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Isoform e of Serine/threonine-protein kinase WNK AlphaSync

Canonical isoform description: Serine/threonine-protein kinase component of the WNK3-SPAK/OSR1 kinase cascade, which plays an important role in the regulation of electrolyte homeostasis and regulatory volume increase in response to hyperosmotic stress¹. Wnk-1 mediates regulatory volume increase in response to hyperosmotic stress by acting as a molecular crowding sensor, which senses cell shrinkage and mediates formation of a membraneless compartment by undergoing liquid-liquid phase separation². The membraneless compartment concentrates wnk-1 with its substrates (By similarity). Phosphorylates gck-3³. Plays a role in osmotic stress responses during which it increases gpdh-1 translation, likely by phosphorylating gck-3⁴. Essential for larval development and the tubular formation of the excretory canals⁵.

AlphaFold DB , UniProt , Accession X5M5N0-6 (canonical: X5M5N0), Species CAEEL (Caenorhabditis elegans), Gene wnk-1, Length 1,679 aa.

						>WNK_CAEEL|X5M5N0-6|wnk-1
MPDSITNGGRPPAPPSSVSSTTASTTGNFGTRRRLVNRIKKVDELHPAQENPTMGSHWLSEQERSRLEAVQQDWRRTRPMKFQWTSKKRPDDPTTSSPSTVSISNALENSTPSLNNVSSITNSSSPFSLSSAATSTASAIIPFTSNVATNHPHLNHHVSRIPQAIVTGGTNGSLPPLLISPTSAAAATPLISGKAGPMSPSTGSPINVAATVLQNAVSSPQHSIFDRSRLNKIPPNTSLASSSSPSDAANNDKPIQQRHSILSNVRTLTQAMVNDGPRTLTGDDMDKMVSEEERARKEQEKREEEEKAARRIDVEDDFDAQEKPIDKSKNGRFLKFDEELGRGSFKTVFRGLDTETGVAVAWCELQESKLNKTERQRFREEAEMLKDLQHPNIVRFYDYWESADLCGKRKYIVLVTELMTSGTLKMYLKRFKRINIKVLKSWCRQILKGLSFLHTRNPPVIHRDLKCDNIFITGTTGSVKIGDLGLATLKNKSFAKSVIGTPEFMAPEMYEEMYDESVDVYAFGMCLLEMVTGEYPYSECMNPATIYRKVISGVKPECFSRIPAQYPEIREIIDRCIRVRREERSTVKQLLVDDFFTPEDLIGIRVEIKNRDADLNDLNVEIQMQLRVYDEKKRKQYRFKENEGLQFAFDIENDSPDEVVQQMIEQQHIPDEDTRMITKLIKDKVDAFRRDRDHRLLEIKRAKEEEERIREEAEIKEELRLRAEAKEKEKERLEKERLEKKAAAAAAANPNPTPIPPTPATPHSSAQQQPIPPPLSTQTSAEIQQSAQQPSVPVTMIANIPAMSPTSAQPQPVLSPTSAAVPVPTTMIHVPKPSEIPVQNVATTAAPVAANNVPPSPAPFKTEDIQTPTLAQNTVPRTISTDASGLVINTPASIASPSPAPSATDVASTTAPVTPAPTPTTTTDGGAAAASTTTENKEEKRKSNKRKVVMEILGCDESRNFALVSCRLDTSHKSVTFQFAPGTDKPCTIATKLLAEDCLLKVHVHIVEAQLGEVIQLINSDGKKGVGTKLATVLDPNSTEPPTITAVMPKDSSAATASNTKPKIEIEKTPPTRDASQEPNNVQVTNVRKVSQESNAESVQSIPRPGGIIVMSPTNQTDSAPPPTGAAAKPSRFQVTKSADPIATPISSSISTATVIPIVAATPTNITSEPVIVQPITAQVITHLATPSPVSHSLSSNSSPSATTHSNMSSIQSTTSVPGRRFTVQPVSQAESGISSSISTPHPEPTPAITSCPPPVPSVPPVVSNGTLNLEVAPKQTPSATNQNVDTQHSSSTASTATLVSETPATVHVTPISVPAPVQEPLVIDHHSDVLTQLDSELRKVSGVSHSASPSTVVESLTSMTPQTIPLACQTVPASIGQAPAVIAAAHAASLIPNASVPQSPSRLDAETGLAGLHEKLEALKMEQDRREDMGDDAIGTTTTDGKDEIPIDTLKGLAEALGKVIHADGRETTPMPPDHPDLTDASTGQMDLESEDPEVIQMIVRHRMEQHKLLEKQRVEIERLRSKIRVPRATSVNPEMIGDDEADTTLTALQSALGNASLSLPASPPPNTETTKVNTTVIPSDVLATRMTMSQSSTKSSNVSVSSRHRDNQSAPPRHHHHQPHPPHHPHLQNHYHPPQNHTSATAPCPSAMVQLQAVSNNNVNPLHQPPHPVSSQIPPQA
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	34.9	Very low	34.8	Very low	192 Å²	192	132.1 Å²	132.1	95%	0.946	79%	0.785	S	S	*	*				0	119.6	0	-96	-64.8	-173.8	0	0	109.6	D3	M1-D3 WeakPolarHBondContact CA-OD2 3.45Å; M1-D3 PolarHBondContact N-OD2 2.99Å
2	P	34.9	Very low	35.3	Very low	110 Å²	110	131.3 Å²	131.3	71%	0.714	79%	0.786	S	S	*	*			cis	-109.4	128.8	-30.3	5.2	17.3	0	0	0	109.5
3	D	34.8	Very low	35.5	Very low	119 Å²	119	126.5 Å²	126.5	64%	0.636	77%	0.769	S	S	*	*				60.4	100.8	54	-54.9	-67.3	0	0	0	112.8	M1 I5	M1-D3 WeakPolarHBondContact CA-OD2 3.45Å; M1-D3 PolarHBondContact N-OD2 2.99Å; D3-I5 PolarHBondContact O-N 3.22Å
4	S	30.8	Very low	36.6	Very low	123 Å²	123	126.1 Å²	126.1	86%	0.86	77%	0.77	S	S	*	*			trans	-35.9	121.4	152	-51.8	0	0	0	0	112
5	I	33.2	Very low	37	Very low	150 Å²	150	126.1 Å²	126.1	77%	0.769	77%	0.773	S	S	*	*			trans	-152.7	127.1	158.4	-117.8	156	0	0	0	114.4	D3	D3-I5 PolarHBondContact O-N 3.22Å
6	T	37.1	Very low	36.9	Very low	103 Å²	103	125.9 Å²	125.9	63%	0.632	78%	0.779	S	S	*	*			trans	77.9	103.2	154.4	58	0	0	0	0	123
7	N	35	Very low	37	Very low	159 Å²	159	124.6 Å²	124.6	85%	0.85	78%	0.776	S	S	*	*				84.9	125.6	110.7	-61.8	-9.3	0	0	0	121.7
8	G	31	Very low	37.1	Very low	88 Å²	88	124.9 Å²	124.9	91%	0.907	78%	0.777	S	S	*	*				109.7	41.5	120.6	0	0	0	0	0	118.8
9	G	34.2	Very low	37.1	Very low	74 Å²	74	123.5 Å²	123.5	76%	0.763	77%	0.772	S	S	*	*			trans	-145.1	104.9	173.8	0	0	0	0	0	113.5	P11	G9-P11 WeakPolarHBondContact O-CD 3.17Å
10	R	33.7	Very low	37.1	Very low	227 Å²	227	122.6 Å²	122.6	86%	0.857	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-86.3	119.2	175.8	176.9	-178.9	-178.5	-122.1	2.2	110.4
11	P	42.8	Very low	37	Very low	108 Å²	108	122.3 Å²	122.3	70%	0.701	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-64.4	152.4	171.3	-21.5	34.8	0	0	0	112.3	G9	G9-P11 WeakPolarHBondContact O-CD 3.17Å
12	P	40.7	Very low	37	Very low	122 Å²	122	119.5 Å²	119.5	79%	0.792	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-81.7	161.5	-162.1	32.4	-37.1	0	0	0	114.7
13	A	38.9	Very low	37	Very low	69 Å²	69	118 Å²	118	57%	0.57	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-89.1	152.1	163.9	0	0	0	0	0	110.5
14	P	50.5	Low	37.1	Very low	121 Å²	121	117.7 Å²	117.7	79%	0.786	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-62.9	155.6	171.8	27.2	-34.3	0	0	0	111.8
15	P	43.2	Very low	37.3	Very low	126 Å²	126	117.6 Å²	117.6	82%	0.818	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-78.7	154.6	-154.1	29.8	-37.2	0	0	0	115.4
16	S	34.1	Very low	37.5	Very low	123 Å²	123	116.9 Å²	116.9	86%	0.86	76%	0.763	S	S	*	*			trans	-130.9	134.6	165.3	59.3	0	0	0	0	111.2
17	S	39.8	Very low	37.4	Very low	105 Å²	105	115.3 Å²	115.3	73%	0.734	77%	0.767	S	S	*	*			trans	-169.9	131.8	-168.5	54	0	0	0	0	107.9
18	V	38.8	Very low	37.5	Very low	129 Å²	129	114.5 Å²	114.5	78%	0.782	76%	0.763	S	S	*	*			cis	-146.9	169.8	2.9	-163.1	0	0	0	0	108.3
19	S	37.2	Very low	37.6	Very low	98 Å²	98	118 Å²	118	69%	0.685	75%	0.753	S	S	*	*			trans	58.7	108.1	151.2	56.7	0	0	0	0	118.5
20	S	36.6	Very low	37.5	Very low	105 Å²	105	117.6 Å²	117.6	73%	0.734	75%	0.75	S	S	*	*				104.2	141.7	78.3	69.8	0	0	0	0	110.7
21	T	35.3	Very low	37.5	Very low	118 Å²	118	113.1 Å²	113.1	72%	0.724	75%	0.748	S	S	*	*			cis	-154.5	162.2	12.5	-26.8	0	0	0	0	109.8
22	T	35.1	Very low	36.8	Very low	132 Å²	132	119.3 Å²	119.3	81%	0.81	76%	0.757	S	S	*	*			trans	14.6	143.5	153.1	49.8	0	0	0	0	121.7
23	A	35.2	Very low	36.3	Very low	79 Å²	79	125.5 Å²	125.5	65%	0.653	76%	0.764	S	S	*	*			cis	-174.5	169.9	-4.5	0	0	0	0	0	110.6
24	S	35.9	Very low	35.9	Very low	113 Å²	113	133.9 Å²	133.9	79%	0.79	78%	0.781	S	S	*	*			trans	61.1	147	161.2	48.8	0	0	0	0	119.3
25	T	35.4	Very low	34.9	Very low	120 Å²	120	135.3 Å²	135.3	74%	0.736	78%	0.782	S	S	*	*			cis	-162	148.7	-10.5	-94	0	0	0	0	109.5
26	T	37.3	Very low	34.4	Very low	136 Å²	136	135.6 Å²	135.6	83%	0.834	78%	0.781	S	S	*	*			trans	3.9	146	169.3	59.7	0	0	0	0	122.2
27	G	35.6	Very low	34.3	Very low	70 Å²	70	137 Å²	137	72%	0.722	78%	0.779	S	S	*	*			cis	179.8	-166.1	9.4	0	0	0	0	0	115.7
28	N	36.5	Very low	33.9	Very low	142 Å²	142	142.4 Å²	142.4	76%	0.759	78%	0.783	S	S	*	*			trans	-82.6	178.5	-170.8	-63.9	-7.6	0	0	0	113.8
29	F	33.3	Very low	33.8	Very low	160 Å²	160	142.8 Å²	142.8	70%	0.702	78%	0.779	S	S	*	*			cis	-149.1	155.1	19	-97.7	-80	0	0	0	112.1
30	G	31.6	Very low	33.5	Very low	67 Å²	67	147.7 Å²	147.7	69%	0.691	79%	0.788	S	S	*	*			trans	169.4	81.5	169.7	0	0	0	0	0	118.6
31	T	33.2	Very low	33.2	Very low	133 Å²	133	151.4 Å²	151.4	82%	0.816	79%	0.791	S	S	*	*			trans	39.6	113.3	150.3	-46	0	0	0	0	122.5
32	R	28.9	Very low	33.1	Very low	238 Å²	238	152.9 Å²	152.9	90%	0.898	80%	0.799	S	S	*	*			trans	9	108.3	148.2	-60.6	179.5	177.3	-169.9	-1.2	119.5
33	R	30.2	Very low	33	Very low	251 Å²	251	153.3 Å²	153.3	95%	0.947	80%	0.797	S	S	*	*			trans	-179.6	90.2	133.4	-103.5	177.5	-175.3	-168	2.5	111.2
34	R	30.7	Very low	32.9	Very low	245 Å²	245	157.8 Å²	157.8	93%	0.925	80%	0.804	S	S	*	*			trans	-171.2	114.1	166	-108.1	174.1	-169.1	179.8	4.5	110.4
35	L	29.6	Very low	32.8	Very low	152 Å²	152	160 Å²	160	80%	0.796	81%	0.806	S	S	*	*				-172.6	59.3	110.6	-154	76.4	0	0	0	112.1
36	V	31.2	Very low	32.8	Very low	131 Å²	131	162.9 Å²	162.9	79%	0.794	81%	0.811	S	S	*	*	S	Bend	trans	-95.5	145.9	154.6	179.6	0	0	0	0	107
37	N	33.4	Very low	32.6	Very low	153 Å²	153	161.5 Å²	161.5	82%	0.818	80%	0.804	S	S	*	*			trans	66.6	89.6	-177	-61	-26.7	0	0	0	116.4
38	R	31.1	Very low	32.5	Very low	218 Å²	218	162.6 Å²	162.6	82%	0.823	81%	0.807	S	S	*	*			trans	-133.9	135.9	140.3	-119.5	-171.4	177	173.7	-0.9	110.2
39	I	35.5	Very low	32.1	Very low	138 Å²	138	164.4 Å²	164.4	71%	0.708	81%	0.811	S	S	*	*			trans	66.5	94.4	156.6	-55.9	167	0	0	0	115.9
40	K	31.6	Very low	32.2	Very low	201 Å²	201	166 Å²	166	87%	0.874	82%	0.82	S	S	*	*			trans	-69.9	161.4	138.5	-68.4	-179	176.1	-178.2	0	108.9
41	K	31.3	Very low	32.3	Very low	183 Å²	183	169.4 Å²	169.4	80%	0.796	82%	0.823	S	S	*	*			trans	72.1	91.4	-174	-61.5	-168.8	170.8	-163.5	0	114.7
42	V	32.9	Very low	32.3	Very low	148 Å²	148	169.1 Å²	169.1	90%	0.897	82%	0.823	S	S	*	*				-116.3	123.9	100.1	178	0	0	0	0	105.8
43	D	33.6	Very low	32.6	Very low	141 Å²	141	163.8 Å²	163.8	75%	0.754	82%	0.817	S	S	*	*			trans	-124.9	154.6	170.7	-140.9	-29.4	0	0	0	105.8
44	E	32.1	Very low	32.7	Very low	174 Å²	174	159 Å²	159	81%	0.813	81%	0.808	S	S	*	*			trans	65.3	144.4	179.7	-54.9	-176	110.6	0	0	118.7
45	L	34.1	Very low	32.9	Very low	159 Å²	159	150 Å²	150	83%	0.832	79%	0.791	S	S	*	*			trans	104.3	61.9	165.3	-58.8	176.1	0	0	0	119.7
46	H	35.3	Very low	33.2	Very low	180 Å²	180	148.1 Å²	148.1	83%	0.833	79%	0.79	S	S	*	*				-173.8	147.2	97.3	-115.5	-102.8	0	0	0	112.7
47	P	32.5	Very low	33.8	Very low	107 Å²	107	146.8 Å²	146.8	70%	0.695	78%	0.775	S	S	*	*			trans	-103.8	176.4	-178.5	40.3	-36	0	0	0	114.6
48	A	33.4	Very low	34.4	Very low	94 Å²	94	148.9 Å²	148.9	78%	0.777	77%	0.772	S	S	*	*			trans	74.5	151.1	163.2	0	0	0	0	0	118.3
49	Q	28.8	Very low	36	Very low	179 Å²	179	141.8 Å²	141.8	84%	0.836	75%	0.75	S	S	*	*			cis	-170.3	96.6	-24.5	173.5	-177.1	-22.9	0	0	108.8
50	E	34.7	Very low	37.9	Very low	193 Å²	193	137.8 Å²	137.8	90%	0.902	73%	0.734	S	S	*	*			trans	-137.6	162.1	174	-69.7	-161.7	153.7	0	0	113.3
51	N	33.9	Very low	39.4	Very low	139 Å²	139	135.8 Å²	135.8	74%	0.743	73%	0.728	S	S	*	*			trans	-89.2	144.2	-150.1	-65.5	-61.6	0	0	0	116.2	T53	N51-T53 PolarHBondContact O-N 3.37Å
52	P	33.3	Very low	41.2	Very low	127 Å²	127	134 Å²	134	83%	0.825	72%	0.722	S	S	*	*			trans	-87.7	81.4	173.1	35.1	-34.5	0	0	0	113	M54	P52-M54 PolarHBondContact O-N 2.92Å
53	T	36.3	Very low	42.9	Very low	127 Å²	127	131.5 Å²	131.5	78%	0.779	70%	0.701	S	S	*	*			trans	-85.3	95.6	177	41.7	0	0	0	0	113.9	N51	N51-T53 PolarHBondContact O-N 3.37Å
54	M	32.3	Very low	44.7	Very low	151 Å²	151	131.5 Å²	131.5	74%	0.744	69%	0.69	S	S	*	*	S	Bend	trans	30.9	87.4	155.6	-71.2	-160.4	-95.9	0	0	119.2	P52 K632	P52-M54 PolarHBondContact O-N 2.92Å; M54-K632 HydrophobicContact CB-CD 4.42Å; M54-K632 PolarHBondContact O-NZ 3.46Å; M54-K632 HydrophobicContact SD-CG 4.44Å
55	G	33.9	Very low	46.8	Very low	56 Å²	56	126.6 Å²	126.6	58%	0.577	68%	0.675	S	S	*	*			trans	-120.6	-53.1	175.3	0	0	0	0	0	117.1
56	S	36.8	Very low	48.8	Very low	111 Å²	111	127.7 Å²	127.7	78%	0.776	67%	0.668	S	S	*	*			trans	-142.8	57.1	-137.6	57	0	0	0	0	116.4
57	H	43.4	Very low	50.5	Low	104 Å²	104	122.8 Å²	122.8	48%	0.481	65%	0.648	S	S	.	*			trans	-146	58.7	175.9	-140.8	-92	0	0	0	114.9	L59 R64	H57-L59 PolarHBondContact CE1-O 3.29Å; H57-L59 PolarHBondContact ND1-O 3.36Å; H57-L59 PolarHBondContact O-N 3.1Å; H57-R64 PolarHBondContact CD2-NH1 3.41Å; H57-R64 PolarHBondContact NE2-NH1 2.99Å
58	W	46.2	Very low	52.8	Low	197 Å²	197	123 Å²	123	75%	0.746	64%	0.639	S	S	*	*			trans	-68.9	7.6	179	-81.8	101.5	0	0	0	116.4
59	L	64.7	Low	54.9	Low	69 Å²	69	121 Å²	121	36%	0.361	62%	0.623	S	S	.	*	S	Bend	trans	-131.6	137.8	174.6	-71.7	164.6	0	0	0	106.8	H57 E63 R64 L67	H57-L59 PolarHBondContact CE1-O 3.29Å; H57-L59 PolarHBondContact ND1-O 3.36Å; H57-L59 PolarHBondContact O-N 3.1Å; L59-E63 HydrophobicContact CB-CB 4.34Å; L59-E63 HydrophobicContact CD2-CB 4.09Å; L59-R64 HydrophobicContact CB-CB 4.43Å; L59-L67 HydrophobicContact CD1-CD1 3.58Å; L59-L67 HydrophobicContact CD2-CD1 3.83Å; L59-L67 HydrophobicContact CG-CD1 4.38Å
60	S	74.9	Confident	57.1	Low	53 Å²	53	117.1 Å²	117.1	37%	0.371	61%	0.611	S	S	.	*			trans	-59.9	154.7	166.5	63	0	0	0	0	110.1	Q62 E63 R64	S60-Q62 PolarHBondContact O-N 2.87Å; S60-E63 VanDerWaalsContact CB-OE2 3.27Å; S60-E63 WeakPolarHBondContact CB-OE2 3.38Å; S60-E63 PolarHBondContact N-OE2 3.43Å; S60-E63 PolarHBondContact O-N 3.38Å; S60-E63 WeakPolarHBondContact OG-CB 3.34Å; S60-E63 VanDerWaalsContact OG-CD 3.3Å; S60-E63 WeakPolarHBondContact OG-CG 3.22Å; S60-E63 PolarHBondContact OG-N 3.36Å; S60-E63 VanDerWaalsContact OG-N 3.08Å; S60-E63 PolarHBondContact OG-OE2 3.17Å; S60-R64 WeakPolarHBondContact O-CB 3.48Å; S60-R64 PolarHBondContact O-N 3.38Å
61	E	63.6	Low	59	Low	159 Å²	159	111.2 Å²	111.2	74%	0.743	58%	0.584	S	S	*	*	H	α-helix	trans	-57.9	-33.1	176.1	-166.7	166.5	-138.1	0	0	111.4	R64 S65	E61-R64 PolarHBondContact O-N 3.01Å; E61-S65 VanDerWaalsContact O-CB 3.29Å; E61-S65 WeakPolarHBondContact O-CB 3.43Å; E61-S65 PolarHBondContact O-N 2.88Å
62	Q	67.9	Low	60.8	Low	145 Å²	145	108.4 Å²	108.4	68%	0.678	57%	0.566	S	S	*	*	H	α-helix	trans	-64.4	-43.2	172.4	-149.6	71.9	5.6	0	0	112.9	S60 R66	S60-Q62 PolarHBondContact O-N 2.87Å; Q62-R66 VanDerWaalsContact O-CG 3.29Å; Q62-R66 WeakPolarHBondContact O-CG 3.33Å; Q62-R66 PolarHBondContact O-N 3.49Å
63	E	69.5	Low	62.8	Low	97 Å²	97	106.9 Å²	106.9	45%	0.453	55%	0.551	S	S	.	*	H	α-helix	trans	-71.9	-36.3	175.8	-73	163.2	119.2	0	0	112.4	L59 S60 S65 R66 L67	L59-E63 HydrophobicContact CB-CB 4.34Å; L59-E63 HydrophobicContact CD2-CB 4.09Å; S60-E63 VanDerWaalsContact CB-OE2 3.27Å; S60-E63 WeakPolarHBondContact CB-OE2 3.38Å; S60-E63 PolarHBondContact N-OE2 3.43Å; S60-E63 PolarHBondContact O-N 3.38Å; S60-E63 WeakPolarHBondContact OG-CB 3.34Å; S60-E63 VanDerWaalsContact OG-CD 3.3Å; S60-E63 WeakPolarHBondContact OG-CG 3.22Å; S60-E63 PolarHBondContact OG-N 3.36Å; S60-E63 VanDerWaalsContact OG-N 3.08Å; S60-E63 PolarHBondContact OG-OE2 3.17Å; E63-S65 VanDerWaalsContact C-N 3.32Å; E63-R66 PolarHBondContact O-N 3.45Å; E63-L67 WeakPolarHBondContact O-CB 3.33Å; E63-L67 PolarHBondContact O-N 2.9Å
64	R	72	Confident	64.1	Low	141 Å²	141	104.6 Å²	104.6	53%	0.532	53%	0.528	S	S	.	.	H	α-helix	trans	-60.7	-44.7	172.8	-164.6	173	-176.1	176.8	-1.8	110.1	H57 L59 S60 E61 L67 E68	H57-R64 PolarHBondContact CD2-NH1 3.41Å; H57-R64 PolarHBondContact NE2-NH1 2.99Å; L59-R64 HydrophobicContact CB-CB 4.43Å; S60-R64 WeakPolarHBondContact O-CB 3.48Å; S60-R64 PolarHBondContact O-N 3.38Å; E61-R64 PolarHBondContact O-N 3.01Å; R64-L67 PolarHBondContact O-N 3.29Å; R64-E68 VanDerWaalsContact O-CB 3.31Å; R64-E68 WeakPolarHBondContact O-CB 3.03Å; R64-E68 PolarHBondContact O-N 2.79Å
65	S	75.7	Confident	65.9	Low	70 Å²	70	103.8 Å²	103.8	49%	0.49	52%	0.517	S	S	.	.	H	α-helix	trans	-63.3	-40.4	172.3	-168.8	0	0	0	0	112.8	E61 E63 E68 A69	E61-S65 VanDerWaalsContact O-CB 3.29Å; E61-S65 WeakPolarHBondContact O-CB 3.43Å; E61-S65 PolarHBondContact O-N 2.88Å; E63-S65 VanDerWaalsContact C-N 3.32Å; S65-E68 PolarHBondContact O-N 3.17Å; S65-A69 VanDerWaalsContact O-CB 3.27Å; S65-A69 WeakPolarHBondContact O-CB 3.45Å; S65-A69 PolarHBondContact O-N 2.79Å
66	R	74.9	Confident	67.4	Low	183 Å²	183	109.8 Å²	109.8	69%	0.691	52%	0.522	S	S	*	.	H	α-helix	trans	-67.8	-39.8	174.9	-72.8	175.7	82	176.4	6.9	112.7	Q62 E63 A69 V70	Q62-R66 VanDerWaalsContact O-CG 3.29Å; Q62-R66 WeakPolarHBondContact O-CG 3.33Å; Q62-R66 PolarHBondContact O-N 3.49Å; E63-R66 PolarHBondContact O-N 3.45Å; R66-A69 PolarHBondContact O-N 3.38Å; R66-V70 WeakPolarHBondContact O-CB 3.29Å; R66-V70 VanDerWaalsContact O-CG2 3.31Å; R66-V70 WeakPolarHBondContact O-CG2 3.39Å; R66-V70 PolarHBondContact O-N 3.25Å
67	L	73	Confident	68.6	Low	77 Å²	77	108.9 Å²	108.9	40%	0.403	51%	0.512	S	S	.	.	H	α-helix	trans	-65.5	-40.8	173.4	-95.1	161.7	0	0	0	111.4	L59 E63 R64 V70 Q71	L59-L67 HydrophobicContact CD1-CD1 3.58Å; L59-L67 HydrophobicContact CD2-CD1 3.83Å; L59-L67 HydrophobicContact CG-CD1 4.38Å; E63-L67 WeakPolarHBondContact O-CB 3.33Å; E63-L67 PolarHBondContact O-N 2.9Å; R64-L67 PolarHBondContact O-N 3.29Å; L67-V70 PolarHBondContact O-N 3.45Å; L67-Q71 WeakPolarHBondContact O-CB 3.42Å; L67-Q71 WeakPolarHBondContact O-CG 3.42Å; L67-Q71 PolarHBondContact O-N 3Å
68	E	79.3	Confident	68.9	Low	110 Å²	110	110.3 Å²	110.3	51%	0.514	51%	0.513	S	S	.	.	H	α-helix	trans	-66.9	-39.2	174.7	-174.2	164.3	-144.1	0	0	111.8	R64 S65 Q71 Q72	R64-E68 VanDerWaalsContact O-CB 3.31Å; R64-E68 WeakPolarHBondContact O-CB 3.03Å; R64-E68 PolarHBondContact O-N 2.79Å; S65-E68 PolarHBondContact O-N 3.17Å; E68-Q71 PolarHBondContact O-N 3.08Å; E68-Q72 WeakPolarHBondContact O-CB 3.47Å; E68-Q72 WeakPolarHBondContact O-CG 3.43Å; E68-Q72 PolarHBondContact O-N 3.2Å
69	A	78.9	Confident	68.5	Low	54 Å²	54	105.5 Å²	105.5	45%	0.446	51%	0.508	S	S	.	.	H	α-helix	trans	-62.8	-42.6	172.1	0	0	0	0	0	111.9	S65 R66 Q72 D73	S65-A69 VanDerWaalsContact O-CB 3.27Å; S65-A69 WeakPolarHBondContact O-CB 3.45Å; S65-A69 PolarHBondContact O-N 2.79Å; R66-A69 PolarHBondContact O-N 3.38Å; A69-Q72 PolarHBondContact O-N 3.09Å; A69-D73 WeakPolarHBondContact O-CB 3.48Å; A69-D73 PolarHBondContact O-N 3.41Å
70	V	73.6	Confident	67.4	Low	96 Å²	96	107.2 Å²	107.2	58%	0.582	52%	0.515	S	S	*	.	H	α-helix	trans	-67.9	-35.9	174.8	169.1	0	0	0	0	111.9	R66 L67 W74	R66-V70 WeakPolarHBondContact O-CB 3.29Å; R66-V70 VanDerWaalsContact O-CG2 3.31Å; R66-V70 WeakPolarHBondContact O-CG2 3.39Å; R66-V70 PolarHBondContact O-N 3.25Å; L67-V70 PolarHBondContact O-N 3.45Å; V70-W74 WeakPolarHBondContact O-CB 3.48Å; V70-W74 PolarHBondContact O-N 2.62Å
71	Q	74.2	Confident	65.5	Low	69 Å²	69	112.1 Å²	112.1	32%	0.322	53%	0.529	S	S	.	.	H	α-helix	trans	-68.9	-38.4	171.3	-75.3	-168.1	16	0	0	112.1	L67 E68 W74 R75	L67-Q71 WeakPolarHBondContact O-CB 3.42Å; L67-Q71 WeakPolarHBondContact O-CG 3.42Å; L67-Q71 PolarHBondContact O-N 3Å; E68-Q71 PolarHBondContact O-N 3.08Å; Q71-W74 PolarHBondContact O-N 3.02Å; Q71-R75 WeakPolarHBondContact O-CB 3.38Å; Q71-R75 WeakPolarHBondContact O-CG 3.28Å; Q71-R75 PolarHBondContact O-N 3.14Å
72	Q	72.8	Confident	64.1	Low	80 Å²	80	110.1 Å²	110.1	37%	0.374	52%	0.518	S	S	.	.	H	α-helix	trans	-65.2	-45.3	174.4	-79.3	-167.7	42.1	0	0	111.1	E68 A69 R75 R76	E68-Q72 WeakPolarHBondContact O-CB 3.47Å; E68-Q72 WeakPolarHBondContact O-CG 3.43Å; E68-Q72 PolarHBondContact O-N 3.2Å; A69-Q72 PolarHBondContact O-N 3.09Å; Q72-R75 PolarHBondContact O-N 2.94Å; Q72-R76 WeakPolarHBondContact O-CB 3.34Å; Q72-R76 WeakPolarHBondContact O-CG 3.36Å; Q72-R76 PolarHBondContact O-N 2.91Å
73	D	74.6	Confident	62.4	Low	95 Å²	95	109.7 Å²	109.7	51%	0.508	52%	0.517	S	S	.	.	H	α-helix	trans	-63.8	-40.6	176.2	-172.2	58	0	0	0	111.3	A69 R75 R76 T77	A69-D73 WeakPolarHBondContact O-CB 3.48Å; A69-D73 PolarHBondContact O-N 3.41Å; D73-R75 PolarHBondContact O-N 2.85Å; D73-R76 CarbonylContact O-C 3.6Å; D73-R76 PolarHBondContact O-N 3.43Å; D73-T77 WeakPolarHBondContact O-CB 3.42Å; D73-T77 WeakPolarHBondContact O-CG2 3.37Å; D73-T77 PolarHBondContact O-N 2.75Å; D73-T77 PolarHBondContact O-OG1 2.82Å
74	W	64.2	Low	60.5	Low	80 Å²	80	116.7 Å²	116.7	30%	0.303	54%	0.539	S	S	.	.	H	α-helix	trans	-64.8	-37.2	172.9	-176.3	47.4	0	0	0	113.5	V70 Q71 R76 T77 R78 R430	V70-W74 WeakPolarHBondContact O-CB 3.48Å; V70-W74 PolarHBondContact O-N 2.62Å; Q71-W74 PolarHBondContact O-N 3.02Å; W74-R76 VanDerWaalsContact C-N 3.35Å; W74-T77 WeakPolarHBondContact CA-OG1 3.42Å; W74-T77 PolarHBondContact O-OG1 3.4Å; W74-R78 PolarHBondContact O-N 3.11Å; W74-R430 VanDerWaalsContact CE2-NH1 3.33Å; W74-R430 VanDerWaalsContact NE1-NH1 3.17Å
75	R	70.2	Confident	58.6	Low	133 Å²	133	115.2 Å²	115.2	50%	0.502	55%	0.546	S	S	.	.	H	α-helix	trans	-65.5	-36.5	172.3	-74.6	169.2	-177.7	125.2	7.4	111.7	Q71 Q72 D73	Q71-R75 WeakPolarHBondContact O-CB 3.38Å; Q71-R75 WeakPolarHBondContact O-CG 3.28Å; Q71-R75 PolarHBondContact O-N 3.14Å; Q72-R75 PolarHBondContact O-N 2.94Å; D73-R75 PolarHBondContact O-N 2.85Å
76	R	64.9	Low	56.4	Low	182 Å²	182	117.9 Å²	117.9	69%	0.687	57%	0.565	S	S	*	*	H	α-helix	trans	-76.8	-29.2	178.2	-69.9	166.5	-167.5	-126.7	11.8	113.8	Q72 D73 W74	Q72-R76 WeakPolarHBondContact O-CB 3.34Å; Q72-R76 WeakPolarHBondContact O-CG 3.36Å; Q72-R76 PolarHBondContact O-N 2.91Å; D73-R76 CarbonylContact O-C 3.6Å; D73-R76 PolarHBondContact O-N 3.43Å; W74-R76 VanDerWaalsContact C-N 3.35Å
77	T	61.9	Low	54.4	Low	92 Å²	92	118.1 Å²	118.1	56%	0.564	57%	0.57	S	S	*	*	H	α-helix	trans	-92.8	-7.6	-177.8	52.5	0	0	0	0	114	D73 W74	D73-T77 WeakPolarHBondContact O-CB 3.42Å; D73-T77 WeakPolarHBondContact O-CG2 3.37Å; D73-T77 PolarHBondContact O-N 2.75Å; D73-T77 PolarHBondContact O-OG1 2.82Å; W74-T77 WeakPolarHBondContact CA-OG1 3.42Å; W74-T77 PolarHBondContact O-OG1 3.4Å
78	R	50.7	Low	52.4	Low	134 Å²	134	124 Å²	124	51%	0.506	59%	0.593	S	S	.	*	S	Bend	trans	-66.8	131.3	160	-89.1	-169.5	173	-126.8	4.3	109.2	W74 M80	W74-R78 PolarHBondContact O-N 3.11Å; R78-M80 PolarHBondContact O-N 3.16Å
79	P	38.1	Very low	50.1	Low	97 Å²	97	130.1 Å²	130.1	63%	0.63	61%	0.611	S	S	*	*			trans	-70.2	94.8	166.4	29.4	-32.4	0	0	0	109	K81	P79-K81 PolarHBondContact O-N 2.84Å
80	M	40.5	Very low	48.2	Very low	104 Å²	104	133.2 Å²	133.2	51%	0.512	63%	0.627	S	S	.	*			trans	-75.3	116.6	169.7	-77.4	-179.5	164.3	0	0	109.7	R78 Q83	R78-M80 PolarHBondContact O-N 3.16Å; M80-Q83 HydrophobicContact SD-CB 4.41Å; M80-Q83 HydrophobicContact SD-CG 4.4Å
81	K	36.3	Very low	46.4	Very low	156 Å²	156	135.8 Å²	135.8	68%	0.678	64%	0.637	S	S	*	*	S	Bend	trans	-84.3	146.2	136.2	-65.1	-170.1	-179.8	-175.6	0	106.3	P79 E938	P79-K81 PolarHBondContact O-N 2.84Å; K81-E938 VanDerWaalsContact CE-OE1 3.22Å; K81-E938 WeakPolarHBondContact CE-OE1 3.3Å; K81-E938 IonicContact NZ-OE1 2.67Å; K81-E938 PolarHBondContact NZ-OE1 3.5Å
82	F	33.4	Very low	44.5	Very low	117 Å²	117	139.5 Å²	139.5	51%	0.513	66%	0.659	S	S	.	*			trans	59.7	118.2	-161.6	-75	-93.2	0	0	0	115.5	F318 D319	F82-F318 HydrophobicContact CE2-CB 4.5Å; F82-F318 HydrophobicContact CZ-CB 4Å; F82-D319 WeakPolarHBondContact CE1-OD1 3.32Å; F82-D319 WeakPolarHBondContact CZ-OD1 3.35Å
83	Q	32.3	Very low	42.8	Very low	137 Å²	137	139.9 Å²	139.9	64%	0.64	67%	0.669	S	S	*	*			trans	-141.8	101.6	167	-178	171.8	94.3	0	0	108.9	M80 T85	M80-Q83 HydrophobicContact SD-CB 4.41Å; M80-Q83 HydrophobicContact SD-CG 4.4Å; Q83-T85 HydrophobicContact CG-CG2 4.08Å; Q83-T85 PolarHBondContact O-N 2.91Å; Q83-T85 VanDerWaalsContact O-N 3.15Å
84	W	28.4	Very low	40.8	Very low	244 Å²	244	140.9 Å²	140.9	92%	0.924	68%	0.679	S	S	*	*			trans	-61.4	113.3	171	-89.4	8.3	0	0	0	110.8
85	T	33.4	Very low	39.3	Very low	109 Å²	109	143.3 Å²	143.3	67%	0.669	70%	0.702	S	S	*	*			trans	-106.9	51.7	-176.3	45.8	0	0	0	0	113.1	Q83 K87	Q83-T85 HydrophobicContact CG-CG2 4.08Å; Q83-T85 PolarHBondContact O-N 2.91Å; Q83-T85 VanDerWaalsContact O-N 3.15Å; T85-K87 VanDerWaalsContact C-N 3.28Å; T85-K87 PolarHBondContact O-N 3.43Å
86	S	29.7	Very low	37.7	Very low	127 Å²	127	141.6 Å²	141.6	89%	0.888	71%	0.711	S	S	*	*			trans	-65.5	84.1	164.9	-84.5	0	0	0	0	111.2
87	K	31.3	Very low	36.3	Very low	187 Å²	187	138.5 Å²	138.5	81%	0.813	72%	0.717	S	S	*	*			trans	-146.2	96.8	177.4	-153.2	162.9	-170.3	173.2	0	115.2	T85	T85-K87 VanDerWaalsContact C-N 3.28Å; T85-K87 PolarHBondContact O-N 3.43Å
88	K	31.6	Very low	35.4	Very low	202 Å²	202	140.1 Å²	140.1	88%	0.878	73%	0.729	S	S	*	*			trans	28.8	115.9	145.2	-61.2	-171.6	174.9	-170.1	0	118
89	R	31.5	Very low	34.7	Very low	237 Å²	237	138.7 Å²	138.7	89%	0.894	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-57.3	149.5	153.5	-67.7	-177.4	176.6	-172.3	-2.7	110.6
90	P	38.3	Very low	34.5	Very low	119 Å²	119	140.1 Å²	140.1	77%	0.773	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-85.4	149.7	157.1	35.7	-31.7	0	0	0	111.2
91	D	36.8	Very low	34.3	Very low	151 Å²	151	140.9 Å²	140.9	81%	0.807	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-73.4	167.6	160.6	-38.4	-82.9	0	0	0	108.6
92	D	34	Very low	34.2	Very low	146 Å²	146	138 Å²	138	78%	0.781	76%	0.757	S	S	*	*			cis	-167.2	-168.3	17.4	-153.4	13.5	0	0	0	106.3
93	P	36.9	Very low	34.2	Very low	89 Å²	89	139.3 Å²	139.3	58%	0.578	77%	0.767	S	S	*	*			cis	-127.8	179.9	-32.2	15.9	9.4	0	0	0	115.4
94	T	33.2	Very low	34.3	Very low	116 Å²	116	138 Å²	138	71%	0.712	77%	0.773	S	S	*	*			trans	73	122.8	146.2	41.1	0	0	0	0	124.2
95	T	33	Very low	34.6	Very low	130 Å²	130	133.2 Å²	133.2	80%	0.798	77%	0.766	S	S	*	*			trans	64.8	142.3	144.7	47.4	0	0	0	0	120.9
96	S	35.3	Very low	34.7	Very low	97 Å²	97	131.7 Å²	131.7	68%	0.678	76%	0.764	S	S	*	*			cis	-166.3	124	-6.1	48.2	0	0	0	0	114.7
97	S	35.5	Very low	34.9	Very low	117 Å²	117	132 Å²	132	82%	0.818	76%	0.755	S	S	*	*			trans	55.2	156.1	141	52	0	0	0	0	124.4
98	P	43.3	Very low	35.1	Very low	126 Å²	126	130.1 Å²	130.1	82%	0.818	75%	0.749	S	S	*	*			trans	-134	-179.8	-159.8	44.5	-27.2	0	0	0	117.5
99	S	36.4	Very low	35.2	Very low	104 Å²	104	126.7 Å²	126.7	73%	0.727	74%	0.741	S	S	*	*			trans	-161.1	128.8	153.9	51.1	0	0	0	0	110.6
100	T	34.1	Very low	35.5	Very low	127 Å²	127	120.4 Å²	120.4	78%	0.779	73%	0.733	S	S	*	*				69.1	119.4	77	-36.9	0	0	0	0	113.3
101	V	35.9	Very low	35.3	Very low	121 Å²	121	120.9 Å²	120.9	73%	0.733	73%	0.734	S	S	*	*				172	118.9	102.3	154.9	0	0	0	0	107.2
102	S	34.7	Very low	35.4	Very low	95 Å²	95	119.2 Å²	119.2	66%	0.664	73%	0.732	S	S	*	*				73.2	156.6	99.1	-45.8	0	0	0	0	116.6
103	I	33.6	Very low	35.5	Very low	145 Å²	145	117.3 Å²	117.3	74%	0.744	73%	0.729	S	S	*	*			cis	-166.3	141	-12.8	-108.4	166.9	0	0	0	110.6
104	S	34	Very low	35.4	Very low	109 Å²	109	119.8 Å²	119.8	76%	0.762	74%	0.737	S	S	*	*			trans	58.2	162.4	163	70.9	0	0	0	0	119.5
105	N	33.9	Very low	35.7	Very low	143 Å²	143	119.9 Å²	119.9	77%	0.765	73%	0.733	S	S	*	*			cis	-138.3	-161.4	0.2	-148.3	9.8	0	0	0	108.8
106	A	36.1	Very low	35.7	Very low	77 Å²	77	120.2 Å²	120.2	64%	0.636	73%	0.73	S	S	*	*			cis	-144.3	-176.7	8.1	0	0	0	0	0	108.4
107	L	33.2	Very low	35.6	Very low	133 Å²	133	119.8 Å²	119.8	70%	0.696	72%	0.723	S	S	*	*			cis	74.9	138.5	26.3	-86.8	66.4	0	0	0	115.1
108	E	35.4	Very low	35.4	Very low	149 Å²	149	117.4 Å²	117.4	70%	0.696	71%	0.707	S	S	*	*			cis	-156.1	165.7	10.3	-149.3	175.9	-114.5	0	0	115.2
109	N	34.7	Very low	34.9	Very low	129 Å²	129	114.8 Å²	114.8	69%	0.69	69%	0.691	S	S	*	*			trans	73.5	143.3	160.1	-66.1	-50.5	0	0	0	121
110	S	36.6	Very low	34.6	Very low	106 Å²	106	115.6 Å²	115.6	74%	0.741	69%	0.686	S	S	*	*			cis	-156.5	179.6	-5.2	-124.7	0	0	0	0	113.9
111	T	33.9	Very low	34.5	Very low	129 Å²	129	115.8 Å²	115.8	79%	0.791	69%	0.687	S	S	*	*			trans	-121.8	-164.7	-161.9	66.1	0	0	0	0	113.6
112	P	38.8	Very low	34.3	Very low	116 Å²	116	115.2 Å²	115.2	75%	0.753	68%	0.68	S	S	*	*			cis	-137.6	-166.5	-16.6	36.1	-14.5	0	0	0	116.1
113	S	37.9	Very low	34.3	Very low	105 Å²	105	115.6 Å²	115.6	73%	0.734	68%	0.683	S	S	*	*			trans	97.3	147.9	152.1	-143.8	0	0	0	0	119.2
114	L	34.9	Very low	34.2	Very low	142 Å²	142	113.3 Å²	113.3	74%	0.743	68%	0.68	S	S	*	*			cis	-166.9	170.5	-27.9	-106.9	-174.4	0	0	0	112.8
115	N	38	Very low	34.3	Very low	118 Å²	118	113.4 Å²	113.4	63%	0.631	68%	0.681	S	S	*	*			trans	59.8	105.7	151.1	-68.9	-10.8	0	0	0	124.8
116	N	33.9	Very low	34.7	Very low	136 Å²	136	111.8 Å²	111.8	73%	0.727	68%	0.678	S	S	*	*				70	141.1	122.4	-66.9	-5.4	0	0	0	122.1
117	V	32.5	Very low	34.4	Very low	89 Å²	89	117.7 Å²	117.7	54%	0.539	69%	0.69	S	S	.	*			cis	-149.4	166.8	-14.4	-153.9	0	0	0	0	109.6	P1255	V117-P1255 VanDerWaalsContact C-CD 3.45Å; V117-P1255 WeakPolarHBondContact O-CD 3.47Å
118	S	32.3	Very low	34.5	Very low	67 Å²	67	115.6 Å²	115.6	47%	0.469	69%	0.686	S	S	.	*			trans	94.9	118	160.7	-48.7	0	0	0	0	122.3	P1255 V1256	S118-P1255 CarbonylContact C-O 3.46Å; S118-P1255 VanDerWaalsContact O-CD 3.29Å; S118-P1255 WeakPolarHBondContact O-CD 3.3Å; S118-V1256 WeakPolarHBondContact CA-O 3.31Å; S118-V1256 PolarHBondContact N-O 3.29Å
119	S	32.1	Very low	34.3	Very low	71 Å²	71	116.2 Å²	116.2	50%	0.497	69%	0.693	S	S	.	*			trans	45.1	134.3	163.6	57	0	0	0	0	123.7	P1255	S119-P1255 CarbonylContact C-O 3.58Å; S119-P1255 WeakPolarHBondContact CA-O 3.21Å; S119-P1255 VanDerWaalsContact N-C 3.33Å; S119-P1255 PolarHBondContact N-O 2.84Å; S119-P1255 VanDerWaalsContact N-O 3.14Å
120	I	30	Very low	34.2	Very low	120 Å²	120	114.4 Å²	114.4	62%	0.615	69%	0.691	S	S	*	*			cis	-160.8	151.5	-8.7	-99	167.9	0	0	0	107.7	P1255 V1256	I120-P1255 PolarHBondContact N-O 2.88Å; I120-P1255 VanDerWaalsContact N-O 3.15Å; I120-V1256 HydrophobicContact CG1-CG1 4.39Å
121	T	32.5	Very low	34.1	Very low	131 Å²	131	114.4 Å²	114.4	80%	0.804	69%	0.69	S	S	*	*			trans	157.2	-173.7	145.1	45.1	0	0	0	0	114.5
122	N	31.1	Very low	34.1	Very low	109 Å²	109	112.6 Å²	112.6	58%	0.583	69%	0.689	S	S	*	*			trans	-86.2	161.4	-159.2	-83.2	-45.7	0	0	0	117.9
123	S	34.1	Very low	33.9	Very low	103 Å²	103	111.5 Å²	111.5	72%	0.72	69%	0.689	S	S	*	*			trans	76.7	156.6	153.9	86.1	0	0	0	0	116.9
124	S	33.1	Very low	33.7	Very low	97 Å²	97	112.4 Å²	112.4	68%	0.678	69%	0.691	S	S	*	*			cis	-155	172.9	10	74.8	0	0	0	0	114.1
125	S	35.8	Very low	33.7	Very low	112 Å²	112	110.2 Å²	110.2	78%	0.783	69%	0.687	S	S	*	*			trans	81.7	152.8	151.1	79.4	0	0	0	0	120.8
126	P	40.8	Very low	33.5	Very low	108 Å²	108	110.4 Å²	110.4	70%	0.701	69%	0.693	S	S	*	*			trans	-117.9	-179.2	-175.7	43.9	-33.4	0	0	0	113.4
127	F	31.6	Very low	33.5	Very low	202 Å²	202	108 Å²	108	89%	0.886	69%	0.692	S	S	*	*			trans	-152.2	98.4	150.4	-116.7	-83.8	0	0	0	115.1
128	S	33.8	Very low	33.6	Very low	88 Å²	88	109.3 Å²	109.3	62%	0.615	71%	0.705	S	S	*	*				58	174.4	124.2	-48.7	0	0	0	0	124.3
129	L	32.3	Very low	33.5	Very low	163 Å²	163	110.5 Å²	110.5	85%	0.853	72%	0.719	S	S	*	*			trans	83.8	137.6	165.8	-55.2	172.8	0	0	0	117.4
130	S	33.2	Very low	33.5	Very low	91 Å²	91	115 Å²	115	64%	0.636	74%	0.736	S	S	*	*			cis	-164.6	171.7	-15.5	56.9	0	0	0	0	112.8
131	S	32.9	Very low	33.5	Very low	105 Å²	105	116.6 Å²	116.6	73%	0.734	74%	0.744	S	S	*	*			trans	53.7	137.4	141.7	59.2	0	0	0	0	121.1
132	A	33.6	Very low	33.8	Very low	92 Å²	92	115.5 Å²	115.5	76%	0.76	74%	0.739	S	S	*	*			cis	170.8	-175.1	3.9	0	0	0	0	0	108.1
133	A	36.2	Very low	33.8	Very low	92 Å²	92	119.9 Å²	119.9	76%	0.76	75%	0.753	S	S	*	*			trans	81.1	146.4	148	0	0	0	0	0	121.3
134	T	33.7	Very low	33.5	Very low	125 Å²	125	120.1 Å²	120.1	77%	0.767	75%	0.75	S	S	*	*			cis	-162.9	161	-34.8	-51.6	0	0	0	0	107.8
135	S	34.5	Very low	33.2	Very low	96 Å²	96	120 Å²	120	67%	0.671	75%	0.749	S	S	*	*			trans	75.9	154.4	144.9	-112.6	0	0	0	0	119.4
136	T	33.7	Very low	32.8	Very low	121 Å²	121	121.4 Å²	121.4	74%	0.742	75%	0.748	S	S	*	*			cis	-158.9	159.6	-11.8	-12.6	0	0	0	0	111.1
137	A	34	Very low	32.3	Very low	86 Å²	86	122.2 Å²	122.2	71%	0.711	75%	0.751	S	S	*	*			trans	64.2	156.6	145.5	0	0	0	0	0	119.9
138	S	33.8	Very low	32.2	Very low	116 Å²	116	116.5 Å²	116.5	81%	0.811	74%	0.741	S	S	*	*			cis	-161.1	142.1	-24.7	-97.6	0	0	0	0	111.4
139	A	30.5	Very low	32.1	Very low	93 Å²	93	117.9 Å²	117.9	77%	0.769	75%	0.746	S	S	*	*			trans	15.5	158.9	146.9	0	0	0	0	0	123.5
140	I	32.8	Very low	32.2	Very low	165 Å²	165	116.8 Å²	116.8	85%	0.846	74%	0.741	S	S	*	*			trans	155.4	99.5	170.6	-35.1	164.2	0	0	0	111.9
141	I	30	Very low	32.4	Very low	154 Å²	154	119.6 Å²	119.6	79%	0.79	74%	0.744	S	S	*	*			trans	-68.3	167.7	-178.4	14.4	177.1	0	0	0	114
142	P	38.9	Very low	32.8	Very low	108 Å²	108	120.4 Å²	120.4	70%	0.701	75%	0.747	S	S	*	*			trans	-89.6	173.3	-157	38.3	-40.7	0	0	0	114.8
143	F	30.2	Very low	32.8	Very low	201 Å²	201	123.1 Å²	123.1	88%	0.882	74%	0.743	S	S	*	*			trans	-154.9	-172	141.9	-123.5	-84.9	0	0	0	112.1
144	T	27.2	Very low	32.6	Very low	107 Å²	107	125.6 Å²	125.6	66%	0.656	74%	0.743	S	S	*	*			trans	-100	168	-161.4	56.2	0	0	0	0	115
145	S	28	Very low	32.7	Very low	94 Å²	94	125.3 Å²	125.3	66%	0.657	74%	0.737	S	S	*	*			trans	94.4	137.9	137.6	83.8	0	0	0	0	120.8
146	N	27.3	Very low	32.5	Very low	142 Å²	142	128.7 Å²	128.7	76%	0.759	74%	0.742	S	S	*	*				88	107	127.9	-78.5	8.1	0	0	0	123.4
147	V	29.5	Very low	32.4	Very low	126 Å²	126	130.5 Å²	130.5	76%	0.764	74%	0.741	S	S	*	*				88.1	148.3	110.3	163.4	0	0	0	0	119.6
148	A	30.5	Very low	32.4	Very low	82 Å²	82	132 Å²	132	68%	0.678	74%	0.741	S	S	*	*			trans	85.6	136.5	154.5	0	0	0	0	0	120
149	T	32.3	Very low	32.3	Very low	117 Å²	117	131.2 Å²	131.2	72%	0.718	74%	0.736	S	S	*	*			cis	-163.2	161	-12.3	11.9	0	0	0	0	114.7
150	N	33.1	Very low	32.3	Very low	140 Å²	140	137.2 Å²	137.2	75%	0.749	74%	0.739	S	S	*	*			trans	71.5	96.9	141.6	-65.5	-6.9	0	0	0	122.9
151	H	36.9	Very low	32.5	Very low	149 Å²	149	137.2 Å²	137.2	69%	0.69	74%	0.739	S	S	*	*				15.2	147.7	98	-79	-53.2	0	0	0	120.3
152	P	42.6	Very low	32.8	Very low	123 Å²	123	133.9 Å²	133.9	80%	0.799	73%	0.727	S	S	*	*				-110.4	153.9	74.2	-6.1	26.2	0	0	0	113.5
153	H	32.5	Very low	32.2	Very low	148 Å²	148	136.7 Å²	136.7	69%	0.685	73%	0.731	S	S	*	*			cis	76.4	116.4	38.1	-90.7	-80	0	0	0	116.4
154	L	33.5	Very low	31.9	Very low	144 Å²	144	130.8 Å²	130.8	75%	0.754	72%	0.719	S	S	*	*				-167.9	150.9	108.5	-122.1	79.5	0	0	0	112.9
155	N	34.3	Very low	31.9	Very low	120 Å²	120	132.7 Å²	132.7	64%	0.642	72%	0.724	S	S	*	*			trans	62.3	118.3	159.9	-60.7	-6.3	0	0	0	119.8
156	H	31.6	Very low	31.9	Very low	167 Å²	167	134 Å²	134	77%	0.773	73%	0.727	S	S	*	*				82.6	140.6	59.5	-69.8	-41.4	0	0	0	112.8
157	H	31.2	Very low	32	Very low	159 Å²	159	133.9 Å²	133.9	74%	0.736	73%	0.732	S	S	*	*			cis	-158.8	-179.5	15.6	-151.9	-104.6	0	0	0	112.1
158	V	33.5	Very low	32	Very low	117 Å²	117	131.5 Å²	131.5	71%	0.709	73%	0.733	S	S	*	*			trans	70.3	106.6	166.5	-176.7	0	0	0	0	115.4
159	S	31.1	Very low	32	Very low	100 Å²	100	131.3 Å²	131.3	70%	0.699	74%	0.739	S	S	*	*				70.1	141.2	78.2	-75.8	0	0	0	0	115.4
160	R	30.7	Very low	32	Very low	219 Å²	219	131.3 Å²	131.3	83%	0.826	74%	0.739	S	S	*	*			cis	-156.5	135.5	9.4	-119	171.9	-163.3	-178.8	4.8	112.3
161	I	38.7	Very low	31.9	Very low	165 Å²	165	132.3 Å²	132.3	85%	0.846	74%	0.744	S	S	*	*			trans	-81.8	128.8	133	-63.4	163.2	0	0	0	103.6
162	P	34.6	Very low	31.8	Very low	84 Å²	84	128.8 Å²	128.8	55%	0.545	75%	0.748	S	S	.	*				-156.9	-161.7	86.2	47.2	-25.7	0	0	0	112.2
163	Q	26.9	Very low	31.2	Very low	166 Å²	166	128 Å²	128	78%	0.776	75%	0.746	S	S	*	*			cis	-157.3	-179.4	-2.9	-144.3	173.5	-95.6	0	0	109.9
164	A	23.6	Very low	31.1	Very low	78 Å²	78	128.3 Å²	128.3	65%	0.645	75%	0.752	S	S	*	*			trans	-111.2	-177.9	147.8	0	0	0	0	0	110
165	I	27.2	Very low	31.3	Very low	147 Å²	147	126.7 Å²	126.7	75%	0.754	75%	0.75	S	S	*	*			trans	90.2	95.8	171.8	-55.8	173.7	0	0	0	116.7
166	V	27.6	Very low	31.5	Very low	120 Å²	120	125.4 Å²	125.4	73%	0.727	75%	0.748	S	S	*	*			trans	78.2	144.6	130.9	176.6	0	0	0	0	121.8
167	T	29.2	Very low	31.4	Very low	141 Å²	141	122.6 Å²	122.6	87%	0.865	74%	0.738	S	S	*	*			trans	65.2	130.9	166.8	38.1	0	0	0	0	120.5
168	G	30.9	Very low	31.2	Very low	75 Å²	75	119.9 Å²	119.9	77%	0.773	73%	0.728	S	S	*	*			trans	169.2	-29.6	133.6	0	0	0	0	0	123.6
169	G	30.6	Very low	30.8	Very low	78 Å²	78	121 Å²	121	80%	0.804	73%	0.729	S	S	*	*			trans	65.5	-178.2	-174.7	0	0	0	0	0	115.1
170	T	30.7	Very low	31.2	Very low	118 Å²	118	120.9 Å²	120.9	72%	0.724	73%	0.728	S	S	*	*			cis	-146.5	163.3	-4.8	50.5	0	0	0	0	110.6
171	N	31	Very low	31.3	Very low	160 Å²	160	116 Å²	116	86%	0.856	73%	0.725	S	S	*	*			trans	63.1	123.4	165.1	-49.9	-26.3	0	0	0	117
172	G	34.8	Very low	30.8	Very low	75 Å²	75	114 Å²	114	77%	0.773	72%	0.721	S	S	*	*			cis	165.3	170	-0.6	0	0	0	0	0	108.5
173	S	30.3	Very low	30.5	Very low	108 Å²	108	115.4 Å²	115.4	76%	0.755	73%	0.732	S	S	*	*			cis	-160.1	106.1	-4.6	179.8	0	0	0	0	105.4
174	L	30.2	Very low	30.5	Very low	154 Å²	154	112.1 Å²	112.1	81%	0.806	73%	0.734	S	S	*	*				81.1	151.2	90.7	-75.3	173.6	0	0	0	113.3
175	P	38.4	Very low	30.6	Very low	109 Å²	109	113 Å²	113	71%	0.708	74%	0.741	S	S	*	*				-124.1	-111.7	-123	27.5	-2.7	0	0	0	111.9
176	P	39.5	Very low	30.6	Very low	93 Å²	93	110.7 Å²	110.7	60%	0.604	74%	0.743	S	S	*	*			cis	-132.1	-154.3	-41	25	0.4	0	0	0	113
177	L	28.6	Very low	30.7	Very low	108 Å²	108	109.2 Å²	109.2	57%	0.565	74%	0.744	S	S	*	*				101.1	143	129.5	-93.2	171.3	0	0	0	121.7
178	L	26.8	Very low	30.9	Very low	102 Å²	102	108.2 Å²	108.2	53%	0.534	74%	0.738	S	S	.	*			trans	73.1	131.5	153.6	-60.5	166.2	0	0	0	117.2
179	I	25.5	Very low	31.1	Very low	141 Å²	141	109.7 Å²	109.7	72%	0.723	73%	0.734	S	S	*	*				81	136.8	53.5	-67.5	-174.1	0	0	0	113.1
180	S	38.5	Very low	31	Very low	97 Å²	97	112.8 Å²	112.8	68%	0.678	73%	0.731	S	S	*	*			trans	-46.3	151.6	-178.6	-36.4	0	0	0	0	115
181	P	33.4	Very low	31	Very low	116 Å²	116	113.9 Å²	113.9	75%	0.753	73%	0.731	S	S	*	*				-134.4	154.1	87.7	40.1	-29.3	0	0	0	112.3
182	T	28.9	Very low	30.9	Very low	125 Å²	125	111 Å²	111	77%	0.767	72%	0.723	S	S	*	*			cis	70.9	118.6	44.8	-45.6	0	0	0	0	113.6
183	S	27	Very low	30.7	Very low	113 Å²	113	111 Å²	111	79%	0.79	72%	0.724	S	S	*	*			trans	149.1	152.3	131.3	-165.9	0	0	0	0	113.4
184	A	27.1	Very low	30.6	Very low	97 Å²	97	115.2 Å²	115.2	80%	0.802	73%	0.729	S	S	*	*			trans	60.9	137.3	169.7	0	0	0	0	0	117.3
185	A	26.9	Very low	30.5	Very low	97 Å²	97	112.5 Å²	112.5	80%	0.802	73%	0.728	S	S	*	*			cis	-164.3	154.2	-7.1	0	0	0	0	0	107.5
186	A	27.4	Very low	30.2	Very low	97 Å²	97	110.7 Å²	110.7	80%	0.802	73%	0.729	S	S	*	*			cis	-157.8	-158.8	-10.3	0	0	0	0	0	107.9
187	A	29.4	Very low	30.4	Very low	89 Å²	89	112 Å²	112	74%	0.736	74%	0.738	S	S	*	*			trans	69.9	73.4	170.9	0	0	0	0	0	117.2
188	T	32.7	Very low	30.4	Very low	121 Å²	121	115.7 Å²	115.7	74%	0.742	75%	0.754	S	S	*	*				-5.5	156.5	106.5	23.2	0	0	0	0	117.4	L190	T188-L190 HydrophobicContact CG2-CD1 4.05Å
189	P	35.8	Very low	31	Very low	106 Å²	106	115.9 Å²	115.9	69%	0.688	76%	0.764	S	S	*	*			cis	-142.8	154.3	23.6	44	-26.3	0	0	0	117.8
190	L	28.9	Very low	31.7	Very low	142 Å²	142	114.3 Å²	114.3	74%	0.743	76%	0.763	S	S	*	*				51.1	171	128	-74.8	55.5	0	0	0	119.9	T188	T188-L190 HydrophobicContact CG2-CD1 4.05Å
191	I	30	Very low	31.2	Very low	141 Å²	141	114.5 Å²	114.5	72%	0.723	77%	0.765	S	S	*	*			cis	-140	167.3	7.3	-146.4	156.7	0	0	0	112.9
192	S	29.8	Very low	31	Very low	99 Å²	99	115.7 Å²	115.7	69%	0.692	77%	0.77	S	S	*	*			trans	-55.3	143.8	174	53.3	0	0	0	0	113.6
193	G	29.4	Very low	31	Very low	76 Å²	76	113.4 Å²	113.4	78%	0.784	77%	0.771	S	S	*	*				116.1	-166.1	94	0	0	0	0	0	110.3
194	K	29.2	Very low	31.2	Very low	197 Å²	197	113.2 Å²	113.2	86%	0.857	77%	0.77	S	S	*	*			cis	-156.7	157.4	2.6	-168.8	179.9	-179.1	-178.8	0	107.8
195	A	28.2	Very low	31.6	Very low	96 Å²	96	114.9 Å²	114.9	79%	0.793	77%	0.772	S	S	*	*			trans	34.1	111.2	161	0	0	0	0	0	117
196	G	31.4	Very low	31.6	Very low	71 Å²	71	117.1 Å²	117.1	73%	0.732	77%	0.77	S	S	*	*				124.3	-173.5	78.5	0	0	0	0	0	111
197	P	42.8	Very low	32.3	Very low	121 Å²	121	120.4 Å²	120.4	79%	0.786	77%	0.774	S	S	*	*			trans	-115.4	168.4	-145.1	40.3	-33.1	0	0	0	113.9
198	M	30.4	Very low	32.3	Very low	186 Å²	186	121.4 Å²	121.4	92%	0.916	77%	0.77	S	S	*	*				-163.8	135.6	120.7	-103.5	159.8	79.4	0	0	112.3
199	S	38.9	Very low	32.3	Very low	106 Å²	106	120 Å²	120	74%	0.741	77%	0.771	S	S	*	*			trans	-75.8	-172.3	162.6	-41.2	0	0	0	0	109.2
200	P	39.5	Very low	32	Very low	107 Å²	107	118.6 Å²	118.6	70%	0.695	77%	0.768	S	S	*	*			cis	-141.3	-164.4	5.4	43	-23	0	0	0	115.1
201	S	28.5	Very low	32	Very low	102 Å²	102	118 Å²	118	71%	0.713	77%	0.771	S	S	*	*			trans	71.9	155.3	151.9	78.5	0	0	0	0	116.9
202	T	28.3	Very low	31.8	Very low	140 Å²	140	116.8 Å²	116.8	86%	0.859	77%	0.77	S	S	*	*			cis	-163.4	150.5	-21	17.3	0	0	0	0	105.7
203	G	30.5	Very low	31.7	Very low	77 Å²	77	118.6 Å²	118.6	79%	0.794	77%	0.771	S	S	*	*			trans	158.9	84.1	173.9	0	0	0	0	0	116.4
204	S	31	Very low	31.6	Very low	110 Å²	110	122.2 Å²	122.2	77%	0.769	77%	0.767	S	S	*	*			trans	-42.2	163.9	164.8	-54.4	0	0	0	0	116.7
205	P	34.5	Very low	31.4	Very low	131 Å²	131	120.4 Å²	120.4	85%	0.851	77%	0.767	S	S	*	*			trans	-76.7	152.8	-174.8	33.1	-37.6	0	0	0	113.2
206	I	27.9	Very low	31.4	Very low	145 Å²	145	120.2 Å²	120.2	74%	0.744	77%	0.765	S	S	*	*			trans	-131	116.7	176	-62.8	-174.7	0	0	0	110.2	V208	I206-V208 HydrophobicContact CG2-CB 3.75Å; I206-V208 HydrophobicContact CG2-CG2 3.39Å
207	N	40.9	Very low	31.2	Very low	166 Å²	166	122.7 Å²	122.7	89%	0.888	77%	0.766	S	S	*	*			trans	-105.7	104.2	165.4	-178.9	20.7	0	0	0	107.2
208	V	30.5	Very low	30.5	Very low	110 Å²	110	121.8 Å²	121.8	67%	0.667	76%	0.762	S	S	*	*			trans	-140.3	120.7	-174.4	157	0	0	0	0	106.5	I206	I206-V208 HydrophobicContact CG2-CB 3.75Å; I206-V208 HydrophobicContact CG2-CG2 3.39Å
209	A	31.7	Very low	30.5	Very low	91 Å²	91	118.3 Å²	118.3	75%	0.752	76%	0.757	S	S	*	*			cis	71.6	157.3	44.9	0	0	0	0	0	112.6
210	A	30.5	Very low	30.8	Very low	77 Å²	77	118.8 Å²	118.8	64%	0.636	76%	0.757	S	S	*	*			cis	-131.6	175.5	-13.6	0	0	0	0	0	107.6	V212	A210-V212 HydrophobicContact CB-CG2 4.49Å
211	T	28	Very low	30.4	Very low	130 Å²	130	121.6 Å²	121.6	80%	0.798	76%	0.761	S	S	*	*				175.1	110.9	94.7	-70.3	0	0	0	0	105.4
212	V	26.3	Very low	30.5	Very low	115 Å²	115	123.6 Å²	123.6	70%	0.697	76%	0.759	S	S	*	*				92.9	117.6	67.8	156.8	0	0	0	0	112.4	A210	A210-V212 HydrophobicContact CB-CG2 4.49Å
213	L	27.3	Very low	30.7	Very low	137 Å²	137	121.6 Å²	121.6	72%	0.717	75%	0.75	S	S	*	*			trans	87.8	129.1	159.9	-65.3	166.7	0	0	0	123.3
214	Q	26.4	Very low	30.7	Very low	152 Å²	152	124.1 Å²	124.1	71%	0.71	74%	0.744	S	S	*	*			trans	78.4	109.9	130.5	-73.7	165.3	-12	0	0	123
215	N	26.1	Very low	30.9	Very low	158 Å²	158	128.5 Å²	128.5	85%	0.845	75%	0.75	S	S	*	*				40	83.8	110.1	-57.8	6.6	0	0	0	119.8
216	A	27.3	Very low	30.6	Very low	92 Å²	92	128.6 Å²	128.6	76%	0.76	74%	0.743	S	S	*	*			trans	-155.9	130.3	135	0	0	0	0	0	107.7
217	V	27.3	Very low	30.8	Very low	123 Å²	123	132.8 Å²	132.8	75%	0.745	75%	0.75	S	S	*	*			cis	74.8	123.5	37.5	-175	0	0	0	0	113.2
218	S	28.1	Very low	30.1	Very low	102 Å²	102	129.1 Å²	129.1	71%	0.713	74%	0.737	S	S	*	*			trans	77.5	87.7	166.6	-65.5	0	0	0	0	120.5
219	S	31.4	Very low	30	Very low	114 Å²	114	134.7 Å²	134.7	80%	0.797	75%	0.746	S	S	*	*				101.9	149.2	106.4	-67.5	0	0	0	0	120.8
220	P	45.5	Very low	29.8	Very low	115 Å²	115	137.9 Å²	137.9	75%	0.747	75%	0.749	S	S	*	*			trans	-106.8	-178.2	-171.2	43.5	-36.4	0	0	0	113.1
221	Q	30.6	Very low	29.7	Very low	167 Å²	167	140.5 Å²	140.5	78%	0.78	75%	0.753	S	S	*	*			trans	171.7	145.6	148.2	-81.7	-118.2	-9.3	0	0	107
222	H	30.1	Very low	29.7	Very low	143 Å²	143	144.6 Å²	144.6	66%	0.662	76%	0.76	S	S	*	*			cis	-160	-169.6	-4.6	-144.3	-121.4	0	0	0	110.9
223	S	33.8	Very low	30.1	Very low	98 Å²	98	145.7 Å²	145.7	69%	0.685	76%	0.76	S	S	*	*			trans	77.3	112.4	170.5	-70	0	0	0	0	118.2
224	I	29.1	Very low	30.6	Very low	130 Å²	130	144.7 Å²	144.7	67%	0.667	76%	0.762	S	S	*	*				76.7	120.6	64.1	-65.1	161.9	0	0	0	110.1
225	F	34.8	Very low	30.8	Very low	203 Å²	203	142.9 Å²	142.9	89%	0.89	76%	0.763	S	S	*	*			cis	-125.4	160.8	41.4	-125.6	-79.7	0	0	0	117.1
226	D	28.1	Very low	31.1	Very low	133 Å²	133	142.1 Å²	142.1	71%	0.711	76%	0.759	S	S	*	*			trans	-88.5	164.4	-157.7	-147.6	-17.2	0	0	0	117.1
227	R	32.1	Very low	31.1	Very low	233 Å²	233	143.5 Å²	143.5	88%	0.879	76%	0.759	S	S	*	*			trans	-76.4	131.7	153.9	-79.6	175.7	161.7	-171.4	-4	108.5
228	S	28.1	Very low	31.1	Very low	88 Å²	88	142.6 Å²	142.6	62%	0.615	76%	0.758	S	S	*	*			trans	-153.4	125.2	166.5	-91.4	0	0	0	0	114.6
229	R	28	Very low	31.1	Very low	228 Å²	228	145.5 Å²	145.5	86%	0.86	76%	0.764	S	S	*	*			trans	48.8	102.2	135.5	-57.3	174.9	-168.4	-126.8	0.7	115.2
230	L	27.3	Very low	30.9	Very low	157 Å²	157	144 Å²	144	82%	0.822	76%	0.759	S	S	*	*	S	Bend		42.8	115.4	54.8	-148.7	82.3	0	0	0	113.1
231	N	28.2	Very low	30.1	Very low	133 Å²	133	143.3 Å²	143.3	71%	0.711	76%	0.757	S	S	*	*			trans	53.5	94.6	172.2	-65.2	5.8	0	0	0	117.3
232	K	27.6	Very low	29.9	Very low	216 Å²	216	140.2 Å²	140.2	94%	0.939	75%	0.754	S	S	*	*			trans	-102.4	66.2	152.9	-158.4	178.9	-173.4	-176.6	0	110
233	I	34.3	Very low	29.9	Very low	138 Å²	138	138.2 Å²	138.2	71%	0.708	76%	0.755	S	S	*	*			trans	-115.1	130.5	166.5	-61.6	178.3	0	0	0	105.8
234	P	37.4	Very low	29.8	Very low	116 Å²	116	139 Å²	139	75%	0.753	76%	0.761	S	S	*	*			trans	-70	149.5	-174.9	29.1	-35.3	0	0	0	112.1
235	P	32.5	Very low	30	Very low	114 Å²	114	138.4 Å²	138.4	74%	0.74	77%	0.766	S	S	*	*			trans	-83.6	158.5	-178.4	34.2	-35.9	0	0	0	113.7
236	N	30.9	Very low	29.8	Very low	142 Å²	142	133.6 Å²	133.6	76%	0.759	76%	0.757	S	S	*	*			trans	68.8	105.2	155.3	-62	4.7	0	0	0	119.9
237	T	28.7	Very low	30	Very low	121 Å²	121	134.2 Å²	134.2	74%	0.742	76%	0.76	S	S	*	*				19.6	130.1	111.6	59.5	0	0	0	0	116.8
238	S	27.6	Very low	29.9	Very low	104 Å²	104	127.8 Å²	127.8	73%	0.727	76%	0.757	S	S	*	*				179.8	170.7	50.6	43.6	0	0	0	0	112.9
239	L	27.8	Very low	30.2	Very low	163 Å²	163	127.4 Å²	127.4	85%	0.853	76%	0.76	S	S	*	*			trans	27.6	121.7	152.7	-85.2	74.9	0	0	0	122
240	A	26.9	Very low	30.5	Very low	82 Å²	82	123.5 Å²	123.5	68%	0.678	76%	0.756	S	S	*	*				77	139.6	119.5	0	0	0	0	0	122.8
241	S	27.4	Very low	30.9	Very low	101 Å²	101	122.2 Å²	122.2	71%	0.706	75%	0.75	S	S	*	*			trans	46	114.2	139	63.7	0	0	0	0	121.3
242	S	27.6	Very low	31.2	Very low	102 Å²	102	122.2 Å²	122.2	71%	0.713	75%	0.75	S	S	*	*			trans	52.7	117.1	131.2	64.6	0	0	0	0	121
243	S	30.3	Very low	31.6	Very low	100 Å²	100	120.8 Å²	120.8	70%	0.699	74%	0.744	S	S	*	*			trans	61.5	116.5	135.1	61.7	0	0	0	0	120.9
244	S	30.6	Very low	31.7	Very low	115 Å²	115	119.6 Å²	119.6	80%	0.804	74%	0.744	S	S	*	*			trans	77.2	160.4	136.5	67.9	0	0	0	0	118
245	P	34.9	Very low	31.3	Very low	118 Å²	118	121.5 Å²	121.5	77%	0.766	75%	0.747	S	S	*	*			trans	-112.9	178.6	-151.1	42.8	-35.5	0	0	0	114.4
246	S	29.5	Very low	31.3	Very low	102 Å²	102	124.4 Å²	124.4	71%	0.713	75%	0.75	S	S	*	*			trans	137.7	145.7	134.9	79.9	0	0	0	0	115.5
247	D	33	Very low	31.3	Very low	145 Å²	145	125.9 Å²	125.9	78%	0.775	75%	0.753	S	S	*	*			trans	65.7	87.6	144.8	-55.8	-12.4	0	0	0	123.4
248	A	30.4	Very low	31.4	Very low	98 Å²	98	131.6 Å²	131.6	81%	0.81	76%	0.761	S	S	*	*				80.1	168.3	100.6	0	0	0	0	0	122.7
249	A	34.4	Very low	31.6	Very low	81 Å²	81	135.3 Å²	135.3	67%	0.669	77%	0.766	S	S	*	*			trans	86.8	85.2	155.5	0	0	0	0	0	120.8
250	N	33.7	Very low	31.9	Very low	145 Å²	145	131.9 Å²	131.9	78%	0.775	76%	0.756	S	S	*	*				101.2	138	104.5	-78.3	6.1	0	0	0	123
251	N	35.4	Very low	32.4	Very low	130 Å²	130	135 Å²	135	70%	0.695	76%	0.76	S	S	*	*			trans	71.5	138.3	144.1	-67.7	27.8	0	0	0	120.1
252	D	35.1	Very low	33	Very low	134 Å²	134	137 Å²	137	72%	0.717	76%	0.761	S	S	*	*			cis	-158.9	177.6	-21.7	-135.1	-40.4	0	0	0	112.6
253	K	35.1	Very low	33.5	Very low	186 Å²	186	134.4 Å²	134.4	81%	0.809	74%	0.743	S	S	*	*			trans	-98.2	-167.7	175.1	-44.3	172.7	-177.1	167.3	0	110
254	P	36.1	Very low	34	Very low	112 Å²	112	135.2 Å²	135.2	73%	0.727	74%	0.74	S	S	*	*			cis	-133.1	170.1	-17.3	30.9	-9.9	0	0	0	115.8
255	I	30.3	Very low	34.5	Very low	157 Å²	157	135 Å²	135	81%	0.805	73%	0.734	S	S	*	*			trans	-4.4	124.6	146.9	-54.8	157.9	0	0	0	117.2
256	Q	30.9	Very low	34.7	Very low	174 Å²	174	138 Å²	138	81%	0.813	73%	0.73	S	S	*	*			trans	-163.7	168.5	138.4	-119	166.3	84.4	0	0	115.4
257	Q	32.3	Very low	35.3	Very low	173 Å²	173	137.9 Å²	137.9	81%	0.808	73%	0.725	S	S	*	*			trans	60.3	80.7	167.5	-68.6	-177.6	-14.5	0	0	119.3	H259	Q257-H259 PolarHBondContact O-N 3.01Å
258	R	30.4	Very low	35.5	Very low	241 Å²	241	138 Å²	138	91%	0.909	73%	0.725	S	S	*	*			trans	-52	115.2	133.1	-72.1	170.2	164.2	154	-7.8	108.8
259	H	31.7	Very low	35.9	Very low	183 Å²	183	138.9 Å²	138.9	85%	0.847	72%	0.72	S	S	*	*			trans	169.6	88.5	150.2	-99.1	-75	0	0	0	110.3	Q257	Q257-H259 PolarHBondContact O-N 3.01Å
260	S	33.6	Very low	36	Very low	90 Å²	90	142.4 Å²	142.4	63%	0.629	72%	0.723	S	S	*	*	S	Bend	trans	-158.8	-41.9	162.6	-165.7	0	0	0	0	114.9	L262 S263	S260-L262 PolarHBondContact O-N 3.02Å; S260-S263 WeakPolarHBondContact O-CB 3.08Å; S260-S263 PolarHBondContact O-N 3.02Å; S260-S263 VanDerWaalsContact O-N 3.15Å; S260-S263 PolarHBondContact O-OG 3.01Å
261	I	37.5	Very low	36.2	Very low	149 Å²	149	139.2 Å²	139.2	76%	0.764	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	43.5	-174.7	-37.7	-175.5	0	0	0	112.8
262	L	39.4	Very low	36.3	Very low	141 Å²	141	141.7 Å²	141.7	74%	0.738	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.8	6.3	155.2	-82.1	168.9	0	0	0	111.3	S260	S260-L262 PolarHBondContact O-N 3.02Å
263	S	38.7	Very low	36.6	Very low	48 Å²	48	141.1 Å²	141.1	34%	0.336	73%	0.727	S	S	.	*	S	Bend	trans	-85.2	-52.5	178.1	48.6	0	0	0	0	112.7	S260 V265 R266	S260-S263 WeakPolarHBondContact O-CB 3.08Å; S260-S263 PolarHBondContact O-N 3.02Å; S260-S263 VanDerWaalsContact O-N 3.15Å; S260-S263 PolarHBondContact O-OG 3.01Å; S263-V265 PolarHBondContact O-N 3.33Å; S263-R266 WeakPolarHBondContact O-CA 3.44Å; S263-R266 WeakPolarHBondContact O-CB 3.28Å; S263-R266 PolarHBondContact O-N 3.25Å
264	N	42	Very low	36.8	Very low	118 Å²	118	139.4 Å²	139.4	63%	0.631	73%	0.727	S	S	*	*	H	α-helix	trans	-76.2	-22.2	-166.4	-64.4	3.5	0	0	0	114.4	R266	N264-R266 PolarHBondContact O-N 2.87Å
265	V	40	Very low	37.1	Very low	111 Å²	111	142.2 Å²	142.2	67%	0.673	74%	0.736	S	S	*	*	H	α-helix	trans	-74.9	-14.9	168.4	-177.8	0	0	0	0	111.3	S263 T269	S263-V265 PolarHBondContact O-N 3.33Å; V265-T269 PolarHBondContact O-OG1 2.84Å; V265-T269 VanDerWaalsContact O-OG1 3.09Å
266	R	39.2	Very low	37.7	Very low	180 Å²	180	137.6 Å²	137.6	68%	0.679	73%	0.726	S	S	*	*	H	α-helix	trans	-78.6	-24.8	176.8	-145.5	179.3	-162.2	96.7	1.8	112.7	S263 N264	S263-R266 WeakPolarHBondContact O-CA 3.44Å; S263-R266 WeakPolarHBondContact O-CB 3.28Å; S263-R266 PolarHBondContact O-N 3.25Å; N264-R266 PolarHBondContact O-N 2.87Å
267	T	41.9	Very low	38.1	Very low	99 Å²	99	135.6 Å²	135.6	61%	0.607	73%	0.729	S	S	*	*	H	α-helix	trans	-77.8	-32.1	-172.6	-41.1	0	0	0	0	113.5
268	L	36.5	Very low	38.7	Very low	148 Å²	148	138.4 Å²	138.4	78%	0.775	73%	0.732	S	S	*	*	H	α-helix	trans	-84.4	-34.9	-178.5	-147.2	73	0	0	0	112.7	Q270 A271	L268-Q270 PolarHBondContact O-N 3.05Å; L268-Q270 VanDerWaalsContact O-N 3.11Å; L268-A271 PolarHBondContact O-N 2.91Å
269	T	39	Very low	39.1	Very low	116 Å²	116	133.7 Å²	133.7	71%	0.712	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-6.5	174.9	-36.6	0	0	0	0	113.1	V265	V265-T269 PolarHBondContact O-OG1 2.84Å; V265-T269 VanDerWaalsContact O-OG1 3.09Å
270	Q	36.7	Very low	39.7	Very low	155 Å²	155	131.7 Å²	131.7	72%	0.724	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	0.9	-179.5	-159.5	164	7.3	0	0	113.3	L268	L268-Q270 PolarHBondContact O-N 3.05Å; L268-Q270 VanDerWaalsContact O-N 3.11Å
271	A	39.1	Very low	40.6	Very low	78 Å²	78	131.5 Å²	131.5	65%	0.645	72%	0.72	S	S	*	*	S	Bend	trans	-106.1	1.3	-174.8	0	0	0	0	0	115.2	L268	L268-A271 PolarHBondContact O-N 2.91Å
272	M	37.3	Very low	41.4	Very low	183 Å²	183	126.9 Å²	126.9	90%	0.901	71%	0.71	S	S	*	*	S	Bend	trans	-113.9	18.2	179.9	-75.2	-175.3	146.1	0	0	114
273	V	40.8	Very low	42.2	Very low	121 Å²	121	126.5 Å²	126.5	73%	0.733	71%	0.708	S	S	*	*			trans	-103.5	75.2	168.5	-175.3	0	0	0	0	108.5
274	N	39.6	Very low	43	Very low	151 Å²	151	127.5 Å²	127.5	81%	0.807	71%	0.71	S	S	*	*			trans	174.6	89.3	158.9	-90.9	-18.9	0	0	0	110
275	D	42.2	Very low	43.5	Very low	171 Å²	171	126.8 Å²	126.8	91%	0.914	70%	0.704	S	S	*	*				-176.4	150.9	121.7	-101.4	-34.4	0	0	0	111.2
276	G	42	Very low	44.4	Very low	59 Å²	59	127.4 Å²	127.4	61%	0.608	70%	0.703	S	S	*	*			trans	-84.2	154.1	-167.4	0	0	0	0	0	115.2	R278	G276-R278 PolarHBondContact O-N 3.43Å
277	P	39.7	Very low	45.4	Very low	133 Å²	133	126.3 Å²	126.3	86%	0.864	70%	0.704	S	S	*	*			trans	-70.4	130.4	-177.8	29.2	-34.8	0	0	0	112
278	R	45.6	Very low	46.1	Very low	231 Å²	231	127.4 Å²	127.4	87%	0.872	70%	0.703	S	S	*	*			trans	-111.4	116.6	161.8	-77.1	-170.6	170.7	-162.1	-2.4	109.8	G276 L280	G276-R278 PolarHBondContact O-N 3.43Å; R278-L280 PolarHBondContact O-N 2.72Å
279	T	38.3	Very low	47.3	Very low	143 Å²	143	124.3 Å²	124.3	88%	0.877	69%	0.69	S	S	*	*			trans	-67.5	121.1	169.6	49.2	0	0	0	0	109.6
280	L	43.9	Very low	48.7	Very low	140 Å²	140	122.2 Å²	122.2	73%	0.733	68%	0.681	S	S	*	*			trans	-110.8	166.1	171.6	-74.7	171.5	0	0	0	111	R278	R278-L280 PolarHBondContact O-N 2.72Å
281	T	53.4	Low	50.2	Low	86 Å²	86	122 Å²	122	53%	0.528	68%	0.68	S	S	.	*			trans	-91.4	161.3	-153.9	20	0	0	0	0	113.9	D283 D284	T281-D283 PolarHBondContact O-N 2.81Å; T281-D284 PolarHBondContact N-OD2 2.71Å; T281-D284 WeakPolarHBondContact O-CB 3.32Å; T281-D284 PolarHBondContact O-N 2.99Å; T281-D284 PolarHBondContact OG1-OD2 2.98Å
282	G	55	Low	51.6	Low	53 Å²	53	123 Å²	123	55%	0.546	67%	0.671	S	S	.	*	H	α-helix	trans	-56.4	-37	-176.1	0	0	0	0	0	113.7	D284 M285	G282-D284 PolarHBondContact O-N 3.31Å; G282-M285 WeakPolarHBondContact O-CB 3.36Å; G282-M285 PolarHBondContact O-N 2.82Å
283	D	56	Low	53.3	Low	132 Å²	132	119 Å²	119	71%	0.706	65%	0.65	S	S	*	*	H	α-helix	trans	-68.3	-21.2	-179.4	-48.8	-57.3	0	0	0	113.4	T281	T281-D283 PolarHBondContact O-N 2.81Å
284	D	54.7	Low	54.9	Low	70 Å²	70	122.1 Å²	122.1	37%	0.374	65%	0.649	S	S	.	*	H	α-helix	trans	-78.1	-29.7	175.7	-60.7	-67.1	0	0	0	111.7	T281 G282 K287 M288	T281-D284 PolarHBondContact N-OD2 2.71Å; T281-D284 WeakPolarHBondContact O-CB 3.32Å; T281-D284 PolarHBondContact O-N 2.99Å; T281-D284 PolarHBondContact OG1-OD2 2.98Å; G282-D284 PolarHBondContact O-N 3.31Å; D284-K287 PolarHBondContact O-N 2.91Å; D284-M288 PolarHBondContact O-N 3.37Å
285	M	52.7	Low	56.7	Low	102 Å²	102	117.8 Å²	117.8	50%	0.502	63%	0.634	S	S	.	*	H	α-helix	trans	-66.1	-45.4	176.8	-66.1	-76.1	97.1	0	0	111.4	G282 K287 M288 V289	G282-M285 WeakPolarHBondContact O-CB 3.36Å; G282-M285 PolarHBondContact O-N 2.82Å; M285-K287 PolarHBondContact O-N 2.96Å; M285-M288 HydrophobicContact CE-SD 4.04Å; M285-M288 PolarHBondContact O-N 3.12Å; M285-M288 VanDerWaalsContact O-N 3.13Å; M285-V289 WeakPolarHBondContact O-CG2 3.29Å; M285-V289 PolarHBondContact O-N 2.92Å
286	D	59.7	Low	58.4	Low	124 Å²	124	116.9 Å²	116.9	66%	0.663	62%	0.618	S	S	*	*	H	α-helix	trans	-60.3	-33.2	179.9	-80.5	-11	0	0	0	112.4	S290	D286-S290 WeakPolarHBondContact O-CB 3.38Å; D286-S290 PolarHBondContact O-N 3.29Å; D286-S290 VanDerWaalsContact O-N 3.09Å
287	K	58.4	Low	60	Low	157 Å²	157	119.8 Å²	119.8	68%	0.683	61%	0.613	S	S	*	*	H	α-helix	trans	-69.7	-47	172.8	-91.4	-171.8	172	-176.8	0	112.9	D284 M285 V289 S290 E291	D284-K287 PolarHBondContact O-N 2.91Å; M285-K287 PolarHBondContact O-N 2.96Å; K287-V289 VanDerWaalsContact C-N 3.31Å; K287-V289 PolarHBondContact O-N 3.27Å; K287-S290 PolarHBondContact O-N 3Å; K287-S290 VanDerWaalsContact O-N 3.15Å; K287-E291 PolarHBondContact O-N 2.7Å; K287-E291 VanDerWaalsContact O-N 3.08Å
288	M	57.5	Low	61.8	Low	122 Å²	122	120.5 Å²	120.5	60%	0.601	61%	0.605	S	S	*	*	H	α-helix	trans	-59.1	-43.4	176.1	-80.8	-176.7	58.6	0	0	111.5	D284 M285 S290 E291 E292	D284-M288 PolarHBondContact O-N 3.37Å; M285-M288 HydrophobicContact CE-SD 4.04Å; M285-M288 PolarHBondContact O-N 3.12Å; M285-M288 VanDerWaalsContact O-N 3.13Å; M288-S290 VanDerWaalsContact C-N 3.31Å; M288-S290 PolarHBondContact O-N 3.24Å; M288-E291 PolarHBondContact O-N 3.17Å; M288-E292 WeakPolarHBondContact O-CB 3.36Å; M288-E292 PolarHBondContact O-N 2.98Å
289	V	62.7	Low	63.2	Low	83 Å²	83	115.4 Å²	115.4	50%	0.503	59%	0.591	S	S	.	*	H	α-helix	trans	-60.4	-40	175.7	171.3	0	0	0	0	111.4	M285 K287 E292 E293	M285-V289 WeakPolarHBondContact O-CG2 3.29Å; M285-V289 PolarHBondContact O-N 2.92Å; K287-V289 VanDerWaalsContact C-N 3.31Å; K287-V289 PolarHBondContact O-N 3.27Å; V289-E292 PolarHBondContact O-N 3.39Å; V289-E293 PolarHBondContact O-N 2.72Å
290	S	67.2	Low	65.1	Low	73 Å²	73	114.2 Å²	114.2	51%	0.51	58%	0.576	S	S	.	*	H	α-helix	trans	-68.1	-36.2	179.1	-162.1	0	0	0	0	113.8	D286 K287 M288 R294	D286-S290 WeakPolarHBondContact O-CB 3.38Å; D286-S290 PolarHBondContact O-N 3.29Å; D286-S290 VanDerWaalsContact O-N 3.09Å; K287-S290 PolarHBondContact O-N 3Å; K287-S290 VanDerWaalsContact O-N 3.15Å; M288-S290 VanDerWaalsContact C-N 3.31Å; M288-S290 PolarHBondContact O-N 3.24Å; S290-R294 PolarHBondContact O-N 3.21Å
291	E	68.5	Low	66.8	Low	151 Å²	151	112.9 Å²	112.9	71%	0.706	56%	0.564	S	S	*	*	H	α-helix	trans	-75.2	-38.3	173.1	-70.2	-166.8	131.9	0	0	112.1	K287 M288 R294 A295	K287-E291 PolarHBondContact O-N 2.7Å; K287-E291 VanDerWaalsContact O-N 3.08Å; M288-E291 PolarHBondContact O-N 3.17Å; E291-R294 VanDerWaalsContact O-CB 3.3Å; E291-R294 WeakPolarHBondContact O-CB 3.47Å; E291-R294 PolarHBondContact O-N 2.77Å; E291-A295 PolarHBondContact O-N 3.31Å
292	E	68	Low	68.1	Low	97 Å²	97	117.9 Å²	117.9	45%	0.453	57%	0.573	S	S	.	*	H	α-helix	trans	-65	-42.6	177.9	-159.1	-165.3	137.3	0	0	112	M288 V289 R294 A295 R296	M288-E292 WeakPolarHBondContact O-CB 3.36Å; M288-E292 PolarHBondContact O-N 2.98Å; V289-E292 PolarHBondContact O-N 3.39Å; E292-R294 PolarHBondContact O-N 2.72Å; E292-A295 PolarHBondContact O-N 3.45Å; E292-R296 WeakPolarHBondContact O-CG 3.13Å; E292-R296 PolarHBondContact O-N 3.16Å; E292-R296 IonicContact OE1-CZ 3.51Å; E292-R296 IonicContact OE1-NE 2.78Å; E292-R296 PolarHBondContact OE1-NE 3.19Å; E292-R296 IonicContact OE1-NH2 3.26Å; E292-R296 PolarHBondContact OE1-NH2 2.97Å
293	E	72.9	Confident	69.2	Low	101 Å²	101	121 Å²	121	47%	0.472	57%	0.574	S	S	.	*	H	α-helix	trans	-65.7	-28.6	176	-155.9	-167.4	126.8	0	0	112	V289 K297	V289-E293 PolarHBondContact O-N 2.72Å; E293-K297 PolarHBondContact O-N 2.94Å; E293-K297 VanDerWaalsContact O-N 3.16Å; E293-K297 IonicContact OE1-NZ 2.96Å; E293-K297 PolarHBondContact OE1-NZ 3.3Å
294	R	75.3	Confident	70.2	Confident	186 Å²	186	121.7 Å²	121.7	70%	0.702	57%	0.573	S	S	*	*	H	α-helix	trans	-66.7	-45.5	173.2	-146.4	-178.6	-159.4	94.6	0.5	111.2	S290 E291 E292 K297 E298	S290-R294 PolarHBondContact O-N 3.21Å; E291-R294 VanDerWaalsContact O-CB 3.3Å; E291-R294 WeakPolarHBondContact O-CB 3.47Å; E291-R294 PolarHBondContact O-N 2.77Å; E292-R294 PolarHBondContact O-N 2.72Å; R294-K297 PolarHBondContact O-N 2.79Å; R294-E298 PolarHBondContact O-N 2.84Å
295	A	77	Confident	71.3	Confident	59 Å²	59	123.8 Å²	123.8	49%	0.488	58%	0.58	S	S	.	*	H	α-helix	trans	-63.1	-43.1	175.6	0	0	0	0	0	112.2	E291 E292 K297 E298 Q299	E291-A295 PolarHBondContact O-N 3.31Å; E292-A295 PolarHBondContact O-N 3.45Å; A295-K297 PolarHBondContact O-N 2.84Å; A295-E298 PolarHBondContact O-N 3.17Å; A295-Q299 PolarHBondContact O-N 2.95Å
296	R	78.6	Confident	72.4	Confident	153 Å²	153	123.5 Å²	123.5	58%	0.577	58%	0.578	S	S	*	*	H	α-helix	trans	-58.2	-43.6	176.8	-71.8	178	-177.5	-149.8	6.7	112.2	E292 Q299 E300	E292-R296 WeakPolarHBondContact O-CG 3.13Å; E292-R296 PolarHBondContact O-N 3.16Å; E292-R296 IonicContact OE1-CZ 3.51Å; E292-R296 IonicContact OE1-NE 2.78Å; E292-R296 PolarHBondContact OE1-NE 3.19Å; E292-R296 IonicContact OE1-NH2 3.26Å; E292-R296 PolarHBondContact OE1-NH2 2.97Å; R296-Q299 PolarHBondContact O-N 2.87Å; R296-E300 WeakPolarHBondContact O-CB 3.25Å; R296-E300 PolarHBondContact O-N 2.76Å
297	K	76	Confident	73.4	Confident	119 Å²	119	124.1 Å²	124.1	52%	0.517	57%	0.574	S	S	.	*	H	α-helix	trans	-66	-35.5	176.9	-84.3	167	173.1	151.8	0	113.7	E293 R294 A295 K301	E293-K297 PolarHBondContact O-N 2.94Å; E293-K297 VanDerWaalsContact O-N 3.16Å; E293-K297 IonicContact OE1-NZ 2.96Å; E293-K297 PolarHBondContact OE1-NZ 3.3Å; R294-K297 PolarHBondContact O-N 2.79Å; A295-K297 PolarHBondContact O-N 2.84Å; K297-K301 WeakPolarHBondContact O-CB 3.41Å; K297-K301 PolarHBondContact O-N 3.35Å; K297-K301 VanDerWaalsContact O-N 3.12Å
298	E	76.4	Confident	74.2	Confident	149 Å²	149	118.9 Å²	118.9	70%	0.696	56%	0.56	S	S	*	*	H	α-helix	trans	-74.3	-31.2	176.9	-168.2	149.8	-146.8	0	0	112.1	R294 A295 R302	R294-E298 PolarHBondContact O-N 2.84Å; A295-E298 PolarHBondContact O-N 3.17Å; E298-R302 WeakPolarHBondContact O-CB 3.35Å; E298-R302 PolarHBondContact O-N 2.99Å
299	Q	75.1	Confident	75.2	Confident	123 Å²	123	115.4 Å²	115.4	58%	0.575	55%	0.551	S	S	*	*	H	α-helix	trans	-69.7	-45.3	170	-175.9	171.2	-22.8	0	0	112.5	A295 R296 K301 R302 E303	A295-Q299 PolarHBondContact O-N 2.95Å; R296-Q299 PolarHBondContact O-N 2.87Å; Q299-K301 VanDerWaalsContact C-N 3.34Å; Q299-K301 PolarHBondContact O-N 3.11Å; Q299-R302 WeakPolarHBondContact O-CB 3.35Å; Q299-R302 PolarHBondContact O-N 2.85Å; Q299-E303 PolarHBondContact O-N 2.78Å
300	E	77.6	Confident	75.7	Confident	119 Å²	119	119.1 Å²	119.1	56%	0.556	56%	0.556	S	S	*	*	H	α-helix	trans	-58.3	-44.4	177.1	-176.1	174.2	-147.2	0	0	111.5	R296 R302 E303 E304	R296-E300 WeakPolarHBondContact O-CB 3.25Å; R296-E300 PolarHBondContact O-N 2.76Å; E300-R302 VanDerWaalsContact C-N 3.28Å; E300-R302 PolarHBondContact O-N 2.73Å; E300-E303 PolarHBondContact O-N 2.94Å; E300-E304 PolarHBondContact O-N 2.8Å
301	K	80.3	Confident	75.8	Confident	111 Å²	111	122 Å²	122	48%	0.483	56%	0.556	S	S	.	*	H	α-helix	trans	-58.4	-38.9	172.9	179.2	-179.6	175	-68.2	0	112.5	K297 Q299 E304 E305	K297-K301 WeakPolarHBondContact O-CB 3.41Å; K297-K301 PolarHBondContact O-N 3.35Å; K297-K301 VanDerWaalsContact O-N 3.12Å; Q299-K301 VanDerWaalsContact C-N 3.34Å; Q299-K301 PolarHBondContact O-N 3.11Å; K301-E304 PolarHBondContact O-N 2.78Å; K301-E305 IonicContact NZ-OE1 3.95Å; K301-E305 PolarHBondContact NZ-OE1 2.93Å; K301-E305 IonicContact NZ-OE2 3.66Å; K301-E305 PolarHBondContact NZ-OE2 3.31Å; K301-E305 PolarHBondContact O-N 3.22Å
302	R	80	Confident	75.5	Confident	191 Å²	191	120 Å²	120	72%	0.721	55%	0.549	S	S	*	.	H	α-helix	trans	-72.2	-38.4	-178.5	-161.2	175.8	-167	162.6	3.7	111.9	E298 Q299 E300 E305 E306	E298-R302 WeakPolarHBondContact O-CB 3.35Å; E298-R302 PolarHBondContact O-N 2.99Å; Q299-R302 WeakPolarHBondContact O-CB 3.35Å; Q299-R302 PolarHBondContact O-N 2.85Å; E300-R302 VanDerWaalsContact C-N 3.28Å; E300-R302 PolarHBondContact O-N 2.73Å; R302-E305 PolarHBondContact O-N 3.2Å; R302-E306 WeakPolarHBondContact O-CB 3.5Å; R302-E306 PolarHBondContact O-N 2.7Å
303	E	78.7	Confident	75	Confident	119 Å²	119	121.2 Å²	121.2	56%	0.556	56%	0.558	S	S	*	*	H	α-helix	trans	-65.6	-36.9	170.8	-72.2	-172.9	-175.2	0	0	111.9	Q299 E300 K307	Q299-E303 PolarHBondContact O-N 2.78Å; E300-E303 PolarHBondContact O-N 2.94Å; E303-K307 WeakPolarHBondContact O-CB 3.16Å; E303-K307 PolarHBondContact O-N 2.75Å
304	E	76.5	Confident	74.2	Confident	147 Å²	147	120.6 Å²	120.6	69%	0.687	56%	0.561	S	S	*	*	H	α-helix	trans	-67.6	-41.9	174.5	-170.9	169.2	-137.6	0	0	112.3	E300 K301 K307 A308	E300-E304 PolarHBondContact O-N 2.8Å; K301-E304 PolarHBondContact O-N 2.78Å; E304-K307 PolarHBondContact O-N 3.34Å; E304-A308 WeakPolarHBondContact O-CB 3.25Å; E304-A308 PolarHBondContact O-N 3.5Å
305	E	77.4	Confident	73.2	Confident	113 Å²	113	118.2 Å²	118.2	53%	0.528	56%	0.558	S	S	.	*	H	α-helix	trans	-63.7	-40.4	174.1	-78.2	175.6	160.9	0	0	112.2	K301 R302 A308 A309	K301-E305 IonicContact NZ-OE1 3.95Å; K301-E305 PolarHBondContact NZ-OE1 2.93Å; K301-E305 IonicContact NZ-OE2 3.66Å; K301-E305 PolarHBondContact NZ-OE2 3.31Å; K301-E305 PolarHBondContact O-N 3.22Å; R302-E305 PolarHBondContact O-N 3.2Å; E305-A308 PolarHBondContact O-N 3.16Å; E305-A309 PolarHBondContact O-N 3.31Å
306	E	77.3	Confident	71.9	Confident	97 Å²	97	121.5 Å²	121.5	45%	0.453	57%	0.567	S	S	.	*	H	α-helix	trans	-68.8	-39	174.9	-162.8	-172.8	144.5	0	0	112.1	R302 A308 A309 R310	R302-E306 WeakPolarHBondContact O-CB 3.5Å; R302-E306 PolarHBondContact O-N 2.7Å; E306-A308 VanDerWaalsContact C-N 3.29Å; E306-A308 PolarHBondContact O-N 3.27Å; E306-A309 PolarHBondContact O-N 2.91Å; E306-R310 WeakPolarHBondContact O-CB 3.43Å; E306-R310 WeakPolarHBondContact O-CG 3.47Å; E306-R310 PolarHBondContact O-N 3.09Å; E306-R310 IonicContact OE1-CZ 3.46Å; E306-R310 IonicContact OE1-NE 3.52Å; E306-R310 PolarHBondContact OE1-NE 3.36Å; E306-R310 IonicContact OE1-NH2 3.76Å; E306-R310 PolarHBondContact OE1-NH2 3.3Å
307	K	79.2	Confident	70.6	Confident	136 Å²	136	118.8 Å²	118.8	59%	0.591	56%	0.564	S	S	*	*	H	α-helix	trans	-69	-27.2	176.2	-169.2	173.6	-172.4	173.3	0	112.4	E303 E304 R311	E303-K307 WeakPolarHBondContact O-CB 3.16Å; E303-K307 PolarHBondContact O-N 2.75Å; E304-K307 PolarHBondContact O-N 3.34Å; K307-R311 WeakPolarHBondContact O-CG 3.44Å; K307-R311 PolarHBondContact O-N 3.22Å
308	A	76.9	Confident	69.3	Low	47 Å²	47	118.7 Å²	118.7	39%	0.388	56%	0.564	S	S	.	*	H	α-helix	trans	-72.3	-44.5	168.3	0	0	0	0	0	111.6	E304 E305 E306 R311 I312	E304-A308 WeakPolarHBondContact O-CB 3.25Å; E304-A308 PolarHBondContact O-N 3.5Å; E305-A308 PolarHBondContact O-N 3.16Å; E306-A308 VanDerWaalsContact C-N 3.29Å; E306-A308 PolarHBondContact O-N 3.27Å; A308-R311 WeakPolarHBondContact O-CB 3.49Å; A308-R311 PolarHBondContact O-N 3.08Å; A308-R311 VanDerWaalsContact O-N 3.14Å; A308-I312 WeakPolarHBondContact O-CG1 3.19Å; A308-I312 PolarHBondContact O-N 2.87Å; A308-I312 VanDerWaalsContact O-N 3.15Å
309	A	77	Confident	68.2	Low	49 Å²	49	116.9 Å²	116.9	41%	0.405	56%	0.559	S	S	.	*	H	α-helix	trans	-60.1	-47.6	175.3	0	0	0	0	0	112.1	E305 E306 R311 I312 D313	E305-A309 PolarHBondContact O-N 3.31Å; E306-A309 PolarHBondContact O-N 2.91Å; A309-R311 PolarHBondContact O-N 2.62Å; A309-I312 PolarHBondContact O-N 3.26Å; A309-D313 PolarHBondContact O-N 3.31Å; A309-D313 VanDerWaalsContact O-N 3.07Å
310	R	73.3	Confident	67.1	Low	161 Å²	161	113.3 Å²	113.3	61%	0.608	55%	0.551	S	S	*	*	H	α-helix	trans	-62.6	-22.2	175.2	-70	175.1	-178.8	-135.4	10.6	113.7	E306 V314	E306-R310 WeakPolarHBondContact O-CB 3.43Å; E306-R310 WeakPolarHBondContact O-CG 3.47Å; E306-R310 PolarHBondContact O-N 3.09Å; E306-R310 IonicContact OE1-CZ 3.46Å; E306-R310 IonicContact OE1-NE 3.52Å; E306-R310 PolarHBondContact OE1-NE 3.36Å; E306-R310 IonicContact OE1-NH2 3.76Å; E306-R310 PolarHBondContact OE1-NH2 3.3Å; R310-V314 VanDerWaalsContact O-CG2 3.24Å; R310-V314 WeakPolarHBondContact O-CG2 3.34Å
311	R	70.1	Confident	65.9	Low	135 Å²	135	113.4 Å²	113.4	51%	0.509	55%	0.551	S	S	.	*	H	α-helix	trans	-76.1	-39.5	171.1	-83.3	169.6	161.7	173.5	-10.3	111.6	K307 A308 A309 V314 E315 E935	K307-R311 WeakPolarHBondContact O-CG 3.44Å; K307-R311 PolarHBondContact O-N 3.22Å; A308-R311 WeakPolarHBondContact O-CB 3.49Å; A308-R311 PolarHBondContact O-N 3.08Å; A308-R311 VanDerWaalsContact O-N 3.14Å; A309-R311 PolarHBondContact O-N 2.62Å; R311-V314 PolarHBondContact O-N 3.16Å; R311-E315 WeakPolarHBondContact O-CG 2.94Å; R311-E315 PolarHBondContact O-N 2.97Å; R311-E935 IonicContact NH2-OE1 2.7Å
312	I	62.7	Low	65.2	Low	109 Å²	109	113 Å²	113	56%	0.559	55%	0.551	S	S	*	*	H	α-helix	trans	-66.6	-44.7	178.7	-64.7	164.7	0	0	0	111.1	A308 A309 V314 E315 D316	A308-I312 WeakPolarHBondContact O-CG1 3.19Å; A308-I312 PolarHBondContact O-N 2.87Å; A308-I312 VanDerWaalsContact O-N 3.15Å; A309-I312 PolarHBondContact O-N 3.26Å; I312-V314 VanDerWaalsContact C-N 3.25Å; I312-V314 PolarHBondContact O-N 2.88Å; I312-E315 PolarHBondContact O-N 3.14Å; I312-E315 VanDerWaalsContact O-N 3.11Å; I312-D316 PolarHBondContact O-N 2.93Å; I312-D316 VanDerWaalsContact O-N 3.1Å
313	D	55.9	Low	65.2	Low	121 Å²	121	111.4 Å²	111.4	65%	0.647	55%	0.549	S	S	*	.	H	α-helix	trans	-61.4	-32.7	175.4	-83.4	-20.7	0	0	0	112.7	A309 D317	A309-D313 PolarHBondContact O-N 3.31Å; A309-D313 VanDerWaalsContact O-N 3.07Å; D313-D317 PolarHBondContact O-N 2.89Å
314	V	56.9	Low	65.7	Low	88 Å²	88	109 Å²	109	53%	0.533	54%	0.544	S	S	.	.	H	α-helix	trans	-77	-27.7	176.1	169.7	0	0	0	0	112.1	R310 R311 I312 F318	R310-V314 VanDerWaalsContact O-CG2 3.24Å; R310-V314 WeakPolarHBondContact O-CG2 3.34Å; R311-V314 PolarHBondContact O-N 3.16Å; I312-V314 VanDerWaalsContact C-N 3.25Å; I312-V314 PolarHBondContact O-N 2.88Å; V314-F318 WeakPolarHBondContact O-CD2 3.2Å
315	E	53.6	Low	66.5	Low	137 Å²	137	106.2 Å²	106.2	64%	0.64	53%	0.533	S	S	*	.	H	α-helix	trans	-74.7	-35.2	175.5	-75.5	176.5	170.7	0	0	112.3	R311 I312	R311-E315 WeakPolarHBondContact O-CG 2.94Å; R311-E315 PolarHBondContact O-N 2.97Å; I312-E315 PolarHBondContact O-N 3.14Å; I312-E315 VanDerWaalsContact O-N 3.11Å
316	D	50.5	Low	67.1	Low	127 Å²	127	103.2 Å²	103.2	68%	0.679	52%	0.52	S	S	*	.	H	α-helix	trans	-72.2	-29.8	176.7	-123	19.9	0	0	0	112.6	I312 F318	I312-D316 PolarHBondContact O-N 2.93Å; I312-D316 VanDerWaalsContact O-N 3.1Å; D316-F318 VanDerWaalsContact C-N 3.31Å; D316-F318 PolarHBondContact O-N 3.08Å
317	D	51.4	Low	67.9	Low	96 Å²	96	105.1 Å²	105.1	51%	0.513	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-11.7	177.7	-165.4	50	0	0	0	113.7	D313 A320	D313-D317 PolarHBondContact O-N 2.89Å; D317-A320 PolarHBondContact O-N 2.67Å
318	F	49.6	Very low	68.6	Low	117 Å²	117	98.7 Å²	98.7	51%	0.513	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-32	172.6	-101.5	-80.5	0	0	0	112.9	F82 V314 D316 A320	F82-F318 HydrophobicContact CE2-CB 4.5Å; F82-F318 HydrophobicContact CZ-CB 4Å; V314-F318 WeakPolarHBondContact O-CD2 3.2Å; D316-F318 VanDerWaalsContact C-N 3.31Å; D316-F318 PolarHBondContact O-N 3.08Å; F318-A320 PolarHBondContact O-N 2.97Å
319	D	52.2	Low	69.2	Low	111 Å²	111	103.9 Å²	103.9	59%	0.594	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-15.4	173.9	-87.1	-17.2	0	0	0	112.2	F82 Q321	F82-D319 WeakPolarHBondContact CE1-OD1 3.32Å; F82-D319 WeakPolarHBondContact CZ-OD1 3.35Å; D319-Q321 VanDerWaalsContact C-N 3.34Å; D319-Q321 PolarHBondContact O-N 2.97Å
320	A	51.7	Low	69.9	Low	49 Å²	49	106.4 Å²	106.4	41%	0.405	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-4.7	179.8	0	0	0	0	0	114.8	D317 F318 K323	D317-A320 PolarHBondContact O-N 2.67Å; F318-A320 PolarHBondContact O-N 2.97Å; A320-K323 WeakPolarHBondContact O-CE 3.36Å
321	Q	53.9	Low	70.9	Confident	120 Å²	120	100.1 Å²	100.1	56%	0.561	51%	0.506	S	S	*	.			trans	-98	-14.3	-169.2	-66.2	-178.3	18.5	0	0	115.1	D319 K323	D319-Q321 VanDerWaalsContact C-N 3.34Å; D319-Q321 PolarHBondContact O-N 2.97Å; Q321-K323 PolarHBondContact O-N 2.81Å
322	E	65.5	Low	72.1	Confident	103 Å²	103	96.6 Å²	96.6	48%	0.481	49%	0.492	S	S	.	.			trans	-79.5	58	179.8	-161.3	167.2	-102.2	0	0	112.3	F336 R350	E322-F336 HydrophobicContact CG-CD1 3.62Å; E322-F336 HydrophobicContact CG-CE1 3.93Å; E322-F336 HydrophobicContact CG-CG 4.2Å; E322-F336 WeakPolarHBondContact O-CE1 3.4Å; E322-R350 IonicContact OE1-CZ 3.21Å; E322-R350 IonicContact OE1-NH1 2.69Å; E322-R350 PolarHBondContact OE1-NH1 3.02Å; E322-R350 IonicContact OE1-NH2 2.78Å; E322-R350 PolarHBondContact OE1-NH2 3.47Å; E322-R350 IonicContact OE2-CZ 2.75Å; E322-R350 IonicContact OE2-NH1 3.85Å; E322-R350 IonicContact OE2-NH2 3.6Å; E322-R350 PolarHBondContact OE2-NH2 2.89Å
323	K	79.6	Confident	73.8	Confident	158 Å²	158	91.5 Å²	91.5	69%	0.687	47%	0.466	S	S	*	.			trans	-76	131.4	179.8	-70.5	172.5	-177.2	165.1	0	110.6	A320 Q321	A320-K323 WeakPolarHBondContact O-CE 3.36Å; Q321-K323 PolarHBondContact O-N 2.81Å
324	P	89.2	Confident	75.7	Confident	69 Å²	69	87.5 Å²	87.5	45%	0.448	44%	0.444	S	S	.	.			trans	-69.4	134.3	178.7	29.1	-34.9	0	0	0	110.9	L334 K335 F336	P324-L334 HydrophobicContact CB-CB 4.06Å; P324-L334 HydrophobicContact CB-CD1 4.32Å; P324-L334 HydrophobicContact CB-CD2 4.37Å; P324-L334 HydrophobicContact CB-CG 4.49Å; P324-L334 HydrophobicContact CG-CD1 4.35Å; P324-K335 CarbonylContact C-O 3.58Å; P324-K335 WeakPolarHBondContact CA-O 3.38Å; P324-F336 HydrophobicContact CB-CD1 4.38Å; P324-F336 HydrophobicContact CB-CE1 4.07Å
325	I	91.7	Very high	77.6	Confident	88 Å²	88	84.1 Å²	84.1	45%	0.451	42%	0.423	S	S	.	.	S	Bend	trans	-95.1	-20.9	-176.5	54.2	161.3	0	0	0	113.6	K335 D337	I325-K335 HydrophobicContact CD1-CD 3.8Å; I325-K335 HydrophobicContact CD1-CG 4.12Å; I325-K335 HydrophobicContact CG1-CB 4.27Å; I325-K335 HydrophobicContact CG1-CD 3.95Å; I325-K335 HydrophobicContact CG1-CG 3.99Å; I325-K335 WeakPolarHBondContact CG1-O 3.42Å; I325-K335 PolarHBondContact N-O 2.95Å; I325-D337 HydrophobicContact CD1-CB 3.96Å; I325-D337 HydrophobicContact CG2-CB 4.15Å
326	D	91.6	Very high	79.5	Confident	49 Å²	49	78.3 Å²	78.3	26%	0.262	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	166.8	174.6	-163.5	11.8	0	0	0	110.6	K335 W362 Y411	D326-K335 HydrophobicContact CB-CB 3.91Å; D326-K335 HydrophobicContact CB-CD 3.82Å; D326-K335 PolarHBondContact O-N 3.17Å; D326-W362 HydrophobicContact CB-CH2 4.22Å; D326-W362 HydrophobicContact CB-CZ2 4.07Å; D326-W362 WeakPolarHBondContact OD2-CZ2 2.96Å; D326-Y411 PolarHBondContact OD2-OH 3.18Å
327	K	93.2	Very high	81.5	Confident	137 Å²	137	78.5 Å²	78.5	60%	0.596	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147	145.7	179.1	63.8	-178.6	-179.3	177	0	112.2	F333 L334	K327-F333 WeakPolarHBondContact CA-O 3.42Å; K327-L334 HydrophobicContact CB-CD2 3.82Å
328	S	93.7	Very high	83.4	Confident	2 Å²	2	78 Å²	78	1%	0.014	39%	0.391	C	S	.	.			trans	-54.4	158.2	168.5	55	0	0	0	0	112.9	N330 G331 R332 F333	S328-N330 VanDerWaalsContact C-N 3.3Å; S328-N330 WeakPolarHBondContact CB-OD1 3.35Å; S328-N330 PolarHBondContact O-N 2.9Å; S328-N330 PolarHBondContact OG-OD1 2.71Å; S328-G331 WeakPolarHBondContact O-CA 3.26Å; S328-G331 PolarHBondContact O-N 3.4Å; S328-G331 PolarHBondContact OG-N 3.35Å; S328-R332 PolarHBondContact OG-N 3.14Å; S328-F333 PolarHBondContact N-O 2.63Å; S328-F333 PolarHBondContact OG-N 2.99Å; S328-F333 PolarHBondContact OG-O 2.72Å
329	K	90.4	Very high	85.5	Confident	155 Å²	155	76.9 Å²	76.9	67%	0.674	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-32.3	-174.5	-62.8	-179.1	-177.7	177.2	0	113.9	W400 E401	K329-W400 HydrophobicContact CD-CB 4.26Å; K329-W400 HydrophobicContact CD-CG 4.34Å; K329-W400 HydrophobicContact CG-CG 4.41Å; K329-E401 WeakPolarHBondContact CE-O 3.44Å; K329-E401 PolarHBondContact NZ-O 3.32Å
330	N	91.7	Very high	87.4	Confident	103 Å²	103	75.1 Å²	75.1	55%	0.551	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-5.5	173	55.8	9.9	0	0	0	113	S328 R332	S328-N330 VanDerWaalsContact C-N 3.3Å; S328-N330 WeakPolarHBondContact CB-OD1 3.35Å; S328-N330 PolarHBondContact O-N 2.9Å; S328-N330 PolarHBondContact OG-OD1 2.71Å; N330-R332 PolarHBondContact O-N 3.22Å; N330-R332 WeakPolarHBondContact OD1-CB 3.4Å; N330-R332 PolarHBondContact OD1-N 2.78Å; N330-R332 VanDerWaalsContact OD1-N 3.13Å
331	G	92.9	Very high	89	Confident	29 Å²	29	74.2 Å²	74.2	30%	0.299	37%	0.373	S	S	.	.	S	Bend	trans	78.1	-3.7	-176.5	0	0	0	0	0	115.2	S328	S328-G331 WeakPolarHBondContact O-CA 3.26Å; S328-G331 PolarHBondContact O-N 3.4Å; S328-G331 PolarHBondContact OG-N 3.35Å
332	R	96.7	Very high	90.5	Very high	60 Å²	60	76.9 Å²	76.9	23%	0.226	38%	0.378	C	S	.	.			trans	-60.6	-54.1	-176.3	177.5	178.9	176.2	159.9	-9.2	112.3	S328 N330 D353 T354 E355	S328-R332 PolarHBondContact OG-N 3.14Å; N330-R332 PolarHBondContact O-N 3.22Å; N330-R332 WeakPolarHBondContact OD1-CB 3.4Å; N330-R332 PolarHBondContact OD1-N 2.78Å; N330-R332 VanDerWaalsContact OD1-N 3.13Å; R332-D353 WeakPolarHBondContact CG-OD1 3.35Å; R332-D353 IonicContact CZ-OD1 3.71Å; R332-D353 IonicContact CZ-OD2 2.71Å; R332-D353 IonicContact NE-OD1 2.68Å; R332-D353 PolarHBondContact NE-OD1 3Å; R332-D353 IonicContact NE-OD2 2.76Å; R332-D353 PolarHBondContact NE-OD2 3.46Å; R332-D353 IonicContact NH2-OD1 3.02Å; R332-D353 IonicContact NH2-OD2 3.46Å; R332-D353 PolarHBondContact NH2-OD2 2.86Å; R332-T354 WeakPolarHBondContact O-CB 3.33Å; R332-T354 WeakPolarHBondContact O-CG2 3.02Å; R332-T354 PolarHBondContact O-N 2.73Å; R332-T354 PolarHBondContact O-OG1 3.05Å; R332-E355 VanDerWaalsContact CD-CD 3.41Å; R332-E355 VanDerWaalsContact CD-OE1 3.31Å; R332-E355 WeakPolarHBondContact CD-OE1 3.41Å; R332-E355 HydrophobicContact CG-CB 4.48Å; R332-E355 HydrophobicContact CG-CG 3.98Å; R332-E355 IonicContact CZ-OE2 2.69Å; R332-E355 IonicContact NE-OE1 2.66Å; R332-E355 IonicContact NE-OE2 3.11Å; R332-E355 PolarHBondContact NE-OE2 2.95Å; R332-E355 IonicContact NH1-OE2 3.71Å; R332-E355 PolarHBondContact NH1-OE2 3.43Å; R332-E355 IonicContact NH2-OE2 2.59Å
333	F	97.2	Very high	90.8	Very high	3 Å²	3	74 Å²	74	1%	0.013	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	135.5	178.9	-48.9	-71.5	0	0	0	111.5	K327 S328 L352 D353 V360 W362 Y397 D398 W400 V415	K327-F333 WeakPolarHBondContact CA-O 3.42Å; S328-F333 PolarHBondContact N-O 2.63Å; S328-F333 PolarHBondContact OG-N 2.99Å; S328-F333 PolarHBondContact OG-O 2.72Å; F333-L352 WeakPolarHBondContact CA-O 3.49Å; F333-D353 HydrophobicContact CD1-CB 3.84Å; F333-D353 HydrophobicContact CE1-CB 3.8Å; F333-V360 HydrophobicContact CD1-CG2 4.25Å; F333-W362 HydrophobicContact CB-CE3 4.4Å; F333-W362 HydrophobicContact CB-CZ3 4.24Å; F333-Y397 HydrophobicContact CE1-CG 4.48Å; F333-Y397 HydrophobicContact CZ-CG 4.48Å; F333-D398 HydrophobicContact CE2-CB 3.74Å; F333-D398 HydrophobicContact CZ-CB 4.42Å; F333-W400 HydrophobicContact CB-CH2 4.41Å; F333-W400 HydrophobicContact CD2-CH2 4.15Å; F333-W400 AromaticContact CD2-CZ3 3.98Å; F333-W400 HydrophobicContact CD2-CZ3 3.98Å; F333-V415 HydrophobicContact CB-CG2 4.36Å; F333-V415 HydrophobicContact CD1-CG1 3.72Å; F333-V415 HydrophobicContact CD2-CB 4.43Å; F333-V415 HydrophobicContact CD2-CG1 4.36Å; F333-V415 HydrophobicContact CD2-CG2 4Å; F333-V415 HydrophobicContact CE1-CG1 3.91Å; F333-V415 HydrophobicContact CG-CB 4.46Å; F333-V415 HydrophobicContact CG-CG1 3.95Å; F333-V415 HydrophobicContact CG-CG2 4.09Å; F333-V415 HydrophobicContact CZ-CG1 4.33Å
334	L	96.1	Very high	90.2	Very high	36 Å²	36	71.2 Å²	71.2	19%	0.188	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	148.7	172.2	-59	177.5	0	0	0	110.5	P324 K327 F336 G351 L352 T354	P324-L334 HydrophobicContact CB-CB 4.06Å; P324-L334 HydrophobicContact CB-CD1 4.32Å; P324-L334 HydrophobicContact CB-CD2 4.37Å; P324-L334 HydrophobicContact CB-CG 4.49Å; P324-L334 HydrophobicContact CG-CD1 4.35Å; K327-L334 HydrophobicContact CB-CD2 3.82Å; L334-F336 HydrophobicContact CB-CZ 4.43Å; L334-G351 CarbonylContact O-C 3.59Å; L334-G351 WeakPolarHBondContact O-CA 3.49Å; L334-L352 PolarHBondContact N-O 2.78Å; L334-L352 PolarHBondContact O-N 3.41Å; L334-T354 HydrophobicContact CD1-CG2 3.61Å; L334-T354 HydrophobicContact CG-CG2 3.74Å
335	K	96.1	Very high	89.2	Confident	18 Å²	18	72 Å²	72	8%	0.078	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	139.8	174.5	-173.2	-167.6	-177.3	179.7	0	110.8	P324 I325 D326 F349 W362 E364	P324-K335 CarbonylContact C-O 3.58Å; P324-K335 WeakPolarHBondContact CA-O 3.38Å; I325-K335 HydrophobicContact CD1-CD 3.8Å; I325-K335 HydrophobicContact CD1-CG 4.12Å; I325-K335 HydrophobicContact CG1-CB 4.27Å; I325-K335 HydrophobicContact CG1-CD 3.95Å; I325-K335 HydrophobicContact CG1-CG 3.99Å; I325-K335 WeakPolarHBondContact CG1-O 3.42Å; I325-K335 PolarHBondContact N-O 2.95Å; D326-K335 HydrophobicContact CB-CB 3.91Å; D326-K335 HydrophobicContact CB-CD 3.82Å; D326-K335 PolarHBondContact O-N 3.17Å; K335-F349 HydrophobicContact CG-CB 4.13Å; K335-F349 HydrophobicContact CG-CG 4.45Å; K335-W362 HydrophobicContact CB-CD2 3.75Å; K335-W362 HydrophobicContact CB-CE3 3.86Å; K335-W362 HydrophobicContact CB-CG 4.28Å; K335-W362 HydrophobicContact CB-CH2 4Å; K335-W362 HydrophobicContact CB-CZ2 3.94Å; K335-W362 HydrophobicContact CB-CZ3 3.99Å; K335-W362 HydrophobicContact CD-CD2 4.34Å; K335-W362 HydrophobicContact CD-CG 4.46Å; K335-W362 HydrophobicContact CD-CZ2 4.08Å; K335-W362 HydrophobicContact CG-CD2 3.96Å; K335-W362 HydrophobicContact CG-CG 4Å; K335-W362 HydrophobicContact CG-CZ2 4.38Å; K335-E364 WeakPolarHBondContact CE-OE1 3.47Å; K335-E364 IonicContact NZ-OE1 2.65Å; K335-E364 PolarHBondContact NZ-OE1 3.24Å; K335-E364 IonicContact NZ-OE2 3.17Å; K335-E364 PolarHBondContact NZ-OE2 2.82Å
336	F	94.2	Very high	88.7	Confident	15 Å²	15	69.8 Å²	69.8	7%	0.066	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	159.9	170.6	-54.4	-80.5	0	0	0	111.3	E322 P324 L334 E338 R350 L352	E322-F336 HydrophobicContact CG-CD1 3.62Å; E322-F336 HydrophobicContact CG-CE1 3.93Å; E322-F336 HydrophobicContact CG-CG 4.2Å; E322-F336 WeakPolarHBondContact O-CE1 3.4Å; P324-F336 HydrophobicContact CB-CD1 4.38Å; P324-F336 HydrophobicContact CB-CE1 4.07Å; L334-F336 HydrophobicContact CB-CZ 4.43Å; F336-E338 PolarHBondContact O-N 3.38Å; F336-R350 PolarHBondContact N-O 2.95Å; F336-L352 HydrophobicContact CE2-CB 3.69Å; F336-L352 HydrophobicContact CZ-CB 4.07Å
337	D	92.2	Very high	88.6	Confident	130 Å²	130	68.3 Å²	68.3	70%	0.695	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	36.5	179.2	-157.5	28.8	0	0	0	113.3	I325	I325-D337 HydrophobicContact CD1-CB 3.96Å; I325-D337 HydrophobicContact CG2-CB 4.15Å
338	E	92.8	Very high	88.5	Confident	86 Å²	86	62.6 Å²	62.6	40%	0.402	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	94.4	173.8	-170.7	-179.9	173.7	0	0	109.3	F336 L340 F349 R350	F336-E338 PolarHBondContact O-N 3.38Å; E338-L340 HydrophobicContact CG-CD2 4.29Å; E338-L340 PolarHBondContact O-N 3.11Å; E338-L340 VanDerWaalsContact O-N 3.16Å; E338-F349 CarbonylContact O-C 3.6Å; E338-F349 VanDerWaalsContact O-CA 3.29Å; E338-F349 WeakPolarHBondContact O-CA 3.49Å; E338-R350 HydrophobicContact CB-CB 4.04Å; E338-R350 PolarHBondContact O-N 2.74Å; E338-R350 WeakPolarHBondContact OE2-CD 3.29Å; E338-R350 IonicContact OE2-CZ 3.02Å; E338-R350 IonicContact OE2-NE 2.84Å; E338-R350 IonicContact OE2-NH1 3.69Å; E338-R350 PolarHBondContact OE2-NH1 3.23Å
339	E	93.6	Very high	88.6	Confident	93 Å²	93	63.6 Å²	63.6	44%	0.435	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	105.7	171.2	-174.1	-171.6	162.3	0	0	109.8	R342 T347 F349	E339-R342 VanDerWaalsContact OE1-CB 3.23Å; E339-R342 WeakPolarHBondContact OE1-CB 3.31Å; E339-R342 WeakPolarHBondContact OE1-CD 3.32Å; E339-T347 HydrophobicContact CG-CG2 3.98Å; E339-F349 HydrophobicContact CB-CE1 4.41Å
340	L	90.8	Very high	88.9	Confident	75 Å²	75	59.4 Å²	59.4	39%	0.393	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-28.1	178.3	-63.7	175.4	0	0	0	112.5	E338 V348 R350 L418	E338-L340 HydrophobicContact CG-CD2 4.29Å; E338-L340 PolarHBondContact O-N 3.11Å; E338-L340 VanDerWaalsContact O-N 3.16Å; L340-V348 HydrophobicContact CB-CG1 4.31Å; L340-V348 HydrophobicContact CD1-CG1 4.33Å; L340-V348 PolarHBondContact N-O 3.17Å; L340-R350 HydrophobicContact CD1-CB 4.02Å; L340-R350 HydrophobicContact CD2-CB 4.26Å; L340-R350 HydrophobicContact CG-CB 4.15Å; L340-L418 HydrophobicContact CD1-CD1 3.42Å; L340-L418 VanDerWaalsContact CD1-CD1 3.42Å
341	G	85.9	Confident	89.1	Confident	30 Å²	30	54.5 Å²	54.5	31%	0.309	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	173.9	161.6	177	0	0	0	0	0	113.4	V348	G341-V348 PolarHBondContact N-O 3.28Å; G341-V348 PolarHBondContact O-N 3Å
342	R	85.3	Confident	89.3	Confident	176 Å²	176	55.7 Å²	55.7	66%	0.664	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.5	138.2	-173.3	179.2	173	171.5	-176.6	-2.6	111.7	E339 T347	E339-R342 VanDerWaalsContact OE1-CB 3.23Å; E339-R342 WeakPolarHBondContact OE1-CB 3.31Å; E339-R342 WeakPolarHBondContact OE1-CD 3.32Å; R342-T347 HydrophobicContact CB-CG2 4.36Å; R342-T347 HydrophobicContact CG-CG2 4.45Å
343	G	72.3	Confident	89.3	Confident	41 Å²	41	52.8 Å²	52.8	42%	0.423	28%	0.275	S	S	.	.			trans	-119	-165.8	175	0	0	0	0	0	112.1	F345 K346	G343-F345 PolarHBondContact O-N 2.65Å; G343-K346 PolarHBondContact N-O 2.98Å
344	S	65.8	Low	89.2	Confident	101 Å²	101	56.1 Å²	56.1	71%	0.706	30%	0.295	S	S	*	.	S	Bend	trans	-69.2	-28.3	-179.3	45.7	0	0	0	0	114.5
345	F	69.8	Low	89.2	Confident	84 Å²	84	60.5 Å²	60.5	37%	0.368	32%	0.315	S	S	.	.	S	Bend	trans	-127.9	-13.6	-178.5	-54.8	-80.4	0	0	0	114.1	G343 L365 Q366 K369	G343-F345 PolarHBondContact O-N 2.65Å; F345-L365 WeakPolarHBondContact O-CA 3.46Å; F345-Q366 PolarHBondContact O-N 2.73Å; F345-K369 HydrophobicContact CD1-CD 4.33Å; F345-K369 HydrophobicContact CE1-CD 3.82Å
346	K	81.5	Confident	89.1	Confident	42 Å²	42	63.3 Å²	63.3	18%	0.183	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	144.7	-176.6	86.1	-178.7	-166.3	-178.5	0	112.8	G343 V348 E364 L365 D483 L486	G343-K346 PolarHBondContact N-O 2.98Å; K346-V348 HydrophobicContact CD-CG2 4.16Å; K346-V348 HydrophobicContact CG-CG2 4.3Å; K346-E364 CarbonylContact C-O 3.59Å; K346-E364 VanDerWaalsContact CA-O 3.31Å; K346-E364 WeakPolarHBondContact CA-O 3.38Å; K346-L365 HydrophobicContact CB-CD2 3.36Å; K346-D483 IonicContact NZ-OD1 2.71Å; K346-D483 PolarHBondContact NZ-OD1 3.11Å; K346-D483 IonicContact NZ-OD2 3.57Å; K346-D483 PolarHBondContact NZ-OD2 2.91Å; K346-L486 HydrophobicContact CD-CD1 3.93Å
347	T	88.4	Confident	89.1	Confident	18 Å²	18	65.3 Å²	65.3	11%	0.11	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	134.5	160.6	-51.7	0	0	0	0	108.4	E339 R342 F349 E364	E339-T347 HydrophobicContact CG-CG2 3.98Å; R342-T347 HydrophobicContact CB-CG2 4.36Å; R342-T347 HydrophobicContact CG-CG2 4.45Å; T347-F349 HydrophobicContact CG2-CD2 4.12Å; T347-F349 HydrophobicContact CG2-CE2 3.41Å; T347-F349 VanDerWaalsContact CG2-CE2 3.41Å; T347-F349 HydrophobicContact CG2-CZ 3.68Å; T347-E364 PolarHBondContact N-O 3.09Å; T347-E364 PolarHBondContact O-N 2.93Å
348	V	92.1	Very high	89.2	Confident	18 Å²	18	62.4 Å²	62.4	11%	0.109	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	124.3	-178.1	-172.7	0	0	0	0	108.9	L340 G341 K346 A361 W362	L340-V348 HydrophobicContact CB-CG1 4.31Å; L340-V348 HydrophobicContact CD1-CG1 4.33Å; L340-V348 PolarHBondContact N-O 3.17Å; G341-V348 PolarHBondContact N-O 3.28Å; G341-V348 PolarHBondContact O-N 3Å; K346-V348 HydrophobicContact CD-CG2 4.16Å; K346-V348 HydrophobicContact CG-CG2 4.3Å; V348-A361 HydrophobicContact CG1-CB 4.02Å; V348-W362 CarbonylContact C-O 3.19Å; V348-W362 WeakPolarHBondContact CA-O 3.25Å
349	F	95.3	Very high	89.4	Confident	23 Å²	23	60.2 Å²	60.2	10%	0.101	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	157.3	176.5	-64.7	-93.6	0	0	0	110.2	K335 E338 E339 T347 W362 E364	K335-F349 HydrophobicContact CG-CB 4.13Å; K335-F349 HydrophobicContact CG-CG 4.45Å; E338-F349 CarbonylContact O-C 3.6Å; E338-F349 VanDerWaalsContact O-CA 3.29Å; E338-F349 WeakPolarHBondContact O-CA 3.49Å; E339-F349 HydrophobicContact CB-CE1 4.41Å; T347-F349 HydrophobicContact CG2-CD2 4.12Å; T347-F349 HydrophobicContact CG2-CE2 3.41Å; T347-F349 VanDerWaalsContact CG2-CE2 3.41Å; T347-F349 HydrophobicContact CG2-CZ 3.68Å; F349-W362 HydrophobicContact CB-CB 4.35Å; F349-W362 PolarHBondContact N-O 2.87Å; F349-W362 PolarHBondContact O-N 3.4Å; F349-E364 HydrophobicContact CD2-CG 4.33Å; F349-E364 HydrophobicContact CE2-CG 4.37Å; F349-E364 WeakPolarHBondContact CE2-OE2 3.35Å
350	R	96.3	Very high	89.5	Confident	66 Å²	66	55.8 Å²	55.8	25%	0.249	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	139.4	165.8	-173.2	177.2	156.5	-141.7	-18.2	109.9	E322 F336 E338 L340 L418	E322-R350 IonicContact OE1-CZ 3.21Å; E322-R350 IonicContact OE1-NH1 2.69Å; E322-R350 PolarHBondContact OE1-NH1 3.02Å; E322-R350 IonicContact OE1-NH2 2.78Å; E322-R350 PolarHBondContact OE1-NH2 3.47Å; E322-R350 IonicContact OE2-CZ 2.75Å; E322-R350 IonicContact OE2-NH1 3.85Å; E322-R350 IonicContact OE2-NH2 3.6Å; E322-R350 PolarHBondContact OE2-NH2 2.89Å; F336-R350 PolarHBondContact N-O 2.95Å; E338-R350 HydrophobicContact CB-CB 4.04Å; E338-R350 PolarHBondContact O-N 2.74Å; E338-R350 WeakPolarHBondContact OE2-CD 3.29Å; E338-R350 IonicContact OE2-CZ 3.02Å; E338-R350 IonicContact OE2-NE 2.84Å; E338-R350 IonicContact OE2-NH1 3.69Å; E338-R350 PolarHBondContact OE2-NH1 3.23Å; L340-R350 HydrophobicContact CD1-CB 4.02Å; L340-R350 HydrophobicContact CD2-CB 4.26Å; L340-R350 HydrophobicContact CG-CB 4.15Å; R350-L418 HydrophobicContact CG-CD2 4.35Å
351	G	96.4	Very high	89.8	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	179.3	170.6	0	0	0	0	0	112.5	L334 A359 V360	L334-G351 CarbonylContact O-C 3.59Å; L334-G351 WeakPolarHBondContact O-CA 3.49Å; G351-A359 WeakPolarHBondContact O-CA 2.98Å; G351-V360 PolarHBondContact N-O 2.94Å; G351-V360 PolarHBondContact O-N 3.45Å
352	L	96.8	Very high	90.2	Very high	54 Å²	54	51.2 Å²	51.2	28%	0.283	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	132	175.7	176.9	70.5	0	0	0	109.4	F333 L334 F336 G357	F333-L352 WeakPolarHBondContact CA-O 3.49Å; L334-L352 PolarHBondContact N-O 2.78Å; L334-L352 PolarHBondContact O-N 3.41Å; F336-L352 HydrophobicContact CE2-CB 3.69Å; F336-L352 HydrophobicContact CZ-CB 4.07Å; L352-G357 WeakPolarHBondContact CD1-O 3.4Å
353	D	97.1	Very high	90.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	112	164.2	178.3	9.6	0	0	0	109.2	R332 F333 E355 T356 G357 V358 V360	R332-D353 WeakPolarHBondContact CG-OD1 3.35Å; R332-D353 IonicContact CZ-OD1 3.71Å; R332-D353 IonicContact CZ-OD2 2.71Å; R332-D353 IonicContact NE-OD1 2.68Å; R332-D353 PolarHBondContact NE-OD1 3Å; R332-D353 IonicContact NE-OD2 2.76Å; R332-D353 PolarHBondContact NE-OD2 3.46Å; R332-D353 IonicContact NH2-OD1 3.02Å; R332-D353 IonicContact NH2-OD2 3.46Å; R332-D353 PolarHBondContact NH2-OD2 2.86Å; F333-D353 HydrophobicContact CD1-CB 3.84Å; F333-D353 HydrophobicContact CE1-CB 3.8Å; D353-E355 VanDerWaalsContact C-N 3.31Å; D353-E355 PolarHBondContact O-N 2.87Å; D353-E355 PolarHBondContact OD1-N 3.2Å; D353-E355 VanDerWaalsContact OD1-N 3.17Å; D353-T356 WeakPolarHBondContact CB-OG1 3.36Å; D353-T356 PolarHBondContact O-N 3.11Å; D353-T356 VanDerWaalsContact OD2-CG2 3.27Å; D353-T356 WeakPolarHBondContact OD2-CG2 3.44Å; D353-T356 PolarHBondContact OD2-OG1 3.25Å; D353-G357 VanDerWaalsContact O-CA 3.32Å; D353-G357 WeakPolarHBondContact O-CA 3.36Å; D353-G357 PolarHBondContact O-N 2.73Å; D353-V358 PolarHBondContact N-O 3.47Å; D353-V360 HydrophobicContact CB-CG1 4.01Å
354	T	95.6	Very high	91.4	Very high	72 Å²	72	42.9 Å²	42.9	44%	0.442	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-17.1	-176	59.8	0	0	0	0	113.8	R332 L334	R332-T354 WeakPolarHBondContact O-CB 3.33Å; R332-T354 WeakPolarHBondContact O-CG2 3.02Å; R332-T354 PolarHBondContact O-N 2.73Å; R332-T354 PolarHBondContact O-OG1 3.05Å; L334-T354 HydrophobicContact CD1-CG2 3.61Å; L334-T354 HydrophobicContact CG-CG2 3.74Å
355	E	95.2	Very high	92.1	Very high	128 Å²	128	38.3 Å²	38.3	60%	0.598	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-35.6	174.4	-73.5	172.8	-160.3	0	0	111.9	R332 D353	R332-E355 VanDerWaalsContact CD-CD 3.41Å; R332-E355 VanDerWaalsContact CD-OE1 3.31Å; R332-E355 WeakPolarHBondContact CD-OE1 3.41Å; R332-E355 HydrophobicContact CG-CB 4.48Å; R332-E355 HydrophobicContact CG-CG 3.98Å; R332-E355 IonicContact CZ-OE2 2.69Å; R332-E355 IonicContact NE-OE1 2.66Å; R332-E355 IonicContact NE-OE2 3.11Å; R332-E355 PolarHBondContact NE-OE2 2.95Å; R332-E355 IonicContact NH1-OE2 3.71Å; R332-E355 PolarHBondContact NH1-OE2 3.43Å; R332-E355 IonicContact NH2-OE2 2.59Å; D353-E355 VanDerWaalsContact C-N 3.31Å; D353-E355 PolarHBondContact O-N 2.87Å; D353-E355 PolarHBondContact OD1-N 3.2Å; D353-E355 VanDerWaalsContact OD1-N 3.17Å
356	T	94.6	Very high	92.3	Very high	78 Å²	78	38.5 Å²	38.5	48%	0.479	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-16.4	-175.1	62	0	0	0	0	114	D353 V358	D353-T356 WeakPolarHBondContact CB-OG1 3.36Å; D353-T356 PolarHBondContact O-N 3.11Å; D353-T356 VanDerWaalsContact OD2-CG2 3.27Å; D353-T356 WeakPolarHBondContact OD2-CG2 3.44Å; D353-T356 PolarHBondContact OD2-OG1 3.25Å; T356-V358 PolarHBondContact O-N 2.75Å; T356-V358 WeakPolarHBondContact OG1-CB 3.47Å; T356-V358 PolarHBondContact OG1-N 2.74Å
357	G	93.4	Very high	91.6	Very high	56 Å²	56	37.5 Å²	37.5	58%	0.577	22%	0.216	S	C	*	.			trans	71.4	10.3	-171.2	0	0	0	0	0	113.9	L352 D353	L352-G357 WeakPolarHBondContact CD1-O 3.4Å; D353-G357 VanDerWaalsContact O-CA 3.32Å; D353-G357 WeakPolarHBondContact O-CA 3.36Å; D353-G357 PolarHBondContact O-N 2.73Å
358	V	94.8	Very high	90.2	Very high	70 Å²	70	40.6 Å²	40.6	42%	0.424	24%	0.239	S	C	.	.			trans	-92	134.5	-175.3	179.6	0	0	0	0	110.7	D353 T356	D353-V358 PolarHBondContact N-O 3.47Å; T356-V358 PolarHBondContact O-N 2.75Å; T356-V358 WeakPolarHBondContact OG1-CB 3.47Å; T356-V358 PolarHBondContact OG1-N 2.74Å
359	A	96.1	Very high	88.7	Confident	39 Å²	39	46.9 Å²	46.9	32%	0.322	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	135	174	0	0	0	0	0	111.2	G351 L418	G351-A359 WeakPolarHBondContact O-CA 2.98Å; A359-L418 HydrophobicContact CB-CD2 3.67Å; A359-L418 VanDerWaalsContact O-CB 3.29Å; A359-L418 WeakPolarHBondContact O-CB 3.47Å
360	V	96.6	Very high	87.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	160.7	-176.2	-65.3	0	0	0	0	111.2	F333 G351 D353 Y397 V415 T416	F333-V360 HydrophobicContact CD1-CG2 4.25Å; G351-V360 PolarHBondContact N-O 2.94Å; G351-V360 PolarHBondContact O-N 3.45Å; D353-V360 HydrophobicContact CB-CG1 4.01Å; V360-Y397 HydrophobicContact CG1-CD2 4.02Å; V360-Y397 HydrophobicContact CG1-CE2 3.76Å; V360-V415 HydrophobicContact CB-CG1 3.75Å; V360-V415 HydrophobicContact CG1-CG1 4.17Å; V360-V415 HydrophobicContact CG2-CG1 3.68Å; V360-T416 WeakPolarHBondContact CB-O 3.36Å
361	A	96	Very high	85.8	Confident	9 Å²	9	49.1 Å²	49.1	7%	0.074	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	117	169.7	0	0	0	0	0	109.3	V348 V415 T416 L418	V348-A361 HydrophobicContact CG1-CB 4.02Å; A361-V415 WeakPolarHBondContact O-CA 3.49Å; A361-T416 PolarHBondContact N-O 3.09Å; A361-T416 PolarHBondContact O-N 2.98Å; A361-L418 HydrophobicContact CB-CD1 4.15Å
362	W	95.1	Very high	84.8	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	109.7	177.1	176.7	-67.9	0	0	0	108.5	D326 F333 K335 V348 F349 E364 W400 V413	D326-W362 HydrophobicContact CB-CH2 4.22Å; D326-W362 HydrophobicContact CB-CZ2 4.07Å; D326-W362 WeakPolarHBondContact OD2-CZ2 2.96Å; F333-W362 HydrophobicContact CB-CE3 4.4Å; F333-W362 HydrophobicContact CB-CZ3 4.24Å; K335-W362 HydrophobicContact CB-CD2 3.75Å; K335-W362 HydrophobicContact CB-CE3 3.86Å; K335-W362 HydrophobicContact CB-CG 4.28Å; K335-W362 HydrophobicContact CB-CH2 4Å; K335-W362 HydrophobicContact CB-CZ2 3.94Å; K335-W362 HydrophobicContact CB-CZ3 3.99Å; K335-W362 HydrophobicContact CD-CD2 4.34Å; K335-W362 HydrophobicContact CD-CG 4.46Å; K335-W362 HydrophobicContact CD-CZ2 4.08Å; K335-W362 HydrophobicContact CG-CD2 3.96Å; K335-W362 HydrophobicContact CG-CG 4Å; K335-W362 HydrophobicContact CG-CZ2 4.38Å; V348-W362 CarbonylContact C-O 3.19Å; V348-W362 WeakPolarHBondContact CA-O 3.25Å; F349-W362 HydrophobicContact CB-CB 4.35Å; F349-W362 PolarHBondContact N-O 2.87Å; F349-W362 PolarHBondContact O-N 3.4Å; W362-E364 PolarHBondContact NE1-OE1 3.48Å; W362-W400 HydrophobicContact CE3-CH2 4.33Å; W362-W400 HydrophobicContact CE3-CZ2 4.35Å; W362-W400 HydrophobicContact CH2-CH2 4.27Å; W362-W400 AromaticContact CH2-CZ2 3.58Å; W362-W400 HydrophobicContact CH2-CZ2 3.58Å; W362-W400 HydrophobicContact CZ2-CZ2 4Å; W362-W400 AromaticContact CZ3-CH2 3.96Å; W362-W400 HydrophobicContact CZ3-CH2 3.96Å; W362-W400 AromaticContact CZ3-CZ2 3.75Å; W362-W400 HydrophobicContact CZ3-CZ2 3.75Å; W362-V413 HydrophobicContact CD2-CG1 3.78Å; W362-V413 HydrophobicContact CE3-CG1 4.38Å; W362-V413 HydrophobicContact CG-CG1 4.11Å; W362-V413 HydrophobicContact CZ2-CG1 4.03Å; W362-V413 HydrophobicContact CZ2-CG2 4.1Å
363	C	92.4	Very high	83.5	Confident	15 Å²	15	59 Å²	59	10%	0.101	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	121.9	-173.6	-60.7	0	0	0	0	111	V413 L414	C363-V413 CarbonylContact O-C 3.58Å; C363-V413 VanDerWaalsContact O-CA 3.31Å; C363-V413 WeakPolarHBondContact O-CA 3.27Å; C363-L414 HydrophobicContact CB-CB 4.32Å; C363-L414 PolarHBondContact N-O 3.43Å; C363-L414 PolarHBondContact O-N 3.39Å
364	E	89.5	Confident	82	Confident	28 Å²	28	60.9 Å²	60.9	13%	0.131	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	122.9	-179.5	-57.7	-172.9	148.4	0	0	110.9	K335 K346 T347 F349 W362 Y411 I412	K335-E364 WeakPolarHBondContact CE-OE1 3.47Å; K335-E364 IonicContact NZ-OE1 2.65Å; K335-E364 PolarHBondContact NZ-OE1 3.24Å; K335-E364 IonicContact NZ-OE2 3.17Å; K335-E364 PolarHBondContact NZ-OE2 2.82Å; K346-E364 CarbonylContact C-O 3.59Å; K346-E364 VanDerWaalsContact CA-O 3.31Å; K346-E364 WeakPolarHBondContact CA-O 3.38Å; T347-E364 PolarHBondContact N-O 3.09Å; T347-E364 PolarHBondContact O-N 2.93Å; F349-E364 HydrophobicContact CD2-CG 4.33Å; F349-E364 HydrophobicContact CE2-CG 4.37Å; F349-E364 WeakPolarHBondContact CE2-OE2 3.35Å; W362-E364 PolarHBondContact NE1-OE1 3.48Å; E364-Y411 HydrophobicContact CB-CD2 4.29Å; E364-Y411 HydrophobicContact CG-CD2 4.31Å; E364-Y411 HydrophobicContact CG-CE2 4.34Å; E364-I412 CarbonylContact C-O 3.48Å; E364-I412 WeakPolarHBondContact CA-O 3.45Å
365	L	80.7	Confident	80.9	Confident	5 Å²	5	59.4 Å²	59.4	3%	0.026	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	129.1	178.7	-53.9	-174.4	0	0	0	111.3	F345 K346 E367 F378 Y411 I412 L414 L486 L489	F345-L365 WeakPolarHBondContact O-CA 3.46Å; K346-L365 HydrophobicContact CB-CD2 3.36Å; L365-E367 PolarHBondContact O-N 3.16Å; L365-F378 HydrophobicContact CD1-CE2 4.09Å; L365-F378 HydrophobicContact CD1-CZ 4.27Å; L365-Y411 CarbonylContact O-C 2.79Å; L365-Y411 VanDerWaalsContact O-CA 3.24Å; L365-Y411 WeakPolarHBondContact O-CA 3.4Å; L365-Y411 VanDerWaalsContact O-CB 3.24Å; L365-Y411 WeakPolarHBondContact O-CB 3.43Å; L365-I412 HydrophobicContact CB-CB 4.33Å; L365-I412 PolarHBondContact N-O 3.22Å; L365-I412 PolarHBondContact O-N 3.08Å; L365-L414 HydrophobicContact CD1-CD1 3.47Å; L365-L414 VanDerWaalsContact CD1-CD1 3.47Å; L365-L414 HydrophobicContact CD2-CD1 4.46Å; L365-L414 HydrophobicContact CG-CD1 3.56Å; L365-L486 HydrophobicContact CD1-CD2 3.6Å; L365-L486 HydrophobicContact CD2-CD2 3.8Å; L365-L486 HydrophobicContact CG-CD2 4.37Å; L365-L489 HydrophobicContact CD1-CD1 3.53Å
366	Q	73.8	Confident	80	Confident	88 Å²	88	57.4 Å²	57.4	41%	0.411	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	112.5	-178.7	-62.5	-173.9	7.2	0	0	111.3	F345 S368	F345-Q366 PolarHBondContact O-N 2.73Å; Q366-S368 VanDerWaalsContact C-N 3.25Å; Q366-S368 PolarHBondContact O-N 3.46Å
367	E	67	Low	78.8	Confident	20 Å²	20	61 Å²	61	9%	0.093	32%	0.321	C	S	.	.			trans	-71.8	-15.9	-173.6	-160.8	-164	93.9	0	0	113.8	L365 K369 L370 R375 K410	L365-E367 PolarHBondContact O-N 3.16Å; E367-K369 PolarHBondContact O-N 2.74Å; E367-L370 PolarHBondContact O-N 2.65Å; E367-R375 VanDerWaalsContact CD-CZ 3.4Å; E367-R375 IonicContact OE1-CZ 3.6Å; E367-R375 IonicContact OE1-NH1 3.58Å; E367-R375 PolarHBondContact OE1-NH1 3.01Å; E367-R375 IonicContact OE1-NH2 2.62Å; E367-R375 PolarHBondContact OE1-NH2 3.29Å; E367-R375 IonicContact OE2-CZ 3.49Å; E367-R375 IonicContact OE2-NH1 2.69Å; E367-R375 PolarHBondContact OE2-NH1 3.06Å; E367-R375 IonicContact OE2-NH2 3.94Å; E367-K410 HydrophobicContact CB-CB 4.19Å; E367-K410 WeakPolarHBondContact CB-O 3.48Å; E367-K410 HydrophobicContact CG-CB 4.41Å; E367-K410 PolarHBondContact N-O 2.71Å; E367-K410 WeakPolarHBondContact OE1-CB 3.36Å; E367-K410 WeakPolarHBondContact OE1-CD 3.4Å; E367-K410 WeakPolarHBondContact OE2-CB 3.5Å
368	S	59.9	Low	77.9	Confident	84 Å²	84	58.4 Å²	58.4	59%	0.587	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	18.3	-169	66.7	0	0	0	0	116	Q366	Q366-S368 VanDerWaalsContact C-N 3.25Å; Q366-S368 PolarHBondContact O-N 3.46Å
369	K	60.6	Low	77.1	Confident	149 Å²	149	60.1 Å²	60.1	65%	0.648	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.7	8.3	173.9	-65.9	-178.6	176.9	179.7	0	112.9	F345 E367	F345-K369 HydrophobicContact CD1-CD 4.33Å; F345-K369 HydrophobicContact CE1-CD 3.82Å; E367-K369 PolarHBondContact O-N 2.74Å
370	L	63	Low	76.3	Confident	35 Å²	35	63.2 Å²	63.2	18%	0.183	30%	0.3	C	S	.	.			trans	-114.4	124.2	-174	-62.3	176.4	0	0	0	112.7	E367 E374 I412 L489	E367-L370 PolarHBondContact O-N 2.65Å; L370-E374 HydrophobicContact CD2-CB 4.36Å; L370-I412 HydrophobicContact CD1-CD1 4.37Å; L370-L489 HydrophobicContact CD1-CD2 3.8Å; L370-L489 HydrophobicContact CD2-CD2 3.74Å; L370-L489 HydrophobicContact CG-CD2 4.45Å
371	N	67.1	Low	75.3	Confident	101 Å²	101	64.9 Å²	64.9	54%	0.54	31%	0.308	S	S	.	.			trans	-77.5	164.8	176.6	-163.2	-2.6	0	0	0	111.7	T373 E374 R375	N371-T373 VanDerWaalsContact C-N 3.3Å; N371-T373 PolarHBondContact O-N 3.06Å; N371-E374 VanDerWaalsContact CB-OE2 3.28Å; N371-E374 WeakPolarHBondContact CB-OE2 3.48Å; N371-E374 PolarHBondContact N-OE2 2.82Å; N371-E374 PolarHBondContact O-N 2.88Å; N371-R375 PolarHBondContact O-N 3.19Å
372	K	74.9	Confident	74.6	Confident	175 Å²	175	64.5 Å²	64.5	76%	0.761	31%	0.305	S	S	*	.	H	α-helix	trans	-53.3	-44.1	-179	-170.7	179.6	178.8	-175.4	0	112.3	Q376	K372-Q376 PolarHBondContact O-N 2.9Å; K372-Q376 VanDerWaalsContact O-N 3.09Å
373	T	70.6	Confident	74	Confident	87 Å²	87	69 Å²	69	53%	0.534	33%	0.326	S	S	.	.	H	α-helix	trans	-68.3	-35	178.4	-41.7	0	0	0	0	113.2	N371 Q376 R377	N371-T373 VanDerWaalsContact C-N 3.3Å; N371-T373 PolarHBondContact O-N 3.06Å; T373-Q376 PolarHBondContact O-N 2.61Å; T373-R377 PolarHBondContact O-N 2.73Å
374	E	66.1	Low	73.4	Confident	39 Å²	39	71.7 Å²	71.7	18%	0.182	34%	0.338	C	S	.	.	H	α-helix	trans	-72.9	-40.2	178.9	-74.2	140.5	-157	0	0	111.3	L370 N371 Q376 R377 F378 K492	L370-E374 HydrophobicContact CD2-CB 4.36Å; N371-E374 VanDerWaalsContact CB-OE2 3.28Å; N371-E374 WeakPolarHBondContact CB-OE2 3.48Å; N371-E374 PolarHBondContact N-OE2 2.82Å; N371-E374 PolarHBondContact O-N 2.88Å; E374-Q376 VanDerWaalsContact C-N 3.3Å; E374-Q376 PolarHBondContact O-N 2.87Å; E374-R377 PolarHBondContact O-N 2.79Å; E374-F378 VanDerWaalsContact O-CB 3.29Å; E374-F378 WeakPolarHBondContact O-CB 3.44Å; E374-F378 PolarHBondContact O-N 3.34Å; E374-K492 HydrophobicContact CG-CD 4.18Å; E374-K492 WeakPolarHBondContact OE1-CD 3.44Å; E374-K492 IonicContact OE1-NZ 3.71Å; E374-K492 PolarHBondContact OE1-NZ 3.48Å
375	R	72.7	Confident	73.1	Confident	41 Å²	41	70.8 Å²	70.8	16%	0.155	33%	0.334	C	S	.	.	H	α-helix	trans	-58.9	-41.1	170.2	-176	-157.7	-53.3	-102	-14.8	111.9	E367 N371 F378 R379 E401	E367-R375 VanDerWaalsContact CD-CZ 3.4Å; E367-R375 IonicContact OE1-CZ 3.6Å; E367-R375 IonicContact OE1-NH1 3.58Å; E367-R375 PolarHBondContact OE1-NH1 3.01Å; E367-R375 IonicContact OE1-NH2 2.62Å; E367-R375 PolarHBondContact OE1-NH2 3.29Å; E367-R375 IonicContact OE2-CZ 3.49Å; E367-R375 IonicContact OE2-NH1 2.69Å; E367-R375 PolarHBondContact OE2-NH1 3.06Å; E367-R375 IonicContact OE2-NH2 3.94Å; N371-R375 PolarHBondContact O-N 3.19Å; R375-F378 PolarHBondContact O-N 3Å; R375-R379 WeakPolarHBondContact O-CB 3.16Å; R375-R379 PolarHBondContact O-N 3.42Å; R375-E401 WeakPolarHBondContact CD-OE1 3.27Å; R375-E401 WeakPolarHBondContact CD-OE2 3.4Å; R375-E401 IonicContact CZ-OE2 3.98Å; R375-E401 IonicContact NH1-OE2 2.66Å; R375-E401 PolarHBondContact NH1-OE2 3Å
376	Q	75.3	Confident	73.4	Confident	87 Å²	87	72.7 Å²	72.7	41%	0.407	34%	0.342	S	S	.	.	H	α-helix	trans	-66.4	-48	178.1	-177.2	57.2	33.2	0	0	111.7	K372 T373 E374 F378 R379 E380	K372-Q376 PolarHBondContact O-N 2.9Å; K372-Q376 VanDerWaalsContact O-N 3.09Å; T373-Q376 PolarHBondContact O-N 2.61Å; E374-Q376 VanDerWaalsContact C-N 3.3Å; E374-Q376 PolarHBondContact O-N 2.87Å; Q376-F378 VanDerWaalsContact C-N 3.33Å; Q376-F378 PolarHBondContact O-N 3.08Å; Q376-R379 VanDerWaalsContact O-CB 3.28Å; Q376-R379 WeakPolarHBondContact O-CB 3.45Å; Q376-R379 PolarHBondContact O-N 3.26Å; Q376-R379 VanDerWaalsContact O-N 3.08Å; Q376-E380 WeakPolarHBondContact CG-OE1 3.28Å; Q376-E380 PolarHBondContact NE2-OE1 2.89Å; Q376-E380 WeakPolarHBondContact O-CG 3.5Å; Q376-E380 PolarHBondContact O-N 2.81Å
377	R	69.3	Low	73.9	Confident	152 Å²	152	74.7 Å²	74.7	57%	0.574	36%	0.355	S	S	*	.	H	α-helix	trans	-61.3	-39.1	173.8	-72.8	-176.6	176.1	-165.1	-2.3	113.1	T373 E374 R379 E380 E381 T488	T373-R377 PolarHBondContact O-N 2.73Å; E374-R377 PolarHBondContact O-N 2.79Å; R377-R379 VanDerWaalsContact C-N 3.31Å; R377-E380 PolarHBondContact O-N 3.48Å; R377-E381 PolarHBondContact O-N 3.42Å; R377-T488 HydrophobicContact CB-CG2 4.07Å
378	F	74.7	Confident	74.9	Confident	3 Å²	3	74.1 Å²	74.1	1%	0.013	35%	0.353	C	S	.	.	H	α-helix	trans	-63.1	-39.1	173.8	175.1	-84.3	0	0	0	111.4	L365 E374 R375 Q376 E380 E381 A382 Y399 I412 L414 G485 L489	L365-F378 HydrophobicContact CD1-CE2 4.09Å; L365-F378 HydrophobicContact CD1-CZ 4.27Å; E374-F378 VanDerWaalsContact O-CB 3.29Å; E374-F378 WeakPolarHBondContact O-CB 3.44Å; E374-F378 PolarHBondContact O-N 3.34Å; R375-F378 PolarHBondContact O-N 3Å; Q376-F378 VanDerWaalsContact C-N 3.33Å; Q376-F378 PolarHBondContact O-N 3.08Å; F378-E380 VanDerWaalsContact C-N 3.34Å; F378-E381 PolarHBondContact O-N 3.48Å; F378-A382 HydrophobicContact CD1-CB 4.27Å; F378-A382 HydrophobicContact CE1-CB 3.71Å; F378-A382 HydrophobicContact CZ-CB 3.99Å; F378-A382 WeakPolarHBondContact O-CB 3.4Å; F378-A382 PolarHBondContact O-N 3.25Å; F378-Y399 HydrophobicContact CE1-CD2 4.38Å; F378-I412 HydrophobicContact CD1-CD1 3.67Å; F378-I412 HydrophobicContact CD1-CG2 4.44Å; F378-I412 HydrophobicContact CE1-CD1 3.83Å; F378-I412 HydrophobicContact CE1-CG2 3.6Å; F378-I412 HydrophobicContact CG-CD1 4.29Å; F378-I412 HydrophobicContact CZ-CD1 4.47Å; F378-I412 HydrophobicContact CZ-CG2 4.06Å; F378-L414 HydrophobicContact CE2-CD2 4.31Å; F378-L414 HydrophobicContact CZ-CD1 4.18Å; F378-L414 HydrophobicContact CZ-CD2 3.81Å; F378-L414 HydrophobicContact CZ-CG 4.13Å; F378-G485 WeakPolarHBondContact CE2-O 3.42Å; F378-L489 HydrophobicContact CB-CD2 4.04Å; F378-L489 HydrophobicContact CD2-CD1 3.78Å; F378-L489 HydrophobicContact CD2-CD2 3.61Å; F378-L489 HydrophobicContact CD2-CG 3.73Å; F378-L489 HydrophobicContact CE2-CD1 3.86Å; F378-L489 HydrophobicContact CE2-CG 4.27Å; F378-L489 HydrophobicContact CG-CD2 4.08Å
379	R	78.3	Confident	76.5	Confident	105 Å²	105	75.7 Å²	75.7	40%	0.396	35%	0.351	S	S	.	.	H	α-helix	trans	-61.8	-43	176.3	-168.9	-176.4	-75.2	-158.8	-2.1	111.4	R375 Q376 R377 A382 E383 Y399 E401	R375-R379 WeakPolarHBondContact O-CB 3.16Å; R375-R379 PolarHBondContact O-N 3.42Å; Q376-R379 VanDerWaalsContact O-CB 3.28Å; Q376-R379 WeakPolarHBondContact O-CB 3.45Å; Q376-R379 PolarHBondContact O-N 3.26Å; Q376-R379 VanDerWaalsContact O-N 3.08Å; R377-R379 VanDerWaalsContact C-N 3.31Å; R379-A382 PolarHBondContact O-N 2.89Å; R379-E383 PolarHBondContact O-N 3.42Å; R379-Y399 HydrophobicContact CG-CE2 4.29Å; R379-Y399 WeakPolarHBondContact CG-OH 3.39Å; R379-E401 IonicContact CZ-OE1 3.75Å; R379-E401 IonicContact NE-OE1 2.64Å; R379-E401 IonicContact NH2-OE1 2.77Å; R379-E401 PolarHBondContact NH2-OE1 3.12Å
380	E	78.1	Confident	78.1	Confident	105 Å²	105	70.6 Å²	70.6	49%	0.491	33%	0.329	S	S	.	.	H	α-helix	trans	-65.3	-47.1	176.7	-69.6	152.6	-171.7	0	0	112	Q376 R377 F378 M384	Q376-E380 WeakPolarHBondContact CG-OE1 3.28Å; Q376-E380 PolarHBondContact NE2-OE1 2.89Å; Q376-E380 WeakPolarHBondContact O-CG 3.5Å; Q376-E380 PolarHBondContact O-N 2.81Å; R377-E380 PolarHBondContact O-N 3.48Å; F378-E380 VanDerWaalsContact C-N 3.34Å; E380-M384 PolarHBondContact O-N 2.91Å
381	E	76.7	Confident	79.6	Confident	35 Å²	35	73.1 Å²	73.1	16%	0.164	35%	0.348	C	S	.	.	H	α-helix	trans	-62.8	-42.5	172.3	-77.7	-167.1	170.8	0	0	111.4	R377 F378 E383 M384 L385 R463 T488	R377-E381 PolarHBondContact O-N 3.42Å; F378-E381 PolarHBondContact O-N 3.48Å; E381-E383 PolarHBondContact O-N 3.1Å; E381-M384 WeakPolarHBondContact O-CB 3.45Å; E381-M384 PolarHBondContact O-N 3.35Å; E381-L385 VanDerWaalsContact O-CG 3.23Å; E381-L385 WeakPolarHBondContact O-CG 3.27Å; E381-L385 PolarHBondContact O-N 2.98Å; E381-R463 IonicContact OE1-CZ 3.59Å; E381-R463 IonicContact OE1-NH1 3.5Å; E381-R463 IonicContact OE1-NH2 3.31Å; E381-R463 PolarHBondContact OE1-NH2 2.85Å; E381-T488 HydrophobicContact CG-CG2 4.01Å; E381-T488 WeakPolarHBondContact OE1-CG2 3.41Å; E381-T488 VanDerWaalsContact OE2-CB 3.23Å; E381-T488 WeakPolarHBondContact OE2-CB 3.16Å; E381-T488 VanDerWaalsContact OE2-CG2 3.27Å; E381-T488 WeakPolarHBondContact OE2-CG2 3.31Å; E381-T488 PolarHBondContact OE2-N 3Å; E381-T488 VanDerWaalsContact OE2-N 3.16Å; E381-T488 PolarHBondContact OE2-OG1 3.06Å
382	A	81.1	Confident	81	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.008	33%	0.326	C	S	.	.	H	α-helix	trans	-71.1	-27.3	-175.3	0	0	0	0	0	114.3	F378 R379 F396 Y399	F378-A382 HydrophobicContact CD1-CB 4.27Å; F378-A382 HydrophobicContact CE1-CB 3.71Å; F378-A382 HydrophobicContact CZ-CB 3.99Å; F378-A382 WeakPolarHBondContact O-CB 3.4Å; F378-A382 PolarHBondContact O-N 3.25Å; R379-A382 PolarHBondContact O-N 2.89Å; A382-F396 WeakPolarHBondContact O-CE1 3.36Å; A382-Y399 HydrophobicContact CB-CD1 3.42Å; A382-Y399 VanDerWaalsContact CB-CD1 3.42Å; A382-Y399 HydrophobicContact CB-CD2 4.11Å; A382-Y399 HydrophobicContact CB-CE1 3.7Å; A382-Y399 HydrophobicContact CB-CE2 4.39Å; A382-Y399 HydrophobicContact CB-CG 3.69Å; A382-Y399 WeakPolarHBondContact O-CD1 3.07Å
383	E	82.9	Confident	82	Confident	94 Å²	94	60.6 Å²	60.6	44%	0.439	29%	0.29	S	S	.	.	H	α-helix	trans	-71.8	-47	169.3	-161.2	66.9	-161.3	0	0	110.4	R379 E381 L385 K386 Y399	R379-E383 PolarHBondContact O-N 3.42Å; E381-E383 PolarHBondContact O-N 3.1Å; E383-L385 PolarHBondContact O-N 3.33Å; E383-L385 VanDerWaalsContact O-N 3.14Å; E383-K386 VanDerWaalsContact CD-NZ 3.31Å; E383-K386 WeakPolarHBondContact O-CB 3.29Å; E383-K386 PolarHBondContact O-N 3.43Å; E383-K386 IonicContact OE1-NZ 2.69Å; E383-K386 PolarHBondContact OE1-NZ 2.89Å; E383-K386 WeakPolarHBondContact OE2-CE 3.22Å; E383-K386 IonicContact OE2-NZ 2.63Å; E383-K386 PolarHBondContact OE2-NZ 2.71Å; E383-Y399 HydrophobicContact CB-CE1 4.37Å; E383-Y399 VanDerWaalsContact OE2-CE1 3.25Å; E383-Y399 WeakPolarHBondContact OE2-CE1 3.22Å
384	M	79.1	Confident	83.2	Confident	71 Å²	71	57.3 Å²	57.3	35%	0.35	27%	0.269	S	S	.	.	H	α-helix	trans	-54.8	-33	176	-172.3	-161.5	-56.3	0	0	113	E380 E381 K386 P458 V460	E380-M384 PolarHBondContact O-N 2.91Å; E381-M384 WeakPolarHBondContact O-CB 3.45Å; E381-M384 PolarHBondContact O-N 3.35Å; M384-K386 VanDerWaalsContact C-N 3.33Å; M384-K386 PolarHBondContact O-N 3.35Å; M384-P458 HydrophobicContact CE-CG 3.89Å; M384-P458 HydrophobicContact SD-CG 4.44Å; M384-V460 HydrophobicContact SD-CG2 3.84Å
385	L	83.6	Confident	84.5	Confident	10 Å²	10	59.4 Å²	59.4	5%	0.052	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-69.7	-23.5	179	-70.6	171.6	0	0	0	114.1	E381 E383 D387 L388 F396 L484	E381-L385 VanDerWaalsContact O-CG 3.23Å; E381-L385 WeakPolarHBondContact O-CG 3.27Å; E381-L385 PolarHBondContact O-N 2.98Å; E383-L385 PolarHBondContact O-N 3.33Å; E383-L385 VanDerWaalsContact O-N 3.14Å; L385-D387 VanDerWaalsContact C-N 3.27Å; L385-D387 PolarHBondContact O-N 3.14Å; L385-L388 HydrophobicContact CD2-CD1 3.49Å; L385-L388 VanDerWaalsContact CD2-CD1 3.49Å; L385-L388 HydrophobicContact CD2-CG 4.39Å; L385-L388 WeakPolarHBondContact O-CB 3.04Å; L385-L388 PolarHBondContact O-N 3.5Å; L385-F396 HydrophobicContact CB-CB 4.38Å; L385-F396 HydrophobicContact CB-CD1 3.98Å; L385-F396 HydrophobicContact CB-CD2 4.23Å; L385-F396 HydrophobicContact CB-CE1 4.25Å; L385-F396 HydrophobicContact CB-CE2 4.5Å; L385-F396 HydrophobicContact CB-CG 3.96Å; L385-F396 HydrophobicContact CD1-CE2 4.44Å; L385-F396 WeakPolarHBondContact O-CB 3.43Å; L385-L484 HydrophobicContact CD1-CB 4.45Å; L385-L484 HydrophobicContact CD2-CB 3.84Å; L385-L484 HydrophobicContact CD2-CD1 4.34Å
386	K	87.3	Confident	85.4	Confident	44 Å²	44	58 Å²	58	19%	0.191	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-62.9	-34.1	179.3	-67.3	172.9	173.9	176.3	0	112.7	E383 M384 L388 F396 D398	E383-K386 VanDerWaalsContact CD-NZ 3.31Å; E383-K386 WeakPolarHBondContact O-CB 3.29Å; E383-K386 PolarHBondContact O-N 3.43Å; E383-K386 IonicContact OE1-NZ 2.69Å; E383-K386 PolarHBondContact OE1-NZ 2.89Å; E383-K386 WeakPolarHBondContact OE2-CE 3.22Å; E383-K386 IonicContact OE2-NZ 2.63Å; E383-K386 PolarHBondContact OE2-NZ 2.71Å; M384-K386 VanDerWaalsContact C-N 3.33Å; M384-K386 PolarHBondContact O-N 3.35Å; K386-L388 VanDerWaalsContact C-N 3.3Å; K386-L388 PolarHBondContact O-N 3.38Å; K386-F396 HydrophobicContact CG-CD1 3.83Å; K386-F396 HydrophobicContact CG-CE1 4.09Å; K386-D398 WeakPolarHBondContact CE-OD1 3.14Å; K386-D398 IonicContact NZ-OD1 2.76Å; K386-D398 PolarHBondContact NZ-OD1 3.23Å; K386-D398 VanDerWaalsContact NZ-OD1 3.1Å
387	D	84.4	Confident	86.2	Confident	130 Å²	130	56.5 Å²	56.5	70%	0.695	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-82.1	-6	-178.8	-67.5	-33.5	0	0	0	113.5	L385 Q389	L385-D387 VanDerWaalsContact C-N 3.27Å; L385-D387 PolarHBondContact O-N 3.14Å; D387-Q389 PolarHBondContact O-N 3.47Å
388	L	87.8	Confident	87.3	Confident	9 Å²	9	50.7 Å²	50.7	5%	0.047	24%	0.242	C	C	.	.			trans	-76.7	95.2	-179.7	-61.9	-167.4	0	0	0	112.3	L385 K386 F452 L453 R456 L484	L385-L388 HydrophobicContact CD2-CD1 3.49Å; L385-L388 VanDerWaalsContact CD2-CD1 3.49Å; L385-L388 HydrophobicContact CD2-CG 4.39Å; L385-L388 WeakPolarHBondContact O-CB 3.04Å; L385-L388 PolarHBondContact O-N 3.5Å; K386-L388 VanDerWaalsContact C-N 3.3Å; K386-L388 PolarHBondContact O-N 3.38Å; L388-F452 HydrophobicContact CB-CE1 4.14Å; L388-F452 HydrophobicContact CD2-CE1 3.97Å; L388-F452 HydrophobicContact CD2-CZ 4.29Å; L388-L453 HydrophobicContact CD1-CD2 3.7Å; L388-R456 HydrophobicContact CD2-CG 3.77Å; L388-L484 HydrophobicContact CD1-CD1 4.15Å
389	Q	92.2	Very high	88	Confident	117 Å²	117	52.2 Å²	52.2	55%	0.547	25%	0.248	S	C	.	.			trans	-117	103.9	179.5	-53.4	-168.8	42.4	0	0	111.1	D387	D387-Q389 PolarHBondContact O-N 3.47Å
390	H	94.8	Very high	88.6	Confident	41 Å²	41	48 Å²	48	19%	0.19	23%	0.232	C	C	.	.			trans	-149.8	139.5	177.8	-178.9	-102	0	0	0	110.8	N392 I393 K448 F452	H390-N392 PolarHBondContact ND1-N 3.13Å; H390-N392 PolarHBondContact O-N 3.14Å; H390-N392 VanDerWaalsContact O-N 3.08Å; H390-I393 HydrophobicContact CB-CB 4.23Å; H390-I393 HydrophobicContact CB-CG1 3.84Å; H390-I393 PolarHBondContact O-N 2.91Å; H390-K448 PolarHBondContact CE1-O 3.45Å; H390-F452 HydrophobicContact CB-CB 4.35Å; H390-F452 HydrophobicContact CB-CD1 3.59Å; H390-F452 HydrophobicContact CB-CD2 3.88Å; H390-F452 HydrophobicContact CB-CE1 3.74Å; H390-F452 HydrophobicContact CB-CE2 4.01Å; H390-F452 HydrophobicContact CB-CG 3.66Å; H390-F452 HydrophobicContact CB-CZ 3.95Å; H390-F452 AromaticContact CD2-CD2 3.85Å; H390-F452 AromaticContact CD2-CG 3.83Å; H390-F452 AromaticContact CG-CG 3.69Å
391	P	95.1	Very high	89	Confident	89 Å²	89	45 Å²	45	58%	0.578	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.2	-175.7	21.5	-35.5	0	0	0	114.8	K480	P391-K480 WeakPolarHBondContact O-CE 3.36Å; P391-K480 WeakPolarHBondContact O-CG 3.44Å
392	N	97	Very high	89.4	Confident	12 Å²	12	44.5 Å²	44.5	6%	0.064	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	18.4	176.9	-54.7	117.2	0	0	0	114.1	H390 Q445 V479 K480 I481	H390-N392 PolarHBondContact ND1-N 3.13Å; H390-N392 PolarHBondContact O-N 3.14Å; H390-N392 VanDerWaalsContact O-N 3.08Å; N392-Q445 VanDerWaalsContact CB-O 3.28Å; N392-Q445 WeakPolarHBondContact CB-O 3.48Å; N392-Q445 WeakPolarHBondContact ND2-CB 3.23Å; N392-Q445 WeakPolarHBondContact ND2-CG 3.49Å; N392-Q445 PolarHBondContact ND2-OE1 2.98Å; N392-V479 WeakPolarHBondContact CA-O 3.24Å; N392-V479 WeakPolarHBondContact CB-O 2.97Å; N392-V479 PolarHBondContact ND2-O 2.64Å; N392-K480 CarbonylContact O-C 3.51Å; N392-K480 WeakPolarHBondContact O-CA 3.2Å; N392-I481 PolarHBondContact O-N 2.86Å
393	I	95.2	Very high	89.3	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.005	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-115.2	145.3	167.3	-58.6	-60.6	0	0	0	108.3	H390 F452 L453 K480 I481 L484	H390-I393 HydrophobicContact CB-CB 4.23Å; H390-I393 HydrophobicContact CB-CG1 3.84Å; H390-I393 PolarHBondContact O-N 2.91Å; I393-F452 HydrophobicContact CG1-CD1 4.04Å; I393-F452 HydrophobicContact CG1-CE1 4.45Å; I393-L453 HydrophobicContact CD1-CD1 3.83Å; I393-L453 HydrophobicContact CD1-CD2 4.08Å; I393-L453 HydrophobicContact CD1-CG 3.9Å; I393-L453 HydrophobicContact CG1-CD2 4.46Å; I393-K480 PolarHBondContact O-NZ 3.04Å; I393-I481 CarbonylContact C-O 3.47Å; I393-I481 WeakPolarHBondContact CA-O 3.44Å; I393-I481 HydrophobicContact CD1-CB 3.98Å; I393-I481 HydrophobicContact CD1-CD1 4.27Å; I393-I481 HydrophobicContact CD1-CG1 4.42Å; I393-L484 HydrophobicContact CG2-CD1 3.66Å
394	V	94.8	Very high	88.9	Confident	17 Å²	17	45.4 Å²	45.4	10%	0.103	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-72.6	120.6	169.8	175.7	0	0	0	0	107.6	F396 E417 M419 F471 K480 I481	V394-F396 PolarHBondContact O-N 3.26Å; V394-E417 HydrophobicContact CG1-CB 3.93Å; V394-M419 HydrophobicContact CG1-CG 4.27Å; V394-M419 HydrophobicContact CG2-CG 3.88Å; V394-M419 HydrophobicContact CG2-SD 4.21Å; V394-F471 HydrophobicContact CG2-CD2 3.79Å; V394-F471 HydrophobicContact CG2-CE2 4.42Å; V394-F471 HydrophobicContact CG2-CG 4.41Å; V394-K480 HydrophobicContact CG2-CB 3.73Å; V394-I481 PolarHBondContact N-O 2.86Å
395	R	93.6	Very high	88.2	Confident	84 Å²	84	51.4 Å²	51.4	32%	0.317	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-64	130.4	-174.7	176.8	172.4	-178.5	110.2	18	111.2	Y397 T416 E417	R395-Y397 VanDerWaalsContact CD-CE1 3.44Å; R395-Y397 HydrophobicContact CG-CD1 4.24Å; R395-Y397 HydrophobicContact CG-CE1 4Å; R395-T416 CarbonylContact O-C 3.6Å; R395-T416 VanDerWaalsContact O-CA 3.3Å; R395-T416 WeakPolarHBondContact O-CA 3.24Å; R395-E417 HydrophobicContact CB-CB 4.13Å; R395-E417 PolarHBondContact N-OE2 2.92Å; R395-E417 PolarHBondContact O-N 3.25Å
396	F	91.9	Very high	87.3	Confident	12 Å²	12	54.9 Å²	54.9	5%	0.053	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	138.6	163.7	-155.1	-101.8	0	0	0	109.4	A382 L385 K386 V394 Y399 L414 T416	A382-F396 WeakPolarHBondContact O-CE1 3.36Å; L385-F396 HydrophobicContact CB-CB 4.38Å; L385-F396 HydrophobicContact CB-CD1 3.98Å; L385-F396 HydrophobicContact CB-CD2 4.23Å; L385-F396 HydrophobicContact CB-CE1 4.25Å; L385-F396 HydrophobicContact CB-CE2 4.5Å; L385-F396 HydrophobicContact CB-CG 3.96Å; L385-F396 HydrophobicContact CD1-CE2 4.44Å; L385-F396 WeakPolarHBondContact O-CB 3.43Å; K386-F396 HydrophobicContact CG-CD1 3.83Å; K386-F396 HydrophobicContact CG-CE1 4.09Å; V394-F396 PolarHBondContact O-N 3.26Å; F396-Y399 HydrophobicContact CE1-CD1 4.3Å; F396-L414 HydrophobicContact CE2-CB 4.01Å; F396-L414 HydrophobicContact CE2-CD2 3.76Å; F396-L414 HydrophobicContact CE2-CG 4.33Å; F396-L414 HydrophobicContact CZ-CB 4.13Å; F396-L414 HydrophobicContact CZ-CD2 3.98Å; F396-L414 HydrophobicContact CZ-CG 4.26Å; F396-T416 HydrophobicContact CD2-CG2 3.74Å; F396-T416 HydrophobicContact CE2-CG2 4.22Å
397	Y	92.9	Very high	86.3	Confident	54 Å²	54	55.4 Å²	55.4	21%	0.212	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-53.9	178.5	-67.5	-70.5	0	0	0	112.1	F333 V360 R395 V415 E417	F333-Y397 HydrophobicContact CE1-CG 4.48Å; F333-Y397 HydrophobicContact CZ-CG 4.48Å; V360-Y397 HydrophobicContact CG1-CD2 4.02Å; V360-Y397 HydrophobicContact CG1-CE2 3.76Å; R395-Y397 VanDerWaalsContact CD-CE1 3.44Å; R395-Y397 HydrophobicContact CG-CD1 4.24Å; R395-Y397 HydrophobicContact CG-CE1 4Å; Y397-V415 WeakPolarHBondContact CB-O 3.21Å; Y397-V415 HydrophobicContact CD2-CG1 4.18Å; Y397-V415 PolarHBondContact N-O 3.02Å; Y397-E417 HydrophobicContact CE2-CB 4.28Å
398	D	92	Very high	85.6	Confident	31 Å²	31	58 Å²	58	17%	0.166	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	168.2	-177.2	-160.6	10.9	0	0	0	111.5	F333 K386 W400 V415	F333-D398 HydrophobicContact CE2-CB 3.74Å; F333-D398 HydrophobicContact CZ-CB 4.42Å; K386-D398 WeakPolarHBondContact CE-OD1 3.14Å; K386-D398 IonicContact NZ-OD1 2.76Å; K386-D398 PolarHBondContact NZ-OD1 3.23Å; K386-D398 VanDerWaalsContact NZ-OD1 3.1Å; D398-W400 HydrophobicContact CB-CZ3 4.31Å; D398-V415 PolarHBondContact O-N 3.29Å
399	Y	90.1	Very high	84.8	Confident	34 Å²	34	63.5 Å²	63.5	13%	0.133	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	157.3	169	83.4	-86.8	0	0	0	111.3	F378 R379 A382 E383 F396 I412 V413	F378-Y399 HydrophobicContact CE1-CD2 4.38Å; R379-Y399 HydrophobicContact CG-CE2 4.29Å; R379-Y399 WeakPolarHBondContact CG-OH 3.39Å; A382-Y399 HydrophobicContact CB-CD1 3.42Å; A382-Y399 VanDerWaalsContact CB-CD1 3.42Å; A382-Y399 HydrophobicContact CB-CD2 4.11Å; A382-Y399 HydrophobicContact CB-CE1 3.7Å; A382-Y399 HydrophobicContact CB-CE2 4.39Å; A382-Y399 HydrophobicContact CB-CG 3.69Å; A382-Y399 WeakPolarHBondContact O-CD1 3.07Å; E383-Y399 HydrophobicContact CB-CE1 4.37Å; E383-Y399 VanDerWaalsContact OE2-CE1 3.25Å; E383-Y399 WeakPolarHBondContact OE2-CE1 3.22Å; F396-Y399 HydrophobicContact CE1-CD1 4.3Å; Y399-I412 HydrophobicContact CD2-CG2 4.45Å; Y399-V413 CarbonylContact C-O 3.51Å; Y399-V413 WeakPolarHBondContact CA-O 3.34Å; Y399-V413 VanDerWaalsContact CB-O 3.31Å; Y399-V413 WeakPolarHBondContact CB-O 3.24Å
400	W	90	Very high	84.1	Confident	16 Å²	16	63 Å²	63	6%	0.061	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	155.5	167.4	58.3	86.6	0	0	0	113	K329 F333 W362 D398 S402 V413 V415	K329-W400 HydrophobicContact CD-CB 4.26Å; K329-W400 HydrophobicContact CD-CG 4.34Å; K329-W400 HydrophobicContact CG-CG 4.41Å; F333-W400 HydrophobicContact CB-CH2 4.41Å; F333-W400 HydrophobicContact CD2-CH2 4.15Å; F333-W400 AromaticContact CD2-CZ3 3.98Å; F333-W400 HydrophobicContact CD2-CZ3 3.98Å; W362-W400 HydrophobicContact CE3-CH2 4.33Å; W362-W400 HydrophobicContact CE3-CZ2 4.35Å; W362-W400 HydrophobicContact CH2-CH2 4.27Å; W362-W400 AromaticContact CH2-CZ2 3.58Å; W362-W400 HydrophobicContact CH2-CZ2 3.58Å; W362-W400 HydrophobicContact CZ2-CZ2 4Å; W362-W400 AromaticContact CZ3-CH2 3.96Å; W362-W400 HydrophobicContact CZ3-CH2 3.96Å; W362-W400 AromaticContact CZ3-CZ2 3.75Å; W362-W400 HydrophobicContact CZ3-CZ2 3.75Å; D398-W400 HydrophobicContact CB-CZ3 4.31Å; W400-S402 VanDerWaalsContact CD1-OG 3.28Å; W400-S402 PolarHBondContact NE1-OG 2.93Å; W400-S402 VanDerWaalsContact NE1-OG 3.16Å; W400-V413 HydrophobicContact CD2-CB 4.16Å; W400-V413 HydrophobicContact CH2-CB 4.37Å; W400-V413 HydrophobicContact CH2-CG1 3.79Å; W400-V413 HydrophobicContact CZ2-CB 3.73Å; W400-V413 HydrophobicContact CZ2-CG1 3.45Å; W400-V413 VanDerWaalsContact CZ2-CG1 3.45Å; W400-V413 HydrophobicContact CZ2-CG2 4.14Å; W400-V413 PolarHBondContact N-O 3.47Å; W400-V413 PolarHBondContact O-N 2.68Å; W400-V415 HydrophobicContact CH2-CG2 3.46Å; W400-V415 VanDerWaalsContact CH2-CG2 3.46Å; W400-V415 HydrophobicContact CZ3-CG2 3.63Å
401	E	87	Confident	83.6	Confident	43 Å²	43	62.3 Å²	62.3	20%	0.201	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	128.9	165.3	-70.5	173.4	-126.1	0	0	110.4	K329 R375 R379 I412	K329-E401 WeakPolarHBondContact CE-O 3.44Å; K329-E401 PolarHBondContact NZ-O 3.32Å; R375-E401 WeakPolarHBondContact CD-OE1 3.27Å; R375-E401 WeakPolarHBondContact CD-OE2 3.4Å; R375-E401 IonicContact CZ-OE2 3.98Å; R375-E401 IonicContact NH1-OE2 2.66Å; R375-E401 PolarHBondContact NH1-OE2 3Å; R379-E401 IonicContact CZ-OE1 3.75Å; R379-E401 IonicContact NE-OE1 2.64Å; R379-E401 IonicContact NH2-OE1 2.77Å; R379-E401 PolarHBondContact NH2-OE1 3.12Å; E401-I412 HydrophobicContact CG-CG1 4.34Å
402	S	85.4	Confident	83.1	Confident	24 Å²	24	58.1 Å²	58.1	17%	0.168	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	171.2	175	-92.3	0	0	0	0	111	W400 K410 Y411	W400-S402 VanDerWaalsContact CD1-OG 3.28Å; W400-S402 PolarHBondContact NE1-OG 2.93Å; W400-S402 VanDerWaalsContact NE1-OG 3.16Å; S402-K410 WeakPolarHBondContact O-CA 3.49Å; S402-Y411 VanDerWaalsContact CB-CE2 3.41Å; S402-Y411 VanDerWaalsContact CB-CZ 3.42Å; S402-Y411 PolarHBondContact N-O 3.35Å; S402-Y411 PolarHBondContact O-N 2.99Å; S402-Y411 VanDerWaalsContact O-O 3.07Å
403	A	79.1	Confident	82.8	Confident	48 Å²	48	57.5 Å²	57.5	40%	0.397	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	150.6	169.1	0	0	0	0	0	110.7	R409 K410 Y411	A403-R409 CarbonylContact C-O 3.55Å; A403-R409 WeakPolarHBondContact CA-O 3.41Å; A403-K410 HydrophobicContact CB-CG 4.34Å; A403-Y411 VanDerWaalsContact C-CE1 3.45Å
404	D	73	Confident	82.6	Confident	66 Å²	66	57.9 Å²	57.9	35%	0.353	30%	0.296	S	S	.	.			trans	-57.5	156.1	175.1	-72.4	-3.3	0	0	0	110.1	C406 G407 R409 Y411	D404-C406 PolarHBondContact O-N 3.09Å; D404-G407 PolarHBondContact O-N 3.33Å; D404-R409 PolarHBondContact N-O 2.94Å; D404-R409 WeakPolarHBondContact OD2-CB 3.26Å; D404-Y411 WeakPolarHBondContact OD1-CD1 3.2Å; D404-Y411 VanDerWaalsContact OD1-CE1 3.27Å; D404-Y411 WeakPolarHBondContact OD1-CE1 3.36Å
405	L	65.9	Low	82.5	Confident	197 Å²	197	57 Å²	57	100%	1.031	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-11.6	178.3	-65.6	170.2	0	0	0	115.1
406	C	63.4	Low	82.6	Confident	84 Å²	84	54.3 Å²	54.3	57%	0.568	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	2.7	176.7	-161.7	0	0	0	0	113.3	D404 K408	D404-C406 PolarHBondContact O-N 3.09Å; C406-K408 PolarHBondContact O-N 2.7Å; C406-K408 VanDerWaalsContact SG-CE 3.56Å
407	G	67.5	Low	82.7	Confident	55 Å²	55	55.8 Å²	55.8	57%	0.567	29%	0.291	S	S	*	.	S	Bend	trans	69.1	-17.6	-178.3	0	0	0	0	0	116.2	D404 R409	D404-G407 PolarHBondContact O-N 3.33Å; G407-R409 VanDerWaalsContact C-N 3.35Å; G407-R409 PolarHBondContact O-N 3.01Å
408	K	68.7	Low	82.8	Confident	185 Å²	185	55 Å²	55	80%	0.804	29%	0.29	S	S	*	.	S	Bend	trans	-69.8	-20.4	-169.8	-71.5	170.8	-174.3	170	0	116	C406	C406-K408 PolarHBondContact O-N 2.7Å; C406-K408 VanDerWaalsContact SG-CE 3.56Å
409	R	71.4	Confident	82.9	Confident	124 Å²	124	54.7 Å²	54.7	47%	0.468	29%	0.288	S	S	.	.			trans	-134.6	131.2	179.1	170.4	-178.5	-71.8	154	-3.3	108.4	A403 D404 G407	A403-R409 CarbonylContact C-O 3.55Å; A403-R409 WeakPolarHBondContact CA-O 3.41Å; D404-R409 PolarHBondContact N-O 2.94Å; D404-R409 WeakPolarHBondContact OD2-CB 3.26Å; G407-R409 VanDerWaalsContact C-N 3.35Å; G407-R409 PolarHBondContact O-N 3.01Å
410	K	77.8	Confident	83	Confident	107 Å²	107	58.2 Å²	58.2	47%	0.465	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	154.8	169.2	-63	177.1	177.2	-176.9	0	110.1	E367 S402 A403	E367-K410 HydrophobicContact CB-CB 4.19Å; E367-K410 WeakPolarHBondContact CB-O 3.48Å; E367-K410 HydrophobicContact CG-CB 4.41Å; E367-K410 PolarHBondContact N-O 2.71Å; E367-K410 WeakPolarHBondContact OE1-CB 3.36Å; E367-K410 WeakPolarHBondContact OE1-CD 3.4Å; E367-K410 WeakPolarHBondContact OE2-CB 3.5Å; S402-K410 WeakPolarHBondContact O-CA 3.49Å; A403-K410 HydrophobicContact CB-CG 4.34Å
411	Y	83.6	Confident	83	Confident	25 Å²	25	59.5 Å²	59.5	10%	0.098	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	158.7	175.3	60	-90	0	0	0	109.5	D326 E364 L365 S402 A403 D404 V413	D326-Y411 PolarHBondContact OD2-OH 3.18Å; E364-Y411 HydrophobicContact CB-CD2 4.29Å; E364-Y411 HydrophobicContact CG-CD2 4.31Å; E364-Y411 HydrophobicContact CG-CE2 4.34Å; L365-Y411 CarbonylContact O-C 2.79Å; L365-Y411 VanDerWaalsContact O-CA 3.24Å; L365-Y411 WeakPolarHBondContact O-CA 3.4Å; L365-Y411 VanDerWaalsContact O-CB 3.24Å; L365-Y411 WeakPolarHBondContact O-CB 3.43Å; S402-Y411 VanDerWaalsContact CB-CE2 3.41Å; S402-Y411 VanDerWaalsContact CB-CZ 3.42Å; S402-Y411 PolarHBondContact N-O 3.35Å; S402-Y411 PolarHBondContact O-N 2.99Å; S402-Y411 VanDerWaalsContact O-O 3.07Å; A403-Y411 VanDerWaalsContact C-CE1 3.45Å; D404-Y411 WeakPolarHBondContact OD1-CD1 3.2Å; D404-Y411 VanDerWaalsContact OD1-CE1 3.27Å; D404-Y411 WeakPolarHBondContact OD1-CE1 3.36Å; Y411-V413 HydrophobicContact CD2-CG2 3.83Å; Y411-V413 HydrophobicContact CE2-CG2 3.49Å; Y411-V413 VanDerWaalsContact CE2-CG2 3.49Å
412	I	84.9	Confident	83.3	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	129.7	176.7	-48.1	-176.4	0	0	0	108.4	E364 L365 L370 F378 Y399 E401 L414	E364-I412 CarbonylContact C-O 3.48Å; E364-I412 WeakPolarHBondContact CA-O 3.45Å; L365-I412 HydrophobicContact CB-CB 4.33Å; L365-I412 PolarHBondContact N-O 3.22Å; L365-I412 PolarHBondContact O-N 3.08Å; L370-I412 HydrophobicContact CD1-CD1 4.37Å; F378-I412 HydrophobicContact CD1-CD1 3.67Å; F378-I412 HydrophobicContact CD1-CG2 4.44Å; F378-I412 HydrophobicContact CE1-CD1 3.83Å; F378-I412 HydrophobicContact CE1-CG2 3.6Å; F378-I412 HydrophobicContact CG-CD1 4.29Å; F378-I412 HydrophobicContact CZ-CD1 4.47Å; F378-I412 HydrophobicContact CZ-CG2 4.06Å; Y399-I412 HydrophobicContact CD2-CG2 4.45Å; E401-I412 HydrophobicContact CG-CG1 4.34Å; I412-L414 HydrophobicContact CG2-CD1 4.23Å
413	V	90.5	Very high	83.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	137.5	170.5	-173.3	0	0	0	0	109.3	W362 C363 Y399 W400 Y411 V415	W362-V413 HydrophobicContact CD2-CG1 3.78Å; W362-V413 HydrophobicContact CE3-CG1 4.38Å; W362-V413 HydrophobicContact CG-CG1 4.11Å; W362-V413 HydrophobicContact CZ2-CG1 4.03Å; W362-V413 HydrophobicContact CZ2-CG2 4.1Å; C363-V413 CarbonylContact O-C 3.58Å; C363-V413 VanDerWaalsContact O-CA 3.31Å; C363-V413 WeakPolarHBondContact O-CA 3.27Å; Y399-V413 CarbonylContact C-O 3.51Å; Y399-V413 WeakPolarHBondContact CA-O 3.34Å; Y399-V413 VanDerWaalsContact CB-O 3.31Å; Y399-V413 WeakPolarHBondContact CB-O 3.24Å; W400-V413 HydrophobicContact CD2-CB 4.16Å; W400-V413 HydrophobicContact CH2-CB 4.37Å; W400-V413 HydrophobicContact CH2-CG1 3.79Å; W400-V413 HydrophobicContact CZ2-CB 3.73Å; W400-V413 HydrophobicContact CZ2-CG1 3.45Å; W400-V413 VanDerWaalsContact CZ2-CG1 3.45Å; W400-V413 HydrophobicContact CZ2-CG2 4.14Å; W400-V413 PolarHBondContact N-O 3.47Å; W400-V413 PolarHBondContact O-N 2.68Å; Y411-V413 HydrophobicContact CD2-CG2 3.83Å; Y411-V413 HydrophobicContact CE2-CG2 3.49Å; Y411-V413 VanDerWaalsContact CE2-CG2 3.49Å; V413-V415 HydrophobicContact CG1-CG2 4.33Å
414	L	90.4	Very high	84.4	Confident	8 Å²	8	55.1 Å²	55.1	4%	0.042	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	138.3	169.7	-53	79.4	0	0	0	107.7	C363 L365 F378 F396 I412	C363-L414 HydrophobicContact CB-CB 4.32Å; C363-L414 PolarHBondContact N-O 3.43Å; C363-L414 PolarHBondContact O-N 3.39Å; L365-L414 HydrophobicContact CD1-CD1 3.47Å; L365-L414 VanDerWaalsContact CD1-CD1 3.47Å; L365-L414 HydrophobicContact CD2-CD1 4.46Å; L365-L414 HydrophobicContact CG-CD1 3.56Å; F378-L414 HydrophobicContact CE2-CD2 4.31Å; F378-L414 HydrophobicContact CZ-CD1 4.18Å; F378-L414 HydrophobicContact CZ-CD2 3.81Å; F378-L414 HydrophobicContact CZ-CG 4.13Å; F396-L414 HydrophobicContact CE2-CB 4.01Å; F396-L414 HydrophobicContact CE2-CD2 3.76Å; F396-L414 HydrophobicContact CE2-CG 4.33Å; F396-L414 HydrophobicContact CZ-CB 4.13Å; F396-L414 HydrophobicContact CZ-CD2 3.98Å; F396-L414 HydrophobicContact CZ-CG 4.26Å; I412-L414 HydrophobicContact CG2-CD1 4.23Å
415	V	94.1	Very high	85.3	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126	179.8	-173.3	0	0	0	0	110.2	F333 V360 A361 Y397 D398 W400 V413	F333-V415 HydrophobicContact CB-CG2 4.36Å; F333-V415 HydrophobicContact CD1-CG1 3.72Å; F333-V415 HydrophobicContact CD2-CB 4.43Å; F333-V415 HydrophobicContact CD2-CG1 4.36Å; F333-V415 HydrophobicContact CD2-CG2 4Å; F333-V415 HydrophobicContact CE1-CG1 3.91Å; F333-V415 HydrophobicContact CG-CB 4.46Å; F333-V415 HydrophobicContact CG-CG1 3.95Å; F333-V415 HydrophobicContact CG-CG2 4.09Å; F333-V415 HydrophobicContact CZ-CG1 4.33Å; V360-V415 HydrophobicContact CB-CG1 3.75Å; V360-V415 HydrophobicContact CG1-CG1 4.17Å; V360-V415 HydrophobicContact CG2-CG1 3.68Å; A361-V415 WeakPolarHBondContact O-CA 3.49Å; Y397-V415 WeakPolarHBondContact CB-O 3.21Å; Y397-V415 HydrophobicContact CD2-CG1 4.18Å; Y397-V415 PolarHBondContact N-O 3.02Å; D398-V415 PolarHBondContact O-N 3.29Å; W400-V415 HydrophobicContact CH2-CG2 3.46Å; W400-V415 VanDerWaalsContact CH2-CG2 3.46Å; W400-V415 HydrophobicContact CZ3-CG2 3.63Å; V413-V415 HydrophobicContact CG1-CG2 4.33Å
416	T	94.3	Very high	86.6	Confident	26 Å²	26	51.5 Å²	51.5	16%	0.16	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	167.1	-174.6	57.3	0	0	0	0	113	V360 A361 R395 F396 L418	V360-T416 WeakPolarHBondContact CB-O 3.36Å; A361-T416 PolarHBondContact N-O 3.09Å; A361-T416 PolarHBondContact O-N 2.98Å; R395-T416 CarbonylContact O-C 3.6Å; R395-T416 VanDerWaalsContact O-CA 3.3Å; R395-T416 WeakPolarHBondContact O-CA 3.24Å; F396-T416 HydrophobicContact CD2-CG2 3.74Å; F396-T416 HydrophobicContact CE2-CG2 4.22Å; T416-L418 PolarHBondContact O-N 3.09Å
417	E	94.9	Very high	88	Confident	44 Å²	44	48.9 Å²	48.9	21%	0.206	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	126.4	174.7	177.1	-176	-177.7	0	0	112.5	V394 R395 Y397 M419 K480	V394-E417 HydrophobicContact CG1-CB 3.93Å; R395-E417 HydrophobicContact CB-CB 4.13Å; R395-E417 PolarHBondContact N-OE2 2.92Å; R395-E417 PolarHBondContact O-N 3.25Å; Y397-E417 HydrophobicContact CE2-CB 4.28Å; E417-M419 HydrophobicContact CG-SD 4.08Å; E417-M419 PolarHBondContact O-N 2.89Å; E417-K480 WeakPolarHBondContact OE1-CD 3.42Å; E417-K480 WeakPolarHBondContact OE1-CE 3.4Å; E417-K480 IonicContact OE1-NZ 3.55Å; E417-K480 PolarHBondContact OE1-NZ 3.2Å; E417-K480 IonicContact OE2-NZ 3.79Å; E417-K480 PolarHBondContact OE2-NZ 3.14Å
418	L	94.8	Very high	89.2	Confident	37 Å²	37	46.9 Å²	46.9	19%	0.194	23%	0.227	C	C	.	.			trans	-78	101.9	-175.8	-178.7	57.5	0	0	0	112.5	L340 R350 A359 A361 T416 T420	L340-L418 HydrophobicContact CD1-CD1 3.42Å; L340-L418 VanDerWaalsContact CD1-CD1 3.42Å; R350-L418 HydrophobicContact CG-CD2 4.35Å; A359-L418 HydrophobicContact CB-CD2 3.67Å; A359-L418 VanDerWaalsContact O-CB 3.29Å; A359-L418 WeakPolarHBondContact O-CB 3.47Å; A361-L418 HydrophobicContact CB-CD1 4.15Å; T416-L418 PolarHBondContact O-N 3.09Å; L418-T420 HydrophobicContact CD2-CG2 4.16Å; L418-T420 HydrophobicContact CG-CG2 3.9Å; L418-T420 PolarHBondContact O-N 3.48Å
419	M	94.2	Very high	90.2	Very high	25 Å²	25	47 Å²	47	12%	0.123	23%	0.227	C	C	.	.			trans	-81.2	77.4	-178.4	-62.8	-54.3	-60.5	0	0	113.5	V394 E417 S421 F471 T473 K480	V394-M419 HydrophobicContact CG1-CG 4.27Å; V394-M419 HydrophobicContact CG2-CG 3.88Å; V394-M419 HydrophobicContact CG2-SD 4.21Å; E417-M419 HydrophobicContact CG-SD 4.08Å; E417-M419 PolarHBondContact O-N 2.89Å; M419-S421 VanDerWaalsContact C-N 3.31Å; M419-S421 PolarHBondContact O-N 3.34Å; M419-F471 HydrophobicContact CB-CB 3.78Å; M419-F471 HydrophobicContact CB-CD1 3.41Å; M419-F471 VanDerWaalsContact CB-CD1 3.41Å; M419-F471 HydrophobicContact CB-CE1 4.17Å; M419-F471 HydrophobicContact CB-CG 3.73Å; M419-F471 HydrophobicContact CE-CB 3.56Å; M419-F471 HydrophobicContact CG-CB 3.65Å; M419-F471 HydrophobicContact CG-CD1 3.89Å; M419-F471 HydrophobicContact CG-CD2 4.3Å; M419-F471 HydrophobicContact CG-CG 3.69Å; M419-F471 HydrophobicContact SD-CB 4.35Å; M419-T473 HydrophobicContact CE-CG2 3.91Å; M419-K480 HydrophobicContact CE-CB 4.18Å; M419-K480 HydrophobicContact CE-CD 3.85Å; M419-K480 HydrophobicContact SD-CD 3.85Å
420	T	91.3	Very high	91	Very high	108 Å²	108	46.9 Å²	46.9	66%	0.663	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-18	-173.2	59.4	0	0	0	0	116.6	L418	L418-T420 HydrophobicContact CD2-CG2 4.16Å; L418-T420 HydrophobicContact CG-CG2 3.9Å; L418-T420 PolarHBondContact O-N 3.48Å
421	S	91.6	Very high	91.2	Very high	42 Å²	42	44.7 Å²	44.7	29%	0.294	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-7.9	-176.2	-79.6	0	0	0	0	114.4	M419 I472 T473	M419-S421 VanDerWaalsContact C-N 3.31Å; M419-S421 PolarHBondContact O-N 3.34Å; S421-I472 VanDerWaalsContact CB-O 3.22Å; S421-I472 WeakPolarHBondContact CB-O 3.39Å; S421-T473 VanDerWaalsContact CB-O 3.26Å; S421-T473 WeakPolarHBondContact CB-O 3.34Å; S421-T473 PolarHBondContact OG-O 3.26Å
422	G	91.8	Very high	90.8	Very high	8 Å²	8	52.2 Å²	52.2	8%	0.082	25%	0.25	C	S	.	.			trans	95	-165.9	174.7	0	0	0	0	0	115.4	F471 I472	G422-F471 CarbonylContact O-C 3.6Å; G422-F471 WeakPolarHBondContact O-CA 3.19Å; G422-I472 WeakPolarHBondContact O-CG1 3.35Å; G422-I472 PolarHBondContact O-N 3.16Å
423	T	94	Very high	90.6	Very high	15 Å²	15	63 Å²	63	9%	0.092	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-109.8	160.5	-172.1	65.8	0	0	0	0	111.5	K425 M426 Y427 D468 I470 F471	T423-K425 PolarHBondContact O-N 3.35Å; T423-M426 PolarHBondContact O-N 2.96Å; T423-M426 VanDerWaalsContact O-N 3.09Å; T423-M426 PolarHBondContact OG1-N 2.78Å; T423-Y427 PolarHBondContact O-N 2.95Å; T423-D468 WeakPolarHBondContact CG2-O 3.4Å; T423-D468 PolarHBondContact OG1-OD1 2.99Å; T423-I470 CarbonylContact C-O 3.53Å; T423-I470 WeakPolarHBondContact CA-O 3.38Å; T423-F471 HydrophobicContact CG2-CD1 3.79Å; T423-F471 HydrophobicContact CG2-CE1 3.74Å; T423-F471 HydrophobicContact CG2-CZ 4.42Å
424	L	94.1	Very high	90.4	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-56.2	-39.2	174.2	-77.8	178.2	0	0	0	111.9	M426 Y427 L428 W442 I446 C467 I470 I472 V479 M530	L424-M426 PolarHBondContact O-N 3.15Å; L424-Y427 CarbonylContact O-C 3.58Å; L424-Y427 WeakPolarHBondContact O-CA 3.49Å; L424-Y427 WeakPolarHBondContact O-CB 3.37Å; L424-Y427 PolarHBondContact O-N 2.86Å; L424-Y427 VanDerWaalsContact O-N 3.14Å; L424-L428 WeakPolarHBondContact O-CG 3.34Å; L424-L428 PolarHBondContact O-N 3.41Å; L424-W442 HydrophobicContact CD2-CD2 4.1Å; L424-W442 HydrophobicContact CD2-CE3 3.35Å; L424-W442 HydrophobicContact CD2-CH2 4.28Å; L424-W442 HydrophobicContact CD2-CZ3 3.45Å; L424-W442 VanDerWaalsContact CD2-CZ3 3.45Å; L424-I446 HydrophobicContact CD1-CD1 4.12Å; L424-C467 HydrophobicContact CB-CB 3.82Å; L424-C467 WeakPolarHBondContact CB-O 3.34Å; L424-C467 PolarHBondContact N-O 2.77Å; L424-C467 VanDerWaalsContact N-O 3.1Å; L424-I470 HydrophobicContact CD1-CB 3.82Å; L424-I470 HydrophobicContact CD1-CD1 4.11Å; L424-I470 HydrophobicContact CD1-CG2 3.5Å; L424-I470 HydrophobicContact CG-CB 4.22Å; L424-I470 HydrophobicContact CG-CG2 3.94Å; L424-I470 PolarHBondContact N-O 2.91Å; L424-I472 HydrophobicContact CD2-CG2 3.96Å; L424-V479 HydrophobicContact CD2-CG1 4.1Å; L424-V479 HydrophobicContact CG-CG1 4.4Å; L424-M530 HydrophobicContact CD1-CE 4.45Å; L424-M530 HydrophobicContact CD1-SD 3.74Å; L424-M530 HydrophobicContact CD2-SD 4.21Å
425	K	92.8	Very high	90.1	Very high	72 Å²	72	68.7 Å²	68.7	31%	0.313	32%	0.321	S	S	.	.	H	α-helix	trans	-61.5	-41.8	175.3	-171.2	-174.9	-171.6	172.6	0	112.1	T423 K429 C467 D468	T423-K425 PolarHBondContact O-N 3.35Å; K425-K429 VanDerWaalsContact O-CB 3.31Å; K425-K429 WeakPolarHBondContact O-CB 3.36Å; K425-K429 PolarHBondContact O-N 3.46Å; K425-C467 HydrophobicContact CB-CB 4.05Å; K425-C467 PolarHBondContact N-O 3.39Å; K425-D468 HydrophobicContact CB-CB 4.46Å; K425-D468 HydrophobicContact CD-CB 3.79Å; K425-D468 WeakPolarHBondContact CD-OD1 3.4Å; K425-D468 WeakPolarHBondContact CD-OD2 3.26Å; K425-D468 WeakPolarHBondContact CE-OD2 3.3Å; K425-D468 IonicContact NZ-OD2 2.65Å; K425-D468 PolarHBondContact NZ-OD2 3.08Å
426	M	92.6	Very high	89.7	Confident	115 Å²	115	70.7 Å²	70.7	57%	0.567	33%	0.332	S	S	*	.	H	α-helix	trans	-71.6	-29.7	174.4	-175.1	155.1	59.8	0	0	112.6	T423 L424 R430	T423-M426 PolarHBondContact O-N 2.96Å; T423-M426 VanDerWaalsContact O-N 3.09Å; T423-M426 PolarHBondContact OG1-N 2.78Å; L424-M426 PolarHBondContact O-N 3.15Å; M426-R430 PolarHBondContact O-N 3.22Å
427	Y	93	Very high	89.3	Confident	29 Å²	29	73.4 Å²	73.4	11%	0.114	34%	0.341	C	S	.	.	H	α-helix	trans	-65.7	-52.8	170.6	-174	-85.4	0	0	0	111.1	T423 L424 K429 R430 F431 I434 W442 I472 T475	T423-Y427 PolarHBondContact O-N 2.95Å; L424-Y427 CarbonylContact O-C 3.58Å; L424-Y427 WeakPolarHBondContact O-CA 3.49Å; L424-Y427 WeakPolarHBondContact O-CB 3.37Å; L424-Y427 PolarHBondContact O-N 2.86Å; L424-Y427 VanDerWaalsContact O-N 3.14Å; Y427-K429 PolarHBondContact O-N 2.79Å; Y427-R430 CarbonylContact O-C 3.58Å; Y427-R430 WeakPolarHBondContact O-CA 3.17Å; Y427-R430 PolarHBondContact O-N 2.85Å; Y427-F431 HydrophobicContact CD1-CB 4.2Å; Y427-F431 HydrophobicContact CD1-CD2 4.14Å; Y427-F431 AromaticContact CD2-CD2 3.55Å; Y427-F431 HydrophobicContact CD2-CD2 3.55Å; Y427-F431 AromaticContact CD2-CE2 3.88Å; Y427-F431 HydrophobicContact CD2-CE2 3.88Å; Y427-F431 HydrophobicContact CE1-CB 3.76Å; Y427-F431 AromaticContact CE1-CD2 3.98Å; Y427-F431 HydrophobicContact CE1-CD2 3.98Å; Y427-F431 HydrophobicContact CE1-CG 4.2Å; Y427-F431 AromaticContact CE2-CD2 3.38Å; Y427-F431 HydrophobicContact CE2-CD2 3.38Å; Y427-F431 AromaticContact CE2-CE2 3.66Å; Y427-F431 HydrophobicContact CE2-CE2 3.66Å; Y427-F431 HydrophobicContact CE2-CG 4.2Å; Y427-F431 AromaticContact CG-CD2 3.93Å; Y427-F431 HydrophobicContact CG-CD2 3.93Å; Y427-F431 AromaticContact CZ-CD2 3.61Å; Y427-F431 AromaticContact CZ-CG 3.97Å; Y427-F431 PolarHBondContact O-N 2.9Å; Y427-I434 HydrophobicContact CD1-CD1 4.5Å; Y427-I434 HydrophobicContact CD1-CG1 4.44Å; Y427-I434 HydrophobicContact CE1-CG1 4.12Å; Y427-W442 AromaticContact CD1-CH2 3.98Å; Y427-W442 HydrophobicContact CD1-CH2 3.98Å; Y427-W442 AromaticContact CD1-CZ3 3.93Å; Y427-W442 HydrophobicContact CD1-CZ3 3.93Å; Y427-W442 AromaticContact CD2-CH2 3.93Å; Y427-W442 HydrophobicContact CD2-CH2 3.93Å; Y427-W442 AromaticContact CE1-CH2 3.9Å; Y427-W442 HydrophobicContact CE1-CH2 3.9Å; Y427-W442 AromaticContact CE1-CZ3 3.99Å; Y427-W442 HydrophobicContact CE1-CZ3 3.99Å; Y427-W442 AromaticContact CE2-CH2 3.83Å; Y427-W442 HydrophobicContact CE2-CH2 3.83Å; Y427-W442 HydrophobicContact CG-CH2 4Å; Y427-W442 HydrophobicContact CG-CZ3 4.28Å; Y427-W442 AromaticContact CZ-CH2 3.81Å; Y427-I472 HydrophobicContact CD2-CD1 3.82Å; Y427-I472 HydrophobicContact CG-CD1 4.45Å; Y427-T475 HydrophobicContact CE2-CG2 4.38Å
428	L	91.9	Very high	89	Confident	13 Å²	13	73 Å²	73	7%	0.068	34%	0.342	C	S	.	.	H	α-helix	trans	-58.2	-44.9	179.4	-76	167.4	0	0	0	112.6	L424 R430 F431 I434 E529 M530	L424-L428 WeakPolarHBondContact O-CG 3.34Å; L424-L428 PolarHBondContact O-N 3.41Å; L428-R430 PolarHBondContact O-N 3.19Å; L428-R430 VanDerWaalsContact O-N 3.09Å; L428-F431 CarbonylContact O-C 3.56Å; L428-F431 PolarHBondContact O-N 3.09Å; L428-I434 HydrophobicContact CD2-CD1 3.73Å; L428-I434 HydrophobicContact CD2-CG1 3.84Å; L428-I434 HydrophobicContact CG-CD1 4.36Å; L428-E529 HydrophobicContact CD1-CG 3.99Å; L428-M530 HydrophobicContact CD1-CG 4.13Å
429	K	90.5	Very high	88.8	Confident	189 Å²	189	71.6 Å²	71.6	82%	0.822	33%	0.334	S	S	*	.	H	α-helix	trans	-57.8	-24.1	175.1	-175.5	170.2	-177.8	172	0	113.5	K425 Y427	K425-K429 VanDerWaalsContact O-CB 3.31Å; K425-K429 WeakPolarHBondContact O-CB 3.36Å; K425-K429 PolarHBondContact O-N 3.46Å; Y427-K429 PolarHBondContact O-N 2.79Å
430	R	88.1	Confident	88.6	Confident	120 Å²	120	71 Å²	71	45%	0.453	33%	0.331	S	S	.	.	H	α-helix	trans	-99.3	-39.9	179.2	-179	177.3	174	-157.5	-5.1	113	W74 M426 Y427 L428	W74-R430 VanDerWaalsContact CE2-NH1 3.33Å; W74-R430 VanDerWaalsContact NE1-NH1 3.17Å; M426-R430 PolarHBondContact O-N 3.22Å; Y427-R430 CarbonylContact O-C 3.58Å; Y427-R430 WeakPolarHBondContact O-CA 3.17Å; Y427-R430 PolarHBondContact O-N 2.85Å; L428-R430 PolarHBondContact O-N 3.19Å; L428-R430 VanDerWaalsContact O-N 3.09Å
431	F	81.5	Confident	88.5	Confident	62 Å²	62	67.7 Å²	67.7	27%	0.272	31%	0.312	S	S	.	.	S	Bend	trans	-119.7	89.9	-175.3	-58.5	-75.3	0	0	0	108.5	Y427 L428 R433 T475	Y427-F431 HydrophobicContact CD1-CB 4.2Å; Y427-F431 HydrophobicContact CD1-CD2 4.14Å; Y427-F431 AromaticContact CD2-CD2 3.55Å; Y427-F431 HydrophobicContact CD2-CD2 3.55Å; Y427-F431 AromaticContact CD2-CE2 3.88Å; Y427-F431 HydrophobicContact CD2-CE2 3.88Å; Y427-F431 HydrophobicContact CE1-CB 3.76Å; Y427-F431 AromaticContact CE1-CD2 3.98Å; Y427-F431 HydrophobicContact CE1-CD2 3.98Å; Y427-F431 HydrophobicContact CE1-CG 4.2Å; Y427-F431 AromaticContact CE2-CD2 3.38Å; Y427-F431 HydrophobicContact CE2-CD2 3.38Å; Y427-F431 AromaticContact CE2-CE2 3.66Å; Y427-F431 HydrophobicContact CE2-CE2 3.66Å; Y427-F431 HydrophobicContact CE2-CG 4.2Å; Y427-F431 AromaticContact CG-CD2 3.93Å; Y427-F431 HydrophobicContact CG-CD2 3.93Å; Y427-F431 AromaticContact CZ-CD2 3.61Å; Y427-F431 AromaticContact CZ-CG 3.97Å; Y427-F431 PolarHBondContact O-N 2.9Å; L428-F431 CarbonylContact O-C 3.56Å; L428-F431 PolarHBondContact O-N 3.09Å; F431-R433 PolarHBondContact O-N 2.92Å; F431-T475 HydrophobicContact CE2-CG2 4.31Å; F431-T475 HydrophobicContact CZ-CG2 4.42Å
432	K	74.7	Confident	88.7	Confident	182 Å²	182	65.8 Å²	65.8	79%	0.791	30%	0.299	S	S	*	.	S	Bend	trans	-58.6	-5.3	-170.9	-62.8	-170.8	175.7	-169.6	0	116.5
433	R	80.9	Confident	88.8	Confident	228 Å²	228	65.4 Å²	65.4	86%	0.86	30%	0.295	S	S	*	.	S	Bend	trans	-146.5	132.9	176.7	-67.3	-172.2	174.6	-176.6	-3.4	109.1	F431	F431-R433 PolarHBondContact O-N 2.92Å
434	I	86.1	Confident	88.8	Confident	26 Å²	26	67.1 Å²	67.1	13%	0.133	30%	0.3	C	S	.	.			trans	-91.3	143	171.6	-52.9	-172	0	0	0	108.7	Y427 L428 V438 L439 W442 M530	Y427-I434 HydrophobicContact CD1-CD1 4.5Å; Y427-I434 HydrophobicContact CD1-CG1 4.44Å; Y427-I434 HydrophobicContact CE1-CG1 4.12Å; L428-I434 HydrophobicContact CD2-CD1 3.73Å; L428-I434 HydrophobicContact CD2-CG1 3.84Å; L428-I434 HydrophobicContact CG-CD1 4.36Å; I434-V438 HydrophobicContact CG2-CB 4.02Å; I434-V438 HydrophobicContact CG2-CG1 4.02Å; I434-L439 HydrophobicContact CG2-CB 4.06Å; I434-W442 HydrophobicContact CD1-CE3 4.26Å; I434-W442 HydrophobicContact CD1-CZ3 4.01Å; I434-W442 HydrophobicContact CG2-CE3 4.49Å; I434-W442 HydrophobicContact CG2-CZ3 4.39Å; I434-M530 HydrophobicContact CD1-CB 3.95Å; I434-M530 HydrophobicContact CD1-CG 3.84Å; I434-M530 HydrophobicContact CD1-SD 4.17Å
435	N	84.9	Confident	88.9	Confident	101 Å²	101	68.4 Å²	68.4	54%	0.54	31%	0.306	S	S	.	.			trans	-70.9	133.8	170.4	178.1	-42.5	0	0	0	109.4	K437 V438 L439	N435-K437 VanDerWaalsContact C-N 3.26Å; N435-K437 PolarHBondContact O-N 2.87Å; N435-K437 VanDerWaalsContact O-N 3.15Å; N435-K437 PolarHBondContact OD1-N 3.29Å; N435-V438 HydrophobicContact CB-CB 4.43Å; N435-V438 HydrophobicContact CB-CG2 4.14Å; N435-V438 WeakPolarHBondContact O-CA 3.22Å; N435-V438 WeakPolarHBondContact O-CB 3.3Å; N435-V438 PolarHBondContact O-N 2.84Å; N435-L439 PolarHBondContact O-N 3.02Å
436	I	86.5	Confident	89.1	Confident	43 Å²	43	65 Å²	65	22%	0.221	29%	0.291	C	S	.	.	H	α-helix	trans	-51.2	-38.6	-177.9	-172.8	58.1	0	0	0	114	V438 L439 K440 Y566 I569 F595	I436-V438 PolarHBondContact O-N 2.75Å; I436-L439 HydrophobicContact CD1-CD2 4.13Å; I436-L439 PolarHBondContact O-N 3.24Å; I436-K440 HydrophobicContact CD1-CG 4.46Å; I436-K440 WeakPolarHBondContact O-CG 3.22Å; I436-K440 PolarHBondContact O-N 2.77Å; I436-Y566 HydrophobicContact CD1-CD1 4.41Å; I436-Y566 HydrophobicContact CD1-CE1 4.19Å; I436-Y566 HydrophobicContact CG1-CE1 4.05Å; I436-I569 HydrophobicContact CD1-CD1 3.83Å; I436-F595 HydrophobicContact CD1-CE2 3.85Å; I436-F595 HydrophobicContact CD1-CZ 3.71Å
437	K	84.8	Confident	89.3	Confident	83 Å²	83	59.5 Å²	59.5	36%	0.361	26%	0.264	S	S	.	.	H	α-helix	trans	-65.9	-37.5	175.6	-72.5	-157.3	168.7	-162.3	0	112.6	N435 S441 D600	N435-K437 VanDerWaalsContact C-N 3.26Å; N435-K437 PolarHBondContact O-N 2.87Å; N435-K437 VanDerWaalsContact O-N 3.15Å; N435-K437 PolarHBondContact OD1-N 3.29Å; K437-S441 VanDerWaalsContact O-CB 3.32Å; K437-S441 WeakPolarHBondContact O-CB 3.46Å; K437-S441 PolarHBondContact O-N 3.09Å; K437-S441 VanDerWaalsContact O-N 3.09Å; K437-D600 IonicContact NZ-OD1 2.73Å; K437-D600 PolarHBondContact NZ-OD1 2.91Å; K437-D600 IonicContact NZ-OD2 3.59Å
438	V	88.6	Confident	89.5	Confident	36 Å²	36	63.2 Å²	63.2	22%	0.218	28%	0.281	C	S	.	.	H	α-helix	trans	-70.1	-42.6	175.5	179.2	0	0	0	0	110.2	I434 N435 I436 S441 W442	I434-V438 HydrophobicContact CG2-CB 4.02Å; I434-V438 HydrophobicContact CG2-CG1 4.02Å; N435-V438 HydrophobicContact CB-CB 4.43Å; N435-V438 HydrophobicContact CB-CG2 4.14Å; N435-V438 WeakPolarHBondContact O-CA 3.22Å; N435-V438 WeakPolarHBondContact O-CB 3.3Å; N435-V438 PolarHBondContact O-N 2.84Å; I436-V438 PolarHBondContact O-N 2.75Å; V438-S441 PolarHBondContact O-N 2.89Å; V438-W442 HydrophobicContact CG1-CD2 3.64Å; V438-W442 VanDerWaalsContact CG1-CE2 3.49Å; V438-W442 HydrophobicContact CG1-CE3 3.88Å; V438-W442 HydrophobicContact CG1-CG 4.28Å; V438-W442 HydrophobicContact CG1-CH2 3.91Å; V438-W442 HydrophobicContact CG1-CZ2 3.65Å; V438-W442 HydrophobicContact CG1-CZ3 4.01Å; V438-W442 WeakPolarHBondContact O-CB 3.36Å; V438-W442 PolarHBondContact O-N 3.41Å
439	L	90.9	Very high	89.7	Confident	7 Å²	7	62.6 Å²	62.6	4%	0.037	28%	0.277	C	S	.	.	H	α-helix	trans	-57.3	-54.9	175.5	-177.4	69.6	0	0	0	111.3	I434 N435 I436 S441 W442 C443 L527 M530 V531 I569	I434-L439 HydrophobicContact CG2-CB 4.06Å; N435-L439 PolarHBondContact O-N 3.02Å; I436-L439 HydrophobicContact CD1-CD2 4.13Å; I436-L439 PolarHBondContact O-N 3.24Å; L439-S441 VanDerWaalsContact C-N 3.27Å; L439-S441 PolarHBondContact O-N 2.84Å; L439-W442 PolarHBondContact O-N 3.41Å; L439-C443 WeakPolarHBondContact O-CB 3.32Å; L439-C443 PolarHBondContact O-N 3.35Å; L439-C443 PolarHBondContact O-SG 2.8Å; L439-L527 HydrophobicContact CD1-CD1 4.14Å; L439-L527 HydrophobicContact CD2-CD1 4.3Å; L439-L527 HydrophobicContact CG-CD1 4.36Å; L439-M530 HydrophobicContact CD1-CB 3.59Å; L439-M530 HydrophobicContact CD1-CE 4.18Å; L439-M530 HydrophobicContact CD1-CG 4.36Å; L439-M530 HydrophobicContact CD1-SD 3.95Å; L439-V531 HydrophobicContact CD2-CG2 3.65Å; L439-I569 HydrophobicContact CD2-CD1 4.06Å
440	K	89.6	Confident	90	Very high	12 Å²	12	53.6 Å²	53.6	5%	0.052	24%	0.238	C	C	.	.	H	α-helix	trans	-53.3	-45.1	175.5	-75.1	-176.2	171.3	-160.5	0	111.8	I436 R444 F595 E599	I436-K440 HydrophobicContact CD1-CG 4.46Å; I436-K440 WeakPolarHBondContact O-CG 3.22Å; I436-K440 PolarHBondContact O-N 2.77Å; K440-R444 VanDerWaalsContact O-CB 3.3Å; K440-R444 WeakPolarHBondContact O-CB 3.42Å; K440-R444 PolarHBondContact O-N 3.13Å; K440-R444 VanDerWaalsContact O-N 3.08Å; K440-F595 HydrophobicContact CD-CD2 4.47Å; K440-F595 HydrophobicContact CD-CE2 4.25Å; K440-F595 HydrophobicContact CD-CZ 4.31Å; K440-F595 WeakPolarHBondContact CD-O 3.35Å; K440-F595 WeakPolarHBondContact CE-O 3.23Å; K440-F595 HydrophobicContact CG-CD1 4.25Å; K440-F595 HydrophobicContact CG-CD2 4.5Å; K440-F595 HydrophobicContact CG-CE1 3.73Å; K440-F595 HydrophobicContact CG-CE2 4.04Å; K440-F595 HydrophobicContact CG-CZ 3.59Å; K440-F595 WeakPolarHBondContact CG-O 3.43Å; K440-F595 PolarHBondContact NZ-O 3.37Å; K440-E599 IonicContact NZ-OE1 2.7Å; K440-E599 PolarHBondContact NZ-OE1 3.14Å
441	S	90.1	Very high	90.4	Very high	39 Å²	39	49.2 Å²	49.2	27%	0.273	23%	0.226	S	C	.	.	H	α-helix	trans	-65.6	-43.8	-179.8	-168.3	0	0	0	0	113.3	K437 V438 L439 Q445	K437-S441 VanDerWaalsContact O-CB 3.32Å; K437-S441 WeakPolarHBondContact O-CB 3.46Å; K437-S441 PolarHBondContact O-N 3.09Å; K437-S441 VanDerWaalsContact O-N 3.09Å; V438-S441 PolarHBondContact O-N 2.89Å; L439-S441 VanDerWaalsContact C-N 3.27Å; L439-S441 PolarHBondContact O-N 2.84Å; S441-Q445 WeakPolarHBondContact O-CB 3.38Å; S441-Q445 WeakPolarHBondContact O-CG 3.33Å; S441-Q445 PolarHBondContact O-N 3.38Å; S441-Q445 PolarHBondContact O-NE2 3.12Å; S441-Q445 PolarHBondContact OG-NE2 3.33Å
442	W	94.4	Very high	91	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-70.8	-40.5	178.6	-71.9	-11.3	0	0	0	112.3	L424 Y427 I434 V438 L439 Q445 I446 I472 G477 V479	L424-W442 HydrophobicContact CD2-CD2 4.1Å; L424-W442 HydrophobicContact CD2-CE3 3.35Å; L424-W442 HydrophobicContact CD2-CH2 4.28Å; L424-W442 HydrophobicContact CD2-CZ3 3.45Å; L424-W442 VanDerWaalsContact CD2-CZ3 3.45Å; Y427-W442 AromaticContact CD1-CH2 3.98Å; Y427-W442 HydrophobicContact CD1-CH2 3.98Å; Y427-W442 AromaticContact CD1-CZ3 3.93Å; Y427-W442 HydrophobicContact CD1-CZ3 3.93Å; Y427-W442 AromaticContact CD2-CH2 3.93Å; Y427-W442 HydrophobicContact CD2-CH2 3.93Å; Y427-W442 AromaticContact CE1-CH2 3.9Å; Y427-W442 HydrophobicContact CE1-CH2 3.9Å; Y427-W442 AromaticContact CE1-CZ3 3.99Å; Y427-W442 HydrophobicContact CE1-CZ3 3.99Å; Y427-W442 AromaticContact CE2-CH2 3.83Å; Y427-W442 HydrophobicContact CE2-CH2 3.83Å; Y427-W442 HydrophobicContact CG-CH2 4Å; Y427-W442 HydrophobicContact CG-CZ3 4.28Å; Y427-W442 AromaticContact CZ-CH2 3.81Å; I434-W442 HydrophobicContact CD1-CE3 4.26Å; I434-W442 HydrophobicContact CD1-CZ3 4.01Å; I434-W442 HydrophobicContact CG2-CE3 4.49Å; I434-W442 HydrophobicContact CG2-CZ3 4.39Å; V438-W442 HydrophobicContact CG1-CD2 3.64Å; V438-W442 VanDerWaalsContact CG1-CE2 3.49Å; V438-W442 HydrophobicContact CG1-CE3 3.88Å; V438-W442 HydrophobicContact CG1-CG 4.28Å; V438-W442 HydrophobicContact CG1-CH2 3.91Å; V438-W442 HydrophobicContact CG1-CZ2 3.65Å; V438-W442 HydrophobicContact CG1-CZ3 4.01Å; V438-W442 WeakPolarHBondContact O-CB 3.36Å; V438-W442 PolarHBondContact O-N 3.41Å; L439-W442 PolarHBondContact O-N 3.41Å; W442-Q445 WeakPolarHBondContact O-CB 3.23Å; W442-Q445 PolarHBondContact O-N 3.16Å; W442-Q445 VanDerWaalsContact O-N 3.14Å; W442-I446 WeakPolarHBondContact O-CG1 3.31Å; W442-I446 PolarHBondContact O-N 3.27Å; W442-I472 HydrophobicContact CH2-CG2 3.96Å; W442-I472 HydrophobicContact CZ2-CG2 3.83Å; W442-I472 HydrophobicContact CZ3-CG2 4.48Å; W442-G477 PolarHBondContact NE1-O 3.45Å; W442-V479 HydrophobicContact CB-CG1 4.11Å; W442-V479 HydrophobicContact CB-CG2 4.03Å; W442-V479 HydrophobicContact CD2-CG1 3.94Å; W442-V479 HydrophobicContact CG-CG1 3.69Å; W442-V479 HydrophobicContact CG-CG2 4.24Å; W442-V479 WeakPolarHBondContact O-CG2 3.28Å
443	C	95.6	Very high	91.9	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64	-46.4	177.8	-63.6	0	0	0	0	111.9	L439 Q445 I446 L447 F523 M530 F596	L439-C443 WeakPolarHBondContact O-CB 3.32Å; L439-C443 PolarHBondContact O-N 3.35Å; L439-C443 PolarHBondContact O-SG 2.8Å; C443-Q445 PolarHBondContact O-N 2.63Å; C443-I446 PolarHBondContact O-N 3.35Å; C443-I446 VanDerWaalsContact O-N 3.16Å; C443-L447 WeakPolarHBondContact O-CG 3.39Å; C443-L447 PolarHBondContact O-N 2.84Å; C443-F523 HydrophobicContact CB-CE2 4.07Å; C443-F523 HydrophobicContact CB-CZ 4.08Å; C443-M530 VanDerWaalsContact SG-CE 3.51Å; C443-F596 HydrophobicContact CB-CD1 3.87Å; C443-F596 HydrophobicContact CB-CE1 3.26Å; C443-F596 HydrophobicContact CB-CZ 4.1Å
444	R	93.8	Very high	92.4	Very high	50 Å²	50	29.4 Å²	29.4	19%	0.189	15%	0.146	C	C	.	.	H	α-helix	trans	-56.4	-35.8	171.9	174.3	173.5	54.4	-121	1.5	112.6	K440 K448 F596	K440-R444 VanDerWaalsContact O-CB 3.3Å; K440-R444 WeakPolarHBondContact O-CB 3.42Å; K440-R444 PolarHBondContact O-N 3.13Å; K440-R444 VanDerWaalsContact O-N 3.08Å; R444-K448 WeakPolarHBondContact O-CG 3.42Å; R444-K448 PolarHBondContact O-N 2.84Å; R444-F596 HydrophobicContact CB-CB 4.48Å; R444-F596 WeakPolarHBondContact CD-O 3.36Å; R444-F596 PolarHBondContact NH1-O 3.25Å
445	Q	95.5	Very high	92.7	Very high	27 Å²	27	31.1 Å²	31.1	13%	0.126	16%	0.158	C	C	.	.	H	α-helix	trans	-72.8	-38.7	177	-78.8	174.1	71.3	0	0	113	N392 S441 W442 C443 K448 G449 V479	N392-Q445 VanDerWaalsContact CB-O 3.28Å; N392-Q445 WeakPolarHBondContact CB-O 3.48Å; N392-Q445 WeakPolarHBondContact ND2-CB 3.23Å; N392-Q445 WeakPolarHBondContact ND2-CG 3.49Å; N392-Q445 PolarHBondContact ND2-OE1 2.98Å; S441-Q445 WeakPolarHBondContact O-CB 3.38Å; S441-Q445 WeakPolarHBondContact O-CG 3.33Å; S441-Q445 PolarHBondContact O-N 3.38Å; S441-Q445 PolarHBondContact O-NE2 3.12Å; S441-Q445 PolarHBondContact OG-NE2 3.33Å; W442-Q445 WeakPolarHBondContact O-CB 3.23Å; W442-Q445 PolarHBondContact O-N 3.16Å; W442-Q445 VanDerWaalsContact O-N 3.14Å; C443-Q445 PolarHBondContact O-N 2.63Å; Q445-K448 PolarHBondContact O-N 3.13Å; Q445-G449 PolarHBondContact O-N 2.78Å; Q445-V479 HydrophobicContact CB-CG2 3.48Å; Q445-V479 VanDerWaalsContact CB-CG2 3.48Å; Q445-V479 HydrophobicContact CG-CG2 4.48Å
446	I	97.5	Very high	92.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-63	-47.9	172.3	-63.7	155.5	0	0	0	109.7	L424 W442 C443 K448 G449 L450 L465 I470 V479 I481 F523 M530	L424-I446 HydrophobicContact CD1-CD1 4.12Å; W442-I446 WeakPolarHBondContact O-CG1 3.31Å; W442-I446 PolarHBondContact O-N 3.27Å; C443-I446 PolarHBondContact O-N 3.35Å; C443-I446 VanDerWaalsContact O-N 3.16Å; I446-K448 VanDerWaalsContact C-N 3.32Å; I446-K448 PolarHBondContact O-N 3.23Å; I446-G449 CarbonylContact O-C 3.59Å; I446-G449 WeakPolarHBondContact O-CA 3.29Å; I446-G449 PolarHBondContact O-N 2.72Å; I446-L450 HydrophobicContact CG2-CD1 4.36Å; I446-L450 HydrophobicContact CG2-CG 4.45Å; I446-L450 PolarHBondContact O-N 2.92Å; I446-L465 HydrophobicContact CG2-CD2 4.45Å; I446-I470 HydrophobicContact CD1-CD1 3.93Å; I446-I470 HydrophobicContact CD1-CG2 4.28Å; I446-I470 HydrophobicContact CG1-CD1 4.21Å; I446-I470 HydrophobicContact CG1-CG2 4.12Å; I446-I470 HydrophobicContact CG2-CD1 4.43Å; I446-V479 HydrophobicContact CG1-CG2 4.03Å; I446-I481 HydrophobicContact CG2-CD1 4.08Å; I446-F523 HydrophobicContact CB-CD2 4.33Å; I446-F523 HydrophobicContact CB-CE2 4.35Å; I446-F523 HydrophobicContact CG2-CD2 3.8Å; I446-F523 HydrophobicContact CG2-CE2 4.32Å; I446-M530 HydrophobicContact CD1-CE 4.2Å
447	L	97.4	Very high	92.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.2	-38	177.1	-69.8	169.5	0	0	0	112.6	C443 L450 S451 F523 V587 L590 L591 F596	C443-L447 WeakPolarHBondContact O-CG 3.39Å; C443-L447 PolarHBondContact O-N 2.84Å; L447-L450 PolarHBondContact O-N 3.47Å; L447-S451 VanDerWaalsContact O-CB 3.24Å; L447-S451 WeakPolarHBondContact O-CB 3.41Å; L447-S451 PolarHBondContact O-N 2.67Å; L447-F523 HydrophobicContact CD1-CE1 4.21Å; L447-F523 HydrophobicContact CD1-CE2 4.27Å; L447-F523 HydrophobicContact CD1-CZ 3.72Å; L447-F523 HydrophobicContact CD2-CD1 3.98Å; L447-F523 HydrophobicContact CD2-CD2 4.17Å; L447-F523 HydrophobicContact CD2-CE1 3.81Å; L447-F523 HydrophobicContact CD2-CE2 4Å; L447-F523 HydrophobicContact CD2-CG 4.16Å; L447-F523 HydrophobicContact CD2-CZ 3.82Å; L447-F523 HydrophobicContact CG-CD2 4.33Å; L447-F523 HydrophobicContact CG-CE1 4.17Å; L447-F523 HydrophobicContact CG-CE2 3.75Å; L447-F523 HydrophobicContact CG-CZ 3.66Å; L447-V587 HydrophobicContact CB-CG1 4.34Å; L447-V587 HydrophobicContact CD2-CG1 4.07Å; L447-V587 VanDerWaalsContact O-CG1 3.24Å; L447-V587 WeakPolarHBondContact O-CG1 3.21Å; L447-L590 HydrophobicContact CD1-CB 3.9Å; L447-L590 HydrophobicContact CD2-CB 3.85Å; L447-L590 HydrophobicContact CD2-CD1 3.88Å; L447-L591 HydrophobicContact CB-CD2 3.57Å; L447-L591 HydrophobicContact CB-CG 3.91Å; L447-F596 HydrophobicContact CD1-CD2 3.92Å; L447-F596 HydrophobicContact CD1-CE2 3.94Å; L447-F596 HydrophobicContact CD1-CG 4.21Å; L447-F596 HydrophobicContact CD1-CZ 4.29Å
448	K	96.4	Very high	92.4	Very high	108 Å²	108	35.7 Å²	35.7	47%	0.47	19%	0.185	S	C	.	.	H	α-helix	trans	-64.4	-40.4	170.7	-77.6	-174.3	176.6	-163.7	0	112.4	H390 R444 Q445 I446 F452 L591	H390-K448 PolarHBondContact CE1-O 3.45Å; R444-K448 WeakPolarHBondContact O-CG 3.42Å; R444-K448 PolarHBondContact O-N 2.84Å; Q445-K448 PolarHBondContact O-N 3.13Å; I446-K448 VanDerWaalsContact C-N 3.32Å; I446-K448 PolarHBondContact O-N 3.23Å; K448-F452 WeakPolarHBondContact O-CB 2.99Å; K448-F452 PolarHBondContact O-N 3.45Å; K448-L591 HydrophobicContact CG-CD2 3.95Å
449	G	96.5	Very high	92.3	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59	-50.2	173.3	0	0	0	0	0	112.5	Q445 I446 F452 L453	Q445-G449 PolarHBondContact O-N 2.78Å; I446-G449 CarbonylContact O-C 3.59Å; I446-G449 WeakPolarHBondContact O-CA 3.29Å; I446-G449 PolarHBondContact O-N 2.72Å; G449-F452 WeakPolarHBondContact O-CB 3.18Å; G449-F452 PolarHBondContact O-N 2.78Å; G449-L453 WeakPolarHBondContact O-CG 3.29Å; G449-L453 PolarHBondContact O-N 2.66Å; G449-L453 VanDerWaalsContact O-N 3.17Å
450	L	96.4	Very high	92	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-47.4	176.3	-66	-179.9	0	0	0	111.8	I446 L447 F452 L453 H454 L465 I481 D519 F523 V587	I446-L450 HydrophobicContact CG2-CD1 4.36Å; I446-L450 HydrophobicContact CG2-CG 4.45Å; I446-L450 PolarHBondContact O-N 2.92Å; L447-L450 PolarHBondContact O-N 3.47Å; L450-F452 PolarHBondContact O-N 2.96Å; L450-L453 PolarHBondContact O-N 3.17Å; L450-H454 WeakPolarHBondContact O-CB 3.25Å; L450-H454 PolarHBondContact O-N 2.98Å; L450-H454 PolarHBondContact O-ND1 3.49Å; L450-L465 HydrophobicContact CD1-CD2 3.9Å; L450-L465 HydrophobicContact CD2-CD1 4.49Å; L450-L465 HydrophobicContact CD2-CD2 4.16Å; L450-L465 HydrophobicContact CG-CD2 4.48Å; L450-I481 HydrophobicContact CD2-CD1 4Å; L450-I481 HydrophobicContact CG-CD1 4.11Å; L450-D519 HydrophobicContact CD1-CB 4.23Å; L450-D519 HydrophobicContact CD2-CB 3.97Å; L450-F523 HydrophobicContact CD1-CB 4.25Å; L450-V587 HydrophobicContact CB-CG1 4.17Å; L450-V587 HydrophobicContact CB-CG2 4.2Å; L450-V587 HydrophobicContact CD1-CG2 4.5Å
451	S	95.9	Very high	91.8	Very high	28 Å²	28	38 Å²	38	20%	0.196	20%	0.201	C	C	.	.	H	α-helix	trans	-57.7	-36.4	177.4	-171.7	0	0	0	0	112.6	L447 T455	L447-S451 VanDerWaalsContact O-CB 3.24Å; L447-S451 WeakPolarHBondContact O-CB 3.41Å; L447-S451 PolarHBondContact O-N 2.67Å; S451-T455 WeakPolarHBondContact O-CB 3.22Å; S451-T455 WeakPolarHBondContact O-CG2 3.27Å; S451-T455 PolarHBondContact O-N 3.17Å; S451-T455 PolarHBondContact O-OG1 2.82Å
452	F	95.3	Very high	91.7	Very high	29 Å²	29	36.4 Å²	36.4	13%	0.127	19%	0.189	C	C	.	.	H	α-helix	trans	-64.2	-45.4	172.2	171.3	-95.6	0	0	0	112.3	L388 H390 I393 K448 G449 L450 T455 R456	L388-F452 HydrophobicContact CB-CE1 4.14Å; L388-F452 HydrophobicContact CD2-CE1 3.97Å; L388-F452 HydrophobicContact CD2-CZ 4.29Å; H390-F452 HydrophobicContact CB-CB 4.35Å; H390-F452 HydrophobicContact CB-CD1 3.59Å; H390-F452 HydrophobicContact CB-CD2 3.88Å; H390-F452 HydrophobicContact CB-CE1 3.74Å; H390-F452 HydrophobicContact CB-CE2 4.01Å; H390-F452 HydrophobicContact CB-CG 3.66Å; H390-F452 HydrophobicContact CB-CZ 3.95Å; H390-F452 AromaticContact CD2-CD2 3.85Å; H390-F452 AromaticContact CD2-CG 3.83Å; H390-F452 AromaticContact CG-CG 3.69Å; I393-F452 HydrophobicContact CG1-CD1 4.04Å; I393-F452 HydrophobicContact CG1-CE1 4.45Å; K448-F452 WeakPolarHBondContact O-CB 2.99Å; K448-F452 PolarHBondContact O-N 3.45Å; G449-F452 WeakPolarHBondContact O-CB 3.18Å; G449-F452 PolarHBondContact O-N 2.78Å; L450-F452 PolarHBondContact O-N 2.96Å; F452-T455 PolarHBondContact O-N 3.14Å; F452-T455 PolarHBondContact O-OG1 3.23Å; F452-T455 VanDerWaalsContact O-OG1 3.14Å; F452-R456 PolarHBondContact O-NE 3.34Å; F452-R456 PolarHBondContact O-NH2 3.01Å
453	L	92.6	Very high	91.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-66.8	-46.5	179.3	-62.4	173.8	0	0	0	112.1	L388 I393 G449 L450 T455 R456 V460 L484	L388-L453 HydrophobicContact CD1-CD2 3.7Å; I393-L453 HydrophobicContact CD1-CD1 3.83Å; I393-L453 HydrophobicContact CD1-CD2 4.08Å; I393-L453 HydrophobicContact CD1-CG 3.9Å; I393-L453 HydrophobicContact CG1-CD2 4.46Å; G449-L453 WeakPolarHBondContact O-CG 3.29Å; G449-L453 PolarHBondContact O-N 2.66Å; G449-L453 VanDerWaalsContact O-N 3.17Å; L450-L453 PolarHBondContact O-N 3.17Å; L453-T455 PolarHBondContact O-N 3.18Å; L453-R456 WeakPolarHBondContact O-CB 3.23Å; L453-R456 WeakPolarHBondContact O-CG 3.25Å; L453-R456 PolarHBondContact O-N 3.47Å; L453-R456 VanDerWaalsContact O-N 3.13Å; L453-V460 CarbonylContact C-O 3.59Å; L453-V460 HydrophobicContact CB-CB 4.12Å; L453-V460 HydrophobicContact CB-CG1 4.39Å; L453-V460 VanDerWaalsContact CB-O 3.27Å; L453-V460 WeakPolarHBondContact CB-O 3.37Å; L453-V460 HydrophobicContact CD2-CB 4.32Å; L453-V460 HydrophobicContact CD2-CG1 4.05Å; L453-V460 PolarHBondContact O-N 3.1Å; L453-L484 HydrophobicContact CD1-CD2 4.02Å; L453-L484 HydrophobicContact CD2-CD1 4.02Å
454	H	92.2	Very high	90.6	Very high	27 Å²	27	39.9 Å²	39.9	13%	0.125	20%	0.204	C	C	.	.	H	α-helix	trans	-68.2	-10	177.7	-60.4	163	0	0	0	113.9	L450 V460 E516 D519	L450-H454 WeakPolarHBondContact O-CB 3.25Å; L450-H454 PolarHBondContact O-N 2.98Å; L450-H454 PolarHBondContact O-ND1 3.49Å; H454-V460 PolarHBondContact CD2-O 2.82Å; H454-E516 HydrophobicContact CB-CG 3.86Å; H454-E516 VanDerWaalsContact CD2-CG 3.49Å; H454-E516 WeakPolarHBondContact CD2-CG 3.48Å; H454-D519 IonicContact CD2-OD2 2.75Å; H454-D519 IonicContact CE1-OD2 3.19Å; H454-D519 IonicContact NE2-OD2 3.21Å; H454-D519 PolarHBondContact NE2-OD2 3.4Å
455	T	91.2	Very high	90.5	Very high	61 Å²	61	37.6 Å²	37.6	37%	0.374	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110	18.8	173.6	57.4	0	0	0	0	113.1	S451 F452 L453	S451-T455 WeakPolarHBondContact O-CB 3.22Å; S451-T455 WeakPolarHBondContact O-CG2 3.27Å; S451-T455 PolarHBondContact O-N 3.17Å; S451-T455 PolarHBondContact O-OG1 2.82Å; F452-T455 PolarHBondContact O-N 3.14Å; F452-T455 PolarHBondContact O-OG1 3.23Å; F452-T455 VanDerWaalsContact O-OG1 3.14Å; L453-T455 PolarHBondContact O-N 3.18Å
456	R	88	Confident	90.4	Very high	83 Å²	83	37.3 Å²	37.3	31%	0.313	19%	0.194	S	C	.	.	S	Bend	trans	-77.9	166.5	165.2	-62	-50.1	86.9	-158.1	-7.1	110.4	L388 F452 L453 P458 P459 V460	L388-R456 HydrophobicContact CD2-CG 3.77Å; F452-R456 PolarHBondContact O-NE 3.34Å; F452-R456 PolarHBondContact O-NH2 3.01Å; L453-R456 WeakPolarHBondContact O-CB 3.23Å; L453-R456 WeakPolarHBondContact O-CG 3.25Å; L453-R456 PolarHBondContact O-N 3.47Å; L453-R456 VanDerWaalsContact O-N 3.13Å; R456-P458 VanDerWaalsContact C-C 3.4Å; R456-P458 CarbonylContact C-O 3.56Å; R456-P458 VanDerWaalsContact CB-O 3.22Å; R456-P458 WeakPolarHBondContact CB-O 3.43Å; R456-P458 CarbonylContact O-C 3.59Å; R456-P459 WeakPolarHBondContact O-CA 3.39Å; R456-P459 VanDerWaalsContact O-N 3.14Å; R456-V460 HydrophobicContact CB-CG2 4Å; R456-V460 HydrophobicContact CG-CG2 3.98Å
457	N	79.6	Confident	90.3	Very high	159 Å²	159	37.3 Å²	37.3	85%	0.85	19%	0.194	S	C	*	.	S	Bend	trans	-125.9	105.3	173.7	-64.6	96.3	0	0	0	108.3
458	P	83	Confident	90	Very high	81 Å²	81	40 Å²	40	53%	0.526	21%	0.208	S	C	.	.	S	Bend	cis	-66.4	160.7	-4.9	31.4	-37	0	0	0	112.9	M384 R456	M384-P458 HydrophobicContact CE-CG 3.89Å; M384-P458 HydrophobicContact SD-CG 4.44Å; R456-P458 VanDerWaalsContact C-C 3.4Å; R456-P458 CarbonylContact C-O 3.56Å; R456-P458 VanDerWaalsContact CB-O 3.22Å; R456-P458 WeakPolarHBondContact CB-O 3.43Å; R456-P458 CarbonylContact O-C 3.59Å
459	P	86	Confident	89.8	Confident	64 Å²	64	35.3 Å²	35.3	42%	0.416	19%	0.188	S	C	.	.			trans	-59.3	138.7	174.6	-25	35.3	0	0	0	112.4	R456 E516	R456-P459 WeakPolarHBondContact O-CA 3.39Å; R456-P459 VanDerWaalsContact O-N 3.14Å; P459-E516 VanDerWaalsContact CB-OE1 3.31Å; P459-E516 WeakPolarHBondContact CB-OE1 3.32Å
460	V	84.6	Confident	89.8	Confident	17 Å²	17	35.3 Å²	35.3	10%	0.103	19%	0.188	C	C	.	.			trans	-101.3	109.8	178.4	177	0	0	0	0	109.3	M384 L453 H454 R456	M384-V460 HydrophobicContact SD-CG2 3.84Å; L453-V460 CarbonylContact C-O 3.59Å; L453-V460 HydrophobicContact CB-CB 4.12Å; L453-V460 HydrophobicContact CB-CG1 4.39Å; L453-V460 VanDerWaalsContact CB-O 3.27Å; L453-V460 WeakPolarHBondContact CB-O 3.37Å; L453-V460 HydrophobicContact CD2-CB 4.32Å; L453-V460 HydrophobicContact CD2-CG1 4.05Å; L453-V460 PolarHBondContact O-N 3.1Å; H454-V460 PolarHBondContact CD2-O 2.82Å; R456-V460 HydrophobicContact CB-CG2 4Å; R456-V460 HydrophobicContact CG-CG2 3.98Å
461	I	86.2	Confident	89.8	Confident	23 Å²	23	37.2 Å²	37.2	12%	0.118	20%	0.196	C	C	.	.			trans	-91.1	132.1	173.5	-53.5	164	0	0	0	108.6	R463 Y514 E516 V518	I461-R463 HydrophobicContact CB-CG 4.26Å; I461-R463 HydrophobicContact CG2-CG 3.83Å; I461-Y514 HydrophobicContact CD1-CD2 4.18Å; I461-E516 HydrophobicContact CG1-CG 4.41Å; I461-V518 HydrophobicContact CG2-CG2 3.61Å
462	H	87.4	Confident	89.7	Confident	6 Å²	6	36.1 Å²	36.1	3%	0.028	19%	0.189	C	C	.	.			trans	-77.5	-37.5	-175	-175.4	-69	0	0	0	112.9	D464 L465 I481 G482 L484 D519	H462-D464 VanDerWaalsContact CE1-C 3.43Å; H462-D464 PolarHBondContact CE1-O 3.5Å; H462-D464 VanDerWaalsContact ND1-C 3.28Å; H462-D464 PolarHBondContact ND1-N 3.26Å; H462-D464 PolarHBondContact O-N 3Å; H462-L465 WeakPolarHBondContact ND1-CA 3.48Å; H462-L465 PolarHBondContact ND1-N 2.88Å; H462-L465 VanDerWaalsContact ND1-N 3.1Å; H462-I481 WeakPolarHBondContact CD2-CG2 3.4Å; H462-I481 WeakPolarHBondContact NE2-CG2 3.46Å; H462-G482 PolarHBondContact NE2-O 2.86Å; H462-G482 VanDerWaalsContact NE2-O 3.09Å; H462-L484 HydrophobicContact CB-CD2 4.49Å; H462-L484 VanDerWaalsContact CD2-CD2 3.43Å; H462-L484 WeakPolarHBondContact CD2-CD2 3.5Å; H462-D519 WeakPolarHBondContact CB-OD1 3.41Å; H462-D519 PolarHBondContact N-OD1 3.31Å; H462-D519 PolarHBondContact N-OD2 3.38Å
463	R	83.3	Confident	89.6	Confident	49 Å²	49	37.3 Å²	37.3	19%	0.185	20%	0.198	C	C	.	.	S	Bend	trans	66.1	-26.8	173.5	-44.2	174.7	-152.1	157.6	10.8	116.2	E381 I461 A487 M509 Y514 D519	E381-R463 IonicContact OE1-CZ 3.59Å; E381-R463 IonicContact OE1-NH1 3.5Å; E381-R463 IonicContact OE1-NH2 3.31Å; E381-R463 PolarHBondContact OE1-NH2 2.85Å; I461-R463 HydrophobicContact CB-CG 4.26Å; I461-R463 HydrophobicContact CG2-CG 3.83Å; R463-A487 PolarHBondContact NH1-O 2.97Å; R463-M509 HydrophobicContact CB-SD 4.31Å; R463-M509 WeakPolarHBondContact O-CE 3.44Å; R463-Y514 WeakPolarHBondContact CD-OH 3.19Å; R463-Y514 HydrophobicContact CG-CE2 3.92Å; R463-D519 PolarHBondContact N-OD1 3Å
464	D	84.2	Confident	89.1	Confident	25 Å²	25	38.1 Å²	38.1	13%	0.134	21%	0.207	C	C	.	.			trans	-122.9	36.6	-179.9	-165.1	48.9	0	0	0	113.5	H462 K466 N469 K490	H462-D464 VanDerWaalsContact CE1-C 3.43Å; H462-D464 PolarHBondContact CE1-O 3.5Å; H462-D464 VanDerWaalsContact ND1-C 3.28Å; H462-D464 PolarHBondContact ND1-N 3.26Å; H462-D464 PolarHBondContact O-N 3Å; D464-K466 PolarHBondContact O-N 3.13Å; D464-K466 IonicContact OD1-NZ 2.74Å; D464-K466 PolarHBondContact OD1-NZ 3.47Å; D464-K466 IonicContact OD2-NZ 3.15Å; D464-K466 PolarHBondContact OD2-NZ 3.02Å; D464-N469 PolarHBondContact O-ND2 3.36Å; D464-N469 PolarHBondContact OD2-ND2 3.41Å; D464-K490 HydrophobicContact CB-CD 4.46Å; D464-K490 IonicContact OD1-NZ 3.45Å; D464-K490 PolarHBondContact OD1-NZ 3.11Å; D464-K490 IonicContact OD2-NZ 3.52Å; D464-K490 PolarHBondContact OD2-NZ 2.82Å
465	L	92.1	Very high	88.2	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	22%	0.215	C	C	.	.			trans	-70.6	128.1	-177.5	-171.7	74.4	0	0	0	110.3	I446 L450 H462 I470 I481 A522 F523	I446-L465 HydrophobicContact CG2-CD2 4.45Å; L450-L465 HydrophobicContact CD1-CD2 3.9Å; L450-L465 HydrophobicContact CD2-CD1 4.49Å; L450-L465 HydrophobicContact CD2-CD2 4.16Å; L450-L465 HydrophobicContact CG-CD2 4.48Å; H462-L465 WeakPolarHBondContact ND1-CA 3.48Å; H462-L465 PolarHBondContact ND1-N 2.88Å; H462-L465 VanDerWaalsContact ND1-N 3.1Å; L465-I470 HydrophobicContact CD1-CD1 4Å; L465-I470 HydrophobicContact CD1-CG1 3.99Å; L465-I470 HydrophobicContact CG-CD1 4.37Å; L465-I481 HydrophobicContact CD1-CD1 4.32Å; L465-I481 HydrophobicContact CD1-CG2 3.73Å; L465-A522 HydrophobicContact CB-CB 3.83Å; L465-A522 HydrophobicContact CD2-CB 4.35Å; L465-F523 HydrophobicContact CD2-CB 4.1Å
466	K	92.4	Very high	87.1	Confident	21 Å²	21	41.8 Å²	41.8	9%	0.091	23%	0.231	C	C	.	.	S	Bend	trans	-162.5	163	176.6	52.1	169.1	163.2	-80.5	0	110.5	D464 D468 N469 I470 T501 F504 C526	D464-K466 PolarHBondContact O-N 3.13Å; D464-K466 IonicContact OD1-NZ 2.74Å; D464-K466 PolarHBondContact OD1-NZ 3.47Å; D464-K466 IonicContact OD2-NZ 3.15Å; D464-K466 PolarHBondContact OD2-NZ 3.02Å; K466-D468 HydrophobicContact CD-CB 3.87Å; K466-D468 HydrophobicContact CG-CB 4.19Å; K466-D468 PolarHBondContact O-N 3.23Å; K466-N469 WeakPolarHBondContact CE-OD1 3.4Å; K466-N469 HydrophobicContact CG-CB 4.21Å; K466-N469 PolarHBondContact O-N 3.43Å; K466-I470 WeakPolarHBondContact O-CG1 3.24Å; K466-I470 PolarHBondContact O-N 2.91Å; K466-T501 PolarHBondContact NZ-OG1 3Å; K466-F504 HydrophobicContact CB-CD1 3.96Å; K466-F504 HydrophobicContact CB-CE1 4.08Å; K466-F504 HydrophobicContact CB-CG 4.34Å; K466-C526 WeakPolarHBondContact CA-SG 3.27Å
467	C	94.7	Very high	86.8	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-13.7	176.2	-64.9	0	0	0	0	114.8	L424 K425 E529	L424-C467 HydrophobicContact CB-CB 3.82Å; L424-C467 WeakPolarHBondContact CB-O 3.34Å; L424-C467 PolarHBondContact N-O 2.77Å; L424-C467 VanDerWaalsContact N-O 3.1Å; K425-C467 HydrophobicContact CB-CB 4.05Å; K425-C467 PolarHBondContact N-O 3.39Å; C467-E529 WeakPolarHBondContact CB-OE2 3.48Å; C467-E529 PolarHBondContact SG-OE2 3.21Å
468	D	91.6	Very high	87.4	Confident	58 Å²	58	33.4 Å²	33.4	31%	0.31	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-25.3	172.7	-129.5	-4.3	0	0	0	113.3	T423 K425 K466	T423-D468 WeakPolarHBondContact CG2-O 3.4Å; T423-D468 PolarHBondContact OG1-OD1 2.99Å; K425-D468 HydrophobicContact CB-CB 4.46Å; K425-D468 HydrophobicContact CD-CB 3.79Å; K425-D468 WeakPolarHBondContact CD-OD1 3.4Å; K425-D468 WeakPolarHBondContact CD-OD2 3.26Å; K425-D468 WeakPolarHBondContact CE-OD2 3.3Å; K425-D468 IonicContact NZ-OD2 2.65Å; K425-D468 PolarHBondContact NZ-OD2 3.08Å; K466-D468 HydrophobicContact CD-CB 3.87Å; K466-D468 HydrophobicContact CG-CB 4.19Å; K466-D468 PolarHBondContact O-N 3.23Å
469	N	93.5	Very high	88.1	Confident	9 Å²	9	29.6 Å²	29.6	5%	0.048	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-2.6	-179.3	-65.3	4.5	0	0	0	111.9	D464 K466 F471 G482 D483	D464-N469 PolarHBondContact O-ND2 3.36Å; D464-N469 PolarHBondContact OD2-ND2 3.41Å; K466-N469 WeakPolarHBondContact CE-OD1 3.4Å; K466-N469 HydrophobicContact CG-CB 4.21Å; K466-N469 PolarHBondContact O-N 3.43Å; N469-F471 WeakPolarHBondContact O-CD2 3.48Å; N469-F471 WeakPolarHBondContact O-CE2 3.49Å; N469-G482 PolarHBondContact O-N 3.25Å; N469-D483 HydrophobicContact CB-CB 4.38Å
470	I	96	Very high	88.6	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	112.8	174.3	-57.4	161.4	0	0	0	108.2	T423 L424 I446 L465 K466 V479	T423-I470 CarbonylContact C-O 3.53Å; T423-I470 WeakPolarHBondContact CA-O 3.38Å; L424-I470 HydrophobicContact CD1-CB 3.82Å; L424-I470 HydrophobicContact CD1-CD1 4.11Å; L424-I470 HydrophobicContact CD1-CG2 3.5Å; L424-I470 HydrophobicContact CG-CB 4.22Å; L424-I470 HydrophobicContact CG-CG2 3.94Å; L424-I470 PolarHBondContact N-O 2.91Å; I446-I470 HydrophobicContact CD1-CD1 3.93Å; I446-I470 HydrophobicContact CD1-CG2 4.28Å; I446-I470 HydrophobicContact CG1-CD1 4.21Å; I446-I470 HydrophobicContact CG1-CG2 4.12Å; I446-I470 HydrophobicContact CG2-CD1 4.43Å; L465-I470 HydrophobicContact CD1-CD1 4Å; L465-I470 HydrophobicContact CD1-CG1 3.99Å; L465-I470 HydrophobicContact CG-CD1 4.37Å; K466-I470 WeakPolarHBondContact O-CG1 3.24Å; K466-I470 PolarHBondContact O-N 2.91Å; I470-V479 HydrophobicContact CG2-CB 3.95Å; I470-V479 HydrophobicContact CG2-CG1 4.18Å
471	F	96	Very high	89.1	Confident	39 Å²	39	27 Å²	27	17%	0.171	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	141.8	-175.6	-62.5	-93.1	0	0	0	111.3	V394 M419 G422 T423 N469 V479 K480	V394-F471 HydrophobicContact CG2-CD2 3.79Å; V394-F471 HydrophobicContact CG2-CE2 4.42Å; V394-F471 HydrophobicContact CG2-CG 4.41Å; M419-F471 HydrophobicContact CB-CB 3.78Å; M419-F471 HydrophobicContact CB-CD1 3.41Å; M419-F471 VanDerWaalsContact CB-CD1 3.41Å; M419-F471 HydrophobicContact CB-CE1 4.17Å; M419-F471 HydrophobicContact CB-CG 3.73Å; M419-F471 HydrophobicContact CE-CB 3.56Å; M419-F471 HydrophobicContact CG-CB 3.65Å; M419-F471 HydrophobicContact CG-CD1 3.89Å; M419-F471 HydrophobicContact CG-CD2 4.3Å; M419-F471 HydrophobicContact CG-CG 3.69Å; M419-F471 HydrophobicContact SD-CB 4.35Å; G422-F471 CarbonylContact O-C 3.6Å; G422-F471 WeakPolarHBondContact O-CA 3.19Å; T423-F471 HydrophobicContact CG2-CD1 3.79Å; T423-F471 HydrophobicContact CG2-CE1 3.74Å; T423-F471 HydrophobicContact CG2-CZ 4.42Å; N469-F471 WeakPolarHBondContact O-CD2 3.48Å; N469-F471 WeakPolarHBondContact O-CE2 3.49Å; F471-V479 CarbonylContact O-C 3.53Å; F471-V479 VanDerWaalsContact O-CA 3.26Å; F471-V479 WeakPolarHBondContact O-CA 3.5Å; F471-K480 PolarHBondContact N-O 2.87Å; F471-K480 PolarHBondContact O-N 2.83Å
472	I	94.9	Very high	89.4	Confident	6 Å²	6	26 Å²	26	3%	0.031	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	142.8	170.6	50.1	164.6	0	0	0	110	S421 G422 L424 Y427 W442 V479	S421-I472 VanDerWaalsContact CB-O 3.22Å; S421-I472 WeakPolarHBondContact CB-O 3.39Å; G422-I472 WeakPolarHBondContact O-CG1 3.35Å; G422-I472 PolarHBondContact O-N 3.16Å; L424-I472 HydrophobicContact CD2-CG2 3.96Å; Y427-I472 HydrophobicContact CD2-CD1 3.82Å; Y427-I472 HydrophobicContact CG-CD1 4.45Å; W442-I472 HydrophobicContact CH2-CG2 3.96Å; W442-I472 HydrophobicContact CZ2-CG2 3.83Å; W442-I472 HydrophobicContact CZ3-CG2 4.48Å; I472-V479 HydrophobicContact CG2-CG1 3.72Å
473	T	92.2	Very high	89.2	Confident	54 Å²	54	27.9 Å²	27.9	33%	0.331	16%	0.163	S	C	.	.	S	Bend	trans	-80.2	-27.2	169.1	53.2	0	0	0	0	112	M419 S421 S478 K480	M419-T473 HydrophobicContact CE-CG2 3.91Å; S421-T473 VanDerWaalsContact CB-O 3.26Å; S421-T473 WeakPolarHBondContact CB-O 3.34Å; S421-T473 PolarHBondContact OG-O 3.26Å; T473-S478 VanDerWaalsContact CG2-OG 3.31Å; T473-S478 WeakPolarHBondContact CG2-OG 3.33Å; T473-S478 PolarHBondContact N-O 3.43Å; T473-S478 PolarHBondContact OG1-N 3.17Å; T473-S478 PolarHBondContact OG1-O 2.93Å; T473-S478 VanDerWaalsContact OG1-O 3.11Å; T473-S478 PolarHBondContact OG1-OG 2.98Å; T473-K480 HydrophobicContact CG2-CD 4.14Å
474	G	81.4	Confident	88.8	Confident	17 Å²	17	26.7 Å²	26.7	18%	0.175	16%	0.161	C	C	.	.	S	Bend	trans	-174	173.9	175.1	0	0	0	0	0	112.3	T476 G477	G474-T476 PolarHBondContact O-N 3.45Å; G474-T476 VanDerWaalsContact O-N 3.14Å; G474-G477 PolarHBondContact O-N 2.95Å
475	T	73.2	Confident	87.5	Confident	48 Å²	48	25.7 Å²	25.7	29%	0.294	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-20.2	-175.6	50.8	0	0	0	0	114.7	Y427 F431	Y427-T475 HydrophobicContact CE2-CG2 4.38Å; F431-T475 HydrophobicContact CE2-CG2 4.31Å; F431-T475 HydrophobicContact CZ-CG2 4.42Å
476	T	69.3	Low	85.8	Confident	117 Å²	117	27.3 Å²	27.3	72%	0.718	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-125.9	21.5	172.3	58.6	0	0	0	0	110.8	G474	G474-T476 PolarHBondContact O-N 3.45Å; G474-T476 VanDerWaalsContact O-N 3.14Å
477	G	80.4	Confident	83.8	Confident	25 Å²	25	26.9 Å²	26.9	26%	0.258	17%	0.165	S	C	.	.	S	Bend	trans	-94.5	-170.5	-172.5	0	0	0	0	0	113.7	W442 G474	W442-G477 PolarHBondContact NE1-O 3.45Å; G474-G477 PolarHBondContact O-N 2.95Å
478	S	93.2	Very high	81.5	Confident	40 Å²	40	28.1 Å²	28.1	28%	0.28	17%	0.172	S	C	.	.			trans	-75.5	164.8	169.8	51.4	0	0	0	0	113.1	T473	T473-S478 VanDerWaalsContact CG2-OG 3.31Å; T473-S478 WeakPolarHBondContact CG2-OG 3.33Å; T473-S478 PolarHBondContact N-O 3.43Å; T473-S478 PolarHBondContact OG1-N 3.17Å; T473-S478 PolarHBondContact OG1-O 2.93Å; T473-S478 VanDerWaalsContact OG1-O 3.11Å; T473-S478 PolarHBondContact OG1-OG 2.98Å
479	V	96.8	Very high	79.4	Confident	2 Å²	2	27.1 Å²	27.1	1%	0.012	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	148.1	166.2	-75.7	0	0	0	0	111.3	N392 L424 W442 Q445 I446 I470 F471 I472	N392-V479 WeakPolarHBondContact CA-O 3.24Å; N392-V479 WeakPolarHBondContact CB-O 2.97Å; N392-V479 PolarHBondContact ND2-O 2.64Å; L424-V479 HydrophobicContact CD2-CG1 4.1Å; L424-V479 HydrophobicContact CG-CG1 4.4Å; W442-V479 HydrophobicContact CB-CG1 4.11Å; W442-V479 HydrophobicContact CB-CG2 4.03Å; W442-V479 HydrophobicContact CD2-CG1 3.94Å; W442-V479 HydrophobicContact CG-CG1 3.69Å; W442-V479 HydrophobicContact CG-CG2 4.24Å; W442-V479 WeakPolarHBondContact O-CG2 3.28Å; Q445-V479 HydrophobicContact CB-CG2 3.48Å; Q445-V479 VanDerWaalsContact CB-CG2 3.48Å; Q445-V479 HydrophobicContact CG-CG2 4.48Å; I446-V479 HydrophobicContact CG1-CG2 4.03Å; I470-V479 HydrophobicContact CG2-CB 3.95Å; I470-V479 HydrophobicContact CG2-CG1 4.18Å; F471-V479 CarbonylContact O-C 3.53Å; F471-V479 VanDerWaalsContact O-CA 3.26Å; F471-V479 WeakPolarHBondContact O-CA 3.5Å; I472-V479 HydrophobicContact CG2-CG1 3.72Å
480	K	97.4	Very high	77.2	Confident	24 Å²	24	29.9 Å²	29.9	10%	0.104	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	129.1	178	-79.7	168.7	162.7	-91.2	0	110.2	P391 N392 I393 V394 E417 M419 F471 T473	P391-K480 WeakPolarHBondContact O-CE 3.36Å; P391-K480 WeakPolarHBondContact O-CG 3.44Å; N392-K480 CarbonylContact O-C 3.51Å; N392-K480 WeakPolarHBondContact O-CA 3.2Å; I393-K480 PolarHBondContact O-NZ 3.04Å; V394-K480 HydrophobicContact CG2-CB 3.73Å; E417-K480 WeakPolarHBondContact OE1-CD 3.42Å; E417-K480 WeakPolarHBondContact OE1-CE 3.4Å; E417-K480 IonicContact OE1-NZ 3.55Å; E417-K480 PolarHBondContact OE1-NZ 3.2Å; E417-K480 IonicContact OE2-NZ 3.79Å; E417-K480 PolarHBondContact OE2-NZ 3.14Å; M419-K480 HydrophobicContact CE-CB 4.18Å; M419-K480 HydrophobicContact CE-CD 3.85Å; M419-K480 HydrophobicContact SD-CD 3.85Å; F471-K480 PolarHBondContact N-O 2.87Å; F471-K480 PolarHBondContact O-N 2.83Å; T473-K480 HydrophobicContact CG2-CD 4.14Å
481	I	96.1	Very high	74.8	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	129.7	174.6	-48.7	175.4	0	0	0	108.8	N392 I393 V394 I446 L450 H462 L465	N392-I481 PolarHBondContact O-N 2.86Å; I393-I481 CarbonylContact C-O 3.47Å; I393-I481 WeakPolarHBondContact CA-O 3.44Å; I393-I481 HydrophobicContact CD1-CB 3.98Å; I393-I481 HydrophobicContact CD1-CD1 4.27Å; I393-I481 HydrophobicContact CD1-CG1 4.42Å; V394-I481 PolarHBondContact N-O 2.86Å; I446-I481 HydrophobicContact CG2-CD1 4.08Å; L450-I481 HydrophobicContact CD2-CD1 4Å; L450-I481 HydrophobicContact CG-CD1 4.11Å; H462-I481 WeakPolarHBondContact CD2-CG2 3.4Å; H462-I481 WeakPolarHBondContact NE2-CG2 3.46Å; L465-I481 HydrophobicContact CD1-CD1 4.32Å; L465-I481 HydrophobicContact CD1-CG2 3.73Å
482	G	91.8	Very high	72.2	Confident	2 Å²	2	37.9 Å²	37.9	2%	0.021	22%	0.217	C	C	.	.			trans	-133.4	-169.1	-179.7	0	0	0	0	0	113.1	H462 N469 L484	H462-G482 PolarHBondContact NE2-O 2.86Å; H462-G482 VanDerWaalsContact NE2-O 3.09Å; N469-G482 PolarHBondContact O-N 3.25Å; G482-L484 PolarHBondContact O-N 3.31Å
483	D	83.8	Confident	69.5	Low	47 Å²	47	39.2 Å²	39.2	25%	0.251	23%	0.226	S	C	.	.			trans	63	15.4	-171.8	-87.8	26.1	0	0	0	115.8	K346 N469 L486	K346-D483 IonicContact NZ-OD1 2.71Å; K346-D483 PolarHBondContact NZ-OD1 3.11Å; K346-D483 IonicContact NZ-OD2 3.57Å; K346-D483 PolarHBondContact NZ-OD2 2.91Å; N469-D483 HydrophobicContact CB-CB 4.38Å; D483-L486 HydrophobicContact CB-CD1 4.45Å
484	L	73.3	Confident	66.6	Low	24 Å²	24	44.6 Å²	44.6	13%	0.126	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	146.1	163.1	-64	174.9	0	0	0	111.3	L385 L388 I393 L453 H462 G482 L486	L385-L484 HydrophobicContact CD1-CB 4.45Å; L385-L484 HydrophobicContact CD2-CB 3.84Å; L385-L484 HydrophobicContact CD2-CD1 4.34Å; L388-L484 HydrophobicContact CD1-CD1 4.15Å; I393-L484 HydrophobicContact CG2-CD1 3.66Å; L453-L484 HydrophobicContact CD1-CD2 4.02Å; L453-L484 HydrophobicContact CD2-CD1 4.02Å; H462-L484 HydrophobicContact CB-CD2 4.49Å; H462-L484 VanDerWaalsContact CD2-CD2 3.43Å; H462-L484 WeakPolarHBondContact CD2-CD2 3.5Å; G482-L484 PolarHBondContact O-N 3.31Å; L484-L486 VanDerWaalsContact C-N 3.33Å; L484-L486 PolarHBondContact O-N 3.11Å
485	G	57	Low	64.3	Low	4 Å²	4	48.9 Å²	48.9	4%	0.041	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	-11.7	-179.7	0	0	0	0	0	115.9	F378 A487	F378-G485 WeakPolarHBondContact CE2-O 3.42Å; G485-A487 PolarHBondContact O-N 2.94Å
486	L	57	Low	62.5	Low	36 Å²	36	56.7 Å²	56.7	19%	0.188	31%	0.309	C	S	.	.	S	Bend	trans	-81.1	-2.1	163.9	-54.6	-176.7	0	0	0	112.2	K346 L365 D483 L484 L489 K490	K346-L486 HydrophobicContact CD-CD1 3.93Å; L365-L486 HydrophobicContact CD1-CD2 3.6Å; L365-L486 HydrophobicContact CD2-CD2 3.8Å; L365-L486 HydrophobicContact CG-CD2 4.37Å; D483-L486 HydrophobicContact CB-CD1 4.45Å; L484-L486 VanDerWaalsContact C-N 3.33Å; L484-L486 PolarHBondContact O-N 3.11Å; L486-L489 HydrophobicContact CD2-CD1 4.17Å; L486-L489 PolarHBondContact O-N 3.14Å; L486-K490 PolarHBondContact O-N 3.42Å
487	A	51.1	Low	60.8	Low	11 Å²	11	54.8 Å²	54.8	9%	0.091	30%	0.301	C	S	.	.	H	α-helix	trans	-67.2	-49.8	-174.2	0	0	0	0	0	112.7	R463 G485 L489 K490 N491	R463-A487 PolarHBondContact NH1-O 2.97Å; G485-A487 PolarHBondContact O-N 2.94Å; A487-L489 VanDerWaalsContact C-N 3.31Å; A487-L489 PolarHBondContact O-N 2.88Å; A487-K490 PolarHBondContact O-N 2.89Å; A487-N491 PolarHBondContact O-OD1 3.41Å
488	T	46.5	Very low	58.6	Low	26 Å²	26	58.1 Å²	58.1	16%	0.16	32%	0.316	C	S	.	.	H	α-helix	trans	-55.6	-45.5	171	21	0	0	0	0	112.6	R377 E381 K490 N491	R377-T488 HydrophobicContact CB-CG2 4.07Å; E381-T488 HydrophobicContact CG-CG2 4.01Å; E381-T488 WeakPolarHBondContact OE1-CG2 3.41Å; E381-T488 VanDerWaalsContact OE2-CB 3.23Å; E381-T488 WeakPolarHBondContact OE2-CB 3.16Å; E381-T488 VanDerWaalsContact OE2-CG2 3.27Å; E381-T488 WeakPolarHBondContact OE2-CG2 3.31Å; E381-T488 PolarHBondContact OE2-N 3Å; E381-T488 VanDerWaalsContact OE2-N 3.16Å; E381-T488 PolarHBondContact OE2-OG1 3.06Å; T488-K490 PolarHBondContact O-N 3.3Å; T488-N491 WeakPolarHBondContact O-CB 3.48Å; T488-N491 PolarHBondContact O-N 2.97Å; T488-N491 VanDerWaalsContact O-N 3.11Å
489	L	46	Very low	56.3	Low	37 Å²	37	58.7 Å²	58.7	19%	0.194	32%	0.315	C	S	.	.	H	α-helix	trans	-65.9	-24.8	-171.4	-55	-178.1	0	0	0	112.6	L365 L370 F378 L486 A487	L365-L489 HydrophobicContact CD1-CD1 3.53Å; L370-L489 HydrophobicContact CD1-CD2 3.8Å; L370-L489 HydrophobicContact CD2-CD2 3.74Å; L370-L489 HydrophobicContact CG-CD2 4.45Å; F378-L489 HydrophobicContact CB-CD2 4.04Å; F378-L489 HydrophobicContact CD2-CD1 3.78Å; F378-L489 HydrophobicContact CD2-CD2 3.61Å; F378-L489 HydrophobicContact CD2-CG 3.73Å; F378-L489 HydrophobicContact CE2-CD1 3.86Å; F378-L489 HydrophobicContact CE2-CG 4.27Å; F378-L489 HydrophobicContact CG-CD2 4.08Å; L486-L489 HydrophobicContact CD2-CD1 4.17Å; L486-L489 PolarHBondContact O-N 3.14Å; A487-L489 VanDerWaalsContact C-N 3.31Å; A487-L489 PolarHBondContact O-N 2.88Å
490	K	48.5	Very low	54	Low	68 Å²	68	59.7 Å²	59.7	30%	0.296	33%	0.326	S	S	.	.	H	α-helix	trans	-73	-24.8	175.6	-82.5	-174.7	159.7	-176.9	0	114.2	D464 L486 A487 T488 K492	D464-K490 HydrophobicContact CB-CD 4.46Å; D464-K490 IonicContact OD1-NZ 3.45Å; D464-K490 PolarHBondContact OD1-NZ 3.11Å; D464-K490 IonicContact OD2-NZ 3.52Å; D464-K490 PolarHBondContact OD2-NZ 2.82Å; L486-K490 PolarHBondContact O-N 3.42Å; A487-K490 PolarHBondContact O-N 2.89Å; T488-K490 PolarHBondContact O-N 3.3Å; K490-K492 PolarHBondContact O-N 2.8Å
491	N	46	Very low	51.7	Low	75 Å²	75	60 Å²	60	40%	0.401	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-7	-171.9	-69.2	21.2	0	0	0	114.7	A487 T488 Y514	A487-N491 PolarHBondContact O-OD1 3.41Å; T488-N491 WeakPolarHBondContact O-CB 3.48Å; T488-N491 PolarHBondContact O-N 2.97Å; T488-N491 VanDerWaalsContact O-N 3.11Å; N491-Y514 PolarHBondContact ND2-OH 3.37Å; N491-Y514 PolarHBondContact OD1-OH 3.03Å
492	K	40.5	Very low	49.8	Very low	132 Å²	132	60.4 Å²	60.4	57%	0.574	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142	0	-168.9	-87.8	-168	175.6	-169.5	0	119.4	E374 K490 F494	E374-K492 HydrophobicContact CG-CD 4.18Å; E374-K492 WeakPolarHBondContact OE1-CD 3.44Å; E374-K492 IonicContact OE1-NZ 3.71Å; E374-K492 PolarHBondContact OE1-NZ 3.48Å; K490-K492 PolarHBondContact O-N 2.8Å; K492-F494 PolarHBondContact O-N 2.89Å
493	S	37.2	Very low	48.2	Very low	33 Å²	33	61.5 Å²	61.5	23%	0.231	34%	0.337	C	S	.	.	S	Bend	trans	-78.3	42.3	-171.9	64.6	0	0	0	0	116.1	I499	S493-I499 WeakPolarHBondContact O-CD1 3.49Å; S493-I499 WeakPolarHBondContact OG-CD1 3.43Å
494	F	32.4	Very low	47.1	Very low	167 Å²	167	59.7 Å²	59.7	73%	0.732	33%	0.327	S	S	*	.			trans	68.9	94.2	170	-74.1	-113.5	0	0	0	117.7	K492 K496 S497	K492-F494 PolarHBondContact O-N 2.89Å; F494-K496 PolarHBondContact O-N 2.76Å; F494-S497 PolarHBondContact O-N 2.81Å
495	A	32	Very low	46.6	Very low	108 Å²	108	59.4 Å²	59.4	89%	0.893	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn		31.5	15.6	115.3	0	0	0	0	0	122.4
496	K	36.6	Very low	46.5	Very low	211 Å²	211	59.2 Å²	59.2	92%	0.917	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-163.7	-22.6	177	-125.4	166.2	-173.4	169.3	0	114.8	F494	F494-K496 PolarHBondContact O-N 2.76Å
497	S	33.2	Very low	46.6	Very low	78 Å²	78	58.3 Å²	58.3	55%	0.545	32%	0.32	S	S	.	.	S	Bend	trans	-101.1	138.1	168.4	48.7	0	0	0	0	110.5	F494 I499	F494-S497 PolarHBondContact O-N 2.81Å; S497-I499 VanDerWaalsContact O-CD1 3.31Å; S497-I499 WeakPolarHBondContact O-CD1 3.4Å; S497-I499 WeakPolarHBondContact O-CG1 3.41Å; S497-I499 PolarHBondContact O-N 3.38Å
498	V	33.7	Very low	47.2	Very low	94 Å²	94	58.7 Å²	58.7	57%	0.57	32%	0.32	S	S	*	.			trans	-56.8	116.5	-176.3	-179.2	0	0	0	0	110.5	P502 P543	V498-P502 HydrophobicContact CG1-CG 3.97Å; V498-P543 HydrophobicContact CB-CG 4.38Å; V498-P543 HydrophobicContact CG1-CB 4.05Å; V498-P543 HydrophobicContact CG1-CG 3.76Å; V498-P543 HydrophobicContact CG2-CB 3.96Å; V498-P543 HydrophobicContact CG2-CG 3.71Å
499	I	46.6	Very low	47.6	Very low	53 Å²	53	58.9 Å²	58.9	27%	0.272	32%	0.319	S	S	.	.			trans	-127.9	140.7	-177.5	-75.6	150.4	0	0	0	108.6	S493 S497 M505	S493-I499 WeakPolarHBondContact O-CD1 3.49Å; S493-I499 WeakPolarHBondContact OG-CD1 3.43Å; S497-I499 VanDerWaalsContact O-CD1 3.31Å; S497-I499 WeakPolarHBondContact O-CD1 3.4Å; S497-I499 WeakPolarHBondContact O-CG1 3.41Å; S497-I499 PolarHBondContact O-N 3.38Å; I499-M505 VanDerWaalsContact O-SD 3.39Å
500	G	48.4	Very low	47.8	Very low	23 Å²	23	61.3 Å²	61.3	24%	0.237	33%	0.326	C	S	.	.	S	Bend	trans	78.4	174.5	-155.5	0	0	0	0	0	111.2
501	T	48.5	Very low	48.1	Very low	30 Å²	30	64.6 Å²	64.6	18%	0.184	34%	0.343	C	S	.	.			trans	-106.5	96.2	175.1	-61.1	0	0	0	0	105.2	K466 E503 F504 M505 Y535	K466-T501 PolarHBondContact NZ-OG1 3Å; T501-E503 VanDerWaalsContact CG2-OE2 3.23Å; T501-E503 WeakPolarHBondContact CG2-OE2 3.29Å; T501-E503 PolarHBondContact O-N 3.46Å; T501-F504 HydrophobicContact CG2-CD2 3.82Å; T501-F504 HydrophobicContact CG2-CE2 4.42Å; T501-F504 PolarHBondContact O-N 2.88Å; T501-M505 PolarHBondContact O-N 2.94Å; T501-Y535 WeakPolarHBondContact CG2-OH 3.42Å
502	P	55.9	Low	48.5	Very low	10 Å²	10	68.9 Å²	68.9	7%	0.065	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-17.8	-156.1	24.9	-33.5	0	0	0	113.7	V498 F504 M505 P543 I546	V498-P502 HydrophobicContact CG1-CG 3.97Å; P502-F504 PolarHBondContact O-N 2.84Å; P502-M505 HydrophobicContact CB-SD 4.49Å; P502-P543 HydrophobicContact CB-CB 4.13Å; P502-P543 HydrophobicContact CG-CB 3.72Å; P502-P543 HydrophobicContact CG-CG 3.72Å; P502-I546 HydrophobicContact CB-CG2 4.44Å; P502-I546 HydrophobicContact CG-CD1 4.29Å; P502-I546 WeakPolarHBondContact O-CG2 3.4Å
503	E	58.9	Low	49.2	Very low	25 Å²	25	69.5 Å²	69.5	12%	0.117	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-14.6	174.6	-47.8	80	-163.8	0	0	113.2	T501 Y535 P536 Y537 I546	T501-E503 VanDerWaalsContact CG2-OE2 3.23Å; T501-E503 WeakPolarHBondContact CG2-OE2 3.29Å; T501-E503 PolarHBondContact O-N 3.46Å; E503-Y535 HydrophobicContact CB-CE1 4.07Å; E503-Y535 HydrophobicContact CG-CD1 4.43Å; E503-Y535 HydrophobicContact CG-CE1 3.63Å; E503-Y535 PolarHBondContact OE2-OH 2.83Å; E503-P536 HydrophobicContact CB-CB 4.46Å; E503-P536 WeakPolarHBondContact CB-O 3.4Å; E503-P536 WeakPolarHBondContact CG-O 3.47Å; E503-Y537 HydrophobicContact CB-CD2 4.26Å; E503-I546 HydrophobicContact CG-CD1 3.64Å; E503-I546 HydrophobicContact CG-CG1 4.41Å; E503-I546 HydrophobicContact CG-CG2 4.36Å; E503-I546 VanDerWaalsContact OE1-CD1 3.22Å; E503-I546 WeakPolarHBondContact OE1-CD1 3.35Å
504	F	59.2	Low	50.6	Low	8 Å²	8	70.4 Å²	70.4	4%	0.035	37%	0.366	C	S	.	.	S	Bend	trans	-114.5	-0.7	-179.3	-68.9	-107.2	0	0	0	112.6	K466 T501 P502 M525 E529 Y535 P536	K466-F504 HydrophobicContact CB-CD1 3.96Å; K466-F504 HydrophobicContact CB-CE1 4.08Å; K466-F504 HydrophobicContact CB-CG 4.34Å; T501-F504 HydrophobicContact CG2-CD2 3.82Å; T501-F504 HydrophobicContact CG2-CE2 4.42Å; T501-F504 PolarHBondContact O-N 2.88Å; P502-F504 PolarHBondContact O-N 2.84Å; F504-M525 HydrophobicContact CD1-CB 3.62Å; F504-M525 HydrophobicContact CE1-CB 3.84Å; F504-M525 HydrophobicContact CG-CB 4.22Å; F504-E529 WeakPolarHBondContact CZ-OE2 3.42Å; F504-Y535 HydrophobicContact CE2-CD2 4.27Å; F504-Y535 AromaticContact CE2-CE2 3.61Å; F504-Y535 HydrophobicContact CE2-CE2 3.61Å; F504-Y535 AromaticContact CE2-CZ 3.78Å; F504-Y535 HydrophobicContact CZ-CE2 4.23Å; F504-P536 HydrophobicContact CE2-CG 4.29Å; F504-P536 HydrophobicContact CZ-CG 4.04Å
505	M	62.8	Low	53	Low	18 Å²	18	64.3 Å²	64.3	9%	0.089	34%	0.341	C	S	.	.			trans	-86.1	127.2	-178.9	-65.3	178.8	67.8	0	0	110.8	I499 T501 P502 M509 Y510 Y521	I499-M505 VanDerWaalsContact O-SD 3.39Å; T501-M505 PolarHBondContact O-N 2.94Å; P502-M505 HydrophobicContact CB-SD 4.49Å; M505-M509 HydrophobicContact CB-CE 4.13Å; M505-M509 HydrophobicContact CE-CG 4.25Å; M505-M509 HydrophobicContact CG-CE 4.09Å; M505-Y510 HydrophobicContact CB-CE2 4.01Å; M505-Y510 HydrophobicContact CE-CE1 4.03Å; M505-Y510 HydrophobicContact CE-CE2 4.06Å; M505-Y521 WeakPolarHBondContact O-CE1 3.22Å
506	A	55.2	Low	55.6	Low	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.313	C	S	.	.			trans	-67.6	150.8	169.5	0	0	0	0	0	111	E508 M509 V518 Y521	A506-E508 VanDerWaalsContact C-N 3.32Å; A506-E508 WeakPolarHBondContact CB-OE1 3.42Å; A506-E508 WeakPolarHBondContact CB-OE2 3.38Å; A506-E508 PolarHBondContact O-N 3.42Å; A506-M509 WeakPolarHBondContact O-CB 3.3Å; A506-M509 PolarHBondContact O-N 3.48Å; A506-M509 VanDerWaalsContact O-N 3.1Å; A506-V518 HydrophobicContact CB-CB 4.4Å; A506-V518 HydrophobicContact CB-CG1 4.21Å; A506-Y521 HydrophobicContact CB-CD1 3.89Å; A506-Y521 HydrophobicContact CB-CD2 4.2Å; A506-Y521 HydrophobicContact CB-CG 3.72Å
507	P	60.2	Low	58.2	Low	18 Å²	18	53 Å²	53	12%	0.117	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-59.5	-36.8	-175.3	21.3	-31.7	0	0	0	113.9	M509 Y510 V550 I551 V579	P507-M509 VanDerWaalsContact C-N 3.29Å; P507-M509 PolarHBondContact O-N 2.98Å; P507-Y510 WeakPolarHBondContact O-CD2 3.27Å; P507-Y510 PolarHBondContact O-N 2.87Å; P507-V550 HydrophobicContact CB-CG1 4.07Å; P507-V550 HydrophobicContact CG-CG1 4.28Å; P507-I551 HydrophobicContact CB-CG2 4.21Å; P507-V579 HydrophobicContact CG-CG1 4.16Å; P507-V579 WeakPolarHBondContact CG-O 3.47Å
508	E	63.9	Low	60.9	Low	18 Å²	18	49.3 Å²	49.3	8%	0.084	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-73.2	-16	178.5	72.7	-72.2	173	0	0	113.7	A506 Y510 E511 V518 R584	A506-E508 VanDerWaalsContact C-N 3.32Å; A506-E508 WeakPolarHBondContact CB-OE1 3.42Å; A506-E508 WeakPolarHBondContact CB-OE2 3.38Å; A506-E508 PolarHBondContact O-N 3.42Å; E508-Y510 PolarHBondContact O-N 3.29Å; E508-E511 PolarHBondContact O-N 3.08Å; E508-V518 HydrophobicContact CG-CG1 4.41Å; E508-V518 WeakPolarHBondContact OE1-CG1 3.28Å; E508-R584 IonicContact OE1-CZ 3.96Å; E508-R584 IonicContact OE1-NH1 2.82Å; E508-R584 PolarHBondContact OE1-NH1 2.81Å; E508-R584 IonicContact OE1-NH2 2.78Å; E508-R584 PolarHBondContact OE1-NH2 2.69Å; E508-R584 IonicContact OE2-CZ 2.73Å; E508-R584 IonicContact OE2-NH1 3.48Å; E508-R584 IonicContact OE2-NH2 2.79Å; E508-R584 PolarHBondContact OE2-NH2 2.93Å
509	M	53.5	Low	63.7	Low	31 Å²	31	44.9 Å²	44.9	15%	0.153	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-70.1	-2	175.8	-168.3	147.4	50.9	0	0	112.8	R463 M505 A506 P507 Y514 V518	R463-M509 HydrophobicContact CB-SD 4.31Å; R463-M509 WeakPolarHBondContact O-CE 3.44Å; M505-M509 HydrophobicContact CB-CE 4.13Å; M505-M509 HydrophobicContact CE-CG 4.25Å; M505-M509 HydrophobicContact CG-CE 4.09Å; A506-M509 WeakPolarHBondContact O-CB 3.3Å; A506-M509 PolarHBondContact O-N 3.48Å; A506-M509 VanDerWaalsContact O-N 3.1Å; P507-M509 VanDerWaalsContact C-N 3.29Å; P507-M509 PolarHBondContact O-N 2.98Å; M509-Y514 HydrophobicContact CG-CD1 4.45Å; M509-V518 HydrophobicContact CB-CG1 4.22Å; M509-V518 HydrophobicContact CE-CB 4.18Å; M509-V518 HydrophobicContact SD-CB 4.17Å; M509-V518 HydrophobicContact SD-CG1 4.22Å; M509-V518 HydrophobicContact SD-CG2 4.23Å
510	Y	51.7	Low	66.1	Low	87 Å²	87	42.6 Å²	42.6	34%	0.341	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-93.1	-7.7	168.5	-64.4	-91.2	0	0	0	113.6	M505 P507 E508 Y547	M505-Y510 HydrophobicContact CB-CE2 4.01Å; M505-Y510 HydrophobicContact CE-CE1 4.03Å; M505-Y510 HydrophobicContact CE-CE2 4.06Å; P507-Y510 WeakPolarHBondContact O-CD2 3.27Å; P507-Y510 PolarHBondContact O-N 2.87Å; E508-Y510 PolarHBondContact O-N 3.29Å; Y510-Y547 HydrophobicContact CD1-CD2 4.09Å; Y510-Y547 AromaticContact CD1-CE2 3.91Å; Y510-Y547 HydrophobicContact CD1-CE2 3.91Å; Y510-Y547 AromaticContact CD2-CD2 3.91Å; Y510-Y547 HydrophobicContact CD2-CD2 3.91Å; Y510-Y547 AromaticContact CD2-CE2 3.7Å; Y510-Y547 HydrophobicContact CD2-CE2 3.7Å; Y510-Y547 AromaticContact CE1-CD2 3.88Å; Y510-Y547 HydrophobicContact CE1-CD2 3.88Å; Y510-Y547 HydrophobicContact CE1-CE2 4.18Å; Y510-Y547 AromaticContact CE2-CD2 3.68Å; Y510-Y547 HydrophobicContact CE2-CD2 3.68Å; Y510-Y547 AromaticContact CE2-CE2 3.99Å; Y510-Y547 HydrophobicContact CE2-CE2 3.99Å; Y510-Y547 HydrophobicContact CG-CD2 4.1Å; Y510-Y547 AromaticContact CG-CE2 3.65Å; Y510-Y547 HydrophobicContact CG-CE2 3.65Å; Y510-Y547 AromaticContact CZ-CD2 3.66Å
511	E	54.7	Low	68.3	Low	137 Å²	137	41.7 Å²	41.7	64%	0.64	20%	0.2	S	C	*	.	S	Bend	trans	-101.9	8.4	-175.8	-56.2	-167	157.2	0	0	113.7	E508 M513	E508-E511 PolarHBondContact O-N 3.08Å; E511-M513 PolarHBondContact O-N 2.91Å
512	E	54.3	Low	70.5	Confident	165 Å²	165	40.5 Å²	40.5	77%	0.771	19%	0.193	S	C	*	.	S	Bend	trans	58.8	-15.5	-174.8	-60.7	-166.1	176.1	0	0	116.7
513	M	54.7	Low	72.5	Confident	146 Å²	146	40 Å²	40	72%	0.719	19%	0.189	S	C	*	.			trans	-97.5	100.9	172.2	-62.4	-172.9	-62.6	0	0	110.9	E511	E511-M513 PolarHBondContact O-N 2.91Å
514	Y	66.5	Low	74.3	Confident	51 Å²	51	38.8 Å²	38.8	20%	0.2	18%	0.184	C	C	.	.			trans	-132.2	155.5	178.4	50.5	-98.5	0	0	0	112.3	I461 R463 N491 M509	I461-Y514 HydrophobicContact CD1-CD2 4.18Å; R463-Y514 WeakPolarHBondContact CD-OH 3.19Å; R463-Y514 HydrophobicContact CG-CE2 3.92Å; N491-Y514 PolarHBondContact ND2-OH 3.37Å; N491-Y514 PolarHBondContact OD1-OH 3.03Å; M509-Y514 HydrophobicContact CG-CD1 4.45Å
515	D	81.8	Confident	76	Confident	39 Å²	39	38.4 Å²	38.4	21%	0.209	18%	0.182	C	C	.	.			trans	-125.6	-166.2	-179.7	55.6	46.7	0	0	0	110.7	S517 V518 R581	D515-S517 PolarHBondContact O-N 2.92Å; D515-S517 VanDerWaalsContact O-N 3.13Å; D515-S517 WeakPolarHBondContact OD1-CB 3.21Å; D515-S517 PolarHBondContact OD1-N 3.36Å; D515-S517 PolarHBondContact OD1-OG 3.27Å; D515-V518 WeakPolarHBondContact O-CG2 3.46Å; D515-R581 VanDerWaalsContact OD2-CD 3.26Å; D515-R581 WeakPolarHBondContact OD2-CD 3.1Å; D515-R581 IonicContact OD2-CZ 2.63Å; D515-R581 IonicContact OD2-NE 3.4Å; D515-R581 IonicContact OD2-NH1 3.11Å; D515-R581 PolarHBondContact OD2-NH1 3.07Å
516	E	88.4	Confident	77.7	Confident	68 Å²	68	37.6 Å²	37.6	32%	0.318	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-18.4	-179.8	-61.9	80.8	-173.6	0	0	114.3	H454 P459 I461 V518 D519	H454-E516 HydrophobicContact CB-CG 3.86Å; H454-E516 VanDerWaalsContact CD2-CG 3.49Å; H454-E516 WeakPolarHBondContact CD2-CG 3.48Å; P459-E516 VanDerWaalsContact CB-OE1 3.31Å; P459-E516 WeakPolarHBondContact CB-OE1 3.32Å; I461-E516 HydrophobicContact CG1-CG 4.41Å; E516-V518 VanDerWaalsContact C-N 3.28Å; E516-V518 PolarHBondContact O-N 3.03Å; E516-D519 PolarHBondContact O-N 3.49Å
517	S	91.2	Very high	79.6	Confident	14 Å²	14	37.6 Å²	37.6	10%	0.098	18%	0.178	C	C	.	.	H	α-helix	trans	-71.6	-16	-175.8	74.7	0	0	0	0	114.3	D515 D519 V520 Y521 R581 R584	D515-S517 PolarHBondContact O-N 2.92Å; D515-S517 VanDerWaalsContact O-N 3.13Å; D515-S517 WeakPolarHBondContact OD1-CB 3.21Å; D515-S517 PolarHBondContact OD1-N 3.36Å; D515-S517 PolarHBondContact OD1-OG 3.27Å; S517-D519 VanDerWaalsContact C-N 3.29Å; S517-V520 WeakPolarHBondContact O-CB 3.48Å; S517-V520 PolarHBondContact O-N 3.25Å; S517-Y521 PolarHBondContact O-N 2.92Å; S517-R581 VanDerWaalsContact OG-CB 3.3Å; S517-R581 WeakPolarHBondContact OG-CB 3.31Å; S517-R584 PolarHBondContact O-NH1 2.55Å; S517-R584 VanDerWaalsContact O-NH1 3.12Å; S517-R584 PolarHBondContact OG-NH1 2.87Å
518	V	89.6	Confident	81.3	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.006	17%	0.172	C	C	.	.	H	α-helix	trans	-65.7	-36.1	171.1	-57.5	0	0	0	0	110.9	I461 A506 E508 M509 D515 E516 V520 Y521 A522	I461-V518 HydrophobicContact CG2-CG2 3.61Å; A506-V518 HydrophobicContact CB-CB 4.4Å; A506-V518 HydrophobicContact CB-CG1 4.21Å; E508-V518 HydrophobicContact CG-CG1 4.41Å; E508-V518 WeakPolarHBondContact OE1-CG1 3.28Å; M509-V518 HydrophobicContact CB-CG1 4.22Å; M509-V518 HydrophobicContact CE-CB 4.18Å; M509-V518 HydrophobicContact SD-CB 4.17Å; M509-V518 HydrophobicContact SD-CG1 4.22Å; M509-V518 HydrophobicContact SD-CG2 4.23Å; D515-V518 WeakPolarHBondContact O-CG2 3.46Å; E516-V518 VanDerWaalsContact C-N 3.28Å; E516-V518 PolarHBondContact O-N 3.03Å; V518-V520 VanDerWaalsContact C-N 3.34Å; V518-Y521 PolarHBondContact O-N 2.84Å; V518-A522 WeakPolarHBondContact O-CB 3.31Å; V518-A522 PolarHBondContact O-N 3.34Å
519	D	93	Very high	82.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-74.3	-28.6	178.5	-64.4	-25.4	0	0	0	111.2	L450 H454 H462 R463 E516 S517 F523	L450-D519 HydrophobicContact CD1-CB 4.23Å; L450-D519 HydrophobicContact CD2-CB 3.97Å; H454-D519 IonicContact CD2-OD2 2.75Å; H454-D519 IonicContact CE1-OD2 3.19Å; H454-D519 IonicContact NE2-OD2 3.21Å; H454-D519 PolarHBondContact NE2-OD2 3.4Å; H462-D519 WeakPolarHBondContact CB-OD1 3.41Å; H462-D519 PolarHBondContact N-OD1 3.31Å; H462-D519 PolarHBondContact N-OD2 3.38Å; R463-D519 PolarHBondContact N-OD1 3Å; E516-D519 PolarHBondContact O-N 3.49Å; S517-D519 VanDerWaalsContact C-N 3.29Å; D519-F523 VanDerWaalsContact O-CB 3.26Å; D519-F523 WeakPolarHBondContact O-CB 3.47Å; D519-F523 PolarHBondContact O-N 3.02Å
520	V	95.6	Very high	84.8	Confident	5 Å²	5	35.2 Å²	35.2	3%	0.03	17%	0.165	C	C	.	.	H	α-helix	trans	-65.6	-48.5	170.4	170.6	0	0	0	0	111	S517 V518 A522 F523 G524 C576 R584 S585 V587 L590	S517-V520 WeakPolarHBondContact O-CB 3.48Å; S517-V520 PolarHBondContact O-N 3.25Å; V518-V520 VanDerWaalsContact C-N 3.34Å; V520-A522 VanDerWaalsContact C-N 3.34Å; V520-A522 PolarHBondContact O-N 3.48Å; V520-F523 WeakPolarHBondContact O-CB 3.4Å; V520-F523 PolarHBondContact O-N 3.24Å; V520-G524 PolarHBondContact O-N 3.43Å; V520-C576 HydrophobicContact CG1-CB 4.23Å; V520-R584 HydrophobicContact CG1-CB 4.23Å; V520-S585 WeakPolarHBondContact CG1-O 3.46Å; V520-V587 HydrophobicContact CG2-CG2 3.73Å; V520-L590 HydrophobicContact CG1-CD1 4.25Å
521	Y	95.1	Very high	86.8	Confident	5 Å²	5	32.3 Å²	32.3	2%	0.02	16%	0.156	C	C	.	.	H	α-helix	trans	-58.6	-47.7	176.5	-178.4	-85.2	0	0	0	111	M505 A506 S517 V518 F523 G524 M525 C576 I577	M505-Y521 WeakPolarHBondContact O-CE1 3.22Å; A506-Y521 HydrophobicContact CB-CD1 3.89Å; A506-Y521 HydrophobicContact CB-CD2 4.2Å; A506-Y521 HydrophobicContact CB-CG 3.72Å; S517-Y521 PolarHBondContact O-N 2.92Å; V518-Y521 PolarHBondContact O-N 2.84Å; Y521-F523 VanDerWaalsContact C-N 3.34Å; Y521-F523 PolarHBondContact O-N 2.81Å; Y521-G524 PolarHBondContact O-N 3.2Å; Y521-G524 VanDerWaalsContact O-N 3.14Å; Y521-M525 HydrophobicContact CD1-CG 4.39Å; Y521-M525 HydrophobicContact CE1-CE 3.84Å; Y521-M525 HydrophobicContact CE1-CG 4.06Å; Y521-M525 HydrophobicContact CE2-CE 4.3Å; Y521-M525 PolarHBondContact O-N 3.33Å; Y521-M525 WeakPolarHBondContact OH-CE 3.46Å; Y521-C576 WeakPolarHBondContact CA-O 3.47Å; Y521-I577 HydrophobicContact CD2-CB 4.25Å; Y521-I577 HydrophobicContact CE2-CB 4.05Å
522	A	94.6	Very high	88.5	Confident	4 Å²	4	27.1 Å²	27.1	3%	0.033	13%	0.134	C	C	.	.	H	α-helix	trans	-64.5	-34.5	177.2	0	0	0	0	0	113	L465 V518 V520 M525 C526	L465-A522 HydrophobicContact CB-CB 3.83Å; L465-A522 HydrophobicContact CD2-CB 4.35Å; V518-A522 WeakPolarHBondContact O-CB 3.31Å; V518-A522 PolarHBondContact O-N 3.34Å; V520-A522 VanDerWaalsContact C-N 3.34Å; V520-A522 PolarHBondContact O-N 3.48Å; A522-M525 PolarHBondContact O-N 2.69Å; A522-C526 PolarHBondContact O-N 3.42Å; A522-C526 PolarHBondContact O-SG 3.14Å
523	F	97.3	Very high	90.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.1	-42.9	170.5	166.9	-97.3	0	0	0	111.7	C443 I446 L447 L450 L465 D519 V520 Y521 M525 C526 L527 L590 F596	C443-F523 HydrophobicContact CB-CE2 4.07Å; C443-F523 HydrophobicContact CB-CZ 4.08Å; I446-F523 HydrophobicContact CB-CD2 4.33Å; I446-F523 HydrophobicContact CB-CE2 4.35Å; I446-F523 HydrophobicContact CG2-CD2 3.8Å; I446-F523 HydrophobicContact CG2-CE2 4.32Å; L447-F523 HydrophobicContact CD1-CE1 4.21Å; L447-F523 HydrophobicContact CD1-CE2 4.27Å; L447-F523 HydrophobicContact CD1-CZ 3.72Å; L447-F523 HydrophobicContact CD2-CD1 3.98Å; L447-F523 HydrophobicContact CD2-CD2 4.17Å; L447-F523 HydrophobicContact CD2-CE1 3.81Å; L447-F523 HydrophobicContact CD2-CE2 4Å; L447-F523 HydrophobicContact CD2-CG 4.16Å; L447-F523 HydrophobicContact CD2-CZ 3.82Å; L447-F523 HydrophobicContact CG-CD2 4.33Å; L447-F523 HydrophobicContact CG-CE1 4.17Å; L447-F523 HydrophobicContact CG-CE2 3.75Å; L447-F523 HydrophobicContact CG-CZ 3.66Å; L450-F523 HydrophobicContact CD1-CB 4.25Å; L465-F523 HydrophobicContact CD2-CB 4.1Å; D519-F523 VanDerWaalsContact O-CB 3.26Å; D519-F523 WeakPolarHBondContact O-CB 3.47Å; D519-F523 PolarHBondContact O-N 3.02Å; V520-F523 WeakPolarHBondContact O-CB 3.4Å; V520-F523 PolarHBondContact O-N 3.24Å; Y521-F523 VanDerWaalsContact C-N 3.34Å; Y521-F523 PolarHBondContact O-N 2.81Å; F523-M525 VanDerWaalsContact C-N 3.32Å; F523-M525 PolarHBondContact O-N 2.86Å; F523-C526 WeakPolarHBondContact O-CB 3.49Å; F523-C526 PolarHBondContact O-N 3.04Å; F523-L527 HydrophobicContact CE1-CD2 4.43Å; F523-L527 WeakPolarHBondContact O-CB 3.26Å; F523-L527 PolarHBondContact O-N 3.34Å; F523-L590 HydrophobicContact CD1-CD1 4.19Å; F523-L590 HydrophobicContact CE1-CD1 4.22Å; F523-F596 HydrophobicContact CE1-CZ 4.41Å; F523-F596 AromaticContact CZ-CZ 3.96Å; F523-F596 HydrophobicContact CZ-CZ 3.96Å
524	G	97	Very high	92	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-57	-43.5	173.5	0	0	0	0	0	112.6	V520 Y521 L527 L528	V520-G524 PolarHBondContact O-N 3.43Å; Y521-G524 PolarHBondContact O-N 3.2Å; Y521-G524 VanDerWaalsContact O-N 3.14Å; G524-L527 PolarHBondContact O-N 3.12Å; G524-L528 WeakPolarHBondContact O-CB 3.1Å; G524-L528 PolarHBondContact O-N 3.13Å
525	M	95.9	Very high	93.2	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-68.5	-35.8	175.1	-66.7	-58.4	-175.8	0	0	113.2	F504 Y521 A522 F523 L528 E529 P536 Y537 P556 I577	F504-M525 HydrophobicContact CD1-CB 3.62Å; F504-M525 HydrophobicContact CE1-CB 3.84Å; F504-M525 HydrophobicContact CG-CB 4.22Å; Y521-M525 HydrophobicContact CD1-CG 4.39Å; Y521-M525 HydrophobicContact CE1-CE 3.84Å; Y521-M525 HydrophobicContact CE1-CG 4.06Å; Y521-M525 HydrophobicContact CE2-CE 4.3Å; Y521-M525 PolarHBondContact O-N 3.33Å; Y521-M525 WeakPolarHBondContact OH-CE 3.46Å; A522-M525 PolarHBondContact O-N 2.69Å; F523-M525 VanDerWaalsContact C-N 3.32Å; F523-M525 PolarHBondContact O-N 2.86Å; M525-L528 PolarHBondContact O-N 3.46Å; M525-L528 HydrophobicContact SD-CD2 4.14Å; M525-E529 PolarHBondContact O-N 3.22Å; M525-P536 HydrophobicContact CB-CG 4.31Å; M525-P536 HydrophobicContact SD-CB 3.99Å; M525-P536 HydrophobicContact SD-CG 4.29Å; M525-Y537 HydrophobicContact CE-CE2 3.84Å; M525-P556 HydrophobicContact CE-CG 4.01Å; M525-P556 HydrophobicContact SD-CG 4.06Å; M525-I577 HydrophobicContact CE-CB 4.21Å; M525-I577 HydrophobicContact CE-CD1 4.35Å; M525-I577 HydrophobicContact CE-CG2 3.96Å; M525-I577 HydrophobicContact CG-CG2 4.34Å; M525-I577 HydrophobicContact SD-CG2 4.13Å
526	C	97	Very high	93.7	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.7	-41.8	171.6	-66.2	0	0	0	0	112.1	K466 A522 F523 E529 M530	K466-C526 WeakPolarHBondContact CA-SG 3.27Å; A522-C526 PolarHBondContact O-N 3.42Å; A522-C526 PolarHBondContact O-SG 3.14Å; F523-C526 WeakPolarHBondContact O-CB 3.49Å; F523-C526 PolarHBondContact O-N 3.04Å; C526-E529 PolarHBondContact O-N 2.86Å; C526-M530 WeakPolarHBondContact O-CB 3.3Å; C526-M530 WeakPolarHBondContact O-CG 3.49Å; C526-M530 PolarHBondContact O-N 3.06Å
527	L	96.7	Very high	94	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-64.3	-42.1	176.3	177.6	56	0	0	0	110.9	L439 F523 G524 M530 V531 I569 I572 I573 F596	L439-L527 HydrophobicContact CD1-CD1 4.14Å; L439-L527 HydrophobicContact CD2-CD1 4.3Å; L439-L527 HydrophobicContact CG-CD1 4.36Å; F523-L527 HydrophobicContact CE1-CD2 4.43Å; F523-L527 WeakPolarHBondContact O-CB 3.26Å; F523-L527 PolarHBondContact O-N 3.34Å; G524-L527 PolarHBondContact O-N 3.12Å; L527-M530 PolarHBondContact O-N 3.43Å; L527-V531 HydrophobicContact CD1-CG2 3.8Å; L527-V531 HydrophobicContact CG-CG2 4.39Å; L527-V531 WeakPolarHBondContact O-CB 3.49Å; L527-V531 WeakPolarHBondContact O-CG2 3.42Å; L527-V531 PolarHBondContact O-N 3.43Å; L527-I569 HydrophobicContact CD1-CG2 4.4Å; L527-I569 HydrophobicContact CG-CG2 4.44Å; L527-I572 HydrophobicContact CD2-CG2 3.77Å; L527-I573 HydrophobicContact CB-CG1 4.19Å; L527-I573 HydrophobicContact CD2-CD1 4.44Å; L527-I573 HydrophobicContact CD2-CG1 3.7Å; L527-I573 HydrophobicContact CG-CD1 4Å; L527-I573 HydrophobicContact CG-CG1 3.7Å; L527-F596 HydrophobicContact CD2-CZ 4.33Å
528	L	95.8	Very high	94	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-60.2	-47	174.1	-178.6	61	0	0	0	112.6	G524 M525 M530 V531 T532 P536 P556 I562 I573	G524-L528 WeakPolarHBondContact O-CB 3.1Å; G524-L528 PolarHBondContact O-N 3.13Å; M525-L528 PolarHBondContact O-N 3.46Å; M525-L528 HydrophobicContact SD-CD2 4.14Å; L528-M530 VanDerWaalsContact C-N 3.33Å; L528-M530 PolarHBondContact O-N 2.96Å; L528-V531 PolarHBondContact O-N 2.7Å; L528-T532 HydrophobicContact CD1-CG2 3.82Å; L528-T532 WeakPolarHBondContact O-CB 3.27Å; L528-T532 WeakPolarHBondContact O-CG2 3.26Å; L528-T532 PolarHBondContact O-N 2.96Å; L528-T532 PolarHBondContact O-OG1 2.95Å; L528-P536 HydrophobicContact CD2-CG 4.43Å; L528-P556 HydrophobicContact CD2-CB 4.02Å; L528-P556 HydrophobicContact CD2-CG 3.79Å; L528-I562 HydrophobicContact CD1-CD1 3.97Å; L528-I562 HydrophobicContact CD1-CG1 3.9Å; L528-I573 HydrophobicContact CB-CD1 4.17Å; L528-I573 HydrophobicContact CB-CG2 4.36Å; L528-I573 HydrophobicContact CD1-CD1 4.26Å
529	E	95.2	Very high	94.1	Very high	13 Å²	13	19.6 Å²	19.6	6%	0.061	11%	0.113	C	C	.	.	H	α-helix	trans	-61.3	-41.6	175.5	-164.9	-171.1	172.9	0	0	111.2	L428 C467 F504 M525 C526 V531 G533 P536	L428-E529 HydrophobicContact CD1-CG 3.99Å; C467-E529 WeakPolarHBondContact CB-OE2 3.48Å; C467-E529 PolarHBondContact SG-OE2 3.21Å; F504-E529 WeakPolarHBondContact CZ-OE2 3.42Å; M525-E529 PolarHBondContact O-N 3.22Å; C526-E529 PolarHBondContact O-N 2.86Å; E529-V531 PolarHBondContact O-N 2.82Å; E529-G533 VanDerWaalsContact O-CA 3.31Å; E529-G533 WeakPolarHBondContact O-CA 3.45Å; E529-G533 PolarHBondContact O-N 2.85Å; E529-P536 HydrophobicContact CB-CG 4.42Å
530	M	94	Very high	93.9	Very high	4 Å²	4	20.4 Å²	20.4	2%	0.02	12%	0.118	C	C	.	.	H	α-helix	trans	-67.8	-31.3	179.3	-80.6	-168.3	-70.2	0	0	114.6	L424 L428 I434 L439 C443 I446 C526 L527 L528	L424-M530 HydrophobicContact CD1-CE 4.45Å; L424-M530 HydrophobicContact CD1-SD 3.74Å; L424-M530 HydrophobicContact CD2-SD 4.21Å; L428-M530 HydrophobicContact CD1-CG 4.13Å; I434-M530 HydrophobicContact CD1-CB 3.95Å; I434-M530 HydrophobicContact CD1-CG 3.84Å; I434-M530 HydrophobicContact CD1-SD 4.17Å; L439-M530 HydrophobicContact CD1-CB 3.59Å; L439-M530 HydrophobicContact CD1-CE 4.18Å; L439-M530 HydrophobicContact CD1-CG 4.36Å; L439-M530 HydrophobicContact CD1-SD 3.95Å; C443-M530 VanDerWaalsContact SG-CE 3.51Å; I446-M530 HydrophobicContact CD1-CE 4.2Å; C526-M530 WeakPolarHBondContact O-CB 3.3Å; C526-M530 WeakPolarHBondContact O-CG 3.49Å; C526-M530 PolarHBondContact O-N 3.06Å; L527-M530 PolarHBondContact O-N 3.43Å; L528-M530 VanDerWaalsContact C-N 3.33Å; L528-M530 PolarHBondContact O-N 2.96Å
531	V	93.9	Very high	93.3	Very high	26 Å²	26	29.3 Å²	29.3	16%	0.158	16%	0.162	C	C	.	.	H	α-helix	trans	-84.5	-41.6	-177.2	169.3	0	0	0	0	111.7	L439 L527 L528 E529 I562 I569	L439-V531 HydrophobicContact CD2-CG2 3.65Å; L527-V531 HydrophobicContact CD1-CG2 3.8Å; L527-V531 HydrophobicContact CG-CG2 4.39Å; L527-V531 WeakPolarHBondContact O-CB 3.49Å; L527-V531 WeakPolarHBondContact O-CG2 3.42Å; L527-V531 PolarHBondContact O-N 3.43Å; L528-V531 PolarHBondContact O-N 2.7Å; E529-V531 PolarHBondContact O-N 2.82Å; V531-I562 HydrophobicContact CG1-CG2 4.15Å; V531-I569 HydrophobicContact CB-CG2 4.5Å; V531-I569 HydrophobicContact CG1-CG2 4.25Å; V531-I569 HydrophobicContact CG2-CD1 4.37Å; V531-I569 HydrophobicContact CG2-CG2 3.62Å
532	T	92.2	Very high	92.5	Very high	29 Å²	29	32.3 Å²	32.3	18%	0.178	18%	0.178	C	C	.	.	H	α-helix	trans	-86.2	-30.8	-177.7	59.7	0	0	0	0	112.6	L528 E534 C558 I562	L528-T532 HydrophobicContact CD1-CG2 3.82Å; L528-T532 WeakPolarHBondContact O-CB 3.27Å; L528-T532 WeakPolarHBondContact O-CG2 3.26Å; L528-T532 PolarHBondContact O-N 2.96Å; L528-T532 PolarHBondContact O-OG1 2.95Å; T532-E534 PolarHBondContact O-N 2.82Å; T532-E534 PolarHBondContact OG1-N 2.88Å; T532-E534 VanDerWaalsContact OG1-N 3.08Å; T532-E534 PolarHBondContact OG1-O 3.42Å; T532-C558 HydrophobicContact CG2-CB 4.17Å; T532-C558 WeakPolarHBondContact CG2-O 3.46Å; T532-I562 HydrophobicContact CG2-CG1 4.48Å
533	G	91.3	Very high	91.7	Very high	40 Å²	40	34.2 Å²	34.2	41%	0.412	19%	0.19	S	C	.	.	S	Bend	trans	72.3	8.6	-165.5	0	0	0	0	0	113.4	E529	E529-G533 VanDerWaalsContact O-CA 3.31Å; E529-G533 WeakPolarHBondContact O-CA 3.45Å; E529-G533 PolarHBondContact O-N 2.85Å
534	E	91.2	Very high	90.7	Very high	70 Å²	70	36.6 Å²	36.6	33%	0.327	21%	0.21	S	C	.	.	S	Bend	trans	-114.7	142.4	-178.3	-61.3	-172	144.6	0	0	110.3	T532 C558 R561	T532-E534 PolarHBondContact O-N 2.82Å; T532-E534 PolarHBondContact OG1-N 2.88Å; T532-E534 VanDerWaalsContact OG1-N 3.08Å; T532-E534 PolarHBondContact OG1-O 3.42Å; E534-C558 HydrophobicContact CB-CB 4.23Å; E534-R561 IonicContact OE1-NH1 2.6Å; E534-R561 PolarHBondContact OE1-NH1 3.37Å; E534-R561 WeakPolarHBondContact OE2-CD 3.34Å; E534-R561 IonicContact OE2-CZ 2.68Å; E534-R561 IonicContact OE2-NE 3.66Å; E534-R561 IonicContact OE2-NH1 3.63Å; E534-R561 PolarHBondContact OE2-NH1 2.95Å
535	Y	90.6	Very high	90.3	Very high	71 Å²	71	38.3 Å²	38.3	28%	0.278	22%	0.22	S	C	.	.			trans	-73.5	130.2	-178.7	-170.9	-100.7	0	0	0	110.2	T501 E503 F504 S538	T501-Y535 WeakPolarHBondContact CG2-OH 3.42Å; E503-Y535 HydrophobicContact CB-CE1 4.07Å; E503-Y535 HydrophobicContact CG-CD1 4.43Å; E503-Y535 HydrophobicContact CG-CE1 3.63Å; E503-Y535 PolarHBondContact OE2-OH 2.83Å; F504-Y535 HydrophobicContact CE2-CD2 4.27Å; F504-Y535 AromaticContact CE2-CE2 3.61Å; F504-Y535 HydrophobicContact CE2-CE2 3.61Å; F504-Y535 AromaticContact CE2-CZ 3.78Å; F504-Y535 HydrophobicContact CZ-CE2 4.23Å; Y535-S538 WeakPolarHBondContact O-CB 3.45Å; Y535-S538 PolarHBondContact O-N 3.4Å; Y535-S538 PolarHBondContact O-OG 3.36Å
536	P	93	Very high	89.8	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	142.9	177.9	-27.6	35.7	0	0	0	112.6	E503 F504 M525 L528 E529 S538 P556	E503-P536 HydrophobicContact CB-CB 4.46Å; E503-P536 WeakPolarHBondContact CB-O 3.4Å; E503-P536 WeakPolarHBondContact CG-O 3.47Å; F504-P536 HydrophobicContact CE2-CG 4.29Å; F504-P536 HydrophobicContact CZ-CG 4.04Å; M525-P536 HydrophobicContact CB-CG 4.31Å; M525-P536 HydrophobicContact SD-CB 3.99Å; M525-P536 HydrophobicContact SD-CG 4.29Å; L528-P536 HydrophobicContact CD2-CG 4.43Å; E529-P536 HydrophobicContact CB-CG 4.42Å; P536-S538 PolarHBondContact O-N 2.8Å; P536-P556 HydrophobicContact CB-CG 4.3Å
537	Y	93.4	Very high	89	Confident	7 Å²	7	42.7 Å²	42.7	3%	0.027	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.7	23	-177.7	-65.1	-66.7	0	0	0	115.8	E503 M525 E539 C540 I546 K549 V550 V554 P556	E503-Y537 HydrophobicContact CB-CD2 4.26Å; M525-Y537 HydrophobicContact CE-CE2 3.84Å; Y537-E539 VanDerWaalsContact CA-OE2 3.23Å; Y537-E539 WeakPolarHBondContact CA-OE2 3.45Å; Y537-E539 PolarHBondContact O-N 3.17Å; Y537-E539 VanDerWaalsContact O-N 3.08Å; Y537-C540 VanDerWaalsContact O-CB 3.26Å; Y537-C540 WeakPolarHBondContact O-CB 3.27Å; Y537-C540 PolarHBondContact O-N 2.87Å; Y537-I546 HydrophobicContact CD2-CG2 3.93Å; Y537-I546 HydrophobicContact CE2-CG2 4.48Å; Y537-I546 HydrophobicContact CG-CG2 4.14Å; Y537-K549 HydrophobicContact CD1-CB 4.47Å; Y537-K549 HydrophobicContact CD1-CD 3.82Å; Y537-K549 HydrophobicContact CE1-CB 3.85Å; Y537-K549 HydrophobicContact CE1-CD 3.73Å; Y537-K549 HydrophobicContact CE1-CG 4.48Å; Y537-V550 HydrophobicContact CD2-CG2 4.45Å; Y537-V550 HydrophobicContact CE2-CG2 3.57Å; Y537-V554 VanDerWaalsContact CE1-O 3.26Å; Y537-V554 WeakPolarHBondContact CE1-O 3.48Å; Y537-V554 PolarHBondContact OH-O 3.09Å; Y537-P556 HydrophobicContact CD1-CB 4.15Å; Y537-P556 HydrophobicContact CD1-CG 4.11Å; Y537-P556 HydrophobicContact CD2-CG 3.92Å; Y537-P556 HydrophobicContact CE1-CB 4.24Å; Y537-P556 HydrophobicContact CE1-CG 3.89Å; Y537-P556 HydrophobicContact CE2-CG 3.7Å; Y537-P556 HydrophobicContact CG-CB 4.34Å; Y537-P556 HydrophobicContact CG-CG 4.13Å
538	S	91.5	Very high	88.4	Confident	78 Å²	78	49.1 Å²	49.1	55%	0.545	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-12.7	179.4	47.5	0	0	0	0	114.7	Y535 P536 C540	Y535-S538 WeakPolarHBondContact O-CB 3.45Å; Y535-S538 PolarHBondContact O-N 3.4Å; Y535-S538 PolarHBondContact O-OG 3.36Å; P536-S538 PolarHBondContact O-N 2.8Å; S538-C540 PolarHBondContact O-N 3.41Å
539	E	91.1	Very high	88.2	Confident	60 Å²	60	51.4 Å²	51.4	28%	0.28	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-8.7	167.4	75.9	-74.4	176.9	0	0	113.9	Y537 K549 E557	Y537-E539 VanDerWaalsContact CA-OE2 3.23Å; Y537-E539 WeakPolarHBondContact CA-OE2 3.45Å; Y537-E539 PolarHBondContact O-N 3.17Å; Y537-E539 VanDerWaalsContact O-N 3.08Å; E539-K549 IonicContact OE1-NZ 2.84Å; E539-K549 PolarHBondContact OE1-NZ 2.8Å; E539-E557 HydrophobicContact CG-CB 4.14Å; E539-E557 PolarHBondContact OE1-N 3.18Å
540	C	88.8	Confident	87.8	Confident	17 Å²	17	51 Å²	51	12%	0.115	27%	0.271	C	S	.	.			trans	-99.8	113.7	-176.8	-60.3	0	0	0	0	112.4	Y537 S538 N542 T545 I546 K549	Y537-C540 VanDerWaalsContact O-CB 3.26Å; Y537-C540 WeakPolarHBondContact O-CB 3.27Å; Y537-C540 PolarHBondContact O-N 2.87Å; S538-C540 PolarHBondContact O-N 3.41Å; C540-N542 VanDerWaalsContact C-N 3.25Å; C540-N542 PolarHBondContact O-N 2.98Å; C540-T545 HydrophobicContact CB-CG2 4.2Å; C540-I546 HydrophobicContact CB-CD1 4.15Å; C540-I546 HydrophobicContact CB-CG1 3.43Å; C540-I546 VanDerWaalsContact CB-CG1 3.43Å; C540-K549 VanDerWaalsContact SG-CE 3.6Å
541	M	84.1	Confident	87.4	Confident	191 Å²	191	54.6 Å²	54.6	94%	0.941	29%	0.289	S	S	*	.	S	Bend	trans	-68.1	-14.8	-179.3	-62.5	-178.9	73.9	0	0	115.5
542	N	78.2	Confident	87.1	Confident	69 Å²	69	57 Å²	57	37%	0.369	31%	0.307	S	S	.	.	S	Bend	trans	-151.1	150.6	-179.7	68.9	76.1	0	0	0	113.7	C540 A544 T545 I546	C540-N542 VanDerWaalsContact C-N 3.25Å; C540-N542 PolarHBondContact O-N 2.98Å; N542-A544 VanDerWaalsContact C-N 3.29Å; N542-A544 PolarHBondContact O-N 3.02Å; N542-A544 WeakPolarHBondContact OD1-CB 3.49Å; N542-A544 PolarHBondContact OD1-N 3.38Å; N542-T545 PolarHBondContact ND2-OG1 2.88Å; N542-T545 WeakPolarHBondContact O-CB 3.35Å; N542-T545 PolarHBondContact O-N 2.76Å; N542-T545 PolarHBondContact OD1-N 2.9Å; N542-T545 PolarHBondContact OD1-OG1 3.47Å; N542-I546 PolarHBondContact O-N 3.37Å
543	P	78.1	Confident	86.9	Confident	43 Å²	43	57.1 Å²	57.1	28%	0.279	31%	0.314	S	S	.	.	H	α-helix	trans	-56.3	-29.7	178.1	-36.3	44.2	0	0	0	116.7	V498 P502 T545 I546 Y547	V498-P543 HydrophobicContact CB-CG 4.38Å; V498-P543 HydrophobicContact CG1-CB 4.05Å; V498-P543 HydrophobicContact CG1-CG 3.76Å; V498-P543 HydrophobicContact CG2-CB 3.96Å; V498-P543 HydrophobicContact CG2-CG 3.71Å; P502-P543 HydrophobicContact CB-CB 4.13Å; P502-P543 HydrophobicContact CG-CB 3.72Å; P502-P543 HydrophobicContact CG-CG 3.72Å; P543-T545 VanDerWaalsContact C-N 3.32Å; P543-T545 PolarHBondContact O-N 3.29Å; P543-I546 PolarHBondContact O-N 3.45Å; P543-Y547 WeakPolarHBondContact O-CB 3.5Å; P543-Y547 PolarHBondContact O-N 2.95Å
544	A	75.8	Confident	86.9	Confident	50 Å²	50	58.4 Å²	58.4	41%	0.413	31%	0.314	S	S	.	.	H	α-helix	trans	-70.1	-31.3	177.1	0	0	0	0	0	111.8	N542 R548	N542-A544 VanDerWaalsContact C-N 3.29Å; N542-A544 PolarHBondContact O-N 3.02Å; N542-A544 WeakPolarHBondContact OD1-CB 3.49Å; N542-A544 PolarHBondContact OD1-N 3.38Å; A544-R548 VanDerWaalsContact C-NH1 3.29Å; A544-R548 WeakPolarHBondContact O-CG 3.37Å; A544-R548 PolarHBondContact O-N 3.47Å; A544-R548 VanDerWaalsContact O-N 3.08Å; A544-R548 PolarHBondContact O-NH1 3.37Å
545	T	87.7	Confident	87.1	Confident	36 Å²	36	58.5 Å²	58.5	22%	0.221	31%	0.313	C	S	.	.	H	α-helix	trans	-69.4	-39.7	171	-59.2	0	0	0	0	111.6	C540 N542 P543 R548 K549	C540-T545 HydrophobicContact CB-CG2 4.2Å; N542-T545 PolarHBondContact ND2-OG1 2.88Å; N542-T545 WeakPolarHBondContact O-CB 3.35Å; N542-T545 PolarHBondContact O-N 2.76Å; N542-T545 PolarHBondContact OD1-N 2.9Å; N542-T545 PolarHBondContact OD1-OG1 3.47Å; P543-T545 VanDerWaalsContact C-N 3.32Å; P543-T545 PolarHBondContact O-N 3.29Å; T545-R548 PolarHBondContact O-N 3.04Å; T545-R548 PolarHBondContact OG1-NH2 3Å; T545-K549 PolarHBondContact O-N 2.85Å
546	I	85.3	Confident	87.3	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-61.7	-52.4	175.5	-61.8	158.5	0	0	0	109.8	P502 E503 Y537 C540 N542 P543 R548 K549 V550	P502-I546 HydrophobicContact CB-CG2 4.44Å; P502-I546 HydrophobicContact CG-CD1 4.29Å; P502-I546 WeakPolarHBondContact O-CG2 3.4Å; E503-I546 HydrophobicContact CG-CD1 3.64Å; E503-I546 HydrophobicContact CG-CG1 4.41Å; E503-I546 HydrophobicContact CG-CG2 4.36Å; E503-I546 VanDerWaalsContact OE1-CD1 3.22Å; E503-I546 WeakPolarHBondContact OE1-CD1 3.35Å; Y537-I546 HydrophobicContact CD2-CG2 3.93Å; Y537-I546 HydrophobicContact CE2-CG2 4.48Å; Y537-I546 HydrophobicContact CG-CG2 4.14Å; C540-I546 HydrophobicContact CB-CD1 4.15Å; C540-I546 HydrophobicContact CB-CG1 3.43Å; C540-I546 VanDerWaalsContact CB-CG1 3.43Å; N542-I546 PolarHBondContact O-N 3.37Å; P543-I546 PolarHBondContact O-N 3.45Å; I546-R548 VanDerWaalsContact C-N 3.35Å; I546-R548 PolarHBondContact O-N 2.74Å; I546-K549 WeakPolarHBondContact O-CB 3.49Å; I546-K549 PolarHBondContact O-N 2.75Å; I546-V550 HydrophobicContact CG2-CG2 4.27Å; I546-V550 WeakPolarHBondContact O-CG2 3.45Å; I546-V550 PolarHBondContact O-N 3.32Å
547	Y	80.4	Confident	87.3	Confident	90 Å²	90	59.6 Å²	59.6	35%	0.353	32%	0.321	S	S	.	.	H	α-helix	trans	-51.7	-49.9	174.7	177.9	-106.4	0	0	0	112.2	Y510 P543 K549 V550 I551	Y510-Y547 HydrophobicContact CD1-CD2 4.09Å; Y510-Y547 AromaticContact CD1-CE2 3.91Å; Y510-Y547 HydrophobicContact CD1-CE2 3.91Å; Y510-Y547 AromaticContact CD2-CD2 3.91Å; Y510-Y547 HydrophobicContact CD2-CD2 3.91Å; Y510-Y547 AromaticContact CD2-CE2 3.7Å; Y510-Y547 HydrophobicContact CD2-CE2 3.7Å; Y510-Y547 AromaticContact CE1-CD2 3.88Å; Y510-Y547 HydrophobicContact CE1-CD2 3.88Å; Y510-Y547 HydrophobicContact CE1-CE2 4.18Å; Y510-Y547 AromaticContact CE2-CD2 3.68Å; Y510-Y547 HydrophobicContact CE2-CD2 3.68Å; Y510-Y547 AromaticContact CE2-CE2 3.99Å; Y510-Y547 HydrophobicContact CE2-CE2 3.99Å; Y510-Y547 HydrophobicContact CG-CD2 4.1Å; Y510-Y547 AromaticContact CG-CE2 3.65Å; Y510-Y547 HydrophobicContact CG-CE2 3.65Å; Y510-Y547 AromaticContact CZ-CD2 3.66Å; P543-Y547 WeakPolarHBondContact O-CB 3.5Å; P543-Y547 PolarHBondContact O-N 2.95Å; Y547-K549 VanDerWaalsContact C-N 3.32Å; Y547-K549 PolarHBondContact O-N 3.31Å; Y547-V550 PolarHBondContact O-N 2.9Å; Y547-I551 HydrophobicContact CD1-CD1 4.18Å; Y547-I551 HydrophobicContact CD2-CG2 4.09Å; Y547-I551 HydrophobicContact CE1-CD1 3.76Å; Y547-I551 HydrophobicContact CE1-CG2 4.35Å; Y547-I551 HydrophobicContact CE2-CG2 3.69Å; Y547-I551 WeakPolarHBondContact O-CG1 3.43Å; Y547-I551 PolarHBondContact O-N 2.8Å
548	R	85.7	Confident	87.3	Confident	135 Å²	135	59.3 Å²	59.3	51%	0.509	32%	0.32	S	S	.	.	H	α-helix	trans	-59.9	-36.6	176.6	-75.4	-169.5	-51.7	-78.1	-2.5	113.3	A544 T545 I546 S552	A544-R548 VanDerWaalsContact C-NH1 3.29Å; A544-R548 WeakPolarHBondContact O-CG 3.37Å; A544-R548 PolarHBondContact O-N 3.47Å; A544-R548 VanDerWaalsContact O-N 3.08Å; A544-R548 PolarHBondContact O-NH1 3.37Å; T545-R548 PolarHBondContact O-N 3.04Å; T545-R548 PolarHBondContact OG1-NH2 3Å; I546-R548 VanDerWaalsContact C-N 3.35Å; I546-R548 PolarHBondContact O-N 2.74Å; R548-S552 WeakPolarHBondContact O-CB 3.02Å; R548-S552 PolarHBondContact O-N 3.46Å; R548-S552 PolarHBondContact O-OG 2.81Å
549	K	90.4	Very high	87.4	Confident	48 Å²	48	56.4 Å²	56.4	21%	0.209	30%	0.298	C	S	.	.	H	α-helix	trans	-67.7	-47.5	174.1	-78.4	-164.1	179.7	-163.8	0	111.7	Y537 E539 C540 T545 I546 Y547 S552 G553 V554	Y537-K549 HydrophobicContact CD1-CB 4.47Å; Y537-K549 HydrophobicContact CD1-CD 3.82Å; Y537-K549 HydrophobicContact CE1-CB 3.85Å; Y537-K549 HydrophobicContact CE1-CD 3.73Å; Y537-K549 HydrophobicContact CE1-CG 4.48Å; E539-K549 IonicContact OE1-NZ 2.84Å; E539-K549 PolarHBondContact OE1-NZ 2.8Å; C540-K549 VanDerWaalsContact SG-CE 3.6Å; T545-K549 PolarHBondContact O-N 2.85Å; I546-K549 WeakPolarHBondContact O-CB 3.49Å; I546-K549 PolarHBondContact O-N 2.75Å; Y547-K549 VanDerWaalsContact C-N 3.32Å; Y547-K549 PolarHBondContact O-N 3.31Å; K549-S552 CarbonylContact O-C 3.57Å; K549-S552 PolarHBondContact O-N 2.88Å; K549-S552 PolarHBondContact O-OG 3.49Å; K549-S552 VanDerWaalsContact O-OG 3.14Å; K549-G553 PolarHBondContact O-N 2.82Å; K549-G553 VanDerWaalsContact O-N 3.15Å; K549-V554 HydrophobicContact CB-CB 3.98Å; K549-V554 HydrophobicContact CB-CG1 4.35Å; K549-V554 HydrophobicContact CD-CB 4.42Å; K549-V554 HydrophobicContact CD-CG1 3.87Å; K549-V554 HydrophobicContact CG-CB 4.06Å; K549-V554 HydrophobicContact CG-CG1 3.98Å; K549-V554 PolarHBondContact O-N 3.03Å
550	V	86.9	Confident	87.5	Confident	6 Å²	6	57.9 Å²	57.9	4%	0.036	32%	0.315	C	S	.	.	H	α-helix	trans	-61.4	-49.1	-177.2	172.6	0	0	0	0	111.4	P507 Y537 I546 Y547 S552 G553	P507-V550 HydrophobicContact CB-CG1 4.07Å; P507-V550 HydrophobicContact CG-CG1 4.28Å; Y537-V550 HydrophobicContact CD2-CG2 4.45Å; Y537-V550 HydrophobicContact CE2-CG2 3.57Å; I546-V550 HydrophobicContact CG2-CG2 4.27Å; I546-V550 WeakPolarHBondContact O-CG2 3.45Å; I546-V550 PolarHBondContact O-N 3.32Å; Y547-V550 PolarHBondContact O-N 2.9Å; V550-S552 PolarHBondContact O-N 2.8Å; V550-G553 PolarHBondContact O-N 3.01Å; V550-G553 VanDerWaalsContact O-N 3.17Å
551	I	85.1	Confident	87.7	Confident	78 Å²	78	62.8 Å²	62.8	40%	0.4	33%	0.331	S	S	.	.	H	α-helix	trans	-68.1	-21.5	179	70.6	-176.2	0	0	0	113.7	P507 Y547	P507-I551 HydrophobicContact CB-CG2 4.21Å; Y547-I551 HydrophobicContact CD1-CD1 4.18Å; Y547-I551 HydrophobicContact CD2-CG2 4.09Å; Y547-I551 HydrophobicContact CE1-CD1 3.76Å; Y547-I551 HydrophobicContact CE1-CG2 4.35Å; Y547-I551 HydrophobicContact CE2-CG2 3.69Å; Y547-I551 WeakPolarHBondContact O-CG1 3.43Å; Y547-I551 PolarHBondContact O-N 2.8Å
552	S	87.6	Confident	88.1	Confident	78 Å²	78	54.4 Å²	54.4	55%	0.545	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	8.4	176	58.8	0	0	0	0	113.7	R548 K549 V550 V554	R548-S552 WeakPolarHBondContact O-CB 3.02Å; R548-S552 PolarHBondContact O-N 3.46Å; R548-S552 PolarHBondContact O-OG 2.81Å; K549-S552 CarbonylContact O-C 3.57Å; K549-S552 PolarHBondContact O-N 2.88Å; K549-S552 PolarHBondContact O-OG 3.49Å; K549-S552 VanDerWaalsContact O-OG 3.14Å; V550-S552 PolarHBondContact O-N 2.8Å; S552-V554 PolarHBondContact O-N 3.02Å
553	G	88.2	Confident	88.5	Confident	31 Å²	31	53.1 Å²	53.1	32%	0.32	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	10.2	179.5	0	0	0	0	0	115.4	K549 V550 K555	K549-G553 PolarHBondContact O-N 2.82Å; K549-G553 VanDerWaalsContact O-N 3.15Å; V550-G553 PolarHBondContact O-N 3.01Å; V550-G553 VanDerWaalsContact O-N 3.17Å; G553-K555 PolarHBondContact O-N 3.3Å; G553-K555 VanDerWaalsContact O-N 3.07Å
554	V	92.7	Very high	88.9	Confident	67 Å²	67	55.6 Å²	55.6	41%	0.406	31%	0.309	S	S	.	.			trans	-73.4	102.9	176.1	179.9	0	0	0	0	108.7	Y537 K549 S552	Y537-V554 VanDerWaalsContact CE1-O 3.26Å; Y537-V554 WeakPolarHBondContact CE1-O 3.48Å; Y537-V554 PolarHBondContact OH-O 3.09Å; K549-V554 HydrophobicContact CB-CB 3.98Å; K549-V554 HydrophobicContact CB-CG1 4.35Å; K549-V554 HydrophobicContact CD-CB 4.42Å; K549-V554 HydrophobicContact CD-CG1 3.87Å; K549-V554 HydrophobicContact CG-CB 4.06Å; K549-V554 HydrophobicContact CG-CG1 3.98Å; K549-V554 PolarHBondContact O-N 3.03Å; S552-V554 PolarHBondContact O-N 3.02Å
555	K	94.6	Very high	89.1	Confident	71 Å²	71	59.3 Å²	59.3	31%	0.309	32%	0.318	S	S	.	.			trans	-63.2	156.3	178.2	-68.3	166.6	178.8	167.6	0	111.4	G553 F559 D574 I577	G553-K555 PolarHBondContact O-N 3.3Å; G553-K555 VanDerWaalsContact O-N 3.07Å; K555-F559 HydrophobicContact CB-CB 4.33Å; K555-F559 HydrophobicContact CB-CD1 4.28Å; K555-F559 HydrophobicContact CB-CG 4.31Å; K555-F559 HydrophobicContact CD-CD1 4.06Å; K555-F559 HydrophobicContact CD-CE1 3.93Å; K555-F559 HydrophobicContact CD-CZ 4.3Å; K555-D574 IonicContact NZ-OD1 3.33Å; K555-D574 PolarHBondContact NZ-OD1 3.27Å; K555-D574 IonicContact NZ-OD2 2.75Å; K555-D574 PolarHBondContact NZ-OD2 2.86Å; K555-I577 HydrophobicContact CB-CD1 4.44Å; K555-I577 HydrophobicContact CD-CD1 4.35Å; K555-I577 HydrophobicContact CG-CD1 3.97Å
556	P	94	Very high	88.9	Confident	4 Å²	4	61.1 Å²	61.1	3%	0.026	32%	0.321	C	S	.	.			trans	-55.9	148.6	176.7	-25.9	34.6	0	0	0	112.8	M525 L528 P536 Y537 C558 F559	M525-P556 HydrophobicContact CE-CG 4.01Å; M525-P556 HydrophobicContact SD-CG 4.06Å; L528-P556 HydrophobicContact CD2-CB 4.02Å; L528-P556 HydrophobicContact CD2-CG 3.79Å; P536-P556 HydrophobicContact CB-CG 4.3Å; Y537-P556 HydrophobicContact CD1-CB 4.15Å; Y537-P556 HydrophobicContact CD1-CG 4.11Å; Y537-P556 HydrophobicContact CD2-CG 3.92Å; Y537-P556 HydrophobicContact CE1-CB 4.24Å; Y537-P556 HydrophobicContact CE1-CG 3.89Å; Y537-P556 HydrophobicContact CE2-CG 3.7Å; Y537-P556 HydrophobicContact CG-CB 4.34Å; Y537-P556 HydrophobicContact CG-CG 4.13Å; P556-C558 PolarHBondContact O-N 3.31Å; P556-F559 WeakPolarHBondContact O-CB 3.26Å; P556-F559 PolarHBondContact O-N 3.11Å
557	E	93.8	Very high	88.9	Confident	90 Å²	90	65 Å²	65	42%	0.421	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-59	-38.7	177.4	-162.9	-163.9	129.8	0	0	111.9	E539 F559 S560 R561	E539-E557 HydrophobicContact CG-CB 4.14Å; E539-E557 PolarHBondContact OE1-N 3.18Å; E557-F559 PolarHBondContact O-N 2.99Å; E557-F559 VanDerWaalsContact O-N 3.13Å; E557-S560 WeakPolarHBondContact O-CB 3.1Å; E557-S560 PolarHBondContact O-N 2.88Å; E557-S560 PolarHBondContact O-OG 3.3Å; E557-R561 IonicContact OE1-CZ 3.99Å; E557-R561 IonicContact OE1-NE 3.86Å; E557-R561 IonicContact OE1-NH2 3.76Å; E557-R561 PolarHBondContact OE1-NH2 3.35Å
558	C	93.4	Very high	89.1	Confident	2 Å²	2	63 Å²	63	1%	0.014	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-64.2	-14.1	177.5	60.9	0	0	0	0	114.4	T532 E534 P556 S560 R561	T532-C558 HydrophobicContact CG2-CB 4.17Å; T532-C558 WeakPolarHBondContact CG2-O 3.46Å; E534-C558 HydrophobicContact CB-CB 4.23Å; P556-C558 PolarHBondContact O-N 3.31Å; C558-S560 PolarHBondContact O-N 3.11Å; C558-R561 WeakPolarHBondContact O-CA 3.38Å; C558-R561 WeakPolarHBondContact O-CB 3.37Å; C558-R561 PolarHBondContact O-N 3.41Å
559	F	94.7	Very high	89.4	Confident	17 Å²	17	56.6 Å²	56.6	8%	0.075	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-62	-33	169.3	-176.9	-99.7	0	0	0	111.9	K555 P556 E557 R561 I562 R570 I573 D574 I577	K555-F559 HydrophobicContact CB-CB 4.33Å; K555-F559 HydrophobicContact CB-CD1 4.28Å; K555-F559 HydrophobicContact CB-CG 4.31Å; K555-F559 HydrophobicContact CD-CD1 4.06Å; K555-F559 HydrophobicContact CD-CE1 3.93Å; K555-F559 HydrophobicContact CD-CZ 4.3Å; P556-F559 WeakPolarHBondContact O-CB 3.26Å; P556-F559 PolarHBondContact O-N 3.11Å; E557-F559 PolarHBondContact O-N 2.99Å; E557-F559 VanDerWaalsContact O-N 3.13Å; F559-R561 PolarHBondContact O-N 3.49Å; F559-I562 HydrophobicContact CD2-CD1 3.6Å; F559-I562 HydrophobicContact CE2-CD1 3.83Å; F559-I562 HydrophobicContact CG-CD1 4.23Å; F559-I562 WeakPolarHBondContact O-CD1 3.41Å; F559-I562 WeakPolarHBondContact O-CG1 3.37Å; F559-R570 HydrophobicContact CE1-CG 4.38Å; F559-R570 HydrophobicContact CE2-CG 4.19Å; F559-R570 HydrophobicContact CZ-CG 3.79Å; F559-I573 HydrophobicContact CD2-CG2 3.84Å; F559-I573 HydrophobicContact CE2-CB 4.16Å; F559-I573 HydrophobicContact CE2-CG2 3.76Å; F559-D574 HydrophobicContact CE2-CB 4.41Å; F559-D574 HydrophobicContact CZ-CB 4.05Å; F559-D574 WeakPolarHBondContact CZ-OD1 3.44Å; F559-I577 HydrophobicContact CD2-CD1 4.1Å; F559-I577 HydrophobicContact CE2-CD1 4.37Å
560	S	93.1	Very high	89.5	Confident	91 Å²	91	60.9 Å²	60.9	64%	0.636	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-71.5	-16.1	173.2	71.3	0	0	0	0	113.6	E557 C558	E557-S560 WeakPolarHBondContact O-CB 3.1Å; E557-S560 PolarHBondContact O-N 2.88Å; E557-S560 PolarHBondContact O-OG 3.3Å; C558-S560 PolarHBondContact O-N 3.11Å
561	R	91.9	Very high	89.8	Confident	119 Å²	119	63.5 Å²	63.5	45%	0.449	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-97.5	4	-176	-53.9	177.9	-176.9	-170.9	-2.1	113	E534 E557 C558 F559	E534-R561 IonicContact OE1-NH1 2.6Å; E534-R561 PolarHBondContact OE1-NH1 3.37Å; E534-R561 WeakPolarHBondContact OE2-CD 3.34Å; E534-R561 IonicContact OE2-CZ 2.68Å; E534-R561 IonicContact OE2-NE 3.66Å; E534-R561 IonicContact OE2-NH1 3.63Å; E534-R561 PolarHBondContact OE2-NH1 2.95Å; E557-R561 IonicContact OE1-CZ 3.99Å; E557-R561 IonicContact OE1-NE 3.86Å; E557-R561 IonicContact OE1-NH2 3.76Å; E557-R561 PolarHBondContact OE1-NH2 3.35Å; C558-R561 WeakPolarHBondContact O-CA 3.38Å; C558-R561 WeakPolarHBondContact O-CB 3.37Å; C558-R561 PolarHBondContact O-N 3.41Å; F559-R561 PolarHBondContact O-N 3.49Å
562	I	92	Very high	90.2	Very high	15 Å²	15	59.9 Å²	59.9	8%	0.077	32%	0.324	C	S	.	.	S	Bend	trans	-58.4	126.3	171.6	-64.9	165.9	0	0	0	108.3	L528 V531 T532 F559 A564 R570 I573	L528-I562 HydrophobicContact CD1-CD1 3.97Å; L528-I562 HydrophobicContact CD1-CG1 3.9Å; V531-I562 HydrophobicContact CG1-CG2 4.15Å; T532-I562 HydrophobicContact CG2-CG1 4.48Å; F559-I562 HydrophobicContact CD2-CD1 3.6Å; F559-I562 HydrophobicContact CE2-CD1 3.83Å; F559-I562 HydrophobicContact CG-CD1 4.23Å; F559-I562 WeakPolarHBondContact O-CD1 3.41Å; F559-I562 WeakPolarHBondContact O-CG1 3.37Å; I562-A564 PolarHBondContact O-N 3.32Å; I562-R570 HydrophobicContact CD1-CB 4.1Å; I562-R570 HydrophobicContact CD1-CG 4Å; I562-R570 HydrophobicContact CG2-CB 4.04Å; I562-I573 HydrophobicContact CD1-CD1 3.69Å; I562-I573 HydrophobicContact CG1-CD1 4.37Å
563	P	88.3	Confident	90.6	Very high	42 Å²	42	56.1 Å²	56.1	27%	0.273	30%	0.298	S	S	.	.			trans	-62.1	127.4	-173.6	-23.6	33.8	0	0	0	112.5	Q565 Y566	P563-Q565 VanDerWaalsContact CB-CD 3.47Å; P563-Q565 VanDerWaalsContact CB-NE2 3.31Å; P563-Q565 PolarHBondContact O-N 3.05Å; P563-Y566 HydrophobicContact CB-CD2 4.28Å; P563-Y566 PolarHBondContact O-N 2.88Å
564	A	85	Confident	90.9	Very high	95 Å²	95	56.6 Å²	56.6	79%	0.785	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.7	-171.5	0	0	0	0	0	114.9	I562 Y566	I562-A564 PolarHBondContact O-N 3.32Å; A564-Y566 PolarHBondContact O-N 2.95Å
565	Q	80.5	Confident	91	Very high	129 Å²	129	55 Å²	55	60%	0.603	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-1.2	173.1	74.4	-83	11.4	0	0	114.8	P563 P567	P563-Q565 VanDerWaalsContact CB-CD 3.47Å; P563-Q565 VanDerWaalsContact CB-NE2 3.31Å; P563-Q565 PolarHBondContact O-N 3.05Å; Q565-P567 VanDerWaalsContact C-CD 3.5Å
566	Y	83.6	Confident	91.1	Very high	74 Å²	74	51.6 Å²	51.6	29%	0.29	27%	0.265	S	S	.	.			trans	-129.2	61.5	176	-54.4	-57.9	0	0	0	111.8	I436 P563 A564 E568 I569	I436-Y566 HydrophobicContact CD1-CD1 4.41Å; I436-Y566 HydrophobicContact CD1-CE1 4.19Å; I436-Y566 HydrophobicContact CG1-CE1 4.05Å; P563-Y566 HydrophobicContact CB-CD2 4.28Å; P563-Y566 PolarHBondContact O-N 2.88Å; A564-Y566 PolarHBondContact O-N 2.95Å; Y566-E568 VanDerWaalsContact CA-OE2 3.23Å; Y566-E568 WeakPolarHBondContact CA-OE2 3.26Å; Y566-E568 PolarHBondContact O-N 3.19Å; Y566-I569 HydrophobicContact CD1-CD1 4.46Å; Y566-I569 HydrophobicContact CD2-CD1 4.2Å; Y566-I569 HydrophobicContact CG-CD1 3.87Å; Y566-I569 PolarHBondContact O-N 3.28Å
567	P	84.7	Confident	91.1	Very high	84 Å²	84	51.8 Å²	51.8	55%	0.545	27%	0.266	S	S	.	.	H	α-helix	trans	-60	-32	-179.3	27.4	-35.4	0	0	0	112.7	Q565 I569 R570 E571	Q565-P567 VanDerWaalsContact C-CD 3.5Å; P567-I569 VanDerWaalsContact C-N 3.3Å; P567-I569 PolarHBondContact O-N 3.02Å; P567-R570 WeakPolarHBondContact O-CB 3.19Å; P567-R570 PolarHBondContact O-N 2.79Å; P567-R570 VanDerWaalsContact O-N 3.09Å; P567-E571 PolarHBondContact O-N 3.13Å
568	E	85.5	Confident	91.1	Very high	47 Å²	47	50 Å²	50	22%	0.22	26%	0.256	C	S	.	.	H	α-helix	trans	-65.9	-32.9	179.9	78.4	-75.1	-166.2	0	0	112.2	Y566 R570 E571 I572 F595	Y566-E568 VanDerWaalsContact CA-OE2 3.23Å; Y566-E568 WeakPolarHBondContact CA-OE2 3.26Å; Y566-E568 PolarHBondContact O-N 3.19Å; E568-R570 VanDerWaalsContact C-N 3.33Å; E568-E571 PolarHBondContact O-N 3.27Å; E568-I572 WeakPolarHBondContact O-CB 3.22Å; E568-I572 WeakPolarHBondContact O-CD1 3.42Å; E568-I572 VanDerWaalsContact O-CG1 3.22Å; E568-I572 WeakPolarHBondContact O-CG1 3.45Å; E568-I572 PolarHBondContact O-N 3.45Å; E568-F595 HydrophobicContact CG-CB 4.2Å; E568-F595 HydrophobicContact CG-CD2 3.34Å; E568-F595 HydrophobicContact CG-CE2 4.03Å; E568-F595 HydrophobicContact CG-CG 4.06Å; E568-F595 WeakPolarHBondContact OE1-CD2 3.34Å; E568-F595 WeakPolarHBondContact OE1-CE2 3.49Å
569	I	92.2	Very high	90.8	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-65.6	-40.6	172.9	-63.7	-178.1	0	0	0	110.5	I436 L439 L527 V531 Y566 P567 I572 I573 F595	I436-I569 HydrophobicContact CD1-CD1 3.83Å; L439-I569 HydrophobicContact CD2-CD1 4.06Å; L527-I569 HydrophobicContact CD1-CG2 4.4Å; L527-I569 HydrophobicContact CG-CG2 4.44Å; V531-I569 HydrophobicContact CB-CG2 4.5Å; V531-I569 HydrophobicContact CG1-CG2 4.25Å; V531-I569 HydrophobicContact CG2-CD1 4.37Å; V531-I569 HydrophobicContact CG2-CG2 3.62Å; Y566-I569 HydrophobicContact CD1-CD1 4.46Å; Y566-I569 HydrophobicContact CD2-CD1 4.2Å; Y566-I569 HydrophobicContact CG-CD1 3.87Å; Y566-I569 PolarHBondContact O-N 3.28Å; P567-I569 VanDerWaalsContact C-N 3.3Å; P567-I569 PolarHBondContact O-N 3.02Å; I569-I572 PolarHBondContact O-N 3.14Å; I569-I573 HydrophobicContact CG2-CD1 3.8Å; I569-I573 HydrophobicContact CG2-CG1 4.43Å; I569-I573 VanDerWaalsContact O-CG1 3.29Å; I569-I573 WeakPolarHBondContact O-CG1 3.47Å; I569-I573 PolarHBondContact O-N 3.02Å; I569-F595 HydrophobicContact CD1-CE1 4.47Å; I569-F595 HydrophobicContact CD1-CE2 3.7Å; I569-F595 HydrophobicContact CD1-CZ 3.47Å; I569-F595 VanDerWaalsContact CD1-CZ 3.47Å; I569-F595 HydrophobicContact CG1-CD2 4.15Å; I569-F595 HydrophobicContact CG1-CE1 4.07Å; I569-F595 HydrophobicContact CG1-CE2 3.36Å; I569-F595 HydrophobicContact CG1-CZ 3.33Å
570	R	92.7	Very high	90.4	Very high	138 Å²	138	58.3 Å²	58.3	52%	0.521	29%	0.292	S	S	.	.	H	α-helix	trans	-64.8	-43.1	178.1	-176.9	177.1	173.2	-154.7	-5	110.9	F559 I562 P567 E568 I573 D574	F559-R570 HydrophobicContact CE1-CG 4.38Å; F559-R570 HydrophobicContact CE2-CG 4.19Å; F559-R570 HydrophobicContact CZ-CG 3.79Å; I562-R570 HydrophobicContact CD1-CB 4.1Å; I562-R570 HydrophobicContact CD1-CG 4Å; I562-R570 HydrophobicContact CG2-CB 4.04Å; P567-R570 WeakPolarHBondContact O-CB 3.19Å; P567-R570 PolarHBondContact O-N 2.79Å; P567-R570 VanDerWaalsContact O-N 3.09Å; E568-R570 VanDerWaalsContact C-N 3.33Å; R570-I573 PolarHBondContact O-N 2.87Å; R570-D574 WeakPolarHBondContact O-CB 3.44Å; R570-D574 PolarHBondContact O-N 3.38Å
571	E	92.2	Very high	90.1	Very high	61 Å²	61	58.9 Å²	58.9	29%	0.285	28%	0.28	S	S	.	.	H	α-helix	trans	-59	-49.7	174.5	-162.2	-166.1	146.3	0	0	111.3	P567 E568 I573 D574 R575 R611	P567-E571 PolarHBondContact O-N 3.13Å; E568-E571 PolarHBondContact O-N 3.27Å; E571-I573 PolarHBondContact O-N 3.32Å; E571-D574 WeakPolarHBondContact O-CB 3.34Å; E571-D574 PolarHBondContact O-N 2.91Å; E571-D574 VanDerWaalsContact O-N 3.17Å; E571-R575 VanDerWaalsContact CD-NH1 3.31Å; E571-R575 WeakPolarHBondContact O-CG 3.21Å; E571-R575 PolarHBondContact O-N 3.36Å; E571-R575 IonicContact OE1-CZ 3.4Å; E571-R575 IonicContact OE1-NH1 3.23Å; E571-R575 PolarHBondContact OE1-NH1 3.09Å; E571-R611 IonicContact OE1-CZ 3.41Å; E571-R611 IonicContact OE1-NH2 2.62Å; E571-R611 PolarHBondContact OE1-NH2 2.85Å; E571-R611 IonicContact OE2-NE 3.09Å; E571-R611 IonicContact OE2-NH2 2.7Å; E571-R611 PolarHBondContact OE2-NH2 3.18Å
572	I	94.3	Very high	89.9	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-59.7	-46.2	178.4	-70	160.9	0	0	0	111.7	L527 E568 I569 D574 C576 L590 F595 F596	L527-I572 HydrophobicContact CD2-CG2 3.77Å; E568-I572 WeakPolarHBondContact O-CB 3.22Å; E568-I572 WeakPolarHBondContact O-CD1 3.42Å; E568-I572 VanDerWaalsContact O-CG1 3.22Å; E568-I572 WeakPolarHBondContact O-CG1 3.45Å; E568-I572 PolarHBondContact O-N 3.45Å; I569-I572 PolarHBondContact O-N 3.14Å; I572-D574 VanDerWaalsContact C-N 3.34Å; I572-C576 PolarHBondContact O-N 3.36Å; I572-C576 VanDerWaalsContact O-N 3.13Å; I572-C576 PolarHBondContact O-SG 2.8Å; I572-L590 HydrophobicContact CG2-CD2 4.15Å; I572-F595 HydrophobicContact CD1-CB 3.44Å; I572-F595 VanDerWaalsContact CD1-CB 3.44Å; I572-F595 HydrophobicContact CD1-CD1 3.74Å; I572-F595 HydrophobicContact CD1-CG 3.71Å; I572-F596 HydrophobicContact CD1-CE2 3.98Å; I572-F596 HydrophobicContact CD1-CZ 4.31Å; I572-F596 HydrophobicContact CG2-CE2 3.86Å; I572-F596 HydrophobicContact CG2-CZ 4Å
573	I	96.2	Very high	89.8	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-45.6	176.1	-67.1	164.7	0	0	0	109.8	L527 L528 F559 I562 I569 R570 E571 R575 C576 I577	L527-I573 HydrophobicContact CB-CG1 4.19Å; L527-I573 HydrophobicContact CD2-CD1 4.44Å; L527-I573 HydrophobicContact CD2-CG1 3.7Å; L527-I573 HydrophobicContact CG-CD1 4Å; L527-I573 HydrophobicContact CG-CG1 3.7Å; L528-I573 HydrophobicContact CB-CD1 4.17Å; L528-I573 HydrophobicContact CB-CG2 4.36Å; L528-I573 HydrophobicContact CD1-CD1 4.26Å; F559-I573 HydrophobicContact CD2-CG2 3.84Å; F559-I573 HydrophobicContact CE2-CB 4.16Å; F559-I573 HydrophobicContact CE2-CG2 3.76Å; I562-I573 HydrophobicContact CD1-CD1 3.69Å; I562-I573 HydrophobicContact CG1-CD1 4.37Å; I569-I573 HydrophobicContact CG2-CD1 3.8Å; I569-I573 HydrophobicContact CG2-CG1 4.43Å; I569-I573 VanDerWaalsContact O-CG1 3.29Å; I569-I573 WeakPolarHBondContact O-CG1 3.47Å; I569-I573 PolarHBondContact O-N 3.02Å; R570-I573 PolarHBondContact O-N 2.87Å; E571-I573 PolarHBondContact O-N 3.32Å; I573-R575 PolarHBondContact O-N 3.29Å; I573-C576 WeakPolarHBondContact O-CB 3.37Å; I573-C576 PolarHBondContact O-N 3.38Å; I573-I577 HydrophobicContact CG2-CD1 3.97Å; I573-I577 HydrophobicContact CG2-CG1 4.37Å; I573-I577 HydrophobicContact CG2-CG2 4.28Å; I573-I577 WeakPolarHBondContact O-CG1 3.33Å; I573-I577 PolarHBondContact O-N 3Å
574	D	94.6	Very high	90.1	Very high	41 Å²	41	59.4 Å²	59.4	22%	0.219	28%	0.284	C	S	.	.	H	α-helix	trans	-55.9	-51	-179.6	-151.7	104.9	0	0	0	111.6	K555 F559 R570 E571 I572 C576 I577 R578	K555-D574 IonicContact NZ-OD1 3.33Å; K555-D574 PolarHBondContact NZ-OD1 3.27Å; K555-D574 IonicContact NZ-OD2 2.75Å; K555-D574 PolarHBondContact NZ-OD2 2.86Å; F559-D574 HydrophobicContact CE2-CB 4.41Å; F559-D574 HydrophobicContact CZ-CB 4.05Å; F559-D574 WeakPolarHBondContact CZ-OD1 3.44Å; R570-D574 WeakPolarHBondContact O-CB 3.44Å; R570-D574 PolarHBondContact O-N 3.38Å; E571-D574 WeakPolarHBondContact O-CB 3.34Å; E571-D574 PolarHBondContact O-N 2.91Å; E571-D574 VanDerWaalsContact O-N 3.17Å; I572-D574 VanDerWaalsContact C-N 3.34Å; D574-C576 PolarHBondContact O-N 3.1Å; D574-I577 PolarHBondContact O-N 2.72Å; D574-R578 WeakPolarHBondContact O-CG 3.49Å; D574-R578 PolarHBondContact O-N 2.72Å
575	R	94.2	Very high	90.4	Very high	32 Å²	32	55.6 Å²	55.6	12%	0.121	25%	0.251	C	S	.	.	H	α-helix	trans	-67.1	-15.7	177.5	-56.9	-176.9	-36.2	-125.8	-1.8	113.7	E571 I573 R584 S585 D593	E571-R575 VanDerWaalsContact CD-NH1 3.31Å; E571-R575 WeakPolarHBondContact O-CG 3.21Å; E571-R575 PolarHBondContact O-N 3.36Å; E571-R575 IonicContact OE1-CZ 3.4Å; E571-R575 IonicContact OE1-NH1 3.23Å; E571-R575 PolarHBondContact OE1-NH1 3.09Å; I573-R575 PolarHBondContact O-N 3.29Å; R575-R584 VanDerWaalsContact O-CA 3.26Å; R575-R584 WeakPolarHBondContact O-CA 3.38Å; R575-S585 WeakPolarHBondContact CB-OG 3.23Å; R575-S585 PolarHBondContact NE-OG 2.9Å; R575-S585 PolarHBondContact O-N 3.47Å; R575-D593 IonicContact CZ-OD2 2.78Å; R575-D593 IonicContact NH1-OD2 2.83Å; R575-D593 IonicContact NH2-OD2 2.8Å; R575-D593 PolarHBondContact NH2-OD2 2.98Å
576	C	96.5	Very high	91	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-86.6	-37.6	171.4	-65.5	0	0	0	0	112.7	V520 Y521 I572 I573 D574 R584	V520-C576 HydrophobicContact CG1-CB 4.23Å; Y521-C576 WeakPolarHBondContact CA-O 3.47Å; I572-C576 PolarHBondContact O-N 3.36Å; I572-C576 VanDerWaalsContact O-N 3.13Å; I572-C576 PolarHBondContact O-SG 2.8Å; I573-C576 WeakPolarHBondContact O-CB 3.37Å; I573-C576 PolarHBondContact O-N 3.38Å; D574-C576 PolarHBondContact O-N 3.1Å; C576-R584 WeakPolarHBondContact O-CD 3.2Å
577	I	94.7	Very high	91.6	Very high	9 Å²	9	49.7 Å²	49.7	5%	0.046	23%	0.232	C	C	.	.	S	Bend	trans	-98.8	18.1	-171	73.6	175.6	0	0	0	114.6	Y521 M525 K555 F559 I573 D574	Y521-I577 HydrophobicContact CD2-CB 4.25Å; Y521-I577 HydrophobicContact CE2-CB 4.05Å; M525-I577 HydrophobicContact CE-CB 4.21Å; M525-I577 HydrophobicContact CE-CD1 4.35Å; M525-I577 HydrophobicContact CE-CG2 3.96Å; M525-I577 HydrophobicContact CG-CG2 4.34Å; M525-I577 HydrophobicContact SD-CG2 4.13Å; K555-I577 HydrophobicContact CB-CD1 4.44Å; K555-I577 HydrophobicContact CD-CD1 4.35Å; K555-I577 HydrophobicContact CG-CD1 3.97Å; F559-I577 HydrophobicContact CD2-CD1 4.1Å; F559-I577 HydrophobicContact CE2-CD1 4.37Å; I573-I577 HydrophobicContact CG2-CD1 3.97Å; I573-I577 HydrophobicContact CG2-CG1 4.37Å; I573-I577 HydrophobicContact CG2-CG2 4.28Å; I573-I577 WeakPolarHBondContact O-CG1 3.33Å; I573-I577 PolarHBondContact O-N 3Å; D574-I577 PolarHBondContact O-N 2.72Å
578	R	93.2	Very high	91.9	Very high	53 Å²	53	52.9 Å²	52.9	20%	0.2	24%	0.237	C	C	.	.			trans	-61.3	146.4	174.7	-66.7	-174.4	173.3	167.7	-14	111.5	D574 E583 R584 H694	D574-R578 WeakPolarHBondContact O-CG 3.49Å; D574-R578 PolarHBondContact O-N 2.72Å; R578-E583 HydrophobicContact CB-CB 4.35Å; R578-E583 VanDerWaalsContact CD-O 3.3Å; R578-E583 WeakPolarHBondContact CD-O 3.17Å; R578-E583 PolarHBondContact NH1-O 3.17Å; R578-R584 HydrophobicContact CB-CG 4.16Å; R578-R584 PolarHBondContact O-NE 2.7Å; R578-R584 PolarHBondContact O-NH2 3.22Å; R578-H694 PolarHBondContact NH1-NE2 2.8Å; R578-H694 PolarHBondContact NH2-CE1 2.9Å
579	V	87.9	Confident	92.2	Very high	57 Å²	57	55 Å²	55	35%	0.345	25%	0.247	S	C	.	.	S	Bend	trans	-64.1	-58.4	-176.7	-176.2	0	0	0	0	110.6	P507 R581 R584	P507-V579 HydrophobicContact CG-CG1 4.16Å; P507-V579 WeakPolarHBondContact CG-O 3.47Å; V579-R581 PolarHBondContact O-N 2.92Å; V579-R584 PolarHBondContact O-NH2 2.84Å
580	R	84.7	Confident	92.3	Very high	136 Å²	136	54.9 Å²	54.9	51%	0.513	25%	0.246	S	C	.	.	S	Bend	trans	-66.7	131.9	174.2	-57.6	-168.2	-173.7	98.7	0.3	109.5	E582 E583	R580-E582 VanDerWaalsContact C-N 3.33Å; R580-E583 HydrophobicContact CB-CB 4.4Å; R580-E583 HydrophobicContact CB-CG 3.94Å; R580-E583 WeakPolarHBondContact CD-OE1 3.4Å; R580-E583 IonicContact CZ-OE1 2.67Å; R580-E583 IonicContact NH1-OE1 2.65Å; R580-E583 PolarHBondContact NH1-OE1 3.46Å; R580-E583 IonicContact NH1-OE2 2.65Å; R580-E583 PolarHBondContact O-N 3.17Å
581	R	87.7	Confident	92.2	Very high	102 Å²	102	50.8 Å²	50.8	39%	0.385	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-68.1	-34.6	-180	56.9	173	-173.4	167	-3.9	112.4	D515 S517 V579 E583 R584	D515-R581 VanDerWaalsContact OD2-CD 3.26Å; D515-R581 WeakPolarHBondContact OD2-CD 3.1Å; D515-R581 IonicContact OD2-CZ 2.63Å; D515-R581 IonicContact OD2-NE 3.4Å; D515-R581 IonicContact OD2-NH1 3.11Å; D515-R581 PolarHBondContact OD2-NH1 3.07Å; S517-R581 VanDerWaalsContact OG-CB 3.3Å; S517-R581 WeakPolarHBondContact OG-CB 3.31Å; V579-R581 PolarHBondContact O-N 2.92Å; R581-E583 PolarHBondContact O-N 3.15Å; R581-R584 WeakPolarHBondContact O-CB 3.4Å; R581-R584 PolarHBondContact O-N 3.4Å; R581-R584 VanDerWaalsContact O-N 3.1Å
582	E	88.3	Confident	91.8	Very high	129 Å²	129	52.1 Å²	52.1	60%	0.603	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-65.7	-22.4	-178.5	-59.4	76.7	-167.6	0	0	112.1	R580	R580-E582 VanDerWaalsContact C-N 3.33Å
583	E	89	Confident	91.3	Very high	45 Å²	45	53.5 Å²	53.5	21%	0.21	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-89.1	-6.9	179.2	-61.7	176.3	165.2	0	0	112.7	R578 R580 R581 R701	R578-E583 HydrophobicContact CB-CB 4.35Å; R578-E583 VanDerWaalsContact CD-O 3.3Å; R578-E583 WeakPolarHBondContact CD-O 3.17Å; R578-E583 PolarHBondContact NH1-O 3.17Å; R580-E583 HydrophobicContact CB-CB 4.4Å; R580-E583 HydrophobicContact CB-CG 3.94Å; R580-E583 WeakPolarHBondContact CD-OE1 3.4Å; R580-E583 IonicContact CZ-OE1 2.67Å; R580-E583 IonicContact NH1-OE1 2.65Å; R580-E583 PolarHBondContact NH1-OE1 3.46Å; R580-E583 IonicContact NH1-OE2 2.65Å; R580-E583 PolarHBondContact O-N 3.17Å; R581-E583 PolarHBondContact O-N 3.15Å; E583-R701 IonicContact OE1-CZ 3.39Å; E583-R701 IonicContact OE1-NH1 2.94Å; E583-R701 PolarHBondContact OE1-NH1 2.76Å; E583-R701 IonicContact OE1-NH2 2.61Å
584	R	93.9	Very high	90.4	Very high	14 Å²	14	56 Å²	56	5%	0.053	27%	0.267	C	S	.	.	S	Bend	trans	-81.9	146.6	-175.5	-59.9	177.8	-164.6	146.6	13.7	112.2	E508 S517 V520 R575 C576 R578 V579 R581 T586	E508-R584 IonicContact OE1-CZ 3.96Å; E508-R584 IonicContact OE1-NH1 2.82Å; E508-R584 PolarHBondContact OE1-NH1 2.81Å; E508-R584 IonicContact OE1-NH2 2.78Å; E508-R584 PolarHBondContact OE1-NH2 2.69Å; E508-R584 IonicContact OE2-CZ 2.73Å; E508-R584 IonicContact OE2-NH1 3.48Å; E508-R584 IonicContact OE2-NH2 2.79Å; E508-R584 PolarHBondContact OE2-NH2 2.93Å; S517-R584 PolarHBondContact O-NH1 2.55Å; S517-R584 VanDerWaalsContact O-NH1 3.12Å; S517-R584 PolarHBondContact OG-NH1 2.87Å; V520-R584 HydrophobicContact CG1-CB 4.23Å; R575-R584 VanDerWaalsContact O-CA 3.26Å; R575-R584 WeakPolarHBondContact O-CA 3.38Å; C576-R584 WeakPolarHBondContact O-CD 3.2Å; R578-R584 HydrophobicContact CB-CG 4.16Å; R578-R584 PolarHBondContact O-NE 2.7Å; R578-R584 PolarHBondContact O-NH2 3.22Å; V579-R584 PolarHBondContact O-NH2 2.84Å; R581-R584 WeakPolarHBondContact O-CB 3.4Å; R581-R584 PolarHBondContact O-N 3.4Å; R581-R584 VanDerWaalsContact O-N 3.1Å; R584-T586 PolarHBondContact O-N 3.13Å
585	S	91.8	Very high	89.8	Confident	14 Å²	14	54.2 Å²	54.2	10%	0.098	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-67.3	122	173.4	-64.2	0	0	0	0	111.8	V520 R575	V520-S585 WeakPolarHBondContact CG1-O 3.46Å; R575-S585 WeakPolarHBondContact CB-OG 3.23Å; R575-S585 PolarHBondContact NE-OG 2.9Å; R575-S585 PolarHBondContact O-N 3.47Å
586	T	93.7	Very high	89.2	Confident	70 Å²	70	52.8 Å²	52.8	43%	0.429	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-61.7	154.5	173.3	63.3	0	0	0	0	111.8	R584 K588 Q589 L590	R584-T586 PolarHBondContact O-N 3.13Å; T586-K588 PolarHBondContact O-N 3.42Å; T586-K588 VanDerWaalsContact O-N 3.13Å; T586-Q589 PolarHBondContact O-N 2.93Å; T586-Q589 VanDerWaalsContact OG1-CD 3.27Å; T586-Q589 WeakPolarHBondContact OG1-CG 3.44Å; T586-Q589 PolarHBondContact OG1-N 2.71Å; T586-Q589 PolarHBondContact OG1-OE1 2.82Å; T586-L590 WeakPolarHBondContact O-CG 3.22Å; T586-L590 PolarHBondContact O-N 3.48Å
587	V	95	Very high	87.9	Confident	10 Å²	10	54.8 Å²	54.8	6%	0.061	27%	0.265	C	S	.	.	H	α-helix	trans	-57	-31	176	-177.4	0	0	0	0	112.2	L447 L450 V520 L591	L447-V587 HydrophobicContact CB-CG1 4.34Å; L447-V587 HydrophobicContact CD2-CG1 4.07Å; L447-V587 VanDerWaalsContact O-CG1 3.24Å; L447-V587 WeakPolarHBondContact O-CG1 3.21Å; L450-V587 HydrophobicContact CB-CG1 4.17Å; L450-V587 HydrophobicContact CB-CG2 4.2Å; L450-V587 HydrophobicContact CD1-CG2 4.5Å; V520-V587 HydrophobicContact CG2-CG2 3.73Å; V587-L591 HydrophobicContact CG1-CD1 4.25Å; V587-L591 WeakPolarHBondContact O-CB 3.44Å; V587-L591 WeakPolarHBondContact O-CG 3.45Å; V587-L591 PolarHBondContact O-N 2.91Å
588	K	92	Very high	86.4	Confident	151 Å²	151	56.5 Å²	56.5	66%	0.657	28%	0.276	S	S	*	.	H	α-helix	trans	-65	-47.3	173.7	-68.2	178.5	-179	172.1	0	111.9	T586 L591 V592	T586-K588 PolarHBondContact O-N 3.42Å; T586-K588 VanDerWaalsContact O-N 3.13Å; K588-L591 PolarHBondContact O-N 3.17Å; K588-V592 PolarHBondContact O-N 3.27Å
589	Q	91.6	Very high	84.7	Confident	90 Å²	90	57.5 Å²	57.5	42%	0.421	28%	0.283	S	S	.	.	H	α-helix	trans	-63.2	-43.2	175.6	-72.1	157.3	-32.2	0	0	111.3	T586 L591 V592 D593	T586-Q589 PolarHBondContact O-N 2.93Å; T586-Q589 VanDerWaalsContact OG1-CD 3.27Å; T586-Q589 WeakPolarHBondContact OG1-CG 3.44Å; T586-Q589 PolarHBondContact OG1-N 2.71Å; T586-Q589 PolarHBondContact OG1-OE1 2.82Å; Q589-L591 VanDerWaalsContact C-N 3.29Å; Q589-L591 PolarHBondContact O-N 2.9Å; Q589-V592 PolarHBondContact O-N 3.1Å; Q589-V592 VanDerWaalsContact O-N 3.11Å; Q589-D593 PolarHBondContact O-N 3.36Å; Q589-D593 VanDerWaalsContact O-N 3.09Å
590	L	93.7	Very high	83	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-64.4	-28.5	177.3	-67.2	172.4	0	0	0	113.3	L447 V520 F523 I572 T586 V592 F596	L447-L590 HydrophobicContact CD1-CB 3.9Å; L447-L590 HydrophobicContact CD2-CB 3.85Å; L447-L590 HydrophobicContact CD2-CD1 3.88Å; V520-L590 HydrophobicContact CG1-CD1 4.25Å; F523-L590 HydrophobicContact CD1-CD1 4.19Å; F523-L590 HydrophobicContact CE1-CD1 4.22Å; I572-L590 HydrophobicContact CG2-CD2 4.15Å; T586-L590 WeakPolarHBondContact O-CG 3.22Å; T586-L590 PolarHBondContact O-N 3.48Å; L590-V592 VanDerWaalsContact C-N 3.32Å; L590-F596 WeakPolarHBondContact O-CD2 3.43Å
591	L	90.5	Very high	81.4	Confident	51 Å²	51	59.8 Å²	59.8	27%	0.267	30%	0.303	S	S	.	.	H	α-helix	trans	-76.4	-17.2	174.4	-80.1	170.9	0	0	0	114.1	L447 K448 V587 K588 Q589	L447-L591 HydrophobicContact CB-CD2 3.57Å; L447-L591 HydrophobicContact CB-CG 3.91Å; K448-L591 HydrophobicContact CG-CD2 3.95Å; V587-L591 HydrophobicContact CG1-CD1 4.25Å; V587-L591 WeakPolarHBondContact O-CB 3.44Å; V587-L591 WeakPolarHBondContact O-CG 3.45Å; V587-L591 PolarHBondContact O-N 2.91Å; K588-L591 PolarHBondContact O-N 3.17Å; Q589-L591 VanDerWaalsContact C-N 3.29Å; Q589-L591 PolarHBondContact O-N 2.9Å
592	V	84.7	Confident	80	Confident	90 Å²	90	56.6 Å²	56.6	55%	0.545	29%	0.293	S	S	.	.	H	α-helix	trans	-97.1	-17.6	177.5	177.4	0	0	0	0	111.7	K588 Q589 L590 D594	K588-V592 PolarHBondContact O-N 3.27Å; Q589-V592 PolarHBondContact O-N 3.1Å; Q589-V592 VanDerWaalsContact O-N 3.11Å; L590-V592 VanDerWaalsContact C-N 3.32Å; V592-D594 PolarHBondContact O-N 3.01Å
593	D	83.8	Confident	79	Confident	30 Å²	30	50.9 Å²	50.9	16%	0.16	27%	0.269	C	S	.	.	S	Bend	trans	-55.3	130.6	177.5	-174.9	-63.3	0	0	0	112.6	R575 Q589 F595 F596 T597	R575-D593 IonicContact CZ-OD2 2.78Å; R575-D593 IonicContact NH1-OD2 2.83Å; R575-D593 IonicContact NH2-OD2 2.8Å; R575-D593 PolarHBondContact NH2-OD2 2.98Å; Q589-D593 PolarHBondContact O-N 3.36Å; Q589-D593 VanDerWaalsContact O-N 3.09Å; D593-F595 PolarHBondContact O-N 2.88Å; D593-F595 VanDerWaalsContact O-N 3.09Å; D593-F595 VanDerWaalsContact OD1-CB 3.28Å; D593-F595 WeakPolarHBondContact OD1-CB 3.5Å; D593-F595 PolarHBondContact OD1-N 3.08Å; D593-F596 HydrophobicContact CB-CD2 4.18Å; D593-F596 PolarHBondContact O-N 2.91Å; D593-T597 PolarHBondContact O-N 2.98Å
594	D	77.4	Confident	78.4	Confident	52 Å²	52	49.2 Å²	49.2	28%	0.278	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-43.8	-42.1	-179.7	-73.3	-55.1	0	0	0	114.5	V592 F596 T597 K684	V592-D594 PolarHBondContact O-N 3.01Å; D594-F596 PolarHBondContact O-N 3.01Å; D594-T597 PolarHBondContact O-N 3.09Å; D594-T597 VanDerWaalsContact O-N 3.16Å; D594-T597 PolarHBondContact O-OG1 2.87Å; D594-K684 VanDerWaalsContact CG-CE 3.4Å; D594-K684 WeakPolarHBondContact OD1-CE 3.2Å; D594-K684 IonicContact OD1-NZ 2.79Å; D594-K684 PolarHBondContact OD1-NZ 3.13Å; D594-K684 VanDerWaalsContact OD2-CE 3.25Å; D594-K684 WeakPolarHBondContact OD2-CE 3.39Å; D594-K684 IonicContact OD2-NZ 2.7Å; D594-K684 PolarHBondContact OD2-NZ 3.25Å
595	F	81.4	Confident	77.7	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.018	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-63.2	-31.5	-176.8	179	-99.3	0	0	0	112.1	I436 K440 E568 I569 I572 D593	I436-F595 HydrophobicContact CD1-CE2 3.85Å; I436-F595 HydrophobicContact CD1-CZ 3.71Å; K440-F595 HydrophobicContact CD-CD2 4.47Å; K440-F595 HydrophobicContact CD-CE2 4.25Å; K440-F595 HydrophobicContact CD-CZ 4.31Å; K440-F595 WeakPolarHBondContact CD-O 3.35Å; K440-F595 WeakPolarHBondContact CE-O 3.23Å; K440-F595 HydrophobicContact CG-CD1 4.25Å; K440-F595 HydrophobicContact CG-CD2 4.5Å; K440-F595 HydrophobicContact CG-CE1 3.73Å; K440-F595 HydrophobicContact CG-CE2 4.04Å; K440-F595 HydrophobicContact CG-CZ 3.59Å; K440-F595 WeakPolarHBondContact CG-O 3.43Å; K440-F595 PolarHBondContact NZ-O 3.37Å; E568-F595 HydrophobicContact CG-CB 4.2Å; E568-F595 HydrophobicContact CG-CD2 3.34Å; E568-F595 HydrophobicContact CG-CE2 4.03Å; E568-F595 HydrophobicContact CG-CG 4.06Å; E568-F595 WeakPolarHBondContact OE1-CD2 3.34Å; E568-F595 WeakPolarHBondContact OE1-CE2 3.49Å; I569-F595 HydrophobicContact CD1-CE1 4.47Å; I569-F595 HydrophobicContact CD1-CE2 3.7Å; I569-F595 HydrophobicContact CD1-CZ 3.47Å; I569-F595 VanDerWaalsContact CD1-CZ 3.47Å; I569-F595 HydrophobicContact CG1-CD2 4.15Å; I569-F595 HydrophobicContact CG1-CE1 4.07Å; I569-F595 HydrophobicContact CG1-CE2 3.36Å; I569-F595 HydrophobicContact CG1-CZ 3.33Å; I572-F595 HydrophobicContact CD1-CB 3.44Å; I572-F595 VanDerWaalsContact CD1-CB 3.44Å; I572-F595 HydrophobicContact CD1-CD1 3.74Å; I572-F595 HydrophobicContact CD1-CG 3.71Å; D593-F595 PolarHBondContact O-N 2.88Å; D593-F595 VanDerWaalsContact O-N 3.09Å; D593-F595 VanDerWaalsContact OD1-CB 3.28Å; D593-F595 WeakPolarHBondContact OD1-CB 3.5Å; D593-F595 PolarHBondContact OD1-N 3.08Å
596	F	82.2	Confident	77.4	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.009	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-94.9	-6.6	177.6	-57.6	-62.5	0	0	0	113.5	C443 R444 L447 F523 L527 I572 L590 D593 D594	C443-F596 HydrophobicContact CB-CD1 3.87Å; C443-F596 HydrophobicContact CB-CE1 3.26Å; C443-F596 HydrophobicContact CB-CZ 4.1Å; R444-F596 HydrophobicContact CB-CB 4.48Å; R444-F596 WeakPolarHBondContact CD-O 3.36Å; R444-F596 PolarHBondContact NH1-O 3.25Å; L447-F596 HydrophobicContact CD1-CD2 3.92Å; L447-F596 HydrophobicContact CD1-CE2 3.94Å; L447-F596 HydrophobicContact CD1-CG 4.21Å; L447-F596 HydrophobicContact CD1-CZ 4.29Å; F523-F596 HydrophobicContact CE1-CZ 4.41Å; F523-F596 AromaticContact CZ-CZ 3.96Å; F523-F596 HydrophobicContact CZ-CZ 3.96Å; L527-F596 HydrophobicContact CD2-CZ 4.33Å; I572-F596 HydrophobicContact CD1-CE2 3.98Å; I572-F596 HydrophobicContact CD1-CZ 4.31Å; I572-F596 HydrophobicContact CG2-CE2 3.86Å; I572-F596 HydrophobicContact CG2-CZ 4Å; L590-F596 WeakPolarHBondContact O-CD2 3.43Å; D593-F596 HydrophobicContact CB-CD2 4.18Å; D593-F596 PolarHBondContact O-N 2.91Å; D594-F596 PolarHBondContact O-N 3.01Å
597	T	69.9	Low	77.1	Confident	42 Å²	42	49.9 Å²	49.9	26%	0.258	26%	0.255	S	S	.	.	S	Bend	trans	-60.9	143.2	168.8	69	0	0	0	0	110.6	D593 D594 E599	D593-T597 PolarHBondContact O-N 2.98Å; D594-T597 PolarHBondContact O-N 3.09Å; D594-T597 VanDerWaalsContact O-N 3.16Å; D594-T597 PolarHBondContact O-OG1 2.87Å; T597-E599 PolarHBondContact O-N 3.47Å
598	P	62.4	Low	76.8	Confident	45 Å²	45	50.5 Å²	50.5	29%	0.292	26%	0.258	S	S	.	.			trans	-80.1	100.6	-179.8	-9.8	27.3	0	0	0	111.4	D600 L601	P598-D600 PolarHBondContact O-N 3.32Å; P598-D600 VanDerWaalsContact O-N 3.14Å; P598-L601 HydrophobicContact CB-CB 4.29Å; P598-L601 HydrophobicContact CB-CD1 4.1Å; P598-L601 PolarHBondContact O-N 2.83Å
599	E	57.4	Low	76.6	Confident	73 Å²	73	47.5 Å²	47.5	34%	0.341	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-45	-43.6	172.4	-61.9	164.4	164.2	0	0	112.1	K440 T597 L601 I602 G603	K440-E599 IonicContact NZ-OE1 2.7Å; K440-E599 PolarHBondContact NZ-OE1 3.14Å; T597-E599 PolarHBondContact O-N 3.47Å; E599-L601 PolarHBondContact O-N 3.23Å; E599-I602 PolarHBondContact O-N 3.08Å; E599-G603 PolarHBondContact O-N 3.47Å
600	D	51.8	Low	76.4	Confident	97 Å²	97	46.8 Å²	46.8	52%	0.519	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-71.5	-5.7	-176.8	-56.3	-49.6	0	0	0	114.6	K437 P598	K437-D600 IonicContact NZ-OD1 2.73Å; K437-D600 PolarHBondContact NZ-OD1 2.91Å; K437-D600 IonicContact NZ-OD2 3.59Å; P598-D600 PolarHBondContact O-N 3.32Å; P598-D600 VanDerWaalsContact O-N 3.14Å
601	L	51.5	Low	76	Confident	145 Å²	145	49.3 Å²	49.3	76%	0.759	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-88.9	-19	174	-111	73.1	0	0	0	113.6	P598 E599	P598-L601 HydrophobicContact CB-CB 4.29Å; P598-L601 HydrophobicContact CB-CD1 4.1Å; P598-L601 PolarHBondContact O-N 2.83Å; E599-L601 PolarHBondContact O-N 3.23Å
602	I	58.7	Low	75.6	Confident	34 Å²	34	52.4 Å²	52.4	17%	0.174	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-41.3	-167.1	-60.2	179.3	0	0	0	110	E599 I604 K633 M676 L680	E599-I602 PolarHBondContact O-N 3.08Å; I602-I604 HydrophobicContact CG2-CB 3.76Å; I602-I604 HydrophobicContact CG2-CD1 4.25Å; I602-I604 HydrophobicContact CG2-CG1 4.5Å; I602-I604 PolarHBondContact O-N 3.46Å; I602-K633 PolarHBondContact O-NZ 2.92Å; I602-M676 HydrophobicContact CB-CE 4.46Å; I602-M676 HydrophobicContact CB-SD 3.95Å; I602-M676 HydrophobicContact CD1-CG 4.47Å; I602-M676 HydrophobicContact CG1-CG 4.39Å; I602-M676 HydrophobicContact CG1-SD 3.84Å; I602-M676 HydrophobicContact CG2-CE 3.56Å; I602-M676 HydrophobicContact CG2-CG 4Å; I602-M676 HydrophobicContact CG2-SD 3.49Å; I602-M676 WeakPolarHBondContact CG2-SD 3.15Å; I602-L680 HydrophobicContact CD1-CD1 4.43Å; I602-L680 HydrophobicContact CD1-CD2 4.12Å; I602-L680 HydrophobicContact CG2-CD1 3.84Å
603	G	66	Low	75.6	Confident	10 Å²	10	50.3 Å²	50.3	10%	0.103	26%	0.263	C	S	.	.	S	Bend	trans	74.4	3.5	-175.1	0	0	0	0	0	114.1	E599 V628 Y629 D630	E599-G603 PolarHBondContact O-N 3.47Å; G603-V628 CarbonylContact O-C 3.58Å; G603-Y629 PolarHBondContact O-N 2.66Å; G603-D630 PolarHBondContact O-N 2.78Å; G603-D630 VanDerWaalsContact O-N 3.11Å
604	I	76.8	Confident	75.8	Confident	9 Å²	9	49.3 Å²	49.3	5%	0.046	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	146.1	-173.4	-61.5	140.6	0	0	0	108.5	I602 L626 R627 V628 K633 Y637 M676 I677 L680	I602-I604 HydrophobicContact CG2-CB 3.76Å; I602-I604 HydrophobicContact CG2-CD1 4.25Å; I602-I604 HydrophobicContact CG2-CG1 4.5Å; I602-I604 PolarHBondContact O-N 3.46Å; I604-L626 HydrophobicContact CG2-CD1 3.37Å; I604-L626 HydrophobicContact CG2-CG 4.18Å; I604-R627 CarbonylContact C-O 3.46Å; I604-R627 WeakPolarHBondContact CA-O 3.2Å; I604-V628 HydrophobicContact CG1-CG1 4.49Å; I604-V628 HydrophobicContact CG1-CG2 3.97Å; I604-K633 HydrophobicContact CD1-CD 4Å; I604-Y637 HydrophobicContact CD1-CE2 4.31Å; I604-Y637 WeakPolarHBondContact CD1-OH 3.48Å; I604-Y637 HydrophobicContact CG1-CE2 4.48Å; I604-M676 HydrophobicContact CD1-CE 3.54Å; I604-I677 HydrophobicContact CD1-CD1 4.42Å; I604-I677 HydrophobicContact CG2-CD1 4.31Å; I604-I677 HydrophobicContact CG2-CG1 4.32Å; I604-L680 HydrophobicContact CG2-CD1 4.31Å
605	R	78.7	Confident	76.2	Confident	79 Å²	79	48.2 Å²	48.2	30%	0.298	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	143	176.6	-169.3	178.8	-177.4	-144	7.4	109.8	E607 L626 R627 Y629	R605-E607 WeakPolarHBondContact CD-OE1 3.48Å; R605-E607 HydrophobicContact CG-CG 4.19Å; R605-E607 IonicContact CZ-OE1 3.68Å; R605-E607 IonicContact NE-OE1 2.67Å; R605-E607 IonicContact NH1-OE1 3.78Å; R605-E607 PolarHBondContact NH1-OE1 2.99Å; R605-E607 IonicContact NH1-OE2 2.65Å; R605-E607 PolarHBondContact NH1-OE2 3.41Å; R605-L626 CarbonylContact O-C 3.54Å; R605-L626 WeakPolarHBondContact O-CA 3.13Å; R605-R627 PolarHBondContact N-O 3.38Å; R605-R627 PolarHBondContact O-N 3.09Å; R605-Y629 HydrophobicContact CB-CD2 4.2Å; R605-Y629 HydrophobicContact CB-CE2 3.83Å
606	V	87	Confident	76.4	Confident	1 Å²	1	52 Å²	52	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	139.5	165	-179.7	0	0	0	0	108.5	M624 Q625 L626 F647 L680 I681 K684	V606-M624 HydrophobicContact CG1-CE 3.75Å; V606-Q625 CarbonylContact C-O 3.58Å; V606-Q625 WeakPolarHBondContact CA-O 3.21Å; V606-L626 HydrophobicContact CG2-CD1 3.64Å; V606-F647 HydrophobicContact CG1-CZ 4.49Å; V606-L680 HydrophobicContact CB-CB 4.46Å; V606-L680 HydrophobicContact CG2-CB 3.78Å; V606-I681 HydrophobicContact CG1-CG1 4.43Å; V606-I681 HydrophobicContact CG2-CG1 4.16Å; V606-K684 HydrophobicContact CB-CG 4.17Å; V606-K684 HydrophobicContact CG1-CG 4.02Å; V606-K684 WeakPolarHBondContact O-CE 3.43Å; V606-K684 PolarHBondContact O-NZ 2.95Å
607	E	86.4	Confident	76.6	Confident	32 Å²	32	57.5 Å²	57.5	15%	0.15	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	149.4	177.7	-68.8	170.6	-137.7	0	0	109.1	R605 M624 Q625 R627	R605-E607 WeakPolarHBondContact CD-OE1 3.48Å; R605-E607 HydrophobicContact CG-CG 4.19Å; R605-E607 IonicContact CZ-OE1 3.68Å; R605-E607 IonicContact NE-OE1 2.67Å; R605-E607 IonicContact NH1-OE1 3.78Å; R605-E607 PolarHBondContact NH1-OE1 2.99Å; R605-E607 IonicContact NH1-OE2 2.65Å; R605-E607 PolarHBondContact NH1-OE2 3.41Å; E607-M624 CarbonylContact O-C 3.56Å; E607-M624 VanDerWaalsContact O-CA 3.31Å; E607-M624 WeakPolarHBondContact O-CA 3.5Å; E607-Q625 PolarHBondContact N-O 3.3Å; E607-Q625 PolarHBondContact O-N 2.91Å; E607-R627 IonicContact OE1-CZ 3.03Å; E607-R627 IonicContact OE1-NE 3.61Å; E607-R627 IonicContact OE1-NH1 3.88Å; E607-R627 PolarHBondContact OE1-NH1 3.37Å; E607-R627 IonicContact OE2-CZ 3.21Å; E607-R627 VanDerWaalsContact OE2-CZ 3.23Å; E607-R627 IonicContact OE2-NH1 2.72Å; E607-R627 PolarHBondContact OE2-NH1 2.87Å; E607-R627 IonicContact OE2-NH2 3.63Å; E607-R627 PolarHBondContact OE2-NH2 3.37Å
608	I	89.8	Confident	77.3	Confident	24 Å²	24	58 Å²	58	12%	0.123	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	119.7	167.7	-59.7	168.9	0	0	0	105.7	R611 I622 Q623 M624 F688	I608-R611 HydrophobicContact CB-CB 4.22Å; I608-R611 HydrophobicContact CG2-CB 4.14Å; I608-I622 HydrophobicContact CD1-CD1 3.81Å; I608-I622 HydrophobicContact CG1-CD1 4.19Å; I608-I622 HydrophobicContact CG2-CB 4.21Å; I608-I622 HydrophobicContact CG2-CD1 4.48Å; I608-Q623 CarbonylContact C-O 3.57Å; I608-M624 HydrophobicContact CG1-CE 4.04Å; I608-M624 HydrophobicContact CG1-CG 4.44Å; I608-F688 HydrophobicContact CD1-CB 3.89Å; I608-F688 HydrophobicContact CD1-CD2 3.71Å; I608-F688 HydrophobicContact CD1-CG 4.08Å
609	K	87	Confident	78.5	Confident	87 Å²	87	58.8 Å²	58.8	38%	0.378	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-45.5	-168.8	-79.2	-164.5	168.8	-168.7	0	113	Q623 Q625	K609-Q623 HydrophobicContact CB-CB 4.42Å; K609-Q623 PolarHBondContact N-O 3.49Å; K609-Q625 HydrophobicContact CG-CB 4.11Å
610	N	86.5	Confident	80.1	Confident	76 Å²	76	57.6 Å²	57.6	41%	0.406	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	25.5	-171.6	-59.9	-16.8	0	0	0	112.1	D612 A613 D614	N610-D612 PolarHBondContact O-N 2.77Å; N610-A613 HydrophobicContact CB-CB 4.49Å; N610-A613 WeakPolarHBondContact O-CA 3.45Å; N610-A613 PolarHBondContact O-N 2.86Å; N610-D614 VanDerWaalsContact C-OD2 3.28Å; N610-D614 WeakPolarHBondContact CB-OD2 3.31Å; N610-D614 PolarHBondContact O-N 2.81Å
611	R	85.5	Confident	82	Confident	52 Å²	52	58.7 Å²	58.7	20%	0.196	30%	0.304	C	S	.	.	H	α-helix	trans	-38.6	-49.3	-172.5	173.2	173.8	162.3	86.7	-7.2	113.6	E571 I608 L615 F688 D691	E571-R611 IonicContact OE1-CZ 3.41Å; E571-R611 IonicContact OE1-NH2 2.62Å; E571-R611 PolarHBondContact OE1-NH2 2.85Å; E571-R611 IonicContact OE2-NE 3.09Å; E571-R611 IonicContact OE2-NH2 2.7Å; E571-R611 PolarHBondContact OE2-NH2 3.18Å; I608-R611 HydrophobicContact CB-CB 4.22Å; I608-R611 HydrophobicContact CG2-CB 4.14Å; R611-L615 WeakPolarHBondContact O-CB 3.5Å; R611-L615 PolarHBondContact O-N 3.24Å; R611-F688 HydrophobicContact CG-CD2 4.38Å; R611-F688 HydrophobicContact CG-CE2 4.32Å; R611-D691 IonicContact CZ-OD2 3.49Å; R611-D691 IonicContact NH1-OD2 3.73Å; R611-D691 PolarHBondContact NH1-OD2 3.23Å; R611-D691 IonicContact NH2-OD2 3.75Å; R611-D691 PolarHBondContact NH2-OD2 2.84Å
612	D	82.2	Confident	83.9	Confident	117 Å²	117	51.8 Å²	51.8	63%	0.626	27%	0.268	S	S	*	.	H	α-helix	trans	-68.8	-33.3	-177.2	-64	-19.1	0	0	0	113.5	N610 N616	N610-D612 PolarHBondContact O-N 2.77Å; D612-N616 WeakPolarHBondContact O-CB 3.43Å; D612-N616 PolarHBondContact O-N 3.25Å; D612-N616 PolarHBondContact O-ND2 2.73Å
613	A	85.4	Confident	85.5	Confident	46 Å²	46	53.9 Å²	53.9	38%	0.38	28%	0.277	S	S	.	.	H	α-helix	trans	-75.3	-51.3	174.2	0	0	0	0	0	110.1	N610 L615 N616 D617	N610-A613 HydrophobicContact CB-CB 4.49Å; N610-A613 WeakPolarHBondContact O-CA 3.45Å; N610-A613 PolarHBondContact O-N 2.86Å; A613-L615 PolarHBondContact O-N 3.45Å; A613-L615 VanDerWaalsContact O-N 3.14Å; A613-N616 PolarHBondContact O-N 3.49Å; A613-D617 PolarHBondContact O-N 3.42Å
614	D	88.4	Confident	86.8	Confident	9 Å²	9	53.4 Å²	53.4	5%	0.048	27%	0.272	C	S	.	.	H	α-helix	trans	-55.6	-36.7	-179.3	-60.2	-34.2	0	0	0	112.2	N610 L618 N619 I622 F688	N610-D614 VanDerWaalsContact C-OD2 3.28Å; N610-D614 WeakPolarHBondContact CB-OD2 3.31Å; N610-D614 PolarHBondContact O-N 2.81Å; D614-L618 CarbonylContact O-C 3.55Å; D614-L618 WeakPolarHBondContact O-CA 3.21Å; D614-L618 PolarHBondContact O-N 3.21Å; D614-L618 VanDerWaalsContact O-N 3.08Å; D614-N619 HydrophobicContact CB-CB 4.14Å; D614-N619 PolarHBondContact O-N 2.8Å; D614-N619 PolarHBondContact OD1-ND2 3.14Å; D614-I622 HydrophobicContact CB-CG2 3.89Å; D614-F688 HydrophobicContact CB-CE2 4.03Å; D614-F688 HydrophobicContact CB-CZ 3.66Å
615	L	85.7	Confident	87.4	Confident	28 Å²	28	53.5 Å²	53.5	15%	0.147	27%	0.272	C	S	.	.	H	α-helix	trans	-78.2	-24.7	178.5	-156.2	80.6	0	0	0	113.9	R611 A613 F688 D691 R692	R611-L615 WeakPolarHBondContact O-CB 3.5Å; R611-L615 PolarHBondContact O-N 3.24Å; A613-L615 PolarHBondContact O-N 3.45Å; A613-L615 VanDerWaalsContact O-N 3.14Å; L615-F688 HydrophobicContact CB-CE2 4.12Å; L615-F688 HydrophobicContact CB-CZ 4.14Å; L615-F688 HydrophobicContact CD1-CD1 4.36Å; L615-F688 HydrophobicContact CD1-CD2 4.06Å; L615-F688 HydrophobicContact CD1-CE1 4.03Å; L615-F688 HydrophobicContact CD1-CE2 3.71Å; L615-F688 HydrophobicContact CD1-CG 4.38Å; L615-F688 HydrophobicContact CD1-CZ 3.69Å; L615-D691 HydrophobicContact CD1-CB 3.76Å; L615-D691 HydrophobicContact CD2-CB 4.01Å; L615-R692 HydrophobicContact CD1-CB 4.2Å
616	N	84.2	Confident	87.9	Confident	84 Å²	84	49.8 Å²	49.8	45%	0.449	26%	0.258	S	S	.	.	H	α-helix	trans	-84.7	-40.8	176.4	-85.9	-63.7	0	0	0	112.1	D612 A613 R695	D612-N616 WeakPolarHBondContact O-CB 3.43Å; D612-N616 PolarHBondContact O-N 3.25Å; D612-N616 PolarHBondContact O-ND2 2.73Å; A613-N616 PolarHBondContact O-N 3.49Å; N616-R695 PolarHBondContact OD1-NE 3.26Å; N616-R695 PolarHBondContact OD1-NH2 3.48Å
617	D	87	Confident	87.7	Confident	117 Å²	117	53.3 Å²	53.3	63%	0.626	27%	0.271	S	S	*	.	H	α-helix	trans	-80.8	-8.8	178	-61.3	-29.8	0	0	0	112.2	A613 N619	A613-D617 PolarHBondContact O-N 3.42Å; D617-N619 VanDerWaalsContact C-N 3.33Å
618	L	86.1	Confident	87.3	Confident	54 Å²	54	52.5 Å²	52.5	28%	0.283	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	62	35.7	-178.9	-57.7	165.1	0	0	0	113.1	D614 R692 L696 I699	D614-L618 CarbonylContact O-C 3.55Å; D614-L618 WeakPolarHBondContact O-CA 3.21Å; D614-L618 PolarHBondContact O-N 3.21Å; D614-L618 VanDerWaalsContact O-N 3.08Å; L618-R692 HydrophobicContact CD2-CG 3.83Å; L618-L696 HydrophobicContact CD1-CD2 3.69Å; L618-L696 HydrophobicContact CD2-CD2 4.06Å; L618-L696 HydrophobicContact CD2-CG 4.05Å; L618-I699 HydrophobicContact CD1-CD1 4.47Å
619	N	86.9	Confident	86.5	Confident	60 Å²	60	57.1 Å²	57.1	32%	0.321	29%	0.285	S	S	.	.			trans	-57.8	140.6	-179.3	-69.6	-19.1	0	0	0	111.8	D614 D617	D614-N619 HydrophobicContact CB-CB 4.14Å; D614-N619 PolarHBondContact O-N 2.8Å; D614-N619 PolarHBondContact OD1-ND2 3.14Å; D617-N619 VanDerWaalsContact C-N 3.33Å
620	V	89.8	Confident	85.6	Confident	49 Å²	49	55.1 Å²	55.1	30%	0.297	28%	0.278	S	S	.	.	S	Bend	trans	-91	-39	175.1	-177.3	0	0	0	0	111.1	D650 I651 E652	V620-D650 WeakPolarHBondContact CG1-OD1 3.29Å; V620-I651 WeakPolarHBondContact O-CB 3.34Å; V620-I651 WeakPolarHBondContact O-CD1 3.44Å; V620-I651 VanDerWaalsContact O-CG1 3.26Å; V620-I651 WeakPolarHBondContact O-CG1 3.34Å; V620-I651 PolarHBondContact O-N 3.03Å; V620-E652 HydrophobicContact CG1-CB 3.95Å; V620-E652 HydrophobicContact CG1-CG 3.93Å
621	E	92.2	Very high	84.7	Confident	120 Å²	120	57.9 Å²	57.9	56%	0.561	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	125.2	169.8	-170.7	-169.3	161.1	0	0	109.8	A648	E621-A648 HydrophobicContact CG-CB 4.11Å; E621-A648 VanDerWaalsContact OE1-CB 3.25Å; E621-A648 WeakPolarHBondContact OE1-CB 3.47Å
622	I	92.5	Very high	83.9	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	140.8	177.1	53.3	168.2	0	0	0	112.3	I608 D614 M624 F649 I651 F688	I608-I622 HydrophobicContact CD1-CD1 3.81Å; I608-I622 HydrophobicContact CG1-CD1 4.19Å; I608-I622 HydrophobicContact CG2-CB 4.21Å; I608-I622 HydrophobicContact CG2-CD1 4.48Å; D614-I622 HydrophobicContact CB-CG2 3.89Å; I622-M624 HydrophobicContact CD1-CG 4.31Å; I622-M624 HydrophobicContact CD1-SD 4.49Å; I622-M624 HydrophobicContact CG1-CG 4.36Å; I622-M624 PolarHBondContact O-N 3.15Å; I622-F649 HydrophobicContact CG1-CB 4.25Å; I622-F649 VanDerWaalsContact CG1-O 3.29Å; I622-F649 WeakPolarHBondContact CG1-O 3.37Å; I622-F649 PolarHBondContact N-O 2.91Å; I622-F649 PolarHBondContact O-N 3.29Å; I622-I651 HydrophobicContact CB-CD1 4.48Å; I622-I651 HydrophobicContact CD1-CD1 4.12Å; I622-I651 HydrophobicContact CD1-CG1 3.95Å; I622-I651 HydrophobicContact CG1-CD1 4.12Å; I622-I651 HydrophobicContact CG1-CG1 3.96Å; I622-I651 HydrophobicContact CG2-CD1 3.62Å; I622-I651 HydrophobicContact CG2-CG1 4.4Å; I622-F688 HydrophobicContact CD1-CG 4.48Å; I622-F688 HydrophobicContact CG2-CD1 4.46Å; I622-F688 HydrophobicContact CG2-CE1 3.95Å; I622-F688 HydrophobicContact CG2-CE2 4.31Å; I622-F688 HydrophobicContact CG2-CZ 3.86Å
623	Q	92.5	Very high	83.3	Confident	78 Å²	78	56.6 Å²	56.6	36%	0.364	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	109.2	177.8	-66.2	-170	4.2	0	0	111.1	I608 K609	I608-Q623 CarbonylContact C-O 3.57Å; K609-Q623 HydrophobicContact CB-CB 4.42Å; K609-Q623 PolarHBondContact N-O 3.49Å
624	M	91.6	Very high	82.5	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	156.1	178.9	-57	-167	95.7	0	0	112	V606 E607 I608 I622 Q646 F647 F649 I681 K684 V685	V606-M624 HydrophobicContact CG1-CE 3.75Å; E607-M624 CarbonylContact O-C 3.56Å; E607-M624 VanDerWaalsContact O-CA 3.31Å; E607-M624 WeakPolarHBondContact O-CA 3.5Å; I608-M624 HydrophobicContact CG1-CE 4.04Å; I608-M624 HydrophobicContact CG1-CG 4.44Å; I622-M624 HydrophobicContact CD1-CG 4.31Å; I622-M624 HydrophobicContact CD1-SD 4.49Å; I622-M624 HydrophobicContact CG1-CG 4.36Å; I622-M624 PolarHBondContact O-N 3.15Å; M624-Q646 WeakPolarHBondContact O-CA 3.27Å; M624-Q646 WeakPolarHBondContact O-CG 3.38Å; M624-F647 HydrophobicContact CB-CD1 4.1Å; M624-F647 HydrophobicContact CB-CD2 3.92Å; M624-F647 HydrophobicContact CB-CE1 3.66Å; M624-F647 HydrophobicContact CB-CE2 3.47Å; M624-F647 VanDerWaalsContact CB-CE2 3.47Å; M624-F647 HydrophobicContact CB-CG 4.22Å; M624-F647 HydrophobicContact CB-CZ 3.31Å; M624-F647 HydrophobicContact CG-CE2 3.94Å; M624-F647 HydrophobicContact CG-CZ 4.14Å; M624-F647 PolarHBondContact N-O 3.25Å; M624-F647 PolarHBondContact O-N 2.99Å; M624-F647 VanDerWaalsContact O-O 3.1Å; M624-F647 HydrophobicContact SD-CE2 3.54Å; M624-F647 VanDerWaalsContact SD-CE2 3.54Å; M624-F647 HydrophobicContact SD-CZ 3.84Å; M624-F649 HydrophobicContact CG-CB 3.97Å; M624-F649 HydrophobicContact SD-CB 3.57Å; M624-F649 VanDerWaalsContact SD-CB 3.57Å; M624-F649 HydrophobicContact SD-CD2 4.19Å; M624-F649 HydrophobicContact SD-CG 3.9Å; M624-I681 HydrophobicContact CE-CG2 4.34Å; M624-I681 HydrophobicContact SD-CG2 4.05Å; M624-K684 HydrophobicContact CE-CB 3.57Å; M624-K684 HydrophobicContact CE-CG 4.25Å; M624-V685 HydrophobicContact CE-CG2 4.25Å; M624-V685 HydrophobicContact SD-CG2 4.43Å
625	Q	89.9	Confident	81.6	Confident	11 Å²	11	66.5 Å²	66.5	5%	0.051	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	119.7	178.1	-169	-175.1	9.1	0	0	111.3	V606 E607 K609 R627 E643 L645	V606-Q625 CarbonylContact C-O 3.58Å; V606-Q625 WeakPolarHBondContact CA-O 3.21Å; E607-Q625 PolarHBondContact N-O 3.3Å; E607-Q625 PolarHBondContact O-N 2.91Å; K609-Q625 HydrophobicContact CG-CB 4.11Å; Q625-R627 HydrophobicContact CG-CG 4.29Å; Q625-E643 PolarHBondContact NE2-O 3.11Å; Q625-L645 CarbonylContact C-O 3.54Å; Q625-L645 WeakPolarHBondContact CA-O 3.36Å
626	L	88.7	Confident	80.9	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	132.2	172.3	-177.5	76.8	0	0	0	110	I604 R605 V606 Y637 F639 G644 L645 F647 I669 I677	I604-L626 HydrophobicContact CG2-CD1 3.37Å; I604-L626 HydrophobicContact CG2-CG 4.18Å; R605-L626 CarbonylContact O-C 3.54Å; R605-L626 WeakPolarHBondContact O-CA 3.13Å; V606-L626 HydrophobicContact CG2-CD1 3.64Å; L626-Y637 HydrophobicContact CD2-CE1 4.5Å; L626-F639 HydrophobicContact CD2-CE1 4.07Å; L626-F639 HydrophobicContact CD2-CZ 4.49Å; L626-G644 CarbonylContact O-C 3.57Å; L626-G644 VanDerWaalsContact O-CA 3.25Å; L626-G644 WeakPolarHBondContact O-CA 3.34Å; L626-L645 HydrophobicContact CB-CB 4.22Å; L626-L645 HydrophobicContact CD2-CB 4.49Å; L626-L645 HydrophobicContact CD2-CD2 4.17Å; L626-L645 PolarHBondContact N-O 3.04Å; L626-L645 PolarHBondContact O-N 2.76Å; L626-F647 HydrophobicContact CB-CE1 4.23Å; L626-I669 HydrophobicContact CD2-CD1 3.5Å; L626-I669 VanDerWaalsContact CD2-CD1 3.5Å; L626-I669 HydrophobicContact CD2-CG1 3.94Å; L626-I677 HydrophobicContact CD1-CD1 4.21Å; L626-I677 HydrophobicContact CD1-CG1 4.36Å; L626-I677 HydrophobicContact CD1-CG2 4.01Å; L626-I677 HydrophobicContact CD2-CD1 4.18Å
627	R	83.5	Confident	80.6	Confident	76 Å²	76	65.9 Å²	65.9	29%	0.287	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	137.1	177.7	-63.6	-176.3	-174.3	149	6.1	111.1	I604 R605 E607 Q625 Y629	I604-R627 CarbonylContact C-O 3.46Å; I604-R627 WeakPolarHBondContact CA-O 3.2Å; R605-R627 PolarHBondContact N-O 3.38Å; R605-R627 PolarHBondContact O-N 3.09Å; E607-R627 IonicContact OE1-CZ 3.03Å; E607-R627 IonicContact OE1-NE 3.61Å; E607-R627 IonicContact OE1-NH1 3.88Å; E607-R627 PolarHBondContact OE1-NH1 3.37Å; E607-R627 IonicContact OE2-CZ 3.21Å; E607-R627 VanDerWaalsContact OE2-CZ 3.23Å; E607-R627 IonicContact OE2-NH1 2.72Å; E607-R627 PolarHBondContact OE2-NH1 2.87Å; E607-R627 IonicContact OE2-NH2 3.63Å; E607-R627 PolarHBondContact OE2-NH2 3.37Å; Q625-R627 HydrophobicContact CG-CG 4.29Å; R627-Y629 HydrophobicContact CB-CD2 4.35Å; R627-Y629 HydrophobicContact CB-CE2 3.73Å; R627-Y629 WeakPolarHBondContact CD-OH 3.39Å
628	V	79	Confident	79.8	Confident	14 Å²	14	69.4 Å²	69.4	9%	0.085	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	112.1	178.2	177.2	0	0	0	0	109.2	G603 I604 K633 R634 Y637 F639	G603-V628 CarbonylContact O-C 3.58Å; I604-V628 HydrophobicContact CG1-CG1 4.49Å; I604-V628 HydrophobicContact CG1-CG2 3.97Å; V628-K633 HydrophobicContact CG1-CB 3.85Å; V628-R634 HydrophobicContact CB-CG 4.45Å; V628-R634 HydrophobicContact CG1-CG 3.91Å; V628-Y637 HydrophobicContact CB-CD2 4.36Å; V628-Y637 HydrophobicContact CG1-CD2 4.08Å; V628-Y637 HydrophobicContact CG1-CE2 4.32Å; V628-Y637 HydrophobicContact CG2-CD1 3.81Å; V628-Y637 HydrophobicContact CG2-CD2 3.52Å; V628-Y637 HydrophobicContact CG2-CE1 3.96Å; V628-Y637 HydrophobicContact CG2-CE2 3.7Å; V628-Y637 HydrophobicContact CG2-CG 3.59Å; V628-F639 HydrophobicContact CB-CZ 4.33Å; V628-F639 HydrophobicContact CG2-CE1 4.25Å; V628-F639 HydrophobicContact CG2-CE2 4.4Å; V628-F639 HydrophobicContact CG2-CZ 3.59Å
629	Y	71.1	Confident	79.2	Confident	122 Å²	122	68.6 Å²	68.6	48%	0.478	30%	0.303	S	S	.	.			trans	-92	-32.6	-179.1	-71.7	-87.3	0	0	0	112.6	G603 R605 R627 E631 R634	G603-Y629 PolarHBondContact O-N 2.66Å; R605-Y629 HydrophobicContact CB-CD2 4.2Å; R605-Y629 HydrophobicContact CB-CE2 3.83Å; R627-Y629 HydrophobicContact CB-CD2 4.35Å; R627-Y629 HydrophobicContact CB-CE2 3.73Å; R627-Y629 WeakPolarHBondContact CD-OH 3.39Å; Y629-E631 PolarHBondContact O-N 3.47Å; Y629-R634 PolarHBondContact O-NH2 3.42Å
630	D	68.4	Low	78	Confident	45 Å²	45	72.2 Å²	72.2	24%	0.241	32%	0.316	C	S	.	.			trans	-69.7	114.1	177.7	-179	7.5	0	0	0	111.5	G603 K632 K633 R634	G603-D630 PolarHBondContact O-N 2.78Å; G603-D630 VanDerWaalsContact O-N 3.11Å; D630-K632 PolarHBondContact O-N 2.93Å; D630-K632 WeakPolarHBondContact OD1-CB 3.48Å; D630-K632 PolarHBondContact OD1-N 3.38Å; D630-K633 HydrophobicContact CB-CB 4.25Å; D630-K633 HydrophobicContact CB-CG 4.38Å; D630-K633 PolarHBondContact O-N 3.16Å; D630-R634 WeakPolarHBondContact O-CG 3.47Å; D630-R634 PolarHBondContact O-N 2.84Å
631	E	68.1	Low	76.4	Confident	133 Å²	133	75.9 Å²	75.9	62%	0.621	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-24.8	179.9	-161.4	147.4	-104.2	0	0	113.8	Y629 R634	Y629-E631 PolarHBondContact O-N 3.47Å; E631-R634 IonicContact OE1-CZ 2.66Å; E631-R634 IonicContact OE1-NH1 2.68Å; E631-R634 PolarHBondContact OE1-NH1 3.06Å; E631-R634 IonicContact OE1-NH2 3.39Å; E631-R634 PolarHBondContact OE1-NH2 2.84Å
632	K	68.7	Low	74.6	Confident	103 Å²	103	77.3 Å²	77.3	45%	0.448	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-45.9	172.1	-57.4	177.6	-161.8	169.2	0	110.7	M54 D630	M54-K632 HydrophobicContact CB-CD 4.42Å; M54-K632 PolarHBondContact O-NZ 3.46Å; M54-K632 HydrophobicContact SD-CG 4.44Å; D630-K632 PolarHBondContact O-N 2.93Å; D630-K632 WeakPolarHBondContact OD1-CB 3.48Å; D630-K632 PolarHBondContact OD1-N 3.38Å
633	K	70	Confident	73.3	Confident	40 Å²	40	82.8 Å²	82.8	17%	0.174	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-70.8	-31.4	179.5	-73.4	-165.2	166.9	-163.2	0	113.2	I602 I604 V628 D630 K635 Q636 Y637 D673	I602-K633 PolarHBondContact O-NZ 2.92Å; I604-K633 HydrophobicContact CD1-CD 4Å; V628-K633 HydrophobicContact CG1-CB 3.85Å; D630-K633 HydrophobicContact CB-CB 4.25Å; D630-K633 HydrophobicContact CB-CG 4.38Å; D630-K633 PolarHBondContact O-N 3.16Å; K633-K635 PolarHBondContact O-N 2.7Å; K633-Q636 WeakPolarHBondContact O-CB 3.44Å; K633-Q636 PolarHBondContact O-N 3.04Å; K633-Y637 HydrophobicContact CB-CE2 4.28Å; K633-Y637 WeakPolarHBondContact O-CD2 3.39Å; K633-D673 WeakPolarHBondContact CE-OD2 3.3Å; K633-D673 IonicContact NZ-OD1 2.76Å; K633-D673 PolarHBondContact NZ-OD1 2.79Å; K633-D673 IonicContact NZ-OD2 2.72Å; K633-D673 PolarHBondContact NZ-OD2 2.75Å
634	R	67.5	Low	72.5	Confident	74 Å²	74	79.7 Å²	79.7	28%	0.279	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-49.7	-26.9	-180	-73.5	-171.7	-138.3	134.7	17.9	114.6	V628 Y629 D630 E631 Q636 E641	V628-R634 HydrophobicContact CB-CG 4.45Å; V628-R634 HydrophobicContact CG1-CG 3.91Å; Y629-R634 PolarHBondContact O-NH2 3.42Å; D630-R634 WeakPolarHBondContact O-CG 3.47Å; D630-R634 PolarHBondContact O-N 2.84Å; E631-R634 IonicContact OE1-CZ 2.66Å; E631-R634 IonicContact OE1-NH1 2.68Å; E631-R634 PolarHBondContact OE1-NH1 3.06Å; E631-R634 IonicContact OE1-NH2 3.39Å; E631-R634 PolarHBondContact OE1-NH2 2.84Å; R634-Q636 VanDerWaalsContact C-N 3.35Å; R634-E641 WeakPolarHBondContact CD-OE1 3.26Å; R634-E641 IonicContact CZ-OE1 3.1Å; R634-E641 IonicContact NE-OE1 2.75Å; R634-E641 IonicContact NH1-OE1 2.72Å; R634-E641 PolarHBondContact NH1-OE1 3.47Å
635	K	69.4	Low	72.2	Confident	189 Å²	189	80.5 Å²	80.5	82%	0.822	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-75.2	-18.3	177.4	-63.9	-174.9	-179.7	-178.7	0	115	K633	K633-K635 PolarHBondContact O-N 2.7Å
636	Q	72.5	Confident	72.2	Confident	87 Å²	87	84 Å²	84	41%	0.407	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-25.2	-176.7	-160.1	176.8	-11.4	0	0	111.8	K633 R634 P670 E672	K633-Q636 WeakPolarHBondContact O-CB 3.44Å; K633-Q636 PolarHBondContact O-N 3.04Å; R634-Q636 VanDerWaalsContact C-N 3.35Å; Q636-P670 HydrophobicContact CB-CG 4.5Å; Q636-P670 HydrophobicContact CG-CB 3.75Å; Q636-P670 HydrophobicContact CG-CG 3.82Å; Q636-E672 PolarHBondContact NE2-OE2 2.68Å
637	Y	78.3	Confident	72.4	Confident	11 Å²	11	85.2 Å²	85.2	4%	0.043	38%	0.382	C	S	.	.			trans	-84.7	148.5	173.5	-70.8	-93.7	0	0	0	111.4	I604 L626 V628 K633 F639 H668 I669 P670 D673 I677	I604-Y637 HydrophobicContact CD1-CE2 4.31Å; I604-Y637 WeakPolarHBondContact CD1-OH 3.48Å; I604-Y637 HydrophobicContact CG1-CE2 4.48Å; L626-Y637 HydrophobicContact CD2-CE1 4.5Å; V628-Y637 HydrophobicContact CB-CD2 4.36Å; V628-Y637 HydrophobicContact CG1-CD2 4.08Å; V628-Y637 HydrophobicContact CG1-CE2 4.32Å; V628-Y637 HydrophobicContact CG2-CD1 3.81Å; V628-Y637 HydrophobicContact CG2-CD2 3.52Å; V628-Y637 HydrophobicContact CG2-CE1 3.96Å; V628-Y637 HydrophobicContact CG2-CE2 3.7Å; V628-Y637 HydrophobicContact CG2-CG 3.59Å; K633-Y637 HydrophobicContact CB-CE2 4.28Å; K633-Y637 WeakPolarHBondContact O-CD2 3.39Å; Y637-F639 HydrophobicContact CD1-CD1 4.27Å; Y637-F639 AromaticContact CD1-CE1 3.56Å; Y637-F639 HydrophobicContact CD1-CE1 3.56Å; Y637-F639 HydrophobicContact CD1-CZ 4.26Å; Y637-F639 HydrophobicContact CE1-CE1 4.41Å; Y637-F639 HydrophobicContact CG-CE1 4.13Å; Y637-H668 WeakPolarHBondContact CD1-O 3.47Å; Y637-I669 HydrophobicContact CD1-CG1 4.42Å; Y637-I669 HydrophobicContact CE1-CB 4.28Å; Y637-I669 HydrophobicContact CE1-CG1 4.08Å; Y637-I669 HydrophobicContact CE1-CG2 4.13Å; Y637-P670 VanDerWaalsContact CE1-CD 3.47Å; Y637-P670 HydrophobicContact CE1-CG 4.43Å; Y637-P670 HydrophobicContact CE2-CG 4.12Å; Y637-D673 WeakPolarHBondContact OH-CB 3.12Å; Y637-D673 PolarHBondContact OH-OD2 3.21Å; Y637-I677 HydrophobicContact CE1-CD1 4.1Å; Y637-I677 WeakPolarHBondContact OH-CD1 3.37Å
638	R	70	Confident	72.8	Confident	191 Å²	191	83.7 Å²	83.7	72%	0.721	39%	0.386	S	S	*	.			trans	-101.5	-5.2	-175.6	-62.7	-60.3	-171.2	163.5	1.6	115.4	Q667	R638-Q667 WeakPolarHBondContact CB-O 3.44Å; R638-Q667 WeakPolarHBondContact CG-O 3.34Å
639	F	71.8	Confident	73.6	Confident	37 Å²	37	83.1 Å²	83.1	16%	0.162	38%	0.382	C	S	.	.	S	Bend	trans	-87	159.9	177.9	63	-102.9	0	0	0	112.8	L626 V628 Y637 L645	L626-F639 HydrophobicContact CD2-CE1 4.07Å; L626-F639 HydrophobicContact CD2-CZ 4.49Å; V628-F639 HydrophobicContact CB-CZ 4.33Å; V628-F639 HydrophobicContact CG2-CE1 4.25Å; V628-F639 HydrophobicContact CG2-CE2 4.4Å; V628-F639 HydrophobicContact CG2-CZ 3.59Å; Y637-F639 HydrophobicContact CD1-CD1 4.27Å; Y637-F639 AromaticContact CD1-CE1 3.56Å; Y637-F639 HydrophobicContact CD1-CE1 3.56Å; Y637-F639 HydrophobicContact CD1-CZ 4.26Å; Y637-F639 HydrophobicContact CE1-CE1 4.41Å; Y637-F639 HydrophobicContact CG-CE1 4.13Å; F639-L645 HydrophobicContact CB-CB 4.47Å; F639-L645 HydrophobicContact CD1-CB 3.64Å; F639-L645 HydrophobicContact CE1-CB 3.84Å; F639-L645 HydrophobicContact CG-CB 4.03Å; F639-L645 HydrophobicContact CZ-CB 4.42Å
640	K	62.4	Low	74.7	Confident	136 Å²	136	79 Å²	79	59%	0.591	37%	0.368	S	S	*	.			trans	-71.9	139.6	-177.5	-73.7	163.4	172.9	179.3	0	112.6	N642 E643 G644	K640-N642 VanDerWaalsContact C-N 3.29Å; K640-N642 PolarHBondContact O-N 3.44Å; K640-N642 VanDerWaalsContact O-N 3.12Å; K640-E643 WeakPolarHBondContact CD-OE2 3.32Å; K640-E643 IonicContact NZ-OE1 3.43Å; K640-E643 PolarHBondContact NZ-OE1 2.79Å; K640-E643 IonicContact NZ-OE2 3.56Å; K640-E643 PolarHBondContact NZ-OE2 2.95Å; K640-E643 PolarHBondContact O-N 3.42Å; K640-G644 PolarHBondContact O-N 3.36Å
641	E	56.6	Low	75.7	Confident	126 Å²	126	76.9 Å²	76.9	59%	0.589	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-37.3	-175.1	-175.8	162.4	-128.4	0	0	115.7	R634	R634-E641 WeakPolarHBondContact CD-OE1 3.26Å; R634-E641 IonicContact CZ-OE1 3.1Å; R634-E641 IonicContact NE-OE1 2.75Å; R634-E641 IonicContact NH1-OE1 2.72Å; R634-E641 PolarHBondContact NH1-OE1 3.47Å
642	N	54.2	Low	76.8	Confident	150 Å²	150	75.8 Å²	75.8	80%	0.802	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-13.6	-173.5	-62.5	-39.2	0	0	0	114.7	K640	K640-N642 VanDerWaalsContact C-N 3.29Å; K640-N642 PolarHBondContact O-N 3.44Å; K640-N642 VanDerWaalsContact O-N 3.12Å
643	E	64.4	Low	77.8	Confident	115 Å²	115	77 Å²	77	54%	0.537	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-24.1	-170.9	-69.8	171.2	175.7	0	0	112.1	Q625 K640	Q625-E643 PolarHBondContact NE2-O 3.11Å; K640-E643 WeakPolarHBondContact CD-OE2 3.32Å; K640-E643 IonicContact NZ-OE1 3.43Å; K640-E643 PolarHBondContact NZ-OE1 2.79Å; K640-E643 IonicContact NZ-OE2 3.56Å; K640-E643 PolarHBondContact NZ-OE2 2.95Å; K640-E643 PolarHBondContact O-N 3.42Å
644	G	76.5	Confident	78.9	Confident	13 Å²	13	77.8 Å²	77.8	13%	0.134	37%	0.369	C	S	.	.			trans	68.2	174.7	-173.4	0	0	0	0	0	112.8	L626 K640	L626-G644 CarbonylContact O-C 3.57Å; L626-G644 VanDerWaalsContact O-CA 3.25Å; L626-G644 WeakPolarHBondContact O-CA 3.34Å; K640-G644 PolarHBondContact O-N 3.36Å
645	L	86.2	Confident	80.1	Confident	17 Å²	17	75.9 Å²	75.9	9%	0.089	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	108.4	164.4	175.8	69.8	0	0	0	108	Q625 L626 F639 M663 H668 I669	Q625-L645 CarbonylContact C-O 3.54Å; Q625-L645 WeakPolarHBondContact CA-O 3.36Å; L626-L645 HydrophobicContact CB-CB 4.22Å; L626-L645 HydrophobicContact CD2-CB 4.49Å; L626-L645 HydrophobicContact CD2-CD2 4.17Å; L626-L645 PolarHBondContact N-O 3.04Å; L626-L645 PolarHBondContact O-N 2.76Å; F639-L645 HydrophobicContact CB-CB 4.47Å; F639-L645 HydrophobicContact CD1-CB 3.64Å; F639-L645 HydrophobicContact CE1-CB 3.84Å; F639-L645 HydrophobicContact CG-CB 4.03Å; F639-L645 HydrophobicContact CZ-CB 4.42Å; L645-M663 HydrophobicContact CD2-CB 4.37Å; L645-M663 HydrophobicContact CD2-CE 4.34Å; L645-M663 HydrophobicContact CD2-CG 3.92Å; L645-M663 HydrophobicContact CD2-SD 3.91Å; L645-H668 HydrophobicContact CD1-CB 4.16Å; L645-H668 VanDerWaalsContact CD1-CD2 3.42Å; L645-H668 WeakPolarHBondContact CD1-CD2 3.16Å; L645-H668 HydrophobicContact CD2-CB 3.8Å; L645-I669 HydrophobicContact CD2-CD1 4.25Å; L645-I669 HydrophobicContact CD2-CG1 4.3Å
646	Q	89.7	Confident	81.2	Confident	86 Å²	86	67.9 Å²	67.9	40%	0.402	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	140.3	170	175.9	173.4	-5	0	0	110	M624	M624-Q646 WeakPolarHBondContact O-CA 3.27Å; M624-Q646 WeakPolarHBondContact O-CG 3.38Å
647	F	92.1	Very high	82.1	Confident	24 Å²	24	68.5 Å²	68.5	11%	0.105	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	157.5	176.7	57.6	-77.1	0	0	0	109.8	V606 M624 L626 V659 M663 I681	V606-F647 HydrophobicContact CG1-CZ 4.49Å; M624-F647 HydrophobicContact CB-CD1 4.1Å; M624-F647 HydrophobicContact CB-CD2 3.92Å; M624-F647 HydrophobicContact CB-CE1 3.66Å; M624-F647 HydrophobicContact CB-CE2 3.47Å; M624-F647 VanDerWaalsContact CB-CE2 3.47Å; M624-F647 HydrophobicContact CB-CG 4.22Å; M624-F647 HydrophobicContact CB-CZ 3.31Å; M624-F647 HydrophobicContact CG-CE2 3.94Å; M624-F647 HydrophobicContact CG-CZ 4.14Å; M624-F647 PolarHBondContact N-O 3.25Å; M624-F647 PolarHBondContact O-N 2.99Å; M624-F647 VanDerWaalsContact O-O 3.1Å; M624-F647 HydrophobicContact SD-CE2 3.54Å; M624-F647 VanDerWaalsContact SD-CE2 3.54Å; M624-F647 HydrophobicContact SD-CZ 3.84Å; L626-F647 HydrophobicContact CB-CE1 4.23Å; F647-V659 HydrophobicContact CD2-CG1 3.87Å; F647-V659 HydrophobicContact CE2-CG1 3.99Å; F647-M663 HydrophobicContact CB-CE 3.78Å; F647-M663 HydrophobicContact CD1-CE 3.36Å; F647-M663 HydrophobicContact CD2-CE 3.32Å; F647-M663 HydrophobicContact CE1-CE 3.64Å; F647-M663 HydrophobicContact CE2-CE 3.59Å; F647-M663 HydrophobicContact CG-CE 3.2Å; F647-M663 HydrophobicContact CZ-CE 3.74Å; F647-I681 HydrophobicContact CE2-CD1 3.78Å; F647-I681 HydrophobicContact CE2-CG1 4.37Å; F647-I681 HydrophobicContact CZ-CD1 3.55Å; F647-I681 HydrophobicContact CZ-CG1 3.93Å
648	A	92.8	Very high	82.8	Confident	45 Å²	45	73.8 Å²	73.8	37%	0.372	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	156	164.8	0	0	0	0	0	109.6	E621	E621-A648 HydrophobicContact CG-CB 4.11Å; E621-A648 VanDerWaalsContact OE1-CB 3.25Å; E621-A648 WeakPolarHBondContact OE1-CB 3.47Å
649	F	95	Very high	83.9	Confident	1 Å²	1	65.1 Å²	65.1	0%	0.004	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	121.7	170.1	-169.4	-77.3	0	0	0	108.9	I622 M624 D654 P656 V659 I681 V685	I622-F649 HydrophobicContact CG1-CB 4.25Å; I622-F649 VanDerWaalsContact CG1-O 3.29Å; I622-F649 WeakPolarHBondContact CG1-O 3.37Å; I622-F649 PolarHBondContact N-O 2.91Å; I622-F649 PolarHBondContact O-N 3.29Å; M624-F649 HydrophobicContact CG-CB 3.97Å; M624-F649 HydrophobicContact SD-CB 3.57Å; M624-F649 VanDerWaalsContact SD-CB 3.57Å; M624-F649 HydrophobicContact SD-CD2 4.19Å; M624-F649 HydrophobicContact SD-CG 3.9Å; F649-D654 WeakPolarHBondContact CA-OD2 3.47Å; F649-D654 HydrophobicContact CD1-CB 4.17Å; F649-D654 HydrophobicContact CD2-CB 4.1Å; F649-D654 HydrophobicContact CE1-CB 3.85Å; F649-D654 HydrophobicContact CE2-CB 3.79Å; F649-D654 HydrophobicContact CG-CB 4.27Å; F649-D654 HydrophobicContact CZ-CB 3.65Å; F649-D654 VanDerWaalsContact CZ-O 3.28Å; F649-D654 WeakPolarHBondContact CZ-O 3.45Å; F649-P656 HydrophobicContact CE2-CB 4.39Å; F649-V659 HydrophobicContact CD2-CB 4.3Å; F649-V659 HydrophobicContact CD2-CG1 4.23Å; F649-V659 HydrophobicContact CD2-CG2 3.87Å; F649-V659 HydrophobicContact CE2-CB 4.23Å; F649-V659 HydrophobicContact CE2-CG2 3.83Å; F649-I681 HydrophobicContact CD2-CG2 3.85Å; F649-I681 HydrophobicContact CE2-CG2 3.72Å; F649-I681 HydrophobicContact CZ-CG2 4.49Å; F649-V685 HydrophobicContact CD1-CG2 3.65Å; F649-V685 HydrophobicContact CE1-CB 4.33Å; F649-V685 HydrophobicContact CE1-CG1 3.91Å; F649-V685 HydrophobicContact CE1-CG2 3.5Å; F649-V685 VanDerWaalsContact CE1-CG2 3.5Å; F649-V685 HydrophobicContact CE2-CG2 4.43Å; F649-V685 HydrophobicContact CG-CG2 4.22Å; F649-V685 HydrophobicContact CZ-CG2 3.92Å
650	D	93.1	Very high	84.9	Confident	36 Å²	36	63.4 Å²	63.4	19%	0.193	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	116.9	172.6	-173.9	-47.1	0	0	0	110.2	V620 E652 N653 D654	V620-D650 WeakPolarHBondContact CG1-OD1 3.29Å; D650-E652 PolarHBondContact O-N 3.1Å; D650-E652 VanDerWaalsContact O-N 3.16Å; D650-E652 PolarHBondContact OD1-N 3.16Å; D650-N653 HydrophobicContact CB-CB 4.13Å; D650-N653 VanDerWaalsContact CG-ND2 3.28Å; D650-N653 PolarHBondContact OD1-N 3.48Å; D650-N653 PolarHBondContact OD1-ND2 2.58Å; D650-N653 PolarHBondContact OD2-ND2 3.44Å; D650-D654 HydrophobicContact CB-CB 4.33Å; D650-D654 PolarHBondContact N-OD2 3.44Å; D650-D654 WeakPolarHBondContact O-CB 3.17Å; D650-D654 PolarHBondContact O-N 3.41Å
651	I	91	Very high	86.3	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.7	-175.5	-68.2	161.1	0	0	0	112.9	V620 I622 F688 R689	V620-I651 WeakPolarHBondContact O-CB 3.34Å; V620-I651 WeakPolarHBondContact O-CD1 3.44Å; V620-I651 VanDerWaalsContact O-CG1 3.26Å; V620-I651 WeakPolarHBondContact O-CG1 3.34Å; V620-I651 PolarHBondContact O-N 3.03Å; I622-I651 HydrophobicContact CB-CD1 4.48Å; I622-I651 HydrophobicContact CD1-CD1 4.12Å; I622-I651 HydrophobicContact CD1-CG1 3.95Å; I622-I651 HydrophobicContact CG1-CD1 4.12Å; I622-I651 HydrophobicContact CG1-CG1 3.96Å; I622-I651 HydrophobicContact CG2-CD1 3.62Å; I622-I651 HydrophobicContact CG2-CG1 4.4Å; I651-F688 HydrophobicContact CD1-CD1 3.38Å; I651-F688 HydrophobicContact CD1-CE1 3.37Å; I651-F688 HydrophobicContact CD1-CG 4.48Å; I651-F688 HydrophobicContact CD1-CZ 4.46Å; I651-F688 HydrophobicContact CG1-CD1 4.39Å; I651-R689 HydrophobicContact CG2-CG 3.53Å; I651-R689 PolarHBondContact O-NE 3.43Å; I651-R689 PolarHBondContact O-NH2 2.91Å
652	E	89.7	Confident	87.9	Confident	111 Å²	111	60.6 Å²	60.6	52%	0.519	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-30	-173.9	-68.1	178.3	-174.5	0	0	112.5	V620 D650 R692	V620-E652 HydrophobicContact CG1-CB 3.95Å; V620-E652 HydrophobicContact CG1-CG 3.93Å; D650-E652 PolarHBondContact O-N 3.1Å; D650-E652 VanDerWaalsContact O-N 3.16Å; D650-E652 PolarHBondContact OD1-N 3.16Å; E652-R692 IonicContact OE1-CZ 2.92Å; E652-R692 IonicContact OE1-NH1 2.7Å; E652-R692 PolarHBondContact OE1-NH1 3.43Å; E652-R692 IonicContact OE1-NH2 3.49Å; E652-R692 PolarHBondContact OE1-NH2 3.29Å
653	N	90.4	Very high	89.5	Confident	127 Å²	127	53.9 Å²	53.9	68%	0.679	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-32.3	-177.9	-59.9	-62.9	0	0	0	114.9	D650	D650-N653 HydrophobicContact CB-CB 4.13Å; D650-N653 VanDerWaalsContact CG-ND2 3.28Å; D650-N653 PolarHBondContact OD1-N 3.48Å; D650-N653 PolarHBondContact OD1-ND2 2.58Å; D650-N653 PolarHBondContact OD2-ND2 3.44Å
654	D	93.1	Very high	90.7	Very high	57 Å²	57	49.4 Å²	49.4	31%	0.305	26%	0.259	S	S	.	.			trans	-84.5	141.3	-172.4	-76	-24.3	0	0	0	113.9	F649 D650 V659	F649-D654 WeakPolarHBondContact CA-OD2 3.47Å; F649-D654 HydrophobicContact CD1-CB 4.17Å; F649-D654 HydrophobicContact CD2-CB 4.1Å; F649-D654 HydrophobicContact CE1-CB 3.85Å; F649-D654 HydrophobicContact CE2-CB 3.79Å; F649-D654 HydrophobicContact CG-CB 4.27Å; F649-D654 HydrophobicContact CZ-CB 3.65Å; F649-D654 VanDerWaalsContact CZ-O 3.28Å; F649-D654 WeakPolarHBondContact CZ-O 3.45Å; D650-D654 HydrophobicContact CB-CB 4.33Å; D650-D654 PolarHBondContact N-OD2 3.44Å; D650-D654 WeakPolarHBondContact O-CB 3.17Å; D650-D654 PolarHBondContact O-N 3.41Å; D654-V659 HydrophobicContact CB-CG2 3.98Å
655	S	92.6	Very high	91.3	Very high	35 Å²	35	56.2 Å²	56.2	25%	0.245	29%	0.288	C	S	.	.			trans	-95.3	131	169.4	177	0	0	0	0	111.1	D657 E658 V659	S655-D657 PolarHBondContact O-N 3.1Å; S655-E658 PolarHBondContact O-N 3.03Å; S655-E658 VanDerWaalsContact O-N 3.17Å; S655-V659 WeakPolarHBondContact O-CG2 3.45Å; S655-V659 PolarHBondContact O-N 3.47Å
656	P	92.4	Very high	91.4	Very high	21 Å²	21	60.6 Å²	60.6	14%	0.136	31%	0.308	C	S	.	.	H	α-helix	trans	-65.6	-23.2	178.9	28.8	-35.5	0	0	0	113.1	F649 V660 T678 I681 K682	F649-P656 HydrophobicContact CE2-CB 4.39Å; P656-V660 VanDerWaalsContact O-CG2 3.29Å; P656-V660 WeakPolarHBondContact O-CG2 3.38Å; P656-V660 PolarHBondContact O-N 3.4Å; P656-T678 HydrophobicContact CB-CG2 4.39Å; P656-I681 HydrophobicContact CB-CB 4.32Å; P656-I681 HydrophobicContact CB-CG2 3.96Å; P656-K682 HydrophobicContact CB-CB 4.17Å; P656-K682 HydrophobicContact CG-CB 4.03Å; P656-K682 HydrophobicContact CG-CD 4.49Å; P656-K682 HydrophobicContact CG-CG 4.46Å
657	D	92.3	Very high	90.9	Very high	100 Å²	100	63.3 Å²	63.3	54%	0.535	32%	0.32	S	S	.	.	H	α-helix	trans	-73.3	-43	174	-68	-101.9	0	0	0	110.8	S655 V660 Q661 T678	S655-D657 PolarHBondContact O-N 3.1Å; D657-V660 PolarHBondContact O-N 3.31Å; D657-Q661 WeakPolarHBondContact O-CB 3.5Å; D657-Q661 PolarHBondContact O-N 3.38Å; D657-T678 HydrophobicContact CB-CG2 4.26Å; D657-T678 VanDerWaalsContact CG-CG2 3.46Å; D657-T678 WeakPolarHBondContact OD1-CG2 3.31Å; D657-T678 WeakPolarHBondContact OD2-CG2 3.17Å
658	E	92.5	Very high	90.5	Very high	121 Å²	121	64.9 Å²	64.9	57%	0.565	33%	0.328	S	S	*	.	H	α-helix	trans	-70.6	-43.3	-179.5	-65.9	175.5	-168.7	0	0	112.2	S655 V660 Q661 Q662	S655-E658 PolarHBondContact O-N 3.03Å; S655-E658 VanDerWaalsContact O-N 3.17Å; E658-V660 VanDerWaalsContact C-N 3.29Å; E658-V660 PolarHBondContact O-N 3.13Å; E658-Q661 WeakPolarHBondContact O-CB 3.18Å; E658-Q661 PolarHBondContact O-N 2.84Å; E658-Q661 VanDerWaalsContact O-N 3.1Å; E658-Q662 WeakPolarHBondContact O-CG 3.28Å; E658-Q662 PolarHBondContact O-N 3.29Å
659	V	93.3	Very high	90	Very high	10 Å²	10	63.1 Å²	63.1	6%	0.061	31%	0.312	C	S	.	.	H	α-helix	trans	-60.4	-39	176.8	169.7	0	0	0	0	111.2	F647 F649 D654 S655 M663 I681	F647-V659 HydrophobicContact CD2-CG1 3.87Å; F647-V659 HydrophobicContact CE2-CG1 3.99Å; F649-V659 HydrophobicContact CD2-CB 4.3Å; F649-V659 HydrophobicContact CD2-CG1 4.23Å; F649-V659 HydrophobicContact CD2-CG2 3.87Å; F649-V659 HydrophobicContact CE2-CB 4.23Å; F649-V659 HydrophobicContact CE2-CG2 3.83Å; D654-V659 HydrophobicContact CB-CG2 3.98Å; S655-V659 WeakPolarHBondContact O-CG2 3.45Å; S655-V659 PolarHBondContact O-N 3.47Å; V659-M663 HydrophobicContact CG1-CE 3.52Å; V659-M663 HydrophobicContact CG1-SD 4.49Å; V659-M663 VanDerWaalsContact O-CG 3.28Å; V659-M663 WeakPolarHBondContact O-CG 3.48Å; V659-M663 PolarHBondContact O-N 2.72Å; V659-I681 HydrophobicContact CG1-CD1 4.46Å
660	V	92.4	Very high	89.5	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-71.2	-37.3	174.1	175.2	0	0	0	0	111.7	P656 D657 E658 Q662 M663 I664 T674 I677 I681	P656-V660 VanDerWaalsContact O-CG2 3.29Å; P656-V660 WeakPolarHBondContact O-CG2 3.38Å; P656-V660 PolarHBondContact O-N 3.4Å; D657-V660 PolarHBondContact O-N 3.31Å; E658-V660 VanDerWaalsContact C-N 3.29Å; E658-V660 PolarHBondContact O-N 3.13Å; V660-Q662 VanDerWaalsContact C-N 3.3Å; V660-Q662 PolarHBondContact O-N 3.23Å; V660-M663 WeakPolarHBondContact O-CB 3.44Å; V660-M663 PolarHBondContact O-N 2.75Å; V660-M663 VanDerWaalsContact O-N 3.14Å; V660-I664 HydrophobicContact CG1-CD1 3.89Å; V660-I664 HydrophobicContact CG1-CG1 4.5Å; V660-I664 WeakPolarHBondContact O-CG1 3.34Å; V660-I664 PolarHBondContact O-N 3.49Å; V660-T674 HydrophobicContact CG1-CG2 3.99Å; V660-I677 HydrophobicContact CG2-CB 4.5Å; V660-I677 HydrophobicContact CG2-CG2 3.92Å; V660-I681 HydrophobicContact CG2-CD1 3.67Å
661	Q	91.3	Very high	89	Confident	108 Å²	108	67.6 Å²	67.6	51%	0.505	34%	0.337	S	S	.	.	H	α-helix	trans	-62.1	-37.4	176	-171.2	55.5	77.8	0	0	112.2	D657 E658 I664 E665	D657-Q661 WeakPolarHBondContact O-CB 3.5Å; D657-Q661 PolarHBondContact O-N 3.38Å; E658-Q661 WeakPolarHBondContact O-CB 3.18Å; E658-Q661 PolarHBondContact O-N 2.84Å; E658-Q661 VanDerWaalsContact O-N 3.1Å; Q661-I664 PolarHBondContact O-N 3.41Å; Q661-E665 PolarHBondContact O-N 3Å
662	Q	90.6	Very high	88.6	Confident	96 Å²	96	74.1 Å²	74.1	45%	0.449	37%	0.367	S	S	.	.	H	α-helix	trans	-65.2	-40.1	172	-67.6	176.8	33.3	0	0	112.2	E658 V660 I664 E665 Q666	E658-Q662 WeakPolarHBondContact O-CG 3.28Å; E658-Q662 PolarHBondContact O-N 3.29Å; V660-Q662 VanDerWaalsContact C-N 3.3Å; V660-Q662 PolarHBondContact O-N 3.23Å; Q662-I664 VanDerWaalsContact C-N 3.27Å; Q662-I664 PolarHBondContact O-N 3.34Å; Q662-E665 PolarHBondContact O-N 2.63Å; Q662-Q666 WeakPolarHBondContact O-CB 3.36Å; Q662-Q666 WeakPolarHBondContact O-CG 3.47Å; Q662-Q666 PolarHBondContact O-N 2.68Å
663	M	89.3	Confident	88.3	Confident	8 Å²	8	69.7 Å²	69.7	4%	0.039	35%	0.347	C	S	.	.	H	α-helix	trans	-66.2	-28.7	176.5	-66.2	168.6	-178.1	0	0	113.3	L645 F647 V659 V660 Q667 H668 I669 I681	L645-M663 HydrophobicContact CD2-CB 4.37Å; L645-M663 HydrophobicContact CD2-CE 4.34Å; L645-M663 HydrophobicContact CD2-CG 3.92Å; L645-M663 HydrophobicContact CD2-SD 3.91Å; F647-M663 HydrophobicContact CB-CE 3.78Å; F647-M663 HydrophobicContact CD1-CE 3.36Å; F647-M663 HydrophobicContact CD2-CE 3.32Å; F647-M663 HydrophobicContact CE1-CE 3.64Å; F647-M663 HydrophobicContact CE2-CE 3.59Å; F647-M663 HydrophobicContact CG-CE 3.2Å; F647-M663 HydrophobicContact CZ-CE 3.74Å; V659-M663 HydrophobicContact CG1-CE 3.52Å; V659-M663 HydrophobicContact CG1-SD 4.49Å; V659-M663 VanDerWaalsContact O-CG 3.28Å; V659-M663 WeakPolarHBondContact O-CG 3.48Å; V659-M663 PolarHBondContact O-N 2.72Å; V660-M663 WeakPolarHBondContact O-CB 3.44Å; V660-M663 PolarHBondContact O-N 2.75Å; V660-M663 VanDerWaalsContact O-N 3.14Å; M663-Q667 PolarHBondContact O-N 2.9Å; M663-H668 PolarHBondContact O-N 3.14Å; M663-I669 HydrophobicContact CB-CB 4.38Å; M663-I669 HydrophobicContact CB-CD1 3.53Å; M663-I669 HydrophobicContact CB-CG1 3.9Å; M663-I669 HydrophobicContact CG-CD1 4.04Å; M663-I669 PolarHBondContact O-N 3.23Å; M663-I669 HydrophobicContact SD-CD1 3.42Å; M663-I669 WeakPolarHBondContact SD-CD1 3.25Å; M663-I681 HydrophobicContact CE-CD1 4.36Å; M663-I681 HydrophobicContact SD-CD1 4.49Å
664	I	89.5	Confident	88.1	Confident	21 Å²	21	65.3 Å²	65.3	11%	0.108	33%	0.325	C	S	.	.	H	α-helix	trans	-74.3	-44.9	173	-69.4	160.8	0	0	0	110.3	V660 Q661 Q662 Q666 Q667 I669 D671 T674	V660-I664 HydrophobicContact CG1-CD1 3.89Å; V660-I664 HydrophobicContact CG1-CG1 4.5Å; V660-I664 WeakPolarHBondContact O-CG1 3.34Å; V660-I664 PolarHBondContact O-N 3.49Å; Q661-I664 PolarHBondContact O-N 3.41Å; Q662-I664 VanDerWaalsContact C-N 3.27Å; Q662-I664 PolarHBondContact O-N 3.34Å; I664-Q666 VanDerWaalsContact C-N 3.3Å; I664-Q666 PolarHBondContact O-N 3.02Å; I664-Q667 WeakPolarHBondContact O-CA 3.35Å; I664-Q667 PolarHBondContact O-N 3.01Å; I664-I669 HydrophobicContact CG1-CB 4.29Å; I664-I669 HydrophobicContact CG1-CG2 4.31Å; I664-D671 WeakPolarHBondContact CG2-OD1 3.32Å; I664-T674 HydrophobicContact CD1-CG2 3.76Å; I664-T674 WeakPolarHBondContact CD1-OG1 3.44Å
665	E	89.1	Confident	87.7	Confident	157 Å²	157	72.9 Å²	72.9	73%	0.734	35%	0.35	S	S	*	.	H	α-helix	trans	-60.3	-39.1	175.5	-173.5	173.9	-163.1	0	0	112	Q661 Q662 Q667	Q661-E665 PolarHBondContact O-N 3Å; Q662-E665 PolarHBondContact O-N 2.63Å; E665-Q667 PolarHBondContact O-N 3.4Å
666	Q	86.8	Confident	87.2	Confident	109 Å²	109	73.5 Å²	73.5	51%	0.509	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	1	172	-66.3	167.6	14.3	0	0	113.7	Q662 I664 H668	Q662-Q666 WeakPolarHBondContact O-CB 3.36Å; Q662-Q666 WeakPolarHBondContact O-CG 3.47Å; Q662-Q666 PolarHBondContact O-N 2.68Å; I664-Q666 VanDerWaalsContact C-N 3.3Å; I664-Q666 PolarHBondContact O-N 3.02Å; Q666-H668 PolarHBondContact O-N 2.99Å; Q666-H668 PolarHBondContact OE1-CD2 2.83Å
667	Q	80.3	Confident	87	Confident	143 Å²	143	72.5 Å²	72.5	67%	0.668	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	25.2	-177.6	-55.4	-171.9	0.9	0	0	114.6	R638 M663 I664 E665	R638-Q667 WeakPolarHBondContact CB-O 3.44Å; R638-Q667 WeakPolarHBondContact CG-O 3.34Å; M663-Q667 PolarHBondContact O-N 2.9Å; I664-Q667 WeakPolarHBondContact O-CA 3.35Å; I664-Q667 PolarHBondContact O-N 3.01Å; E665-Q667 PolarHBondContact O-N 3.4Å
668	H	82.2	Confident	86.9	Confident	57 Å²	57	68.4 Å²	68.4	26%	0.264	32%	0.321	S	S	.	.	S	Bend	trans	-79.3	-28.2	176.4	-67.5	-30.5	0	0	0	112.7	Y637 L645 M663 Q666	Y637-H668 WeakPolarHBondContact CD1-O 3.47Å; L645-H668 HydrophobicContact CD1-CB 4.16Å; L645-H668 VanDerWaalsContact CD1-CD2 3.42Å; L645-H668 WeakPolarHBondContact CD1-CD2 3.16Å; L645-H668 HydrophobicContact CD2-CB 3.8Å; M663-H668 PolarHBondContact O-N 3.14Å; Q666-H668 PolarHBondContact O-N 2.99Å; Q666-H668 PolarHBondContact OE1-CD2 2.83Å
669	I	84.1	Confident	86.6	Confident	7 Å²	7	68.3 Å²	68.3	4%	0.036	32%	0.319	C	S	.	.	S	Bend	trans	-128.8	142.1	-173.1	-61.9	-176	0	0	0	110	L626 Y637 L645 M663 I664 I677	L626-I669 HydrophobicContact CD2-CD1 3.5Å; L626-I669 VanDerWaalsContact CD2-CD1 3.5Å; L626-I669 HydrophobicContact CD2-CG1 3.94Å; Y637-I669 HydrophobicContact CD1-CG1 4.42Å; Y637-I669 HydrophobicContact CE1-CB 4.28Å; Y637-I669 HydrophobicContact CE1-CG1 4.08Å; Y637-I669 HydrophobicContact CE1-CG2 4.13Å; L645-I669 HydrophobicContact CD2-CD1 4.25Å; L645-I669 HydrophobicContact CD2-CG1 4.3Å; M663-I669 HydrophobicContact CB-CB 4.38Å; M663-I669 HydrophobicContact CB-CD1 3.53Å; M663-I669 HydrophobicContact CB-CG1 3.9Å; M663-I669 HydrophobicContact CG-CD1 4.04Å; M663-I669 PolarHBondContact O-N 3.23Å; M663-I669 HydrophobicContact SD-CD1 3.42Å; M663-I669 WeakPolarHBondContact SD-CD1 3.25Å; I664-I669 HydrophobicContact CG1-CB 4.29Å; I664-I669 HydrophobicContact CG1-CG2 4.31Å; I669-I677 HydrophobicContact CD1-CD1 4.05Å; I669-I677 HydrophobicContact CD1-CG2 4.16Å; I669-I677 HydrophobicContact CG2-CD1 3.74Å
670	P	82.7	Confident	86.3	Confident	14 Å²	14	68.6 Å²	68.6	9%	0.091	32%	0.32	C	S	.	.			trans	-85.3	143	174	34.2	-35.2	0	0	0	114.1	Q636 Y637 E672 D673	Q636-P670 HydrophobicContact CB-CG 4.5Å; Q636-P670 HydrophobicContact CG-CB 3.75Å; Q636-P670 HydrophobicContact CG-CG 3.82Å; Y637-P670 VanDerWaalsContact CE1-CD 3.47Å; Y637-P670 HydrophobicContact CE1-CG 4.43Å; Y637-P670 HydrophobicContact CE2-CG 4.12Å; P670-E672 PolarHBondContact O-N 2.66Å; P670-E672 VanDerWaalsContact O-N 3.09Å; P670-D673 HydrophobicContact CG-CB 4.48Å; P670-D673 PolarHBondContact O-N 2.92Å; P670-D673 VanDerWaalsContact O-N 3.11Å
671	D	84.2	Confident	86.2	Confident	117 Å²	117	68.6 Å²	68.6	63%	0.626	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-51.6	-33.2	-176.8	-54.3	2.3	0	0	0	113.9	I664 D673 T674	I664-D671 WeakPolarHBondContact CG2-OD1 3.32Å; D671-D673 VanDerWaalsContact C-N 3.32Å; D671-D673 PolarHBondContact O-N 2.82Å; D671-T674 VanDerWaalsContact C-OG1 3.29Å; D671-T674 WeakPolarHBondContact CA-OG1 3.43Å; D671-T674 WeakPolarHBondContact O-CB 3.27Å; D671-T674 PolarHBondContact O-N 2.89Å; D671-T674 PolarHBondContact O-OG1 2.9Å
672	E	82.4	Confident	86.1	Confident	137 Å²	137	68.4 Å²	68.4	64%	0.64	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-68	-30.8	-177.3	-58.7	92.8	160.5	0	0	113.3	Q636 P670	Q636-E672 PolarHBondContact NE2-OE2 2.68Å; P670-E672 PolarHBondContact O-N 2.66Å; P670-E672 VanDerWaalsContact O-N 3.09Å
673	D	82.8	Confident	85.9	Confident	18 Å²	18	66.2 Å²	66.2	10%	0.096	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-91.5	-4.5	-177.9	-80.8	-30.3	0	0	0	113.1	K633 Y637 P670 D671 R675 M676 I677	K633-D673 WeakPolarHBondContact CE-OD2 3.3Å; K633-D673 IonicContact NZ-OD1 2.76Å; K633-D673 PolarHBondContact NZ-OD1 2.79Å; K633-D673 IonicContact NZ-OD2 2.72Å; K633-D673 PolarHBondContact NZ-OD2 2.75Å; Y637-D673 WeakPolarHBondContact OH-CB 3.12Å; Y637-D673 PolarHBondContact OH-OD2 3.21Å; P670-D673 HydrophobicContact CG-CB 4.48Å; P670-D673 PolarHBondContact O-N 2.92Å; P670-D673 VanDerWaalsContact O-N 3.11Å; D671-D673 VanDerWaalsContact C-N 3.32Å; D671-D673 PolarHBondContact O-N 2.82Å; D673-R675 PolarHBondContact O-N 3.01Å; D673-M676 HydrophobicContact CB-CE 4.07Å; D673-M676 WeakPolarHBondContact O-CB 3.48Å; D673-M676 PolarHBondContact O-N 2.7Å; D673-M676 WeakPolarHBondContact OD1-CE 3.39Å; D673-I677 HydrophobicContact CB-CD1 4.26Å; D673-I677 PolarHBondContact O-N 3.25Å
674	T	87.2	Confident	85.8	Confident	35 Å²	35	66.6 Å²	66.6	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-38.5	-68.7	179.3	-55.3	0	0	0	0	113.4	V660 I664 D671 M676 I677 T678	V660-T674 HydrophobicContact CG1-CG2 3.99Å; I664-T674 HydrophobicContact CD1-CG2 3.76Å; I664-T674 WeakPolarHBondContact CD1-OG1 3.44Å; D671-T674 VanDerWaalsContact C-OG1 3.29Å; D671-T674 WeakPolarHBondContact CA-OG1 3.43Å; D671-T674 WeakPolarHBondContact O-CB 3.27Å; D671-T674 PolarHBondContact O-N 2.89Å; D671-T674 PolarHBondContact O-OG1 2.9Å; T674-M676 PolarHBondContact O-N 3.38Å; T674-I677 PolarHBondContact O-N 2.72Å; T674-T678 PolarHBondContact O-N 3.02Å; T674-T678 PolarHBondContact O-OG1 3.03Å; T674-T678 VanDerWaalsContact O-OG1 3.08Å
675	R	84.6	Confident	85.9	Confident	217 Å²	217	65.8 Å²	65.8	82%	0.819	31%	0.306	S	S	*	.	H	α-helix	trans	-56	-28	-175.9	-68.9	179.7	-67.9	-134.1	-6.5	113.6	D673 K679	D673-R675 PolarHBondContact O-N 3.01Å; R675-K679 WeakPolarHBondContact O-CB 3.12Å; R675-K679 PolarHBondContact O-N 2.83Å
676	M	82.3	Confident	85.9	Confident	48 Å²	48	60.9 Å²	60.9	24%	0.236	29%	0.285	C	S	.	.	H	α-helix	trans	-82.4	-37.1	-178.7	-172.7	178	63.1	0	0	111.3	I602 I604 D673 T674 L680	I602-M676 HydrophobicContact CB-CE 4.46Å; I602-M676 HydrophobicContact CB-SD 3.95Å; I602-M676 HydrophobicContact CD1-CG 4.47Å; I602-M676 HydrophobicContact CG1-CG 4.39Å; I602-M676 HydrophobicContact CG1-SD 3.84Å; I602-M676 HydrophobicContact CG2-CE 3.56Å; I602-M676 HydrophobicContact CG2-CG 4Å; I602-M676 HydrophobicContact CG2-SD 3.49Å; I602-M676 WeakPolarHBondContact CG2-SD 3.15Å; I604-M676 HydrophobicContact CD1-CE 3.54Å; D673-M676 HydrophobicContact CB-CE 4.07Å; D673-M676 WeakPolarHBondContact O-CB 3.48Å; D673-M676 PolarHBondContact O-N 2.7Å; D673-M676 WeakPolarHBondContact OD1-CE 3.39Å; T674-M676 PolarHBondContact O-N 3.38Å; M676-L680 WeakPolarHBondContact O-CG 3.31Å; M676-L680 PolarHBondContact O-N 3.06Å
677	I	87.8	Confident	85.7	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-76.9	-39.9	176	-65.2	175	0	0	0	111	I604 L626 Y637 V660 I669 D673 T674 K679 L680 I681	I604-I677 HydrophobicContact CD1-CD1 4.42Å; I604-I677 HydrophobicContact CG2-CD1 4.31Å; I604-I677 HydrophobicContact CG2-CG1 4.32Å; L626-I677 HydrophobicContact CD1-CD1 4.21Å; L626-I677 HydrophobicContact CD1-CG1 4.36Å; L626-I677 HydrophobicContact CD1-CG2 4.01Å; L626-I677 HydrophobicContact CD2-CD1 4.18Å; Y637-I677 HydrophobicContact CE1-CD1 4.1Å; Y637-I677 WeakPolarHBondContact OH-CD1 3.37Å; V660-I677 HydrophobicContact CG2-CB 4.5Å; V660-I677 HydrophobicContact CG2-CG2 3.92Å; I669-I677 HydrophobicContact CD1-CD1 4.05Å; I669-I677 HydrophobicContact CD1-CG2 4.16Å; I669-I677 HydrophobicContact CG2-CD1 3.74Å; D673-I677 HydrophobicContact CB-CD1 4.26Å; D673-I677 PolarHBondContact O-N 3.25Å; T674-I677 PolarHBondContact O-N 2.72Å; I677-K679 PolarHBondContact O-N 2.73Å; I677-L680 PolarHBondContact O-N 2.65Å; I677-I681 HydrophobicContact CG2-CD1 4.07Å; I677-I681 HydrophobicContact CG2-CG1 4.36Å; I677-I681 WeakPolarHBondContact O-CG1 3.35Å; I677-I681 PolarHBondContact O-N 3.23Å
678	T	90.3	Very high	86.2	Confident	13 Å²	13	49.7 Å²	49.7	8%	0.08	24%	0.235	C	C	.	.	H	α-helix	trans	-52.7	-46.6	169.2	-59.1	0	0	0	0	110.5	P656 D657 T674 I681 K682	P656-T678 HydrophobicContact CB-CG2 4.39Å; D657-T678 HydrophobicContact CB-CG2 4.26Å; D657-T678 VanDerWaalsContact CG-CG2 3.46Å; D657-T678 WeakPolarHBondContact OD1-CG2 3.31Å; D657-T678 WeakPolarHBondContact OD2-CG2 3.17Å; T674-T678 PolarHBondContact O-N 3.02Å; T674-T678 PolarHBondContact O-OG1 3.03Å; T674-T678 VanDerWaalsContact O-OG1 3.08Å; T678-I681 PolarHBondContact O-N 3.05Å; T678-K682 WeakPolarHBondContact O-CB 3.49Å; T678-K682 PolarHBondContact O-N 2.67Å
679	K	85.9	Confident	86.5	Confident	120 Å²	120	51.2 Å²	51.2	52%	0.522	24%	0.239	S	C	.	.	H	α-helix	trans	-62.3	-45.3	174.3	-173.4	-178.7	-169.6	-61.2	0	112.4	R675 I677 I681 K682 D683	R675-K679 WeakPolarHBondContact O-CB 3.12Å; R675-K679 PolarHBondContact O-N 2.83Å; I677-K679 PolarHBondContact O-N 2.73Å; K679-I681 VanDerWaalsContact C-N 3.34Å; K679-I681 PolarHBondContact O-N 3.15Å; K679-K682 PolarHBondContact O-N 3.28Å; K679-D683 VanDerWaalsContact NZ-CG 3.28Å; K679-D683 IonicContact NZ-OD1 2.77Å; K679-D683 PolarHBondContact NZ-OD1 2.94Å; K679-D683 VanDerWaalsContact NZ-OD1 3.09Å; K679-D683 IonicContact NZ-OD2 3.22Å; K679-D683 PolarHBondContact NZ-OD2 2.73Å; K679-D683 WeakPolarHBondContact O-CB 3.43Å; K679-D683 PolarHBondContact O-N 3.49Å
680	L	86.8	Confident	86.6	Confident	15 Å²	15	56.6 Å²	56.6	8%	0.079	26%	0.259	C	S	.	.	H	α-helix	trans	-63.1	-37.6	178.6	-75.7	170.7	0	0	0	112.8	I602 I604 V606 M676 I677 K684	I602-L680 HydrophobicContact CD1-CD1 4.43Å; I602-L680 HydrophobicContact CD1-CD2 4.12Å; I602-L680 HydrophobicContact CG2-CD1 3.84Å; I604-L680 HydrophobicContact CG2-CD1 4.31Å; V606-L680 HydrophobicContact CB-CB 4.46Å; V606-L680 HydrophobicContact CG2-CB 3.78Å; M676-L680 WeakPolarHBondContact O-CG 3.31Å; M676-L680 PolarHBondContact O-N 3.06Å; I677-L680 PolarHBondContact O-N 2.65Å; L680-K684 WeakPolarHBondContact O-CG 3.4Å; L680-K684 PolarHBondContact O-N 3.22Å
681	I	90.2	Very high	86.7	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.7	-46.1	174.9	-66.4	177.1	0	0	0	109.6	V606 M624 F647 F649 P656 V659 V660 M663 I677 T678 K679 K684 V685	V606-I681 HydrophobicContact CG1-CG1 4.43Å; V606-I681 HydrophobicContact CG2-CG1 4.16Å; M624-I681 HydrophobicContact CE-CG2 4.34Å; M624-I681 HydrophobicContact SD-CG2 4.05Å; F647-I681 HydrophobicContact CE2-CD1 3.78Å; F647-I681 HydrophobicContact CE2-CG1 4.37Å; F647-I681 HydrophobicContact CZ-CD1 3.55Å; F647-I681 HydrophobicContact CZ-CG1 3.93Å; F649-I681 HydrophobicContact CD2-CG2 3.85Å; F649-I681 HydrophobicContact CE2-CG2 3.72Å; F649-I681 HydrophobicContact CZ-CG2 4.49Å; P656-I681 HydrophobicContact CB-CB 4.32Å; P656-I681 HydrophobicContact CB-CG2 3.96Å; V659-I681 HydrophobicContact CG1-CD1 4.46Å; V660-I681 HydrophobicContact CG2-CD1 3.67Å; M663-I681 HydrophobicContact CE-CD1 4.36Å; M663-I681 HydrophobicContact SD-CD1 4.49Å; I677-I681 HydrophobicContact CG2-CD1 4.07Å; I677-I681 HydrophobicContact CG2-CG1 4.36Å; I677-I681 WeakPolarHBondContact O-CG1 3.35Å; I677-I681 PolarHBondContact O-N 3.23Å; T678-I681 PolarHBondContact O-N 3.05Å; K679-I681 VanDerWaalsContact C-N 3.34Å; K679-I681 PolarHBondContact O-N 3.15Å; I681-K684 WeakPolarHBondContact O-CB 3.42Å; I681-K684 PolarHBondContact O-N 3.4Å; I681-V685 HydrophobicContact CG2-CG2 4.31Å; I681-V685 WeakPolarHBondContact O-CG2 3.4Å; I681-V685 PolarHBondContact O-N 3.31Å
682	K	89.8	Confident	86.9	Confident	105 Å²	105	53.8 Å²	53.8	46%	0.457	24%	0.24	S	C	.	.	H	α-helix	trans	-59	-50.6	176.7	-177.8	167.3	-177.8	164.7	0	113	P656 T678 K679 K684 V685 D686	P656-K682 HydrophobicContact CB-CB 4.17Å; P656-K682 HydrophobicContact CG-CB 4.03Å; P656-K682 HydrophobicContact CG-CD 4.49Å; P656-K682 HydrophobicContact CG-CG 4.46Å; T678-K682 WeakPolarHBondContact O-CB 3.49Å; T678-K682 PolarHBondContact O-N 2.67Å; K679-K682 PolarHBondContact O-N 3.28Å; K682-K684 PolarHBondContact O-N 2.75Å; K682-K684 VanDerWaalsContact O-N 3.16Å; K682-V685 PolarHBondContact O-N 3.45Å; K682-D686 WeakPolarHBondContact CE-OD2 3.39Å; K682-D686 WeakPolarHBondContact CG-OD2 3.34Å; K682-D686 WeakPolarHBondContact O-CB 3.37Å; K682-D686 PolarHBondContact O-N 3.42Å
683	D	84.8	Confident	87.2	Confident	49 Å²	49	51.2 Å²	51.2	26%	0.262	23%	0.231	S	C	.	.	H	α-helix	trans	-56.1	-33.4	178.8	-70.1	-17.3	0	0	0	111.1	K679 A687	K679-D683 VanDerWaalsContact NZ-CG 3.28Å; K679-D683 IonicContact NZ-OD1 2.77Å; K679-D683 PolarHBondContact NZ-OD1 2.94Å; K679-D683 VanDerWaalsContact NZ-OD1 3.09Å; K679-D683 IonicContact NZ-OD2 3.22Å; K679-D683 PolarHBondContact NZ-OD2 2.73Å; K679-D683 WeakPolarHBondContact O-CB 3.43Å; K679-D683 PolarHBondContact O-N 3.49Å; D683-A687 WeakPolarHBondContact O-CB 3.35Å; D683-A687 PolarHBondContact O-N 3.43Å; D683-A687 VanDerWaalsContact O-N 3.16Å
684	K	87.6	Confident	87.3	Confident	16 Å²	16	53.8 Å²	53.8	7%	0.07	24%	0.242	C	C	.	.	H	α-helix	trans	-74.5	-46.1	176.3	-68.2	-81.4	169.9	177.5	0	113.5	D594 V606 M624 L680 I681 K682 A687 F688	D594-K684 VanDerWaalsContact CG-CE 3.4Å; D594-K684 WeakPolarHBondContact OD1-CE 3.2Å; D594-K684 IonicContact OD1-NZ 2.79Å; D594-K684 PolarHBondContact OD1-NZ 3.13Å; D594-K684 VanDerWaalsContact OD2-CE 3.25Å; D594-K684 WeakPolarHBondContact OD2-CE 3.39Å; D594-K684 IonicContact OD2-NZ 2.7Å; D594-K684 PolarHBondContact OD2-NZ 3.25Å; V606-K684 HydrophobicContact CB-CG 4.17Å; V606-K684 HydrophobicContact CG1-CG 4.02Å; V606-K684 WeakPolarHBondContact O-CE 3.43Å; V606-K684 PolarHBondContact O-NZ 2.95Å; M624-K684 HydrophobicContact CE-CB 3.57Å; M624-K684 HydrophobicContact CE-CG 4.25Å; L680-K684 WeakPolarHBondContact O-CG 3.4Å; L680-K684 PolarHBondContact O-N 3.22Å; I681-K684 WeakPolarHBondContact O-CB 3.42Å; I681-K684 PolarHBondContact O-N 3.4Å; K682-K684 PolarHBondContact O-N 2.75Å; K682-K684 VanDerWaalsContact O-N 3.16Å; K684-A687 WeakPolarHBondContact O-CB 3.47Å; K684-A687 PolarHBondContact O-N 3.03Å; K684-F688 PolarHBondContact O-N 2.98Å
685	V	91.5	Very high	87.3	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.024	25%	0.246	C	C	.	.	H	α-helix	trans	-66.1	-44	178.9	173.2	0	0	0	0	109.8	M624 F649 I681 K682 A687 F688 R689	M624-V685 HydrophobicContact CE-CG2 4.25Å; M624-V685 HydrophobicContact SD-CG2 4.43Å; F649-V685 HydrophobicContact CD1-CG2 3.65Å; F649-V685 HydrophobicContact CE1-CB 4.33Å; F649-V685 HydrophobicContact CE1-CG1 3.91Å; F649-V685 HydrophobicContact CE1-CG2 3.5Å; F649-V685 VanDerWaalsContact CE1-CG2 3.5Å; F649-V685 HydrophobicContact CE2-CG2 4.43Å; F649-V685 HydrophobicContact CG-CG2 4.22Å; F649-V685 HydrophobicContact CZ-CG2 3.92Å; I681-V685 HydrophobicContact CG2-CG2 4.31Å; I681-V685 WeakPolarHBondContact O-CG2 3.4Å; I681-V685 PolarHBondContact O-N 3.31Å; K682-V685 PolarHBondContact O-N 3.45Å; V685-A687 PolarHBondContact O-N 3.08Å; V685-F688 PolarHBondContact O-N 3.14Å; V685-R689 HydrophobicContact CG1-CG 4.4Å; V685-R689 WeakPolarHBondContact O-CB 3.39Å; V685-R689 WeakPolarHBondContact O-CG 3Å; V685-R689 PolarHBondContact O-N 2.99Å
686	D	88.8	Confident	87.5	Confident	54 Å²	54	49.1 Å²	49.1	29%	0.289	23%	0.226	S	C	.	.	H	α-helix	trans	-69	-17.8	175.2	-70.8	-21.4	0	0	0	112.7	K682 R689 R690	K682-D686 WeakPolarHBondContact CE-OD2 3.39Å; K682-D686 WeakPolarHBondContact CG-OD2 3.34Å; K682-D686 WeakPolarHBondContact O-CB 3.37Å; K682-D686 PolarHBondContact O-N 3.42Å; D686-R689 IonicContact OD1-NH1 2.71Å; D686-R689 PolarHBondContact OD1-NH1 2.7Å; D686-R690 WeakPolarHBondContact O-CG 3.41Å; D686-R690 PolarHBondContact O-NE 2.88Å; D686-R690 PolarHBondContact O-NH2 2.99Å
687	A	83.6	Confident	87.8	Confident	17 Å²	17	51.6 Å²	51.6	14%	0.14	24%	0.24	C	C	.	.	H	α-helix	trans	-78.6	-52.9	166	0	0	0	0	0	111.8	D683 K684 V685 R689 R690 D691	D683-A687 WeakPolarHBondContact O-CB 3.35Å; D683-A687 PolarHBondContact O-N 3.43Å; D683-A687 VanDerWaalsContact O-N 3.16Å; K684-A687 WeakPolarHBondContact O-CB 3.47Å; K684-A687 PolarHBondContact O-N 3.03Å; V685-A687 PolarHBondContact O-N 3.08Å; A687-R689 VanDerWaalsContact C-N 3.34Å; A687-R689 PolarHBondContact O-N 3.41Å; A687-R690 PolarHBondContact O-N 3.48Å; A687-R690 VanDerWaalsContact O-N 3.16Å; A687-D691 PolarHBondContact O-N 3.02Å
688	F	89.7	Confident	87.7	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.7	-39.8	-178.1	-170.1	-83.4	0	0	0	112.7	I608 R611 D614 L615 I622 I651 K684 V685 R690 D691 R692	I608-F688 HydrophobicContact CD1-CB 3.89Å; I608-F688 HydrophobicContact CD1-CD2 3.71Å; I608-F688 HydrophobicContact CD1-CG 4.08Å; R611-F688 HydrophobicContact CG-CD2 4.38Å; R611-F688 HydrophobicContact CG-CE2 4.32Å; D614-F688 HydrophobicContact CB-CE2 4.03Å; D614-F688 HydrophobicContact CB-CZ 3.66Å; L615-F688 HydrophobicContact CB-CE2 4.12Å; L615-F688 HydrophobicContact CB-CZ 4.14Å; L615-F688 HydrophobicContact CD1-CD1 4.36Å; L615-F688 HydrophobicContact CD1-CD2 4.06Å; L615-F688 HydrophobicContact CD1-CE1 4.03Å; L615-F688 HydrophobicContact CD1-CE2 3.71Å; L615-F688 HydrophobicContact CD1-CG 4.38Å; L615-F688 HydrophobicContact CD1-CZ 3.69Å; I622-F688 HydrophobicContact CD1-CG 4.48Å; I622-F688 HydrophobicContact CG2-CD1 4.46Å; I622-F688 HydrophobicContact CG2-CE1 3.95Å; I622-F688 HydrophobicContact CG2-CE2 4.31Å; I622-F688 HydrophobicContact CG2-CZ 3.86Å; I651-F688 HydrophobicContact CD1-CD1 3.38Å; I651-F688 HydrophobicContact CD1-CE1 3.37Å; I651-F688 HydrophobicContact CD1-CG 4.48Å; I651-F688 HydrophobicContact CD1-CZ 4.46Å; I651-F688 HydrophobicContact CG1-CD1 4.39Å; K684-F688 PolarHBondContact O-N 2.98Å; V685-F688 PolarHBondContact O-N 3.14Å; F688-R690 PolarHBondContact O-N 2.85Å; F688-D691 PolarHBondContact O-N 3.11Å; F688-R692 WeakPolarHBondContact O-CB 3.49Å; F688-R692 PolarHBondContact O-N 2.93Å
689	R	89.3	Confident	87.5	Confident	90 Å²	90	57.5 Å²	57.5	34%	0.34	27%	0.267	S	S	.	.	H	α-helix	trans	-53.9	-53.2	172	-76.4	171.9	171.7	173.4	-8.1	111.6	I651 V685 D686 A687 D691 R692 D693	I651-R689 HydrophobicContact CG2-CG 3.53Å; I651-R689 PolarHBondContact O-NE 3.43Å; I651-R689 PolarHBondContact O-NH2 2.91Å; V685-R689 HydrophobicContact CG1-CG 4.4Å; V685-R689 WeakPolarHBondContact O-CB 3.39Å; V685-R689 WeakPolarHBondContact O-CG 3Å; V685-R689 PolarHBondContact O-N 2.99Å; D686-R689 IonicContact OD1-NH1 2.71Å; D686-R689 PolarHBondContact OD1-NH1 2.7Å; A687-R689 VanDerWaalsContact C-N 3.34Å; A687-R689 PolarHBondContact O-N 3.41Å; R689-D691 VanDerWaalsContact C-N 3.29Å; R689-D691 PolarHBondContact O-N 3.03Å; R689-R692 WeakPolarHBondContact O-CB 3.23Å; R689-R692 PolarHBondContact O-N 3.09Å; R689-R692 VanDerWaalsContact O-N 3.08Å; R689-D693 PolarHBondContact O-N 3.46Å
690	R	86.3	Confident	87.7	Confident	119 Å²	119	57.5 Å²	57.5	45%	0.449	27%	0.267	S	S	.	.	H	α-helix	trans	-60.8	-36.4	178.6	-73.7	-179.8	-72.7	125.5	-5.2	113.2	D686 A687 F688 H694	D686-R690 WeakPolarHBondContact O-CG 3.41Å; D686-R690 PolarHBondContact O-NE 2.88Å; D686-R690 PolarHBondContact O-NH2 2.99Å; A687-R690 PolarHBondContact O-N 3.48Å; A687-R690 VanDerWaalsContact O-N 3.16Å; F688-R690 PolarHBondContact O-N 2.85Å; R690-H694 WeakPolarHBondContact O-CB 3.45Å; R690-H694 PolarHBondContact O-N 2.9Å
691	D	85.3	Confident	87.6	Confident	33 Å²	33	61.7 Å²	61.7	18%	0.176	28%	0.282	C	S	.	.	H	α-helix	trans	-71.2	-36.2	176.7	-63.1	-35.4	0	0	0	111.3	R611 L615 A687 F688 R689 H694 R695	R611-D691 IonicContact CZ-OD2 3.49Å; R611-D691 IonicContact NH1-OD2 3.73Å; R611-D691 PolarHBondContact NH1-OD2 3.23Å; R611-D691 IonicContact NH2-OD2 3.75Å; R611-D691 PolarHBondContact NH2-OD2 2.84Å; L615-D691 HydrophobicContact CD1-CB 3.76Å; L615-D691 HydrophobicContact CD2-CB 4.01Å; A687-D691 PolarHBondContact O-N 3.02Å; F688-D691 PolarHBondContact O-N 3.11Å; R689-D691 VanDerWaalsContact C-N 3.29Å; R689-D691 PolarHBondContact O-N 3.03Å; D691-H694 PolarHBondContact O-N 3.31Å; D691-R695 WeakPolarHBondContact O-CB 3.39Å; D691-R695 PolarHBondContact O-N 3.06Å
692	R	88.7	Confident	87.4	Confident	39 Å²	39	64.4 Å²	64.4	15%	0.147	31%	0.305	C	S	.	.	H	α-helix	trans	-63.7	-45.4	174	-171.4	-176.4	78	161.5	2.4	110.5	L615 L618 E652 F688 R689 R695 L696	L615-R692 HydrophobicContact CD1-CB 4.2Å; L618-R692 HydrophobicContact CD2-CG 3.83Å; E652-R692 IonicContact OE1-CZ 2.92Å; E652-R692 IonicContact OE1-NH1 2.7Å; E652-R692 PolarHBondContact OE1-NH1 3.43Å; E652-R692 IonicContact OE1-NH2 3.49Å; E652-R692 PolarHBondContact OE1-NH2 3.29Å; F688-R692 WeakPolarHBondContact O-CB 3.49Å; F688-R692 PolarHBondContact O-N 2.93Å; R689-R692 WeakPolarHBondContact O-CB 3.23Å; R689-R692 PolarHBondContact O-N 3.09Å; R689-R692 VanDerWaalsContact O-N 3.08Å; R692-R695 PolarHBondContact O-N 3.16Å; R692-L696 HydrophobicContact CG-CD1 4.39Å; R692-L696 WeakPolarHBondContact O-CG 3.23Å; R692-L696 PolarHBondContact O-N 2.88Å
693	D	88.8	Confident	87.3	Confident	84 Å²	84	65.9 Å²	65.9	45%	0.449	31%	0.311	S	S	.	.	H	α-helix	trans	-65.9	-39.3	178.9	-56.2	-25.2	0	0	0	111.4	R689 L696 L697	R689-D693 PolarHBondContact O-N 3.46Å; D693-L696 PolarHBondContact O-N 3.45Å; D693-L697 WeakPolarHBondContact O-CB 3.19Å; D693-L697 PolarHBondContact O-N 3.29Å
694	H	84.8	Confident	87.3	Confident	72 Å²	72	67.5 Å²	67.5	33%	0.333	32%	0.317	S	S	.	.	H	α-helix	trans	-61.5	-43.8	171.2	-177.9	-76.7	0	0	0	111.7	R578 R690 D691 L697 E698	R578-H694 PolarHBondContact NH1-NE2 2.8Å; R578-H694 PolarHBondContact NH2-CE1 2.9Å; R690-H694 WeakPolarHBondContact O-CB 3.45Å; R690-H694 PolarHBondContact O-N 2.9Å; D691-H694 PolarHBondContact O-N 3.31Å; H694-L697 WeakPolarHBondContact O-CB 3.2Å; H694-L697 PolarHBondContact O-N 2.88Å; H694-E698 PolarHBondContact O-N 3.41Å
695	R	86.4	Confident	87	Confident	77 Å²	77	71.9 Å²	71.9	29%	0.291	34%	0.338	S	S	.	.	H	α-helix	trans	-66.2	-39.4	178.7	-171.8	55.6	164.7	166.8	0.7	112.4	N616 D691 R692 E698 I699	N616-R695 PolarHBondContact OD1-NE 3.26Å; N616-R695 PolarHBondContact OD1-NH2 3.48Å; D691-R695 WeakPolarHBondContact O-CB 3.39Å; D691-R695 PolarHBondContact O-N 3.06Å; R692-R695 PolarHBondContact O-N 3.16Å; R695-E698 WeakPolarHBondContact CD-OE2 3.49Å; R695-E698 IonicContact CZ-OE2 2.73Å; R695-E698 IonicContact NE-OE2 2.69Å; R695-E698 IonicContact NH1-OE2 3.87Å; R695-E698 PolarHBondContact NH1-OE2 2.88Å; R695-E698 PolarHBondContact O-N 3.02Å; R695-I699 HydrophobicContact CG-CD1 4.11Å; R695-I699 WeakPolarHBondContact O-CB 3.46Å; R695-I699 VanDerWaalsContact O-CG1 3.27Å; R695-I699 WeakPolarHBondContact O-CG1 3.39Å; R695-I699 PolarHBondContact O-N 2.82Å
696	L	89.2	Confident	86.6	Confident	76 Å²	76	76.8 Å²	76.8	40%	0.398	36%	0.36	S	S	.	.	H	α-helix	trans	-60	-43.6	171.4	-75.1	167.7	0	0	0	111.6	L618 R692 D693 I699 K700	L618-L696 HydrophobicContact CD1-CD2 3.69Å; L618-L696 HydrophobicContact CD2-CD2 4.06Å; L618-L696 HydrophobicContact CD2-CG 4.05Å; R692-L696 HydrophobicContact CG-CD1 4.39Å; R692-L696 WeakPolarHBondContact O-CG 3.23Å; R692-L696 PolarHBondContact O-N 2.88Å; D693-L696 PolarHBondContact O-N 3.45Å; L696-I699 PolarHBondContact O-N 2.73Å; L696-K700 WeakPolarHBondContact O-CB 3.07Å; L696-K700 PolarHBondContact O-N 3.49Å
697	L	88.2	Confident	86.5	Confident	101 Å²	101	80 Å²	80	53%	0.529	37%	0.374	S	S	.	.	H	α-helix	trans	-66.6	-37.4	177.4	-165.8	73	0	0	0	112.4	D693 H694 K700 R701	D693-L697 WeakPolarHBondContact O-CB 3.19Å; D693-L697 PolarHBondContact O-N 3.29Å; H694-L697 WeakPolarHBondContact O-CB 3.2Å; H694-L697 PolarHBondContact O-N 2.88Å; L697-K700 PolarHBondContact O-N 3.33Å; L697-R701 WeakPolarHBondContact O-CB 3.31Å; L697-R701 PolarHBondContact O-N 3.08Å
698	E	84.8	Confident	86.6	Confident	85 Å²	85	85.7 Å²	85.7	40%	0.397	39%	0.392	S	S	.	.	H	α-helix	trans	-65.5	-45	174.2	-173.9	178.4	-136.7	0	0	111.7	H694 R695 K700 R701 A702	H694-E698 PolarHBondContact O-N 3.41Å; R695-E698 WeakPolarHBondContact CD-OE2 3.49Å; R695-E698 IonicContact CZ-OE2 2.73Å; R695-E698 IonicContact NE-OE2 2.69Å; R695-E698 IonicContact NH1-OE2 3.87Å; R695-E698 PolarHBondContact NH1-OE2 2.88Å; R695-E698 PolarHBondContact O-N 3.02Å; E698-K700 VanDerWaalsContact C-N 3.32Å; E698-K700 PolarHBondContact O-N 2.71Å; E698-R701 PolarHBondContact O-N 3.14Å; E698-A702 WeakPolarHBondContact O-CB 3.37Å; E698-A702 PolarHBondContact O-N 2.92Å
699	I	87.7	Confident	86.4	Confident	51 Å²	51	90.6 Å²	90.6	26%	0.262	42%	0.417	S	S	.	.	H	α-helix	trans	-62.8	-38.8	174.7	-69.2	164.7	0	0	0	111	L618 R695 L696 A702 K703	L618-I699 HydrophobicContact CD1-CD1 4.47Å; R695-I699 HydrophobicContact CG-CD1 4.11Å; R695-I699 WeakPolarHBondContact O-CB 3.46Å; R695-I699 VanDerWaalsContact O-CG1 3.27Å; R695-I699 WeakPolarHBondContact O-CG1 3.39Å; R695-I699 PolarHBondContact O-N 2.82Å; L696-I699 PolarHBondContact O-N 2.73Å; I699-A702 PolarHBondContact O-N 2.8Å; I699-K703 HydrophobicContact CG2-CD 4.45Å; I699-K703 WeakPolarHBondContact O-CG 3.33Å; I699-K703 PolarHBondContact O-N 2.81Å; I699-K703 VanDerWaalsContact O-N 3.14Å
700	K	88.9	Confident	86.3	Confident	121 Å²	121	93.8 Å²	93.8	53%	0.526	43%	0.429	S	S	.	.	H	α-helix	trans	-61.4	-51.8	174.8	-166.6	-169.3	-175.4	-115.7	0	110.9	L696 L697 E698 A702 K703 E704	L696-K700 WeakPolarHBondContact O-CB 3.07Å; L696-K700 PolarHBondContact O-N 3.49Å; L697-K700 PolarHBondContact O-N 3.33Å; E698-K700 VanDerWaalsContact C-N 3.32Å; E698-K700 PolarHBondContact O-N 2.71Å; K700-A702 VanDerWaalsContact C-N 3.32Å; K700-A702 PolarHBondContact O-N 3.28Å; K700-K703 WeakPolarHBondContact O-CB 3.5Å; K700-K703 PolarHBondContact O-N 3.21Å; K700-K703 VanDerWaalsContact O-N 3.14Å; K700-E704 VanDerWaalsContact CE-OE1 3.26Å; K700-E704 WeakPolarHBondContact CE-OE1 3.23Å; K700-E704 IonicContact NZ-OE1 3.65Å; K700-E704 PolarHBondContact NZ-OE1 3.08Å; K700-E704 WeakPolarHBondContact O-CG 3.29Å; K700-E704 PolarHBondContact O-N 2.77Å
701	R	84.7	Confident	86.2	Confident	103 Å²	103	93.5 Å²	93.5	39%	0.389	43%	0.432	S	S	.	.	H	α-helix	trans	-60.9	-39.1	178.8	-171.8	-170	-68.5	167.7	-10.9	112.4	E583 L697 E698 K703 E704 E705	E583-R701 IonicContact OE1-CZ 3.39Å; E583-R701 IonicContact OE1-NH1 2.94Å; E583-R701 PolarHBondContact OE1-NH1 2.76Å; E583-R701 IonicContact OE1-NH2 2.61Å; L697-R701 WeakPolarHBondContact O-CB 3.31Å; L697-R701 PolarHBondContact O-N 3.08Å; E698-R701 PolarHBondContact O-N 3.14Å; R701-K703 VanDerWaalsContact C-N 3.32Å; R701-K703 PolarHBondContact O-N 2.95Å; R701-E704 PolarHBondContact O-N 3.2Å; R701-E705 WeakPolarHBondContact O-CB 3.4Å; R701-E705 PolarHBondContact O-N 2.86Å
702	A	86	Confident	86	Confident	57 Å²	57	97.8 Å²	97.8	47%	0.471	45%	0.451	S	S	.	.	H	α-helix	trans	-63.6	-37.5	176.8	0	0	0	0	0	112.1	E698 I699 K700 E705 E706	E698-A702 WeakPolarHBondContact O-CB 3.37Å; E698-A702 PolarHBondContact O-N 2.92Å; I699-A702 PolarHBondContact O-N 2.8Å; K700-A702 VanDerWaalsContact C-N 3.32Å; K700-A702 PolarHBondContact O-N 3.28Å; A702-E705 PolarHBondContact O-N 3.43Å; A702-E706 WeakPolarHBondContact O-CB 3.28Å; A702-E706 PolarHBondContact O-N 3.16Å
703	K	88	Confident	85.8	Confident	136 Å²	136	98.7 Å²	98.7	59%	0.591	47%	0.467	S	S	*	.	H	α-helix	trans	-67.9	-44.4	173	-70.8	173.2	179.8	-179.7	0	112	I699 K700 R701 E705 E706 E707	I699-K703 HydrophobicContact CG2-CD 4.45Å; I699-K703 WeakPolarHBondContact O-CG 3.33Å; I699-K703 PolarHBondContact O-N 2.81Å; I699-K703 VanDerWaalsContact O-N 3.14Å; K700-K703 WeakPolarHBondContact O-CB 3.5Å; K700-K703 PolarHBondContact O-N 3.21Å; K700-K703 VanDerWaalsContact O-N 3.14Å; R701-K703 VanDerWaalsContact C-N 3.32Å; R701-K703 PolarHBondContact O-N 2.95Å; K703-E705 VanDerWaalsContact C-N 3.25Å; K703-E705 PolarHBondContact O-N 2.97Å; K703-E706 PolarHBondContact O-N 3.32Å; K703-E707 VanDerWaalsContact O-CB 3.25Å; K703-E707 WeakPolarHBondContact O-CB 3.45Å; K703-E707 PolarHBondContact O-N 2.8Å
704	E	85.2	Confident	85.8	Confident	82 Å²	82	101.3 Å²	101.3	38%	0.383	48%	0.477	S	S	.	.	H	α-helix	trans	-60.1	-34.2	175.3	-68	166.1	173	0	0	112	K700 R701 R708	K700-E704 VanDerWaalsContact CE-OE1 3.26Å; K700-E704 WeakPolarHBondContact CE-OE1 3.23Å; K700-E704 IonicContact NZ-OE1 3.65Å; K700-E704 PolarHBondContact NZ-OE1 3.08Å; K700-E704 WeakPolarHBondContact O-CG 3.29Å; K700-E704 PolarHBondContact O-N 2.77Å; R701-E704 PolarHBondContact O-N 3.2Å; E704-R708 WeakPolarHBondContact O-CG 3.37Å; E704-R708 PolarHBondContact O-N 2.87Å; E704-R708 VanDerWaalsContact O-N 3.16Å
705	E	81.8	Confident	85.8	Confident	109 Å²	109	102.7 Å²	102.7	51%	0.509	49%	0.485	S	S	.	.	H	α-helix	trans	-77.2	-39.1	175.4	-172.8	159.6	-143.5	0	0	112.7	R701 A702 K703 R708 I709	R701-E705 WeakPolarHBondContact O-CB 3.4Å; R701-E705 PolarHBondContact O-N 2.86Å; A702-E705 PolarHBondContact O-N 3.43Å; K703-E705 VanDerWaalsContact C-N 3.25Å; K703-E705 PolarHBondContact O-N 2.97Å; E705-R708 PolarHBondContact O-N 3.47Å; E705-I709 HydrophobicContact CG-CD1 4.17Å; E705-I709 WeakPolarHBondContact O-CD1 3.44Å; E705-I709 VanDerWaalsContact O-CG1 3.27Å; E705-I709 WeakPolarHBondContact O-CG1 3.41Å; E705-I709 PolarHBondContact O-N 2.69Å
706	E	82.7	Confident	85.7	Confident	107 Å²	107	106.3 Å²	106.3	50%	0.5	50%	0.503	S	S	.	.	H	α-helix	trans	-63.7	-41.4	172.6	-163	-159	131.4	0	0	111.8	A702 K703 I709 R710	A702-E706 WeakPolarHBondContact O-CB 3.28Å; A702-E706 PolarHBondContact O-N 3.16Å; K703-E706 PolarHBondContact O-N 3.32Å; E706-I709 PolarHBondContact O-N 2.8Å; E706-R710 WeakPolarHBondContact O-CB 3.42Å; E706-R710 PolarHBondContact O-N 3.44Å; E706-R710 IonicContact OE1-CZ 3.76Å; E706-R710 IonicContact OE1-NH2 3.48Å; E706-R710 PolarHBondContact OE1-NH2 3.01Å
707	E	86.3	Confident	85.6	Confident	122 Å²	122	107.6 Å²	107.6	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-60.9	-49	176.4	-173.7	162.3	-136.4	0	0	110.8	K703 I709 R710 E711	K703-E707 VanDerWaalsContact O-CB 3.25Å; K703-E707 WeakPolarHBondContact O-CB 3.45Å; K703-E707 PolarHBondContact O-N 2.8Å; E707-I709 VanDerWaalsContact C-N 3.34Å; E707-I709 PolarHBondContact O-N 3.38Å; E707-R710 WeakPolarHBondContact O-CA 3.37Å; E707-R710 WeakPolarHBondContact O-CB 3.4Å; E707-R710 PolarHBondContact O-N 3.1Å; E707-R710 VanDerWaalsContact O-N 3.08Å; E707-E711 WeakPolarHBondContact O-CG 3.47Å; E707-E711 PolarHBondContact O-N 3.48Å
708	R	85.2	Confident	85.4	Confident	136 Å²	136	108 Å²	108	51%	0.513	51%	0.507	S	S	.	.	H	α-helix	trans	-59.3	-38.8	173.2	-81	-174.6	58.9	-96.4	-17.3	114	E704 E705 R710 E712	E704-R708 WeakPolarHBondContact O-CG 3.37Å; E704-R708 PolarHBondContact O-N 2.87Å; E704-R708 VanDerWaalsContact O-N 3.16Å; E705-R708 PolarHBondContact O-N 3.47Å; R708-R710 VanDerWaalsContact C-N 3.29Å; R708-E712 WeakPolarHBondContact O-CB 3.44Å; R708-E712 PolarHBondContact O-N 3.15Å
709	I	86.5	Confident	85.3	Confident	102 Å²	102	108.6 Å²	108.6	52%	0.523	51%	0.512	S	S	.	.	H	α-helix	trans	-67.7	-34.2	176.8	-71	165.6	0	0	0	110.5	E705 E706 E707 A713	E705-I709 HydrophobicContact CG-CD1 4.17Å; E705-I709 WeakPolarHBondContact O-CD1 3.44Å; E705-I709 VanDerWaalsContact O-CG1 3.27Å; E705-I709 WeakPolarHBondContact O-CG1 3.41Å; E705-I709 PolarHBondContact O-N 2.69Å; E706-I709 PolarHBondContact O-N 2.8Å; E707-I709 VanDerWaalsContact C-N 3.34Å; E707-I709 PolarHBondContact O-N 3.38Å; I709-A713 WeakPolarHBondContact O-CB 3.31Å; I709-A713 PolarHBondContact O-N 3.43Å
710	R	86.3	Confident	85.2	Confident	158 Å²	158	112.2 Å²	112.2	60%	0.596	52%	0.522	S	S	*	.	H	α-helix	trans	-68.8	-45.3	175.1	-163.6	-176.5	-62.2	-177.7	0.4	111.7	E706 E707 R708 A713 E714	E706-R710 WeakPolarHBondContact O-CB 3.42Å; E706-R710 PolarHBondContact O-N 3.44Å; E706-R710 IonicContact OE1-CZ 3.76Å; E706-R710 IonicContact OE1-NH2 3.48Å; E706-R710 PolarHBondContact OE1-NH2 3.01Å; E707-R710 WeakPolarHBondContact O-CA 3.37Å; E707-R710 WeakPolarHBondContact O-CB 3.4Å; E707-R710 PolarHBondContact O-N 3.1Å; E707-R710 VanDerWaalsContact O-N 3.08Å; R708-R710 VanDerWaalsContact C-N 3.29Å; R710-A713 PolarHBondContact O-N 3.11Å; R710-E714 PolarHBondContact O-N 3.03Å
711	E	83.9	Confident	85	Confident	112 Å²	112	110.9 Å²	110.9	52%	0.523	52%	0.52	S	S	.	.	H	α-helix	trans	-58.4	-45.7	172.4	-69.7	-177.5	144.7	0	0	111.8	E707 A713 E714 I715	E707-E711 WeakPolarHBondContact O-CG 3.47Å; E707-E711 PolarHBondContact O-N 3.48Å; E711-A713 VanDerWaalsContact C-N 3.31Å; E711-A713 PolarHBondContact O-N 3.37Å; E711-E714 PolarHBondContact O-N 3.07Å; E711-I715 WeakPolarHBondContact O-CB 3.45Å; E711-I715 VanDerWaalsContact O-CG1 3.28Å; E711-I715 WeakPolarHBondContact O-CG1 3.22Å; E711-I715 PolarHBondContact O-N 3.31Å
712	E	80.9	Confident	84.9	Confident	124 Å²	124	113.4 Å²	113.4	58%	0.579	53%	0.53	S	S	*	.	H	α-helix	trans	-63.7	-36.8	178.1	-167.8	-177.9	143.1	0	0	111.8	R708 K716	R708-E712 WeakPolarHBondContact O-CB 3.44Å; R708-E712 PolarHBondContact O-N 3.15Å; E712-K716 WeakPolarHBondContact O-CB 3.2Å; E712-K716 PolarHBondContact O-N 3.48Å; E712-K716 VanDerWaalsContact O-N 3.11Å
713	A	86.2	Confident	84.8	Confident	57 Å²	57	113.4 Å²	113.4	47%	0.471	53%	0.53	S	S	.	.	H	α-helix	trans	-67.6	-42.3	174.5	0	0	0	0	0	112.5	I709 R710 E711 K716 E717	I709-A713 WeakPolarHBondContact O-CB 3.31Å; I709-A713 PolarHBondContact O-N 3.43Å; R710-A713 PolarHBondContact O-N 3.11Å; E711-A713 VanDerWaalsContact C-N 3.31Å; E711-A713 PolarHBondContact O-N 3.37Å; A713-K716 WeakPolarHBondContact O-CB 2.93Å; A713-K716 PolarHBondContact O-N 2.96Å; A713-E717 PolarHBondContact O-N 2.67Å
714	E	87.6	Confident	84.6	Confident	140 Å²	140	109.7 Å²	109.7	65%	0.654	51%	0.514	S	S	*	.	H	α-helix	trans	-65.5	-46.5	178.3	-173.6	169.8	-174.3	0	0	111.7	R710 E711 K716 E717 E718	R710-E714 PolarHBondContact O-N 3.03Å; E711-E714 PolarHBondContact O-N 3.07Å; E714-K716 PolarHBondContact O-N 2.83Å; E714-E717 PolarHBondContact O-N 3.33Å; E714-E717 VanDerWaalsContact O-N 3.11Å; E714-E718 PolarHBondContact O-N 3.23Å
715	I	84.6	Confident	84.6	Confident	100 Å²	100	108.5 Å²	108.5	51%	0.513	52%	0.518	S	S	.	.	H	α-helix	trans	-58.5	-38.9	174.1	-69.1	165.8	0	0	0	111.1	E711 E718 L719	E711-I715 WeakPolarHBondContact O-CB 3.45Å; E711-I715 VanDerWaalsContact O-CG1 3.28Å; E711-I715 WeakPolarHBondContact O-CG1 3.22Å; E711-I715 PolarHBondContact O-N 3.31Å; I715-E718 PolarHBondContact O-N 2.97Å; I715-L719 HydrophobicContact CG2-CD1 4.16Å; I715-L719 WeakPolarHBondContact O-CB 3.41Å; I715-L719 WeakPolarHBondContact O-CG 3.48Å; I715-L719 PolarHBondContact O-N 3.14Å
716	K	84.9	Confident	84.6	Confident	153 Å²	153	109.9 Å²	109.9	67%	0.665	52%	0.523	S	S	*	.	H	α-helix	trans	-70.3	-32.9	177.8	-175	176	-177.4	175.2	0	112.7	E712 A713 E714 R720	E712-K716 WeakPolarHBondContact O-CB 3.2Å; E712-K716 PolarHBondContact O-N 3.48Å; E712-K716 VanDerWaalsContact O-N 3.11Å; A713-K716 WeakPolarHBondContact O-CB 2.93Å; A713-K716 PolarHBondContact O-N 2.96Å; E714-K716 PolarHBondContact O-N 2.83Å; K716-R720 PolarHBondContact O-N 3.41Å; K716-R720 VanDerWaalsContact O-N 3.16Å
717	E	86.5	Confident	84.5	Confident	103 Å²	103	111.5 Å²	111.5	48%	0.481	53%	0.53	S	S	.	.	H	α-helix	trans	-72.9	-41.8	172.1	-178.6	139.5	-133.3	0	0	111.8	A713 E714 L719 R720 L721	A713-E717 PolarHBondContact O-N 2.67Å; E714-E717 PolarHBondContact O-N 3.33Å; E714-E717 VanDerWaalsContact O-N 3.11Å; E717-L719 VanDerWaalsContact C-N 3.33Å; E717-L719 PolarHBondContact O-N 2.61Å; E717-R720 WeakPolarHBondContact O-CB 3.29Å; E717-R720 PolarHBondContact O-N 3.4Å; E717-R720 IonicContact OE1-NH1 2.73Å; E717-R720 PolarHBondContact OE1-NH1 3.3Å; E717-R720 VanDerWaalsContact OE1-NH1 3.13Å; E717-L721 HydrophobicContact CG-CD1 4.14Å; E717-L721 HydrophobicContact CG-CG 4.41Å; E717-L721 WeakPolarHBondContact O-CG 3.26Å; E717-L721 PolarHBondContact O-N 2.65Å
718	E	83.8	Confident	84.3	Confident	111 Å²	111	111.6 Å²	111.6	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-57.7	-46.4	173.5	-162.8	-148.5	139.5	0	0	111	E714 I715 R720 L721 R722	E714-E718 PolarHBondContact O-N 3.23Å; I715-E718 PolarHBondContact O-N 2.97Å; E718-R720 VanDerWaalsContact C-N 3.29Å; E718-R720 PolarHBondContact O-N 3.39Å; E718-L721 PolarHBondContact O-N 2.98Å; E718-R722 VanDerWaalsContact O-CB 3.28Å; E718-R722 WeakPolarHBondContact O-CB 3.01Å; E718-R722 PolarHBondContact O-N 2.93Å; E718-R722 IonicContact OE1-NH1 2.65Å
719	L	82.4	Confident	84.1	Confident	97 Å²	97	111.1 Å²	111.1	51%	0.508	53%	0.533	S	S	.	.	H	α-helix	trans	-58.5	-38.3	174.3	-83	165	0	0	0	112.5	I715 E717 A723	I715-L719 HydrophobicContact CG2-CD1 4.16Å; I715-L719 WeakPolarHBondContact O-CB 3.41Å; I715-L719 WeakPolarHBondContact O-CG 3.48Å; I715-L719 PolarHBondContact O-N 3.14Å; E717-L719 VanDerWaalsContact C-N 3.33Å; E717-L719 PolarHBondContact O-N 2.61Å; L719-A723 PolarHBondContact O-N 2.84Å
720	R	86.8	Confident	83.8	Confident	127 Å²	127	113.1 Å²	113.1	48%	0.479	54%	0.537	S	S	.	.	H	α-helix	trans	-68	-48.2	176.9	-154.9	-165.6	88.6	-129.8	-2.5	111.4	K716 E717 E718 R722 A723 E724	K716-R720 PolarHBondContact O-N 3.41Å; K716-R720 VanDerWaalsContact O-N 3.16Å; E717-R720 WeakPolarHBondContact O-CB 3.29Å; E717-R720 PolarHBondContact O-N 3.4Å; E717-R720 IonicContact OE1-NH1 2.73Å; E717-R720 PolarHBondContact OE1-NH1 3.3Å; E717-R720 VanDerWaalsContact OE1-NH1 3.13Å; E718-R720 VanDerWaalsContact C-N 3.29Å; E718-R720 PolarHBondContact O-N 3.39Å; R720-R722 VanDerWaalsContact C-N 3.28Å; R720-R722 PolarHBondContact O-N 3.27Å; R720-A723 WeakPolarHBondContact O-CB 3.36Å; R720-A723 PolarHBondContact O-N 3.36Å; R720-A723 VanDerWaalsContact O-N 3.11Å; R720-E724 IonicContact CZ-OE1 3Å; R720-E724 VanDerWaalsContact CZ-OE1 3.26Å; R720-E724 IonicContact NE-OE1 3Å; R720-E724 PolarHBondContact NE-OE1 3.46Å; R720-E724 IonicContact NH2-OE1 3.19Å; R720-E724 PolarHBondContact NH2-OE1 2.96Å; R720-E724 PolarHBondContact O-N 3.45Å
721	L	85.5	Confident	83.5	Confident	92 Å²	92	112 Å²	112	48%	0.482	54%	0.539	S	S	.	.	H	α-helix	trans	-60.7	-38.3	177.2	-69.6	171.1	0	0	0	111.6	E717 E718 A723 E724 A725	E717-L721 HydrophobicContact CG-CD1 4.14Å; E717-L721 HydrophobicContact CG-CG 4.41Å; E717-L721 WeakPolarHBondContact O-CG 3.26Å; E717-L721 PolarHBondContact O-N 2.65Å; E718-L721 PolarHBondContact O-N 2.98Å; L721-A723 VanDerWaalsContact C-N 3.35Å; L721-E724 PolarHBondContact O-N 3.46Å; L721-A725 WeakPolarHBondContact O-CB 3.48Å; L721-A725 PolarHBondContact O-N 3.48Å
722	R	81.9	Confident	83.4	Confident	157 Å²	157	115.8 Å²	115.8	59%	0.592	55%	0.549	S	S	*	.	H	α-helix	trans	-71.4	-26.7	176.4	-162.1	168.3	-174	170.4	-2.2	113.2	E718 R720 K726	E718-R722 VanDerWaalsContact O-CB 3.28Å; E718-R722 WeakPolarHBondContact O-CB 3.01Å; E718-R722 PolarHBondContact O-N 2.93Å; E718-R722 IonicContact OE1-NH1 2.65Å; R720-R722 VanDerWaalsContact C-N 3.28Å; R720-R722 PolarHBondContact O-N 3.27Å; R722-K726 WeakPolarHBondContact O-CG 3.17Å; R722-K726 PolarHBondContact O-N 3.44Å
723	A	82.8	Confident	83.4	Confident	57 Å²	57	114.9 Å²	114.9	47%	0.471	55%	0.547	S	S	.	.	H	α-helix	trans	-73.2	-48.5	169.1	0	0	0	0	0	111.6	L719 R720 L721 A725 K726 E727	L719-A723 PolarHBondContact O-N 2.84Å; R720-A723 WeakPolarHBondContact O-CB 3.36Å; R720-A723 PolarHBondContact O-N 3.36Å; R720-A723 VanDerWaalsContact O-N 3.11Å; L721-A723 VanDerWaalsContact C-N 3.35Å; A723-A725 VanDerWaalsContact C-N 3.25Å; A723-A725 PolarHBondContact O-N 3.33Å; A723-K726 PolarHBondContact O-N 3.33Å; A723-K726 VanDerWaalsContact O-N 3.14Å; A723-E727 PolarHBondContact O-N 2.93Å
724	E	84.8	Confident	83.1	Confident	57 Å²	57	117.7 Å²	117.7	27%	0.266	55%	0.551	S	S	.	*	H	α-helix	trans	-58.2	-36.4	175.7	-70.7	-179	-144.5	0	0	112.4	R720 L721 E727 K728	R720-E724 IonicContact CZ-OE1 3Å; R720-E724 VanDerWaalsContact CZ-OE1 3.26Å; R720-E724 IonicContact NE-OE1 3Å; R720-E724 PolarHBondContact NE-OE1 3.46Å; R720-E724 IonicContact NH2-OE1 3.19Å; R720-E724 PolarHBondContact NH2-OE1 2.96Å; R720-E724 PolarHBondContact O-N 3.45Å; L721-E724 PolarHBondContact O-N 3.46Å; E724-E727 PolarHBondContact O-N 3.21Å; E724-K728 WeakPolarHBondContact O-CD 3.13Å; E724-K728 WeakPolarHBondContact O-CG 3.36Å; E724-K728 PolarHBondContact O-N 3.02Å; E724-K728 IonicContact OE2-NZ 2.71Å
725	A	85.5	Confident	82.7	Confident	57 Å²	57	118 Å²	118	47%	0.471	55%	0.55	S	S	.	.	H	α-helix	trans	-64.9	-44.7	175.4	0	0	0	0	0	112.4	L721 A723 E727 K728 E729	L721-A725 WeakPolarHBondContact O-CB 3.48Å; L721-A725 PolarHBondContact O-N 3.48Å; A723-A725 VanDerWaalsContact C-N 3.25Å; A723-A725 PolarHBondContact O-N 3.33Å; A725-E727 VanDerWaalsContact C-N 3.32Å; A725-E727 PolarHBondContact O-N 2.88Å; A725-K728 PolarHBondContact O-N 3.46Å; A725-E729 WeakPolarHBondContact O-CB 3.47Å; A725-E729 PolarHBondContact O-N 2.87Å
726	K	82.4	Confident	82.4	Confident	138 Å²	138	117.2 Å²	117.2	60%	0.6	54%	0.544	S	S	*	.	H	α-helix	trans	-65.1	-34.4	175.6	-75.9	179	175.6	-176.7	0	112.5	R722 A723 K730	R722-K726 WeakPolarHBondContact O-CG 3.17Å; R722-K726 PolarHBondContact O-N 3.44Å; A723-K726 PolarHBondContact O-N 3.33Å; A723-K726 VanDerWaalsContact O-N 3.14Å; K726-K730 WeakPolarHBondContact O-CB 3.4Å; K726-K730 PolarHBondContact O-N 3.42Å
727	E	80.3	Confident	82.2	Confident	141 Å²	141	119.4 Å²	119.4	66%	0.659	55%	0.548	S	S	*	.	H	α-helix	trans	-66.8	-46.5	175.2	-173.2	163.2	-140.5	0	0	111.5	A723 E724 A725 E729 K730 E731	A723-E727 PolarHBondContact O-N 2.93Å; E724-E727 PolarHBondContact O-N 3.21Å; A725-E727 VanDerWaalsContact C-N 3.32Å; A725-E727 PolarHBondContact O-N 2.88Å; E727-E729 VanDerWaalsContact C-N 3.33Å; E727-E729 PolarHBondContact O-N 2.88Å; E727-K730 WeakPolarHBondContact O-CB 3.44Å; E727-K730 PolarHBondContact O-N 3.33Å; E727-E731 PolarHBondContact O-N 3.45Å
728	K	82.1	Confident	81.7	Confident	125 Å²	125	119.7 Å²	119.7	54%	0.543	55%	0.552	S	S	.	*	H	α-helix	trans	-62.8	-35.6	174.5	-71.7	162.3	-175.9	154.3	0	112.7	E724 A725 R732	E724-K728 WeakPolarHBondContact O-CD 3.13Å; E724-K728 WeakPolarHBondContact O-CG 3.36Å; E724-K728 PolarHBondContact O-N 3.02Å; E724-K728 IonicContact OE2-NZ 2.71Å; A725-K728 PolarHBondContact O-N 3.46Å; K728-R732 WeakPolarHBondContact O-CB 3.17Å; K728-R732 PolarHBondContact O-N 2.81Å
729	E	81.2	Confident	81.4	Confident	126 Å²	126	120.6 Å²	120.6	59%	0.589	56%	0.556	S	S	*	*	H	α-helix	trans	-65.9	-44.6	173.3	-177.8	173	-143.3	0	0	111.9	A725 E727 R732 L733	A725-E729 WeakPolarHBondContact O-CB 3.47Å; A725-E729 PolarHBondContact O-N 2.87Å; E727-E729 VanDerWaalsContact C-N 3.33Å; E727-E729 PolarHBondContact O-N 2.88Å; E729-R732 PolarHBondContact O-N 3.24Å; E729-L733 HydrophobicContact CG-CD1 4.46Å; E729-L733 PolarHBondContact O-N 3.03Å
730	K	79.6	Confident	81	Confident	143 Å²	143	122.3 Å²	122.3	62%	0.622	56%	0.56	S	S	*	*	H	α-helix	trans	-62	-45.5	175.1	-176.9	-169.2	170.2	-161.9	0	111.8	K726 E727 R732 L733 E734	K726-K730 WeakPolarHBondContact O-CB 3.4Å; K726-K730 PolarHBondContact O-N 3.42Å; E727-K730 WeakPolarHBondContact O-CB 3.44Å; E727-K730 PolarHBondContact O-N 3.33Å; K730-R732 VanDerWaalsContact C-N 3.32Å; K730-R732 PolarHBondContact O-N 2.91Å; K730-L733 PolarHBondContact O-N 3.48Å; K730-E734 WeakPolarHBondContact O-CB 3.35Å; K730-E734 PolarHBondContact O-N 3.46Å
731	E	79.3	Confident	80.4	Confident	136 Å²	136	123.9 Å²	123.9	64%	0.636	57%	0.57	S	S	*	*	H	α-helix	trans	-60.5	-41.8	176.2	-171.5	-172.8	-170.3	0	0	111.1	E727 E734 K735	E727-E731 PolarHBondContact O-N 3.45Å; E731-E734 PolarHBondContact O-N 2.78Å; E731-K735 WeakPolarHBondContact O-CB 3.31Å; E731-K735 PolarHBondContact O-N 3.49Å
732	R	82.8	Confident	79.6	Confident	191 Å²	191	122.3 Å²	122.3	72%	0.721	57%	0.571	S	S	*	*	H	α-helix	trans	-62.9	-43.3	175.6	-173.7	179.7	178.1	-162.6	-1.5	112.2	K728 E729 K730 K735 E736	K728-R732 WeakPolarHBondContact O-CB 3.17Å; K728-R732 PolarHBondContact O-N 2.81Å; E729-R732 PolarHBondContact O-N 3.24Å; K730-R732 VanDerWaalsContact C-N 3.32Å; K730-R732 PolarHBondContact O-N 2.91Å; R732-K735 PolarHBondContact O-N 3.44Å; R732-E736 WeakPolarHBondContact O-CB 3.37Å; R732-E736 PolarHBondContact O-N 2.8Å
733	L	79.7	Confident	78.7	Confident	104 Å²	104	117.6 Å²	117.6	55%	0.545	57%	0.565	S	S	.	*	H	α-helix	trans	-65.3	-38	174.9	-86.9	165.4	0	0	0	112.6	E729 K730 R737	E729-L733 HydrophobicContact CG-CD1 4.46Å; E729-L733 PolarHBondContact O-N 3.03Å; K730-L733 PolarHBondContact O-N 3.48Å; L733-R737 VanDerWaalsContact O-CB 3.3Å; L733-R737 WeakPolarHBondContact O-CB 3.4Å; L733-R737 PolarHBondContact O-N 3.33Å
734	E	79.7	Confident	77.8	Confident	117 Å²	117	118.2 Å²	118.2	55%	0.547	57%	0.57	S	S	.	*	H	α-helix	trans	-68.4	-40.7	175.4	-177	155.8	-162.1	0	0	111.6	K730 E731 R737 L738	K730-E734 WeakPolarHBondContact O-CB 3.35Å; K730-E734 PolarHBondContact O-N 3.46Å; E731-E734 PolarHBondContact O-N 2.78Å; E734-R737 PolarHBondContact O-N 3.27Å; E734-L738 HydrophobicContact CG-CD1 4.33Å; E734-L738 WeakPolarHBondContact O-CB 3.38Å; E734-L738 PolarHBondContact O-N 3.42Å
735	K	80.6	Confident	76.6	Confident	147 Å²	147	118.7 Å²	118.7	64%	0.639	58%	0.584	S	S	*	*	H	α-helix	trans	-61.6	-45.8	172.3	-174.2	175	179.9	177.4	0	111.9	E731 R732 R737 L738 E739	E731-K735 WeakPolarHBondContact O-CB 3.31Å; E731-K735 PolarHBondContact O-N 3.49Å; R732-K735 PolarHBondContact O-N 3.44Å; K735-R737 VanDerWaalsContact C-N 3.3Å; K735-R737 PolarHBondContact O-N 2.9Å; K735-L738 PolarHBondContact O-N 2.79Å; K735-E739 WeakPolarHBondContact O-CB 3.49Å; K735-E739 PolarHBondContact O-N 2.88Å
736	E	78.5	Confident	75.2	Confident	82 Å²	82	119.2 Å²	119.2	38%	0.383	59%	0.588	S	S	.	*	H	α-helix	trans	-64.3	-35.3	176.2	-163.7	-166.4	127.2	0	0	111.8	R732 E739 K740	R732-E736 WeakPolarHBondContact O-CB 3.37Å; R732-E736 PolarHBondContact O-N 2.8Å; E736-E739 PolarHBondContact O-N 3.32Å; E736-K740 HydrophobicContact CG-CD 4.44Å; E736-K740 WeakPolarHBondContact O-CB 3.41Å; E736-K740 WeakPolarHBondContact O-CG 3.5Å; E736-K740 PolarHBondContact O-N 2.92Å; E736-K740 VanDerWaalsContact OE1-CE 3.31Å; E736-K740 WeakPolarHBondContact OE1-CE 3.49Å; E736-K740 IonicContact OE1-NZ 3.89Å; E736-K740 PolarHBondContact OE1-NZ 3.42Å
737	R	79.4	Confident	73.9	Confident	200 Å²	200	117 Å²	117	76%	0.755	60%	0.595	S	S	*	*	H	α-helix	trans	-68.8	-38.9	174.3	-173.9	174.5	-177.7	156.7	1.3	112.2	L733 E734 K735 K741	L733-R737 VanDerWaalsContact O-CB 3.3Å; L733-R737 WeakPolarHBondContact O-CB 3.4Å; L733-R737 PolarHBondContact O-N 3.33Å; E734-R737 PolarHBondContact O-N 3.27Å; K735-R737 VanDerWaalsContact C-N 3.3Å; K735-R737 PolarHBondContact O-N 2.9Å; R737-K741 VanDerWaalsContact O-CB 3.31Å; R737-K741 WeakPolarHBondContact O-CB 3.35Å; R737-K741 PolarHBondContact O-N 3.27Å
738	L	76.3	Confident	72.4	Confident	109 Å²	109	114.2 Å²	114.2	57%	0.571	60%	0.596	S	S	*	*	H	α-helix	trans	-65.2	-42.6	171.9	-83.3	163.2	0	0	0	111.3	E734 K735 K741 A742	E734-L738 HydrophobicContact CG-CD1 4.33Å; E734-L738 WeakPolarHBondContact O-CB 3.38Å; E734-L738 PolarHBondContact O-N 3.42Å; K735-L738 PolarHBondContact O-N 2.79Å; L738-K741 CarbonylContact O-C 3.56Å; L738-K741 PolarHBondContact O-N 2.82Å; L738-A742 WeakPolarHBondContact O-CB 3.39Å; L738-A742 PolarHBondContact O-N 3.02Å
739	E	77	Confident	70.6	Confident	129 Å²	129	114.7 Å²	114.7	60%	0.603	61%	0.605	S	S	*	*	H	α-helix	trans	-65.9	-43.8	177.6	-172.4	164.5	-162.8	0	0	111.7	K735 E736 K741 A742 A743	K735-E739 WeakPolarHBondContact O-CB 3.49Å; K735-E739 PolarHBondContact O-N 2.88Å; E736-E739 PolarHBondContact O-N 3.32Å; E739-K741 VanDerWaalsContact C-N 3.31Å; E739-K741 PolarHBondContact O-N 3.25Å; E739-A742 PolarHBondContact O-N 3.46Å; E739-A743 VanDerWaalsContact O-CB 3.31Å; E739-A743 WeakPolarHBondContact O-CB 3.24Å; E739-A743 PolarHBondContact O-N 3.13Å
740	K	75.6	Confident	68.7	Low	134 Å²	134	114.5 Å²	114.5	58%	0.583	62%	0.615	S	S	*	*	H	α-helix	trans	-61.1	-36.6	170.8	-79.5	170.8	170.5	168.3	0	112.6	E736 A744	E736-K740 HydrophobicContact CG-CD 4.44Å; E736-K740 WeakPolarHBondContact O-CB 3.41Å; E736-K740 WeakPolarHBondContact O-CG 3.5Å; E736-K740 PolarHBondContact O-N 2.92Å; E736-K740 VanDerWaalsContact OE1-CE 3.31Å; E736-K740 WeakPolarHBondContact OE1-CE 3.49Å; E736-K740 IonicContact OE1-NZ 3.89Å; E736-K740 PolarHBondContact OE1-NZ 3.42Å; K740-A744 WeakPolarHBondContact O-CB 3.22Å; K740-A744 PolarHBondContact O-N 3.47Å
741	K	72.9	Confident	66.8	Low	159 Å²	159	115 Å²	115	69%	0.691	62%	0.624	S	S	*	*	H	α-helix	trans	-72.6	-35.6	176.1	-164.1	178.2	-176.8	-173.9	0	112.3	R737 L738 E739 A745	R737-K741 VanDerWaalsContact O-CB 3.31Å; R737-K741 WeakPolarHBondContact O-CB 3.35Å; R737-K741 PolarHBondContact O-N 3.27Å; L738-K741 CarbonylContact O-C 3.56Å; L738-K741 PolarHBondContact O-N 2.82Å; E739-K741 VanDerWaalsContact C-N 3.31Å; E739-K741 PolarHBondContact O-N 3.25Å; K741-A745 PolarHBondContact O-N 2.85Å; K741-A745 VanDerWaalsContact O-N 3.08Å
742	A	68.9	Low	64.9	Low	60 Å²	60	113.7 Å²	113.7	50%	0.496	63%	0.627	S	S	.	*	H	α-helix	trans	-70.1	-40.7	173.3	0	0	0	0	0	111.7	L738 E739 A745 A746	L738-A742 WeakPolarHBondContact O-CB 3.39Å; L738-A742 PolarHBondContact O-N 3.02Å; E739-A742 PolarHBondContact O-N 3.46Å; A742-A745 PolarHBondContact O-N 3.38Å; A742-A746 WeakPolarHBondContact O-CB 3.28Å; A742-A746 PolarHBondContact O-N 2.83Å
743	A	64.3	Low	62.9	Low	58 Å²	58	111.4 Å²	111.4	48%	0.479	64%	0.635	S	S	.	*	H	α-helix	trans	-63.2	-41.8	173.6	0	0	0	0	0	111.7	E739 A745 A746 A747	E739-A743 VanDerWaalsContact O-CB 3.31Å; E739-A743 WeakPolarHBondContact O-CB 3.24Å; E739-A743 PolarHBondContact O-N 3.13Å; A743-A745 VanDerWaalsContact C-N 3.32Å; A743-A745 PolarHBondContact O-N 2.87Å; A743-A746 PolarHBondContact O-N 2.81Å; A743-A747 VanDerWaalsContact O-CB 3.28Å; A743-A747 WeakPolarHBondContact O-CB 3.33Å; A743-A747 PolarHBondContact O-N 3.28Å
744	A	62.9	Low	61	Low	69 Å²	69	111.3 Å²	111.3	57%	0.57	64%	0.641	S	S	*	*	H	α-helix	trans	-63.1	-35	172.9	0	0	0	0	0	112.9	K740	K740-A744 WeakPolarHBondContact O-CB 3.22Å; K740-A744 PolarHBondContact O-N 3.47Å
745	A	59	Low	59	Low	68 Å²	68	113.2 Å²	113.2	56%	0.562	65%	0.653	S	S	*	*	H	α-helix	trans	-74.3	-36.3	173.8	0	0	0	0	0	112.9	K741 A742 A743 A748	K741-A745 PolarHBondContact O-N 2.85Å; K741-A745 VanDerWaalsContact O-N 3.08Å; A742-A745 PolarHBondContact O-N 3.38Å; A743-A745 VanDerWaalsContact C-N 3.32Å; A743-A745 PolarHBondContact O-N 2.87Å; A745-A748 WeakPolarHBondContact O-CB 3.47Å; A745-A748 PolarHBondContact O-N 2.84Å
746	A	57.1	Low	57.2	Low	68 Å²	68	111.5 Å²	111.5	56%	0.562	66%	0.657	S	S	*	*	H	α-helix	trans	-71.8	-35.3	177.3	0	0	0	0	0	112.4	A742 A743 A748 N749	A742-A746 WeakPolarHBondContact O-CB 3.28Å; A742-A746 PolarHBondContact O-N 2.83Å; A743-A746 PolarHBondContact O-N 2.81Å; A746-A748 PolarHBondContact O-N 2.81Å; A746-A748 VanDerWaalsContact O-N 3.11Å; A746-N749 PolarHBondContact O-N 3.16Å; A746-N749 VanDerWaalsContact O-N 3.15Å
747	A	55	Low	55.7	Low	90 Å²	90	112.9 Å²	112.9	74%	0.744	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-13.3	174.7	0	0	0	0	0	113.7	A743 N749	A743-A747 VanDerWaalsContact O-CB 3.28Å; A743-A747 WeakPolarHBondContact O-CB 3.33Å; A743-A747 PolarHBondContact O-N 3.28Å; A747-N749 VanDerWaalsContact C-N 3.35Å
748	A	49.2	Very low	53.7	Low	83 Å²	83	110.1 Å²	110.1	69%	0.686	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	2.6	175.8	0	0	0	0	0	114.3	A745 A746	A745-A748 WeakPolarHBondContact O-CB 3.47Å; A745-A748 PolarHBondContact O-N 2.84Å; A746-A748 PolarHBondContact O-N 2.81Å; A746-A748 VanDerWaalsContact O-N 3.11Å
749	N	43.8	Very low	51.9	Low	136 Å²	136	110.9 Å²	110.9	73%	0.727	69%	0.69	S	S	*	*	S	Bend	trans	-134.5	100.7	-175.5	-158	7.1	0	0	0	112.6	A746 A747 N751	A746-N749 PolarHBondContact O-N 3.16Å; A746-N749 VanDerWaalsContact O-N 3.15Å; A747-N749 VanDerWaalsContact C-N 3.35Å; N749-N751 PolarHBondContact O-N 3.32Å
750	P	40.3	Very low	49.9	Very low	121 Å²	121	109.6 Å²	109.6	79%	0.786	70%	0.701	S	S	*	*			trans	-89.4	99.9	-169.8	33.6	-33.8	0	0	0	113.1
751	N	39.6	Very low	48.1	Very low	154 Å²	154	109.6 Å²	109.6	82%	0.824	71%	0.713	S	S	*	*			trans	-153	113	155.4	-150	3.9	0	0	0	112.8	N749	N749-N751 PolarHBondContact O-N 3.32Å
752	P	40.1	Very low	46.5	Very low	108 Å²	108	106.4 Å²	106.4	70%	0.701	71%	0.708	S	S	*	*			trans	-101.3	140.1	-177.9	36.2	-31.4	0	0	0	113.6
753	T	41.7	Very low	44.9	Very low	143 Å²	143	111.9 Å²	111.9	88%	0.877	72%	0.723	S	S	*	*			trans	-167	149.6	144.1	5.8	0	0	0	0	111.7
754	P	39.1	Very low	43.6	Very low	103 Å²	103	113.9 Å²	113.9	67%	0.669	73%	0.734	S	S	*	*			trans	-134.7	168.9	-163.9	43.2	-26.7	0	0	0	117.1
755	I	37.1	Very low	42.2	Very low	156 Å²	156	116.2 Å²	116.2	80%	0.8	75%	0.746	S	S	*	*			trans	70	141.4	143.1	-78.7	163.4	0	0	0	118.5
756	P	43.8	Very low	41.1	Very low	112 Å²	112	116.7 Å²	116.7	73%	0.727	75%	0.749	S	S	*	*			cis	-138.3	-134.2	-24.5	48.3	-27.1	0	0	0	111.4
757	P	47.2	Very low	40	Very low	111 Å²	111	121.5 Å²	121.5	72%	0.721	76%	0.76	S	S	*	*			trans	-118.8	168.5	-151.3	44.4	-28.1	0	0	0	117.6
758	T	35.9	Very low	39	Very low	142 Å²	142	124.4 Å²	124.4	87%	0.871	76%	0.759	S	S	*	*			trans	-167.1	157.8	144.9	7.4	0	0	0	0	110.6
759	P	40.1	Very low	38.3	Very low	125 Å²	125	128.7 Å²	128.7	81%	0.812	77%	0.765	S	S	*	*			trans	-102.6	143.5	-167.4	37	-32.1	0	0	0	115.1
760	A	35.1	Very low	37.9	Very low	102 Å²	102	127.8 Å²	127.8	84%	0.843	77%	0.766	S	S	*	*			trans	-153.9	133.8	157.2	0	0	0	0	0	111.7
761	T	37	Very low	37.6	Very low	134 Å²	134	129.1 Å²	129.1	82%	0.822	77%	0.765	S	S	*	*			trans	-74.1	170.3	164.6	48.4	0	0	0	0	110.7
762	P	38.4	Very low	37.4	Very low	91 Å²	91	127.3 Å²	127.3	59%	0.591	76%	0.762	S	S	*	*			cis	-149.4	-170.1	23.8	47.4	-27.9	0	0	0	117.3
763	H	35.7	Very low	37.6	Very low	176 Å²	176	128 Å²	128	82%	0.815	77%	0.766	S	S	*	*			trans	49.1	135.9	150	-54.7	-36.5	0	0	0	119.6
764	S	36.7	Very low	37.3	Very low	100 Å²	100	126.8 Å²	126.8	70%	0.699	76%	0.761	S	S	*	*			cis	-164.8	166.5	25.4	-105	0	0	0	0	112
765	S	34.8	Very low	36.9	Very low	117 Å²	117	129.6 Å²	129.6	82%	0.818	77%	0.769	S	S	*	*			trans	62	141.2	154.9	47.2	0	0	0	0	120.2
766	A	35.3	Very low	36.7	Very low	78 Å²	78	127.6 Å²	127.6	65%	0.645	77%	0.769	S	S	*	*			cis	-166	160.7	-12.1	0	0	0	0	0	111.3
767	Q	33.9	Very low	36.1	Very low	169 Å²	169	127.8 Å²	127.8	79%	0.79	77%	0.768	S	S	*	*			trans	67.7	144.7	161.6	-64.4	165.8	-10.7	0	0	117
768	Q	33.7	Very low	35.4	Very low	151 Å²	151	130.3 Å²	130.3	71%	0.706	77%	0.771	S	S	*	*			cis	-162	148	-9.2	-121.1	167.9	8.2	0	0	112.2
769	Q	34.8	Very low	35	Very low	174 Å²	174	128.8 Å²	128.8	81%	0.813	76%	0.761	S	S	*	*			trans	67.1	161.5	157.4	-62.8	-153.4	-5.7	0	0	117.8
770	P	36.6	Very low	34.6	Very low	116 Å²	116	128.5 Å²	128.5	75%	0.753	76%	0.762	S	S	*	*				-129	166.5	-87.4	24.9	-1	0	0	0	115.4
771	I	33.4	Very low	34.4	Very low	149 Å²	149	127.7 Å²	127.7	76%	0.764	76%	0.756	S	S	*	*			trans	-109.1	140.3	-171.8	-65.8	162.5	0	0	0	111
772	P	35.4	Very low	33.9	Very low	117 Å²	117	129.8 Å²	129.8	76%	0.76	76%	0.756	S	S	*	*			trans	-77.4	121.3	162	31.3	-31.4	0	0	0	110.5
773	P	43.9	Very low	33.6	Very low	121 Å²	121	132.3 Å²	132.3	79%	0.786	76%	0.763	S	S	*	*			trans	-84.3	133.7	-172.2	31.5	-34.1	0	0	0	113.5
774	P	34.6	Very low	33.4	Very low	119 Å²	119	131.3 Å²	131.3	77%	0.773	76%	0.759	S	S	*	*			trans	-89.6	177.8	171.5	36.9	-35.5	0	0	0	113
775	L	30.4	Very low	32.9	Very low	162 Å²	162	134.7 Å²	134.7	85%	0.848	76%	0.763	S	S	*	*			trans	-62.6	138.5	176	-78.1	66	0	0	0	112.8
776	S	33.6	Very low	32.5	Very low	114 Å²	114	133.9 Å²	133.9	80%	0.797	76%	0.758	S	S	*	*				175	151.8	116	-77.6	0	0	0	0	114.2
777	T	30.9	Very low	32.2	Very low	116 Å²	116	134.6 Å²	134.6	71%	0.712	76%	0.763	S	S	*	*			trans	-14.8	150.1	162.7	62.4	0	0	0	0	118.3
778	Q	32.7	Very low	32	Very low	164 Å²	164	135.4 Å²	135.4	77%	0.766	77%	0.767	S	S	*	*				-172.3	148	59.8	-145.6	169.1	104.6	0	0	114.9
779	T	28.3	Very low	31.9	Very low	109 Å²	109	137 Å²	137	67%	0.669	78%	0.775	S	S	*	*			trans	48.2	125.1	150	46.5	0	0	0	0	124.6
780	S	30.4	Very low	31.7	Very low	120 Å²	120	133.9 Å²	133.9	84%	0.839	77%	0.77	S	S	*	*			trans	72.3	149.8	135	-54	0	0	0	0	119.5
781	A	31.6	Very low	31.2	Very low	85 Å²	85	133.1 Å²	133.1	70%	0.702	77%	0.767	S	S	*	*			cis	-139.3	179.3	6.3	0	0	0	0	0	112.8
782	E	27.2	Very low	31.2	Very low	178 Å²	178	132.6 Å²	132.6	83%	0.832	77%	0.77	S	S	*	*			trans	4.7	138.7	159.3	-63.6	167.9	86.5	0	0	119.3
783	I	31.3	Very low	30.9	Very low	144 Å²	144	132.3 Å²	132.3	74%	0.738	77%	0.769	S	S	*	*				-163.2	139.9	88.4	-99	167.7	0	0	0	112.9
784	Q	31.5	Very low	30.1	Very low	155 Å²	155	132.5 Å²	132.5	72%	0.724	77%	0.768	S	S	*	*			trans	50.4	119.3	152.7	-71.2	163.9	-4.9	0	0	120.2
785	Q	27.3	Very low	29.8	Very low	170 Å²	170	132.4 Å²	132.4	79%	0.794	77%	0.765	S	S	*	*				61.2	95.8	83.9	-69.8	178.5	-3.7	0	0	112.7
786	S	25.5	Very low	29.7	Very low	101 Å²	101	132.9 Å²	132.9	71%	0.706	77%	0.765	S	S	*	*				85.3	89.6	74.4	71.8	0	0	0	0	114.8
787	A	29.2	Very low	29.4	Very low	92 Å²	92	134.7 Å²	134.7	76%	0.76	76%	0.764	S	S	*	*			trans	-131.9	117.5	154.6	0	0	0	0	0	106.4
788	Q	28.8	Very low	29.2	Very low	187 Å²	187	133.4 Å²	133.4	87%	0.874	77%	0.765	S	S	*	*				77.7	124.7	64.8	-68.9	179.4	-2.5	0	0	113.6
789	Q	33.5	Very low	29	Very low	183 Å²	183	132.1 Å²	132.1	86%	0.855	76%	0.764	S	S	*	*			trans	-49.9	158.4	158	-67.4	171.3	-20.1	0	0	110.1
790	P	30.4	Very low	29.2	Very low	110 Å²	110	134 Å²	134	71%	0.714	77%	0.768	S	S	*	*			cis	-155.6	-171.1	47	38	-13	0	0	0	118.1
791	S	25.2	Very low	29.5	Very low	100 Å²	100	133.5 Å²	133.5	70%	0.699	76%	0.762	S	S	*	*			trans	53.1	125.7	143	62.8	0	0	0	0	121.6
792	V	34.3	Very low	29.2	Very low	137 Å²	137	133.7 Å²	133.7	83%	0.83	76%	0.764	S	S	*	*			trans	-50.9	147.5	151.5	-60.8	0	0	0	0	111.3
793	P	28.6	Very low	29.5	Very low	112 Å²	112	134 Å²	134	73%	0.727	77%	0.767	S	S	*	*				-145.2	164.8	88.5	39.9	-25.2	0	0	0	116.8
794	V	27.9	Very low	29.9	Very low	125 Å²	125	131.8 Å²	131.8	76%	0.758	77%	0.765	S	S	*	*			trans	-18.9	135.5	140.8	-154	0	0	0	0	112.1
795	T	26.6	Very low	30.3	Very low	117 Å²	117	130 Å²	130	72%	0.718	77%	0.766	S	S	*	*				-172.1	160.1	83.7	-63.1	0	0	0	0	113.7
796	M	28.5	Very low	30.4	Very low	172 Å²	172	128 Å²	128	85%	0.847	77%	0.766	S	S	*	*			trans	-53.8	-167.7	177.1	-50.2	174.3	177.1	0	0	117
797	I	27.3	Very low	30.6	Very low	151 Å²	151	128.4 Å²	128.4	77%	0.774	77%	0.769	S	S	*	*			trans	93.2	93.8	170.2	-51.5	164.4	0	0	0	111.2
798	A	27.6	Very low	30.6	Very low	90 Å²	90	128.1 Å²	128.1	74%	0.744	77%	0.767	S	S	*	*			cis	88.6	172.1	39.6	0	0	0	0	0	114.8
799	N	27.4	Very low	30.7	Very low	136 Å²	136	127.6 Å²	127.6	73%	0.727	76%	0.764	S	S	*	*			trans	81.3	104.6	159.1	-89.5	10.6	0	0	0	121.9
800	I	33.9	Very low	30.6	Very low	150 Å²	150	124.7 Å²	124.7	77%	0.769	76%	0.761	S	S	*	*			trans	55.1	173.1	135.1	34.6	171.4	0	0	0	119.9
801	P	35	Very low	30.8	Very low	109 Å²	109	127.3 Å²	127.3	71%	0.708	76%	0.764	S	S	*	*			cis	-124.6	176.8	-17.5	19.2	5	0	0	0	115.2
802	A	27.3	Very low	31.2	Very low	89 Å²	89	127.4 Å²	127.4	74%	0.736	76%	0.762	S	S	*	*			trans	4.9	147.7	147.2	0	0	0	0	0	119.8
803	M	33.2	Very low	30.9	Very low	183 Å²	183	126.7 Å²	126.7	90%	0.901	76%	0.758	S	S	*	*				-160.4	146.2	69.3	-82.6	174.5	69.9	0	0	114.9
804	S	39.1	Very low	30.8	Very low	99 Å²	99	128.4 Å²	128.4	69%	0.692	76%	0.76	S	S	*	*			trans	-71.2	153.8	163.7	57.9	0	0	0	0	111.5
805	P	40	Very low	31	Very low	116 Å²	116	127 Å²	127	75%	0.753	76%	0.756	S	S	*	*				-148.6	144.7	77.2	35.9	-16	0	0	0	118.2
806	T	29.8	Very low	31.6	Very low	129 Å²	129	126.9 Å²	126.9	79%	0.791	76%	0.757	S	S	*	*				37.1	129.6	119	-39.8	0	0	0	0	120.3
807	S	28.7	Very low	31.5	Very low	110 Å²	110	125 Å²	125	77%	0.769	76%	0.755	S	S	*	*				171.8	158.4	101.2	-155	0	0	0	0	116.2
808	A	28.5	Very low	31.7	Very low	86 Å²	86	123 Å²	123	71%	0.711	76%	0.755	S	S	*	*			trans	64.7	95.1	144.8	0	0	0	0	0	121.7
809	Q	30.9	Very low	31.7	Very low	176 Å²	176	123.6 Å²	123.6	82%	0.822	76%	0.76	S	S	*	*				-25.3	159.2	119.4	-93.2	-178.3	-30.3	0	0	115.7
810	P	32.2	Very low	31.7	Very low	121 Å²	121	121 Å²	121	79%	0.786	76%	0.757	S	S	*	*			cis	-145.6	178.7	43.2	41	-20.3	0	0	0	118.6
811	Q	34.3	Very low	31.9	Very low	165 Å²	165	120.4 Å²	120.4	77%	0.771	76%	0.76	S	S	*	*			trans	-70.4	-165.4	154.5	-56.4	-171.3	-21.2	0	0	109.3
812	P	34.3	Very low	32	Very low	103 Å²	103	120.9 Å²	120.9	67%	0.669	76%	0.763	S	S	*	*			cis	-143.7	-155.2	3.8	38.5	-14.1	0	0	0	115.7
813	V	26.9	Very low	32.1	Very low	122 Å²	122	122.5 Å²	122.5	74%	0.739	76%	0.763	S	S	*	*			trans	82.3	123.5	151.5	-74.4	0	0	0	0	123.1
814	L	28.2	Very low	32.2	Very low	148 Å²	148	119.1 Å²	119.1	78%	0.775	76%	0.755	S	S	*	*			trans	80	83	138.4	-65.2	165.5	0	0	0	120.4
815	S	30.1	Very low	31.7	Very low	95 Å²	95	120.2 Å²	120.2	66%	0.664	76%	0.758	S	S	*	*				2.6	161.5	112	63.6	0	0	0	0	120
816	P	39.4	Very low	31.1	Very low	114 Å²	114	120.7 Å²	120.7	74%	0.74	76%	0.759	S	S	*	*			cis	-133.4	-166.1	-35.1	38.6	-21.6	0	0	0	110.6
817	T	28	Very low	30.9	Very low	132 Å²	132	122.6 Å²	122.6	81%	0.81	76%	0.761	S	S	*	*			trans	150.3	137.3	133.1	-64	0	0	0	0	112.4
818	S	30.5	Very low	30.9	Very low	110 Å²	110	124.6 Å²	124.6	77%	0.769	76%	0.761	S	S	*	*			trans	-57.9	133.8	174.6	161.1	0	0	0	0	114.5
819	A	27.9	Very low	30.9	Very low	103 Å²	103	126.9 Å²	126.9	85%	0.851	76%	0.757	S	S	*	*			trans	-148	125.1	150	0	0	0	0	0	111.5
820	A	27.7	Very low	30.8	Very low	80 Å²	80	120.9 Å²	120.9	66%	0.661	73%	0.732	S	S	*	*			trans	-82.9	164	-169	0	0	0	0	0	115.5
821	V	37	Very low	30.6	Very low	139 Å²	139	118.3 Å²	118.3	84%	0.842	72%	0.715	S	S	*	*			trans	60.3	163.4	158.6	-81.1	0	0	0	0	118.2
822	P	37	Very low	30.2	Very low	118 Å²	118	118.1 Å²	118.1	77%	0.766	71%	0.712	S	S	*	*			cis	-119.4	158.1	5	39.9	-26.7	0	0	0	116.7
823	V	30.1	Very low	30.2	Very low	123 Å²	123	117.8 Å²	117.8	75%	0.745	71%	0.71	S	S	*	*			trans	-86.4	125.6	164.3	-161.5	0	0	0	0	108.5	T825	V823-T825 PolarHBondContact O-N 2.76Å; V823-T825 VanDerWaalsContact O-N 3.11Å
824	P	35	Very low	30.3	Very low	112 Å²	112	116.8 Å²	116.8	73%	0.727	71%	0.708	S	S	*	*			trans	-70.9	106	169.3	28.4	-31.8	0	0	0	109.3	T826	P824-T826 PolarHBondContact O-N 2.94Å
825	T	28.3	Very low	30.5	Very low	122 Å²	122	118.9 Å²	118.9	75%	0.748	71%	0.714	S	S	*	*			trans	-73.2	122.5	167.5	-65.1	0	0	0	0	109	V823	V823-T825 PolarHBondContact O-N 2.76Å; V823-T825 VanDerWaalsContact O-N 3.11Å
826	T	28.7	Very low	30.8	Very low	127 Å²	127	121.1 Å²	121.1	78%	0.779	72%	0.717	S	S	*	*			trans	-134.4	119.3	165.4	-46.5	0	0	0	0	108.8	P824	P824-T826 PolarHBondContact O-N 2.94Å
827	M	25.7	Very low	30.3	Very low	168 Å²	168	121.9 Å²	121.9	83%	0.828	72%	0.722	S	S	*	*			trans	-75.1	132.9	178.3	-63.9	-176.7	177.5	0	0	110.5
828	I	29.2	Very low	30.4	Very low	152 Å²	152	121 Å²	121	78%	0.779	72%	0.716	S	S	*	*			trans	-96	90.9	156.4	-61.7	-176.3	0	0	0	107.2	V830	I828-V830 PolarHBondContact O-N 3.41Å
829	H	26.9	Very low	30.3	Very low	134 Å²	134	123.6 Å²	123.6	62%	0.62	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-66.3	121	167.2	169.6	70.9	0	0	0	109.1
830	V	29	Very low	30.3	Very low	51 Å²	51	125.5 Å²	125.5	31%	0.309	71%	0.712	S	S	.	*	P	Polyproline II helix	trans	-76.6	126	172.3	156	0	0	0	0	109.4	I828 K832 S1400	I828-V830 PolarHBondContact O-N 3.41Å; V830-K832 PolarHBondContact O-N 2.82Å; V830-S1400 VanDerWaalsContact CG1-O 3.28Å; V830-S1400 WeakPolarHBondContact CG1-O 3.41Å; V830-S1400 WeakPolarHBondContact CG2-O 3.35Å
831	P	28.3	Very low	30.4	Very low	66 Å²	66	127.8 Å²	127.8	43%	0.429	72%	0.718	S	S	.	*	P	Polyproline II helix	trans	-79.8	128.2	-155.6	-17.1	33.1	0	0	0	113.9	S1402	P831-S1402 WeakPolarHBondContact O-CB 3.09Å; P831-S1402 PolarHBondContact O-OG 2.81Å
832	K	27.2	Very low	30	Very low	162 Å²	162	125 Å²	125	70%	0.704	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-75.2	134.5	144.8	-176.1	-174.1	176.4	-168.2	0	107.3	V830 S834	V830-K832 PolarHBondContact O-N 2.82Å; K832-S834 PolarHBondContact O-N 2.91Å; K832-S834 VanDerWaalsContact O-N 3.11Å; K832-S834 PolarHBondContact O-OG 3.12Å
833	P	33	Very low	29.7	Very low	96 Å²	96	124.4 Å²	124.4	62%	0.623	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-57.7	120.8	171.5	-20.9	32.3	0	0	0	109.3
834	S	30.2	Very low	29.7	Very low	100 Å²	100	123 Å²	123	70%	0.699	70%	0.695	S	S	*	*			trans	-117	106.4	-178	-61.9	0	0	0	0	108.2	K832 I836	K832-S834 PolarHBondContact O-N 2.91Å; K832-S834 VanDerWaalsContact O-N 3.11Å; K832-S834 PolarHBondContact O-OG 3.12Å; S834-I836 PolarHBondContact O-N 2.85Å
835	E	31.7	Very low	29.6	Very low	192 Å²	192	120.1 Å²	120.1	90%	0.897	68%	0.681	S	S	*	*			trans	-72.1	109.6	170.4	-74.7	177.1	123.2	0	0	109.8
836	I	35.9	Very low	29.9	Very low	142 Å²	142	117 Å²	117	73%	0.728	67%	0.667	S	S	*	*			trans	13.3	104.4	145.4	-41.3	177.5	0	0	0	115.5	S834 V838	S834-I836 PolarHBondContact O-N 2.85Å; I836-V838 HydrophobicContact CG2-CG2 3.64Å
837	P	28.5	Very low	30.5	Very low	130 Å²	130	115.5 Å²	115.5	84%	0.844	66%	0.66	S	S	*	*			trans	-82.4	120.9	164.7	31.8	-30.5	0	0	0	110.7
838	V	31.8	Very low	31	Very low	113 Å²	113	114 Å²	114	69%	0.685	66%	0.659	S	S	*	*			trans	-124.3	103	170.2	-165.3	0	0	0	0	110.4	I836	I836-V838 HydrophobicContact CG2-CG2 3.64Å
839	Q	28.1	Very low	31.2	Very low	166 Å²	166	111 Å²	111	78%	0.776	66%	0.658	S	S	*	*			trans	34.5	129.2	148.2	-72.2	172.4	-35.5	0	0	122
840	N	27.9	Very low	31.7	Very low	142 Å²	142	108.7 Å²	108.7	76%	0.759	66%	0.662	S	S	*	*			trans	104.5	113.6	137.2	-67.5	-2.5	0	0	0	122.5
841	V	29.1	Very low	32	Very low	129 Å²	129	113.1 Å²	113.1	78%	0.782	68%	0.684	S	S	*	*			trans	83.4	84.3	132.4	-175.4	0	0	0	0	120.9
842	A	29.1	Very low	32.4	Very low	79 Å²	79	116.7 Å²	116.7	65%	0.653	70%	0.699	S	S	*	*				67.1	145.6	112.3	0	0	0	0	0	125.9
843	T	30.2	Very low	33	Very low	107 Å²	107	115.1 Å²	115.1	66%	0.656	70%	0.703	S	S	*	*			trans	67.7	142.2	143.7	40.2	0	0	0	0	121.1	T1352	T843-T1352 WeakPolarHBondContact O-CG2 3.12Å
844	T	30.6	Very low	33.3	Very low	93 Å²	93	116.2 Å²	116.2	57%	0.571	71%	0.71	S	S	*	*			cis	-168.3	150.1	-17	7.3	0	0	0	0	112.6	V1353	T844-V1353 WeakPolarHBondContact O-CA 3.34Å; T844-V1353 VanDerWaalsContact O-CG1 3.31Å; T844-V1353 WeakPolarHBondContact O-CG1 3.09Å
845	A	32.2	Very low	34.3	Very low	51 Å²	51	116.8 Å²	116.8	42%	0.421	71%	0.712	S	S	.	*			trans	60.4	-174.6	153.6	0	0	0	0	0	119.6	V1353 V1354 E1355	A845-V1353 CarbonylContact O-C 3.18Å; A845-V1353 WeakPolarHBondContact O-CA 3.4Å; A845-V1353 PolarHBondContact O-N 2.85Å; A845-V1354 PolarHBondContact O-N 2.88Å; A845-E1355 HydrophobicContact CB-CG 4.37Å
846	A	33.9	Very low	34.7	Very low	57 Å²	57	113.5 Å²	113.5	47%	0.471	71%	0.71	S	S	.	*				-157.9	-129.2	-60.7	0	0	0	0	0	112.7	V1354	A846-V1354 CarbonylContact C-O 3.49Å; A846-V1354 PolarHBondContact N-O 3.04Å; A846-V1354 VanDerWaalsContact O-O 3.07Å
847	P	42.8	Very low	34.9	Very low	95 Å²	95	112.7 Å²	112.7	62%	0.617	71%	0.714	S	S	*	*			trans	-139.1	-172.1	-159.1	38.2	-12.5	0	0	0	119.7	E1355	P847-E1355 WeakPolarHBondContact CD-O 3.18Å
848	V	34.9	Very low	35.5	Very low	136 Å²	136	110.9 Å²	110.9	82%	0.824	71%	0.71	S	S	*	*			trans	135.1	118.6	140.1	175.5	0	0	0	0	116.1
849	A	35	Very low	35.9	Very low	91 Å²	91	110.2 Å²	110.2	75%	0.752	71%	0.708	S	S	*	*				166.4	123.3	126.6	0	0	0	0	0	117.3
850	A	35.8	Very low	36.1	Very low	85 Å²	85	110.2 Å²	110.2	70%	0.702	71%	0.706	S	S	*	*			trans	66.1	111	134.2	0	0	0	0	0	125.7
851	N	36	Very low	36.4	Very low	143 Å²	143	112 Å²	112	77%	0.765	71%	0.706	S	S	*	*				90	116.7	115.9	-66.7	1.5	0	0	0	125.3
852	N	36	Very low	36.5	Very low	141 Å²	141	111.5 Å²	111.5	75%	0.754	70%	0.704	S	S	*	*				109.3	124.6	114.7	-83.2	-2.5	0	0	0	125
853	V	40.7	Very low	36.5	Very low	130 Å²	130	116.5 Å²	116.5	79%	0.788	71%	0.714	S	S	*	*			trans	94.9	138.3	133.2	164.5	0	0	0	0	120.9
854	P	38.5	Very low	36.3	Very low	118 Å²	118	118.3 Å²	118.3	77%	0.766	72%	0.72	S	S	*	*			trans	-129.4	-115	-145.9	27.9	0.9	0	0	0	118.6
855	P	51.7	Low	36.2	Very low	113 Å²	113	119.6 Å²	119.6	73%	0.734	72%	0.722	S	S	*	*				-131.9	-177.9	-118.4	43.3	-25	0	0	0	118
856	S	39.3	Very low	36.1	Very low	122 Å²	122	125.1 Å²	125.1	85%	0.853	74%	0.739	S	S	*	*			trans	-158.1	160.6	157.7	-89.6	0	0	0	0	115.5
857	P	41.2	Very low	35.6	Very low	125 Å²	125	128.4 Å²	128.4	81%	0.812	75%	0.753	S	S	*	*			trans	-135.8	-172	-161.8	43.3	-24.9	0	0	0	116.5
858	A	40.2	Very low	35.2	Very low	93 Å²	93	129 Å²	129	77%	0.769	76%	0.757	S	S	*	*			trans	134.5	150.5	140.9	0	0	0	0	0	116.6
859	P	39.9	Very low	34.9	Very low	98 Å²	98	129.4 Å²	129.4	64%	0.636	76%	0.76	S	S	*	*			trans	-144.5	-176.6	-146.9	36.1	-12.1	0	0	0	118.7
860	F	33.2	Very low	34.6	Very low	167 Å²	167	133.5 Å²	133.5	73%	0.732	77%	0.768	S	S	*	*			trans	127.3	121	137	-70.8	-50.9	0	0	0	120
861	K	33.3	Very low	34.4	Very low	178 Å²	178	133.7 Å²	133.7	77%	0.774	77%	0.77	S	S	*	*				71.3	141.1	128.1	-70.8	-176.1	-179.1	-178.6	0	121.8
862	T	31.9	Very low	34.1	Very low	119 Å²	119	135.9 Å²	135.9	73%	0.73	78%	0.775	S	S	*	*			cis	-162.7	167.5	-24.7	-26.9	0	0	0	0	109.7
863	E	28.3	Very low	33.7	Very low	185 Å²	185	136.3 Å²	136.3	86%	0.864	78%	0.778	S	S	*	*			trans	75.2	80.8	162.9	-60.1	-157.3	155.4	0	0	117.4
864	D	26.3	Very low	33.2	Very low	145 Å²	145	136.1 Å²	136.1	78%	0.775	78%	0.777	S	S	*	*			trans	-154	166	155.1	-146.7	-16.3	0	0	0	111.4
865	I	29.3	Very low	32.8	Very low	120 Å²	120	137 Å²	137	62%	0.615	78%	0.78	S	S	*	*			trans	75.5	122	143.3	-87	162.3	0	0	0	123
866	Q	29.5	Very low	31.8	Very low	167 Å²	167	136.7 Å²	136.7	78%	0.78	78%	0.778	S	S	*	*			trans	72.6	155.3	136.6	-68.3	174.3	5.5	0	0	125.8
867	T	23.8	Very low	31.2	Very low	125 Å²	125	141.6 Å²	141.6	77%	0.767	78%	0.778	S	S	*	*			trans	-120.3	-175.1	171.5	54.3	0	0	0	0	107.2
868	P	35	Very low	30.4	Very low	109 Å²	109	142 Å²	142	71%	0.708	78%	0.778	S	S	*	*			cis	-136	138.2	-49.5	32.8	-15.2	0	0	0	113.8
869	T	27.6	Very low	29.8	Very low	144 Å²	144	145.5 Å²	145.5	88%	0.883	78%	0.782	S	S	*	*			trans	-150.7	113.4	165	1.4	0	0	0	0	118.1
870	L	30.2	Very low	29.2	Very low	176 Å²	176	145 Å²	145	92%	0.921	78%	0.781	S	S	*	*			trans	24.7	100.5	131	-155	78.9	0	0	0	121.6
871	A	30	Very low	29	Very low	89 Å²	89	143.5 Å²	143.5	74%	0.736	79%	0.786	S	S	*	*			trans	-163.8	150.3	148.7	0	0	0	0	0	109.6
872	Q	30.4	Very low	28.8	Very low	189 Å²	189	142.6 Å²	142.6	88%	0.883	79%	0.789	S	S	*	*			cis	-155.2	-177.7	-15.2	-116.9	-179.6	17.9	0	0	109
873	N	26.9	Very low	28.7	Very low	151 Å²	151	141.2 Å²	141.2	81%	0.807	79%	0.79	S	S	*	*			trans	-52.6	150	177.6	-59.6	-37.8	0	0	0	114.3
874	T	30.3	Very low	28.8	Very low	126 Å²	126	138.3 Å²	138.3	77%	0.773	79%	0.79	S	S	*	*				173.2	139.2	108.6	-72.1	0	0	0	0	111.6
875	V	30.9	Very low	28.9	Very low	136 Å²	136	134.9 Å²	134.9	82%	0.824	79%	0.789	S	S	*	*			trans	-100.9	135.9	168.4	-161	0	0	0	0	108.4
876	P	30	Very low	28.8	Very low	106 Å²	106	137 Å²	137	69%	0.688	80%	0.801	S	S	*	*				-147.2	139.3	125	33.9	-16.6	0	0	0	116.4
877	R	27.2	Very low	28.6	Very low	226 Å²	226	135 Å²	135	85%	0.853	80%	0.8	S	S	*	*			trans	31.5	129.7	131.9	-62	179.5	174.9	162.9	-1.5	121.3
878	T	24.3	Very low	28.7	Very low	134 Å²	134	135.8 Å²	135.8	82%	0.822	80%	0.798	S	S	*	*			trans	-32.9	134.1	140.7	-36.1	0	0	0	0	114.5
879	I	28.3	Very low	28.4	Very low	165 Å²	165	137 Å²	137	85%	0.846	80%	0.798	S	S	*	*			trans	-133.4	140.1	156.3	-65.8	-176.6	0	0	0	107.6
880	S	27.3	Very low	28.6	Very low	89 Å²	89	135.8 Å²	135.8	62%	0.622	79%	0.791	S	S	*	*			trans	-96.6	161.4	177.7	-60	0	0	0	0	111.5
881	T	28.1	Very low	28.9	Very low	135 Å²	135	133 Å²	133	83%	0.828	78%	0.783	S	S	*	*			trans	47.7	113.2	151	51.3	0	0	0	0	118.6
882	D	30.1	Very low	29	Very low	159 Å²	159	133.2 Å²	133.2	85%	0.85	79%	0.785	S	S	*	*				-151.7	164	96.6	-141.9	-32.2	0	0	0	111.6
883	A	29.1	Very low	29.1	Very low	90 Å²	90	129.3 Å²	129.3	74%	0.744	78%	0.778	S	S	*	*			trans	-155.2	76.5	-180	0	0	0	0	0	112.4
884	S	30.9	Very low	29.6	Very low	123 Å²	123	129.8 Å²	129.8	86%	0.86	78%	0.779	S	S	*	*			trans	-163.6	150.3	166.3	-84.6	0	0	0	0	112.1
885	G	28.1	Very low	30	Very low	73 Å²	73	127.8 Å²	127.8	75%	0.753	78%	0.776	S	S	*	*			trans	97	88.8	152.7	0	0	0	0	0	119.7
886	L	26.7	Very low	30.4	Very low	165 Å²	165	126.6 Å²	126.6	86%	0.864	77%	0.773	S	S	*	*				61.9	105.3	128.5	-124.1	67.6	0	0	0	122.7
887	V	25.4	Very low	30.9	Very low	125 Å²	125	127.7 Å²	127.7	76%	0.758	78%	0.78	S	S	*	*				27.2	133.9	129.4	-154.2	0	0	0	0	120.7
888	I	26.2	Very low	31.2	Very low	142 Å²	142	122 Å²	122	73%	0.728	78%	0.775	S	S	*	*				166.5	132.4	122.7	-87.2	171.5	0	0	0	115.2
889	N	27.3	Very low	31.9	Very low	135 Å²	135	121.2 Å²	121.2	72%	0.722	77%	0.772	S	S	*	*			trans	71.8	108.3	153.5	-73.8	0.7	0	0	0	126.7
890	T	32.6	Very low	32.2	Very low	117 Å²	117	117.1 Å²	117.1	72%	0.718	76%	0.763	S	S	*	*				49	156.7	106.7	44.7	0	0	0	0	122.6
891	P	36.2	Very low	32.9	Very low	119 Å²	119	118.2 Å²	118.2	77%	0.773	77%	0.768	S	S	*	*			cis	-138.3	157.7	26.3	42.1	-23.4	0	0	0	121.2
892	A	32	Very low	33	Very low	92 Å²	92	117.3 Å²	117.3	76%	0.76	77%	0.767	S	S	*	*			trans	14.5	161.8	135.4	0	0	0	0	0	122.3
893	S	33.3	Very low	33	Very low	107 Å²	107	114.1 Å²	114.1	75%	0.748	76%	0.763	S	S	*	*			cis	-163.2	-176	18.4	-157.1	0	0	0	0	114
894	I	37.4	Very low	33	Very low	162 Å²	162	115.9 Å²	115.9	83%	0.831	76%	0.764	S	S	*	*			trans	76.6	120.3	169.9	-54.2	164.1	0	0	0	113.5
895	A	39.3	Very low	33.1	Very low	84 Å²	84	116.7 Å²	116.7	69%	0.694	76%	0.759	S	S	*	*			cis	-173.4	-175.8	-4.3	0	0	0	0	0	108
896	S	38.4	Very low	33.2	Very low	110 Å²	110	119.1 Å²	119.1	77%	0.769	76%	0.759	S	S	*	*			cis	176.5	168.4	-40	-73.1	0	0	0	0	107.1
897	P	40.2	Very low	33.6	Very low	130 Å²	130	115.5 Å²	115.5	84%	0.844	75%	0.753	S	S	*	*			cis	-129	-173.8	-8.3	39.3	-20.4	0	0	0	115.6
898	S	33.4	Very low	33.8	Very low	107 Å²	107	114.8 Å²	114.8	75%	0.748	75%	0.754	S	S	*	*			trans	-82.3	-173.7	176.3	-133.2	0	0	0	0	113.4
899	P	40.2	Very low	33.9	Very low	116 Å²	116	113.8 Å²	113.8	75%	0.753	75%	0.754	S	S	*	*			cis	-129.4	177.2	33.8	36.1	-13.7	0	0	0	114.7
900	A	34.2	Very low	34	Very low	79 Å²	79	113.2 Å²	113.2	65%	0.653	76%	0.756	S	S	*	*			cis	74.4	153.9	31.8	0	0	0	0	0	115.8
901	P	41.7	Very low	33.9	Very low	113 Å²	113	111.8 Å²	111.8	73%	0.734	76%	0.756	S	S	*	*			cis	-138.9	-175.3	-43.2	40.7	-24.1	0	0	0	114.9
902	S	31.3	Very low	33.9	Very low	115 Å²	115	111.7 Å²	111.7	80%	0.804	76%	0.756	S	S	*	*			trans	81.6	145.4	148.9	-59.3	0	0	0	0	123.9
903	A	29.3	Very low	33.8	Very low	92 Å²	92	113.6 Å²	113.6	76%	0.76	76%	0.757	S	S	*	*			trans	80.8	131.9	149	0	0	0	0	0	122.4
904	T	30	Very low	33.8	Very low	127 Å²	127	114.5 Å²	114.5	78%	0.779	76%	0.759	S	S	*	*			trans	9.6	140.6	148.1	50.1	0	0	0	0	119.8
905	D	31.2	Very low	33.7	Very low	140 Å²	140	112.6 Å²	112.6	75%	0.749	76%	0.757	S	S	*	*				-163.4	173.8	59.5	-140.5	-18.1	0	0	0	117.2
906	V	31.2	Very low	33.5	Very low	124 Å²	124	112.5 Å²	112.5	75%	0.752	76%	0.756	S	S	*	*			trans	7.9	126.6	168.6	-72.8	0	0	0	0	122.2
907	A	34.3	Very low	33.4	Very low	90 Å²	90	112.4 Å²	112.4	74%	0.744	75%	0.752	S	S	*	*				168.5	103.2	96.5	0	0	0	0	0	116.1
908	S	30.7	Very low	32.9	Very low	109 Å²	109	112.5 Å²	112.5	76%	0.762	75%	0.751	S	S	*	*			trans	66.9	102.5	130.3	-53.6	0	0	0	0	124.7
909	T	27.4	Very low	33.2	Very low	121 Å²	121	112.2 Å²	112.2	74%	0.742	75%	0.746	S	S	*	*				84.3	113.1	110.7	-50.3	0	0	0	0	122.1
910	T	30.7	Very low	32.8	Very low	124 Å²	124	112.9 Å²	112.9	76%	0.761	75%	0.748	S	S	*	*			trans	58.2	115.2	151.2	60.9	0	0	0	0	123
911	A	30.6	Very low	32.5	Very low	87 Å²	87	115.1 Å²	115.1	72%	0.719	75%	0.754	S	S	*	*				18.2	164.7	101.5	0	0	0	0	0	120.8
912	P	36	Very low	32	Very low	117 Å²	117	115.3 Å²	115.3	76%	0.76	75%	0.754	S	S	*	*			cis	-133.7	-155.5	-7.5	22.5	5	0	0	0	113.3
913	V	29.9	Very low	32.1	Very low	132 Å²	132	115.4 Å²	115.4	80%	0.8	75%	0.749	S	S	*	*			trans	96.7	108.8	151.4	-175.5	0	0	0	0	119.4
914	T	32.7	Very low	32.2	Very low	126 Å²	126	118.3 Å²	118.3	77%	0.773	75%	0.752	S	S	*	*			trans	-63	161.4	154.6	35.8	0	0	0	0	113
915	P	35.3	Very low	32.3	Very low	122 Å²	122	115.7 Å²	115.7	79%	0.792	75%	0.751	S	S	*	*			cis	-146.8	-167.3	37.6	38.2	-14.7	0	0	0	116.6
916	A	34.3	Very low	32.4	Very low	81 Å²	81	112.6 Å²	112.6	67%	0.669	75%	0.752	S	S	*	*			trans	-64.5	176.8	160.7	0	0	0	0	0	111
917	P	36.7	Very low	32.4	Very low	108 Å²	108	111.9 Å²	111.9	70%	0.701	76%	0.758	S	S	*	*			cis	-153.6	-173.1	38.6	43.1	-20.1	0	0	0	119.4
918	T	30.6	Very low	32.3	Very low	133 Å²	133	112.7 Å²	112.7	82%	0.816	77%	0.765	S	S	*	*			trans	77.6	150.8	153.7	39.8	0	0	0	0	120.8
919	P	39.9	Very low	32.5	Very low	100 Å²	100	112.2 Å²	112.2	65%	0.649	77%	0.768	S	S	*	*			trans	-119.7	-177.2	-158.5	44.2	-32.9	0	0	0	114.2
920	T	30	Very low	32.7	Very low	130 Å²	130	111 Å²	111	80%	0.798	77%	0.77	S	S	*	*			trans	-172.5	141.5	132.1	15.3	0	0	0	0	116.2
921	T	29.5	Very low	32.6	Very low	127 Å²	127	110.1 Å²	110.1	78%	0.779	77%	0.769	S	S	*	*			trans	69.4	131.1	149.2	28.7	0	0	0	0	126.1
922	T	30.5	Very low	32.4	Very low	117 Å²	117	112.6 Å²	112.6	72%	0.718	78%	0.775	S	S	*	*			trans	98.5	97.2	145.8	-33.4	0	0	0	0	117.2
923	T	33.5	Very low	32.1	Very low	116 Å²	116	113.2 Å²	113.2	71%	0.712	78%	0.777	S	S	*	*				57.2	147.3	78.2	40.7	0	0	0	0	116.3
924	D	31.4	Very low	31.9	Very low	154 Å²	154	112.8 Å²	112.8	82%	0.824	78%	0.775	S	S	*	*			cis	-153.1	170.8	17.9	-137.2	-43	0	0	0	115.2
925	G	32.8	Very low	31.7	Very low	72 Å²	72	113.9 Å²	113.9	74%	0.742	77%	0.771	S	S	*	*			trans	99.2	120.6	157.2	0	0	0	0	0	117.8
926	G	32.3	Very low	31.3	Very low	75 Å²	75	116.2 Å²	116.2	77%	0.773	78%	0.777	S	S	*	*			cis	163.9	173.3	-12.4	0	0	0	0	0	115.9
927	A	32.4	Very low	31	Very low	108 Å²	108	122 Å²	122	89%	0.893	79%	0.787	S	S	*	*			trans	86.9	144.1	158.7	0	0	0	0	0	122.3
928	A	30.7	Very low	30.7	Very low	107 Å²	107	122.2 Å²	122.2	88%	0.884	78%	0.779	S	S	*	*			trans	70.7	84.9	159.4	0	0	0	0	0	119.6
929	A	36.2	Very low	30.6	Very low	99 Å²	99	125 Å²	125	82%	0.818	78%	0.783	S	S	*	*			trans	-111.5	145.3	160.2	0	0	0	0	0	111.6
930	A	30.4	Very low	30.4	Very low	95 Å²	95	129.6 Å²	129.6	79%	0.785	79%	0.792	S	S	*	*			trans	-155.4	124.4	158.2	0	0	0	0	0	107.2
931	S	28.4	Very low	30.8	Very low	106 Å²	106	133.1 Å²	133.1	74%	0.741	79%	0.791	S	S	*	*			cis	81.5	62.9	14.6	95.8	0	0	0	0	117.2
932	T	26.5	Very low	31	Very low	139 Å²	139	133.8 Å²	133.8	85%	0.853	78%	0.783	S	S	*	*			trans	-149.6	126.9	142.9	-23.6	0	0	0	0	112.2
933	T	30.4	Very low	31.3	Very low	130 Å²	130	130.3 Å²	130.3	80%	0.798	76%	0.764	S	S	*	*			trans	-85.4	142.3	169.4	28	0	0	0	0	110.9
934	T	24.5	Very low	31.7	Very low	124 Å²	124	130.6 Å²	130.6	76%	0.761	76%	0.761	S	S	*	*			trans	-168.8	151.4	139.2	6.3	0	0	0	0	114.2
935	E	28.6	Very low	32.5	Very low	148 Å²	148	131.6 Å²	131.6	69%	0.692	76%	0.758	S	S	*	*			trans	61	73.3	161.7	-61	-165.9	-140.5	0	0	120	R311 K937	R311-E935 IonicContact NH2-OE1 2.7Å; E935-K937 PolarHBondContact O-N 3.26Å
936	N	27.7	Very low	34	Very low	172 Å²	172	132.7 Å²	132.7	92%	0.92	74%	0.74	S	S	*	*			trans	-60.7	117.8	165.1	-66.4	-21.3	0	0	0	112.8
937	K	28.5	Very low	36.1	Very low	202 Å²	202	132.7 Å²	132.7	88%	0.878	72%	0.719	S	S	*	*			trans	-154.5	23.1	175.2	-139.2	170.6	-171.8	169.6	0	116.9	E935	E935-K937 PolarHBondContact O-N 3.26Å
938	E	28.9	Very low	38.8	Very low	113 Å²	113	127.6 Å²	127.6	53%	0.528	68%	0.676	S	S	.	*			trans	-133.7	48.4	-167.1	-157	174.9	-119.7	0	0	116.3	K81	K81-E938 VanDerWaalsContact CE-OE1 3.22Å; K81-E938 WeakPolarHBondContact CE-OE1 3.3Å; K81-E938 IonicContact NZ-OE1 2.67Å; K81-E938 PolarHBondContact NZ-OE1 3.5Å
939	E	29.1	Very low	41.7	Very low	192 Å²	192	123.4 Å²	123.4	90%	0.897	64%	0.64	S	S	*	*			trans	-111	14.6	-163.4	-148.1	169.3	-144.1	0	0	117.5
940	K	35.5	Very low	44.5	Very low	195 Å²	195	118.8 Å²	118.8	85%	0.848	60%	0.601	S	S	*	*	S	Bend	trans	-129.7	10.9	-176.9	-142.4	166.9	-171.9	167.8	0	117.2
941	R	38.5	Very low	47.5	Very low	204 Å²	204	116 Å²	116	77%	0.77	57%	0.572	S	S	*	*	S	Bend	trans	-130.1	-24.9	178.4	-74.6	-175.4	168.8	-169.5	-5.7	115.4
942	K	34.5	Very low	50.6	Low	141 Å²	141	111.1 Å²	111.1	61%	0.613	54%	0.537	S	S	*	.	S	Bend	trans	-79.2	-28.9	-178.5	-141.9	165.9	-169.5	166.7	0	113.3	N944 K945	K942-N944 PolarHBondContact O-N 3.02Å; K942-K945 PolarHBondContact O-N 3.07Å
943	S	36.9	Very low	53.7	Low	44 Å²	44	108.3 Å²	108.3	31%	0.308	52%	0.517	S	S	.	.	G	3₁₀ helix	trans	-64.7	-31	-178	50.7	0	0	0	0	114.4	K945 R946 K947	S943-K945 VanDerWaalsContact C-N 3.28Å; S943-K945 PolarHBondContact O-N 2.94Å; S943-R946 CarbonylContact O-C 3.52Å; S943-R946 PolarHBondContact O-N 2.75Å; S943-K947 PolarHBondContact O-N 2.82Å
944	N	41.8	Very low	56.4	Low	123 Å²	123	103 Å²	103	66%	0.658	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-64.2	-26.8	179.7	-87.6	15.4	0	0	0	113.9	K942 R946	K942-N944 PolarHBondContact O-N 3.02Å; N944-R946 PolarHBondContact O-N 3.26Å
945	K	47.7	Very low	59.3	Low	174 Å²	174	98.6 Å²	98.6	76%	0.757	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-79.1	-2.5	173.5	-77.9	-168.6	174.1	-174.7	0	113.3	K942 S943	K942-K945 PolarHBondContact O-N 3.07Å; S943-K945 VanDerWaalsContact C-N 3.28Å; S943-K945 PolarHBondContact O-N 2.94Å
946	R	63.5	Low	61.6	Low	95 Å²	95	93.8 Å²	93.8	36%	0.358	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-123.5	21.1	-180	-55.1	-170.6	-174.6	168.6	-12.7	113.2	S943 N944 L1034 D1035	S943-R946 CarbonylContact O-C 3.52Å; S943-R946 PolarHBondContact O-N 2.75Å; N944-R946 PolarHBondContact O-N 3.26Å; R946-L1034 HydrophobicContact CB-CB 4.36Å; R946-L1034 WeakPolarHBondContact CB-O 3.46Å; R946-L1034 WeakPolarHBondContact CD-O 3.48Å; R946-L1034 PolarHBondContact O-N 3.44Å; R946-D1035 IonicContact CZ-OD1 3.48Å; R946-D1035 IonicContact NH1-OD1 2.8Å; R946-D1035 PolarHBondContact NH1-OD1 3.19Å; R946-D1035 IonicContact NH1-OD2 3.21Å; R946-D1035 IonicContact NH2-OD1 3.9Å
947	K	78	Confident	63.7	Low	76 Å²	76	90.7 Å²	90.7	33%	0.33	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	132.6	-172	-157.8	178.3	-176.3	176.9	0	111.7	S943 V949 T1032 V1033	S943-K947 PolarHBondContact O-N 2.82Å; K947-V949 HydrophobicContact CD-CG2 3.76Å; K947-V949 HydrophobicContact CG-CG2 3.74Å; K947-T1032 WeakPolarHBondContact CA-O 3.34Å; K947-T1032 WeakPolarHBondContact CG-O 3.39Å; K947-V1033 HydrophobicContact CG-CG2 4.32Å
948	V	88.3	Confident	65	Low	1 Å²	1	85.9 Å²	85.9	1%	0.006	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	127.6	167.9	-179.4	0	0	0	0	107.6	L968 I1006 V1007 Q1010 T1032 L1034	V948-L968 HydrophobicContact CG1-CD1 3.74Å; V948-I1006 HydrophobicContact CB-CG2 3.95Å; V948-I1006 HydrophobicContact CG1-CG2 4.03Å; V948-I1006 HydrophobicContact CG2-CG2 4.34Å; V948-V1007 HydrophobicContact CG1-CG2 3.99Å; V948-Q1010 PolarHBondContact O-NE2 3.22Å; V948-T1032 PolarHBondContact N-O 2.91Å; V948-T1032 PolarHBondContact O-N 2.89Å; V948-L1034 HydrophobicContact CG2-CD1 3.88Å
949	V	92.4	Very high	66.5	Low	19 Å²	19	87.9 Å²	87.9	12%	0.115	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	131.9	-172.8	-178	0	0	0	0	110.2	K947 L968 D969 K1029 L1030	K947-V949 HydrophobicContact CD-CG2 3.76Å; K947-V949 HydrophobicContact CG-CG2 3.74Å; V949-L968 WeakPolarHBondContact O-CA 3.07Å; V949-D969 HydrophobicContact CB-CB 4.37Å; V949-D969 PolarHBondContact N-O 2.83Å; V949-D969 PolarHBondContact O-N 3.15Å; V949-K1029 HydrophobicContact CG1-CD 4.2Å; V949-K1029 VanDerWaalsContact CG1-CE 3.42Å; V949-K1029 HydrophobicContact CG1-CG 3.73Å; V949-L1030 WeakPolarHBondContact CA-O 3.24Å; V949-L1030 WeakPolarHBondContact CG1-O 3.38Å
950	M	93.7	Very high	68	Low	1 Å²	1	86.4 Å²	86.4	1%	0.005	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136	176.2	-166.4	179.2	-60.6	0	0	109.9	C966 R967 L968 V1007 Q1010 L1011 V1014 K1029 L1030	M950-C966 HydrophobicContact CG-CB 4.38Å; M950-R967 CarbonylContact C-O 3.59Å; M950-R967 WeakPolarHBondContact CA-O 3.16Å; M950-L968 HydrophobicContact CE-CD1 4.22Å; M950-V1007 HydrophobicContact CE-CB 4.48Å; M950-V1007 HydrophobicContact CE-CG1 3.88Å; M950-Q1010 HydrophobicContact CB-CB 4.47Å; M950-Q1010 HydrophobicContact CE-CB 3.66Å; M950-Q1010 HydrophobicContact SD-CB 4.12Å; M950-L1011 HydrophobicContact CE-CG 4.06Å; M950-L1011 HydrophobicContact SD-CD2 4.3Å; M950-L1011 HydrophobicContact SD-CG 4.24Å; M950-V1014 HydrophobicContact SD-CG2 3.92Å; M950-K1029 CarbonylContact O-C 3.48Å; M950-K1029 WeakPolarHBondContact O-CA 3.35Å; M950-L1030 HydrophobicContact CB-CB 4.45Å; M950-L1030 PolarHBondContact N-O 2.69Å; M950-L1030 PolarHBondContact O-N 2.65Å
951	E	94.2	Very high	69.3	Low	38 Å²	38	83.6 Å²	83.6	18%	0.178	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	124.2	-173.5	-172.6	178.9	111.7	0	0	109.8	L953 C966 R967 T1028 K1029	E951-L953 PolarHBondContact O-N 2.8Å; E951-C966 CarbonylContact O-C 3.57Å; E951-C966 WeakPolarHBondContact O-CA 3.17Å; E951-R967 VanDerWaalsContact CD-NH1 3.33Å; E951-R967 VanDerWaalsContact CD-NH2 3.3Å; E951-R967 PolarHBondContact N-O 2.66Å; E951-R967 PolarHBondContact O-N 2.8Å; E951-R967 IonicContact OE1-CZ 3.62Å; E951-R967 IonicContact OE1-NH1 3.61Å; E951-R967 PolarHBondContact OE1-NH1 3.49Å; E951-R967 IonicContact OE1-NH2 3.65Å; E951-R967 PolarHBondContact OE1-NH2 3.23Å; E951-R967 IonicContact OE2-CZ 3.27Å; E951-R967 IonicContact OE2-NH1 2.81Å; E951-R967 IonicContact OE2-NH2 2.76Å; E951-R967 PolarHBondContact OE2-NH2 3.31Å; E951-T1028 WeakPolarHBondContact CA-O 3.47Å; E951-K1029 HydrophobicContact CB-CG 4.35Å; E951-K1029 HydrophobicContact CG-CD 4.39Å; E951-K1029 HydrophobicContact CG-CG 4.44Å; E951-K1029 WeakPolarHBondContact OE2-CD 3.16Å; E951-K1029 WeakPolarHBondContact OE2-CE 3.27Å; E951-K1029 IonicContact OE2-NZ 3.79Å; E951-K1029 PolarHBondContact OE2-NZ 3.39Å
952	I	93.3	Very high	70.9	Confident	2 Å²	2	75.8 Å²	75.8	1%	0.01	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	113.7	178.5	-56.3	176.5	0	0	0	108.5	V964 V1014 L1017 I1018 G1025 G1027 T1028	I952-V964 HydrophobicContact CG2-CG1 4.36Å; I952-V1014 HydrophobicContact CD1-CB 4.38Å; I952-V1014 HydrophobicContact CD1-CG1 3.85Å; I952-V1014 HydrophobicContact CD1-CG2 4.07Å; I952-V1014 HydrophobicContact CG1-CG1 4.05Å; I952-V1014 HydrophobicContact CG1-CG2 4.05Å; I952-L1017 HydrophobicContact CD1-CD2 3.91Å; I952-I1018 HydrophobicContact CG2-CD1 4.42Å; I952-G1025 WeakPolarHBondContact CD1-O 3.49Å; I952-G1027 WeakPolarHBondContact O-CA 3.49Å; I952-G1027 PolarHBondContact O-N 2.84Å; I952-T1028 PolarHBondContact N-O 2.98Å
953	L	90.9	Very high	73.4	Confident	80 Å²	80	70.6 Å²	70.6	42%	0.419	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-28.1	-177.2	-59	178.4	0	0	0	113	E951 S965 R967 T976	E951-L953 PolarHBondContact O-N 2.8Å; L953-S965 PolarHBondContact N-O 2.97Å; L953-R967 HydrophobicContact CD1-CB 4.17Å; L953-R967 HydrophobicContact CD2-CB 4.16Å; L953-R967 HydrophobicContact CG-CB 4.29Å; L953-T976 HydrophobicContact CD1-CG2 3.94Å
954	G	88.2	Confident	75.9	Confident	18 Å²	18	68.5 Å²	68.5	19%	0.186	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.6	162.3	-177.5	0	0	0	0	0	112.8	S965	G954-S965 PolarHBondContact O-N 2.78Å
955	C	84.5	Confident	78.3	Confident	33 Å²	33	63.6 Å²	63.6	22%	0.223	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	124.3	172.3	-167.9	0	0	0	0	108.5	L963 I1018	C955-L963 WeakPolarHBondContact CA-O 2.97Å; C955-I1018 HydrophobicContact CB-CD1 4.36Å
956	D	78.6	Confident	80.5	Confident	47 Å²	47	55.3 Å²	55.3	25%	0.251	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	105.9	176.3	179.3	14	0	0	0	109.6	S958 R959 A962 L963	D956-S958 VanDerWaalsContact C-N 3.35Å; D956-S958 WeakPolarHBondContact OD1-CB 3.36Å; D956-S958 PolarHBondContact OD1-N 2.82Å; D956-S958 PolarHBondContact OD1-OG 2.99Å; D956-S958 PolarHBondContact OD2-OG 2.73Å; D956-R959 IonicContact OD2-NE 2.84Å; D956-R959 PolarHBondContact OD2-NE 3.17Å; D956-A962 WeakPolarHBondContact O-CA 3.27Å; D956-L963 HydrophobicContact CB-CB 4.32Å; D956-L963 PolarHBondContact N-O 2.94Å; D956-L963 PolarHBondContact O-N 2.82Å
957	E	70.8	Confident	82	Confident	106 Å²	106	53.4 Å²	53.4	50%	0.495	28%	0.277	S	S	.	.			trans	-85.7	-1.5	176.6	-63.7	175.3	156.9	0	0	112.8	R959 K1023	E957-R959 PolarHBondContact O-N 3.2Å; E957-K1023 WeakPolarHBondContact OE1-CE 3.35Å; E957-K1023 IonicContact OE1-NZ 2.7Å; E957-K1023 PolarHBondContact OE1-NZ 3.41Å; E957-K1023 VanDerWaalsContact OE1-NZ 3.07Å; E957-K1023 WeakPolarHBondContact OE2-CE 3.38Å; E957-K1023 IonicContact OE2-NZ 2.65Å; E957-K1023 PolarHBondContact OE2-NZ 3.29Å
958	S	55.9	Low	82.8	Confident	101 Å²	101	49.8 Å²	49.8	71%	0.706	26%	0.261	S	S	*	.	S	Bend	trans	-79.2	5.1	-170.9	72.2	0	0	0	0	115.5	D956	D956-S958 VanDerWaalsContact C-N 3.35Å; D956-S958 WeakPolarHBondContact OD1-CB 3.36Å; D956-S958 PolarHBondContact OD1-N 2.82Å; D956-S958 PolarHBondContact OD1-OG 2.99Å; D956-S958 PolarHBondContact OD2-OG 2.73Å
959	R	60.3	Low	82.9	Confident	155 Å²	155	51.5 Å²	51.5	59%	0.585	27%	0.27	S	S	*	.	S	Bend	trans	-127.7	161.5	-178.1	-51.7	-172.3	-164.8	-161.8	-1.7	110.8	D956 E957 F961	D956-R959 IonicContact OD2-NE 2.84Å; D956-R959 PolarHBondContact OD2-NE 3.17Å; E957-R959 PolarHBondContact O-N 3.2Å; R959-F961 CarbonylContact O-C 3.21Å; R959-F961 PolarHBondContact O-N 3.18Å
960	N	60	Low	82.7	Confident	162 Å²	162	51.5 Å²	51.5	87%	0.866	27%	0.271	S	S	*	.	S	Bend	trans	-55.4	-15.1	179.7	-67.6	20.1	0	0	0	115.1
961	F	62.9	Low	82	Confident	135 Å²	135	54.9 Å²	54.9	59%	0.592	29%	0.294	S	S	*	.	S	Bend	trans	-131.3	129.9	169.8	-46.9	-78.8	0	0	0	107.8	R959 L963 A980	R959-F961 CarbonylContact O-C 3.21Å; R959-F961 PolarHBondContact O-N 3.18Å; F961-L963 PolarHBondContact O-N 3.22Å; F961-A980 HydrophobicContact CB-CB 4.18Å
962	A	72.8	Confident	81.2	Confident	40 Å²	40	57.3 Å²	57.3	33%	0.331	31%	0.306	S	S	.	.			trans	-61.6	130.3	175	0	0	0	0	0	110.1	D956 A980 P981	D956-A962 WeakPolarHBondContact O-CA 3.27Å; A962-A980 WeakPolarHBondContact O-CA 3.45Å; A962-P981 VanDerWaalsContact O-CD 3.26Å; A962-P981 WeakPolarHBondContact O-CD 3.48Å
963	L	86.2	Confident	80.7	Confident	32 Å²	32	60.9 Å²	60.9	17%	0.168	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	116.3	179.7	-75.8	171.3	0	0	0	110.9	C955 D956 F961 A980	C955-L963 WeakPolarHBondContact CA-O 2.97Å; D956-L963 HydrophobicContact CB-CB 4.32Å; D956-L963 PolarHBondContact N-O 2.94Å; D956-L963 PolarHBondContact O-N 2.82Å; F961-L963 PolarHBondContact O-N 3.22Å; L963-A980 HydrophobicContact CD2-CB 4.24Å
964	V	90.3	Very high	80.7	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	122	177.8	-177.9	0	0	0	0	108.9	I952 Q978 F979 P981 V1014 I1018	I952-V964 HydrophobicContact CG2-CG1 4.36Å; V964-Q978 WeakPolarHBondContact O-CA 3.4Å; V964-F979 HydrophobicContact CB-CD1 4.38Å; V964-F979 HydrophobicContact CB-CE1 3.98Å; V964-F979 HydrophobicContact CB-CZ 4.06Å; V964-F979 HydrophobicContact CG1-CE1 3.92Å; V964-F979 HydrophobicContact CG1-CZ 4.04Å; V964-F979 PolarHBondContact N-O 2.94Å; V964-F979 PolarHBondContact O-N 2.88Å; V964-F979 VanDerWaalsContact O-N 3.13Å; V964-P981 HydrophobicContact CG2-CG 3.88Å; V964-V1014 HydrophobicContact CG1-CG1 3.89Å; V964-I1018 HydrophobicContact CG1-CD1 4.25Å; V964-I1018 HydrophobicContact CG1-CG1 4.2Å; V964-I1018 HydrophobicContact CG2-CB 4.36Å; V964-I1018 HydrophobicContact CG2-CD1 4.05Å; V964-I1018 HydrophobicContact CG2-CG1 3.84Å; V964-I1018 HydrophobicContact CG2-CG2 3.89Å
965	S	92.2	Very high	80.8	Confident	21 Å²	21	61.1 Å²	61.1	15%	0.147	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	125.4	175	-58.3	0	0	0	0	110	L953 G954 Q978	L953-S965 PolarHBondContact N-O 2.97Å; G954-S965 PolarHBondContact O-N 2.78Å; S965-Q978 WeakPolarHBondContact OG-CG 3.45Å; S965-Q978 PolarHBondContact OG-NE2 3.35Å
966	C	94.4	Very high	81.3	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.9	178	-75.4	0	0	0	0	112	M950 E951 T976 F977	M950-C966 HydrophobicContact CG-CB 4.38Å; E951-C966 CarbonylContact O-C 3.57Å; E951-C966 WeakPolarHBondContact O-CA 3.17Å; C966-T976 VanDerWaalsContact O-CA 3.31Å; C966-T976 WeakPolarHBondContact O-CA 3.44Å; C966-F977 HydrophobicContact CB-CE1 4.05Å; C966-F977 HydrophobicContact CB-CE2 4.28Å; C966-F977 HydrophobicContact CB-CZ 3.86Å; C966-F977 PolarHBondContact N-O 2.87Å; C966-F977 PolarHBondContact O-N 3.35Å
967	R	94.9	Very high	82	Confident	55 Å²	55	63.2 Å²	63.2	21%	0.208	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	128.3	161.1	-165.6	178	75.7	-99	-15.6	109.3	M950 E951 L953 D969 V975 T976	M950-R967 CarbonylContact C-O 3.59Å; M950-R967 WeakPolarHBondContact CA-O 3.16Å; E951-R967 VanDerWaalsContact CD-NH1 3.33Å; E951-R967 VanDerWaalsContact CD-NH2 3.3Å; E951-R967 PolarHBondContact N-O 2.66Å; E951-R967 PolarHBondContact O-N 2.8Å; E951-R967 IonicContact OE1-CZ 3.62Å; E951-R967 IonicContact OE1-NH1 3.61Å; E951-R967 PolarHBondContact OE1-NH1 3.49Å; E951-R967 IonicContact OE1-NH2 3.65Å; E951-R967 PolarHBondContact OE1-NH2 3.23Å; E951-R967 IonicContact OE2-CZ 3.27Å; E951-R967 IonicContact OE2-NH1 2.81Å; E951-R967 IonicContact OE2-NH2 2.76Å; E951-R967 PolarHBondContact OE2-NH2 3.31Å; L953-R967 HydrophobicContact CD1-CB 4.17Å; L953-R967 HydrophobicContact CD2-CB 4.16Å; L953-R967 HydrophobicContact CG-CB 4.29Å; R967-D969 IonicContact CZ-OD2 3.5Å; R967-D969 VanDerWaalsContact CZ-OD2 3.31Å; R967-D969 IonicContact NE-OD1 2.72Å; R967-D969 PolarHBondContact NE-OD1 2.95Å; R967-D969 IonicContact NE-OD2 3.03Å; R967-D969 PolarHBondContact NE-OD2 2.82Å; R967-D969 IonicContact NH2-OD2 3.4Å; R967-D969 PolarHBondContact NH2-OD2 2.96Å; R967-V975 WeakPolarHBondContact CA-O 3.24Å; R967-T976 HydrophobicContact CB-CG2 4Å; R967-T976 HydrophobicContact CG-CG2 3.8Å
968	L	94.4	Very high	83	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.8	168.5	170.9	68.9	0	0	0	108.5	V948 V949 M950 T970 S974 V975 F977 L993 L999 V1007	V948-L968 HydrophobicContact CG1-CD1 3.74Å; V949-L968 WeakPolarHBondContact O-CA 3.07Å; M950-L968 HydrophobicContact CE-CD1 4.22Å; L968-T970 HydrophobicContact CD1-CG2 4.21Å; L968-T970 HydrophobicContact CD2-CG2 4.08Å; L968-T970 HydrophobicContact CG-CG2 3.9Å; L968-S974 CarbonylContact O-C 3.54Å; L968-S974 VanDerWaalsContact O-CA 3.28Å; L968-S974 WeakPolarHBondContact O-CA 3.41Å; L968-V975 HydrophobicContact CB-CG1 4Å; L968-V975 HydrophobicContact CD2-CG1 4.23Å; L968-V975 HydrophobicContact CG-CG1 4.49Å; L968-V975 PolarHBondContact N-O 2.96Å; L968-V975 PolarHBondContact O-N 3.05Å; L968-F977 HydrophobicContact CB-CE1 4.01Å; L968-L993 HydrophobicContact CD2-CD1 4.21Å; L968-L999 HydrophobicContact CD2-CD1 3.53Å; L968-V1007 HydrophobicContact CD1-CG2 3.87Å; L968-V1007 HydrophobicContact CD2-CG1 4.3Å; L968-V1007 HydrophobicContact CD2-CG2 3.99Å
969	D	91	Very high	84.8	Confident	36 Å²	36	59.1 Å²	59.1	19%	0.193	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	119.5	173.8	-60.6	-45.8	0	0	0	109.2	V949 R967 S974	V949-D969 HydrophobicContact CB-CB 4.37Å; V949-D969 PolarHBondContact N-O 2.83Å; V949-D969 PolarHBondContact O-N 3.15Å; R967-D969 IonicContact CZ-OD2 3.5Å; R967-D969 VanDerWaalsContact CZ-OD2 3.31Å; R967-D969 IonicContact NE-OD1 2.72Å; R967-D969 PolarHBondContact NE-OD1 2.95Å; R967-D969 IonicContact NE-OD2 3.03Å; R967-D969 PolarHBondContact NE-OD2 2.82Å; R967-D969 IonicContact NH2-OD2 3.4Å; R967-D969 PolarHBondContact NH2-OD2 2.96Å; D969-S974 VanDerWaalsContact OD1-CB 3.31Å; D969-S974 WeakPolarHBondContact OD1-CB 3.24Å; D969-S974 PolarHBondContact OD1-OG 3.4Å
970	T	87.9	Confident	86.2	Confident	20 Å²	20	52.1 Å²	52.1	12%	0.123	28%	0.281	C	S	.	.			trans	-117.1	177.4	177.4	75.8	0	0	0	0	111.9	L968 H972 K973	L968-T970 HydrophobicContact CD1-CG2 4.21Å; L968-T970 HydrophobicContact CD2-CG2 4.08Å; L968-T970 HydrophobicContact CG-CG2 3.9Å; T970-H972 PolarHBondContact O-N 2.95Å; T970-H972 VanDerWaalsContact O-N 3.11Å; T970-H972 PolarHBondContact OG1-CE1 2.69Å; T970-H972 VanDerWaalsContact OG1-CE1 3.32Å; T970-H972 PolarHBondContact OG1-N 2.86Å; T970-H972 PolarHBondContact OG1-ND1 3.44Å; T970-K973 WeakPolarHBondContact CB-O 3.31Å; T970-K973 PolarHBondContact N-O 3.35Å; T970-K973 PolarHBondContact OG1-N 3.21Å; T970-K973 VanDerWaalsContact OG1-N 3.1Å; T970-K973 PolarHBondContact OG1-O 2.86Å
971	S	77.5	Confident	87.4	Confident	72 Å²	72	45.3 Å²	45.3	50%	0.503	25%	0.246	S	C	.	.	S	Bend	trans	-60.9	-14	176.5	56.5	0	0	0	0	116
972	H	78	Confident	88.2	Confident	89 Å²	89	42.5 Å²	42.5	41%	0.412	26%	0.255	S	S	.	.	S	Bend	trans	-139.5	-19.6	-170.4	54.6	-77.4	0	0	0	114.5	T970 H1003	T970-H972 PolarHBondContact O-N 2.95Å; T970-H972 VanDerWaalsContact O-N 3.11Å; T970-H972 PolarHBondContact OG1-CE1 2.69Å; T970-H972 VanDerWaalsContact OG1-CE1 3.32Å; T970-H972 PolarHBondContact OG1-N 2.86Å; T970-H972 PolarHBondContact OG1-ND1 3.44Å; H972-H1003 AromaticContact CE1-CE1 3.67Å; H972-H1003 AromaticContact CE1-ND1 3.71Å
973	K	83.8	Confident	88.7	Confident	76 Å²	76	44.8 Å²	44.8	33%	0.33	27%	0.265	S	S	.	.			trans	-153.9	140.1	-178.3	-168.6	158.8	158.3	-168	0	110.7	T970 E996 D997 C998	T970-K973 WeakPolarHBondContact CB-O 3.31Å; T970-K973 PolarHBondContact N-O 3.35Å; T970-K973 PolarHBondContact OG1-N 3.21Å; T970-K973 VanDerWaalsContact OG1-N 3.1Å; T970-K973 PolarHBondContact OG1-O 2.86Å; K973-E996 PolarHBondContact NZ-O 3.45Å; K973-D997 VanDerWaalsContact CD-O 3.27Å; K973-D997 WeakPolarHBondContact CD-O 3.23Å; K973-D997 PolarHBondContact NZ-O 3.3Å; K973-C998 WeakPolarHBondContact CE-SG 3.22Å; K973-C998 PolarHBondContact NZ-SG 2.85Å
974	S	89.4	Confident	88.9	Confident	76 Å²	76	45.4 Å²	45.4	53%	0.531	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	138.9	165.2	-71.9	0	0	0	0	108.9	L968 D969	L968-S974 CarbonylContact O-C 3.54Å; L968-S974 VanDerWaalsContact O-CA 3.28Å; L968-S974 WeakPolarHBondContact O-CA 3.41Å; D969-S974 VanDerWaalsContact OD1-CB 3.31Å; D969-S974 WeakPolarHBondContact OD1-CB 3.24Å; D969-S974 PolarHBondContact OD1-OG 3.4Å
975	V	91.6	Very high	88.9	Confident	27 Å²	27	52.1 Å²	52.1	16%	0.164	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	138.1	-179.7	64.9	0	0	0	0	110.5	R967 L968 F977 L993 C998	R967-V975 WeakPolarHBondContact CA-O 3.24Å; L968-V975 HydrophobicContact CB-CG1 4Å; L968-V975 HydrophobicContact CD2-CG1 4.23Å; L968-V975 HydrophobicContact CG-CG1 4.49Å; L968-V975 PolarHBondContact N-O 2.96Å; L968-V975 PolarHBondContact O-N 3.05Å; V975-F977 HydrophobicContact CG1-CD1 4.43Å; V975-L993 HydrophobicContact CG1-CD2 4.13Å; V975-L993 HydrophobicContact CG2-CD2 4.44Å; V975-C998 HydrophobicContact CG1-CB 4.23Å
976	T	93.7	Very high	88.9	Confident	96 Å²	96	52.7 Å²	52.7	59%	0.589	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.9	170.5	49.5	0	0	0	0	109.3	L953 C966 R967	L953-T976 HydrophobicContact CD1-CG2 3.94Å; C966-T976 VanDerWaalsContact O-CA 3.31Å; C966-T976 WeakPolarHBondContact O-CA 3.44Å; R967-T976 HydrophobicContact CB-CG2 4Å; R967-T976 HydrophobicContact CG-CG2 3.8Å
977	F	93.8	Very high	88.7	Confident	28 Å²	28	55.3 Å²	55.3	12%	0.123	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	160.1	-179.4	64.8	-83.9	0	0	0	111.1	C966 L968 V975 F979 I989 L993 L1011	C966-F977 HydrophobicContact CB-CE1 4.05Å; C966-F977 HydrophobicContact CB-CE2 4.28Å; C966-F977 HydrophobicContact CB-CZ 3.86Å; C966-F977 PolarHBondContact N-O 2.87Å; C966-F977 PolarHBondContact O-N 3.35Å; L968-F977 HydrophobicContact CB-CE1 4.01Å; V975-F977 HydrophobicContact CG1-CD1 4.43Å; F977-F979 AromaticContact CD2-CD1 4Å; F977-F979 HydrophobicContact CD2-CD1 4Å; F977-F979 AromaticContact CE2-CD1 3.6Å; F977-F979 HydrophobicContact CE2-CD1 3.6Å; F977-F979 AromaticContact CE2-CE1 3.97Å; F977-F979 HydrophobicContact CE2-CE1 3.97Å; F977-I989 HydrophobicContact CD2-CG2 4.05Å; F977-I989 HydrophobicContact CE2-CG2 3.7Å; F977-I989 HydrophobicContact CZ-CG2 4.35Å; F977-L993 HydrophobicContact CD1-CD1 4.33Å; F977-L993 HydrophobicContact CD1-CD2 4.48Å; F977-L993 HydrophobicContact CE1-CD1 4.14Å; F977-L993 HydrophobicContact CZ-CD1 4.39Å; F977-L1011 HydrophobicContact CE2-CD2 4.01Å; F977-L1011 HydrophobicContact CZ-CD2 4.09Å
978	Q	92.9	Very high	88.5	Confident	118 Å²	118	55.5 Å²	55.5	55%	0.551	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	144.9	173.1	-72.7	-176.8	-19.4	0	0	109.6	V964 S965	V964-Q978 WeakPolarHBondContact O-CA 3.4Å; S965-Q978 WeakPolarHBondContact OG-CG 3.45Å; S965-Q978 PolarHBondContact OG-NE2 3.35Å
979	F	93.2	Very high	88.4	Confident	4 Å²	4	56 Å²	56	2%	0.018	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	156.2	174.2	69.9	-81	0	0	0	110.2	V964 F977 P981 D984 I989 L1011 V1014 I1015	V964-F979 HydrophobicContact CB-CD1 4.38Å; V964-F979 HydrophobicContact CB-CE1 3.98Å; V964-F979 HydrophobicContact CB-CZ 4.06Å; V964-F979 HydrophobicContact CG1-CE1 3.92Å; V964-F979 HydrophobicContact CG1-CZ 4.04Å; V964-F979 PolarHBondContact N-O 2.94Å; V964-F979 PolarHBondContact O-N 2.88Å; V964-F979 VanDerWaalsContact O-N 3.13Å; F977-F979 AromaticContact CD2-CD1 4Å; F977-F979 HydrophobicContact CD2-CD1 4Å; F977-F979 AromaticContact CE2-CD1 3.6Å; F977-F979 HydrophobicContact CE2-CD1 3.6Å; F977-F979 AromaticContact CE2-CE1 3.97Å; F977-F979 HydrophobicContact CE2-CE1 3.97Å; F979-P981 HydrophobicContact CE2-CB 4.11Å; F979-D984 HydrophobicContact CB-CB 3.98Å; F979-D984 HydrophobicContact CD2-CB 4.41Å; F979-I989 HydrophobicContact CB-CD1 3.73Å; F979-I989 HydrophobicContact CB-CG1 4.34Å; F979-I989 HydrophobicContact CD1-CD1 4.29Å; F979-I989 HydrophobicContact CD2-CD1 3.6Å; F979-I989 HydrophobicContact CE2-CD1 4.24Å; F979-I989 HydrophobicContact CG-CD1 3.62Å; F979-L1011 HydrophobicContact CD1-CD2 4.24Å; F979-L1011 HydrophobicContact CE1-CD2 3.66Å; F979-L1011 HydrophobicContact CE2-CD2 4.19Å; F979-L1011 HydrophobicContact CZ-CD2 3.62Å; F979-V1014 HydrophobicContact CE1-CG1 4.38Å; F979-V1014 HydrophobicContact CZ-CB 4.48Å; F979-V1014 HydrophobicContact CZ-CG1 3.8Å; F979-I1015 HydrophobicContact CE2-CD1 4.23Å; F979-I1015 HydrophobicContact CE2-CG1 3.78Å; F979-I1015 HydrophobicContact CZ-CG1 4.4Å
980	A	89.7	Confident	88.5	Confident	7 Å²	7	54.3 Å²	54.3	6%	0.058	32%	0.32	C	S	.	.			trans	-100.1	114.5	173.8	0	0	0	0	0	109.3	F961 A962 L963 G982 T983 D984	F961-A980 HydrophobicContact CB-CB 4.18Å; A962-A980 WeakPolarHBondContact O-CA 3.45Å; L963-A980 HydrophobicContact CD2-CB 4.24Å; A980-G982 PolarHBondContact O-N 3.02Å; A980-T983 WeakPolarHBondContact CB-OG1 3.11Å; A980-T983 PolarHBondContact O-N 3.25Å; A980-T983 PolarHBondContact O-OG1 3.41Å; A980-D984 PolarHBondContact N-OD2 3.35Å; A980-D984 PolarHBondContact O-N 3.12Å
981	P	85.7	Confident	88.6	Confident	19 Å²	19	57.3 Å²	57.3	12%	0.123	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-12.2	-170	28.8	-35.8	0	0	0	113.8	A962 V964 F979 I1015 I1018	A962-P981 VanDerWaalsContact O-CD 3.26Å; A962-P981 WeakPolarHBondContact O-CD 3.48Å; V964-P981 HydrophobicContact CG2-CG 3.88Å; F979-P981 HydrophobicContact CE2-CB 4.11Å; P981-I1015 HydrophobicContact CB-CB 4.46Å; P981-I1015 HydrophobicContact CB-CG1 3.9Å; P981-I1015 HydrophobicContact CB-CG2 4.28Å; P981-I1018 HydrophobicContact CG-CG2 4.21Å
982	G	79.5	Confident	89.2	Confident	77 Å²	77	59.6 Å²	59.6	79%	0.794	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-10.8	172.1	0	0	0	0	0	115.2	A980	A980-G982 PolarHBondContact O-N 3.02Å
983	T	83.8	Confident	89.9	Confident	88 Å²	88	55.7 Å²	55.7	54%	0.54	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.7	-37.7	-175.6	56.1	0	0	0	0	113.9	A980	A980-T983 WeakPolarHBondContact CB-OG1 3.11Å; A980-T983 PolarHBondContact O-N 3.25Å; A980-T983 PolarHBondContact O-OG1 3.41Å
984	D	88.9	Confident	90.3	Very high	45 Å²	45	54.4 Å²	54.4	24%	0.241	32%	0.318	C	S	.	.			trans	-87.8	112.8	-178.6	-69.6	-63.7	0	0	0	111.3	F979 A980 I989	F979-D984 HydrophobicContact CB-CB 3.98Å; F979-D984 HydrophobicContact CD2-CB 4.41Å; A980-D984 PolarHBondContact N-OD2 3.35Å; A980-D984 PolarHBondContact O-N 3.12Å; D984-I989 HydrophobicContact CB-CD1 3.86Å; D984-I989 HydrophobicContact CB-CG1 3.97Å
985	K	90.5	Very high	90.2	Very high	140 Å²	140	55 Å²	55	61%	0.609	33%	0.327	S	S	*	.			trans	-73.9	141.9	175.9	-61.7	-178.7	-179.3	179.5	0	110.8	C987 T988 I989	K985-C987 VanDerWaalsContact C-N 3.28Å; K985-C987 PolarHBondContact O-N 2.96Å; K985-T988 WeakPolarHBondContact O-CB 3.33Å; K985-T988 PolarHBondContact O-N 3.41Å; K985-I989 PolarHBondContact O-N 2.91Å; K985-I989 VanDerWaalsContact O-N 3.14Å
986	P	91.9	Very high	90.1	Very high	33 Å²	33	59.9 Å²	59.9	21%	0.214	35%	0.348	C	S	.	.	H	α-helix	trans	-48.4	-44.3	177.2	-33.2	37.4	0	0	0	114.7	T988 I989 A990 E1008 L1011 I1015	P986-T988 PolarHBondContact O-N 3.23Å; P986-I989 PolarHBondContact O-N 3.36Å; P986-A990 WeakPolarHBondContact O-CB 3.39Å; P986-A990 PolarHBondContact O-N 3.22Å; P986-E1008 HydrophobicContact CB-CB 4.45Å; P986-L1011 HydrophobicContact CB-CB 3.82Å; P986-L1011 HydrophobicContact CB-CD1 4.47Å; P986-L1011 HydrophobicContact CG-CB 4.12Å; P986-I1015 HydrophobicContact CG-CD1 3.71Å
987	C	91.3	Very high	89.7	Confident	56 Å²	56	61.3 Å²	61.3	38%	0.378	35%	0.352	S	S	.	.	H	α-helix	trans	-64.2	-37.4	178.3	57.3	0	0	0	0	113.3	K985 T991 E1008	K985-C987 VanDerWaalsContact C-N 3.28Å; K985-C987 PolarHBondContact O-N 2.96Å; C987-T991 WeakPolarHBondContact O-CB 3.31Å; C987-T991 PolarHBondContact O-N 3.03Å; C987-T991 PolarHBondContact O-OG1 2.98Å; C987-E1008 WeakPolarHBondContact CA-OE1 3.34Å; C987-E1008 WeakPolarHBondContact CB-OE1 3.49Å
988	T	90.9	Very high	89.3	Confident	59 Å²	59	60.3 Å²	60.3	36%	0.362	35%	0.348	S	S	.	.	H	α-helix	trans	-65.7	-41.7	175.5	-52.9	0	0	0	0	111	K985 P986 K992	K985-T988 WeakPolarHBondContact O-CB 3.33Å; K985-T988 PolarHBondContact O-N 3.41Å; P986-T988 PolarHBondContact O-N 3.23Å; T988-K992 WeakPolarHBondContact O-CG 3.29Å; T988-K992 PolarHBondContact O-N 3.43Å
989	I	92.3	Very high	89.1	Confident	11 Å²	11	54.9 Å²	54.9	6%	0.056	32%	0.323	C	S	.	.	H	α-helix	trans	-66.4	-50.7	177.4	-57.7	163.8	0	0	0	110	F977 F979 D984 K985 P986 T991 K992 L993 L1011	F977-I989 HydrophobicContact CD2-CG2 4.05Å; F977-I989 HydrophobicContact CE2-CG2 3.7Å; F977-I989 HydrophobicContact CZ-CG2 4.35Å; F979-I989 HydrophobicContact CB-CD1 3.73Å; F979-I989 HydrophobicContact CB-CG1 4.34Å; F979-I989 HydrophobicContact CD1-CD1 4.29Å; F979-I989 HydrophobicContact CD2-CD1 3.6Å; F979-I989 HydrophobicContact CE2-CD1 4.24Å; F979-I989 HydrophobicContact CG-CD1 3.62Å; D984-I989 HydrophobicContact CB-CD1 3.86Å; D984-I989 HydrophobicContact CB-CG1 3.97Å; K985-I989 PolarHBondContact O-N 2.91Å; K985-I989 VanDerWaalsContact O-N 3.14Å; P986-I989 PolarHBondContact O-N 3.36Å; I989-T991 VanDerWaalsContact C-N 3.28Å; I989-T991 PolarHBondContact O-N 3.2Å; I989-K992 PolarHBondContact O-N 3.16Å; I989-L993 HydrophobicContact CG2-CD1 4.03Å; I989-L993 HydrophobicContact CG2-CG 4.43Å; I989-L993 WeakPolarHBondContact O-CG 3.22Å; I989-L993 PolarHBondContact O-N 3.32Å; I989-L1011 HydrophobicContact CB-CD1 3.74Å; I989-L1011 HydrophobicContact CD1-CD1 4.06Å; I989-L1011 HydrophobicContact CD1-CD2 3.94Å; I989-L1011 HydrophobicContact CG2-CD1 3.68Å
990	A	92.7	Very high	88.8	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-61.7	-35.4	179.3	0	0	0	0	0	112.5	P986 L994 V1004 V1007 E1008	P986-A990 WeakPolarHBondContact O-CB 3.39Å; P986-A990 PolarHBondContact O-N 3.22Å; A990-L994 WeakPolarHBondContact O-CB 3.44Å; A990-L994 PolarHBondContact O-N 3.19Å; A990-V1004 HydrophobicContact CB-CG1 4.15Å; A990-V1007 HydrophobicContact CB-CG1 4.34Å; A990-E1008 HydrophobicContact CB-CG 3.63Å
991	T	89.7	Confident	88.5	Confident	83 Å²	83	67 Å²	67	51%	0.509	38%	0.378	S	S	.	.	H	α-helix	trans	-69.4	-42.1	174.9	-58.2	0	0	0	0	112.2	C987 I989 L994 A995	C987-T991 WeakPolarHBondContact O-CB 3.31Å; C987-T991 PolarHBondContact O-N 3.03Å; C987-T991 PolarHBondContact O-OG1 2.98Å; I989-T991 VanDerWaalsContact C-N 3.28Å; I989-T991 PolarHBondContact O-N 3.2Å; T991-L994 PolarHBondContact O-N 3.44Å; T991-A995 PolarHBondContact O-N 3.08Å
992	K	90.2	Very high	88.4	Confident	119 Å²	119	70.7 Å²	70.7	52%	0.517	40%	0.4	S	S	.	.	H	α-helix	trans	-60.8	-46.4	172.7	-76.8	175.5	177.9	176.6	0	111.3	T988 I989 L994 A995 E996	T988-K992 WeakPolarHBondContact O-CG 3.29Å; T988-K992 PolarHBondContact O-N 3.43Å; I989-K992 PolarHBondContact O-N 3.16Å; K992-L994 VanDerWaalsContact C-N 3.29Å; K992-L994 PolarHBondContact O-N 2.59Å; K992-A995 PolarHBondContact O-N 3.12Å; K992-A995 VanDerWaalsContact O-N 3.07Å; K992-E996 PolarHBondContact O-N 3.38Å
993	L	92.5	Very high	88.8	Confident	7 Å²	7	67.6 Å²	67.6	4%	0.037	37%	0.365	C	S	.	.	H	α-helix	trans	-63.7	-32.6	176.9	-67.4	174	0	0	0	112.4	L968 V975 F977 I989 C998 L999 V1007	L968-L993 HydrophobicContact CD2-CD1 4.21Å; V975-L993 HydrophobicContact CG1-CD2 4.13Å; V975-L993 HydrophobicContact CG2-CD2 4.44Å; F977-L993 HydrophobicContact CD1-CD1 4.33Å; F977-L993 HydrophobicContact CD1-CD2 4.48Å; F977-L993 HydrophobicContact CE1-CD1 4.14Å; F977-L993 HydrophobicContact CZ-CD1 4.39Å; I989-L993 HydrophobicContact CG2-CD1 4.03Å; I989-L993 HydrophobicContact CG2-CG 4.43Å; I989-L993 WeakPolarHBondContact O-CG 3.22Å; I989-L993 PolarHBondContact O-N 3.32Å; L993-C998 HydrophobicContact CB-CB 4.09Å; L993-C998 HydrophobicContact CD2-CB 3.9Å; L993-C998 CarbonylContact O-C 3.57Å; L993-C998 VanDerWaalsContact O-CA 3.26Å; L993-C998 WeakPolarHBondContact O-CA 3.45Å; L993-C998 WeakPolarHBondContact O-CB 3.44Å; L993-C998 PolarHBondContact O-N 3.48Å; L993-L999 HydrophobicContact CB-CD1 3.59Å; L993-L999 HydrophobicContact CD1-CD1 4Å; L993-L999 HydrophobicContact CG-CD1 4.43Å; L993-L999 PolarHBondContact O-N 3.49Å; L993-L999 VanDerWaalsContact O-N 3.14Å; L993-V1007 HydrophobicContact CD1-CG1 4.39Å
994	L	91.8	Very high	89	Confident	50 Å²	50	64.2 Å²	64.2	26%	0.262	34%	0.344	S	S	.	.	H	α-helix	trans	-67.7	-39	170.9	-178.4	67.1	0	0	0	112	A990 T991 K992 D997 L999 K1001 V1004	A990-L994 WeakPolarHBondContact O-CB 3.44Å; A990-L994 PolarHBondContact O-N 3.19Å; T991-L994 PolarHBondContact O-N 3.44Å; K992-L994 VanDerWaalsContact C-N 3.29Å; K992-L994 PolarHBondContact O-N 2.59Å; L994-D997 PolarHBondContact O-N 3.34Å; L994-L999 HydrophobicContact CB-CB 4.42Å; L994-L999 HydrophobicContact CD1-CB 4.35Å; L994-K1001 HydrophobicContact CD1-CG 3.91Å; L994-K1001 HydrophobicContact CD2-CG 4.22Å; L994-V1004 HydrophobicContact CD1-CG2 4.41Å; L994-V1004 HydrophobicContact CD2-CG2 4.08Å
995	A	88.5	Confident	88.9	Confident	87 Å²	87	69 Å²	69	72%	0.719	37%	0.365	S	S	*	.	H	α-helix	trans	-71.3	-26	-180	0	0	0	0	0	113.9	T991 K992 D997	T991-A995 PolarHBondContact O-N 3.08Å; K992-A995 PolarHBondContact O-N 3.12Å; K992-A995 VanDerWaalsContact O-N 3.07Å; A995-D997 VanDerWaalsContact C-N 3.32Å
996	E	88.5	Confident	88.9	Confident	130 Å²	130	62.8 Å²	62.8	61%	0.607	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	18	175.8	-66.2	-178.3	-175.8	0	0	113.6	K973 K992 C998	K973-E996 PolarHBondContact NZ-O 3.45Å; K992-E996 PolarHBondContact O-N 3.38Å; E996-C998 PolarHBondContact O-N 2.75Å; E996-C998 PolarHBondContact O-SG 3.07Å; E996-C998 VanDerWaalsContact O-SG 3.42Å
997	D	86.1	Confident	88.9	Confident	127 Å²	127	61.2 Å²	61.2	68%	0.679	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	29.1	-171.9	-80.1	-39.7	0	0	0	112.8	K973 L994 A995	K973-D997 VanDerWaalsContact CD-O 3.27Å; K973-D997 WeakPolarHBondContact CD-O 3.23Å; K973-D997 PolarHBondContact NZ-O 3.3Å; L994-D997 PolarHBondContact O-N 3.34Å; A995-D997 VanDerWaalsContact C-N 3.32Å
998	C	84.3	Confident	89	Confident	6 Å²	6	60.8 Å²	60.8	4%	0.041	32%	0.32	C	S	.	.	S	Bend	trans	-89.1	-10.8	176.9	-64	0	0	0	0	112.5	K973 V975 L993 E996	K973-C998 WeakPolarHBondContact CE-SG 3.22Å; K973-C998 PolarHBondContact NZ-SG 2.85Å; V975-C998 HydrophobicContact CG1-CB 4.23Å; L993-C998 HydrophobicContact CB-CB 4.09Å; L993-C998 HydrophobicContact CD2-CB 3.9Å; L993-C998 CarbonylContact O-C 3.57Å; L993-C998 VanDerWaalsContact O-CA 3.26Å; L993-C998 WeakPolarHBondContact O-CA 3.45Å; L993-C998 WeakPolarHBondContact O-CB 3.44Å; L993-C998 PolarHBondContact O-N 3.48Å; E996-C998 PolarHBondContact O-N 2.75Å; E996-C998 PolarHBondContact O-SG 3.07Å; E996-C998 VanDerWaalsContact O-SG 3.42Å
999	L	88.5	Confident	88.9	Confident	4 Å²	4	60.1 Å²	60.1	2%	0.021	32%	0.321	C	S	.	.	S	Bend	trans	-132.7	155.4	174.6	-108.7	89.1	0	0	0	111.3	L968 L993 L994 H1003 V1004 V1007	L968-L999 HydrophobicContact CD2-CD1 3.53Å; L993-L999 HydrophobicContact CB-CD1 3.59Å; L993-L999 HydrophobicContact CD1-CD1 4Å; L993-L999 HydrophobicContact CG-CD1 4.43Å; L993-L999 PolarHBondContact O-N 3.49Å; L993-L999 VanDerWaalsContact O-N 3.14Å; L994-L999 HydrophobicContact CB-CB 4.42Å; L994-L999 HydrophobicContact CD1-CB 4.35Å; L999-H1003 HydrophobicContact CD2-CB 3.79Å; L999-H1003 HydrophobicContact CG-CB 4.05Å; L999-V1004 HydrophobicContact CD2-CB 4.39Å; L999-V1004 HydrophobicContact CD2-CG2 3.94Å; L999-V1007 HydrophobicContact CD1-CG1 4.28Å; L999-V1007 HydrophobicContact CD1-CG2 4.17Å; L999-V1007 HydrophobicContact CD2-CB 4.08Å; L999-V1007 HydrophobicContact CD2-CG2 4Å; L999-V1007 HydrophobicContact CG-CG2 4.4Å
1000	L	86.8	Confident	88.9	Confident	87 Å²	87	59.6 Å²	59.6	46%	0.455	32%	0.318	S	S	.	.			trans	-91	151.2	156	-72.9	167.2	0	0	0	109.3	V1002 H1003	L1000-V1002 HydrophobicContact CB-CG1 4.1Å; L1000-V1002 PolarHBondContact O-N 3.46Å; L1000-H1003 PolarHBondContact O-N 3.46Å
1001	K	84.4	Confident	89	Confident	179 Å²	179	59.6 Å²	59.6	78%	0.778	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-50.3	-36.1	177.5	-70.2	-173.6	176.2	-177.1	0	113.5	L994 H1003 V1004	L994-K1001 HydrophobicContact CD1-CG 3.91Å; L994-K1001 HydrophobicContact CD2-CG 4.22Å; K1001-H1003 PolarHBondContact O-N 3.16Å; K1001-V1004 WeakPolarHBondContact O-CG2 3.24Å; K1001-V1004 PolarHBondContact O-N 2.68Å
1002	V	83.3	Confident	89.1	Confident	97 Å²	97	57 Å²	57	59%	0.588	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-69.2	-14.4	179	70.8	0	0	0	0	114.3	L1000 L1034	L1000-V1002 HydrophobicContact CB-CG1 4.1Å; L1000-V1002 PolarHBondContact O-N 3.46Å; V1002-L1034 HydrophobicContact CG2-CD2 4.18Å
1003	H	87.4	Confident	89	Confident	11 Å²	11	54.8 Å²	54.8	5%	0.051	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-95.9	-8.8	178.4	-60	162.1	0	0	0	113.9	H972 L999 L1000 K1001 H1005 I1006 V1007	H972-H1003 AromaticContact CE1-CE1 3.67Å; H972-H1003 AromaticContact CE1-ND1 3.71Å; L999-H1003 HydrophobicContact CD2-CB 3.79Å; L999-H1003 HydrophobicContact CG-CB 4.05Å; L1000-H1003 PolarHBondContact O-N 3.46Å; K1001-H1003 PolarHBondContact O-N 3.16Å; H1003-H1005 PolarHBondContact O-N 3.02Å; H1003-I1006 PolarHBondContact O-N 2.76Å; H1003-V1007 PolarHBondContact O-N 3.02Å
1004	V	88.7	Confident	88.8	Confident	18 Å²	18	54.5 Å²	54.5	11%	0.109	30%	0.299	C	S	.	.	H	α-helix	trans	-57.3	-58.3	-169.1	174.6	0	0	0	0	111.5	A990 L994 L999 K1001 I1006 V1007 E1008	A990-V1004 HydrophobicContact CB-CG1 4.15Å; L994-V1004 HydrophobicContact CD1-CG2 4.41Å; L994-V1004 HydrophobicContact CD2-CG2 4.08Å; L999-V1004 HydrophobicContact CD2-CB 4.39Å; L999-V1004 HydrophobicContact CD2-CG2 3.94Å; K1001-V1004 WeakPolarHBondContact O-CG2 3.24Å; K1001-V1004 PolarHBondContact O-N 2.68Å; V1004-I1006 PolarHBondContact O-N 3.05Å; V1004-V1007 PolarHBondContact O-N 2.8Å; V1004-E1008 HydrophobicContact CG1-CG 4.34Å; V1004-E1008 WeakPolarHBondContact O-CG 3.45Å; V1004-E1008 PolarHBondContact O-N 2.79Å
1005	H	87.3	Confident	88.7	Confident	145 Å²	145	53.4 Å²	53.4	67%	0.671	29%	0.293	S	S	*	.	H	α-helix	trans	-62.6	-27.4	-179	-60.8	-40.7	0	0	0	114.2	H1003 E1008 A1009	H1003-H1005 PolarHBondContact O-N 3.02Å; H1005-E1008 WeakPolarHBondContact CA-OE2 3.09Å; H1005-E1008 IonicContact CE1-OE2 3.68Å; H1005-E1008 IonicContact CG-OE2 3.73Å; H1005-E1008 IonicContact ND1-OE2 3.62Å; H1005-E1008 PolarHBondContact ND1-OE2 2.81Å; H1005-A1009 WeakPolarHBondContact O-CB 3.49Å; H1005-A1009 PolarHBondContact O-N 3.1Å
1006	I	89.5	Confident	88.5	Confident	10 Å²	10	55.8 Å²	55.8	5%	0.051	29%	0.289	C	S	.	.	H	α-helix	trans	-70.4	-42.9	175	-66.5	170.6	0	0	0	110.4	V948 H1003 V1004 A1009 Q1010 T1032 L1034 P1042	V948-I1006 HydrophobicContact CB-CG2 3.95Å; V948-I1006 HydrophobicContact CG1-CG2 4.03Å; V948-I1006 HydrophobicContact CG2-CG2 4.34Å; H1003-I1006 PolarHBondContact O-N 2.76Å; V1004-I1006 PolarHBondContact O-N 3.05Å; I1006-A1009 PolarHBondContact O-N 3.07Å; I1006-Q1010 WeakPolarHBondContact O-CB 3.34Å; I1006-Q1010 WeakPolarHBondContact O-CG 3.46Å; I1006-Q1010 PolarHBondContact O-N 2.94Å; I1006-T1032 HydrophobicContact CD1-CG2 4.17Å; I1006-T1032 HydrophobicContact CG1-CG2 4.21Å; I1006-T1032 HydrophobicContact CG2-CG2 3.75Å; I1006-L1034 HydrophobicContact CD1-CD1 3.8Å; I1006-L1034 HydrophobicContact CD1-CD2 3.57Å; I1006-L1034 HydrophobicContact CD1-CG 3.52Å; I1006-P1042 HydrophobicContact CG1-CB 4.36Å; I1006-P1042 HydrophobicContact CG1-CG 4.12Å
1007	V	92	Very high	88.3	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-73.6	-34.2	179.2	170.5	0	0	0	0	111.3	V948 M950 L968 A990 L993 L999 H1003 V1004 L1011	V948-V1007 HydrophobicContact CG1-CG2 3.99Å; M950-V1007 HydrophobicContact CE-CB 4.48Å; M950-V1007 HydrophobicContact CE-CG1 3.88Å; L968-V1007 HydrophobicContact CD1-CG2 3.87Å; L968-V1007 HydrophobicContact CD2-CG1 4.3Å; L968-V1007 HydrophobicContact CD2-CG2 3.99Å; A990-V1007 HydrophobicContact CB-CG1 4.34Å; L993-V1007 HydrophobicContact CD1-CG1 4.39Å; L999-V1007 HydrophobicContact CD1-CG1 4.28Å; L999-V1007 HydrophobicContact CD1-CG2 4.17Å; L999-V1007 HydrophobicContact CD2-CB 4.08Å; L999-V1007 HydrophobicContact CD2-CG2 4Å; L999-V1007 HydrophobicContact CG-CG2 4.4Å; H1003-V1007 PolarHBondContact O-N 3.02Å; V1004-V1007 PolarHBondContact O-N 2.8Å; V1007-L1011 HydrophobicContact CG1-CD1 4.02Å; V1007-L1011 VanDerWaalsContact O-CB 3.3Å; V1007-L1011 WeakPolarHBondContact O-CB 3.3Å; V1007-L1011 WeakPolarHBondContact O-CD1 3.43Å; V1007-L1011 WeakPolarHBondContact O-CG 3.35Å; V1007-L1011 PolarHBondContact O-N 2.79Å
1008	E	92.8	Very high	88.1	Confident	46 Å²	46	46.5 Å²	46.5	22%	0.215	24%	0.243	C	C	.	.	H	α-helix	trans	-59.5	-46.5	168.9	-70.5	177.9	132.3	0	0	111.8	P986 C987 A990 V1004 H1005 L1011 G1012	P986-E1008 HydrophobicContact CB-CB 4.45Å; C987-E1008 WeakPolarHBondContact CA-OE1 3.34Å; C987-E1008 WeakPolarHBondContact CB-OE1 3.49Å; A990-E1008 HydrophobicContact CB-CG 3.63Å; V1004-E1008 HydrophobicContact CG1-CG 4.34Å; V1004-E1008 WeakPolarHBondContact O-CG 3.45Å; V1004-E1008 PolarHBondContact O-N 2.79Å; H1005-E1008 WeakPolarHBondContact CA-OE2 3.09Å; H1005-E1008 IonicContact CE1-OE2 3.68Å; H1005-E1008 IonicContact CG-OE2 3.73Å; H1005-E1008 IonicContact ND1-OE2 3.62Å; H1005-E1008 PolarHBondContact ND1-OE2 2.81Å; E1008-L1011 PolarHBondContact O-N 3Å; E1008-G1012 PolarHBondContact O-N 2.86Å
1009	A	90.3	Very high	87.9	Confident	45 Å²	45	51.6 Å²	51.6	37%	0.372	27%	0.27	S	S	.	.	H	α-helix	trans	-68.5	-42.1	179.5	0	0	0	0	0	112.5	H1005 I1006 L1011 G1012 E1013 I1044	H1005-A1009 WeakPolarHBondContact O-CB 3.49Å; H1005-A1009 PolarHBondContact O-N 3.1Å; I1006-A1009 PolarHBondContact O-N 3.07Å; A1009-L1011 PolarHBondContact O-N 3.25Å; A1009-G1012 WeakPolarHBondContact O-CA 3.42Å; A1009-G1012 PolarHBondContact O-N 3.31Å; A1009-G1012 VanDerWaalsContact O-N 3.15Å; A1009-E1013 PolarHBondContact O-N 2.98Å; A1009-E1013 VanDerWaalsContact O-N 3.09Å; A1009-I1044 HydrophobicContact CB-CD1 3.91Å
1010	Q	92.3	Very high	87.3	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-40.4	173.7	-73.3	179.9	-0.3	0	0	111.8	V948 M950 I1006 G1012 E1013 V1014 L1030 T1032 I1044	V948-Q1010 PolarHBondContact O-NE2 3.22Å; M950-Q1010 HydrophobicContact CB-CB 4.47Å; M950-Q1010 HydrophobicContact CE-CB 3.66Å; M950-Q1010 HydrophobicContact SD-CB 4.12Å; I1006-Q1010 WeakPolarHBondContact O-CB 3.34Å; I1006-Q1010 WeakPolarHBondContact O-CG 3.46Å; I1006-Q1010 PolarHBondContact O-N 2.94Å; Q1010-G1012 VanDerWaalsContact C-N 3.31Å; Q1010-G1012 PolarHBondContact O-N 3.45Å; Q1010-E1013 PolarHBondContact O-N 2.78Å; Q1010-V1014 WeakPolarHBondContact O-CG2 3.39Å; Q1010-V1014 PolarHBondContact O-N 3.4Å; Q1010-L1030 HydrophobicContact CB-CD1 4.06Å; Q1010-L1030 HydrophobicContact CG-CB 4.22Å; Q1010-L1030 HydrophobicContact CG-CD1 4.39Å; Q1010-L1030 VanDerWaalsContact O-CD1 3.27Å; Q1010-L1030 WeakPolarHBondContact O-CD1 3.43Å; Q1010-T1032 PolarHBondContact NE2-OG1 2.9Å; Q1010-I1044 HydrophobicContact CG-CD1 4.2Å; Q1010-I1044 HydrophobicContact CG-CG1 4.48Å
1011	L	93.8	Very high	86.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-63.5	-35.7	172.4	-82.8	163.4	0	0	0	112.5	M950 F977 F979 P986 I989 V1007 E1008 A1009 V1014 I1015	M950-L1011 HydrophobicContact CE-CG 4.06Å; M950-L1011 HydrophobicContact SD-CD2 4.3Å; M950-L1011 HydrophobicContact SD-CG 4.24Å; F977-L1011 HydrophobicContact CE2-CD2 4.01Å; F977-L1011 HydrophobicContact CZ-CD2 4.09Å; F979-L1011 HydrophobicContact CD1-CD2 4.24Å; F979-L1011 HydrophobicContact CE1-CD2 3.66Å; F979-L1011 HydrophobicContact CE2-CD2 4.19Å; F979-L1011 HydrophobicContact CZ-CD2 3.62Å; P986-L1011 HydrophobicContact CB-CB 3.82Å; P986-L1011 HydrophobicContact CB-CD1 4.47Å; P986-L1011 HydrophobicContact CG-CB 4.12Å; I989-L1011 HydrophobicContact CB-CD1 3.74Å; I989-L1011 HydrophobicContact CD1-CD1 4.06Å; I989-L1011 HydrophobicContact CD1-CD2 3.94Å; I989-L1011 HydrophobicContact CG2-CD1 3.68Å; V1007-L1011 HydrophobicContact CG1-CD1 4.02Å; V1007-L1011 VanDerWaalsContact O-CB 3.3Å; V1007-L1011 WeakPolarHBondContact O-CB 3.3Å; V1007-L1011 WeakPolarHBondContact O-CD1 3.43Å; V1007-L1011 WeakPolarHBondContact O-CG 3.35Å; V1007-L1011 PolarHBondContact O-N 2.79Å; E1008-L1011 PolarHBondContact O-N 3Å; A1009-L1011 PolarHBondContact O-N 3.25Å; L1011-V1014 PolarHBondContact O-N 3.2Å; L1011-I1015 VanDerWaalsContact O-CG1 3.3Å; L1011-I1015 WeakPolarHBondContact O-CG1 3.43Å; L1011-I1015 PolarHBondContact O-N 2.84Å
1012	G	91.5	Very high	85.2	Confident	30 Å²	30	47.3 Å²	47.3	31%	0.309	27%	0.268	S	S	.	.	H	α-helix	trans	-57	-50.1	171.5	0	0	0	0	0	112.3	E1008 A1009 Q1010 I1015 Q1016	E1008-G1012 PolarHBondContact O-N 2.86Å; A1009-G1012 WeakPolarHBondContact O-CA 3.42Å; A1009-G1012 PolarHBondContact O-N 3.31Å; A1009-G1012 VanDerWaalsContact O-N 3.15Å; Q1010-G1012 VanDerWaalsContact C-N 3.31Å; Q1010-G1012 PolarHBondContact O-N 3.45Å; G1012-I1015 PolarHBondContact O-N 2.8Å; G1012-Q1016 WeakPolarHBondContact O-CB 3.39Å; G1012-Q1016 PolarHBondContact O-N 2.67Å
1013	E	88.8	Confident	84.1	Confident	72 Å²	72	49.6 Å²	49.6	34%	0.336	27%	0.27	S	S	.	.	H	α-helix	trans	-63.1	-42.2	174.4	-80.5	-160.4	175.9	0	0	112.5	A1009 Q1010 I1015 Q1016 L1017 L1030 I1044	A1009-E1013 PolarHBondContact O-N 2.98Å; A1009-E1013 VanDerWaalsContact O-N 3.09Å; Q1010-E1013 PolarHBondContact O-N 2.78Å; E1013-I1015 PolarHBondContact O-N 2.84Å; E1013-Q1016 PolarHBondContact O-N 2.93Å; E1013-L1017 VanDerWaalsContact O-CB 3.29Å; E1013-L1017 WeakPolarHBondContact O-CB 3.25Å; E1013-L1017 PolarHBondContact O-N 2.8Å; E1013-L1030 HydrophobicContact CB-CD1 3.78Å; E1013-L1030 VanDerWaalsContact OE2-CD2 3.29Å; E1013-L1030 WeakPolarHBondContact OE2-CD2 3.3Å; E1013-I1044 HydrophobicContact CG-CD1 4.27Å; E1013-I1044 WeakPolarHBondContact OE2-CG2 3.2Å
1014	V	89.2	Confident	82.9	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	30%	0.297	C	S	.	.	H	α-helix	trans	-58.8	-46	176.7	174.3	0	0	0	0	111.3	M950 I952 V964 F979 Q1010 L1011 Q1016 L1017 I1018 L1030	M950-V1014 HydrophobicContact SD-CG2 3.92Å; I952-V1014 HydrophobicContact CD1-CB 4.38Å; I952-V1014 HydrophobicContact CD1-CG1 3.85Å; I952-V1014 HydrophobicContact CD1-CG2 4.07Å; I952-V1014 HydrophobicContact CG1-CG1 4.05Å; I952-V1014 HydrophobicContact CG1-CG2 4.05Å; V964-V1014 HydrophobicContact CG1-CG1 3.89Å; F979-V1014 HydrophobicContact CE1-CG1 4.38Å; F979-V1014 HydrophobicContact CZ-CB 4.48Å; F979-V1014 HydrophobicContact CZ-CG1 3.8Å; Q1010-V1014 WeakPolarHBondContact O-CG2 3.39Å; Q1010-V1014 PolarHBondContact O-N 3.4Å; L1011-V1014 PolarHBondContact O-N 3.2Å; V1014-Q1016 VanDerWaalsContact C-N 3.35Å; V1014-Q1016 PolarHBondContact O-N 2.96Å; V1014-L1017 PolarHBondContact O-N 2.87Å; V1014-I1018 HydrophobicContact CG1-CG1 4.23Å; V1014-I1018 WeakPolarHBondContact O-CB 3.26Å; V1014-I1018 VanDerWaalsContact O-CG1 3.24Å; V1014-I1018 WeakPolarHBondContact O-CG1 3.33Å; V1014-I1018 PolarHBondContact O-N 3.27Å; V1014-L1030 HydrophobicContact CG2-CD1 3.79Å
1015	I	88.7	Confident	82	Confident	26 Å²	26	54.9 Å²	54.9	13%	0.133	29%	0.292	C	S	.	.	H	α-helix	trans	-60.9	-45.6	176.7	-69.8	170.2	0	0	0	110.3	F979 P981 P986 L1011 G1012 E1013 L1017 N1019	F979-I1015 HydrophobicContact CE2-CD1 4.23Å; F979-I1015 HydrophobicContact CE2-CG1 3.78Å; F979-I1015 HydrophobicContact CZ-CG1 4.4Å; P981-I1015 HydrophobicContact CB-CB 4.46Å; P981-I1015 HydrophobicContact CB-CG1 3.9Å; P981-I1015 HydrophobicContact CB-CG2 4.28Å; P986-I1015 HydrophobicContact CG-CD1 3.71Å; L1011-I1015 VanDerWaalsContact O-CG1 3.3Å; L1011-I1015 WeakPolarHBondContact O-CG1 3.43Å; L1011-I1015 PolarHBondContact O-N 2.84Å; G1012-I1015 PolarHBondContact O-N 2.8Å; E1013-I1015 PolarHBondContact O-N 2.84Å; I1015-L1017 VanDerWaalsContact C-N 3.33Å; I1015-L1017 PolarHBondContact O-N 2.79Å; I1015-N1019 WeakPolarHBondContact CG2-ND2 3.05Å; I1015-N1019 WeakPolarHBondContact O-CB 3.4Å; I1015-N1019 PolarHBondContact O-N 2.67Å; I1015-N1019 PolarHBondContact O-ND2 2.6Å
1016	Q	85.1	Confident	81.6	Confident	137 Å²	137	50.9 Å²	50.9	64%	0.64	28%	0.277	S	S	*	.	H	α-helix	trans	-64.2	-37.4	179.3	-165.6	170.5	18	0	0	112.3	G1012 E1013 V1014 S1020	G1012-Q1016 WeakPolarHBondContact O-CB 3.39Å; G1012-Q1016 PolarHBondContact O-N 2.67Å; E1013-Q1016 PolarHBondContact O-N 2.93Å; V1014-Q1016 VanDerWaalsContact C-N 3.35Å; V1014-Q1016 PolarHBondContact O-N 2.96Å; Q1016-S1020 WeakPolarHBondContact O-CB 3.48Å; Q1016-S1020 PolarHBondContact O-N 3.48Å; Q1016-S1020 VanDerWaalsContact O-N 3.09Å; Q1016-S1020 PolarHBondContact O-OG 2.86Å
1017	L	84.8	Confident	81.2	Confident	49 Å²	49	52 Å²	52	26%	0.257	29%	0.291	S	S	.	.	H	α-helix	trans	-68.8	-47.3	178.9	-154.4	75.6	0	0	0	111.8	I952 E1013 V1014 I1015 S1020 D1021 T1028 M1048	I952-L1017 HydrophobicContact CD1-CD2 3.91Å; E1013-L1017 VanDerWaalsContact O-CB 3.29Å; E1013-L1017 WeakPolarHBondContact O-CB 3.25Å; E1013-L1017 PolarHBondContact O-N 2.8Å; V1014-L1017 PolarHBondContact O-N 2.87Å; I1015-L1017 VanDerWaalsContact C-N 3.33Å; I1015-L1017 PolarHBondContact O-N 2.79Å; L1017-S1020 PolarHBondContact O-N 3.27Å; L1017-D1021 PolarHBondContact O-N 2.72Å; L1017-D1021 VanDerWaalsContact O-N 3.11Å; L1017-T1028 HydrophobicContact CD2-CG2 3.82Å; L1017-M1048 HydrophobicContact CD1-CE 3.8Å; L1017-M1048 HydrophobicContact CD2-CE 4.15Å; L1017-M1048 HydrophobicContact CG-CE 4.38Å
1018	I	81.7	Confident	81	Confident	14 Å²	14	52 Å²	52	7%	0.072	29%	0.291	C	S	.	.	H	α-helix	trans	-64.9	-41.1	177.5	-65.2	-73.3	0	0	0	111	I952 C955 V964 P981 V1014 S1020 G1022	I952-I1018 HydrophobicContact CG2-CD1 4.42Å; C955-I1018 HydrophobicContact CB-CD1 4.36Å; V964-I1018 HydrophobicContact CG1-CD1 4.25Å; V964-I1018 HydrophobicContact CG1-CG1 4.2Å; V964-I1018 HydrophobicContact CG2-CB 4.36Å; V964-I1018 HydrophobicContact CG2-CD1 4.05Å; V964-I1018 HydrophobicContact CG2-CG1 3.84Å; V964-I1018 HydrophobicContact CG2-CG2 3.89Å; P981-I1018 HydrophobicContact CG-CG2 4.21Å; V1014-I1018 HydrophobicContact CG1-CG1 4.23Å; V1014-I1018 WeakPolarHBondContact O-CB 3.26Å; V1014-I1018 VanDerWaalsContact O-CG1 3.24Å; V1014-I1018 WeakPolarHBondContact O-CG1 3.33Å; V1014-I1018 PolarHBondContact O-N 3.27Å; I1018-S1020 PolarHBondContact O-N 3.31Å; I1018-G1022 WeakPolarHBondContact O-CA 3.37Å; I1018-G1022 PolarHBondContact O-N 3Å
1019	N	79.8	Confident	80.9	Confident	112 Å²	112	53.6 Å²	53.6	60%	0.599	30%	0.298	S	S	*	.	H	α-helix	trans	-70.9	-17.4	176.8	-68.9	-8.9	0	0	0	113.3	I1015	I1015-N1019 WeakPolarHBondContact CG2-ND2 3.05Å; I1015-N1019 WeakPolarHBondContact O-CB 3.4Å; I1015-N1019 PolarHBondContact O-N 2.67Å; I1015-N1019 PolarHBondContact O-ND2 2.6Å
1020	S	74.7	Confident	80.9	Confident	97 Å²	97	51.7 Å²	51.7	68%	0.678	28%	0.281	S	S	*	.	H	α-helix	trans	-87.4	-45.4	177.5	-61.7	0	0	0	0	112.4	Q1016 L1017 I1018	Q1016-S1020 WeakPolarHBondContact O-CB 3.48Å; Q1016-S1020 PolarHBondContact O-N 3.48Å; Q1016-S1020 VanDerWaalsContact O-N 3.09Å; Q1016-S1020 PolarHBondContact O-OG 2.86Å; L1017-S1020 PolarHBondContact O-N 3.27Å; I1018-S1020 PolarHBondContact O-N 3.31Å
1021	D	66.8	Low	80.7	Confident	64 Å²	64	52.2 Å²	52.2	34%	0.342	29%	0.285	S	S	.	.			trans	-158.1	92	178.6	-163.4	-39	0	0	0	110.5	L1017 K1023 K1024	L1017-D1021 PolarHBondContact O-N 2.72Å; L1017-D1021 VanDerWaalsContact O-N 3.11Å; D1021-K1023 PolarHBondContact O-N 3.27Å; D1021-K1024 HydrophobicContact CB-CB 4.23Å; D1021-K1024 HydrophobicContact CB-CD 4.2Å; D1021-K1024 HydrophobicContact CB-CG 4.34Å; D1021-K1024 PolarHBondContact O-N 3.43Å; D1021-K1024 VanDerWaalsContact OD2-CD 3.27Å; D1021-K1024 WeakPolarHBondContact OD2-CD 3.35Å; D1021-K1024 WeakPolarHBondContact OD2-CE 3.31Å; D1021-K1024 IonicContact OD2-NZ 3.93Å; D1021-K1024 PolarHBondContact OD2-NZ 3Å
1022	G	61.5	Low	80.2	Confident	20 Å²	20	52.2 Å²	52.2	21%	0.206	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-11.8	-166.2	0	0	0	0	0	116.6	I1018	I1018-G1022 WeakPolarHBondContact O-CA 3.37Å; I1018-G1022 PolarHBondContact O-N 3Å
1023	K	60.4	Low	79.4	Confident	145 Å²	145	54.4 Å²	54.4	63%	0.63	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	-15.8	178.5	-76.8	163.2	-180	138.9	0	114.4	E957 D1021	E957-K1023 WeakPolarHBondContact OE1-CE 3.35Å; E957-K1023 IonicContact OE1-NZ 2.7Å; E957-K1023 PolarHBondContact OE1-NZ 3.41Å; E957-K1023 VanDerWaalsContact OE1-NZ 3.07Å; E957-K1023 WeakPolarHBondContact OE2-CE 3.38Å; E957-K1023 IonicContact OE2-NZ 2.65Å; E957-K1023 PolarHBondContact OE2-NZ 3.29Å; D1021-K1023 PolarHBondContact O-N 3.27Å
1024	K	61.9	Low	78.3	Confident	140 Å²	140	52.8 Å²	52.8	61%	0.609	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-15.1	176.2	-68.4	-177.9	-174	141	0	114.3	D1021	D1021-K1024 HydrophobicContact CB-CB 4.23Å; D1021-K1024 HydrophobicContact CB-CD 4.2Å; D1021-K1024 HydrophobicContact CB-CG 4.34Å; D1021-K1024 PolarHBondContact O-N 3.43Å; D1021-K1024 VanDerWaalsContact OD2-CD 3.27Å; D1021-K1024 WeakPolarHBondContact OD2-CD 3.35Å; D1021-K1024 WeakPolarHBondContact OD2-CE 3.31Å; D1021-K1024 IonicContact OD2-NZ 3.93Å; D1021-K1024 PolarHBondContact OD2-NZ 3Å
1025	G	69.4	Low	76.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.31	C	S	.	.	S	Bend	trans	-71.4	-27.9	180	0	0	0	0	0	114.5	I952 G1027 T1028	I952-G1025 WeakPolarHBondContact CD1-O 3.49Å; G1025-G1027 PolarHBondContact O-N 2.76Å; G1025-T1028 WeakPolarHBondContact O-CB 3.28Å; G1025-T1028 PolarHBondContact O-N 2.74Å; G1025-T1028 PolarHBondContact O-OG1 2.63Å
1026	V	79.2	Confident	75.1	Confident	60 Å²	60	60.8 Å²	60.8	36%	0.364	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	132.4	-172.2	-175.7	0	0	0	0	111.4	T1028 P1049	V1026-T1028 VanDerWaalsContact C-N 3.26Å; V1026-T1028 PolarHBondContact O-N 3.45Å; V1026-P1049 WeakPolarHBondContact O-CG 3.47Å
1027	G	81.3	Confident	73.1	Confident	33 Å²	33	61.7 Å²	61.7	34%	0.34	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	-4.1	-174.1	0	0	0	0	0	114.9	I952 G1025	I952-G1027 WeakPolarHBondContact O-CA 3.49Å; I952-G1027 PolarHBondContact O-N 2.84Å; G1025-G1027 PolarHBondContact O-N 2.76Å
1028	T	86.9	Confident	71.2	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.006	35%	0.353	C	S	.	.			trans	-66.4	135.1	173.9	-56	0	0	0	0	110.3	E951 I952 L1017 G1025 V1026 L1030 M1048	E951-T1028 WeakPolarHBondContact CA-O 3.47Å; I952-T1028 PolarHBondContact N-O 2.98Å; L1017-T1028 HydrophobicContact CD2-CG2 3.82Å; G1025-T1028 WeakPolarHBondContact O-CB 3.28Å; G1025-T1028 PolarHBondContact O-N 2.74Å; G1025-T1028 PolarHBondContact O-OG1 2.63Å; V1026-T1028 VanDerWaalsContact C-N 3.26Å; V1026-T1028 PolarHBondContact O-N 3.45Å; T1028-L1030 HydrophobicContact CG2-CD2 4.35Å; T1028-M1048 HydrophobicContact CG2-CG 4.01Å
1029	K	90.4	Very high	69.3	Low	80 Å²	80	69 Å²	69	35%	0.348	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	106.6	-174.5	-162.2	160	-171.8	157.2	0	110.5	V949 M950 E951 V1047	V949-K1029 HydrophobicContact CG1-CD 4.2Å; V949-K1029 VanDerWaalsContact CG1-CE 3.42Å; V949-K1029 HydrophobicContact CG1-CG 3.73Å; M950-K1029 CarbonylContact O-C 3.48Å; M950-K1029 WeakPolarHBondContact O-CA 3.35Å; E951-K1029 HydrophobicContact CB-CG 4.35Å; E951-K1029 HydrophobicContact CG-CD 4.39Å; E951-K1029 HydrophobicContact CG-CG 4.44Å; E951-K1029 WeakPolarHBondContact OE2-CD 3.16Å; E951-K1029 WeakPolarHBondContact OE2-CE 3.27Å; E951-K1029 IonicContact OE2-NZ 3.79Å; E951-K1029 PolarHBondContact OE2-NZ 3.39Å; K1029-V1047 PolarHBondContact N-O 2.71Å; K1029-V1047 PolarHBondContact O-N 3.15Å
1030	L	90.1	Very high	67.4	Low	4 Å²	4	70.9 Å²	70.9	2%	0.021	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	140.3	174.6	-55.9	-175.6	0	0	0	109.8	V949 M950 Q1010 E1013 V1014 T1028 I1044 A1046	V949-L1030 WeakPolarHBondContact CA-O 3.24Å; V949-L1030 WeakPolarHBondContact CG1-O 3.38Å; M950-L1030 HydrophobicContact CB-CB 4.45Å; M950-L1030 PolarHBondContact N-O 2.69Å; M950-L1030 PolarHBondContact O-N 2.65Å; Q1010-L1030 HydrophobicContact CB-CD1 4.06Å; Q1010-L1030 HydrophobicContact CG-CB 4.22Å; Q1010-L1030 HydrophobicContact CG-CD1 4.39Å; Q1010-L1030 VanDerWaalsContact O-CD1 3.27Å; Q1010-L1030 WeakPolarHBondContact O-CD1 3.43Å; E1013-L1030 HydrophobicContact CB-CD1 3.78Å; E1013-L1030 VanDerWaalsContact OE2-CD2 3.29Å; E1013-L1030 WeakPolarHBondContact OE2-CD2 3.3Å; V1014-L1030 HydrophobicContact CG2-CD1 3.79Å; T1028-L1030 HydrophobicContact CG2-CD2 4.35Å; L1030-I1044 HydrophobicContact CB-CG2 4.22Å; L1030-I1044 HydrophobicContact CD2-CG2 4.28Å; L1030-A1046 HydrophobicContact CD2-CB 3.63Å
1031	A	88.3	Confident	66	Low	11 Å²	11	71.5 Å²	71.5	9%	0.091	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	133.5	-177.7	0	0	0	0	0	111.4	T1045	A1031-T1045 PolarHBondContact N-O 2.84Å; A1031-T1045 PolarHBondContact O-N 3.2Å
1032	T	84.4	Confident	65.5	Low	1 Å²	1	71.7 Å²	71.7	1%	0.006	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	138.1	173.8	-57.8	0	0	0	0	109.1	K947 V948 I1006 Q1010 P1042	K947-T1032 WeakPolarHBondContact CA-O 3.34Å; K947-T1032 WeakPolarHBondContact CG-O 3.39Å; V948-T1032 PolarHBondContact N-O 2.91Å; V948-T1032 PolarHBondContact O-N 2.89Å; I1006-T1032 HydrophobicContact CD1-CG2 4.17Å; I1006-T1032 HydrophobicContact CG1-CG2 4.21Å; I1006-T1032 HydrophobicContact CG2-CG2 3.75Å; Q1010-T1032 PolarHBondContact NE2-OG1 2.9Å; T1032-P1042 HydrophobicContact CG2-CB 3.73Å
1033	V	75.2	Confident	65.4	Low	75 Å²	75	76 Å²	76	46%	0.455	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123	175.3	-178.3	0	0	0	0	108.1	K947	K947-V1033 HydrophobicContact CG-CG2 4.32Å
1034	L	65.7	Low	66	Low	39 Å²	39	70.9 Å²	70.9	20%	0.204	41%	0.407	C	S	.	.			trans	-77.5	133.2	170.9	-71.7	116.5	0	0	0	110	R946 V948 V1002 I1006	R946-L1034 HydrophobicContact CB-CB 4.36Å; R946-L1034 WeakPolarHBondContact CB-O 3.46Å; R946-L1034 WeakPolarHBondContact CD-O 3.48Å; R946-L1034 PolarHBondContact O-N 3.44Å; V948-L1034 HydrophobicContact CG2-CD1 3.88Å; V1002-L1034 HydrophobicContact CG2-CD2 4.18Å; I1006-L1034 HydrophobicContact CD1-CD1 3.8Å; I1006-L1034 HydrophobicContact CD1-CD2 3.57Å; I1006-L1034 HydrophobicContact CD1-CG 3.52Å
1035	D	59.8	Low	66.7	Low	96 Å²	96	68.1 Å²	68.1	51%	0.513	40%	0.402	S	S	.	.			trans	-123.5	111.2	162.9	-148.7	-13.2	0	0	0	109.2	R946 N1037 S1038	R946-D1035 IonicContact CZ-OD1 3.48Å; R946-D1035 IonicContact NH1-OD1 2.8Å; R946-D1035 PolarHBondContact NH1-OD1 3.19Å; R946-D1035 IonicContact NH1-OD2 3.21Å; R946-D1035 IonicContact NH2-OD1 3.9Å; D1035-N1037 PolarHBondContact O-N 3.4Å; D1035-S1038 PolarHBondContact O-N 2.96Å; D1035-S1038 VanDerWaalsContact O-N 3.16Å
1036	P	50	Low	67	Low	99 Å²	99	70.9 Å²	70.9	64%	0.643	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	2.4	-167.4	29.5	-37.4	0	0	0	115
1037	N	43	Very low	66.6	Low	155 Å²	155	72.3 Å²	72.3	83%	0.829	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	0.1	176.9	-79.7	32.7	0	0	0	113.5	D1035	D1035-N1037 PolarHBondContact O-N 3.4Å
1038	S	44	Very low	65.6	Low	66 Å²	66	75.8 Å²	75.8	46%	0.462	44%	0.442	S	S	.	.			trans	-93.5	135.9	179.2	-170.4	0	0	0	0	112.2	D1035 E1040	D1035-S1038 PolarHBondContact O-N 2.96Å; D1035-S1038 VanDerWaalsContact O-N 3.16Å; S1038-E1040 PolarHBondContact OG-N 3.44Å; S1038-E1040 VanDerWaalsContact OG-N 3.15Å
1039	T	42.2	Very low	63.7	Low	150 Å²	150	78.8 Å²	78.8	92%	0.92	46%	0.462	S	S	*	.			trans	-90.8	-2.8	170.4	-24.7	0	0	0	0	112.4
1040	E	41	Very low	61.2	Low	152 Å²	152	84.4 Å²	84.4	71%	0.71	49%	0.486	S	S	*	.	S	Bend	trans	-78.9	149	179.4	-64.3	-169.1	142.3	0	0	112.1	S1038	S1038-E1040 PolarHBondContact OG-N 3.44Å; S1038-E1040 VanDerWaalsContact OG-N 3.15Å
1041	P	44.6	Very low	58.6	Low	110 Å²	110	91.1 Å²	91.1	71%	0.714	52%	0.522	S	S	*	.			trans	-62.8	138.9	176.7	26.4	-34.5	0	0	0	111.3	T1043	P1041-T1043 PolarHBondContact O-N 2.9Å; P1041-T1043 VanDerWaalsContact O-N 3.15Å
1042	P	55.8	Low	55.8	Low	68 Å²	68	96.5 Å²	96.5	44%	0.442	56%	0.559	S	S	.	*			trans	-68.6	113.9	-170	26.9	-35.3	0	0	0	112.3	I1006 T1032 I1044	I1006-P1042 HydrophobicContact CG1-CB 4.36Å; I1006-P1042 HydrophobicContact CG1-CG 4.12Å; T1032-P1042 HydrophobicContact CG2-CB 3.73Å; P1042-I1044 PolarHBondContact O-N 3.13Å
1043	T	59.1	Low	53.2	Low	112 Å²	112	101.6 Å²	101.6	69%	0.687	60%	0.595	S	S	*	*			trans	-64.4	127.3	-179.2	-37.8	0	0	0	0	111.7	P1041	P1041-T1043 PolarHBondContact O-N 2.9Å; P1041-T1043 VanDerWaalsContact O-N 3.15Å
1044	I	73.2	Confident	51.1	Low	37 Å²	37	103.1 Å²	103.1	19%	0.19	62%	0.615	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-87.6	137.2	169.6	-56.2	176.5	0	0	0	108.7	A1009 Q1010 E1013 L1030 P1042	A1009-I1044 HydrophobicContact CB-CD1 3.91Å; Q1010-I1044 HydrophobicContact CG-CD1 4.2Å; Q1010-I1044 HydrophobicContact CG-CG1 4.48Å; E1013-I1044 HydrophobicContact CG-CD1 4.27Å; E1013-I1044 WeakPolarHBondContact OE2-CG2 3.2Å; L1030-I1044 HydrophobicContact CB-CG2 4.22Å; L1030-I1044 HydrophobicContact CD2-CG2 4.28Å; P1042-I1044 PolarHBondContact O-N 3.13Å
1045	T	77.5	Confident	49.3	Very low	82 Å²	82	105.8 Å²	105.8	50%	0.503	64%	0.643	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.7	112.7	171.4	-43.5	0	0	0	0	109.2	A1031	A1031-T1045 PolarHBondContact N-O 2.84Å; A1031-T1045 PolarHBondContact O-N 3.2Å
1046	A	74.9	Confident	47.8	Very low	58 Å²	58	108.3 Å²	108.3	48%	0.479	66%	0.662	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.9	138	173.5	0	0	0	0	0	111.4	L1030	L1030-A1046 HydrophobicContact CD2-CB 3.63Å
1047	V	71.3	Confident	47	Very low	90 Å²	90	108.5 Å²	108.5	55%	0.545	67%	0.672	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.1	116.9	170.7	-176.3	0	0	0	0	108.7	K1029	K1029-V1047 PolarHBondContact N-O 2.71Å; K1029-V1047 PolarHBondContact O-N 3.15Å
1048	M	60.3	Low	46.5	Very low	106 Å²	106	106.6 Å²	106.6	52%	0.522	67%	0.671	S	S	.	*			trans	-88.4	157.5	177	-75.3	-177.9	160	0	0	112.3	L1017 T1028	L1017-M1048 HydrophobicContact CD1-CE 3.8Å; L1017-M1048 HydrophobicContact CD2-CE 4.15Å; L1017-M1048 HydrophobicContact CG-CE 4.38Å; T1028-M1048 HydrophobicContact CG2-CG 4.01Å
1049	P	46.3	Very low	45.9	Very low	63 Å²	63	110.2 Å²	110.2	41%	0.409	69%	0.685	S	S	.	*			trans	-58.5	158.2	165.6	-20.2	33.5	0	0	0	111.6	V1026	V1026-P1049 WeakPolarHBondContact O-CG 3.47Å
1050	K	38.3	Very low	45.3	Very low	198 Å²	198	109.7 Å²	109.7	86%	0.861	68%	0.682	S	S	*	*			trans	-114.8	90.3	176.1	-165.6	173.1	-174.1	176.9	0	109.5	S1052	K1050-S1052 PolarHBondContact O-OG 3.24Å
1051	D	36.5	Very low	45	Very low	145 Å²	145	110.8 Å²	110.8	78%	0.775	68%	0.684	S	S	*	*			trans	-55.3	139	-175	-67	-34.8	0	0	0	112.4
1052	S	29.8	Very low	44.3	Very low	124 Å²	124	111.8 Å²	111.8	87%	0.867	69%	0.691	S	S	*	*			trans	-121.5	52.4	-173.2	-65.2	0	0	0	0	111.3	K1050	K1050-S1052 PolarHBondContact O-OG 3.24Å
1053	S	29.2	Very low	43.3	Very low	109 Å²	109	115 Å²	115	76%	0.762	70%	0.697	S	S	*	*			trans	-151.6	95.4	175.2	58.7	0	0	0	0	112.2
1054	A	30.5	Very low	42	Very low	107 Å²	107	116.7 Å²	116.7	88%	0.884	70%	0.701	S	S	*	*			trans	-153.3	117.9	166	0	0	0	0	0	110.1
1055	A	28.3	Very low	40	Very low	95 Å²	95	121.1 Å²	121.1	79%	0.785	72%	0.721	S	S	*	*			trans	-96.1	146	171.1	0	0	0	0	0	110.6
1056	T	27.6	Very low	37.9	Very low	148 Å²	148	123.8 Å²	123.8	91%	0.908	73%	0.731	S	S	*	*			trans	32.1	92.4	153	-46	0	0	0	0	118.2
1057	A	34.5	Very low	35.8	Very low	104 Å²	104	127.7 Å²	127.7	86%	0.86	74%	0.739	S	S	*	*			trans	-139.7	145.2	154.1	0	0	0	0	0	109.7
1058	S	32.1	Very low	34.1	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	74%	0.743	S	S	*	*			trans	-107.8	137.4	-159.8	59.3	0	0	0	0	115.5
1059	N	30.4	Very low	32.7	Very low	142 Å²	142	131.3 Å²	131.3	76%	0.759	76%	0.755	S	S	*	*			trans	57	108	140.6	-168.3	28	0	0	0	119.2
1060	T	29.3	Very low	32.9	Very low	139 Å²	139	133.7 Å²	133.7	85%	0.853	77%	0.771	S	S	*	*				-162.6	147	116.1	13	0	0	0	0	111
1061	K	36	Very low	33.1	Very low	175 Å²	175	129.1 Å²	129.1	76%	0.761	76%	0.761	S	S	*	*			trans	-137.6	141.6	176.7	-173	176.3	-173.7	176.4	0	108.5
1062	P	30.3	Very low	32.9	Very low	131 Å²	131	128 Å²	128	85%	0.851	76%	0.76	S	S	*	*			trans	-100.8	138.5	144.5	-16	33	0	0	0	111.7
1063	K	34.9	Very low	33.1	Very low	135 Å²	135	132 Å²	132	59%	0.587	76%	0.756	S	S	*	*			trans	-121.8	141	167	172.9	-135.2	178.1	-159.7	0	105.5	E1065	K1063-E1065 WeakPolarHBondContact CE-OE2 3.27Å; K1063-E1065 IonicContact NZ-OE1 2.84Å; K1063-E1065 PolarHBondContact NZ-OE1 3.49Å; K1063-E1065 IonicContact NZ-OE2 3.76Å; K1063-E1065 PolarHBondContact NZ-OE2 3.09Å
1064	I	31.4	Very low	33.2	Very low	148 Å²	148	133 Å²	133	76%	0.759	75%	0.753	S	S	*	*			trans	-167	121.9	143.7	-97.5	143.3	0	0	0	105.3
1065	E	31.5	Very low	33.3	Very low	131 Å²	131	132.1 Å²	132.1	61%	0.612	75%	0.746	S	S	*	*			cis	102.3	170	37.9	-177.8	159.8	-162.4	0	0	111.7	K1063	K1063-E1065 WeakPolarHBondContact CE-OE2 3.27Å; K1063-E1065 IonicContact NZ-OE1 2.84Å; K1063-E1065 PolarHBondContact NZ-OE1 3.49Å; K1063-E1065 IonicContact NZ-OE2 3.76Å; K1063-E1065 PolarHBondContact NZ-OE2 3.09Å
1066	I	32.5	Very low	33.5	Very low	138 Å²	138	132.6 Å²	132.6	71%	0.708	74%	0.743	S	S	*	*			trans	95.4	119.7	178.4	-58.1	170.3	0	0	0	113
1067	E	31	Very low	33.6	Very low	139 Å²	139	133.3 Å²	133.3	65%	0.65	74%	0.736	S	S	*	*			cis	-163.4	174.3	-2.7	-125.6	-166.4	138.5	0	0	116.1
1068	K	35.7	Very low	33.5	Very low	144 Å²	144	135.8 Å²	135.8	63%	0.626	73%	0.73	S	S	*	*			trans	82.5	85.8	142.1	-84.9	172.2	170.5	83.9	0	123.8
1069	T	32	Very low	33.8	Very low	129 Å²	129	133.4 Å²	133.4	79%	0.791	71%	0.712	S	S	*	*				89.5	147.7	111.1	45.6	0	0	0	0	123.8
1070	P	49.5	Very low	34	Very low	113 Å²	113	131.9 Å²	131.9	73%	0.734	70%	0.703	S	S	*	*			trans	-118.9	-151.1	-170.6	34.6	-9.9	0	0	0	111.8
1071	P	41.7	Very low	34.1	Very low	102 Å²	102	131.1 Å²	131.1	66%	0.662	69%	0.694	S	S	*	*				-158.5	158.5	80	42.9	-22.5	0	0	0	119.9
1072	T	32.2	Very low	33.9	Very low	121 Å²	121	128.1 Å²	128.1	74%	0.742	69%	0.69	S	S	*	*			trans	61.3	156.4	144.4	52.5	0	0	0	0	121.3
1073	R	34.1	Very low	33.9	Very low	209 Å²	209	129.4 Å²	129.4	79%	0.789	69%	0.685	S	S	*	*			cis	-157.3	144.4	18.4	-152.6	152	-175.6	167.7	3.3	116.2
1074	D	31	Very low	33.6	Very low	130 Å²	130	128.4 Å²	128.4	70%	0.695	69%	0.69	S	S	*	*			trans	27.3	154.3	144	-51	-25.7	0	0	0	121.9
1075	A	33.7	Very low	33.5	Very low	88 Å²	88	126 Å²	126	73%	0.727	68%	0.682	S	S	*	*			cis	177.6	171.3	-9.8	0	0	0	0	0	108.4
1076	S	31.9	Very low	33.3	Very low	104 Å²	104	126.7 Å²	126.7	73%	0.727	69%	0.69	S	S	*	*			cis	-172.6	164.8	-27.1	-85.6	0	0	0	0	111.3
1077	Q	29.5	Very low	33.1	Very low	164 Å²	164	125.3 Å²	125.3	77%	0.766	69%	0.688	S	S	*	*			trans	70.4	111.2	149.2	-79.7	179.1	-56.1	0	0	124.9
1078	E	31.9	Very low	33.1	Very low	156 Å²	156	129.6 Å²	129.6	73%	0.729	70%	0.698	S	S	*	*				61.3	166.9	101.5	-74.3	-149	112.9	0	0	123.8
1079	P	38.7	Very low	32.7	Very low	64 Å²	64	131.2 Å²	131.2	42%	0.416	71%	0.705	S	S	.	*			cis	-148.2	-177.6	-47.3	44.8	-27	0	0	0	116.9
1080	N	34.9	Very low	32.6	Very low	109 Å²	109	129.7 Å²	129.7	58%	0.583	70%	0.695	S	S	*	*			trans	73.4	134.9	141.1	-70.5	-20.6	0	0	0	126.4
1081	N	32.2	Very low	31.6	Very low	124 Å²	124	129.1 Å²	129.1	66%	0.663	69%	0.694	S	S	*	*			trans	86.8	105.7	132.7	-95	3.9	0	0	0	126.4
1082	V	32.1	Very low	30.9	Very low	112 Å²	112	131.4 Å²	131.4	68%	0.679	70%	0.696	S	S	*	*				99.1	145.4	101.6	96.8	0	0	0	0	123.5
1083	Q	29.3	Very low	30.7	Very low	158 Å²	158	133 Å²	133	74%	0.738	70%	0.695	S	S	*	*			trans	90.5	117.8	149.7	-81.4	-165.5	35.4	0	0	123.3
1084	V	28	Very low	30.5	Very low	114 Å²	114	128.7 Å²	128.7	69%	0.691	70%	0.697	S	S	*	*				67	136.9	116.2	168.2	0	0	0	0	119.5
1085	T	29.8	Very low	30.2	Very low	98 Å²	98	130.3 Å²	130.3	60%	0.601	71%	0.706	S	S	*	*			cis	-167.9	160	-12	33.2	0	0	0	0	111.5
1086	N	26.9	Very low	30.1	Very low	144 Å²	144	130.5 Å²	130.5	77%	0.77	71%	0.707	S	S	*	*			trans	63.9	157.5	140.7	-65	-16.6	0	0	0	122.7
1087	V	28.8	Very low	30	Very low	110 Å²	110	132.9 Å²	132.9	67%	0.667	71%	0.707	S	S	*	*			trans	122.9	95.9	136.2	-174.3	0	0	0	0	116.3
1088	R	30.3	Very low	30.1	Very low	228 Å²	228	128.8 Å²	128.8	86%	0.86	70%	0.696	S	S	*	*			trans	69.3	164.6	144.3	-71.1	178	179.8	144.6	-0.5	118.9
1089	K	29.2	Very low	29.9	Very low	178 Å²	178	123.8 Å²	123.8	77%	0.774	68%	0.676	S	S	*	*			cis	-179.9	167.2	-24.7	-177.1	-160.2	169.7	-158.4	0	107.4
1090	V	28.1	Very low	29.6	Very low	97 Å²	97	129.6 Å²	129.6	59%	0.588	70%	0.698	S	S	*	*			trans	93.2	92.4	157.6	-166.5	0	0	0	0	116.6
1091	S	29.3	Very low	29.3	Very low	101 Å²	101	128.6 Å²	128.6	71%	0.706	70%	0.699	S	S	*	*				42.9	157.3	108.9	-38.3	0	0	0	0	123.9
1092	Q	27.9	Very low	29.2	Very low	150 Å²	150	130.3 Å²	130.3	70%	0.701	71%	0.707	S	S	*	*			trans	97	103.2	148.4	-76	174.8	-96.2	0	0	120.5
1093	E	27.1	Very low	29.2	Very low	155 Å²	155	130.5 Å²	130.5	72%	0.724	71%	0.711	S	S	*	*				79	151.8	118.8	-71.1	174.4	136.4	0	0	123.1
1094	S	30.7	Very low	29.7	Very low	119 Å²	119	134.3 Å²	134.3	83%	0.832	72%	0.718	S	S	*	*			trans	84.3	128.9	156.3	67.7	0	0	0	0	120.3
1095	N	24.7	Very low	30.2	Very low	164 Å²	164	135.2 Å²	135.2	88%	0.877	73%	0.726	S	S	*	*			trans	-66.4	154.3	163.6	-47.8	-47.4	0	0	0	110.8
1096	A	31.8	Very low	30.4	Very low	92 Å²	92	134.3 Å²	134.3	76%	0.76	74%	0.736	S	S	*	*			trans	-161.6	149.6	136.5	0	0	0	0	0	110.4
1097	E	28.7	Very low	30.8	Very low	153 Å²	153	131.1 Å²	131.1	72%	0.715	74%	0.737	S	S	*	*			trans	-66.1	161.9	168.1	-53.2	107.6	100.9	0	0	112.6	I1166	E1097-I1166 HydrophobicContact CB-CG2 3.78Å; E1097-I1166 HydrophobicContact CG-CG2 4.31Å
1098	S	31	Very low	31.1	Very low	78 Å²	78	133.1 Å²	133.1	55%	0.545	74%	0.743	S	S	.	*				171.2	141.5	106.2	-160.6	0	0	0	0	114.2	T1167	S1098-T1167 WeakPolarHBondContact O-CG2 3.46Å
1099	V	29.1	Very low	31.3	Very low	51 Å²	51	129.3 Å²	129.3	31%	0.309	74%	0.738	S	S	.	*			trans	-82.8	141.9	170.4	155.9	0	0	0	0	110.8	I1166 T1167	V1099-I1166 HydrophobicContact CB-CD1 4.19Å; V1099-I1166 HydrophobicContact CB-CG1 3.87Å; V1099-I1166 HydrophobicContact CB-CG2 4.3Å; V1099-I1166 HydrophobicContact CG2-CB 4.13Å; V1099-I1166 HydrophobicContact CG2-CG1 3.82Å; V1099-I1166 HydrophobicContact CG2-CG2 4.03Å; V1099-T1167 HydrophobicContact CG2-CG2 4.16Å
1100	Q	31.4	Very low	31.5	Very low	187 Å²	187	126.6 Å²	126.6	87%	0.874	74%	0.736	S	S	*	*			trans	-152.1	168.6	143.7	-115.5	148.9	75	0	0	112.5
1101	S	28.1	Very low	31.8	Very low	87 Å²	87	130.1 Å²	130.1	61%	0.608	75%	0.748	S	S	*	*			trans	-150.4	159.7	-152.4	58.2	0	0	0	0	112.9
1102	I	30.9	Very low	31.9	Very low	160 Å²	160	130.4 Å²	130.4	82%	0.821	75%	0.75	S	S	*	*			trans	71.7	155.2	164.3	-68.9	160	0	0	0	112.4
1103	P	33.2	Very low	32.4	Very low	117 Å²	117	128.5 Å²	128.5	76%	0.76	75%	0.751	S	S	*	*			cis	-127.7	178.4	10.3	23.2	2	0	0	0	117.7
1104	R	38.2	Very low	32.6	Very low	238 Å²	238	126.6 Å²	126.6	90%	0.898	75%	0.75	S	S	*	*			trans	-81.8	151.9	156.4	-63.1	177.4	169.9	-169.7	-2.3	110.5
1105	P	38.4	Very low	32.4	Very low	133 Å²	133	127.4 Å²	127.4	86%	0.864	75%	0.745	S	S	*	*				-147.4	-177.3	91	33.6	-13.4	0	0	0	112.9
1106	G	34.3	Very low	32.7	Very low	78 Å²	78	128.2 Å²	128.2	80%	0.804	74%	0.743	S	S	*	*			cis	159.1	161.1	-7.5	0	0	0	0	0	112.4
1107	G	35.8	Very low	32.6	Very low	77 Å²	77	129.6 Å²	129.6	79%	0.794	74%	0.743	S	S	*	*			trans	97	151.5	178.3	0	0	0	0	0	114.8
1108	I	35.4	Very low	32.8	Very low	153 Å²	153	130 Å²	130	79%	0.785	75%	0.75	S	S	*	*			cis	-140	127.4	3.8	-69.5	-177.4	0	0	0	110.6
1109	I	33.2	Very low	33	Very low	147 Å²	147	131.2 Å²	131.2	75%	0.754	76%	0.758	S	S	*	*			trans	24.4	128.6	133.8	-28	171.9	0	0	0	116.6
1110	V	33.5	Very low	33.1	Very low	121 Å²	121	133 Å²	133	73%	0.733	78%	0.778	S	S	*	*				-168.9	124.1	78.9	162.4	0	0	0	0	113.8
1111	M	35.9	Very low	33.6	Very low	171 Å²	171	130 Å²	130	84%	0.842	78%	0.775	S	S	*	*			trans	45.1	129.8	139.8	-54.8	171.8	68.9	0	0	124.3
1112	S	30.8	Very low	34.2	Very low	107 Å²	107	131.2 Å²	131.2	75%	0.748	78%	0.781	S	S	*	*			trans	-81.1	177.1	149.7	-28.7	0	0	0	0	110.6
1113	P	39	Very low	34.8	Very low	110 Å²	110	128.5 Å²	128.5	71%	0.714	77%	0.773	S	S	*	*				-159.5	178.7	53	44.6	-21.3	0	0	0	120.1
1114	T	29.7	Very low	34.9	Very low	116 Å²	116	129.8 Å²	129.8	71%	0.712	78%	0.78	S	S	*	*			trans	36.4	135	144.2	56.4	0	0	0	0	126.1
1115	N	27.7	Very low	34.7	Very low	136 Å²	136	122 Å²	122	73%	0.727	77%	0.774	S	S	*	*			trans	44.6	125.5	133.2	-60.4	-0.4	0	0	0	123.2
1116	Q	31.6	Very low	34.5	Very low	180 Å²	180	120.5 Å²	120.5	84%	0.841	77%	0.772	S	S	*	*				172	116.1	116.9	-92.1	154.1	112.3	0	0	109.1
1117	T	28.1	Very low	34.6	Very low	122 Å²	122	122 Å²	122	75%	0.748	78%	0.776	S	S	*	*				62.3	98.3	86.2	61.5	0	0	0	0	116.9
1118	D	34.5	Very low	34.6	Very low	161 Å²	161	123 Å²	123	86%	0.861	78%	0.778	S	S	*	*			trans	-177.6	157.7	145.8	-108	-33.8	0	0	0	109.2
1119	S	34.6	Very low	34.6	Very low	104 Å²	104	125.4 Å²	125.4	73%	0.727	78%	0.782	S	S	*	*			cis	-157	172.6	-49.7	37.8	0	0	0	0	109.2
1120	A	31.9	Very low	35	Very low	87 Å²	87	124.1 Å²	124.1	72%	0.719	78%	0.783	S	S	*	*			trans	-82.5	164.4	-169.5	0	0	0	0	0	114.1
1121	P	40.7	Very low	35.3	Very low	125 Å²	125	123.5 Å²	123.5	81%	0.812	78%	0.784	S	S	*	*				-148.5	158.4	87.4	38.8	-22.1	0	0	0	117.5
1122	P	41.2	Very low	35.3	Very low	113 Å²	113	123.6 Å²	123.6	73%	0.734	78%	0.775	S	S	*	*			trans	-106.7	-155.2	164.5	45.1	-36.2	0	0	0	110.1
1123	P	43.9	Very low	35.5	Very low	102 Å²	102	125.7 Å²	125.7	66%	0.662	77%	0.771	S	S	*	*			cis	-130.5	-158.5	-18.8	33.1	-9.9	0	0	0	113.3
1124	T	35.5	Very low	35.4	Very low	145 Å²	145	127.2 Å²	127.2	89%	0.89	77%	0.769	S	S	*	*			trans	73.1	153.6	171.2	76.4	0	0	0	0	116.1
1125	G	34	Very low	35.6	Very low	75 Å²	75	127 Å²	127	77%	0.773	77%	0.768	S	S	*	*			cis	163.4	164.7	-4.5	0	0	0	0	0	110
1126	A	34	Very low	35.9	Very low	101 Å²	101	126.3 Å²	126.3	84%	0.835	77%	0.768	S	S	*	*			cis	-168	176.6	-12.2	0	0	0	0	0	110.6
1127	A	35.1	Very low	36	Very low	108 Å²	108	127.8 Å²	127.8	89%	0.893	77%	0.772	S	S	*	*			trans	71	151.5	176	0	0	0	0	0	117.3
1128	A	36.8	Very low	36.3	Very low	99 Å²	99	127.2 Å²	127.2	82%	0.818	77%	0.773	S	S	*	*			cis	-138.2	165.5	2.8	0	0	0	0	0	113.4
1129	K	34.2	Very low	36.3	Very low	203 Å²	203	124 Å²	124	88%	0.883	77%	0.769	S	S	*	*			trans	-122.2	157.2	177.2	-87.3	-178.8	177.1	175.2	0	109.6
1130	P	41.8	Very low	36.2	Very low	120 Å²	120	126.3 Å²	126.3	78%	0.779	77%	0.773	S	S	*	*				-136.3	172.4	78	18.1	5.8	0	0	0	112.9
1131	S	39.5	Very low	36.8	Very low	108 Å²	108	127.2 Å²	127.2	76%	0.755	77%	0.772	S	S	*	*			cis	-168.7	-164.2	-5	-103.2	0	0	0	0	106.8
1132	R	37.7	Very low	36.3	Very low	173 Å²	173	128.7 Å²	128.7	65%	0.653	77%	0.771	S	S	*	*				171.3	110.5	-53.1	-174.2	-168.7	179.1	-165.6	-2.7	105.1
1133	F	33.8	Very low	35.9	Very low	151 Å²	151	127.1 Å²	127.1	66%	0.662	77%	0.768	S	S	*	*				-171.1	146.5	88.9	-89.6	-86	0	0	0	107.2
1134	Q	37.2	Very low	35.5	Very low	143 Å²	143	128.7 Å²	128.7	67%	0.668	78%	0.776	S	S	*	*			cis	74.3	148.7	26.6	-55.8	-169.4	-29	0	0	114.8
1135	V	32.8	Very low	35.7	Very low	112 Å²	112	126.8 Å²	126.8	68%	0.679	77%	0.766	S	S	*	*			cis	-141.1	144.9	5.9	-178.7	0	0	0	0	107.8
1136	T	35	Very low	35.6	Very low	120 Å²	120	131 Å²	131	74%	0.736	77%	0.768	S	S	*	*			cis	85.4	82.7	0.1	79.7	0	0	0	0	120.7
1137	K	34.3	Very low	35.5	Very low	211 Å²	211	131.4 Å²	131.4	92%	0.917	77%	0.766	S	S	*	*			trans	-168.4	166.2	157.6	-116.2	172	-173.1	-170.7	0	117.9
1138	S	33.7	Very low	35.6	Very low	111 Å²	111	132.2 Å²	132.2	78%	0.776	76%	0.764	S	S	*	*			trans	-130.8	172.8	-178.9	49.3	0	0	0	0	112.3
1139	A	35.3	Very low	35.4	Very low	94 Å²	94	132.6 Å²	132.6	78%	0.777	76%	0.761	S	S	*	*			trans	-161.4	155.1	168.2	0	0	0	0	0	114
1140	D	31.5	Very low	35.6	Very low	151 Å²	151	131 Å²	131	81%	0.807	76%	0.761	S	S	*	*			trans	-116.4	-144.2	-172.8	-62.1	-85.8	0	0	0	112
1141	P	44.8	Very low	35.2	Very low	107 Å²	107	129.8 Å²	129.8	70%	0.695	76%	0.755	S	S	*	*				-134.6	-162.2	-91.3	42	-24.1	0	0	0	116.3
1142	I	30.3	Very low	34.9	Very low	156 Å²	156	131.4 Å²	131.4	80%	0.8	76%	0.761	S	S	*	*			trans	78.6	123.1	154.2	-71.6	166.4	0	0	0	119.7
1143	A	32.5	Very low	34.8	Very low	80 Å²	80	127 Å²	127	66%	0.661	76%	0.761	S	S	*	*				160.5	99.8	118.9	0	0	0	0	0	118.7
1144	T	34.8	Very low	34.7	Very low	135 Å²	135	125.7 Å²	125.7	83%	0.828	77%	0.765	S	S	*	*				63.4	-176.6	129.8	70.1	0	0	0	0	120.8
1145	P	40	Very low	34.6	Very low	105 Å²	105	125.3 Å²	125.3	68%	0.682	77%	0.772	S	S	*	*				-136.7	-175.8	-96.7	38.8	-17.3	0	0	0	117.3
1146	I	33	Very low	34.6	Very low	162 Å²	162	126.8 Å²	126.8	83%	0.831	78%	0.775	S	S	*	*			trans	145.7	137.2	138.1	-74.2	157.7	0	0	0	115.3
1147	S	32.4	Very low	34.8	Very low	111 Å²	111	125.9 Å²	125.9	78%	0.776	77%	0.771	S	S	*	*			trans	-61.7	162	-174.6	-38.3	0	0	0	0	119.7
1148	S	37.2	Very low	34.6	Very low	124 Å²	124	123 Å²	123	87%	0.867	76%	0.764	S	S	*	*			trans	-151.4	155.3	130.7	59.5	0	0	0	0	111
1149	S	32.4	Very low	34.7	Very low	108 Å²	108	124.3 Å²	124.3	76%	0.755	77%	0.767	S	S	*	*			trans	-154.9	128.6	-166.6	58.4	0	0	0	0	114.6
1150	I	37.2	Very low	34.6	Very low	169 Å²	169	123.5 Å²	123.5	87%	0.867	76%	0.76	S	S	*	*			trans	-154.8	153.4	172.2	-52.2	-179.5	0	0	0	107.3
1151	S	33.1	Very low	34.6	Very low	94 Å²	94	120.6 Å²	120.6	66%	0.657	76%	0.757	S	S	*	*				179.6	158.9	-53.1	-97.4	0	0	0	0	109.2
1152	T	34.3	Very low	34	Very low	143 Å²	143	122.1 Å²	122.1	88%	0.877	77%	0.765	S	S	*	*			trans	64.5	148.9	167.1	40	0	0	0	0	118
1153	A	34.4	Very low	34.4	Very low	79 Å²	79	120 Å²	120	65%	0.653	76%	0.762	S	S	*	*			cis	-161.2	150.4	-6.9	0	0	0	0	0	112.6
1154	T	32.2	Very low	34.4	Very low	124 Å²	124	122.4 Å²	122.4	76%	0.761	77%	0.768	S	S	*	*			trans	43.4	126.9	138.8	-38.4	0	0	0	0	119.2
1155	V	34.5	Very low	34.1	Very low	135 Å²	135	121.4 Å²	121.4	82%	0.818	76%	0.758	S	S	*	*				-153.3	156.5	72.9	164.8	0	0	0	0	112.1
1156	I	34.6	Very low	33.6	Very low	144 Å²	144	120 Å²	120	74%	0.738	74%	0.743	S	S	*	*			trans	-123.8	-166.6	-177.5	0.8	174.1	0	0	0	108.4
1157	P	39.4	Very low	33.5	Very low	100 Å²	100	115.8 Å²	115.8	65%	0.649	73%	0.726	S	S	*	*			cis	-139.1	169.2	-14.3	27.9	-3.2	0	0	0	117.7
1158	I	29.9	Very low	33.4	Very low	151 Å²	151	115.6 Å²	115.6	77%	0.774	72%	0.724	S	S	*	*			trans	31.1	125.2	130.9	-48.5	159.3	0	0	0	121.4
1159	V	35.9	Very low	33.1	Very low	139 Å²	139	117.4 Å²	117.4	84%	0.842	72%	0.719	S	S	*	*				-153.2	104.1	125.9	179.4	0	0	0	0	107.1
1160	A	32.6	Very low	33.2	Very low	76 Å²	76	117.4 Å²	117.4	63%	0.628	72%	0.716	S	S	*	*				65.6	116.3	91.7	0	0	0	0	0	114.9
1161	A	31.6	Very low	32.7	Very low	90 Å²	90	114.7 Å²	114.7	74%	0.744	71%	0.707	S	S	*	*				82.3	143.8	93.7	0	0	0	0	0	113.7
1162	T	31.5	Very low	32.4	Very low	139 Å²	139	117.3 Å²	117.3	85%	0.853	71%	0.713	S	S	*	*			cis	-158.3	171.9	11.9	-3.2	0	0	0	0	110.3
1163	P	38.9	Very low	32	Very low	113 Å²	113	116.1 Å²	116.1	73%	0.734	71%	0.705	S	S	*	*			trans	-112.5	163.7	-168.5	41.3	-34.8	0	0	0	117.1
1164	T	32.5	Very low	31.8	Very low	129 Å²	129	120.8 Å²	120.8	79%	0.791	71%	0.713	S	S	*	*			trans	-164.8	129.9	147.7	28.4	0	0	0	0	107.9
1165	N	27.8	Very low	32.1	Very low	115 Å²	115	119.4 Å²	119.4	62%	0.615	71%	0.706	S	S	*	*				67.7	128	69.7	-156.9	18.6	0	0	0	111.2
1166	I	31.5	Very low	32	Very low	74 Å²	74	120.1 Å²	120.1	38%	0.379	70%	0.704	S	S	.	*				177.2	133.8	87.5	-85.8	179.9	0	0	0	111.7	E1097 V1099	E1097-I1166 HydrophobicContact CB-CG2 3.78Å; E1097-I1166 HydrophobicContact CG-CG2 4.31Å; V1099-I1166 HydrophobicContact CB-CD1 4.19Å; V1099-I1166 HydrophobicContact CB-CG1 3.87Å; V1099-I1166 HydrophobicContact CB-CG2 4.3Å; V1099-I1166 HydrophobicContact CG2-CB 4.13Å; V1099-I1166 HydrophobicContact CG2-CG1 3.82Å; V1099-I1166 HydrophobicContact CG2-CG2 4.03Å
1167	T	29.8	Very low	32	Very low	75 Å²	75	119 Å²	119	46%	0.46	70%	0.704	S	S	.	*			trans	54.7	154.1	165.5	46.5	0	0	0	0	121.1	S1098 V1099	S1098-T1167 WeakPolarHBondContact O-CG2 3.46Å; V1099-T1167 HydrophobicContact CG2-CG2 4.16Å
1168	S	31.4	Very low	31.8	Very low	107 Å²	107	118 Å²	118	75%	0.748	70%	0.704	S	S	*	*			cis	-168.2	153.8	-18.8	50.2	0	0	0	0	112.8
1169	E	29.9	Very low	32.1	Very low	162 Å²	162	119.1 Å²	119.1	76%	0.757	71%	0.706	S	S	*	*			trans	-63	173.6	161.1	-86.4	-107.5	158.1	0	0	112.9
1170	P	34.6	Very low	31.9	Very low	107 Å²	107	118.4 Å²	118.4	70%	0.695	70%	0.702	S	S	*	*			cis	-146.5	167.4	20	45.9	-26.9	0	0	0	119.6
1171	V	27.2	Very low	31.9	Very low	112 Å²	112	122.1 Å²	122.1	68%	0.679	71%	0.709	S	S	*	*			trans	53.5	129.2	131.1	176.9	0	0	0	0	124.1
1172	I	25.7	Very low	32	Very low	150 Å²	150	122.6 Å²	122.6	77%	0.769	70%	0.703	S	S	*	*			trans	91.8	106.3	152	-79.3	166	0	0	0	123.5
1173	V	26.2	Very low	32.1	Very low	117 Å²	117	123.7 Å²	123.7	71%	0.709	70%	0.698	S	S	*	*				59.6	106.8	129.1	-173.5	0	0	0	0	124.3
1174	Q	30.5	Very low	31.8	Very low	178 Å²	178	125.9 Å²	125.9	83%	0.832	70%	0.703	S	S	*	*			trans	53.3	169	131.4	-68.9	-166.2	14.1	0	0	123.5
1175	P	38.8	Very low	31.8	Very low	94 Å²	94	123.3 Å²	123.3	61%	0.61	70%	0.695	S	S	*	*			cis	-142	-164.7	-41.4	40.8	-22.1	0	0	0	115.1
1176	I	31.5	Very low	32	Very low	151 Å²	151	124 Å²	124	77%	0.774	70%	0.704	S	S	*	*			trans	79.2	144.9	155.4	-71.4	169.1	0	0	0	118.8
1177	T	35.8	Very low	32.1	Very low	119 Å²	119	126 Å²	126	73%	0.73	72%	0.721	S	S	*	*			cis	-174.9	166.5	-23	-77.9	0	0	0	0	109.5
1178	A	34.8	Very low	32.3	Very low	79 Å²	79	127.9 Å²	127.9	65%	0.653	74%	0.737	S	S	*	*			trans	106.3	141.3	154.4	0	0	0	0	0	117.9
1179	Q	35.7	Very low	32.5	Very low	176 Å²	176	128.1 Å²	128.1	82%	0.822	74%	0.736	S	S	*	*			cis	-162.5	137	-5.4	-118.6	172	2	0	0	113
1180	V	30.9	Very low	32.6	Very low	124 Å²	124	126.5 Å²	126.5	75%	0.752	74%	0.737	S	S	*	*				58.8	133.4	129.6	172.7	0	0	0	0	118.7
1181	I	33.6	Very low	32.4	Very low	153 Å²	153	126.1 Å²	126.1	79%	0.785	74%	0.737	S	S	*	*				-135.6	147.4	59	-67.1	168.5	0	0	0	112.9
1182	T	33.4	Very low	32.5	Very low	101 Å²	101	128.9 Å²	128.9	62%	0.62	74%	0.742	S	S	*	*			trans	-63.2	166.1	179.6	38.6	0	0	0	0	114
1183	H	33.4	Very low	32.7	Very low	162 Å²	162	126.6 Å²	126.6	75%	0.75	74%	0.74	S	S	*	*			cis	-152.7	178.9	48	-74.5	-88.5	0	0	0	111.3
1184	L	33	Very low	32.8	Very low	158 Å²	158	128.7 Å²	128.7	83%	0.827	75%	0.746	S	S	*	*			cis	-133.6	-125.8	12.1	-165.3	58.8	0	0	0	113
1185	A	33.1	Very low	32.8	Very low	76 Å²	76	125.4 Å²	125.4	63%	0.628	74%	0.743	S	S	*	*			trans	-166.3	153.4	-158.9	0	0	0	0	0	113.2
1186	T	32.1	Very low	32.7	Very low	130 Å²	130	125.4 Å²	125.4	80%	0.798	75%	0.745	S	S	*	*			cis	-171.1	148.1	-16.6	27.4	0	0	0	0	110.3
1187	P	33	Very low	32.5	Very low	115 Å²	115	125.1 Å²	125.1	75%	0.747	75%	0.745	S	S	*	*			trans	-118.5	156.3	158.8	38.5	-28.7	0	0	0	114.7
1188	S	33.1	Very low	32.6	Very low	114 Å²	114	124.5 Å²	124.5	80%	0.797	75%	0.745	S	S	*	*			trans	67.9	-174.2	154.1	-45.3	0	0	0	0	117.7
1189	P	35.5	Very low	32.6	Very low	112 Å²	112	125.6 Å²	125.6	73%	0.727	75%	0.748	S	S	*	*				-137.8	174.5	-113.9	37.4	-13.3	0	0	0	118.9
1190	V	32.2	Very low	32.5	Very low	129 Å²	129	123.4 Å²	123.4	78%	0.782	75%	0.749	S	S	*	*			trans	47.6	118.3	158.7	-69.2	0	0	0	0	123.6
1191	S	31.5	Very low	32.5	Very low	99 Å²	99	122.9 Å²	122.9	69%	0.692	75%	0.751	S	S	*	*				99.5	130.7	126.1	-74.3	0	0	0	0	124.4
1192	H	29.2	Very low	32.3	Very low	169 Å²	169	119.9 Å²	119.9	78%	0.782	75%	0.749	S	S	*	*			trans	79.7	109.5	148.5	-61.1	-44.4	0	0	0	123.8
1193	S	28.6	Very low	32.1	Very low	102 Å²	102	120.6 Å²	120.6	71%	0.713	75%	0.754	S	S	*	*				106	112.6	117.7	70.5	0	0	0	0	123.4
1194	L	28.8	Very low	31.8	Very low	162 Å²	162	117.9 Å²	117.9	85%	0.848	75%	0.749	S	S	*	*			trans	84.3	139.7	131.9	-68.7	170.2	0	0	0	124.2
1195	S	31.4	Very low	31.6	Very low	109 Å²	109	118.3 Å²	118.3	76%	0.762	75%	0.746	S	S	*	*			trans	78.3	144.3	152.1	-64.2	0	0	0	0	120.4
1196	S	35.2	Very low	31.5	Very low	94 Å²	94	120.1 Å²	120.1	66%	0.657	75%	0.754	S	S	*	*			cis	-168.9	174.5	-13.6	52.6	0	0	0	0	112.9
1197	N	28.7	Very low	31.4	Very low	144 Å²	144	121.6 Å²	121.6	77%	0.77	76%	0.757	S	S	*	*			trans	84.2	137	173.3	-51.5	-12.4	0	0	0	115.1
1198	S	37.1	Very low	31.1	Very low	106 Å²	106	124.3 Å²	124.3	74%	0.741	76%	0.762	S	S	*	*			cis	-136.7	128.8	12.3	-67	0	0	0	0	109.8
1199	S	35.1	Very low	30.9	Very low	102 Å²	102	123.2 Å²	123.2	71%	0.713	76%	0.755	S	S	*	*				74.5	147	82.9	-61.1	0	0	0	0	114.5
1200	P	34.6	Very low	30.7	Very low	130 Å²	130	123.1 Å²	123.1	84%	0.844	76%	0.757	S	S	*	*			cis	-110	172.1	17.3	40.5	-33.4	0	0	0	116.5
1201	S	30.2	Very low	30.4	Very low	113 Å²	113	124 Å²	124	79%	0.79	76%	0.755	S	S	*	*			trans	-131.8	-162.3	178.9	-51.2	0	0	0	0	110.4
1202	A	29.8	Very low	30.1	Very low	90 Å²	90	127.2 Å²	127.2	74%	0.744	76%	0.759	S	S	*	*			trans	80.4	145.1	170.6	0	0	0	0	0	115
1203	T	28.2	Very low	30	Very low	117 Å²	117	123.6 Å²	123.6	72%	0.718	75%	0.753	S	S	*	*			cis	-156.5	-167.3	0.2	-1	0	0	0	0	108.4
1204	T	27.5	Very low	30	Very low	105 Å²	105	124.4 Å²	124.4	64%	0.644	75%	0.754	S	S	*	*			cis	-156.8	112.8	11.6	-4.6	0	0	0	0	111.2
1205	H	29.6	Very low	29.8	Very low	167 Å²	167	122.9 Å²	122.9	77%	0.773	75%	0.752	S	S	*	*			trans	55.2	-177.9	155.6	-48.3	-53.8	0	0	0	117.2
1206	S	30.2	Very low	29.6	Very low	114 Å²	114	122.3 Å²	122.3	80%	0.797	75%	0.747	S	S	*	*			cis	-144.5	156.6	7.1	-57.3	0	0	0	0	112.5
1207	N	29.4	Very low	29.7	Very low	160 Å²	160	124.4 Å²	124.4	86%	0.856	76%	0.756	S	S	*	*			trans	-68.1	148.2	162.7	-80.9	-34.7	0	0	0	111.3
1208	M	28.3	Very low	29.9	Very low	172 Å²	172	123.3 Å²	123.3	85%	0.847	76%	0.757	S	S	*	*			trans	-142.1	132.8	131.4	-79.6	-145.8	78.4	0	0	111.9
1209	S	27.2	Very low	29.6	Very low	92 Å²	92	121.7 Å²	121.7	64%	0.643	76%	0.757	S	S	*	*			trans	0.8	128.7	144.4	-42.3	0	0	0	0	117.1
1210	S	32.5	Very low	29.3	Very low	110 Å²	110	127.3 Å²	127.3	77%	0.769	76%	0.762	S	S	*	*				59.8	110.6	60.5	-169.5	0	0	0	0	113.5
1211	I	26	Very low	28.9	Very low	147 Å²	147	131 Å²	131	75%	0.754	76%	0.759	S	S	*	*			trans	-173.5	113.2	144.6	-96.6	151	0	0	0	110.4
1212	Q	25.4	Very low	28.9	Very low	166 Å²	166	134.8 Å²	134.8	78%	0.776	76%	0.762	S	S	*	*			trans	38.2	158.1	133.7	-50.4	176.9	-22	0	0	124.2
1213	S	26.5	Very low	28.9	Very low	93 Å²	93	134.2 Å²	134.2	65%	0.65	75%	0.749	S	S	*	*			trans	74.8	99	149.9	-60.6	0	0	0	0	118.2
1214	T	28.4	Very low	28.7	Very low	119 Å²	119	134.7 Å²	134.7	73%	0.73	75%	0.752	S	S	*	*				85.6	150.6	68.8	59	0	0	0	0	115.1
1215	T	25.2	Very low	28.6	Very low	131 Å²	131	137.5 Å²	137.5	80%	0.804	76%	0.758	S	S	*	*			trans	72.7	158.2	176.2	77.4	0	0	0	0	115.4
1216	S	26	Very low	28.6	Very low	96 Å²	96	135.3 Å²	135.3	67%	0.671	76%	0.758	S	S	*	*				-177.5	130.2	-69.9	46.4	0	0	0	0	110
1217	V	37.7	Very low	28.4	Very low	139 Å²	139	134.2 Å²	134.2	84%	0.842	75%	0.747	S	S	*	*			trans	65.7	167.8	160.8	175	0	0	0	0	112.1
1218	P	32.9	Very low	28.7	Very low	121 Å²	121	131.7 Å²	131.7	79%	0.786	74%	0.741	S	S	*	*			cis	-108.1	176.3	-10.6	19.1	4	0	0	0	114.4
1219	G	31	Very low	28.6	Very low	72 Å²	72	131.4 Å²	131.4	74%	0.742	74%	0.738	S	S	*	*			trans	-89.8	153.5	167.8	0	0	0	0	0	114.1
1220	R	29.5	Very low	28.5	Very low	219 Å²	219	130.8 Å²	130.8	83%	0.826	74%	0.738	S	S	*	*			trans	-130	132.4	149	-74	-178.5	173.4	-177.3	-3.1	104.7
1221	R	26.4	Very low	28.3	Very low	208 Å²	208	134.4 Å²	134.4	79%	0.785	74%	0.743	S	S	*	*			cis	55.9	69.2	33.5	-157	-178.2	-174.2	159.8	8	113	T1223	R1221-T1223 HydrophobicContact CG-CG2 3.96Å; R1221-T1223 PolarHBondContact NE-OG1 3.07Å
1222	F	29.7	Very low	28.4	Very low	192 Å²	192	132.3 Å²	132.3	84%	0.842	74%	0.742	S	S	*	*			trans	-91.7	97.9	139.2	-84.3	-80.5	0	0	0	108.1
1223	T	29.8	Very low	28.7	Very low	78 Å²	78	127.7 Å²	127.7	48%	0.479	74%	0.739	S	S	.	*			trans	-88.3	171.2	159.4	33.7	0	0	0	0	109.3	R1221	R1221-T1223 HydrophobicContact CG-CG2 3.96Å; R1221-T1223 PolarHBondContact NE-OG1 3.07Å
1224	V	24.4	Very low	28.8	Very low	128 Å²	128	130.8 Å²	130.8	78%	0.776	75%	0.746	S	S	*	*			trans	72	129	177.7	-146.3	0	0	0	0	110
1225	Q	25.6	Very low	28.8	Very low	163 Å²	163	129.8 Å²	129.8	76%	0.762	74%	0.744	S	S	*	*			cis	-127.1	135	28.6	-78	166.9	-28.5	0	0	114.7	V1227	Q1225-V1227 HydrophobicContact CB-CG2 3.97Å; Q1225-V1227 HydrophobicContact CG-CG2 4.17Å
1226	P	29	Very low	29	Very low	121 Å²	121	128.5 Å²	128.5	79%	0.786	74%	0.74	S	S	*	*			trans	-84.9	111.2	141.5	32.6	-23.1	0	0	0	108.3
1227	V	25.5	Very low	29.1	Very low	92 Å²	92	128.9 Å²	128.9	56%	0.558	74%	0.743	S	S	*	*			trans	-130.2	105.1	170.9	168.8	0	0	0	0	108.6	Q1225	Q1225-V1227 HydrophobicContact CB-CG2 3.97Å; Q1225-V1227 HydrophobicContact CG-CG2 4.17Å
1228	S	35.1	Very low	28.5	Very low	106 Å²	106	130.1 Å²	130.1	74%	0.741	74%	0.743	S	S	*	*			trans	-76.3	122.3	165.4	-52.7	0	0	0	0	108.9
1229	Q	25.9	Very low	28.3	Very low	167 Å²	167	128.5 Å²	128.5	78%	0.78	73%	0.734	S	S	*	*			trans	-144.2	120.2	159.1	-101.2	162.2	-3.6	0	0	104.3
1230	A	27	Very low	28.3	Very low	78 Å²	78	131 Å²	131	65%	0.645	74%	0.735	S	S	*	*				54.1	114.9	68.2	0	0	0	0	0	108.4
1231	E	27.6	Very low	28.3	Very low	187 Å²	187	125.9 Å²	125.9	87%	0.874	73%	0.731	S	S	*	*				-164.8	174.5	52.1	-81.9	-179.2	136.6	0	0	108.9
1232	S	28.7	Very low	28.7	Very low	103 Å²	103	123 Å²	123	72%	0.72	73%	0.726	S	S	*	*			cis	-164.3	154.5	-17.2	46.8	0	0	0	0	108.5
1233	G	30.5	Very low	28.7	Very low	69 Å²	69	119.2 Å²	119.2	71%	0.711	72%	0.72	S	S	*	*			trans	71.5	153.4	169.8	0	0	0	0	0	115.6
1234	I	30	Very low	29.1	Very low	157 Å²	157	122.3 Å²	122.3	81%	0.805	73%	0.729	S	S	*	*			cis	-142	137.6	-7.9	41.2	174.9	0	0	0	105.8
1235	S	27.8	Very low	29.7	Very low	98 Å²	98	121.7 Å²	121.7	69%	0.685	73%	0.728	S	S	*	*				52.6	125.9	74.2	-46.8	0	0	0	0	111.4
1236	S	28.8	Very low	30.3	Very low	104 Å²	104	119.5 Å²	119.5	73%	0.727	73%	0.726	S	S	*	*			cis	-150.1	138.3	14	-33.6	0	0	0	0	108.2
1237	S	28.1	Very low	30.7	Very low	104 Å²	104	119.2 Å²	119.2	73%	0.727	72%	0.724	S	S	*	*				73.5	150.7	78.7	-47.9	0	0	0	0	115.1
1238	I	26.2	Very low	30.9	Very low	166 Å²	166	118.6 Å²	118.6	85%	0.851	73%	0.729	S	S	*	*			trans	72.8	136.2	156.8	-85.1	168.4	0	0	0	115.7
1239	S	27.3	Very low	30.7	Very low	86 Å²	86	121.5 Å²	121.5	60%	0.601	73%	0.734	S	S	*	*			cis	-148.7	159.5	-6.5	-94.5	0	0	0	0	108.6
1240	T	31.4	Very low	31	Very low	124 Å²	124	119.1 Å²	119.1	76%	0.761	73%	0.731	S	S	*	*				46.1	144.5	69.7	27.9	0	0	0	0	114.6
1241	P	29.2	Very low	31.1	Very low	113 Å²	113	120 Å²	120	73%	0.734	73%	0.733	S	S	*	*			cis	-116	-177.7	20.4	29.9	-6.6	0	0	0	112.6
1242	H	35.1	Very low	31.3	Very low	148 Å²	148	116.9 Å²	116.9	69%	0.685	73%	0.73	S	S	*	*				49.8	144.4	60	-114.8	-113.2	0	0	0	113	E1244	H1242-E1244 IonicContact CE1-OE2 2.75Å
1243	P	30.9	Very low	31.6	Very low	111 Å²	111	117.7 Å²	117.7	72%	0.721	73%	0.733	S	S	*	*			cis	-138	176.6	27	40.8	-21.3	0	0	0	118
1244	E	37.2	Very low	32.4	Very low	143 Å²	143	119.3 Å²	119.3	67%	0.668	73%	0.731	S	S	*	*			trans	-9.3	155.1	134.2	-85.3	174.9	105.2	0	0	118.7	H1242	H1242-E1244 IonicContact CE1-OE2 2.75Å
1245	P	36.3	Very low	32.7	Very low	116 Å²	116	114.3 Å²	114.3	75%	0.753	71%	0.709	S	S	*	*			cis	-142.1	159.9	43.9	40.9	-22.7	0	0	0	119
1246	T	38.4	Very low	33.1	Very low	116 Å²	116	113 Å²	113	71%	0.712	70%	0.697	S	S	*	*			trans	-79.8	145.9	150.9	50.5	0	0	0	0	109.8
1247	P	38.1	Very low	33.5	Very low	116 Å²	116	112.4 Å²	112.4	75%	0.753	69%	0.69	S	S	*	*				-114.8	131.2	109.7	-9	27.8	0	0	0	109.6
1248	A	29	Very low	34	Very low	79 Å²	79	112.8 Å²	112.8	65%	0.653	69%	0.693	S	S	*	*				64.9	112.9	55.3	0	0	0	0	0	113.1
1249	I	30.5	Very low	34.5	Very low	167 Å²	167	111.2 Å²	111.2	86%	0.856	69%	0.691	S	S	*	*			trans	-172.4	115.8	141.8	-101.5	155.9	0	0	0	111.6
1250	T	32.1	Very low	34.9	Very low	116 Å²	116	112.7 Å²	112.7	71%	0.712	70%	0.698	S	S	*	*			trans	78.1	82.8	141.1	-52.3	0	0	0	0	122.3
1251	S	30	Very low	35.3	Very low	97 Å²	97	112 Å²	112	68%	0.678	70%	0.696	S	S	*	*				50.4	132.3	122.3	67.7	0	0	0	0	124.5
1252	C	31.6	Very low	35.4	Very low	122 Å²	122	112.5 Å²	112.5	82%	0.824	70%	0.696	S	S	*	*				-178.4	162.6	102.3	-88.6	0	0	0	0	113.6
1253	P	35.2	Very low	35.2	Very low	120 Å²	120	111.3 Å²	111.3	78%	0.779	70%	0.7	S	S	*	*			trans	-117	171.6	-167.9	18.2	5.8	0	0	0	117.2
1254	P	48	Very low	35	Very low	103 Å²	103	110.8 Å²	110.8	67%	0.669	70%	0.698	S	S	*	*			trans	-109.4	163.9	-178.1	41.8	-35	0	0	0	115.2
1255	P	36.6	Very low	34.5	Very low	51 Å²	51	111.8 Å²	111.8	33%	0.331	71%	0.708	S	S	.	*			trans	-123.8	-143.4	155.1	-7.5	31.6	0	0	0	117.5	V117 S118 S119 I120	V117-P1255 VanDerWaalsContact C-CD 3.45Å; V117-P1255 WeakPolarHBondContact O-CD 3.47Å; S118-P1255 CarbonylContact C-O 3.46Å; S118-P1255 VanDerWaalsContact O-CD 3.29Å; S118-P1255 WeakPolarHBondContact O-CD 3.3Å; S119-P1255 CarbonylContact C-O 3.58Å; S119-P1255 WeakPolarHBondContact CA-O 3.21Å; S119-P1255 VanDerWaalsContact N-C 3.33Å; S119-P1255 PolarHBondContact N-O 2.84Å; S119-P1255 VanDerWaalsContact N-O 3.14Å; I120-P1255 PolarHBondContact N-O 2.88Å; I120-P1255 VanDerWaalsContact N-O 3.15Å
1256	V	36.3	Very low	34.4	Very low	72 Å²	72	109.5 Å²	109.5	44%	0.436	71%	0.705	S	S	.	*			trans	-141.7	165.1	178.3	-151.9	0	0	0	0	109.5	S118 I120	S118-V1256 WeakPolarHBondContact CA-O 3.31Å; S118-V1256 PolarHBondContact N-O 3.29Å; I120-V1256 HydrophobicContact CG1-CG1 4.39Å
1257	P	37.1	Very low	33.9	Very low	90 Å²	90	110.1 Å²	110.1	58%	0.584	71%	0.709	S	S	*	*				-156.8	-141.7	96.6	43.1	-20.2	0	0	0	115.6
1258	S	37	Very low	33.7	Very low	112 Å²	112	111.8 Å²	111.8	78%	0.783	71%	0.711	S	S	*	*			trans	-140.3	-179	-157.6	-54.7	0	0	0	0	117.5
1259	V	37.2	Very low	33.6	Very low	133 Å²	133	113.6 Å²	113.6	81%	0.806	71%	0.71	S	S	*	*			trans	-44.4	159.9	178.7	-123.5	0	0	0	0	117
1260	P	36.3	Very low	33.9	Very low	118 Å²	118	113.7 Å²	113.7	77%	0.766	71%	0.711	S	S	*	*				-149.1	-151.7	80.2	51.3	-31.5	0	0	0	113.6
1261	P	40	Very low	33.8	Very low	109 Å²	109	115.3 Å²	115.3	71%	0.708	71%	0.711	S	S	*	*			trans	-138.4	-165.4	-131.9	31.3	-2.2	0	0	0	118.2
1262	V	29.6	Very low	34.1	Very low	123 Å²	123	117 Å²	117	75%	0.745	72%	0.716	S	S	*	*			trans	89.9	148	155.3	-153	0	0	0	0	119.8
1263	V	30.8	Very low	34.4	Very low	124 Å²	124	114.9 Å²	114.9	75%	0.752	71%	0.708	S	S	*	*			trans	61.7	104.9	165.1	-85.4	0	0	0	0	123.4
1264	S	28.1	Very low	34.8	Very low	99 Å²	99	114.4 Å²	114.4	69%	0.692	71%	0.705	S	S	*	*				57.4	135.1	111.3	-52.8	0	0	0	0	125.4
1265	N	27.1	Very low	34.2	Very low	165 Å²	165	117.9 Å²	117.9	88%	0.882	71%	0.71	S	S	*	*			trans	78	150.3	148.9	-62.7	1.2	0	0	0	120.3
1266	G	33.7	Very low	34	Very low	67 Å²	67	122.1 Å²	122.1	69%	0.691	73%	0.725	S	S	*	*			trans	91.9	103	-174.2	0	0	0	0	0	111.5
1267	T	27.8	Very low	33.9	Very low	129 Å²	129	124.4 Å²	124.4	79%	0.791	74%	0.739	S	S	*	*			cis	77.8	141.6	28.5	-39.3	0	0	0	0	113.8
1268	L	33.1	Very low	33.9	Very low	152 Å²	152	126.3 Å²	126.3	80%	0.796	75%	0.752	S	S	*	*			trans	78.2	151.8	-177.1	-51.2	176.4	0	0	0	115.4
1269	N	28.5	Very low	33.6	Very low	117 Å²	117	126.5 Å²	126.5	63%	0.626	75%	0.753	S	S	*	*			cis	179	135.8	-43.5	-117.6	49	0	0	0	106.1
1270	L	34.9	Very low	33.5	Very low	168 Å²	168	124.3 Å²	124.3	88%	0.88	75%	0.749	S	S	*	*			trans	165.5	152.1	139.4	-112.8	59.4	0	0	0	110.3
1271	E	30.5	Very low	33.3	Very low	150 Å²	150	124.4 Å²	124.4	70%	0.701	75%	0.747	S	S	*	*				-165	-174	-59.1	-167.9	147.8	108.6	0	0	106.4
1272	V	35.9	Very low	33	Very low	132 Å²	132	125.3 Å²	125.3	80%	0.8	75%	0.746	S	S	*	*			trans	71.7	92.9	176.6	-167.5	0	0	0	0	113
1273	A	38.8	Very low	33.2	Very low	79 Å²	79	127.5 Å²	127.5	65%	0.653	75%	0.748	S	S	*	*			cis	67.5	161.6	17	0	0	0	0	0	115.1
1274	P	43	Very low	33.2	Very low	109 Å²	109	128.3 Å²	128.3	71%	0.708	75%	0.748	S	S	*	*			cis	-135.6	177.9	-8.2	39.1	-21.5	0	0	0	115.3
1275	K	35.9	Very low	33.5	Very low	177 Å²	177	128.7 Å²	128.7	77%	0.77	75%	0.746	S	S	*	*				156.6	145.6	126.9	-84.5	-169.6	176.3	-176.5	0	112.1
1276	Q	33.1	Very low	33.7	Very low	140 Å²	140	127.2 Å²	127.2	65%	0.654	74%	0.739	S	S	*	*			cis	-167	114.3	-24.2	-110.9	168.2	-21.7	0	0	105.1
1277	T	33.8	Very low	33.7	Very low	120 Å²	120	129.5 Å²	129.5	74%	0.736	74%	0.739	S	S	*	*				64.8	154.2	85.3	62.6	0	0	0	0	116.7
1278	P	37.5	Very low	34	Very low	130 Å²	130	130.1 Å²	130.1	84%	0.844	73%	0.733	S	S	*	*			cis	-136.8	-154.6	-9.7	35.6	-12	0	0	0	114.2
1279	S	29.8	Very low	34.1	Very low	115 Å²	115	130.4 Å²	130.4	80%	0.804	73%	0.73	S	S	*	*			trans	-129.8	166.2	-176	178	0	0	0	0	112.5
1280	A	35.5	Very low	34.4	Very low	88 Å²	88	129.1 Å²	129.1	73%	0.727	73%	0.73	S	S	*	*			trans	-128.5	-179.5	176.1	0	0	0	0	0	112
1281	T	32.2	Very low	34.4	Very low	120 Å²	120	126.2 Å²	126.2	74%	0.736	72%	0.724	S	S	*	*			trans	-165.9	143.7	-162	-68.9	0	0	0	0	113.3
1282	N	32.7	Very low	34.6	Very low	128 Å²	128	123.8 Å²	123.8	68%	0.684	72%	0.723	S	S	*	*			trans	148.9	139.4	142.1	-90.2	-55.4	0	0	0	117.9
1283	Q	34.8	Very low	34.5	Very low	169 Å²	169	124.1 Å²	124.1	79%	0.79	73%	0.726	S	S	*	*			trans	63.4	143.7	138.9	-64.2	164.7	46.2	0	0	121.4
1284	N	29.5	Very low	34.3	Very low	140 Å²	140	125 Å²	125	75%	0.749	73%	0.733	S	S	*	*			cis	168.5	179.1	-9.9	-178.1	27.8	0	0	0	105.6
1285	V	34.7	Very low	33.9	Very low	107 Å²	107	124.8 Å²	124.8	65%	0.648	73%	0.734	S	S	*	*			trans	88.2	90.5	159.9	-167.2	0	0	0	0	119.4
1286	D	32.9	Very low	33.7	Very low	135 Å²	135	122.2 Å²	122.2	72%	0.722	73%	0.734	S	S	*	*				57.6	146	124.3	-67.2	-68.5	0	0	0	126.6
1287	T	33.2	Very low	33.6	Very low	115 Å²	115	119.7 Å²	119.7	71%	0.706	74%	0.737	S	S	*	*			trans	76.6	141.2	141.5	-73.5	0	0	0	0	119.5
1288	Q	33.3	Very low	33.4	Very low	142 Å²	142	119.5 Å²	119.5	66%	0.664	74%	0.735	S	S	*	*			cis	-169.8	157.2	-16.3	-105.1	177.3	10.4	0	0	109.9
1289	H	35	Very low	33.1	Very low	157 Å²	157	120.6 Å²	120.6	73%	0.727	73%	0.733	S	S	*	*			trans	60.1	164.8	151.8	-64.5	-41.6	0	0	0	120.2
1290	S	34.8	Very low	33.1	Very low	91 Å²	91	121.5 Å²	121.5	64%	0.636	73%	0.734	S	S	*	*			cis	-168.1	147.7	-32.4	-88.9	0	0	0	0	112.6
1291	S	35.5	Very low	32.8	Very low	106 Å²	106	121.5 Å²	121.5	74%	0.741	73%	0.729	S	S	*	*			trans	65.4	130.1	139	67.9	0	0	0	0	125.6
1292	S	35.6	Very low	32.6	Very low	99 Å²	99	124 Å²	124	69%	0.692	73%	0.732	S	S	*	*				116.4	135	116.1	69.9	0	0	0	0	123.3
1293	T	32.8	Very low	32.4	Very low	140 Å²	140	124.3 Å²	124.3	86%	0.859	74%	0.739	S	S	*	*			trans	64.4	153.3	155.3	49.6	0	0	0	0	119
1294	A	35	Very low	32.5	Very low	96 Å²	96	122.3 Å²	122.3	79%	0.793	74%	0.741	S	S	*	*			cis	-169	175.5	0.7	0	0	0	0	0	108.7
1295	S	34.1	Very low	32.5	Very low	105 Å²	105	120.1 Å²	120.1	73%	0.734	74%	0.741	S	S	*	*			cis	-177.3	173.4	-22.3	-179.7	0	0	0	0	109.9
1296	T	32.5	Very low	32.1	Very low	124 Å²	124	121.1 Å²	121.1	76%	0.761	75%	0.748	S	S	*	*			trans	81	113	147.2	-56.8	0	0	0	0	122.4
1297	A	31.1	Very low	31.9	Very low	87 Å²	87	120.1 Å²	120.1	72%	0.719	75%	0.747	S	S	*	*			trans	53.6	164.5	131.1	0	0	0	0	0	123.3
1298	T	29.9	Very low	31.7	Very low	115 Å²	115	123.6 Å²	123.6	71%	0.706	75%	0.754	S	S	*	*			cis	-175.9	133.9	-27.4	-85.3	0	0	0	0	109.8
1299	L	30.1	Very low	31.5	Very low	153 Å²	153	120.1 Å²	120.1	80%	0.801	74%	0.743	S	S	*	*			trans	58.9	177.6	169.5	-68.8	166.3	0	0	0	114.4
1300	V	31.1	Very low	31.2	Very low	134 Å²	134	116 Å²	116	81%	0.812	73%	0.729	S	S	*	*			cis	-138.8	176.6	11.2	-145.9	0	0	0	0	111.2
1301	S	28.2	Very low	31.2	Very low	89 Å²	89	114.4 Å²	114.4	62%	0.622	72%	0.716	S	S	*	*			trans	-76.3	163.4	-176	-41.7	0	0	0	0	116.2
1302	E	28.5	Very low	31	Very low	171 Å²	171	116.9 Å²	116.9	80%	0.799	72%	0.72	S	S	*	*			trans	84.1	144	131.5	-88	161.6	-170.5	0	0	124.9
1303	T	28.2	Very low	30.8	Very low	135 Å²	135	117.2 Å²	117.2	83%	0.828	72%	0.722	S	S	*	*			trans	77.4	137.7	157.6	52.2	0	0	0	0	121.6
1304	P	37.1	Very low	30.7	Very low	128 Å²	128	116.6 Å²	116.6	83%	0.831	72%	0.717	S	S	*	*			trans	-104.9	155.6	176	39.8	-33.2	0	0	0	113.8
1305	A	29	Very low	30.7	Very low	93 Å²	93	118 Å²	118	77%	0.769	72%	0.718	S	S	*	*			trans	-162.5	120.9	156.4	0	0	0	0	0	113.8
1306	T	26.7	Very low	30.6	Very low	129 Å²	129	117.3 Å²	117.3	79%	0.791	72%	0.719	S	S	*	*				47.2	107.5	122	-50.1	0	0	0	0	121.3
1307	V	27.6	Very low	30.6	Very low	113 Å²	113	117.1 Å²	117.1	69%	0.685	72%	0.72	S	S	*	*			trans	49.3	115.3	131.2	-174.8	0	0	0	0	119.2
1308	H	30.3	Very low	30.6	Very low	188 Å²	188	120 Å²	120	87%	0.87	73%	0.729	S	S	*	*				-154.6	155	108.1	-119.6	-83.1	0	0	0	114.1
1309	V	28.4	Very low	30.4	Very low	69 Å²	69	122.1 Å²	122.1	42%	0.418	73%	0.731	S	S	.	*			trans	-102.2	152.2	-172.1	133.8	0	0	0	0	111.1	K1443	V1309-K1443 HydrophobicContact CG1-CB 3.55Å; V1309-K1443 HydrophobicContact CG1-CD 4.4Å; V1309-K1443 HydrophobicContact CG1-CG 4.14Å; V1309-K1443 HydrophobicContact CG2-CB 4.46Å
1310	T	29	Very low	30.3	Very low	71 Å²	71	122.3 Å²	122.3	44%	0.436	73%	0.727	S	S	.	*			trans	-174.2	158.3	150.4	17.2	0	0	0	0	113.5	D1441 K1443	T1310-D1441 HydrophobicContact CG2-CB 3.38Å; T1310-D1441 WeakPolarHBondContact CG2-OD1 3.44Å; T1310-K1443 WeakPolarHBondContact O-CD 3.36Å; T1310-K1443 WeakPolarHBondContact O-CE 3.4Å; T1310-K1443 PolarHBondContact O-NZ 3.17Å
1311	P	34	Very low	30.4	Very low	58 Å²	58	121 Å²	121	38%	0.377	72%	0.722	S	S	.	*			trans	-113.9	-178.1	-176.3	30.6	-11.5	0	0	0	115.6	D1441 K1443	P1311-D1441 VanDerWaalsContact CD-OD1 3.3Å; P1311-D1441 WeakPolarHBondContact CD-OD1 3.49Å; P1311-K1443 HydrophobicContact CB-CD 4.38Å; P1311-K1443 HydrophobicContact CB-CG 3.6Å; P1311-K1443 HydrophobicContact CG-CG 3.76Å
1312	I	31.3	Very low	30.3	Very low	158 Å²	158	123.8 Å²	123.8	81%	0.81	73%	0.729	S	S	*	*			trans	149.7	147.2	156.5	-84.7	157.9	0	0	0	108.5
1313	S	31	Very low	30.4	Very low	105 Å²	105	122.6 Å²	122.6	73%	0.734	73%	0.733	S	S	*	*			cis	-160.7	166.6	-40.8	-164.3	0	0	0	0	108
1314	V	31.8	Very low	30.4	Very low	127 Å²	127	123.1 Å²	123.1	77%	0.77	73%	0.729	S	S	*	*			trans	-82.2	162.5	-177.4	-145.9	0	0	0	0	112
1315	P	35.1	Very low	30.1	Very low	125 Å²	125	123.9 Å²	123.9	81%	0.812	73%	0.726	S	S	*	*				-126.7	149.3	127.8	36.1	-30.2	0	0	0	114.3
1316	A	30.9	Very low	30.2	Very low	91 Å²	91	126.6 Å²	126.6	75%	0.752	72%	0.723	S	S	*	*			trans	-93.4	-179.7	-165.1	0	0	0	0	0	113.9
1317	P	33.9	Very low	30.6	Very low	121 Å²	121	129.5 Å²	129.5	79%	0.786	73%	0.727	S	S	*	*			trans	-99.7	179	-166.5	40.6	-36.3	0	0	0	114.8
1318	V	30.2	Very low	30.6	Very low	148 Å²	148	129 Å²	129	90%	0.897	73%	0.728	S	S	*	*			trans	-139.9	149.1	165.8	-174.7	0	0	0	0	109.6
1319	Q	26.9	Very low	30.8	Very low	159 Å²	159	125.5 Å²	125.5	74%	0.743	72%	0.716	S	S	*	*			trans	-104.7	156.2	-168.6	-63.8	160.9	-102.6	0	0	114.9
1320	E	26.5	Very low	31.1	Very low	156 Å²	156	127.6 Å²	127.6	73%	0.729	73%	0.729	S	S	*	*			trans	64.5	170	140.2	-83.1	178.8	-136.5	0	0	119.8
1321	P	33.4	Very low	31.6	Very low	108 Å²	108	131.3 Å²	131.3	70%	0.701	75%	0.745	S	S	*	*			cis	-131.9	164.1	10.6	42.1	-25.7	0	0	0	119
1322	L	26.9	Very low	31.8	Very low	147 Å²	147	132.9 Å²	132.9	77%	0.77	75%	0.754	S	S	*	*			trans	9.9	127.4	146.8	-64.9	161.9	0	0	0	120.7
1323	V	30.5	Very low	32	Very low	146 Å²	146	130.9 Å²	130.9	89%	0.885	74%	0.741	S	S	*	*			trans	-135.1	131.4	134.7	-176.6	0	0	0	0	110.8
1324	I	28.1	Very low	32.3	Very low	145 Å²	145	130.6 Å²	130.6	74%	0.744	73%	0.731	S	S	*	*			trans	-62.8	141.7	179.4	-63.7	144.2	0	0	0	113.2
1325	D	30.5	Very low	32.6	Very low	144 Å²	144	128.2 Å²	128.2	77%	0.77	71%	0.714	S	S	*	*			trans	-153.4	165.1	130.1	-136.9	-14.8	0	0	0	115.2
1326	H	31.7	Very low	32.7	Very low	150 Å²	150	124.5 Å²	124.5	69%	0.694	69%	0.691	S	S	*	*			trans	-67.5	139.5	-159.6	-69.4	59.2	0	0	0	117
1327	H	34.2	Very low	33.1	Very low	190 Å²	190	124.8 Å²	124.8	88%	0.88	68%	0.676	S	S	*	*			trans	-168.5	56	130.4	-108.5	-59.3	0	0	0	114.3
1328	S	28.2	Very low	33.3	Very low	103 Å²	103	124.7 Å²	124.7	72%	0.72	67%	0.669	S	S	*	*			trans	-93.4	94.2	177.4	55.1	0	0	0	0	112.8
1329	D	34.6	Very low	33.8	Very low	114 Å²	114	125.5 Å²	125.5	61%	0.61	66%	0.656	S	S	*	*			trans	-156.4	-31.9	170.3	-98.1	-41.1	0	0	0	115.4	L1331 T1332 Q1333	D1329-L1331 PolarHBondContact O-N 3.1Å; D1329-T1332 PolarHBondContact O-OG1 3.14Å; D1329-Q1333 PolarHBondContact O-N 3.35Å; D1329-Q1333 VanDerWaalsContact O-N 3.12Å
1330	V	34.9	Very low	34.3	Very low	113 Å²	113	124.9 Å²	124.9	69%	0.685	65%	0.65	S	S	*	*	H	α-helix	trans	-70.9	-32.3	-167.2	-177.1	0	0	0	0	113.6	L1334	V1330-L1334 PolarHBondContact O-N 3.4Å
1331	L	38.6	Very low	34.5	Very low	149 Å²	149	123.4 Å²	123.4	78%	0.78	65%	0.652	S	S	*	*	H	α-helix	trans	-82.6	-30.8	-178.6	-70.9	169.5	0	0	0	112.9	D1329 L1334 D1335	D1329-L1331 PolarHBondContact O-N 3.1Å; L1331-L1334 PolarHBondContact O-N 3.11Å; L1331-D1335 PolarHBondContact O-N 3.15Å; L1331-D1335 VanDerWaalsContact O-N 3.16Å
1332	T	39.3	Very low	34.3	Very low	91 Å²	91	122.6 Å²	122.6	56%	0.558	65%	0.649	S	S	*	*	H	α-helix	trans	-73.2	-33.3	173.2	36.9	0	0	0	0	112.1	D1329 L1334 S1336	D1329-T1332 PolarHBondContact O-OG1 3.14Å; T1332-L1334 VanDerWaalsContact C-N 3.33Å; T1332-L1334 PolarHBondContact O-N 3.11Å; T1332-S1336 WeakPolarHBondContact O-CB 3.3Å; T1332-S1336 PolarHBondContact O-N 3.16Å; T1332-S1336 VanDerWaalsContact O-N 3.07Å; T1332-S1336 PolarHBondContact O-OG 3.32Å
1333	Q	35.1	Very low	34.4	Very low	116 Å²	116	119.1 Å²	119.1	54%	0.542	65%	0.648	S	S	.	*	H	α-helix	trans	-62	-39.4	171.2	-159.5	78.2	14.4	0	0	111.9	D1329 S1336 E1337	D1329-Q1333 PolarHBondContact O-N 3.35Å; D1329-Q1333 VanDerWaalsContact O-N 3.12Å; Q1333-S1336 PolarHBondContact O-OG 2.79Å; Q1333-S1336 VanDerWaalsContact O-OG 3.1Å; Q1333-E1337 WeakPolarHBondContact O-CG 3.28Å; Q1333-E1337 PolarHBondContact O-N 3.08Å; Q1333-E1337 VanDerWaalsContact O-N 3.11Å
1334	L	37.8	Very low	34.2	Very low	100 Å²	100	117.3 Å²	117.3	52%	0.524	64%	0.638	S	S	.	*	H	α-helix	trans	-72.4	-42.2	179.5	-94.8	155.7	0	0	0	113.1	V1330 L1331 T1332 S1336 L1338	V1330-L1334 PolarHBondContact O-N 3.4Å; L1331-L1334 PolarHBondContact O-N 3.11Å; T1332-L1334 VanDerWaalsContact C-N 3.33Å; T1332-L1334 PolarHBondContact O-N 3.11Å; L1334-S1336 VanDerWaalsContact C-N 3.29Å; L1334-S1336 PolarHBondContact O-N 2.74Å; L1334-L1338 WeakPolarHBondContact O-CB 3.11Å; L1334-L1338 PolarHBondContact O-N 3.36Å
1335	D	36.9	Very low	34.3	Very low	76 Å²	76	116 Å²	116	41%	0.406	64%	0.641	S	S	.	*	H	α-helix	trans	-75.6	-16.7	179.3	-162.2	39.2	0	0	0	113	L1331 R1339	L1331-D1335 PolarHBondContact O-N 3.15Å; L1331-D1335 VanDerWaalsContact O-N 3.16Å; D1335-R1339 VanDerWaalsContact CG-NH1 3.26Å; D1335-R1339 WeakPolarHBondContact O-CG 3.35Å; D1335-R1339 IonicContact OD1-CZ 2.79Å; D1335-R1339 IonicContact OD1-NH1 2.72Å; D1335-R1339 IonicContact OD1-NH2 3.19Å; D1335-R1339 PolarHBondContact OD1-NH2 3.04Å; D1335-R1339 IonicContact OD2-CZ 3.84Å; D1335-R1339 IonicContact OD2-NH1 3.38Å; D1335-R1339 PolarHBondContact OD2-NH1 2.63Å; D1335-R1339 IonicContact OD2-NH2 3.13Å; D1335-R1339 PolarHBondContact OD2-NH2 2.7Å
1336	S	37.3	Very low	34.1	Very low	47 Å²	47	116.9 Å²	116.9	33%	0.329	64%	0.64	S	S	.	*	H	α-helix	trans	-87.7	-35.8	170.7	56.4	0	0	0	0	113.3	T1332 Q1333 L1334 R1339 K1340	T1332-S1336 WeakPolarHBondContact O-CB 3.3Å; T1332-S1336 PolarHBondContact O-N 3.16Å; T1332-S1336 VanDerWaalsContact O-N 3.07Å; T1332-S1336 PolarHBondContact O-OG 3.32Å; Q1333-S1336 PolarHBondContact O-OG 2.79Å; Q1333-S1336 VanDerWaalsContact O-OG 3.1Å; L1334-S1336 VanDerWaalsContact C-N 3.29Å; L1334-S1336 PolarHBondContact O-N 2.74Å; S1336-R1339 PolarHBondContact O-N 2.92Å; S1336-K1340 WeakPolarHBondContact O-CG 3.19Å; S1336-K1340 PolarHBondContact O-N 3.33Å; S1336-K1340 VanDerWaalsContact O-N 3.14Å
1337	E	40.5	Very low	33.8	Very low	97 Å²	97	115.5 Å²	115.5	45%	0.453	65%	0.647	S	S	.	*	H	α-helix	trans	-68.7	-38	170.7	-73.2	-60.7	121.2	0	0	112.2	Q1333 R1339 K1340	Q1333-E1337 WeakPolarHBondContact O-CG 3.28Å; Q1333-E1337 PolarHBondContact O-N 3.08Å; Q1333-E1337 VanDerWaalsContact O-N 3.11Å; E1337-R1339 PolarHBondContact O-N 2.81Å; E1337-K1340 PolarHBondContact O-N 3.1Å; E1337-K1340 VanDerWaalsContact O-N 3.16Å; E1337-K1340 WeakPolarHBondContact OE1-CD 3.34Å; E1337-K1340 WeakPolarHBondContact OE1-CE 3.37Å; E1337-K1340 IonicContact OE1-NZ 3.07Å; E1337-K1340 PolarHBondContact OE1-NZ 3.11Å
1338	L	37.9	Very low	33.5	Very low	119 Å²	119	110.5 Å²	110.5	62%	0.623	64%	0.639	S	S	*	*	H	α-helix	trans	-66.9	-21.4	173.5	-91.1	149.8	0	0	0	113.8	L1334	L1334-L1338 WeakPolarHBondContact O-CB 3.11Å; L1334-L1338 PolarHBondContact O-N 3.36Å
1339	R	39.8	Very low	33.4	Very low	166 Å²	166	111.1 Å²	111.1	63%	0.626	64%	0.644	S	S	*	*	H	α-helix	trans	-88.4	-16.8	170.7	-71.5	-170.9	-169.1	101.4	17.6	114.3	D1335 S1336 E1337 V1341 S1342	D1335-R1339 VanDerWaalsContact CG-NH1 3.26Å; D1335-R1339 WeakPolarHBondContact O-CG 3.35Å; D1335-R1339 IonicContact OD1-CZ 2.79Å; D1335-R1339 IonicContact OD1-NH1 2.72Å; D1335-R1339 IonicContact OD1-NH2 3.19Å; D1335-R1339 PolarHBondContact OD1-NH2 3.04Å; D1335-R1339 IonicContact OD2-CZ 3.84Å; D1335-R1339 IonicContact OD2-NH1 3.38Å; D1335-R1339 PolarHBondContact OD2-NH1 2.63Å; D1335-R1339 IonicContact OD2-NH2 3.13Å; D1335-R1339 PolarHBondContact OD2-NH2 2.7Å; S1336-R1339 PolarHBondContact O-N 2.92Å; E1337-R1339 PolarHBondContact O-N 2.81Å; R1339-V1341 VanDerWaalsContact C-N 3.28Å; R1339-V1341 PolarHBondContact O-N 2.9Å; R1339-S1342 PolarHBondContact O-N 3.4Å
1340	K	37.3	Very low	33.1	Very low	145 Å²	145	111.5 Å²	111.5	63%	0.63	65%	0.652	S	S	*	*	H	α-helix	trans	-75.7	-11.7	173	-75.4	175.9	-162.2	164.2	0	114.4	S1336 E1337	S1336-K1340 WeakPolarHBondContact O-CG 3.19Å; S1336-K1340 PolarHBondContact O-N 3.33Å; S1336-K1340 VanDerWaalsContact O-N 3.14Å; E1337-K1340 PolarHBondContact O-N 3.1Å; E1337-K1340 VanDerWaalsContact O-N 3.16Å; E1337-K1340 WeakPolarHBondContact OE1-CD 3.34Å; E1337-K1340 WeakPolarHBondContact OE1-CE 3.37Å; E1337-K1340 IonicContact OE1-NZ 3.07Å; E1337-K1340 PolarHBondContact OE1-NZ 3.11Å
1341	V	30.9	Very low	32.6	Very low	126 Å²	126	111 Å²	111	76%	0.764	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	36.2	169.5	-80.8	0	0	0	0	112.7	R1339	R1339-V1341 VanDerWaalsContact C-N 3.28Å; R1339-V1341 PolarHBondContact O-N 2.9Å
1342	S	28.8	Very low	32.1	Very low	91 Å²	91	108.4 Å²	108.4	64%	0.636	64%	0.644	S	S	*	*			trans	-147.7	57.4	172.3	-169	0	0	0	0	114.2	R1339	R1339-S1342 PolarHBondContact O-N 3.4Å
1343	G	29.5	Very low	31.4	Very low	73 Å²	73	108.5 Å²	108.5	75%	0.753	65%	0.645	S	S	*	*			trans	-112.9	116	159.1	0	0	0	0	0	108.9
1344	V	25.7	Very low	31.1	Very low	109 Å²	109	107.7 Å²	107.7	66%	0.661	65%	0.647	S	S	*	*				71.2	86.9	58	-174.8	0	0	0	0	112.6
1345	S	29.9	Very low	30.5	Very low	118 Å²	118	107.1 Å²	107.1	83%	0.825	64%	0.642	S	S	*	*			trans	-176.5	85.1	157.9	-79.4	0	0	0	0	107.1
1346	H	27	Very low	30.1	Very low	162 Å²	162	107.3 Å²	107.3	75%	0.75	65%	0.649	S	S	*	*				65.1	116.6	81.6	-74.8	-83.4	0	0	0	116.2
1347	S	25.2	Very low	29.7	Very low	120 Å²	120	111.7 Å²	111.7	84%	0.839	67%	0.668	S	S	*	*			trans	79	166.5	150.1	81.9	0	0	0	0	120.1
1348	A	27.3	Very low	29.1	Very low	85 Å²	85	113.1 Å²	113.1	70%	0.702	68%	0.683	S	S	*	*			trans	61.4	93.5	169.9	0	0	0	0	0	118.3
1349	S	26.9	Very low	28.7	Very low	117 Å²	117	111.9 Å²	111.9	82%	0.818	69%	0.685	S	S	*	*			trans	-56.4	145.5	144.5	-47.5	0	0	0	0	109.8
1350	P	27.6	Very low	28.3	Very low	122 Å²	122	111.2 Å²	111.2	79%	0.792	69%	0.691	S	S	*	*				-131.4	143.8	120.2	35.7	-29	0	0	0	112.9
1351	S	26	Very low	28.1	Very low	103 Å²	103	109.3 Å²	109.3	72%	0.72	69%	0.691	S	S	*	*			trans	-87.8	169.3	166.3	-60.3	0	0	0	0	111.1
1352	T	27.6	Very low	28.3	Very low	94 Å²	94	108.2 Å²	108.2	58%	0.577	69%	0.687	S	S	*	*			trans	87.9	151.2	145.1	-24	0	0	0	0	119.7	T843	T843-T1352 WeakPolarHBondContact O-CG2 3.12Å
1353	V	25.3	Very low	28.4	Very low	93 Å²	93	112.4 Å²	112.4	56%	0.564	70%	0.696	S	S	*	*			trans	63.5	155.8	162.9	-86.2	0	0	0	0	118.7	T844 A845	T844-V1353 WeakPolarHBondContact O-CA 3.34Å; T844-V1353 VanDerWaalsContact O-CG1 3.31Å; T844-V1353 WeakPolarHBondContact O-CG1 3.09Å; A845-V1353 CarbonylContact O-C 3.18Å; A845-V1353 WeakPolarHBondContact O-CA 3.4Å; A845-V1353 PolarHBondContact O-N 2.85Å
1354	V	26.7	Very low	28.5	Very low	98 Å²	98	113.4 Å²	113.4	59%	0.594	69%	0.688	S	S	*	*			cis	-151.2	157.9	-3.2	-111.8	0	0	0	0	107.4	A845 A846	A845-V1354 PolarHBondContact O-N 2.88Å; A846-V1354 CarbonylContact C-O 3.49Å; A846-V1354 PolarHBondContact N-O 3.04Å; A846-V1354 VanDerWaalsContact O-O 3.07Å
1355	E	26.8	Very low	28.8	Very low	89 Å²	89	115.4 Å²	115.4	42%	0.416	69%	0.694	S	S	.	*			cis	-151.9	160.2	-15.7	-154	-145.4	-125.4	0	0	107.5	A845 P847 L1357	A845-E1355 HydrophobicContact CB-CG 4.37Å; P847-E1355 WeakPolarHBondContact CD-O 3.18Å; E1355-L1357 VanDerWaalsContact CD-CD1 3.44Å; E1355-L1357 WeakPolarHBondContact OE1-CD1 3.34Å; E1355-L1357 VanDerWaalsContact OE2-CD1 3.22Å; E1355-L1357 WeakPolarHBondContact OE2-CD1 3.27Å
1356	S	27.7	Very low	29.3	Very low	80 Å²	80	114.9 Å²	114.9	56%	0.559	69%	0.687	S	S	*	*				164.1	136.3	91.3	-72.5	0	0	0	0	106.5
1357	L	28.5	Very low	29.6	Very low	138 Å²	138	114.5 Å²	114.5	72%	0.723	69%	0.69	S	S	*	*				70.8	141.9	61.3	-64.1	-171.6	0	0	0	113.8	E1355	E1355-L1357 VanDerWaalsContact CD-CD1 3.44Å; E1355-L1357 WeakPolarHBondContact OE1-CD1 3.34Å; E1355-L1357 VanDerWaalsContact OE2-CD1 3.22Å; E1355-L1357 WeakPolarHBondContact OE2-CD1 3.27Å
1358	T	29	Very low	29.9	Very low	127 Å²	127	112.9 Å²	112.9	78%	0.779	68%	0.684	S	S	*	*			cis	-129.3	-174.6	7.3	53.9	0	0	0	0	109.6
1359	S	28.6	Very low	30.1	Very low	93 Å²	93	114 Å²	114	65%	0.65	69%	0.685	S	S	*	*			cis	-163.9	-177.1	-28.5	48.1	0	0	0	0	105.3
1360	M	32.2	Very low	30.3	Very low	152 Å²	152	116.3 Å²	116.3	75%	0.749	68%	0.683	S	S	*	*			cis	-132.9	165.6	8.4	-70.5	-97.9	84.8	0	0	106.5
1361	T	32	Very low	30.4	Very low	106 Å²	106	115 Å²	115	65%	0.65	67%	0.673	S	S	*	*			cis	75.7	140.1	30.6	68.4	0	0	0	0	117.3
1362	P	35.5	Very low	30.7	Very low	102 Å²	102	116.6 Å²	116.6	66%	0.662	68%	0.678	S	S	*	*			cis	-147.6	176	-31	39.7	-21.4	0	0	0	116.8
1363	Q	31.9	Very low	31.3	Very low	179 Å²	179	117.7 Å²	117.7	84%	0.836	69%	0.687	S	S	*	*			trans	70.5	165.3	141.7	-91.3	-172.9	48.4	0	0	119.2
1364	T	30.5	Very low	31.4	Very low	95 Å²	95	117.6 Å²	117.6	58%	0.583	70%	0.696	S	S	*	*			cis	-161.3	149.6	5.1	-127.3	0	0	0	0	116.4
1365	I	32.4	Very low	31.4	Very low	151 Å²	151	117.5 Å²	117.5	77%	0.774	70%	0.699	S	S	*	*			trans	71.1	151.7	147.6	-71.5	179.4	0	0	0	124
1366	P	40.2	Very low	31.4	Very low	106 Å²	106	121.1 Å²	121.1	69%	0.688	72%	0.72	S	S	*	*			trans	-131.3	-160.7	-166.8	41.8	-20.1	0	0	0	114.9
1367	L	32.8	Very low	31.4	Very low	154 Å²	154	120.1 Å²	120.1	81%	0.806	72%	0.723	S	S	*	*			trans	159.5	133.3	148.3	-106	66.3	0	0	0	110.4
1368	A	33	Very low	31.5	Very low	87 Å²	87	122.8 Å²	122.8	72%	0.719	73%	0.731	S	S	*	*				68.7	138	103.5	0	0	0	0	0	115.7
1369	C	31.2	Very low	31.4	Very low	108 Å²	108	121 Å²	121	73%	0.73	73%	0.729	S	S	*	*			cis	-150.6	154.2	41.3	-96.7	0	0	0	0	111.9
1370	Q	30.9	Very low	31.8	Very low	166 Å²	166	122 Å²	122	78%	0.776	73%	0.733	S	S	*	*				73.1	141.6	77.2	-118.8	-155.5	96.4	0	0	113.4
1371	T	30.3	Very low	31.7	Very low	95 Å²	95	119.3 Å²	119.3	58%	0.583	74%	0.736	S	S	*	*			cis	-167.2	172.5	11.3	-24.2	0	0	0	0	114.4
1372	V	31.2	Very low	31.5	Very low	135 Å²	135	119.8 Å²	119.8	82%	0.818	74%	0.738	S	S	*	*			trans	73.8	150.9	153.1	-71.4	0	0	0	0	124
1373	P	39.5	Very low	31.1	Very low	118 Å²	118	122.8 Å²	122.8	77%	0.766	75%	0.747	S	S	*	*			trans	-145	-150.6	-149.8	45.6	-22.6	0	0	0	116.3
1374	A	27.6	Very low	30.9	Very low	90 Å²	90	118.1 Å²	118.1	74%	0.744	74%	0.739	S	S	*	*			trans	79	161.6	162.1	0	0	0	0	0	116.9
1375	S	28.5	Very low	30.8	Very low	96 Å²	96	118.1 Å²	118.1	67%	0.671	75%	0.748	S	S	*	*			cis	-159.7	163.5	8	-143.9	0	0	0	0	112.7
1376	I	26.7	Very low	30.6	Very low	165 Å²	165	115.4 Å²	115.4	85%	0.846	75%	0.748	S	S	*	*			trans	42	136.3	148.5	-60.6	156.4	0	0	0	119.4
1377	G	27.6	Very low	30	Very low	60 Å²	60	119 Å²	119	62%	0.619	76%	0.755	S	S	*	*			cis	154.2	168.7	2	0	0	0	0	0	111.4
1378	Q	29.6	Very low	29.8	Very low	194 Å²	194	115.8 Å²	115.8	91%	0.907	75%	0.751	S	S	*	*			trans	67	133.4	178.2	-55.5	174.6	-5.2	0	0	115.2
1379	A	27.2	Very low	29.6	Very low	89 Å²	89	116.4 Å²	116.4	74%	0.736	76%	0.757	S	S	*	*			cis	78.6	146.6	18	0	0	0	0	0	116.1
1380	P	36.6	Very low	29.5	Very low	113 Å²	113	116.7 Å²	116.7	73%	0.734	76%	0.76	S	S	*	*			cis	-139.6	167	-24.5	39.1	-22.4	0	0	0	116.3
1381	A	30.5	Very low	29.5	Very low	97 Å²	97	115.8 Å²	115.8	80%	0.802	76%	0.76	S	S	*	*			trans	60.4	179.6	156.1	0	0	0	0	0	116.2
1382	V	27.4	Very low	29.7	Very low	115 Å²	115	118.5 Å²	118.5	70%	0.697	77%	0.769	S	S	*	*			cis	-164	128.3	40.8	160.6	0	0	0	0	110.7
1383	I	27.7	Very low	30	Very low	166 Å²	166	117.1 Å²	117.1	85%	0.851	76%	0.763	S	S	*	*			trans	57.2	147.6	149.8	-60.9	173.2	0	0	0	118
1384	A	28.1	Very low	29.4	Very low	80 Å²	80	119.4 Å²	119.4	66%	0.661	77%	0.769	S	S	*	*			cis	-136.2	150.6	-4.3	0	0	0	0	0	107
1385	A	27.3	Very low	29.5	Very low	95 Å²	95	119 Å²	119	79%	0.785	77%	0.765	S	S	*	*				72.5	143.1	54	0	0	0	0	0	114.6
1386	A	28.6	Very low	29.7	Very low	94 Å²	94	120.1 Å²	120.1	78%	0.777	77%	0.773	S	S	*	*			trans	70.6	138.6	178.3	0	0	0	0	0	117.5
1387	H	28.3	Very low	29.8	Very low	181 Å²	181	118.7 Å²	118.7	84%	0.838	77%	0.771	S	S	*	*			cis	-160	159.1	-17.5	-130.9	-93.5	0	0	0	111.2
1388	A	27.7	Very low	30	Very low	87 Å²	87	121.5 Å²	121.5	72%	0.719	78%	0.779	S	S	*	*			trans	65.8	116.8	152.8	0	0	0	0	0	122.3
1389	A	28.4	Very low	30.1	Very low	101 Å²	101	120 Å²	120	84%	0.835	77%	0.772	S	S	*	*			trans	94.7	136.5	131.2	0	0	0	0	0	122.4
1390	S	29.3	Very low	30.2	Very low	113 Å²	113	120.4 Å²	120.4	79%	0.79	77%	0.769	S	S	*	*			trans	93.4	143	162	-142.6	0	0	0	0	119.8
1391	L	32	Very low	29.9	Very low	148 Å²	148	119.8 Å²	119.8	78%	0.775	77%	0.765	S	S	*	*			trans	76.7	95.5	162.4	-62.7	158.7	0	0	0	121.8
1392	I	33.4	Very low	29.9	Very low	151 Å²	151	118.1 Å²	118.1	77%	0.774	75%	0.748	S	S	*	*				18.6	148.1	115.7	-36	164.2	0	0	0	118.2
1393	P	37.7	Very low	30	Very low	107 Å²	107	121 Å²	121	70%	0.695	75%	0.746	S	S	*	*			cis	-131.6	170.4	-35.9	39.4	-24.4	0	0	0	114.3
1394	N	28.2	Very low	30.3	Very low	166 Å²	166	119.3 Å²	119.3	89%	0.888	74%	0.738	S	S	*	*			trans	-173	172.3	130.8	-120.7	-44.6	0	0	0	116.3
1395	A	28.4	Very low	30.3	Very low	80 Å²	80	121.3 Å²	121.3	66%	0.661	74%	0.738	S	S	*	*			trans	-74.3	161.9	-176.4	0	0	0	0	0	116.5
1396	S	32.2	Very low	30.8	Very low	120 Å²	120	121.7 Å²	121.7	84%	0.839	74%	0.741	S	S	*	*				-174.1	153.5	122.9	-82.4	0	0	0	0	113.7
1397	V	30.1	Very low	30.8	Very low	135 Å²	135	125.5 Å²	125.5	82%	0.818	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-102.2	131.2	175.2	171.1	0	0	0	0	110.2
1398	P	31.4	Very low	31	Very low	119 Å²	119	122.9 Å²	122.9	77%	0.773	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-89.5	145.7	160.3	34.1	-30.2	0	0	0	111.4
1399	Q	30.9	Very low	31.4	Very low	164 Å²	164	122 Å²	122	77%	0.766	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-82.2	148.5	173.9	-66	173.4	-7.9	0	0	110.9	P1401	Q1399-P1401 WeakPolarHBondContact O-CD 3.48Å
1400	S	29.7	Very low	31.9	Very low	97 Å²	97	123.8 Å²	123.8	68%	0.678	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-71.5	129.4	-177.6	53.9	0	0	0	0	113.8	V830	V830-S1400 VanDerWaalsContact CG1-O 3.28Å; V830-S1400 WeakPolarHBondContact CG1-O 3.41Å; V830-S1400 WeakPolarHBondContact CG2-O 3.35Å
1401	P	31.6	Very low	32.3	Very low	100 Å²	100	122.3 Å²	122.3	65%	0.649	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-89.7	160.4	161.2	-11.3	30.6	0	0	0	113.8	Q1399	Q1399-P1401 WeakPolarHBondContact O-CD 3.48Å
1402	S	29.9	Very low	32.7	Very low	62 Å²	62	116.8 Å²	116.8	43%	0.434	71%	0.707	S	S	.	*	P	Polyproline II helix	trans	-79.6	136.1	178.4	-33.8	0	0	0	0	112.9	P831	P831-S1402 WeakPolarHBondContact O-CB 3.09Å; P831-S1402 PolarHBondContact O-OG 2.81Å
1403	R	29	Very low	33.2	Very low	176 Å²	176	114.3 Å²	114.3	66%	0.664	70%	0.695	S	S	*	*			trans	53.8	112.5	140.6	-168.2	-169.7	-165.1	-175.9	6.2	118.5
1404	L	33.7	Very low	33.7	Very low	130 Å²	130	114.7 Å²	114.7	68%	0.681	69%	0.687	S	S	*	*				178.8	127.5	121.8	-91.7	163.8	0	0	0	112.2
1405	D	28.9	Very low	34.9	Very low	122 Å²	122	113.5 Å²	113.5	65%	0.652	68%	0.676	S	S	*	*			trans	41.8	119.2	143.2	-48.4	-7.6	0	0	0	122.1	R1529	D1405-R1529 IonicContact OD2-NH1 2.86Å
1406	A	36.5	Very low	36.2	Very low	103 Å²	103	116.9 Å²	116.9	85%	0.851	68%	0.676	S	S	*	*			trans	-155.8	42.6	162.3	0	0	0	0	0	112.9	T1408	A1406-T1408 PolarHBondContact O-N 2.84Å
1407	E	29.4	Very low	37.5	Very low	174 Å²	174	116.9 Å²	116.9	81%	0.813	67%	0.666	S	S	*	*			trans	-90.2	96.3	179.4	-72.9	-167.2	129.5	0	0	113.1
1408	T	32.1	Very low	39	Very low	125 Å²	125	115.4 Å²	115.4	77%	0.767	65%	0.65	S	S	*	*			trans	-144.4	99.2	159.3	51.1	0	0	0	0	110	A1406	A1406-T1408 PolarHBondContact O-N 2.84Å
1409	G	36.2	Very low	40.6	Very low	69 Å²	69	112.4 Å²	112.4	71%	0.711	64%	0.635	S	S	*	*	S	Bend	trans	173.9	-36.2	175.4	0	0	0	0	0	115.9
1410	L	40.1	Very low	42.2	Very low	139 Å²	139	110.2 Å²	110.2	73%	0.728	63%	0.628	S	S	*	*	S	Bend	trans	-84.3	-13.8	-172.7	-73.8	168.6	0	0	0	115.5	G1412 L1413	L1410-G1412 PolarHBondContact O-N 2.93Å; L1410-L1413 HydrophobicContact CD2-CD1 4.22Å; L1410-L1413 PolarHBondContact O-N 3.39Å
1411	A	37.7	Very low	44.2	Very low	81 Å²	81	111.9 Å²	111.9	67%	0.669	62%	0.623	S	S	*	*	H	α-helix	trans	-61	-44.9	177.5	0	0	0	0	0	112.3	L1413 H1414 E1415	A1411-L1413 PolarHBondContact O-N 2.78Å; A1411-L1413 VanDerWaalsContact O-N 3.09Å; A1411-H1414 PolarHBondContact O-N 2.8Å; A1411-H1414 VanDerWaalsContact O-N 3.15Å; A1411-E1415 PolarHBondContact O-N 2.79Å; A1411-E1415 VanDerWaalsContact O-N 3.14Å
1412	G	39.6	Very low	45.8	Very low	32 Å²	32	113.3 Å²	113.3	33%	0.33	62%	0.623	S	S	.	*	H	α-helix	trans	-66.7	-8.7	178.1	0	0	0	0	0	114.5	L1410 K1416	L1410-G1412 PolarHBondContact O-N 2.93Å; G1412-K1416 VanDerWaalsContact O-CB 3.22Å; G1412-K1416 WeakPolarHBondContact O-CB 3.35Å; G1412-K1416 VanDerWaalsContact O-CG 3.23Å; G1412-K1416 WeakPolarHBondContact O-CG 3.39Å; G1412-K1416 PolarHBondContact O-N 2.85Å
1413	L	43.7	Very low	47.6	Very low	99 Å²	99	113.2 Å²	113.2	52%	0.518	62%	0.616	S	S	.	*	H	α-helix	trans	-88.2	-31.5	174.2	-123.6	172.3	0	0	0	112.1	L1410 A1411 L1417	L1410-L1413 HydrophobicContact CD2-CD1 4.22Å; L1410-L1413 PolarHBondContact O-N 3.39Å; A1411-L1413 PolarHBondContact O-N 2.78Å; A1411-L1413 VanDerWaalsContact O-N 3.09Å; L1413-L1417 WeakPolarHBondContact O-CB 3.39Å; L1413-L1417 PolarHBondContact O-N 3.43Å
1414	H	48.2	Very low	49	Very low	116 Å²	116	110 Å²	110	54%	0.537	61%	0.608	S	S	.	*	H	α-helix	trans	-67.4	-49.9	166.2	-160.1	-80.1	0	0	0	109.4	A1411 K1416 L1417 E1418	A1411-H1414 PolarHBondContact O-N 2.8Å; A1411-H1414 VanDerWaalsContact O-N 3.15Å; H1414-K1416 VanDerWaalsContact C-N 3.3Å; H1414-K1416 PolarHBondContact O-N 3.04Å; H1414-L1417 PolarHBondContact O-N 2.97Å; H1414-E1418 IonicContact CE1-OE1 2.67Å; H1414-E1418 PolarHBondContact CE1-OE1 2.84Å; H1414-E1418 IonicContact CE1-OE2 2.7Å; H1414-E1418 PolarHBondContact CE1-OE2 2.91Å; H1414-E1418 IonicContact ND1-OE1 3.55Å; H1414-E1418 IonicContact ND1-OE2 3.7Å; H1414-E1418 PolarHBondContact ND1-OE2 3.45Å; H1414-E1418 WeakPolarHBondContact O-CB 3.35Å; H1414-E1418 PolarHBondContact O-N 2.99Å
1415	E	54.1	Low	50	Low	140 Å²	140	107.4 Å²	107.4	65%	0.654	60%	0.595	S	S	*	*	H	α-helix	trans	-58.4	-38.7	178.2	-167.2	176.4	-168.2	0	0	112.1	A1411 A1419	A1411-E1415 PolarHBondContact O-N 2.79Å; A1411-E1415 VanDerWaalsContact O-N 3.14Å; E1415-A1419 WeakPolarHBondContact O-CB 3.43Å; E1415-A1419 PolarHBondContact O-N 2.66Å
1416	K	55.7	Low	51.2	Low	151 Å²	151	107.8 Å²	107.8	66%	0.657	59%	0.587	S	S	*	*	H	α-helix	trans	-69.8	-37.3	171.3	-82.4	179.9	176.1	-176.8	0	113.8	G1412 H1414 E1418 L1420	G1412-K1416 VanDerWaalsContact O-CB 3.22Å; G1412-K1416 WeakPolarHBondContact O-CB 3.35Å; G1412-K1416 VanDerWaalsContact O-CG 3.23Å; G1412-K1416 WeakPolarHBondContact O-CG 3.39Å; G1412-K1416 PolarHBondContact O-N 2.85Å; H1414-K1416 VanDerWaalsContact C-N 3.3Å; H1414-K1416 PolarHBondContact O-N 3.04Å; K1416-E1418 VanDerWaalsContact C-N 3.32Å; K1416-L1420 WeakPolarHBondContact O-CB 3.47Å; K1416-L1420 WeakPolarHBondContact O-CD1 3.45Å; K1416-L1420 WeakPolarHBondContact O-CG 3.28Å; K1416-L1420 PolarHBondContact O-N 2.93Å
1417	L	58.9	Low	52	Low	121 Å²	121	111 Å²	111	63%	0.634	58%	0.577	S	S	*	*	H	α-helix	trans	-67.4	-37.6	175.5	-129.3	81	0	0	0	111.5	L1413 H1414 K1421	L1413-L1417 WeakPolarHBondContact O-CB 3.39Å; L1413-L1417 PolarHBondContact O-N 3.43Å; H1414-L1417 PolarHBondContact O-N 2.97Å; L1417-K1421 VanDerWaalsContact O-CB 3.3Å; L1417-K1421 WeakPolarHBondContact O-CB 3.21Å; L1417-K1421 PolarHBondContact O-N 3.02Å
1418	E	60.8	Low	52.8	Low	103 Å²	103	109.3 Å²	109.3	48%	0.481	57%	0.569	S	S	.	*	H	α-helix	trans	-78.9	-35.2	-176.8	-161	154.1	-134.4	0	0	111.1	H1414 K1416 K1421 M1422	H1414-E1418 IonicContact CE1-OE1 2.67Å; H1414-E1418 PolarHBondContact CE1-OE1 2.84Å; H1414-E1418 IonicContact CE1-OE2 2.7Å; H1414-E1418 PolarHBondContact CE1-OE2 2.91Å; H1414-E1418 IonicContact ND1-OE1 3.55Å; H1414-E1418 IonicContact ND1-OE2 3.7Å; H1414-E1418 PolarHBondContact ND1-OE2 3.45Å; H1414-E1418 WeakPolarHBondContact O-CB 3.35Å; H1414-E1418 PolarHBondContact O-N 2.99Å; K1416-E1418 VanDerWaalsContact C-N 3.32Å; E1418-K1421 PolarHBondContact O-N 3.43Å; E1418-M1422 WeakPolarHBondContact O-CB 3.49Å; E1418-M1422 WeakPolarHBondContact O-CG 3.46Å; E1418-M1422 PolarHBondContact O-N 2.73Å
1419	A	67	Low	53.5	Low	56 Å²	56	110.3 Å²	110.3	46%	0.463	57%	0.57	S	S	.	*	H	α-helix	trans	-72.2	-35.1	167.8	0	0	0	0	0	112.9	E1415 K1421 E1423	E1415-A1419 WeakPolarHBondContact O-CB 3.43Å; E1415-A1419 PolarHBondContact O-N 2.66Å; A1419-K1421 VanDerWaalsContact C-N 3.34Å; A1419-E1423 VanDerWaalsContact O-CB 3.25Å; A1419-E1423 WeakPolarHBondContact O-CB 3.28Å; A1419-E1423 PolarHBondContact O-N 3.29Å
1420	L	63.8	Low	53.6	Low	119 Å²	119	113.7 Å²	113.7	62%	0.623	57%	0.569	S	S	*	*	H	α-helix	trans	-66.9	-37.4	170.2	-81.3	168.3	0	0	0	111.3	K1416 E1423 Q1424	K1416-L1420 WeakPolarHBondContact O-CB 3.47Å; K1416-L1420 WeakPolarHBondContact O-CD1 3.45Å; K1416-L1420 WeakPolarHBondContact O-CG 3.28Å; K1416-L1420 PolarHBondContact O-N 2.93Å; L1420-E1423 PolarHBondContact O-N 3.22Å; L1420-Q1424 WeakPolarHBondContact O-CB 3.17Å; L1420-Q1424 PolarHBondContact O-N 2.67Å
1421	K	71.3	Confident	53.3	Low	131 Å²	131	110.3 Å²	110.3	57%	0.57	57%	0.568	S	S	*	*	H	α-helix	trans	-67.1	-46.7	173.2	-173	171.8	179.3	-177.8	0	111.3	L1417 E1418 A1419 E1423 Q1424 D1425	L1417-K1421 VanDerWaalsContact O-CB 3.3Å; L1417-K1421 WeakPolarHBondContact O-CB 3.21Å; L1417-K1421 PolarHBondContact O-N 3.02Å; E1418-K1421 PolarHBondContact O-N 3.43Å; A1419-K1421 VanDerWaalsContact C-N 3.34Å; K1421-E1423 VanDerWaalsContact C-N 3.31Å; K1421-E1423 PolarHBondContact O-N 2.65Å; K1421-Q1424 CarbonylContact O-C 3.4Å; K1421-Q1424 PolarHBondContact O-N 3.44Å; K1421-Q1424 VanDerWaalsContact O-N 3.09Å; K1421-D1425 WeakPolarHBondContact O-CB 3.45Å; K1421-D1425 PolarHBondContact O-N 3.41Å
1422	M	64.5	Low	53	Low	131 Å²	131	114.3 Å²	114.3	65%	0.645	58%	0.578	S	S	*	*	H	α-helix	trans	-61.6	-36.1	173.6	-77	-170.3	177.6	0	0	112.7	E1418 Q1424 R1426	E1418-M1422 WeakPolarHBondContact O-CB 3.49Å; E1418-M1422 WeakPolarHBondContact O-CG 3.46Å; E1418-M1422 PolarHBondContact O-N 2.73Å; M1422-Q1424 VanDerWaalsContact C-N 3.33Å; M1422-R1426 WeakPolarHBondContact O-CB 3.31Å; M1422-R1426 PolarHBondContact O-N 3.21Å
1423	E	67.6	Low	52.7	Low	60 Å²	60	120.4 Å²	120.4	28%	0.28	60%	0.603	S	S	.	*	H	α-helix	trans	-77.5	-17.5	175.5	-179.3	59	-168.5	0	0	112.9	A1419 L1420 K1421 R1426 R1427	A1419-E1423 VanDerWaalsContact O-CB 3.25Å; A1419-E1423 WeakPolarHBondContact O-CB 3.28Å; A1419-E1423 PolarHBondContact O-N 3.29Å; L1420-E1423 PolarHBondContact O-N 3.22Å; K1421-E1423 VanDerWaalsContact C-N 3.31Å; K1421-E1423 PolarHBondContact O-N 2.65Å; E1423-R1426 VanDerWaalsContact CD-NH2 3.27Å; E1423-R1426 IonicContact OE1-NH2 2.73Å; E1423-R1426 PolarHBondContact OE1-NH2 3.39Å; E1423-R1426 IonicContact OE2-CZ 3.35Å; E1423-R1426 IonicContact OE2-NE 3.68Å; E1423-R1426 PolarHBondContact OE2-NE 3.43Å; E1423-R1426 IonicContact OE2-NH2 3.49Å; E1423-R1426 PolarHBondContact OE2-NH2 2.83Å; E1423-R1427 WeakPolarHBondContact O-CD 3.42Å; E1423-R1427 WeakPolarHBondContact O-CG 3.48Å; E1423-R1427 IonicContact OE1-CZ 2.97Å; E1423-R1427 IonicContact OE1-NE 2.71Å; E1423-R1427 PolarHBondContact OE1-NE 2.93Å; E1423-R1427 IonicContact OE1-NH2 2.67Å; E1423-R1427 PolarHBondContact OE1-NH2 3.44Å
1424	Q	58.6	Low	52.3	Low	109 Å²	109	119.5 Å²	119.5	51%	0.509	61%	0.61	S	S	.	*	H	α-helix	trans	-79.2	-53	166.4	-179.1	171.7	-9.6	0	0	110.6	L1420 K1421 M1422 R1426 R1427 E1428	L1420-Q1424 WeakPolarHBondContact O-CB 3.17Å; L1420-Q1424 PolarHBondContact O-N 2.67Å; K1421-Q1424 CarbonylContact O-C 3.4Å; K1421-Q1424 PolarHBondContact O-N 3.44Å; K1421-Q1424 VanDerWaalsContact O-N 3.09Å; M1422-Q1424 VanDerWaalsContact C-N 3.33Å; Q1424-R1426 VanDerWaalsContact C-N 3.27Å; Q1424-R1426 PolarHBondContact O-N 3.11Å; Q1424-R1427 CarbonylContact O-C 3.6Å; Q1424-R1427 WeakPolarHBondContact O-CA 3.31Å; Q1424-R1427 WeakPolarHBondContact O-CB 3.28Å; Q1424-R1427 PolarHBondContact O-N 3.24Å; Q1424-E1428 WeakPolarHBondContact CG-OE1 3.33Å; Q1424-E1428 PolarHBondContact NE2-OE1 2.94Å; Q1424-E1428 PolarHBondContact O-N 3.32Å
1425	D	56.5	Low	51.7	Low	75 Å²	75	122.1 Å²	122.1	40%	0.401	63%	0.626	S	S	.	*	H	α-helix	trans	-55.1	-43.1	176.3	-62.8	-18.2	0	0	0	110.2	K1421 R1427 E1428 D1429	K1421-D1425 WeakPolarHBondContact O-CB 3.45Å; K1421-D1425 PolarHBondContact O-N 3.41Å; D1425-R1427 PolarHBondContact O-N 2.81Å; D1425-E1428 PolarHBondContact O-N 3.4Å; D1425-D1429 VanDerWaalsContact O-CB 3.29Å; D1425-D1429 WeakPolarHBondContact O-CB 3.35Å; D1425-D1429 PolarHBondContact O-N 2.96Å
1426	R	53.3	Low	50.8	Low	129 Å²	129	118.4 Å²	118.4	49%	0.487	63%	0.625	S	S	.	*	H	α-helix	trans	-74.9	-0.6	175.7	-160.3	-159.6	67.4	69.1	1.8	114.6	M1422 E1423 Q1424	M1422-R1426 WeakPolarHBondContact O-CB 3.31Å; M1422-R1426 PolarHBondContact O-N 3.21Å; E1423-R1426 VanDerWaalsContact CD-NH2 3.27Å; E1423-R1426 IonicContact OE1-NH2 2.73Å; E1423-R1426 PolarHBondContact OE1-NH2 3.39Å; E1423-R1426 IonicContact OE2-CZ 3.35Å; E1423-R1426 IonicContact OE2-NE 3.68Å; E1423-R1426 PolarHBondContact OE2-NE 3.43Å; E1423-R1426 IonicContact OE2-NH2 3.49Å; E1423-R1426 PolarHBondContact OE2-NH2 2.83Å; Q1424-R1426 VanDerWaalsContact C-N 3.27Å; Q1424-R1426 PolarHBondContact O-N 3.11Å
1427	R	53.4	Low	49.8	Very low	172 Å²	172	117.5 Å²	117.5	65%	0.649	63%	0.633	S	S	*	*	H	α-helix	trans	-105.2	-24.7	167.2	-76	173.4	-170.6	-158.4	4.1	112.3	E1423 Q1424 D1425	E1423-R1427 WeakPolarHBondContact O-CD 3.42Å; E1423-R1427 WeakPolarHBondContact O-CG 3.48Å; E1423-R1427 IonicContact OE1-CZ 2.97Å; E1423-R1427 IonicContact OE1-NE 2.71Å; E1423-R1427 PolarHBondContact OE1-NE 2.93Å; E1423-R1427 IonicContact OE1-NH2 2.67Å; E1423-R1427 PolarHBondContact OE1-NH2 3.44Å; Q1424-R1427 CarbonylContact O-C 3.6Å; Q1424-R1427 WeakPolarHBondContact O-CA 3.31Å; Q1424-R1427 WeakPolarHBondContact O-CB 3.28Å; Q1424-R1427 PolarHBondContact O-N 3.24Å; D1425-R1427 PolarHBondContact O-N 2.81Å
1428	E	46.6	Very low	48.8	Very low	138 Å²	138	118.8 Å²	118.8	65%	0.645	65%	0.646	S	S	*	*	H	α-helix	trans	-83.5	-24.8	173.1	-66.9	177	-157.8	0	0	111.3	Q1424 D1425	Q1424-E1428 WeakPolarHBondContact CG-OE1 3.33Å; Q1424-E1428 PolarHBondContact NE2-OE1 2.94Å; Q1424-E1428 PolarHBondContact O-N 3.32Å; D1425-E1428 PolarHBondContact O-N 3.4Å
1429	D	45.2	Very low	47.4	Very low	145 Å²	145	120.1 Å²	120.1	78%	0.775	66%	0.661	S	S	*	*	S	Bend	trans	-93.5	20.1	175	-161.1	37.7	0	0	0	114.2	D1425	D1425-D1429 VanDerWaalsContact O-CB 3.29Å; D1425-D1429 WeakPolarHBondContact O-CB 3.35Å; D1425-D1429 PolarHBondContact O-N 2.96Å
1430	M	39.8	Very low	46	Very low	141 Å²	141	124 Å²	124	70%	0.695	68%	0.679	S	S	*	*	S	Bend	trans	-123.4	70.4	174.4	-79.4	-94.6	-76.1	0	0	109.7
1431	G	33.1	Very low	44.5	Very low	68 Å²	68	123.8 Å²	123.8	70%	0.701	68%	0.678	S	S	*	*			trans	-68.3	150.6	-171.8	0	0	0	0	0	116.1
1432	D	31.5	Very low	42.8	Very low	164 Å²	164	119.6 Å²	119.6	88%	0.877	67%	0.673	S	S	*	*			trans	13.3	114.3	157.4	-63.2	-39.5	0	0	0	119.8
1433	D	33.8	Very low	41.4	Very low	161 Å²	161	118.9 Å²	118.9	86%	0.861	67%	0.666	S	S	*	*				-158.2	158.8	129.8	-133.4	-30.5	0	0	0	113.8
1434	A	34.5	Very low	40.2	Very low	80 Å²	80	123.7 Å²	123.7	66%	0.661	69%	0.694	S	S	*	*			trans	67.5	81	165.8	0	0	0	0	0	121.8
1435	I	35.7	Very low	39.6	Very low	171 Å²	171	127 Å²	127	88%	0.877	71%	0.709	S	S	*	*				37.6	133.4	107.9	-51.6	160.2	0	0	0	118.3
1436	G	36.2	Very low	39.3	Very low	62 Å²	62	127.7 Å²	127.7	64%	0.639	71%	0.712	S	S	*	*			cis	156.9	167.9	-2.4	0	0	0	0	0	115
1437	T	34.7	Very low	39	Very low	132 Å²	132	125.1 Å²	125.1	81%	0.81	71%	0.712	S	S	*	*			trans	61.6	114.1	163.3	60	0	0	0	0	121.9
1438	T	36.6	Very low	39.2	Very low	148 Å²	148	122.7 Å²	122.7	91%	0.908	71%	0.711	S	S	*	*				-165.9	158.3	105.6	16.3	0	0	0	0	111.2
1439	T	32.5	Very low	39.6	Very low	130 Å²	130	123.8 Å²	123.8	80%	0.798	72%	0.721	S	S	*	*			trans	-97.9	141.5	-166.6	47.3	0	0	0	0	114.6
1440	T	37.9	Very low	40.9	Very low	139 Å²	139	119.5 Å²	119.5	85%	0.853	70%	0.7	S	S	*	*				-170.5	102.4	115.8	31.3	0	0	0	0	111.9
1441	D	32.2	Very low	42	Very low	113 Å²	113	120.5 Å²	120.5	60%	0.604	71%	0.707	S	S	*	*			trans	32.7	105.2	141.1	-108.2	-24	0	0	0	121.4	T1310 P1311	T1310-D1441 HydrophobicContact CG2-CB 3.38Å; T1310-D1441 WeakPolarHBondContact CG2-OD1 3.44Å; P1311-D1441 VanDerWaalsContact CD-OD1 3.3Å; P1311-D1441 WeakPolarHBondContact CD-OD1 3.49Å
1442	G	34.1	Very low	43.9	Very low	44 Å²	44	123.8 Å²	123.8	45%	0.454	70%	0.702	S	S	.	*			trans	-171.7	136.5	165.8	0	0	0	0	0	111.5
1443	K	36	Very low	46.1	Very low	116 Å²	116	116.3 Å²	116.3	50%	0.504	66%	0.664	S	S	.	*			trans	-84.4	106.4	169.4	-72.7	164.6	161.6	145.6	0	108.8	V1309 T1310 P1311	V1309-K1443 HydrophobicContact CG1-CB 3.55Å; V1309-K1443 HydrophobicContact CG1-CD 4.4Å; V1309-K1443 HydrophobicContact CG1-CG 4.14Å; V1309-K1443 HydrophobicContact CG2-CB 4.46Å; T1310-K1443 WeakPolarHBondContact O-CD 3.36Å; T1310-K1443 WeakPolarHBondContact O-CE 3.4Å; T1310-K1443 PolarHBondContact O-NZ 3.17Å; P1311-K1443 HydrophobicContact CB-CD 4.38Å; P1311-K1443 HydrophobicContact CB-CG 3.6Å; P1311-K1443 HydrophobicContact CG-CG 3.76Å
1444	D	41.3	Very low	47.7	Very low	161 Å²	161	112.9 Å²	112.9	86%	0.861	65%	0.645	S	S	*	*			trans	-84.7	111.9	160.7	-67.4	-42.8	0	0	0	108.9
1445	E	47.6	Very low	49.4	Very low	179 Å²	179	111.8 Å²	111.8	84%	0.836	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-75.9	125.2	166.7	-67.4	-174.5	131.7	0	0	108.7	P1447	E1445-P1447 VanDerWaalsContact O-CD 3.29Å; E1445-P1447 WeakPolarHBondContact O-CD 3.05Å
1446	I	49	Very low	51	Low	89 Å²	89	106.4 Å²	106.4	46%	0.456	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-63.9	120.4	171.4	-61	175.8	0	0	0	107.4	I1448	I1446-I1448 PolarHBondContact O-N 2.87Å
1447	P	47.8	Very low	52.6	Low	75 Å²	75	105.5 Å²	105.5	49%	0.487	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-62.8	129	-176.6	-21.9	32.6	0	0	0	110.9	E1445 D1449 T1450	E1445-P1447 VanDerWaalsContact O-CD 3.29Å; E1445-P1447 WeakPolarHBondContact O-CD 3.05Å; P1447-D1449 PolarHBondContact O-N 2.89Å; P1447-T1450 HydrophobicContact CB-CG2 4.25Å; P1447-T1450 HydrophobicContact CG-CG2 4.5Å; P1447-T1450 WeakPolarHBondContact O-CB 3.38Å; P1447-T1450 PolarHBondContact O-N 3.39Å; P1447-T1450 PolarHBondContact O-OG1 3Å
1448	I	56.7	Low	53.9	Low	121 Å²	121	103.5 Å²	103.5	62%	0.621	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.8	-25.1	178.2	-61.1	174.2	0	0	0	110.6	I1446 T1450	I1446-I1448 PolarHBondContact O-N 2.87Å; I1448-T1450 PolarHBondContact O-N 3.13Å
1449	D	56.4	Low	55.2	Low	160 Å²	160	97.8 Å²	97.8	86%	0.856	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-12.4	174.1	-52	-64.5	0	0	0	114.2	P1447	P1447-D1449 PolarHBondContact O-N 2.89Å
1450	T	71.6	Confident	56.7	Low	56 Å²	56	98.5 Å²	98.5	34%	0.344	54%	0.541	S	S	.	.	S	Bend	trans	-81.5	138.9	171.5	64.9	0	0	0	0	110.7	P1447 I1448 K1452 G1453 L1454	P1447-T1450 HydrophobicContact CB-CG2 4.25Å; P1447-T1450 HydrophobicContact CG-CG2 4.5Å; P1447-T1450 WeakPolarHBondContact O-CB 3.38Å; P1447-T1450 PolarHBondContact O-N 3.39Å; P1447-T1450 PolarHBondContact O-OG1 3Å; I1448-T1450 PolarHBondContact O-N 3.13Å; T1450-K1452 PolarHBondContact O-N 2.57Å; T1450-K1452 VanDerWaalsContact O-N 3.1Å; T1450-G1453 PolarHBondContact O-N 2.62Å; T1450-G1453 PolarHBondContact OG1-N 2.86Å; T1450-L1454 PolarHBondContact O-N 2.95Å
1451	L	63.1	Low	57.4	Low	161 Å²	161	97 Å²	97	84%	0.843	53%	0.531	S	S	*	.	H	α-helix	trans	-59.6	-27	179.1	-155.5	143.9	0	0	0	112.2	A1455	L1451-A1455 VanDerWaalsContact O-CB 3.23Å; L1451-A1455 WeakPolarHBondContact O-CB 3.39Å; L1451-A1455 PolarHBondContact O-N 2.89Å
1452	K	72	Confident	58.2	Low	137 Å²	137	97.5 Å²	97.5	60%	0.596	53%	0.532	S	S	*	.	H	α-helix	trans	-71.2	-49.2	169.6	-172.5	176.8	-171.3	-84.6	0	112.7	T1450 L1454 A1455 E1456	T1450-K1452 PolarHBondContact O-N 2.57Å; T1450-K1452 VanDerWaalsContact O-N 3.1Å; K1452-L1454 VanDerWaalsContact C-N 3.3Å; K1452-L1454 PolarHBondContact O-N 2.94Å; K1452-A1455 PolarHBondContact O-N 2.94Å; K1452-E1456 IonicContact NZ-OE1 2.75Å; K1452-E1456 PolarHBondContact NZ-OE1 3.07Å; K1452-E1456 PolarHBondContact O-N 3.22Å
1453	G	78.2	Confident	58.6	Low	8 Å²	8	103.2 Å²	103.2	8%	0.082	55%	0.547	C	S	.	.	H	α-helix	trans	-59.7	-40.8	177.2	0	0	0	0	0	112.3	T1450 E1456 A1457	T1450-G1453 PolarHBondContact O-N 2.62Å; T1450-G1453 PolarHBondContact OG1-N 2.86Å; G1453-E1456 PolarHBondContact O-N 2.87Å; G1453-A1457 VanDerWaalsContact O-CB 3.27Å; G1453-A1457 WeakPolarHBondContact O-CB 3.48Å; G1453-A1457 PolarHBondContact O-N 2.8Å
1454	L	67.8	Low	58.7	Low	89 Å²	89	101 Å²	101	47%	0.466	55%	0.55	S	S	.	*	H	α-helix	trans	-68.1	-40.7	175.8	-155	153.9	0	0	0	111.9	T1450 K1452 A1457 L1458	T1450-L1454 PolarHBondContact O-N 2.95Å; K1452-L1454 VanDerWaalsContact C-N 3.3Å; K1452-L1454 PolarHBondContact O-N 2.94Å; L1454-A1457 PolarHBondContact O-N 3.39Å; L1454-L1458 HydrophobicContact CD2-CD1 3.57Å; L1454-L1458 HydrophobicContact CD2-CG 4.02Å; L1454-L1458 WeakPolarHBondContact O-CB 3.4Å; L1454-L1458 WeakPolarHBondContact O-CG 3.48Å; L1454-L1458 PolarHBondContact O-N 3.21Å
1455	A	70.2	Confident	58.5	Low	57 Å²	57	101.6 Å²	101.6	47%	0.471	55%	0.553	S	S	.	*	H	α-helix	trans	-65.3	-41.1	173.8	0	0	0	0	0	112.8	L1451 K1452 G1459	L1451-A1455 VanDerWaalsContact O-CB 3.23Å; L1451-A1455 WeakPolarHBondContact O-CB 3.39Å; L1451-A1455 PolarHBondContact O-N 2.89Å; K1452-A1455 PolarHBondContact O-N 2.94Å; A1455-G1459 PolarHBondContact O-N 2.65Å
1456	E	70	Confident	57.8	Low	58 Å²	58	96.2 Å²	96.2	27%	0.271	55%	0.547	S	S	.	.	H	α-helix	trans	-67	-38.3	174.3	-77.8	-173	-142.1	0	0	112.5	K1452 G1453 G1459 K1460	K1452-E1456 IonicContact NZ-OE1 2.75Å; K1452-E1456 PolarHBondContact NZ-OE1 3.07Å; K1452-E1456 PolarHBondContact O-N 3.22Å; G1453-E1456 PolarHBondContact O-N 2.87Å; E1456-G1459 PolarHBondContact O-N 3.32Å; E1456-K1460 WeakPolarHBondContact O-CB 3.38Å; E1456-K1460 WeakPolarHBondContact O-CD 3.45Å; E1456-K1460 VanDerWaalsContact O-CG 3.24Å; E1456-K1460 WeakPolarHBondContact O-CG 3.27Å; E1456-K1460 PolarHBondContact O-N 3.42Å; E1456-K1460 IonicContact OE2-NZ 3.31Å; E1456-K1460 PolarHBondContact OE2-NZ 3.14Å; E1456-K1460 VanDerWaalsContact OE2-NZ 3.11Å
1457	A	68.9	Low	56.9	Low	43 Å²	43	102.9 Å²	102.9	36%	0.355	57%	0.566	S	S	.	*	H	α-helix	trans	-66	-45.9	175.5	0	0	0	0	0	111.4	G1453 L1454 K1460 V1461	G1453-A1457 VanDerWaalsContact O-CB 3.27Å; G1453-A1457 WeakPolarHBondContact O-CB 3.48Å; G1453-A1457 PolarHBondContact O-N 2.8Å; L1454-A1457 PolarHBondContact O-N 3.39Å; A1457-K1460 PolarHBondContact O-N 3.48Å; A1457-V1461 WeakPolarHBondContact O-CG2 3.47Å; A1457-V1461 PolarHBondContact O-N 3.11Å; A1457-V1461 VanDerWaalsContact O-N 3.12Å
1458	L	62.4	Low	56.2	Low	89 Å²	89	107.2 Å²	107.2	47%	0.466	58%	0.58	S	S	.	*	H	α-helix	trans	-63.2	-41.5	173.8	-74.6	179	0	0	0	111.7	L1454 K1460 V1461 I1462	L1454-L1458 HydrophobicContact CD2-CD1 3.57Å; L1454-L1458 HydrophobicContact CD2-CG 4.02Å; L1454-L1458 WeakPolarHBondContact O-CB 3.4Å; L1454-L1458 WeakPolarHBondContact O-CG 3.48Å; L1454-L1458 PolarHBondContact O-N 3.21Å; L1458-K1460 VanDerWaalsContact C-N 3.34Å; L1458-K1460 PolarHBondContact O-N 3.11Å; L1458-V1461 PolarHBondContact O-N 3.42Å; L1458-V1461 VanDerWaalsContact O-N 3.13Å; L1458-I1462 HydrophobicContact CB-CD1 4.11Å; L1458-I1462 HydrophobicContact CD2-CD1 4.49Å; L1458-I1462 VanDerWaalsContact O-CB 3.27Å; L1458-I1462 WeakPolarHBondContact O-CB 3.14Å; L1458-I1462 VanDerWaalsContact O-CG1 3.22Å; L1458-I1462 WeakPolarHBondContact O-CG1 3.45Å; L1458-I1462 PolarHBondContact O-N 2.8Å
1459	G	62.7	Low	55	Low	29 Å²	29	107 Å²	107	30%	0.299	58%	0.584	S	S	.	*	H	α-helix	trans	-57.7	-44.9	174.8	0	0	0	0	0	112.5	A1455 E1456 V1461 I1462 H1463	A1455-G1459 PolarHBondContact O-N 2.65Å; E1456-G1459 PolarHBondContact O-N 3.32Å; G1459-V1461 VanDerWaalsContact C-N 3.27Å; G1459-V1461 PolarHBondContact O-N 3.43Å; G1459-I1462 PolarHBondContact O-N 3.06Å; G1459-H1463 PolarHBondContact O-CD2 3.28Å; G1459-H1463 PolarHBondContact O-N 3.02Å; G1459-H1463 VanDerWaalsContact O-N 3.12Å
1460	K	65.9	Low	53.7	Low	144 Å²	144	105.8 Å²	105.8	63%	0.626	58%	0.583	S	S	*	*	H	α-helix	trans	-66.7	-24	177.1	-71.6	161	-170.9	157.1	0	113.5	E1456 A1457 L1458	E1456-K1460 WeakPolarHBondContact O-CB 3.38Å; E1456-K1460 WeakPolarHBondContact O-CD 3.45Å; E1456-K1460 VanDerWaalsContact O-CG 3.24Å; E1456-K1460 WeakPolarHBondContact O-CG 3.27Å; E1456-K1460 PolarHBondContact O-N 3.42Å; E1456-K1460 IonicContact OE2-NZ 3.31Å; E1456-K1460 PolarHBondContact OE2-NZ 3.14Å; E1456-K1460 VanDerWaalsContact OE2-NZ 3.11Å; A1457-K1460 PolarHBondContact O-N 3.48Å; L1458-K1460 VanDerWaalsContact C-N 3.34Å; L1458-K1460 PolarHBondContact O-N 3.11Å
1461	V	52.4	Low	51.7	Low	108 Å²	108	109.4 Å²	109.4	66%	0.655	61%	0.607	S	S	*	*	H	α-helix	trans	-91.3	-31.7	176.2	173.2	0	0	0	0	112.6	A1457 L1458 G1459	A1457-V1461 WeakPolarHBondContact O-CG2 3.47Å; A1457-V1461 PolarHBondContact O-N 3.11Å; A1457-V1461 VanDerWaalsContact O-N 3.12Å; L1458-V1461 PolarHBondContact O-N 3.42Å; L1458-V1461 VanDerWaalsContact O-N 3.13Å; G1459-V1461 VanDerWaalsContact C-N 3.27Å; G1459-V1461 PolarHBondContact O-N 3.43Å
1462	I	47.3	Very low	50.3	Low	123 Å²	123	109.1 Å²	109.1	63%	0.631	60%	0.603	S	S	*	*	H	α-helix	trans	-86.6	-22.9	-174.6	-67.9	169.4	0	0	0	112.4	L1458 G1459 A1464	L1458-I1462 HydrophobicContact CB-CD1 4.11Å; L1458-I1462 HydrophobicContact CD2-CD1 4.49Å; L1458-I1462 VanDerWaalsContact O-CB 3.27Å; L1458-I1462 WeakPolarHBondContact O-CB 3.14Å; L1458-I1462 VanDerWaalsContact O-CG1 3.22Å; L1458-I1462 WeakPolarHBondContact O-CG1 3.45Å; L1458-I1462 PolarHBondContact O-N 2.8Å; G1459-I1462 PolarHBondContact O-N 3.06Å; I1462-A1464 VanDerWaalsContact C-N 3.35Å
1463	H	43.3	Very low	48.5	Very low	164 Å²	164	108 Å²	108	76%	0.759	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	3.4	173.1	-76.9	-83.1	0	0	0	114.5	G1459 D1465	G1459-H1463 PolarHBondContact O-CD2 3.28Å; G1459-H1463 PolarHBondContact O-N 3.02Å; G1459-H1463 VanDerWaalsContact O-N 3.12Å; H1463-D1465 PolarHBondContact O-N 3.37Å
1464	A	38.8	Very low	46.4	Very low	70 Å²	70	112.2 Å²	112.2	58%	0.579	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	42.4	-175.9	0	0	0	0	0	114.3	I1462	I1462-A1464 VanDerWaalsContact C-N 3.35Å
1465	D	35.4	Very low	44.7	Very low	173 Å²	173	114.7 Å²	114.7	93%	0.925	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-155.9	37.5	164.7	-115.8	-20.4	0	0	0	111.9	H1463	H1463-D1465 PolarHBondContact O-N 3.37Å
1466	G	33.6	Very low	43	Very low	67 Å²	67	119.3 Å²	119.3	69%	0.691	66%	0.661	S	S	*	*			trans	-86.3	157.3	171.2	0	0	0	0	0	112.9
1467	R	31	Very low	41.4	Very low	228 Å²	228	117.7 Å²	117.7	86%	0.86	66%	0.656	S	S	*	*			trans	-54.2	158.1	170	-60.4	-178.9	-178.3	133.9	-4.8	110.9
1468	E	31.8	Very low	39.7	Very low	166 Å²	166	117.5 Å²	117.5	78%	0.776	65%	0.649	S	S	*	*			cis	-158.3	-175.4	39.6	-146.2	123.9	-121.6	0	0	113.2
1469	T	31.3	Very low	38.4	Very low	117 Å²	117	119.4 Å²	119.4	72%	0.718	66%	0.659	S	S	*	*			trans	-106.1	155.6	-168.8	50.9	0	0	0	0	115.2
1470	T	29.6	Very low	36.9	Very low	135 Å²	135	122.8 Å²	122.8	83%	0.828	67%	0.674	S	S	*	*			trans	67.7	166.4	164.9	31.5	0	0	0	0	116.5
1471	P	29.4	Very low	35.4	Very low	131 Å²	131	123.3 Å²	123.3	85%	0.851	68%	0.684	S	S	*	*			cis	-125	-164.3	10.6	42.2	-25.2	0	0	0	116.2
1472	M	35.1	Very low	34.6	Very low	156 Å²	156	122.5 Å²	122.5	77%	0.768	69%	0.688	S	S	*	*			trans	-118.1	155.5	-162.5	-162.6	-168.1	87.3	0	0	113.1	P1474	M1472-P1474 HydrophobicContact CE-CB 4.33Å
1473	P	33.7	Very low	33.9	Very low	113 Å²	113	121.7 Å²	121.7	73%	0.734	69%	0.693	S	S	*	*			trans	-113.4	163.5	156.8	31.4	-17.2	0	0	0	113.4
1474	P	33	Very low	33.4	Very low	97 Å²	97	119.4 Å²	119.4	63%	0.63	69%	0.691	S	S	*	*			trans	-127.4	-173.7	-136.1	41.8	-28.4	0	0	0	119.1	M1472	M1472-P1474 HydrophobicContact CE-CB 4.33Å
1475	D	33.5	Very low	33	Very low	141 Å²	141	119.5 Å²	119.5	75%	0.754	70%	0.699	S	S	*	*			trans	92.5	72.7	153.7	-58.2	-31.6	0	0	0	123.4
1476	H	34.2	Very low	32.7	Very low	154 Å²	154	117 Å²	117	71%	0.713	68%	0.681	S	S	*	*				59.1	169.2	117	-109	-10	0	0	0	124.6
1477	P	36.7	Very low	33	Very low	24 Å²	24	122.8 Å²	122.8	16%	0.156	69%	0.693	C	S	.	*			cis	-127	-172.4	-40.6	44.2	-35.5	0	0	0	112.8	P1635 Q1637 N1638	P1477-P1635 WeakPolarHBondContact CD-O 3.13Å; P1477-P1635 VanDerWaalsContact CG-O 3.24Å; P1477-P1635 WeakPolarHBondContact CG-O 3.04Å; P1477-Q1637 HydrophobicContact CG-CG 3.79Å; P1477-N1638 VanDerWaalsContact O-CA 3.23Å; P1477-N1638 WeakPolarHBondContact O-CA 3.22Å; P1477-N1638 WeakPolarHBondContact O-CB 3.33Å; P1477-N1638 PolarHBondContact O-ND2 3.43Å
1478	D	33.6	Very low	33.2	Very low	38 Å²	38	115.5 Å²	115.5	20%	0.203	67%	0.671	C	S	.	*			trans	-173	163.6	140.6	-135.8	159.7	0	0	0	119	T1480 Q1637 N1638 H1639	D1478-T1480 PolarHBondContact O-N 2.92Å; D1478-Q1637 HydrophobicContact CB-CG 4.47Å; D1478-Q1637 WeakPolarHBondContact OD2-CB 3.49Å; D1478-Q1637 VanDerWaalsContact OD2-CD 3.24Å; D1478-Q1637 WeakPolarHBondContact OD2-CG 3.31Å; D1478-Q1637 PolarHBondContact OD2-NE2 3.5Å; D1478-Q1637 VanDerWaalsContact OD2-NE2 3.09Å; D1478-N1638 WeakPolarHBondContact OD1-CA 3.44Å; D1478-N1638 PolarHBondContact OD1-N 2.93Å; D1478-H1639 HydrophobicContact CB-CB 3.55Å; D1478-H1639 WeakPolarHBondContact CB-ND1 3.37Å; D1478-H1639 WeakPolarHBondContact OD1-CB 3.27Å
1479	L	34	Very low	33.7	Very low	129 Å²	129	113 Å²	113	68%	0.675	66%	0.662	S	S	*	*				37.4	26.4	120.3	66.9	71.3	0	0	0	120.6
1480	T	32.4	Very low	33.7	Very low	101 Å²	101	115.3 Å²	115.3	62%	0.62	67%	0.665	S	S	*	*			trans	-37.8	132.6	165.1	48.7	0	0	0	0	115.8	D1478	D1478-T1480 PolarHBondContact O-N 2.92Å
1481	D	33.9	Very low	34.1	Very low	155 Å²	155	114 Å²	114	83%	0.829	66%	0.661	S	S	*	*			trans	172.8	157.9	135.3	-92.6	-13.6	0	0	0	109.8
1482	A	34.2	Very low	34.8	Very low	90 Å²	90	112.5 Å²	112.5	74%	0.744	64%	0.643	S	S	*	*			cis	-174	152.3	-28.7	0	0	0	0	0	107
1483	S	34	Very low	35.7	Very low	106 Å²	106	109.3 Å²	109.3	74%	0.741	63%	0.629	S	S	*	*			cis	-111.7	-175.4	-7.4	73.9	0	0	0	0	109.1
1484	T	31.9	Very low	37.3	Very low	116 Å²	116	108.2 Å²	108.2	71%	0.712	62%	0.622	S	S	*	*			cis	73.2	95.3	24.4	-36.4	0	0	0	0	116.6	Q1486	T1484-Q1486 HydrophobicContact CG2-CB 4.27Å
1485	G	31.7	Very low	38.9	Very low	72 Å²	72	110 Å²	110	74%	0.742	62%	0.622	S	S	*	*			trans	-129.5	120.2	138.6	0	0	0	0	0	105.7
1486	Q	28.8	Very low	40.3	Very low	121 Å²	121	105.6 Å²	105.6	57%	0.565	60%	0.6	S	S	*	*			cis	53.5	70.9	36.3	-165.3	164.7	-7	0	0	110.3	T1484 D1488	T1484-Q1486 HydrophobicContact CG2-CB 4.27Å; Q1486-D1488 WeakPolarHBondContact CG-OD1 3.34Å; Q1486-D1488 PolarHBondContact NE2-OD1 2.93Å; Q1486-D1488 PolarHBondContact O-N 2.89Å
1487	M	39.5	Very low	41.9	Very low	188 Å²	188	100.8 Å²	100.8	93%	0.926	58%	0.579	S	S	*	*			trans	-75	105.6	148.5	-78.8	-163.3	-64.8	0	0	106.3	L1489	M1487-L1489 PolarHBondContact O-N 2.92Å
1488	D	35.3	Very low	43.6	Very low	75 Å²	75	105.4 Å²	105.4	40%	0.401	60%	0.598	S	S	.	*			trans	-62.2	120.1	-175	-80.5	-51.9	0	0	0	112.7	Q1486 E1490	Q1486-D1488 WeakPolarHBondContact CG-OD1 3.34Å; Q1486-D1488 PolarHBondContact NE2-OD1 2.93Å; Q1486-D1488 PolarHBondContact O-N 2.89Å; D1488-E1490 HydrophobicContact CB-CB 4.11Å; D1488-E1490 PolarHBondContact O-N 3.07Å
1489	L	42.5	Very low	45.5	Very low	113 Å²	113	108.9 Å²	108.9	59%	0.592	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	20.9	149.7	-79.3	162.5	0	0	0	110.8	M1487 I1497	M1487-L1489 PolarHBondContact O-N 2.92Å; L1489-I1497 HydrophobicContact CB-CD1 3.96Å; L1489-I1497 HydrophobicContact CD2-CD1 3.98Å; L1489-I1497 HydrophobicContact CD2-CG1 4.1Å; L1489-I1497 WeakPolarHBondContact O-CD1 3.4Å
1490	E	31.8	Very low	47.3	Very low	166 Å²	166	107 Å²	107	78%	0.776	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	2	176.9	-53.4	-159.7	142	0	0	112.8	D1488	D1488-E1490 HydrophobicContact CB-CB 4.11Å; D1488-E1490 PolarHBondContact O-N 3.07Å
1491	S	36.1	Very low	49.5	Very low	108 Å²	108	106 Å²	106	76%	0.755	60%	0.598	S	S	*	*	S	Bend	trans	-121.7	2.7	167.8	81.9	0	0	0	0	114.7
1492	E	44.4	Very low	51.7	Low	99 Å²	99	105.8 Å²	105.8	46%	0.463	59%	0.586	S	S	.	*	S	Bend	trans	-91.2	143.5	160.6	-67.1	-149.2	132.7	0	0	109
1493	D	55.5	Low	53.9	Low	90 Å²	90	106.2 Å²	106.2	48%	0.481	57%	0.572	S	S	.	*			trans	-57.3	135.5	-176.7	-163.4	-50.8	0	0	0	110.7	E1495 V1496 I1497	D1493-E1495 PolarHBondContact O-N 3.4Å; D1493-E1495 WeakPolarHBondContact OD1-CB 3.43Å; D1493-E1495 PolarHBondContact OD1-N 3.39Å; D1493-V1496 HydrophobicContact CB-CB 4.27Å; D1493-V1496 HydrophobicContact CB-CG2 4Å; D1493-V1496 WeakPolarHBondContact O-CA 3.2Å; D1493-V1496 WeakPolarHBondContact O-CB 3.26Å; D1493-V1496 PolarHBondContact O-N 2.88Å; D1493-I1497 PolarHBondContact O-N 3.2Å
1494	P	66.3	Low	56	Low	90 Å²	90	110.8 Å²	110.8	58%	0.584	57%	0.573	S	S	*	*	H	α-helix	trans	-53.6	-26.3	170.8	22.2	-34.4	0	0	0	112.8	Q1498	P1494-Q1498 WeakPolarHBondContact O-CB 3.49Å; P1494-Q1498 VanDerWaalsContact O-CG 3.25Å; P1494-Q1498 WeakPolarHBondContact O-CG 3.22Å; P1494-Q1498 PolarHBondContact O-N 3.06Å
1495	E	67	Low	58.3	Low	134 Å²	134	111.2 Å²	111.2	63%	0.626	57%	0.569	S	S	*	*	H	α-helix	trans	-67.9	-36.6	170.7	-166.1	170	-105.2	0	0	112.6	D1493 M1499	D1493-E1495 PolarHBondContact O-N 3.4Å; D1493-E1495 WeakPolarHBondContact OD1-CB 3.43Å; D1493-E1495 PolarHBondContact OD1-N 3.39Å; E1495-M1499 VanDerWaalsContact O-CB 3.26Å; E1495-M1499 WeakPolarHBondContact O-CB 3.33Å; E1495-M1499 PolarHBondContact O-N 3.5Å
1496	V	62.4	Low	60.8	Low	48 Å²	48	112.8 Å²	112.8	29%	0.291	56%	0.557	S	S	.	*	H	α-helix	trans	-68.7	-42.3	173.5	169.7	0	0	0	0	111.2	D1493 M1499 I1500	D1493-V1496 HydrophobicContact CB-CB 4.27Å; D1493-V1496 HydrophobicContact CB-CG2 4Å; D1493-V1496 WeakPolarHBondContact O-CA 3.2Å; D1493-V1496 WeakPolarHBondContact O-CB 3.26Å; D1493-V1496 PolarHBondContact O-N 2.88Å; V1496-M1499 HydrophobicContact CG2-CE 4.45Å; V1496-M1499 WeakPolarHBondContact O-CA 3.33Å; V1496-M1499 WeakPolarHBondContact O-CB 3.17Å; V1496-M1499 PolarHBondContact O-N 2.91Å; V1496-M1499 VanDerWaalsContact O-N 3.1Å; V1496-I1500 HydrophobicContact CG1-CD1 4.03Å; V1496-I1500 WeakPolarHBondContact O-CG1 3.34Å; V1496-I1500 PolarHBondContact O-N 3.21Å
1497	I	67.3	Low	63.1	Low	54 Å²	54	111.3 Å²	111.3	28%	0.277	55%	0.55	S	S	.	.	H	α-helix	trans	-64.9	-43.9	176.5	-60	176.9	0	0	0	110.1	L1489 D1493 M1499 I1500 V1501	L1489-I1497 HydrophobicContact CB-CD1 3.96Å; L1489-I1497 HydrophobicContact CD2-CD1 3.98Å; L1489-I1497 HydrophobicContact CD2-CG1 4.1Å; L1489-I1497 WeakPolarHBondContact O-CD1 3.4Å; D1493-I1497 PolarHBondContact O-N 3.2Å; I1497-M1499 VanDerWaalsContact C-N 3.3Å; I1497-M1499 PolarHBondContact O-N 3.03Å; I1497-I1500 PolarHBondContact O-N 3.29Å; I1497-V1501 WeakPolarHBondContact O-CG2 3.44Å; I1497-V1501 PolarHBondContact O-N 2.87Å
1498	Q	72.9	Confident	65.1	Low	120 Å²	120	108.5 Å²	108.5	56%	0.561	53%	0.534	S	S	*	.	H	α-helix	trans	-60.6	-36.9	170.5	-76.6	-178.5	51.3	0	0	112.4	P1494 R1502	P1494-Q1498 WeakPolarHBondContact O-CB 3.49Å; P1494-Q1498 VanDerWaalsContact O-CG 3.25Å; P1494-Q1498 WeakPolarHBondContact O-CG 3.22Å; P1494-Q1498 PolarHBondContact O-N 3.06Å; Q1498-R1502 WeakPolarHBondContact O-CB 3.27Å; Q1498-R1502 PolarHBondContact O-N 3.43Å
1499	M	73.3	Confident	67.4	Low	111 Å²	111	112.6 Å²	112.6	55%	0.547	55%	0.548	S	S	.	.	H	α-helix	trans	-65.6	-41.9	176.4	-165	-165.3	-47	0	0	111.8	E1495 V1496 I1497 H1503	E1495-M1499 VanDerWaalsContact O-CB 3.26Å; E1495-M1499 WeakPolarHBondContact O-CB 3.33Å; E1495-M1499 PolarHBondContact O-N 3.5Å; V1496-M1499 HydrophobicContact CG2-CE 4.45Å; V1496-M1499 WeakPolarHBondContact O-CA 3.33Å; V1496-M1499 WeakPolarHBondContact O-CB 3.17Å; V1496-M1499 PolarHBondContact O-N 2.91Å; V1496-M1499 VanDerWaalsContact O-N 3.1Å; I1497-M1499 VanDerWaalsContact C-N 3.3Å; I1497-M1499 PolarHBondContact O-N 3.03Å; M1499-H1503 VanDerWaalsContact O-CB 3.28Å; M1499-H1503 WeakPolarHBondContact O-CB 3.24Å; M1499-H1503 PolarHBondContact O-N 3.42Å
1500	I	71.6	Confident	69.3	Low	89 Å²	89	111.5 Å²	111.5	46%	0.456	54%	0.542	S	S	.	.	H	α-helix	trans	-65.2	-47.1	176.2	-68.4	166.4	0	0	0	110.4	V1496 I1497 H1503 R1504	V1496-I1500 HydrophobicContact CG1-CD1 4.03Å; V1496-I1500 WeakPolarHBondContact O-CG1 3.34Å; V1496-I1500 PolarHBondContact O-N 3.21Å; I1497-I1500 PolarHBondContact O-N 3.29Å; I1500-H1503 PolarHBondContact O-N 2.94Å; I1500-R1504 PolarHBondContact O-N 3.46Å
1501	V	78.7	Confident	71.4	Confident	81 Å²	81	108.7 Å²	108.7	49%	0.491	53%	0.532	S	S	.	.	H	α-helix	trans	-62.9	-46.7	177	171.7	0	0	0	0	111	I1497 H1503 R1504 M1505	I1497-V1501 WeakPolarHBondContact O-CG2 3.44Å; I1497-V1501 PolarHBondContact O-N 2.87Å; V1501-H1503 PolarHBondContact O-N 3.15Å; V1501-R1504 PolarHBondContact O-N 2.96Å; V1501-M1505 HydrophobicContact CG1-CE 4.27Å; V1501-M1505 WeakPolarHBondContact O-CB 3.29Å; V1501-M1505 PolarHBondContact O-N 3.5Å
1502	R	80.6	Confident	73.7	Confident	151 Å²	151	106.8 Å²	106.8	57%	0.57	51%	0.512	S	S	*	.	H	α-helix	trans	-57.1	-47.2	174.7	-176.7	-171.7	-125.4	110.4	-3	110.9	Q1498 R1504 M1505 E1506	Q1498-R1502 WeakPolarHBondContact O-CB 3.27Å; Q1498-R1502 PolarHBondContact O-N 3.43Å; R1502-R1504 PolarHBondContact O-N 3.21Å; R1502-M1505 CarbonylContact O-C 3.57Å; R1502-M1505 WeakPolarHBondContact O-CB 3.17Å; R1502-M1505 PolarHBondContact O-N 3.42Å; R1502-E1506 HydrophobicContact CG-CG 4.47Å; R1502-E1506 WeakPolarHBondContact CG-OE1 3.4Å; R1502-E1506 WeakPolarHBondContact O-CB 3.49Å; R1502-E1506 WeakPolarHBondContact O-CG 3.47Å; R1502-E1506 PolarHBondContact O-N 2.96Å
1503	H	81.2	Confident	75.6	Confident	99 Å²	99	109.3 Å²	109.3	46%	0.458	52%	0.521	S	S	.	.	H	α-helix	trans	-64.8	-40.3	179.1	-168.3	64.3	0	0	0	112.2	M1499 I1500 V1501 M1505 E1506 Q1507	M1499-H1503 VanDerWaalsContact O-CB 3.28Å; M1499-H1503 WeakPolarHBondContact O-CB 3.24Å; M1499-H1503 PolarHBondContact O-N 3.42Å; I1500-H1503 PolarHBondContact O-N 2.94Å; V1501-H1503 PolarHBondContact O-N 3.15Å; H1503-M1505 VanDerWaalsContact C-N 3.31Å; H1503-M1505 PolarHBondContact O-N 3.4Å; H1503-E1506 PolarHBondContact O-N 3.3Å; H1503-Q1507 PolarHBondContact CE1-NE2 2.82Å; H1503-Q1507 PolarHBondContact NE2-NE2 2.93Å; H1503-Q1507 WeakPolarHBondContact O-CB 3.38Å; H1503-Q1507 VanDerWaalsContact O-CG 3.22Å; H1503-Q1507 WeakPolarHBondContact O-CG 3.39Å; H1503-Q1507 PolarHBondContact O-N 3.09Å
1504	R	76.4	Confident	76.8	Confident	201 Å²	201	110 Å²	110	76%	0.758	52%	0.521	S	S	*	.	H	α-helix	trans	-60.6	-42.1	173.5	-125	178	-169.1	167.2	4.2	111.6	I1500 V1501 R1502 Q1507 H1508	I1500-R1504 PolarHBondContact O-N 3.46Å; V1501-R1504 PolarHBondContact O-N 2.96Å; R1502-R1504 PolarHBondContact O-N 3.21Å; R1504-Q1507 PolarHBondContact O-N 2.98Å; R1504-H1508 PolarHBondContact O-N 3.49Å
1505	M	82.1	Confident	77.6	Confident	126 Å²	126	113.3 Å²	113.3	62%	0.621	52%	0.522	S	S	*	.	H	α-helix	trans	-68.6	-38.3	178	-158.3	-173.5	-58.9	0	0	112	V1501 R1502 H1503 H1508 K1509	V1501-M1505 HydrophobicContact CG1-CE 4.27Å; V1501-M1505 WeakPolarHBondContact O-CB 3.29Å; V1501-M1505 PolarHBondContact O-N 3.5Å; R1502-M1505 CarbonylContact O-C 3.57Å; R1502-M1505 WeakPolarHBondContact O-CB 3.17Å; R1502-M1505 PolarHBondContact O-N 3.42Å; H1503-M1505 VanDerWaalsContact C-N 3.31Å; H1503-M1505 PolarHBondContact O-N 3.4Å; M1505-H1508 PolarHBondContact O-N 2.97Å; M1505-K1509 VanDerWaalsContact O-CB 3.24Å; M1505-K1509 WeakPolarHBondContact O-CB 3.36Å; M1505-K1509 PolarHBondContact O-N 3.44Å
1506	E	83.7	Confident	78.2	Confident	105 Å²	105	110.9 Å²	110.9	49%	0.491	52%	0.516	S	S	.	.	H	α-helix	trans	-66.1	-41.2	173.3	-76.7	173.1	-177.2	0	0	112.3	R1502 H1503 K1509 L1510	R1502-E1506 HydrophobicContact CG-CG 4.47Å; R1502-E1506 WeakPolarHBondContact CG-OE1 3.4Å; R1502-E1506 WeakPolarHBondContact O-CB 3.49Å; R1502-E1506 WeakPolarHBondContact O-CG 3.47Å; R1502-E1506 PolarHBondContact O-N 2.96Å; H1503-E1506 PolarHBondContact O-N 3.3Å; E1506-K1509 PolarHBondContact O-N 3.33Å; E1506-L1510 VanDerWaalsContact O-CB 3.3Å; E1506-L1510 WeakPolarHBondContact O-CB 3.26Å; E1506-L1510 PolarHBondContact O-N 3.16Å
1507	Q	76.1	Confident	78.9	Confident	89 Å²	89	112.4 Å²	112.4	42%	0.416	52%	0.52	S	S	.	.	H	α-helix	trans	-61.2	-46.7	173.1	-69.7	-74.2	-2.4	0	0	110.9	H1503 R1504 K1509 L1510 L1511	H1503-Q1507 PolarHBondContact CE1-NE2 2.82Å; H1503-Q1507 PolarHBondContact NE2-NE2 2.93Å; H1503-Q1507 WeakPolarHBondContact O-CB 3.38Å; H1503-Q1507 VanDerWaalsContact O-CG 3.22Å; H1503-Q1507 WeakPolarHBondContact O-CG 3.39Å; H1503-Q1507 PolarHBondContact O-N 3.09Å; R1504-Q1507 PolarHBondContact O-N 2.98Å; Q1507-K1509 VanDerWaalsContact C-N 3.35Å; Q1507-K1509 PolarHBondContact O-N 3.37Å; Q1507-L1510 PolarHBondContact O-N 2.94Å; Q1507-L1511 WeakPolarHBondContact O-CB 3.35Å; Q1507-L1511 WeakPolarHBondContact O-CG 3.3Å; Q1507-L1511 PolarHBondContact O-N 3.34Å
1508	H	81.4	Confident	79.3	Confident	130 Å²	130	114.1 Å²	114.1	60%	0.602	53%	0.529	S	S	*	.	H	α-helix	trans	-63.2	-40	176.1	-163.3	-62.1	0	0	0	112.1	R1504 M1505 L1510 L1511 E1512	R1504-H1508 PolarHBondContact O-N 3.49Å; M1505-H1508 PolarHBondContact O-N 2.97Å; H1508-L1510 VanDerWaalsContact C-N 3.34Å; H1508-L1511 PolarHBondContact O-N 3.39Å; H1508-E1512 WeakPolarHBondContact O-CB 3.36Å; H1508-E1512 PolarHBondContact O-N 3.09Å
1509	K	84.5	Confident	79.4	Confident	161 Å²	161	112.9 Å²	112.9	70%	0.7	52%	0.523	S	S	*	.	H	α-helix	trans	-68.8	-30.5	176.4	-167.9	169.6	-173.1	170.2	0	112.5	M1505 E1506 Q1507 K1513	M1505-K1509 VanDerWaalsContact O-CB 3.24Å; M1505-K1509 WeakPolarHBondContact O-CB 3.36Å; M1505-K1509 PolarHBondContact O-N 3.44Å; E1506-K1509 PolarHBondContact O-N 3.33Å; Q1507-K1509 VanDerWaalsContact C-N 3.35Å; Q1507-K1509 PolarHBondContact O-N 3.37Å; K1509-K1513 WeakPolarHBondContact O-CB 3.46Å; K1509-K1513 PolarHBondContact O-N 3.2Å
1510	L	81.5	Confident	79.5	Confident	89 Å²	89	114.9 Å²	114.9	47%	0.466	52%	0.524	S	S	.	.	H	α-helix	trans	-74.6	-41.9	173.7	-177.2	61.7	0	0	0	111.7	E1506 Q1507 H1508 K1513 Q1514	E1506-L1510 VanDerWaalsContact O-CB 3.3Å; E1506-L1510 WeakPolarHBondContact O-CB 3.26Å; E1506-L1510 PolarHBondContact O-N 3.16Å; Q1507-L1510 PolarHBondContact O-N 2.94Å; H1508-L1510 VanDerWaalsContact C-N 3.34Å; L1510-K1513 PolarHBondContact O-N 3.07Å; L1510-Q1514 WeakPolarHBondContact O-CG 3.3Å; L1510-Q1514 PolarHBondContact O-N 2.97Å
1511	L	77.1	Confident	79.5	Confident	108 Å²	108	114.6 Å²	114.6	57%	0.565	52%	0.524	S	S	*	.	H	α-helix	trans	-62	-47.3	173.8	-75.1	168.9	0	0	0	111.3	Q1507 H1508 K1513 Q1514 R1515	Q1507-L1511 WeakPolarHBondContact O-CB 3.35Å; Q1507-L1511 WeakPolarHBondContact O-CG 3.3Å; Q1507-L1511 PolarHBondContact O-N 3.34Å; H1508-L1511 PolarHBondContact O-N 3.39Å; L1511-K1513 VanDerWaalsContact C-N 3.31Å; L1511-K1513 PolarHBondContact O-N 2.97Å; L1511-Q1514 PolarHBondContact O-N 3.15Å; L1511-Q1514 VanDerWaalsContact O-N 3.13Å; L1511-R1515 WeakPolarHBondContact O-CB 3.46Å; L1511-R1515 PolarHBondContact O-N 2.66Å
1512	E	83.4	Confident	79	Confident	68 Å²	68	118.3 Å²	118.3	32%	0.318	53%	0.529	S	S	.	.	H	α-helix	trans	-65.9	-35.6	176.5	-164.4	58.3	-144.8	0	0	111.4	H1508 Q1514 R1515 V1516	H1508-E1512 WeakPolarHBondContact O-CB 3.36Å; H1508-E1512 PolarHBondContact O-N 3.09Å; E1512-Q1514 VanDerWaalsContact C-N 3.34Å; E1512-Q1514 PolarHBondContact O-N 3.15Å; E1512-R1515 PolarHBondContact O-N 3.47Å; E1512-R1515 IonicContact OE1-CZ 2.67Å; E1512-R1515 IonicContact OE1-NH1 3.61Å; E1512-R1515 PolarHBondContact OE1-NH1 3.33Å; E1512-R1515 IonicContact OE2-NH1 2.72Å; E1512-R1515 PolarHBondContact OE2-NH1 2.89Å; E1512-V1516 HydrophobicContact CG-CG2 4.41Å; E1512-V1516 WeakPolarHBondContact O-CB 3.22Å; E1512-V1516 VanDerWaalsContact O-CG2 3.28Å; E1512-V1516 WeakPolarHBondContact O-CG2 3.42Å; E1512-V1516 PolarHBondContact O-N 2.89Å
1513	K	84.7	Confident	78.2	Confident	151 Å²	151	114.2 Å²	114.2	66%	0.657	52%	0.523	S	S	*	.	H	α-helix	trans	-65.5	-34.1	172.4	-173.8	173.5	-177.6	178.2	0	112.8	K1509 L1510 L1511 E1517	K1509-K1513 WeakPolarHBondContact O-CB 3.46Å; K1509-K1513 PolarHBondContact O-N 3.2Å; L1510-K1513 PolarHBondContact O-N 3.07Å; L1511-K1513 VanDerWaalsContact C-N 3.31Å; L1511-K1513 PolarHBondContact O-N 2.97Å; K1513-E1517 WeakPolarHBondContact O-CB 3.48Å; K1513-E1517 PolarHBondContact O-N 2.96Å
1514	Q	80.5	Confident	77.3	Confident	105 Å²	105	114.5 Å²	114.5	49%	0.491	52%	0.523	S	S	.	.	H	α-helix	trans	-70.2	-44.4	172.4	-74.6	179.2	14.5	0	0	111.3	L1510 L1511 E1512 V1516 E1517 I1518	L1510-Q1514 WeakPolarHBondContact O-CG 3.3Å; L1510-Q1514 PolarHBondContact O-N 2.97Å; L1511-Q1514 PolarHBondContact O-N 3.15Å; L1511-Q1514 VanDerWaalsContact O-N 3.13Å; E1512-Q1514 VanDerWaalsContact C-N 3.34Å; E1512-Q1514 PolarHBondContact O-N 3.15Å; Q1514-V1516 PolarHBondContact O-N 3.28Å; Q1514-E1517 PolarHBondContact O-N 3.21Å; Q1514-I1518 WeakPolarHBondContact O-CB 3.29Å; Q1514-I1518 VanDerWaalsContact O-CG1 3.24Å; Q1514-I1518 WeakPolarHBondContact O-CG1 3.45Å; Q1514-I1518 PolarHBondContact O-N 3Å
1515	R	83.5	Confident	76.3	Confident	160 Å²	160	111.6 Å²	111.6	60%	0.604	52%	0.521	S	S	*	.	H	α-helix	trans	-56.7	-49	173.6	-177.9	176.2	176.2	-120.2	5.1	111.3	L1511 E1512 I1518 E1519	L1511-R1515 WeakPolarHBondContact O-CB 3.46Å; L1511-R1515 PolarHBondContact O-N 2.66Å; E1512-R1515 PolarHBondContact O-N 3.47Å; E1512-R1515 IonicContact OE1-CZ 2.67Å; E1512-R1515 IonicContact OE1-NH1 3.61Å; E1512-R1515 PolarHBondContact OE1-NH1 3.33Å; E1512-R1515 IonicContact OE2-NH1 2.72Å; E1512-R1515 PolarHBondContact OE2-NH1 2.89Å; R1515-I1518 PolarHBondContact O-N 3.41Å; R1515-E1519 WeakPolarHBondContact O-CB 3.21Å; R1515-E1519 PolarHBondContact O-N 2.75Å
1516	V	80	Confident	74.2	Confident	82 Å²	82	115.1 Å²	115.1	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-66.4	-37.4	177.5	170.7	0	0	0	0	112.2	E1512 Q1514 E1519 R1520	E1512-V1516 HydrophobicContact CG-CG2 4.41Å; E1512-V1516 WeakPolarHBondContact O-CB 3.22Å; E1512-V1516 VanDerWaalsContact O-CG2 3.28Å; E1512-V1516 WeakPolarHBondContact O-CG2 3.42Å; E1512-V1516 PolarHBondContact O-N 2.89Å; Q1514-V1516 PolarHBondContact O-N 3.28Å; V1516-E1519 PolarHBondContact O-N 3.14Å; V1516-R1520 WeakPolarHBondContact O-CB 3.35Å; V1516-R1520 PolarHBondContact O-N 2.7Å
1517	E	77.2	Confident	72.1	Confident	81 Å²	81	114.9 Å²	114.9	38%	0.379	53%	0.533	S	S	.	.	H	α-helix	trans	-74	-31.7	174.6	-170	59.2	-135.7	0	0	112.3	K1513 Q1514 R1520 L1521 K1524	K1513-E1517 WeakPolarHBondContact O-CB 3.48Å; K1513-E1517 PolarHBondContact O-N 2.96Å; Q1514-E1517 PolarHBondContact O-N 3.21Å; E1517-R1520 CarbonylContact O-C 3.57Å; E1517-R1520 PolarHBondContact O-N 3.2Å; E1517-R1520 WeakPolarHBondContact OE2-CD 3.39Å; E1517-L1521 HydrophobicContact CG-CD1 4.24Å; E1517-L1521 HydrophobicContact CG-CG 4.49Å; E1517-L1521 VanDerWaalsContact O-CB 3.27Å; E1517-L1521 WeakPolarHBondContact O-CB 3.37Å; E1517-L1521 WeakPolarHBondContact O-CD1 3.43Å; E1517-L1521 WeakPolarHBondContact O-CG 3.39Å; E1517-L1521 PolarHBondContact O-N 3.17Å; E1517-K1524 IonicContact OE1-NZ 3.44Å; E1517-K1524 PolarHBondContact OE1-NZ 2.88Å
1518	I	73.9	Confident	70	Confident	89 Å²	89	116.2 Å²	116.2	46%	0.456	55%	0.55	S	S	.	.	H	α-helix	trans	-64.4	-44.9	170.1	-71.8	164.9	0	0	0	110.1	Q1514 R1515 L1521 R1522	Q1514-I1518 WeakPolarHBondContact O-CB 3.29Å; Q1514-I1518 VanDerWaalsContact O-CG1 3.24Å; Q1514-I1518 WeakPolarHBondContact O-CG1 3.45Å; Q1514-I1518 PolarHBondContact O-N 3Å; R1515-I1518 PolarHBondContact O-N 3.41Å; I1518-L1521 CarbonylContact O-C 3.15Å; I1518-L1521 PolarHBondContact O-N 2.98Å; I1518-L1521 VanDerWaalsContact O-N 3.16Å; I1518-R1522 WeakPolarHBondContact O-CG 3.4Å; I1518-R1522 PolarHBondContact O-N 3.07Å
1519	E	75.4	Confident	67.7	Low	94 Å²	94	118 Å²	118	44%	0.439	55%	0.551	S	S	.	*	H	α-helix	trans	-71.5	-32	178.5	-153.3	55	-121.8	0	0	111.8	R1515 V1516 R1522 S1523	R1515-E1519 WeakPolarHBondContact O-CB 3.21Å; R1515-E1519 PolarHBondContact O-N 2.75Å; V1516-E1519 PolarHBondContact O-N 3.14Å; E1519-R1522 IonicContact OE2-NH1 2.89Å; E1519-S1523 WeakPolarHBondContact O-CB 3.44Å; E1519-S1523 PolarHBondContact O-N 3.11Å; E1519-S1523 PolarHBondContact O-OG 3.38Å
1520	R	75.6	Confident	65.2	Low	153 Å²	153	114.9 Å²	114.9	58%	0.577	56%	0.555	S	S	*	*	H	α-helix	trans	-69.2	-32.8	168.9	-169	-174	179.9	88.3	0.1	111.5	V1516 E1517 S1523 K1524	V1516-R1520 WeakPolarHBondContact O-CB 3.35Å; V1516-R1520 PolarHBondContact O-N 2.7Å; E1517-R1520 CarbonylContact O-C 3.57Å; E1517-R1520 PolarHBondContact O-N 3.2Å; E1517-R1520 WeakPolarHBondContact OE2-CD 3.39Å; R1520-S1523 CarbonylContact O-C 3.46Å; R1520-K1524 HydrophobicContact CG-CD 4.37Å; R1520-K1524 WeakPolarHBondContact O-CB 3.05Å; R1520-K1524 VanDerWaalsContact O-CD 3.3Å; R1520-K1524 WeakPolarHBondContact O-CD 3.43Å; R1520-K1524 WeakPolarHBondContact O-CG 3.18Å; R1520-K1524 PolarHBondContact O-N 3.49Å
1521	L	72.3	Confident	63.1	Low	84 Å²	84	117.4 Å²	117.4	44%	0.44	58%	0.575	S	S	.	*	H	α-helix	trans	-72.2	-43.6	173.5	-77.6	164.9	0	0	0	111.4	E1517 I1518 S1523 K1524 I1525	E1517-L1521 HydrophobicContact CG-CD1 4.24Å; E1517-L1521 HydrophobicContact CG-CG 4.49Å; E1517-L1521 VanDerWaalsContact O-CB 3.27Å; E1517-L1521 WeakPolarHBondContact O-CB 3.37Å; E1517-L1521 WeakPolarHBondContact O-CD1 3.43Å; E1517-L1521 WeakPolarHBondContact O-CG 3.39Å; E1517-L1521 PolarHBondContact O-N 3.17Å; I1518-L1521 CarbonylContact O-C 3.15Å; I1518-L1521 PolarHBondContact O-N 2.98Å; I1518-L1521 VanDerWaalsContact O-N 3.16Å; L1521-S1523 VanDerWaalsContact C-N 3.27Å; L1521-S1523 PolarHBondContact O-N 3.47Å; L1521-K1524 HydrophobicContact CD2-CD 4.04Å; L1521-K1524 PolarHBondContact O-N 3.06Å; L1521-K1524 VanDerWaalsContact O-N 3.12Å; L1521-I1525 WeakPolarHBondContact O-CD1 3.4Å; L1521-I1525 VanDerWaalsContact O-CG1 3.27Å; L1521-I1525 WeakPolarHBondContact O-CG1 3.33Å; L1521-I1525 PolarHBondContact O-N 3.27Å
1522	R	68.4	Low	60.9	Low	158 Å²	158	117.9 Å²	117.9	60%	0.596	59%	0.587	S	S	*	*	H	α-helix	trans	-56.3	-43.7	168.7	-72.9	172.9	168.1	-162.9	-6.6	111	I1518 E1519 K1524 I1525 R1526	I1518-R1522 WeakPolarHBondContact O-CG 3.4Å; I1518-R1522 PolarHBondContact O-N 3.07Å; E1519-R1522 IonicContact OE2-NH1 2.89Å; R1522-K1524 PolarHBondContact O-N 3.09Å; R1522-I1525 PolarHBondContact O-N 2.83Å; R1522-R1526 WeakPolarHBondContact O-CB 3.02Å; R1522-R1526 PolarHBondContact O-N 3.15Å
1523	S	64	Low	58.6	Low	66 Å²	66	120.9 Å²	120.9	46%	0.462	61%	0.61	S	S	.	*	H	α-helix	trans	-76.2	-14.7	176.7	-57.9	0	0	0	0	114.8	E1519 R1520 L1521	E1519-S1523 WeakPolarHBondContact O-CB 3.44Å; E1519-S1523 PolarHBondContact O-N 3.11Å; E1519-S1523 PolarHBondContact O-OG 3.38Å; R1520-S1523 CarbonylContact O-C 3.46Å; L1521-S1523 VanDerWaalsContact C-N 3.27Å; L1521-S1523 PolarHBondContact O-N 3.47Å
1524	K	62.3	Low	56.2	Low	105 Å²	105	120.8 Å²	120.8	46%	0.457	62%	0.617	S	S	.	*	H	α-helix	trans	-84.4	-28.2	167.1	-76.9	157.1	178	169.6	0	111.8	E1517 R1520 L1521 R1522	E1517-K1524 IonicContact OE1-NZ 3.44Å; E1517-K1524 PolarHBondContact OE1-NZ 2.88Å; R1520-K1524 HydrophobicContact CG-CD 4.37Å; R1520-K1524 WeakPolarHBondContact O-CB 3.05Å; R1520-K1524 VanDerWaalsContact O-CD 3.3Å; R1520-K1524 WeakPolarHBondContact O-CD 3.43Å; R1520-K1524 WeakPolarHBondContact O-CG 3.18Å; R1520-K1524 PolarHBondContact O-N 3.49Å; L1521-K1524 HydrophobicContact CD2-CD 4.04Å; L1521-K1524 PolarHBondContact O-N 3.06Å; L1521-K1524 VanDerWaalsContact O-N 3.12Å; R1522-K1524 PolarHBondContact O-N 3.09Å
1525	I	53.8	Low	54	Low	139 Å²	139	121.2 Å²	121.2	71%	0.713	63%	0.628	S	S	*	*	H	α-helix	trans	-78.3	-34.5	173.7	-68.5	163.7	0	0	0	110.1	L1521 R1522 V1527	L1521-I1525 WeakPolarHBondContact O-CD1 3.4Å; L1521-I1525 VanDerWaalsContact O-CG1 3.27Å; L1521-I1525 WeakPolarHBondContact O-CG1 3.33Å; L1521-I1525 PolarHBondContact O-N 3.27Å; R1522-I1525 PolarHBondContact O-N 2.83Å; I1525-V1527 VanDerWaalsContact C-N 3.3Å; I1525-V1527 PolarHBondContact O-N 2.75Å
1526	R	39.6	Very low	51.4	Low	201 Å²	201	122.3 Å²	122.3	76%	0.758	64%	0.64	S	S	*	*	S	Bend	trans	-76	76.2	168.4	-165.3	-180	-158.9	161.9	4.9	110.5	R1522 P1528	R1522-R1526 WeakPolarHBondContact O-CB 3.02Å; R1522-R1526 PolarHBondContact O-N 3.15Å; R1526-P1528 VanDerWaalsContact O-CD 3.27Å; R1526-P1528 WeakPolarHBondContact O-CD 3.41Å
1527	V	38.2	Very low	49	Very low	100 Å²	100	125.7 Å²	125.7	61%	0.606	65%	0.653	S	S	*	*			trans	-57.8	120.2	-174.3	179	0	0	0	0	111.8	I1525	I1525-V1527 VanDerWaalsContact C-N 3.3Å; I1525-V1527 PolarHBondContact O-N 2.75Å
1528	P	32.3	Very low	46.9	Very low	117 Å²	117	129.6 Å²	129.6	76%	0.76	67%	0.674	S	S	*	*			trans	-85.9	136.4	161.2	33.9	-29.4	0	0	0	109.3	R1526	R1526-P1528 VanDerWaalsContact O-CD 3.27Å; R1526-P1528 WeakPolarHBondContact O-CD 3.41Å
1529	R	32.7	Very low	44.9	Very low	166 Å²	166	128.1 Å²	128.1	63%	0.626	68%	0.681	S	S	*	*			trans	-143.6	106	168.9	-162.8	169.3	-169.1	-171.1	-2.3	113.4	D1405	D1405-R1529 IonicContact OD2-NH1 2.86Å
1530	A	32.8	Very low	42.9	Very low	96 Å²	96	131 Å²	131	79%	0.793	70%	0.7	S	S	*	*			trans	-72	150.1	166.6	0	0	0	0	0	111.6
1531	T	37.6	Very low	40.9	Very low	142 Å²	142	131.2 Å²	131.2	87%	0.871	71%	0.712	S	S	*	*			trans	-104.2	144	159.1	41.4	0	0	0	0	109.1
1532	S	31.6	Very low	39.1	Very low	119 Å²	119	136.1 Å²	136.1	83%	0.832	73%	0.733	S	S	*	*			trans	-97.3	132	-169	55	0	0	0	0	113.2
1533	V	35.1	Very low	37.2	Very low	130 Å²	130	132.9 Å²	132.9	79%	0.788	74%	0.74	S	S	*	*			trans	-138.1	128.6	159.2	-173.1	0	0	0	0	108.6
1534	N	33.7	Very low	35.5	Very low	150 Å²	150	136.4 Å²	136.4	80%	0.802	75%	0.753	S	S	*	*			trans	34.2	133.3	168.2	-63.8	0	0	0	0	121.8
1535	P	33.9	Very low	33.9	Very low	113 Å²	113	137 Å²	137	73%	0.734	77%	0.766	S	S	*	*			trans	-86.3	-179.8	162.1	39	-35.3	0	0	0	112.5
1536	E	29.1	Very low	32.8	Very low	183 Å²	183	136.5 Å²	136.5	86%	0.855	77%	0.77	S	S	*	*			trans	78.1	148.3	171	-56.6	-168.5	102.6	0	0	118.2
1537	M	30.2	Very low	32.3	Very low	154 Å²	154	133.5 Å²	133.5	76%	0.759	77%	0.768	S	S	*	*			trans	74.2	100.9	169.8	-58.8	-63.6	-80.1	0	0	119.2
1538	I	32.8	Very low	31.8	Very low	162 Å²	162	134.9 Å²	134.9	83%	0.831	78%	0.777	S	S	*	*			trans	68.7	131.8	145.7	-51.3	166.7	0	0	0	114.8
1539	G	32.5	Very low	31.7	Very low	59 Å²	59	133.5 Å²	133.5	61%	0.608	78%	0.775	S	S	*	*			cis	151.3	145.5	8.5	0	0	0	0	0	107.5
1540	D	31.8	Very low	31.7	Very low	155 Å²	155	133.8 Å²	133.8	83%	0.829	79%	0.788	S	S	*	*			trans	-80.3	173.3	-163.8	-50.7	-92	0	0	0	115.3
1541	D	34.4	Very low	31.6	Very low	156 Å²	156	138.1 Å²	138.1	83%	0.834	79%	0.792	S	S	*	*			trans	79.3	158.5	160.9	-65.3	-44.2	0	0	0	121.5
1542	E	33.8	Very low	31.1	Very low	187 Å²	187	136.6 Å²	136.6	87%	0.874	79%	0.787	S	S	*	*			trans	61.9	116.1	-176	-54.3	-160.4	134.8	0	0	116.4
1543	A	29	Very low	31.1	Very low	90 Å²	90	135.2 Å²	135.2	74%	0.744	78%	0.783	S	S	*	*			cis	91.6	141.8	40.4	0	0	0	0	0	114.7
1544	D	28.2	Very low	31.2	Very low	140 Å²	140	137.3 Å²	137.3	75%	0.749	79%	0.789	S	S	*	*			trans	57.4	126.1	164	-106.6	-48.7	0	0	0	122.5
1545	T	28	Very low	31	Very low	117 Å²	117	133 Å²	133	72%	0.718	78%	0.779	S	S	*	*			trans	41.8	99.1	132.9	-60.2	0	0	0	0	119
1546	T	31.5	Very low	30.8	Very low	129 Å²	129	136 Å²	136	79%	0.791	79%	0.789	S	S	*	*			trans	-146.1	106.2	147.4	8.9	0	0	0	0	114
1547	L	28.2	Very low	31.1	Very low	139 Å²	139	131.7 Å²	131.7	73%	0.728	79%	0.786	S	S	*	*			trans	34.1	112.9	134.2	-61.9	166.5	0	0	0	118
1548	T	28.5	Very low	31.1	Very low	128 Å²	128	129.5 Å²	129.5	79%	0.785	79%	0.785	S	S	*	*				58.9	67.1	68.8	-44.9	0	0	0	0	113.6
1549	A	29.5	Very low	31	Very low	88 Å²	88	129.6 Å²	129.6	73%	0.727	79%	0.786	S	S	*	*			trans	-157.2	75.8	165.8	0	0	0	0	0	113.6
1550	L	34.5	Very low	30.9	Very low	172 Å²	172	132 Å²	132	90%	0.901	79%	0.794	S	S	*	*			trans	173.9	49.3	143.8	-95	164.7	0	0	0	113.8	S1552	L1550-S1552 PolarHBondContact O-N 2.92Å
1551	Q	29.5	Very low	31	Very low	188 Å²	188	132.4 Å²	132.4	88%	0.879	80%	0.795	S	S	*	*			trans	-76.1	113	153.7	-72.8	175.2	-46.7	0	0	108.7
1552	S	26.9	Very low	31	Very low	110 Å²	110	131.3 Å²	131.3	77%	0.769	80%	0.796	S	S	*	*			trans	173.4	76.8	147.4	58.7	0	0	0	0	114.5	L1550	L1550-S1552 PolarHBondContact O-N 2.92Å
1553	A	32.1	Very low	31	Very low	90 Å²	90	127.1 Å²	127.1	74%	0.744	79%	0.794	S	S	*	*			trans	-160.2	118.3	156.4	0	0	0	0	0	112.3
1554	L	37.4	Very low	31.2	Very low	174 Å²	174	128.1 Å²	128.1	91%	0.911	80%	0.795	S	S	*	*			trans	15.6	131.9	159	-55.5	91.1	0	0	0	119.6
1555	G	29.1	Very low	31.6	Very low	58 Å²	58	127.4 Å²	127.4	60%	0.598	80%	0.798	S	S	*	*			cis	104.7	121.1	2.9	0	0	0	0	0	114.5
1556	N	31	Very low	32	Very low	176 Å²	176	127.3 Å²	127.3	94%	0.941	80%	0.8	S	S	*	*			trans	71.3	144.4	178.9	-46.8	-33.2	0	0	0	114.8
1557	A	34.4	Very low	32.6	Very low	94 Å²	94	126.5 Å²	126.5	78%	0.777	80%	0.797	S	S	*	*			cis	-148.3	156.4	-2.3	0	0	0	0	0	107.6
1558	S	30.3	Very low	32.9	Very low	107 Å²	107	126.9 Å²	126.9	75%	0.748	80%	0.799	S	S	*	*			cis	98.1	128.7	32.8	-155.8	0	0	0	0	114.6
1559	L	29.9	Very low	33.2	Very low	164 Å²	164	126.3 Å²	126.3	86%	0.859	80%	0.796	S	S	*	*			trans	72.8	149.4	172.7	-54.8	176.6	0	0	0	117.4
1560	S	30.4	Very low	33.5	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	80%	0.801	S	S	*	*			cis	-167.1	164.1	-8.7	46.9	0	0	0	0	112.9
1561	L	35.3	Very low	33.6	Very low	165 Å²	165	127.4 Å²	127.4	86%	0.864	79%	0.789	S	S	*	*			trans	-69.6	163	169.5	-68.2	162.4	0	0	0	113.6
1562	P	34.3	Very low	33.8	Very low	132 Å²	132	123.5 Å²	123.5	86%	0.857	78%	0.778	S	S	*	*				-151.8	-173.1	110.7	40.1	-22.1	0	0	0	116
1563	A	32.5	Very low	34.2	Very low	100 Å²	100	127.5 Å²	127.5	83%	0.826	78%	0.781	S	S	*	*			trans	-118.1	-176.8	-172.8	0	0	0	0	0	115.8
1564	S	33.9	Very low	34.3	Very low	110 Å²	110	128.9 Å²	128.9	77%	0.769	78%	0.78	S	S	*	*			trans	-65.6	170.6	-177.2	-33.7	0	0	0	0	114.8
1565	P	35.9	Very low	34.1	Very low	125 Å²	125	127.4 Å²	127.4	81%	0.812	77%	0.773	S	S	*	*				-144.9	-127.1	69.6	31.7	-3.6	0	0	0	116.7
1566	P	36	Very low	34.4	Very low	116 Å²	116	131.3 Å²	131.3	75%	0.753	79%	0.786	S	S	*	*				-119.5	-178.1	-119.2	39.3	-18.9	0	0	0	116.9
1567	P	45.4	Very low	34.4	Very low	111 Å²	111	128.7 Å²	128.7	72%	0.721	78%	0.777	S	S	*	*			trans	-111.8	164.3	-158.4	41.3	-35.5	0	0	0	118.1
1568	N	33.9	Very low	34.3	Very low	147 Å²	147	130.8 Å²	130.8	79%	0.786	78%	0.779	S	S	*	*				-179.7	155.8	123.8	-106.6	-15	0	0	0	118
1569	T	35.1	Very low	34.5	Very low	117 Å²	117	133.2 Å²	133.2	72%	0.718	78%	0.782	S	S	*	*			trans	64.9	112.7	149.1	50.5	0	0	0	0	124.9
1570	E	35.7	Very low	34.6	Very low	179 Å²	179	130.9 Å²	130.9	84%	0.836	78%	0.777	S	S	*	*				97.8	100	119.9	-76.3	-154.6	136.4	0	0	125.9
1571	T	35.8	Very low	34.5	Very low	104 Å²	104	130.8 Å²	130.8	64%	0.638	78%	0.776	S	S	*	*				107.9	126.7	113.9	-48.2	0	0	0	0	122.9
1572	T	35.4	Very low	34.2	Very low	105 Å²	105	129.8 Å²	129.8	64%	0.644	77%	0.772	S	S	*	*			trans	91.4	114.1	148.4	27.1	0	0	0	0	125.3
1573	K	34.7	Very low	34	Very low	194 Å²	194	129.5 Å²	129.5	84%	0.843	77%	0.767	S	S	*	*				71.5	140.7	129.9	-84.1	171.9	-170.7	171.9	0	120.1
1574	V	34.7	Very low	33.7	Very low	119 Å²	119	132.7 Å²	132.7	72%	0.721	77%	0.769	S	S	*	*			cis	-139.2	148.8	-2.2	157	0	0	0	0	110.8
1575	N	32.2	Very low	33.6	Very low	143 Å²	143	131.7 Å²	131.7	77%	0.765	77%	0.768	S	S	*	*			trans	-13.1	144.4	163.3	-47.3	-0.1	0	0	0	120.5
1576	T	34.6	Very low	33.3	Very low	141 Å²	141	132.5 Å²	132.5	87%	0.865	77%	0.771	S	S	*	*				-153.2	144.9	109.3	-74.1	0	0	0	0	111.6
1577	T	31.8	Very low	33	Very low	121 Å²	121	136.7 Å²	136.7	74%	0.742	77%	0.772	S	S	*	*			trans	-56.4	138	-172.3	-44.6	0	0	0	0	117.4
1578	V	32.6	Very low	32.4	Very low	138 Å²	138	138.4 Å²	138.4	84%	0.836	77%	0.772	S	S	*	*				-174.1	157.9	119.8	148.7	0	0	0	0	109.8
1579	I	34.1	Very low	32.4	Very low	157 Å²	157	136.9 Å²	136.9	81%	0.805	77%	0.768	S	S	*	*			trans	-91	150.7	-165.2	-75.6	171.3	0	0	0	111.4
1580	P	32.1	Very low	32.4	Very low	116 Å²	116	140 Å²	140	75%	0.753	78%	0.777	S	S	*	*			trans	-97.5	151.5	-136.6	35.5	-36.4	0	0	0	116.8
1581	S	29.7	Very low	32.3	Very low	106 Å²	106	135.8 Å²	135.8	74%	0.741	77%	0.767	S	S	*	*			trans	-135.1	145.2	154.3	-63.5	0	0	0	0	108.3
1582	D	28.3	Very low	32.3	Very low	144 Å²	144	139.3 Å²	139.3	77%	0.77	78%	0.776	S	S	*	*			trans	52	121.1	151.1	-54	-37.3	0	0	0	123.4
1583	V	29	Very low	32.2	Very low	127 Å²	127	139.6 Å²	139.6	77%	0.77	78%	0.782	S	S	*	*				55.3	152.3	120.6	-164.3	0	0	0	0	121.1
1584	L	28.2	Very low	32.3	Very low	166 Å²	166	135 Å²	135	87%	0.869	78%	0.775	S	S	*	*			trans	92.9	153	150.4	-102.2	146.9	0	0	0	121.5
1585	A	30.9	Very low	32.3	Very low	90 Å²	90	135.3 Å²	135.3	74%	0.744	78%	0.777	S	S	*	*			trans	99.4	95.6	150.6	0	0	0	0	0	121.5
1586	T	29.8	Very low	32.5	Very low	142 Å²	142	137.7 Å²	137.7	87%	0.871	78%	0.781	S	S	*	*			trans	-52.9	155	155.1	-39.1	0	0	0	0	115.1
1587	R	29.8	Very low	32.6	Very low	203 Å²	203	136 Å²	136	77%	0.766	78%	0.775	S	S	*	*				129.7	122.8	126	-166.4	175.7	-170.4	175.9	7	119.1
1588	M	32.6	Very low	32.8	Very low	148 Å²	148	135.3 Å²	135.3	73%	0.729	78%	0.775	S	S	*	*			trans	67.7	154.7	155.8	-73.3	168.2	169	0	0	117.9
1589	T	34.2	Very low	33	Very low	115 Å²	115	135.1 Å²	135.1	71%	0.706	77%	0.769	S	S	*	*			cis	-160.7	145.5	3.5	1.5	0	0	0	0	112.2
1590	M	34.8	Very low	33.1	Very low	183 Å²	183	134.2 Å²	134.2	90%	0.901	77%	0.771	S	S	*	*			trans	62.1	154.5	152.8	-76.3	-170.2	166.8	0	0	120.2
1591	S	33.7	Very low	33.2	Very low	89 Å²	89	133 Å²	133	62%	0.622	77%	0.765	S	S	*	*			cis	-168.1	145.8	-4.9	44.9	0	0	0	0	115.7
1592	Q	34.9	Very low	33.5	Very low	178 Å²	178	134.7 Å²	134.7	83%	0.832	77%	0.77	S	S	*	*			trans	75.3	125.7	144.5	-72	-179.3	88.2	0	0	125.7
1593	S	34.9	Very low	33.9	Very low	111 Å²	111	133.1 Å²	133.1	78%	0.776	77%	0.771	S	S	*	*			trans	76.8	149.8	140.1	77.8	0	0	0	0	121.5
1594	S	35.2	Very low	34.2	Very low	98 Å²	98	131.6 Å²	131.6	69%	0.685	77%	0.766	S	S	*	*			cis	-171.5	163.2	-20.7	55.7	0	0	0	0	114.7
1595	T	36.4	Very low	34.5	Very low	125 Å²	125	134.8 Å²	134.8	77%	0.767	77%	0.766	S	S	*	*			trans	75	152.7	168.5	78.7	0	0	0	0	117.5
1596	K	36.2	Very low	34.6	Very low	193 Å²	193	138.3 Å²	138.3	84%	0.839	77%	0.767	S	S	*	*			cis	-155.2	156.6	7.6	-139.8	164.7	-172.6	175.2	0	113.7
1597	S	35.7	Very low	34.9	Very low	107 Å²	107	142.6 Å²	142.6	75%	0.748	77%	0.767	S	S	*	*			trans	-56	172.7	176.2	-22.3	0	0	0	0	116.1
1598	S	36.8	Very low	35	Very low	105 Å²	105	138.8 Å²	138.8	73%	0.734	76%	0.762	S	S	*	*			cis	-175.4	-161.5	-9.1	41.5	0	0	0	0	107.5
1599	N	35	Very low	35	Very low	135 Å²	135	138 Å²	138	72%	0.722	76%	0.761	S	S	*	*			cis	-168.3	-167.1	13.1	-156.3	-4.9	0	0	0	111.2
1600	V	36.3	Very low	34.9	Very low	138 Å²	138	140.1 Å²	140.1	84%	0.836	76%	0.763	S	S	*	*			trans	87.3	134.7	165.9	-173.4	0	0	0	0	117.6
1601	S	35.5	Very low	34.7	Very low	91 Å²	91	136.7 Å²	136.7	64%	0.636	76%	0.756	S	S	*	*				-179.4	110	-61.1	-86.8	0	0	0	0	113.4
1602	V	36.4	Very low	34.5	Very low	141 Å²	141	137 Å²	137	86%	0.855	77%	0.765	S	S	*	*			trans	-149.5	97.8	149.6	-164.3	0	0	0	0	106.7
1603	S	35.6	Very low	34.7	Very low	111 Å²	111	134.2 Å²	134.2	78%	0.776	76%	0.762	S	S	*	*				38	129.9	104.5	-64.4	0	0	0	0	116.1
1604	S	34.7	Very low	34.9	Very low	95 Å²	95	134.3 Å²	134.3	66%	0.664	76%	0.76	S	S	*	*			cis	-167.8	175.7	-9.6	65.5	0	0	0	0	107.6
1605	R	35.2	Very low	34.7	Very low	232 Å²	232	139.7 Å²	139.7	88%	0.875	77%	0.765	S	S	*	*			cis	-162.6	162.2	13.5	-148.1	172	-145.6	135.8	3.1	109.8
1606	H	33.3	Very low	34.7	Very low	165 Å²	165	140.8 Å²	140.8	76%	0.764	76%	0.761	S	S	*	*			trans	-97.2	154.1	166.4	-84	-95.3	0	0	0	112.7
1607	R	35.5	Very low	34.7	Very low	232 Å²	232	138.5 Å²	138.5	88%	0.875	75%	0.753	S	S	*	*				-176.8	127.2	127.3	-95.4	164.3	177.8	-172	-1.6	108.5
1608	D	32.5	Very low	34.7	Very low	123 Å²	123	140.4 Å²	140.4	66%	0.658	75%	0.75	S	S	*	*			cis	89.5	141.1	49.8	-67.5	-42.2	0	0	0	113.8
1609	N	33.2	Very low	34.7	Very low	131 Å²	131	143.2 Å²	143.2	70%	0.701	75%	0.751	S	S	*	*			trans	76.5	106.2	162.6	-72	-23.9	0	0	0	121.3
1610	Q	31.4	Very low	34.6	Very low	160 Å²	160	143.8 Å²	143.8	75%	0.748	75%	0.75	S	S	*	*				53.8	122.3	108.5	-65.7	-178.9	73.8	0	0	120.7
1611	S	30.1	Very low	34.8	Very low	110 Å²	110	142.7 Å²	142.7	77%	0.769	75%	0.746	S	S	*	*			trans	79.5	130.1	134.7	-61	0	0	0	0	121.9
1612	A	29.6	Very low	34.7	Very low	97 Å²	97	144.9 Å²	144.9	80%	0.802	75%	0.745	S	S	*	*			trans	85.8	144	153.1	0	0	0	0	0	119.7
1613	P	40.3	Very low	34.9	Very low	118 Å²	118	143.8 Å²	143.8	77%	0.766	74%	0.741	S	S	*	*			trans	-98.5	171.3	-175.1	43.5	-39.4	0	0	0	112.4
1614	P	37.7	Very low	34.9	Very low	114 Å²	114	143 Å²	143	74%	0.74	73%	0.733	S	S	*	*				-160.6	155.4	88.3	42.1	-21.6	0	0	0	120
1615	R	32.2	Very low	35	Very low	211 Å²	211	146.3 Å²	146.3	80%	0.796	74%	0.738	S	S	*	*			trans	57.1	127.2	133.3	-74	-179.3	162.1	173.9	-3	125.4
1616	H	35.1	Very low	35	Very low	148 Å²	148	143.6 Å²	143.6	69%	0.685	74%	0.735	S	S	*	*			trans	65.6	157.9	138.5	-55.4	-49.3	0	0	0	119.3
1617	H	36.8	Very low	35.2	Very low	145 Å²	145	140.2 Å²	140.2	67%	0.671	73%	0.728	S	S	*	*			cis	-146.3	151.9	15	-109	-74.9	0	0	0	112.5
1618	H	35.8	Very low	35.2	Very low	147 Å²	147	137 Å²	137	68%	0.681	72%	0.722	S	S	*	*			trans	46.7	152.6	145.6	-71.3	-15.4	0	0	0	122.7
1619	H	36.7	Very low	35.1	Very low	164 Å²	164	137.3 Å²	137.3	76%	0.759	72%	0.723	S	S	*	*			cis	-145.8	178.2	19.3	-106.7	-46.8	0	0	0	114.4
1620	Q	33.5	Very low	35.1	Very low	147 Å²	147	138.5 Å²	138.5	69%	0.687	72%	0.724	S	S	*	*			trans	-83.3	-178.2	177.5	-73.3	179.9	-50.5	0	0	113.5	H1622	Q1620-H1622 WeakPolarHBondContact CG-NE2 3.13Å; Q1620-H1622 PolarHBondContact NE2-CD2 3.38Å; Q1620-H1622 PolarHBondContact NE2-NE2 3.26Å
1621	P	39.1	Very low	35.2	Very low	115 Å²	115	137 Å²	137	75%	0.747	72%	0.722	S	S	*	*			cis	-118.9	-172	9.6	44.4	-30.7	0	0	0	114.8
1622	H	35	Very low	35.6	Very low	137 Å²	137	139 Å²	139	63%	0.634	72%	0.718	S	S	*	*			cis	95.6	175.8	8.1	-35.6	-34.5	0	0	0	116.5	Q1620	Q1620-H1622 WeakPolarHBondContact CG-NE2 3.13Å; Q1620-H1622 PolarHBondContact NE2-CD2 3.38Å; Q1620-H1622 PolarHBondContact NE2-NE2 3.26Å
1623	P	39.7	Very low	35.8	Very low	118 Å²	118	143.4 Å²	143.4	77%	0.766	72%	0.715	S	S	*	*				-127.5	-137.5	-124.6	36	-9.1	0	0	0	112
1624	P	35.9	Very low	35.8	Very low	93 Å²	93	145.5 Å²	145.5	60%	0.604	72%	0.715	S	S	*	*			cis	-141.8	-172.8	-14.3	27	0.7	0	0	0	117.7
1625	H	36.3	Very low	35.9	Very low	166 Å²	166	144.1 Å²	144.1	77%	0.769	71%	0.706	S	S	*	*			trans	80.9	120.2	153.8	-59.2	-55.2	0	0	0	124.4
1626	H	35.6	Very low	36.2	Very low	175 Å²	175	138.5 Å²	138.5	81%	0.81	70%	0.696	S	S	*	*				25.4	163.6	103.1	-83.8	-70.6	0	0	0	121.8
1627	P	38.1	Very low	36.2	Very low	94 Å²	94	137 Å²	137	61%	0.61	69%	0.69	S	S	*	*			cis	-143.8	-171.4	-12.3	38	-16.3	0	0	0	117.4
1628	H	35	Very low	36.1	Very low	163 Å²	163	135.5 Å²	135.5	76%	0.755	69%	0.687	S	S	*	*			trans	81.2	118	141.2	-80	-41	0	0	0	125.9
1629	L	30.6	Very low	36.1	Very low	130 Å²	130	132.9 Å²	132.9	68%	0.681	68%	0.675	S	S	*	*				77.6	133.3	123.1	-72.8	167.4	0	0	0	125.7
1630	Q	33.9	Very low	36.1	Very low	157 Å²	157	129.6 Å²	129.6	73%	0.734	67%	0.666	S	S	*	*			trans	88.9	112.4	135.7	-86.9	163.1	-36.9	0	0	123.9
1631	N	32.3	Very low	36.1	Very low	129 Å²	129	128 Å²	128	69%	0.69	67%	0.671	S	S	*	*			trans	32.1	130.3	135.3	-60.2	3.8	0	0	0	121.4
1632	H	37.8	Very low	35.9	Very low	151 Å²	151	127 Å²	127	70%	0.699	67%	0.673	S	S	*	*				-179.4	146.3	95.3	-100.2	-67.7	0	0	0	116.1
1633	Y	34.5	Very low	35.9	Very low	189 Å²	189	126.4 Å²	126.4	74%	0.741	68%	0.679	S	S	*	*			trans	54.2	112.9	152.2	-72.8	-69	0	0	0	123.6
1634	H	40.8	Very low	35.6	Very low	163 Å²	163	125.2 Å²	125.2	76%	0.755	68%	0.679	S	S	*	*				18.5	153.6	126.2	-67.4	-61.8	0	0	0	122.4
1635	P	39.6	Very low	35.7	Very low	85 Å²	85	126.7 Å²	126.7	55%	0.552	69%	0.689	S	S	*	*			cis	-136.6	-21.5	-22.8	39.1	-26.8	0	0	0	126.5	P1477	P1477-P1635 WeakPolarHBondContact CD-O 3.13Å; P1477-P1635 VanDerWaalsContact CG-O 3.24Å; P1477-P1635 WeakPolarHBondContact CG-O 3.04Å
1636	P	38.7	Very low	35.8	Very low	92 Å²	92	124.3 Å²	124.3	60%	0.597	69%	0.69	S	S	*	*			trans	-107.2	173.3	-142.8	11.5	12	0	0	0	117.8
1637	Q	35.3	Very low	36	Very low	118 Å²	118	122 Å²	122	55%	0.551	69%	0.69	S	S	*	*			cis	175.1	141.8	-18	-90.4	173	-44.2	0	0	108.2	P1477 D1478	P1477-Q1637 HydrophobicContact CG-CG 3.79Å; D1478-Q1637 HydrophobicContact CB-CG 4.47Å; D1478-Q1637 WeakPolarHBondContact OD2-CB 3.49Å; D1478-Q1637 VanDerWaalsContact OD2-CD 3.24Å; D1478-Q1637 WeakPolarHBondContact OD2-CG 3.31Å; D1478-Q1637 PolarHBondContact OD2-NE2 3.5Å; D1478-Q1637 VanDerWaalsContact OD2-NE2 3.09Å
1638	N	33.6	Very low	36	Very low	112 Å²	112	122.6 Å²	122.6	60%	0.599	70%	0.696	S	S	*	*			cis	160.7	-161.6	-12.3	-178.3	107.8	0	0	0	111.3	P1477 D1478	P1477-N1638 VanDerWaalsContact O-CA 3.23Å; P1477-N1638 WeakPolarHBondContact O-CA 3.22Å; P1477-N1638 WeakPolarHBondContact O-CB 3.33Å; P1477-N1638 PolarHBondContact O-ND2 3.43Å; D1478-N1638 WeakPolarHBondContact OD1-CA 3.44Å; D1478-N1638 PolarHBondContact OD1-N 2.93Å
1639	H	36.3	Very low	36.1	Very low	93 Å²	93	119.2 Å²	119.2	43%	0.431	70%	0.697	S	S	.	*			cis	-148	-160.5	13.7	-174.3	49.1	0	0	0	113.3	D1478	D1478-H1639 HydrophobicContact CB-CB 3.55Å; D1478-H1639 WeakPolarHBondContact CB-ND1 3.37Å; D1478-H1639 WeakPolarHBondContact OD1-CB 3.27Å
1640	T	35.8	Very low	36.3	Very low	94 Å²	94	121.5 Å²	121.5	58%	0.577	71%	0.706	S	S	*	*			trans	-117.7	152.5	-165.6	59.4	0	0	0	0	121
1641	S	34.6	Very low	36.2	Very low	114 Å²	114	118.6 Å²	118.6	80%	0.797	70%	0.699	S	S	*	*			trans	106.5	111.4	143.3	80.1	0	0	0	0	123.1
1642	A	35.5	Very low	36.4	Very low	94 Å²	94	120 Å²	120	78%	0.777	70%	0.701	S	S	*	*			trans	43.5	123.7	136.4	0	0	0	0	0	124
1643	T	33.4	Very low	36.2	Very low	124 Å²	124	118.6 Å²	118.6	76%	0.761	70%	0.698	S	S	*	*				-166.1	129.4	107	-71.7	0	0	0	0	110.1
1644	A	34.9	Very low	36.2	Very low	94 Å²	94	117.7 Å²	117.7	78%	0.777	70%	0.701	S	S	*	*			trans	-151.1	158.3	177	0	0	0	0	0	111
1645	P	37.7	Very low	35.8	Very low	124 Å²	124	114.2 Å²	114.2	81%	0.805	70%	0.7	S	S	*	*			trans	-125.4	176.7	-142.8	45.2	-34.6	0	0	0	116.3
1646	C	37.9	Very low	35.5	Very low	116 Å²	116	116.4 Å²	116.4	78%	0.784	71%	0.711	S	S	*	*			trans	-70.6	164.3	150.5	-52.7	0	0	0	0	109.8
1647	P	40.4	Very low	35.5	Very low	125 Å²	125	116.2 Å²	116.2	81%	0.812	71%	0.713	S	S	*	*			cis	-140.8	-112.3	18.8	40	-16.5	0	0	0	113.1
1648	S	37.3	Very low	35.7	Very low	107 Å²	107	116.8 Å²	116.8	75%	0.748	72%	0.72	S	S	*	*			trans	-63.9	150.5	-170	-49.9	0	0	0	0	117
1649	A	36.8	Very low	36	Very low	92 Å²	92	118.3 Å²	118.3	76%	0.76	73%	0.727	S	S	*	*			trans	72.8	126.9	141.9	0	0	0	0	0	120.8
1650	M	35.2	Very low	36.1	Very low	179 Å²	179	120.3 Å²	120.3	88%	0.882	74%	0.742	S	S	*	*			trans	67	138.5	140.4	-95.9	-169	138.8	0	0	122.1
1651	V	32.5	Very low	36.4	Very low	96 Å²	96	120.8 Å²	120.8	58%	0.582	74%	0.744	S	S	*	*			trans	83.9	89.5	137.8	170.8	0	0	0	0	118.9
1652	Q	36.2	Very low	36.7	Very low	159 Å²	159	122.4 Å²	122.4	74%	0.743	74%	0.744	S	S	*	*				77	165.7	107	-150.8	-175.9	3.8	0	0	120.1
1653	L	33.3	Very low	37.3	Very low	120 Å²	120	122.9 Å²	122.9	63%	0.628	74%	0.739	S	S	*	*			trans	84.8	145.7	159.4	-56.7	179.4	0	0	0	117.9
1654	Q	35.1	Very low	37.5	Very low	171 Å²	171	123.6 Å²	123.6	80%	0.799	74%	0.737	S	S	*	*			cis	-172.9	148.1	-20	-178.8	169.2	36.7	0	0	110.7
1655	A	31.9	Very low	37.7	Very low	90 Å²	90	126 Å²	126	74%	0.744	73%	0.732	S	S	*	*			trans	165.1	158.9	143.4	0	0	0	0	0	108.6
1656	V	34.1	Very low	37.9	Very low	130 Å²	130	127.8 Å²	127.8	79%	0.788	73%	0.73	S	S	*	*			cis	-142.7	137.5	16.8	-179.6	0	0	0	0	110.8
1657	S	37.4	Very low	38.2	Very low	89 Å²	89	126 Å²	126	62%	0.622	72%	0.717	S	S	*	*			trans	62	112.8	151.5	-66.4	0	0	0	0	125.8
1658	N	39	Very low	38.2	Very low	130 Å²	130	126 Å²	126	70%	0.695	72%	0.716	S	S	*	*				90.6	131	109.9	-65.4	-7.2	0	0	0	125.2
1659	N	39.8	Very low	38.6	Very low	143 Å²	143	128.7 Å²	128.7	77%	0.765	72%	0.717	S	S	*	*			trans	72.4	146.4	141.7	-66.4	-14.5	0	0	0	119.8
1660	N	40	Very low	39.1	Very low	136 Å²	136	129.4 Å²	129.4	73%	0.727	71%	0.714	S	S	*	*			cis	-173.4	176.1	-22	-147.4	-1.9	0	0	0	106.6
1661	V	41	Very low	39.3	Very low	104 Å²	104	127.4 Å²	127.4	63%	0.63	71%	0.712	S	S	*	*			cis	-155	173.3	8.8	-149.2	0	0	0	0	109.5
1662	N	41.4	Very low	39.7	Very low	147 Å²	147	127 Å²	127	79%	0.786	71%	0.713	S	S	*	*			trans	86.8	149.8	146.7	-83.7	-10.3	0	0	0	121.5
1663	P	47.9	Very low	39.9	Very low	105 Å²	105	123.8 Å²	123.8	68%	0.682	71%	0.708	S	S	*	*			trans	-144.5	-174.8	-131	38.1	-15	0	0	0	117.6
1664	L	38.2	Very low	40.3	Very low	138 Å²	138	125.9 Å²	125.9	72%	0.723	72%	0.715	S	S	*	*				139.9	127.3	111.6	-158.2	71.1	0	0	0	117.3
1665	H	39	Very low	40.7	Very low	145 Å²	145	124.6 Å²	124.6	67%	0.671	71%	0.712	S	S	*	*			trans	68.6	149.2	156.3	-81.5	26.7	0	0	0	121.1
1666	Q	41.4	Very low	41.3	Very low	161 Å²	161	125.6 Å²	125.6	75%	0.752	71%	0.711	S	S	*	*			cis	-161	165.6	-27.2	-116.6	-161.9	2.3	0	0	111.1
1667	P	43.9	Very low	41.4	Very low	80 Å²	80	124.7 Å²	124.7	52%	0.519	71%	0.708	S	S	.	*			trans	-90.2	162.6	-165.2	38.3	-39.1	0	0	0	115.8
1668	P	41.8	Very low	41.3	Very low	123 Å²	123	129.8 Å²	129.8	80%	0.799	72%	0.722	S	S	*	*				-100.6	170.3	89.8	-20.6	35.6	0	0	0	114.7
1669	H	44.8	Very low	41.2	Very low	164 Å²	164	132.1 Å²	132.1	76%	0.759	76%	0.759	S	S	*	*			cis	94.4	142	11.2	-73.7	-65.8	0	0	0	119.1
1670	P	46.4	Very low	41.2	Very low	108 Å²	108	131.6 Å²	131.6	70%	0.701	76%	0.759	S	S	*	*			trans	-138.6	-137.1	-131.2	44.5	-23.5	0	0	0	113.2
1671	V	40.3	Very low	41.3	Very low	137 Å²	137	131.4 Å²	131.4	83%	0.83	76%	0.76	S	S	*	*			trans	118.1	133.6	160.7	171.4	0	0	0	0	113.5
1672	S	40.5	Very low	41.3	Very low	88 Å²	88	132.9 Å²	132.9	62%	0.615	77%	0.768	S	S	*	*			cis	-174.1	159.6	-22	-175.6	0	0	0	0	109.3
1673	S	41	Very low	41.3	Very low	91 Å²	91	132.1 Å²	132.1	64%	0.636	77%	0.767	S	S	*	*			trans	49.6	147.7	140.7	57	0	0	0	0	122.5
1674	Q	41.9	Very low	40.9	Very low	164 Å²	164	133.8 Å²	133.8	77%	0.766	77%	0.772	S	S	*	*			cis	-163.2	145.7	-8.3	-107.9	174.2	-3.1	0	0	105.8
1675	I	43.7	Very low	41.1	Very low	143 Å²	143	133.5 Å²	133.5	73%	0.733	78%	0.775	S	S	*	*				63.1	144.4	88.7	-107.7	169.4	0	0	0	113.9
1676	P	43.2	Very low	41.2	Very low	111 Å²	111	132.6 Å²	132.6	72%	0.721	78%	0.783	S	S	*	*			cis	-131.1	-164.5	-10.1	41.4	-22.1	0	0	0	112.3
1677	P	35.9	Very low	41.2	Very low	112 Å²	112	130.5 Å²	130.5	73%	0.727	79%	0.785	S	S	*	*			trans	-101	-178.5	177.6	39.9	-32	0	0	0	112.8
1678	Q	36.2	Very low	41	Very low	196 Å²	196	134.7 Å²	134.7	92%	0.916	81%	0.807	S	S	*	*			trans	-178.9	102.7	136.6	-103.4	174.2	21.9	0	0	112.7
1679	A	35.9	Very low	40.9	Very low	179 Å²	179	135.7 Å²	135.7	100%	1.479	81%	0.808	S	S	*	*			trans	-176	0	149	0	0	0	0	0	108.2

Retrieved 1,679 of 1,679 residues in 2166 ms (Link to these results)

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