A0A087X165_HUMAN Loading...

SRC kinase signaling inhibitor 1

AlphaFold DB , UniProt , Accession A0A087X165, Species HUMAN (Homo sapiens, Human), Gene SRCIN1, Length 1,217 aa.

						>A0A087X165_HUMAN|A0A087X165|SRCIN1
MGNAPSQDPERSSPPMLSADDAEYPREYRTLGGGGGGGSGGRRFSNVGLVHTSERRHTVIAAQSLEALSGLQKADADRKRDAFMDHLKSKYPQHALALRGQQDRMREQVGGWTVDPVCLLSSLCSHLHGDSAPSGAGQPAQQPNYWSFKTRSSRHTQGAQPGLADQAAKLSYASAESLETMSEAELPLGFSRMNRFRQSLPLSRSASQTKLRSPGVLFLQFGEETRRVHITHEVSSLDTLHALIAHMFPQKLTMGMLKSPNTAILIKDEARNVFYELEDVRDIQDRSIIKIYRKEPLYAAFPGSHLTNGDLRREMVYASRESSPTRRLNNLSPAPHLASGSPPPGLPSGLPSGLQSGSPSRSRLSYAGGRPPSYAGSPVHHAAERLGGAPAAQGVSPSPSAILERRDVKPDEDLASKAGGMVLVKGEGLYADPYGLLHEGRLSLAAAAGDPFAYPGAGGLYKRGSVRSLSTYSAAALQSDLEDSLYKAAGGGGPLYGDGYGFRLPPSSPQKLADVAAPPGGPPPPHSPYSGPPSRGSPVRQSFRKDSGSSSVFAESPGGKTRSAGSASTAGAPPSELFPGPGERSLVGFGPPVPAKDTETRERMEAMEKQIASLTGLVQSALLRGSEPETPSEKIEGSNGAATPSAPCGSGGRSSGATPVSGPPPPSASSTPAGQPTAVSRLQMQLHLRGLQNSASDLRGQLQQLRKLQLQNQESVRALLKRTEAELSMRVSEAARRQEDPLQRQRTLVEEERLRYLNDEELITQQLNDLEKSVEKIQRDVSHNHRLVPGPELEEKALVLKQLGETLTELKAHFPGLQSKMRVVLRVEVEAVKFLKEEPQRLDGLLKRCRGVTDTLAQIRRQVDEGVWPPPNNLLSQSPKKVTAETDFNKSVDFEMPPPSPPLNLHELSGPAEGASLTPKGGNPTKGLDTPGKRSVDKAVSVEAAERDWEEKRAALTQYSAKDINRLLEETQAELLKAIPDLDCASKAHPGPAPTPDHKPPKAPHGQKAAPRTEPSGRRGSDELTVPRYRTEKPSKSPPPPPPRRSFPSSHGLTTTRTGEVVVTSKKDSAFIKKAESEELEVQKPQVKLRRAVSEVARPASTPPIMASAIKDEDDEDRIIAELESGGGSVPPMKVVTPGASRLKAAQGQAGSPDKSKHGKQRAEYMRIQAQQQATKPSKEMSGSNETSSPVSEKPSASRTSIPVLTSFGARNSSISF
					

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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	32	Very low	37.3	Very low	253 Å²	253	154.7 Å²	154.7	100%	1.246	86%	0.86	S	S	*	*				0	135.9	0	-60.6	167.5	178.7	0	0	107.2
2	G	34.8	Very low	36.4	Very low	71 Å²	71	151.3 Å²	151.3	73%	0.732	86%	0.855	S	S	*	*			cis	167.5	130.7	-9.6	0	0	0	0	0	112.7
3	N	35.1	Very low	35.8	Very low	177 Å²	177	148.4 Å²	148.4	95%	0.947	85%	0.85	S	S	*	*			trans	71	162.4	172.1	-72.1	-6.6	0	0	0	120.2
4	A	43.7	Very low	35.9	Very low	93 Å²	93	146.3 Å²	146.3	77%	0.769	85%	0.845	S	S	*	*			trans	-120.3	-157.6	-170.4	0	0	0	0	0	110.3
5	P	56.5	Low	36.2	Very low	127 Å²	127	144 Å²	144	83%	0.825	84%	0.837	S	S	*	*			cis	-143.3	177.1	43.5	40.9	-19.1	0	0	0	118.7
6	S	39.3	Very low	35.6	Very low	102 Å²	102	145.3 Å²	145.3	71%	0.713	84%	0.835	S	S	*	*			trans	-53.3	154.4	175.7	-179	0	0	0	0	119
7	Q	30.8	Very low	35.1	Very low	188 Å²	188	143.4 Å²	143.4	88%	0.879	82%	0.821	S	S	*	*				-179.8	144.1	118.9	-96.3	171.3	17.8	0	0	115.9
8	D	34.2	Very low	34.7	Very low	152 Å²	152	140.2 Å²	140.2	81%	0.813	81%	0.809	S	S	*	*			trans	-89.5	174.8	165.1	-81.3	-56.7	0	0	0	110.6
9	P	45.8	Very low	34.4	Very low	129 Å²	129	135.6 Å²	135.6	84%	0.838	79%	0.789	S	S	*	*			cis	-154.9	-149	35.9	45.8	-20.7	0	0	0	118.2
10	E	27.7	Very low	34.2	Very low	174 Å²	174	137 Å²	137	81%	0.813	79%	0.793	S	S	*	*			trans	-80.2	156.9	-164.9	-44.2	179.8	118.8	0	0	120.1
11	R	29.9	Very low	33.8	Very low	236 Å²	236	138.1 Å²	138.1	89%	0.891	80%	0.797	S	S	*	*				171.2	155.2	118.4	-97.9	178.3	171.9	-161.1	-3.3	110.7
12	S	27.6	Very low	33.8	Very low	114 Å²	114	130.1 Å²	130.1	80%	0.797	77%	0.77	S	S	*	*			cis	-162.1	170.5	15.1	41.5	0	0	0	0	112.7
13	S	28.3	Very low	33.3	Very low	113 Å²	113	135.1 Å²	135.1	79%	0.79	78%	0.775	S	S	*	*			trans	-105.1	175.1	175.4	-30.3	0	0	0	0	111.8
14	P	36.7	Very low	33	Very low	119 Å²	119	136.3 Å²	136.3	77%	0.773	77%	0.767	S	S	*	*				-147.3	-135.1	51.7	36.2	-9.9	0	0	0	114.3
15	P	40	Very low	32.4	Very low	112 Å²	112	137.8 Å²	137.8	73%	0.727	77%	0.769	S	S	*	*				-102.2	156.6	-80.6	21.3	-0.1	0	0	0	113.4
16	M	26.7	Very low	31.1	Very low	165 Å²	165	141.8 Å²	141.8	81%	0.813	77%	0.768	S	S	*	*			cis	95	127.4	49.7	-76.7	-146.4	76.8	0	0	117.7
17	L	27.3	Very low	30.6	Very low	113 Å²	113	145.4 Å²	145.4	59%	0.592	77%	0.773	S	S	*	*			trans	67.8	139.9	168	-50.8	-178.7	0	0	0	118.7
18	S	27.8	Very low	30.4	Very low	86 Å²	86	146.7 Å²	146.7	60%	0.601	77%	0.772	S	S	*	*			cis	100.6	103.7	2.4	-166.6	0	0	0	0	119.4	S551	S18-S551 WeakPolarHBondContact O-CB 3.47Å; S18-S551 PolarHBondContact O-OG 3.24Å
19	A	29.7	Very low	30.1	Very low	53 Å²	53	150.5 Å²	150.5	44%	0.438	78%	0.775	S	S	.	*			trans	-169.6	142.5	138.7	0	0	0	0	0	114.9
20	D	29.5	Very low	29.4	Very low	162 Å²	162	150.8 Å²	150.8	87%	0.866	77%	0.774	S	S	*	*			trans	44.4	140.8	147.7	-58.2	-59.7	0	0	0	123.4
21	D	27.3	Very low	29.5	Very low	162 Å²	162	150.5 Å²	150.5	87%	0.866	78%	0.777	S	S	*	*			trans	-131.6	150.7	-176.1	-179.7	28	0	0	0	110.3
22	A	31.1	Very low	29.3	Very low	84 Å²	84	143.3 Å²	143.3	69%	0.694	78%	0.776	S	S	*	*			trans	-152.4	137.6	-173.7	0	0	0	0	0	114.6
23	E	25.5	Very low	29.3	Very low	177 Å²	177	141.9 Å²	141.9	83%	0.827	78%	0.78	S	S	*	*			trans	75.5	122.2	156.6	-149.6	173.2	171.6	0	0	119.5
24	Y	28	Very low	29.2	Very low	201 Å²	201	140.4 Å²	140.4	79%	0.788	78%	0.783	S	S	*	*			trans	17.6	119.8	159.3	-77.4	-87.8	0	0	0	121.4	R26	Y24-R26 PolarHBondContact O-N 2.62Å
25	P	30.6	Very low	28.8	Very low	124 Å²	124	139 Å²	139	81%	0.805	79%	0.789	S	S	*	*			trans	-75.4	116.1	144.8	-5.1	23.4	0	0	0	110.1
26	R	30.3	Very low	28.2	Very low	211 Å²	211	137.8 Å²	137.8	80%	0.796	80%	0.797	S	S	*	*			trans	-84.8	143.1	153.5	-87.3	-173.5	174.2	126.2	-1.2	109.5	Y24 Y28	Y24-R26 PolarHBondContact O-N 2.62Å; R26-Y28 PolarHBondContact O-N 2.78Å
27	E	28.4	Very low	28.3	Very low	178 Å²	178	134.1 Å²	134.1	83%	0.832	80%	0.802	S	S	*	*			trans	16.7	98.2	144.8	-64.4	159.8	-111.1	0	0	116.6	R29	E27-R29 PolarHBondContact O-N 2.64Å
28	Y	26.1	Very low	28.4	Very low	215 Å²	215	132.7 Å²	132.7	84%	0.843	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-68	120.6	170.6	-102	-94.1	0	0	0	111.6	R26	R26-Y28 PolarHBondContact O-N 2.78Å
29	R	28.9	Very low	28.4	Very low	233 Å²	233	135 Å²	135	88%	0.879	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-92.7	127.9	144	-87.7	-174.2	172.5	-179.3	-2.3	108.3	E27	E27-R29 PolarHBondContact O-N 2.64Å
30	T	29.4	Very low	28.4	Very low	134 Å²	134	136.1 Å²	136.1	82%	0.822	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-83.3	151.5	168.7	-42.6	0	0	0	0	110.1
31	L	30.8	Very low	28.5	Very low	169 Å²	169	132.1 Å²	132.1	89%	0.885	84%	0.844	S	S	*	*			trans	-109.4	157.8	-163	-68.3	166.2	0	0	0	114
32	G	25.4	Very low	28.6	Very low	84 Å²	84	135.6 Å²	135.6	87%	0.866	85%	0.845	S	S	*	*			trans	158.9	106.7	160.7	0	0	0	0	0	112.7
33	G	26.7	Very low	28.7	Very low	84 Å²	84	141.1 Å²	141.1	87%	0.866	85%	0.848	S	S	*	*			cis	168.5	167.1	-8.7	0	0	0	0	0	111.7
34	G	27.2	Very low	28.7	Very low	83 Å²	83	141.2 Å²	141.2	86%	0.856	85%	0.846	S	S	*	*			trans	122.8	101	160.2	0	0	0	0	0	119.1
35	G	27.9	Very low	28.7	Very low	88 Å²	88	136.3 Å²	136.3	91%	0.907	84%	0.841	S	S	*	*			trans	91.7	133.5	132.1	0	0	0	0	0	121.4
36	G	28.5	Very low	28.5	Very low	87 Å²	87	137.8 Å²	137.8	90%	0.897	84%	0.843	S	S	*	*			trans	102.5	97.2	151.9	0	0	0	0	0	117.3
37	G	28.9	Very low	28.4	Very low	89 Å²	89	135 Å²	135	92%	0.918	85%	0.849	S	S	*	*			trans	-92.4	172.9	-179.7	0	0	0	0	0	115.9
38	G	28.9	Very low	28.4	Very low	83 Å²	83	129.9 Å²	129.9	86%	0.856	84%	0.844	S	S	*	*			trans	-169.9	106.3	178.6	0	0	0	0	0	114.2
39	S	28.4	Very low	28.6	Very low	134 Å²	134	126.7 Å²	126.7	94%	0.937	84%	0.84	S	S	*	*			trans	-58.7	150.5	-172.2	-175.4	0	0	0	0	118.9
40	G	29.7	Very low	28.9	Very low	77 Å²	77	121.7 Å²	121.7	79%	0.794	84%	0.835	S	S	*	*			trans	112.9	158.4	135.6	0	0	0	0	0	118.9
41	G	29.5	Very low	29.1	Very low	77 Å²	77	122.2 Å²	122.2	79%	0.794	83%	0.828	S	S	*	*			trans	162.4	-114.9	172.2	0	0	0	0	0	116.3
42	R	30.4	Very low	29.2	Very low	235 Å²	235	121 Å²	121	89%	0.887	83%	0.828	S	S	*	*			trans	73.4	119.6	177	-102.7	-166.8	-90.8	-109	7.6	119.4
43	R	32.5	Very low	29.8	Very low	201 Å²	201	120 Å²	120	76%	0.758	81%	0.808	S	S	*	*			trans	94	116.8	142.6	-65.6	-179.9	167.5	-91.3	0.3	122.2
44	F	26.4	Very low	30.2	Very low	178 Å²	178	121.8 Å²	121.8	78%	0.781	79%	0.794	S	S	*	*			trans	38.6	151.1	135.4	-53.1	-78.9	0	0	0	121.9
45	S	27.9	Very low	30.6	Very low	99 Å²	99	128.7 Å²	128.7	69%	0.692	79%	0.794	S	S	*	*			cis	-157.7	160.1	28.5	-38.1	0	0	0	0	114.9
46	N	25.5	Very low	31.2	Very low	155 Å²	155	134.4 Å²	134.4	83%	0.829	79%	0.788	S	S	*	*			trans	49.3	119.5	151.1	-64.3	-0.3	0	0	0	122.5
47	V	29.8	Very low	31.8	Very low	153 Å²	153	136.5 Å²	136.5	93%	0.927	77%	0.774	S	S	*	*				-178.3	144.1	108	147.6	0	0	0	0	110
48	G	28.6	Very low	32.6	Very low	70 Å²	70	134.8 Å²	134.8	72%	0.722	75%	0.746	S	S	*	*			trans	106.4	82.2	162.6	0	0	0	0	0	117.3
49	L	29.5	Very low	33.4	Very low	147 Å²	147	134.5 Å²	134.5	77%	0.77	73%	0.728	S	S	*	*			trans	-97.3	105.4	172.9	-178.8	68	0	0	0	111.4
50	V	35.1	Very low	34.1	Very low	129 Å²	129	134.1 Å²	134.1	78%	0.782	71%	0.713	S	S	*	*			trans	-110.9	130.5	174.8	-175.2	0	0	0	0	109.9
51	H	33.2	Very low	34.8	Very low	145 Å²	145	133.4 Å²	133.4	67%	0.671	70%	0.7	S	S	*	*			trans	-85.4	128.5	-166.9	-74.3	60	0	0	0	113.4
52	T	33.2	Very low	35.5	Very low	143 Å²	143	132.3 Å²	132.3	88%	0.877	68%	0.683	S	S	*	*			trans	-121.6	38.4	177.8	51.2	0	0	0	0	113.1
53	S	37.3	Very low	36	Very low	64 Å²	64	124 Å²	124	45%	0.448	66%	0.655	S	S	.	*			trans	-99.3	-32.9	-173.4	50.1	0	0	0	0	116	R55 R56 H57	S53-R55 VanDerWaalsContact C-N 3.3Å; S53-R55 PolarHBondContact O-N 3.3Å; S53-R55 VanDerWaalsContact O-N 3.08Å; S53-R56 PolarHBondContact O-N 2.73Å; S53-H57 PolarHBondContact O-CD2 3.09Å
54	E	36	Very low	36.5	Very low	121 Å²	121	117.5 Å²	117.5	57%	0.565	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-60.5	-31.6	-161.9	-157.3	-168.5	144.9	0	0	114.8	R56 R227	E54-R56 VanDerWaalsContact C-N 3.29Å; E54-R56 PolarHBondContact O-N 2.73Å; E54-R227 IonicContact OE1-NH1 2.62Å
55	R	35.4	Very low	37.4	Very low	228 Å²	228	114.6 Å²	114.6	86%	0.86	63%	0.632	S	S	*	*	G	3₁₀ helix	trans	-74.1	-9.9	-171.1	-148.3	174.9	-160.8	-108.6	0.9	115.2	S53	S53-R55 VanDerWaalsContact C-N 3.3Å; S53-R55 PolarHBondContact O-N 3.3Å; S53-R55 VanDerWaalsContact O-N 3.08Å
56	R	40.2	Very low	38.4	Very low	207 Å²	207	116.2 Å²	116.2	78%	0.781	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-93.1	-25	-179.9	-62.7	-170.2	-174	-161.5	2.2	113.9	S53 E54	S53-R56 PolarHBondContact O-N 2.73Å; E54-R56 VanDerWaalsContact C-N 3.29Å; E54-R56 PolarHBondContact O-N 2.73Å
57	H	41.4	Very low	39.4	Very low	132 Å²	132	112 Å²	112	61%	0.611	62%	0.615	S	S	*	*	H	α-helix	trans	-83.1	-25.7	-174	-63	-77.8	0	0	0	113.9	S53	S53-H57 PolarHBondContact O-CD2 3.09Å
58	T	46.3	Very low	40.1	Very low	53 Å²	53	109.7 Å²	109.7	33%	0.325	60%	0.597	S	S	.	*	H	α-helix	trans	-75.3	-28.1	-173.9	16.9	0	0	0	0	114.4	A62	T58-A62 PolarHBondContact O-N 2.91Å
59	V	44.9	Very low	41.3	Very low	77 Å²	77	109.6 Å²	109.6	47%	0.467	59%	0.585	S	S	.	*	H	α-helix	trans	-72.4	-40.9	-180	-177.8	0	0	0	0	111.4	A61 A62 Q63	V59-A61 VanDerWaalsContact C-N 3.35Å; V59-A61 PolarHBondContact O-N 2.67Å; V59-A62 PolarHBondContact O-N 2.71Å; V59-Q63 PolarHBondContact O-N 3.16Å
60	I	43.8	Very low	42.3	Very low	125 Å²	125	104.7 Å²	104.7	64%	0.641	57%	0.571	S	S	*	*	H	α-helix	trans	-67.2	-37.6	-179	-58.5	173.8	0	0	0	110.8
61	A	44	Very low	43	Very low	62 Å²	62	103.1 Å²	103.1	51%	0.512	56%	0.557	S	S	.	*	H	α-helix	trans	-71	-26.6	177.8	0	0	0	0	0	113.9	V59 S64	V59-A61 VanDerWaalsContact C-N 3.35Å; V59-A61 PolarHBondContact O-N 2.67Å; A61-S64 PolarHBondContact O-OG 3.22Å
62	A	45	Very low	44.1	Very low	54 Å²	54	102.6 Å²	102.6	45%	0.446	56%	0.555	S	S	.	*	H	α-helix	trans	-72.4	-46.7	176.3	0	0	0	0	0	111.5	T58 V59 S64 L65 E66	T58-A62 PolarHBondContact O-N 2.91Å; V59-A62 PolarHBondContact O-N 2.71Å; A62-S64 VanDerWaalsContact C-N 3.29Å; A62-S64 PolarHBondContact O-N 3.3Å; A62-L65 PolarHBondContact O-N 2.7Å; A62-L65 VanDerWaalsContact O-N 3.16Å; A62-E66 PolarHBondContact O-N 2.61Å
63	Q	40	Very low	45.5	Very low	62 Å²	62	102.7 Å²	102.7	29%	0.29	54%	0.544	S	S	.	.	H	α-helix	trans	-63.4	-29.1	-178.9	-80.1	-173.9	-52.9	0	0	113.9	V59 A67 A734	V59-Q63 PolarHBondContact O-N 3.16Å; Q63-A67 PolarHBondContact O-N 3.23Å; Q63-A734 PolarHBondContact NE2-O 2.89Å
64	S	43.7	Very low	46.6	Very low	63 Å²	63	101.4 Å²	101.4	44%	0.441	54%	0.537	S	S	.	.	H	α-helix	trans	-74.5	-31.4	175.8	62.6	0	0	0	0	113.1	A61 A62 A67 L68	A61-S64 PolarHBondContact O-OG 3.22Å; A62-S64 VanDerWaalsContact C-N 3.29Å; A62-S64 PolarHBondContact O-N 3.3Å; S64-A67 PolarHBondContact O-N 3.19Å; S64-L68 WeakPolarHBondContact O-CG 3.32Å; S64-L68 PolarHBondContact O-N 2.84Å; S64-L68 VanDerWaalsContact O-N 3.16Å
65	L	45.6	Very low	47.8	Very low	117 Å²	117	97.8 Å²	97.8	61%	0.613	52%	0.521	S	S	*	.	H	α-helix	trans	-70.1	-36.4	-179.3	-154.2	80.7	0	0	0	112.4	A62 S69	A62-L65 PolarHBondContact O-N 2.7Å; A62-L65 VanDerWaalsContact O-N 3.16Å; L65-S69 PolarHBondContact O-N 3.07Å; L65-S69 VanDerWaalsContact O-N 3.08Å; L65-S69 PolarHBondContact O-OG 3.05Å
66	E	49	Very low	49.3	Very low	134 Å²	134	89.3 Å²	89.3	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-69.1	-38.3	175.7	-65.3	179.1	149.4	0	0	111.6	A62 S69 G70	A62-E66 PolarHBondContact O-N 2.61Å; E66-S69 PolarHBondContact O-N 2.63Å; E66-G70 PolarHBondContact O-N 3.42Å
67	A	46.3	Very low	50.8	Low	66 Å²	66	82.1 Å²	82.1	55%	0.545	48%	0.477	S	S	.	.	H	α-helix	trans	-62.6	-41.8	174.7	0	0	0	0	0	112.4	Q63 S64 G70 L71	Q63-A67 PolarHBondContact O-N 3.23Å; S64-A67 PolarHBondContact O-N 3.19Å; A67-G70 PolarHBondContact O-N 3.49Å; A67-L71 PolarHBondContact O-N 2.91Å
68	L	43.6	Very low	52.6	Low	104 Å²	104	83.4 Å²	83.4	55%	0.545	48%	0.476	S	S	.	.	H	α-helix	trans	-65.9	-41.2	175.9	-69.4	168.7	0	0	0	112	S64 G70 L71 Q72	S64-L68 WeakPolarHBondContact O-CG 3.32Å; S64-L68 PolarHBondContact O-N 2.84Å; S64-L68 VanDerWaalsContact O-N 3.16Å; L68-G70 PolarHBondContact O-N 3.21Å; L68-L71 PolarHBondContact O-N 2.92Å; L68-Q72 PolarHBondContact O-N 3.33Å
69	S	52.9	Low	54.2	Low	68 Å²	68	85.9 Å²	85.9	48%	0.476	48%	0.483	S	S	.	.	H	α-helix	trans	-65.4	-37.3	178.4	-57.8	0	0	0	0	112.4	L65 E66 K73	L65-S69 PolarHBondContact O-N 3.07Å; L65-S69 VanDerWaalsContact O-N 3.08Å; L65-S69 PolarHBondContact O-OG 3.05Å; E66-S69 PolarHBondContact O-N 2.63Å; S69-K73 PolarHBondContact O-N 2.96Å
70	G	51.1	Low	55.9	Low	45 Å²	45	88.1 Å²	88.1	46%	0.464	48%	0.483	S	S	.	.	H	α-helix	trans	-64.7	-39.3	173.4	0	0	0	0	0	113.1	E66 A67 L68 K73 A74	E66-G70 PolarHBondContact O-N 3.42Å; A67-G70 PolarHBondContact O-N 3.49Å; L68-G70 PolarHBondContact O-N 3.21Å; G70-K73 PolarHBondContact O-N 3.44Å; G70-A74 PolarHBondContact O-N 3.2Å
71	L	51.1	Low	57.4	Low	95 Å²	95	86.8 Å²	86.8	50%	0.497	48%	0.477	S	S	.	.	H	α-helix	trans	-68.3	-46.1	179.5	-170.5	63.9	0	0	0	112	A67 L68 K73 A74 D75	A67-L71 PolarHBondContact O-N 2.91Å; L68-L71 PolarHBondContact O-N 2.92Å; L71-K73 PolarHBondContact O-N 2.85Å; L71-A74 PolarHBondContact O-N 3.5Å; L71-A74 VanDerWaalsContact O-N 3.09Å; L71-D75 PolarHBondContact O-N 3.36Å
72	Q	55.9	Low	59.2	Low	134 Å²	134	86.8 Å²	86.8	63%	0.626	48%	0.477	S	S	*	.	H	α-helix	trans	-56.7	-38	175.7	-77.1	-172.2	-36.6	0	0	112.7	L68 A76	L68-Q72 PolarHBondContact O-N 3.33Å; Q72-A76 VanDerWaalsContact O-CB 3.3Å; Q72-A76 WeakPolarHBondContact O-CB 3.45Å; Q72-A76 PolarHBondContact O-N 2.84Å
73	K	61.7	Low	61	Low	146 Å²	146	90.5 Å²	90.5	64%	0.635	48%	0.483	S	S	*	.	H	α-helix	trans	-66.2	-45.2	175.5	-172.4	179.3	176.4	-174.8	0	111.8	S69 G70 L71 D75 A76 D77	S69-K73 PolarHBondContact O-N 2.96Å; G70-K73 PolarHBondContact O-N 3.44Å; L71-K73 PolarHBondContact O-N 2.85Å; K73-D75 VanDerWaalsContact C-N 3.34Å; K73-D75 PolarHBondContact O-N 2.98Å; K73-A76 PolarHBondContact O-N 3.32Å; K73-D77 PolarHBondContact O-N 2.96Å
74	A	59.8	Low	63	Low	37 Å²	37	89.4 Å²	89.4	31%	0.306	48%	0.478	S	S	.	.	H	α-helix	trans	-62.8	-38.5	178.4	0	0	0	0	0	112.5	G70 L71 D77 R78	G70-A74 PolarHBondContact O-N 3.2Å; L71-A74 PolarHBondContact O-N 3.5Å; L71-A74 VanDerWaalsContact O-N 3.09Å; A74-D77 PolarHBondContact O-N 3.5Å; A74-R78 VanDerWaalsContact O-CG 3.31Å; A74-R78 WeakPolarHBondContact O-CG 3.2Å; A74-R78 PolarHBondContact O-N 3.49Å
75	D	61.5	Low	64.8	Low	44 Å²	44	90.7 Å²	90.7	24%	0.235	48%	0.48	C	S	.	.	H	α-helix	trans	-75.9	-30.9	175.6	-71.4	-27.8	0	0	0	112.8	L71 K73 D77 R78 K79	L71-D75 PolarHBondContact O-N 3.36Å; K73-D75 VanDerWaalsContact C-N 3.34Å; K73-D75 PolarHBondContact O-N 2.98Å; D75-D77 VanDerWaalsContact C-N 3.32Å; D75-R78 PolarHBondContact O-N 3.05Å; D75-R78 VanDerWaalsContact OD1-CD 3.32Å; D75-R78 WeakPolarHBondContact OD1-CD 3.46Å; D75-R78 IonicContact OD1-CZ 2.58Å; D75-R78 IonicContact OD1-NE 3.13Å; D75-R78 IonicContact OD1-NH1 2.76Å; D75-R78 PolarHBondContact OD1-NH1 3.39Å; D75-K79 VanDerWaalsContact O-CB 3.23Å; D75-K79 WeakPolarHBondContact O-CB 3.43Å; D75-K79 WeakPolarHBondContact O-CG 3.46Å; D75-K79 PolarHBondContact O-N 2.9Å
76	A	67.7	Low	66.8	Low	50 Å²	50	90.6 Å²	90.6	41%	0.413	48%	0.477	S	S	.	.	H	α-helix	trans	-65.3	-35.5	168.5	0	0	0	0	0	112.3	Q72 K73 R80	Q72-A76 VanDerWaalsContact O-CB 3.3Å; Q72-A76 WeakPolarHBondContact O-CB 3.45Å; Q72-A76 PolarHBondContact O-N 2.84Å; K73-A76 PolarHBondContact O-N 3.32Å; A76-R80 WeakPolarHBondContact O-CB 3.41Å; A76-R80 PolarHBondContact O-N 3.4Å; A76-R80 VanDerWaalsContact O-N 3.14Å
77	D	71.3	Confident	68.4	Low	56 Å²	56	85.2 Å²	85.2	30%	0.299	45%	0.452	S	S	.	.	H	α-helix	trans	-66	-49.3	172.2	-71.6	-34.5	0	0	0	111	K73 A74 D75 R80 D81	K73-D77 PolarHBondContact O-N 2.96Å; A74-D77 PolarHBondContact O-N 3.5Å; D75-D77 VanDerWaalsContact C-N 3.32Å; D77-R80 WeakPolarHBondContact O-CB 3.28Å; D77-R80 PolarHBondContact O-N 3.03Å; D77-R80 IonicContact OD1-CZ 2.73Å; D77-R80 IonicContact OD1-NH1 2.7Å; D77-R80 PolarHBondContact OD1-NH1 3.42Å; D77-R80 IonicContact OD1-NH2 3.18Å; D77-R80 PolarHBondContact OD1-NH2 3.5Å; D77-D81 PolarHBondContact O-N 3.45Å
78	R	79.5	Confident	70.1	Confident	159 Å²	159	86 Å²	86	60%	0.6	44%	0.443	S	S	*	.	H	α-helix	trans	-59.7	-46.2	175.3	-71.1	163.2	176.4	170.1	-4.2	113.3	A74 D75 R80 D81 A82	A74-R78 VanDerWaalsContact O-CG 3.31Å; A74-R78 WeakPolarHBondContact O-CG 3.2Å; A74-R78 PolarHBondContact O-N 3.49Å; D75-R78 PolarHBondContact O-N 3.05Å; D75-R78 VanDerWaalsContact OD1-CD 3.32Å; D75-R78 WeakPolarHBondContact OD1-CD 3.46Å; D75-R78 IonicContact OD1-CZ 2.58Å; D75-R78 IonicContact OD1-NE 3.13Å; D75-R78 IonicContact OD1-NH1 2.76Å; D75-R78 PolarHBondContact OD1-NH1 3.39Å; R78-R80 VanDerWaalsContact C-N 3.25Å; R78-R80 PolarHBondContact O-N 2.85Å; R78-D81 PolarHBondContact O-N 2.86Å; R78-A82 WeakPolarHBondContact O-CB 3.43Å; R78-A82 PolarHBondContact O-N 2.99Å
79	K	79.1	Confident	71.9	Confident	106 Å²	106	85.9 Å²	85.9	46%	0.461	45%	0.451	S	S	.	.	H	α-helix	trans	-58.4	-38.8	176.8	-76.1	170.8	179.8	179.1	0	110.6	D75 F83 E179	D75-K79 VanDerWaalsContact O-CB 3.23Å; D75-K79 WeakPolarHBondContact O-CB 3.43Å; D75-K79 WeakPolarHBondContact O-CG 3.46Å; D75-K79 PolarHBondContact O-N 2.9Å; K79-F83 VanDerWaalsContact O-CB 3.27Å; K79-F83 WeakPolarHBondContact O-CB 3.18Å; K79-F83 PolarHBondContact O-N 3.35Å; K79-E179 IonicContact NZ-OE2 2.82Å; K79-E179 PolarHBondContact NZ-OE2 2.96Å
80	R	80.7	Confident	72.9	Confident	124 Å²	124	88.9 Å²	88.9	47%	0.468	46%	0.455	S	S	.	.	H	α-helix	trans	-68	-44.6	175.5	-167.3	-164.3	-47.2	108.4	7.2	112.5	A76 D77 R78 F83 M84	A76-R80 WeakPolarHBondContact O-CB 3.41Å; A76-R80 PolarHBondContact O-N 3.4Å; A76-R80 VanDerWaalsContact O-N 3.14Å; D77-R80 WeakPolarHBondContact O-CB 3.28Å; D77-R80 PolarHBondContact O-N 3.03Å; D77-R80 IonicContact OD1-CZ 2.73Å; D77-R80 IonicContact OD1-NH1 2.7Å; D77-R80 PolarHBondContact OD1-NH1 3.42Å; D77-R80 IonicContact OD1-NH2 3.18Å; D77-R80 PolarHBondContact OD1-NH2 3.5Å; R78-R80 VanDerWaalsContact C-N 3.25Å; R78-R80 PolarHBondContact O-N 2.85Å; R80-F83 PolarHBondContact O-N 2.95Å; R80-M84 WeakPolarHBondContact O-CB 3.44Å; R80-M84 WeakPolarHBondContact O-CG 3.46Å; R80-M84 PolarHBondContact O-N 3.15Å
81	D	76.8	Confident	74.6	Confident	96 Å²	96	93.6 Å²	93.6	51%	0.513	46%	0.46	S	S	.	.	H	α-helix	trans	-68.4	-41.4	-179.6	-73.8	-24.4	0	0	0	111.5	D77 R78 F83 M84 D85	D77-D81 PolarHBondContact O-N 3.45Å; R78-D81 PolarHBondContact O-N 2.86Å; D81-F83 PolarHBondContact O-N 3.43Å; D81-M84 CarbonylContact O-C 3.56Å; D81-M84 PolarHBondContact O-N 2.71Å; D81-D85 PolarHBondContact O-N 3.42Å
82	A	81.9	Confident	75.2	Confident	62 Å²	62	92.3 Å²	92.3	51%	0.512	46%	0.458	S	S	.	.	H	α-helix	trans	-61.2	-41.3	172.2	0	0	0	0	0	112.5	R78 D85 H86	R78-A82 WeakPolarHBondContact O-CB 3.43Å; R78-A82 PolarHBondContact O-N 2.99Å; A82-D85 PolarHBondContact O-N 3.18Å; A82-H86 WeakPolarHBondContact O-CB 3.43Å; A82-H86 PolarHBondContact O-N 3.12Å
83	F	81.9	Confident	75.8	Confident	132 Å²	132	92.9 Å²	92.9	58%	0.579	46%	0.46	S	S	*	.	H	α-helix	trans	-63	-43.6	172.7	176.3	-107.3	0	0	0	111.8	K79 R80 D81 D85 H86 L87	K79-F83 VanDerWaalsContact O-CB 3.27Å; K79-F83 WeakPolarHBondContact O-CB 3.18Å; K79-F83 PolarHBondContact O-N 3.35Å; R80-F83 PolarHBondContact O-N 2.95Å; D81-F83 PolarHBondContact O-N 3.43Å; F83-D85 PolarHBondContact O-N 3.15Å; F83-H86 PolarHBondContact O-N 3.08Å; F83-L87 HydrophobicContact CD1-CD1 4.01Å; F83-L87 HydrophobicContact CE1-CD1 3.43Å; F83-L87 VanDerWaalsContact CE1-CD1 3.43Å; F83-L87 HydrophobicContact CE2-CD1 4.29Å; F83-L87 HydrophobicContact CZ-CD1 3.59Å; F83-L87 WeakPolarHBondContact O-CB 3.25Å; F83-L87 PolarHBondContact O-N 2.94Å
84	M	82.3	Confident	76.2	Confident	39 Å²	39	91.8 Å²	91.8	19%	0.192	46%	0.457	C	S	.	.	H	α-helix	trans	-66.1	-34	176.6	-75.8	-60.2	-59.5	0	0	112.9	R80 D81 L87 K88	R80-M84 WeakPolarHBondContact O-CB 3.44Å; R80-M84 WeakPolarHBondContact O-CG 3.46Å; R80-M84 PolarHBondContact O-N 3.15Å; D81-M84 CarbonylContact O-C 3.56Å; D81-M84 PolarHBondContact O-N 2.71Å; M84-L87 PolarHBondContact O-N 2.74Å; M84-L87 HydrophobicContact SD-CD1 4.44Å; M84-K88 WeakPolarHBondContact O-CE 3.4Å; M84-K88 VanDerWaalsContact O-CG 3.24Å; M84-K88 WeakPolarHBondContact O-CG 3.42Å; M84-K88 PolarHBondContact O-N 2.92Å
85	D	81.9	Confident	76.9	Confident	90 Å²	90	90.2 Å²	90.2	48%	0.481	44%	0.444	S	S	.	.	H	α-helix	trans	-73.2	-36.7	173.3	-79.7	-17.5	0	0	0	112.3	D81 A82 F83 L87 K88 S89	D81-D85 PolarHBondContact O-N 3.42Å; A82-D85 PolarHBondContact O-N 3.18Å; F83-D85 PolarHBondContact O-N 3.15Å; D85-L87 VanDerWaalsContact C-N 3.31Å; D85-L87 PolarHBondContact O-N 3.03Å; D85-K88 PolarHBondContact O-N 3.14Å; D85-K88 WeakPolarHBondContact OD1-CD 3.32Å; D85-K88 WeakPolarHBondContact OD1-CE 3.35Å; D85-K88 IonicContact OD1-NZ 2.64Å; D85-K88 PolarHBondContact OD1-NZ 3.13Å; D85-S89 VanDerWaalsContact O-CB 3.25Å; D85-S89 WeakPolarHBondContact O-CB 3.25Å; D85-S89 PolarHBondContact O-N 3.09Å
86	H	87	Confident	77.4	Confident	115 Å²	115	93.6 Å²	93.6	53%	0.532	46%	0.462	S	S	.	.	H	α-helix	trans	-60.9	-41.5	169.2	-166	93.3	0	0	0	111.5	A82 F83 S89 K90	A82-H86 WeakPolarHBondContact O-CB 3.43Å; A82-H86 PolarHBondContact O-N 3.12Å; F83-H86 PolarHBondContact O-N 3.08Å; H86-S89 PolarHBondContact O-N 3.19Å; H86-K90 WeakPolarHBondContact O-CB 3.48Å; H86-K90 PolarHBondContact O-N 3.1Å
87	L	82.6	Confident	77.6	Confident	22 Å²	22	94 Å²	94	12%	0.115	47%	0.465	C	S	.	.	H	α-helix	trans	-63.4	-43.4	174.5	-113.3	154.1	0	0	0	112.4	F83 M84 D85 S89 Y91 H94 A95 L98	F83-L87 HydrophobicContact CD1-CD1 4.01Å; F83-L87 HydrophobicContact CE1-CD1 3.43Å; F83-L87 VanDerWaalsContact CE1-CD1 3.43Å; F83-L87 HydrophobicContact CE2-CD1 4.29Å; F83-L87 HydrophobicContact CZ-CD1 3.59Å; F83-L87 WeakPolarHBondContact O-CB 3.25Å; F83-L87 PolarHBondContact O-N 2.94Å; M84-L87 PolarHBondContact O-N 2.74Å; M84-L87 HydrophobicContact SD-CD1 4.44Å; D85-L87 VanDerWaalsContact C-N 3.31Å; D85-L87 PolarHBondContact O-N 3.03Å; L87-S89 VanDerWaalsContact C-N 3.3Å; L87-S89 PolarHBondContact O-N 3.36Å; L87-Y91 CarbonylContact O-C 3.59Å; L87-Y91 VanDerWaalsContact O-CA 3.31Å; L87-Y91 WeakPolarHBondContact O-CA 3.35Å; L87-Y91 PolarHBondContact O-N 3.28Å; L87-H94 HydrophobicContact CD2-CB 4.21Å; L87-A95 HydrophobicContact CB-CB 4.27Å; L87-L98 HydrophobicContact CD1-CD1 4.19Å; L87-L98 HydrophobicContact CD2-CD1 4.27Å
88	K	81.4	Confident	77.6	Confident	83 Å²	83	95.3 Å²	95.3	36%	0.361	47%	0.472	S	S	.	.	H	α-helix	trans	-61.8	-38.7	173.3	-69.6	164	-146.6	163	0	111.8	M84 D85 P92 A95	M84-K88 WeakPolarHBondContact O-CE 3.4Å; M84-K88 VanDerWaalsContact O-CG 3.24Å; M84-K88 WeakPolarHBondContact O-CG 3.42Å; M84-K88 PolarHBondContact O-N 2.92Å; D85-K88 PolarHBondContact O-N 3.14Å; D85-K88 WeakPolarHBondContact OD1-CD 3.32Å; D85-K88 WeakPolarHBondContact OD1-CE 3.35Å; D85-K88 IonicContact OD1-NZ 2.64Å; D85-K88 PolarHBondContact OD1-NZ 3.13Å; K88-P92 WeakPolarHBondContact O-CA 3.27Å; K88-P92 WeakPolarHBondContact O-CB 3.5Å; K88-A95 HydrophobicContact CB-CB 4.29Å; K88-A95 HydrophobicContact CG-CB 3.72Å
89	S	81.3	Confident	77	Confident	100 Å²	100	94 Å²	94	70%	0.699	47%	0.467	S	S	*	.	H	α-helix	trans	-73	-44.4	-177.5	-177.2	0	0	0	0	113.1	D85 H86 L87	D85-S89 VanDerWaalsContact O-CB 3.25Å; D85-S89 WeakPolarHBondContact O-CB 3.25Å; D85-S89 PolarHBondContact O-N 3.09Å; H86-S89 PolarHBondContact O-N 3.19Å; L87-S89 VanDerWaalsContact C-N 3.3Å; L87-S89 PolarHBondContact O-N 3.36Å
90	K	75.3	Confident	76.5	Confident	131 Å²	131	90.6 Å²	90.6	57%	0.57	46%	0.461	S	S	*	.	H	α-helix	trans	-88	-37.8	-179.1	-70.4	-69.1	-170.5	173.4	0	114.1	H86	H86-K90 WeakPolarHBondContact O-CB 3.48Å; H86-K90 PolarHBondContact O-N 3.1Å
91	Y	85	Confident	75.6	Confident	144 Å²	144	90.7 Å²	90.7	57%	0.565	47%	0.467	S	S	*	.			trans	-139.1	60.4	-168.9	-57.5	-70.4	0	0	0	111.6	L87 Q93 H94 A95	L87-Y91 CarbonylContact O-C 3.59Å; L87-Y91 VanDerWaalsContact O-CA 3.31Å; L87-Y91 WeakPolarHBondContact O-CA 3.35Å; L87-Y91 PolarHBondContact O-N 3.28Å; Y91-Q93 PolarHBondContact O-N 3.34Å; Y91-Q93 VanDerWaalsContact O-N 3.08Å; Y91-H94 PolarHBondContact O-N 3.39Å; Y91-A95 PolarHBondContact O-N 2.87Å
92	P	65.2	Low	74.8	Confident	69 Å²	69	91.9 Å²	91.9	45%	0.448	47%	0.469	S	S	.	.	H	α-helix	trans	-54.4	-35.8	-170.9	18	-31.5	0	0	0	114.2	K88 A95 L96	K88-P92 WeakPolarHBondContact O-CA 3.27Å; K88-P92 WeakPolarHBondContact O-CB 3.5Å; P92-A95 PolarHBondContact O-N 3.3Å; P92-L96 WeakPolarHBondContact O-CG 3.38Å; P92-L96 PolarHBondContact O-N 2.9Å
93	Q	67.7	Low	73.5	Confident	146 Å²	146	91.7 Å²	91.7	68%	0.682	46%	0.46	S	S	*	.	H	α-helix	trans	-64.7	-40.5	176.9	-57.2	-62.5	-4.2	0	0	112.4	Y91 L96 A97	Y91-Q93 PolarHBondContact O-N 3.34Å; Y91-Q93 VanDerWaalsContact O-N 3.08Å; Q93-L96 PolarHBondContact O-N 2.99Å; Q93-A97 WeakPolarHBondContact O-CB 3.49Å; Q93-A97 PolarHBondContact O-N 3.45Å
94	H	70.4	Confident	72	Confident	122 Å²	122	93.9 Å²	93.9	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-72.2	-35.5	176.3	-69.8	-87	0	0	0	111.9	L87 Y91 L96 A97 L98	L87-H94 HydrophobicContact CD2-CB 4.21Å; Y91-H94 PolarHBondContact O-N 3.39Å; H94-L96 VanDerWaalsContact C-N 3.34Å; H94-A97 PolarHBondContact O-N 3.03Å; H94-L98 WeakPolarHBondContact O-CB 3.38Å; H94-L98 PolarHBondContact O-N 3.21Å
95	A	75.3	Confident	70.3	Confident	5 Å²	5	97.1 Å²	97.1	4%	0.041	48%	0.481	C	S	.	.	H	α-helix	trans	-64.9	-37.3	174.3	0	0	0	0	0	112.5	L87 K88 Y91 P92 R99	L87-A95 HydrophobicContact CB-CB 4.27Å; K88-A95 HydrophobicContact CB-CB 4.29Å; K88-A95 HydrophobicContact CG-CB 3.72Å; Y91-A95 PolarHBondContact O-N 2.87Å; P92-A95 PolarHBondContact O-N 3.3Å; A95-R99 WeakPolarHBondContact O-CB 3.43Å; A95-R99 PolarHBondContact O-N 2.99Å
96	L	71.9	Confident	68.7	Low	114 Å²	114	99.9 Å²	99.9	60%	0.597	48%	0.484	S	S	*	.	H	α-helix	trans	-69.1	-41.6	172.2	-73	171.2	0	0	0	112	P92 Q93 H94 R99 G100	P92-L96 WeakPolarHBondContact O-CG 3.38Å; P92-L96 PolarHBondContact O-N 2.9Å; Q93-L96 PolarHBondContact O-N 2.99Å; H94-L96 VanDerWaalsContact C-N 3.34Å; L96-R99 PolarHBondContact O-N 3.11Å; L96-G100 PolarHBondContact O-N 3.34Å
97	A	72.1	Confident	66.7	Low	59 Å²	59	101.6 Å²	101.6	49%	0.488	49%	0.492	S	S	.	.	H	α-helix	trans	-62	-46	175.2	0	0	0	0	0	112.2	Q93 H94 G100 Q101	Q93-A97 WeakPolarHBondContact O-CB 3.49Å; Q93-A97 PolarHBondContact O-N 3.45Å; H94-A97 PolarHBondContact O-N 3.03Å; A97-G100 PolarHBondContact O-N 2.88Å; A97-Q101 WeakPolarHBondContact O-CB 3.47Å; A97-Q101 PolarHBondContact O-N 3.42Å
98	L	70.1	Confident	64.8	Low	83 Å²	83	107.8 Å²	107.8	44%	0.435	52%	0.521	S	S	.	.	H	α-helix	trans	-63.5	-41.2	176.6	-82.2	162.3	0	0	0	112.4	L87 H94 Q101 Q102	L87-L98 HydrophobicContact CD1-CD1 4.19Å; L87-L98 HydrophobicContact CD2-CD1 4.27Å; H94-L98 WeakPolarHBondContact O-CB 3.38Å; H94-L98 PolarHBondContact O-N 3.21Å; L98-Q101 PolarHBondContact O-N 2.82Å; L98-Q102 WeakPolarHBondContact O-CB 3.46Å; L98-Q102 PolarHBondContact O-N 2.69Å
99	R	67.3	Low	63	Low	133 Å²	133	108.1 Å²	108.1	50%	0.502	53%	0.529	S	S	.	.	H	α-helix	trans	-63.7	-48.7	173	179.2	171.3	-72.1	-115.6	-5.8	111.2	A95 L96 Q101 Q102 D103	A95-R99 WeakPolarHBondContact O-CB 3.43Å; A95-R99 PolarHBondContact O-N 2.99Å; L96-R99 PolarHBondContact O-N 3.11Å; R99-Q101 VanDerWaalsContact C-N 3.26Å; R99-Q101 PolarHBondContact O-N 3.08Å; R99-Q102 PolarHBondContact O-N 3.24Å; R99-Q102 VanDerWaalsContact O-N 3.14Å; R99-D103 WeakPolarHBondContact CG-OD2 3.32Å; R99-D103 PolarHBondContact O-N 3.03Å
100	G	69.2	Low	60.9	Low	33 Å²	33	105.3 Å²	105.3	34%	0.34	52%	0.516	S	S	.	.	H	α-helix	trans	-61.2	-32.9	177.3	0	0	0	0	0	113.3	L96 A97 R104	L96-G100 PolarHBondContact O-N 3.34Å; A97-G100 PolarHBondContact O-N 2.88Å; G100-R104 VanDerWaalsContact O-CB 3.27Å; G100-R104 WeakPolarHBondContact O-CB 3.4Å; G100-R104 WeakPolarHBondContact O-CD 3.3Å; G100-R104 WeakPolarHBondContact O-CG 3.36Å; G100-R104 PolarHBondContact O-N 3.48Å
101	Q	62.1	Low	59	Low	127 Å²	127	101.5 Å²	101.5	59%	0.593	51%	0.514	S	S	*	.	H	α-helix	trans	-73.1	-40.7	173	-175.5	173.9	-12	0	0	112	A97 L98 R99 R104 M105	A97-Q101 WeakPolarHBondContact O-CB 3.47Å; A97-Q101 PolarHBondContact O-N 3.42Å; L98-Q101 PolarHBondContact O-N 2.82Å; R99-Q101 VanDerWaalsContact C-N 3.26Å; R99-Q101 PolarHBondContact O-N 3.08Å; Q101-R104 PolarHBondContact O-N 2.84Å; Q101-M105 WeakPolarHBondContact O-CB 3.37Å; Q101-M105 VanDerWaalsContact O-CG 3.3Å; Q101-M105 WeakPolarHBondContact O-CG 3.31Å; Q101-M105 PolarHBondContact O-N 2.9Å
102	Q	58.3	Low	56.6	Low	120 Å²	120	105.6 Å²	105.6	56%	0.561	53%	0.529	S	S	*	.	H	α-helix	trans	-67.4	-37.6	175.9	-171.2	178.6	80.6	0	0	112	L98 R99 M105 R106	L98-Q102 WeakPolarHBondContact O-CB 3.46Å; L98-Q102 PolarHBondContact O-N 2.69Å; R99-Q102 PolarHBondContact O-N 3.24Å; R99-Q102 VanDerWaalsContact O-N 3.14Å; Q102-M105 WeakPolarHBondContact O-CB 3.38Å; Q102-M105 PolarHBondContact O-N 3.32Å; Q102-R106 WeakPolarHBondContact O-CB 3.46Å; Q102-R106 PolarHBondContact O-N 2.96Å
103	D	54.3	Low	55.4	Low	59 Å²	59	107.8 Å²	107.8	32%	0.316	54%	0.541	S	S	.	.	H	α-helix	trans	-76.7	-32.1	176.7	-69.3	-35.4	0	0	0	112	R99 R106 E107	R99-D103 WeakPolarHBondContact CG-OD2 3.32Å; R99-D103 PolarHBondContact O-N 3.03Å; D103-R106 CarbonylContact O-C 3.58Å; D103-R106 WeakPolarHBondContact O-CA 3.49Å; D103-R106 VanDerWaalsContact O-CB 3.3Å; D103-R106 WeakPolarHBondContact O-CB 3.46Å; D103-R106 PolarHBondContact O-N 3.26Å; D103-R106 VanDerWaalsContact O-N 3.1Å; D103-R106 IonicContact OD1-CZ 2.72Å; D103-R106 IonicContact OD1-NE 2.96Å; D103-R106 PolarHBondContact OD1-NE 2.92Å; D103-R106 IonicContact OD1-NH2 2.83Å; D103-R106 PolarHBondContact OD1-NH2 3.11Å; D103-E107 PolarHBondContact O-N 3.29Å
104	R	50.8	Low	53.7	Low	177 Å²	177	105 Å²	105	67%	0.668	53%	0.534	S	S	*	.	H	α-helix	trans	-64.7	-36.4	166.1	-78.2	171.6	176.3	177.3	-0.7	113.1	G100 Q101 R106 E107 Q108	G100-R104 VanDerWaalsContact O-CB 3.27Å; G100-R104 WeakPolarHBondContact O-CB 3.4Å; G100-R104 WeakPolarHBondContact O-CD 3.3Å; G100-R104 WeakPolarHBondContact O-CG 3.36Å; G100-R104 PolarHBondContact O-N 3.48Å; Q101-R104 PolarHBondContact O-N 2.84Å; R104-R106 VanDerWaalsContact C-N 3.31Å; R104-E107 PolarHBondContact O-N 3.08Å; R104-Q108 WeakPolarHBondContact O-CG 3.38Å; R104-Q108 PolarHBondContact O-N 3.43Å
105	M	48.3	Very low	51.8	Low	108 Å²	108	104.3 Å²	104.3	53%	0.532	53%	0.534	S	S	.	.	H	α-helix	trans	-64.8	-36.9	169.1	-76.8	-72.7	-68.2	0	0	111.1	Q101 Q102 Q108 V109	Q101-M105 WeakPolarHBondContact O-CB 3.37Å; Q101-M105 VanDerWaalsContact O-CG 3.3Å; Q101-M105 WeakPolarHBondContact O-CG 3.31Å; Q101-M105 PolarHBondContact O-N 2.9Å; Q102-M105 WeakPolarHBondContact O-CB 3.38Å; Q102-M105 PolarHBondContact O-N 3.32Å; M105-Q108 PolarHBondContact O-N 3.41Å; M105-V109 WeakPolarHBondContact O-CB 3.28Å; M105-V109 WeakPolarHBondContact O-CG2 3.31Å; M105-V109 PolarHBondContact O-N 3.13Å
106	R	47.1	Very low	49.9	Very low	147 Å²	147	109 Å²	109	56%	0.555	56%	0.564	S	S	*	*	H	α-helix	trans	-67.5	-33.7	174.9	-162.6	-171.4	-52.8	-75.3	-3.4	112.4	Q102 D103 R104 G110	Q102-R106 WeakPolarHBondContact O-CB 3.46Å; Q102-R106 PolarHBondContact O-N 2.96Å; D103-R106 CarbonylContact O-C 3.58Å; D103-R106 WeakPolarHBondContact O-CA 3.49Å; D103-R106 VanDerWaalsContact O-CB 3.3Å; D103-R106 WeakPolarHBondContact O-CB 3.46Å; D103-R106 PolarHBondContact O-N 3.26Å; D103-R106 VanDerWaalsContact O-N 3.1Å; D103-R106 IonicContact OD1-CZ 2.72Å; D103-R106 IonicContact OD1-NE 2.96Å; D103-R106 PolarHBondContact OD1-NE 2.92Å; D103-R106 IonicContact OD1-NH2 2.83Å; D103-R106 PolarHBondContact OD1-NH2 3.11Å; R104-R106 VanDerWaalsContact C-N 3.31Å; R106-G110 WeakPolarHBondContact O-CA 3.3Å; R106-G110 PolarHBondContact O-N 3.2Å
107	E	45.9	Very low	48.6	Very low	152 Å²	152	108.4 Å²	108.4	71%	0.71	57%	0.565	S	S	*	*	H	α-helix	trans	-71	-46.6	171.1	-71.9	179.9	129.3	0	0	111.7	D103 R104 V109 G110 G111	D103-E107 PolarHBondContact O-N 3.29Å; R104-E107 PolarHBondContact O-N 3.08Å; E107-V109 PolarHBondContact O-N 3Å; E107-G110 PolarHBondContact O-N 3.44Å; E107-G111 PolarHBondContact O-N 3.05Å
108	Q	42.3	Very low	46.9	Very low	152 Å²	152	109.8 Å²	109.8	71%	0.71	57%	0.57	S	S	*	*	H	α-helix	trans	-66.2	-36.3	-180	-73.1	-172.5	13	0	0	113.4	R104 M105	R104-Q108 WeakPolarHBondContact O-CG 3.38Å; R104-Q108 PolarHBondContact O-N 3.43Å; M105-Q108 PolarHBondContact O-N 3.41Å
109	V	42.9	Very low	45.3	Very low	89 Å²	89	111 Å²	111	54%	0.539	58%	0.577	S	S	.	*	H	α-helix	trans	-85.5	-31.5	175.5	178.5	0	0	0	0	111.7	M105 E107 G111 W112	M105-V109 WeakPolarHBondContact O-CB 3.28Å; M105-V109 WeakPolarHBondContact O-CG2 3.31Å; M105-V109 PolarHBondContact O-N 3.13Å; E107-V109 PolarHBondContact O-N 3Å; V109-G111 PolarHBondContact O-N 3.2Å; V109-W112 PolarHBondContact O-N 2.69Å
110	G	37.3	Very low	43.9	Very low	41 Å²	41	111.3 Å²	111.3	42%	0.423	59%	0.587	S	S	.	*	H	α-helix	trans	-64.3	-19.8	179.4	0	0	0	0	0	114.4	R106 E107 W112	R106-G110 WeakPolarHBondContact O-CA 3.3Å; R106-G110 PolarHBondContact O-N 3.2Å; E107-G110 PolarHBondContact O-N 3.44Å; G110-W112 PolarHBondContact O-N 2.91Å
111	G	35.8	Very low	42.4	Very low	51 Å²	51	114.4 Å²	114.4	53%	0.526	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.5	-10.5	168.6	0	0	0	0	0	115.1	E107 V109	E107-G111 PolarHBondContact O-N 3.05Å; V109-G111 PolarHBondContact O-N 3.2Å
112	W	33.8	Very low	40.9	Very low	231 Å²	231	113.2 Å²	113.2	88%	0.875	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.2	17.4	-173.8	-71.4	83.4	0	0	0	114.8	V109 G110	V109-W112 PolarHBondContact O-N 2.69Å; G110-W112 PolarHBondContact O-N 2.91Å
113	T	40.1	Very low	39.6	Very low	114 Å²	114	114.7 Å²	114.7	70%	0.699	62%	0.62	S	S	*	*			trans	-124.4	63.6	166.8	59	0	0	0	0	111.2	D115	T113-D115 PolarHBondContact O-N 3.47Å
114	V	32.5	Very low	38.6	Very low	89 Å²	89	117.3 Å²	117.3	54%	0.539	64%	0.642	S	S	.	*			trans	-78.4	113.6	168.5	179.2	0	0	0	0	108.8	L119	V114-L119 HydrophobicContact CG1-CD1 3.83Å; V114-L119 HydrophobicContact CG1-CG 3.82Å
115	D	31.5	Very low	37.7	Very low	106 Å²	106	113.7 Å²	113.7	57%	0.567	64%	0.644	S	S	*	*			trans	-65.2	123.1	171.6	-159.1	-29.6	0	0	0	109	T113 V117 C118	T113-D115 PolarHBondContact O-N 3.47Å; D115-V117 PolarHBondContact O-N 3.45Å; D115-C118 PolarHBondContact O-N 2.95Å
116	P	34.6	Very low	36.9	Very low	103 Å²	103	117.5 Å²	117.5	67%	0.669	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-6.4	-169	22.8	-35.3	0	0	0	115.4
117	V	44.4	Very low	36.1	Very low	102 Å²	102	118 Å²	118	62%	0.618	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-34.5	173.4	-172.9	0	0	0	0	112.1	D115 L119	D115-V117 PolarHBondContact O-N 3.45Å; V117-L119 PolarHBondContact O-N 3.35Å
118	C	36.6	Very low	35.2	Very low	89 Å²	89	119.8 Å²	119.8	60%	0.601	68%	0.681	S	S	*	*	H	α-helix	trans	-76.2	-22.5	-170.8	-69.7	0	0	0	0	114.6	D115 L120	D115-C118 PolarHBondContact O-N 2.95Å; C118-L120 VanDerWaalsContact C-N 3.34Å; C118-L120 PolarHBondContact O-N 3.43Å
119	L	36.3	Very low	34.4	Very low	109 Å²	109	116.1 Å²	116.1	57%	0.571	68%	0.684	S	S	*	*	H	α-helix	trans	-73.2	-23	-179.2	-79.3	168.5	0	0	0	113.7	V114 V117	V114-L119 HydrophobicContact CG1-CD1 3.83Å; V114-L119 HydrophobicContact CG1-CG 3.82Å; V117-L119 PolarHBondContact O-N 3.35Å
120	L	38.5	Very low	33.6	Very low	138 Å²	138	118.9 Å²	118.9	72%	0.723	70%	0.696	S	S	*	*	H	α-helix	trans	-76.4	-33.6	-178.2	-74.7	165.1	0	0	0	112.8	C118 S122	C118-L120 VanDerWaalsContact C-N 3.34Å; C118-L120 PolarHBondContact O-N 3.43Å; L120-S122 VanDerWaalsContact C-N 3.31Å; L120-S122 PolarHBondContact O-N 2.8Å
121	S	36.1	Very low	33.2	Very low	99 Å²	99	122.3 Å²	122.3	69%	0.692	71%	0.713	S	S	*	*	H	α-helix	trans	-74.5	-17.4	-180	-55.6	0	0	0	0	114
122	S	31.6	Very low	32.8	Very low	101 Å²	101	124.3 Å²	124.3	71%	0.706	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	1.7	-176.2	-165.8	0	0	0	0	114.4	L120	L120-S122 VanDerWaalsContact C-N 3.31Å; L120-S122 PolarHBondContact O-N 2.8Å
123	L	31.7	Very low	33.2	Very low	151 Å²	151	118.6 Å²	118.6	79%	0.791	72%	0.718	S	S	*	*	S	Bend	trans	-111.3	4.4	-175.1	-92	163	0	0	0	114.3
124	C	33.2	Very low	32.6	Very low	115 Å²	115	119.1 Å²	119.1	78%	0.777	73%	0.726	S	S	*	*	S	Bend	trans	-111.2	17.1	-171.3	-156	0	0	0	0	114.5
125	S	31.8	Very low	32.3	Very low	101 Å²	101	118.8 Å²	118.8	71%	0.706	74%	0.74	S	S	*	*	S	Bend	trans	-129.9	25.5	-171.2	-53.1	0	0	0	0	114.9
126	H	31.9	Very low	32.2	Very low	187 Å²	187	119 Å²	119	87%	0.866	76%	0.756	S	S	*	*			trans	-141	98.8	171.9	-104.4	30.1	0	0	0	111.6
127	L	29.3	Very low	31.8	Very low	159 Å²	159	117.8 Å²	117.8	83%	0.832	76%	0.763	S	S	*	*			trans	-178.1	129.8	142.8	-101.5	163.8	0	0	0	109.4
128	H	26.9	Very low	30.8	Very low	189 Å²	189	121.9 Å²	121.9	88%	0.875	78%	0.776	S	S	*	*			trans	64.6	139.3	-175	-58.1	35	0	0	0	113.9
129	G	25.6	Very low	31.3	Very low	74 Å²	74	122.9 Å²	122.9	76%	0.763	78%	0.781	S	S	*	*			cis	166.6	161.5	-5.4	0	0	0	0	0	109.5
130	D	26.6	Very low	30.8	Very low	148 Å²	148	122.1 Å²	122.1	79%	0.791	79%	0.79	S	S	*	*			cis	-163.8	173.3	-9.1	-173.7	61	0	0	0	110.7
131	S	28.2	Very low	30.4	Very low	112 Å²	112	124.8 Å²	124.8	78%	0.783	80%	0.799	S	S	*	*			trans	72.8	162	162.1	-77.5	0	0	0	0	119.6
132	A	27	Very low	29.8	Very low	94 Å²	94	128.2 Å²	128.2	78%	0.777	80%	0.804	S	S	*	*			trans	-126.8	-169.9	-166.9	0	0	0	0	0	110.1
133	P	43.2	Very low	30.1	Very low	111 Å²	111	128.9 Å²	128.9	72%	0.721	81%	0.806	S	S	*	*			cis	-142.2	-170.7	4.9	44.6	-25.3	0	0	0	116.9
134	S	27.8	Very low	29.7	Very low	125 Å²	125	128.3 Å²	128.3	87%	0.874	80%	0.804	S	S	*	*			trans	75.1	143.2	153.3	-63.8	0	0	0	0	120.5
135	G	26	Very low	29.2	Very low	82 Å²	82	131.7 Å²	131.7	85%	0.845	80%	0.801	S	S	*	*			trans	143.6	129.1	170.7	0	0	0	0	0	112.5
136	A	28.7	Very low	28.9	Very low	109 Å²	109	136 Å²	136	90%	0.901	80%	0.803	S	S	*	*			trans	-128.5	159	179.9	0	0	0	0	0	111.3
137	G	25.8	Very low	28.6	Very low	79 Å²	79	131 Å²	131	81%	0.814	79%	0.788	S	S	*	*			trans	114.1	119.6	162.9	0	0	0	0	0	116.5
138	Q	24.7	Very low	28.4	Very low	188 Å²	188	133 Å²	133	88%	0.879	79%	0.79	S	S	*	*			trans	-87.8	175.5	146.5	-93.4	-162.2	27.3	0	0	109.1
139	P	46.2	Very low	28.3	Very low	110 Å²	110	133.6 Å²	133.6	71%	0.714	79%	0.791	S	S	*	*			cis	-132	179.2	-25.9	33.9	-16.9	0	0	0	112.2
140	A	26.9	Very low	28.3	Very low	92 Å²	92	136.3 Å²	136.3	76%	0.76	79%	0.793	S	S	*	*			trans	-177.6	146.9	142.5	0	0	0	0	0	115.5
141	Q	28.9	Very low	28.3	Very low	194 Å²	194	140.6 Å²	140.6	91%	0.907	80%	0.798	S	S	*	*			trans	63.7	149.7	154.7	-66.9	-171.3	10.6	0	0	122.6
142	Q	23.6	Very low	28.4	Very low	171 Å²	171	141 Å²	141	80%	0.799	80%	0.8	S	S	*	*			trans	-114.7	-172.6	174.8	-52.6	-172.2	5.1	0	0	107.6
143	P	37.2	Very low	28.2	Very low	116 Å²	116	141.7 Å²	141.7	75%	0.753	80%	0.8	S	S	*	*			cis	-139.2	-179.8	6	40	-18.4	0	0	0	118.1
144	N	24.8	Very low	27.4	Very low	139 Å²	139	146.8 Å²	146.8	74%	0.743	81%	0.805	S	S	*	*			trans	-72.7	147.2	-170.2	-42.5	-91.5	0	0	0	116.4
145	Y	22.8	Very low	27.2	Very low	185 Å²	185	148.2 Å²	148.2	73%	0.725	80%	0.797	S	S	*	*				-175.9	140.5	122.9	-98.1	-170.1	0	0	0	107.7
146	W	26	Very low	27.2	Very low	193 Å²	193	150 Å²	150	73%	0.731	79%	0.791	S	S	*	*			cis	-151.4	174.4	2.8	-116.1	143.9	0	0	0	111.1
147	S	24.2	Very low	27.2	Very low	81 Å²	81	153.6 Å²	153.6	57%	0.566	79%	0.79	S	S	*	*			trans	-3.3	143.4	164.8	50.7	0	0	0	0	120.4
148	F	25.4	Very low	27.2	Very low	200 Å²	200	153.6 Å²	153.6	88%	0.877	79%	0.79	S	S	*	*			cis	-125.8	157	39.4	-85	-100	0	0	0	115.7
149	K	25	Very low	27.3	Very low	203 Å²	203	149 Å²	149	88%	0.883	78%	0.784	S	S	*	*			trans	-148.8	96.2	-177.7	-160.7	173.3	-169.5	173.2	0	112
150	T	26.4	Very low	26.2	Very low	131 Å²	131	152 Å²	152	80%	0.804	79%	0.788	S	S	*	*			trans	-102.8	91.3	-178.3	-54.3	0	0	0	0	111.8
151	R	26.7	Very low	27	Very low	238 Å²	238	153.7 Å²	153.7	90%	0.898	79%	0.791	S	S	*	*			trans	-169.6	114.3	149.5	-108.3	162.5	-162.7	-95.5	-0.2	113.6
152	S	29.8	Very low	26.8	Very low	119 Å²	119	147.7 Å²	147.7	83%	0.832	78%	0.782	S	S	*	*			trans	68.3	120.2	152.7	-154.8	0	0	0	0	121.2
153	S	22.6	Very low	27	Very low	109 Å²	109	148 Å²	148	76%	0.762	79%	0.788	S	S	*	*			trans	-140.1	127.2	141.2	-171.9	0	0	0	0	105.7
154	R	26.8	Very low	26.5	Very low	219 Å²	219	146.5 Å²	146.5	83%	0.826	79%	0.785	S	S	*	*				69.9	120.3	60.5	-85.2	-170.5	-172.6	-106.8	3.3	115.3
155	H	23.7	Very low	26.7	Very low	154 Å²	154	146.3 Å²	146.3	71%	0.713	78%	0.784	S	S	*	*			trans	86.6	154.8	139.8	-136.9	-88.9	0	0	0	120.9
156	T	25.8	Very low	26.9	Very low	119 Å²	119	145.6 Å²	145.6	73%	0.73	79%	0.788	S	S	*	*			trans	-115.5	-177.8	-176.3	53.7	0	0	0	0	111.8
157	Q	29.2	Very low	26.9	Very low	186 Å²	186	141.5 Å²	141.5	87%	0.869	79%	0.794	S	S	*	*			trans	104	149.2	-176	-62.5	-179.7	12.3	0	0	112.9
158	G	24.8	Very low	27.1	Very low	79 Å²	79	142 Å²	142	81%	0.814	80%	0.803	S	S	*	*			cis	-143.3	-160.5	3.1	0	0	0	0	0	112.6
159	A	26.6	Very low	27.4	Very low	91 Å²	91	141.6 Å²	141.6	75%	0.752	80%	0.801	S	S	*	*			trans	-126.8	147.1	-165.3	0	0	0	0	0	115.1
160	Q	24.2	Very low	27.7	Very low	172 Å²	172	139.8 Å²	139.8	80%	0.804	80%	0.801	S	S	*	*			trans	63.4	164.7	147.2	-69.6	-62.3	-27.4	0	0	117.3
161	P	43.4	Very low	27.6	Very low	128 Å²	128	137.9 Å²	137.9	83%	0.831	79%	0.793	S	S	*	*			cis	-133.1	171	20.5	42.5	-25.1	0	0	0	118
162	G	23.9	Very low	27.6	Very low	68 Å²	68	136.8 Å²	136.8	70%	0.701	79%	0.79	S	S	*	*			trans	-179.1	86.3	169.5	0	0	0	0	0	115.9
163	L	27.8	Very low	27.5	Very low	179 Å²	179	134.9 Å²	134.9	94%	0.937	78%	0.781	S	S	*	*			trans	-54.1	150	165.7	-70.4	153.8	0	0	0	111.7
164	A	27.4	Very low	27.9	Very low	83 Å²	83	135.2 Å²	135.2	69%	0.686	78%	0.784	S	S	*	*			cis	-159.1	-160.2	-4.9	0	0	0	0	0	106.9
165	D	27.3	Very low	28	Very low	136 Å²	136	130 Å²	130	73%	0.727	79%	0.787	S	S	*	*			cis	-153	-127	8.2	-167.2	-112.9	0	0	0	111.6
166	Q	27.4	Very low	28.2	Very low	170 Å²	170	130.4 Å²	130.4	79%	0.794	79%	0.79	S	S	*	*			trans	-105.2	139.4	-162.9	-67.9	164.1	91.6	0	0	116.8
167	A	26.8	Very low	28.4	Very low	106 Å²	106	128.7 Å²	128.7	88%	0.876	78%	0.783	S	S	*	*			trans	-156.8	140.9	132.4	0	0	0	0	0	109.4
168	A	29	Very low	28.7	Very low	91 Å²	91	126.3 Å²	126.3	75%	0.752	78%	0.775	S	S	*	*			trans	-114	149.4	-170	0	0	0	0	0	113.9
169	K	29.7	Very low	29.3	Very low	192 Å²	192	128.3 Å²	128.3	84%	0.835	76%	0.763	S	S	*	*				171.4	129.4	125.4	-94.6	158.6	-173.9	177.5	0	114.5
170	L	32	Very low	29.8	Very low	166 Å²	166	129.5 Å²	129.5	87%	0.869	76%	0.761	S	S	*	*			trans	65.6	154	152.4	-55.4	168.7	0	0	0	117.8
171	S	24.3	Very low	30.1	Very low	91 Å²	91	128.2 Å²	128.2	64%	0.636	76%	0.757	S	S	*	*			cis	-166.9	177.9	-31.8	-163.1	0	0	0	0	108.5
172	Y	27.2	Very low	29.4	Very low	214 Å²	214	128 Å²	128	84%	0.839	76%	0.759	S	S	*	*			trans	71.7	121.4	180	-60.6	-77.9	0	0	0	114.7
173	A	27.9	Very low	29.8	Very low	79 Å²	79	133.2 Å²	133.2	65%	0.653	77%	0.765	S	S	*	*			cis	63.6	136.4	11	0	0	0	0	0	115.8
174	S	29.7	Very low	30	Very low	116 Å²	116	129.2 Å²	129.2	81%	0.811	76%	0.758	S	S	*	*			cis	-168.4	159	-9	-91.4	0	0	0	0	108.5
175	A	29.7	Very low	30.1	Very low	109 Å²	109	134.2 Å²	134.2	90%	0.901	77%	0.767	S	S	*	*			trans	-178.1	106.3	145.5	0	0	0	0	0	112.5
176	E	27.1	Very low	30.4	Very low	164 Å²	164	135 Å²	135	77%	0.766	77%	0.77	S	S	*	*			trans	-147.6	151.3	162.5	-173.1	-178.2	-153.7	0	0	107.7
177	S	30.7	Very low	30.9	Very low	83 Å²	83	133 Å²	133	58%	0.58	77%	0.772	S	S	*	*			trans	69.1	155.4	168.6	-75.8	0	0	0	0	117.9
178	L	35.3	Very low	31.5	Very low	135 Å²	135	136.3 Å²	136.3	71%	0.707	77%	0.774	S	S	*	*			cis	-146.5	160.7	8.2	-133.4	151.8	0	0	0	112
179	E	38.3	Very low	31.5	Very low	121 Å²	121	135.3 Å²	135.3	57%	0.565	77%	0.772	S	S	*	*			trans	-90.4	-163.5	173.1	-58.7	156.2	94.4	0	0	111.4	K79	K79-E179 IonicContact NZ-OE2 2.82Å; K79-E179 PolarHBondContact NZ-OE2 2.96Å
180	T	36.6	Very low	31.4	Very low	116 Å²	116	136.7 Å²	136.7	71%	0.712	78%	0.779	S	S	*	*			trans	79.5	152.5	165.4	85.2	0	0	0	0	117.5
181	M	31.1	Very low	31.6	Very low	145 Å²	145	133.7 Å²	133.7	71%	0.714	77%	0.772	S	S	*	*			cis	-134.5	153.1	9.8	-68.8	-81.4	-74	0	0	112.7
182	S	28.2	Very low	31.9	Very low	125 Å²	125	141.3 Å²	141.3	87%	0.874	79%	0.787	S	S	*	*			trans	-161.6	139.7	133.9	50.9	0	0	0	0	111.1
183	E	33.1	Very low	32.2	Very low	177 Å²	177	139.6 Å²	139.6	83%	0.827	79%	0.788	S	S	*	*			trans	-151	133.2	-172.5	175	179.6	-160.2	0	0	109.7
184	A	31.2	Very low	32.1	Very low	95 Å²	95	143.5 Å²	143.5	79%	0.785	80%	0.798	S	S	*	*			trans	175.1	150	163.6	0	0	0	0	0	108.7
185	E	28.7	Very low	32.9	Very low	187 Å²	187	147.8 Å²	147.8	87%	0.874	80%	0.796	S	S	*	*			cis	-158.8	153.3	-25	-175.9	171	-171.3	0	0	106.6
186	L	34.6	Very low	33	Very low	153 Å²	153	151.6 Å²	151.6	80%	0.801	79%	0.793	S	S	*	*			trans	-129.7	128.3	-178.8	-88.9	169	0	0	0	111.7	L188	L186-L188 PolarHBondContact O-N 2.72Å
187	P	37.8	Very low	33.3	Very low	128 Å²	128	155.3 Å²	155.3	83%	0.831	80%	0.8	S	S	*	*			trans	-75	120.3	169.9	29.9	-32.1	0	0	0	111
188	L	39.3	Very low	34.1	Very low	175 Å²	175	160.7 Å²	160.7	92%	0.916	82%	0.816	S	S	*	*			trans	-91	130.7	174.8	-100.1	154.6	0	0	0	110.9	L186	L186-L188 PolarHBondContact O-N 2.72Å
189	G	29.8	Very low	34	Very low	70 Å²	70	159.6 Å²	159.6	72%	0.722	82%	0.82	S	S	*	*			trans	-138	49.2	-163	0	0	0	0	0	117
190	F	26.6	Very low	34.3	Very low	222 Å²	222	160.8 Å²	160.8	97%	0.974	83%	0.829	S	S	*	*			trans	62.9	175	164	-86.5	-90.4	0	0	0	119.5
191	S	36.2	Very low	34.4	Very low	102 Å²	102	161.3 Å²	161.3	71%	0.713	84%	0.835	S	S	*	*			trans	-136.6	146	-160.2	168.5	0	0	0	0	111.9
192	R	30.7	Very low	34.6	Very low	252 Å²	252	161.8 Å²	161.8	95%	0.951	84%	0.839	S	S	*	*			trans	-154.6	148.4	143.7	-108.3	162.5	-152.3	-118.7	4.4	111.3
193	M	32.9	Very low	34.9	Very low	178 Å²	178	161.2 Å²	161.2	88%	0.877	84%	0.835	S	S	*	*			trans	-105.3	130.1	-173.2	164.3	177.1	58.2	0	0	110.4
194	N	26.6	Very low	35.4	Very low	160 Å²	160	164.7 Å²	164.7	86%	0.856	84%	0.841	S	S	*	*			trans	-151.7	158.7	156.3	-154	-3.6	0	0	0	111.7
195	R	45.9	Very low	35.4	Very low	206 Å²	206	165.1 Å²	165.1	78%	0.777	84%	0.838	S	S	*	*			trans	-104.7	171.4	177	-68.6	-177.2	179.2	174.9	0.5	111.1
196	F	32.8	Very low	35.8	Very low	189 Å²	189	161.2 Å²	161.2	83%	0.829	84%	0.838	S	S	*	*			trans	64.2	103.5	170.1	-67.2	-84.3	0	0	0	117.2
197	R	34	Very low	35.7	Very low	242 Å²	242	158 Å²	158	91%	0.913	83%	0.828	S	S	*	*				-161.6	170.4	86.1	-100.7	172.2	-174.1	-93.7	-1.6	111.6
198	Q	47.5	Very low	35.7	Very low	196 Å²	196	160.3 Å²	160.3	92%	0.916	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-76	121.3	-176.8	-65.2	161.9	-29.7	0	0	110.6
199	S	32.3	Very low	35.7	Very low	112 Å²	112	154.4 Å²	154.4	78%	0.783	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-101	129.6	153.2	50.5	0	0	0	0	108.6
200	L	44	Very low	36.2	Very low	146 Å²	146	160.8 Å²	160.8	76%	0.764	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-66.5	147	171.7	-66.8	168	0	0	0	109	L202	L200-L202 WeakPolarHBondContact O-CD1 3.45Å; L200-L202 PolarHBondContact O-N 3.39Å
201	P	38.8	Very low	36.7	Very low	128 Å²	128	158 Å²	158	83%	0.831	80%	0.801	S	S	*	*			trans	-68.5	98.7	178.1	27.8	-34	0	0	0	110.5	S203	P201-S203 PolarHBondContact O-N 2.82Å
202	L	36.3	Very low	37.1	Very low	154 Å²	154	161.7 Å²	161.7	81%	0.806	80%	0.8	S	S	*	*			trans	-64.1	129.6	172.8	-93.4	72.4	0	0	0	110.6	L200	L200-L202 WeakPolarHBondContact O-CD1 3.45Å; L200-L202 PolarHBondContact O-N 3.39Å
203	S	34.7	Very low	38.1	Very low	113 Å²	113	153.9 Å²	153.9	79%	0.79	78%	0.784	S	S	*	*	S	Bend	trans	21	104.1	149.2	-59.8	0	0	0	0	119.1	P201	P201-S203 PolarHBondContact O-N 2.82Å
204	R	42.1	Very low	39.6	Very low	250 Å²	250	149 Å²	149	94%	0.943	77%	0.765	S	S	*	*			trans	38.1	84.5	144.3	-66.9	-176.6	168.7	-151.3	-0.3	117
205	S	30.9	Very low	42.1	Very low	104 Å²	104	142.3 Å²	142.3	73%	0.727	73%	0.734	S	S	*	*			trans	-72.9	137.6	154.2	-175.5	0	0	0	0	110.8	S207	S205-S207 PolarHBondContact O-N 3.42Å; S205-S207 VanDerWaalsContact O-N 3.16Å
206	A	37.8	Very low	44.3	Very low	105 Å²	105	133.2 Å²	133.2	87%	0.868	70%	0.701	S	S	*	*	S	Bend	trans	-84.2	78.3	175.3	0	0	0	0	0	110.5
207	S	33.3	Very low	47.2	Very low	85 Å²	85	124.4 Å²	124.4	59%	0.594	66%	0.663	S	S	*	*			trans	-145.3	36.5	-175.6	69.1	0	0	0	0	114.4	S205 T209	S205-S207 PolarHBondContact O-N 3.42Å; S205-S207 VanDerWaalsContact O-N 3.16Å; S207-T209 VanDerWaalsContact C-N 3.31Å; S207-T209 PolarHBondContact O-N 2.9Å
208	Q	36.4	Very low	50.1	Low	178 Å²	178	115.6 Å²	115.6	83%	0.832	63%	0.631	S	S	*	*			trans	-93.5	40.6	177.2	-155.7	-172.2	11	0	0	112.9
209	T	39.7	Very low	52.4	Low	51 Å²	51	106.3 Å²	106.3	31%	0.313	59%	0.588	S	S	.	*			trans	-90.3	-20.3	-170.2	55.7	0	0	0	0	114.1	S207 L211 R212 E233	S207-T209 VanDerWaalsContact C-N 3.31Å; S207-T209 PolarHBondContact O-N 2.9Å; T209-L211 PolarHBondContact O-N 2.96Å; T209-R212 PolarHBondContact O-N 3.49Å; T209-R212 VanDerWaalsContact O-N 3.16Å; T209-E233 HydrophobicContact CG2-CG 3.99Å; T209-E233 WeakPolarHBondContact CG2-OE1 3.35Å; T209-E233 VanDerWaalsContact CG2-OE2 3.24Å; T209-E233 WeakPolarHBondContact CG2-OE2 3.27Å
210	K	40.7	Very low	55.4	Low	204 Å²	204	103.1 Å²	103.1	89%	0.887	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.1	6.3	-177.9	-76.8	-171.1	173.4	-177.8	0	116.3
211	L	37.5	Very low	57.8	Low	164 Å²	164	98.1 Å²	98.1	86%	0.859	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130	16.8	176.3	-68.1	175.8	0	0	0	113.1	T209	T209-L211 PolarHBondContact O-N 2.96Å
212	R	43.6	Very low	60.2	Low	179 Å²	179	94.4 Å²	94.4	68%	0.675	52%	0.518	S	S	*	.	S	Bend	trans	-99.2	140.7	170.5	-159.6	174.8	-175.3	95.6	-1.5	109.3	T209	T209-R212 PolarHBondContact O-N 3.49Å; T209-R212 VanDerWaalsContact O-N 3.16Å
213	S	51.6	Low	62.9	Low	88 Å²	88	96.4 Å²	96.4	62%	0.615	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-56.1	141.1	168.1	51.2	0	0	0	0	110.1	G215	S213-G215 PolarHBondContact O-N 3.1Å
214	P	64.3	Low	65.7	Low	75 Å²	75	93.4 Å²	93.4	49%	0.487	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-56.7	125.7	-178.5	23.5	-33.7	0	0	0	110.2	I230	P214-I230 CarbonylContact C-O 3.4Å; P214-I230 VanDerWaalsContact CA-O 3.25Å; P214-I230 WeakPolarHBondContact CA-O 3.3Å; P214-I230 WeakPolarHBondContact CB-O 3.49Å
215	G	80.6	Confident	68.2	Low	20 Å²	20	85.1 Å²	85.1	21%	0.206	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	147.6	-175.1	0	0	0	0	0	111.3	S213 H229 I230 D285	S213-G215 PolarHBondContact O-N 3.1Å; G215-H229 CarbonylContact O-C 3.08Å; G215-H229 WeakPolarHBondContact O-CA 3.44Å; G215-I230 PolarHBondContact N-O 2.89Å; G215-I230 PolarHBondContact O-N 3.03Å; G215-D285 WeakPolarHBondContact CA-OD1 3.36Å
216	V	91.2	Very high	71.3	Confident	14 Å²	14	84.7 Å²	84.7	9%	0.085	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	127.9	175.7	177.5	0	0	0	0	109	F218 R227 V228 D285 R286	V216-F218 HydrophobicContact CG1-CD2 4.47Å; V216-F218 HydrophobicContact CG1-CE2 3.9Å; V216-F218 HydrophobicContact CG1-CZ 3.95Å; V216-R227 HydrophobicContact CG1-CG 3.49Å; V216-R227 VanDerWaalsContact CG1-CG 3.49Å; V216-V228 WeakPolarHBondContact CA-O 3.42Å; V216-D285 PolarHBondContact N-OD1 3.46Å; V216-R286 WeakPolarHBondContact O-CA 3.29Å; V216-R286 PolarHBondContact O-N 3.32Å
217	L	93.6	Very high	73.9	Confident	4 Å²	4	83.9 Å²	83.9	2%	0.021	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	153.9	165.2	-55.7	-173.1	0	0	0	110.9	L219 R227 V228 I230 L240 I283 Q284 I289	L217-L219 HydrophobicContact CB-CD2 4.31Å; L217-R227 WeakPolarHBondContact O-CA 3.27Å; L217-V228 HydrophobicContact CB-CG1 3.8Å; L217-V228 PolarHBondContact N-O 3.24Å; L217-V228 PolarHBondContact O-N 3Å; L217-I230 HydrophobicContact CB-CD1 4.47Å; L217-I230 HydrophobicContact CD1-CD1 3.35Å; L217-I230 HydrophobicContact CG-CD1 3.56Å; L217-I230 HydrophobicContact CG-CG1 4.43Å; L217-L240 HydrophobicContact CD1-CD1 4.46Å; L217-I283 HydrophobicContact CD1-CG2 3.62Å; L217-I283 HydrophobicContact CD2-CG2 3.61Å; L217-I283 HydrophobicContact CG-CG2 4.26Å; L217-Q284 VanDerWaalsContact CD2-O 3.27Å; L217-Q284 WeakPolarHBondContact CD2-O 3.47Å; L217-I289 HydrophobicContact CD1-CD1 3.96Å
218	F	95.6	Very high	76.8	Confident	58 Å²	58	80.3 Å²	80.3	25%	0.254	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	106.7	171.1	-62.6	-88.7	0	0	0	108.7	V216 R227 R286 S287 I288 I289	V216-F218 HydrophobicContact CG1-CD2 4.47Å; V216-F218 HydrophobicContact CG1-CE2 3.9Å; V216-F218 HydrophobicContact CG1-CZ 3.95Å; F218-R227 HydrophobicContact CD1-CB 4.08Å; F218-R227 HydrophobicContact CD1-CG 4.2Å; F218-R227 HydrophobicContact CE1-CB 4.06Å; F218-R227 HydrophobicContact CE1-CG 3.86Å; F218-R227 HydrophobicContact CZ-CG 4.36Å; F218-R286 HydrophobicContact CE2-CB 4.2Å; F218-R286 HydrophobicContact CE2-CG 4.33Å; F218-S287 PolarHBondContact N-O 3.48Å; F218-S287 VanDerWaalsContact N-O 3.16Å; F218-I288 HydrophobicContact CB-CG1 4.24Å; F218-I288 HydrophobicContact CB-CG2 4.5Å; F218-I288 HydrophobicContact CD2-CG1 4.47Å; F218-I288 WeakPolarHBondContact O-CA 3.45Å; F218-I289 PolarHBondContact O-N 3.44Å
219	L	95.9	Very high	79.3	Confident	0 Å²	0	76.7 Å²	76.7	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	121	180	-52.6	-180	0	0	0	109.2	L217 T225 R226 V228 I244 M247 F248 I289 I291	L217-L219 HydrophobicContact CB-CD2 4.31Å; L219-T225 CarbonylContact O-C 3.42Å; L219-T225 WeakPolarHBondContact O-CA 2.8Å; L219-R226 PolarHBondContact N-O 3.19Å; L219-R226 PolarHBondContact O-N 2.9Å; L219-V228 HydrophobicContact CD1-CG1 3.94Å; L219-V228 HydrophobicContact CG-CG1 4.01Å; L219-I244 HydrophobicContact CD1-CG1 4.02Å; L219-I244 HydrophobicContact CD2-CG1 4.41Å; L219-M247 HydrophobicContact CD1-CB 4.18Å; L219-M247 HydrophobicContact CD1-CG 4.04Å; L219-F248 HydrophobicContact CB-CE2 3.81Å; L219-F248 HydrophobicContact CB-CZ 4.34Å; L219-I289 CarbonylContact C-O 3.55Å; L219-I289 WeakPolarHBondContact CA-O 3.45Å; L219-I289 HydrophobicContact CD2-CB 3.98Å; L219-I289 HydrophobicContact CD2-CD1 4.34Å; L219-I289 HydrophobicContact CD2-CG2 4.47Å; L219-I291 HydrophobicContact CB-CD1 4.23Å
220	Q	95.4	Very high	81.4	Confident	46 Å²	46	75.3 Å²	75.3	22%	0.215	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.7	177.7	-177.7	178.1	41	0	0	110.8	G222 E224 T225 I289 K290 I291	Q220-G222 PolarHBondContact NE2-O 3.41Å; Q220-E224 CarbonylContact C-O 3.47Å; Q220-E224 WeakPolarHBondContact CA-O 3.16Å; Q220-T225 HydrophobicContact CB-CG2 4.46Å; Q220-I289 PolarHBondContact N-O 3.3Å; Q220-K290 HydrophobicContact CB-CB 4.44Å; Q220-K290 HydrophobicContact CB-CG 4.33Å; Q220-K290 HydrophobicContact CG-CG 4.39Å; Q220-K290 CarbonylContact O-C 3.56Å; Q220-K290 WeakPolarHBondContact O-CA 3.35Å; Q220-I291 WeakPolarHBondContact O-CD1 3.43Å; Q220-I291 PolarHBondContact O-N 3.05Å
221	F	94.3	Very high	82.7	Confident	40 Å²	40	71 Å²	71	18%	0.175	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	112.4	170.2	178.6	-110.8	0	0	0	110.2	E223 E224 F248 K251 L252 I291 R293	F221-E223 PolarHBondContact O-N 3.47Å; F221-E224 PolarHBondContact N-O 3.1Å; F221-E224 PolarHBondContact O-N 2.96Å; F221-E224 VanDerWaalsContact O-N 3.08Å; F221-F248 HydrophobicContact CB-CD1 4.3Å; F221-F248 HydrophobicContact CB-CE1 3.98Å; F221-F248 HydrophobicContact CB-CE2 4.38Å; F221-F248 HydrophobicContact CB-CZ 4.03Å; F221-K251 HydrophobicContact CD1-CB 4.19Å; F221-K251 HydrophobicContact CD1-CD 4.11Å; F221-K251 HydrophobicContact CE1-CB 3.95Å; F221-K251 HydrophobicContact CE1-CD 4.22Å; F221-L252 HydrophobicContact CB-CD1 4.21Å; F221-L252 HydrophobicContact CD1-CD1 4.29Å; F221-L252 HydrophobicContact CD1-CG 4.35Å; F221-L252 HydrophobicContact CD2-CD1 3.91Å; F221-L252 HydrophobicContact CD2-CD2 4.1Å; F221-L252 HydrophobicContact CD2-CG 4.33Å; F221-L252 HydrophobicContact CE1-CD2 4.36Å; F221-L252 HydrophobicContact CE1-CG 4.35Å; F221-L252 HydrophobicContact CE2-CD1 4.38Å; F221-L252 HydrophobicContact CE2-CD2 3.73Å; F221-L252 HydrophobicContact CE2-CG 4.34Å; F221-L252 HydrophobicContact CG-CD1 3.85Å; F221-L252 HydrophobicContact CG-CG 4.33Å; F221-L252 HydrophobicContact CZ-CD2 3.86Å; F221-L252 HydrophobicContact CZ-CG 4.34Å; F221-I291 HydrophobicContact CB-CB 4.47Å; F221-I291 HydrophobicContact CD2-CB 4.03Å; F221-I291 HydrophobicContact CD2-CG2 3.99Å; F221-R293 HydrophobicContact CE2-CB 4.34Å
222	G	89.6	Confident	84.2	Confident	50 Å²	50	70.1 Å²	70.1	52%	0.515	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	-125.5	-168.7	0	0	0	0	0	111.1	Q220	Q220-G222 PolarHBondContact NE2-O 3.41Å
223	E	91.3	Very high	85.6	Confident	196 Å²	196	67.7 Å²	67.7	92%	0.916	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-20.5	174.9	-59.9	-179.4	161.4	0	0	113	F221	F221-E223 PolarHBondContact O-N 3.47Å
224	E	93.3	Very high	87.1	Confident	50 Å²	50	64.3 Å²	64.3	23%	0.234	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	125	-173.5	-169.1	178.2	-177.6	0	0	111.1	Q220 F221 R226 F248 K251	Q220-E224 CarbonylContact C-O 3.47Å; Q220-E224 WeakPolarHBondContact CA-O 3.16Å; F221-E224 PolarHBondContact N-O 3.1Å; F221-E224 PolarHBondContact O-N 2.96Å; F221-E224 VanDerWaalsContact O-N 3.08Å; E224-R226 HydrophobicContact CG-CG 4.42Å; E224-R226 IonicContact OE1-CZ 2.63Å; E224-R226 IonicContact OE1-NE 2.68Å; E224-R226 PolarHBondContact OE1-NE 3.43Å; E224-R226 IonicContact OE1-NH2 2.7Å; E224-R226 PolarHBondContact OE1-NH2 2.98Å; E224-F248 HydrophobicContact CB-CE1 4.19Å; E224-F248 HydrophobicContact CG-CE1 3.91Å; E224-K251 WeakPolarHBondContact OE2-CE 3.43Å; E224-K251 IonicContact OE2-NZ 3.16Å; E224-K251 PolarHBondContact OE2-NZ 3.19Å
225	T	95.3	Very high	88	Confident	77 Å²	77	65.8 Å²	65.8	47%	0.472	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126.6	174.4	-53.8	0	0	0	0	109.9	L219 Q220	L219-T225 CarbonylContact O-C 3.42Å; L219-T225 WeakPolarHBondContact O-CA 2.8Å; Q220-T225 HydrophobicContact CB-CG2 4.46Å
226	R	95.3	Very high	88.4	Confident	95 Å²	95	67 Å²	67	36%	0.358	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	128.5	179.3	-68.3	-173.8	173.5	-132	-12	110.4	L219 E224 M247 F248	L219-R226 PolarHBondContact N-O 3.19Å; L219-R226 PolarHBondContact O-N 2.9Å; E224-R226 HydrophobicContact CG-CG 4.42Å; E224-R226 IonicContact OE1-CZ 2.63Å; E224-R226 IonicContact OE1-NE 2.68Å; E224-R226 PolarHBondContact OE1-NE 3.43Å; E224-R226 IonicContact OE1-NH2 2.7Å; E224-R226 PolarHBondContact OE1-NH2 2.98Å; R226-M247 HydrophobicContact CB-CE 3.87Å; R226-M247 WeakPolarHBondContact CD-O 3.28Å; R226-M247 PolarHBondContact NE-O 3.45Å; R226-M247 PolarHBondContact NH1-O 3.2Å; R226-F248 HydrophobicContact CB-CE1 4.44Å; R226-F248 HydrophobicContact CB-CE2 4.45Å; R226-F248 HydrophobicContact CB-CZ 3.95Å; R226-F248 HydrophobicContact CG-CE1 3.78Å; R226-F248 HydrophobicContact CG-CZ 3.8Å
227	R	94.3	Very high	88.4	Confident	87 Å²	87	69.7 Å²	69.7	33%	0.328	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	132.3	171.6	-178.3	179.9	157.1	-177.8	-3.8	109.5	E54 V216 L217 F218 H229	E54-R227 IonicContact OE1-NH1 2.62Å; V216-R227 HydrophobicContact CG1-CG 3.49Å; V216-R227 VanDerWaalsContact CG1-CG 3.49Å; L217-R227 WeakPolarHBondContact O-CA 3.27Å; F218-R227 HydrophobicContact CD1-CB 4.08Å; F218-R227 HydrophobicContact CD1-CG 4.2Å; F218-R227 HydrophobicContact CE1-CB 4.06Å; F218-R227 HydrophobicContact CE1-CG 3.86Å; F218-R227 HydrophobicContact CZ-CG 4.36Å; R227-H229 PolarHBondContact NH2-NE2 2.91Å
228	V	92.5	Very high	88.3	Confident	11 Å²	11	73.2 Å²	73.2	7%	0.067	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	142.8	179.1	66	0	0	0	0	110.5	V216 L217 L219 I230 L243 M247	V216-V228 WeakPolarHBondContact CA-O 3.42Å; L217-V228 HydrophobicContact CB-CG1 3.8Å; L217-V228 PolarHBondContact N-O 3.24Å; L217-V228 PolarHBondContact O-N 3Å; L219-V228 HydrophobicContact CD1-CG1 3.94Å; L219-V228 HydrophobicContact CG-CG1 4.01Å; V228-I230 HydrophobicContact CG1-CG1 4.48Å; V228-L243 HydrophobicContact CG1-CD2 3.92Å; V228-L243 HydrophobicContact CG2-CD1 3.78Å; V228-L243 HydrophobicContact CG2-CD2 4.07Å; V228-L243 HydrophobicContact CG2-CG 4.06Å; V228-M247 HydrophobicContact CB-CE 4.05Å; V228-M247 HydrophobicContact CB-CG 4.23Å; V228-M247 HydrophobicContact CB-SD 4.12Å; V228-M247 HydrophobicContact CG2-CE 4.33Å; V228-M247 HydrophobicContact CG2-CG 4.03Å; V228-M247 HydrophobicContact CG2-SD 3.77Å
229	H	89.4	Confident	88.1	Confident	101 Å²	101	73.7 Å²	73.7	47%	0.468	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	138.4	175.8	-62.8	90.6	0	0	0	109.5	G215 R227	G215-H229 CarbonylContact O-C 3.08Å; G215-H229 WeakPolarHBondContact O-CA 3.44Å; R227-H229 PolarHBondContact NH2-NE2 2.91Å
230	I	84.6	Confident	87.9	Confident	23 Å²	23	73.7 Å²	73.7	12%	0.118	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	116.1	-170.9	-63.7	-165.5	0	0	0	109.4	P214 G215 L217 V228 H232 V234 L243	P214-I230 CarbonylContact C-O 3.4Å; P214-I230 VanDerWaalsContact CA-O 3.25Å; P214-I230 WeakPolarHBondContact CA-O 3.3Å; P214-I230 WeakPolarHBondContact CB-O 3.49Å; G215-I230 PolarHBondContact N-O 2.89Å; G215-I230 PolarHBondContact O-N 3.03Å; L217-I230 HydrophobicContact CB-CD1 4.47Å; L217-I230 HydrophobicContact CD1-CD1 3.35Å; L217-I230 HydrophobicContact CG-CD1 3.56Å; L217-I230 HydrophobicContact CG-CG1 4.43Å; V228-I230 HydrophobicContact CG1-CG1 4.48Å; I230-H232 WeakPolarHBondContact CG2-O 3.19Å; I230-V234 HydrophobicContact CD1-CG2 3.62Å; I230-V234 HydrophobicContact CG2-CG2 4.16Å; I230-L243 HydrophobicContact CD1-CD2 3.44Å; I230-L243 VanDerWaalsContact CD1-CD2 3.44Å; I230-L243 HydrophobicContact CG1-CD2 3.96Å
231	T	67.8	Low	87.8	Confident	112 Å²	112	72.1 Å²	72.1	69%	0.687	38%	0.383	S	S	*	.	S	Bend	trans	-86.3	-18.2	-177.2	50.2	0	0	0	0	113.7
232	H	67.9	Low	87.7	Confident	146 Å²	146	72.4 Å²	72.4	68%	0.676	39%	0.393	S	S	*	.	S	Bend	trans	-137.9	134.5	-178.9	-56.8	-36.5	0	0	0	109.1	I230 V234	I230-H232 WeakPolarHBondContact CG2-O 3.19Å; H232-V234 PolarHBondContact O-N 2.98Å
233	E	74.7	Confident	87.8	Confident	128 Å²	128	72 Å²	72	60%	0.598	38%	0.378	S	S	*	.			trans	-52.8	139.3	179.2	-67.4	179.4	168.2	0	0	111.2	T209 S235	T209-E233 HydrophobicContact CG2-CG 3.99Å; T209-E233 WeakPolarHBondContact CG2-OE1 3.35Å; T209-E233 VanDerWaalsContact CG2-OE2 3.24Å; T209-E233 WeakPolarHBondContact CG2-OE2 3.27Å; E233-S235 VanDerWaalsContact C-N 3.31Å; E233-S235 PolarHBondContact O-N 2.93Å
234	V	83	Confident	87.9	Confident	18 Å²	18	62.6 Å²	62.6	11%	0.109	34%	0.335	C	S	.	.			trans	-73.1	86.2	-172.7	-177.5	0	0	0	0	109.1	I230 H232 S236 L240 V280 I283	I230-V234 HydrophobicContact CD1-CG2 3.62Å; I230-V234 HydrophobicContact CG2-CG2 4.16Å; H232-V234 PolarHBondContact O-N 2.98Å; V234-S236 VanDerWaalsContact C-N 3.32Å; V234-S236 PolarHBondContact O-N 2.76Å; V234-L240 HydrophobicContact CG1-CB 3.85Å; V234-L240 HydrophobicContact CG1-CD1 4.42Å; V234-V280 WeakPolarHBondContact O-CB 3.45Å; V234-V280 VanDerWaalsContact O-CG2 3.31Å; V234-V280 WeakPolarHBondContact O-CG2 3.37Å; V234-I283 HydrophobicContact CB-CD1 3.91Å; V234-I283 HydrophobicContact CG1-CD1 3.76Å; V234-I283 HydrophobicContact CG2-CD1 4.48Å; V234-I283 HydrophobicContact CG2-CG2 4.4Å
235	S	82.6	Confident	87.9	Confident	105 Å²	105	61.1 Å²	61.1	73%	0.734	33%	0.331	S	S	*	.			trans	-77.5	-10.4	-169.6	57.7	0	0	0	0	115.2	E233	E233-S235 VanDerWaalsContact C-N 3.31Å; E233-S235 PolarHBondContact O-N 2.93Å
236	S	89.8	Confident	87.8	Confident	45 Å²	45	64.4 Å²	64.4	32%	0.315	34%	0.34	S	S	.	.	S	Bend	trans	-151	155.5	175.6	86.1	0	0	0	0	111.9	V234 D238 T239 L240	V234-S236 VanDerWaalsContact C-N 3.32Å; V234-S236 PolarHBondContact O-N 2.76Å; S236-D238 PolarHBondContact O-N 3.4Å; S236-D238 PolarHBondContact OG-N 3.33Å; S236-T239 WeakPolarHBondContact O-CB 3.43Å; S236-T239 PolarHBondContact O-N 2.72Å; S236-T239 VanDerWaalsContact O-N 3.12Å; S236-T239 PolarHBondContact O-OG1 2.83Å; S236-T239 PolarHBondContact OG-N 3.23Å; S236-T239 VanDerWaalsContact OG-N 3.07Å; S236-T239 PolarHBondContact OG-OG1 3.15Å; S236-L240 PolarHBondContact O-N 2.75Å
237	L	90.3	Very high	87.7	Confident	71 Å²	71	61.5 Å²	61.5	37%	0.372	33%	0.331	S	S	.	.	H	α-helix	trans	-63.9	-30.5	176.3	-166.7	72	0	0	0	111.5	L240 H241 V280	L237-L240 HydrophobicContact CD1-CD2 4.19Å; L237-L240 CarbonylContact O-C 3.6Å; L237-L240 WeakPolarHBondContact O-CB 3.36Å; L237-L240 PolarHBondContact O-N 3.42Å; L237-L240 VanDerWaalsContact O-N 3.17Å; L237-H241 PolarHBondContact O-N 3.44Å; L237-H241 PolarHBondContact O-ND1 2.99Å; L237-V280 HydrophobicContact CB-CG1 4.11Å; L237-V280 HydrophobicContact CD1-CG1 4.06Å
238	D	91.6	Very high	87.7	Confident	79 Å²	79	57.6 Å²	57.6	42%	0.422	32%	0.317	S	S	.	.	H	α-helix	trans	-70.5	-30.9	174.3	-86.5	-11	0	0	0	113.2	S236 L240 H241 A242 K258	S236-D238 PolarHBondContact O-N 3.4Å; S236-D238 PolarHBondContact OG-N 3.33Å; D238-L240 VanDerWaalsContact C-N 3.29Å; D238-H241 PolarHBondContact O-N 3.36Å; D238-H241 IonicContact OD1-ND1 2.72Å; D238-H241 PolarHBondContact OD1-ND1 3.19Å; D238-H241 VanDerWaalsContact OD1-ND1 3.16Å; D238-A242 WeakPolarHBondContact O-CB 3.44Å; D238-A242 PolarHBondContact O-N 3.2Å; D238-K258 WeakPolarHBondContact OD1-CE 3.49Å; D238-K258 IonicContact OD1-NZ 2.67Å; D238-K258 PolarHBondContact OD1-NZ 3.16Å; D238-K258 IonicContact OD2-NZ 3.3Å; D238-K258 PolarHBondContact OD2-NZ 3.41Å
239	T	90.8	Very high	87.5	Confident	68 Å²	68	61 Å²	61	42%	0.417	34%	0.339	S	S	.	.	H	α-helix	trans	-63.8	-38.7	169.3	-33.2	0	0	0	0	110.5	S236 L243	S236-T239 WeakPolarHBondContact O-CB 3.43Å; S236-T239 PolarHBondContact O-N 2.72Å; S236-T239 VanDerWaalsContact O-N 3.12Å; S236-T239 PolarHBondContact O-OG1 2.83Å; S236-T239 PolarHBondContact OG-N 3.23Å; S236-T239 VanDerWaalsContact OG-N 3.07Å; S236-T239 PolarHBondContact OG-OG1 3.15Å; T239-L243 WeakPolarHBondContact O-CB 3.11Å; T239-L243 PolarHBondContact O-N 3.13Å; T239-L243 VanDerWaalsContact O-N 3.11Å
240	L	91.9	Very high	87.4	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-68.2	-42.9	174.1	-173.1	64.2	0	0	0	112.1	L217 V234 S236 L237 D238 A242 L243 I244 I264 L277 I283 I289	L217-L240 HydrophobicContact CD1-CD1 4.46Å; V234-L240 HydrophobicContact CG1-CB 3.85Å; V234-L240 HydrophobicContact CG1-CD1 4.42Å; S236-L240 PolarHBondContact O-N 2.75Å; L237-L240 HydrophobicContact CD1-CD2 4.19Å; L237-L240 CarbonylContact O-C 3.6Å; L237-L240 WeakPolarHBondContact O-CB 3.36Å; L237-L240 PolarHBondContact O-N 3.42Å; L237-L240 VanDerWaalsContact O-N 3.17Å; D238-L240 VanDerWaalsContact C-N 3.29Å; L240-A242 VanDerWaalsContact C-N 3.35Å; L240-A242 PolarHBondContact O-N 3.08Å; L240-L243 WeakPolarHBondContact O-CB 3Å; L240-L243 PolarHBondContact O-N 2.83Å; L240-I244 HydrophobicContact CD1-CD1 4.24Å; L240-I244 HydrophobicContact CD1-CG1 4.44Å; L240-I244 HydrophobicContact CD2-CD1 4.33Å; L240-I244 HydrophobicContact CG-CD1 3.8Å; L240-I244 HydrophobicContact CG-CG1 4.4Å; L240-I244 WeakPolarHBondContact O-CG1 3.27Å; L240-I244 PolarHBondContact O-N 3.42Å; L240-I264 HydrophobicContact CD2-CG2 4.14Å; L240-L277 HydrophobicContact CD2-CD2 3.49Å; L240-L277 VanDerWaalsContact CD2-CD2 3.49Å; L240-I283 HydrophobicContact CD1-CD1 4.38Å; L240-I283 HydrophobicContact CD2-CD1 4.04Å; L240-I289 HydrophobicContact CD1-CD1 4.07Å; L240-I289 HydrophobicContact CD2-CD1 4.29Å
241	H	92.9	Very high	87.5	Confident	12 Å²	12	68.7 Å²	68.7	6%	0.056	37%	0.373	C	S	.	.	H	α-helix	trans	-61.3	-42.5	176.2	-65.5	152.9	0	0	0	112	L237 D238 L243 I244 A245 M254 L257 I264	L237-H241 PolarHBondContact O-N 3.44Å; L237-H241 PolarHBondContact O-ND1 2.99Å; D238-H241 PolarHBondContact O-N 3.36Å; D238-H241 IonicContact OD1-ND1 2.72Å; D238-H241 PolarHBondContact OD1-ND1 3.19Å; D238-H241 VanDerWaalsContact OD1-ND1 3.16Å; H241-L243 VanDerWaalsContact C-N 3.32Å; H241-L243 PolarHBondContact O-N 3.43Å; H241-I244 PolarHBondContact O-N 2.85Å; H241-A245 WeakPolarHBondContact O-CB 3.37Å; H241-A245 PolarHBondContact O-N 3.44Å; H241-M254 HydrophobicContact CB-CE 4.13Å; H241-M254 HydrophobicContact CB-SD 3.67Å; H241-L257 HydrophobicContact CB-CB 4.3Å; H241-L257 HydrophobicContact CB-CD1 4.25Å; H241-L257 WeakPolarHBondContact O-CD1 3.5Å; H241-I264 VanDerWaalsContact CD2-CD1 3.49Å; H241-I264 WeakPolarHBondContact CD2-CD1 3.42Å; H241-I264 WeakPolarHBondContact NE2-CD1 3.27Å
242	A	92.4	Very high	88.6	Confident	46 Å²	46	63.4 Å²	63.4	38%	0.38	34%	0.341	S	S	.	.	H	α-helix	trans	-60.8	-43.2	174.6	0	0	0	0	0	111.2	D238 L240 H246 M254	D238-A242 WeakPolarHBondContact O-CB 3.44Å; D238-A242 PolarHBondContact O-N 3.2Å; L240-A242 VanDerWaalsContact C-N 3.35Å; L240-A242 PolarHBondContact O-N 3.08Å; A242-H246 VanDerWaalsContact O-CB 3.23Å; A242-H246 WeakPolarHBondContact O-CB 3.38Å; A242-H246 PolarHBondContact O-N 3.24Å; A242-M254 HydrophobicContact CB-CE 3.97Å
243	L	93.1	Very high	89.6	Confident	41 Å²	41	60.1 Å²	60.1	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-64.5	-45.3	177.2	-164.1	69.1	0	0	0	112.2	V228 I230 T239 L240 H241 H246 M247	V228-L243 HydrophobicContact CG1-CD2 3.92Å; V228-L243 HydrophobicContact CG2-CD1 3.78Å; V228-L243 HydrophobicContact CG2-CD2 4.07Å; V228-L243 HydrophobicContact CG2-CG 4.06Å; I230-L243 HydrophobicContact CD1-CD2 3.44Å; I230-L243 VanDerWaalsContact CD1-CD2 3.44Å; I230-L243 HydrophobicContact CG1-CD2 3.96Å; T239-L243 WeakPolarHBondContact O-CB 3.11Å; T239-L243 PolarHBondContact O-N 3.13Å; T239-L243 VanDerWaalsContact O-N 3.11Å; L240-L243 WeakPolarHBondContact O-CB 3Å; L240-L243 PolarHBondContact O-N 2.83Å; H241-L243 VanDerWaalsContact C-N 3.32Å; H241-L243 PolarHBondContact O-N 3.43Å; L243-H246 PolarHBondContact O-N 2.92Å; L243-M247 WeakPolarHBondContact O-CB 3.07Å; L243-M247 VanDerWaalsContact O-CG 3.22Å; L243-M247 WeakPolarHBondContact O-CG 3.22Å; L243-M247 PolarHBondContact O-N 3.26Å
244	I	93.4	Very high	90.5	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64.5	-45.9	178.4	-67.5	165.1	0	0	0	110.7	L219 L240 H241 H246 M247 F248 L252 L257 I264 I291	L219-I244 HydrophobicContact CD1-CG1 4.02Å; L219-I244 HydrophobicContact CD2-CG1 4.41Å; L240-I244 HydrophobicContact CD1-CD1 4.24Å; L240-I244 HydrophobicContact CD1-CG1 4.44Å; L240-I244 HydrophobicContact CD2-CD1 4.33Å; L240-I244 HydrophobicContact CG-CD1 3.8Å; L240-I244 HydrophobicContact CG-CG1 4.4Å; L240-I244 WeakPolarHBondContact O-CG1 3.27Å; L240-I244 PolarHBondContact O-N 3.42Å; H241-I244 PolarHBondContact O-N 2.85Å; I244-H246 VanDerWaalsContact C-N 3.35Å; I244-H246 PolarHBondContact O-N 2.82Å; I244-M247 PolarHBondContact O-N 3.32Å; I244-F248 HydrophobicContact CG2-CD2 4.25Å; I244-F248 WeakPolarHBondContact O-CD2 3.36Å; I244-F248 PolarHBondContact O-N 2.94Å; I244-L252 HydrophobicContact CG2-CD1 3.62Å; I244-L257 HydrophobicContact CB-CD1 3.9Å; I244-L257 HydrophobicContact CB-CD2 4.4Å; I244-L257 HydrophobicContact CG2-CD1 3.79Å; I244-L257 HydrophobicContact CG2-CD2 3.66Å; I244-L257 HydrophobicContact CG2-CG 4.39Å; I244-I264 HydrophobicContact CD1-CD1 3.84Å; I244-I291 HydrophobicContact CD1-CD1 4.25Å; I244-I291 HydrophobicContact CD1-CG1 3.93Å; I244-I291 HydrophobicContact CG1-CD1 4.33Å; I244-I291 HydrophobicContact CG1-CG1 4.41Å; I244-I291 HydrophobicContact CG2-CD1 4.18Å; I244-I291 HydrophobicContact CG2-CG1 3.93Å
245	A	93	Very high	90.8	Very high	18 Å²	18	59.2 Å²	59.2	15%	0.149	34%	0.341	C	S	.	.	H	α-helix	trans	-62.1	-41.5	176.7	0	0	0	0	0	111.7	H241 F248 P249 L257	H241-A245 WeakPolarHBondContact O-CB 3.37Å; H241-A245 PolarHBondContact O-N 3.44Å; A245-F248 CarbonylContact O-C 3.57Å; A245-F248 PolarHBondContact O-N 3.49Å; A245-P249 WeakPolarHBondContact O-CA 3.22Å; A245-P249 VanDerWaalsContact O-N 3.11Å; A245-L257 HydrophobicContact CB-CD1 3.9Å
246	H	93	Very high	91.1	Very high	147 Å²	147	56.1 Å²	56.1	68%	0.681	32%	0.315	S	S	*	.	H	α-helix	trans	-67	-34.1	176.1	-176.2	78	0	0	0	112.9	A242 L243 I244 P249	A242-H246 VanDerWaalsContact O-CB 3.23Å; A242-H246 WeakPolarHBondContact O-CB 3.38Å; A242-H246 PolarHBondContact O-N 3.24Å; L243-H246 PolarHBondContact O-N 2.92Å; I244-H246 VanDerWaalsContact C-N 3.35Å; I244-H246 PolarHBondContact O-N 2.82Å; H246-P249 WeakPolarHBondContact O-CD 3.32Å
247	M	93.6	Very high	91.2	Very high	34 Å²	34	54.2 Å²	54.2	17%	0.167	30%	0.302	C	S	.	.	H	α-helix	trans	-77.9	-26.1	176.6	-68.7	-59.5	-65.8	0	0	113	L219 R226 V228 L243 I244 P249	L219-M247 HydrophobicContact CD1-CB 4.18Å; L219-M247 HydrophobicContact CD1-CG 4.04Å; R226-M247 HydrophobicContact CB-CE 3.87Å; R226-M247 WeakPolarHBondContact CD-O 3.28Å; R226-M247 PolarHBondContact NE-O 3.45Å; R226-M247 PolarHBondContact NH1-O 3.2Å; V228-M247 HydrophobicContact CB-CE 4.05Å; V228-M247 HydrophobicContact CB-CG 4.23Å; V228-M247 HydrophobicContact CB-SD 4.12Å; V228-M247 HydrophobicContact CG2-CE 4.33Å; V228-M247 HydrophobicContact CG2-CG 4.03Å; V228-M247 HydrophobicContact CG2-SD 3.77Å; L243-M247 WeakPolarHBondContact O-CB 3.07Å; L243-M247 VanDerWaalsContact O-CG 3.22Å; L243-M247 WeakPolarHBondContact O-CG 3.22Å; L243-M247 PolarHBondContact O-N 3.26Å; I244-M247 PolarHBondContact O-N 3.32Å; M247-P249 VanDerWaalsContact C-CD 3.45Å
248	F	93.3	Very high	91.1	Very high	4 Å²	4	56.2 Å²	56.2	2%	0.018	31%	0.307	C	S	.	.	S	Bend	trans	-126.9	50.6	-179.6	-62.4	-84	0	0	0	113.8	L219 F221 E224 R226 I244 A245 Q250 K251 L252	L219-F248 HydrophobicContact CB-CE2 3.81Å; L219-F248 HydrophobicContact CB-CZ 4.34Å; F221-F248 HydrophobicContact CB-CD1 4.3Å; F221-F248 HydrophobicContact CB-CE1 3.98Å; F221-F248 HydrophobicContact CB-CE2 4.38Å; F221-F248 HydrophobicContact CB-CZ 4.03Å; E224-F248 HydrophobicContact CB-CE1 4.19Å; E224-F248 HydrophobicContact CG-CE1 3.91Å; R226-F248 HydrophobicContact CB-CE1 4.44Å; R226-F248 HydrophobicContact CB-CE2 4.45Å; R226-F248 HydrophobicContact CB-CZ 3.95Å; R226-F248 HydrophobicContact CG-CE1 3.78Å; R226-F248 HydrophobicContact CG-CZ 3.8Å; I244-F248 HydrophobicContact CG2-CD2 4.25Å; I244-F248 WeakPolarHBondContact O-CD2 3.36Å; I244-F248 PolarHBondContact O-N 2.94Å; A245-F248 CarbonylContact O-C 3.57Å; A245-F248 PolarHBondContact O-N 3.49Å; F248-Q250 PolarHBondContact O-N 3.46Å; F248-Q250 VanDerWaalsContact O-N 3.09Å; F248-K251 HydrophobicContact CB-CB 4.43Å; F248-K251 PolarHBondContact O-N 3.4Å; F248-L252 HydrophobicContact CB-CB 4.2Å; F248-L252 HydrophobicContact CB-CD1 4Å; F248-L252 HydrophobicContact CB-CG 4.26Å; F248-L252 HydrophobicContact CD2-CD1 4.17Å; F248-L252 HydrophobicContact CG-CD1 4.23Å; F248-L252 PolarHBondContact O-N 2.76Å
249	P	89.3	Confident	91	Very high	82 Å²	82	53.9 Å²	53.9	53%	0.532	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-22.5	-164.2	27.2	-35.7	0	0	0	114.2	A245 H246 M247	A245-P249 WeakPolarHBondContact O-CA 3.22Å; A245-P249 VanDerWaalsContact O-N 3.11Å; H246-P249 WeakPolarHBondContact O-CD 3.32Å; M247-P249 VanDerWaalsContact C-CD 3.45Å
250	Q	87.4	Confident	90.7	Very high	182 Å²	182	56.7 Å²	56.7	85%	0.85	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	1.7	176.8	-55.3	-65.1	2.3	0	0	113.5	F248	F248-Q250 PolarHBondContact O-N 3.46Å; F248-Q250 VanDerWaalsContact O-N 3.09Å
251	K	86.4	Confident	90.5	Very high	104 Å²	104	60.3 Å²	60.3	45%	0.452	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.4	-28.1	-173.7	-68.2	-175.3	177	178.9	0	114.3	F221 E224 F248 M256	F221-K251 HydrophobicContact CD1-CB 4.19Å; F221-K251 HydrophobicContact CD1-CD 4.11Å; F221-K251 HydrophobicContact CE1-CB 3.95Å; F221-K251 HydrophobicContact CE1-CD 4.22Å; E224-K251 WeakPolarHBondContact OE2-CE 3.43Å; E224-K251 IonicContact OE2-NZ 3.16Å; E224-K251 PolarHBondContact OE2-NZ 3.19Å; F248-K251 HydrophobicContact CB-CB 4.43Å; F248-K251 PolarHBondContact O-N 3.4Å; K251-M256 WeakPolarHBondContact O-CE 3.47Å
252	L	89.8	Confident	90.4	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.01	34%	0.337	C	S	.	.			trans	-135.6	119.9	-176.3	-67.3	172.5	0	0	0	110	F221 I244 F248 M256 L257 I291	F221-L252 HydrophobicContact CB-CD1 4.21Å; F221-L252 HydrophobicContact CD1-CD1 4.29Å; F221-L252 HydrophobicContact CD1-CG 4.35Å; F221-L252 HydrophobicContact CD2-CD1 3.91Å; F221-L252 HydrophobicContact CD2-CD2 4.1Å; F221-L252 HydrophobicContact CD2-CG 4.33Å; F221-L252 HydrophobicContact CE1-CD2 4.36Å; F221-L252 HydrophobicContact CE1-CG 4.35Å; F221-L252 HydrophobicContact CE2-CD1 4.38Å; F221-L252 HydrophobicContact CE2-CD2 3.73Å; F221-L252 HydrophobicContact CE2-CG 4.34Å; F221-L252 HydrophobicContact CG-CD1 3.85Å; F221-L252 HydrophobicContact CG-CG 4.33Å; F221-L252 HydrophobicContact CZ-CD2 3.86Å; F221-L252 HydrophobicContact CZ-CG 4.34Å; I244-L252 HydrophobicContact CG2-CD1 3.62Å; F248-L252 HydrophobicContact CB-CB 4.2Å; F248-L252 HydrophobicContact CB-CD1 4Å; F248-L252 HydrophobicContact CB-CG 4.26Å; F248-L252 HydrophobicContact CD2-CD1 4.17Å; F248-L252 HydrophobicContact CG-CD1 4.23Å; F248-L252 PolarHBondContact O-N 2.76Å; L252-M256 HydrophobicContact CD2-CE 4.12Å; L252-L257 HydrophobicContact CD1-CD2 4.28Å; L252-L257 HydrophobicContact CD2-CD2 4.42Å; L252-I291 HydrophobicContact CD1-CB 4.48Å; L252-I291 HydrophobicContact CD1-CG2 4.04Å; L252-I291 HydrophobicContact CD2-CG2 4.49Å
253	T	90.2	Very high	90.4	Very high	77 Å²	77	59.1 Å²	59.1	47%	0.472	33%	0.327	S	S	.	.			trans	-97.7	158.8	171.6	68.1	0	0	0	0	110.9	G255 M256 L257	T253-G255 PolarHBondContact O-N 3.08Å; T253-M256 HydrophobicContact CG2-SD 4.32Å; T253-M256 WeakPolarHBondContact O-CB 3.36Å; T253-M256 PolarHBondContact O-N 3.19Å; T253-M256 WeakPolarHBondContact OG1-CG 3.18Å; T253-M256 PolarHBondContact OG1-N 3.25Å; T253-L257 PolarHBondContact O-N 3.16Å; T253-L257 VanDerWaalsContact O-N 3.09Å
254	M	92.8	Very high	90.5	Very high	72 Å²	72	57.6 Å²	57.6	36%	0.355	32%	0.319	S	S	.	.	H	α-helix	trans	-53.4	-40.5	175.1	-178.2	61.3	69.5	0	0	112.4	H241 A242 M256 L257 K258	H241-M254 HydrophobicContact CB-CE 4.13Å; H241-M254 HydrophobicContact CB-SD 3.67Å; A242-M254 HydrophobicContact CB-CE 3.97Å; M254-M256 PolarHBondContact O-N 3.17Å; M254-L257 PolarHBondContact O-N 3.18Å; M254-K258 HydrophobicContact CG-CD 4.14Å; M254-K258 WeakPolarHBondContact O-CG 3.33Å; M254-K258 PolarHBondContact O-N 3.26Å; M254-K258 HydrophobicContact SD-CD 4.1Å; M254-K258 WeakPolarHBondContact SD-CE 3.5Å; M254-K258 HydrophobicContact SD-CG 4.3Å
255	G	89.1	Confident	90.6	Very high	54 Å²	54	59.5 Å²	59.5	56%	0.557	33%	0.329	S	S	*	.	H	α-helix	trans	-67.1	-31.6	177.2	0	0	0	0	0	113.9	T253 S259	T253-G255 PolarHBondContact O-N 3.08Å; G255-S259 PolarHBondContact O-N 3.02Å
256	M	89.1	Confident	90.7	Very high	41 Å²	41	58.7 Å²	58.7	20%	0.202	32%	0.322	C	S	.	.	H	α-helix	trans	-72.1	-38.4	174.1	-72.2	167	56.3	0	0	112	K251 L252 T253 M254 S259 T262	K251-M256 WeakPolarHBondContact O-CE 3.47Å; L252-M256 HydrophobicContact CD2-CE 4.12Å; T253-M256 HydrophobicContact CG2-SD 4.32Å; T253-M256 WeakPolarHBondContact O-CB 3.36Å; T253-M256 PolarHBondContact O-N 3.19Å; T253-M256 WeakPolarHBondContact OG1-CG 3.18Å; T253-M256 PolarHBondContact OG1-N 3.25Å; M254-M256 PolarHBondContact O-N 3.17Å; M256-S259 WeakPolarHBondContact O-CB 3.23Å; M256-S259 PolarHBondContact O-N 3.34Å; M256-S259 PolarHBondContact O-OG 2.89Å; M256-T262 WeakPolarHBondContact O-CB 3.39Å; M256-T262 PolarHBondContact O-OG1 3.28Å
257	L	91.9	Very high	90.9	Very high	5 Å²	5	53.9 Å²	53.9	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-68.9	-39	177.7	-66.3	170.1	0	0	0	112.1	H241 I244 A245 L252 T253 M254 S259 T262 I291	H241-L257 HydrophobicContact CB-CB 4.3Å; H241-L257 HydrophobicContact CB-CD1 4.25Å; H241-L257 WeakPolarHBondContact O-CD1 3.5Å; I244-L257 HydrophobicContact CB-CD1 3.9Å; I244-L257 HydrophobicContact CB-CD2 4.4Å; I244-L257 HydrophobicContact CG2-CD1 3.79Å; I244-L257 HydrophobicContact CG2-CD2 3.66Å; I244-L257 HydrophobicContact CG2-CG 4.39Å; A245-L257 HydrophobicContact CB-CD1 3.9Å; L252-L257 HydrophobicContact CD1-CD2 4.28Å; L252-L257 HydrophobicContact CD2-CD2 4.42Å; T253-L257 PolarHBondContact O-N 3.16Å; T253-L257 VanDerWaalsContact O-N 3.09Å; M254-L257 PolarHBondContact O-N 3.18Å; L257-S259 PolarHBondContact O-N 3.33Å; L257-T262 HydrophobicContact CD2-CG2 4.23Å; L257-I291 HydrophobicContact CD2-CG2 4.21Å
258	K	88.9	Confident	90.8	Very high	112 Å²	112	53.6 Å²	53.6	49%	0.487	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	0.8	172.9	-68.5	177.1	176.4	-101.4	0	114.1	D238 M254	D238-K258 WeakPolarHBondContact OD1-CE 3.49Å; D238-K258 IonicContact OD1-NZ 2.67Å; D238-K258 PolarHBondContact OD1-NZ 3.16Å; D238-K258 IonicContact OD2-NZ 3.3Å; D238-K258 PolarHBondContact OD2-NZ 3.41Å; M254-K258 HydrophobicContact CG-CD 4.14Å; M254-K258 WeakPolarHBondContact O-CG 3.33Å; M254-K258 PolarHBondContact O-N 3.26Å; M254-K258 HydrophobicContact SD-CD 4.1Å; M254-K258 WeakPolarHBondContact SD-CE 3.5Å; M254-K258 HydrophobicContact SD-CG 4.3Å
259	S	88	Confident	90.6	Very high	31 Å²	31	59.5 Å²	59.5	22%	0.217	33%	0.326	C	S	.	.	S	Bend	trans	-89	143.4	178.6	80.3	0	0	0	0	111.5	G255 M256 L257 N261 T262	G255-S259 PolarHBondContact O-N 3.02Å; M256-S259 WeakPolarHBondContact O-CB 3.23Å; M256-S259 PolarHBondContact O-N 3.34Å; M256-S259 PolarHBondContact O-OG 2.89Å; L257-S259 PolarHBondContact O-N 3.33Å; S259-N261 PolarHBondContact O-N 2.71Å; S259-T262 PolarHBondContact O-N 2.81Å
260	P	85.6	Confident	90.6	Very high	127 Å²	127	60.2 Å²	60.2	83%	0.825	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	1.3	177	30.3	-37.3	0	0	0	113.7
261	N	87	Confident	90.7	Very high	75 Å²	75	59.4 Å²	59.4	40%	0.401	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	5.7	172.1	-63.7	-35.6	0	0	0	112.4	S259 R293 K294	S259-N261 PolarHBondContact O-N 2.71Å; N261-R293 CarbonylContact O-C 3.41Å; N261-R293 WeakPolarHBondContact O-CA 3.24Å; N261-K294 PolarHBondContact O-N 3.29Å
262	T	91.9	Very high	90.9	Very high	14 Å²	14	59.5 Å²	59.5	9%	0.086	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	116.5	172.2	-54.1	0	0	0	0	110.1	M256 L257 S259 I291 Y292	M256-T262 WeakPolarHBondContact O-CB 3.39Å; M256-T262 PolarHBondContact O-OG1 3.28Å; L257-T262 HydrophobicContact CD2-CG2 4.23Å; S259-T262 PolarHBondContact O-N 2.81Å; T262-I291 HydrophobicContact CG2-CG2 3.61Å; T262-Y292 CarbonylContact C-O 3.56Å; T262-Y292 WeakPolarHBondContact CA-O 3.39Å
263	A	92.3	Very high	91.2	Very high	19 Å²	19	62.9 Å²	62.9	16%	0.157	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	138.3	170.5	0	0	0	0	0	109.7	L265 E276 Y292	A263-L265 HydrophobicContact CB-CD2 4.23Å; A263-E276 WeakPolarHBondContact CB-OE1 3.48Å; A263-Y292 PolarHBondContact N-O 2.93Å; A263-Y292 PolarHBondContact O-N 2.92Å
264	I	95.1	Very high	91.4	Very high	10 Å²	10	63.2 Å²	63.2	5%	0.051	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	112.9	174	-63.2	179.1	0	0	0	107.1	L240 H241 I244 L277 I289	L240-I264 HydrophobicContact CD2-CG2 4.14Å; H241-I264 VanDerWaalsContact CD2-CD1 3.49Å; H241-I264 WeakPolarHBondContact CD2-CD1 3.42Å; H241-I264 WeakPolarHBondContact NE2-CD1 3.27Å; I244-I264 HydrophobicContact CD1-CD1 3.84Å; I264-L277 HydrophobicContact CG2-CB 4.2Å; I264-L277 HydrophobicContact CG2-CD2 3.91Å; I264-L277 WeakPolarHBondContact O-CB 3.48Å; I264-L277 PolarHBondContact O-N 3Å; I264-I289 HydrophobicContact CG2-CG2 3.44Å; I264-I289 VanDerWaalsContact CG2-CG2 3.44Å
265	L	95.2	Very high	91.6	Very high	39 Å²	39	63.3 Å²	63.3	20%	0.204	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132	-175.2	-50.9	176.7	0	0	0	110.3	A263 F274 Y275 E276 I289 K290	A263-L265 HydrophobicContact CB-CD2 4.23Å; L265-F274 HydrophobicContact CB-CB 4.18Å; L265-F274 HydrophobicContact CB-CD1 4.11Å; L265-F274 HydrophobicContact CD1-CB 4.44Å; L265-Y275 CarbonylContact C-O 3.54Å; L265-Y275 WeakPolarHBondContact CA-O 3.06Å; L265-E276 HydrophobicContact CD2-CB 4.1Å; L265-E276 HydrophobicContact CD2-CG 4.48Å; L265-I289 CarbonylContact O-C 3.6Å; L265-I289 VanDerWaalsContact O-CA 3.27Å; L265-I289 WeakPolarHBondContact O-CA 3.43Å; L265-K290 HydrophobicContact CB-CB 4.47Å; L265-K290 WeakPolarHBondContact CB-O 3.3Å; L265-K290 PolarHBondContact N-O 3.43Å; L265-K290 PolarHBondContact O-N 2.98Å
266	I	95.8	Very high	91.8	Very high	2 Å²	2	66.1 Å²	66.1	1%	0.01	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	142.1	171.6	-175.3	164.1	0	0	0	110.2	F274 Y275 L277 D282 I289	I266-F274 WeakPolarHBondContact O-CA 3.39Å; I266-Y275 HydrophobicContact CG2-CD1 4.12Å; I266-Y275 HydrophobicContact CG2-CD2 3.88Å; I266-Y275 HydrophobicContact CG2-CE1 3.71Å; I266-Y275 HydrophobicContact CG2-CE2 3.46Å; I266-Y275 VanDerWaalsContact CG2-CE2 3.46Å; I266-Y275 HydrophobicContact CG2-CG 4.2Å; I266-Y275 PolarHBondContact N-O 3.38Å; I266-Y275 WeakPolarHBondContact O-CD1 3.42Å; I266-Y275 PolarHBondContact O-N 3.12Å; I266-L277 HydrophobicContact CB-CB 4.38Å; I266-L277 HydrophobicContact CB-CD1 4.04Å; I266-L277 HydrophobicContact CD1-CD1 3.98Å; I266-L277 HydrophobicContact CG2-CB 4.12Å; I266-L277 HydrophobicContact CG2-CD1 3.76Å; I266-L277 HydrophobicContact CG2-CG 4.5Å; I266-D282 HydrophobicContact CD1-CB 4.4Å; I266-D282 WeakPolarHBondContact CD1-O 3.4Å; I266-I289 HydrophobicContact CG1-CG1 4.44Å
267	K	95.6	Very high	92	Very high	45 Å²	45	64.6 Å²	64.6	20%	0.196	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	125.4	175.7	-163.7	-162.6	168.8	-164.3	0	110.9	N272 F274 I288	K267-N272 VanDerWaalsContact CE-OD1 3.25Å; K267-N272 WeakPolarHBondContact CE-OD1 3.38Å; K267-N272 PolarHBondContact NZ-OD1 3.47Å; K267-F274 HydrophobicContact CB-CD1 3.95Å; K267-F274 HydrophobicContact CB-CE1 3.63Å; K267-F274 HydrophobicContact CB-CE2 4.42Å; K267-F274 HydrophobicContact CB-CG 4.49Å; K267-F274 HydrophobicContact CB-CZ 3.89Å; K267-F274 HydrophobicContact CD-CZ 4.34Å; K267-F274 HydrophobicContact CG-CD1 4.48Å; K267-F274 HydrophobicContact CG-CD2 4.37Å; K267-F274 HydrophobicContact CG-CE1 4.19Å; K267-F274 HydrophobicContact CG-CE2 4.07Å; K267-F274 HydrophobicContact CG-CZ 3.98Å; K267-I288 HydrophobicContact CB-CB 4Å; K267-I288 HydrophobicContact CD-CD1 4.1Å; K267-I288 PolarHBondContact N-O 2.98Å
268	D	93.1	Very high	91.8	Very high	29 Å²	29	73.3 Å²	73.3	16%	0.155	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-75.2	117.8	161.1	-167.4	-53.7	0	0	0	109.6	A270 R271 N272 V273 Y275	D268-A270 WeakPolarHBondContact OD1-CA 3.43Å; D268-A270 WeakPolarHBondContact OD1-CB 3.47Å; D268-A270 PolarHBondContact OD1-N 2.94Å; D268-R271 HydrophobicContact CB-CB 4.17Å; D268-R271 PolarHBondContact OD1-N 2.96Å; D268-R271 IonicContact OD2-CZ 3.12Å; D268-R271 IonicContact OD2-NE 2.73Å; D268-R271 PolarHBondContact OD2-NE 3.23Å; D268-R271 IonicContact OD2-NH2 2.64Å; D268-R271 PolarHBondContact OD2-NH2 2.85Å; D268-N272 WeakPolarHBondContact O-CA 3.34Å; D268-N272 PolarHBondContact O-N 3.34Å; D268-V273 HydrophobicContact CB-CG2 4.27Å; D268-V273 PolarHBondContact N-O 2.9Å; D268-Y275 HydrophobicContact CB-CD1 4.14Å; D268-Y275 HydrophobicContact CB-CE1 3.84Å
269	E	89.1	Confident	91.8	Very high	127 Å²	127	70.1 Å²	70.1	59%	0.593	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-30.7	178	-64.6	-155.3	130.2	0	0	113.5	N272	E269-N272 PolarHBondContact O-ND2 2.92Å
270	A	88.6	Confident	91.8	Very high	97 Å²	97	69.8 Å²	69.8	80%	0.802	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-37.2	-177.8	0	0	0	0	0	112.1	D268	D268-A270 WeakPolarHBondContact OD1-CA 3.43Å; D268-A270 WeakPolarHBondContact OD1-CB 3.47Å; D268-A270 PolarHBondContact OD1-N 2.94Å
271	R	90.3	Very high	91.8	Very high	166 Å²	166	73.3 Å²	73.3	63%	0.626	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-12.8	177.2	-66.3	-178.1	-72	167.6	1.3	113.6	D268 V273	D268-R271 HydrophobicContact CB-CB 4.17Å; D268-R271 PolarHBondContact OD1-N 2.96Å; D268-R271 IonicContact OD2-CZ 3.12Å; D268-R271 IonicContact OD2-NE 2.73Å; D268-R271 PolarHBondContact OD2-NE 3.23Å; D268-R271 IonicContact OD2-NH2 2.64Å; D268-R271 PolarHBondContact OD2-NH2 2.85Å; R271-V273 HydrophobicContact CB-CG2 3.85Å; R271-V273 PolarHBondContact O-N 3.07Å
272	N	90.6	Very high	91.9	Very high	106 Å²	106	72.9 Å²	72.9	57%	0.567	36%	0.357	S	S	*	.			trans	55.1	25.4	-175.6	-78.2	-82.5	0	0	0	115.3	K267 D268 E269	K267-N272 VanDerWaalsContact CE-OD1 3.25Å; K267-N272 WeakPolarHBondContact CE-OD1 3.38Å; K267-N272 PolarHBondContact NZ-OD1 3.47Å; D268-N272 WeakPolarHBondContact O-CA 3.34Å; D268-N272 PolarHBondContact O-N 3.34Å; E269-N272 PolarHBondContact O-ND2 2.92Å
273	V	94.7	Very high	91.8	Very high	73 Å²	73	73.5 Å²	73.5	44%	0.442	36%	0.36	S	S	.	.			trans	-108.8	155.2	175.6	-63.8	0	0	0	0	111.1	D268 R271	D268-V273 HydrophobicContact CB-CG2 4.27Å; D268-V273 PolarHBondContact N-O 2.9Å; R271-V273 HydrophobicContact CB-CG2 3.85Å; R271-V273 PolarHBondContact O-N 3.07Å
274	F	95.3	Very high	91.7	Very high	83 Å²	83	79.2 Å²	79.2	36%	0.364	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	136.8	167.8	-74.9	-93	0	0	0	109.6	L265 I266 K267 I288 K290	L265-F274 HydrophobicContact CB-CB 4.18Å; L265-F274 HydrophobicContact CB-CD1 4.11Å; L265-F274 HydrophobicContact CD1-CB 4.44Å; I266-F274 WeakPolarHBondContact O-CA 3.39Å; K267-F274 HydrophobicContact CB-CD1 3.95Å; K267-F274 HydrophobicContact CB-CE1 3.63Å; K267-F274 HydrophobicContact CB-CE2 4.42Å; K267-F274 HydrophobicContact CB-CG 4.49Å; K267-F274 HydrophobicContact CB-CZ 3.89Å; K267-F274 HydrophobicContact CD-CZ 4.34Å; K267-F274 HydrophobicContact CG-CD1 4.48Å; K267-F274 HydrophobicContact CG-CD2 4.37Å; K267-F274 HydrophobicContact CG-CE1 4.19Å; K267-F274 HydrophobicContact CG-CE2 4.07Å; K267-F274 HydrophobicContact CG-CZ 3.98Å; F274-I288 HydrophobicContact CE1-CG2 4.33Å; F274-I288 HydrophobicContact CZ-CG2 4.32Å; F274-K290 HydrophobicContact CD1-CB 3.99Å; F274-K290 HydrophobicContact CE1-CB 3.64Å; F274-K290 HydrophobicContact CE1-CD 4.45Å; F274-K290 HydrophobicContact CZ-CB 4.37Å
275	Y	95.8	Very high	91.4	Very high	75 Å²	75	81.3 Å²	81.3	29%	0.294	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	160	172.5	62.7	-80.4	0	0	0	109.7	L265 I266 D268	L265-Y275 CarbonylContact C-O 3.54Å; L265-Y275 WeakPolarHBondContact CA-O 3.06Å; I266-Y275 HydrophobicContact CG2-CD1 4.12Å; I266-Y275 HydrophobicContact CG2-CD2 3.88Å; I266-Y275 HydrophobicContact CG2-CE1 3.71Å; I266-Y275 HydrophobicContact CG2-CE2 3.46Å; I266-Y275 VanDerWaalsContact CG2-CE2 3.46Å; I266-Y275 HydrophobicContact CG2-CG 4.2Å; I266-Y275 PolarHBondContact N-O 3.38Å; I266-Y275 WeakPolarHBondContact O-CD1 3.42Å; I266-Y275 PolarHBondContact O-N 3.12Å; D268-Y275 HydrophobicContact CB-CD1 4.14Å; D268-Y275 HydrophobicContact CB-CE1 3.84Å
276	E	94	Very high	91.1	Very high	113 Å²	113	86.7 Å²	86.7	53%	0.528	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	137	-179.6	-168.3	153.1	-159.7	0	0	111	A263 L265 E278	A263-E276 WeakPolarHBondContact CB-OE1 3.48Å; L265-E276 HydrophobicContact CD2-CB 4.1Å; L265-E276 HydrophobicContact CD2-CG 4.48Å; E276-E278 PolarHBondContact O-N 2.97Å; E276-E278 VanDerWaalsContact O-N 3.07Å
277	L	93.5	Very high	91	Very high	9 Å²	9	87.3 Å²	87.3	5%	0.047	42%	0.416	C	S	.	.			trans	-84.5	80.5	-173	-177.9	63.5	0	0	0	110.3	L240 I264 I266 D279 D282 I283 I289	L240-L277 HydrophobicContact CD2-CD2 3.49Å; L240-L277 VanDerWaalsContact CD2-CD2 3.49Å; I264-L277 HydrophobicContact CG2-CB 4.2Å; I264-L277 HydrophobicContact CG2-CD2 3.91Å; I264-L277 WeakPolarHBondContact O-CB 3.48Å; I264-L277 PolarHBondContact O-N 3Å; I266-L277 HydrophobicContact CB-CB 4.38Å; I266-L277 HydrophobicContact CB-CD1 4.04Å; I266-L277 HydrophobicContact CD1-CD1 3.98Å; I266-L277 HydrophobicContact CG2-CB 4.12Å; I266-L277 HydrophobicContact CG2-CD1 3.76Å; I266-L277 HydrophobicContact CG2-CG 4.5Å; L277-D279 VanDerWaalsContact CD1-O 3.24Å; L277-D279 WeakPolarHBondContact CD1-O 3.27Å; L277-D282 HydrophobicContact CD1-CB 4.26Å; L277-I283 HydrophobicContact CD1-CG1 4.11Å; L277-I283 HydrophobicContact CD2-CD1 4.04Å; L277-I283 HydrophobicContact CD2-CG1 4.04Å; L277-I289 HydrophobicContact CD2-CD1 4.18Å
278	E	88.3	Confident	90.9	Very high	187 Å²	187	87.5 Å²	87.5	87%	0.874	42%	0.419	S	S	*	.			trans	-70.6	-32.8	176.7	-63.5	-179.9	-175.5	0	0	112.6	E276	E276-E278 PolarHBondContact O-N 2.97Å; E276-E278 VanDerWaalsContact O-N 3.07Å
279	D	87.5	Confident	91	Very high	46 Å²	46	86.1 Å²	86.1	25%	0.246	41%	0.412	C	S	.	.			trans	-128.8	123.3	-175.2	-166.6	-24.1	0	0	0	112	L277 R281 D282	L277-D279 VanDerWaalsContact CD1-O 3.24Å; L277-D279 WeakPolarHBondContact CD1-O 3.27Å; D279-R281 PolarHBondContact O-N 3.35Å; D279-R281 VanDerWaalsContact O-N 3.17Å; D279-R281 VanDerWaalsContact OD1-CB 3.27Å; D279-R281 WeakPolarHBondContact OD1-CB 3.37Å; D279-R281 VanDerWaalsContact OD1-CG 3.24Å; D279-R281 WeakPolarHBondContact OD1-CG 3.4Å; D279-R281 PolarHBondContact OD1-N 3.34Å; D279-R281 IonicContact OD1-NE 2.93Å; D279-R281 PolarHBondContact OD1-NE 3.13Å; D279-R281 IonicContact OD2-CZ 3.42Å; D279-R281 IonicContact OD2-NE 3.62Å; D279-R281 PolarHBondContact OD2-NE 2.87Å; D279-R281 IonicContact OD2-NH2 3.56Å; D279-R281 PolarHBondContact OD2-NH2 3.4Å; D279-D282 PolarHBondContact O-N 2.94Å
280	V	88.9	Confident	91.4	Very high	23 Å²	23	83.4 Å²	83.4	14%	0.139	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-67.4	-12.9	178.1	-64.5	0	0	0	0	113.9	V234 L237 D282 I283	V234-V280 WeakPolarHBondContact O-CB 3.45Å; V234-V280 VanDerWaalsContact O-CG2 3.31Å; V234-V280 WeakPolarHBondContact O-CG2 3.37Å; L237-V280 HydrophobicContact CB-CG1 4.11Å; L237-V280 HydrophobicContact CD1-CG1 4.06Å; V280-D282 PolarHBondContact O-N 3.32Å; V280-I283 HydrophobicContact CB-CD1 3.85Å; V280-I283 HydrophobicContact CG1-CD1 4.05Å; V280-I283 VanDerWaalsContact O-CB 3.29Å; V280-I283 WeakPolarHBondContact O-CB 3.37Å; V280-I283 VanDerWaalsContact O-CG1 3.28Å; V280-I283 WeakPolarHBondContact O-CG1 3.45Å; V280-I283 PolarHBondContact O-N 3.49Å
281	R	86.3	Confident	91.7	Very high	202 Å²	202	79 Å²	79	76%	0.762	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-69	-17.4	173	-62.9	179.4	-64.3	171.9	3.7	113.3	D279 I283	D279-R281 PolarHBondContact O-N 3.35Å; D279-R281 VanDerWaalsContact O-N 3.17Å; D279-R281 VanDerWaalsContact OD1-CB 3.27Å; D279-R281 WeakPolarHBondContact OD1-CB 3.37Å; D279-R281 VanDerWaalsContact OD1-CG 3.24Å; D279-R281 WeakPolarHBondContact OD1-CG 3.4Å; D279-R281 PolarHBondContact OD1-N 3.34Å; D279-R281 IonicContact OD1-NE 2.93Å; D279-R281 PolarHBondContact OD1-NE 3.13Å; D279-R281 IonicContact OD2-CZ 3.42Å; D279-R281 IonicContact OD2-NE 3.62Å; D279-R281 PolarHBondContact OD2-NE 2.87Å; D279-R281 IonicContact OD2-NH2 3.56Å; D279-R281 PolarHBondContact OD2-NH2 3.4Å; R281-I283 PolarHBondContact O-N 3.25Å
282	D	88.3	Confident	91.8	Very high	66 Å²	66	77.2 Å²	77.2	35%	0.353	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-77.7	-9.4	174	-67.5	-29.1	0	0	0	112.9	I266 L277 D279 V280 Q284	I266-D282 HydrophobicContact CD1-CB 4.4Å; I266-D282 WeakPolarHBondContact CD1-O 3.4Å; L277-D282 HydrophobicContact CD1-CB 4.26Å; D279-D282 PolarHBondContact O-N 2.94Å; V280-D282 PolarHBondContact O-N 3.32Å; D282-Q284 PolarHBondContact O-N 2.95Å
283	I	90	Very high	91.8	Very high	27 Å²	27	78.3 Å²	78.3	14%	0.138	35%	0.351	C	S	.	.			trans	-75.6	111.8	176.9	-55.2	171.5	0	0	0	109.8	L217 V234 L240 L277 V280 R281 I289	L217-I283 HydrophobicContact CD1-CG2 3.62Å; L217-I283 HydrophobicContact CD2-CG2 3.61Å; L217-I283 HydrophobicContact CG-CG2 4.26Å; V234-I283 HydrophobicContact CB-CD1 3.91Å; V234-I283 HydrophobicContact CG1-CD1 3.76Å; V234-I283 HydrophobicContact CG2-CD1 4.48Å; V234-I283 HydrophobicContact CG2-CG2 4.4Å; L240-I283 HydrophobicContact CD1-CD1 4.38Å; L240-I283 HydrophobicContact CD2-CD1 4.04Å; L277-I283 HydrophobicContact CD1-CG1 4.11Å; L277-I283 HydrophobicContact CD2-CD1 4.04Å; L277-I283 HydrophobicContact CD2-CG1 4.04Å; V280-I283 HydrophobicContact CB-CD1 3.85Å; V280-I283 HydrophobicContact CG1-CD1 4.05Å; V280-I283 VanDerWaalsContact O-CB 3.29Å; V280-I283 WeakPolarHBondContact O-CB 3.37Å; V280-I283 VanDerWaalsContact O-CG1 3.28Å; V280-I283 WeakPolarHBondContact O-CG1 3.45Å; V280-I283 PolarHBondContact O-N 3.49Å; R281-I283 PolarHBondContact O-N 3.25Å; I283-I289 HydrophobicContact CD1-CD1 4.47Å; I283-I289 HydrophobicContact CG1-CD1 4.32Å; I283-I289 HydrophobicContact CG2-CD1 4.48Å
284	Q	88.9	Confident	91.1	Very high	139 Å²	139	81 Å²	81	65%	0.65	36%	0.357	S	S	*	.			trans	-118	174.7	-178.9	-61	-176.8	39	0	0	111.5	L217 D282 R286 S287	L217-Q284 VanDerWaalsContact CD2-O 3.27Å; L217-Q284 WeakPolarHBondContact CD2-O 3.47Å; D282-Q284 PolarHBondContact O-N 2.95Å; Q284-R286 PolarHBondContact O-N 3.25Å; Q284-S287 PolarHBondContact N-OG 2.91Å; Q284-S287 WeakPolarHBondContact O-CB 3.36Å; Q284-S287 PolarHBondContact O-N 2.94Å; Q284-S287 PolarHBondContact O-OG 2.94Å
285	D	88.8	Confident	89.2	Confident	54 Å²	54	84 Å²	84	29%	0.289	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	131.3	171.6	-177.1	48.1	0	0	0	110.1	G215 V216 S287	G215-D285 WeakPolarHBondContact CA-OD1 3.36Å; V216-D285 PolarHBondContact N-OD1 3.46Å; D285-S287 VanDerWaalsContact C-N 3.3Å; D285-S287 PolarHBondContact O-N 2.93Å
286	R	90.2	Very high	86.8	Confident	151 Å²	151	84.1 Å²	84.1	57%	0.57	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	7	-174.9	-56	133.9	-171.1	-88.7	-5.1	116.5	V216 F218 Q284 I288	V216-R286 WeakPolarHBondContact O-CA 3.29Å; V216-R286 PolarHBondContact O-N 3.32Å; F218-R286 HydrophobicContact CE2-CB 4.2Å; F218-R286 HydrophobicContact CE2-CG 4.33Å; Q284-R286 PolarHBondContact O-N 3.25Å; R286-I288 PolarHBondContact O-N 2.97Å
287	S	92.6	Very high	84.5	Confident	15 Å²	15	85.8 Å²	85.8	11%	0.105	39%	0.394	C	S	.	.			trans	-53.2	129.1	175	-69.8	0	0	0	0	111.6	F218 Q284 D285	F218-S287 PolarHBondContact N-O 3.48Å; F218-S287 VanDerWaalsContact N-O 3.16Å; Q284-S287 PolarHBondContact N-OG 2.91Å; Q284-S287 WeakPolarHBondContact O-CB 3.36Å; Q284-S287 PolarHBondContact O-N 2.94Å; Q284-S287 PolarHBondContact O-OG 2.94Å; D285-S287 VanDerWaalsContact C-N 3.3Å; D285-S287 PolarHBondContact O-N 2.93Å
288	I	94.7	Very high	82.2	Confident	50 Å²	50	96.7 Å²	96.7	26%	0.256	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	116.5	176.5	-54.7	177.3	0	0	0	107.5	F218 K267 F274 R286	F218-I288 HydrophobicContact CB-CG1 4.24Å; F218-I288 HydrophobicContact CB-CG2 4.5Å; F218-I288 HydrophobicContact CD2-CG1 4.47Å; F218-I288 WeakPolarHBondContact O-CA 3.45Å; K267-I288 HydrophobicContact CB-CB 4Å; K267-I288 HydrophobicContact CD-CD1 4.1Å; K267-I288 PolarHBondContact N-O 2.98Å; F274-I288 HydrophobicContact CE1-CG2 4.33Å; F274-I288 HydrophobicContact CZ-CG2 4.32Å; R286-I288 PolarHBondContact O-N 2.97Å
289	I	95.8	Very high	79.5	Confident	0 Å²	0	91.4 Å²	91.4	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	120.1	-179.3	-59.3	179.3	0	0	0	108.5	L217 F218 L219 Q220 L240 I264 L265 I266 L277 I283	L217-I289 HydrophobicContact CD1-CD1 3.96Å; F218-I289 PolarHBondContact O-N 3.44Å; L219-I289 CarbonylContact C-O 3.55Å; L219-I289 WeakPolarHBondContact CA-O 3.45Å; L219-I289 HydrophobicContact CD2-CB 3.98Å; L219-I289 HydrophobicContact CD2-CD1 4.34Å; L219-I289 HydrophobicContact CD2-CG2 4.47Å; Q220-I289 PolarHBondContact N-O 3.3Å; L240-I289 HydrophobicContact CD1-CD1 4.07Å; L240-I289 HydrophobicContact CD2-CD1 4.29Å; I264-I289 HydrophobicContact CG2-CG2 3.44Å; I264-I289 VanDerWaalsContact CG2-CG2 3.44Å; L265-I289 CarbonylContact O-C 3.6Å; L265-I289 VanDerWaalsContact O-CA 3.27Å; L265-I289 WeakPolarHBondContact O-CA 3.43Å; I266-I289 HydrophobicContact CG1-CG1 4.44Å; L277-I289 HydrophobicContact CD2-CD1 4.18Å; I283-I289 HydrophobicContact CD1-CD1 4.47Å; I283-I289 HydrophobicContact CG1-CD1 4.32Å; I283-I289 HydrophobicContact CG2-CD1 4.48Å
290	K	95.9	Very high	77	Confident	70 Å²	70	94 Å²	94	30%	0.304	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	116.5	178.3	-174	173.3	-172.5	168.2	0	110.2	Q220 L265 F274	Q220-K290 HydrophobicContact CB-CB 4.44Å; Q220-K290 HydrophobicContact CB-CG 4.33Å; Q220-K290 HydrophobicContact CG-CG 4.39Å; Q220-K290 CarbonylContact O-C 3.56Å; Q220-K290 WeakPolarHBondContact O-CA 3.35Å; L265-K290 HydrophobicContact CB-CB 4.47Å; L265-K290 WeakPolarHBondContact CB-O 3.3Å; L265-K290 PolarHBondContact N-O 3.43Å; L265-K290 PolarHBondContact O-N 2.98Å; F274-K290 HydrophobicContact CD1-CB 3.99Å; F274-K290 HydrophobicContact CE1-CB 3.64Å; F274-K290 HydrophobicContact CE1-CD 4.45Å; F274-K290 HydrophobicContact CZ-CB 4.37Å
291	I	95.8	Very high	74.3	Confident	3 Å²	3	102.3 Å²	102.3	2%	0.015	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	119.5	175.2	-56.2	86.3	0	0	0	107.8	L219 Q220 F221 I244 L252 L257 T262	L219-I291 HydrophobicContact CB-CD1 4.23Å; Q220-I291 WeakPolarHBondContact O-CD1 3.43Å; Q220-I291 PolarHBondContact O-N 3.05Å; F221-I291 HydrophobicContact CB-CB 4.47Å; F221-I291 HydrophobicContact CD2-CB 4.03Å; F221-I291 HydrophobicContact CD2-CG2 3.99Å; I244-I291 HydrophobicContact CD1-CD1 4.25Å; I244-I291 HydrophobicContact CD1-CG1 3.93Å; I244-I291 HydrophobicContact CG1-CD1 4.33Å; I244-I291 HydrophobicContact CG1-CG1 4.41Å; I244-I291 HydrophobicContact CG2-CD1 4.18Å; I244-I291 HydrophobicContact CG2-CG1 3.93Å; L252-I291 HydrophobicContact CD1-CB 4.48Å; L252-I291 HydrophobicContact CD1-CG2 4.04Å; L252-I291 HydrophobicContact CD2-CG2 4.49Å; L257-I291 HydrophobicContact CD2-CG2 4.21Å; T262-I291 HydrophobicContact CG2-CG2 3.61Å
292	Y	93.1	Very high	72.1	Confident	129 Å²	129	98.8 Å²	98.8	51%	0.506	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	115.6	177.6	177.6	-101.8	0	0	0	110.2	T262 A263 K294	T262-Y292 CarbonylContact C-O 3.56Å; T262-Y292 WeakPolarHBondContact CA-O 3.39Å; A263-Y292 PolarHBondContact N-O 2.93Å; A263-Y292 PolarHBondContact O-N 2.92Å; Y292-K294 HydrophobicContact CE1-CB 3.99Å
293	R	89.2	Confident	69.4	Low	129 Å²	129	99.2 Å²	99.2	49%	0.487	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	115.2	169.6	-168.2	-177.3	-174.6	-165.3	2.6	108.6	F221 N261 E295	F221-R293 HydrophobicContact CE2-CB 4.34Å; N261-R293 CarbonylContact O-C 3.41Å; N261-R293 WeakPolarHBondContact O-CA 3.24Å; R293-E295 PolarHBondContact O-N 3.16Å
294	K	80.3	Confident	66.5	Low	131 Å²	131	104 Å²	104	57%	0.57	55%	0.545	S	S	*	.			trans	-72.1	104.8	169.8	-173.6	-179.5	-179.2	-177.7	0	108.2	N261 Y292	N261-K294 PolarHBondContact O-N 3.29Å; Y292-K294 HydrophobicContact CE1-CB 3.99Å
295	E	55.5	Low	63.8	Low	146 Å²	146	105.4 Å²	105.4	68%	0.682	55%	0.552	S	S	*	*			trans	-66.3	131.1	176.8	-167.2	155	-123	0	0	109.9	R293 L297	R293-E295 PolarHBondContact O-N 3.16Å; E295-L297 PolarHBondContact O-N 3.41Å
296	P	45.8	Very low	61.1	Low	77 Å²	77	109.2 Å²	109.2	50%	0.5	57%	0.571	S	S	.	*			trans	-77.1	74.5	-175.6	31.5	-35.8	0	0	0	111.4	Y298 A299	P296-Y298 PolarHBondContact O-N 3.1Å; P296-A299 PolarHBondContact O-N 2.86Å
297	L	46	Very low	58.2	Low	148 Å²	148	106.9 Å²	106.9	78%	0.775	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.1	123.1	162.2	-64.2	171.1	0	0	0	108.1	E295	E295-L297 PolarHBondContact O-N 3.41Å
298	Y	44.3	Very low	55.3	Low	238 Å²	238	113.6 Å²	113.6	93%	0.933	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	72.4	60.4	-167.1	-63.5	-89.6	0	0	0	116.5	P296	P296-Y298 PolarHBondContact O-N 3.1Å
299	A	32.6	Very low	52.2	Low	75 Å²	75	115.1 Å²	115.1	62%	0.62	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-96.7	125.8	135.2	0	0	0	0	0	108.7	P296	P296-A299 PolarHBondContact O-N 2.86Å
300	A	34.3	Very low	49.2	Very low	101 Å²	101	120.6 Å²	120.6	84%	0.835	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-80.5	131.6	179.8	0	0	0	0	0	111.1
301	F	31.5	Very low	46.3	Very low	197 Å²	197	123.8 Å²	123.8	86%	0.864	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-76.7	130.1	171.8	-73.4	-90.8	0	0	0	110.7	G303	F301-G303 PolarHBondContact O-N 2.89Å
302	P	40.5	Very low	43.5	Very low	128 Å²	128	134.3 Å²	134.3	83%	0.831	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-66.9	121.6	150.9	30.3	-30.3	0	0	0	107.2
303	G	31.3	Very low	40.9	Very low	75 Å²	75	138 Å²	138	77%	0.773	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-92.5	168.1	-162	0	0	0	0	0	115.9	F301	F301-G303 PolarHBondContact O-N 2.89Å
304	S	29	Very low	38.2	Very low	127 Å²	127	140.7 Å²	140.7	89%	0.888	76%	0.756	S	S	*	*			trans	-121.9	145.7	146.9	53.6	0	0	0	0	108.7
305	H	32.4	Very low	36	Very low	169 Å²	169	141.8 Å²	141.8	78%	0.782	77%	0.766	S	S	*	*			trans	-113.2	-179	-169.7	173.8	-105	0	0	0	110.2
306	L	33.5	Very low	34.9	Very low	134 Å²	134	140.7 Å²	140.7	70%	0.702	77%	0.768	S	S	*	*			trans	82	136.1	-179.3	-46.4	168.3	0	0	0	113.4
307	T	29.2	Very low	34.1	Very low	103 Å²	103	147 Å²	147	63%	0.632	78%	0.784	S	S	*	*			cis	-161.1	145.2	-3.6	5.7	0	0	0	0	111.1
308	N	29.9	Very low	33.3	Very low	156 Å²	156	144.2 Å²	144.2	83%	0.834	78%	0.782	S	S	*	*			trans	64.5	137.9	162.6	-48.6	-26.4	0	0	0	115.6
309	G	30.7	Very low	33.3	Very low	81 Å²	81	138.7 Å²	138.7	84%	0.835	78%	0.778	S	S	*	*			cis	102.4	115	30.5	0	0	0	0	0	107.6
310	D	32.3	Very low	33	Very low	116 Å²	116	145.4 Å²	145.4	62%	0.62	79%	0.787	S	S	*	*			cis	-132	150	39.5	175	22.4	0	0	0	112.7	R312	D310-R312 WeakPolarHBondContact OD2-CD 3.43Å; D310-R312 WeakPolarHBondContact OD2-CG 3.46Å; D310-R312 IonicContact OD2-CZ 3.66Å; D310-R312 IonicContact OD2-NE 2.67Å; D310-R312 IonicContact OD2-NH1 3.14Å; D310-R312 PolarHBondContact OD2-NH1 2.93Å
311	L	35.5	Very low	32.6	Very low	137 Å²	137	146.7 Å²	146.7	72%	0.717	78%	0.776	S	S	*	*			trans	-105.6	77.9	178.1	-169.8	79.7	0	0	0	110.7	R313	L311-R313 VanDerWaalsContact C-N 3.26Å; L311-R313 PolarHBondContact O-N 3.32Å
312	R	37.3	Very low	32.5	Very low	223 Å²	223	142.3 Å²	142.3	84%	0.842	77%	0.77	S	S	*	*			trans	-72.6	82.1	175.3	-56.7	-158.5	85.3	81.8	-6.5	111.2	D310	D310-R312 WeakPolarHBondContact OD2-CD 3.43Å; D310-R312 WeakPolarHBondContact OD2-CG 3.46Å; D310-R312 IonicContact OD2-CZ 3.66Å; D310-R312 IonicContact OD2-NE 2.67Å; D310-R312 IonicContact OD2-NH1 3.14Å; D310-R312 PolarHBondContact OD2-NH1 2.93Å
313	R	38.4	Very low	31.8	Very low	206 Å²	206	141.2 Å²	141.2	78%	0.777	77%	0.765	S	S	*	*			trans	-68.6	119.5	-178.2	-178.5	-163.3	-53.9	148	4.4	112.1	L311	L311-R313 VanDerWaalsContact C-N 3.26Å; L311-R313 PolarHBondContact O-N 3.32Å
314	E	32.3	Very low	32.5	Very low	186 Å²	186	143.1 Å²	143.1	87%	0.869	76%	0.764	S	S	*	*			trans	-153.1	152	152.4	-107.6	-69.4	82.5	0	0	108.2
315	M	33.8	Very low	32.4	Very low	155 Å²	155	142.2 Å²	142.2	76%	0.764	75%	0.753	S	S	*	*			trans	-138.5	119.2	-164.4	-178	-175.1	-62.8	0	0	112.5
316	V	32	Very low	32.3	Very low	122 Å²	122	144.6 Å²	144.6	74%	0.739	76%	0.755	S	S	*	*			trans	70.2	129.1	162.6	171.3	0	0	0	0	115.5
317	Y	29.6	Very low	32	Very low	211 Å²	211	147.2 Å²	147.2	83%	0.827	76%	0.756	S	S	*	*			cis	-158.4	161	-2	-132.1	-133.2	0	0	0	110.2
318	A	29.2	Very low	31.9	Very low	88 Å²	88	147.5 Å²	147.5	73%	0.727	75%	0.753	S	S	*	*			trans	60.3	117.1	150.3	0	0	0	0	0	123.2
319	S	44.1	Very low	31.8	Very low	123 Å²	123	143.3 Å²	143.3	86%	0.86	73%	0.731	S	S	*	*			trans	100.6	100.1	130.2	-152.2	0	0	0	0	121.5
320	R	25.9	Very low	31.7	Very low	216 Å²	216	144 Å²	144	82%	0.815	72%	0.715	S	S	*	*			trans	-149	159.5	153.1	-91.2	-174.4	168.5	-107.6	9.8	105.9
321	E	26.2	Very low	31.5	Very low	128 Å²	128	144 Å²	144	60%	0.598	72%	0.715	S	S	*	*			cis	-138.3	148	9.3	-169.7	67.3	-174.4	0	0	110.1
322	S	29.6	Very low	31.2	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	72%	0.717	S	S	*	*			trans	-124.9	151.4	165.3	64.8	0	0	0	0	109.8
323	S	25.6	Very low	32.1	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	72%	0.716	S	S	*	*			trans	-164.6	145	164.3	-90.3	0	0	0	0	112.5
324	P	45.7	Very low	31.7	Very low	114 Å²	114	133 Å²	133	74%	0.74	72%	0.717	S	S	*	*			cis	-121.4	170.7	-28.6	31.3	-12.3	0	0	0	110.6
325	T	27.2	Very low	32.5	Very low	109 Å²	109	129.7 Å²	129.7	67%	0.669	71%	0.713	S	S	*	*				-177.3	121.8	63.6	-59.5	0	0	0	0	112.3
326	R	29.9	Very low	32.3	Very low	218 Å²	218	130.9 Å²	130.9	82%	0.823	72%	0.716	S	S	*	*			trans	61	147	156.5	-66.5	-175.1	174.9	-148.7	-3	118.6
327	R	27.9	Very low	32.2	Very low	189 Å²	189	133.6 Å²	133.6	71%	0.713	73%	0.725	S	S	*	*			cis	-161.7	137.7	1.1	-128.3	-169.6	157.9	-161.1	-8	111.1
328	L	26.5	Very low	32.2	Very low	109 Å²	109	128.1 Å²	128.1	57%	0.571	72%	0.723	S	S	*	*			trans	63.9	157.3	154.7	-56.3	169.4	0	0	0	116.4
329	N	27.4	Very low	32.2	Very low	69 Å²	69	130.1 Å²	130.1	37%	0.369	73%	0.732	S	S	.	*			cis	-165.6	160.5	-1.1	-114.8	-8.7	0	0	0	108.6	D997	N329-D997 VanDerWaalsContact CB-OD1 3.23Å; N329-D997 WeakPolarHBondContact CB-OD1 3.32Å; N329-D997 VanDerWaalsContact ND2-CG 3.28Å; N329-D997 PolarHBondContact ND2-OD1 3.33Å; N329-D997 PolarHBondContact ND2-OD2 2.88Å
330	N	28.4	Very low	31.5	Very low	94 Å²	94	127.4 Å²	127.4	50%	0.503	72%	0.724	S	S	.	*			cis	-169.9	163.7	-33	-142	-39.6	0	0	0	112.9	K999	N330-K999 WeakPolarHBondContact O-CE 3.32Å; N330-K999 PolarHBondContact O-NZ 3.31Å
331	L	29.4	Very low	31.7	Very low	117 Å²	117	122.9 Å²	122.9	61%	0.613	73%	0.725	S	S	*	*			trans	68.8	90.2	159.5	-59.3	168.6	0	0	0	121	K999	L331-K999 PolarHBondContact O-NZ 3.23Å
332	S	28.8	Very low	33.4	Very low	110 Å²	110	122.3 Å²	122.3	77%	0.769	73%	0.733	S	S	*	*				55.2	-179.6	94.3	-34.4	0	0	0	0	121.8
333	P	55.8	Low	34.2	Very low	126 Å²	126	123.1 Å²	123.1	82%	0.818	74%	0.735	S	S	*	*				-139.1	-167.2	-114.5	39.5	-15.1	0	0	0	116.2
334	A	29.7	Very low	35.4	Very low	98 Å²	98	123.9 Å²	123.9	81%	0.81	74%	0.738	S	S	*	*			trans	174.1	147.5	141.5	0	0	0	0	0	114.6
335	P	50.8	Low	34.7	Very low	118 Å²	118	122.3 Å²	122.3	77%	0.766	74%	0.742	S	S	*	*			trans	-128.2	179.6	173.2	43.4	-31.1	0	0	0	115
336	H	28	Very low	34.9	Very low	180 Å²	180	125.3 Å²	125.3	83%	0.833	75%	0.753	S	S	*	*			trans	-166	151	153	32.6	-92.6	0	0	0	114.9
337	L	30.3	Very low	35.3	Very low	179 Å²	179	120 Å²	120	94%	0.937	75%	0.746	S	S	*	*			trans	-155.3	171.5	171.7	-57.7	173.7	0	0	0	106.2
338	A	30.6	Very low	35.4	Very low	95 Å²	95	117.1 Å²	117.1	79%	0.785	76%	0.755	S	S	*	*			cis	-157.7	-179.7	-5	0	0	0	0	0	107.3
339	S	29.5	Very low	35.5	Very low	131 Å²	131	115.3 Å²	115.3	92%	0.916	76%	0.763	S	S	*	*			trans	165.2	158.6	145.2	-172.4	0	0	0	0	114.2
340	G	29.1	Very low	36	Very low	66 Å²	66	120.3 Å²	120.3	68%	0.68	79%	0.789	S	S	*	*			trans	119.8	132.6	149.4	0	0	0	0	0	117.6
341	S	29	Very low	36.3	Very low	120 Å²	120	121.8 Å²	121.8	84%	0.839	80%	0.804	S	S	*	*			trans	-134.9	-150.7	178.3	-56.7	0	0	0	0	113.2
342	P	62	Low	36.3	Very low	117 Å²	117	122.1 Å²	122.1	76%	0.76	82%	0.816	S	S	*	*			trans	-85.7	-173.8	-133.4	46.5	-36.7	0	0	0	114.4
343	P	46.4	Very low	36.5	Very low	120 Å²	120	119.8 Å²	119.8	78%	0.779	81%	0.81	S	S	*	*			cis	-125.5	-100.2	10.1	22.3	5.3	0	0	0	120
344	P	51.5	Low	35.4	Very low	123 Å²	123	122.4 Å²	122.4	80%	0.799	82%	0.816	S	S	*	*				-129.7	158.9	-127.4	40.9	-23.1	0	0	0	118.3
345	G	30.1	Very low	35.4	Very low	80 Å²	80	126.6 Å²	126.6	83%	0.825	82%	0.818	S	S	*	*			trans	165.8	142.2	164.1	0	0	0	0	0	115.6
346	L	32.5	Very low	34.2	Very low	172 Å²	172	126.8 Å²	126.8	90%	0.901	82%	0.823	S	S	*	*			trans	-114.8	169.8	169.8	-76.1	174.8	0	0	0	108.9
347	P	36.9	Very low	34.2	Very low	106 Å²	106	121.6 Å²	121.6	69%	0.688	82%	0.818	S	S	*	*			cis	-134.2	156.3	-30.6	34.8	-19.3	0	0	0	113.7
348	S	30.4	Very low	34.3	Very low	129 Å²	129	118.7 Å²	118.7	90%	0.902	81%	0.812	S	S	*	*			trans	166.4	154.3	141.6	-82.4	0	0	0	0	113.4
349	G	29.8	Very low	34.6	Very low	71 Å²	71	119.9 Å²	119.9	73%	0.732	81%	0.812	S	S	*	*			trans	92.5	67.1	150	0	0	0	0	0	119.9
350	L	37.4	Very low	34.6	Very low	174 Å²	174	119.1 Å²	119.1	91%	0.911	81%	0.807	S	S	*	*			trans	27.4	122.5	148.3	-70.4	160.7	0	0	0	119.4
351	P	34.8	Very low	34.6	Very low	125 Å²	125	127.1 Å²	127.1	81%	0.812	82%	0.816	S	S	*	*				-147.7	-175.1	96.5	40.9	-26.3	0	0	0	115
352	S	30	Very low	34.5	Very low	124 Å²	124	126.5 Å²	126.5	87%	0.867	81%	0.812	S	S	*	*			trans	-84.1	161	167.9	-61.6	0	0	0	0	111.7
353	G	31.6	Very low	33.3	Very low	62 Å²	62	131.4 Å²	131.4	64%	0.639	82%	0.816	S	S	*	*			cis	172.7	-152.4	2.1	0	0	0	0	0	112
354	L	34.2	Very low	32.5	Very low	181 Å²	181	132.7 Å²	132.7	95%	0.948	82%	0.815	S	S	*	*			trans	70.9	133.1	-158.5	-52.8	169.1	0	0	0	111.2
355	Q	28.3	Very low	31.3	Very low	185 Å²	185	131.6 Å²	131.6	86%	0.864	81%	0.811	S	S	*	*	S	Bend	cis	-119.5	161.2	6.9	-58	176.3	-4	0	0	112.6
356	S	27.1	Very low	31.1	Very low	123 Å²	123	139 Å²	139	86%	0.86	82%	0.815	S	S	*	*			trans	60	112.7	153.3	-155.1	0	0	0	0	121.4
357	G	27	Very low	30.8	Very low	71 Å²	71	135.1 Å²	135.1	73%	0.732	81%	0.808	S	S	*	*			trans	75	164	159.6	0	0	0	0	0	117
358	S	32.8	Very low	30.4	Very low	117 Å²	117	134.3 Å²	134.3	82%	0.818	82%	0.819	S	S	*	*			cis	-163.7	164.8	-17	-82.3	0	0	0	0	108.7
359	P	37.5	Very low	30.2	Very low	121 Å²	121	132 Å²	132	79%	0.786	82%	0.816	S	S	*	*				-135.4	151.7	126.3	36.6	-27.7	0	0	0	111
360	S	27.6	Very low	30.2	Very low	115 Å²	115	140.2 Å²	140.2	80%	0.804	82%	0.824	S	S	*	*			cis	-161	163.9	-4.1	-93.3	0	0	0	0	105.7
361	R	29.4	Very low	30.8	Very low	233 Å²	233	137.4 Å²	137.4	88%	0.879	82%	0.816	S	S	*	*			cis	-146.3	139.4	13	-117.6	174	168.2	-174.1	-4.4	105.7
362	S	28.2	Very low	31.4	Very low	107 Å²	107	136.5 Å²	136.5	75%	0.748	81%	0.811	S	S	*	*				56	132.4	93.7	-178.2	0	0	0	0	116
363	R	36	Very low	31.4	Very low	221 Å²	221	135.9 Å²	135.9	83%	0.834	81%	0.807	S	S	*	*			cis	-174.9	162.6	-10.9	-177.7	-176.7	-178.9	-146.2	2.6	108.2
364	L	28.8	Very low	31.2	Very low	146 Å²	146	143.8 Å²	143.8	76%	0.764	82%	0.819	S	S	*	*			trans	116.3	167.9	158.8	-62.8	172.8	0	0	0	115.4
365	S	26.3	Very low	30.9	Very low	101 Å²	101	139.7 Å²	139.7	71%	0.706	81%	0.811	S	S	*	*			trans	-132	-178	-142.6	-48.6	0	0	0	0	113.6
366	Y	25.8	Very low	30.7	Very low	234 Å²	234	134.4 Å²	134.4	92%	0.918	81%	0.806	S	S	*	*			trans	83.3	155.4	165.1	-88.6	-83.6	0	0	0	118.8
367	A	27.7	Very low	30.8	Very low	92 Å²	92	134 Å²	134	76%	0.76	80%	0.803	S	S	*	*			trans	-122.8	156.4	-176.3	0	0	0	0	0	110.4
368	G	28.5	Very low	31.9	Very low	88 Å²	88	136 Å²	136	91%	0.907	80%	0.803	S	S	*	*			trans	90	117.9	165.9	0	0	0	0	0	115.5
369	G	26.1	Very low	31.8	Very low	81 Å²	81	134.8 Å²	134.8	84%	0.835	79%	0.791	S	S	*	*			trans	171.2	123.9	171.3	0	0	0	0	0	113.6
370	R	29	Very low	31.3	Very low	243 Å²	243	137.5 Å²	137.5	92%	0.917	79%	0.793	S	S	*	*			trans	-103.2	-175.8	157.6	-67.8	-178.2	169.6	-160.5	-0.3	107.5
371	P	50.3	Low	31.5	Very low	115 Å²	115	139.5 Å²	139.5	75%	0.747	79%	0.789	S	S	*	*				-109.1	-138.1	-68.6	37.7	-20.2	0	0	0	106.9
372	P	47.9	Very low	31.4	Very low	106 Å²	106	133 Å²	133	69%	0.688	79%	0.785	S	S	*	*			cis	-132.8	172.9	-22.3	40.1	-22.4	0	0	0	116.2
373	S	29.3	Very low	31.3	Very low	112 Å²	112	132.3 Å²	132.3	78%	0.783	79%	0.786	S	S	*	*			trans	39.5	135.9	138.5	-54.1	0	0	0	0	125.8
374	Y	27	Very low	30.9	Very low	228 Å²	228	128.6 Å²	128.6	89%	0.894	78%	0.778	S	S	*	*			trans	91	141.6	134.7	-136.4	-103.8	0	0	0	121.8
375	A	27.9	Very low	30.9	Very low	94 Å²	94	130.9 Å²	130.9	78%	0.777	78%	0.776	S	S	*	*			trans	57	148.6	172.4	0	0	0	0	0	118.2
376	G	25.3	Very low	31	Very low	75 Å²	75	134.2 Å²	134.2	77%	0.773	79%	0.785	S	S	*	*			cis	-176.2	155.4	-7.3	0	0	0	0	0	111.4
377	S	28.8	Very low	31	Very low	114 Å²	114	127.2 Å²	127.2	80%	0.797	78%	0.784	S	S	*	*			trans	-81.9	160.7	166.5	-162.1	0	0	0	0	109.5
378	P	50	Low	30.8	Very low	112 Å²	112	126.6 Å²	126.6	73%	0.727	79%	0.787	S	S	*	*				-150.3	148.6	92.7	38.4	-20.8	0	0	0	117.2
379	V	29.8	Very low	30.9	Very low	93 Å²	93	127 Å²	127	56%	0.564	78%	0.782	S	S	*	*			trans	61.6	125.7	130.8	175.3	0	0	0	0	120.1
380	H	28.5	Very low	31.5	Very low	177 Å²	177	129.2 Å²	129.2	82%	0.819	78%	0.782	S	S	*	*				-154.6	118.4	110.3	-106.4	-82.5	0	0	0	112.1
381	H	30.4	Very low	31.4	Very low	158 Å²	158	122.2 Å²	122.2	73%	0.731	78%	0.776	S	S	*	*			trans	-3.2	147.4	161.3	-55.9	-103.8	0	0	0	119.7
382	A	26.7	Very low	30.2	Very low	95 Å²	95	121 Å²	121	79%	0.785	78%	0.775	S	S	*	*			cis	-170.8	-163.5	-13.1	0	0	0	0	0	106.2
383	A	27.4	Very low	29.3	Very low	94 Å²	94	125.9 Å²	125.9	78%	0.777	79%	0.789	S	S	*	*			cis	-163.6	175.4	-3.9	0	0	0	0	0	106.4
384	E	26.9	Very low	29.2	Very low	142 Å²	142	123.9 Å²	123.9	66%	0.664	79%	0.786	S	S	*	*			cis	-158.9	-168.9	-15.1	-143.3	-152.7	158.7	0	0	109.1
385	R	29.4	Very low	29.2	Very low	194 Å²	194	120.1 Å²	120.1	73%	0.732	79%	0.786	S	S	*	*			trans	35	87.6	157.2	-71.5	173.1	-154.4	-80.4	-26.4	120.9
386	L	27.5	Very low	29.5	Very low	171 Å²	171	120.5 Å²	120.5	90%	0.895	78%	0.783	S	S	*	*				29.9	116.3	113.3	-60.9	173.3	0	0	0	120.1
387	G	26	Very low	30	Very low	87 Å²	87	122.7 Å²	122.7	90%	0.897	78%	0.784	S	S	*	*				93.9	124.9	116.5	0	0	0	0	0	119.5
388	G	24.5	Very low	30.1	Very low	80 Å²	80	122.4 Å²	122.4	83%	0.825	78%	0.782	S	S	*	*			trans	168	136.4	167.2	0	0	0	0	0	114.3
389	A	30.8	Very low	29.6	Very low	97 Å²	97	122.5 Å²	122.5	80%	0.802	78%	0.783	S	S	*	*			trans	-88.3	-179.1	156.6	0	0	0	0	0	108.2
390	P	37.8	Very low	29.7	Very low	126 Å²	126	123.3 Å²	123.3	82%	0.818	79%	0.792	S	S	*	*			cis	-148.4	-129.6	18	44.3	-20.4	0	0	0	113.5
391	A	26.6	Very low	30.2	Very low	97 Å²	97	119.4 Å²	119.4	80%	0.802	79%	0.791	S	S	*	*			trans	94.6	152.7	160.6	0	0	0	0	0	118.4
392	A	26.1	Very low	30.4	Very low	88 Å²	88	119.6 Å²	119.6	73%	0.727	80%	0.796	S	S	*	*			trans	-157	160.4	-169.4	0	0	0	0	0	112.1
393	Q	28.6	Very low	31	Very low	209 Å²	209	122.2 Å²	122.2	98%	0.977	80%	0.796	S	S	*	*			trans	66.8	152.5	175.4	-51	-171.9	-96.9	0	0	115.6
394	G	28.1	Very low	32.1	Very low	70 Å²	70	122.7 Å²	122.7	72%	0.722	78%	0.782	S	S	*	*			trans	-163.7	-47.1	-174.4	0	0	0	0	0	117.9
395	V	26.1	Very low	32.8	Very low	149 Å²	149	125 Å²	125	90%	0.903	78%	0.784	S	S	*	*			trans	73.8	152.1	-176.5	-171.3	0	0	0	0	114.9
396	S	33.8	Very low	33.9	Very low	102 Å²	102	124.4 Å²	124.4	71%	0.713	78%	0.782	S	S	*	*			trans	-80.9	170.7	-170.9	69.7	0	0	0	0	113.4
397	P	35.9	Very low	35	Very low	121 Å²	121	122.5 Å²	122.5	79%	0.786	77%	0.773	S	S	*	*				-141.7	168.9	69.1	41.9	-25.8	0	0	0	116.6
398	S	32	Very low	35.4	Very low	108 Å²	108	125 Å²	125	76%	0.755	77%	0.77	S	S	*	*			trans	-73.5	171.5	156.9	-48.4	0	0	0	0	110.2
399	P	39.7	Very low	36.5	Very low	114 Å²	114	128.2 Å²	128.2	74%	0.74	76%	0.762	S	S	*	*			cis	-145	-176.2	16.2	44.5	-24.5	0	0	0	117.6
400	S	30.1	Very low	37.8	Very low	110 Å²	110	129.1 Å²	129.1	77%	0.769	76%	0.76	S	S	*	*			trans	38	114.9	144.9	-58.3	0	0	0	0	124
401	A	39.8	Very low	38.2	Very low	96 Å²	96	128.7 Å²	128.7	79%	0.793	75%	0.75	S	S	*	*				50.2	128.7	119	0	0	0	0	0	123
402	I	35	Very low	38.9	Very low	162 Å²	162	132.8 Å²	132.8	83%	0.831	75%	0.753	S	S	*	*			trans	-170.8	144	167.9	-109.6	152.6	0	0	0	107.3
403	L	39.6	Very low	39.3	Very low	150 Å²	150	134.7 Å²	134.7	79%	0.785	75%	0.751	S	S	*	*			cis	-165.2	-167.5	-13.3	-131.1	-178	0	0	0	109.2
404	E	49.1	Very low	39.9	Very low	103 Å²	103	132.3 Å²	132.3	48%	0.481	74%	0.744	S	S	.	*			trans	73.1	140.3	159.6	-79.8	-147.5	101.3	0	0	118.3	R406	E404-R406 IonicContact OE1-CZ 2.73Å; E404-R406 IonicContact OE1-NE 3.43Å; E404-R406 PolarHBondContact OE1-NE 2.88Å; E404-R406 IonicContact OE1-NH2 2.67Å; E404-R406 PolarHBondContact OE1-NH2 2.93Å
405	R	42.6	Very low	40	Very low	191 Å²	191	132.2 Å²	132.2	72%	0.721	74%	0.736	S	S	*	*			cis	-132.2	140.1	7.8	-67	-165.4	165.1	143.3	11.1	109.6
406	R	52.6	Low	40	Very low	181 Å²	181	130.6 Å²	130.6	68%	0.683	73%	0.732	S	S	*	*				62	134.5	72.4	-69.2	-166.5	-62.2	135.3	-12.6	113.1	E404	E404-R406 IonicContact OE1-CZ 2.73Å; E404-R406 IonicContact OE1-NE 3.43Å; E404-R406 PolarHBondContact OE1-NE 2.88Å; E404-R406 IonicContact OE1-NH2 2.67Å; E404-R406 PolarHBondContact OE1-NH2 2.93Å
407	D	50.7	Low	39.9	Very low	131 Å²	131	135 Å²	135	70%	0.701	74%	0.738	S	S	*	*			cis	-159.3	-170.8	18.4	-133.3	-45.5	0	0	0	114.8
408	V	32.9	Very low	39.4	Very low	139 Å²	139	134 Å²	134	84%	0.842	74%	0.74	S	S	*	*			trans	102.4	127.8	165.5	-173.8	0	0	0	0	117.8
409	K	48.3	Very low	39.1	Very low	149 Å²	149	132.9 Å²	132.9	65%	0.648	75%	0.746	S	S	*	*			trans	-156.8	153.6	179.5	-168.9	-141.3	171.8	-170.7	0	110.6	D411	K409-D411 WeakPolarHBondContact CE-OD2 3.43Å; K409-D411 IonicContact NZ-OD1 2.68Å; K409-D411 PolarHBondContact NZ-OD1 2.89Å; K409-D411 IonicContact NZ-OD2 2.72Å; K409-D411 PolarHBondContact NZ-OD2 3.14Å
410	P	57.5	Low	38.4	Very low	116 Å²	116	130.8 Å²	130.8	75%	0.753	74%	0.744	S	S	*	*			trans	-124.7	169.6	148.1	36.3	-25.2	0	0	0	114
411	D	47.5	Very low	38.4	Very low	116 Å²	116	134 Å²	134	62%	0.62	75%	0.749	S	S	*	*			trans	-103.7	-174.3	-175.9	-87.1	-74.9	0	0	0	113	K409	K409-D411 WeakPolarHBondContact CE-OD2 3.43Å; K409-D411 IonicContact NZ-OD1 2.68Å; K409-D411 PolarHBondContact NZ-OD1 2.89Å; K409-D411 IonicContact NZ-OD2 2.72Å; K409-D411 PolarHBondContact NZ-OD2 3.14Å
412	E	40.3	Very low	37.8	Very low	184 Å²	184	135.2 Å²	135.2	86%	0.86	75%	0.747	S	S	*	*			cis	-166.4	155.4	21.9	-159.1	164.3	-83.4	0	0	110
413	D	35.3	Very low	37.7	Very low	128 Å²	128	134.9 Å²	134.9	68%	0.684	75%	0.746	S	S	*	*			cis	-119.3	-88.1	-18.5	164.8	44.2	0	0	0	110.6	A415	D413-A415 PolarHBondContact OD2-N 2.82Å
414	L	40.1	Very low	37.4	Very low	159 Å²	159	133.4 Å²	133.4	83%	0.832	74%	0.743	S	S	*	*			cis	-144.8	130	-2.6	-140.3	-176.2	0	0	0	111.3
415	A	30.8	Very low	36.5	Very low	68 Å²	68	138 Å²	138	56%	0.562	76%	0.761	S	S	*	*			trans	-71.1	154.4	-174.1	0	0	0	0	0	117.3	D413	D413-A415 PolarHBondContact OD2-N 2.82Å
416	S	26.9	Very low	35.9	Very low	115 Å²	115	132.5 Å²	132.5	80%	0.804	76%	0.763	S	S	*	*				168.9	172.3	94.4	-74.4	0	0	0	0	112.4
417	K	30.3	Very low	34.8	Very low	194 Å²	194	133.6 Å²	133.6	84%	0.843	78%	0.776	S	S	*	*			cis	-179.4	122.6	-36.7	179.5	178.6	178.7	-179.4	0	110.9
418	A	25.6	Very low	33.9	Very low	101 Å²	101	131 Å²	131	84%	0.835	78%	0.781	S	S	*	*			trans	63.4	153.7	158	0	0	0	0	0	122.3
419	G	26.7	Very low	33.8	Very low	84 Å²	84	132.9 Å²	132.9	87%	0.866	79%	0.785	S	S	*	*			trans	91.1	146.6	170	0	0	0	0	0	115.6
420	G	24.8	Very low	33.4	Very low	69 Å²	69	136.6 Å²	136.6	71%	0.711	80%	0.797	S	S	*	*			cis	154.2	136.8	-9.6	0	0	0	0	0	112.9
421	M	29.2	Very low	32.1	Very low	177 Å²	177	135.1 Å²	135.1	87%	0.872	79%	0.794	S	S	*	*			trans	67.8	138.7	177	-52.9	169.3	70.3	0	0	113.9
422	V	28.6	Very low	31.7	Very low	123 Å²	123	135.7 Å²	135.7	75%	0.745	80%	0.798	S	S	*	*			cis	82	130.7	19	-164.5	0	0	0	0	114.4
423	L	33.2	Very low	31.6	Very low	154 Å²	154	132.5 Å²	132.5	81%	0.806	79%	0.793	S	S	*	*			trans	78	148.6	-179.6	-54.2	-171.8	0	0	0	116.5
424	V	33.3	Very low	31.9	Very low	119 Å²	119	137.3 Å²	137.3	72%	0.721	80%	0.803	S	S	*	*			cis	-166.6	165.3	-31.9	97.2	0	0	0	0	109.1
425	K	29.3	Very low	31.8	Very low	200 Å²	200	132.9 Å²	132.9	87%	0.87	80%	0.795	S	S	*	*			trans	63.7	131.5	177.5	-82.5	176.8	173.5	-174.9	0	116.1
426	G	30.5	Very low	32.4	Very low	75 Å²	75	137.3 Å²	137.3	77%	0.773	81%	0.809	S	S	*	*			cis	122.7	101.9	-15.8	0	0	0	0	0	115.2
427	E	28.8	Very low	32.6	Very low	204 Å²	204	138.9 Å²	138.9	95%	0.953	81%	0.807	S	S	*	*			trans	-165.3	165.6	159.6	-129	173.4	-134.5	0	0	109
428	G	32	Very low	32.7	Very low	78 Å²	78	137.8 Å²	137.8	80%	0.804	81%	0.805	S	S	*	*			trans	88.8	110	162.6	0	0	0	0	0	118.1
429	L	31.5	Very low	32.8	Very low	177 Å²	177	141.1 Å²	141.1	93%	0.927	80%	0.803	S	S	*	*			trans	-53.4	161.7	179.3	-70	155.2	0	0	0	117.7
430	Y	39.8	Very low	33	Very low	227 Å²	227	140 Å²	140	89%	0.89	79%	0.792	S	S	*	*			trans	-64.8	130.8	175.4	-177.8	-87	0	0	0	113.4
431	A	30.2	Very low	33.2	Very low	85 Å²	85	148.6 Å²	148.6	70%	0.702	80%	0.803	S	S	*	*			trans	-145.4	145.4	168.7	0	0	0	0	0	111
432	D	38.8	Very low	33.5	Very low	129 Å²	129	147.7 Å²	147.7	69%	0.69	80%	0.8	S	S	*	*			trans	-87	135.6	170.9	169.8	42.7	0	0	0	110.5
433	P	37.6	Very low	33.5	Very low	116 Å²	116	146.6 Å²	146.6	75%	0.753	80%	0.798	S	S	*	*			trans	-133.4	93.7	161.9	35.9	-19	0	0	0	112.9	G435	P433-G435 PolarHBondContact O-N 3.44Å
434	Y	41.9	Very low	33.2	Very low	230 Å²	230	147.1 Å²	147.1	90%	0.902	80%	0.801	S	S	*	*			trans	-76.9	101.5	153.8	-106.8	-82.1	0	0	0	111.1
435	G	38.9	Very low	32.8	Very low	65 Å²	65	146.5 Å²	146.5	67%	0.67	81%	0.808	S	S	*	*			trans	113.9	138.6	149.2	0	0	0	0	0	118.2	P433	P433-G435 PolarHBondContact O-N 3.44Å
436	L	41.7	Very low	32.9	Very low	162 Å²	162	141.3 Å²	141.3	85%	0.848	80%	0.802	S	S	*	*			trans	-161.2	170.7	132.5	-141.9	66.7	0	0	0	111.4
437	L	31.5	Very low	32.9	Very low	147 Å²	147	141 Å²	141	77%	0.77	79%	0.793	S	S	*	*			trans	71.3	117.2	179.5	-82.9	65.6	0	0	0	115
438	H	32.6	Very low	33	Very low	172 Å²	172	136.2 Å²	136.2	80%	0.796	79%	0.788	S	S	*	*			cis	69.8	139.9	18.3	-135.7	70.1	0	0	0	113
439	E	28.3	Very low	32.7	Very low	171 Å²	171	136.3 Å²	136.3	80%	0.799	79%	0.789	S	S	*	*			cis	-107.7	-178.9	3.9	-68.5	178.2	111	0	0	111.6
440	G	31.6	Very low	32.4	Very low	60 Å²	60	132.5 Å²	132.5	62%	0.619	77%	0.769	S	S	*	*			cis	114.5	113.6	0	0	0	0	0	0	114.1
441	R	28.7	Very low	32.3	Very low	250 Å²	250	127.4 Å²	127.4	94%	0.943	76%	0.764	S	S	*	*			trans	-163.9	159	156.4	-101.7	-64.5	156.7	150.6	-3.1	110.4
442	L	34	Very low	32.2	Very low	158 Å²	158	127.8 Å²	127.8	83%	0.827	75%	0.75	S	S	*	*			trans	-107.7	156.7	-168.2	-59.1	162	0	0	0	112.4
443	S	29.9	Very low	31.6	Very low	100 Å²	100	125.5 Å²	125.5	70%	0.699	75%	0.75	S	S	*	*				141.8	130.3	116.4	-75.8	0	0	0	0	117.1
444	L	27	Very low	31.5	Very low	165 Å²	165	128.8 Å²	128.8	86%	0.864	75%	0.748	S	S	*	*			trans	50	104.2	134.1	-59.2	164.7	0	0	0	119.9
445	A	24.8	Very low	31.3	Very low	105 Å²	105	123.9 Å²	123.9	87%	0.868	75%	0.745	S	S	*	*				174.5	137.6	99.7	0	0	0	0	0	113.3
446	A	30	Very low	30.8	Very low	91 Å²	91	123.3 Å²	123.3	75%	0.752	74%	0.739	S	S	*	*			trans	-107.4	174.8	156.6	0	0	0	0	0	108
447	A	31.1	Very low	30.8	Very low	70 Å²	70	120.1 Å²	120.1	58%	0.579	74%	0.736	S	S	*	*			cis	-148	-163.3	8	0	0	0	0	0	106.7
448	A	31.1	Very low	31.1	Very low	103 Å²	103	116.6 Å²	116.6	85%	0.851	74%	0.735	S	S	*	*			cis	-157	173.7	12.3	0	0	0	0	0	110.9
449	G	25.6	Very low	31	Very low	79 Å²	79	111.4 Å²	111.4	81%	0.814	73%	0.728	S	S	*	*			trans	-175.6	82	176.3	0	0	0	0	0	110.5
450	D	25.8	Very low	31.4	Very low	97 Å²	97	110.6 Å²	110.6	52%	0.519	73%	0.728	S	S	.	*			trans	-73.7	159.7	-163.4	-161.2	39.2	0	0	0	114.2	F452	D450-F452 PolarHBondContact OD1-N 3.32Å; D450-F452 WeakPolarHBondContact OD2-CD2 3.44Å; D450-F452 PolarHBondContact OD2-N 3.33Å
451	P	37.8	Very low	31.3	Very low	121 Å²	121	118.1 Å²	118.1	79%	0.786	74%	0.739	S	S	*	*				-143.9	131.3	91	36.8	-19.9	0	0	0	117.3
452	F	27.1	Very low	31.7	Very low	92 Å²	92	116.5 Å²	116.5	40%	0.404	74%	0.739	S	S	.	*			trans	-47.5	167.8	146.6	-90.8	-135.8	0	0	0	113.8	D450 L975 A978	D450-F452 PolarHBondContact OD1-N 3.32Å; D450-F452 WeakPolarHBondContact OD2-CD2 3.44Å; D450-F452 PolarHBondContact OD2-N 3.33Å; F452-L975 HydrophobicContact CE1-CD1 3.74Å; F452-L975 HydrophobicContact CE1-CG 3.75Å; F452-L975 HydrophobicContact CE2-CD1 3.68Å; F452-L975 HydrophobicContact CE2-CG 4.27Å; F452-L975 HydrophobicContact CZ-CB 4.06Å; F452-L975 HydrophobicContact CZ-CD1 3.22Å; F452-L975 HydrophobicContact CZ-CG 3.36Å; F452-L975 VanDerWaalsContact CZ-O 3.31Å; F452-L975 WeakPolarHBondContact CZ-O 3.45Å; F452-A978 HydrophobicContact CD2-CB 4.3Å; F452-A978 HydrophobicContact CE2-CB 3.5Å; F452-A978 VanDerWaalsContact CE2-CB 3.5Å; F452-A978 HydrophobicContact CZ-CB 3.87Å
453	A	26.5	Very low	31.8	Very low	82 Å²	82	121.1 Å²	121.1	68%	0.678	75%	0.745	S	S	*	*			cis	-145.4	163.4	8.3	0	0	0	0	0	112.3
454	Y	34.8	Very low	31.7	Very low	185 Å²	185	119.7 Å²	119.7	73%	0.725	75%	0.746	S	S	*	*			trans	-87.5	174.4	153.1	-121	-135.2	0	0	0	109.3	G456 A457	Y454-G456 VanDerWaalsContact CE1-CA 3.42Å; Y454-A457 HydrophobicContact CE1-CB 4.34Å
455	P	38.1	Very low	31.8	Very low	127 Å²	127	117 Å²	117	83%	0.825	74%	0.741	S	S	*	*			cis	-100.8	164.9	18.1	38.7	-34.6	0	0	0	114.1
456	G	29.3	Very low	32	Very low	53 Å²	53	117.9 Å²	117.9	55%	0.546	74%	0.736	S	S	.	*			cis	112.9	144.6	10.6	0	0	0	0	0	111.3	Y454	Y454-G456 VanDerWaalsContact CE1-CA 3.42Å
457	A	40.9	Very low	32	Very low	95 Å²	95	125.1 Å²	125.1	79%	0.785	74%	0.744	S	S	*	*			cis	-151.6	170	-3.8	0	0	0	0	0	107.8	Y454	Y454-A457 HydrophobicContact CE1-CB 4.34Å
458	G	37.2	Very low	32.2	Very low	73 Å²	73	127.4 Å²	127.4	75%	0.753	76%	0.755	S	S	*	*			cis	137.1	155.4	13.3	0	0	0	0	0	108.4
459	G	31.3	Very low	32.1	Very low	63 Å²	63	131.1 Å²	131.1	65%	0.649	76%	0.76	S	S	*	*			cis	-120.6	-178.3	-7.3	0	0	0	0	0	112.2
460	L	37.2	Very low	32.3	Very low	153 Å²	153	132.2 Å²	132.2	80%	0.801	76%	0.755	S	S	*	*				68.2	138.6	76.6	-56	173.8	0	0	0	112.5
461	Y	28.7	Very low	32.5	Very low	218 Å²	218	133.8 Å²	133.8	86%	0.855	77%	0.769	S	S	*	*			cis	-136.9	-172.9	35.1	-45.2	-83.4	0	0	0	114.4
462	K	38.1	Very low	32.1	Very low	216 Å²	216	137.3 Å²	137.3	94%	0.939	77%	0.768	S	S	*	*			trans	-96.8	168.8	-177.6	-81	-175.5	178.6	175.7	0	114.3
463	R	35.9	Very low	32.3	Very low	255 Å²	255	138.6 Å²	138.6	96%	0.962	79%	0.788	S	S	*	*			trans	-92.1	134.6	-175.3	175.9	-165.9	-169	-145.4	6.8	113.4
464	G	26.8	Very low	32.5	Very low	70 Å²	70	139.6 Å²	139.6	72%	0.722	80%	0.796	S	S	*	*			trans	153.7	127.2	147.4	0	0	0	0	0	120.2
465	S	28.5	Very low	32.2	Very low	108 Å²	108	135.2 Å²	135.2	76%	0.755	80%	0.798	S	S	*	*			trans	90.8	95.3	134	-153.3	0	0	0	0	122.8
466	V	30.5	Very low	31.7	Very low	124 Å²	124	133.5 Å²	133.5	75%	0.752	80%	0.795	S	S	*	*			trans	73	142.6	135.6	-51.2	0	0	0	0	124.6
467	R	29.2	Very low	31.7	Very low	244 Å²	244	138.4 Å²	138.4	92%	0.921	81%	0.808	S	S	*	*			trans	83.8	136.4	161	-64.4	-170.4	179.1	155.1	2.4	119.2
468	S	36	Very low	31	Very low	117 Å²	117	142.2 Å²	142.2	82%	0.818	81%	0.809	S	S	*	*			trans	-90.8	152.3	177.9	-14.6	0	0	0	0	111.9
469	L	29.3	Very low	30.6	Very low	181 Å²	181	143.4 Å²	143.4	95%	0.948	81%	0.806	S	S	*	*			trans	-142.4	159.1	146.9	-86.1	-177.9	0	0	0	108.9
470	S	29.9	Very low	30.5	Very low	102 Å²	102	147.3 Å²	147.3	71%	0.713	81%	0.812	S	S	*	*			trans	-122	137.5	-176.7	177.5	0	0	0	0	110.5
471	T	29.8	Very low	30.2	Very low	131 Å²	131	147.8 Å²	147.8	80%	0.804	81%	0.814	S	S	*	*			trans	-148.7	95.1	172.1	51.6	0	0	0	0	112.4
472	Y	29	Very low	30.1	Very low	195 Å²	195	145.7 Å²	145.7	77%	0.765	81%	0.812	S	S	*	*			trans	52.3	149.2	146.7	-88.2	-88.3	0	0	0	123.5
473	S	30.9	Very low	29.6	Very low	118 Å²	118	142.7 Å²	142.7	83%	0.825	81%	0.807	S	S	*	*			trans	-115.7	141	-168.3	-46.6	0	0	0	0	113.7
474	A	30.3	Very low	29.2	Very low	104 Å²	104	136.9 Å²	136.9	86%	0.86	81%	0.805	S	S	*	*			trans	-173.5	147.3	151.6	0	0	0	0	0	109.8
475	A	29.3	Very low	29.4	Very low	93 Å²	93	140.2 Å²	140.2	77%	0.769	81%	0.806	S	S	*	*			cis	-161.3	150.3	-22.8	0	0	0	0	0	109.8
476	A	26.5	Very low	29.5	Very low	91 Å²	91	144.4 Å²	144.4	75%	0.752	81%	0.806	S	S	*	*			trans	46.9	136.7	151.9	0	0	0	0	0	123.3
477	L	29.8	Very low	29.3	Very low	155 Å²	155	147.5 Å²	147.5	81%	0.812	81%	0.81	S	S	*	*			trans	108.2	134.1	147.5	-58.2	-171	0	0	0	120.1
478	Q	26.5	Very low	29.2	Very low	176 Å²	176	140.6 Å²	140.6	82%	0.822	80%	0.804	S	S	*	*			trans	64.3	148.7	156.8	-69.9	-175.6	-78	0	0	120.5
479	S	28.2	Very low	28.8	Very low	97 Å²	97	140.3 Å²	140.3	68%	0.678	81%	0.81	S	S	*	*			cis	-165.6	167.5	-33.2	47.6	0	0	0	0	109.4
480	D	29.8	Very low	28.7	Very low	145 Å²	145	135.3 Å²	135.3	78%	0.775	80%	0.802	S	S	*	*			trans	-63.4	165.1	166.6	-150	-59.7	0	0	0	112.4
481	L	31.3	Very low	28.6	Very low	163 Å²	163	134.7 Å²	134.7	85%	0.853	81%	0.811	S	S	*	*			trans	74.3	132	162.2	-141.8	71.6	0	0	0	120.5
482	E	25.6	Very low	28.4	Very low	174 Å²	174	132.1 Å²	132.1	81%	0.813	81%	0.811	S	S	*	*			trans	-108	155.8	171.8	62	-167.7	151.4	0	0	112.3
483	D	28	Very low	28.3	Very low	154 Å²	154	126.4 Å²	126.4	82%	0.824	81%	0.811	S	S	*	*			trans	53	105.5	171.3	-87.5	-18.9	0	0	0	121.4
484	S	27.5	Very low	28.9	Very low	132 Å²	132	126.3 Å²	126.3	92%	0.923	81%	0.808	S	S	*	*				-166.6	145.2	112.4	-83.6	0	0	0	0	113.5
485	L	32.2	Very low	28.9	Very low	141 Å²	141	127.8 Å²	127.8	74%	0.738	80%	0.801	S	S	*	*			trans	-124.3	123.5	-168.7	173.8	74.8	0	0	0	112.3
486	Y	29.1	Very low	29.1	Very low	196 Å²	196	133.5 Å²	133.5	77%	0.769	80%	0.804	S	S	*	*				166	147	127.1	-105.9	-68.7	0	0	0	116.1
487	K	27.9	Very low	29.1	Very low	189 Å²	189	132.5 Å²	132.5	82%	0.822	80%	0.802	S	S	*	*			trans	54.2	119.3	156.4	-86.7	168.9	176.6	178.5	0	118.3
488	A	26.6	Very low	29.1	Very low	98 Å²	98	132.8 Å²	132.8	81%	0.81	80%	0.804	S	S	*	*			cis	93.8	139.9	28.2	0	0	0	0	0	116.4
489	A	27	Very low	29.2	Very low	112 Å²	112	126.8 Å²	126.8	93%	0.926	79%	0.79	S	S	*	*			trans	71	141	-175.8	0	0	0	0	0	116.8
490	G	27	Very low	29.6	Very low	76 Å²	76	133.1 Å²	133.1	78%	0.784	80%	0.8	S	S	*	*			cis	167	159.8	-9.4	0	0	0	0	0	114.7
491	G	27.9	Very low	29.7	Very low	88 Å²	88	129.2 Å²	129.2	91%	0.907	80%	0.795	S	S	*	*			trans	85.1	140.4	175.1	0	0	0	0	0	114.8
492	G	26.5	Very low	29.5	Very low	78 Å²	78	132 Å²	132	80%	0.804	80%	0.8	S	S	*	*			cis	-170.3	165	-5	0	0	0	0	0	111.9
493	G	26.3	Very low	29.7	Very low	75 Å²	75	133.4 Å²	133.4	77%	0.773	80%	0.798	S	S	*	*			trans	-88.6	-139.4	172.7	0	0	0	0	0	112.2
494	P	43	Very low	30.2	Very low	115 Å²	115	132.3 Å²	132.3	75%	0.747	79%	0.792	S	S	*	*			cis	-145	-163.9	6.4	34.3	-9	0	0	0	115.7
495	L	30.8	Very low	31.5	Very low	136 Å²	136	131.3 Å²	131.3	71%	0.712	78%	0.782	S	S	*	*			trans	77.1	145.4	162.2	-55.3	167.5	0	0	0	117.4
496	Y	34	Very low	32.4	Very low	213 Å²	213	130.3 Å²	130.3	84%	0.835	78%	0.784	S	S	*	*			cis	-134.5	146.2	-5.1	-106.1	-72.7	0	0	0	108
497	G	26.6	Very low	32.4	Very low	70 Å²	70	126.4 Å²	126.4	72%	0.722	79%	0.786	S	S	*	*				98.7	141.8	85.8	0	0	0	0	0	111.2
498	D	29.3	Very low	32.7	Very low	160 Å²	160	123.1 Å²	123.1	86%	0.856	79%	0.786	S	S	*	*			cis	-158.6	166	-0.9	-170.5	23.2	0	0	0	112.1
499	G	29	Very low	33.7	Very low	50 Å²	50	124.3 Å²	124.3	52%	0.515	79%	0.786	S	S	.	*			trans	44.9	139.3	141.5	0	0	0	0	0	122.5
500	Y	36.5	Very low	34.1	Very low	230 Å²	230	127.7 Å²	127.7	90%	0.902	78%	0.782	S	S	*	*			cis	-146.3	168	15.5	-54.5	-102	0	0	0	109.9
501	G	31.5	Very low	34.4	Very low	64 Å²	64	132.9 Å²	132.9	66%	0.66	78%	0.783	S	S	*	*			cis	129.6	91.6	-10.6	0	0	0	0	0	116
502	F	27.2	Very low	34.6	Very low	221 Å²	221	135.6 Å²	135.6	97%	0.969	78%	0.776	S	S	*	*			trans	-155.1	152.1	155.5	-118.4	-80.2	0	0	0	112
503	R	30.5	Very low	34.7	Very low	204 Å²	204	136.3 Å²	136.3	77%	0.77	78%	0.775	S	S	*	*			trans	-164.2	175.5	-165.6	-153.9	-169.8	-174.3	-82.1	5.4	112.4
504	L	37.3	Very low	34.9	Very low	131 Å²	131	139.8 Å²	139.8	69%	0.686	78%	0.776	S	S	*	*			trans	79.8	163.9	154.9	-68.7	155.7	0	0	0	118
505	P	55.5	Low	34.5	Very low	110 Å²	110	140.3 Å²	140.3	71%	0.714	78%	0.776	S	S	*	*			cis	-129.8	-153.1	-26.4	35.6	-14.1	0	0	0	110.4
506	P	51	Low	34.3	Very low	120 Å²	120	138.2 Å²	138.2	78%	0.779	78%	0.779	S	S	*	*			cis	-133.7	-169.6	-6.5	43	-24.1	0	0	0	116.3
507	S	30.1	Very low	34.4	Very low	115 Å²	115	132.6 Å²	132.6	80%	0.804	78%	0.776	S	S	*	*			trans	-136.8	154.8	179.7	-48.7	0	0	0	0	112.4
508	S	32.4	Very low	36.3	Very low	120 Å²	120	135 Å²	135	84%	0.839	78%	0.779	S	S	*	*			trans	68.6	167.3	168.1	-103.2	0	0	0	0	116.1
509	P	48.8	Very low	37.6	Very low	122 Å²	122	133.4 Å²	133.4	79%	0.792	78%	0.778	S	S	*	*			cis	-139.4	-168.4	30.4	43.9	-24.5	0	0	0	117.6
510	Q	34.7	Very low	37.6	Very low	183 Å²	183	135.1 Å²	135.1	86%	0.855	80%	0.795	S	S	*	*			trans	-111.6	147.2	167.5	-62.7	175.9	-30.9	0	0	111.2
511	K	34.2	Very low	37.3	Very low	185 Å²	185	127.8 Å²	127.8	80%	0.804	79%	0.789	S	S	*	*			trans	169.1	133.2	130.2	-98.7	-165.6	165.8	-167.1	0	116.9
512	L	31.2	Very low	38.1	Very low	146 Å²	146	130.8 Å²	130.8	76%	0.764	80%	0.797	S	S	*	*			trans	67.6	135.1	135.5	-62.9	-179.1	0	0	0	125.9
513	A	29	Very low	39.4	Very low	93 Å²	93	125.7 Å²	125.7	77%	0.769	79%	0.786	S	S	*	*			trans	77.1	133.9	133.9	0	0	0	0	0	120.3
514	D	30.4	Very low	40.4	Very low	148 Å²	148	121.5 Å²	121.5	79%	0.791	79%	0.786	S	S	*	*			cis	-174.6	163.3	10.4	-150.5	-10.3	0	0	0	112.8
515	V	34.1	Very low	41.1	Very low	125 Å²	125	120 Å²	120	76%	0.758	78%	0.783	S	S	*	*			trans	57.8	146.5	147	144.4	0	0	0	0	127
516	A	26.5	Very low	39.9	Very low	93 Å²	93	123.7 Å²	123.7	77%	0.769	79%	0.791	S	S	*	*			trans	86	143.1	161	0	0	0	0	0	120.4
517	A	36	Very low	38.7	Very low	94 Å²	94	123.3 Å²	123.3	78%	0.777	79%	0.791	S	S	*	*			cis	-165	159.7	-21.2	0	0	0	0	0	111.5
518	P	66.3	Low	39.4	Very low	120 Å²	120	122.9 Å²	122.9	78%	0.779	79%	0.785	S	S	*	*			trans	-102.8	-168.2	-173.1	41.7	-36.7	0	0	0	114.5
519	P	56.5	Low	39.1	Very low	128 Å²	128	127.7 Å²	127.7	83%	0.831	79%	0.787	S	S	*	*				-153.3	158.5	96.1	39.4	-21.3	0	0	0	119.5
520	G	30.1	Very low	38.1	Very low	85 Å²	85	127 Å²	127	88%	0.876	79%	0.785	S	S	*	*			trans	95.1	135.6	157.9	0	0	0	0	0	117.7
521	G	30.7	Very low	37.7	Very low	76 Å²	76	121.8 Å²	121.8	78%	0.784	78%	0.78	S	S	*	*			cis	127.5	150.3	-9.1	0	0	0	0	0	114.3
522	P	47	Very low	38.8	Very low	128 Å²	128	118.7 Å²	118.7	83%	0.831	78%	0.779	S	S	*	*			cis	-133.5	-144.5	-6.5	48.8	-28.8	0	0	0	112.5
523	P	54.3	Low	39.3	Very low	114 Å²	114	117.9 Å²	117.9	74%	0.74	78%	0.782	S	S	*	*				-138.7	-135.6	-128.8	38.1	-9.5	0	0	0	115.6
524	P	52.8	Low	39.4	Very low	116 Å²	116	118.9 Å²	118.9	75%	0.753	78%	0.784	S	S	*	*				-116.8	-117	-69.8	27.8	-6.1	0	0	0	117.1
525	P	51.4	Low	39.4	Very low	98 Å²	98	124 Å²	124	64%	0.636	79%	0.792	S	S	*	*				-123.8	-175.4	-99.8	34.1	-15	0	0	0	118.6
526	H	30.6	Very low	39.1	Very low	188 Å²	188	121.3 Å²	121.3	87%	0.87	79%	0.79	S	S	*	*			trans	115.8	162.5	161.4	-67.7	-82.2	0	0	0	118.5
527	S	26.1	Very low	39.2	Very low	113 Å²	113	122.8 Å²	122.8	79%	0.79	80%	0.795	S	S	*	*			trans	-97.3	-176.8	-177.5	-147.1	0	0	0	0	110.6
528	P	44.5	Very low	39.4	Very low	105 Å²	105	123.6 Å²	123.6	68%	0.682	79%	0.792	S	S	*	*			cis	-141	-174.3	-5.2	43.6	-24.7	0	0	0	116.3
529	Y	26.1	Very low	37.5	Very low	221 Å²	221	123.7 Å²	123.7	87%	0.867	79%	0.79	S	S	*	*			trans	63.2	161.9	140.6	-113	-112.4	0	0	0	125.2
530	S	27.1	Very low	36.4	Very low	109 Å²	109	127.8 Å²	127.8	76%	0.762	79%	0.789	S	S	*	*			trans	81.6	104.5	152.6	-64.6	0	0	0	0	123.3
531	G	26.3	Very low	36.4	Very low	73 Å²	73	131.6 Å²	131.6	75%	0.753	78%	0.784	S	S	*	*				97.7	146.8	109	0	0	0	0	0	120.7
532	P	57.7	Low	36.4	Very low	120 Å²	120	132.6 Å²	132.6	78%	0.779	78%	0.779	S	S	*	*			trans	-87.9	179.5	167.6	39	-36.1	0	0	0	111.8
533	P	42.6	Very low	35.4	Very low	128 Å²	128	135.6 Å²	135.6	83%	0.831	78%	0.779	S	S	*	*				-148.7	159.2	105.6	38.8	-23.6	0	0	0	117.7
534	S	30.3	Very low	34.2	Very low	114 Å²	114	141.5 Å²	141.5	80%	0.797	79%	0.787	S	S	*	*			trans	-61.4	143.4	175.4	-41.5	0	0	0	0	116.5
535	R	30.6	Very low	33.2	Very low	255 Å²	255	144.2 Å²	144.2	96%	0.962	79%	0.787	S	S	*	*			trans	-144.5	140.9	137.3	-75.3	-170.2	173.8	-176.8	-2.1	108
536	G	28	Very low	32.1	Very low	70 Å²	70	146.3 Å²	146.3	72%	0.722	79%	0.792	S	S	*	*			cis	165.3	113.9	-6.8	0	0	0	0	0	110.1
537	S	28.3	Very low	32.1	Very low	124 Å²	124	143.2 Å²	143.2	87%	0.867	79%	0.792	S	S	*	*			trans	-60.4	147.2	173.7	-48.2	0	0	0	0	110.4
538	P	40.6	Very low	32.2	Very low	110 Å²	110	141.4 Å²	141.4	71%	0.714	79%	0.791	S	S	*	*				-150.1	149.2	85.6	40	-22.9	0	0	0	116.8
539	V	26.3	Very low	31.4	Very low	122 Å²	122	141.7 Å²	141.7	74%	0.739	80%	0.796	S	S	*	*				56.5	122.8	128.2	179.7	0	0	0	0	117.7
540	R	32.2	Very low	31.5	Very low	214 Å²	214	134.5 Å²	134.5	81%	0.808	78%	0.778	S	S	*	*			cis	-162.9	176.3	42.2	-142.3	153	-151	-95.6	1.5	114.1
541	Q	32	Very low	31.6	Very low	165 Å²	165	132 Å²	132	77%	0.771	76%	0.761	S	S	*	*			trans	79.9	109.9	157.5	-82.2	165.9	-41.7	0	0	120.8
542	S	29.5	Very low	32.5	Very low	97 Å²	97	134.1 Å²	134.1	68%	0.678	76%	0.758	S	S	*	*			trans	43.8	107.4	145.5	46.3	0	0	0	0	119.4
543	F	25.8	Very low	31.1	Very low	192 Å²	192	136.6 Å²	136.6	84%	0.842	76%	0.757	S	S	*	*				55.1	130.9	63.9	-63.3	-71.5	0	0	0	113.9
544	R	30.2	Very low	30.4	Very low	238 Å²	238	134.9 Å²	134.9	90%	0.898	75%	0.754	S	S	*	*			cis	-132.2	145.7	10.6	-49.2	167	-171.9	-114.2	2.2	107.9
545	K	30.5	Very low	30.2	Very low	173 Å²	173	138 Å²	138	75%	0.752	76%	0.756	S	S	*	*			cis	83.5	126.9	24.2	-164.2	161.1	-175.4	170.4	0	117
546	D	29.6	Very low	30	Very low	141 Å²	141	130.1 Å²	130.1	75%	0.754	74%	0.74	S	S	*	*			trans	-93.9	-169.7	-165.8	-37.1	-109.7	0	0	0	115.3
547	S	30.1	Very low	30.3	Very low	123 Å²	123	132.4 Å²	132.4	86%	0.86	74%	0.742	S	S	*	*			trans	80.8	152.3	167.7	-51.4	0	0	0	0	116.4
548	G	27.9	Very low	30.2	Very low	75 Å²	75	130.6 Å²	130.6	77%	0.773	74%	0.743	S	S	*	*			cis	-168.4	-157.4	5.2	0	0	0	0	0	113.9
549	S	28.5	Very low	29.5	Very low	111 Å²	111	128.5 Å²	128.5	78%	0.776	74%	0.741	S	S	*	*			trans	-81.2	168.3	-162.1	-44.2	0	0	0	0	117.7
550	S	27.7	Very low	29.6	Very low	70 Å²	70	128.8 Å²	128.8	49%	0.49	73%	0.733	S	S	.	*			trans	81.7	127.8	134.9	65.3	0	0	0	0	123.5
551	S	29.5	Very low	29.3	Very low	58 Å²	58	122.4 Å²	122.4	41%	0.406	72%	0.717	S	S	.	*			trans	75.4	174.3	146.6	-107	0	0	0	0	121.1	S18	S18-S551 WeakPolarHBondContact O-CB 3.47Å; S18-S551 PolarHBondContact O-OG 3.24Å
552	V	45.6	Very low	29.2	Very low	116 Å²	116	121.6 Å²	121.6	70%	0.703	71%	0.707	S	S	*	*			trans	-129.2	158.1	-142.5	-151	0	0	0	0	115.2
553	F	28	Very low	29.2	Very low	173 Å²	173	122.3 Å²	122.3	76%	0.759	71%	0.712	S	S	*	*			trans	100.3	154.2	158.8	-83.9	-76.9	0	0	0	120.9
554	A	26.4	Very low	29.5	Very low	92 Å²	92	117.9 Å²	117.9	76%	0.76	71%	0.711	S	S	*	*			trans	77.9	79	163.5	0	0	0	0	0	119.5
555	E	26.3	Very low	29.4	Very low	178 Å²	178	109.6 Å²	109.6	83%	0.832	70%	0.7	S	S	*	*			trans	6.3	156.3	132.2	-154.7	-177.3	114.2	0	0	122.2
556	S	27.4	Very low	29.3	Very low	91 Å²	91	107.3 Å²	107.3	64%	0.636	71%	0.706	S	S	*	*			trans	87.2	151.9	155.8	-91.2	0	0	0	0	118.5
557	P	33.9	Very low	29.2	Very low	117 Å²	117	105.4 Å²	105.4	76%	0.76	71%	0.709	S	S	*	*			cis	-140.5	150.7	-45.4	34.4	-17.1	0	0	0	115
558	G	26	Very low	29.1	Very low	86 Å²	86	105 Å²	105	89%	0.887	71%	0.706	S	S	*	*			trans	81.8	137.9	156.7	0	0	0	0	0	116.5
559	G	27.1	Very low	29	Very low	66 Å²	66	108.5 Å²	108.5	68%	0.68	71%	0.713	S	S	*	*			cis	148.3	167.3	-6.8	0	0	0	0	0	112.5
560	K	26.7	Very low	28.7	Very low	129 Å²	129	108.4 Å²	108.4	56%	0.561	72%	0.719	S	S	*	*			trans	67.5	141.3	176.6	-51.3	165.5	179.1	-175.8	0	113.2	I635 E636	K560-I635 HydrophobicContact CB-CD1 4.29Å; K560-I635 HydrophobicContact CB-CG1 3.79Å; K560-I635 HydrophobicContact CD-CD1 3.93Å; K560-I635 HydrophobicContact CD-CG1 3.91Å; K560-I635 HydrophobicContact CG-CG1 4.29Å; K560-E636 HydrophobicContact CD-CG 4.47Å; K560-E636 VanDerWaalsContact CE-CD 3.49Å; K560-E636 WeakPolarHBondContact CE-OE1 3.28Å; K560-E636 WeakPolarHBondContact CE-OE2 3.45Å; K560-E636 IonicContact NZ-OE1 2.81Å; K560-E636 PolarHBondContact NZ-OE1 2.82Å; K560-E636 IonicContact NZ-OE2 3.94Å; K560-E636 PolarHBondContact NZ-OE2 2.85Å
561	T	26.4	Very low	28.5	Very low	79 Å²	79	108.9 Å²	108.9	49%	0.485	74%	0.735	S	S	.	*			cis	174.2	164.8	-12.6	37.8	0	0	0	0	104.4	I635	T561-I635 VanDerWaalsContact OG1-CA 3.24Å; T561-I635 WeakPolarHBondContact OG1-CA 3.43Å; T561-I635 WeakPolarHBondContact OG1-CG1 3.28Å; T561-I635 PolarHBondContact OG1-N 2.68Å
562	R	30.6	Very low	28.7	Very low	148 Å²	148	110.6 Å²	110.6	56%	0.558	75%	0.753	S	S	*	*			cis	-137.4	147.7	22.5	-85	-172.6	174	151.7	-8.4	107.9	E633 K634 I635	R562-E633 PolarHBondContact NH1-O 3.37Å; R562-K634 VanDerWaalsContact NE-C 3.29Å; R562-K634 PolarHBondContact NE-O 3.04Å; R562-K634 PolarHBondContact NH1-O 3.32Å; R562-K634 VanDerWaalsContact NH1-O 3.12Å; R562-K634 PolarHBondContact NH2-O 3.02Å; R562-I635 PolarHBondContact NH2-O 2.96Å
563	S	29.5	Very low	29.3	Very low	113 Å²	113	110.9 Å²	110.9	79%	0.79	76%	0.757	S	S	*	*				62.5	146.8	94.8	-36.2	0	0	0	0	114.3
564	A	31	Very low	29.8	Very low	98 Å²	98	108 Å²	108	81%	0.81	76%	0.756	S	S	*	*			cis	-130.3	168.5	16.1	0	0	0	0	0	112.8
565	G	28.5	Very low	29.6	Very low	65 Å²	65	108.1 Å²	108.1	67%	0.67	75%	0.751	S	S	*	*			cis	115.6	87	-3.2	0	0	0	0	0	114.6
566	S	28	Very low	29.5	Very low	125 Å²	125	107.9 Å²	107.9	87%	0.874	75%	0.75	S	S	*	*			trans	-157.3	78.9	159.2	-78.6	0	0	0	0	106
567	A	27.9	Very low	29.4	Very low	100 Å²	100	111 Å²	111	83%	0.826	76%	0.759	S	S	*	*				75.1	126.3	58.8	0	0	0	0	0	112.6
568	S	28.8	Very low	29.5	Very low	114 Å²	114	114.9 Å²	114.9	80%	0.797	76%	0.764	S	S	*	*			trans	-77.2	151.6	179.6	-27.5	0	0	0	0	111.9
569	T	25.1	Very low	29.9	Very low	150 Å²	150	116.6 Å²	116.6	92%	0.92	76%	0.759	S	S	*	*			trans	-160.7	162.6	135.6	15.7	0	0	0	0	111
570	A	23.4	Very low	30.2	Very low	108 Å²	108	116.5 Å²	116.5	89%	0.893	76%	0.758	S	S	*	*			trans	-84.9	157.9	178.1	0	0	0	0	0	112.2
571	G	22	Very low	30.9	Very low	81 Å²	81	116.7 Å²	116.7	84%	0.835	77%	0.773	S	S	*	*			trans	-172.3	93.8	176	0	0	0	0	0	113.2
572	A	35.3	Very low	31	Very low	94 Å²	94	116.5 Å²	116.5	78%	0.777	79%	0.786	S	S	*	*			trans	-150.9	166.1	168	0	0	0	0	0	109
573	P	57.7	Low	30.8	Very low	121 Å²	121	116.1 Å²	116.1	79%	0.786	79%	0.791	S	S	*	*			cis	-83	-114.5	-21.6	38	-29.9	0	0	0	107.1
574	P	38	Very low	30.8	Very low	113 Å²	113	120.5 Å²	120.5	73%	0.734	79%	0.79	S	S	*	*			cis	-101	-160.1	-13.8	47.3	-36.7	0	0	0	110
575	S	23.2	Very low	30.6	Very low	95 Å²	95	120.8 Å²	120.8	66%	0.664	79%	0.786	S	S	*	*			cis	-145.4	173.1	0.7	-79.1	0	0	0	0	109.5
576	E	24.3	Very low	30.5	Very low	173 Å²	173	124.8 Å²	124.8	81%	0.808	79%	0.792	S	S	*	*			trans	74.5	108.5	160.2	-46.4	-145.3	158.8	0	0	115.6
577	L	25.1	Very low	30.5	Very low	157 Å²	157	124.4 Å²	124.4	82%	0.822	78%	0.784	S	S	*	*				81.1	119	71.1	-77.2	159	0	0	0	113.4
578	F	35.4	Very low	30.4	Very low	198 Å²	198	123.2 Å²	123.2	87%	0.868	78%	0.782	S	S	*	*			trans	-54.6	148.2	153.1	-78.3	-90.6	0	0	0	109.5
579	P	34.3	Very low	30.4	Very low	121 Å²	121	127.4 Å²	127.4	79%	0.786	79%	0.786	S	S	*	*			cis	-141.4	-171.8	45.3	38.5	-18.2	0	0	0	116
580	G	32.3	Very low	30.6	Very low	64 Å²	64	123.9 Å²	123.9	66%	0.66	78%	0.779	S	S	*	*			trans	-82.2	-150.3	158.7	0	0	0	0	0	111.7
581	P	42.5	Very low	31.1	Very low	133 Å²	133	124.3 Å²	124.3	86%	0.864	77%	0.773	S	S	*	*			cis	-137.7	172.7	9.1	42.5	-25.8	0	0	0	116.6
582	G	28	Very low	32	Very low	75 Å²	75	126.2 Å²	126.2	77%	0.773	77%	0.77	S	S	*	*			trans	81.8	164.1	159.5	0	0	0	0	0	117.2
583	E	27.8	Very low	32.1	Very low	140 Å²	140	127.5 Å²	127.5	65%	0.654	77%	0.768	S	S	*	*			cis	-163.2	130.4	-17.6	-137.7	-147.1	-154.9	0	0	111.4
584	R	29.3	Very low	31.3	Very low	205 Å²	205	127.2 Å²	127.2	77%	0.774	77%	0.767	S	S	*	*			trans	59.3	152.9	161.7	-60.1	179.6	171.8	120.1	1.4	117
585	S	25.8	Very low	31.8	Very low	104 Å²	104	126.9 Å²	126.9	73%	0.727	77%	0.774	S	S	*	*			cis	-135.3	-170.8	1	-54.8	0	0	0	0	108.4
586	L	26.9	Very low	33.1	Very low	149 Å²	149	130.2 Å²	130.2	78%	0.78	78%	0.776	S	S	*	*			cis	-158.2	138.4	12.3	-152.9	137.3	0	0	0	111.1
587	V	26.8	Very low	34.5	Very low	117 Å²	117	126.7 Å²	126.7	71%	0.709	76%	0.763	S	S	*	*			trans	16.8	124.4	165.1	-170.1	0	0	0	0	121	F589	V587-F589 HydrophobicContact CG1-CD2 4Å; V587-F589 HydrophobicContact CG1-CE2 4.14Å
588	G	26.8	Very low	36.3	Very low	76 Å²	76	124.4 Å²	124.4	78%	0.784	76%	0.756	S	S	*	*			trans	-159.3	118.4	153.7	0	0	0	0	0	110.8
589	F	28.4	Very low	37.7	Very low	201 Å²	201	120 Å²	120	88%	0.882	74%	0.738	S	S	*	*			trans	-88.2	143	-171.6	-90.3	-101.6	0	0	0	113.6	V587	V587-F589 HydrophobicContact CG1-CD2 4Å; V587-F589 HydrophobicContact CG1-CE2 4.14Å
590	G	29	Very low	39.2	Very low	76 Å²	76	117.4 Å²	117.4	78%	0.784	72%	0.72	S	S	*	*			trans	179.1	108.5	166.4	0	0	0	0	0	115.4
591	P	33.6	Very low	41.4	Very low	117 Å²	117	122.7 Å²	122.7	76%	0.76	72%	0.72	S	S	*	*			trans	-121.3	164.6	167.2	39.6	-29.1	0	0	0	112.9
592	P	41.5	Very low	42.9	Very low	121 Å²	121	122.7 Å²	122.7	79%	0.786	71%	0.708	S	S	*	*			cis	-123.4	148	-46.4	36.6	-24.3	0	0	0	111.5
593	V	38	Very low	45.4	Very low	121 Å²	121	126.5 Å²	126.5	73%	0.733	70%	0.699	S	S	*	*			trans	-95.6	131.5	178.2	-179.7	0	0	0	0	110.8
594	P	41	Very low	47.8	Very low	115 Å²	115	125.4 Å²	125.4	75%	0.747	70%	0.696	S	S	*	*			trans	-72.4	130.1	171.8	29.8	-33.5	0	0	0	110.9	K596	P594-K596 PolarHBondContact O-N 3.29Å
595	A	48.1	Very low	50.2	Low	107 Å²	107	119.2 Å²	119.2	88%	0.884	68%	0.675	S	S	*	*	S	Bend	trans	-71.4	109.7	-167.6	0	0	0	0	0	114.2
596	K	50.6	Low	52.7	Low	164 Å²	164	116.8 Å²	116.8	71%	0.713	66%	0.662	S	S	*	*			trans	-145.7	26.3	160	-148.2	-172.2	176.1	-173.7	0	114.2	P594	P594-K596 PolarHBondContact O-N 3.29Å
597	D	53.7	Low	55.5	Low	100 Å²	100	115 Å²	115	54%	0.535	65%	0.651	S	S	.	*			trans	-93.6	-9.6	-173.3	-83.5	-51	0	0	0	116.1	T600 R601	D597-T600 PolarHBondContact O-N 3.28Å; D597-R601 WeakPolarHBondContact O-CB 3.35Å; D597-R601 PolarHBondContact O-N 3.34Å
598	T	63.4	Low	58.1	Low	109 Å²	109	115.6 Å²	115.6	67%	0.669	65%	0.646	S	S	*	*	H	α-helix	trans	-63.2	-52.3	-174.9	41	0	0	0	0	113.1	T600 R601 E602	T598-T600 VanDerWaalsContact C-N 3.29Å; T598-T600 PolarHBondContact O-N 3.33Å; T598-R601 PolarHBondContact O-N 3.17Å; T598-E602 WeakPolarHBondContact O-CB 3.31Å; T598-E602 WeakPolarHBondContact O-CG 3.24Å; T598-E602 PolarHBondContact O-N 3.16Å
599	E	64.9	Low	60.6	Low	104 Å²	104	118 Å²	118	49%	0.486	64%	0.635	S	S	.	*	H	α-helix	trans	-64.3	-34.7	178.4	-166.2	-171	156.3	0	0	112	R603	E599-R603 PolarHBondContact O-N 2.84Å; E599-R603 IonicContact OE1-CZ 3.14Å; E599-R603 IonicContact OE1-NH1 2.72Å; E599-R603 PolarHBondContact OE1-NH1 2.98Å; E599-R603 IonicContact OE1-NH2 2.71Å; E599-R603 PolarHBondContact OE1-NH2 3.26Å
600	T	65.8	Low	63.4	Low	68 Å²	68	114.8 Å²	114.8	42%	0.417	62%	0.622	S	S	.	*	H	α-helix	trans	-68.4	-43.1	177.1	-41.6	0	0	0	0	111.2	D597 T598 R603 M604	D597-T600 PolarHBondContact O-N 3.28Å; T598-T600 VanDerWaalsContact C-N 3.29Å; T598-T600 PolarHBondContact O-N 3.33Å; T600-R603 PolarHBondContact O-N 3.31Å; T600-M604 HydrophobicContact CG2-CE 4.03Å; T600-M604 PolarHBondContact O-N 3.28Å
601	R	77.3	Confident	66	Low	174 Å²	174	116 Å²	116	66%	0.657	61%	0.61	S	S	*	*	H	α-helix	trans	-65.2	-45.2	175.4	-174.6	-177.4	-175.5	102.9	4.6	111.2	D597 T598 R603 M604 E605	D597-R601 WeakPolarHBondContact O-CB 3.35Å; D597-R601 PolarHBondContact O-N 3.34Å; T598-R601 PolarHBondContact O-N 3.17Å; R601-R603 VanDerWaalsContact C-N 3.35Å; R601-R603 PolarHBondContact O-N 2.92Å; R601-M604 PolarHBondContact O-N 2.88Å; R601-E605 VanDerWaalsContact O-CB 3.3Å; R601-E605 WeakPolarHBondContact O-CB 3.45Å; R601-E605 PolarHBondContact O-N 3.4Å
602	E	75.3	Confident	67.9	Low	133 Å²	133	113.3 Å²	113.3	62%	0.621	60%	0.597	S	S	*	*	H	α-helix	trans	-63.6	-38.2	177.2	-74.6	176.4	-178.7	0	0	112	T598 A606	T598-E602 WeakPolarHBondContact O-CB 3.31Å; T598-E602 WeakPolarHBondContact O-CG 3.24Å; T598-E602 PolarHBondContact O-N 3.16Å; E602-A606 VanDerWaalsContact O-CB 3.27Å; E602-A606 WeakPolarHBondContact O-CB 3.44Å; E602-A606 PolarHBondContact O-N 3.23Å
603	R	79.8	Confident	69.6	Low	156 Å²	156	110.9 Å²	110.9	59%	0.589	58%	0.584	S	S	*	*	H	α-helix	trans	-65.5	-41.3	170.9	-79.4	-159.1	-176.8	88.1	9.7	113	E599 T600 R601 M607	E599-R603 PolarHBondContact O-N 2.84Å; E599-R603 IonicContact OE1-CZ 3.14Å; E599-R603 IonicContact OE1-NH1 2.72Å; E599-R603 PolarHBondContact OE1-NH1 2.98Å; E599-R603 IonicContact OE1-NH2 2.71Å; E599-R603 PolarHBondContact OE1-NH2 3.26Å; T600-R603 PolarHBondContact O-N 3.31Å; R601-R603 VanDerWaalsContact C-N 3.35Å; R601-R603 PolarHBondContact O-N 2.92Å; R603-M607 WeakPolarHBondContact O-CB 3.2Å; R603-M607 PolarHBondContact O-N 2.84Å; R603-M607 VanDerWaalsContact O-N 3.1Å
604	M	77.4	Confident	71.7	Confident	117 Å²	117	110.4 Å²	110.4	58%	0.576	58%	0.576	S	S	*	*	H	α-helix	trans	-64.2	-46.4	174.9	-103.1	-176.4	-75.2	0	0	111.5	T600 R601 A606 M607 E608	T600-M604 HydrophobicContact CG2-CE 4.03Å; T600-M604 PolarHBondContact O-N 3.28Å; R601-M604 PolarHBondContact O-N 2.88Å; M604-A606 VanDerWaalsContact C-N 3.33Å; M604-A606 PolarHBondContact O-N 3.48Å; M604-M607 CarbonylContact O-C 3.58Å; M604-M607 WeakPolarHBondContact O-CB 3.45Å; M604-M607 PolarHBondContact O-N 2.87Å; M604-M607 VanDerWaalsContact O-N 3.1Å; M604-E608 VanDerWaalsContact O-CB 3.31Å; M604-E608 WeakPolarHBondContact O-CB 3.43Å; M604-E608 PolarHBondContact O-N 3.3Å
605	E	79.6	Confident	73.2	Confident	74 Å²	74	108 Å²	108	35%	0.346	56%	0.56	S	S	.	*	H	α-helix	trans	-65.4	-35.3	-179.7	-165.7	-176.7	130.4	0	0	111.7	R601 K609	R601-E605 VanDerWaalsContact O-CB 3.3Å; R601-E605 WeakPolarHBondContact O-CB 3.45Å; R601-E605 PolarHBondContact O-N 3.4Å; E605-K609 HydrophobicContact CG-CD 4.29Å; E605-K609 VanDerWaalsContact O-CB 3.25Å; E605-K609 WeakPolarHBondContact O-CB 3.46Å; E605-K609 WeakPolarHBondContact O-CD 3.22Å; E605-K609 WeakPolarHBondContact O-CG 3.37Å; E605-K609 PolarHBondContact O-N 2.64Å; E605-K609 WeakPolarHBondContact OE1-CE 3.49Å; E605-K609 IonicContact OE1-NZ 2.7Å; E605-K609 PolarHBondContact OE1-NZ 3.39Å
606	A	79.2	Confident	74.4	Confident	53 Å²	53	104.6 Å²	104.6	44%	0.438	54%	0.535	S	S	.	.	H	α-helix	trans	-65.2	-40	171.3	0	0	0	0	0	112.4	E602 M604 Q610	E602-A606 VanDerWaalsContact O-CB 3.27Å; E602-A606 WeakPolarHBondContact O-CB 3.44Å; E602-A606 PolarHBondContact O-N 3.23Å; M604-A606 VanDerWaalsContact C-N 3.33Å; M604-A606 PolarHBondContact O-N 3.48Å; A606-Q610 WeakPolarHBondContact O-CG 3.47Å; A606-Q610 PolarHBondContact O-N 2.93Å
607	M	85.3	Confident	75.6	Confident	111 Å²	111	102.1 Å²	102.1	55%	0.547	53%	0.529	S	S	.	.	H	α-helix	trans	-71.4	-41	177.2	-162.5	-174	-50.2	0	0	111.8	R603 M604 Q610 I611	R603-M607 WeakPolarHBondContact O-CB 3.2Å; R603-M607 PolarHBondContact O-N 2.84Å; R603-M607 VanDerWaalsContact O-N 3.1Å; M604-M607 CarbonylContact O-C 3.58Å; M604-M607 WeakPolarHBondContact O-CB 3.45Å; M604-M607 PolarHBondContact O-N 2.87Å; M604-M607 VanDerWaalsContact O-N 3.1Å; M607-Q610 WeakPolarHBondContact O-CB 3.49Å; M607-Q610 PolarHBondContact O-N 3.31Å; M607-Q610 VanDerWaalsContact O-N 3.15Å; M607-I611 HydrophobicContact CG-CD1 4.39Å; M607-I611 WeakPolarHBondContact O-CG1 3.2Å; M607-I611 PolarHBondContact O-N 2.67Å
608	E	82.4	Confident	76.5	Confident	131 Å²	131	101.4 Å²	101.4	61%	0.612	53%	0.528	S	S	*	.	H	α-helix	trans	-62.8	-41.2	174	-173.8	174.4	-163.2	0	0	110.9	M604 Q610 I611 A612	M604-E608 VanDerWaalsContact O-CB 3.31Å; M604-E608 WeakPolarHBondContact O-CB 3.43Å; M604-E608 PolarHBondContact O-N 3.3Å; E608-Q610 VanDerWaalsContact C-N 3.35Å; E608-Q610 PolarHBondContact O-N 2.89Å; E608-I611 PolarHBondContact O-N 3.12Å; E608-A612 VanDerWaalsContact O-CB 3.28Å; E608-A612 WeakPolarHBondContact O-CB 3.36Å; E608-A612 PolarHBondContact O-N 3.14Å
609	K	78.6	Confident	76.4	Confident	127 Å²	127	101.9 Å²	101.9	55%	0.552	52%	0.523	S	S	*	.	H	α-helix	trans	-63.6	-35.6	171.3	-77.1	166.3	176.9	169.2	0	112.8	E605 S613	E605-K609 HydrophobicContact CG-CD 4.29Å; E605-K609 VanDerWaalsContact O-CB 3.25Å; E605-K609 WeakPolarHBondContact O-CB 3.46Å; E605-K609 WeakPolarHBondContact O-CD 3.22Å; E605-K609 WeakPolarHBondContact O-CG 3.37Å; E605-K609 PolarHBondContact O-N 2.64Å; E605-K609 WeakPolarHBondContact OE1-CE 3.49Å; E605-K609 IonicContact OE1-NZ 2.7Å; E605-K609 PolarHBondContact OE1-NZ 3.39Å; K609-S613 WeakPolarHBondContact O-CB 3.46Å; K609-S613 PolarHBondContact O-N 3.03Å
610	Q	86.6	Confident	76	Confident	132 Å²	132	99.6 Å²	99.6	62%	0.617	52%	0.519	S	S	*	.	H	α-helix	trans	-66.8	-42.7	171.7	-76.3	-176.9	-22	0	0	112.1	A606 M607 E608 S613 L614	A606-Q610 WeakPolarHBondContact O-CG 3.47Å; A606-Q610 PolarHBondContact O-N 2.93Å; M607-Q610 WeakPolarHBondContact O-CB 3.49Å; M607-Q610 PolarHBondContact O-N 3.31Å; M607-Q610 VanDerWaalsContact O-N 3.15Å; E608-Q610 VanDerWaalsContact C-N 3.35Å; E608-Q610 PolarHBondContact O-N 2.89Å; Q610-S613 PolarHBondContact O-N 3.23Å; Q610-L614 WeakPolarHBondContact O-CB 3.36Å; Q610-L614 PolarHBondContact O-N 2.85Å
611	I	84.6	Confident	75.7	Confident	101 Å²	101	100.1 Å²	100.1	52%	0.518	53%	0.53	S	S	.	.	H	α-helix	trans	-66.4	-43.6	177.7	-67.7	164.3	0	0	0	111.2	M607 E608 L614 T615	M607-I611 HydrophobicContact CG-CD1 4.39Å; M607-I611 WeakPolarHBondContact O-CG1 3.2Å; M607-I611 PolarHBondContact O-N 2.67Å; E608-I611 PolarHBondContact O-N 3.12Å; I611-L614 PolarHBondContact O-N 3.14Å; I611-T615 WeakPolarHBondContact O-CB 3.45Å; I611-T615 PolarHBondContact O-N 3.42Å; I611-T615 PolarHBondContact O-OG1 3.37Å
612	A	72.6	Confident	74.9	Confident	61 Å²	61	98.4 Å²	98.4	50%	0.504	53%	0.533	S	S	.	.	H	α-helix	trans	-65.2	-39.7	175.9	0	0	0	0	0	111.9	E608 T615 G616	E608-A612 VanDerWaalsContact O-CB 3.28Å; E608-A612 WeakPolarHBondContact O-CB 3.36Å; E608-A612 PolarHBondContact O-N 3.14Å; A612-T615 PolarHBondContact O-N 2.71Å; A612-G616 PolarHBondContact O-N 3.43Å
613	S	77.6	Confident	74	Confident	71 Å²	71	99.3 Å²	99.3	50%	0.497	54%	0.541	S	S	.	.	H	α-helix	trans	-61.7	-46.5	173.3	-178	0	0	0	0	112	K609 Q610 T615 G616 L617	K609-S613 WeakPolarHBondContact O-CB 3.46Å; K609-S613 PolarHBondContact O-N 3.03Å; Q610-S613 PolarHBondContact O-N 3.23Å; S613-T615 VanDerWaalsContact C-N 3.33Å; S613-T615 PolarHBondContact O-N 2.91Å; S613-G616 PolarHBondContact O-N 3.41Å; S613-L617 WeakPolarHBondContact O-CB 3.29Å; S613-L617 WeakPolarHBondContact O-CG 3.45Å; S613-L617 PolarHBondContact O-N 3.43Å
614	L	81.6	Confident	72.4	Confident	110 Å²	110	102.3 Å²	102.3	58%	0.576	55%	0.553	S	S	*	*	H	α-helix	trans	-60.4	-41.1	173.3	-87.7	161.1	0	0	0	112.3	Q610 I611 L617 V618	Q610-L614 WeakPolarHBondContact O-CB 3.36Å; Q610-L614 PolarHBondContact O-N 2.85Å; I611-L614 PolarHBondContact O-N 3.14Å; L614-L617 PolarHBondContact O-N 2.95Å; L614-V618 WeakPolarHBondContact O-CG2 3.42Å; L614-V618 PolarHBondContact O-N 3.47Å
615	T	72.9	Confident	70.6	Confident	65 Å²	65	100.4 Å²	100.4	40%	0.399	56%	0.563	S	S	.	*	H	α-helix	trans	-68.8	-40	-179.9	-55.6	0	0	0	0	111.1	I611 A612 S613 V618 Q619	I611-T615 WeakPolarHBondContact O-CB 3.45Å; I611-T615 PolarHBondContact O-N 3.42Å; I611-T615 PolarHBondContact O-OG1 3.37Å; A612-T615 PolarHBondContact O-N 2.71Å; S613-T615 VanDerWaalsContact C-N 3.33Å; S613-T615 PolarHBondContact O-N 2.91Å; T615-V618 PolarHBondContact O-N 3.24Å; T615-Q619 WeakPolarHBondContact O-CB 3.42Å; T615-Q619 WeakPolarHBondContact O-CG 3.4Å; T615-Q619 PolarHBondContact O-N 2.95Å
616	G	73.6	Confident	68.4	Low	36 Å²	36	101.9 Å²	101.9	37%	0.371	58%	0.581	S	S	.	*	H	α-helix	trans	-65	-37.9	172.6	0	0	0	0	0	113.2	A612 S613 S620	A612-G616 PolarHBondContact O-N 3.43Å; S613-G616 PolarHBondContact O-N 3.41Å; G616-S620 VanDerWaalsContact O-CB 3.28Å; G616-S620 WeakPolarHBondContact O-CB 3.33Å; G616-S620 PolarHBondContact O-N 2.98Å; G616-S620 PolarHBondContact O-OG 2.89Å
617	L	76.1	Confident	66.1	Low	111 Å²	111	107.8 Å²	107.8	58%	0.581	60%	0.6	S	S	*	*	H	α-helix	trans	-65.5	-42.4	172.7	-78.9	165.1	0	0	0	112	S613 L614 S620 A621	S613-L617 WeakPolarHBondContact O-CB 3.29Å; S613-L617 WeakPolarHBondContact O-CG 3.45Å; S613-L617 PolarHBondContact O-N 3.43Å; L614-L617 PolarHBondContact O-N 2.95Å; L617-S620 PolarHBondContact O-OG 3.49Å; L617-A621 WeakPolarHBondContact O-CB 3.38Å; L617-A621 PolarHBondContact O-N 2.97Å
618	V	72.1	Confident	64.3	Low	86 Å²	86	107.3 Å²	107.3	52%	0.521	61%	0.605	S	S	.	*	H	α-helix	trans	-65.9	-44.7	176.2	169.7	0	0	0	0	111.4	L614 T615 A621 L622	L614-V618 WeakPolarHBondContact O-CG2 3.42Å; L614-V618 PolarHBondContact O-N 3.47Å; T615-V618 PolarHBondContact O-N 3.24Å; V618-A621 PolarHBondContact O-N 2.88Å; V618-L622 HydrophobicContact CG1-CD1 4.12Å; V618-L622 WeakPolarHBondContact O-CG 3.25Å; V618-L622 PolarHBondContact O-N 3.49Å; V618-L622 VanDerWaalsContact O-N 3.17Å
619	Q	62	Low	61.6	Low	118 Å²	118	109.8 Å²	109.8	55%	0.551	62%	0.617	S	S	*	*	H	α-helix	trans	-66	-40.7	177.7	-72.4	177.2	3	0	0	112.3	T615 L622 L623	T615-Q619 WeakPolarHBondContact O-CB 3.42Å; T615-Q619 WeakPolarHBondContact O-CG 3.4Å; T615-Q619 PolarHBondContact O-N 2.95Å; Q619-L622 PolarHBondContact O-N 2.91Å; Q619-L623 PolarHBondContact O-N 3.14Å
620	S	56.5	Low	59.5	Low	57 Å²	57	109.5 Å²	109.5	40%	0.399	63%	0.625	S	S	.	*	H	α-helix	trans	-73.8	-23.6	178.5	57.7	0	0	0	0	114	G616 L617	G616-S620 VanDerWaalsContact O-CB 3.28Å; G616-S620 WeakPolarHBondContact O-CB 3.33Å; G616-S620 PolarHBondContact O-N 2.98Å; G616-S620 PolarHBondContact O-OG 2.89Å; L617-S620 PolarHBondContact O-OG 3.49Å
621	A	59.5	Low	57.4	Low	79 Å²	79	108.5 Å²	108.5	65%	0.653	63%	0.63	S	S	*	*	H	α-helix	trans	-70.8	-35.5	167.6	0	0	0	0	0	112.6	L617 V618	L617-A621 WeakPolarHBondContact O-CB 3.38Å; L617-A621 PolarHBondContact O-N 2.97Å; V618-A621 PolarHBondContact O-N 2.88Å
622	L	58.9	Low	54.8	Low	137 Å²	137	109 Å²	109	72%	0.717	64%	0.643	S	S	*	*	H	α-helix	trans	-75.6	-25.4	179.3	-72.8	166.3	0	0	0	113.8	V618 Q619	V618-L622 HydrophobicContact CG1-CD1 4.12Å; V618-L622 WeakPolarHBondContact O-CG 3.25Å; V618-L622 PolarHBondContact O-N 3.49Å; V618-L622 VanDerWaalsContact O-N 3.17Å; Q619-L622 PolarHBondContact O-N 2.91Å
623	L	58	Low	52.8	Low	153 Å²	153	112.8 Å²	112.8	80%	0.801	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	8.1	-171.4	-104.2	69.5	0	0	0	116.1	Q619	Q619-L623 PolarHBondContact O-N 3.14Å
624	R	45.2	Very low	50.7	Low	219 Å²	219	114.8 Å²	114.8	83%	0.826	65%	0.65	S	S	*	*			trans	-139.8	35.9	-171.7	-142.7	-163.8	-55.7	-155.5	3.6	117.4
625	G	40.5	Very low	48.8	Very low	77 Å²	77	112 Å²	112	79%	0.794	64%	0.635	S	S	*	*			trans	-108.7	80.8	176.1	0	0	0	0	0	114.9
626	S	33.4	Very low	46.9	Very low	105 Å²	105	115.3 Å²	115.3	73%	0.734	65%	0.646	S	S	*	*			trans	-172	110.9	163.3	56.3	0	0	0	0	114.4
627	E	31.1	Very low	45	Very low	177 Å²	177	116.9 Å²	116.9	83%	0.827	66%	0.662	S	S	*	*			trans	54.9	160.2	141.7	-59	-60	89.8	0	0	122.6
628	P	45.7	Very low	43.3	Very low	101 Å²	101	116.5 Å²	116.5	66%	0.656	67%	0.668	S	S	*	*				-139.4	-167.4	-50.4	41.5	-24.4	0	0	0	114.8
629	E	27.5	Very low	41.5	Very low	183 Å²	183	120.1 Å²	120.1	86%	0.855	69%	0.685	S	S	*	*			trans	82.2	175.6	164.6	-83.1	-156.9	94.6	0	0	122.4
630	T	32.6	Very low	40.2	Very low	120 Å²	120	117.9 Å²	117.9	74%	0.736	69%	0.693	S	S	*	*			trans	-139	-173	-144.7	65.9	0	0	0	0	113.9
631	P	44.1	Very low	39	Very low	111 Å²	111	120.3 Å²	120.3	72%	0.721	72%	0.717	S	S	*	*				-128.1	-171.7	-59.9	35.5	-17	0	0	0	114.6
632	S	29.2	Very low	37.6	Very low	111 Å²	111	121.2 Å²	121.2	78%	0.776	73%	0.725	S	S	*	*			trans	102.9	136.5	150.3	-66.7	0	0	0	0	124.6
633	E	30.3	Very low	36.4	Very low	141 Å²	141	121 Å²	121	66%	0.659	73%	0.73	S	S	*	*			trans	79.3	110.8	142	-75.2	-153.7	123.4	0	0	127.2	R562	R562-E633 PolarHBondContact NH1-O 3.37Å
634	K	34.4	Very low	35.7	Very low	114 Å²	114	119 Å²	119	50%	0.496	73%	0.726	S	S	.	*				81	100.7	104.9	-156.7	164.3	173.5	-80.4	0	123.6	R562	R562-K634 VanDerWaalsContact NE-C 3.29Å; R562-K634 PolarHBondContact NE-O 3.04Å; R562-K634 PolarHBondContact NH1-O 3.32Å; R562-K634 VanDerWaalsContact NH1-O 3.12Å; R562-K634 PolarHBondContact NH2-O 3.02Å
635	I	40.6	Very low	34.9	Very low	51 Å²	51	113.9 Å²	113.9	26%	0.262	72%	0.723	S	S	.	*				95.1	137.5	128.3	-74.3	-179	0	0	0	123	K560 T561 R562	K560-I635 HydrophobicContact CB-CD1 4.29Å; K560-I635 HydrophobicContact CB-CG1 3.79Å; K560-I635 HydrophobicContact CD-CD1 3.93Å; K560-I635 HydrophobicContact CD-CG1 3.91Å; K560-I635 HydrophobicContact CG-CG1 4.29Å; T561-I635 VanDerWaalsContact OG1-CA 3.24Å; T561-I635 WeakPolarHBondContact OG1-CA 3.43Å; T561-I635 WeakPolarHBondContact OG1-CG1 3.28Å; T561-I635 PolarHBondContact OG1-N 2.68Å; R562-I635 PolarHBondContact NH2-O 2.96Å
636	E	33.2	Very low	34.5	Very low	135 Å²	135	114.7 Å²	114.7	63%	0.631	72%	0.723	S	S	*	*			trans	47.7	157	158.7	-79.5	160	134	0	0	122.5	K560	K560-E636 HydrophobicContact CD-CG 4.47Å; K560-E636 VanDerWaalsContact CE-CD 3.49Å; K560-E636 WeakPolarHBondContact CE-OE1 3.28Å; K560-E636 WeakPolarHBondContact CE-OE2 3.45Å; K560-E636 IonicContact NZ-OE1 2.81Å; K560-E636 PolarHBondContact NZ-OE1 2.82Å; K560-E636 IonicContact NZ-OE2 3.94Å; K560-E636 PolarHBondContact NZ-OE2 2.85Å
637	G	34.7	Very low	34.6	Very low	68 Å²	68	116 Å²	116	70%	0.701	73%	0.728	S	S	*	*			cis	166.3	168	-11.8	0	0	0	0	0	116.9
638	S	39.4	Very low	34.4	Very low	103 Å²	103	113.8 Å²	113.8	72%	0.72	73%	0.731	S	S	*	*			trans	74	107.5	147.5	-174.7	0	0	0	0	124.6
639	N	34.8	Very low	33.5	Very low	162 Å²	162	112.8 Å²	112.8	87%	0.866	74%	0.739	S	S	*	*				65.2	150.1	128.9	-55.3	-15.4	0	0	0	124.6
640	G	33.5	Very low	33.6	Very low	71 Å²	71	110.1 Å²	110.1	73%	0.732	74%	0.741	S	S	*	*			trans	107.6	122	171.7	0	0	0	0	0	112.7
641	A	32.1	Very low	33.5	Very low	108 Å²	108	108.3 Å²	108.3	89%	0.893	75%	0.745	S	S	*	*			cis	68.4	127	36.9	0	0	0	0	0	113.1
642	A	29.7	Very low	32.9	Very low	99 Å²	99	106.1 Å²	106.1	82%	0.818	74%	0.743	S	S	*	*			cis	-152.2	-174.5	8.5	0	0	0	0	0	113.9
643	T	34.3	Very low	33.2	Very low	133 Å²	133	112.2 Å²	112.2	82%	0.816	75%	0.749	S	S	*	*			trans	-62.9	170.1	163.6	41.3	0	0	0	0	112.1
644	P	43	Very low	33.3	Very low	111 Å²	111	110.5 Å²	110.5	72%	0.721	75%	0.753	S	S	*	*			cis	-150.3	176.7	30.2	44.8	-23.8	0	0	0	120.5
645	S	28.8	Very low	33.3	Very low	110 Å²	110	111.2 Å²	111.2	77%	0.769	77%	0.773	S	S	*	*			trans	54.5	117.4	146.2	-62	0	0	0	0	123.9
646	A	33	Very low	32.9	Very low	95 Å²	95	112.5 Å²	112.5	79%	0.785	80%	0.798	S	S	*	*			trans	48.8	134.7	132	0	0	0	0	0	121
647	P	34.4	Very low	32.9	Very low	131 Å²	131	110.5 Å²	110.5	85%	0.851	81%	0.805	S	S	*	*				-145.2	-157.5	74.9	40.9	-22.3	0	0	0	115.2
648	C	26.1	Very low	32.9	Very low	132 Å²	132	113.2 Å²	113.2	89%	0.892	81%	0.808	S	S	*	*			trans	-108	161.2	-164	-56.9	0	0	0	0	115.3
649	G	26.9	Very low	33.5	Very low	79 Å²	79	113.4 Å²	113.4	81%	0.814	81%	0.807	S	S	*	*			trans	89.2	163.4	166.6	0	0	0	0	0	114.8
650	S	31.2	Very low	33.4	Very low	128 Å²	128	112 Å²	112	90%	0.895	80%	0.804	S	S	*	*			cis	-159.5	162.4	-8.8	-174.7	0	0	0	0	109.2
651	G	30	Very low	33.6	Very low	81 Å²	81	113.7 Å²	113.7	84%	0.835	80%	0.804	S	S	*	*			trans	-141.5	97.4	174.1	0	0	0	0	0	111.7
652	G	32.2	Very low	33.8	Very low	66 Å²	66	112.2 Å²	112.2	68%	0.68	80%	0.799	S	S	*	*			trans	-169.6	78.4	-171.8	0	0	0	0	0	116.7
653	R	35.3	Very low	34.6	Very low	238 Å²	238	113.6 Å²	113.6	90%	0.898	80%	0.8	S	S	*	*			trans	81.9	149.2	163	-52.3	170.2	69.2	-138.3	3.4	118.7
654	S	32	Very low	35.1	Very low	106 Å²	106	112.9 Å²	112.9	74%	0.741	80%	0.798	S	S	*	*			trans	65.6	114.9	163.3	54.9	0	0	0	0	122
655	S	33.9	Very low	35.4	Very low	129 Å²	129	113.5 Å²	113.5	90%	0.902	80%	0.801	S	S	*	*			trans	72.3	124.1	134.5	-53.2	0	0	0	0	121.7
656	G	32	Very low	36.7	Very low	78 Å²	78	114.4 Å²	114.4	80%	0.804	81%	0.805	S	S	*	*			trans	138.8	97.2	147.9	0	0	0	0	0	118.8
657	A	33.4	Very low	37.1	Very low	92 Å²	92	115.8 Å²	115.8	76%	0.76	81%	0.809	S	S	*	*			trans	27	113.9	146	0	0	0	0	0	122.8
658	T	35	Very low	37.6	Very low	126 Å²	126	114.1 Å²	114.1	77%	0.773	81%	0.806	S	S	*	*				20.8	159.6	112.3	58.3	0	0	0	0	121.9
659	P	52.3	Low	38.1	Very low	107 Å²	107	113.1 Å²	113.1	70%	0.695	80%	0.801	S	S	*	*			cis	-146.7	-167.6	-33	41	-21.1	0	0	0	114.7
660	V	33.1	Very low	38.7	Very low	132 Å²	132	115 Å²	115	80%	0.8	80%	0.801	S	S	*	*			trans	69.7	155.6	146.4	153.4	0	0	0	0	119.7
661	S	36.6	Very low	39.4	Very low	107 Å²	107	115.2 Å²	115.2	75%	0.748	80%	0.797	S	S	*	*			cis	-169.9	147.5	-41.4	-78.5	0	0	0	0	111.2
662	G	36.1	Very low	40.7	Very low	76 Å²	76	116.8 Å²	116.8	78%	0.784	79%	0.793	S	S	*	*			trans	72.6	-176.9	162.2	0	0	0	0	0	117
663	P	46.4	Very low	41.3	Very low	128 Å²	128	118.6 Å²	118.6	83%	0.831	80%	0.802	S	S	*	*			cis	-120.4	-175	0.7	41.6	-26	0	0	0	114.5
664	P	46.4	Very low	41.7	Very low	119 Å²	119	110.7 Å²	110.7	77%	0.773	79%	0.794	S	S	*	*			trans	-100.8	-175.4	-166.2	42.1	-36.4	0	0	0	115.5
665	P	48.8	Very low	42.1	Very low	123 Å²	123	114.6 Å²	114.6	80%	0.799	80%	0.801	S	S	*	*			trans	-95.4	168.8	-153.5	38.3	-37.6	0	0	0	117.7
666	P	56.2	Low	43.1	Very low	129 Å²	129	114.3 Å²	114.3	84%	0.838	80%	0.795	S	S	*	*			trans	-101.8	174.4	-175.9	40.5	-36.9	0	0	0	115.8
667	S	41.7	Very low	44.3	Very low	124 Å²	124	117.1 Å²	117.1	87%	0.867	80%	0.797	S	S	*	*			trans	-124.7	143.4	-178.9	-68.8	0	0	0	0	115
668	A	43.9	Very low	45.5	Very low	97 Å²	97	117.5 Å²	117.5	80%	0.802	80%	0.801	S	S	*	*			trans	14.4	137.9	159.8	0	0	0	0	0	123.7
669	S	36.7	Very low	47.3	Very low	111 Å²	111	115.9 Å²	115.9	78%	0.776	79%	0.79	S	S	*	*				177.7	149.5	122.3	41.5	0	0	0	0	116.7
670	S	39.4	Very low	48.7	Very low	117 Å²	117	114.2 Å²	114.2	82%	0.818	78%	0.781	S	S	*	*			trans	64	144.5	152.6	45.3	0	0	0	0	124.4
671	T	47.1	Very low	51.1	Low	133 Å²	133	118 Å²	118	82%	0.816	78%	0.781	S	S	*	*			trans	-116	-167.9	171.3	53.5	0	0	0	0	108.9
672	P	56.8	Low	53.5	Low	114 Å²	114	118.6 Å²	118.6	74%	0.74	78%	0.775	S	S	*	*			cis	-143.8	177.2	3.5	44.4	-25.1	0	0	0	118.9
673	A	45.1	Very low	55.7	Low	105 Å²	105	121 Å²	121	87%	0.868	77%	0.766	S	S	*	*			trans	54.8	151.1	149.7	0	0	0	0	0	122.4
674	G	42.5	Very low	57.8	Low	72 Å²	72	119.7 Å²	119.7	74%	0.742	75%	0.75	S	S	*	*			cis	155	143.9	-10.9	0	0	0	0	0	114.2
675	Q	41.7	Very low	59.9	Low	188 Å²	188	119.9 Å²	119.9	88%	0.879	74%	0.741	S	S	*	*			trans	-170.1	153	160.5	-87.4	-129.3	3.4	0	0	111.3
676	P	53	Low	61.9	Low	122 Å²	122	120.3 Å²	120.3	79%	0.792	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-103.8	136.6	179.3	37	-30.5	0	0	0	114.7
677	T	57.2	Low	63.6	Low	137 Å²	137	120.9 Å²	120.9	84%	0.84	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-96	138.6	-179.8	-43.8	0	0	0	0	112.7
678	A	59.8	Low	66.1	Low	101 Å²	101	119.1 Å²	119.1	84%	0.835	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-74.5	131.9	175	0	0	0	0	0	112.5
679	V	72.2	Confident	68.4	Low	92 Å²	92	122.4 Å²	122.4	56%	0.558	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-84	134.1	-176.5	179	0	0	0	0	111.7	Q683	V679-Q683 HydrophobicContact CG1-CB 4.3Å; V679-Q683 HydrophobicContact CG1-CG 4.46Å
680	S	81.3	Confident	71.2	Confident	72 Å²	72	118.8 Å²	118.8	50%	0.503	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-71.1	141.6	179.9	-179.2	0	0	0	0	113.2	L682 Q683 M684	S680-L682 VanDerWaalsContact C-N 3.27Å; S680-L682 PolarHBondContact O-N 2.63Å; S680-Q683 WeakPolarHBondContact O-CB 3.41Å; S680-Q683 PolarHBondContact O-N 2.98Å; S680-M684 PolarHBondContact O-N 2.71Å
681	R	83.6	Confident	73.9	Confident	211 Å²	211	118.3 Å²	118.3	80%	0.796	67%	0.666	S	S	*	*	H	α-helix	trans	-54.4	-37.6	-176.5	-172.1	177.8	-178.5	-179.6	1.2	113.6	Q685	R681-Q685 WeakPolarHBondContact O-CB 3.39Å; R681-Q685 PolarHBondContact O-N 3.42Å
682	L	87.6	Confident	76.2	Confident	119 Å²	119	117.5 Å²	117.5	62%	0.623	65%	0.653	S	S	*	*	H	α-helix	trans	-71.2	-38	178.7	-69.8	172.5	0	0	0	112.4	S680 M684 Q685 L686	S680-L682 VanDerWaalsContact C-N 3.27Å; S680-L682 PolarHBondContact O-N 2.63Å; L682-M684 VanDerWaalsContact C-N 3.34Å; L682-Q685 PolarHBondContact O-N 3.22Å; L682-L686 WeakPolarHBondContact O-CG 3.43Å; L682-L686 PolarHBondContact O-N 3.34Å
683	Q	83.3	Confident	78.1	Confident	126 Å²	126	116.1 Å²	116.1	59%	0.589	64%	0.64	S	S	*	*	H	α-helix	trans	-65.6	-41.3	175.4	-170.3	178.9	14.4	0	0	110.6	V679 S680 L686 H687	V679-Q683 HydrophobicContact CG1-CB 4.3Å; V679-Q683 HydrophobicContact CG1-CG 4.46Å; S680-Q683 WeakPolarHBondContact O-CB 3.41Å; S680-Q683 PolarHBondContact O-N 2.98Å; Q683-L686 PolarHBondContact O-N 2.95Å; Q683-H687 VanDerWaalsContact O-CB 3.3Å; Q683-H687 WeakPolarHBondContact O-CB 3.5Å; Q683-H687 PolarHBondContact O-N 3.05Å
684	M	89.4	Confident	80.4	Confident	102 Å²	102	114.6 Å²	114.6	50%	0.502	62%	0.623	S	S	.	*	H	α-helix	trans	-60.7	-44	172.1	-170.2	-173	-64.6	0	0	111.8	S680 L682 H687 L688	S680-M684 PolarHBondContact O-N 2.71Å; L682-M684 VanDerWaalsContact C-N 3.34Å; M684-H687 PolarHBondContact O-N 3.43Å; M684-L688 HydrophobicContact CG-CD1 4.22Å; M684-L688 WeakPolarHBondContact O-CB 3.31Å; M684-L688 VanDerWaalsContact O-CG 3.26Å; M684-L688 WeakPolarHBondContact O-CG 3.46Å; M684-L688 PolarHBondContact O-N 2.86Å
685	Q	90.1	Very high	83	Confident	122 Å²	122	112.8 Å²	112.8	57%	0.57	60%	0.601	S	S	*	*	H	α-helix	trans	-65	-41	178.6	-173.3	175.8	1.2	0	0	112.9	R681 L682 R689	R681-Q685 WeakPolarHBondContact O-CB 3.39Å; R681-Q685 PolarHBondContact O-N 3.42Å; L682-Q685 PolarHBondContact O-N 3.22Å; Q685-R689 PolarHBondContact O-N 2.98Å
686	L	91	Very high	85.6	Confident	132 Å²	132	106.2 Å²	106.2	69%	0.691	58%	0.576	S	S	*	*	H	α-helix	trans	-67.3	-42	174.5	-72.8	172.3	0	0	0	111.7	L682 Q683 R689 G690	L682-L686 WeakPolarHBondContact O-CG 3.43Å; L682-L686 PolarHBondContact O-N 3.34Å; Q683-L686 PolarHBondContact O-N 2.95Å; L686-R689 PolarHBondContact O-N 3.48Å; L686-G690 PolarHBondContact O-N 3.05Å
687	H	91.9	Very high	87.7	Confident	141 Å²	141	105.2 Å²	105.2	65%	0.653	56%	0.564	S	S	*	*	H	α-helix	trans	-63.6	-43	176.4	-173.2	-117.9	0	0	0	111.9	Q683 M684 R689 G690 L691	Q683-H687 VanDerWaalsContact O-CB 3.3Å; Q683-H687 WeakPolarHBondContact O-CB 3.5Å; Q683-H687 PolarHBondContact O-N 3.05Å; M684-H687 PolarHBondContact O-N 3.43Å; H687-R689 VanDerWaalsContact C-N 3.33Å; H687-R689 PolarHBondContact O-N 3.37Å; H687-G690 PolarHBondContact O-N 2.93Å; H687-L691 WeakPolarHBondContact O-CB 3.24Å; H687-L691 PolarHBondContact O-N 3.08Å
688	L	93.8	Very high	89.7	Confident	87 Å²	87	103 Å²	103	46%	0.455	55%	0.547	S	S	.	.	H	α-helix	trans	-59.6	-40.3	172.5	-77.2	172.2	0	0	0	112.1	M684 L691 Q692	M684-L688 HydrophobicContact CG-CD1 4.22Å; M684-L688 WeakPolarHBondContact O-CB 3.31Å; M684-L688 VanDerWaalsContact O-CG 3.26Å; M684-L688 WeakPolarHBondContact O-CG 3.46Å; M684-L688 PolarHBondContact O-N 2.86Å; L688-L691 PolarHBondContact O-N 3.16Å; L688-Q692 WeakPolarHBondContact O-CB 3.42Å; L688-Q692 VanDerWaalsContact O-CG 3.23Å; L688-Q692 WeakPolarHBondContact O-CG 3.34Å; L688-Q692 PolarHBondContact O-N 3.48Å
689	R	94.2	Very high	91.5	Very high	167 Å²	167	105 Å²	105	63%	0.63	53%	0.532	S	S	*	.	H	α-helix	trans	-72.5	-36	177.1	-166.1	168.3	-174.6	166.5	1.7	112.7	Q685 L686 H687 Q692 N693	Q685-R689 PolarHBondContact O-N 2.98Å; L686-R689 PolarHBondContact O-N 3.48Å; H687-R689 VanDerWaalsContact C-N 3.33Å; H687-R689 PolarHBondContact O-N 3.37Å; R689-Q692 PolarHBondContact O-N 3.11Å; R689-N693 VanDerWaalsContact O-CG 3.31Å; R689-N693 PolarHBondContact O-N 3.26Å; R689-N693 PolarHBondContact O-OD1 2.73Å
690	G	95.1	Very high	92.7	Very high	34 Å²	34	102.1 Å²	102.1	35%	0.351	52%	0.521	S	S	.	.	H	α-helix	trans	-58.6	-47.8	169.5	0	0	0	0	0	111.5	L686 H687 Q692 N693 S694	L686-G690 PolarHBondContact O-N 3.05Å; H687-G690 PolarHBondContact O-N 2.93Å; G690-Q692 PolarHBondContact O-N 2.98Å; G690-N693 PolarHBondContact O-N 3.27Å; G690-S694 PolarHBondContact O-N 2.7Å; G690-S694 PolarHBondContact O-OG 2.64Å
691	L	95.3	Very high	93.5	Very high	107 Å²	107	104.5 Å²	104.5	56%	0.56	53%	0.525	S	S	*	.	H	α-helix	trans	-62.5	-39	175.6	-176	62.8	0	0	0	112.7	H687 L688 A695	H687-L691 WeakPolarHBondContact O-CB 3.24Å; H687-L691 PolarHBondContact O-N 3.08Å; L688-L691 PolarHBondContact O-N 3.16Å; L691-A695 WeakPolarHBondContact O-CB 3.1Å; L691-A695 PolarHBondContact O-N 2.81Å
692	Q	95.6	Very high	94.2	Very high	116 Å²	116	98 Å²	98	54%	0.542	51%	0.505	S	S	.	.	H	α-helix	trans	-62	-42	174	-75.7	166.3	17.1	0	0	112.3	L688 R689 G690 A695 S696	L688-Q692 WeakPolarHBondContact O-CB 3.42Å; L688-Q692 VanDerWaalsContact O-CG 3.23Å; L688-Q692 WeakPolarHBondContact O-CG 3.34Å; L688-Q692 PolarHBondContact O-N 3.48Å; R689-Q692 PolarHBondContact O-N 3.11Å; G690-Q692 PolarHBondContact O-N 2.98Å; Q692-A695 PolarHBondContact O-N 3.19Å; Q692-S696 PolarHBondContact O-N 2.89Å; Q692-S696 PolarHBondContact O-OG 3.39Å
693	N	95.8	Very high	94.7	Very high	85 Å²	85	99 Å²	99	46%	0.455	51%	0.507	S	S	.	.	H	α-helix	trans	-65.4	-50.5	175.9	-70	3.3	0	0	0	111.1	R689 G690 A695 S696 D697	R689-N693 VanDerWaalsContact O-CG 3.31Å; R689-N693 PolarHBondContact O-N 3.26Å; R689-N693 PolarHBondContact O-OD1 2.73Å; G690-N693 PolarHBondContact O-N 3.27Å; N693-A695 PolarHBondContact O-N 2.89Å; N693-S696 WeakPolarHBondContact CA-OG 3.27Å; N693-S696 WeakPolarHBondContact O-CA 3.34Å; N693-S696 PolarHBondContact O-N 3.3Å; N693-S696 PolarHBondContact O-OG 2.87Å; N693-D697 VanDerWaalsContact O-CG 3.3Å; N693-D697 PolarHBondContact O-N 2.92Å
694	S	95.3	Very high	95.4	Very high	74 Å²	74	99.9 Å²	99.9	52%	0.517	51%	0.511	S	S	.	.	H	α-helix	trans	-57.4	-36	175.4	-57.8	0	0	0	0	112	G690 D697 L698	G690-S694 PolarHBondContact O-N 2.7Å; G690-S694 PolarHBondContact O-OG 2.64Å; S694-D697 PolarHBondContact O-N 2.73Å; S694-L698 WeakPolarHBondContact O-CB 3.22Å; S694-L698 PolarHBondContact O-N 2.73Å
695	A	96.4	Very high	95.8	Very high	33 Å²	33	100.2 Å²	100.2	27%	0.273	51%	0.514	S	S	.	.	H	α-helix	trans	-72	-30.1	174.7	0	0	0	0	0	113.2	L691 Q692 N693 R699	L691-A695 WeakPolarHBondContact O-CB 3.1Å; L691-A695 PolarHBondContact O-N 2.81Å; Q692-A695 PolarHBondContact O-N 3.19Å; N693-A695 PolarHBondContact O-N 2.89Å; A695-R699 VanDerWaalsContact C-CZ 3.48Å; A695-R699 WeakPolarHBondContact O-CB 3.45Å; A695-R699 VanDerWaalsContact O-CG 3.25Å; A695-R699 WeakPolarHBondContact O-CG 3.41Å; A695-R699 PolarHBondContact O-N 3.43Å; A695-R699 VanDerWaalsContact O-N 3.12Å; A695-R699 PolarHBondContact O-NE 3.39Å; A695-R699 PolarHBondContact O-NH1 3.21Å
696	S	96.8	Very high	96.2	Very high	51 Å²	51	102.9 Å²	102.9	36%	0.357	52%	0.519	S	S	.	.	H	α-helix	trans	-71.5	-38.3	169.2	42.7	0	0	0	0	112.3	Q692 N693 R699 G700	Q692-S696 PolarHBondContact O-N 2.89Å; Q692-S696 PolarHBondContact O-OG 3.39Å; N693-S696 WeakPolarHBondContact CA-OG 3.27Å; N693-S696 WeakPolarHBondContact O-CA 3.34Å; N693-S696 PolarHBondContact O-N 3.3Å; N693-S696 PolarHBondContact O-OG 2.87Å; S696-R699 WeakPolarHBondContact O-CB 3.43Å; S696-R699 PolarHBondContact O-N 3.36Å; S696-G700 PolarHBondContact O-N 3.02Å
697	D	97.1	Very high	96.5	Very high	100 Å²	100	103.9 Å²	103.9	54%	0.535	52%	0.518	S	S	.	.	H	α-helix	trans	-67.5	-42.3	179.5	-61.9	-16.9	0	0	0	110.5	N693 S694 R699 G700 Q701	N693-D697 VanDerWaalsContact O-CG 3.3Å; N693-D697 PolarHBondContact O-N 2.92Å; S694-D697 PolarHBondContact O-N 2.73Å; D697-R699 PolarHBondContact O-N 2.89Å; D697-G700 WeakPolarHBondContact O-CA 3.3Å; D697-G700 PolarHBondContact O-N 3.47Å; D697-G700 VanDerWaalsContact O-N 3.13Å; D697-Q701 WeakPolarHBondContact O-CG 3.47Å; D697-Q701 PolarHBondContact O-N 3.33Å
698	L	97.9	Very high	96.8	Very high	92 Å²	92	101.2 Å²	101.2	48%	0.482	51%	0.508	S	S	.	.	H	α-helix	trans	-63.2	-39.4	172.4	-174.4	62.8	0	0	0	112.1	S694 G700 Q701 L702	S694-L698 WeakPolarHBondContact O-CB 3.22Å; S694-L698 PolarHBondContact O-N 2.73Å; L698-G700 VanDerWaalsContact C-N 3.31Å; L698-G700 PolarHBondContact O-N 3.2Å; L698-Q701 PolarHBondContact O-N 3.08Å; L698-L702 HydrophobicContact CG-CD1 4.24Å; L698-L702 WeakPolarHBondContact O-CB 3.46Å; L698-L702 VanDerWaalsContact O-CG 3.29Å; L698-L702 WeakPolarHBondContact O-CG 3.42Å; L698-L702 PolarHBondContact O-N 3.07Å
699	R	97.7	Very high	97	Very high	141 Å²	141	103.1 Å²	103.1	53%	0.532	51%	0.514	S	S	.	.	H	α-helix	trans	-60.8	-40.5	171.1	-78	-177.4	-62.1	-93.8	3.2	111.5	A695 S696 D697 Q703	A695-R699 VanDerWaalsContact C-CZ 3.48Å; A695-R699 WeakPolarHBondContact O-CB 3.45Å; A695-R699 VanDerWaalsContact O-CG 3.25Å; A695-R699 WeakPolarHBondContact O-CG 3.41Å; A695-R699 PolarHBondContact O-N 3.43Å; A695-R699 VanDerWaalsContact O-N 3.12Å; A695-R699 PolarHBondContact O-NE 3.39Å; A695-R699 PolarHBondContact O-NH1 3.21Å; S696-R699 WeakPolarHBondContact O-CB 3.43Å; S696-R699 PolarHBondContact O-N 3.36Å; D697-R699 PolarHBondContact O-N 2.89Å; R699-Q703 WeakPolarHBondContact O-CB 3.48Å; R699-Q703 VanDerWaalsContact O-CG 3.29Å; R699-Q703 WeakPolarHBondContact O-CG 3.42Å; R699-Q703 PolarHBondContact O-N 3.45Å
700	G	98.1	Very high	97.1	Very high	32 Å²	32	99.1 Å²	99.1	33%	0.33	51%	0.505	S	S	.	.	H	α-helix	trans	-63.7	-46.2	175	0	0	0	0	0	112.9	S696 D697 L698 L702 Q703 Q704	S696-G700 PolarHBondContact O-N 3.02Å; D697-G700 WeakPolarHBondContact O-CA 3.3Å; D697-G700 PolarHBondContact O-N 3.47Å; D697-G700 VanDerWaalsContact O-N 3.13Å; L698-G700 VanDerWaalsContact C-N 3.31Å; L698-G700 PolarHBondContact O-N 3.2Å; G700-L702 PolarHBondContact O-N 2.83Å; G700-Q703 PolarHBondContact O-N 3.31Å; G700-Q704 WeakPolarHBondContact O-CB 3.44Å; G700-Q704 PolarHBondContact O-N 2.97Å
701	Q	97.8	Very high	97.3	Very high	123 Å²	123	102.8 Å²	102.8	58%	0.575	51%	0.513	S	S	*	.	H	α-helix	trans	-62.5	-41.3	176.2	-70.5	177.4	9.7	0	0	112.1	D697 L698 Q704 L705	D697-Q701 WeakPolarHBondContact O-CG 3.47Å; D697-Q701 PolarHBondContact O-N 3.33Å; L698-Q701 PolarHBondContact O-N 3.08Å; Q701-Q704 PolarHBondContact O-N 3.43Å; Q701-L705 WeakPolarHBondContact O-CB 3.33Å; Q701-L705 PolarHBondContact O-N 2.92Å
702	L	98.2	Very high	97.4	Very high	73 Å²	73	101.8 Å²	101.8	38%	0.382	51%	0.508	S	S	.	.	H	α-helix	trans	-65.8	-37.2	174.8	-72	170.1	0	0	0	112.4	L698 G700 R706	L698-L702 HydrophobicContact CG-CD1 4.24Å; L698-L702 WeakPolarHBondContact O-CB 3.46Å; L698-L702 VanDerWaalsContact O-CG 3.29Å; L698-L702 WeakPolarHBondContact O-CG 3.42Å; L698-L702 PolarHBondContact O-N 3.07Å; G700-L702 PolarHBondContact O-N 2.83Å; L702-R706 WeakPolarHBondContact O-CB 3.46Å; L702-R706 PolarHBondContact O-N 3.24Å
703	Q	97.9	Very high	97.5	Very high	142 Å²	142	100.8 Å²	100.8	66%	0.664	50%	0.503	S	S	*	.	H	α-helix	trans	-65.9	-41.6	172.2	-74.8	174.3	1.8	0	0	112	R699 G700 R706 K707	R699-Q703 WeakPolarHBondContact O-CB 3.48Å; R699-Q703 VanDerWaalsContact O-CG 3.29Å; R699-Q703 WeakPolarHBondContact O-CG 3.42Å; R699-Q703 PolarHBondContact O-N 3.45Å; G700-Q703 PolarHBondContact O-N 3.31Å; Q703-R706 PolarHBondContact O-N 2.91Å; Q703-K707 PolarHBondContact O-N 3.47Å
704	Q	97.7	Very high	97.6	Very high	144 Å²	144	102.2 Å²	102.2	67%	0.673	51%	0.508	S	S	*	.	H	α-helix	trans	-63.2	-44.5	175.2	-178.4	178	-7.9	0	0	111.6	G700 Q701 K707 L708	G700-Q704 WeakPolarHBondContact O-CB 3.44Å; G700-Q704 PolarHBondContact O-N 2.97Å; Q701-Q704 PolarHBondContact O-N 3.43Å; Q704-K707 PolarHBondContact O-N 2.75Å; Q704-L708 PolarHBondContact O-N 3.11Å
705	L	98.3	Very high	97.7	Very high	109 Å²	109	101.7 Å²	101.7	57%	0.571	50%	0.504	S	S	*	.	H	α-helix	trans	-61.8	-43.2	175.9	-178.7	60.6	0	0	0	111.4	Q701 K707 L708 Q709	Q701-L705 WeakPolarHBondContact O-CB 3.33Å; Q701-L705 PolarHBondContact O-N 2.92Å; L705-K707 VanDerWaalsContact C-N 3.34Å; L705-K707 PolarHBondContact O-N 3.22Å; L705-L708 PolarHBondContact O-N 2.97Å; L705-Q709 WeakPolarHBondContact O-CB 3.45Å; L705-Q709 PolarHBondContact O-N 3.5Å
706	R	97.8	Very high	97.8	Very high	178 Å²	178	104 Å²	104	67%	0.672	51%	0.514	S	S	*	.	H	α-helix	trans	-64.2	-36.7	175.8	-169.9	171.7	-175.7	150.6	2	112.5	L702 Q703 Q709 L710	L702-R706 WeakPolarHBondContact O-CB 3.46Å; L702-R706 PolarHBondContact O-N 3.24Å; Q703-R706 PolarHBondContact O-N 2.91Å; R706-Q709 PolarHBondContact O-N 2.96Å; R706-L710 WeakPolarHBondContact O-CG 3.35Å; R706-L710 PolarHBondContact O-N 3.47Å; R706-L710 VanDerWaalsContact O-N 3.1Å
707	K	97.8	Very high	97.9	Very high	152 Å²	152	107.3 Å²	107.3	66%	0.661	52%	0.519	S	S	*	.	H	α-helix	trans	-64.5	-45.1	172.6	-175.2	179.9	177.7	-178.1	0	111.5	Q703 Q704 L705 Q709 L710 Q711	Q703-K707 PolarHBondContact O-N 3.47Å; Q704-K707 PolarHBondContact O-N 2.75Å; L705-K707 VanDerWaalsContact C-N 3.34Å; L705-K707 PolarHBondContact O-N 3.22Å; K707-Q709 VanDerWaalsContact C-N 3.34Å; K707-L710 PolarHBondContact O-N 2.93Å; K707-Q711 WeakPolarHBondContact O-CB 3.44Å; K707-Q711 PolarHBondContact O-N 2.84Å
708	L	98.1	Very high	97.9	Very high	85 Å²	85	105.6 Å²	105.6	45%	0.445	52%	0.519	S	S	.	.	H	α-helix	trans	-65.2	-37.2	177.1	-177.9	60.3	0	0	0	112.1	Q704 L705 Q711 N712	Q704-L708 PolarHBondContact O-N 3.11Å; L705-L708 PolarHBondContact O-N 2.97Å; L708-Q711 PolarHBondContact O-N 3.07Å; L708-N712 WeakPolarHBondContact O-CB 3.43Å; L708-N712 VanDerWaalsContact O-CG 3.31Å; L708-N712 PolarHBondContact O-N 2.88Å
709	Q	97.6	Very high	97.9	Very high	128 Å²	128	106.3 Å²	106.3	60%	0.598	52%	0.522	S	S	*	.	H	α-helix	trans	-59.7	-47.5	173.5	-175.2	-172.4	6.8	0	0	111.4	L705 R706 K707 N712 Q713	L705-Q709 WeakPolarHBondContact O-CB 3.45Å; L705-Q709 PolarHBondContact O-N 3.5Å; R706-Q709 PolarHBondContact O-N 2.96Å; K707-Q709 VanDerWaalsContact C-N 3.34Å; Q709-N712 PolarHBondContact O-N 2.62Å; Q709-Q713 WeakPolarHBondContact O-CB 3.4Å; Q709-Q713 PolarHBondContact O-N 3.32Å
710	L	97.8	Very high	98	Very high	82 Å²	82	104.9 Å²	104.9	43%	0.429	53%	0.525	S	S	.	.	H	α-helix	trans	-64	-45.1	176.8	-70.8	168.9	0	0	0	111.6	R706 K707 N712 Q713 E714	R706-L710 WeakPolarHBondContact O-CG 3.35Å; R706-L710 PolarHBondContact O-N 3.47Å; R706-L710 VanDerWaalsContact O-N 3.1Å; K707-L710 PolarHBondContact O-N 2.93Å; L710-N712 VanDerWaalsContact C-N 3.32Å; L710-N712 PolarHBondContact O-N 3.46Å; L710-Q713 CarbonylContact O-C 3.58Å; L710-Q713 WeakPolarHBondContact O-CB 3.39Å; L710-Q713 PolarHBondContact O-N 3.08Å; L710-Q713 VanDerWaalsContact O-N 3.09Å; L710-E714 WeakPolarHBondContact O-CG 3.24Å; L710-E714 PolarHBondContact O-N 3.39Å
711	Q	98.1	Very high	98	Very high	111 Å²	111	110.7 Å²	110.7	52%	0.519	54%	0.541	S	S	.	.	H	α-helix	trans	-61.1	-38.2	176.7	-173.8	177.1	-4.4	0	0	112.6	K707 L708 E714 S715	K707-Q711 WeakPolarHBondContact O-CB 3.44Å; K707-Q711 PolarHBondContact O-N 2.84Å; L708-Q711 PolarHBondContact O-N 3.07Å; Q711-E714 PolarHBondContact O-N 2.63Å; Q711-S715 WeakPolarHBondContact O-CB 3.31Å; Q711-S715 PolarHBondContact O-N 2.68Å; Q711-S715 PolarHBondContact O-OG 3.2Å
712	N	97.9	Very high	98	Very high	86 Å²	86	114 Å²	114	46%	0.46	55%	0.548	S	S	.	.	H	α-helix	trans	-70	-35.8	173.5	-75.6	-15.9	0	0	0	112.1	L708 Q709 L710 E714 S715 V716	L708-N712 WeakPolarHBondContact O-CB 3.43Å; L708-N712 VanDerWaalsContact O-CG 3.31Å; L708-N712 PolarHBondContact O-N 2.88Å; Q709-N712 PolarHBondContact O-N 2.62Å; L710-N712 VanDerWaalsContact C-N 3.32Å; L710-N712 PolarHBondContact O-N 3.46Å; N712-E714 VanDerWaalsContact C-N 3.32Å; N712-S715 WeakPolarHBondContact CA-OG 3.27Å; N712-S715 PolarHBondContact O-N 3.27Å; N712-S715 PolarHBondContact O-OG 2.9Å; N712-S715 VanDerWaalsContact O-OG 3.1Å; N712-V716 WeakPolarHBondContact O-CB 3.38Å; N712-V716 VanDerWaalsContact O-CG2 3.27Å; N712-V716 WeakPolarHBondContact O-CG2 3.33Å; N712-V716 PolarHBondContact O-N 3.39Å
713	Q	98	Very high	98	Very high	95 Å²	95	113.3 Å²	113.3	44%	0.444	55%	0.547	S	S	.	.	H	α-helix	trans	-66.3	-36.4	174	-158.1	-169.4	50.3	0	0	111.4	Q709 L710 R717	Q709-Q713 WeakPolarHBondContact O-CB 3.4Å; Q709-Q713 PolarHBondContact O-N 3.32Å; L710-Q713 CarbonylContact O-C 3.58Å; L710-Q713 WeakPolarHBondContact O-CB 3.39Å; L710-Q713 PolarHBondContact O-N 3.08Å; L710-Q713 VanDerWaalsContact O-N 3.09Å; Q713-R717 VanDerWaalsContact C-NH1 3.28Å; Q713-R717 VanDerWaalsContact O-CG 3.29Å; Q713-R717 WeakPolarHBondContact O-CG 3.45Å; Q713-R717 PolarHBondContact O-N 3.48Å; Q713-R717 VanDerWaalsContact O-N 3.12Å; Q713-R717 PolarHBondContact O-NH1 3.01Å; Q713-R717 VanDerWaalsContact O-NH1 3.15Å
714	E	97.6	Very high	98	Very high	116 Å²	116	112.8 Å²	112.8	54%	0.542	55%	0.545	S	S	.	.	H	α-helix	trans	-70.3	-44.6	174.1	-73.7	166	-165.2	0	0	112.1	L710 Q711 N712 V716 R717 A718	L710-E714 WeakPolarHBondContact O-CG 3.24Å; L710-E714 PolarHBondContact O-N 3.39Å; Q711-E714 PolarHBondContact O-N 2.63Å; N712-E714 VanDerWaalsContact C-N 3.32Å; E714-V716 PolarHBondContact O-N 3Å; E714-R717 PolarHBondContact O-N 2.79Å; E714-A718 WeakPolarHBondContact O-CB 3.48Å; E714-A718 PolarHBondContact O-N 3.15Å
715	S	98	Very high	97.9	Very high	63 Å²	63	108.8 Å²	108.8	44%	0.441	54%	0.536	S	S	.	.	H	α-helix	trans	-65.3	-38.7	178.3	71.1	0	0	0	0	112.4	Q711 N712 A718 L719	Q711-S715 WeakPolarHBondContact O-CB 3.31Å; Q711-S715 PolarHBondContact O-N 2.68Å; Q711-S715 PolarHBondContact O-OG 3.2Å; N712-S715 WeakPolarHBondContact CA-OG 3.27Å; N712-S715 PolarHBondContact O-N 3.27Å; N712-S715 PolarHBondContact O-OG 2.9Å; N712-S715 VanDerWaalsContact O-OG 3.1Å; S715-A718 PolarHBondContact O-N 2.85Å; S715-L719 WeakPolarHBondContact O-CB 3.31Å; S715-L719 PolarHBondContact O-N 2.87Å
716	V	98.3	Very high	97.9	Very high	80 Å²	80	107.5 Å²	107.5	49%	0.485	53%	0.527	S	S	.	.	H	α-helix	trans	-65.5	-44.4	172.9	170.7	0	0	0	0	111.5	N712 E714 A718 L719 L720	N712-V716 WeakPolarHBondContact O-CB 3.38Å; N712-V716 VanDerWaalsContact O-CG2 3.27Å; N712-V716 WeakPolarHBondContact O-CG2 3.33Å; N712-V716 PolarHBondContact O-N 3.39Å; E714-V716 PolarHBondContact O-N 3Å; V716-A718 VanDerWaalsContact C-N 3.33Å; V716-A718 PolarHBondContact O-N 3.47Å; V716-L719 PolarHBondContact O-N 3.39Å; V716-L720 HydrophobicContact CG1-CD1 3.97Å; V716-L720 HydrophobicContact CG1-CG 4.4Å; V716-L720 WeakPolarHBondContact O-CB 3.24Å; V716-L720 VanDerWaalsContact O-CG 3.31Å; V716-L720 WeakPolarHBondContact O-CG 3.27Å; V716-L720 PolarHBondContact O-N 2.83Å
717	R	98	Very high	97.8	Very high	122 Å²	122	104.1 Å²	104.1	46%	0.46	52%	0.522	S	S	.	.	H	α-helix	trans	-59.5	-42.7	173.7	-76.7	-175.5	-157.2	98.9	-16.5	112.1	Q713 E714 L720 K721	Q713-R717 VanDerWaalsContact C-NH1 3.28Å; Q713-R717 VanDerWaalsContact O-CG 3.29Å; Q713-R717 WeakPolarHBondContact O-CG 3.45Å; Q713-R717 PolarHBondContact O-N 3.48Å; Q713-R717 VanDerWaalsContact O-N 3.12Å; Q713-R717 PolarHBondContact O-NH1 3.01Å; Q713-R717 VanDerWaalsContact O-NH1 3.15Å; E714-R717 PolarHBondContact O-N 2.79Å; R717-L720 PolarHBondContact O-N 3.16Å; R717-K721 PolarHBondContact O-N 2.85Å
718	A	98.1	Very high	97.8	Very high	64 Å²	64	100.3 Å²	100.3	53%	0.529	51%	0.514	S	S	.	.	H	α-helix	trans	-66.9	-40.1	179.6	0	0	0	0	0	112	E714 S715 V716 R722	E714-A718 WeakPolarHBondContact O-CB 3.48Å; E714-A718 PolarHBondContact O-N 3.15Å; S715-A718 PolarHBondContact O-N 2.85Å; V716-A718 VanDerWaalsContact C-N 3.33Å; V716-A718 PolarHBondContact O-N 3.47Å; A718-R722 WeakPolarHBondContact O-CB 3.34Å; A718-R722 PolarHBondContact O-N 3.03Å
719	L	98.2	Very high	97.7	Very high	106 Å²	106	101.3 Å²	101.3	56%	0.555	52%	0.518	S	S	*	.	H	α-helix	trans	-62.9	-47.7	173.2	-179.8	59.6	0	0	0	111.2	S715 V716 K721 R722 T723	S715-L719 WeakPolarHBondContact O-CB 3.31Å; S715-L719 PolarHBondContact O-N 2.87Å; V716-L719 PolarHBondContact O-N 3.39Å; L719-K721 PolarHBondContact O-N 3.47Å; L719-R722 WeakPolarHBondContact O-CB 3.49Å; L719-R722 PolarHBondContact O-N 3.1Å; L719-R722 VanDerWaalsContact O-N 3.12Å; L719-T723 PolarHBondContact O-N 3.08Å; L719-T723 PolarHBondContact O-OG1 2.88Å; L719-T723 VanDerWaalsContact O-OG1 3.14Å
720	L	98.2	Very high	97.5	Very high	112 Å²	112	101 Å²	101	59%	0.586	51%	0.512	S	S	*	.	H	α-helix	trans	-57.9	-48.4	177.8	-73.9	170.3	0	0	0	111.9	V716 R717 R722 T723 E724	V716-L720 HydrophobicContact CG1-CD1 3.97Å; V716-L720 HydrophobicContact CG1-CG 4.4Å; V716-L720 WeakPolarHBondContact O-CB 3.24Å; V716-L720 VanDerWaalsContact O-CG 3.31Å; V716-L720 WeakPolarHBondContact O-CG 3.27Å; V716-L720 PolarHBondContact O-N 2.83Å; R717-L720 PolarHBondContact O-N 3.16Å; L720-R722 VanDerWaalsContact C-N 3.29Å; L720-R722 PolarHBondContact O-N 2.67Å; L720-T723 PolarHBondContact O-N 3.38Å; L720-E724 VanDerWaalsContact O-CB 3.32Å; L720-E724 WeakPolarHBondContact O-CB 3.34Å; L720-E724 PolarHBondContact O-N 3.3Å
721	K	98.2	Very high	97.4	Very high	153 Å²	153	101.7 Å²	101.7	67%	0.665	52%	0.519	S	S	*	.	H	α-helix	trans	-61.3	-34.8	175.5	-75.9	-167.5	171.1	-165.3	0	113.1	R717 L719 A725	R717-K721 PolarHBondContact O-N 2.85Å; L719-K721 PolarHBondContact O-N 3.47Å; K721-A725 WeakPolarHBondContact O-CB 3.28Å; K721-A725 PolarHBondContact O-N 3.41Å
722	R	97.8	Very high	97.1	Very high	192 Å²	192	99.7 Å²	99.7	73%	0.725	52%	0.517	S	S	*	.	H	α-helix	trans	-68.1	-44.4	175.3	-169.5	-176.1	-169.6	121.4	3.1	111.5	A718 L719 L720 A725 E726	A718-R722 WeakPolarHBondContact O-CB 3.34Å; A718-R722 PolarHBondContact O-N 3.03Å; L719-R722 WeakPolarHBondContact O-CB 3.49Å; L719-R722 PolarHBondContact O-N 3.1Å; L719-R722 VanDerWaalsContact O-N 3.12Å; L720-R722 VanDerWaalsContact C-N 3.29Å; L720-R722 PolarHBondContact O-N 2.67Å; R722-A725 PolarHBondContact O-N 2.78Å; R722-E726 PolarHBondContact O-N 2.97Å
723	T	98.3	Very high	96.5	Very high	60 Å²	60	99.1 Å²	99.1	37%	0.368	51%	0.512	S	S	.	.	H	α-helix	trans	-67	-38.3	176.8	-58.5	0	0	0	0	111.6	L719 L720 E726 L727	L719-T723 PolarHBondContact O-N 3.08Å; L719-T723 PolarHBondContact O-OG1 2.88Å; L719-T723 VanDerWaalsContact O-OG1 3.14Å; L720-T723 PolarHBondContact O-N 3.38Å; T723-E726 PolarHBondContact O-N 2.92Å; T723-L727 HydrophobicContact CG2-CD1 3.99Å; T723-L727 HydrophobicContact CG2-CG 4.3Å; T723-L727 WeakPolarHBondContact O-CB 3.44Å; T723-L727 VanDerWaalsContact O-CG 3.25Å; T723-L727 WeakPolarHBondContact O-CG 3.48Å; T723-L727 PolarHBondContact O-N 2.96Å
724	E	97.5	Very high	95.8	Very high	130 Å²	130	96.3 Å²	96.3	61%	0.607	51%	0.505	S	S	*	.	H	α-helix	trans	-58.8	-48.5	172.4	179.9	-177.2	-168.3	0	0	111.6	L720 E726 L727 S728	L720-E724 VanDerWaalsContact O-CB 3.32Å; L720-E724 WeakPolarHBondContact O-CB 3.34Å; L720-E724 PolarHBondContact O-N 3.3Å; E724-E726 PolarHBondContact O-N 3.26Å; E724-L727 PolarHBondContact O-N 3.01Å; E724-S728 VanDerWaalsContact O-CB 3.29Å; E724-S728 WeakPolarHBondContact O-CB 3.44Å; E724-S728 PolarHBondContact O-N 3.48Å
725	A	97.1	Very high	95.1	Very high	60 Å²	60	93.8 Å²	93.8	50%	0.496	50%	0.503	S	S	.	.	H	α-helix	trans	-62.8	-41.2	175.9	0	0	0	0	0	112.5	K721 R722 S728 M729	K721-A725 WeakPolarHBondContact O-CB 3.28Å; K721-A725 PolarHBondContact O-N 3.41Å; R722-A725 PolarHBondContact O-N 2.78Å; A725-S728 PolarHBondContact O-N 2.89Å; A725-M729 WeakPolarHBondContact O-CB 3.41Å; A725-M729 PolarHBondContact O-N 3.26Å
726	E	97.1	Very high	94.1	Very high	82 Å²	82	98.4 Å²	98.4	38%	0.383	51%	0.511	S	S	.	.	H	α-helix	trans	-65.7	-42.7	176	-173.9	173	175.5	0	0	112.1	R722 T723 E724 M729 R730	R722-E726 PolarHBondContact O-N 2.97Å; T723-E726 PolarHBondContact O-N 2.92Å; E724-E726 PolarHBondContact O-N 3.26Å; E726-M729 HydrophobicContact CG-CE 4.33Å; E726-M729 PolarHBondContact O-N 2.79Å; E726-R730 HydrophobicContact CG-CG 4.4Å; E726-R730 WeakPolarHBondContact O-CB 3.41Å; E726-R730 WeakPolarHBondContact O-CG 3.27Å; E726-R730 PolarHBondContact O-N 2.72Å; E726-R730 IonicContact OE1-CZ 2.67Å; E726-R730 IonicContact OE1-NH1 3.26Å; E726-R730 PolarHBondContact OE1-NH1 3.4Å; E726-R730 IonicContact OE1-NH2 3.5Å; E726-R730 PolarHBondContact OE1-NH2 3.14Å
727	L	97.1	Very high	92.9	Very high	107 Å²	107	102.3 Å²	102.3	56%	0.56	52%	0.517	S	S	*	.	H	α-helix	trans	-64.5	-44.4	175.2	-73.6	172.4	0	0	0	111.5	T723 E724 M729 R730 V731	T723-L727 HydrophobicContact CG2-CD1 3.99Å; T723-L727 HydrophobicContact CG2-CG 4.3Å; T723-L727 WeakPolarHBondContact O-CB 3.44Å; T723-L727 VanDerWaalsContact O-CG 3.25Å; T723-L727 WeakPolarHBondContact O-CG 3.48Å; T723-L727 PolarHBondContact O-N 2.96Å; E724-L727 PolarHBondContact O-N 3.01Å; L727-M729 PolarHBondContact O-N 2.7Å; L727-R730 PolarHBondContact O-N 2.98Å; L727-V731 WeakPolarHBondContact O-CB 3.46Å; L727-V731 VanDerWaalsContact O-CG2 3.27Å; L727-V731 WeakPolarHBondContact O-CG2 3.49Å; L727-V731 PolarHBondContact O-N 3Å
728	S	96.9	Very high	91.7	Very high	72 Å²	72	102.4 Å²	102.4	50%	0.503	52%	0.523	S	S	.	.	H	α-helix	trans	-59.7	-44.9	177	-178.2	0	0	0	0	111.9	E724 A725 S732	E724-S728 VanDerWaalsContact O-CB 3.29Å; E724-S728 WeakPolarHBondContact O-CB 3.44Å; E724-S728 PolarHBondContact O-N 3.48Å; A725-S728 PolarHBondContact O-N 2.89Å; S728-S732 WeakPolarHBondContact O-CB 3.25Å; S728-S732 PolarHBondContact O-N 2.88Å; S728-S732 PolarHBondContact O-OG 3.2Å
729	M	95.8	Very high	90.7	Very high	106 Å²	106	102.8 Å²	102.8	52%	0.522	51%	0.514	S	S	.	.	H	α-helix	trans	-59.4	-49	172.6	177.7	179.1	62.4	0	0	111.6	A725 E726 L727 S732 E733	A725-M729 WeakPolarHBondContact O-CB 3.41Å; A725-M729 PolarHBondContact O-N 3.26Å; E726-M729 HydrophobicContact CG-CE 4.33Å; E726-M729 PolarHBondContact O-N 2.79Å; L727-M729 PolarHBondContact O-N 2.7Å; M729-S732 WeakPolarHBondContact O-CB 3.33Å; M729-S732 PolarHBondContact O-N 3.23Å; M729-E733 WeakPolarHBondContact O-CB 3.22Å; M729-E733 PolarHBondContact O-N 2.87Å
730	R	94.4	Very high	90.1	Very high	123 Å²	123	102 Å²	102	46%	0.464	51%	0.51	S	S	.	.	H	α-helix	trans	-67.6	-36.7	-178	-67.1	-85.9	173.5	56.6	14.2	112.8	E726 L727 E733 A734	E726-R730 HydrophobicContact CG-CG 4.4Å; E726-R730 WeakPolarHBondContact O-CB 3.41Å; E726-R730 WeakPolarHBondContact O-CG 3.27Å; E726-R730 PolarHBondContact O-N 2.72Å; E726-R730 IonicContact OE1-CZ 2.67Å; E726-R730 IonicContact OE1-NH1 3.26Å; E726-R730 PolarHBondContact OE1-NH1 3.4Å; E726-R730 IonicContact OE1-NH2 3.5Å; E726-R730 PolarHBondContact OE1-NH2 3.14Å; L727-R730 PolarHBondContact O-N 2.98Å; R730-E733 PolarHBondContact O-N 3.2Å; R730-A734 VanDerWaalsContact O-CB 3.23Å; R730-A734 WeakPolarHBondContact O-CB 3.42Å; R730-A734 PolarHBondContact O-N 3.36Å
731	V	94.8	Very high	89.4	Confident	96 Å²	96	101.6 Å²	101.6	58%	0.582	51%	0.514	S	S	*	.	H	α-helix	trans	-66.1	-43.9	173.6	168.2	0	0	0	0	110.2	L727 E733 A734 A735	L727-V731 WeakPolarHBondContact O-CB 3.46Å; L727-V731 VanDerWaalsContact O-CG2 3.27Å; L727-V731 WeakPolarHBondContact O-CG2 3.49Å; L727-V731 PolarHBondContact O-N 3Å; V731-E733 VanDerWaalsContact C-N 3.33Å; V731-E733 PolarHBondContact O-N 3.47Å; V731-A734 PolarHBondContact O-N 3.37Å; V731-A735 VanDerWaalsContact O-CB 3.3Å; V731-A735 WeakPolarHBondContact O-CB 3.24Å; V731-A735 PolarHBondContact O-N 3.47Å
732	S	91.1	Very high	88.9	Confident	68 Å²	68	100.1 Å²	100.1	48%	0.476	51%	0.513	S	S	.	.	H	α-helix	trans	-62	-40.3	175.1	-58.5	0	0	0	0	112	S728 M729 R736	S728-S732 WeakPolarHBondContact O-CB 3.25Å; S728-S732 PolarHBondContact O-N 2.88Å; S728-S732 PolarHBondContact O-OG 3.2Å; M729-S732 WeakPolarHBondContact O-CB 3.33Å; M729-S732 PolarHBondContact O-N 3.23Å; S732-R736 WeakPolarHBondContact O-CB 3.38Å; S732-R736 WeakPolarHBondContact O-CG 3.38Å; S732-R736 PolarHBondContact O-N 3.32Å
733	E	86.6	Confident	88.5	Confident	75 Å²	75	94.3 Å²	94.3	35%	0.35	49%	0.494	S	S	.	.	H	α-helix	trans	-69.2	-40.9	176.7	-156.1	-166.4	162.1	0	0	112.2	M729 R730 V731 R736 R737	M729-E733 WeakPolarHBondContact O-CB 3.22Å; M729-E733 PolarHBondContact O-N 2.87Å; R730-E733 PolarHBondContact O-N 3.2Å; V731-E733 VanDerWaalsContact C-N 3.33Å; V731-E733 PolarHBondContact O-N 3.47Å; E733-R736 CarbonylContact O-C 3.51Å; E733-R736 PolarHBondContact O-N 2.9Å; E733-R737 PolarHBondContact O-N 3.2Å; E733-R737 VanDerWaalsContact O-N 3.12Å; E733-R737 IonicContact OE1-CZ 3.62Å; E733-R737 IonicContact OE1-NH1 3.78Å; E733-R737 PolarHBondContact OE1-NH1 2.83Å; E733-R737 IonicContact OE1-NH2 2.73Å; E733-R737 PolarHBondContact OE1-NH2 2.71Å
734	A	83.4	Confident	88.1	Confident	36 Å²	36	94.5 Å²	94.5	30%	0.298	49%	0.488	S	S	.	.	H	α-helix	trans	-69.2	-40.5	177	0	0	0	0	0	112.4	Q63 R730 V731 R736 R737 Q738	Q63-A734 PolarHBondContact NE2-O 2.89Å; R730-A734 VanDerWaalsContact O-CB 3.23Å; R730-A734 WeakPolarHBondContact O-CB 3.42Å; R730-A734 PolarHBondContact O-N 3.36Å; V731-A734 PolarHBondContact O-N 3.37Å; A734-R736 VanDerWaalsContact C-N 3.33Å; A734-R737 PolarHBondContact O-N 3.48Å; A734-Q738 PolarHBondContact O-N 3.25Å
735	A	82.4	Confident	87.8	Confident	62 Å²	62	92.5 Å²	92.5	51%	0.512	48%	0.478	S	S	.	.	H	α-helix	trans	-59.2	-45.9	170.7	0	0	0	0	0	110.4	V731 R737 Q738	V731-A735 VanDerWaalsContact O-CB 3.3Å; V731-A735 WeakPolarHBondContact O-CB 3.24Å; V731-A735 PolarHBondContact O-N 3.47Å; A735-R737 PolarHBondContact O-N 3.4Å; A735-R737 VanDerWaalsContact O-N 3.13Å; A735-Q738 PolarHBondContact O-N 3.04Å; A735-Q738 VanDerWaalsContact O-N 3.17Å
736	R	77.3	Confident	87.6	Confident	160 Å²	160	94.2 Å²	94.2	60%	0.604	47%	0.472	S	S	*	.	H	α-helix	trans	-62.6	-13.6	172.7	-82.2	-173.3	59.7	115.4	-0	114.6	S732 E733 A734 R744	S732-R736 WeakPolarHBondContact O-CB 3.38Å; S732-R736 WeakPolarHBondContact O-CG 3.38Å; S732-R736 PolarHBondContact O-N 3.32Å; E733-R736 CarbonylContact O-C 3.51Å; E733-R736 PolarHBondContact O-N 2.9Å; A734-R736 VanDerWaalsContact C-N 3.33Å; R736-R744 PolarHBondContact O-NH1 3.37Å; R736-R744 PolarHBondContact O-NH2 3.21Å
737	R	73.1	Confident	87.4	Confident	163 Å²	163	92.8 Å²	92.8	62%	0.615	47%	0.469	S	S	*	.	H	α-helix	trans	-101.6	-15.8	173.4	-73.2	-162.1	-177.1	90.4	8.4	114.5	E733 A734 A735	E733-R737 PolarHBondContact O-N 3.2Å; E733-R737 VanDerWaalsContact O-N 3.12Å; E733-R737 IonicContact OE1-CZ 3.62Å; E733-R737 IonicContact OE1-NH1 3.78Å; E733-R737 PolarHBondContact OE1-NH1 2.83Å; E733-R737 IonicContact OE1-NH2 2.73Å; E733-R737 PolarHBondContact OE1-NH2 2.71Å; A734-R737 PolarHBondContact O-N 3.48Å; A735-R737 PolarHBondContact O-N 3.4Å; A735-R737 VanDerWaalsContact O-N 3.13Å
738	Q	71.7	Confident	87.2	Confident	123 Å²	123	91 Å²	91	58%	0.575	46%	0.46	S	S	*	.	H	α-helix	trans	-76.1	-25.7	178.3	-168.4	173.1	96.6	0	0	113.1	A734 A735 D740	A734-Q738 PolarHBondContact O-N 3.25Å; A735-Q738 PolarHBondContact O-N 3.04Å; A735-Q738 VanDerWaalsContact O-N 3.17Å; Q738-D740 PolarHBondContact O-N 2.78Å
739	E	78.7	Confident	87.2	Confident	72 Å²	72	87.6 Å²	87.6	34%	0.336	44%	0.436	S	S	.	.	S	Bend	trans	-71.3	124.3	178.3	-167.2	-179.5	-156.8	0	0	110.9	R744 T747	E739-R744 HydrophobicContact CG-CB 4.05Å; E739-R744 WeakPolarHBondContact OE2-CG 3.28Å; E739-R744 IonicContact OE2-NH2 3.17Å; E739-T747 PolarHBondContact OE1-OG1 3.4Å
740	D	84.2	Confident	87.2	Confident	89 Å²	89	84.7 Å²	84.7	48%	0.476	42%	0.421	S	S	.	.			trans	-50.2	128.6	175	156.2	43	0	0	0	110.6	Q738 L742 Q743 R744	Q738-D740 PolarHBondContact O-N 2.78Å; D740-L742 PolarHBondContact O-N 2.81Å; D740-L742 VanDerWaalsContact O-N 3.1Å; D740-L742 PolarHBondContact OD1-N 2.76Å; D740-L742 WeakPolarHBondContact OD2-CB 3.47Å; D740-Q743 HydrophobicContact CB-CB 4.05Å; D740-Q743 PolarHBondContact O-N 3.19Å; D740-Q743 VanDerWaalsContact O-N 3.08Å; D740-Q743 WeakPolarHBondContact OD2-CB 3.27Å; D740-Q743 PolarHBondContact OD2-N 2.67Å; D740-R744 WeakPolarHBondContact O-CB 3.29Å; D740-R744 PolarHBondContact O-N 3.17Å
741	P	85	Confident	87.2	Confident	104 Å²	104	82.5 Å²	82.5	68%	0.675	42%	0.416	S	S	*	.	H	α-helix	trans	-52	-32.9	178.2	-29.6	36.1	0	0	0	114.6	Q745	P741-Q745 VanDerWaalsContact O-CB 3.27Å; P741-Q745 WeakPolarHBondContact O-CB 3.37Å; P741-Q745 PolarHBondContact O-N 3.18Å
742	L	86.9	Confident	87.3	Confident	122 Å²	122	80.8 Å²	80.8	64%	0.639	40%	0.402	S	S	*	.	H	α-helix	trans	-72.4	-49.2	175.1	-95.1	165.1	0	0	0	111.9	D740 R744 Q745 R746	D740-L742 PolarHBondContact O-N 2.81Å; D740-L742 VanDerWaalsContact O-N 3.1Å; D740-L742 PolarHBondContact OD1-N 2.76Å; D740-L742 WeakPolarHBondContact OD2-CB 3.47Å; L742-R744 VanDerWaalsContact C-N 3.29Å; L742-R744 PolarHBondContact O-N 3.33Å; L742-Q745 PolarHBondContact O-N 3.35Å; L742-R746 VanDerWaalsContact O-CB 3.28Å; L742-R746 WeakPolarHBondContact O-CB 3.36Å; L742-R746 PolarHBondContact O-N 3.16Å
743	Q	88.7	Confident	87.5	Confident	71 Å²	71	78.7 Å²	78.7	33%	0.332	38%	0.383	S	S	.	.	H	α-helix	trans	-61.2	-36.2	174.5	-176.5	52.6	55.2	0	0	112.5	D740 R746 T747	D740-Q743 HydrophobicContact CB-CB 4.05Å; D740-Q743 PolarHBondContact O-N 3.19Å; D740-Q743 VanDerWaalsContact O-N 3.08Å; D740-Q743 WeakPolarHBondContact OD2-CB 3.27Å; D740-Q743 PolarHBondContact OD2-N 2.67Å; Q743-R746 WeakPolarHBondContact O-CB 2.91Å; Q743-R746 PolarHBondContact O-N 2.72Å; Q743-T747 PolarHBondContact NE2-OG1 3.07Å; Q743-T747 PolarHBondContact O-N 3.17Å; Q743-T747 PolarHBondContact O-OG1 3.17Å
744	R	89.9	Confident	88	Confident	64 Å²	64	79.9 Å²	79.9	24%	0.242	39%	0.392	C	S	.	.	H	α-helix	trans	-63.2	-50.5	172.5	-174.2	-167.1	-147.8	114.3	47	111.7	R736 E739 D740 L742 R746 T747 L748	R736-R744 PolarHBondContact O-NH1 3.37Å; R736-R744 PolarHBondContact O-NH2 3.21Å; E739-R744 HydrophobicContact CG-CB 4.05Å; E739-R744 WeakPolarHBondContact OE2-CG 3.28Å; E739-R744 IonicContact OE2-NH2 3.17Å; D740-R744 WeakPolarHBondContact O-CB 3.29Å; D740-R744 PolarHBondContact O-N 3.17Å; L742-R744 VanDerWaalsContact C-N 3.29Å; L742-R744 PolarHBondContact O-N 3.33Å; R744-R746 PolarHBondContact O-N 3.39Å; R744-T747 PolarHBondContact O-N 2.81Å; R744-L748 HydrophobicContact CG-CD1 4.24Å; R744-L748 WeakPolarHBondContact O-CG 3.13Å; R744-L748 PolarHBondContact O-N 3.12Å
745	Q	91.9	Very high	88.6	Confident	87 Å²	87	84.2 Å²	84.2	41%	0.407	40%	0.4	S	S	.	.	H	α-helix	trans	-61.7	-32.6	179.3	-173.2	62.2	57.2	0	0	110.9	P741 L742 V749 V824	P741-Q745 VanDerWaalsContact O-CB 3.27Å; P741-Q745 WeakPolarHBondContact O-CB 3.37Å; P741-Q745 PolarHBondContact O-N 3.18Å; L742-Q745 PolarHBondContact O-N 3.35Å; Q745-V749 WeakPolarHBondContact O-CB 3.48Å; Q745-V749 WeakPolarHBondContact O-CG2 3.3Å; Q745-V749 PolarHBondContact O-N 3.47Å; Q745-V749 VanDerWaalsContact O-N 3.08Å; Q745-V824 HydrophobicContact CG-CG2 3.95Å
746	R	93.1	Very high	89.3	Confident	97 Å²	97	81.7 Å²	81.7	37%	0.366	38%	0.377	S	S	.	.	H	α-helix	trans	-63.5	-53.1	171.6	168.9	164	-173.2	-133	6	111.7	L742 Q743 R744 L748 V749 E750 V824 L825 E828	L742-R746 VanDerWaalsContact O-CB 3.28Å; L742-R746 WeakPolarHBondContact O-CB 3.36Å; L742-R746 PolarHBondContact O-N 3.16Å; Q743-R746 WeakPolarHBondContact O-CB 2.91Å; Q743-R746 PolarHBondContact O-N 2.72Å; R744-R746 PolarHBondContact O-N 3.39Å; R746-L748 VanDerWaalsContact C-N 3.32Å; R746-L748 PolarHBondContact O-N 3.36Å; R746-V749 PolarHBondContact O-N 3.21Å; R746-E750 WeakPolarHBondContact O-CB 3.37Å; R746-E750 PolarHBondContact O-N 3.17Å; R746-V824 VanDerWaalsContact CA-CG1 3.48Å; R746-V824 HydrophobicContact CB-CG1 3.66Å; R746-L825 HydrophobicContact CB-CD2 4.15Å; R746-L825 HydrophobicContact CG-CD2 3.6Å; R746-E828 IonicContact CZ-OE1 2.81Å; R746-E828 IonicContact NE-OE1 3.42Å; R746-E828 PolarHBondContact NE-OE1 2.82Å; R746-E828 IonicContact NH2-OE1 2.63Å; R746-E828 PolarHBondContact NH2-OE1 3.22Å
747	T	91.9	Very high	90.2	Very high	51 Å²	51	76.1 Å²	76.1	31%	0.313	36%	0.36	S	S	.	.	H	α-helix	trans	-54.4	-46.5	174.9	-51.5	0	0	0	0	111.6	E739 Q743 R744 V749 E750 E751	E739-T747 PolarHBondContact OE1-OG1 3.4Å; Q743-T747 PolarHBondContact NE2-OG1 3.07Å; Q743-T747 PolarHBondContact O-N 3.17Å; Q743-T747 PolarHBondContact O-OG1 3.17Å; R744-T747 PolarHBondContact O-N 2.81Å; T747-V749 PolarHBondContact O-N 2.95Å; T747-E750 PolarHBondContact O-N 2.75Å; T747-E751 WeakPolarHBondContact O-CG 3.25Å; T747-E751 PolarHBondContact O-N 3.35Å
748	L	94.6	Very high	91.3	Very high	70 Å²	70	73.1 Å²	73.1	37%	0.366	36%	0.356	S	S	.	.	H	α-helix	trans	-64.4	-36.8	179.8	-70.2	170.9	0	0	0	113.7	R744 R746 E752	R744-L748 HydrophobicContact CG-CD1 4.24Å; R744-L748 WeakPolarHBondContact O-CG 3.13Å; R744-L748 PolarHBondContact O-N 3.12Å; R746-L748 VanDerWaalsContact C-N 3.32Å; R746-L748 PolarHBondContact O-N 3.36Å; L748-E752 PolarHBondContact O-N 2.72Å; L748-E752 VanDerWaalsContact O-N 3.11Å
749	V	96.4	Very high	92.4	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-77.4	-32.1	178.1	172.8	0	0	0	0	111.5	Q745 R746 T747 E752 R753 K820 M821 V824 L825	Q745-V749 WeakPolarHBondContact O-CB 3.48Å; Q745-V749 WeakPolarHBondContact O-CG2 3.3Å; Q745-V749 PolarHBondContact O-N 3.47Å; Q745-V749 VanDerWaalsContact O-N 3.08Å; R746-V749 PolarHBondContact O-N 3.21Å; T747-V749 PolarHBondContact O-N 2.95Å; V749-E752 PolarHBondContact O-N 2.68Å; V749-R753 PolarHBondContact O-N 3.49Å; V749-K820 HydrophobicContact CG1-CB 3.94Å; V749-K820 HydrophobicContact CG2-CB 3.87Å; V749-K820 HydrophobicContact CG2-CD 4.42Å; V749-M821 HydrophobicContact CG1-CB 4.32Å; V749-M821 HydrophobicContact CG1-CG 3.56Å; V749-V824 HydrophobicContact CG2-CG2 4.48Å; V749-L825 HydrophobicContact CG1-CD1 3.97Å; V749-L825 HydrophobicContact CG1-CG 4.05Å
750	E	94.6	Very high	93.3	Very high	45 Å²	45	67.8 Å²	67.8	21%	0.21	33%	0.333	C	S	.	.	H	α-helix	trans	-64.5	-42.7	169.3	-163	81.7	-98.7	0	0	111	R746 T747 E752 R753 L754	R746-E750 WeakPolarHBondContact O-CB 3.37Å; R746-E750 PolarHBondContact O-N 3.17Å; T747-E750 PolarHBondContact O-N 2.75Å; E750-E752 PolarHBondContact O-N 3.07Å; E750-R753 WeakPolarHBondContact O-CB 3.31Å; E750-R753 PolarHBondContact O-N 3Å; E750-R753 WeakPolarHBondContact OE1-CD 3.46Å; E750-R753 IonicContact OE1-CZ 3.34Å; E750-R753 IonicContact OE1-NE 2.89Å; E750-R753 IonicContact OE1-NH1 3.11Å; E750-R753 PolarHBondContact OE1-NH1 3.36Å; E750-L754 HydrophobicContact CG-CD1 4.23Å; E750-L754 WeakPolarHBondContact O-CB 3.18Å; E750-L754 VanDerWaalsContact O-CG 3.3Å; E750-L754 WeakPolarHBondContact O-CG 3.23Å; E750-L754 PolarHBondContact O-N 3.47Å
751	E	95.7	Very high	93.9	Very high	78 Å²	78	69.3 Å²	69.3	36%	0.364	34%	0.338	S	S	.	.	H	α-helix	trans	-61.8	-40.9	173.5	-74.8	-177.7	-153.6	0	0	112.8	T747 R753 L754 R755	T747-E751 WeakPolarHBondContact O-CG 3.25Å; T747-E751 PolarHBondContact O-N 3.35Å; E751-R753 VanDerWaalsContact C-N 3.32Å; E751-L754 PolarHBondContact O-N 3.27Å; E751-R755 VanDerWaalsContact CB-NH2 3.32Å; E751-R755 WeakPolarHBondContact O-CG 3.32Å; E751-R755 PolarHBondContact O-N 3.26Å; E751-R755 PolarHBondContact O-NE 3.26Å; E751-R755 IonicContact OE2-CZ 2.71Å; E751-R755 IonicContact OE2-NH1 3.34Å; E751-R755 PolarHBondContact OE2-NH1 3.47Å; E751-R755 IonicContact OE2-NH2 3.6Å; E751-R755 PolarHBondContact OE2-NH2 2.92Å
752	E	96.2	Very high	94.4	Very high	59 Å²	59	68.7 Å²	68.7	28%	0.276	33%	0.328	S	S	.	.	H	α-helix	trans	-62.8	-39.4	174.4	-73.9	-176.5	-153.7	0	0	111.7	L748 V749 E750 Y756 L817 K820	L748-E752 PolarHBondContact O-N 2.72Å; L748-E752 VanDerWaalsContact O-N 3.11Å; V749-E752 PolarHBondContact O-N 2.68Å; E750-E752 PolarHBondContact O-N 3.07Å; E752-Y756 VanDerWaalsContact O-CB 3.22Å; E752-Y756 WeakPolarHBondContact O-CB 3.41Å; E752-Y756 PolarHBondContact O-N 3.19Å; E752-L817 HydrophobicContact CB-CD1 3.84Å; E752-K820 IonicContact OE1-NZ 2.98Å; E752-K820 PolarHBondContact OE1-NZ 2.82Å; E752-K820 WeakPolarHBondContact OE2-CD 3.29Å; E752-K820 WeakPolarHBondContact OE2-CE 3.26Å; E752-K820 IonicContact OE2-NZ 2.93Å; E752-K820 PolarHBondContact OE2-NZ 3.34Å
753	R	95.9	Very high	94.9	Very high	24 Å²	24	63.3 Å²	63.3	9%	0.091	30%	0.3	C	S	.	.	H	α-helix	trans	-63.2	-42.2	172.8	178.3	-150.3	167.7	-160.6	-11.1	111.9	V749 E750 E751 L757 L817 M821 E830 F834	V749-R753 PolarHBondContact O-N 3.49Å; E750-R753 WeakPolarHBondContact O-CB 3.31Å; E750-R753 PolarHBondContact O-N 3Å; E750-R753 WeakPolarHBondContact OE1-CD 3.46Å; E750-R753 IonicContact OE1-CZ 3.34Å; E750-R753 IonicContact OE1-NE 2.89Å; E750-R753 IonicContact OE1-NH1 3.11Å; E750-R753 PolarHBondContact OE1-NH1 3.36Å; E751-R753 VanDerWaalsContact C-N 3.32Å; R753-L757 HydrophobicContact CG-CD1 4.04Å; R753-L757 WeakPolarHBondContact O-CB 3.34Å; R753-L757 WeakPolarHBondContact O-CG 3.44Å; R753-L757 PolarHBondContact O-N 3.48Å; R753-L817 HydrophobicContact CB-CD1 4.28Å; R753-L817 HydrophobicContact CB-CD2 4.49Å; R753-M821 HydrophobicContact CB-CE 4.33Å; R753-M821 HydrophobicContact CB-SD 3.98Å; R753-M821 HydrophobicContact CG-CE 3.84Å; R753-M821 HydrophobicContact CG-SD 3.96Å; R753-E830 IonicContact CZ-OE2 2.7Å; R753-E830 IonicContact NH1-OE2 3.81Å; R753-E830 PolarHBondContact NH1-OE2 3.07Å; R753-E830 IonicContact NH2-OE2 2.74Å; R753-E830 PolarHBondContact NH2-OE2 2.92Å; R753-F834 HydrophobicContact CG-CD1 4.4Å; R753-F834 HydrophobicContact CG-CE1 4.36Å
754	L	95.7	Very high	95.3	Very high	101 Å²	101	61.2 Å²	61.2	53%	0.529	29%	0.292	S	S	.	.	H	α-helix	trans	-71.5	-38.9	-178.6	-71.9	169.8	0	0	0	112.5	E750 E751 L757 N758	E750-L754 HydrophobicContact CG-CD1 4.23Å; E750-L754 WeakPolarHBondContact O-CB 3.18Å; E750-L754 VanDerWaalsContact O-CG 3.3Å; E750-L754 WeakPolarHBondContact O-CG 3.23Å; E750-L754 PolarHBondContact O-N 3.47Å; E751-L754 PolarHBondContact O-N 3.27Å; L754-L757 PolarHBondContact O-N 3.45Å; L754-N758 PolarHBondContact O-N 2.89Å
755	R	96.8	Very high	95.7	Very high	126 Å²	126	61.3 Å²	61.3	48%	0.475	30%	0.295	S	S	.	.	H	α-helix	trans	-59.1	-53.6	170.4	-76.4	-178.5	-75.9	-97.1	-0.8	110.6	E751 L757 N758 D759	E751-R755 VanDerWaalsContact CB-NH2 3.32Å; E751-R755 WeakPolarHBondContact O-CG 3.32Å; E751-R755 PolarHBondContact O-N 3.26Å; E751-R755 PolarHBondContact O-NE 3.26Å; E751-R755 IonicContact OE2-CZ 2.71Å; E751-R755 IonicContact OE2-NH1 3.34Å; E751-R755 PolarHBondContact OE2-NH1 3.47Å; E751-R755 IonicContact OE2-NH2 3.6Å; E751-R755 PolarHBondContact OE2-NH2 2.92Å; R755-L757 VanDerWaalsContact C-N 3.29Å; R755-L757 PolarHBondContact O-N 2.94Å; R755-N758 WeakPolarHBondContact O-CA 3.35Å; R755-N758 WeakPolarHBondContact O-CB 3.19Å; R755-N758 PolarHBondContact O-N 2.81Å; R755-D759 PolarHBondContact O-N 2.72Å
756	Y	97.4	Very high	96	Very high	9 Å²	9	61.4 Å²	61.4	4%	0.035	30%	0.295	C	S	.	.	H	α-helix	trans	-51.4	-45	176.7	179.1	-74.8	0	0	0	113.2	E752 N758 D759 E760 L810 F814 L817 F834 E838 L842	E752-Y756 VanDerWaalsContact O-CB 3.22Å; E752-Y756 WeakPolarHBondContact O-CB 3.41Å; E752-Y756 PolarHBondContact O-N 3.19Å; Y756-N758 VanDerWaalsContact C-N 3.35Å; Y756-D759 PolarHBondContact O-N 3.09Å; Y756-E760 PolarHBondContact O-N 2.78Å; Y756-L810 HydrophobicContact CD1-CD1 4.36Å; Y756-L810 HydrophobicContact CD2-CD1 3.44Å; Y756-L810 VanDerWaalsContact CD2-CD1 3.44Å; Y756-L810 HydrophobicContact CD2-CG 4.26Å; Y756-L810 HydrophobicContact CE1-CD1 4.31Å; Y756-L810 HydrophobicContact CE1-CG 4.42Å; Y756-L810 HydrophobicContact CE2-CD1 3.42Å; Y756-L810 VanDerWaalsContact CE2-CD1 3.42Å; Y756-L810 HydrophobicContact CE2-CG 3.71Å; Y756-L810 WeakPolarHBondContact CE2-O 3.27Å; Y756-L810 HydrophobicContact CG-CD1 3.91Å; Y756-F814 HydrophobicContact CE2-CB 3.89Å; Y756-F814 HydrophobicContact CE2-CD2 4.33Å; Y756-L817 HydrophobicContact CD1-CD2 4.24Å; Y756-L817 HydrophobicContact CD2-CD2 3.74Å; Y756-L817 HydrophobicContact CE2-CD2 4.48Å; Y756-L817 HydrophobicContact CG-CD2 3.62Å; Y756-F834 AromaticContact CD1-CE2 3.75Å; Y756-F834 HydrophobicContact CD1-CE2 3.75Å; Y756-F834 AromaticContact CD1-CZ 3.54Å; Y756-F834 HydrophobicContact CD1-CZ 3.54Å; Y756-F834 AromaticContact CE1-CE2 3.77Å; Y756-F834 HydrophobicContact CE1-CE2 3.77Å; Y756-F834 AromaticContact CE1-CZ 3.65Å; Y756-F834 HydrophobicContact CE1-CZ 3.65Å; Y756-F834 HydrophobicContact CG-CZ 4.28Å; Y756-E838 HydrophobicContact CE1-CG 3.68Å; Y756-E838 WeakPolarHBondContact OH-CG 3.49Å; Y756-E838 PolarHBondContact OH-OE1 3.44Å; Y756-L842 WeakPolarHBondContact OH-CD1 3.08Å; Y756-L842 WeakPolarHBondContact OH-CD2 3.43Å
757	L	95.3	Very high	96.2	Very high	44 Å²	44	56.8 Å²	56.8	23%	0.23	28%	0.278	C	S	.	.	H	α-helix	trans	-69.3	-31.2	178.6	-77.1	168.1	0	0	0	112.9	R753 L754 R755 E760 E761 F834	R753-L757 HydrophobicContact CG-CD1 4.04Å; R753-L757 WeakPolarHBondContact O-CB 3.34Å; R753-L757 WeakPolarHBondContact O-CG 3.44Å; R753-L757 PolarHBondContact O-N 3.48Å; L754-L757 PolarHBondContact O-N 3.45Å; R755-L757 VanDerWaalsContact C-N 3.29Å; R755-L757 PolarHBondContact O-N 2.94Å; L757-E760 PolarHBondContact O-N 2.85Å; L757-E761 WeakPolarHBondContact O-CB 3.37Å; L757-E761 PolarHBondContact O-N 3.3Å; L757-F834 HydrophobicContact CD1-CD2 4.46Å; L757-F834 HydrophobicContact CD2-CD2 3.93Å; L757-F834 HydrophobicContact CD2-CE2 3.74Å; L757-F834 HydrophobicContact CG-CD2 4.36Å; L757-F834 HydrophobicContact CG-CE2 4.02Å
758	N	96.8	Very high	96.5	Very high	100 Å²	100	56.2 Å²	56.2	54%	0.535	27%	0.273	S	S	.	.	H	α-helix	trans	-71.7	-38.1	174.9	-167.5	-122.5	0	0	0	111.5	L754 R755 Y756 E761 L762	L754-N758 PolarHBondContact O-N 2.89Å; R755-N758 WeakPolarHBondContact O-CA 3.35Å; R755-N758 WeakPolarHBondContact O-CB 3.19Å; R755-N758 PolarHBondContact O-N 2.81Å; Y756-N758 VanDerWaalsContact C-N 3.35Å; N758-E761 PolarHBondContact O-N 3.28Å; N758-L762 WeakPolarHBondContact O-CB 3.44Å; N758-L762 PolarHBondContact O-N 3.38Å
759	D	95.8	Very high	96.6	Very high	76 Å²	76	56.3 Å²	56.3	41%	0.406	27%	0.274	S	S	.	.	H	α-helix	trans	-63.8	-40.7	171.4	-58.6	-41.4	0	0	0	111.1	R755 Y756 L762 I763 L810	R755-D759 PolarHBondContact O-N 2.72Å; Y756-D759 PolarHBondContact O-N 3.09Å; D759-L762 PolarHBondContact O-N 3.05Å; D759-I763 WeakPolarHBondContact O-CB 3.48Å; D759-I763 VanDerWaalsContact O-CG1 3.29Å; D759-I763 WeakPolarHBondContact O-CG1 3.5Å; D759-I763 PolarHBondContact O-N 3.01Å; D759-L810 HydrophobicContact CB-CD1 3.95Å
760	E	95.8	Very high	96.7	Very high	6 Å²	6	56.7 Å²	56.7	3%	0.028	28%	0.276	C	S	.	.	H	α-helix	trans	-61.4	-45.1	174.5	-158.3	-122.9	145.7	0	0	112.2	Y756 L757 T764 L810 R841 L845	Y756-E760 PolarHBondContact O-N 2.78Å; L757-E760 PolarHBondContact O-N 2.85Å; E760-T764 WeakPolarHBondContact O-CB 3.32Å; E760-T764 PolarHBondContact O-N 2.99Å; E760-T764 PolarHBondContact O-OG1 2.88Å; E760-L810 HydrophobicContact CB-CD2 3.95Å; E760-L810 HydrophobicContact CG-CD2 4.22Å; E760-R841 VanDerWaalsContact CD-NE 3.31Å; E760-R841 IonicContact OE1-CZ 3.51Å; E760-R841 IonicContact OE1-NE 3.15Å; E760-R841 PolarHBondContact OE1-NE 3.38Å; E760-R841 IonicContact OE1-NH2 3.52Å; E760-R841 PolarHBondContact OE1-NH2 3.03Å; E760-R841 IonicContact OE2-CZ 2.72Å; E760-R841 IonicContact OE2-NE 3.35Å; E760-R841 PolarHBondContact OE2-NE 3.39Å; E760-R841 IonicContact OE2-NH2 2.69Å; E760-R841 PolarHBondContact OE2-NH2 3.4Å; E760-L845 HydrophobicContact CG-CD1 4.18Å
761	E	96.9	Very high	96.8	Very high	122 Å²	122	56.5 Å²	56.5	57%	0.57	28%	0.275	S	S	*	.	H	α-helix	trans	-67.8	-40.6	178.9	-172.9	168.5	-144.4	0	0	111.7	L757 N758 T764 Q765	L757-E761 WeakPolarHBondContact O-CB 3.37Å; L757-E761 PolarHBondContact O-N 3.3Å; N758-E761 PolarHBondContact O-N 3.28Å; E761-T764 WeakPolarHBondContact O-CB 3.48Å; E761-T764 PolarHBondContact O-N 2.84Å; E761-Q765 WeakPolarHBondContact O-CB 3.49Å; E761-Q765 PolarHBondContact O-N 3.24Å
762	L	97.2	Very high	96.8	Very high	90 Å²	90	57.4 Å²	57.4	47%	0.471	28%	0.278	S	S	.	.	H	α-helix	trans	-63.2	-49.9	175.7	178.6	60.5	0	0	0	111.8	N758 D759 T764 Q765 Q766	N758-L762 WeakPolarHBondContact O-CB 3.44Å; N758-L762 PolarHBondContact O-N 3.38Å; D759-L762 PolarHBondContact O-N 3.05Å; L762-T764 VanDerWaalsContact C-N 3.29Å; L762-T764 PolarHBondContact O-N 3.45Å; L762-Q765 PolarHBondContact O-N 3.22Å; L762-Q766 HydrophobicContact CD1-CG 4.15Å; L762-Q766 WeakPolarHBondContact O-CB 3.38Å; L762-Q766 WeakPolarHBondContact O-CG 3.11Å; L762-Q766 PolarHBondContact O-N 3.47Å
763	I	96.6	Very high	96.7	Very high	9 Å²	9	56 Å²	56	5%	0.046	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-40.8	176.3	-69.2	168.5	0	0	0	110.4	D759 Q765 L767 L803 L807 L810	D759-I763 WeakPolarHBondContact O-CB 3.48Å; D759-I763 VanDerWaalsContact O-CG1 3.29Å; D759-I763 WeakPolarHBondContact O-CG1 3.5Å; D759-I763 PolarHBondContact O-N 3.01Å; I763-Q765 PolarHBondContact O-N 2.94Å; I763-L767 VanDerWaalsContact O-CB 3.23Å; I763-L767 WeakPolarHBondContact O-CB 3.48Å; I763-L767 PolarHBondContact O-N 2.9Å; I763-L803 HydrophobicContact CG2-CD2 4.4Å; I763-L807 HydrophobicContact CG2-CB 4.19Å; I763-L807 HydrophobicContact CG2-CD1 4.3Å; I763-L810 HydrophobicContact CD1-CD2 4.15Å
764	T	97.3	Very high	96.7	Very high	28 Å²	28	55.1 Å²	55.1	17%	0.172	27%	0.272	C	S	.	.	H	α-helix	trans	-59.3	-46.7	175.8	-66.3	0	0	0	0	111.3	E760 E761 L762 L767 N768 L845	E760-T764 WeakPolarHBondContact O-CB 3.32Å; E760-T764 PolarHBondContact O-N 2.99Å; E760-T764 PolarHBondContact O-OG1 2.88Å; E761-T764 WeakPolarHBondContact O-CB 3.48Å; E761-T764 PolarHBondContact O-N 2.84Å; L762-T764 VanDerWaalsContact C-N 3.29Å; L762-T764 PolarHBondContact O-N 3.45Å; T764-L767 PolarHBondContact O-N 2.85Å; T764-N768 PolarHBondContact O-N 2.81Å; T764-N768 PolarHBondContact O-ND2 2.86Å; T764-N768 PolarHBondContact O-OD1 3.2Å; T764-L845 HydrophobicContact CG2-CD2 4.45Å
765	Q	97.9	Very high	96.5	Very high	66 Å²	66	55.1 Å²	55.1	31%	0.308	27%	0.269	S	S	.	.	H	α-helix	trans	-68.1	-45.7	179.7	-177.7	58.3	30	0	0	112.3	E761 L762 I763 L767 N768 D769	E761-Q765 WeakPolarHBondContact O-CB 3.49Å; E761-Q765 PolarHBondContact O-N 3.24Å; L762-Q765 PolarHBondContact O-N 3.22Å; I763-Q765 PolarHBondContact O-N 2.94Å; Q765-L767 VanDerWaalsContact C-N 3.28Å; Q765-L767 PolarHBondContact O-N 3.16Å; Q765-N768 WeakPolarHBondContact O-CB 3.5Å; Q765-N768 PolarHBondContact O-N 3.37Å; Q765-N768 VanDerWaalsContact O-N 3.14Å; Q765-D769 VanDerWaalsContact NE2-CG 3.28Å; Q765-D769 PolarHBondContact NE2-OD1 2.77Å; Q765-D769 PolarHBondContact NE2-OD2 3.48Å; Q765-D769 PolarHBondContact O-N 2.93Å
766	Q	97.6	Very high	96.3	Very high	88 Å²	88	53.9 Å²	53.9	41%	0.411	27%	0.267	S	S	.	.	H	α-helix	trans	-60.8	-38.2	176.8	-71.6	176.2	-37.7	0	0	111.7	L762 L770 L803	L762-Q766 HydrophobicContact CD1-CG 4.15Å; L762-Q766 WeakPolarHBondContact O-CB 3.38Å; L762-Q766 WeakPolarHBondContact O-CG 3.11Å; L762-Q766 PolarHBondContact O-N 3.47Å; Q766-L770 VanDerWaalsContact O-CB 3.25Å; Q766-L770 WeakPolarHBondContact O-CB 3.38Å; Q766-L770 PolarHBondContact O-N 3.11Å; Q766-L803 HydrophobicContact CB-CD1 4.11Å; Q766-L803 HydrophobicContact CB-CD2 3.61Å; Q766-L803 HydrophobicContact CB-CG 4.49Å; Q766-L803 HydrophobicContact CG-CD2 4.46Å; Q766-L803 VanDerWaalsContact OE1-CD2 3.3Å
767	L	97.8	Very high	95.9	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67.6	-41.3	173.6	-175.2	59.3	0	0	0	112	I763 T764 Q765 D769 L770 E771 L800 L803 L845 R848 C849 V852	I763-L767 VanDerWaalsContact O-CB 3.23Å; I763-L767 WeakPolarHBondContact O-CB 3.48Å; I763-L767 PolarHBondContact O-N 2.9Å; T764-L767 PolarHBondContact O-N 2.85Å; Q765-L767 VanDerWaalsContact C-N 3.28Å; Q765-L767 PolarHBondContact O-N 3.16Å; L767-D769 VanDerWaalsContact C-N 3.32Å; L767-D769 PolarHBondContact O-N 2.73Å; L767-L770 PolarHBondContact O-N 2.83Å; L767-E771 WeakPolarHBondContact O-CB 3.43Å; L767-E771 VanDerWaalsContact O-CG 3.24Å; L767-E771 WeakPolarHBondContact O-CG 3.39Å; L767-E771 PolarHBondContact O-N 2.9Å; L767-L800 HydrophobicContact CD1-CD1 4.22Å; L767-L803 HydrophobicContact CB-CD1 4.5Å; L767-L845 HydrophobicContact CD2-CD2 4.38Å; L767-R848 HydrophobicContact CD2-CB 3.76Å; L767-C849 VanDerWaalsContact CD2-SG 3.55Å; L767-V852 HydrophobicContact CD1-CG2 4.02Å
768	N	97.9	Very high	95.5	Very high	39 Å²	39	55 Å²	55	21%	0.209	27%	0.272	C	S	.	.	H	α-helix	trans	-60.6	-39.7	175.6	-62.4	-19.3	0	0	0	112.3	T764 Q765 K772 R848	T764-N768 PolarHBondContact O-N 2.81Å; T764-N768 PolarHBondContact O-ND2 2.86Å; T764-N768 PolarHBondContact O-OD1 3.2Å; Q765-N768 WeakPolarHBondContact O-CB 3.5Å; Q765-N768 PolarHBondContact O-N 3.37Å; Q765-N768 VanDerWaalsContact O-N 3.14Å; N768-K772 WeakPolarHBondContact O-CD 3.42Å; N768-K772 VanDerWaalsContact O-CE 3.31Å; N768-K772 WeakPolarHBondContact O-CE 3.27Å; N768-K772 VanDerWaalsContact O-CG 3.24Å; N768-K772 WeakPolarHBondContact O-CG 3.25Å; N768-K772 PolarHBondContact O-N 3.16Å; N768-R848 PolarHBondContact OD1-NH1 3.35Å; N768-R848 PolarHBondContact OD1-NH2 3.48Å
769	D	97.5	Very high	95.1	Very high	73 Å²	73	55.9 Å²	55.9	39%	0.39	27%	0.267	S	S	.	.	H	α-helix	trans	-79	-31.9	-179.3	-67.3	-26.9	0	0	0	111.9	Q765 L767 K772 S773	Q765-D769 VanDerWaalsContact NE2-CG 3.28Å; Q765-D769 PolarHBondContact NE2-OD1 2.77Å; Q765-D769 PolarHBondContact NE2-OD2 3.48Å; Q765-D769 PolarHBondContact O-N 2.93Å; L767-D769 VanDerWaalsContact C-N 3.32Å; L767-D769 PolarHBondContact O-N 2.73Å; D769-K772 IonicContact OD1-NZ 3.95Å; D769-K772 PolarHBondContact OD1-NZ 3.43Å; D769-S773 WeakPolarHBondContact O-CB 3.23Å; D769-S773 PolarHBondContact O-N 2.84Å
770	L	97.1	Very high	94.5	Very high	7 Å²	7	54 Å²	54	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-63.5	-48.6	168.4	-178.8	67	0	0	0	111.4	Q766 L767 K772 S773 V774 K796 V799 L800 L803 V852	Q766-L770 VanDerWaalsContact O-CB 3.25Å; Q766-L770 WeakPolarHBondContact O-CB 3.38Å; Q766-L770 PolarHBondContact O-N 3.11Å; L767-L770 PolarHBondContact O-N 2.83Å; L770-K772 PolarHBondContact O-N 3.28Å; L770-S773 WeakPolarHBondContact O-CA 3.33Å; L770-S773 WeakPolarHBondContact O-CB 3.48Å; L770-S773 PolarHBondContact O-N 3.08Å; L770-S773 PolarHBondContact O-OG 2.91Å; L770-V774 HydrophobicContact CD1-CG2 4.28Å; L770-V774 HydrophobicContact CG-CG2 4.45Å; L770-V774 WeakPolarHBondContact O-CG2 3.46Å; L770-V774 PolarHBondContact O-N 3.03Å; L770-K796 HydrophobicContact CD1-CB 3.88Å; L770-K796 HydrophobicContact CD1-CD 4.22Å; L770-K796 HydrophobicContact CD1-CG 4.28Å; L770-V799 HydrophobicContact CD1-CG1 4.36Å; L770-V799 HydrophobicContact CD2-CG1 4.44Å; L770-L800 HydrophobicContact CD2-CB 3.74Å; L770-L800 HydrophobicContact CD2-CD1 3.68Å; L770-L800 HydrophobicContact CD2-CG 4.23Å; L770-L803 HydrophobicContact CD2-CD1 3.88Å; L770-V852 HydrophobicContact CD2-CG1 4.14Å; L770-V852 HydrophobicContact CG-CG1 4.16Å
771	E	96.8	Very high	93.8	Very high	42 Å²	42	54 Å²	54	20%	0.196	26%	0.258	C	S	.	.	H	α-helix	trans	-49.9	-55.6	174.1	-79	166.7	174.8	0	0	110.8	L767 S773 V774 E775 R848 V852	L767-E771 WeakPolarHBondContact O-CB 3.43Å; L767-E771 VanDerWaalsContact O-CG 3.24Å; L767-E771 WeakPolarHBondContact O-CG 3.39Å; L767-E771 PolarHBondContact O-N 2.9Å; E771-S773 VanDerWaalsContact C-N 3.26Å; E771-S773 PolarHBondContact O-N 2.9Å; E771-V774 PolarHBondContact O-N 3.4Å; E771-V774 VanDerWaalsContact O-N 3.13Å; E771-E775 WeakPolarHBondContact O-CG 3.44Å; E771-E775 PolarHBondContact O-N 3.17Å; E771-R848 WeakPolarHBondContact OE1-CD 3.18Å; E771-R848 IonicContact OE1-CZ 3.83Å; E771-R848 IonicContact OE1-NE 3.28Å; E771-R848 IonicContact OE1-NH1 3.71Å; E771-R848 PolarHBondContact OE1-NH1 2.9Å; E771-R848 IonicContact OE2-CZ 2.74Å; E771-R848 IonicContact OE2-NH1 2.71Å; E771-R848 PolarHBondContact OE2-NH1 3.44Å; E771-V852 HydrophobicContact CG-CG2 3.5Å
772	K	96.8	Very high	93	Very high	97 Å²	97	51.3 Å²	51.3	42%	0.422	25%	0.252	S	S	.	.	H	α-helix	trans	-56.3	-37.5	176.2	-66	163.6	-153.8	163.2	0	112.9	N768 D769 L770 K776	N768-K772 WeakPolarHBondContact O-CD 3.42Å; N768-K772 VanDerWaalsContact O-CE 3.31Å; N768-K772 WeakPolarHBondContact O-CE 3.27Å; N768-K772 VanDerWaalsContact O-CG 3.24Å; N768-K772 WeakPolarHBondContact O-CG 3.25Å; N768-K772 PolarHBondContact O-N 3.16Å; D769-K772 IonicContact OD1-NZ 3.95Å; D769-K772 PolarHBondContact OD1-NZ 3.43Å; L770-K772 PolarHBondContact O-N 3.28Å; K772-K776 WeakPolarHBondContact O-CB 3.14Å; K772-K776 PolarHBondContact O-N 3.13Å
773	S	94.4	Very high	92	Very high	30 Å²	30	53.7 Å²	53.7	21%	0.21	26%	0.261	C	S	.	.	H	α-helix	trans	-70.4	-39.5	178.9	80.2	0	0	0	0	112.1	D769 L770 E771 K776 I777	D769-S773 WeakPolarHBondContact O-CB 3.23Å; D769-S773 PolarHBondContact O-N 2.84Å; L770-S773 WeakPolarHBondContact O-CA 3.33Å; L770-S773 WeakPolarHBondContact O-CB 3.48Å; L770-S773 PolarHBondContact O-N 3.08Å; L770-S773 PolarHBondContact O-OG 2.91Å; E771-S773 VanDerWaalsContact C-N 3.26Å; E771-S773 PolarHBondContact O-N 2.9Å; S773-K776 WeakPolarHBondContact O-CB 3.38Å; S773-K776 PolarHBondContact O-N 3.26Å; S773-I777 VanDerWaalsContact O-CG1 3.27Å; S773-I777 WeakPolarHBondContact O-CG1 3.35Å; S773-I777 PolarHBondContact O-N 3.07Å
774	V	94.9	Very high	90.5	Very high	4 Å²	4	58.3 Å²	58.3	2%	0.024	29%	0.286	C	S	.	.	H	α-helix	trans	-70.7	-41.3	176.6	176.2	0	0	0	0	110.6	L770 E771 K776 I777 Q778 V852 L856 I859	L770-V774 HydrophobicContact CD1-CG2 4.28Å; L770-V774 HydrophobicContact CG-CG2 4.45Å; L770-V774 WeakPolarHBondContact O-CG2 3.46Å; L770-V774 PolarHBondContact O-N 3.03Å; E771-V774 PolarHBondContact O-N 3.4Å; E771-V774 VanDerWaalsContact O-N 3.13Å; V774-K776 VanDerWaalsContact C-N 3.31Å; V774-K776 PolarHBondContact O-N 3.02Å; V774-I777 PolarHBondContact O-N 3.26Å; V774-Q778 VanDerWaalsContact O-CB 3.32Å; V774-Q778 WeakPolarHBondContact O-CB 3.46Å; V774-Q778 PolarHBondContact O-N 3.36Å; V774-V852 HydrophobicContact CB-CG1 4.35Å; V774-V852 HydrophobicContact CG2-CG1 3.85Å; V774-L856 HydrophobicContact CG1-CD2 4.03Å; V774-L856 HydrophobicContact CG1-CG 4.05Å; V774-L856 HydrophobicContact CG2-CD1 4.25Å; V774-L856 HydrophobicContact CG2-CD2 3.68Å; V774-L856 HydrophobicContact CG2-CG 3.87Å; V774-I859 HydrophobicContact CG1-CD1 3.83Å
775	E	92.9	Very high	89	Confident	102 Å²	102	62.2 Å²	62.2	48%	0.477	30%	0.302	S	S	.	.	H	α-helix	trans	-59.8	-38.7	170.2	-72.9	177.7	-178.7	0	0	112.5	E771 Q778 R779	E771-E775 WeakPolarHBondContact O-CG 3.44Å; E771-E775 PolarHBondContact O-N 3.17Å; E775-Q778 PolarHBondContact O-N 3.03Å; E775-R779 WeakPolarHBondContact O-CB 3.4Å; E775-R779 WeakPolarHBondContact O-CG 3.43Å; E775-R779 PolarHBondContact O-N 3.12Å; E775-R779 PolarHBondContact O-NE 2.92Å
776	K	91.4	Very high	87.1	Confident	99 Å²	99	67.6 Å²	67.6	43%	0.43	32%	0.319	S	S	.	.	H	α-helix	trans	-64.4	-49.6	174.4	-174.1	-165.7	169.3	-79.9	0	110.6	K772 S773 V774 Q778 R779 D780	K772-K776 WeakPolarHBondContact O-CB 3.14Å; K772-K776 PolarHBondContact O-N 3.13Å; S773-K776 WeakPolarHBondContact O-CB 3.38Å; S773-K776 PolarHBondContact O-N 3.26Å; V774-K776 VanDerWaalsContact C-N 3.31Å; V774-K776 PolarHBondContact O-N 3.02Å; K776-Q778 VanDerWaalsContact C-N 3.29Å; K776-Q778 PolarHBondContact O-N 3.36Å; K776-R779 PolarHBondContact O-N 3.2Å; K776-D780 IonicContact NZ-OD2 3.15Å; K776-D780 PolarHBondContact NZ-OD2 3.2Å; K776-D780 WeakPolarHBondContact O-CB 3.4Å; K776-D780 VanDerWaalsContact O-CG 3.26Å; K776-D780 PolarHBondContact O-N 2.95Å
777	I	88.4	Confident	85.5	Confident	4 Å²	4	70.8 Å²	70.8	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-57.3	-44.8	176.5	-70.6	168.1	0	0	0	110	S773 V774 R779 D780 V781 V788 E792 L793 K796 I859	S773-I777 VanDerWaalsContact O-CG1 3.27Å; S773-I777 WeakPolarHBondContact O-CG1 3.35Å; S773-I777 PolarHBondContact O-N 3.07Å; V774-I777 PolarHBondContact O-N 3.26Å; I777-R779 PolarHBondContact O-N 2.71Å; I777-D780 PolarHBondContact O-N 2.69Å; I777-V781 VanDerWaalsContact O-CG2 3.31Å; I777-V781 WeakPolarHBondContact O-CG2 3.2Å; I777-V781 PolarHBondContact O-N 2.88Å; I777-V788 HydrophobicContact CG2-CB 4.47Å; I777-V788 HydrophobicContact CG2-CG1 3.91Å; I777-V788 HydrophobicContact CG2-CG2 3.76Å; I777-E792 HydrophobicContact CD1-CG 4.26Å; I777-L793 HydrophobicContact CG2-CD1 4.23Å; I777-K796 HydrophobicContact CD1-CG 4.03Å; I777-I859 HydrophobicContact CG2-CD1 4.39Å; I777-I859 HydrophobicContact CG2-CG2 4.14Å
778	Q	88.2	Confident	84	Confident	73 Å²	73	71.6 Å²	71.6	34%	0.341	34%	0.343	S	S	.	.	H	α-helix	trans	-62.5	-40.5	177.5	-162.2	179.5	33.2	0	0	112.8	V774 E775 K776 S782 I859	V774-Q778 VanDerWaalsContact O-CB 3.32Å; V774-Q778 WeakPolarHBondContact O-CB 3.46Å; V774-Q778 PolarHBondContact O-N 3.36Å; E775-Q778 PolarHBondContact O-N 3.03Å; K776-Q778 VanDerWaalsContact C-N 3.29Å; K776-Q778 PolarHBondContact O-N 3.36Å; Q778-S782 WeakPolarHBondContact O-CB 3.22Å; Q778-S782 PolarHBondContact O-N 2.98Å; Q778-S782 PolarHBondContact O-OG 2.99Å; Q778-I859 HydrophobicContact CB-CD1 3.87Å; Q778-I859 HydrophobicContact CB-CG1 4.36Å; Q778-I859 HydrophobicContact CG-CD1 4.19Å; Q778-I859 HydrophobicContact CG-CG1 4.22Å
779	R	87.4	Confident	82.8	Confident	118 Å²	118	73 Å²	73	45%	0.445	35%	0.354	S	S	.	.	H	α-helix	trans	-67.2	-43.3	173.1	-79.6	-177.1	-75.3	97.4	-3.6	111.9	E775 K776 I777 V781 S782 H783	E775-R779 WeakPolarHBondContact O-CB 3.4Å; E775-R779 WeakPolarHBondContact O-CG 3.43Å; E775-R779 PolarHBondContact O-N 3.12Å; E775-R779 PolarHBondContact O-NE 2.92Å; K776-R779 PolarHBondContact O-N 3.2Å; I777-R779 PolarHBondContact O-N 2.71Å; R779-V781 VanDerWaalsContact C-N 3.34Å; R779-V781 PolarHBondContact O-N 2.72Å; R779-S782 WeakPolarHBondContact CA-OG 3.39Å; R779-S782 PolarHBondContact O-N 3.43Å; R779-S782 PolarHBondContact O-OG 2.76Å; R779-H783 VanDerWaalsContact O-CB 3.27Å; R779-H783 WeakPolarHBondContact O-CB 3.21Å; R779-H783 PolarHBondContact O-N 2.88Å; R779-H783 PolarHBondContact O-ND1 3.01Å; R779-H783 VanDerWaalsContact O-ND1 3.13Å
780	D	83.9	Confident	81.8	Confident	38 Å²	38	71.2 Å²	71.2	20%	0.203	35%	0.353	C	S	.	.	H	α-helix	trans	-63.9	-39.6	-180	-70.5	-13	0	0	0	111.4	K776 I777 N784	K776-D780 IonicContact NZ-OD2 3.15Å; K776-D780 PolarHBondContact NZ-OD2 3.2Å; K776-D780 WeakPolarHBondContact O-CB 3.4Å; K776-D780 VanDerWaalsContact O-CG 3.26Å; K776-D780 PolarHBondContact O-N 2.95Å; I777-D780 PolarHBondContact O-N 2.69Å; D780-N784 WeakPolarHBondContact O-CB 3.38Å; D780-N784 PolarHBondContact O-N 2.93Å
781	V	81.6	Confident	81.2	Confident	6 Å²	6	75.6 Å²	75.6	4%	0.036	38%	0.382	C	S	.	.	H	α-helix	trans	-59.4	-57.5	169.2	169.1	0	0	0	0	110.9	I777 R779 H783 H785 V788 I859 W868	I777-V781 VanDerWaalsContact O-CG2 3.31Å; I777-V781 WeakPolarHBondContact O-CG2 3.2Å; I777-V781 PolarHBondContact O-N 2.88Å; R779-V781 VanDerWaalsContact C-N 3.34Å; R779-V781 PolarHBondContact O-N 2.72Å; V781-H783 PolarHBondContact O-N 2.73Å; V781-H785 VanDerWaalsContact O-CA 3.3Å; V781-H785 WeakPolarHBondContact O-CA 3.23Å; V781-H785 PolarHBondContact O-N 2.88Å; V781-H785 VanDerWaalsContact O-N 3.13Å; V781-V788 HydrophobicContact CG2-CB 4.35Å; V781-V788 HydrophobicContact CG2-CG2 3.31Å; V781-I859 HydrophobicContact CG2-CG2 4.36Å; V781-W868 HydrophobicContact CG1-CH2 3.69Å; V781-W868 HydrophobicContact CG1-CZ2 4.13Å; V781-W868 VanDerWaalsContact O-CH2 3.27Å; V781-W868 WeakPolarHBondContact O-CH2 3.38Å
782	S	79.3	Confident	80.6	Confident	64 Å²	64	77 Å²	77	45%	0.448	39%	0.389	S	S	.	.	H	α-helix	trans	-73	-27	-170.1	52.5	0	0	0	0	115.1	Q778 R779	Q778-S782 WeakPolarHBondContact O-CB 3.22Å; Q778-S782 PolarHBondContact O-N 2.98Å; Q778-S782 PolarHBondContact O-OG 2.99Å; R779-S782 WeakPolarHBondContact CA-OG 3.39Å; R779-S782 PolarHBondContact O-N 3.43Å; R779-S782 PolarHBondContact O-OG 2.76Å
783	H	76.3	Confident	80.2	Confident	141 Å²	141	72.9 Å²	72.9	65%	0.653	37%	0.371	S	S	*	.	H	α-helix	trans	-102.9	-26.9	-174.9	-66.1	59.3	0	0	0	113.7	R779 V781	R779-H783 VanDerWaalsContact O-CB 3.27Å; R779-H783 WeakPolarHBondContact O-CB 3.21Å; R779-H783 PolarHBondContact O-N 2.88Å; R779-H783 PolarHBondContact O-ND1 3.01Å; R779-H783 VanDerWaalsContact O-ND1 3.13Å; V781-H783 PolarHBondContact O-N 2.73Å
784	N	66.3	Low	80	Confident	106 Å²	106	75.7 Å²	75.7	57%	0.567	38%	0.381	S	S	*	.	H	α-helix	trans	-113.4	-3.4	-177.7	-58.7	-87.7	0	0	0	113.3	D780 R786	D780-N784 WeakPolarHBondContact O-CB 3.38Å; D780-N784 PolarHBondContact O-N 2.93Å; N784-R786 HydrophobicContact CB-CB 3.97Å; N784-R786 PolarHBondContact O-N 2.73Å
785	H	65.6	Low	79.9	Confident	110 Å²	110	80.3 Å²	80.3	51%	0.509	40%	0.402	S	S	.	.			trans	48.5	24.5	-167.2	-60.6	-65.5	0	0	0	113.4	V781 L787 W868	V781-H785 VanDerWaalsContact O-CA 3.3Å; V781-H785 WeakPolarHBondContact O-CA 3.23Å; V781-H785 PolarHBondContact O-N 2.88Å; V781-H785 VanDerWaalsContact O-N 3.13Å; H785-L787 PolarHBondContact O-N 2.84Å; H785-W868 HydrophobicContact CB-CZ2 4.2Å; H785-W868 AromaticContact CE1-CE3 3.55Å; H785-W868 AromaticContact CE1-CZ3 3.64Å; H785-W868 AromaticContact ND1-CD2 3.41Å; H785-W868 AromaticContact ND1-CE2 3.5Å; H785-W868 AromaticContact ND1-CE3 3.27Å; H785-W868 VanDerWaalsContact ND1-CE3 3.27Å; H785-W868 AromaticContact ND1-CH2 3.35Å; H785-W868 WeakPolarHBondContact ND1-CH2 3.44Å; H785-W868 AromaticContact ND1-CZ2 3.48Å; H785-W868 WeakPolarHBondContact ND1-CZ2 3.47Å; H785-W868 AromaticContact ND1-CZ3 3.25Å; H785-W868 WeakPolarHBondContact ND1-CZ3 3.49Å
786	R	57.4	Low	80	Confident	179 Å²	179	77.3 Å²	77.3	68%	0.675	39%	0.388	S	S	*	.			trans	-78.2	124.1	-169.9	-167.9	175.6	-170.9	-129.9	1.5	108.8	N784 V788	N784-R786 HydrophobicContact CB-CB 3.97Å; N784-R786 PolarHBondContact O-N 2.73Å; R786-V788 PolarHBondContact O-N 2.8Å
787	L	63	Low	80.1	Confident	154 Å²	154	74.4 Å²	74.4	81%	0.806	38%	0.382	S	S	*	.			trans	-55.6	110	172.3	-69.2	170.4	0	0	0	109.3	H785	H785-L787 PolarHBondContact O-N 2.84Å
788	V	66.4	Low	80.5	Confident	18 Å²	18	79.9 Å²	79.9	11%	0.109	41%	0.411	C	S	.	.			trans	-70.2	133.1	171.5	167.8	0	0	0	0	108	I777 V781 R786 G790 L793	I777-V788 HydrophobicContact CG2-CB 4.47Å; I777-V788 HydrophobicContact CG2-CG1 3.91Å; I777-V788 HydrophobicContact CG2-CG2 3.76Å; V781-V788 HydrophobicContact CG2-CB 4.35Å; V781-V788 HydrophobicContact CG2-CG2 3.31Å; R786-V788 PolarHBondContact O-N 2.8Å; V788-G790 PolarHBondContact O-N 2.81Å; V788-G790 VanDerWaalsContact O-N 3.1Å; V788-L793 HydrophobicContact CG1-CB 4.43Å
789	P	73.8	Confident	80.8	Confident	68 Å²	68	79.3 Å²	79.3	44%	0.442	41%	0.412	S	S	.	.			trans	-60.3	117.4	171.6	-20.5	32.6	0	0	0	109.8	P791 E792 L793	P789-P791 VanDerWaalsContact C-N 3.25Å; P789-P791 HydrophobicContact CB-CG 4.1Å; P789-P791 VanDerWaalsContact O-N 3.17Å; P789-E792 HydrophobicContact CB-CB 4.21Å; P789-E792 WeakPolarHBondContact O-CB 3.39Å; P789-E792 PolarHBondContact O-N 2.84Å; P789-L793 PolarHBondContact O-N 3.25Å
790	G	76.8	Confident	81.3	Confident	36 Å²	36	74 Å²	74	37%	0.371	39%	0.393	S	S	.	.	H	α-helix	trans	-40.2	-47.5	168.3	0	0	0	0	0	114.2	V788 E792 L793 E794	V788-G790 PolarHBondContact O-N 2.81Å; V788-G790 VanDerWaalsContact O-N 3.1Å; G790-E792 VanDerWaalsContact C-N 3.32Å; G790-E792 PolarHBondContact O-N 2.84Å; G790-L793 WeakPolarHBondContact O-CB 3.5Å; G790-L793 PolarHBondContact O-N 3.31Å; G790-L793 VanDerWaalsContact O-N 3.16Å; G790-E794 WeakPolarHBondContact O-CG 3.38Å; G790-E794 PolarHBondContact O-N 3.32Å
791	P	83	Confident	81.8	Confident	98 Å²	98	78.3 Å²	78.3	64%	0.636	41%	0.41	S	S	*	.	H	α-helix	trans	-62.8	-28.8	176.8	23	-35.3	0	0	0	115.2	P789 E795	P789-P791 VanDerWaalsContact C-N 3.25Å; P789-P791 HydrophobicContact CB-CG 4.1Å; P789-P791 VanDerWaalsContact O-N 3.17Å; P791-E795 WeakPolarHBondContact O-CB 3.3Å; P791-E795 PolarHBondContact O-N 3Å
792	E	84.3	Confident	82.6	Confident	73 Å²	73	83.2 Å²	83.2	34%	0.341	43%	0.432	S	S	.	.	H	α-helix	trans	-69.4	-40.9	174.6	-174.8	177.1	-176.1	0	0	110.3	I777 P789 G790 E795 K796	I777-E792 HydrophobicContact CD1-CG 4.26Å; P789-E792 HydrophobicContact CB-CB 4.21Å; P789-E792 WeakPolarHBondContact O-CB 3.39Å; P789-E792 PolarHBondContact O-N 2.84Å; G790-E792 VanDerWaalsContact C-N 3.32Å; G790-E792 PolarHBondContact O-N 2.84Å; E792-E795 PolarHBondContact O-N 2.75Å; E792-K796 WeakPolarHBondContact O-CG 3.49Å; E792-K796 PolarHBondContact O-N 3.48Å
793	L	89.3	Confident	83.4	Confident	10 Å²	10	80.4 Å²	80.4	5%	0.052	41%	0.412	C	S	.	.	H	α-helix	trans	-66.3	-38.6	175.8	-162.9	73.4	0	0	0	111.9	I777 V788 P789 G790 K796 A797 L856 I859 R860	I777-L793 HydrophobicContact CG2-CD1 4.23Å; V788-L793 HydrophobicContact CG1-CB 4.43Å; P789-L793 PolarHBondContact O-N 3.25Å; G790-L793 WeakPolarHBondContact O-CB 3.5Å; G790-L793 PolarHBondContact O-N 3.31Å; G790-L793 VanDerWaalsContact O-N 3.16Å; L793-K796 PolarHBondContact O-N 3.02Å; L793-A797 WeakPolarHBondContact O-CB 3.33Å; L793-A797 PolarHBondContact O-N 3.35Å; L793-L856 HydrophobicContact CD1-CD2 3.46Å; L793-L856 VanDerWaalsContact CD1-CD2 3.46Å; L793-L856 HydrophobicContact CG-CD2 4.2Å; L793-I859 HydrophobicContact CD1-CB 4.22Å; L793-I859 HydrophobicContact CD1-CG2 3.7Å; L793-I859 HydrophobicContact CD2-CG2 4.2Å; L793-R860 HydrophobicContact CD2-CB 3.7Å; L793-R860 HydrophobicContact CD2-CG 4.06Å
794	E	89.9	Confident	84.4	Confident	89 Å²	89	74.6 Å²	74.6	42%	0.416	39%	0.391	S	S	.	.	H	α-helix	trans	-70.7	-36.4	175.3	-67.5	-164.4	138.4	0	0	112.6	G790 A797 L798 R860	G790-E794 WeakPolarHBondContact O-CG 3.38Å; G790-E794 PolarHBondContact O-N 3.32Å; E794-A797 PolarHBondContact O-N 3.09Å; E794-L798 WeakPolarHBondContact O-CB 3.01Å; E794-L798 VanDerWaalsContact O-CG 3.29Å; E794-L798 WeakPolarHBondContact O-CG 3.49Å; E794-L798 PolarHBondContact O-N 3.03Å; E794-R860 IonicContact OE1-CZ 2.61Å; E794-R860 VanDerWaalsContact OE1-CZ 3.28Å; E794-R860 IonicContact OE1-NH1 3.33Å; E794-R860 PolarHBondContact OE1-NH1 3.15Å; E794-R860 IonicContact OE1-NH2 2.63Å; E794-R860 PolarHBondContact OE1-NH2 2.58Å
795	E	93.4	Very high	85.8	Confident	100 Å²	100	74 Å²	74	47%	0.467	38%	0.384	S	S	.	.	H	α-helix	trans	-58.8	-47	170	-169.5	-154.6	109.6	0	0	111	P791 E792 A797 L798 V799	P791-E795 WeakPolarHBondContact O-CB 3.3Å; P791-E795 PolarHBondContact O-N 3Å; E792-E795 PolarHBondContact O-N 2.75Å; E795-A797 VanDerWaalsContact C-N 3.33Å; E795-A797 PolarHBondContact O-N 2.91Å; E795-L798 PolarHBondContact O-N 3.34Å; E795-V799 WeakPolarHBondContact O-CG2 3.43Å; E795-V799 PolarHBondContact O-N 3.24Å
796	K	93.6	Very high	87.3	Confident	39 Å²	39	70.8 Å²	70.8	17%	0.17	37%	0.372	C	S	.	.	H	α-helix	trans	-66.2	-35.1	177.9	-60.1	-30.8	170.7	-164.5	0	112.1	L770 I777 E792 L793 L800 L856	L770-K796 HydrophobicContact CD1-CB 3.88Å; L770-K796 HydrophobicContact CD1-CD 4.22Å; L770-K796 HydrophobicContact CD1-CG 4.28Å; I777-K796 HydrophobicContact CD1-CG 4.03Å; E792-K796 WeakPolarHBondContact O-CG 3.49Å; E792-K796 PolarHBondContact O-N 3.48Å; L793-K796 PolarHBondContact O-N 3.02Å; K796-L800 WeakPolarHBondContact O-CB 3.38Å; K796-L800 PolarHBondContact O-N 3.47Å; K796-L856 HydrophobicContact CB-CD1 4.43Å; K796-L856 HydrophobicContact CB-CD2 4.17Å
797	A	94.9	Very high	89.2	Confident	39 Å²	39	62.2 Å²	62.2	32%	0.322	34%	0.34	S	S	.	.	H	α-helix	trans	-67.6	-36.1	173.3	0	0	0	0	0	112.9	L793 E794 E795 L800 K801 L856	L793-A797 WeakPolarHBondContact O-CB 3.33Å; L793-A797 PolarHBondContact O-N 3.35Å; E794-A797 PolarHBondContact O-N 3.09Å; E795-A797 VanDerWaalsContact C-N 3.33Å; E795-A797 PolarHBondContact O-N 2.91Å; A797-L800 PolarHBondContact O-N 3.39Å; A797-K801 WeakPolarHBondContact O-CB 3Å; A797-K801 PolarHBondContact O-N 3.4Å; A797-L856 HydrophobicContact CB-CD1 4.33Å
798	L	95.6	Very high	90.7	Very high	119 Å²	119	58.7 Å²	58.7	62%	0.623	33%	0.325	S	S	*	.	H	α-helix	trans	-67.4	-44.5	173.9	-74.7	166.9	0	0	0	111.7	E794 E795 L800 K801 Q802	E794-L798 WeakPolarHBondContact O-CB 3.01Å; E794-L798 VanDerWaalsContact O-CG 3.29Å; E794-L798 WeakPolarHBondContact O-CG 3.49Å; E794-L798 PolarHBondContact O-N 3.03Å; E795-L798 PolarHBondContact O-N 3.34Å; L798-L800 VanDerWaalsContact C-N 3.34Å; L798-K801 PolarHBondContact O-N 2.92Å; L798-Q802 PolarHBondContact O-N 2.88Å
799	V	96.1	Very high	92.1	Very high	60 Å²	60	63.5 Å²	63.5	36%	0.364	35%	0.346	S	S	.	.	H	α-helix	trans	-61.1	-43.7	173.5	173.8	0	0	0	0	110.7	L770 E795 K801 Q802 L803	L770-V799 HydrophobicContact CD1-CG1 4.36Å; L770-V799 HydrophobicContact CD2-CG1 4.44Å; E795-V799 WeakPolarHBondContact O-CG2 3.43Å; E795-V799 PolarHBondContact O-N 3.24Å; V799-K801 PolarHBondContact O-N 3.26Å; V799-Q802 PolarHBondContact O-N 3.39Å; V799-L803 HydrophobicContact CG1-CD1 4.08Å; V799-L803 HydrophobicContact CG1-CG 4.48Å; V799-L803 WeakPolarHBondContact O-CG 3.49Å; V799-L803 PolarHBondContact O-N 3.49Å
800	L	96.9	Very high	93.2	Very high	8 Å²	8	60.7 Å²	60.7	4%	0.042	33%	0.328	C	S	.	.	H	α-helix	trans	-61.3	-43.9	176.4	-174.7	56.1	0	0	0	112.6	L767 L770 K796 A797 L798 Q802 L803 G804 C849 V852 T853 L856	L767-L800 HydrophobicContact CD1-CD1 4.22Å; L770-L800 HydrophobicContact CD2-CB 3.74Å; L770-L800 HydrophobicContact CD2-CD1 3.68Å; L770-L800 HydrophobicContact CD2-CG 4.23Å; K796-L800 WeakPolarHBondContact O-CB 3.38Å; K796-L800 PolarHBondContact O-N 3.47Å; A797-L800 PolarHBondContact O-N 3.39Å; L798-L800 VanDerWaalsContact C-N 3.34Å; L800-Q802 VanDerWaalsContact C-N 3.33Å; L800-Q802 PolarHBondContact O-N 3.33Å; L800-L803 PolarHBondContact O-N 3.41Å; L800-G804 PolarHBondContact O-N 3.48Å; L800-C849 HydrophobicContact CD1-CB 4.17Å; L800-V852 HydrophobicContact CD1-CB 3.97Å; L800-V852 HydrophobicContact CD1-CG1 4.18Å; L800-V852 HydrophobicContact CD2-CB 3.85Å; L800-V852 HydrophobicContact CD2-CG1 3.85Å; L800-T853 VanDerWaalsContact CD2-N 3.28Å; L800-T853 VanDerWaalsContact CD2-OG1 3.27Å; L800-T853 WeakPolarHBondContact CD2-OG1 3.34Å; L800-L856 HydrophobicContact CB-CD1 4.36Å; L800-L856 HydrophobicContact CD2-CD1 3.8Å
801	K	95.6	Very high	94.1	Very high	128 Å²	128	62.2 Å²	62.2	56%	0.557	32%	0.324	S	S	*	.	H	α-helix	trans	-59.1	-47.2	175.8	179.6	-175.3	164.2	-174.4	0	110.3	A797 L798 V799 L803 G804 E805	A797-K801 WeakPolarHBondContact O-CB 3Å; A797-K801 PolarHBondContact O-N 3.4Å; L798-K801 PolarHBondContact O-N 2.92Å; V799-K801 PolarHBondContact O-N 3.26Å; K801-L803 VanDerWaalsContact C-N 3.32Å; K801-L803 PolarHBondContact O-N 3.16Å; K801-G804 PolarHBondContact O-N 2.84Å; K801-G804 VanDerWaalsContact O-N 3.13Å; K801-E805 WeakPolarHBondContact CE-OE1 3.37Å; K801-E805 IonicContact NZ-OE1 3.65Å; K801-E805 WeakPolarHBondContact O-CG 3.41Å; K801-E805 PolarHBondContact O-N 3.46Å
802	Q	96.9	Very high	94.7	Very high	109 Å²	109	61 Å²	61	51%	0.509	32%	0.323	S	S	.	.	H	α-helix	trans	-60.9	-40.6	179	-173.9	62.8	92	0	0	112.2	L798 V799 L800 E805 T806	L798-Q802 PolarHBondContact O-N 2.88Å; V799-Q802 PolarHBondContact O-N 3.39Å; L800-Q802 VanDerWaalsContact C-N 3.33Å; L800-Q802 PolarHBondContact O-N 3.33Å; Q802-E805 PolarHBondContact O-N 3.34Å; Q802-T806 PolarHBondContact O-N 2.84Å; Q802-T806 PolarHBondContact O-OG1 3.2Å
803	L	97.2	Very high	95.3	Very high	5 Å²	5	63 Å²	63	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-67	-36	174.2	-70	171.5	0	0	0	112.8	I763 Q766 L767 L770 V799 L800 K801 E805 T806 L807	I763-L803 HydrophobicContact CG2-CD2 4.4Å; Q766-L803 HydrophobicContact CB-CD1 4.11Å; Q766-L803 HydrophobicContact CB-CD2 3.61Å; Q766-L803 HydrophobicContact CB-CG 4.49Å; Q766-L803 HydrophobicContact CG-CD2 4.46Å; Q766-L803 VanDerWaalsContact OE1-CD2 3.3Å; L767-L803 HydrophobicContact CB-CD1 4.5Å; L770-L803 HydrophobicContact CD2-CD1 3.88Å; V799-L803 HydrophobicContact CG1-CD1 4.08Å; V799-L803 HydrophobicContact CG1-CG 4.48Å; V799-L803 WeakPolarHBondContact O-CG 3.49Å; V799-L803 PolarHBondContact O-N 3.49Å; L800-L803 PolarHBondContact O-N 3.41Å; K801-L803 VanDerWaalsContact C-N 3.32Å; K801-L803 PolarHBondContact O-N 3.16Å; L803-E805 VanDerWaalsContact C-N 3.34Å; L803-T806 PolarHBondContact O-OG1 3.42Å; L803-L807 WeakPolarHBondContact O-CB 3.44Å; L803-L807 PolarHBondContact O-N 3.44Å
804	G	96.6	Very high	95.6	Very high	19 Å²	19	63.1 Å²	63.1	20%	0.196	33%	0.331	C	S	.	.	H	α-helix	trans	-65	-37.5	172.9	0	0	0	0	0	112.6	L800 K801 T808	L800-G804 PolarHBondContact O-N 3.48Å; K801-G804 PolarHBondContact O-N 2.84Å; K801-G804 VanDerWaalsContact O-N 3.13Å; G804-T808 WeakPolarHBondContact O-CB 3.49Å; G804-T808 PolarHBondContact O-N 3.3Å; G804-T808 VanDerWaalsContact O-N 3.12Å; G804-T808 PolarHBondContact O-OG1 3.21Å
805	E	96.2	Very high	95.9	Very high	93 Å²	93	62.2 Å²	62.2	44%	0.435	33%	0.333	S	S	.	.	H	α-helix	trans	-69.5	-52.2	176.3	-72.7	172.2	171.2	0	0	111.6	K801 Q802 L803 L807 T808 E809	K801-E805 WeakPolarHBondContact CE-OE1 3.37Å; K801-E805 IonicContact NZ-OE1 3.65Å; K801-E805 WeakPolarHBondContact O-CG 3.41Å; K801-E805 PolarHBondContact O-N 3.46Å; Q802-E805 PolarHBondContact O-N 3.34Å; L803-E805 VanDerWaalsContact C-N 3.34Å; E805-L807 VanDerWaalsContact C-N 3.33Å; E805-L807 PolarHBondContact O-N 2.88Å; E805-T808 WeakPolarHBondContact O-CB 3.41Å; E805-T808 PolarHBondContact O-N 2.95Å; E805-T808 VanDerWaalsContact O-N 3.07Å; E805-E809 PolarHBondContact O-N 2.94Å
806	T	96.1	Very high	96.1	Very high	42 Å²	42	59.4 Å²	59.4	26%	0.258	33%	0.332	S	S	.	.	H	α-helix	trans	-64.1	-36	178.8	55.9	0	0	0	0	112.6	Q802 L803 T808 E809 L810	Q802-T806 PolarHBondContact O-N 2.84Å; Q802-T806 PolarHBondContact O-OG1 3.2Å; L803-T806 PolarHBondContact O-OG1 3.42Å; T806-T808 VanDerWaalsContact C-N 3.31Å; T806-T808 PolarHBondContact O-N 2.8Å; T806-E809 PolarHBondContact O-N 2.77Å; T806-L810 WeakPolarHBondContact O-CB 3.03Å; T806-L810 PolarHBondContact O-N 2.74Å
807	L	97.3	Very high	96.2	Very high	0 Å²	0	58 Å²	58	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-67.7	-31.5	174.1	-178.3	58.6	0	0	0	112.6	I763 L803 E805 K811 L842 L845 L846	I763-L807 HydrophobicContact CG2-CB 4.19Å; I763-L807 HydrophobicContact CG2-CD1 4.3Å; L803-L807 WeakPolarHBondContact O-CB 3.44Å; L803-L807 PolarHBondContact O-N 3.44Å; E805-L807 VanDerWaalsContact C-N 3.33Å; E805-L807 PolarHBondContact O-N 2.88Å; L807-K811 WeakPolarHBondContact O-CB 3.37Å; L807-K811 PolarHBondContact O-N 3.36Å; L807-L842 HydrophobicContact CD1-CD2 3.82Å; L807-L845 HydrophobicContact CD1-CB 3.9Å; L807-L845 HydrophobicContact CD1-CD1 3.86Å; L807-L845 HydrophobicContact CD2-CB 3.55Å; L807-L845 HydrophobicContact CG-CB 4.38Å; L807-L846 HydrophobicContact CD2-CB 4.41Å; L807-L846 HydrophobicContact CD2-CD2 3.7Å; L807-L846 HydrophobicContact CD2-CG 3.73Å; L807-L846 HydrophobicContact CG-CD2 3.91Å; L807-L846 HydrophobicContact CG-CG 3.97Å
808	T	95.4	Very high	96.2	Very high	80 Å²	80	58 Å²	58	49%	0.491	32%	0.319	S	S	.	.	H	α-helix	trans	-73.1	-38.7	174.2	-59.8	0	0	0	0	111.1	G804 E805 T806 K811 A812	G804-T808 WeakPolarHBondContact O-CB 3.49Å; G804-T808 PolarHBondContact O-N 3.3Å; G804-T808 VanDerWaalsContact O-N 3.12Å; G804-T808 PolarHBondContact O-OG1 3.21Å; E805-T808 WeakPolarHBondContact O-CB 3.41Å; E805-T808 PolarHBondContact O-N 2.95Å; E805-T808 VanDerWaalsContact O-N 3.07Å; T806-T808 VanDerWaalsContact C-N 3.31Å; T806-T808 PolarHBondContact O-N 2.8Å; T808-K811 PolarHBondContact O-N 2.77Å; T808-A812 PolarHBondContact O-N 2.84Å
809	E	96.1	Very high	96.2	Very high	119 Å²	119	55.2 Å²	55.2	56%	0.556	31%	0.309	S	S	*	.	H	α-helix	trans	-63.5	-46.8	172.3	-177.2	165.6	-141.3	0	0	111.6	E805 T806 K811 A812 H813	E805-E809 PolarHBondContact O-N 2.94Å; T806-E809 PolarHBondContact O-N 2.77Å; E809-K811 VanDerWaalsContact C-N 3.29Å; E809-K811 PolarHBondContact O-N 3.19Å; E809-A812 CarbonylContact O-C 3.44Å; E809-A812 WeakPolarHBondContact O-CA 3.29Å; E809-A812 WeakPolarHBondContact O-CB 3.08Å; E809-A812 PolarHBondContact O-N 2.79Å; E809-H813 PolarHBondContact O-CD2 3.11Å; E809-H813 VanDerWaalsContact O-CD2 3.23Å; E809-H813 PolarHBondContact O-N 3.23Å
810	L	96.5	Very high	96.2	Very high	9 Å²	9	56.4 Å²	56.4	5%	0.047	31%	0.31	C	S	.	.	H	α-helix	trans	-57.6	-41.5	173.6	-170.8	67.1	0	0	0	111.5	Y756 D759 E760 I763 T806 A812 H813 F814 L842	Y756-L810 HydrophobicContact CD1-CD1 4.36Å; Y756-L810 HydrophobicContact CD2-CD1 3.44Å; Y756-L810 VanDerWaalsContact CD2-CD1 3.44Å; Y756-L810 HydrophobicContact CD2-CG 4.26Å; Y756-L810 HydrophobicContact CE1-CD1 4.31Å; Y756-L810 HydrophobicContact CE1-CG 4.42Å; Y756-L810 HydrophobicContact CE2-CD1 3.42Å; Y756-L810 VanDerWaalsContact CE2-CD1 3.42Å; Y756-L810 HydrophobicContact CE2-CG 3.71Å; Y756-L810 WeakPolarHBondContact CE2-O 3.27Å; Y756-L810 HydrophobicContact CG-CD1 3.91Å; D759-L810 HydrophobicContact CB-CD1 3.95Å; E760-L810 HydrophobicContact CB-CD2 3.95Å; E760-L810 HydrophobicContact CG-CD2 4.22Å; I763-L810 HydrophobicContact CD1-CD2 4.15Å; T806-L810 WeakPolarHBondContact O-CB 3.03Å; T806-L810 PolarHBondContact O-N 2.74Å; L810-A812 VanDerWaalsContact C-N 3.3Å; L810-A812 PolarHBondContact O-N 3Å; L810-H813 PolarHBondContact O-N 3.06Å; L810-F814 PolarHBondContact O-N 3.4Å; L810-L842 HydrophobicContact CD2-CD2 4.04Å; L810-L842 HydrophobicContact CG-CD2 4.28Å
811	K	95.6	Very high	96.1	Very high	67 Å²	67	56 Å²	56	29%	0.291	31%	0.308	S	S	.	.	H	α-helix	trans	-65	-30.1	173.2	-171.2	173.3	-176.7	87.3	0	113.2	L807 T808 E809 P815 L842 D843 L846	L807-K811 WeakPolarHBondContact O-CB 3.37Å; L807-K811 PolarHBondContact O-N 3.36Å; T808-K811 PolarHBondContact O-N 2.77Å; E809-K811 VanDerWaalsContact C-N 3.29Å; E809-K811 PolarHBondContact O-N 3.19Å; K811-P815 VanDerWaalsContact O-CD 3.3Å; K811-P815 WeakPolarHBondContact O-CD 3.4Å; K811-L842 HydrophobicContact CB-CD1 3.98Å; K811-L842 HydrophobicContact CG-CD1 3.9Å; K811-D843 IonicContact NZ-OD1 3.88Å; K811-D843 PolarHBondContact NZ-OD1 3.28Å; K811-D843 IonicContact NZ-OD2 3.83Å; K811-D843 PolarHBondContact NZ-OD2 3.4Å; K811-L846 HydrophobicContact CD-CD1 3.61Å
812	A	96.3	Very high	96.1	Very high	74 Å²	74	55.4 Å²	55.4	61%	0.612	30%	0.302	S	S	*	.	H	α-helix	trans	-76.3	-30	173.7	0	0	0	0	0	113.2	T808 E809 L810 P815	T808-A812 PolarHBondContact O-N 2.84Å; E809-A812 CarbonylContact O-C 3.44Å; E809-A812 WeakPolarHBondContact O-CA 3.29Å; E809-A812 WeakPolarHBondContact O-CB 3.08Å; E809-A812 PolarHBondContact O-N 2.79Å; L810-A812 VanDerWaalsContact C-N 3.3Å; L810-A812 PolarHBondContact O-N 3Å; A812-P815 WeakPolarHBondContact O-CD 3.48Å
813	H	95.5	Very high	95.9	Very high	115 Å²	115	55.2 Å²	55.2	53%	0.532	31%	0.308	S	S	.	.	H	α-helix	trans	-70.1	-33.5	172.8	-80.4	-72.1	0	0	0	113.2	E809 L810 G816 L817	E809-H813 PolarHBondContact O-CD2 3.11Å; E809-H813 VanDerWaalsContact O-CD2 3.23Å; E809-H813 PolarHBondContact O-N 3.23Å; L810-H813 PolarHBondContact O-N 3.06Å; H813-G816 PolarHBondContact O-N 3.08Å; H813-G816 VanDerWaalsContact O-N 3.16Å; H813-L817 PolarHBondContact O-N 3.09Å
814	F	97	Very high	95.6	Very high	11 Å²	11	56.3 Å²	56.3	5%	0.048	32%	0.315	C	S	.	.	H	α-helix	trans	-54.6	-48.2	-173.2	179.1	-100.4	0	0	0	114.6	Y756 L810 G816 L817 Q818 F834 E838 P839 L842	Y756-F814 HydrophobicContact CE2-CB 3.89Å; Y756-F814 HydrophobicContact CE2-CD2 4.33Å; L810-F814 PolarHBondContact O-N 3.4Å; F814-G816 PolarHBondContact O-N 2.89Å; F814-L817 PolarHBondContact O-N 2.75Å; F814-Q818 HydrophobicContact CD1-CB 4.28Å; F814-Q818 HydrophobicContact CE1-CB 3.89Å; F814-Q818 HydrophobicContact CE1-CG 3.76Å; F814-Q818 HydrophobicContact CE2-CB 4.29Å; F814-Q818 HydrophobicContact CE2-CG 4.43Å; F814-Q818 HydrophobicContact CZ-CB 3.91Å; F814-Q818 HydrophobicContact CZ-CG 3.67Å; F814-Q818 WeakPolarHBondContact O-CB 3.4Å; F814-Q818 PolarHBondContact O-N 2.74Å; F814-F834 HydrophobicContact CD2-CE1 4.16Å; F814-F834 HydrophobicContact CD2-CZ 4.07Å; F814-F834 HydrophobicContact CE2-CD1 4.33Å; F814-F834 AromaticContact CE2-CE1 3.69Å; F814-F834 HydrophobicContact CE2-CE1 3.69Å; F814-F834 AromaticContact CE2-CZ 3.93Å; F814-F834 HydrophobicContact CE2-CZ 3.93Å; F814-E838 HydrophobicContact CD2-CB 4.05Å; F814-E838 HydrophobicContact CD2-CG 3.57Å; F814-E838 HydrophobicContact CE2-CB 3.47Å; F814-E838 VanDerWaalsContact CE2-CB 3.47Å; F814-E838 HydrophobicContact CE2-CG 3.54Å; F814-E838 HydrophobicContact CG-CG 4.4Å; F814-E838 HydrophobicContact CZ-CB 3.92Å; F814-E838 HydrophobicContact CZ-CG 4.34Å; F814-P839 HydrophobicContact CE1-CG 3.73Å; F814-P839 HydrophobicContact CZ-CG 4.03Å; F814-L842 HydrophobicContact CB-CD1 4.37Å
815	P	96.2	Very high	95.2	Very high	70 Å²	70	55.4 Å²	55.4	46%	0.455	31%	0.306	S	S	.	.	H	α-helix	trans	-56.9	-32.7	179.3	-27.9	35.9	0	0	0	115	K811 A812 S819	K811-P815 VanDerWaalsContact O-CD 3.3Å; K811-P815 WeakPolarHBondContact O-CD 3.4Å; A812-P815 WeakPolarHBondContact O-CD 3.48Å; P815-S819 WeakPolarHBondContact O-CB 3.2Å; P815-S819 PolarHBondContact O-N 3.49Å; P815-S819 PolarHBondContact O-OG 2.7Å
816	G	96.1	Very high	94.6	Very high	42 Å²	42	59.1 Å²	59.1	43%	0.433	32%	0.316	S	S	.	.	H	α-helix	trans	-69.7	-51.6	175.3	0	0	0	0	0	111.6	H813 F814 S819 K820	H813-G816 PolarHBondContact O-N 3.08Å; H813-G816 VanDerWaalsContact O-N 3.16Å; F814-G816 PolarHBondContact O-N 2.89Å; G816-S819 PolarHBondContact O-N 2.99Å; G816-K820 PolarHBondContact O-N 2.93Å; G816-K820 VanDerWaalsContact O-N 3.08Å
817	L	96	Very high	94.2	Very high	9 Å²	9	63.2 Å²	63.2	5%	0.047	34%	0.34	C	S	.	.	H	α-helix	trans	-59.4	-47.1	175.6	176.3	61.2	0	0	0	111.7	E752 R753 Y756 H813 F814 S819 K820 M821 F834	E752-L817 HydrophobicContact CB-CD1 3.84Å; R753-L817 HydrophobicContact CB-CD1 4.28Å; R753-L817 HydrophobicContact CB-CD2 4.49Å; Y756-L817 HydrophobicContact CD1-CD2 4.24Å; Y756-L817 HydrophobicContact CD2-CD2 3.74Å; Y756-L817 HydrophobicContact CE2-CD2 4.48Å; Y756-L817 HydrophobicContact CG-CD2 3.62Å; H813-L817 PolarHBondContact O-N 3.09Å; F814-L817 PolarHBondContact O-N 2.75Å; L817-S819 PolarHBondContact O-N 2.83Å; L817-S819 VanDerWaalsContact O-N 3.16Å; L817-K820 PolarHBondContact O-N 3.23Å; L817-K820 VanDerWaalsContact O-N 3.14Å; L817-M821 HydrophobicContact CD1-CG 3.84Å; L817-M821 HydrophobicContact CD1-SD 3.78Å; L817-M821 HydrophobicContact CD2-SD 4.29Å; L817-M821 HydrophobicContact CG-CG 4.25Å; L817-M821 HydrophobicContact CG-SD 3.75Å; L817-M821 WeakPolarHBondContact O-CB 3.33Å; L817-M821 WeakPolarHBondContact O-CG 3.49Å; L817-M821 PolarHBondContact O-N 2.99Å; L817-F834 HydrophobicContact CD2-CE1 3.82Å; L817-F834 HydrophobicContact CD2-CZ 3.79Å; L817-F834 HydrophobicContact CG-CE1 4.3Å
818	Q	95.4	Very high	93.8	Very high	40 Å²	40	64.6 Å²	64.6	19%	0.187	35%	0.347	C	S	.	.	H	α-helix	trans	-53.9	-36.3	176.8	-163.4	-163.4	47.4	0	0	111.5	F814 R822 L835	F814-Q818 HydrophobicContact CD1-CB 4.28Å; F814-Q818 HydrophobicContact CE1-CB 3.89Å; F814-Q818 HydrophobicContact CE1-CG 3.76Å; F814-Q818 HydrophobicContact CE2-CB 4.29Å; F814-Q818 HydrophobicContact CE2-CG 4.43Å; F814-Q818 HydrophobicContact CZ-CB 3.91Å; F814-Q818 HydrophobicContact CZ-CG 3.67Å; F814-Q818 WeakPolarHBondContact O-CB 3.4Å; F814-Q818 PolarHBondContact O-N 2.74Å; Q818-R822 VanDerWaalsContact CD-CZ 3.47Å; Q818-R822 WeakPolarHBondContact O-CB 3.41Å; Q818-R822 VanDerWaalsContact O-CG 3.22Å; Q818-R822 WeakPolarHBondContact O-CG 3.32Å; Q818-R822 PolarHBondContact O-N 3.47Å; Q818-R822 VanDerWaalsContact O-N 3.15Å; Q818-R822 PolarHBondContact O-NE 3.18Å; Q818-L835 HydrophobicContact CB-CD2 4.01Å; Q818-L835 HydrophobicContact CG-CD2 3.32Å
819	S	96.2	Very high	93.7	Very high	59 Å²	59	66.8 Å²	66.8	41%	0.413	36%	0.36	S	S	.	.	H	α-helix	trans	-77.1	-43.8	179.1	-58	0	0	0	0	112.1	P815 G816 L817 R822 V823	P815-S819 WeakPolarHBondContact O-CB 3.2Å; P815-S819 PolarHBondContact O-N 3.49Å; P815-S819 PolarHBondContact O-OG 2.7Å; G816-S819 PolarHBondContact O-N 2.99Å; L817-S819 PolarHBondContact O-N 2.83Å; L817-S819 VanDerWaalsContact O-N 3.16Å; S819-R822 PolarHBondContact O-N 3.49Å; S819-R822 PolarHBondContact OG-NH2 2.79Å; S819-R822 VanDerWaalsContact OG-NH2 3.09Å; S819-V823 PolarHBondContact O-N 2.74Å
820	K	95.1	Very high	93.4	Very high	86 Å²	86	67 Å²	67	37%	0.374	36%	0.361	S	S	.	.	H	α-helix	trans	-59	-48.8	172.8	-67	174.3	-177.3	177.5	0	111.9	V749 E752 G816 L817 R822 V823 V824	V749-K820 HydrophobicContact CG1-CB 3.94Å; V749-K820 HydrophobicContact CG2-CB 3.87Å; V749-K820 HydrophobicContact CG2-CD 4.42Å; E752-K820 IonicContact OE1-NZ 2.98Å; E752-K820 PolarHBondContact OE1-NZ 2.82Å; E752-K820 WeakPolarHBondContact OE2-CD 3.29Å; E752-K820 WeakPolarHBondContact OE2-CE 3.26Å; E752-K820 IonicContact OE2-NZ 2.93Å; E752-K820 PolarHBondContact OE2-NZ 3.34Å; G816-K820 PolarHBondContact O-N 2.93Å; G816-K820 VanDerWaalsContact O-N 3.08Å; L817-K820 PolarHBondContact O-N 3.23Å; L817-K820 VanDerWaalsContact O-N 3.14Å; K820-R822 PolarHBondContact O-N 2.81Å; K820-V823 PolarHBondContact O-N 3.28Å; K820-V823 VanDerWaalsContact O-N 3.14Å; K820-V824 PolarHBondContact O-N 3.43Å; K820-V824 VanDerWaalsContact O-N 3.12Å
821	M	95.4	Very high	93.1	Very high	0 Å²	0	66.6 Å²	66.6	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-39.4	179.3	-70.3	-179.2	68.7	0	0	112.6	V749 R753 L817 V823 V824 L825 R826 A831 F834 L835	V749-M821 HydrophobicContact CG1-CB 4.32Å; V749-M821 HydrophobicContact CG1-CG 3.56Å; R753-M821 HydrophobicContact CB-CE 4.33Å; R753-M821 HydrophobicContact CB-SD 3.98Å; R753-M821 HydrophobicContact CG-CE 3.84Å; R753-M821 HydrophobicContact CG-SD 3.96Å; L817-M821 HydrophobicContact CD1-CG 3.84Å; L817-M821 HydrophobicContact CD1-SD 3.78Å; L817-M821 HydrophobicContact CD2-SD 4.29Å; L817-M821 HydrophobicContact CG-CG 4.25Å; L817-M821 HydrophobicContact CG-SD 3.75Å; L817-M821 WeakPolarHBondContact O-CB 3.33Å; L817-M821 WeakPolarHBondContact O-CG 3.49Å; L817-M821 PolarHBondContact O-N 2.99Å; M821-V823 PolarHBondContact O-N 3.17Å; M821-V824 PolarHBondContact O-N 3.06Å; M821-L825 HydrophobicContact CB-CB 4.46Å; M821-L825 HydrophobicContact CE-CD1 4.12Å; M821-L825 HydrophobicContact CG-CD1 4.05Å; M821-L825 WeakPolarHBondContact O-CA 3.42Å; M821-L825 PolarHBondContact O-N 2.66Å; M821-R826 PolarHBondContact O-N 2.93Å; M821-A831 HydrophobicContact CE-CB 3.61Å; M821-F834 HydrophobicContact CE-CB 4.42Å; M821-F834 HydrophobicContact CE-CD1 3.43Å; M821-F834 VanDerWaalsContact CE-CD1 3.43Å; M821-F834 HydrophobicContact CE-CE1 4.04Å; M821-F834 HydrophobicContact CE-CG 4.23Å; M821-F834 HydrophobicContact SD-CD1 3.51Å; M821-F834 VanDerWaalsContact SD-CD1 3.51Å; M821-F834 HydrophobicContact SD-CE1 3.46Å; M821-F834 WeakPolarHBondContact SD-CE1 3.29Å; M821-L835 HydrophobicContact CB-CD1 4.38Å; M821-L835 HydrophobicContact CB-CD2 4.06Å; M821-L835 HydrophobicContact CB-CG 4.46Å
822	R	94.3	Very high	93	Very high	114 Å²	114	67 Å²	67	43%	0.43	37%	0.366	S	S	.	.	H	α-helix	trans	-66.2	-20.1	175.6	-80	180	-62.3	-149	-2.8	114.3	Q818 S819 K820 R826 L835	Q818-R822 VanDerWaalsContact CD-CZ 3.47Å; Q818-R822 WeakPolarHBondContact O-CB 3.41Å; Q818-R822 VanDerWaalsContact O-CG 3.22Å; Q818-R822 WeakPolarHBondContact O-CG 3.32Å; Q818-R822 PolarHBondContact O-N 3.47Å; Q818-R822 VanDerWaalsContact O-N 3.15Å; Q818-R822 PolarHBondContact O-NE 3.18Å; S819-R822 PolarHBondContact O-N 3.49Å; S819-R822 PolarHBondContact OG-NH2 2.79Å; S819-R822 VanDerWaalsContact OG-NH2 3.09Å; K820-R822 PolarHBondContact O-N 2.81Å; R822-R826 WeakPolarHBondContact O-CB 3.25Å; R822-R826 WeakPolarHBondContact O-CD 3.34Å; R822-L835 HydrophobicContact CG-CD1 3.8Å; R822-L835 HydrophobicContact CG-CD2 4.07Å
823	V	93.1	Very high	92.8	Very high	106 Å²	106	69 Å²	69	64%	0.642	36%	0.361	S	S	*	.	H	α-helix	trans	-82.4	-47.6	171.5	174.8	0	0	0	0	110.6	S819 K820 M821	S819-V823 PolarHBondContact O-N 2.74Å; K820-V823 PolarHBondContact O-N 3.28Å; K820-V823 VanDerWaalsContact O-N 3.14Å; M821-V823 PolarHBondContact O-N 3.17Å
824	V	92	Very high	92.8	Very high	28 Å²	28	64.1 Å²	64.1	17%	0.17	34%	0.339	C	S	.	.	H	α-helix	trans	-104.1	-41.3	-161.5	-168.9	0	0	0	0	113.8	Q745 R746 V749 K820 M821	Q745-V824 HydrophobicContact CG-CG2 3.95Å; R746-V824 VanDerWaalsContact CA-CG1 3.48Å; R746-V824 HydrophobicContact CB-CG1 3.66Å; V749-V824 HydrophobicContact CG2-CG2 4.48Å; K820-V824 PolarHBondContact O-N 3.43Å; K820-V824 VanDerWaalsContact O-N 3.12Å; M821-V824 PolarHBondContact O-N 3.06Å
825	L	86.9	Confident	92.7	Very high	0 Å²	0	64.9 Å²	64.9	0%	0	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-0.2	-172.7	-56.4	-166.7	0	0	0	113.7	R746 V749 M821 V827 E828 A831	R746-L825 HydrophobicContact CB-CD2 4.15Å; R746-L825 HydrophobicContact CG-CD2 3.6Å; V749-L825 HydrophobicContact CG1-CD1 3.97Å; V749-L825 HydrophobicContact CG1-CG 4.05Å; M821-L825 HydrophobicContact CB-CB 4.46Å; M821-L825 HydrophobicContact CE-CD1 4.12Å; M821-L825 HydrophobicContact CG-CD1 4.05Å; M821-L825 WeakPolarHBondContact O-CA 3.42Å; M821-L825 PolarHBondContact O-N 2.66Å; L825-V827 PolarHBondContact O-N 3.13Å; L825-E828 WeakPolarHBondContact CB-OE2 3.42Å; L825-E828 WeakPolarHBondContact O-CB 3.21Å; L825-E828 PolarHBondContact O-N 3.35Å; L825-A831 HydrophobicContact CB-CB 3.56Å; L825-A831 HydrophobicContact CD1-CB 4.38Å
826	R	84.4	Confident	92.5	Very high	171 Å²	171	69.5 Å²	69.5	65%	0.645	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-12.1	-170.6	68.4	-176.8	-178.9	179.3	-2.6	118.4	M821 R822 V832	M821-R826 PolarHBondContact O-N 2.93Å; R822-R826 WeakPolarHBondContact O-CB 3.25Å; R822-R826 WeakPolarHBondContact O-CD 3.34Å; R826-V832 WeakPolarHBondContact O-CG2 3.36Å
827	V	87	Confident	92.5	Very high	127 Å²	127	71.4 Å²	71.4	77%	0.77	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-7.8	176.7	-66.4	0	0	0	0	113	L825	L825-V827 PolarHBondContact O-N 3.13Å
828	E	89.8	Confident	92.4	Very high	30 Å²	30	71 Å²	71	14%	0.14	35%	0.352	C	S	.	.			trans	-90	128.2	-178.3	-62.5	165.2	174.2	0	0	110.3	R746 L825 E830 A831 V832	R746-E828 IonicContact CZ-OE1 2.81Å; R746-E828 IonicContact NE-OE1 3.42Å; R746-E828 PolarHBondContact NE-OE1 2.82Å; R746-E828 IonicContact NH2-OE1 2.63Å; R746-E828 PolarHBondContact NH2-OE1 3.22Å; L825-E828 WeakPolarHBondContact CB-OE2 3.42Å; L825-E828 WeakPolarHBondContact O-CB 3.21Å; L825-E828 PolarHBondContact O-N 3.35Å; E828-E830 PolarHBondContact O-N 2.88Å; E828-A831 HydrophobicContact CB-CB 4.04Å; E828-A831 PolarHBondContact O-N 3.43Å; E828-V832 WeakPolarHBondContact O-CG2 3.46Å; E828-V832 PolarHBondContact O-N 3.49Å
829	V	92.3	Very high	92.3	Very high	126 Å²	126	70.8 Å²	70.8	76%	0.764	35%	0.354	S	S	*	.	H	α-helix	trans	-61.3	-35.6	-177.3	-176.8	0	0	0	0	111.4	K833	V829-K833 VanDerWaalsContact O-CB 3.28Å; V829-K833 WeakPolarHBondContact O-CB 3.36Å; V829-K833 PolarHBondContact O-N 3.27Å
830	E	89.6	Confident	92.2	Very high	124 Å²	124	74.4 Å²	74.4	58%	0.579	36%	0.364	S	S	*	.	H	α-helix	trans	-68.4	-45.3	176.7	-68.5	-166.7	-164.8	0	0	113.4	R753 E828 V832 K833 F834	R753-E830 IonicContact CZ-OE2 2.7Å; R753-E830 IonicContact NH1-OE2 3.81Å; R753-E830 PolarHBondContact NH1-OE2 3.07Å; R753-E830 IonicContact NH2-OE2 2.74Å; R753-E830 PolarHBondContact NH2-OE2 2.92Å; E828-E830 PolarHBondContact O-N 2.88Å; E830-V832 VanDerWaalsContact C-N 3.33Å; E830-V832 PolarHBondContact O-N 2.76Å; E830-K833 WeakPolarHBondContact O-CB 3.29Å; E830-K833 PolarHBondContact O-N 2.83Å; E830-F834 WeakPolarHBondContact O-CB 3.33Å; E830-F834 PolarHBondContact O-N 2.97Å
831	A	91.8	Very high	92.2	Very high	0 Å²	0	75.8 Å²	75.8	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-61.5	-44.3	175.8	0	0	0	0	0	110.5	M821 L825 E828 K833 F834 L835	M821-A831 HydrophobicContact CE-CB 3.61Å; L825-A831 HydrophobicContact CB-CB 3.56Å; L825-A831 HydrophobicContact CD1-CB 4.38Å; E828-A831 HydrophobicContact CB-CB 4.04Å; E828-A831 PolarHBondContact O-N 3.43Å; A831-K833 VanDerWaalsContact C-N 3.31Å; A831-K833 PolarHBondContact O-N 3.49Å; A831-F834 PolarHBondContact O-N 3.48Å; A831-L835 VanDerWaalsContact O-CB 3.28Å; A831-L835 WeakPolarHBondContact O-CB 3.36Å; A831-L835 WeakPolarHBondContact O-CD1 3.3Å; A831-L835 WeakPolarHBondContact O-CG 3.45Å; A831-L835 PolarHBondContact O-N 2.72Å
832	V	92.5	Very high	92.2	Very high	75 Å²	75	75.9 Å²	75.9	46%	0.455	37%	0.367	S	S	.	.	H	α-helix	trans	-62.2	-36.6	175.1	173.2	0	0	0	0	112.2	R826 E828 E830 K836	R826-V832 WeakPolarHBondContact O-CG2 3.36Å; E828-V832 WeakPolarHBondContact O-CG2 3.46Å; E828-V832 PolarHBondContact O-N 3.49Å; E830-V832 VanDerWaalsContact C-N 3.33Å; E830-V832 PolarHBondContact O-N 2.76Å; V832-K836 PolarHBondContact O-N 3.39Å
833	K	93.3	Very high	92.3	Very high	116 Å²	116	72.9 Å²	72.9	50%	0.504	36%	0.36	S	S	.	.	H	α-helix	trans	-64.9	-53.4	174.4	-172	-170.3	-179.2	-146	0	111.3	V829 E830 A831 L835 K836 E837	V829-K833 VanDerWaalsContact O-CB 3.28Å; V829-K833 WeakPolarHBondContact O-CB 3.36Å; V829-K833 PolarHBondContact O-N 3.27Å; E830-K833 WeakPolarHBondContact O-CB 3.29Å; E830-K833 PolarHBondContact O-N 2.83Å; A831-K833 VanDerWaalsContact C-N 3.31Å; A831-K833 PolarHBondContact O-N 3.49Å; K833-L835 PolarHBondContact O-N 3.08Å; K833-K836 PolarHBondContact O-N 3.35Å; K833-K836 VanDerWaalsContact O-N 3.1Å; K833-E837 WeakPolarHBondContact CE-OE1 3.37Å; K833-E837 WeakPolarHBondContact CE-OE2 3.38Å; K833-E837 HydrophobicContact CG-CG 4.45Å; K833-E837 VanDerWaalsContact CG-OE1 3.27Å; K833-E837 WeakPolarHBondContact CG-OE1 3.15Å; K833-E837 IonicContact NZ-OE2 2.92Å; K833-E837 PolarHBondContact O-N 2.68Å
834	F	94.5	Very high	92.4	Very high	13 Å²	13	69.3 Å²	69.3	6%	0.057	34%	0.344	C	S	.	.	H	α-helix	trans	-54.6	-50.1	176.9	172.8	-100	0	0	0	111.8	R753 Y756 L757 F814 L817 M821 E830 A831 K836 E837 E838	R753-F834 HydrophobicContact CG-CD1 4.4Å; R753-F834 HydrophobicContact CG-CE1 4.36Å; Y756-F834 AromaticContact CD1-CE2 3.75Å; Y756-F834 HydrophobicContact CD1-CE2 3.75Å; Y756-F834 AromaticContact CD1-CZ 3.54Å; Y756-F834 HydrophobicContact CD1-CZ 3.54Å; Y756-F834 AromaticContact CE1-CE2 3.77Å; Y756-F834 HydrophobicContact CE1-CE2 3.77Å; Y756-F834 AromaticContact CE1-CZ 3.65Å; Y756-F834 HydrophobicContact CE1-CZ 3.65Å; Y756-F834 HydrophobicContact CG-CZ 4.28Å; L757-F834 HydrophobicContact CD1-CD2 4.46Å; L757-F834 HydrophobicContact CD2-CD2 3.93Å; L757-F834 HydrophobicContact CD2-CE2 3.74Å; L757-F834 HydrophobicContact CG-CD2 4.36Å; L757-F834 HydrophobicContact CG-CE2 4.02Å; F814-F834 HydrophobicContact CD2-CE1 4.16Å; F814-F834 HydrophobicContact CD2-CZ 4.07Å; F814-F834 HydrophobicContact CE2-CD1 4.33Å; F814-F834 AromaticContact CE2-CE1 3.69Å; F814-F834 HydrophobicContact CE2-CE1 3.69Å; F814-F834 AromaticContact CE2-CZ 3.93Å; F814-F834 HydrophobicContact CE2-CZ 3.93Å; L817-F834 HydrophobicContact CD2-CE1 3.82Å; L817-F834 HydrophobicContact CD2-CZ 3.79Å; L817-F834 HydrophobicContact CG-CE1 4.3Å; M821-F834 HydrophobicContact CE-CB 4.42Å; M821-F834 HydrophobicContact CE-CD1 3.43Å; M821-F834 VanDerWaalsContact CE-CD1 3.43Å; M821-F834 HydrophobicContact CE-CE1 4.04Å; M821-F834 HydrophobicContact CE-CG 4.23Å; M821-F834 HydrophobicContact SD-CD1 3.51Å; M821-F834 VanDerWaalsContact SD-CD1 3.51Å; M821-F834 HydrophobicContact SD-CE1 3.46Å; M821-F834 WeakPolarHBondContact SD-CE1 3.29Å; E830-F834 WeakPolarHBondContact O-CB 3.33Å; E830-F834 PolarHBondContact O-N 2.97Å; A831-F834 PolarHBondContact O-N 3.48Å; F834-K836 PolarHBondContact O-N 3.37Å; F834-E837 PolarHBondContact O-N 3.49Å; F834-E838 HydrophobicContact CD2-CB 4.15Å; F834-E838 HydrophobicContact CD2-CG 4.31Å; F834-E838 HydrophobicContact CE2-CB 3.99Å; F834-E838 HydrophobicContact CE2-CG 3.67Å; F834-E838 WeakPolarHBondContact CE2-OE2 3.43Å; F834-E838 HydrophobicContact CZ-CB 4.31Å; F834-E838 HydrophobicContact CZ-CG 3.89Å; F834-E838 VanDerWaalsContact O-CB 3.22Å; F834-E838 WeakPolarHBondContact O-CB 3.42Å; F834-E838 PolarHBondContact O-N 2.81Å
835	L	94.4	Very high	92.7	Very high	26 Å²	26	68.5 Å²	68.5	14%	0.136	34%	0.339	C	S	.	.	H	α-helix	trans	-55.4	-22.5	178.6	-74	169.3	0	0	0	114.4	Q818 M821 R822 A831 K833	Q818-L835 HydrophobicContact CB-CD2 4.01Å; Q818-L835 HydrophobicContact CG-CD2 3.32Å; M821-L835 HydrophobicContact CB-CD1 4.38Å; M821-L835 HydrophobicContact CB-CD2 4.06Å; M821-L835 HydrophobicContact CB-CG 4.46Å; R822-L835 HydrophobicContact CG-CD1 3.8Å; R822-L835 HydrophobicContact CG-CD2 4.07Å; A831-L835 VanDerWaalsContact O-CB 3.28Å; A831-L835 WeakPolarHBondContact O-CB 3.36Å; A831-L835 WeakPolarHBondContact O-CD1 3.3Å; A831-L835 WeakPolarHBondContact O-CG 3.45Å; A831-L835 PolarHBondContact O-N 2.72Å; K833-L835 PolarHBondContact O-N 3.08Å
836	K	93.3	Very high	93.1	Very high	168 Å²	168	69.6 Å²	69.6	73%	0.73	35%	0.345	S	S	*	.	H	α-helix	trans	-97.6	-43	179.2	-176.6	-168.5	174.4	-166.3	0	113	V832 K833 F834	V832-K836 PolarHBondContact O-N 3.39Å; K833-K836 PolarHBondContact O-N 3.35Å; K833-K836 VanDerWaalsContact O-N 3.1Å; F834-K836 PolarHBondContact O-N 3.37Å
837	E	94.7	Very high	93.7	Very high	81 Å²	81	68 Å²	68	38%	0.379	34%	0.342	S	S	.	.	H	α-helix	trans	-83.1	-35.1	-172.2	-71.2	176.1	-165.5	0	0	112.6	K833 F834 Q840 R841	K833-E837 WeakPolarHBondContact CE-OE1 3.37Å; K833-E837 WeakPolarHBondContact CE-OE2 3.38Å; K833-E837 HydrophobicContact CG-CG 4.45Å; K833-E837 VanDerWaalsContact CG-OE1 3.27Å; K833-E837 WeakPolarHBondContact CG-OE1 3.15Å; K833-E837 IonicContact NZ-OE2 2.92Å; K833-E837 PolarHBondContact O-N 2.68Å; F834-E837 PolarHBondContact O-N 3.49Å; E837-Q840 WeakPolarHBondContact O-CB 3.26Å; E837-Q840 PolarHBondContact O-N 3.14Å; E837-R841 PolarHBondContact O-N 3.42Å; E837-R841 VanDerWaalsContact O-N 3.12Å
838	E	94.4	Very high	94.2	Very high	2 Å²	2	65.3 Å²	65.3	1%	0.009	32%	0.319	C	S	.	.	H	α-helix	trans	-57.4	-42.7	-170.3	-166.9	53.7	-130.8	0	0	115.4	Y756 F814 F834 Q840 R841 L842	Y756-E838 HydrophobicContact CE1-CG 3.68Å; Y756-E838 WeakPolarHBondContact OH-CG 3.49Å; Y756-E838 PolarHBondContact OH-OE1 3.44Å; F814-E838 HydrophobicContact CD2-CB 4.05Å; F814-E838 HydrophobicContact CD2-CG 3.57Å; F814-E838 HydrophobicContact CE2-CB 3.47Å; F814-E838 VanDerWaalsContact CE2-CB 3.47Å; F814-E838 HydrophobicContact CE2-CG 3.54Å; F814-E838 HydrophobicContact CG-CG 4.4Å; F814-E838 HydrophobicContact CZ-CB 3.92Å; F814-E838 HydrophobicContact CZ-CG 4.34Å; F834-E838 HydrophobicContact CD2-CB 4.15Å; F834-E838 HydrophobicContact CD2-CG 4.31Å; F834-E838 HydrophobicContact CE2-CB 3.99Å; F834-E838 HydrophobicContact CE2-CG 3.67Å; F834-E838 WeakPolarHBondContact CE2-OE2 3.43Å; F834-E838 HydrophobicContact CZ-CB 4.31Å; F834-E838 HydrophobicContact CZ-CG 3.89Å; F834-E838 VanDerWaalsContact O-CB 3.22Å; F834-E838 WeakPolarHBondContact O-CB 3.42Å; F834-E838 PolarHBondContact O-N 2.81Å; E838-Q840 PolarHBondContact O-N 3.22Å; E838-Q840 VanDerWaalsContact O-N 3.14Å; E838-R841 PolarHBondContact O-N 3.07Å; E838-R841 VanDerWaalsContact O-N 3.08Å; E838-R841 IonicContact OE2-NE 3.86Å; E838-L842 HydrophobicContact CG-CD1 4.49Å; E838-L842 WeakPolarHBondContact O-CG 3.32Å; E838-L842 PolarHBondContact O-N 2.67Å; E838-L842 VanDerWaalsContact O-N 3.08Å
839	P	92.8	Very high	94.6	Very high	35 Å²	35	64.3 Å²	64.3	23%	0.227	31%	0.314	C	S	.	.	H	α-helix	trans	-56	-36.6	176.6	-24.7	34.8	0	0	0	112.9	F814 D843	F814-P839 HydrophobicContact CE1-CG 3.73Å; F814-P839 HydrophobicContact CZ-CG 4.03Å; P839-D843 WeakPolarHBondContact O-CB 3.46Å; P839-D843 PolarHBondContact O-N 3.05Å
840	Q	94.1	Very high	94.8	Very high	135 Å²	135	64.4 Å²	64.4	63%	0.631	30%	0.301	S	S	*	.	H	α-helix	trans	-79.3	-30.6	-179.5	-58.1	-60.6	-45.2	0	0	112.2	E837 E838 G844	E837-Q840 WeakPolarHBondContact O-CB 3.26Å; E837-Q840 PolarHBondContact O-N 3.14Å; E838-Q840 PolarHBondContact O-N 3.22Å; E838-Q840 VanDerWaalsContact O-N 3.14Å; Q840-G844 PolarHBondContact O-N 2.87Å
841	R	95.3	Very high	95.1	Very high	115 Å²	115	60.1 Å²	60.1	43%	0.434	29%	0.291	S	S	.	.	H	α-helix	trans	-63.2	-53.3	173	-68.6	179.7	62.5	79.6	2.2	110.5	E760 E837 E838 D843 G844 L845	E760-R841 VanDerWaalsContact CD-NE 3.31Å; E760-R841 IonicContact OE1-CZ 3.51Å; E760-R841 IonicContact OE1-NE 3.15Å; E760-R841 PolarHBondContact OE1-NE 3.38Å; E760-R841 IonicContact OE1-NH2 3.52Å; E760-R841 PolarHBondContact OE1-NH2 3.03Å; E760-R841 IonicContact OE2-CZ 2.72Å; E760-R841 IonicContact OE2-NE 3.35Å; E760-R841 PolarHBondContact OE2-NE 3.39Å; E760-R841 IonicContact OE2-NH2 2.69Å; E760-R841 PolarHBondContact OE2-NH2 3.4Å; E837-R841 PolarHBondContact O-N 3.42Å; E837-R841 VanDerWaalsContact O-N 3.12Å; E838-R841 PolarHBondContact O-N 3.07Å; E838-R841 VanDerWaalsContact O-N 3.08Å; E838-R841 IonicContact OE2-NE 3.86Å; R841-D843 VanDerWaalsContact C-N 3.34Å; R841-D843 PolarHBondContact O-N 3.12Å; R841-G844 CarbonylContact O-C 3.57Å; R841-G844 WeakPolarHBondContact O-CA 3.31Å; R841-G844 PolarHBondContact O-N 2.82Å; R841-L845 PolarHBondContact O-N 2.82Å
842	L	96.1	Very high	95.3	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-56.9	-43.1	175.3	-62.7	170.4	0	0	0	113	Y756 L807 L810 K811 F814 E838 G844 L845 L846	Y756-L842 WeakPolarHBondContact OH-CD1 3.08Å; Y756-L842 WeakPolarHBondContact OH-CD2 3.43Å; L807-L842 HydrophobicContact CD1-CD2 3.82Å; L810-L842 HydrophobicContact CD2-CD2 4.04Å; L810-L842 HydrophobicContact CG-CD2 4.28Å; K811-L842 HydrophobicContact CB-CD1 3.98Å; K811-L842 HydrophobicContact CG-CD1 3.9Å; F814-L842 HydrophobicContact CB-CD1 4.37Å; E838-L842 HydrophobicContact CG-CD1 4.49Å; E838-L842 WeakPolarHBondContact O-CG 3.32Å; E838-L842 PolarHBondContact O-N 2.67Å; E838-L842 VanDerWaalsContact O-N 3.08Å; L842-G844 VanDerWaalsContact C-N 3.28Å; L842-G844 PolarHBondContact O-N 3.19Å; L842-L845 PolarHBondContact O-N 3.34Å; L842-L846 WeakPolarHBondContact O-CB 3.31Å; L842-L846 WeakPolarHBondContact O-CG 3.32Å; L842-L846 PolarHBondContact O-N 3.48Å
843	D	95.4	Very high	95.5	Very high	52 Å²	52	60.1 Å²	60.1	28%	0.278	29%	0.291	S	S	.	.	H	α-helix	trans	-70.5	-25	177.9	-75.1	-28.8	0	0	0	112.7	K811 P839 R841 K847	K811-D843 IonicContact NZ-OD1 3.88Å; K811-D843 PolarHBondContact NZ-OD1 3.28Å; K811-D843 IonicContact NZ-OD2 3.83Å; K811-D843 PolarHBondContact NZ-OD2 3.4Å; P839-D843 WeakPolarHBondContact O-CB 3.46Å; P839-D843 PolarHBondContact O-N 3.05Å; R841-D843 VanDerWaalsContact C-N 3.34Å; R841-D843 PolarHBondContact O-N 3.12Å; D843-K847 VanDerWaalsContact O-CD 3.28Å; D843-K847 WeakPolarHBondContact O-CD 3.31Å; D843-K847 WeakPolarHBondContact O-CG 3.44Å; D843-K847 PolarHBondContact O-N 2.8Å
844	G	96.9	Very high	95.6	Very high	31 Å²	31	59.7 Å²	59.7	32%	0.32	29%	0.294	S	S	.	.	H	α-helix	trans	-66.4	-53.2	165.7	0	0	0	0	0	111.8	Q840 R841 L842 L846 K847 R848	Q840-G844 PolarHBondContact O-N 2.87Å; R841-G844 CarbonylContact O-C 3.57Å; R841-G844 WeakPolarHBondContact O-CA 3.31Å; R841-G844 PolarHBondContact O-N 2.82Å; L842-G844 VanDerWaalsContact C-N 3.28Å; L842-G844 PolarHBondContact O-N 3.19Å; G844-L846 VanDerWaalsContact C-N 3.35Å; G844-L846 PolarHBondContact O-N 3.46Å; G844-K847 WeakPolarHBondContact O-CB 3.48Å; G844-K847 PolarHBondContact O-N 3.22Å; G844-K847 VanDerWaalsContact O-N 3.1Å; G844-R848 PolarHBondContact O-N 3.38Å
845	L	96.9	Very high	95.6	Very high	11 Å²	11	61.3 Å²	61.3	6%	0.058	31%	0.305	C	S	.	.	H	α-helix	trans	-58	-43.8	178	-65.1	177.5	0	0	0	111.9	E760 T764 L767 L807 R841 L842 K847 R848 C849	E760-L845 HydrophobicContact CG-CD1 4.18Å; T764-L845 HydrophobicContact CG2-CD2 4.45Å; L767-L845 HydrophobicContact CD2-CD2 4.38Å; L807-L845 HydrophobicContact CD1-CB 3.9Å; L807-L845 HydrophobicContact CD1-CD1 3.86Å; L807-L845 HydrophobicContact CD2-CB 3.55Å; L807-L845 HydrophobicContact CG-CB 4.38Å; R841-L845 PolarHBondContact O-N 2.82Å; L842-L845 PolarHBondContact O-N 3.34Å; L845-K847 VanDerWaalsContact C-N 3.29Å; L845-K847 PolarHBondContact O-N 2.78Å; L845-R848 WeakPolarHBondContact O-CB 3.29Å; L845-R848 PolarHBondContact O-N 2.9Å; L845-R848 VanDerWaalsContact O-N 3.11Å; L845-C849 PolarHBondContact O-N 3.01Å; L845-C849 PolarHBondContact O-SG 3.05Å
846	L	96.4	Very high	95.6	Very high	23 Å²	23	60.5 Å²	60.5	12%	0.12	30%	0.301	C	S	.	.	H	α-helix	trans	-65.8	-29.1	177.5	-77.4	169.6	0	0	0	113.1	L807 K811 L842 G844 R850	L807-L846 HydrophobicContact CD2-CB 4.41Å; L807-L846 HydrophobicContact CD2-CD2 3.7Å; L807-L846 HydrophobicContact CD2-CG 3.73Å; L807-L846 HydrophobicContact CG-CD2 3.91Å; L807-L846 HydrophobicContact CG-CG 3.97Å; K811-L846 HydrophobicContact CD-CD1 3.61Å; L842-L846 WeakPolarHBondContact O-CB 3.31Å; L842-L846 WeakPolarHBondContact O-CG 3.32Å; L842-L846 PolarHBondContact O-N 3.48Å; G844-L846 VanDerWaalsContact C-N 3.35Å; G844-L846 PolarHBondContact O-N 3.46Å; L846-R850 PolarHBondContact O-N 3.19Å; L846-R850 PolarHBondContact O-NE 2.77Å; L846-R850 PolarHBondContact O-NH2 3.46Å
847	K	96.9	Very high	95.5	Very high	136 Å²	136	54.1 Å²	54.1	59%	0.591	28%	0.279	S	S	*	.	H	α-helix	trans	-71.5	-40.6	171	-73.5	164.8	-172.3	172.1	0	111.2	D843 G844 L845 R850 G851	D843-K847 VanDerWaalsContact O-CD 3.28Å; D843-K847 WeakPolarHBondContact O-CD 3.31Å; D843-K847 WeakPolarHBondContact O-CG 3.44Å; D843-K847 PolarHBondContact O-N 2.8Å; G844-K847 WeakPolarHBondContact O-CB 3.48Å; G844-K847 PolarHBondContact O-N 3.22Å; G844-K847 VanDerWaalsContact O-N 3.1Å; L845-K847 VanDerWaalsContact C-N 3.29Å; L845-K847 PolarHBondContact O-N 2.78Å; K847-R850 PolarHBondContact O-N 3.47Å; K847-G851 PolarHBondContact O-N 3.29Å
848	R	97.4	Very high	95.3	Very high	72 Å²	72	53.9 Å²	53.9	27%	0.272	28%	0.278	S	S	.	.	H	α-helix	trans	-61.3	-49.7	174.1	-66	-157	-54.6	149.6	-8.1	111.8	L767 N768 E771 G844 L845 R850 G851 V852	L767-R848 HydrophobicContact CD2-CB 3.76Å; N768-R848 PolarHBondContact OD1-NH1 3.35Å; N768-R848 PolarHBondContact OD1-NH2 3.48Å; E771-R848 WeakPolarHBondContact OE1-CD 3.18Å; E771-R848 IonicContact OE1-CZ 3.83Å; E771-R848 IonicContact OE1-NE 3.28Å; E771-R848 IonicContact OE1-NH1 3.71Å; E771-R848 PolarHBondContact OE1-NH1 2.9Å; E771-R848 IonicContact OE2-CZ 2.74Å; E771-R848 IonicContact OE2-NH1 2.71Å; E771-R848 PolarHBondContact OE2-NH1 3.44Å; G844-R848 PolarHBondContact O-N 3.38Å; L845-R848 WeakPolarHBondContact O-CB 3.29Å; L845-R848 PolarHBondContact O-N 2.9Å; L845-R848 VanDerWaalsContact O-N 3.11Å; R848-R850 VanDerWaalsContact C-N 3.26Å; R848-R850 PolarHBondContact O-N 2.8Å; R848-G851 WeakPolarHBondContact O-CA 3.27Å; R848-G851 PolarHBondContact O-N 2.8Å; R848-V852 WeakPolarHBondContact O-CG2 3.4Å; R848-V852 PolarHBondContact O-N 3.4Å
849	C	97.3	Very high	95.1	Very high	8 Å²	8	53.8 Å²	53.8	5%	0.054	28%	0.278	C	S	.	.	H	α-helix	trans	-52.3	-43.7	175.3	-66.7	0	0	0	0	112.2	L767 L800 L845 V852 T853	L767-C849 VanDerWaalsContact CD2-SG 3.55Å; L800-C849 HydrophobicContact CD1-CB 4.17Å; L845-C849 PolarHBondContact O-N 3.01Å; L845-C849 PolarHBondContact O-SG 3.05Å; C849-V852 PolarHBondContact O-N 2.82Å; C849-T853 PolarHBondContact O-N 2.88Å; C849-T853 PolarHBondContact O-OG1 3.46Å; C849-T853 VanDerWaalsContact O-OG1 3.08Å
850	R	96.2	Very high	94.8	Very high	128 Å²	128	57.2 Å²	57.2	48%	0.483	29%	0.286	S	S	.	.	H	α-helix	trans	-62.1	-44.2	174.2	-82.5	-179.5	-73.5	-92	-2.8	113	L846 K847 R848 V852 T853 D854	L846-R850 PolarHBondContact O-N 3.19Å; L846-R850 PolarHBondContact O-NE 2.77Å; L846-R850 PolarHBondContact O-NH2 3.46Å; K847-R850 PolarHBondContact O-N 3.47Å; R848-R850 VanDerWaalsContact C-N 3.26Å; R848-R850 PolarHBondContact O-N 2.8Å; R850-V852 VanDerWaalsContact C-N 3.27Å; R850-V852 PolarHBondContact O-N 2.96Å; R850-T853 CarbonylContact O-C 3.57Å; R850-T853 WeakPolarHBondContact O-CA 3.25Å; R850-T853 VanDerWaalsContact O-CB 3.32Å; R850-T853 WeakPolarHBondContact O-CB 3.27Å; R850-T853 PolarHBondContact O-N 2.88Å; R850-D854 VanDerWaalsContact O-CG 3.23Å; R850-D854 PolarHBondContact O-N 3.16Å
851	G	96.9	Very high	94.4	Very high	35 Å²	35	56.4 Å²	56.4	36%	0.361	28%	0.277	S	S	.	.	H	α-helix	trans	-59.4	-35.1	174.8	0	0	0	0	0	113.6	K847 R848 T855	K847-G851 PolarHBondContact O-N 3.29Å; R848-G851 WeakPolarHBondContact O-CA 3.27Å; R848-G851 PolarHBondContact O-N 2.8Å; G851-T855 WeakPolarHBondContact O-CG2 3.44Å; G851-T855 PolarHBondContact O-N 3.47Å; G851-T855 VanDerWaalsContact O-N 3.08Å; G851-T855 PolarHBondContact O-OG1 3.02Å
852	V	96.7	Very high	93.7	Very high	6 Å²	6	55.2 Å²	55.2	4%	0.036	28%	0.277	C	S	.	.	H	α-helix	trans	-70.9	-36	172	-169.4	0	0	0	0	111.1	L767 L770 E771 V774 L800 R848 C849 R850 T855 L856	L767-V852 HydrophobicContact CD1-CG2 4.02Å; L770-V852 HydrophobicContact CD2-CG1 4.14Å; L770-V852 HydrophobicContact CG-CG1 4.16Å; E771-V852 HydrophobicContact CG-CG2 3.5Å; V774-V852 HydrophobicContact CB-CG1 4.35Å; V774-V852 HydrophobicContact CG2-CG1 3.85Å; L800-V852 HydrophobicContact CD1-CB 3.97Å; L800-V852 HydrophobicContact CD1-CG1 4.18Å; L800-V852 HydrophobicContact CD2-CB 3.85Å; L800-V852 HydrophobicContact CD2-CG1 3.85Å; R848-V852 WeakPolarHBondContact O-CG2 3.4Å; R848-V852 PolarHBondContact O-N 3.4Å; C849-V852 PolarHBondContact O-N 2.82Å; R850-V852 VanDerWaalsContact C-N 3.27Å; R850-V852 PolarHBondContact O-N 2.96Å; V852-T855 WeakPolarHBondContact CA-OG1 3.4Å; V852-T855 PolarHBondContact O-OG1 3.35Å; V852-T855 VanDerWaalsContact O-OG1 3.11Å; V852-L856 HydrophobicContact CG1-CD1 4.26Å; V852-L856 HydrophobicContact CG1-CG 4.47Å; V852-L856 VanDerWaalsContact O-CB 3.31Å; V852-L856 WeakPolarHBondContact O-CB 3.46Å; V852-L856 WeakPolarHBondContact O-CG 3.47Å; V852-L856 PolarHBondContact O-N 2.89Å
853	T	95.6	Very high	92.8	Very high	69 Å²	69	57.5 Å²	57.5	42%	0.423	29%	0.291	S	S	.	.	H	α-helix	trans	-63.4	-46.3	174.4	-55.1	0	0	0	0	110.7	L800 C849 R850 L856 A857	L800-T853 VanDerWaalsContact CD2-N 3.28Å; L800-T853 VanDerWaalsContact CD2-OG1 3.27Å; L800-T853 WeakPolarHBondContact CD2-OG1 3.34Å; C849-T853 PolarHBondContact O-N 2.88Å; C849-T853 PolarHBondContact O-OG1 3.46Å; C849-T853 VanDerWaalsContact O-OG1 3.08Å; R850-T853 CarbonylContact O-C 3.57Å; R850-T853 WeakPolarHBondContact O-CA 3.25Å; R850-T853 VanDerWaalsContact O-CB 3.32Å; R850-T853 WeakPolarHBondContact O-CB 3.27Å; R850-T853 PolarHBondContact O-N 2.88Å; T853-L856 PolarHBondContact O-N 3.43Å; T853-A857 VanDerWaalsContact O-CB 3.25Å; T853-A857 WeakPolarHBondContact O-CB 3.42Å; T853-A857 PolarHBondContact O-N 3.39Å
854	D	95.7	Very high	91.7	Very high	107 Å²	107	60.8 Å²	60.8	57%	0.572	31%	0.308	S	S	*	.	H	α-helix	trans	-67.8	-37.6	-176.5	-63.8	-34.1	0	0	0	111.5	R850 Q858	R850-D854 VanDerWaalsContact O-CG 3.23Å; R850-D854 PolarHBondContact O-N 3.16Å; D854-Q858 WeakPolarHBondContact O-CB 3.15Å; D854-Q858 PolarHBondContact O-N 3.05Å
855	T	94.3	Very high	90.2	Very high	46 Å²	46	66.4 Å²	66.4	28%	0.282	33%	0.326	S	S	.	.	H	α-helix	trans	-71.7	-43.4	173.9	48.5	0	0	0	0	112.5	G851 V852 A857 Q858 I859	G851-T855 WeakPolarHBondContact O-CG2 3.44Å; G851-T855 PolarHBondContact O-N 3.47Å; G851-T855 VanDerWaalsContact O-N 3.08Å; G851-T855 PolarHBondContact O-OG1 3.02Å; V852-T855 WeakPolarHBondContact CA-OG1 3.4Å; V852-T855 PolarHBondContact O-OG1 3.35Å; V852-T855 VanDerWaalsContact O-OG1 3.11Å; T855-A857 VanDerWaalsContact C-N 3.32Å; T855-A857 PolarHBondContact O-N 3.3Å; T855-Q858 PolarHBondContact O-N 3.48Å; T855-I859 VanDerWaalsContact O-CG1 3.28Å; T855-I859 WeakPolarHBondContact O-CG1 3.28Å; T855-I859 PolarHBondContact O-N 2.76Å
856	L	93.7	Very high	88.4	Confident	10 Å²	10	68.3 Å²	68.3	5%	0.052	35%	0.349	C	S	.	.	H	α-helix	trans	-58.4	-42.8	171.2	-81.2	174.8	0	0	0	111.9	V774 L793 K796 A797 L800 V852 T853 Q858 I859 R860	V774-L856 HydrophobicContact CG1-CD2 4.03Å; V774-L856 HydrophobicContact CG1-CG 4.05Å; V774-L856 HydrophobicContact CG2-CD1 4.25Å; V774-L856 HydrophobicContact CG2-CD2 3.68Å; V774-L856 HydrophobicContact CG2-CG 3.87Å; L793-L856 HydrophobicContact CD1-CD2 3.46Å; L793-L856 VanDerWaalsContact CD1-CD2 3.46Å; L793-L856 HydrophobicContact CG-CD2 4.2Å; K796-L856 HydrophobicContact CB-CD1 4.43Å; K796-L856 HydrophobicContact CB-CD2 4.17Å; A797-L856 HydrophobicContact CB-CD1 4.33Å; L800-L856 HydrophobicContact CB-CD1 4.36Å; L800-L856 HydrophobicContact CD2-CD1 3.8Å; V852-L856 HydrophobicContact CG1-CD1 4.26Å; V852-L856 HydrophobicContact CG1-CG 4.47Å; V852-L856 VanDerWaalsContact O-CB 3.31Å; V852-L856 WeakPolarHBondContact O-CB 3.46Å; V852-L856 WeakPolarHBondContact O-CG 3.47Å; V852-L856 PolarHBondContact O-N 2.89Å; T853-L856 PolarHBondContact O-N 3.43Å; L856-Q858 VanDerWaalsContact C-N 3.34Å; L856-Q858 PolarHBondContact O-N 2.88Å; L856-I859 PolarHBondContact O-N 3.42Å; L856-R860 WeakPolarHBondContact O-CB 3.4Å; L856-R860 PolarHBondContact O-N 2.92Å
857	A	91.8	Very high	85.9	Confident	34 Å²	34	73 Å²	73	28%	0.281	38%	0.378	S	S	.	.	H	α-helix	trans	-66.4	-35	177	0	0	0	0	0	112.4	T853 T855 R860 R861	T853-A857 VanDerWaalsContact O-CB 3.25Å; T853-A857 WeakPolarHBondContact O-CB 3.42Å; T853-A857 PolarHBondContact O-N 3.39Å; T855-A857 VanDerWaalsContact C-N 3.32Å; T855-A857 PolarHBondContact O-N 3.3Å; A857-R860 PolarHBondContact O-N 2.99Å; A857-R861 WeakPolarHBondContact O-CG 3.35Å; A857-R861 PolarHBondContact O-N 3.41Å
858	Q	90.7	Very high	83.6	Confident	75 Å²	75	72.3 Å²	72.3	35%	0.35	37%	0.372	S	S	.	.	H	α-helix	trans	-68.5	-43.3	173.9	-178.5	59.4	19.8	0	0	112.1	D854 T855 L856 R860 R861 Q862	D854-Q858 WeakPolarHBondContact O-CB 3.15Å; D854-Q858 PolarHBondContact O-N 3.05Å; T855-Q858 PolarHBondContact O-N 3.48Å; L856-Q858 VanDerWaalsContact C-N 3.34Å; L856-Q858 PolarHBondContact O-N 2.88Å; Q858-R860 VanDerWaalsContact C-N 3.31Å; Q858-R860 PolarHBondContact O-N 3.41Å; Q858-R861 PolarHBondContact O-N 3.34Å; Q858-Q862 WeakPolarHBondContact O-CG 3.48Å; Q858-Q862 PolarHBondContact O-N 3.48Å
859	I	89.3	Confident	80.9	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-61.9	-42.5	174	-64.8	160.8	0	0	0	109.9	V774 I777 Q778 V781 L793 T855 L856 R861 Q862 V863	V774-I859 HydrophobicContact CG1-CD1 3.83Å; I777-I859 HydrophobicContact CG2-CD1 4.39Å; I777-I859 HydrophobicContact CG2-CG2 4.14Å; Q778-I859 HydrophobicContact CB-CD1 3.87Å; Q778-I859 HydrophobicContact CB-CG1 4.36Å; Q778-I859 HydrophobicContact CG-CD1 4.19Å; Q778-I859 HydrophobicContact CG-CG1 4.22Å; V781-I859 HydrophobicContact CG2-CG2 4.36Å; L793-I859 HydrophobicContact CD1-CB 4.22Å; L793-I859 HydrophobicContact CD1-CG2 3.7Å; L793-I859 HydrophobicContact CD2-CG2 4.2Å; T855-I859 VanDerWaalsContact O-CG1 3.28Å; T855-I859 WeakPolarHBondContact O-CG1 3.28Å; T855-I859 PolarHBondContact O-N 2.76Å; L856-I859 PolarHBondContact O-N 3.42Å; I859-R861 PolarHBondContact O-N 2.9Å; I859-Q862 PolarHBondContact O-N 3.1Å; I859-V863 WeakPolarHBondContact O-CG2 3.43Å; I859-V863 PolarHBondContact O-N 3.1Å
860	R	87.3	Confident	78	Confident	107 Å²	107	79 Å²	79	40%	0.404	43%	0.425	S	S	.	.	H	α-helix	trans	-59.6	-47.4	177.7	-166.8	170.1	-176.9	141	10.4	111.8	L793 E794 L856 A857 Q858 Q862 V863 D864	L793-R860 HydrophobicContact CD2-CB 3.7Å; L793-R860 HydrophobicContact CD2-CG 4.06Å; E794-R860 IonicContact OE1-CZ 2.61Å; E794-R860 VanDerWaalsContact OE1-CZ 3.28Å; E794-R860 IonicContact OE1-NH1 3.33Å; E794-R860 PolarHBondContact OE1-NH1 3.15Å; E794-R860 IonicContact OE1-NH2 2.63Å; E794-R860 PolarHBondContact OE1-NH2 2.58Å; L856-R860 WeakPolarHBondContact O-CB 3.4Å; L856-R860 PolarHBondContact O-N 2.92Å; A857-R860 PolarHBondContact O-N 2.99Å; Q858-R860 VanDerWaalsContact C-N 3.31Å; Q858-R860 PolarHBondContact O-N 3.41Å; R860-Q862 VanDerWaalsContact C-N 3.34Å; R860-Q862 PolarHBondContact O-N 3.49Å; R860-V863 PolarHBondContact O-N 3.3Å; R860-V863 VanDerWaalsContact O-N 3.15Å; R860-D864 IonicContact NE-OD2 2.72Å; R860-D864 WeakPolarHBondContact O-CB 3.37Å; R860-D864 PolarHBondContact O-N 3.12Å
861	R	86.4	Confident	75.6	Confident	118 Å²	118	78.7 Å²	78.7	45%	0.445	44%	0.439	S	S	.	.	H	α-helix	trans	-58.3	-42.8	173.4	-73.5	-175.5	-66.1	-93.1	3.3	112.7	A857 Q858 I859 V863 D864 E865	A857-R861 WeakPolarHBondContact O-CG 3.35Å; A857-R861 PolarHBondContact O-N 3.41Å; Q858-R861 PolarHBondContact O-N 3.34Å; I859-R861 PolarHBondContact O-N 2.9Å; R861-V863 VanDerWaalsContact C-N 3.26Å; R861-V863 PolarHBondContact O-N 3.25Å; R861-D864 PolarHBondContact O-N 3.24Å; R861-E865 WeakPolarHBondContact O-CB 3.45Å; R861-E865 PolarHBondContact O-N 2.79Å
862	Q	80	Confident	72.7	Confident	90 Å²	90	83.7 Å²	83.7	42%	0.421	46%	0.457	S	S	.	.	H	α-helix	trans	-64.9	-27.7	177.8	-73.3	173.2	-28.8	0	0	113.3	Q858 I859 R860	Q858-Q862 WeakPolarHBondContact O-CG 3.48Å; Q858-Q862 PolarHBondContact O-N 3.48Å; I859-Q862 PolarHBondContact O-N 3.1Å; R860-Q862 VanDerWaalsContact C-N 3.34Å; R860-Q862 PolarHBondContact O-N 3.49Å
863	V	76.1	Confident	69.9	Low	50 Å²	50	89.9 Å²	89.9	30%	0.303	49%	0.49	S	S	.	.	H	α-helix	trans	-84.4	-42.2	175.1	174.2	0	0	0	0	111.9	I859 R860 R861	I859-V863 WeakPolarHBondContact O-CG2 3.43Å; I859-V863 PolarHBondContact O-N 3.1Å; R860-V863 PolarHBondContact O-N 3.3Å; R860-V863 VanDerWaalsContact O-N 3.15Å; R861-V863 VanDerWaalsContact C-N 3.26Å; R861-V863 PolarHBondContact O-N 3.25Å
864	D	72.9	Confident	67.1	Low	120 Å²	120	95.2 Å²	95.2	64%	0.642	52%	0.515	S	S	*	.	H	α-helix	trans	-69.9	-38.9	-179.7	-82.7	-37.5	0	0	0	112.8	R860 R861	R860-D864 IonicContact NE-OD2 2.72Å; R860-D864 WeakPolarHBondContact O-CB 3.37Å; R860-D864 PolarHBondContact O-N 3.12Å; R861-D864 PolarHBondContact O-N 3.24Å
865	E	66.6	Low	64.4	Low	150 Å²	150	98.5 Å²	98.5	70%	0.701	53%	0.532	S	S	*	.	S	Bend	trans	-82.9	-19.9	-177.2	-67.4	-170.3	164.1	0	0	113.9	R861 V867	R861-E865 WeakPolarHBondContact O-CB 3.45Å; R861-E865 PolarHBondContact O-N 2.79Å; E865-V867 PolarHBondContact O-N 2.91Å
866	G	57.5	Low	61.4	Low	51 Å²	51	101.7 Å²	101.7	53%	0.526	56%	0.556	S	S	.	*			trans	64.3	-8.4	171.1	0	0	0	0	0	117.7	W868	G866-W868 PolarHBondContact O-N 2.94Å
867	V	43.8	Very low	58.5	Low	122 Å²	122	110.1 Å²	110.1	74%	0.739	60%	0.595	S	S	*	*			trans	-81.6	97.6	-177.5	178	0	0	0	0	111.1	E865 P869	E865-V867 PolarHBondContact O-N 2.91Å; V867-P869 WeakPolarHBondContact O-CD 3.43Å
868	W	48.9	Very low	55.7	Low	121 Å²	121	113.9 Å²	113.9	46%	0.458	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-76.9	118.5	158.5	-66.1	100.1	0	0	0	109.6	V781 H785 G866	V781-W868 HydrophobicContact CG1-CH2 3.69Å; V781-W868 HydrophobicContact CG1-CZ2 4.13Å; V781-W868 VanDerWaalsContact O-CH2 3.27Å; V781-W868 WeakPolarHBondContact O-CH2 3.38Å; H785-W868 HydrophobicContact CB-CZ2 4.2Å; H785-W868 AromaticContact CE1-CE3 3.55Å; H785-W868 AromaticContact CE1-CZ3 3.64Å; H785-W868 AromaticContact ND1-CD2 3.41Å; H785-W868 AromaticContact ND1-CE2 3.5Å; H785-W868 AromaticContact ND1-CE3 3.27Å; H785-W868 VanDerWaalsContact ND1-CE3 3.27Å; H785-W868 AromaticContact ND1-CH2 3.35Å; H785-W868 WeakPolarHBondContact ND1-CH2 3.44Å; H785-W868 AromaticContact ND1-CZ2 3.48Å; H785-W868 WeakPolarHBondContact ND1-CZ2 3.47Å; H785-W868 AromaticContact ND1-CZ3 3.25Å; H785-W868 WeakPolarHBondContact ND1-CZ3 3.49Å; G866-W868 PolarHBondContact O-N 2.94Å
869	P	41.4	Very low	53.1	Low	104 Å²	104	116.5 Å²	116.5	68%	0.675	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-65.1	132.2	168.2	27.3	-32.7	0	0	0	109.2	V867	V867-P869 WeakPolarHBondContact O-CD 3.43Å
870	P	35.8	Very low	50.3	Low	117 Å²	117	126.6 Å²	126.6	76%	0.76	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-69.7	136.7	-174.5	27.6	-34.6	0	0	0	111.3	N872	P870-N872 PolarHBondContact O-N 2.89Å
871	P	47.3	Very low	47.6	Very low	120 Å²	120	130.7 Å²	130.7	78%	0.779	71%	0.707	S	S	*	*			trans	-78.7	106.5	-178.4	30.4	-33.5	0	0	0	111.1
872	N	35.1	Very low	44.8	Very low	141 Å²	141	131.4 Å²	131.4	75%	0.754	72%	0.724	S	S	*	*			trans	-158.6	131.1	164.1	-109.2	-43.6	0	0	0	115.4	P870	P870-N872 PolarHBondContact O-N 2.89Å
873	N	38.7	Very low	42.3	Very low	135 Å²	135	132.9 Å²	132.9	72%	0.722	74%	0.74	S	S	*	*			trans	54	100	151.3	-58.6	-43.4	0	0	0	120.9
874	L	35	Very low	40.1	Very low	181 Å²	181	133.9 Å²	133.9	95%	0.948	75%	0.754	S	S	*	*			trans	-132.2	83.4	142.2	-79.1	-178.8	0	0	0	111
875	L	40.8	Very low	37.9	Very low	177 Å²	177	136 Å²	136	93%	0.927	76%	0.759	S	S	*	*			trans	-139	81.8	164.7	-109.7	178.5	0	0	0	110
876	S	30.6	Very low	36.3	Very low	112 Å²	112	133.7 Å²	133.7	78%	0.783	76%	0.756	S	S	*	*			trans	-160.7	151.8	161.9	-164.6	0	0	0	0	112.4
877	Q	33.5	Very low	34.7	Very low	187 Å²	187	138 Å²	138	87%	0.874	77%	0.767	S	S	*	*			trans	76.1	89.7	172.5	-52.6	-162.4	55.2	0	0	118
878	S	32.4	Very low	34.2	Very low	114 Å²	114	140.6 Å²	140.6	80%	0.797	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-97.7	131.3	148.2	51.9	0	0	0	0	109.9
879	P	36	Very low	33.2	Very low	129 Å²	129	141.1 Å²	141.1	84%	0.838	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-82.8	135.5	177.9	31.4	-32.9	0	0	0	111.7
880	K	30	Very low	32.6	Very low	212 Å²	212	145.4 Å²	145.4	92%	0.922	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-80.9	145.6	169.1	-67.4	178.6	179.6	176.1	0	110.2
881	K	30.1	Very low	32.1	Very low	193 Å²	193	145.3 Å²	145.3	84%	0.839	79%	0.79	S	S	*	*			trans	-115.2	119.4	176.4	-171.8	-175.7	-180	-174.8	0	112.2
882	V	28.1	Very low	31.4	Very low	133 Å²	133	146.2 Å²	146.2	81%	0.806	79%	0.794	S	S	*	*			trans	-146.8	130.3	159.6	175.4	0	0	0	0	103
883	T	27.6	Very low	31	Very low	121 Å²	121	145.9 Å²	145.9	74%	0.742	79%	0.792	S	S	*	*			cis	-132.2	-177	34.8	-20.4	0	0	0	0	113
884	A	30.9	Very low	30.8	Very low	72 Å²	72	147.3 Å²	147.3	60%	0.595	79%	0.792	S	S	*	*			trans	-80.1	178.9	165.4	0	0	0	0	0	110.5
885	E	26.4	Very low	30.5	Very low	163 Å²	163	146.3 Å²	146.3	76%	0.762	78%	0.782	S	S	*	*			cis	-98.2	152.7	25	-60.9	-52.5	135.2	0	0	113.8
886	T	31.4	Very low	30.2	Very low	102 Å²	102	145.2 Å²	145.2	63%	0.626	77%	0.774	S	S	*	*				63.4	115.6	62.9	-28.8	0	0	0	0	110.8
887	D	25.6	Very low	30.4	Very low	142 Å²	142	145.3 Å²	145.3	76%	0.759	77%	0.772	S	S	*	*			cis	-142.5	-177.2	32.7	-141.3	-39.1	0	0	0	115.2
888	F	33.3	Very low	31.2	Very low	177 Å²	177	142 Å²	142	78%	0.776	77%	0.767	S	S	*	*			trans	-80	170.7	-171.5	-83	-100.4	0	0	0	115
889	N	27.9	Very low	32.2	Very low	132 Å²	132	142.5 Å²	142.5	71%	0.706	77%	0.768	S	S	*	*			cis	-161.9	161.3	30.8	-144.3	-45.7	0	0	0	115.7
890	K	28.9	Very low	32.4	Very low	194 Å²	194	141.7 Å²	141.7	84%	0.843	77%	0.765	S	S	*	*			trans	76	120.3	166.1	-60.5	-169.2	177.1	179.2	0	120.7
891	S	23.5	Very low	33.7	Very low	114 Å²	114	137.5 Å²	137.5	80%	0.797	76%	0.759	S	S	*	*			trans	-148.1	-177.6	174.3	49.8	0	0	0	0	107.7
892	V	32.9	Very low	34.6	Very low	140 Å²	140	133.3 Å²	133.3	85%	0.848	75%	0.752	S	S	*	*			cis	-146	178	10.6	-141	0	0	0	0	109.8
893	D	27.3	Very low	34.6	Very low	134 Å²	134	134.7 Å²	134.7	72%	0.717	75%	0.754	S	S	*	*			trans	-141.9	157	178	-162.1	-129.4	0	0	0	112
894	F	34	Very low	34.5	Very low	165 Å²	165	136.4 Å²	136.4	72%	0.724	76%	0.759	S	S	*	*			trans	54.2	131.8	157	-97.4	-117.9	0	0	0	126.9
895	E	30	Very low	34.2	Very low	159 Å²	159	139.8 Å²	139.8	74%	0.743	77%	0.766	S	S	*	*				65.1	133.3	127.1	-159.4	160.5	-155	0	0	128.1
896	M	34.4	Very low	34.4	Very low	155 Å²	155	140.5 Å²	140.5	76%	0.764	77%	0.769	S	S	*	*			trans	19.8	137.7	151.6	-159.1	70.3	78.9	0	0	125.6
897	P	33.8	Very low	34.1	Very low	114 Å²	114	142.9 Å²	142.9	74%	0.74	77%	0.773	S	S	*	*			trans	-146.6	162.4	136.5	39.9	-25	0	0	0	117.9
898	P	50	Low	34.4	Very low	117 Å²	117	143.8 Å²	143.8	76%	0.76	78%	0.777	S	S	*	*			trans	-109.3	-167.1	168.5	43.3	-35.4	0	0	0	112.8
899	P	53.9	Low	34	Very low	125 Å²	125	140.9 Å²	140.9	81%	0.812	78%	0.778	S	S	*	*			cis	-127.1	-168	-17.7	37.6	-17.5	0	0	0	115
900	S	39.8	Very low	33.8	Very low	112 Å²	112	137.4 Å²	137.4	78%	0.783	77%	0.774	S	S	*	*			trans	-113.8	-171.3	177.4	-33.9	0	0	0	0	112.2
901	P	58.7	Low	34.6	Very low	123 Å²	123	134.3 Å²	134.3	80%	0.799	77%	0.773	S	S	*	*			cis	-125.6	-121.8	20.4	27.6	1.4	0	0	0	112.1
902	P	49	Very low	34.9	Very low	105 Å²	105	132.8 Å²	132.8	68%	0.682	77%	0.768	S	S	*	*			cis	-141.5	-172.2	-21.6	37.3	-13.8	0	0	0	118.6
903	L	27	Very low	34.6	Very low	162 Å²	162	135.8 Å²	135.8	85%	0.848	77%	0.773	S	S	*	*			trans	96.7	126.4	152.7	-69.4	-171.8	0	0	0	126.1
904	N	26	Very low	34.7	Very low	158 Å²	158	133.3 Å²	133.3	85%	0.845	78%	0.779	S	S	*	*			trans	104.7	156.6	137.4	-120.5	-26.4	0	0	0	123.2
905	L	24.9	Very low	34.4	Very low	142 Å²	142	130.2 Å²	130.2	74%	0.743	78%	0.784	S	S	*	*			trans	-128.9	150.2	-155.7	177.4	76.5	0	0	0	112.3
906	H	29.5	Very low	34.2	Very low	178 Å²	178	127.8 Å²	127.8	82%	0.824	78%	0.784	S	S	*	*			trans	-158.9	154.8	147.2	-124.9	-79.8	0	0	0	113.3
907	E	25.7	Very low	33.9	Very low	152 Å²	152	127.9 Å²	127.9	71%	0.71	79%	0.787	S	S	*	*			trans	-92.8	157.2	-178.1	-57.2	166.1	97.3	0	0	113.5
908	L	31.3	Very low	33.5	Very low	162 Å²	162	128.2 Å²	128.2	85%	0.848	79%	0.787	S	S	*	*				163.1	141.9	111.8	-85.7	175.5	0	0	0	114.4
909	S	24.8	Very low	32.9	Very low	115 Å²	115	127.8 Å²	127.8	80%	0.804	79%	0.785	S	S	*	*			trans	51	138.4	151.8	-150.8	0	0	0	0	123.1
910	G	24.1	Very low	31.7	Very low	60 Å²	60	131.9 Å²	131.9	62%	0.619	79%	0.79	S	S	*	*			trans	-91.9	-150.8	152	0	0	0	0	0	111.5
911	P	45.6	Very low	31.1	Very low	128 Å²	128	130.3 Å²	130.3	83%	0.831	79%	0.791	S	S	*	*			cis	-139.5	-169.1	2.5	43.2	-24.7	0	0	0	115.6
912	A	30.1	Very low	29.6	Very low	83 Å²	83	128.4 Å²	128.4	69%	0.686	79%	0.794	S	S	*	*			trans	84.7	132.8	143	0	0	0	0	0	123.1
913	E	27.7	Very low	28.6	Very low	202 Å²	202	130.9 Å²	130.9	94%	0.944	80%	0.801	S	S	*	*			trans	61.2	162.5	145.3	-67.2	-165	122.7	0	0	122.9
914	G	29.4	Very low	29.6	Very low	83 Å²	83	127.7 Å²	127.7	86%	0.856	79%	0.791	S	S	*	*			trans	122.5	99.4	169	0	0	0	0	0	114.4
915	A	27.6	Very low	29.7	Very low	99 Å²	99	125.7 Å²	125.7	82%	0.818	78%	0.784	S	S	*	*			trans	-112.7	145.1	179.3	0	0	0	0	0	113.1
916	S	24.7	Very low	29.9	Very low	108 Å²	108	128.8 Å²	128.8	76%	0.755	79%	0.792	S	S	*	*			trans	59.6	124	156.3	-160.8	0	0	0	0	119.1
917	L	28.9	Very low	29.7	Very low	158 Å²	158	123.6 Å²	123.6	83%	0.827	79%	0.786	S	S	*	*				-178.1	151.9	104.2	-94.3	170.5	0	0	0	112.7
918	T	26	Very low	30	Very low	121 Å²	121	124.3 Å²	124.3	74%	0.742	79%	0.794	S	S	*	*			trans	-86.6	171.4	165.5	55.4	0	0	0	0	108.9
919	P	37.2	Very low	29.9	Very low	108 Å²	108	122.5 Å²	122.5	70%	0.701	79%	0.785	S	S	*	*			cis	-153.3	-178.4	29	44.9	-23.3	0	0	0	119.8
920	K	27.2	Very low	30.4	Very low	210 Å²	210	122.8 Å²	122.8	91%	0.913	78%	0.782	S	S	*	*			trans	48.2	123.8	148.1	-76.4	177.2	176.9	-179.4	0	120.5
921	G	27.9	Very low	31.2	Very low	80 Å²	80	125.9 Å²	125.9	83%	0.825	79%	0.791	S	S	*	*			trans	-173.7	124.9	155.6	0	0	0	0	0	113
922	G	27.3	Very low	30.3	Very low	83 Å²	83	123.4 Å²	123.4	86%	0.856	79%	0.789	S	S	*	*			trans	-69.3	156.8	-169.4	0	0	0	0	0	117.8
923	N	28	Very low	30.5	Very low	156 Å²	156	128.6 Å²	128.6	83%	0.834	80%	0.796	S	S	*	*			trans	-62.1	170.7	154	-131.1	3.6	0	0	0	109.7
924	P	48	Very low	30.9	Very low	96 Å²	96	129.6 Å²	129.6	62%	0.623	79%	0.791	S	S	*	*			cis	-143.4	-173.2	10.9	32	-6.5	0	0	0	117.5
925	T	27	Very low	30.9	Very low	115 Å²	115	131 Å²	131	71%	0.706	79%	0.788	S	S	*	*			trans	119	129.6	143.5	67.7	0	0	0	0	118.9
926	K	29.3	Very low	31.7	Very low	207 Å²	207	131.7 Å²	131.7	90%	0.9	78%	0.782	S	S	*	*			trans	31.3	127.6	146.2	-55	176.4	-178.3	-179.7	0	118.6
927	G	26.8	Very low	32.6	Very low	69 Å²	69	133.1 Å²	133.1	71%	0.711	78%	0.781	S	S	*	*			cis	141.5	171.1	4.9	0	0	0	0	0	111
928	L	31	Very low	33.2	Very low	167 Å²	167	134.9 Å²	134.9	87%	0.874	78%	0.782	S	S	*	*			trans	71.2	141.6	178.3	-148.5	62.4	0	0	0	113.2
929	D	28.4	Very low	34.2	Very low	125 Å²	125	132.9 Å²	132.9	67%	0.668	78%	0.778	S	S	*	*			cis	-138.3	-174.8	2.5	-144	-46.4	0	0	0	111.8
930	T	36.3	Very low	34.6	Very low	120 Å²	120	132.4 Å²	132.4	74%	0.736	77%	0.773	S	S	*	*			trans	-81.3	-176.3	-176.3	66.8	0	0	0	0	114
931	P	40.7	Very low	35.6	Very low	125 Å²	125	126.7 Å²	126.7	81%	0.812	76%	0.759	S	S	*	*			cis	-129.1	154.4	-12.7	37.6	-22.2	0	0	0	114.9
932	G	27.1	Very low	36.7	Very low	76 Å²	76	127.8 Å²	127.8	78%	0.784	75%	0.75	S	S	*	*			trans	179.3	118.1	169.7	0	0	0	0	0	121.7
933	K	34.5	Very low	37.8	Very low	192 Å²	192	128.7 Å²	128.7	84%	0.835	73%	0.732	S	S	*	*			trans	55.4	129.2	130.1	-142.7	-171.2	-177.3	176.4	0	121.6
934	R	35.1	Very low	39.1	Very low	223 Å²	223	123.7 Å²	123.7	84%	0.842	71%	0.712	S	S	*	*			trans	91.6	143.5	160.8	-52.4	-178.4	-68.1	-172.6	2.6	117
935	S	30.8	Very low	39.7	Very low	112 Å²	112	121.6 Å²	121.6	78%	0.783	70%	0.703	S	S	*	*			trans	-134.3	110.4	170.2	141.7	0	0	0	0	107.3
936	V	44.5	Very low	41.1	Very low	115 Å²	115	122 Å²	122	70%	0.697	70%	0.697	S	S	*	*			trans	-140.1	48.4	-179.9	-167.4	0	0	0	0	110
937	D	42.1	Very low	42.9	Very low	137 Å²	137	119 Å²	119	73%	0.733	68%	0.68	S	S	*	*			trans	-127.6	61.4	-169.9	-67.6	-80.4	0	0	0	112.3
938	K	42.9	Very low	44.9	Very low	195 Å²	195	118.9 Å²	118.9	85%	0.848	66%	0.662	S	S	*	*	S	Bend	trans	-132.8	-11	168.8	-73	-169.3	175.8	-179.9	0	115.5
939	A	45.3	Very low	46	Very low	80 Å²	80	119.5 Å²	119.5	66%	0.661	65%	0.653	S	S	*	*	S	Bend	trans	-82.1	-44.3	175.3	0	0	0	0	0	112.4	S941 V942	A939-S941 VanDerWaalsContact C-N 3.26Å; A939-S941 PolarHBondContact O-N 3.43Å; A939-S941 VanDerWaalsContact O-N 3.17Å; A939-V942 PolarHBondContact O-N 3.1Å
940	V	45.9	Very low	48	Very low	97 Å²	97	118.1 Å²	118.1	59%	0.588	64%	0.643	S	S	*	*	H	α-helix	trans	-60.5	-31.1	-172.8	-177.6	0	0	0	0	113.1	V942 E943 A944	V940-V942 VanDerWaalsContact C-N 3.31Å; V940-V942 PolarHBondContact O-N 3.49Å; V940-E943 PolarHBondContact O-N 3.47Å; V940-A944 VanDerWaalsContact O-CB 3.28Å; V940-A944 WeakPolarHBondContact O-CB 3.41Å; V940-A944 PolarHBondContact O-N 3.15Å
941	S	49	Very low	49.3	Very low	90 Å²	90	119 Å²	119	63%	0.629	64%	0.639	S	S	*	*	H	α-helix	trans	-67.6	-25.2	-175.5	-170.5	0	0	0	0	114.5	A939 A945	A939-S941 VanDerWaalsContact C-N 3.26Å; A939-S941 PolarHBondContact O-N 3.43Å; A939-S941 VanDerWaalsContact O-N 3.17Å; S941-A945 WeakPolarHBondContact O-CB 3.32Å; S941-A945 PolarHBondContact O-N 3.06Å
942	V	49.8	Very low	50.4	Low	103 Å²	103	118.7 Å²	118.7	62%	0.624	63%	0.625	S	S	*	*	H	α-helix	trans	-79	-48.8	176.1	179.3	0	0	0	0	109.4	A939 V940 A944 A945 E946	A939-V942 PolarHBondContact O-N 3.1Å; V940-V942 VanDerWaalsContact C-N 3.31Å; V940-V942 PolarHBondContact O-N 3.49Å; V942-A944 PolarHBondContact O-N 3.09Å; V942-A945 PolarHBondContact O-N 3.38Å; V942-A945 VanDerWaalsContact O-N 3.11Å; V942-E946 WeakPolarHBondContact O-CB 3.38Å; V942-E946 PolarHBondContact O-N 3.37Å
943	E	51	Low	52.1	Low	103 Å²	103	121.3 Å²	121.3	48%	0.481	61%	0.611	S	S	.	*	H	α-helix	trans	-65.9	-23.1	179.4	-131.2	-168.7	95.1	0	0	113.2	V940 R947	V940-E943 PolarHBondContact O-N 3.47Å; E943-R947 VanDerWaalsContact CG-NH1 3.34Å; E943-R947 VanDerWaalsContact O-CG 3.31Å; E943-R947 WeakPolarHBondContact O-CG 3.33Å; E943-R947 PolarHBondContact O-N 3.44Å; E943-R947 PolarHBondContact O-NH1 2.85Å; E943-R947 IonicContact OE1-CZ 2.74Å; E943-R947 IonicContact OE1-NH1 3.88Å; E943-R947 PolarHBondContact OE1-NH1 3.43Å; E943-R947 IonicContact OE1-NH2 3.14Å; E943-R947 PolarHBondContact OE1-NH2 2.92Å
944	A	55.7	Low	53.1	Low	51 Å²	51	114.5 Å²	114.5	42%	0.421	59%	0.59	S	S	.	*	H	α-helix	trans	-78.1	-41.7	170.6	0	0	0	0	0	112.3	V940 V942 E946 R947 D948	V940-A944 VanDerWaalsContact O-CB 3.28Å; V940-A944 WeakPolarHBondContact O-CB 3.41Å; V940-A944 PolarHBondContact O-N 3.15Å; V942-A944 PolarHBondContact O-N 3.09Å; A944-E946 VanDerWaalsContact C-N 3.33Å; A944-R947 PolarHBondContact O-N 3.4Å; A944-D948 PolarHBondContact O-N 2.87Å
945	A	60.6	Low	54	Low	51 Å²	51	106.8 Å²	106.8	42%	0.421	57%	0.574	S	S	.	*	H	α-helix	trans	-67.6	-34.7	175.8	0	0	0	0	0	112.2	S941 V942 D948 W949	S941-A945 WeakPolarHBondContact O-CB 3.32Å; S941-A945 PolarHBondContact O-N 3.06Å; V942-A945 PolarHBondContact O-N 3.38Å; V942-A945 VanDerWaalsContact O-N 3.11Å; A945-D948 PolarHBondContact O-N 3.41Å; A945-W949 PolarHBondContact O-N 2.95Å; A945-W949 VanDerWaalsContact O-N 3.16Å
946	E	56.8	Low	54.9	Low	124 Å²	124	108.1 Å²	108.1	58%	0.579	57%	0.572	S	S	*	*	H	α-helix	trans	-67.7	-42.9	174.1	-167.2	161.8	-143.3	0	0	111.1	V942 A944 D948 W949 E950	V942-E946 WeakPolarHBondContact O-CB 3.38Å; V942-E946 PolarHBondContact O-N 3.37Å; A944-E946 VanDerWaalsContact C-N 3.33Å; E946-D948 PolarHBondContact O-N 2.88Å; E946-W949 CarbonylContact O-C 3.52Å; E946-W949 PolarHBondContact O-N 2.92Å; E946-E950 WeakPolarHBondContact O-CB 3.43Å; E946-E950 PolarHBondContact O-N 3.39Å
947	R	66.1	Low	55.4	Low	145 Å²	145	108.2 Å²	108.2	55%	0.547	57%	0.573	S	S	.	*	H	α-helix	trans	-61.2	-40.8	171.7	-79.4	-179.2	-173.5	85.3	-4	113.5	E943 A944 W949 E950 E951	E943-R947 VanDerWaalsContact CG-NH1 3.34Å; E943-R947 VanDerWaalsContact O-CG 3.31Å; E943-R947 WeakPolarHBondContact O-CG 3.33Å; E943-R947 PolarHBondContact O-N 3.44Å; E943-R947 PolarHBondContact O-NH1 2.85Å; E943-R947 IonicContact OE1-CZ 2.74Å; E943-R947 IonicContact OE1-NH1 3.88Å; E943-R947 PolarHBondContact OE1-NH1 3.43Å; E943-R947 IonicContact OE1-NH2 3.14Å; E943-R947 PolarHBondContact OE1-NH2 2.92Å; A944-R947 PolarHBondContact O-N 3.4Å; R947-W949 VanDerWaalsContact C-N 3.27Å; R947-W949 PolarHBondContact O-N 3.35Å; R947-E950 WeakPolarHBondContact O-CB 3.28Å; R947-E950 PolarHBondContact O-N 2.84Å; R947-E950 VanDerWaalsContact O-N 3.15Å; R947-E951 WeakPolarHBondContact O-CB 3.4Å; R947-E951 PolarHBondContact O-N 2.75Å
948	D	69.6	Low	55.8	Low	65 Å²	65	109.1 Å²	109.1	35%	0.348	57%	0.573	S	S	.	*	H	α-helix	trans	-62	-34.9	175.2	176.5	70.3	0	0	0	112.3	A944 A945 E946 K952	A944-D948 PolarHBondContact O-N 2.87Å; A945-D948 PolarHBondContact O-N 3.41Å; E946-D948 PolarHBondContact O-N 2.88Å; D948-K952 WeakPolarHBondContact O-CB 3.37Å; D948-K952 VanDerWaalsContact O-CG 3.27Å; D948-K952 WeakPolarHBondContact O-CG 3.5Å; D948-K952 PolarHBondContact O-N 3.28Å; D948-K952 IonicContact OD1-NZ 2.67Å; D948-K952 PolarHBondContact OD1-NZ 3.48Å; D948-K952 IonicContact OD2-NZ 2.68Å; D948-K952 PolarHBondContact OD2-NZ 2.84Å
949	W	54.5	Low	56.4	Low	180 Å²	180	108 Å²	108	68%	0.682	56%	0.564	S	S	*	*	H	α-helix	trans	-79.8	-22	173.2	-89.1	82	0	0	0	114.4	A945 E946 R947 R953	A945-W949 PolarHBondContact O-N 2.95Å; A945-W949 VanDerWaalsContact O-N 3.16Å; E946-W949 CarbonylContact O-C 3.52Å; E946-W949 PolarHBondContact O-N 2.92Å; R947-W949 VanDerWaalsContact C-N 3.27Å; R947-W949 PolarHBondContact O-N 3.35Å; W949-R953 PolarHBondContact O-NH2 3.26Å; W949-R953 VanDerWaalsContact O-NH2 3.17Å
950	E	70.2	Confident	57.3	Low	97 Å²	97	106.9 Å²	106.9	45%	0.453	55%	0.552	S	S	.	*	H	α-helix	trans	-74.5	-45.9	169.4	-154.1	65.3	-149.3	0	0	110.2	E946 R947 R953 A954	E946-E950 WeakPolarHBondContact O-CB 3.43Å; E946-E950 PolarHBondContact O-N 3.39Å; R947-E950 WeakPolarHBondContact O-CB 3.28Å; R947-E950 PolarHBondContact O-N 2.84Å; R947-E950 VanDerWaalsContact O-N 3.15Å; E950-R953 WeakPolarHBondContact O-CA 3.49Å; E950-R953 VanDerWaalsContact O-CB 3.22Å; E950-R953 WeakPolarHBondContact O-CB 2.99Å; E950-R953 PolarHBondContact O-N 3.47Å; E950-R953 IonicContact OE1-CZ 3.19Å; E950-R953 IonicContact OE1-NH1 2.68Å; E950-R953 PolarHBondContact OE1-NH1 2.96Å; E950-R953 IonicContact OE1-NH2 3.59Å; E950-R953 IonicContact OE2-CZ 2.81Å; E950-R953 IonicContact OE2-NH1 3.18Å; E950-R953 PolarHBondContact OE2-NH1 2.91Å; E950-R953 IonicContact OE2-NH2 2.89Å; E950-R953 PolarHBondContact OE2-NH2 3.26Å; E950-A954 PolarHBondContact O-N 2.94Å
951	E	63	Low	58.1	Low	139 Å²	139	105.4 Å²	105.4	65%	0.65	55%	0.55	S	S	*	.	H	α-helix	trans	-66.6	-40.8	178.8	-174	169.9	-168.4	0	0	111.8	R947 R953 A954 A955	R947-E951 WeakPolarHBondContact O-CB 3.4Å; R947-E951 PolarHBondContact O-N 2.75Å; E951-R953 PolarHBondContact O-N 2.93Å; E951-A954 PolarHBondContact O-N 3.33Å; E951-A955 WeakPolarHBondContact O-CB 3.29Å; E951-A955 PolarHBondContact O-N 3.1Å
952	K	63.8	Low	59.1	Low	118 Å²	118	109.2 Å²	109.2	51%	0.513	56%	0.555	S	S	.	*	H	α-helix	trans	-61.3	-26.3	170	-77.8	177.9	174.8	76.6	0	113.3	D948	D948-K952 WeakPolarHBondContact O-CB 3.37Å; D948-K952 VanDerWaalsContact O-CG 3.27Å; D948-K952 WeakPolarHBondContact O-CG 3.5Å; D948-K952 PolarHBondContact O-N 3.28Å; D948-K952 IonicContact OD1-NZ 2.67Å; D948-K952 PolarHBondContact OD1-NZ 3.48Å; D948-K952 IonicContact OD2-NZ 2.68Å; D948-K952 PolarHBondContact OD2-NZ 2.84Å
953	R	63.3	Low	60.3	Low	131 Å²	131	108 Å²	108	49%	0.494	55%	0.545	S	S	.	.	H	α-helix	trans	-78	-42.2	173.9	-141	-179.3	-51.8	126.1	18.2	111.3	W949 E950 E951 L956 T957	W949-R953 PolarHBondContact O-NH2 3.26Å; W949-R953 VanDerWaalsContact O-NH2 3.17Å; E950-R953 WeakPolarHBondContact O-CA 3.49Å; E950-R953 VanDerWaalsContact O-CB 3.22Å; E950-R953 WeakPolarHBondContact O-CB 2.99Å; E950-R953 PolarHBondContact O-N 3.47Å; E950-R953 IonicContact OE1-CZ 3.19Å; E950-R953 IonicContact OE1-NH1 2.68Å; E950-R953 PolarHBondContact OE1-NH1 2.96Å; E950-R953 IonicContact OE1-NH2 3.59Å; E950-R953 IonicContact OE2-CZ 2.81Å; E950-R953 IonicContact OE2-NH1 3.18Å; E950-R953 PolarHBondContact OE2-NH1 2.91Å; E950-R953 IonicContact OE2-NH2 2.89Å; E950-R953 PolarHBondContact OE2-NH2 3.26Å; E951-R953 PolarHBondContact O-N 2.93Å; R953-L956 PolarHBondContact O-N 3.43Å; R953-T957 PolarHBondContact O-N 3.27Å; R953-T957 PolarHBondContact O-OG1 2.91Å
954	A	54.1	Low	61.4	Low	49 Å²	49	107.1 Å²	107.1	41%	0.405	54%	0.543	S	S	.	.	H	α-helix	trans	-64.7	-40.2	174.7	0	0	0	0	0	112.5	E950 E951 L956 T957 Q958	E950-A954 PolarHBondContact O-N 2.94Å; E951-A954 PolarHBondContact O-N 3.33Å; A954-L956 PolarHBondContact O-N 3.37Å; A954-T957 CarbonylContact O-C 3.48Å; A954-T957 PolarHBondContact O-N 2.7Å; A954-T957 PolarHBondContact O-OG1 2.82Å; A954-Q958 WeakPolarHBondContact O-CG 3.43Å; A954-Q958 PolarHBondContact O-N 2.89Å
955	A	55.8	Low	62.5	Low	61 Å²	61	109.1 Å²	109.1	50%	0.504	55%	0.546	S	S	.	.	H	α-helix	trans	-60.2	-32.3	174.6	0	0	0	0	0	112.4	E951 T957 Q958	E951-A955 WeakPolarHBondContact O-CB 3.29Å; E951-A955 PolarHBondContact O-N 3.1Å; A955-T957 VanDerWaalsContact C-N 3.33Å; A955-Q958 PolarHBondContact O-N 3.17Å
956	L	49.3	Very low	63.8	Low	139 Å²	139	113.8 Å²	113.8	73%	0.728	55%	0.553	S	S	*	*	H	α-helix	trans	-76.1	-20	176.2	-160.6	65.5	0	0	0	112.9	R953 A954	R953-L956 PolarHBondContact O-N 3.43Å; A954-L956 PolarHBondContact O-N 3.37Å
957	T	55.6	Low	65.2	Low	117 Å²	117	113.2 Å²	113.2	72%	0.718	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	3.2	171.1	48.2	0	0	0	0	114	R953 A954 A955 Y959	R953-T957 PolarHBondContact O-N 3.27Å; R953-T957 PolarHBondContact O-OG1 2.91Å; A954-T957 CarbonylContact O-C 3.48Å; A954-T957 PolarHBondContact O-N 2.7Å; A954-T957 PolarHBondContact O-OG1 2.82Å; A955-T957 VanDerWaalsContact C-N 3.33Å; T957-Y959 VanDerWaalsContact C-N 3.34Å; T957-Y959 PolarHBondContact O-N 2.97Å
958	Q	50.3	Low	66.1	Low	156 Å²	156	110.9 Å²	110.9	73%	0.729	55%	0.551	S	S	*	*			trans	-82.8	4.5	-179	-77.9	-108.1	-64	0	0	115.3	A954 A955 S960	A954-Q958 WeakPolarHBondContact O-CG 3.43Å; A954-Q958 PolarHBondContact O-N 2.89Å; A955-Q958 PolarHBondContact O-N 3.17Å; Q958-S960 PolarHBondContact O-N 3.38Å
959	Y	54.8	Low	66.7	Low	172 Å²	172	113.9 Å²	113.9	68%	0.675	56%	0.563	S	S	*	*			trans	-67.3	101.3	167	-81.3	-78.6	0	0	0	109.9	T957 D963	T957-Y959 VanDerWaalsContact C-N 3.34Å; T957-Y959 PolarHBondContact O-N 2.97Å; Y959-D963 HydrophobicContact CD1-CB 4.47Å
960	S	64.7	Low	68	Low	56 Å²	56	110.3 Å²	110.3	39%	0.392	55%	0.554	S	S	.	*			trans	-64.5	151.8	176.4	-166.8	0	0	0	0	110	Q958 K962 D963 I964	Q958-S960 PolarHBondContact O-N 3.38Å; S960-K962 PolarHBondContact O-N 2.86Å; S960-K962 PolarHBondContact OG-N 3.31Å; S960-D963 WeakPolarHBondContact CA-OD2 3.03Å; S960-D963 WeakPolarHBondContact CB-OD2 3.34Å; S960-D963 PolarHBondContact N-OD2 2.98Å; S960-D963 PolarHBondContact O-N 3.24Å; S960-I964 PolarHBondContact O-N 3.48Å
961	A	62.6	Low	68.4	Low	67 Å²	67	109.1 Å²	109.1	55%	0.554	55%	0.553	S	S	*	*	H	α-helix	trans	-54.1	-26	164.7	0	0	0	0	0	111.6	N965	A961-N965 WeakPolarHBondContact O-CB 3.41Å; A961-N965 PolarHBondContact O-N 3.48Å; A961-N965 PolarHBondContact O-ND2 2.87Å
962	K	69	Low	68.6	Low	170 Å²	170	108 Å²	108	74%	0.739	55%	0.548	S	S	*	.	H	α-helix	trans	-69.7	-37.3	172.4	-69	-174.3	176.4	-177.7	0	113.5	S960 R966	S960-K962 PolarHBondContact O-N 2.86Å; S960-K962 PolarHBondContact OG-N 3.31Å; K962-R966 VanDerWaalsContact O-CB 3.29Å; K962-R966 WeakPolarHBondContact O-CB 3.45Å; K962-R966 PolarHBondContact O-N 3.17Å
963	D	75.3	Confident	68.9	Low	76 Å²	76	105.2 Å²	105.2	41%	0.406	55%	0.547	S	S	.	.	H	α-helix	trans	-74.6	-35.8	179.1	-54	-57.7	0	0	0	111.1	Y959 S960 R966 L967	Y959-D963 HydrophobicContact CD1-CB 4.47Å; S960-D963 WeakPolarHBondContact CA-OD2 3.03Å; S960-D963 WeakPolarHBondContact CB-OD2 3.34Å; S960-D963 PolarHBondContact N-OD2 2.98Å; S960-D963 PolarHBondContact O-N 3.24Å; D963-R966 PolarHBondContact O-N 2.76Å; D963-L967 WeakPolarHBondContact O-CB 3.47Å; D963-L967 PolarHBondContact O-N 2.93Å
964	I	75.6	Confident	69.5	Low	86 Å²	86	104.5 Å²	104.5	44%	0.441	55%	0.55	S	S	.	.	H	α-helix	trans	-66.4	-45	172.3	-60.9	172.2	0	0	0	110.4	S960 L967 L968	S960-I964 PolarHBondContact O-N 3.48Å; I964-L967 PolarHBondContact O-N 3.39Å; I964-L968 HydrophobicContact CG2-CD1 4.13Å; I964-L968 WeakPolarHBondContact O-CB 3.48Å; I964-L968 VanDerWaalsContact O-CG 3.29Å; I964-L968 WeakPolarHBondContact O-CG 3.29Å; I964-L968 PolarHBondContact O-N 2.85Å
965	N	77.8	Confident	70.5	Confident	92 Å²	92	106.2 Å²	106.2	49%	0.492	55%	0.551	S	S	.	*	H	α-helix	trans	-64.8	-41.9	174.6	-82	-69.5	0	0	0	111.9	A961 L967 L968 E969	A961-N965 WeakPolarHBondContact O-CB 3.41Å; A961-N965 PolarHBondContact O-N 3.48Å; A961-N965 PolarHBondContact O-ND2 2.87Å; N965-L967 VanDerWaalsContact C-N 3.33Å; N965-L967 PolarHBondContact O-N 3.47Å; N965-L968 CarbonylContact O-C 3.55Å; N965-L968 WeakPolarHBondContact O-CB 3.48Å; N965-L968 PolarHBondContact O-N 3.13Å; N965-L968 VanDerWaalsContact O-N 3.13Å; N965-E969 PolarHBondContact O-N 2.87Å
966	R	87	Confident	71.2	Confident	150 Å²	150	109.6 Å²	109.6	57%	0.566	56%	0.56	S	S	*	*	H	α-helix	trans	-59.3	-44.5	173.9	-178.3	-172.4	153.6	-152.8	-14.8	111.2	K962 D963 L968 E969 E970	K962-R966 VanDerWaalsContact O-CB 3.29Å; K962-R966 WeakPolarHBondContact O-CB 3.45Å; K962-R966 PolarHBondContact O-N 3.17Å; D963-R966 PolarHBondContact O-N 2.76Å; R966-L968 VanDerWaalsContact C-N 3.28Å; R966-L968 PolarHBondContact O-N 3.18Å; R966-E969 PolarHBondContact O-N 3.25Å; R966-E970 IonicContact CZ-OE2 4Å; R966-E970 IonicContact NE-OE2 2.7Å; R966-E970 PolarHBondContact NE-OE2 2.93Å; R966-E970 IonicContact NH2-OE1 3.76Å; R966-E970 IonicContact NH2-OE2 2.79Å; R966-E970 PolarHBondContact NH2-OE2 3.03Å; R966-E970 WeakPolarHBondContact O-CB 3.25Å; R966-E970 PolarHBondContact O-N 3Å
967	L	86.9	Confident	71.7	Confident	111 Å²	111	110.6 Å²	110.6	58%	0.581	56%	0.559	S	S	*	*	H	α-helix	trans	-64.7	-34.1	177.1	-175.4	62.7	0	0	0	111.7	D963 I964 N965 T971	D963-L967 WeakPolarHBondContact O-CB 3.47Å; D963-L967 PolarHBondContact O-N 2.93Å; I964-L967 PolarHBondContact O-N 3.39Å; N965-L967 VanDerWaalsContact C-N 3.33Å; N965-L967 PolarHBondContact O-N 3.47Å; L967-T971 VanDerWaalsContact O-CB 3.26Å; L967-T971 WeakPolarHBondContact O-CB 3.41Å; L967-T971 PolarHBondContact O-N 3.12Å; L967-T971 PolarHBondContact O-OG1 3.25Å
968	L	84.7	Confident	71.7	Confident	96 Å²	96	107 Å²	107	50%	0.503	54%	0.541	S	S	.	.	H	α-helix	trans	-69.6	-40.9	172.7	-72.4	166.6	0	0	0	112.3	I964 N965 R966 T971 Q972	I964-L968 HydrophobicContact CG2-CD1 4.13Å; I964-L968 WeakPolarHBondContact O-CB 3.48Å; I964-L968 VanDerWaalsContact O-CG 3.29Å; I964-L968 WeakPolarHBondContact O-CG 3.29Å; I964-L968 PolarHBondContact O-N 2.85Å; N965-L968 CarbonylContact O-C 3.55Å; N965-L968 WeakPolarHBondContact O-CB 3.48Å; N965-L968 PolarHBondContact O-N 3.13Å; N965-L968 VanDerWaalsContact O-N 3.13Å; R966-L968 VanDerWaalsContact C-N 3.28Å; R966-L968 PolarHBondContact O-N 3.18Å; L968-T971 PolarHBondContact O-N 3.49Å; L968-Q972 WeakPolarHBondContact O-CB 3.23Å; L968-Q972 WeakPolarHBondContact O-CG 3.36Å; L968-Q972 PolarHBondContact O-N 3.26Å
969	E	82.3	Confident	71.7	Confident	129 Å²	129	104.7 Å²	104.7	60%	0.603	53%	0.532	S	S	*	.	H	α-helix	trans	-66.6	-41.8	173.6	-75	-178.2	119.4	0	0	111.8	N965 R966 T971 Q972 A973	N965-E969 PolarHBondContact O-N 2.87Å; R966-E969 PolarHBondContact O-N 3.25Å; E969-T971 VanDerWaalsContact C-N 3.35Å; E969-Q972 PolarHBondContact O-N 2.94Å; E969-A973 WeakPolarHBondContact O-CB 3.37Å; E969-A973 PolarHBondContact O-N 3.44Å
970	E	82	Confident	72	Confident	104 Å²	104	101.3 Å²	101.3	49%	0.486	53%	0.532	S	S	.	.	H	α-helix	trans	-64.5	-41.5	176.3	-164.5	160.8	163.9	0	0	109.9	R966 A973 E974	R966-E970 IonicContact CZ-OE2 4Å; R966-E970 IonicContact NE-OE2 2.7Å; R966-E970 PolarHBondContact NE-OE2 2.93Å; R966-E970 IonicContact NH2-OE1 3.76Å; R966-E970 IonicContact NH2-OE2 2.79Å; R966-E970 PolarHBondContact NH2-OE2 3.03Å; R966-E970 WeakPolarHBondContact O-CB 3.25Å; R966-E970 PolarHBondContact O-N 3Å; E970-A973 PolarHBondContact O-N 2.9Å; E970-E974 PolarHBondContact O-N 3.36Å
971	T	78.3	Confident	71.2	Confident	72 Å²	72	106.6 Å²	106.6	44%	0.442	56%	0.556	S	S	.	*	H	α-helix	trans	-64.1	-44.1	170.2	-55.6	0	0	0	0	111.7	L967 L968 E969 A973 E974 L975	L967-T971 VanDerWaalsContact O-CB 3.26Å; L967-T971 WeakPolarHBondContact O-CB 3.41Å; L967-T971 PolarHBondContact O-N 3.12Å; L967-T971 PolarHBondContact O-OG1 3.25Å; L968-T971 PolarHBondContact O-N 3.49Å; E969-T971 VanDerWaalsContact C-N 3.35Å; T971-A973 VanDerWaalsContact C-N 3.35Å; T971-A973 PolarHBondContact O-N 2.95Å; T971-E974 PolarHBondContact O-N 3.21Å; T971-L975 VanDerWaalsContact O-CB 3.29Å; T971-L975 WeakPolarHBondContact O-CB 3.49Å; T971-L975 PolarHBondContact O-N 3.15Å
972	Q	68.8	Low	70.3	Confident	116 Å²	116	111.5 Å²	111.5	54%	0.542	57%	0.572	S	S	.	*	H	α-helix	trans	-65.5	-34.7	178.1	-81.7	-174.8	-57.1	0	0	112.7	L968 E969 L975 L976	L968-Q972 WeakPolarHBondContact O-CB 3.23Å; L968-Q972 WeakPolarHBondContact O-CG 3.36Å; L968-Q972 PolarHBondContact O-N 3.26Å; E969-Q972 PolarHBondContact O-N 2.94Å; Q972-L975 VanDerWaalsContact O-CB 3.32Å; Q972-L975 WeakPolarHBondContact O-CB 3.22Å; Q972-L975 PolarHBondContact O-N 3.41Å; Q972-L976 WeakPolarHBondContact O-CB 3.23Å; Q972-L976 WeakPolarHBondContact O-CG 3.49Å; Q972-L976 PolarHBondContact O-N 2.89Å
973	A	70	Confident	68.8	Low	60 Å²	60	110.5 Å²	110.5	50%	0.496	57%	0.574	S	S	.	*	H	α-helix	trans	-69.3	-40.8	175.2	0	0	0	0	0	111.4	E969 E970 T971 L975 L976 K977	E969-A973 WeakPolarHBondContact O-CB 3.37Å; E969-A973 PolarHBondContact O-N 3.44Å; E970-A973 PolarHBondContact O-N 2.9Å; T971-A973 VanDerWaalsContact C-N 3.35Å; T971-A973 PolarHBondContact O-N 2.95Å; A973-L975 VanDerWaalsContact C-N 3.32Å; A973-L976 PolarHBondContact O-N 2.96Å; A973-K977 VanDerWaalsContact O-CB 3.26Å; A973-K977 WeakPolarHBondContact O-CB 3.43Å; A973-K977 PolarHBondContact O-N 2.92Å
974	E	74.2	Confident	66.6	Low	116 Å²	116	113 Å²	113	54%	0.542	60%	0.596	S	S	.	*	H	α-helix	trans	-67.3	-34	172.1	-167	157.9	-125.8	0	0	111.8	E970 T971 K977 A978	E970-E974 PolarHBondContact O-N 3.36Å; T971-E974 PolarHBondContact O-N 3.21Å; E974-K977 PolarHBondContact O-N 2.74Å; E974-A978 PolarHBondContact O-N 2.95Å
975	L	76.2	Confident	64.5	Low	84 Å²	84	112.9 Å²	112.9	44%	0.44	61%	0.608	S	S	.	*	H	α-helix	trans	-61	-52.7	172.3	-149.1	73.4	0	0	0	111	F452 T971 Q972 A973 K977 A978	F452-L975 HydrophobicContact CE1-CD1 3.74Å; F452-L975 HydrophobicContact CE1-CG 3.75Å; F452-L975 HydrophobicContact CE2-CD1 3.68Å; F452-L975 HydrophobicContact CE2-CG 4.27Å; F452-L975 HydrophobicContact CZ-CB 4.06Å; F452-L975 HydrophobicContact CZ-CD1 3.22Å; F452-L975 HydrophobicContact CZ-CG 3.36Å; F452-L975 VanDerWaalsContact CZ-O 3.31Å; F452-L975 WeakPolarHBondContact CZ-O 3.45Å; T971-L975 VanDerWaalsContact O-CB 3.29Å; T971-L975 WeakPolarHBondContact O-CB 3.49Å; T971-L975 PolarHBondContact O-N 3.15Å; Q972-L975 VanDerWaalsContact O-CB 3.32Å; Q972-L975 WeakPolarHBondContact O-CB 3.22Å; Q972-L975 PolarHBondContact O-N 3.41Å; A973-L975 VanDerWaalsContact C-N 3.32Å; L975-K977 PolarHBondContact O-N 3.33Å; L975-A978 PolarHBondContact O-N 2.9Å; L975-A978 VanDerWaalsContact O-N 3.16Å
976	L	69.3	Low	62.1	Low	133 Å²	133	113.7 Å²	113.7	70%	0.696	62%	0.621	S	S	*	*	H	α-helix	trans	-64.6	-28.8	179.8	-73.6	164.8	0	0	0	112.6	Q972 A973 A978	Q972-L976 WeakPolarHBondContact O-CB 3.23Å; Q972-L976 WeakPolarHBondContact O-CG 3.49Å; Q972-L976 PolarHBondContact O-N 2.89Å; A973-L976 PolarHBondContact O-N 2.96Å; L976-A978 VanDerWaalsContact C-N 3.33Å
977	K	61.5	Low	59.4	Low	159 Å²	159	116 Å²	116	69%	0.691	64%	0.635	S	S	*	*	H	α-helix	trans	-75.6	-16.2	176.7	-175.6	-179.5	173.4	-168.7	0	114	A973 E974 L975	A973-K977 VanDerWaalsContact O-CB 3.26Å; A973-K977 WeakPolarHBondContact O-CB 3.43Å; A973-K977 PolarHBondContact O-N 2.92Å; E974-K977 PolarHBondContact O-N 2.74Å; L975-K977 PolarHBondContact O-N 3.33Å
978	A	54.5	Low	56.9	Low	41 Å²	41	114.7 Å²	114.7	34%	0.339	64%	0.64	S	S	.	*	H	α-helix	trans	-87.5	-14.6	-179.1	0	0	0	0	0	114	F452 E974 L975 L976 P980	F452-A978 HydrophobicContact CD2-CB 4.3Å; F452-A978 HydrophobicContact CE2-CB 3.5Å; F452-A978 VanDerWaalsContact CE2-CB 3.5Å; F452-A978 HydrophobicContact CZ-CB 3.87Å; E974-A978 PolarHBondContact O-N 2.95Å; L975-A978 PolarHBondContact O-N 2.9Å; L975-A978 VanDerWaalsContact O-N 3.16Å; L976-A978 VanDerWaalsContact C-N 3.33Å; A978-P980 WeakPolarHBondContact O-CD 3.34Å
979	I	51.3	Low	54.4	Low	108 Å²	108	118.9 Å²	118.9	55%	0.554	66%	0.657	S	S	*	*	S	Bend	trans	-82.5	121.7	177.9	-56.1	176.2	0	0	0	108.9
980	P	60.5	Low	52.1	Low	102 Å²	102	118.8 Å²	118.8	66%	0.662	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-71.1	129.6	174.8	-17.1	31.9	0	0	0	111.5	A978 L982	A978-P980 WeakPolarHBondContact O-CD 3.34Å; P980-L982 HydrophobicContact CB-CD1 4.4Å; P980-L982 PolarHBondContact O-N 3.46Å
981	D	47.1	Very low	49.3	Very low	167 Å²	167	117.5 Å²	117.5	89%	0.893	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-58.3	119.9	172.9	-82.6	-43.2	0	0	0	111.5
982	L	45.3	Very low	48.2	Very low	170 Å²	170	120.6 Å²	120.6	89%	0.89	70%	0.704	S	S	*	*			trans	-142.4	73	165.2	-87.1	111.5	0	0	0	110.9	P980	P980-L982 HydrophobicContact CB-CD1 4.4Å; P980-L982 PolarHBondContact O-N 3.46Å
983	D	36.1	Very low	46.1	Very low	148 Å²	148	119.8 Å²	119.8	79%	0.791	72%	0.717	S	S	*	*			trans	-118.3	113	155.2	-168.4	-1.7	0	0	0	110.3
984	C	29.5	Very low	44.4	Very low	128 Å²	128	122.9 Å²	122.9	87%	0.865	73%	0.732	S	S	*	*			trans	-167.2	112.4	142.6	-99.1	0	0	0	0	110.6
985	A	30.7	Very low	42.3	Very low	85 Å²	85	123.3 Å²	123.3	70%	0.702	74%	0.743	S	S	*	*			trans	-59.7	167.5	177.5	0	0	0	0	0	113.6
986	S	27.7	Very low	40.5	Very low	109 Å²	109	124.3 Å²	124.3	76%	0.762	75%	0.754	S	S	*	*				176.8	152.4	82.1	46.7	0	0	0	0	116.6
987	K	31	Very low	38.3	Very low	197 Å²	197	121.9 Å²	121.9	86%	0.857	74%	0.742	S	S	*	*			trans	48	104.4	146.2	-68.3	179.2	178.5	176	0	121.9
988	A	33.6	Very low	36.7	Very low	84 Å²	84	119.8 Å²	119.8	69%	0.694	73%	0.734	S	S	*	*				59	121.6	116.6	0	0	0	0	0	122.6
989	H	32.8	Very low	35.4	Very low	184 Å²	184	123.7 Å²	123.7	85%	0.852	74%	0.744	S	S	*	*			trans	37.2	133.1	136.3	-56.1	-57.7	0	0	0	120.6
990	P	34	Very low	35.2	Very low	127 Å²	127	123.6 Å²	123.6	83%	0.825	75%	0.75	S	S	*	*				-152.1	174.9	60.5	41.9	-23.4	0	0	0	118.1
991	G	24.2	Very low	34.1	Very low	77 Å²	77	123.7 Å²	123.7	79%	0.794	75%	0.751	S	S	*	*			trans	84.9	131.2	145.6	0	0	0	0	0	119.2
992	P	54	Low	33.1	Very low	137 Å²	137	125.1 Å²	125.1	89%	0.89	75%	0.749	S	S	*	*			trans	-99.3	146	170.8	36.5	-31.4	0	0	0	113.5
993	A	24.7	Very low	32.6	Very low	99 Å²	99	121.6 Å²	121.6	82%	0.818	74%	0.744	S	S	*	*			trans	-148.1	155.3	168.6	0	0	0	0	0	111.6
994	P	35.4	Very low	32.3	Very low	125 Å²	125	120.1 Å²	120.1	81%	0.812	74%	0.743	S	S	*	*			trans	-102.5	-178.5	-166.3	40.3	-37.3	0	0	0	116.4
995	T	29.3	Very low	32.2	Very low	126 Å²	126	123.3 Å²	123.3	77%	0.773	75%	0.745	S	S	*	*			trans	-52.2	167.8	170.6	57.8	0	0	0	0	114.1
996	P	37.5	Very low	31.9	Very low	104 Å²	104	122.1 Å²	122.1	68%	0.675	74%	0.74	S	S	*	*			cis	-154.1	-175.5	29.8	41.4	-17.5	0	0	0	120.6
997	D	24.4	Very low	31.7	Very low	83 Å²	83	126.1 Å²	126.1	44%	0.444	75%	0.747	S	S	.	*			trans	94.4	150.1	132.3	-102.3	-51.1	0	0	0	126	N329	N329-D997 VanDerWaalsContact CB-OD1 3.23Å; N329-D997 WeakPolarHBondContact CB-OD1 3.32Å; N329-D997 VanDerWaalsContact ND2-CG 3.28Å; N329-D997 PolarHBondContact ND2-OD1 3.33Å; N329-D997 PolarHBondContact ND2-OD2 2.88Å
998	H	26.7	Very low	31.2	Very low	115 Å²	115	125.9 Å²	125.9	53%	0.532	75%	0.746	S	S	.	*			trans	60.3	84.6	154.1	-72.3	-47.5	0	0	0	124.9
999	K	26.9	Very low	30.8	Very low	123 Å²	123	126.1 Å²	126.1	54%	0.535	75%	0.748	S	S	.	*				94.2	152.9	107.6	-91.8	-159	170.2	-158.3	0	122.5	N330 L331	N330-K999 WeakPolarHBondContact O-CE 3.32Å; N330-K999 PolarHBondContact O-NZ 3.31Å; L331-K999 PolarHBondContact O-NZ 3.23Å
1000	P	48	Very low	30.8	Very low	105 Å²	105	121.2 Å²	121.2	68%	0.682	74%	0.74	S	S	*	*			trans	-98	-164.5	-178.3	46.4	-39.9	0	0	0	111
1001	P	37.6	Very low	30.4	Very low	105 Å²	105	121.1 Å²	121.1	68%	0.682	74%	0.739	S	S	*	*			cis	-151.8	175.3	16.6	43.7	-21.6	0	0	0	122.1
1002	K	26.6	Very low	30.6	Very low	196 Å²	196	123.8 Å²	123.8	85%	0.852	73%	0.725	S	S	*	*			trans	59.9	119.9	142.3	-81.7	175.3	176.6	-178.3	0	121.8
1003	A	34.9	Very low	29.3	Very low	96 Å²	96	121 Å²	121	79%	0.793	71%	0.706	S	S	*	*			trans	65.1	164.2	132.9	0	0	0	0	0	118.3
1004	P	29.5	Very low	30.2	Very low	118 Å²	118	121.2 Å²	121.2	77%	0.766	69%	0.69	S	S	*	*			cis	-108.1	166.3	2.1	37.6	-22.2	0	0	0	112.7
1005	H	27.4	Very low	30	Very low	195 Å²	195	119.4 Å²	119.4	90%	0.903	68%	0.678	S	S	*	*				50.6	101.7	68.2	-159.6	90.9	0	0	0	115.6
1006	G	23.3	Very low	30.3	Very low	59 Å²	59	119.5 Å²	119.5	61%	0.608	68%	0.684	S	S	*	*			trans	165.9	121.2	165.5	0	0	0	0	0	116.3
1007	Q	24	Very low	29.8	Very low	193 Å²	193	117 Å²	117	90%	0.902	68%	0.677	S	S	*	*			trans	54.6	116.3	138.8	-53.1	-175.4	37.3	0	0	118.7
1008	K	20.7	Very low	30.6	Very low	192 Å²	192	124.7 Å²	124.7	84%	0.835	70%	0.7	S	S	*	*				100	102.6	61.3	-175.7	-171.4	175.3	-169.8	0	112.2
1009	A	24.3	Very low	31.1	Very low	89 Å²	89	128.1 Å²	128.1	74%	0.736	71%	0.708	S	S	*	*			trans	37.5	114.4	149.2	0	0	0	0	0	121.4
1010	A	34.2	Very low	31.3	Very low	82 Å²	82	124.1 Å²	124.1	68%	0.678	70%	0.702	S	S	*	*				31	147.7	126	0	0	0	0	0	122.5
1011	P	25.3	Very low	30.3	Very low	125 Å²	125	122.4 Å²	122.4	81%	0.812	69%	0.692	S	S	*	*				-129.3	149.1	126.8	37.1	-29.6	0	0	0	113.7
1012	R	29	Very low	29.7	Very low	132 Å²	132	122.3 Å²	122.3	50%	0.498	69%	0.686	S	S	.	*			trans	-93.7	161.6	166.9	-94.7	160.3	69.3	-172.3	170	111	S1021 D1022	R1012-S1021 PolarHBondContact NH1-O 3.45Å; R1012-S1021 VanDerWaalsContact NH1-O 3.11Å; R1012-D1022 PolarHBondContact NH2-O 2.89Å
1013	T	26.4	Very low	30	Very low	79 Å²	79	119.8 Å²	119.8	49%	0.485	68%	0.677	S	S	.	*			trans	143.3	90.5	141.2	-60.1	0	0	0	0	114	R1019 S1021	T1013-R1019 HydrophobicContact CG2-CG 3.81Å; T1013-S1021 PolarHBondContact OG1-OG 2.98Å; T1013-S1021 VanDerWaalsContact OG1-OG 3.06Å
1014	E	43.3	Very low	29.9	Very low	103 Å²	103	121.8 Å²	121.8	48%	0.481	67%	0.674	S	S	.	*			trans	12.5	136.9	130.8	-76	-65.7	129.4	0	0	118.8	G1017 R1019	E1014-G1017 WeakPolarHBondContact OE2-CA 3.24Å; E1014-R1019 HydrophobicContact CB-CG 4.02Å; E1014-R1019 WeakPolarHBondContact O-CD 3.43Å; E1014-R1019 WeakPolarHBondContact O-CG 3.5Å
1015	P	31.8	Very low	29.8	Very low	87 Å²	87	121.6 Å²	121.6	57%	0.565	67%	0.671	S	S	*	*				-156	88.4	105.9	37.1	-16.8	0	0	0	116.8	R1019	P1015-R1019 HydrophobicContact CB-CG 3.99Å
1016	S	35.3	Very low	29.9	Very low	129 Å²	129	118.7 Å²	118.7	90%	0.902	67%	0.666	S	S	*	*	S	Bend	trans	-156.3	52.3	149.8	-168.7	0	0	0	0	115
1017	G	26.9	Very low	30.4	Very low	51 Å²	51	121.2 Å²	121.2	53%	0.526	67%	0.672	S	S	.	*	S	Bend	cis	155	117.2	-4.7	0	0	0	0	0	116.5	E1014	E1014-G1017 WeakPolarHBondContact OE2-CA 3.24Å
1018	R	40.7	Very low	30.4	Very low	244 Å²	244	122.1 Å²	122.1	92%	0.921	67%	0.667	S	S	*	*	S	Bend	trans	-131.4	135.3	131.6	-72.9	-165	174.2	-119.7	-2.1	107.9
1019	R	36.4	Very low	30.6	Very low	188 Å²	188	122.4 Å²	122.4	71%	0.709	66%	0.664	S	S	*	*			trans	-90.7	120.9	-147.7	-126.1	-174.1	-73.2	-131	2.3	115	T1013 E1014 P1015	T1013-R1019 HydrophobicContact CG2-CG 3.81Å; E1014-R1019 HydrophobicContact CB-CG 4.02Å; E1014-R1019 WeakPolarHBondContact O-CD 3.43Å; E1014-R1019 WeakPolarHBondContact O-CG 3.5Å; P1015-R1019 HydrophobicContact CB-CG 3.99Å
1020	G	31.3	Very low	30.7	Very low	39 Å²	39	127.4 Å²	127.4	40%	0.402	66%	0.664	S	S	.	*			trans	71.6	-177.2	159.3	0	0	0	0	0	116.9
1021	S	27.1	Very low	30.3	Very low	68 Å²	68	128.4 Å²	128.4	48%	0.476	66%	0.662	S	S	.	*			cis	-156.4	162.4	-26.7	-156.7	0	0	0	0	112.3	R1012 T1013	R1012-S1021 PolarHBondContact NH1-O 3.45Å; R1012-S1021 VanDerWaalsContact NH1-O 3.11Å; T1013-S1021 PolarHBondContact OG1-OG 2.98Å; T1013-S1021 VanDerWaalsContact OG1-OG 3.06Å
1022	D	25.6	Very low	30.4	Very low	103 Å²	103	130.1 Å²	130.1	55%	0.551	66%	0.659	S	S	*	*			trans	44.6	161.8	172.2	-117.1	-16.6	0	0	0	126.4	R1012	R1012-D1022 PolarHBondContact NH2-O 2.89Å
1023	E	32.5	Very low	30.5	Very low	144 Å²	144	131.6 Å²	131.6	67%	0.673	67%	0.669	S	S	*	*			trans	-136.7	151.5	-178.6	-142.5	-159.1	147.9	0	0	111.2
1024	L	32.6	Very low	30.9	Very low	137 Å²	137	133.9 Å²	133.9	72%	0.717	69%	0.685	S	S	*	*			trans	63.2	118.9	158.7	-65.7	171.5	0	0	0	122.6
1025	T	27.1	Very low	30.4	Very low	115 Å²	115	134.5 Å²	134.5	71%	0.706	70%	0.701	S	S	*	*				117.4	129.6	123.5	-5.7	0	0	0	0	122.4
1026	V	30.1	Very low	30.6	Very low	133 Å²	133	139.8 Å²	139.8	81%	0.806	72%	0.715	S	S	*	*			trans	60.6	157.1	156.1	-84.4	0	0	0	0	120
1027	P	33.8	Very low	30.7	Very low	112 Å²	112	138.6 Å²	138.6	73%	0.727	71%	0.707	S	S	*	*			cis	-133.8	162.7	18.2	41.3	-23.8	0	0	0	120
1028	R	24.4	Very low	31.6	Very low	213 Å²	213	141.7 Å²	141.7	80%	0.804	72%	0.717	S	S	*	*			trans	34.7	130.8	149	-69.6	-178.4	172.6	153.8	-2.1	121.3
1029	Y	25.6	Very low	31.5	Very low	197 Å²	197	135.6 Å²	135.6	77%	0.773	71%	0.709	S	S	*	*				153.3	149.3	114.6	-90.2	-84.8	0	0	0	107.6
1030	R	25.1	Very low	31.8	Very low	195 Å²	195	132.1 Å²	132.1	74%	0.736	71%	0.711	S	S	*	*			cis	-177.7	151.1	-26.7	179.2	-159.4	175.8	149.1	1.4	106.6
1031	T	25.8	Very low	32.5	Very low	103 Å²	103	136 Å²	136	63%	0.632	73%	0.729	S	S	*	*			trans	61.7	121.4	158.6	32.7	0	0	0	0	120.6
1032	E	27.3	Very low	33.5	Very low	160 Å²	160	137.9 Å²	137.9	75%	0.748	74%	0.74	S	S	*	*			trans	54.5	153.8	146.4	-40.5	-170	136.7	0	0	120
1033	K	31.7	Very low	34.2	Very low	164 Å²	164	138.6 Å²	138.6	71%	0.713	75%	0.75	S	S	*	*			cis	-147.4	156.7	24.1	-70.7	172.2	179.6	170.9	0	110.7	S1035	K1033-S1035 PolarHBondContact O-N 3.31Å; K1033-S1035 VanDerWaalsContact O-N 3.08Å
1034	P	35.1	Very low	35.1	Very low	127 Å²	127	143.4 Å²	143.4	83%	0.825	76%	0.762	S	S	*	*			trans	-72.8	98.4	169.4	30.1	-33.4	0	0	0	111.1	K1036	P1034-K1036 PolarHBondContact O-N 2.85Å
1035	S	33.3	Very low	35.3	Very low	116 Å²	116	146.2 Å²	146.2	81%	0.811	76%	0.763	S	S	*	*			trans	-74.7	90.6	176.6	55.9	0	0	0	0	111.5	K1033 S1037	K1033-S1035 PolarHBondContact O-N 3.31Å; K1033-S1035 VanDerWaalsContact O-N 3.08Å; S1035-S1037 PolarHBondContact O-N 3.44Å
1036	K	34.9	Very low	35.5	Very low	197 Å²	197	146.2 Å²	146.2	86%	0.857	77%	0.768	S	S	*	*			trans	-25.2	120.6	170.1	-60	168.1	-178.3	175.1	0	114.3	P1034	P1034-K1036 PolarHBondContact O-N 2.85Å
1037	S	36.9	Very low	35.5	Very low	105 Å²	105	146.4 Å²	146.4	73%	0.734	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-64.5	149.5	148.6	45.3	0	0	0	0	109.6	S1035	S1035-S1037 PolarHBondContact O-N 3.44Å
1038	P	45.8	Very low	35.9	Very low	115 Å²	115	146.9 Å²	146.9	75%	0.747	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-68.1	145.8	175.5	28.9	-34.3	0	0	0	110.6
1039	P	39.9	Very low	36.1	Very low	116 Å²	116	141.9 Å²	141.9	75%	0.753	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-65.8	151.8	172.8	29.5	-34.8	0	0	0	110.8
1040	P	42.6	Very low	36.5	Very low	115 Å²	115	137.3 Å²	137.3	75%	0.747	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-61.5	149.4	174.1	27.5	-34.9	0	0	0	111
1041	P	45.3	Very low	36.9	Very low	120 Å²	120	136.8 Å²	136.8	78%	0.779	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-62.8	140.4	-179.4	26.4	-34.5	0	0	0	111.1
1042	P	47.8	Very low	37.5	Very low	109 Å²	109	134.9 Å²	134.9	71%	0.708	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-65	149.3	-179	27.2	-34.8	0	0	0	111.5	R1044	P1042-R1044 PolarHBondContact O-N 3.22Å
1043	P	41.7	Very low	37.7	Very low	118 Å²	118	135.1 Å²	135.1	77%	0.766	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-59.9	127.6	179.5	24.7	-33.9	0	0	0	110.6	R1045	P1043-R1045 PolarHBondContact O-N 3.04Å
1044	R	49.5	Very low	37.6	Very low	245 Å²	245	132.8 Å²	132.8	93%	0.925	77%	0.768	S	S	*	*			trans	-64	97.3	-179	-76.1	-172.9	170.8	-150.8	-1.2	110.9	P1042 S1046	P1042-R1044 PolarHBondContact O-N 3.22Å; R1044-S1046 PolarHBondContact O-N 2.87Å
1045	R	38	Very low	37.3	Very low	195 Å²	195	132.2 Å²	132.2	74%	0.736	76%	0.762	S	S	*	*			trans	-66.7	97	166.9	-66	173.4	82.6	-124.1	10	109	P1043 F1047	P1043-R1045 PolarHBondContact O-N 3.04Å; R1045-F1047 VanDerWaalsContact C-N 3.29Å; R1045-F1047 HydrophobicContact CB-CD2 3.92Å; R1045-F1047 HydrophobicContact CB-CE2 4.01Å; R1045-F1047 VanDerWaalsContact NH2-CE2 3.35Å; R1045-F1047 VanDerWaalsContact NH2-CZ 3.29Å; R1045-F1047 PolarHBondContact O-N 3.22Å
1046	S	31.6	Very low	37	Very low	116 Å²	116	134 Å²	134	81%	0.811	77%	0.768	S	S	*	*			trans	-71	81.4	172.1	39.9	0	0	0	0	111.1	R1044	R1044-S1046 PolarHBondContact O-N 2.87Å
1047	F	30.3	Very low	36.9	Very low	136 Å²	136	134.8 Å²	134.8	60%	0.596	77%	0.766	S	S	*	*			trans	-79.6	131.6	164.4	-84.9	-104.3	0	0	0	109.4	R1045 S1049	R1045-F1047 VanDerWaalsContact C-N 3.29Å; R1045-F1047 HydrophobicContact CB-CD2 3.92Å; R1045-F1047 HydrophobicContact CB-CE2 4.01Å; R1045-F1047 VanDerWaalsContact NH2-CE2 3.35Å; R1045-F1047 VanDerWaalsContact NH2-CZ 3.29Å; R1045-F1047 PolarHBondContact O-N 3.22Å; F1047-S1049 VanDerWaalsContact C-N 3.25Å; F1047-S1049 PolarHBondContact O-N 3.12Å
1048	P	42.4	Very low	36.7	Very low	122 Å²	122	133.5 Å²	133.5	79%	0.792	75%	0.754	S	S	*	*			trans	-72.3	85.3	167.3	30.9	-32.7	0	0	0	108.6	S1050	P1048-S1050 PolarHBondContact O-N 2.76Å
1049	S	27.2	Very low	36	Very low	108 Å²	108	129.6 Å²	129.6	76%	0.755	73%	0.734	S	S	*	*			trans	-79.9	86.5	176	-172.4	0	0	0	0	110.3	F1047 H1051	F1047-S1049 VanDerWaalsContact C-N 3.25Å; F1047-S1049 PolarHBondContact O-N 3.12Å; S1049-H1051 PolarHBondContact O-N 2.75Å; S1049-H1051 VanDerWaalsContact O-N 3.16Å
1050	S	34.3	Very low	35.6	Very low	101 Å²	101	127 Å²	127	71%	0.706	71%	0.712	S	S	*	*			trans	-69.5	98	167.6	56.4	0	0	0	0	110.9	P1048	P1048-S1050 PolarHBondContact O-N 2.76Å
1051	H	33.3	Very low	34.9	Very low	184 Å²	184	127 Å²	127	85%	0.852	71%	0.709	S	S	*	*			trans	-163.8	126.5	152.8	-91.2	-64.5	0	0	0	108.2	S1049	S1049-H1051 PolarHBondContact O-N 2.75Å; S1049-H1051 VanDerWaalsContact O-N 3.16Å
1052	G	38.8	Very low	34.1	Very low	64 Å²	64	128 Å²	128	66%	0.66	71%	0.713	S	S	*	*			cis	126.8	72.4	-5	0	0	0	0	0	113
1053	L	30.6	Very low	33.2	Very low	164 Å²	164	128.8 Å²	128.8	86%	0.859	72%	0.716	S	S	*	*			trans	-149.3	143.9	174.3	-60.6	174.8	0	0	0	108.4
1054	T	29.6	Very low	32.7	Very low	115 Å²	115	128.8 Å²	128.8	71%	0.706	71%	0.714	S	S	*	*			cis	-162.9	158.9	-14.7	24.7	0	0	0	0	110.3
1055	T	29.7	Very low	31.7	Very low	116 Å²	116	121.8 Å²	121.8	71%	0.712	70%	0.703	S	S	*	*			trans	57	111.4	152.5	-174.1	0	0	0	0	121.9
1056	T	27.4	Very low	31.4	Very low	152 Å²	152	122 Å²	122	93%	0.933	71%	0.709	S	S	*	*			trans	-129.3	54.4	145.9	45	0	0	0	0	112
1057	R	31.2	Very low	31.5	Very low	214 Å²	214	124.4 Å²	124.4	81%	0.808	70%	0.704	S	S	*	*			trans	-137.2	85.8	165.8	-165.9	172.8	179.3	-145.7	-1.4	114
1058	T	34.2	Very low	31.4	Very low	79 Å²	79	124.4 Å²	124.4	49%	0.485	71%	0.711	S	S	.	*			trans	38.6	118.1	143.3	62.2	0	0	0	0	119.4	L1089	T1058-L1089 HydrophobicContact CG2-CD1 4.47Å
1059	G	31.3	Very low	30.7	Very low	32 Å²	32	123.7 Å²	123.7	33%	0.33	71%	0.709	S	S	.	*				128.2	151.6	110	0	0	0	0	0	118.9	R1091	G1059-R1091 PolarHBondContact O-NH1 2.7Å
1060	E	30.2	Very low	30.8	Very low	63 Å²	63	122.8 Å²	122.8	29%	0.294	71%	0.708	S	S	.	*			cis	-161	119	-17	-159.9	179.3	-95.9	0	0	111.2	L1089 R1090	E1060-L1089 HydrophobicContact CB-CB 3.62Å; E1060-L1089 HydrophobicContact CB-CD1 4.21Å; E1060-L1089 HydrophobicContact CB-CG 4.46Å; E1060-L1089 HydrophobicContact CG-CB 4.4Å; E1060-L1089 HydrophobicContact CG-CD1 4.49Å; E1060-L1089 WeakPolarHBondContact OE1-CD1 3.26Å; E1060-R1090 HydrophobicContact CB-CG 4.49Å; E1060-R1090 WeakPolarHBondContact O-CD 3.48Å; E1060-R1090 PolarHBondContact O-NH2 3.05Å; E1060-R1090 IonicContact OE2-CZ 2.64Å; E1060-R1090 IonicContact OE2-NH1 2.62Å; E1060-R1090 PolarHBondContact OE2-NH1 2.96Å; E1060-R1090 VanDerWaalsContact OE2-NH1 3.09Å; E1060-R1090 IonicContact OE2-NH2 3.09Å; E1060-R1090 PolarHBondContact OE2-NH2 3.46Å
1061	V	28.7	Very low	30.7	Very low	113 Å²	113	125.5 Å²	125.5	69%	0.685	71%	0.707	S	S	*	*			trans	-65.7	-119.8	168.5	-90.5	0	0	0	0	114.3	R1090	V1061-R1090 PolarHBondContact O-NH2 2.94Å
1062	V	27.9	Very low	30.9	Very low	141 Å²	141	123.5 Å²	123.5	86%	0.855	70%	0.701	S	S	*	*				-115.6	161.1	-112.8	-143.1	0	0	0	0	110.8
1063	V	30	Very low	30.5	Very low	126 Å²	126	128.2 Å²	128.2	76%	0.764	70%	0.704	S	S	*	*			trans	-93.8	152.1	166.1	-137.5	0	0	0	0	106.2
1064	T	30.7	Very low	30.5	Very low	118 Å²	118	126.9 Å²	126.9	72%	0.724	69%	0.691	S	S	*	*			cis	-158.7	147.9	46.6	51	0	0	0	0	116.5
1065	S	29.1	Very low	30.8	Very low	99 Å²	99	125.3 Å²	125.3	69%	0.692	69%	0.689	S	S	*	*			trans	63.4	125.8	135.3	-62.2	0	0	0	0	125.8
1066	K	31.3	Very low	30.5	Very low	200 Å²	200	125.9 Å²	125.9	87%	0.87	68%	0.684	S	S	*	*			trans	70	154.2	142.8	-68	176.3	179.3	177.5	0	118.4
1067	K	34	Very low	30.7	Very low	165 Å²	165	123 Å²	123	72%	0.717	67%	0.67	S	S	*	*			cis	-169.1	156.1	-19.2	161.7	171.6	162.8	171.3	0	110
1068	D	27	Very low	30.5	Very low	136 Å²	136	121 Å²	121	73%	0.727	67%	0.67	S	S	*	*			trans	85.2	148.8	159.5	-81.9	-12.5	0	0	0	124.3
1069	S	27.9	Very low	30.2	Very low	107 Å²	107	124.8 Å²	124.8	75%	0.748	68%	0.682	S	S	*	*			trans	54.9	121.5	165.1	-145.3	0	0	0	0	119.9
1070	A	30	Very low	30.2	Very low	89 Å²	89	129.1 Å²	129.1	74%	0.736	70%	0.697	S	S	*	*			cis	76.4	141.9	33.9	0	0	0	0	0	114
1071	F	32.3	Very low	29.9	Very low	159 Å²	159	133 Å²	133	70%	0.697	72%	0.715	S	S	*	*			cis	-173.1	-174.6	-10.6	169.6	-115.3	0	0	0	109.2	K1073	F1071-K1073 HydrophobicContact CE1-CG 3.81Å; F1071-K1073 HydrophobicContact CZ-CG 4.15Å
1072	I	37.2	Very low	29.8	Very low	141 Å²	141	132.5 Å²	132.5	72%	0.723	71%	0.712	S	S	*	*			trans	116.5	122.2	158.1	-64.4	171	0	0	0	112.9
1073	K	31.4	Very low	29.6	Very low	164 Å²	164	133 Å²	133	71%	0.713	71%	0.705	S	S	*	*			cis	-157.8	172.5	-8.9	-115.8	-179.8	-173.2	174.6	0	107.6	F1071	F1071-K1073 HydrophobicContact CE1-CG 3.81Å; F1071-K1073 HydrophobicContact CZ-CG 4.15Å
1074	K	30.3	Very low	29.3	Very low	135 Å²	135	135.8 Å²	135.8	59%	0.587	71%	0.707	S	S	*	*			cis	-137.5	-41.8	2.9	-176.6	-171.2	-175	-71.3	0	113.2	E1076	K1074-E1076 WeakPolarHBondContact CD-OE2 3.3Å; K1074-E1076 IonicContact NZ-OE1 3.16Å; K1074-E1076 PolarHBondContact NZ-OE1 2.7Å; K1074-E1076 IonicContact NZ-OE2 2.76Å; K1074-E1076 PolarHBondContact NZ-OE2 3.38Å
1075	A	36	Very low	29.4	Very low	82 Å²	82	135.4 Å²	135.4	68%	0.678	71%	0.707	S	S	*	*			trans	-118	157.2	-135	0	0	0	0	0	114.2
1076	E	23.5	Very low	29.2	Very low	128 Å²	128	139.4 Å²	139.4	60%	0.598	71%	0.714	S	S	*	*			cis	123.4	141.3	1.6	-79.1	149.8	179.6	0	0	108.6	K1074	K1074-E1076 WeakPolarHBondContact CD-OE2 3.3Å; K1074-E1076 IonicContact NZ-OE1 3.16Å; K1074-E1076 PolarHBondContact NZ-OE1 2.7Å; K1074-E1076 IonicContact NZ-OE2 2.76Å; K1074-E1076 PolarHBondContact NZ-OE2 3.38Å
1077	S	30.3	Very low	28.8	Very low	93 Å²	93	136.2 Å²	136.2	65%	0.65	71%	0.712	S	S	*	*			cis	-152.5	170.7	5.2	-110.6	0	0	0	0	106.8
1078	E	26.4	Very low	28.6	Very low	172 Å²	172	135.1 Å²	135.1	80%	0.804	71%	0.707	S	S	*	*			cis	173.5	148.4	-0.2	172.9	165.3	161.6	0	0	105.2
1079	E	28.6	Very low	28.8	Very low	158 Å²	158	132.2 Å²	132.2	74%	0.738	69%	0.691	S	S	*	*			cis	-136.3	-74.8	13.3	-165.2	-152.5	176.3	0	0	115.9
1080	L	32	Very low	28.7	Very low	122 Å²	122	133.1 Å²	133.1	64%	0.639	68%	0.678	S	S	*	*			trans	-138.1	171.5	-151.6	-129.3	65.6	0	0	0	112.6
1081	E	24.4	Very low	28.8	Very low	145 Å²	145	138.1 Å²	138.1	68%	0.678	68%	0.678	S	S	*	*			cis	-131	138.5	-8	-165.4	-159	170	0	0	106.6	Q1083	E1081-Q1083 PolarHBondContact OE1-NE2 2.93Å
1082	V	25.9	Very low	28.7	Very low	102 Å²	102	134.8 Å²	134.8	62%	0.618	68%	0.679	S	S	*	*			cis	93.7	96.6	27.8	-179.4	0	0	0	0	115.3
1083	Q	23.9	Very low	28	Very low	152 Å²	152	135.3 Å²	135.3	71%	0.71	69%	0.689	S	S	*	*			trans	171.2	114	136.9	-93.6	173	90.6	0	0	108.7	E1081	E1081-Q1083 PolarHBondContact OE1-NE2 2.93Å
1084	K	24.1	Very low	28	Very low	184 Å²	184	132 Å²	132	80%	0.8	69%	0.687	S	S	*	*				88.7	134.3	65.8	-178.5	-172.3	-179.8	-175	0	112.1
1085	P	32.5	Very low	27.7	Very low	110 Å²	110	134.7 Å²	134.7	71%	0.714	70%	0.701	S	S	*	*			cis	-137.6	174.9	-23.3	41	-23.1	0	0	0	116.5
1086	Q	23.4	Very low	27.3	Very low	183 Å²	183	136.8 Å²	136.8	86%	0.855	71%	0.705	S	S	*	*			trans	14.5	145.7	155.4	-60.1	-168.6	2.9	0	0	124.6
1087	V	24.1	Very low	27.4	Very low	134 Å²	134	134.5 Å²	134.5	81%	0.812	71%	0.709	S	S	*	*				-178.8	161.1	111.2	147.8	0	0	0	0	111.6
1088	K	28.8	Very low	27.2	Very low	141 Å²	141	141.7 Å²	141.7	61%	0.613	72%	0.721	S	S	*	*			trans	-122.4	138.9	176.3	-106.3	179.4	179.1	173.3	0	112.9	R1090	K1088-R1090 PolarHBondContact O-NH1 3.28Å
1089	L	32.5	Very low	27.6	Very low	76 Å²	76	139.5 Å²	139.5	40%	0.398	72%	0.722	S	S	.	*			trans	54.9	166.4	158.3	-69.4	144.2	0	0	0	116.1	T1058 E1060	T1058-L1089 HydrophobicContact CG2-CD1 4.47Å; E1060-L1089 HydrophobicContact CB-CB 3.62Å; E1060-L1089 HydrophobicContact CB-CD1 4.21Å; E1060-L1089 HydrophobicContact CB-CG 4.46Å; E1060-L1089 HydrophobicContact CG-CB 4.4Å; E1060-L1089 HydrophobicContact CG-CD1 4.49Å; E1060-L1089 WeakPolarHBondContact OE1-CD1 3.26Å
1090	R	24.7	Very low	27.4	Very low	125 Å²	125	137 Å²	137	47%	0.472	73%	0.728	S	S	.	*				-139.8	-105.2	72.9	-48.2	-165.6	180	-63	133.3	113.1	E1060 V1061 K1088	E1060-R1090 HydrophobicContact CB-CG 4.49Å; E1060-R1090 WeakPolarHBondContact O-CD 3.48Å; E1060-R1090 PolarHBondContact O-NH2 3.05Å; E1060-R1090 IonicContact OE2-CZ 2.64Å; E1060-R1090 IonicContact OE2-NH1 2.62Å; E1060-R1090 PolarHBondContact OE2-NH1 2.96Å; E1060-R1090 VanDerWaalsContact OE2-NH1 3.09Å; E1060-R1090 IonicContact OE2-NH2 3.09Å; E1060-R1090 PolarHBondContact OE2-NH2 3.46Å; V1061-R1090 PolarHBondContact O-NH2 2.94Å; K1088-R1090 PolarHBondContact O-NH1 3.28Å
1091	R	31.8	Very low	27.1	Very low	194 Å²	194	136.2 Å²	136.2	73%	0.732	73%	0.733	S	S	*	*			trans	-159.1	142.8	-175.4	-130.4	178.4	-173.8	87.9	2	114.1	G1059	G1059-R1091 PolarHBondContact O-NH1 2.7Å
1092	A	30.1	Very low	27.1	Very low	89 Å²	89	135.3 Å²	135.3	74%	0.736	74%	0.738	S	S	*	*			trans	35.5	138.4	149.4	0	0	0	0	0	123.3
1093	V	23.9	Very low	28.2	Very low	152 Å²	152	135.8 Å²	135.8	92%	0.921	74%	0.743	S	S	*	*				-140.5	162.1	116.2	-176.7	0	0	0	0	108.3
1094	S	30.4	Very low	29.6	Very low	96 Å²	96	133.9 Å²	133.9	67%	0.671	74%	0.744	S	S	*	*			trans	-93.4	145.4	-179.4	155.3	0	0	0	0	112.8
1095	E	24.6	Very low	29.8	Very low	190 Å²	190	132.2 Å²	132.2	89%	0.888	74%	0.742	S	S	*	*			trans	-158.3	-167.2	130.6	-125.5	-171.3	120.3	0	0	114.1
1096	V	27.9	Very low	29.6	Very low	126 Å²	126	135.5 Å²	135.5	76%	0.764	75%	0.75	S	S	*	*			trans	-127.2	159.5	-146	168.5	0	0	0	0	114.2
1097	A	25.5	Very low	30	Very low	81 Å²	81	130.9 Å²	130.9	67%	0.669	74%	0.743	S	S	*	*			trans	96.1	109.3	158.6	0	0	0	0	0	121.1
1098	R	25.3	Very low	30.2	Very low	243 Å²	243	129.6 Å²	129.6	92%	0.917	74%	0.74	S	S	*	*			trans	65	-170.4	148.5	-55.8	-178.5	172.9	152.3	-3.8	115.2
1099	P	35.3	Very low	30.4	Very low	126 Å²	126	127 Å²	127	82%	0.818	75%	0.745	S	S	*	*				-123.6	173.4	-88	38.8	-24.2	0	0	0	113.4
1100	A	24.4	Very low	30.3	Very low	105 Å²	105	131 Å²	131	87%	0.868	77%	0.765	S	S	*	*			trans	-129.8	128.7	169.3	0	0	0	0	0	110.9
1101	S	24.5	Very low	30.6	Very low	106 Å²	106	132.8 Å²	132.8	74%	0.741	78%	0.777	S	S	*	*			trans	-157.9	155.9	177	-173.6	0	0	0	0	110.3
1102	T	25.5	Very low	30.8	Very low	127 Å²	127	130.5 Å²	130.5	78%	0.779	78%	0.779	S	S	*	*			trans	67.2	163.2	175.5	77.2	0	0	0	0	116.6
1103	P	48.6	Very low	30.9	Very low	111 Å²	111	133.2 Å²	133.2	72%	0.721	78%	0.776	S	S	*	*			cis	-93.3	-161.1	-20.7	40.3	-32.7	0	0	0	109.9
1104	P	52.5	Low	31.7	Very low	112 Å²	112	132.9 Å²	132.9	73%	0.727	77%	0.769	S	S	*	*			cis	-100.3	-177.5	-18	10.8	15	0	0	0	110.9
1105	I	29.8	Very low	32	Very low	150 Å²	150	134.5 Å²	134.5	77%	0.769	77%	0.77	S	S	*	*			cis	73.3	124.7	36.4	-57.2	173.1	0	0	0	111.5
1106	M	28.4	Very low	32.5	Very low	179 Å²	179	133.5 Å²	133.5	88%	0.882	77%	0.766	S	S	*	*			cis	-154.4	149.2	1.5	-138.2	159.5	66.7	0	0	106.7
1107	A	31.5	Very low	33	Very low	86 Å²	86	134.6 Å²	134.6	71%	0.711	77%	0.767	S	S	*	*			cis	-151.2	-155	-17.2	0	0	0	0	0	105.7
1108	S	28.4	Very low	33.6	Very low	106 Å²	106	141.5 Å²	141.5	74%	0.741	78%	0.776	S	S	*	*			cis	-151.3	153.5	14.8	-70.5	0	0	0	0	108.3
1109	A	31.7	Very low	34	Very low	88 Å²	88	136.4 Å²	136.4	73%	0.727	77%	0.766	S	S	*	*				52.2	120.7	81	0	0	0	0	0	113.8
1110	I	30.6	Very low	33.9	Very low	159 Å²	159	137.4 Å²	137.4	82%	0.815	76%	0.763	S	S	*	*			cis	-151.2	158.2	19.6	48.1	173.3	0	0	0	113.7
1111	K	31.4	Very low	34.2	Very low	163 Å²	163	136.3 Å²	136.3	71%	0.709	75%	0.754	S	S	*	*			trans	40	134.9	161.5	-76.9	-158.5	158.8	-141.1	0	121.7	E1113	K1111-E1113 IonicContact NZ-OE2 3.36Å; K1111-E1113 PolarHBondContact NZ-OE2 3.28Å
1112	D	36.4	Very low	34.5	Very low	146 Å²	146	139.1 Å²	139.1	78%	0.781	76%	0.755	S	S	*	*			cis	100.8	153.6	8.9	-155.9	28.8	0	0	0	117.4
1113	E	31.3	Very low	34.8	Very low	146 Å²	146	139 Å²	139	68%	0.682	75%	0.749	S	S	*	*			trans	78.3	158	-177.7	-58.6	174.4	118.8	0	0	118.5	K1111	K1111-E1113 IonicContact NZ-OE2 3.36Å; K1111-E1113 PolarHBondContact NZ-OE2 3.28Å
1114	D	41	Very low	33.7	Very low	144 Å²	144	141.9 Å²	141.9	77%	0.77	75%	0.753	S	S	*	*				-157.8	-176.3	-79.7	-146.6	-23	0	0	0	109.7
1115	D	38.3	Very low	32.5	Very low	130 Å²	130	142.7 Å²	142.7	70%	0.695	76%	0.761	S	S	*	*			trans	77.7	131.8	147.6	-82.9	-35.4	0	0	0	125.5
1116	E	34.3	Very low	32.4	Very low	169 Å²	169	138.7 Å²	138.7	79%	0.79	76%	0.757	S	S	*	*			trans	74.1	136.2	139.5	-68.7	-166.5	176.1	0	0	125.9
1117	D	37.6	Very low	32.3	Very low	150 Å²	150	134.4 Å²	134.4	80%	0.802	76%	0.758	S	S	*	*			trans	-67.1	137.3	163.7	-59.2	-88.9	0	0	0	112.3
1118	R	38.1	Very low	32.1	Very low	226 Å²	226	133.8 Å²	133.8	85%	0.853	76%	0.761	S	S	*	*			trans	-179.7	164.1	134.7	-107	157.9	-175	-165.1	2.4	117
1119	I	34.7	Very low	31.9	Very low	136 Å²	136	134.9 Å²	134.9	70%	0.697	77%	0.768	S	S	*	*			trans	68.6	108.4	153.8	-71	157.6	0	0	0	115
1120	I	32.1	Very low	31.9	Very low	147 Å²	147	136.6 Å²	136.6	75%	0.754	77%	0.77	S	S	*	*				79.6	114.3	55	-63.3	162.9	0	0	0	112.4
1121	A	31.5	Very low	32.8	Very low	82 Å²	82	134.4 Å²	134.4	68%	0.678	77%	0.765	S	S	*	*			trans	62.8	165.3	156.4	0	0	0	0	0	116.1
1122	E	31.3	Very low	33.7	Very low	164 Å²	164	131.4 Å²	131.4	77%	0.766	76%	0.763	S	S	*	*			cis	-166.4	177.9	-28.1	-113	-169.2	125.3	0	0	107.4
1123	L	32.1	Very low	33.3	Very low	125 Å²	125	131.7 Å²	131.7	65%	0.654	76%	0.761	S	S	*	*			trans	63.4	128.8	146.5	-72.1	158.7	0	0	0	122.1
1124	E	25.8	Very low	33	Very low	171 Å²	171	133.1 Å²	133.1	80%	0.799	77%	0.765	S	S	*	*			trans	82.8	149.7	132.5	-78.3	-176.3	101.5	0	0	124.4
1125	S	27	Very low	32.4	Very low	129 Å²	129	132.1 Å²	132.1	90%	0.902	76%	0.764	S	S	*	*			trans	65.4	128.1	161.3	-154.6	0	0	0	0	117.9
1126	G	28.1	Very low	31.9	Very low	67 Å²	67	132.3 Å²	132.3	69%	0.691	77%	0.77	S	S	*	*			cis	-147.1	173.6	-6.1	0	0	0	0	0	108.9
1127	G	26.3	Very low	31.6	Very low	88 Å²	88	130.4 Å²	130.4	91%	0.907	77%	0.77	S	S	*	*				78	106.9	52	0	0	0	0	0	110.2
1128	G	26.7	Very low	31.8	Very low	74 Å²	74	129.2 Å²	129.2	76%	0.763	77%	0.77	S	S	*	*			cis	168.7	-159.9	-2	0	0	0	0	0	111.8
1129	S	24.3	Very low	31.3	Very low	128 Å²	128	121.7 Å²	121.7	90%	0.895	76%	0.763	S	S	*	*			trans	70.1	117.2	164.2	-140.6	0	0	0	0	121.2
1130	V	32	Very low	31	Very low	125 Å²	125	120 Å²	120	76%	0.758	77%	0.769	S	S	*	*			trans	-80.3	-171.7	146.6	-121.4	0	0	0	0	109.2
1131	P	47.8	Very low	30.8	Very low	112 Å²	112	118.2 Å²	118.2	73%	0.727	77%	0.77	S	S	*	*			cis	-129.4	-121.4	-20.8	36.8	-15	0	0	0	110.9
1132	P	50.9	Low	30.7	Very low	101 Å²	101	124.7 Å²	124.7	66%	0.656	78%	0.777	S	S	*	*				-118	-179.5	-64.2	37.6	-22.6	0	0	0	114.2
1133	M	27.4	Very low	30.9	Very low	151 Å²	151	124.5 Å²	124.5	74%	0.744	78%	0.78	S	S	*	*			trans	152	124.5	141.4	-79.8	-76.2	173.6	0	0	109.8
1134	K	26.5	Very low	30.7	Very low	177 Å²	177	129 Å²	129	77%	0.77	79%	0.794	S	S	*	*				74	131.9	67.2	-80.8	-154.9	-160.7	172.4	0	113.8
1135	V	28.7	Very low	31.1	Very low	123 Å²	123	125.4 Å²	125.4	75%	0.745	79%	0.794	S	S	*	*			cis	-153.2	177.9	-15.2	-174.8	0	0	0	0	106.7
1136	V	25.8	Very low	31.3	Very low	134 Å²	134	123.9 Å²	123.9	81%	0.812	79%	0.789	S	S	*	*			trans	119	112.5	147	-177.5	0	0	0	0	117.2
1137	T	28.1	Very low	31.4	Very low	129 Å²	129	130.2 Å²	130.2	79%	0.791	80%	0.801	S	S	*	*			trans	-78.9	156.6	158.2	9.2	0	0	0	0	110.6
1138	P	43	Very low	31.6	Very low	124 Å²	124	129.1 Å²	129.1	81%	0.805	79%	0.79	S	S	*	*				-156.9	176.8	57.7	42.9	-21.8	0	0	0	118.8
1139	G	27.6	Very low	31.8	Very low	69 Å²	69	135.2 Å²	135.2	71%	0.711	80%	0.798	S	S	*	*				90.7	109.7	117.9	0	0	0	0	0	122.9
1140	A	28	Very low	32.3	Very low	100 Å²	100	133.8 Å²	133.8	83%	0.826	79%	0.794	S	S	*	*				72.8	111.4	129.3	0	0	0	0	0	124.1
1141	S	27.5	Very low	32	Very low	110 Å²	110	131.5 Å²	131.5	77%	0.769	80%	0.796	S	S	*	*				71.6	123.2	115.7	-149	0	0	0	0	124.4
1142	R	29.4	Very low	31.5	Very low	218 Å²	218	132 Å²	132	82%	0.823	80%	0.803	S	S	*	*			trans	58.4	108.1	142.9	-78.8	-170.7	164	-149.3	-2.5	123.4
1143	L	36.3	Very low	31.9	Very low	159 Å²	159	132.6 Å²	132.6	83%	0.832	81%	0.806	S	S	*	*				46.5	115.9	115.6	-62.4	172.5	0	0	0	121.8
1144	K	27.8	Very low	32.2	Very low	219 Å²	219	131.5 Å²	131.5	95%	0.952	80%	0.803	S	S	*	*				-159.3	179.2	129.9	-128	176.8	-179.7	-179.2	0	112.4
1145	A	33.6	Very low	32.4	Very low	97 Å²	97	131.4 Å²	131.4	80%	0.802	80%	0.803	S	S	*	*			trans	-144.8	165.2	-167.7	0	0	0	0	0	113.4
1146	A	32	Very low	32.6	Very low	96 Å²	96	131.1 Å²	131.1	79%	0.793	81%	0.807	S	S	*	*			trans	-175.7	115.7	153.8	0	0	0	0	0	116.4
1147	Q	30.6	Very low	33.2	Very low	201 Å²	201	133.2 Å²	133.2	94%	0.939	80%	0.804	S	S	*	*				50.7	135.9	114.4	-173.8	173.2	-21.8	0	0	124.7
1148	G	29.7	Very low	33.8	Very low	65 Å²	65	134.9 Å²	134.9	67%	0.67	80%	0.803	S	S	*	*			trans	156.8	104.9	142.1	0	0	0	0	0	121.9
1149	Q	30.7	Very low	33.3	Very low	201 Å²	201	132 Å²	132	94%	0.939	80%	0.796	S	S	*	*			trans	56.9	165.3	146.3	-68.2	-175.2	-11.2	0	0	121.7
1150	A	34.2	Very low	33.6	Very low	99 Å²	99	137.9 Å²	137.9	82%	0.818	80%	0.802	S	S	*	*			cis	-169.5	159.8	-33.7	0	0	0	0	0	110.8
1151	G	26.1	Very low	33.7	Very low	77 Å²	77	142.9 Å²	142.9	79%	0.794	81%	0.808	S	S	*	*			trans	169	145.9	171.3	0	0	0	0	0	117.6
1152	S	37.6	Very low	33.7	Very low	123 Å²	123	145 Å²	145	86%	0.86	80%	0.799	S	S	*	*			trans	-177.4	-174.9	-177.6	-128.1	0	0	0	0	110.6
1153	P	60.2	Low	33.7	Very low	112 Å²	112	139.2 Å²	139.2	73%	0.727	80%	0.797	S	S	*	*			cis	-139.5	-167.9	-7.8	33	-8.8	0	0	0	115.5
1154	D	33.9	Very low	33.3	Very low	128 Å²	128	137.1 Å²	137.1	68%	0.684	78%	0.784	S	S	*	*				126.1	143.1	123.8	-142.5	-152.5	0	0	0	121.9
1155	K	30.5	Very low	33.2	Very low	175 Å²	175	134.1 Å²	134.1	76%	0.761	77%	0.767	S	S	*	*			trans	49.9	116.8	169.4	-38.6	-171.1	-170.7	177.5	0	119.2
1156	S	32.2	Very low	32.9	Very low	118 Å²	118	135.8 Å²	135.8	83%	0.825	76%	0.76	S	S	*	*			cis	85.2	134.2	6.8	-157.7	0	0	0	0	119.5
1157	K	38.4	Very low	33	Very low	177 Å²	177	141.5 Å²	141.5	77%	0.77	76%	0.761	S	S	*	*			trans	108.5	153.1	-176.1	-70.2	-176.7	172.9	177.9	0	114
1158	H	41.5	Very low	33.3	Very low	164 Å²	164	136.9 Å²	136.9	76%	0.759	74%	0.742	S	S	*	*			cis	-167.2	168.9	-18.9	-101.3	-7.6	0	0	0	108.4
1159	G	30.8	Very low	33.1	Very low	63 Å²	63	142.3 Å²	142.3	65%	0.649	75%	0.75	S	S	*	*			cis	163.2	142.5	-8.7	0	0	0	0	0	115.4
1160	K	34.5	Very low	33.1	Very low	194 Å²	194	137 Å²	137	84%	0.843	74%	0.741	S	S	*	*			trans	58.5	125.4	157	-55.9	177.8	-176.9	177	0	121.4
1161	Q	29.7	Very low	32.9	Very low	204 Å²	204	140.1 Å²	140.1	95%	0.953	74%	0.738	S	S	*	*				-132	148.4	107.4	-103.6	-173.6	0.3	0	0	109.7
1162	R	29.1	Very low	33.2	Very low	156 Å²	156	143.6 Å²	143.6	59%	0.589	73%	0.734	S	S	*	*			trans	-161.4	122.8	-176.3	171.8	-166.2	139.9	-166.7	-10.2	108.7	E1164 Y1165	R1162-E1164 WeakPolarHBondContact CG-OE1 3.44Å; R1162-E1164 IonicContact CZ-OE1 3.16Å; R1162-E1164 IonicContact CZ-OE2 2.71Å; R1162-E1164 IonicContact NE-OE1 2.72Å; R1162-E1164 PolarHBondContact NE-OE1 3.05Å; R1162-E1164 IonicContact NE-OE2 2.7Å; R1162-E1164 IonicContact NH2-OE1 2.71Å; R1162-E1164 PolarHBondContact NH2-OE1 3.18Å; R1162-E1164 VanDerWaalsContact NH2-OE1 3.15Å; R1162-E1164 IonicContact NH2-OE2 3.3Å; R1162-E1164 PolarHBondContact NH2-OE2 3.41Å; R1162-Y1165 HydrophobicContact CG-CE2 4.5Å
1163	A	28.5	Very low	32.9	Very low	95 Å²	95	146.5 Å²	146.5	79%	0.785	73%	0.734	S	S	*	*			trans	-165.8	136.5	153.9	0	0	0	0	0	108.9
1164	E	27.7	Very low	31.4	Very low	116 Å²	116	145 Å²	145	54%	0.542	73%	0.731	S	S	.	*			cis	-134.1	168	-33.7	-85.8	-60.3	76	0	0	105.3	R1162	R1162-E1164 WeakPolarHBondContact CG-OE1 3.44Å; R1162-E1164 IonicContact CZ-OE1 3.16Å; R1162-E1164 IonicContact CZ-OE2 2.71Å; R1162-E1164 IonicContact NE-OE1 2.72Å; R1162-E1164 PolarHBondContact NE-OE1 3.05Å; R1162-E1164 IonicContact NE-OE2 2.7Å; R1162-E1164 IonicContact NH2-OE1 2.71Å; R1162-E1164 PolarHBondContact NH2-OE1 3.18Å; R1162-E1164 VanDerWaalsContact NH2-OE1 3.15Å; R1162-E1164 IonicContact NH2-OE2 3.3Å; R1162-E1164 PolarHBondContact NH2-OE2 3.41Å
1165	Y	25.9	Very low	31	Very low	155 Å²	155	144.7 Å²	144.7	61%	0.608	73%	0.734	S	S	*	*			cis	63.9	150.6	39	-75.6	-129.5	0	0	0	110.6	R1162	R1162-Y1165 HydrophobicContact CG-CE2 4.5Å
1166	M	27.1	Very low	31.1	Very low	133 Å²	133	145.6 Å²	145.6	66%	0.655	74%	0.738	S	S	*	*			cis	-161.5	-167.7	-6.3	-126	-67.8	-154.9	0	0	108.8	I1168	M1166-I1168 HydrophobicContact CE-CD1 3.74Å; M1166-I1168 HydrophobicContact CE-CG1 4.49Å; M1166-I1168 HydrophobicContact SD-CD1 3.43Å; M1166-I1168 WeakPolarHBondContact SD-CD1 3.44Å; M1166-I1168 HydrophobicContact SD-CG1 3.86Å
1167	R	34	Very low	31.8	Very low	216 Å²	216	145.1 Å²	145.1	82%	0.815	73%	0.732	S	S	*	*			trans	95.1	106.1	157.3	-153.9	155.5	-70.4	172	0.4	113.6
1168	I	36.6	Very low	31.3	Very low	104 Å²	104	141.9 Å²	141.9	53%	0.533	73%	0.732	S	S	.	*			cis	72.7	133.2	45.1	-49.9	156.1	0	0	0	112.3	M1166	M1166-I1168 HydrophobicContact CE-CD1 3.74Å; M1166-I1168 HydrophobicContact CE-CG1 4.49Å; M1166-I1168 HydrophobicContact SD-CD1 3.43Å; M1166-I1168 WeakPolarHBondContact SD-CD1 3.44Å; M1166-I1168 HydrophobicContact SD-CG1 3.86Å
1169	Q	27	Very low	30.9	Very low	178 Å²	178	142.2 Å²	142.2	83%	0.832	73%	0.731	S	S	*	*			trans	60.3	113.5	170.2	-78.6	165.5	-19.3	0	0	115
1170	A	30.4	Very low	30.7	Very low	91 Å²	91	145.6 Å²	145.6	75%	0.752	73%	0.73	S	S	*	*				86.6	142.1	64	0	0	0	0	0	113.9
1171	Q	29.9	Very low	30.4	Very low	163 Å²	163	144 Å²	144	76%	0.762	73%	0.727	S	S	*	*			trans	73.4	96.8	152.3	-157.2	166.3	-3.8	0	0	120.3
1172	Q	32.5	Very low	30.3	Very low	150 Å²	150	139.4 Å²	139.4	70%	0.701	72%	0.717	S	S	*	*			trans	74.6	142.8	141.7	-62.9	177.6	31.1	0	0	121.5
1173	Q	30.8	Very low	30.1	Very low	184 Å²	184	135.8 Å²	135.8	86%	0.86	73%	0.729	S	S	*	*			trans	68.4	127.4	169.2	-57.3	-176.8	39.5	0	0	116.7
1174	A	28.1	Very low	30.1	Very low	82 Å²	82	135.9 Å²	135.9	68%	0.678	72%	0.724	S	S	*	*			cis	-155.7	156.3	-5.4	0	0	0	0	0	114.6
1175	T	26.9	Very low	30	Very low	120 Å²	120	136.5 Å²	136.5	74%	0.736	73%	0.731	S	S	*	*			trans	59.2	102.8	152.7	47.4	0	0	0	0	123.6
1176	K	30.6	Very low	30.1	Very low	195 Å²	195	136.4 Å²	136.4	85%	0.848	74%	0.736	S	S	*	*				63.4	163.2	109.6	-75	-174.6	179	-178.8	0	121.4
1177	P	48.2	Very low	30.2	Very low	107 Å²	107	135.9 Å²	135.9	70%	0.695	74%	0.74	S	S	*	*			cis	-143.6	158.9	-35.4	38.4	-21.5	0	0	0	116.4
1178	S	28.3	Very low	30	Very low	110 Å²	110	130.3 Å²	130.3	77%	0.769	74%	0.735	S	S	*	*				160.7	128.4	122.7	-69.3	0	0	0	0	110.5
1179	K	32	Very low	29.7	Very low	170 Å²	170	130.9 Å²	130.9	74%	0.739	75%	0.747	S	S	*	*				70.3	130.5	66.9	-126.7	-169.1	-177.2	-127.5	0	111.5
1180	E	27.1	Very low	30.5	Very low	134 Å²	134	127.7 Å²	127.7	63%	0.626	74%	0.742	S	S	*	*			cis	-140.5	-167.3	12.3	-153.7	128	23.2	0	0	108.6
1181	M	28.2	Very low	30.4	Very low	162 Å²	162	129.6 Å²	129.6	80%	0.798	74%	0.744	S	S	*	*			cis	-148	-114.7	11.6	-174.2	26.3	165.5	0	0	113.6
1182	S	26.5	Very low	30.5	Very low	106 Å²	106	126.5 Å²	126.5	74%	0.741	74%	0.74	S	S	*	*			trans	-161.9	168.2	-160.3	-179.6	0	0	0	0	110.4
1183	G	26.3	Very low	30.3	Very low	80 Å²	80	128.4 Å²	128.4	83%	0.825	75%	0.749	S	S	*	*			trans	161.6	89.4	169	0	0	0	0	0	115.5
1184	S	27.8	Very low	30.3	Very low	98 Å²	98	128.9 Å²	128.9	69%	0.685	75%	0.749	S	S	*	*			trans	-126	-179.4	170.1	67.6	0	0	0	0	111.2
1185	N	26.7	Very low	31.1	Very low	128 Å²	128	129.7 Å²	129.7	68%	0.684	75%	0.747	S	S	*	*			trans	76.4	137.1	161.6	-76.1	51.2	0	0	0	117.5
1186	E	27.8	Very low	31.1	Very low	154 Å²	154	129.1 Å²	129.1	72%	0.72	75%	0.748	S	S	*	*			cis	-128.8	-113.4	-9.3	-59.9	-160.6	170.1	0	0	113.6
1187	T	29.4	Very low	31	Very low	122 Å²	122	123.8 Å²	123.8	75%	0.748	74%	0.74	S	S	*	*			cis	-151.7	137.2	5.3	-37.6	0	0	0	0	113.5
1188	S	28.8	Very low	30.1	Very low	99 Å²	99	124.1 Å²	124.1	69%	0.692	75%	0.745	S	S	*	*			trans	0.5	127.9	167.4	64.8	0	0	0	0	122.1
1189	S	29.6	Very low	30.3	Very low	115 Å²	115	129.7 Å²	129.7	80%	0.804	75%	0.749	S	S	*	*			trans	-77.7	161.6	134.8	-41.5	0	0	0	0	109.5
1190	P	45.5	Very low	30.2	Very low	112 Å²	112	127.9 Å²	127.9	73%	0.727	75%	0.753	S	S	*	*				-158.5	177.6	83.3	42	-22	0	0	0	118
1191	V	27.9	Very low	30.4	Very low	131 Å²	131	126.4 Å²	126.4	79%	0.794	76%	0.757	S	S	*	*			trans	80.7	123.8	141.2	150.2	0	0	0	0	121.9
1192	S	31.2	Very low	30.8	Very low	97 Å²	97	126 Å²	126	68%	0.678	76%	0.757	S	S	*	*			trans	72.8	136.2	145.2	-74.5	0	0	0	0	125.7
1193	E	29.8	Very low	31.4	Very low	190 Å²	190	126.5 Å²	126.5	89%	0.888	76%	0.757	S	S	*	*			trans	85.1	138.9	139	-77.1	-177.9	116.2	0	0	123.9
1194	K	29.9	Very low	31.5	Very low	194 Å²	194	128.2 Å²	128.2	84%	0.843	75%	0.752	S	S	*	*			trans	-78.8	175.1	165.7	-105.7	176.8	177.6	174.3	0	108.9
1195	P	44.7	Very low	31.6	Very low	100 Å²	100	131.9 Å²	131.9	65%	0.649	76%	0.762	S	S	*	*			cis	-139.9	174.7	12.4	34.9	-13.8	0	0	0	116.8
1196	S	27.6	Very low	31.7	Very low	107 Å²	107	131 Å²	131	75%	0.748	76%	0.762	S	S	*	*			trans	62.1	150.9	137.3	64.4	0	0	0	0	123.5
1197	A	28.7	Very low	31.7	Very low	84 Å²	84	128.9 Å²	128.9	69%	0.694	76%	0.764	S	S	*	*			trans	80.8	103.4	146.3	0	0	0	0	0	120.1
1198	S	28.4	Very low	31.6	Very low	113 Å²	113	133.4 Å²	133.4	79%	0.79	77%	0.774	S	S	*	*				78.7	108.4	117.6	-59.1	0	0	0	0	121.6
1199	R	33.4	Very low	31.7	Very low	227 Å²	227	132.2 Å²	132.2	86%	0.857	78%	0.777	S	S	*	*				90.9	139.4	117.8	-163.5	-173.7	-170.8	-172.2	2.8	118.3
1200	T	30	Very low	31.9	Very low	133 Å²	133	131.7 Å²	131.7	82%	0.816	78%	0.78	S	S	*	*			trans	66.9	149.6	170.9	17.7	0	0	0	0	114.8
1201	S	30.4	Very low	31.3	Very low	102 Å²	102	137.6 Å²	137.6	71%	0.713	79%	0.788	S	S	*	*			cis	-146.2	170.4	14.3	52.4	0	0	0	0	113.1
1202	I	36.7	Very low	31.5	Very low	154 Å²	154	139.1 Å²	139.1	79%	0.79	79%	0.791	S	S	*	*			trans	-119.7	129.2	165.2	-62.4	171.4	0	0	0	107.8	V1204	I1202-V1204 HydrophobicContact CG2-CG2 4.45Å
1203	P	38.3	Very low	31.4	Very low	117 Å²	117	140.5 Å²	140.5	76%	0.76	80%	0.801	S	S	*	*			trans	-99.6	124.4	153.2	32.9	-25.2	0	0	0	110.2
1204	V	29.9	Very low	31.4	Very low	116 Å²	116	137.3 Å²	137.3	70%	0.703	80%	0.799	S	S	*	*			trans	-76.8	140.3	167.4	172.5	0	0	0	0	108.9	I1202 T1206	I1202-V1204 HydrophobicContact CG2-CG2 4.45Å; V1204-T1206 HydrophobicContact CG1-CG2 4.07Å
1205	L	29.7	Very low	31.3	Very low	174 Å²	174	136 Å²	136	91%	0.911	80%	0.8	S	S	*	*			trans	-142.3	149.3	148.1	-104.2	-179	0	0	0	111.1
1206	T	28.8	Very low	30.6	Very low	110 Å²	110	136.2 Å²	136.2	68%	0.675	80%	0.804	S	S	*	*			trans	-122.5	143.2	-174.8	64.9	0	0	0	0	110.7	V1204	V1204-T1206 HydrophobicContact CG1-CG2 4.07Å
1207	S	27.7	Very low	30.7	Very low	110 Å²	110	144.4 Å²	144.4	77%	0.769	83%	0.826	S	S	*	*			trans	-176.8	131	151.1	16.6	0	0	0	0	107.5
1208	F	27.6	Very low	30.8	Very low	217 Å²	217	147.5 Å²	147.5	95%	0.952	83%	0.833	S	S	*	*				59.6	116	67.8	-92.7	-87.4	0	0	0	113.7
1209	G	29.4	Very low	30.9	Very low	74 Å²	74	149.3 Å²	149.3	76%	0.763	84%	0.835	S	S	*	*			trans	165.4	53.1	179	0	0	0	0	0	115.1
1210	A	33.5	Very low	30.8	Very low	103 Å²	103	144.9 Å²	144.9	85%	0.851	83%	0.834	S	S	*	*			trans	-67	133.7	173.6	0	0	0	0	0	111.2
1211	R	33.1	Very low	30.8	Very low	237 Å²	237	145.6 Å²	145.6	89%	0.894	84%	0.835	S	S	*	*			trans	-141	120.3	164.4	-60	-166.4	81.6	174	5.4	110.2
1212	N	32.5	Very low	30.9	Very low	163 Å²	163	148.4 Å²	148.4	87%	0.872	84%	0.843	S	S	*	*			trans	-68.3	149.5	164.6	-65.8	-17.7	0	0	0	109.9
1213	S	28.6	Very low	30.5	Very low	125 Å²	125	148 Å²	148	87%	0.874	85%	0.846	S	S	*	*			trans	-164.4	133.6	139.2	-104.4	0	0	0	0	110.1
1214	S	29.9	Very low	29.9	Very low	123 Å²	123	150.2 Å²	150.2	86%	0.86	85%	0.853	S	S	*	*			trans	-72	152.2	176.6	-40.5	0	0	0	0	111.9
1215	I	27.8	Very low	29.9	Very low	167 Å²	167	152.8 Å²	152.8	86%	0.856	86%	0.864	S	S	*	*				-151	153.5	123.7	-160.3	155	0	0	0	110.6
1216	S	29.9	Very low	29.9	Very low	104 Å²	104	151.1 Å²	151.1	73%	0.727	86%	0.86	S	S	*	*			trans	-77.8	150.8	-174.6	-38.8	0	0	0	0	113.6
1217	F	30.4	Very low	30	Very low	280 Å²	280	154.8 Å²	154.8	100%	1.228	88%	0.877	S	S	*	*				-157.2	0	123.8	-113	-69.1	0	0	0	111.1

Retrieved 1,217 of 1,217 residues in 438 ms (Link to these results)

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