R1022 HydrophobicContact CD1-CB 3.76Å; Y1001-R1022 HydrophobicContact CD1-CG 4.18Å; Y1001-R1022 HydrophobicContact CE1-CB 3.6Å; Y1001-R1022 HydrophobicContact CE1-CG 3.84Å; Y1001-R1022 PolarHBondContact OH-NH1 2.85Å; R1022-L1024 HydrophobicContact CG-CD2 4.14Å; R1022-V1054 CarbonylContact O-C 3.55Å; R1022-V1054 WeakPolarHBondContact O-CA 2.91Å; R1022-A1055 HydrophobicContact CB-CB 4.38Å; R1022-A1055 PolarHBondContact N-O 2.99Å; R1022-A1055 PolarHBondContact O-N 3.11Å
1023	I	91.4	Very high	85.6	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	124.2	171.1	-53.2	-178.2	0	0	0	108.9	M985 L987 L1000 V1026 L1031 I1043 F1052	M985-I1023 HydrophobicContact CE-CD1 3.66Å; M985-I1023 HydrophobicContact SD-CD1 4.18Å; L987-I1023 HydrophobicContact CD1-CD1 4.03Å; L987-I1023 HydrophobicContact CD2-CD1 3.64Å; L1000-I1023 HydrophobicContact CD2-CD1 4.48Å; L1000-I1023 PolarHBondContact O-N 2.86Å; I1023-V1026 HydrophobicContact CG2-CG2 4.13Å; I1023-L1031 HydrophobicContact CB-CD1 4.17Å; I1023-L1031 HydrophobicContact CG2-CD1 3.7Å; I1023-I1043 HydrophobicContact CD1-CD1 4.46Å; I1023-F1052 HydrophobicContact CD1-CD1 4.15Å; I1023-F1052 HydrophobicContact CD1-CE1 4.34Å; I1023-F1052 HydrophobicContact CG2-CD1 3.96Å
1024	L	89.5	Confident	85.2	Confident	31 Å²	31	48.1 Å²	48.1	16%	0.162	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-39.7	176.8	-59.2	-174.4	0	0	0	112.1	V971 R1022 L1031 L1032 L1053 A1055	V971-L1024 HydrophobicContact CG1-CD1 4.02Å; V971-L1024 HydrophobicContact CG2-CD1 4.13Å; R1022-L1024 HydrophobicContact CG-CD2 4.14Å; L1024-L1031 WeakPolarHBondContact O-CB 3.37Å; L1024-L1031 PolarHBondContact O-N 3.48Å; L1024-L1032 HydrophobicContact CD2-CD2 4.31Å; L1024-L1053 HydrophobicContact CB-CB 4.42Å; L1024-L1053 HydrophobicContact CB-CD2 4.27Å; L1024-L1053 HydrophobicContact CB-CG 4.44Å; L1024-L1053 HydrophobicContact CD1-CD2 4.32Å; L1024-L1053 PolarHBondContact N-O 2.86Å; L1024-A1055 HydrophobicContact CD1-CB 4.06Å; L1024-A1055 HydrophobicContact CD2-CB 4.3Å; L1024-A1055 HydrophobicContact CG-CB 4.14Å
1025	E	91.1	Very high	84.6	Confident	62 Å²	62	48.3 Å²	48.3	29%	0.29	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	155.6	-176.7	-47.6	-162.2	141.3	0	0	113	S1029 F1052 L1053	E1025-S1029 WeakPolarHBondContact CA-O 3.3Å; E1025-F1052 WeakPolarHBondContact O-CA 3.42Å; E1025-L1053 HydrophobicContact CB-CB 3.77Å; E1025-L1053 HydrophobicContact CG-CB 3.91Å; E1025-L1053 HydrophobicContact CG-CD2 3.85Å; E1025-L1053 PolarHBondContact N-O 3.29Å; E1025-L1053 PolarHBondContact O-N 2.83Å
1026	V	90.4	Very high	84.6	Confident	3 Å²	3	49.1 Å²	49.1	2%	0.018	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	119.8	176.2	-176.8	0	0	0	0	109	I1023 G1028 S1029 L1031 I1043 M1050 R1051 F1052	I1023-V1026 HydrophobicContact CG2-CG2 4.13Å; V1026-G1028 PolarHBondContact O-N 2.79Å; V1026-G1028 VanDerWaalsContact O-N 3.13Å; V1026-S1029 PolarHBondContact N-O 2.72Å; V1026-S1029 WeakPolarHBondContact O-CB 3.36Å; V1026-S1029 PolarHBondContact O-N 2.78Å; V1026-L1031 HydrophobicContact CG2-CD1 3.82Å; V1026-L1031 HydrophobicContact CG2-CD2 4.03Å; V1026-L1031 HydrophobicContact CG2-CG 4.09Å; V1026-I1043 HydrophobicContact CB-CG1 4.49Å; V1026-I1043 HydrophobicContact CG1-CG1 3.98Å; V1026-I1043 HydrophobicContact CG2-CD1 4.06Å; V1026-I1043 HydrophobicContact CG2-CG1 3.74Å; V1026-M1050 HydrophobicContact CG1-CE 3.39Å; V1026-R1051 CarbonylContact C-O 3.51Å; V1026-R1051 WeakPolarHBondContact CA-O 3.3Å; V1026-F1052 HydrophobicContact CG1-CE1 4.16Å; V1026-F1052 HydrophobicContact CG2-CD1 3.97Å; V1026-F1052 HydrophobicContact CG2-CE1 3.93Å
1027	N	87.3	Confident	84.4	Confident	73 Å²	73	50 Å²	50	39%	0.39	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	32.7	-176.6	-66.2	-11.2	0	0	0	113.9	S1029 G1046 M1050 R1051	N1027-S1029 VanDerWaalsContact C-N 3.31Å; N1027-G1046 PolarHBondContact ND2-O 3.43Å; N1027-M1050 WeakPolarHBondContact OD1-CA 3.34Å; N1027-R1051 PolarHBondContact N-O 2.88Å; N1027-R1051 PolarHBondContact OD1-N 2.8Å
1028	G	82	Confident	83.9	Confident	58 Å²	58	58.4 Å²	58.4	60%	0.598	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	9.1	-175.8	0	0	0	0	0	114.9	V1026	V1026-G1028 PolarHBondContact O-N 2.79Å; V1026-G1028 VanDerWaalsContact O-N 3.13Å
1029	S	84.8	Confident	83.5	Confident	57 Å²	57	56.1 Å²	56.1	40%	0.399	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	118.8	166.5	-59.1	0	0	0	0	109.4	E1025 V1026 N1027	E1025-S1029 WeakPolarHBondContact CA-O 3.3Å; V1026-S1029 PolarHBondContact N-O 2.72Å; V1026-S1029 WeakPolarHBondContact O-CB 3.36Å; V1026-S1029 PolarHBondContact O-N 2.78Å; N1027-S1029 VanDerWaalsContact C-N 3.31Å
1030	S	85.1	Confident	83.3	Confident	49 Å²	49	53.9 Å²	53.9	34%	0.343	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	139.3	179	-164.8	0	0	0	0	112.2	L1034	S1030-L1034 VanDerWaalsContact O-CD1 3.3Å; S1030-L1034 WeakPolarHBondContact O-CD1 3.38Å
1031	L	83.3	Confident	83.1	Confident	11 Å²	11	57.4 Å²	57.4	6%	0.058	33%	0.334	C	S	.	.			trans	-95.1	-3.2	175.7	-57.7	-171.6	0	0	0	113	L1000 I1023 L1024 V1026 G1033 L1034 A1039 L1042	L1000-L1031 HydrophobicContact CB-CD1 4.32Å; L1000-L1031 HydrophobicContact CD2-CD1 3.66Å; I1023-L1031 HydrophobicContact CB-CD1 4.17Å; I1023-L1031 HydrophobicContact CG2-CD1 3.7Å; L1024-L1031 WeakPolarHBondContact O-CB 3.37Å; L1024-L1031 PolarHBondContact O-N 3.48Å; V1026-L1031 HydrophobicContact CG2-CD1 3.82Å; V1026-L1031 HydrophobicContact CG2-CD2 4.03Å; V1026-L1031 HydrophobicContact CG2-CG 4.09Å; L1031-G1033 PolarHBondContact O-N 3.22Å; L1031-G1033 VanDerWaalsContact O-N 3.15Å; L1031-L1034 HydrophobicContact CD2-CD1 4.23Å; L1031-L1034 PolarHBondContact O-N 3.25Å; L1031-A1039 HydrophobicContact CD1-CB 4.09Å; L1031-A1039 HydrophobicContact CD2-CB 3.82Å; L1031-A1039 HydrophobicContact CG-CB 4.46Å; L1031-L1042 HydrophobicContact CD2-CD1 3.93Å
1032	L	75.5	Confident	82.7	Confident	108 Å²	108	60.4 Å²	60.4	57%	0.565	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	117.2	179.9	-63.3	179.1	0	0	0	110.3	L1024 L1034	L1024-L1032 HydrophobicContact CD2-CD2 4.31Å; L1032-L1034 VanDerWaalsContact C-N 3.3Å; L1032-L1034 PolarHBondContact O-N 3.27Å
1033	G	67.2	Low	82.4	Confident	85 Å²	85	58.6 Å²	58.6	88%	0.876	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	0.5	-175.4	0	0	0	0	0	115.5	L1031	L1031-G1033 PolarHBondContact O-N 3.22Å; L1031-G1033 VanDerWaalsContact O-N 3.15Å
1034	L	75.9	Confident	82	Confident	69 Å²	69	66.4 Å²	66.4	36%	0.361	37%	0.374	S	S	.	.			trans	-86.3	124.1	172.3	-65	-172.1	0	0	0	110.9	S1030 L1031 L1032 L1042	S1030-L1034 VanDerWaalsContact O-CD1 3.3Å; S1030-L1034 WeakPolarHBondContact O-CD1 3.38Å; L1031-L1034 HydrophobicContact CD2-CD1 4.23Å; L1031-L1034 PolarHBondContact O-N 3.25Å; L1032-L1034 VanDerWaalsContact C-N 3.3Å; L1032-L1034 PolarHBondContact O-N 3.27Å; L1034-L1042 HydrophobicContact CD1-CD1 3.88Å
1035	G	71.9	Confident	81.6	Confident	48 Å²	48	71.9 Å²	71.9	50%	0.495	40%	0.398	S	S	.	.			trans	-65.8	145	176	0	0	0	0	0	113	L1037 R1038 A1039	G1035-L1037 VanDerWaalsContact C-N 3.33Å; G1035-L1037 PolarHBondContact O-N 3.12Å; G1035-R1038 PolarHBondContact O-N 2.85Å; G1035-A1039 PolarHBondContact O-N 3.36Å
1036	Y	80.8	Confident	80.9	Confident	78 Å²	78	70.1 Å²	70.1	31%	0.306	40%	0.397	S	S	.	.	H	α-helix	trans	-34.6	-53.3	-173.5	178.9	-99.7	0	0	0	115.7	L987 D989 L1000 R1038 A1039 V1040	L987-Y1036 PolarHBondContact O-OH 3.01Å; L987-Y1036 VanDerWaalsContact O-OH 3.11Å; D989-Y1036 HydrophobicContact CB-CD2 4.12Å; D989-Y1036 HydrophobicContact CB-CG 4.41Å; L1000-Y1036 HydrophobicContact CD1-CD2 3.45Å; L1000-Y1036 VanDerWaalsContact CD1-CD2 3.45Å; L1000-Y1036 HydrophobicContact CD1-CE2 3.66Å; Y1036-R1038 PolarHBondContact O-N 3.48Å; Y1036-A1039 PolarHBondContact O-N 3.31Å; Y1036-V1040 HydrophobicContact CD1-CG2 4.32Å; Y1036-V1040 HydrophobicContact CD2-CG2 4.29Å; Y1036-V1040 HydrophobicContact CE1-CG2 3.92Å; Y1036-V1040 HydrophobicContact CE2-CG2 3.86Å; Y1036-V1040 HydrophobicContact CG-CG2 4.48Å; Y1036-V1040 WeakPolarHBondContact O-CG2 3.49Å; Y1036-V1040 PolarHBondContact O-N 3.28Å
1037	L	81.2	Confident	80.5	Confident	132 Å²	132	71.8 Å²	71.8	69%	0.691	41%	0.414	S	S	*	.	H	α-helix	trans	-57.9	-45.3	-177.1	-65.5	175.7	0	0	0	112.6	G1035 A1039 V1040 D1041	G1035-L1037 VanDerWaalsContact C-N 3.33Å; G1035-L1037 PolarHBondContact O-N 3.12Å; L1037-A1039 PolarHBondContact O-N 3.39Å; L1037-V1040 PolarHBondContact O-N 3.06Å; L1037-D1041 PolarHBondContact O-N 2.86Å
1038	R	79.1	Confident	80.2	Confident	185 Å²	185	75.5 Å²	75.5	70%	0.698	43%	0.427	S	S	*	.	H	α-helix	trans	-68.4	-34.9	178.6	-79.8	-170.3	165.5	-144.6	-5.6	112.5	G1035 Y1036 D1041 L1042	G1035-R1038 PolarHBondContact O-N 2.85Å; Y1036-R1038 PolarHBondContact O-N 3.48Å; R1038-D1041 PolarHBondContact O-N 3.44Å; R1038-L1042 WeakPolarHBondContact O-CG 3.45Å; R1038-L1042 PolarHBondContact O-N 2.89Å
1039	A	80.4	Confident	80.4	Confident	1 Å²	1	79.1 Å²	79.1	1%	0.008	43%	0.426	C	S	.	.	H	α-helix	trans	-67.5	-41.1	174.9	0	0	0	0	0	111.4	L1000 L1031 G1035 Y1036 L1037 D1041 L1042 I1043	L1000-A1039 HydrophobicContact CD2-CB 3.85Å; L1031-A1039 HydrophobicContact CD1-CB 4.09Å; L1031-A1039 HydrophobicContact CD2-CB 3.82Å; L1031-A1039 HydrophobicContact CG-CB 4.46Å; G1035-A1039 PolarHBondContact O-N 3.36Å; Y1036-A1039 PolarHBondContact O-N 3.31Å; L1037-A1039 PolarHBondContact O-N 3.39Å; A1039-D1041 VanDerWaalsContact C-N 3.34Å; A1039-L1042 PolarHBondContact O-N 3.32Å; A1039-I1043 WeakPolarHBondContact O-CG1 3.37Å; A1039-I1043 PolarHBondContact O-N 2.89Å; A1039-I1043 VanDerWaalsContact O-N 3.12Å
1040	V	82.9	Confident	80.6	Confident	23 Å²	23	76.4 Å²	76.4	14%	0.139	41%	0.407	C	S	.	.	H	α-helix	trans	-63.6	-38.3	171.9	169.9	0	0	0	0	111.5	Y1036 L1037 I1043 R1044	Y1036-V1040 HydrophobicContact CD1-CG2 4.32Å; Y1036-V1040 HydrophobicContact CD2-CG2 4.29Å; Y1036-V1040 HydrophobicContact CE1-CG2 3.92Å; Y1036-V1040 HydrophobicContact CE2-CG2 3.86Å; Y1036-V1040 HydrophobicContact CG-CG2 4.48Å; Y1036-V1040 WeakPolarHBondContact O-CG2 3.49Å; Y1036-V1040 PolarHBondContact O-N 3.28Å; L1037-V1040 PolarHBondContact O-N 3.06Å; V1040-I1043 CarbonylContact O-C 3.57Å; V1040-I1043 PolarHBondContact O-N 2.92Å; V1040-R1044 HydrophobicContact CG1-CG 4.26Å; V1040-R1044 WeakPolarHBondContact O-CB 3.43Å; V1040-R1044 VanDerWaalsContact O-CG 3.3Å; V1040-R1044 WeakPolarHBondContact O-CG 3.42Å; V1040-R1044 PolarHBondContact O-N 2.76Å
1041	D	82.8	Confident	80.8	Confident	74 Å²	74	80.6 Å²	80.6	40%	0.396	42%	0.416	S	S	.	.	H	α-helix	trans	-65.1	-40.6	175.9	-74.4	-33.5	0	0	0	112.6	L1037 R1038 A1039 I1043 R1044 H1045	L1037-D1041 PolarHBondContact O-N 2.86Å; R1038-D1041 PolarHBondContact O-N 3.44Å; A1039-D1041 VanDerWaalsContact C-N 3.34Å; D1041-I1043 VanDerWaalsContact C-N 3.29Å; D1041-I1043 PolarHBondContact O-N 2.84Å; D1041-R1044 PolarHBondContact O-N 3.21Å; D1041-H1045 WeakPolarHBondContact O-CB 3.33Å; D1041-H1045 PolarHBondContact O-N 2.85Å; D1041-H1045 PolarHBondContact O-ND1 2.92Å
1042	L	83.8	Confident	81.3	Confident	64 Å²	64	80.1 Å²	80.1	34%	0.335	41%	0.413	S	S	.	.	H	α-helix	trans	-59.1	-41.9	171.5	-71.3	170.3	0	0	0	111.2	L1031 L1034 R1038 A1039 G1046	L1031-L1042 HydrophobicContact CD2-CD1 3.93Å; L1034-L1042 HydrophobicContact CD1-CD1 3.88Å; R1038-L1042 WeakPolarHBondContact O-CG 3.45Å; R1038-L1042 PolarHBondContact O-N 2.89Å; A1039-L1042 PolarHBondContact O-N 3.32Å; L1042-G1046 WeakPolarHBondContact O-CA 3.24Å; L1042-G1046 PolarHBondContact O-N 2.81Å
1043	I	84.7	Confident	82	Confident	18 Å²	18	77.2 Å²	77.2	9%	0.092	40%	0.398	C	S	.	.	H	α-helix	trans	-69.8	-33.2	177.5	-64.6	172.9	0	0	0	111.9	R978 L983 L987 L1000 I1023 V1026 A1039 V1040 D1041 F1052	R978-I1043 PolarHBondContact NH2-O 3.22Å; L983-I1043 HydrophobicContact CD1-CG2 3.97Å; L987-I1043 HydrophobicContact CD1-CD1 3.48Å; L987-I1043 VanDerWaalsContact CD1-CD1 3.48Å; L1000-I1043 HydrophobicContact CD2-CD1 3.92Å; I1023-I1043 HydrophobicContact CD1-CD1 4.46Å; V1026-I1043 HydrophobicContact CB-CG1 4.49Å; V1026-I1043 HydrophobicContact CG1-CG1 3.98Å; V1026-I1043 HydrophobicContact CG2-CD1 4.06Å; V1026-I1043 HydrophobicContact CG2-CG1 3.74Å; A1039-I1043 WeakPolarHBondContact O-CG1 3.37Å; A1039-I1043 PolarHBondContact O-N 2.89Å; A1039-I1043 VanDerWaalsContact O-N 3.12Å; V1040-I1043 CarbonylContact O-C 3.57Å; V1040-I1043 PolarHBondContact O-N 2.92Å; D1041-I1043 VanDerWaalsContact C-N 3.29Å; D1041-I1043 PolarHBondContact O-N 2.84Å; I1043-F1052 HydrophobicContact CD1-CE1 4.02Å; I1043-F1052 HydrophobicContact CG1-CE1 4Å; I1043-F1052 HydrophobicContact CG2-CZ 4.42Å
1044	R	82.6	Confident	83.2	Confident	165 Å²	165	73.2 Å²	73.2	62%	0.623	36%	0.357	S	S	*	.	H	α-helix	trans	-70.1	-42	175.5	-77	174.6	179.5	-122.8	-1.2	112.4	R978 V1040 D1041	R978-R1044 PolarHBondContact NH1-O 2.93Å; R978-R1044 VanDerWaalsContact NH1-O 3.1Å; R978-R1044 PolarHBondContact NH2-O 3.32Å; V1040-R1044 HydrophobicContact CG1-CG 4.26Å; V1040-R1044 WeakPolarHBondContact O-CB 3.43Å; V1040-R1044 VanDerWaalsContact O-CG 3.3Å; V1040-R1044 WeakPolarHBondContact O-CG 3.42Å; V1040-R1044 PolarHBondContact O-N 2.76Å; D1041-R1044 PolarHBondContact O-N 3.21Å
1045	H	80.9	Confident	84	Confident	146 Å²	146	70.4 Å²	70.4	68%	0.676	34%	0.343	S	S	*	.	H	α-helix	trans	-95.1	-14	-173.6	-61.2	93.7	0	0	0	114.9	D1041 G1047	D1041-H1045 WeakPolarHBondContact O-CB 3.33Å; D1041-H1045 PolarHBondContact O-N 2.85Å; D1041-H1045 PolarHBondContact O-ND1 2.92Å; H1045-G1047 PolarHBondContact O-N 2.8Å
1046	G	76.6	Confident	84.8	Confident	26 Å²	26	71.1 Å²	71.1	27%	0.268	33%	0.333	S	S	.	.	S	Bend	trans	-63.8	3.9	-174	0	0	0	0	0	118.1	N1027 L1042 M1050	N1027-G1046 PolarHBondContact ND2-O 3.43Å; L1042-G1046 WeakPolarHBondContact O-CA 3.24Å; L1042-G1046 PolarHBondContact O-N 2.81Å; G1046-M1050 VanDerWaalsContact CA-SD 3.58Å; G1046-M1050 VanDerWaalsContact O-SD 3.34Å
1047	G	81.3	Confident	85.1	Confident	37 Å²	37	69 Å²	69	38%	0.381	33%	0.329	S	S	.	.			trans	96.6	-156.7	170	0	0	0	0	0	115.7	H1045	H1045-G1047 PolarHBondContact O-N 2.8Å
1048	K	80.7	Confident	85.1	Confident	152 Å²	152	66.4 Å²	66.4	66%	0.661	32%	0.316	S	S	*	.	S	Bend	trans	-88.6	-30.5	-173.9	-172.3	175.7	177.4	-176.9	0	113.7	E977 R978	E977-K1048 CarbonylContact C-O 3.6Å; E977-K1048 WeakPolarHBondContact CA-O 3.28Å; R978-K1048 PolarHBondContact N-O 3.14Å
1049	K	86.8	Confident	85	Confident	133 Å²	133	62.6 Å²	62.6	58%	0.578	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	135.3	170.2	-54.6	-152.7	-173	-150.1	0	108.7	E977	E977-K1049 HydrophobicContact CG-CD 4.19Å; E977-K1049 HydrophobicContact CG-CG 4.07Å; E977-K1049 WeakPolarHBondContact OE1-CE 3.32Å; E977-K1049 IonicContact OE1-NZ 3.47Å; E977-K1049 PolarHBondContact OE1-NZ 2.93Å
1050	M	88.5	Confident	84.8	Confident	1 Å²	1	68 Å²	68	1%	0.005	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	123.3	-174	-62.9	-66.4	-61.5	0	0	109.6	E975 L976 L983 V1026 N1027 G1046 F1052	E975-M1050 CarbonylContact C-O 3.55Å; E975-M1050 WeakPolarHBondContact CA-O 3.33Å; L976-M1050 PolarHBondContact N-O 2.92Å; L976-M1050 PolarHBondContact O-N 2.79Å; L983-M1050 HydrophobicContact CD1-CG 4.32Å; L983-M1050 HydrophobicContact CD2-CG 4.37Å; V1026-M1050 HydrophobicContact CG1-CE 3.39Å; N1027-M1050 WeakPolarHBondContact OD1-CA 3.34Å; G1046-M1050 VanDerWaalsContact CA-SD 3.58Å; G1046-M1050 VanDerWaalsContact O-SD 3.34Å; M1050-F1052 HydrophobicContact CB-CD2 4.27Å; M1050-F1052 HydrophobicContact CB-CE2 3.46Å; M1050-F1052 VanDerWaalsContact CB-CE2 3.46Å; M1050-F1052 HydrophobicContact CB-CZ 3.87Å; M1050-F1052 HydrophobicContact CE-CZ 4.13Å; M1050-F1052 HydrophobicContact CG-CE2 4.43Å; M1050-F1052 HydrophobicContact CG-CZ 4.48Å
1051	R	90.6	Very high	84.7	Confident	136 Å²	136	67.7 Å²	67.7	51%	0.513	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	128.9	171.2	-177.4	-178.2	-68.1	171.8	-1.4	109.3	T973 V974 E975 V1026 N1027	T973-R1051 HydrophobicContact CG2-CG 3.57Å; V974-R1051 CarbonylContact O-C 3.58Å; V974-R1051 WeakPolarHBondContact O-CA 3.45Å; E975-R1051 HydrophobicContact CG-CB 4.21Å; E975-R1051 HydrophobicContact CG-CG 4.17Å; E975-R1051 IonicContact OE1-CZ 3.31Å; E975-R1051 IonicContact OE1-NE 3.95Å; E975-R1051 PolarHBondContact OE1-NE 3.13Å; E975-R1051 IonicContact OE1-NH2 2.63Å; E975-R1051 PolarHBondContact OE1-NH2 2.91Å; V1026-R1051 CarbonylContact C-O 3.51Å; V1026-R1051 WeakPolarHBondContact CA-O 3.3Å; N1027-R1051 PolarHBondContact N-O 2.88Å; N1027-R1051 PolarHBondContact OD1-N 2.8Å
1052	F	92.6	Very high	84.5	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.009	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	133.8	176.5	-64.4	-82.9	0	0	0	110	T973 V974 L976 L983 M985 I1023 E1025 V1026 I1043 M1050 V1054	T973-F1052 WeakPolarHBondContact CA-O 3.46Å; V974-F1052 PolarHBondContact N-O 3.38Å; V974-F1052 PolarHBondContact O-N 2.65Å; L976-F1052 HydrophobicContact CB-CE2 4.41Å; L976-F1052 HydrophobicContact CD1-CD2 4.26Å; L976-F1052 HydrophobicContact CD1-CE2 4.02Å; L976-F1052 HydrophobicContact CG-CD2 4.37Å; L976-F1052 HydrophobicContact CG-CE2 4.36Å; L983-F1052 HydrophobicContact CD1-CE2 4Å; L983-F1052 HydrophobicContact CD1-CZ 3.65Å; M985-F1052 HydrophobicContact CE-CE1 4.2Å; M985-F1052 HydrophobicContact CE-CZ 4.16Å; I1023-F1052 HydrophobicContact CD1-CD1 4.15Å; I1023-F1052 HydrophobicContact CD1-CE1 4.34Å; I1023-F1052 HydrophobicContact CG2-CD1 3.96Å; E1025-F1052 WeakPolarHBondContact O-CA 3.42Å; V1026-F1052 HydrophobicContact CG1-CE1 4.16Å; V1026-F1052 HydrophobicContact CG2-CD1 3.97Å; V1026-F1052 HydrophobicContact CG2-CE1 3.93Å; I1043-F1052 HydrophobicContact CD1-CE1 4.02Å; I1043-F1052 HydrophobicContact CG1-CE1 4Å; I1043-F1052 HydrophobicContact CG2-CZ 4.42Å; M1050-F1052 HydrophobicContact CB-CD2 4.27Å; M1050-F1052 HydrophobicContact CB-CE2 3.46Å; M1050-F1052 VanDerWaalsContact CB-CE2 3.46Å; M1050-F1052 HydrophobicContact CB-CZ 3.87Å; M1050-F1052 HydrophobicContact CE-CZ 4.13Å; M1050-F1052 HydrophobicContact CG-CE2 4.43Å; M1050-F1052 HydrophobicContact CG-CZ 4.48Å; F1052-V1054 HydrophobicContact CB-CG2 3.89Å
1053	L	91.9	Very high	84.3	Confident	47 Å²	47	69.2 Å²	69.2	25%	0.246	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	125.1	161.9	-167.9	71.6	0	0	0	107.8	V971 T973 L1024 E1025	V971-L1053 HydrophobicContact CG1-CD1 3.68Å; V971-L1053 HydrophobicContact CG1-CD2 4.05Å; V971-L1053 HydrophobicContact CG1-CG 3.64Å; T973-L1053 WeakPolarHBondContact OG1-CD1 3.34Å; L1024-L1053 HydrophobicContact CB-CB 4.42Å; L1024-L1053 HydrophobicContact CB-CD2 4.27Å; L1024-L1053 HydrophobicContact CB-CG 4.44Å; L1024-L1053 HydrophobicContact CD1-CD2 4.32Å; L1024-L1053 PolarHBondContact N-O 2.86Å; E1025-L1053 HydrophobicContact CB-CB 3.77Å; E1025-L1053 HydrophobicContact CG-CB 3.91Å; E1025-L1053 HydrophobicContact CG-CD2 3.85Å; E1025-L1053 PolarHBondContact N-O 3.29Å; E1025-L1053 PolarHBondContact O-N 2.83Å
1054	V	92.4	Very high	84	Confident	1 Å²	1	71.8 Å²	71.8	1%	0.006	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.2	-169.8	-177.7	0	0	0	0	109.9	V971 F972 L1017 D1021 R1022 F1052	V971-V1054 CarbonylContact C-O 3.59Å; V971-V1054 WeakPolarHBondContact CA-O 3.14Å; F972-V1054 VanDerWaalsContact CD1-O 3.32Å; F972-V1054 WeakPolarHBondContact CD1-O 3.3Å; F972-V1054 HydrophobicContact CE1-CB 4.07Å; F972-V1054 HydrophobicContact CE1-CG1 3.9Å; F972-V1054 HydrophobicContact CE2-CB 4.49Å; F972-V1054 HydrophobicContact CZ-CB 4.07Å; F972-V1054 HydrophobicContact CZ-CG1 3.89Å; F972-V1054 PolarHBondContact N-O 3.44Å; F972-V1054 PolarHBondContact O-N 3.1Å; L1017-V1054 HydrophobicContact CD2-CB 4.45Å; L1017-V1054 HydrophobicContact CD2-CG1 4.21Å; L1017-V1054 HydrophobicContact CD2-CG2 3.91Å; D1021-V1054 HydrophobicContact CB-CG1 3.73Å; R1022-V1054 CarbonylContact O-C 3.55Å; R1022-V1054 WeakPolarHBondContact O-CA 2.91Å; F1052-V1054 HydrophobicContact CB-CG2 3.89Å
1055	A	90.8	Very high	83.8	Confident	10 Å²	10	63.9 Å²	63.9	8%	0.083	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	121.2	167.7	0	0	0	0	0	109.4	V971 R1022 L1024 S1057	V971-A1055 HydrophobicContact CG2-CB 4.13Å; R1022-A1055 HydrophobicContact CB-CB 4.38Å; R1022-A1055 PolarHBondContact N-O 2.99Å; R1022-A1055 PolarHBondContact O-N 3.11Å; L1024-A1055 HydrophobicContact CD1-CB 4.06Å; L1024-A1055 HydrophobicContact CD2-CB 4.3Å; L1024-A1055 HydrophobicContact CG-CB 4.14Å; A1055-S1057 PolarHBondContact O-N 3.33Å
1056	K	90.3	Very high	83.1	Confident	63 Å²	63	60.5 Å²	60.5	27%	0.274	31%	0.306	S	S	.	.			trans	-63.6	129.8	174.3	-157.4	76.6	-163	163.8	0	109.3	Y970 F972 R1016 S1018 D1021	Y970-K1056 HydrophobicContact CD1-CB 4.04Å; Y970-K1056 VanDerWaalsContact O-CB 3.32Å; Y970-K1056 WeakPolarHBondContact O-CB 3.47Å; Y970-K1056 PolarHBondContact O-N 3.1Å; F972-K1056 HydrophobicContact CE1-CB 4.06Å; F972-K1056 HydrophobicContact CE1-CD 3.64Å; F972-K1056 HydrophobicContact CZ-CD 4.06Å; R1016-K1056 PolarHBondContact O-NZ 3.49Å; S1018-K1056 PolarHBondContact OG-NZ 3.11Å; D1021-K1056 WeakPolarHBondContact OD1-CA 3.5Å; D1021-K1056 WeakPolarHBondContact OD1-CD 3.46Å; D1021-K1056 WeakPolarHBondContact OD1-CE 3.49Å; D1021-K1056 IonicContact OD1-NZ 2.68Å; D1021-K1056 PolarHBondContact OD1-NZ 3.13Å; D1021-K1056 IonicContact OD2-NZ 2.85Å; D1021-K1056 PolarHBondContact OD2-NZ 3.3Å
1057	S	85.8	Confident	81.9	Confident	32 Å²	32	65.3 Å²	65.3	22%	0.224	32%	0.319	C	S	.	.			trans	-108	154.9	180	-62.4	0	0	0	0	111.4	G1020 D1021 A1055	G1020-S1057 WeakPolarHBondContact O-CB 3.47Å; G1020-S1057 PolarHBondContact O-OG 3.24Å; G1020-S1057 VanDerWaalsContact O-OG 3.14Å; D1021-S1057 PolarHBondContact OD1-N 3.2Å; A1055-S1057 PolarHBondContact O-N 3.33Å
1058	D	82.6	Confident	79.9	Confident	78 Å²	78	74.7 Å²	74.7	42%	0.417	34%	0.343	S	S	.	.			trans	-76.5	169	-177.4	73.5	-75.2	0	0	0	112.7	E1060 T1061 A1062	D1058-E1060 VanDerWaalsContact C-N 3.28Å; D1058-E1060 PolarHBondContact O-N 2.87Å; D1058-E1060 VanDerWaalsContact OD2-CA 3.23Å; D1058-E1060 WeakPolarHBondContact OD2-CA 3.47Å; D1058-E1060 WeakPolarHBondContact OD2-CB 3.36Å; D1058-E1060 PolarHBondContact OD2-N 3.48Å; D1058-T1061 PolarHBondContact O-N 2.79Å; D1058-T1061 WeakPolarHBondContact OD1-CB 3.43Å; D1058-T1061 PolarHBondContact OD1-N 3.1Å; D1058-T1061 PolarHBondContact OD1-OG1 3.1Å; D1058-T1061 PolarHBondContact OD2-N 3.02Å; D1058-A1062 PolarHBondContact O-N 2.88Å
1059	V	76.4	Confident	77.5	Confident	106 Å²	106	73.3 Å²	73.3	64%	0.642	35%	0.348	S	S	*	.	H	α-helix	trans	-67.3	-24.5	-176.7	178.4	0	0	0	0	112.8	K1063	V1059-K1063 WeakPolarHBondContact O-CD 3.35Å; V1059-K1063 VanDerWaalsContact O-CG 3.23Å; V1059-K1063 WeakPolarHBondContact O-CG 3.43Å; V1059-K1063 PolarHBondContact O-N 2.83Å
1060	E	76.9	Confident	74.9	Confident	113 Å²	113	72 Å²	72	53%	0.528	35%	0.353	S	S	.	.	H	α-helix	trans	-77.9	-41	171.8	-48.5	-163.7	164.4	0	0	112.5	D1058 A1062 K1063 K1064	D1058-E1060 VanDerWaalsContact C-N 3.28Å; D1058-E1060 PolarHBondContact O-N 2.87Å; D1058-E1060 VanDerWaalsContact OD2-CA 3.23Å; D1058-E1060 WeakPolarHBondContact OD2-CA 3.47Å; D1058-E1060 WeakPolarHBondContact OD2-CB 3.36Å; D1058-E1060 PolarHBondContact OD2-N 3.48Å; E1060-A1062 VanDerWaalsContact C-N 3.3Å; E1060-A1062 PolarHBondContact O-N 3.04Å; E1060-K1063 CarbonylContact O-C 3.57Å; E1060-K1063 WeakPolarHBondContact O-CB 3.35Å; E1060-K1063 PolarHBondContact O-N 2.84Å; E1060-K1063 VanDerWaalsContact O-N 3.12Å; E1060-K1064 WeakPolarHBondContact O-CB 3.49Å; E1060-K1064 WeakPolarHBondContact O-CD 3.33Å; E1060-K1064 WeakPolarHBondContact O-CG 3.32Å; E1060-K1064 PolarHBondContact O-N 2.86Å; E1060-K1064 IonicContact OE2-NZ 3.71Å; E1060-K1064 PolarHBondContact OE2-NZ 3.37Å
1061	T	79.8	Confident	72.5	Confident	18 Å²	18	81.5 Å²	81.5	11%	0.11	42%	0.415	C	S	.	.	H	α-helix	trans	-57.9	-44.9	173.1	-69	0	0	0	0	110.6	L995 Y1001 D1058 K1063 K1064 I1065	L995-T1061 HydrophobicContact CD1-CG2 3.98Å; L995-T1061 HydrophobicContact CD2-CG2 3.93Å; Y1001-T1061 HydrophobicContact CE1-CG2 4.3Å; D1058-T1061 PolarHBondContact O-N 2.79Å; D1058-T1061 WeakPolarHBondContact OD1-CB 3.43Å; D1058-T1061 PolarHBondContact OD1-N 3.1Å; D1058-T1061 PolarHBondContact OD1-OG1 3.1Å; D1058-T1061 PolarHBondContact OD2-N 3.02Å; T1061-K1063 VanDerWaalsContact C-N 3.33Å; T1061-K1063 PolarHBondContact O-N 2.7Å; T1061-K1064 PolarHBondContact O-N 2.74Å; T1061-K1064 VanDerWaalsContact O-N 3.1Å; T1061-I1065 HydrophobicContact CG2-CD1 3.58Å; T1061-I1065 WeakPolarHBondContact O-CD1 3.22Å; T1061-I1065 WeakPolarHBondContact O-CG1 3.2Å; T1061-I1065 PolarHBondContact O-N 2.69Å
1062	A	78.8	Confident	71.6	Confident	21 Å²	21	78.8 Å²	78.8	17%	0.174	41%	0.41	C	S	.	.	H	α-helix	trans	-55.8	-42.4	172.4	0	0	0	0	0	113.5	L1019 D1058 E1060 I1065 H1066	L1019-A1062 VanDerWaalsContact O-CB 3.23Å; L1019-A1062 WeakPolarHBondContact O-CB 3.24Å; D1058-A1062 PolarHBondContact O-N 2.88Å; E1060-A1062 VanDerWaalsContact C-N 3.3Å; E1060-A1062 PolarHBondContact O-N 3.04Å; A1062-I1065 PolarHBondContact O-N 3Å; A1062-H1066 PolarHBondContact O-N 3.26Å; A1062-H1066 PolarHBondContact O-ND1 2.94Å
1063	K	79	Confident	70.5	Confident	148 Å²	148	82.8 Å²	82.8	64%	0.643	43%	0.431	S	S	*	.	H	α-helix	trans	-68.1	-34.9	174.9	-72.4	165.1	-176.5	169	0	113.2	V1059 E1060 T1061 I1065	V1059-K1063 WeakPolarHBondContact O-CD 3.35Å; V1059-K1063 VanDerWaalsContact O-CG 3.23Å; V1059-K1063 WeakPolarHBondContact O-CG 3.43Å; V1059-K1063 PolarHBondContact O-N 2.83Å; E1060-K1063 CarbonylContact O-C 3.57Å; E1060-K1063 WeakPolarHBondContact O-CB 3.35Å; E1060-K1063 PolarHBondContact O-N 2.84Å; E1060-K1063 VanDerWaalsContact O-N 3.12Å; T1061-K1063 VanDerWaalsContact C-N 3.33Å; T1061-K1063 PolarHBondContact O-N 2.7Å; K1063-I1065 VanDerWaalsContact C-N 3.31Å
1064	K	79.6	Confident	69.3	Low	72 Å²	72	84.8 Å²	84.8	31%	0.313	44%	0.441	S	S	.	.	H	α-helix	trans	-71.5	-26.6	178.5	-69.7	158.1	-166.8	161.1	0	111.9	R994 L995 E1060 T1061	R994-K1064 HydrophobicContact CB-CB 4.36Å; R994-K1064 WeakPolarHBondContact CB-O 3.07Å; R994-K1064 PolarHBondContact N-O 3.42Å; L995-K1064 HydrophobicContact CB-CB 4.19Å; L995-K1064 HydrophobicContact CD1-CB 4.16Å; L995-K1064 HydrophobicContact CD1-CD 3.89Å; E1060-K1064 WeakPolarHBondContact O-CB 3.49Å; E1060-K1064 WeakPolarHBondContact O-CD 3.33Å; E1060-K1064 WeakPolarHBondContact O-CG 3.32Å; E1060-K1064 PolarHBondContact O-N 2.86Å; E1060-K1064 IonicContact OE2-NZ 3.71Å; E1060-K1064 PolarHBondContact OE2-NZ 3.37Å; T1061-K1064 PolarHBondContact O-N 2.74Å; T1061-K1064 VanDerWaalsContact O-N 3.1Å
1065	I	77.9	Confident	67.9	Low	0 Å²	0	89.7 Å²	89.7	0%	0	47%	0.467	C	S	.	.	H	α-helix	trans	-84.3	-24.7	177.8	-71.5	158.3	0	0	0	112.8	I988 T993 L995 Y1001 Q1003 G1020 T1061 A1062 K1063 F1067	I988-I1065 HydrophobicContact CG2-CG2 3.98Å; T993-I1065 HydrophobicContact CG2-CG1 4.34Å; T993-I1065 HydrophobicContact CG2-CG2 4.49Å; L995-I1065 HydrophobicContact CD2-CD1 4.21Å; L995-I1065 HydrophobicContact CD2-CG1 4.42Å; Y1001-I1065 HydrophobicContact CD1-CD1 3.49Å; Y1001-I1065 VanDerWaalsContact CD1-CD1 3.49Å; Y1001-I1065 HydrophobicContact CE1-CD1 4.19Å; Y1001-I1065 HydrophobicContact CG-CD1 3.71Å; Y1001-I1065 HydrophobicContact CG-CG1 4.49Å; Q1003-I1065 HydrophobicContact CG-CG2 4.49Å; G1020-I1065 WeakPolarHBondContact O-CD1 3.41Å; T1061-I1065 HydrophobicContact CG2-CD1 3.58Å; T1061-I1065 WeakPolarHBondContact O-CD1 3.22Å; T1061-I1065 WeakPolarHBondContact O-CG1 3.2Å; T1061-I1065 PolarHBondContact O-N 2.69Å; A1062-I1065 PolarHBondContact O-N 3Å; K1063-I1065 VanDerWaalsContact C-N 3.31Å; I1065-F1067 PolarHBondContact O-N 2.85Å
1066	H	66.6	Low	66.5	Low	75 Å²	75	94.7 Å²	94.7	35%	0.347	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-76.1	120.3	174.5	-93	56.9	0	0	0	112.8	Q1003 A1062	Q1003-H1066 PolarHBondContact O-CE1 3.26Å; Q1003-H1066 VanDerWaalsContact O-CE1 3.28Å; A1062-H1066 PolarHBondContact O-N 3.26Å; A1062-H1066 PolarHBondContact O-ND1 2.94Å
1067	F	51.1	Low	64.9	Low	126 Å²	126	96.8 Å²	96.8	55%	0.553	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-71.5	148.4	155.1	-81.1	-100.5	0	0	0	109.1	I988 H992 I1065 T1069	I988-F1067 HydrophobicContact CD1-CE2 4.4Å; H992-F1067 WeakPolarHBondContact O-CE2 3.05Å; I1065-F1067 PolarHBondContact O-N 2.85Å; F1067-T1069 PolarHBondContact O-N 2.63Å
1068	R	38.5	Very low	63.4	Low	234 Å²	234	101.4 Å²	101.4	88%	0.883	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-58.4	128	176.1	-79.3	-177	170.7	179.7	-4.6	109.6
1069	T	31.2	Very low	62	Low	123 Å²	123	103.2 Å²	103.2	76%	0.755	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-55.7	135.3	159.3	-26.6	0	0	0	0	108.5	F1067	F1067-T1069 PolarHBondContact O-N 2.63Å
1070	P	32.6	Very low	60.7	Low	106 Å²	106	103 Å²	103	69%	0.688	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-64.2	154.9	165	29.7	-34.8	0	0	0	110.2
1071	P	36.9	Very low	59.3	Low	200 Å²	200	102.1 Å²	102.1	100%	1.299	52%	0.524	S	S	*	.			trans	-69.5	0	167.1	33.5	-35.6	0	0	0	112

Retrieved 1,071 of 1,071 residues in 358.7 ms (Link to these results)

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