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Isoform k 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 X5M5N0-12 (canonical: X5M5N0), Species CAEEL (Caenorhabditis elegans), Gene wnk-1, Length 1,682 aa.

						>WNK_CAEEL|X5M5N0-12|wnk-1
MPDSITNGGRPPAPPSSVSSTTASTTGNFGTRRRLVNRIKKVDELHPAQENPTMGSHWLSEQERSRLEAVQQDWRRTRPMKFQWTSKKRPDDPTTSSPSTVSISNALENSTPSLNNVSSITNSSSPFSLSSAATSTASAIIPFTSNVATNHPHLNHHVSRIPQAIVTGGTNGSLPPLLISPTSAAAATPLISGKAGPMSPSTGSPINVAATVLQNAVSSPQHSIFDRSRLNKIPPNTSLASSSSPSDAANNDKPIQQRHSILSNVRTLTQAMVNDGPRTLTGDDMDKMVSEEERARKEQEKREEEEKAARRIDVEDDFDAQEKPIDKSKNGRFLKFDEELGRGSFKTVFRGLDTETGVAVAWCELQESKLNKTERQRFREEAEMLKDLQHPNIVRFYDYWESADLCGKRKYIVLVTELMTSGTLKMYLKRFKRINIKVLKSWCRQILKGLSFLHTRNPPVIHRDLKCDNIFITGTTGSVKIGDLGLATLKNKSFAKSVIGTPEFMAPEMYEEMYDESVDVYAFGMCLLEMVTGEYPYSECMNPATIYRKVISGVKPECFSRIPAQYPEIREIIDRCIRVRREERSTVKQLLVDDFFTPEDLIGIRVEIKNRDADLNDLNVEIQMQLRVYDEKKRKQYRFKENEGLQFAFDIENDSPDEVVQQMIEQQHIPDEDTRMITKLIKDKVDAFRRDRDHRLLEIKRAKEEEERIREEAEIKEELRLRAEAKEKEKERLEKERLEKKAAAAAAANPNPTPIPPTPATPHSSAQQQPIPPPLSTQTSAEIQQSAQQPSVPVTMIANIPAMSPTSAQPQPVLSPTSAAVPVPTTMIHVPKPSEIPVQNVATTAAPVAANNVPPSPAPFKTEDIQTPTLAQNTVPRTISTDASGLVINTPASIASPSPAPSATDVASTTAPVTPAPTPTTTTDGGAAAASTTTENKEEKRKSNKRKVVMEILGCDESRNFALVSCRLDTSHKSVTFQFAPGTDKPCTIATKLLAEDCLLKVHVHIVEAQLGEVIQLINSDGKKGVGTKLATVLDPNSTEPPTITAVMPKDSSAATASNTKPKIEIEKTPPTRDASQEPNNVQVTNVRKVSQESNAESVQSIPRPGGIIVMSPTNQTDSAPPPTGAAAKPSRFQVTKSADPIATPISSSISTATVIPIVAATPTNITSEPVIVQPITAQVITHLATPSPVSHSLSSNSSPSATTHSNMSSIQSTTSVPGRRFTVQPVSQAESGISSSISTPHPEPTPAITSCPPPVPSVPPVVSNGTLNLEVAPKQTPSATNQNVDTQHSSSTASTATLVSETPATVHVTPISVPAPVQEPLVIDHHSDVLTQLDSELRKCFQVSGVSHSASPSTVVESLTSMTPQTIPLACQTVPASIGQAPAVIAAAHAASLIPNASVPQSPSRLDAETGLAGLHEKLEALKMEQDRREDMGDDAIGTTTTDGKDEIPIDTLKGLAEALGKVIHADGRETTPMPPDHPDLTDASTGQMDLESEDPEVIQMIVRHRMEQHKLLEKQRVEIERLRSKIRVPRATSVNPEMIGDDEADTTLTALQSALGNASLSLPASPPPNTETTKVNTTVIPSDVLATRMTMSQSSTKSSNVSVSSRHRDNQSAPPRHHHHQPHPPHHPHLQNHYHPPQNHTSATAPCPSAMVQLQAVSNNNVNPLHQPPHPVSSQIPPQA
					

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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	33.6	Very low	36.8	Very low	215 Å²	215	138.2 Å²	138.2	100%	1.059	82%	0.818	S	S	*	*				0	152.8	0	-77.6	-55.1	177	0	0	109.3
2	P	49.9	Very low	37.3	Very low	103 Å²	103	137.3 Å²	137.3	67%	0.669	82%	0.819	S	S	*	*				-118	172.8	-126.1	41.9	-36.4	0	0	0	115.9
3	D	33.7	Very low	37.1	Very low	168 Å²	168	132.9 Å²	132.9	90%	0.898	81%	0.807	S	S	*	*			trans	-157.1	161.9	142.8	-107.2	-34.7	0	0	0	110.8
4	S	38.3	Very low	37.1	Very low	99 Å²	99	131.9 Å²	131.9	69%	0.692	81%	0.805	S	S	*	*			trans	-136.3	128.4	-158.2	-65.8	0	0	0	0	117.9
5	I	36.2	Very low	37.9	Very low	168 Å²	168	131.9 Å²	131.9	86%	0.862	81%	0.808	S	S	*	*			trans	23.4	134	137.6	-53.8	175	0	0	0	120.1
6	T	36.5	Very low	37.6	Very low	114 Å²	114	131.2 Å²	131.2	70%	0.699	81%	0.81	S	S	*	*			trans	-136.1	164	159.4	58.5	0	0	0	0	113.3
7	N	37.1	Very low	38	Very low	165 Å²	165	129.9 Å²	129.9	88%	0.882	81%	0.807	S	S	*	*			trans	82.9	122.1	163	-60.7	-28	0	0	0	121
8	G	31.2	Very low	37.8	Very low	84 Å²	84	130.2 Å²	130.2	87%	0.866	81%	0.808	S	S	*	*			trans	-159.6	137.9	159.4	0	0	0	0	0	109.2
9	G	33.8	Very low	37.6	Very low	85 Å²	85	128.5 Å²	128.5	88%	0.876	80%	0.801	S	S	*	*			trans	-133.9	158	-170.2	0	0	0	0	0	114
10	R	37.1	Very low	37.4	Very low	212 Å²	212	127.7 Å²	127.7	80%	0.8	80%	0.801	S	S	*	*			trans	-137.8	138.3	-167.5	-176.1	-172.7	179	-96	6.6	112.3
11	P	37.5	Very low	37.1	Very low	107 Å²	107	127 Å²	127	70%	0.695	80%	0.796	S	S	*	*			trans	-76.5	165.4	172.8	30.3	-32.8	0	0	0	113.7
12	P	42.2	Very low	37	Very low	127 Å²	127	122.8 Å²	122.8	83%	0.825	78%	0.782	S	S	*	*			trans	-99.4	-172.1	-141.4	38.5	-38.9	0	0	0	117
13	A	35.6	Very low	36.2	Very low	81 Å²	81	122.4 Å²	122.4	67%	0.669	79%	0.788	S	S	*	*			trans	-120.5	163.2	-173.3	0	0	0	0	0	112.4
14	P	36.7	Very low	36.2	Very low	119 Å²	119	119.3 Å²	119.3	77%	0.773	78%	0.779	S	S	*	*			trans	-81.6	160.4	178.1	34.1	-36.3	0	0	0	113.6
15	P	49.6	Very low	35.9	Very low	132 Å²	132	120.8 Å²	120.8	86%	0.857	78%	0.784	S	S	*	*			trans	-79.9	162.2	-179.3	33.5	-36.5	0	0	0	113.8
16	S	32.9	Very low	35.8	Very low	120 Å²	120	119.1 Å²	119.1	84%	0.839	78%	0.782	S	S	*	*			trans	-145.2	147.1	-174.6	61.1	0	0	0	0	112.8
17	S	43.8	Very low	35.4	Very low	109 Å²	109	117 Å²	117	76%	0.762	78%	0.783	S	S	*	*			trans	-145.9	115.3	165.6	58.8	0	0	0	0	112.9
18	V	35.5	Very low	35.1	Very low	136 Å²	136	116.6 Å²	116.6	82%	0.824	78%	0.781	S	S	*	*			trans	6.7	147	141.6	-72	0	0	0	0	119.9
19	S	33.3	Very low	35.1	Very low	97 Å²	97	122.4 Å²	122.4	68%	0.678	78%	0.783	S	S	*	*			cis	-174.6	158.9	-3.8	46.3	0	0	0	0	112.3
20	S	33.1	Very low	34.9	Very low	112 Å²	112	122 Å²	122	78%	0.783	78%	0.778	S	S	*	*			trans	68.6	146.4	163.8	78.1	0	0	0	0	116.2
21	T	32.1	Very low	34.6	Very low	115 Å²	115	118.8 Å²	118.8	71%	0.706	78%	0.782	S	S	*	*			cis	-147.5	146.8	6.9	-39.3	0	0	0	0	110.4
22	T	31.5	Very low	34.4	Very low	125 Å²	125	125.7 Å²	125.7	77%	0.767	80%	0.795	S	S	*	*			trans	35.9	108.5	159.1	49.4	0	0	0	0	119.8
23	A	33.2	Very low	34	Very low	95 Å²	95	131.2 Å²	131.2	79%	0.785	80%	0.799	S	S	*	*				90.8	141.7	80.8	0	0	0	0	0	113.6
24	S	33.6	Very low	33.9	Very low	104 Å²	104	139.3 Å²	139.3	73%	0.727	81%	0.812	S	S	*	*			cis	-158.9	157.3	-5.2	43.9	0	0	0	0	113.2
25	T	31.3	Very low	33.8	Very low	130 Å²	130	141.2 Å²	141.2	80%	0.798	82%	0.815	S	S	*	*			trans	-5.2	147.7	148.1	-0.1	0	0	0	0	118.1
26	T	33.2	Very low	33.2	Very low	132 Å²	132	139.7 Å²	139.7	81%	0.81	80%	0.803	S	S	*	*			cis	-143.4	163.7	23.6	48.9	0	0	0	0	110.6
27	G	28.1	Very low	33.2	Very low	70 Å²	70	142.1 Å²	142.1	72%	0.722	81%	0.807	S	S	*	*			cis	118.5	92.9	14.8	0	0	0	0	0	111.4
28	N	32.7	Very low	32.9	Very low	157 Å²	157	147.2 Å²	147.2	84%	0.84	81%	0.809	S	S	*	*			trans	-163	163.5	162.4	-127	-3.1	0	0	0	115.6
29	F	29.6	Very low	33.2	Very low	206 Å²	206	146.5 Å²	146.5	90%	0.904	80%	0.799	S	S	*	*			trans	-37.6	133.9	179.5	-75.7	-122.5	0	0	0	117
30	G	29.8	Very low	33.2	Very low	75 Å²	75	149.4 Å²	149.4	77%	0.773	80%	0.8	S	S	*	*			trans	-163.3	27	179.7	0	0	0	0	0	118.9
31	T	31.3	Very low	33.1	Very low	145 Å²	145	151 Å²	151	89%	0.89	79%	0.792	S	S	*	*			trans	-139.2	43.9	-172.4	-28.3	0	0	0	0	116.3
32	R	32.3	Very low	33.2	Very low	253 Å²	253	149.9 Å²	149.9	96%	0.955	79%	0.785	S	S	*	*			trans	-128.9	65.6	163.3	-80.5	-165.3	174.6	-158	0.9	112.4
33	R	34.2	Very low	33.3	Very low	242 Å²	242	151.9 Å²	151.9	91%	0.913	79%	0.791	S	S	*	*			trans	-146.9	32	172.6	-118.5	176.5	-170.4	-179.2	2.9	115.3
34	R	33.2	Very low	33.1	Very low	252 Å²	252	152.1 Å²	152.1	95%	0.951	78%	0.776	S	S	*	*	S	Bend	trans	-126.7	16.4	175.1	-80.6	-170	173.6	-177.7	-0.9	115.1
35	L	35.5	Very low	32.9	Very low	159 Å²	159	153.9 Å²	153.9	83%	0.832	78%	0.777	S	S	*	*	S	Bend	trans	-130.3	43.4	-177.9	-159.8	72.7	0	0	0	113.2
36	V	37.3	Very low	33	Very low	100 Å²	100	156.2 Å²	156.2	61%	0.606	78%	0.778	S	S	*	*	S	Bend	trans	-132	-35.7	174.7	-173	0	0	0	0	111.7	R38	V36-R38 PolarHBondContact O-N 3.01Å
37	N	33.2	Very low	33	Very low	171 Å²	171	155.5 Å²	155.5	91%	0.914	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	27.7	-179.9	-70.8	6.5	0	0	0	115.3
38	R	37.1	Very low	33	Very low	216 Å²	216	156.7 Å²	156.7	82%	0.815	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.1	-10	177.2	-142.2	176.3	-168.7	173.1	3	114.6	V36	V36-R38 PolarHBondContact O-N 3.01Å
39	I	40.7	Very low	32.8	Very low	121 Å²	121	157.3 Å²	157.3	62%	0.621	78%	0.777	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-37	-178.2	-68.2	167.4	0	0	0	111.7	K41 V42	I39-K41 PolarHBondContact O-N 3.26Å; I39-V42 PolarHBondContact O-N 2.92Å
40	K	34.2	Very low	32.7	Very low	158 Å²	158	156 Å²	156	69%	0.687	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	39.5	177.9	-71.3	170.2	175.2	164.5	0	113.6	D319	K40-D319 WeakPolarHBondContact CE-OD1 3.33Å; K40-D319 IonicContact NZ-OD1 3.66Å; K40-D319 PolarHBondContact NZ-OD1 3.03Å; K40-D319 IonicContact NZ-OD2 2.72Å; K40-D319 PolarHBondContact NZ-OD2 3.31Å
41	K	31.5	Very low	32.5	Very low	144 Å²	144	159.1 Å²	159.1	63%	0.626	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.4	14.9	167	-145.8	-178.5	-177.9	-179.8	0	113.9	I39 D43	I39-K41 PolarHBondContact O-N 3.26Å; K41-D43 PolarHBondContact O-N 2.82Å
42	V	34.2	Very low	32.5	Very low	92 Å²	92	157 Å²	157	56%	0.558	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	58.6	-179.7	-167.1	0	0	0	0	111	I39	I39-V42 PolarHBondContact O-N 2.92Å
43	D	33.2	Very low	32.3	Very low	167 Å²	167	151.4 Å²	151.4	89%	0.893	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.7	4.2	166.1	-141.3	10.1	0	0	0	111.2	K41	K41-D43 PolarHBondContact O-N 2.82Å
44	E	29.6	Very low	32	Very low	100 Å²	100	149.2 Å²	149.2	47%	0.467	76%	0.758	S	S	.	*	S	Bend	trans	-132.8	47.4	176.2	-74.1	-167.5	120.1	0	0	111
45	L	29.3	Very low	31.7	Very low	142 Å²	142	140.3 Å²	140.3	74%	0.743	74%	0.744	S	S	*	*			trans	-128.2	83.8	170.2	-75.4	178.1	0	0	0	111.1
46	H	33.3	Very low	31.8	Very low	179 Å²	179	137.5 Å²	137.5	83%	0.829	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-54.2	143.2	151.4	-84.1	-123.9	0	0	0	109.2
47	P	33.3	Very low	32.2	Very low	117 Å²	117	138.4 Å²	138.4	76%	0.76	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-58.4	157.6	157.5	29.5	-34.3	0	0	0	109.4
48	A	27.8	Very low	33.2	Very low	94 Å²	94	135.8 Å²	135.8	78%	0.777	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-53.9	143.6	-175	0	0	0	0	0	112.1	E50	A48-E50 VanDerWaalsContact C-N 3.28Å; A48-E50 PolarHBondContact O-N 3.21Å
49	Q	28	Very low	34.3	Very low	170 Å²	170	126.3 Å²	126.3	79%	0.794	68%	0.678	S	S	*	*			trans	-69.1	85.1	177.2	-177.3	178.9	-15.1	0	0	109.7	N51	Q49-N51 PolarHBondContact O-N 3.08Å
50	E	28.4	Very low	35.8	Very low	179 Å²	179	123.1 Å²	123.1	84%	0.836	67%	0.666	S	S	*	*			trans	-55.2	132.6	158.2	-67.6	-168.1	147.6	0	0	108	A48 P52	A48-E50 VanDerWaalsContact C-N 3.28Å; A48-E50 PolarHBondContact O-N 3.21Å; E50-P52 VanDerWaalsContact O-CD 3.25Å; E50-P52 WeakPolarHBondContact O-CD 3.4Å; E50-P52 VanDerWaalsContact O-N 3.15Å
51	N	25.5	Very low	37.6	Very low	140 Å²	140	123.4 Å²	123.4	75%	0.749	67%	0.67	S	S	*	*			trans	-59.8	119.6	-176.5	-79.5	-40.8	0	0	0	109.8	Q49 T53	Q49-N51 PolarHBondContact O-N 3.08Å; N51-T53 VanDerWaalsContact C-N 3.3Å; N51-T53 PolarHBondContact O-N 3.29Å
52	P	30.4	Very low	39.5	Very low	102 Å²	102	122.4 Å²	122.4	66%	0.662	67%	0.668	S	S	*	*			trans	-70.9	94.1	168.7	30	-32.1	0	0	0	108	E50 M54	E50-P52 VanDerWaalsContact O-CD 3.25Å; E50-P52 WeakPolarHBondContact O-CD 3.4Å; E50-P52 VanDerWaalsContact O-N 3.15Å; P52-M54 PolarHBondContact O-N 3.37Å
53	T	28.7	Very low	41.5	Very low	134 Å²	134	118.8 Å²	118.8	82%	0.822	65%	0.645	S	S	*	*			trans	-50.7	128.9	159	-35.7	0	0	0	0	107	N51 G55	N51-T53 VanDerWaalsContact C-N 3.3Å; N51-T53 PolarHBondContact O-N 3.29Å; T53-G55 PolarHBondContact O-N 3.26Å
54	M	27.3	Very low	43.6	Very low	197 Å²	197	116.9 Å²	116.9	97%	0.97	63%	0.625	S	S	*	*	S	Bend	trans	-57.6	123.5	-166.3	-68.8	-170.6	-174.6	0	0	112.3	P52	P52-M54 PolarHBondContact O-N 3.37Å
55	G	28.4	Very low	46.1	Very low	65 Å²	65	115.2 Å²	115.2	67%	0.67	63%	0.625	S	S	*	*			trans	136.4	67.1	164.8	0	0	0	0	0	117.2	T53	T53-G55 PolarHBondContact O-N 3.26Å
56	S	36.8	Very low	48.5	Very low	100 Å²	100	111.5 Å²	111.5	70%	0.699	60%	0.601	S	S	*	*			trans	-161	36.6	166	75	0	0	0	0	116.3	W58	S56-W58 PolarHBondContact O-N 3.26Å
57	H	46	Very low	50.6	Low	119 Å²	119	103.2 Å²	103.2	55%	0.551	56%	0.563	S	S	*	*			trans	-101.6	72.2	178	-161.2	-39.5	0	0	0	111.6	L59 R64	H57-L59 PolarHBondContact CE1-O 2.96Å; H57-L59 PolarHBondContact ND1-O 3.5Å; H57-L59 VanDerWaalsContact ND1-O 3.13Å; H57-L59 PolarHBondContact O-N 2.86Å; H57-R64 VanDerWaalsContact CE1-CZ 3.42Å; H57-R64 PolarHBondContact CE1-NE 3.03Å; H57-R64 VanDerWaalsContact NE2-CZ 3.32Å; H57-R64 PolarHBondContact NE2-NH2 2.84Å
58	W	53.2	Low	52.9	Low	116 Å²	116	102.8 Å²	102.8	44%	0.439	55%	0.551	S	S	.	*			trans	-79.1	-8.7	-168.9	-80.3	100.5	0	0	0	116.6	S56 D600	S56-W58 PolarHBondContact O-N 3.26Å; W58-D600 WeakPolarHBondContact CH2-OD1 3.43Å; W58-D600 HydrophobicContact CZ2-CB 4.3Å; W58-D600 WeakPolarHBondContact CZ2-OD1 3.19Å; W58-D600 VanDerWaalsContact CZ2-OD2 3.23Å; W58-D600 WeakPolarHBondContact CZ2-OD2 3.15Å
59	L	60.5	Low	55.5	Low	17 Å²	17	99.2 Å²	99.2	9%	0.089	52%	0.521	C	S	.	.	S	Bend	trans	-111.5	130.9	-178.1	-65.5	121.7	0	0	0	109.2	H57 E63 R64 L67 V438 T476	H57-L59 PolarHBondContact CE1-O 2.96Å; H57-L59 PolarHBondContact ND1-O 3.5Å; H57-L59 VanDerWaalsContact ND1-O 3.13Å; H57-L59 PolarHBondContact O-N 2.86Å; L59-E63 HydrophobicContact CB-CB 4.14Å; L59-E63 HydrophobicContact CD2-CB 3.79Å; L59-R64 HydrophobicContact CB-CG 4.2Å; L59-L67 HydrophobicContact CD2-CD1 3.83Å; L59-V438 HydrophobicContact CD2-CG1 4.48Å; L59-V438 HydrophobicContact CD2-CG2 4.08Å; L59-T476 WeakPolarHBondContact CD1-O 3.36Å
60	S	73.1	Confident	57.8	Low	53 Å²	53	91.2 Å²	91.2	37%	0.371	48%	0.484	S	S	.	.			trans	-61.9	162.5	169.7	67.6	0	0	0	0	111	Q62 E63 R64	S60-Q62 PolarHBondContact O-N 3.19Å; S60-Q62 PolarHBondContact OG-N 2.94Å; S60-E63 VanDerWaalsContact CB-OE2 3.29Å; S60-E63 WeakPolarHBondContact CB-OE2 3.33Å; S60-E63 PolarHBondContact N-OE2 3.37Å; S60-E63 PolarHBondContact O-N 3.46Å; S60-E63 PolarHBondContact OG-N 3.49Å; S60-E63 PolarHBondContact OG-OE2 2.96Å; S60-R64 PolarHBondContact O-N 2.97Å
61	E	70.5	Confident	60.1	Low	165 Å²	165	84 Å²	84	77%	0.771	45%	0.45	S	S	*	.	H	α-helix	trans	-56.5	-33.2	172.2	-60	-168.8	137.4	0	0	111.9	R64 S65	E61-R64 PolarHBondContact O-N 3.5Å; E61-S65 VanDerWaalsContact O-CB 3.3Å; E61-S65 WeakPolarHBondContact O-CB 3.35Å; E61-S65 PolarHBondContact O-N 3.36Å
62	Q	72.5	Confident	62.5	Low	123 Å²	123	80.9 Å²	80.9	58%	0.575	43%	0.431	S	S	*	.	H	α-helix	trans	-66.9	-38.5	175.8	-173.9	67.7	-24.5	0	0	112.2	S60 R66	S60-Q62 PolarHBondContact O-N 3.19Å; S60-Q62 PolarHBondContact OG-N 2.94Å; Q62-R66 WeakPolarHBondContact O-CB 3.27Å; Q62-R66 VanDerWaalsContact O-CG 3.28Å; Q62-R66 WeakPolarHBondContact O-CG 3.42Å; Q62-R66 PolarHBondContact O-N 2.84Å
63	E	74.9	Confident	64.4	Low	16 Å²	16	79 Å²	79	8%	0.075	42%	0.415	C	S	.	.	H	α-helix	trans	-74.4	-31.5	172.9	-73.8	117.6	-167.6	0	0	113.3	L59 S60 R66 L67 N435 V438	L59-E63 HydrophobicContact CB-CB 4.14Å; L59-E63 HydrophobicContact CD2-CB 3.79Å; S60-E63 VanDerWaalsContact CB-OE2 3.29Å; S60-E63 WeakPolarHBondContact CB-OE2 3.33Å; S60-E63 PolarHBondContact N-OE2 3.37Å; S60-E63 PolarHBondContact O-N 3.46Å; S60-E63 PolarHBondContact OG-N 3.49Å; S60-E63 PolarHBondContact OG-OE2 2.96Å; E63-R66 WeakPolarHBondContact O-CB 3.36Å; E63-R66 PolarHBondContact O-N 3.34Å; E63-L67 WeakPolarHBondContact O-CG 3.4Å; E63-L67 PolarHBondContact O-N 3.03Å; E63-N435 WeakPolarHBondContact OE1-CB 3.23Å; E63-N435 PolarHBondContact OE1-ND2 3.22Å; E63-V438 HydrophobicContact CG-CG2 3.99Å
64	R	78.5	Confident	66	Low	126 Å²	126	74.5 Å²	74.5	48%	0.475	38%	0.383	S	S	.	.	H	α-helix	trans	-63.8	-47.2	170.3	-74	-175.4	163.5	-147.3	-4.4	111.7	H57 L59 S60 E61 R66 L67 E68	H57-R64 VanDerWaalsContact CE1-CZ 3.42Å; H57-R64 PolarHBondContact CE1-NE 3.03Å; H57-R64 VanDerWaalsContact NE2-CZ 3.32Å; H57-R64 PolarHBondContact NE2-NH2 2.84Å; L59-R64 HydrophobicContact CB-CG 4.2Å; S60-R64 PolarHBondContact O-N 2.97Å; E61-R64 PolarHBondContact O-N 3.5Å; R64-R66 VanDerWaalsContact C-N 3.29Å; R64-R66 PolarHBondContact O-N 3.06Å; R64-L67 PolarHBondContact O-N 3.44Å; R64-L67 VanDerWaalsContact O-N 3.12Å; R64-E68 PolarHBondContact O-N 3.15Å
65	S	81.6	Confident	68	Low	66 Å²	66	71.9 Å²	71.9	46%	0.462	36%	0.362	S	S	.	.	H	α-helix	trans	-56.6	-42.5	173.4	177.2	0	0	0	0	111.4	E61 E68 A69	E61-S65 VanDerWaalsContact O-CB 3.3Å; E61-S65 WeakPolarHBondContact O-CB 3.35Å; E61-S65 PolarHBondContact O-N 3.36Å; S65-E68 PolarHBondContact O-N 3.26Å; S65-A69 WeakPolarHBondContact O-CB 3.36Å; S65-A69 PolarHBondContact O-N 2.73Å
66	R	80.6	Confident	69.7	Low	63 Å²	63	77.5 Å²	77.5	24%	0.238	36%	0.363	C	S	.	.	H	α-helix	trans	-59.8	-48.2	171.7	-77.5	179	172.9	-158.2	-0.4	113	Q62 E63 R64 A69 V70 Y427 F431 R433	Q62-R66 WeakPolarHBondContact O-CB 3.27Å; Q62-R66 VanDerWaalsContact O-CG 3.28Å; Q62-R66 WeakPolarHBondContact O-CG 3.42Å; Q62-R66 PolarHBondContact O-N 2.84Å; E63-R66 WeakPolarHBondContact O-CB 3.36Å; E63-R66 PolarHBondContact O-N 3.34Å; R64-R66 VanDerWaalsContact C-N 3.29Å; R64-R66 PolarHBondContact O-N 3.06Å; R66-A69 WeakPolarHBondContact O-CB 3.5Å; R66-A69 PolarHBondContact O-N 3.37Å; R66-V70 PolarHBondContact O-N 3.11Å; R66-Y427 HydrophobicContact CB-CE2 4.2Å; R66-F431 VanDerWaalsContact CA-CZ 3.49Å; R66-F431 HydrophobicContact CB-CD2 3.99Å; R66-F431 HydrophobicContact CB-CE1 4.16Å; R66-F431 HydrophobicContact CB-CE2 3.44Å; R66-F431 VanDerWaalsContact CB-CE2 3.44Å; R66-F431 HydrophobicContact CB-CZ 3.56Å; R66-F431 HydrophobicContact CG-CD1 3.96Å; R66-F431 HydrophobicContact CG-CD2 4.15Å; R66-F431 HydrophobicContact CG-CE1 3.7Å; R66-F431 HydrophobicContact CG-CE2 3.87Å; R66-F431 HydrophobicContact CG-CG 4.18Å; R66-F431 HydrophobicContact CG-CZ 3.65Å; R66-F431 WeakPolarHBondContact O-CE2 3.28Å; R66-F431 VanDerWaalsContact O-CZ 3.26Å; R66-F431 WeakPolarHBondContact O-CZ 3.48Å; R66-R433 PolarHBondContact NH1-O 3.13Å
67	L	77.1	Confident	70.5	Confident	6 Å²	6	77.4 Å²	77.4	3%	0.031	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-44.4	178.6	-74.1	174	0	0	0	112.2	L59 E63 R64 A69 V70 Q71 Y427 W442 I472	L59-L67 HydrophobicContact CD2-CD1 3.83Å; E63-L67 WeakPolarHBondContact O-CG 3.4Å; E63-L67 PolarHBondContact O-N 3.03Å; R64-L67 PolarHBondContact O-N 3.44Å; R64-L67 VanDerWaalsContact O-N 3.12Å; L67-A69 VanDerWaalsContact C-N 3.31Å; L67-A69 PolarHBondContact O-N 3.47Å; L67-V70 PolarHBondContact O-N 3.15Å; L67-Q71 PolarHBondContact O-N 2.64Å; L67-Y427 HydrophobicContact CD2-CD2 3.93Å; L67-Y427 HydrophobicContact CD2-CE2 3.77Å; L67-Y427 HydrophobicContact CG-CE2 4.28Å; L67-W442 HydrophobicContact CD2-CZ2 4.27Å; L67-I472 HydrophobicContact CD2-CD1 4.38Å; L67-I472 HydrophobicContact CD2-CG2 3.62Å
68	E	82.3	Confident	70.7	Confident	108 Å²	108	74 Å²	74	51%	0.505	34%	0.341	S	S	.	.	H	α-helix	trans	-62.5	-40.8	175.2	-159.4	-158.3	137.1	0	0	110.9	R64 S65 V70 Q71 Q72	R64-E68 PolarHBondContact O-N 3.15Å; S65-E68 PolarHBondContact O-N 3.26Å; E68-V70 PolarHBondContact O-N 3.27Å; E68-Q71 CarbonylContact O-C 3.57Å; E68-Q71 WeakPolarHBondContact O-CA 3.47Å; E68-Q71 WeakPolarHBondContact O-CB 3.43Å; E68-Q71 PolarHBondContact O-N 3.27Å; E68-Q71 VanDerWaalsContact O-N 3.09Å; E68-Q72 WeakPolarHBondContact O-CG 3.38Å; E68-Q72 PolarHBondContact O-N 3.47Å; E68-Q72 PolarHBondContact OE1-NE2 3.28Å
69	A	80.7	Confident	69.9	Low	19 Å²	19	73.8 Å²	73.8	16%	0.157	36%	0.355	C	S	.	.	H	α-helix	trans	-63.4	-35.8	177.7	0	0	0	0	0	113.4	S65 R66 L67 D73 F431	S65-A69 WeakPolarHBondContact O-CB 3.36Å; S65-A69 PolarHBondContact O-N 2.73Å; R66-A69 WeakPolarHBondContact O-CB 3.5Å; R66-A69 PolarHBondContact O-N 3.37Å; L67-A69 VanDerWaalsContact C-N 3.31Å; L67-A69 PolarHBondContact O-N 3.47Å; A69-D73 PolarHBondContact O-N 2.85Å; A69-D73 VanDerWaalsContact O-N 3.08Å; A69-F431 HydrophobicContact CB-CZ 4.18Å
70	V	76.6	Confident	68.7	Low	2 Å²	2	79.7 Å²	79.7	1%	0.012	38%	0.383	C	S	.	.	H	α-helix	trans	-67.8	-41.6	169.3	167.3	0	0	0	0	111.1	R66 L67 E68 Q72 D73 W74 S421 M426 Y427 R430 F431	R66-V70 PolarHBondContact O-N 3.11Å; L67-V70 PolarHBondContact O-N 3.15Å; E68-V70 PolarHBondContact O-N 3.27Å; V70-Q72 PolarHBondContact O-N 3.49Å; V70-D73 PolarHBondContact O-N 2.82Å; V70-W74 WeakPolarHBondContact O-CB 2.94Å; V70-W74 PolarHBondContact O-N 3.01Å; V70-S421 WeakPolarHBondContact CG1-O 3.46Å; V70-M426 HydrophobicContact CG1-CB 4.48Å; V70-Y427 HydrophobicContact CG2-CD2 4.08Å; V70-R430 HydrophobicContact CG2-CB 4.19Å; V70-F431 HydrophobicContact CG2-CD2 4.18Å; V70-F431 HydrophobicContact CG2-CE2 3.45Å; V70-F431 VanDerWaalsContact CG2-CE2 3.45Å; V70-F431 HydrophobicContact CG2-CZ 4.17Å
71	Q	77.5	Confident	66.8	Low	27 Å²	27	84.8 Å²	84.8	13%	0.126	40%	0.399	C	S	.	.	H	α-helix	trans	-64.8	-37.9	177.3	179.6	162	41.6	0	0	112.3	L67 E68 R75 T420 S421	L67-Q71 PolarHBondContact O-N 2.64Å; E68-Q71 CarbonylContact O-C 3.57Å; E68-Q71 WeakPolarHBondContact O-CA 3.47Å; E68-Q71 WeakPolarHBondContact O-CB 3.43Å; E68-Q71 PolarHBondContact O-N 3.27Å; E68-Q71 VanDerWaalsContact O-N 3.09Å; Q71-R75 VanDerWaalsContact CD-NH2 3.33Å; Q71-R75 VanDerWaalsContact NE2-NH2 3.17Å; Q71-R75 WeakPolarHBondContact O-CB 3.36Å; Q71-R75 VanDerWaalsContact O-CG 3.23Å; Q71-R75 WeakPolarHBondContact O-CG 3.34Å; Q71-R75 PolarHBondContact O-N 3.04Å; Q71-T420 WeakPolarHBondContact CG-O 3.48Å; Q71-T420 PolarHBondContact NE2-O 2.99Å; Q71-T420 PolarHBondContact NE2-OG1 3.12Å; Q71-S421 PolarHBondContact NE2-OG 2.98Å
72	Q	76.3	Confident	64.8	Low	74 Å²	74	86 Å²	86	35%	0.346	40%	0.402	S	S	.	.	H	α-helix	trans	-65.3	-42.2	172.7	-72.3	-164.3	28.2	0	0	111.5	E68 V70 R75 R76	E68-Q72 WeakPolarHBondContact O-CG 3.38Å; E68-Q72 PolarHBondContact O-N 3.47Å; E68-Q72 PolarHBondContact OE1-NE2 3.28Å; V70-Q72 PolarHBondContact O-N 3.49Å; Q72-R75 PolarHBondContact O-N 3.1Å; Q72-R76 WeakPolarHBondContact O-CB 3.25Å; Q72-R76 WeakPolarHBondContact O-CG 3.42Å; Q72-R76 PolarHBondContact O-N 3.08Å
73	D	69.2	Low	62.7	Low	63 Å²	63	85.5 Å²	85.5	34%	0.337	40%	0.4	S	S	.	.	H	α-helix	trans	-62.6	-47.5	175.3	-119.2	28.3	0	0	0	111.5	A69 V70 R75 R76 T77 R430	A69-D73 PolarHBondContact O-N 2.85Å; A69-D73 VanDerWaalsContact O-N 3.08Å; V70-D73 PolarHBondContact O-N 2.82Å; D73-R75 VanDerWaalsContact C-N 3.27Å; D73-R75 PolarHBondContact O-N 2.9Å; D73-R76 CarbonylContact O-C 3.33Å; D73-R76 WeakPolarHBondContact O-CA 3.34Å; D73-R76 PolarHBondContact O-N 3.17Å; D73-T77 PolarHBondContact O-N 3.11Å; D73-T77 PolarHBondContact O-OG1 3.07Å; D73-R430 IonicContact OD1-NH1 3.39Å; D73-R430 PolarHBondContact OD1-NH1 3.36Å; D73-R430 IonicContact OD2-CZ 3.3Å; D73-R430 IonicContact OD2-NH1 3.22Å; D73-R430 PolarHBondContact OD2-NH1 2.69Å
74	W	62.2	Low	60.5	Low	39 Å²	39	93.4 Å²	93.4	15%	0.148	43%	0.429	C	S	.	.	H	α-helix	trans	-59.3	-38.5	177.8	-176.1	77.8	0	0	0	112.1	V70 T77 M419 T420 M426	V70-W74 WeakPolarHBondContact O-CB 2.94Å; V70-W74 PolarHBondContact O-N 3.01Å; W74-T77 WeakPolarHBondContact CA-OG1 3.47Å; W74-T77 PolarHBondContact O-OG1 2.89Å; W74-M419 WeakPolarHBondContact CH2-O 3.42Å; W74-T420 VanDerWaalsContact CE3-O 3.25Å; W74-T420 HydrophobicContact CH2-CG2 4.14Å; W74-T420 VanDerWaalsContact CZ3-CA 3.43Å; W74-T420 HydrophobicContact CZ3-CG2 4.09Å; W74-T420 WeakPolarHBondContact CZ3-O 3.35Å; W74-M426 HydrophobicContact CB-CE 3.98Å; W74-M426 HydrophobicContact CG-CE 4.29Å
75	R	69.3	Low	58.1	Low	142 Å²	142	93.7 Å²	93.7	54%	0.536	45%	0.445	S	S	.	.	H	α-helix	trans	-66.7	-34.9	171.6	-70.9	172.9	-169.2	-168	7.2	112.7	Q71 Q72 D73	Q71-R75 VanDerWaalsContact CD-NH2 3.33Å; Q71-R75 VanDerWaalsContact NE2-NH2 3.17Å; Q71-R75 WeakPolarHBondContact O-CB 3.36Å; Q71-R75 VanDerWaalsContact O-CG 3.23Å; Q71-R75 WeakPolarHBondContact O-CG 3.34Å; Q71-R75 PolarHBondContact O-N 3.04Å; Q72-R75 PolarHBondContact O-N 3.1Å; D73-R75 VanDerWaalsContact C-N 3.27Å; D73-R75 PolarHBondContact O-N 2.9Å
76	R	64	Low	55.5	Low	183 Å²	183	96.3 Å²	96.3	69%	0.691	46%	0.463	S	S	*	.	H	α-helix	trans	-80.1	-27.5	179.4	-71.4	170	-167.6	-144.3	9.6	113.9	Q72 D73 R78	Q72-R76 WeakPolarHBondContact O-CB 3.25Å; Q72-R76 WeakPolarHBondContact O-CG 3.42Å; Q72-R76 PolarHBondContact O-N 3.08Å; D73-R76 CarbonylContact O-C 3.33Å; D73-R76 WeakPolarHBondContact O-CA 3.34Å; D73-R76 PolarHBondContact O-N 3.17Å; R76-R78 VanDerWaalsContact C-N 3.3Å
77	T	53.9	Low	53.1	Low	99 Å²	99	102.7 Å²	102.7	61%	0.607	49%	0.493	S	S	*	.	S	Bend	trans	-83	-5.6	176.4	52.3	0	0	0	0	113.2	D73 W74	D73-T77 PolarHBondContact O-N 3.11Å; D73-T77 PolarHBondContact O-OG1 3.07Å; W74-T77 WeakPolarHBondContact CA-OG1 3.47Å; W74-T77 PolarHBondContact O-OG1 2.89Å
78	R	51	Low	50.9	Low	48 Å²	48	112 Å²	112	18%	0.181	53%	0.533	C	S	.	.	S	Bend	trans	-64	144.4	165.8	-72.6	-173.2	180	-158.5	1.1	110.7	R76 M80 E338	R76-R78 VanDerWaalsContact C-N 3.3Å; R78-M80 VanDerWaalsContact C-N 3.29Å; R78-M80 PolarHBondContact O-N 2.66Å; R78-E338 IonicContact CZ-OE1 2.69Å; R78-E338 IonicContact NE-OE1 3.72Å; R78-E338 IonicContact NH1-OE1 3.84Å; R78-E338 PolarHBondContact NH1-OE1 2.75Å; R78-E338 IonicContact NH1-OE2 2.91Å
79	P	35.7	Very low	48.3	Very low	110 Å²	110	115.7 Å²	115.7	71%	0.714	54%	0.542	S	S	*	.			trans	-73.6	78.8	175.3	31.5	-35.5	0	0	0	111.6	K81	P79-K81 PolarHBondContact O-N 3.07Å; P79-K81 VanDerWaalsContact O-N 3.14Å
80	M	35.7	Very low	46	Very low	141 Å²	141	120 Å²	120	70%	0.695	57%	0.569	S	S	*	*			trans	-59.7	112.8	170.4	-82.4	-74.5	-180	0	0	110.6	R78 F82	R78-M80 VanDerWaalsContact C-N 3.29Å; R78-M80 PolarHBondContact O-N 2.66Å; M80-F82 PolarHBondContact O-N 2.7Å
81	K	32.2	Very low	43.7	Very low	160 Å²	160	127.4 Å²	127.4	70%	0.696	61%	0.608	S	S	*	*			trans	-65.8	94.7	169.9	-72.8	167.8	178.2	160.4	0	108.6	P79 Q83 D337	P79-K81 PolarHBondContact O-N 3.07Å; P79-K81 VanDerWaalsContact O-N 3.14Å; K81-Q83 PolarHBondContact O-N 3.18Å; K81-D337 PolarHBondContact NZ-O 2.96Å; K81-D337 IonicContact NZ-OD2 2.67Å; K81-D337 PolarHBondContact NZ-OD2 3.21Å
82	F	29.9	Very low	41.3	Very low	191 Å²	191	133.7 Å²	133.7	84%	0.838	64%	0.643	S	S	*	*			trans	-57	119.4	177.8	-94.8	-95.9	0	0	0	111.4	M80 W84	M80-F82 PolarHBondContact O-N 2.7Å; F82-W84 PolarHBondContact O-N 2.82Å
83	Q	27.4	Very low	39.7	Very low	113 Å²	113	134.8 Å²	134.8	53%	0.528	66%	0.656	S	S	.	*			trans	-64.8	125.2	164.6	-80.8	-179.5	-33	0	0	109.5	K81	K81-Q83 PolarHBondContact O-N 3.18Å
84	W	28.4	Very low	37.9	Very low	182 Å²	182	137.6 Å²	137.6	69%	0.689	68%	0.676	S	S	*	*			trans	-84.3	112.4	167.9	-105.6	24.1	0	0	0	109.7	F82 S86 K945	F82-W84 PolarHBondContact O-N 2.82Å; W84-S86 PolarHBondContact O-N 3.17Å; W84-K945 HydrophobicContact CH2-CG 4.44Å; W84-K945 HydrophobicContact CZ2-CD 4.04Å; W84-K945 HydrophobicContact CZ2-CG 4Å
85	T	28	Very low	36.5	Very low	131 Å²	131	141.5 Å²	141.5	80%	0.804	70%	0.704	S	S	*	*			trans	-67.2	113.8	159.5	52	0	0	0	0	108.6	K87	T85-K87 VanDerWaalsContact C-N 3.31Å; T85-K87 PolarHBondContact O-N 2.87Å
86	S	28.1	Very low	34.8	Very low	121 Å²	121	140 Å²	140	85%	0.846	72%	0.715	S	S	*	*			trans	-65.2	81.7	-178.6	-66	0	0	0	0	113	W84 K88	W84-S86 PolarHBondContact O-N 3.17Å; S86-K88 PolarHBondContact O-N 2.88Å
87	K	29.2	Very low	33.1	Very low	197 Å²	197	136.6 Å²	136.6	86%	0.857	72%	0.72	S	S	*	*			trans	-87.1	104.4	169	-166.9	169.8	-173.7	176.4	0	108.7	T85 R89	T85-K87 VanDerWaalsContact C-N 3.31Å; T85-K87 PolarHBondContact O-N 2.87Å; K87-R89 PolarHBondContact O-N 3.14Å
88	K	30.4	Very low	32.6	Very low	202 Å²	202	137 Å²	137	88%	0.878	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-52.5	128.2	171.2	-70.1	-175.9	175.2	-175.7	0	109.4	S86	S86-K88 PolarHBondContact O-N 2.88Å
89	R	28	Very low	31.6	Very low	185 Å²	185	139.9 Å²	139.9	70%	0.698	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-81.8	142.5	152.7	-103.4	-172.5	176.2	148.3	-3	107.7	K87 D1035	K87-R89 PolarHBondContact O-N 3.14Å; R89-D1035 IonicContact NH1-OD2 2.58Å; R89-D1035 PolarHBondContact NH1-OD2 2.91Å; R89-D1035 VanDerWaalsContact NH1-OD2 3.14Å
90	P	32.2	Very low	31.2	Very low	111 Å²	111	141.3 Å²	141.3	72%	0.721	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-75.2	155.7	153.8	35.9	-32.7	0	0	0	109.3
91	D	29.8	Very low	31	Very low	156 Å²	156	140 Å²	140	83%	0.834	76%	0.758	S	S	*	*			trans	-160.7	159.5	151.1	-83.9	-47.1	0	0	0	107
92	D	27.1	Very low	30.7	Very low	159 Å²	159	138.4 Å²	138.4	85%	0.85	77%	0.767	S	S	*	*			trans	-103.9	-162.5	-157.2	-133.4	-21.4	0	0	0	113.3
93	P	41.9	Very low	30.7	Very low	98 Å²	98	135.7 Å²	135.7	64%	0.636	76%	0.76	S	S	*	*			trans	-95.6	162.6	-145.5	33.8	-18.9	0	0	0	114.7
94	T	32.1	Very low	30.8	Very low	121 Å²	121	135.8 Å²	135.8	74%	0.742	77%	0.773	S	S	*	*				-175.9	143.7	79.3	29.7	0	0	0	0	115.4
95	T	32.7	Very low	30.9	Very low	121 Å²	121	134.9 Å²	134.9	74%	0.742	78%	0.782	S	S	*	*			trans	54	124.3	148.5	51.3	0	0	0	0	124.9
96	S	32.7	Very low	31	Very low	111 Å²	111	133.6 Å²	133.6	78%	0.776	79%	0.785	S	S	*	*			trans	73.5	151.9	138	71.8	0	0	0	0	121
97	S	29.6	Very low	30.9	Very low	111 Å²	111	135.9 Å²	135.9	78%	0.776	79%	0.786	S	S	*	*			cis	-161.9	-161	-26.6	57.9	0	0	0	0	109
98	P	42.6	Very low	30.9	Very low	109 Å²	109	135 Å²	135	71%	0.708	79%	0.785	S	S	*	*				-125.8	179.7	-109.5	41	-23	0	0	0	117.9
99	S	29.5	Very low	30.8	Very low	107 Å²	107	132 Å²	132	75%	0.748	78%	0.779	S	S	*	*			trans	77.7	139.2	151.1	70.5	0	0	0	0	122.1
100	T	28.5	Very low	30.9	Very low	141 Å²	141	128.3 Å²	128.3	87%	0.865	78%	0.781	S	S	*	*			trans	-113	154	158.8	38.8	0	0	0	0	108.4
101	V	30.5	Very low	30.9	Very low	112 Å²	112	129.2 Å²	129.2	68%	0.679	79%	0.785	S	S	*	*			trans	-133.8	128.3	174.4	179	0	0	0	0	110.7	I103	V101-I103 HydrophobicContact CG1-CD1 4.03Å; V101-I103 HydrophobicContact CG1-CG1 3.88Å
102	S	26.3	Very low	31.4	Very low	127 Å²	127	127.1 Å²	127.1	89%	0.888	78%	0.78	S	S	*	*			trans	-152.4	135.1	149.7	-76.6	0	0	0	0	107.1
103	I	30.1	Very low	31.5	Very low	135 Å²	135	124.5 Å²	124.5	69%	0.692	77%	0.774	S	S	*	*			trans	-106.6	142.9	-164.8	-61.5	162.2	0	0	0	107.1	V101	V101-I103 HydrophobicContact CG1-CD1 4.03Å; V101-I103 HydrophobicContact CG1-CG1 3.88Å
104	S	29.5	Very low	31	Very low	115 Å²	115	126.7 Å²	126.7	80%	0.804	78%	0.78	S	S	*	*				-174.2	159.7	102.4	-68.5	0	0	0	0	114.1
105	N	30.4	Very low	31	Very low	162 Å²	162	127 Å²	127	87%	0.866	78%	0.777	S	S	*	*			trans	-75.2	178.1	-165.9	-68.7	-17.9	0	0	0	115.8
106	A	29.2	Very low	31	Very low	105 Å²	105	128 Å²	128	87%	0.868	78%	0.778	S	S	*	*			trans	-75.4	-175.6	170.6	0	0	0	0	0	113.9
107	L	27.3	Very low	31	Very low	168 Å²	168	128.2 Å²	128.2	88%	0.88	77%	0.774	S	S	*	*			trans	-85.9	140.3	-155.8	-171.9	77.7	0	0	0	115.8
108	E	28.4	Very low	31.1	Very low	179 Å²	179	128 Å²	128	84%	0.836	77%	0.772	S	S	*	*			trans	-153.7	162.3	144.4	-129.5	175.3	-159.3	0	0	113.8
109	N	28.9	Very low	30.7	Very low	138 Å²	138	127.8 Å²	127.8	74%	0.738	77%	0.773	S	S	*	*			trans	-56.5	146.4	-158.7	-55.6	-59.8	0	0	0	120.1
110	S	29.9	Very low	30.8	Very low	108 Å²	108	129.9 Å²	129.9	76%	0.755	78%	0.775	S	S	*	*				159.7	110.6	115.4	-68.3	0	0	0	0	116.9
111	T	32	Very low	31	Very low	130 Å²	130	128.5 Å²	128.5	80%	0.798	77%	0.767	S	S	*	*			trans	19.8	161.9	135.4	51.4	0	0	0	0	124.6
112	P	39.8	Very low	31.1	Very low	112 Å²	112	130 Å²	130	73%	0.727	77%	0.771	S	S	*	*			cis	-150.6	155.1	-27.3	41.1	-20.7	0	0	0	119.7
113	S	29.3	Very low	31.3	Very low	105 Å²	105	128.2 Å²	128.2	73%	0.734	76%	0.758	S	S	*	*				72.7	138.1	128.8	-153	0	0	0	0	127.5
114	L	30.7	Very low	31.3	Very low	143 Å²	143	127 Å²	127	75%	0.749	76%	0.761	S	S	*	*			trans	109.2	117.6	145.6	-76.6	153.7	0	0	0	125.8
115	N	32.5	Very low	31.3	Very low	128 Å²	128	127.2 Å²	127.2	68%	0.684	76%	0.763	S	S	*	*			trans	59.4	122.6	134.9	-75.2	5.5	0	0	0	127.9
116	N	32.9	Very low	31.6	Very low	142 Å²	142	125 Å²	125	76%	0.759	76%	0.758	S	S	*	*				-175.6	127.6	99	-101.7	-15	0	0	0	111.7
117	V	33.2	Very low	31.5	Very low	116 Å²	116	130 Å²	130	70%	0.703	76%	0.76	S	S	*	*				77.7	116.2	79.7	167.8	0	0	0	0	112.8
118	S	31.9	Very low	31.4	Very low	105 Å²	105	127.2 Å²	127.2	73%	0.734	76%	0.755	S	S	*	*				-150.9	163.2	59.5	-58.7	0	0	0	0	115.9
119	S	33.5	Very low	31.4	Very low	105 Å²	105	126.5 Å²	126.5	73%	0.734	76%	0.756	S	S	*	*			trans	85	139.3	179.1	79.5	0	0	0	0	116.1
120	I	32.8	Very low	31.4	Very low	152 Å²	152	124.1 Å²	124.1	78%	0.779	75%	0.75	S	S	*	*			cis	83.8	120.8	12.9	-53.7	169.2	0	0	0	113.8
121	T	32.4	Very low	31.1	Very low	112 Å²	112	125 Å²	125	69%	0.687	76%	0.756	S	S	*	*			cis	-167.3	169.8	-10.1	28.5	0	0	0	0	106.4
122	N	31	Very low	31	Very low	143 Å²	143	123.6 Å²	123.6	77%	0.765	76%	0.758	S	S	*	*			cis	-161.6	170.4	0.8	-116.2	-14.9	0	0	0	107.5
123	S	31.4	Very low	30.3	Very low	89 Å²	89	122.6 Å²	122.6	62%	0.622	76%	0.759	S	S	*	*			cis	-158.5	148.2	-9	43.4	0	0	0	0	110.9
124	S	29.6	Very low	30.1	Very low	109 Å²	109	123.7 Å²	123.7	76%	0.762	76%	0.761	S	S	*	*			trans	77.4	140.6	160.6	78	0	0	0	0	120.3
125	S	29.4	Very low	30	Very low	120 Å²	120	121.2 Å²	121.2	84%	0.839	76%	0.756	S	S	*	*			trans	65.5	142.2	-175.9	77.2	0	0	0	0	114.4
126	P	37	Very low	29.7	Very low	117 Å²	117	121.1 Å²	121.1	76%	0.76	76%	0.76	S	S	*	*			cis	-128.3	171.4	35.5	42.2	-29	0	0	0	116.6
127	F	27.8	Very low	29.4	Very low	208 Å²	208	118.8 Å²	118.8	91%	0.912	76%	0.761	S	S	*	*			trans	-149.5	164.9	149.7	-124.1	-84	0	0	0	110
128	S	25.1	Very low	29.3	Very low	110 Å²	110	119 Å²	119	77%	0.769	77%	0.767	S	S	*	*			trans	-65.9	134.4	-163.7	-49.4	0	0	0	0	116.1
129	L	28.9	Very low	29.3	Very low	164 Å²	164	118.3 Å²	118.3	86%	0.859	77%	0.768	S	S	*	*			trans	-87.9	113.7	160.7	-67.9	166.9	0	0	0	107.7
130	S	28.6	Very low	29.2	Very low	88 Å²	88	120.9 Å²	120.9	62%	0.615	77%	0.772	S	S	*	*				79.1	103.8	64.3	78.2	0	0	0	0	113.2
131	S	23.9	Very low	29.2	Very low	126 Å²	126	119.5 Å²	119.5	88%	0.881	77%	0.765	S	S	*	*			trans	-57.6	152.4	154.7	42.7	0	0	0	0	110.5
132	A	28.4	Very low	29.7	Very low	102 Å²	102	120 Å²	120	84%	0.843	77%	0.77	S	S	*	*			trans	-138.9	139.1	178.6	0	0	0	0	0	112.4
133	A	26.4	Very low	29.7	Very low	90 Å²	90	120.6 Å²	120.6	74%	0.744	77%	0.766	S	S	*	*			trans	-156.9	167.8	173.7	0	0	0	0	0	106.7
134	T	25.6	Very low	29.7	Very low	128 Å²	128	121.6 Å²	121.6	79%	0.785	77%	0.768	S	S	*	*			cis	-148.4	176.7	13.3	-36.9	0	0	0	0	109.3
135	S	26.7	Very low	29.7	Very low	91 Å²	91	121.1 Å²	121.1	64%	0.636	77%	0.765	S	S	*	*			trans	84.7	115.2	140.5	-106.5	0	0	0	0	121
136	T	26.3	Very low	29.7	Very low	126 Å²	126	122.4 Å²	122.4	77%	0.773	76%	0.763	S	S	*	*				40.8	121.8	117.7	63.3	0	0	0	0	120.2
137	A	27.7	Very low	29.4	Very low	94 Å²	94	123.4 Å²	123.4	78%	0.777	77%	0.766	S	S	*	*				156.3	118.4	94.3	0	0	0	0	0	114.7
138	S	30.9	Very low	29.6	Very low	120 Å²	120	117.2 Å²	117.2	84%	0.839	75%	0.753	S	S	*	*			trans	-175.1	125.8	146.1	-78	0	0	0	0	106.7
139	A	32.3	Very low	29.9	Very low	90 Å²	90	117.6 Å²	117.6	74%	0.744	75%	0.752	S	S	*	*			cis	77.2	129.7	46.7	0	0	0	0	0	112.9
140	I	31.1	Very low	29.9	Very low	160 Å²	160	117.1 Å²	117.1	82%	0.821	75%	0.75	S	S	*	*			cis	-151.4	162.8	-1.6	-120.2	164	0	0	0	111.9
141	I	32	Very low	29.8	Very low	123 Å²	123	121.2 Å²	121.2	63%	0.631	76%	0.759	S	S	*	*			trans	-45.7	150.9	179.7	-4.8	177.8	0	0	0	115.6	F143	I141-F143 HydrophobicContact CB-CD2 4.45Å; I141-F143 HydrophobicContact CD1-CE2 4.45Å; I141-F143 HydrophobicContact CG2-CD2 4.26Å
142	P	43.2	Very low	30.7	Very low	122 Å²	122	119.5 Å²	119.5	79%	0.792	74%	0.744	S	S	*	*				-137.5	172.6	82	18.9	3.7	0	0	0	114.4
143	F	31.6	Very low	30.8	Very low	156 Å²	156	122.3 Å²	122.3	68%	0.684	74%	0.74	S	S	*	*			cis	-165.2	146.7	-34.9	-141	-108.4	0	0	0	107.8	I141	I141-F143 HydrophobicContact CB-CD2 4.45Å; I141-F143 HydrophobicContact CD1-CE2 4.45Å; I141-F143 HydrophobicContact CG2-CD2 4.26Å
144	T	30.9	Very low	30.9	Very low	109 Å²	109	125.4 Å²	125.4	67%	0.669	74%	0.743	S	S	*	*			trans	49.7	108.8	159.7	46.3	0	0	0	0	123
145	S	29.1	Very low	31.1	Very low	99 Å²	99	126 Å²	126	69%	0.692	74%	0.741	S	S	*	*				95	139.2	110.2	78.3	0	0	0	0	124.1
146	N	29.3	Very low	31.3	Very low	148 Å²	148	129 Å²	129	79%	0.791	75%	0.745	S	S	*	*			trans	85.8	117.3	142.7	-75.1	3.5	0	0	0	123.6
147	V	31	Very low	31.4	Very low	137 Å²	137	130.5 Å²	130.5	83%	0.83	74%	0.743	S	S	*	*			trans	96.9	130.9	145	176	0	0	0	0	119.8
148	A	32.6	Very low	31.5	Very low	78 Å²	78	131.6 Å²	131.6	65%	0.645	74%	0.74	S	S	*	*			trans	58.5	97.1	166.9	0	0	0	0	0	118.4
149	T	31.1	Very low	31.3	Very low	119 Å²	119	130.8 Å²	130.8	73%	0.73	73%	0.734	S	S	*	*				65.3	118.3	64	73.3	0	0	0	0	114.6
150	N	29.9	Very low	31.1	Very low	153 Å²	153	137.3 Å²	137.3	82%	0.818	74%	0.74	S	S	*	*				-168	165.8	79.3	-99.6	-32.1	0	0	0	116.8
151	H	26.8	Very low	31.1	Very low	175 Å²	175	137.2 Å²	137.2	81%	0.81	74%	0.739	S	S	*	*			trans	-153.1	169.5	173.3	-114.4	-75.6	0	0	0	105.5
152	P	42.4	Very low	31.4	Very low	89 Å²	89	135.8 Å²	135.8	58%	0.578	74%	0.738	S	S	*	*				-131.3	-170.5	-52.4	24.5	-0.4	0	0	0	113.9
153	H	30.7	Very low	30.7	Very low	162 Å²	162	138.9 Å²	138.9	75%	0.75	74%	0.742	S	S	*	*			trans	91.5	116.1	152.9	-66.3	-60.9	0	0	0	124.3
154	L	28.4	Very low	30.5	Very low	155 Å²	155	134.9 Å²	134.9	81%	0.812	74%	0.737	S	S	*	*			trans	74.6	155.8	134.6	-92.4	78.7	0	0	0	124.2
155	N	29	Very low	30.4	Very low	139 Å²	139	136.8 Å²	136.8	74%	0.743	74%	0.742	S	S	*	*			trans	-63.7	156	177.9	-65.2	-22.2	0	0	0	112.2
156	H	31.1	Very low	30.4	Very low	155 Å²	155	138.2 Å²	138.2	72%	0.718	75%	0.746	S	S	*	*				-158	157.8	52.7	-110.4	-82.8	0	0	0	115.1
157	H	29.4	Very low	30.6	Very low	157 Å²	157	137.5 Å²	137.5	73%	0.727	75%	0.748	S	S	*	*			trans	67	129.6	152.2	-86.5	-70.8	0	0	0	122.6
158	V	28.1	Very low	30.6	Very low	118 Å²	118	134.7 Å²	134.7	72%	0.715	75%	0.746	S	S	*	*			trans	80.2	105.2	141.2	177.5	0	0	0	0	120.1
159	S	27.1	Very low	30.3	Very low	103 Å²	103	134 Å²	134	72%	0.72	75%	0.747	S	S	*	*			trans	68.9	134.2	138.1	-67.6	0	0	0	0	123.5
160	R	28.3	Very low	30.4	Very low	227 Å²	227	134.8 Å²	134.8	86%	0.857	75%	0.751	S	S	*	*			trans	71	131.6	161.7	-64.5	176.7	177.8	-177.5	-1.2	114.8
161	I	31.3	Very low	30.6	Very low	157 Å²	157	135.1 Å²	135.1	81%	0.805	75%	0.753	S	S	*	*				67.7	129.1	51.3	-60.4	168	0	0	0	109.9
162	P	38.7	Very low	30.7	Very low	94 Å²	94	129.6 Å²	129.6	61%	0.61	74%	0.744	S	S	*	*			cis	-138.3	166	21.6	28.4	-4.8	0	0	0	119
163	Q	28.1	Very low	30.5	Very low	186 Å²	186	131 Å²	131	87%	0.869	76%	0.756	S	S	*	*			trans	64.7	168.6	141.7	-68.5	165.2	11.7	0	0	118.6
164	A	28.4	Very low	30.5	Very low	72 Å²	72	130.6 Å²	130.6	60%	0.595	76%	0.758	S	S	*	*			cis	-155.1	141.7	7.8	0	0	0	0	0	115
165	I	27	Very low	31.2	Very low	149 Å²	149	128.5 Å²	128.5	76%	0.764	75%	0.754	S	S	*	*			trans	67.7	149.6	133.4	-56.2	163.3	0	0	0	120.6
166	V	30.2	Very low	31.8	Very low	130 Å²	130	127 Å²	127	79%	0.788	75%	0.752	S	S	*	*			trans	57.5	143.5	174	-75.3	0	0	0	0	118.8
167	T	34	Very low	31.7	Very low	133 Å²	133	127.4 Å²	127.4	82%	0.816	76%	0.759	S	S	*	*			cis	-136.1	158.3	-1.5	-2.3	0	0	0	0	108.3
168	G	29.5	Very low	31.8	Very low	78 Å²	78	127.8 Å²	127.8	80%	0.804	77%	0.765	S	S	*	*				67.9	131.6	85.5	0	0	0	0	0	112.8
169	G	27	Very low	32	Very low	64 Å²	64	129.4 Å²	129.4	66%	0.66	77%	0.768	S	S	*	*			cis	145.5	156.4	6.7	0	0	0	0	0	110.2
170	T	33.3	Very low	32.3	Very low	134 Å²	134	129.8 Å²	129.8	82%	0.822	77%	0.771	S	S	*	*			trans	69.4	148.3	-174.6	78	0	0	0	0	114.9
171	N	33.8	Very low	33.2	Very low	160 Å²	160	124.7 Å²	124.7	86%	0.856	77%	0.767	S	S	*	*			cis	-159.7	170.2	-13.8	-106.9	0.9	0	0	0	108.5
172	G	28.5	Very low	33.4	Very low	60 Å²	60	123.6 Å²	123.6	62%	0.619	77%	0.768	S	S	*	*			cis	166.6	29.8	-0.9	0	0	0	0	0	116.7
173	S	38.1	Very low	33.1	Very low	118 Å²	118	124.5 Å²	124.5	83%	0.825	78%	0.776	S	S	*	*			trans	-142.6	131.8	179.1	-178	0	0	0	0	110.2
174	L	31.2	Very low	33.3	Very low	153 Å²	153	120 Å²	120	80%	0.801	77%	0.771	S	S	*	*			cis	125.8	139.7	5	-78.8	172.8	0	0	0	109.9
175	P	43	Very low	33.5	Very low	111 Å²	111	121.5 Å²	121.5	72%	0.721	78%	0.783	S	S	*	*			trans	-122.8	-171.3	-155.5	47.3	-32.2	0	0	0	112.8
176	P	42.3	Very low	33.7	Very low	109 Å²	109	119 Å²	119	71%	0.708	79%	0.785	S	S	*	*				-151.3	152	72.3	38.2	-16.8	0	0	0	119.3
177	L	28.6	Very low	33.8	Very low	163 Å²	163	117.2 Å²	117.2	85%	0.853	78%	0.784	S	S	*	*			trans	56	123.4	140	-66	170.7	0	0	0	124.2
178	L	30.4	Very low	33.7	Very low	164 Å²	164	117.6 Å²	117.6	86%	0.859	79%	0.786	S	S	*	*				-154.3	170.1	129	-114.6	175.4	0	0	0	110.3
179	I	34.1	Very low	34.4	Very low	153 Å²	153	119.2 Å²	119.2	79%	0.785	78%	0.783	S	S	*	*	S	Bend	trans	79.2	137.2	177.5	-42.1	174.3	0	0	0	116.3
180	S	32.6	Very low	34.6	Very low	110 Å²	110	123.8 Å²	123.8	77%	0.769	79%	0.791	S	S	*	*			trans	87.2	117.4	169	-50.9	0	0	0	0	118.9
181	P	47.3	Very low	34.6	Very low	121 Å²	121	124.8 Å²	124.8	79%	0.786	79%	0.79	S	S	*	*			trans	-100.3	155.1	168.1	40.3	-33.8	0	0	0	111.6
182	T	34.5	Very low	34.6	Very low	134 Å²	134	122.5 Å²	122.5	82%	0.822	79%	0.786	S	S	*	*			cis	-155.3	152.3	1.6	-15.8	0	0	0	0	110
183	S	33.6	Very low	34.9	Very low	112 Å²	112	123.2 Å²	123.2	78%	0.783	79%	0.794	S	S	*	*			trans	49.3	111.7	160.5	-160.4	0	0	0	0	118.9
184	A	31.9	Very low	34.7	Very low	91 Å²	91	127.5 Å²	127.5	75%	0.752	80%	0.798	S	S	*	*			cis	93.4	141.7	35.6	0	0	0	0	0	116.1
185	A	32.8	Very low	35	Very low	104 Å²	104	125.5 Å²	125.5	86%	0.86	80%	0.803	S	S	*	*			trans	71.2	151.4	178.9	0	0	0	0	0	118.4
186	A	31.5	Very low	34.4	Very low	97 Å²	97	123.7 Å²	123.7	80%	0.802	81%	0.805	S	S	*	*			cis	-170.3	172.9	-24.7	0	0	0	0	0	111.9
187	A	32.4	Very low	34.9	Very low	93 Å²	93	124.4 Å²	124.4	77%	0.769	81%	0.809	S	S	*	*			trans	79	80.6	155.5	0	0	0	0	0	122.8
188	T	31.1	Very low	35.2	Very low	140 Å²	140	124.5 Å²	124.5	86%	0.859	81%	0.808	S	S	*	*				24.8	138.9	120.8	-36.9	0	0	0	0	123.5
189	P	45	Very low	35.6	Very low	112 Å²	112	121.5 Å²	121.5	73%	0.727	80%	0.8	S	S	*	*			trans	-113.3	178.5	175.8	43.6	-36.1	0	0	0	116.3
190	L	30.2	Very low	36.3	Very low	161 Å²	161	120.2 Å²	120.2	84%	0.843	80%	0.802	S	S	*	*			trans	-170	168.5	159.2	-128.9	60.4	0	0	0	109
191	I	33.5	Very low	36.5	Very low	155 Å²	155	119.4 Å²	119.4	80%	0.795	80%	0.796	S	S	*	*			cis	-146	-150.9	2.9	-163.2	156.5	0	0	0	111.1
192	S	35	Very low	36	Very low	111 Å²	111	120.1 Å²	120.1	78%	0.776	80%	0.798	S	S	*	*			trans	-124.3	166.6	-163.7	65.2	0	0	0	0	116.8
193	G	33	Very low	35.9	Very low	76 Å²	76	117.2 Å²	117.2	78%	0.784	80%	0.795	S	S	*	*			trans	-176.9	71.8	165.8	0	0	0	0	0	122
194	K	34.9	Very low	35.9	Very low	208 Å²	208	117.8 Å²	117.8	90%	0.904	80%	0.799	S	S	*	*			trans	18.7	118.2	156.9	-71.6	-178.8	173.8	178.7	0	124.9
195	A	37.7	Very low	36.4	Very low	110 Å²	110	119.1 Å²	119.1	91%	0.909	80%	0.8	S	S	*	*				52.5	136.3	116.4	0	0	0	0	0	126.1
196	G	30.1	Very low	36.4	Very low	74 Å²	74	122 Å²	122	76%	0.763	80%	0.799	S	S	*	*			trans	179	136.7	162.1	0	0	0	0	0	114.2
197	P	53	Low	36.3	Very low	123 Å²	123	124.7 Å²	124.7	80%	0.799	80%	0.8	S	S	*	*			trans	-140.5	172.9	-166.3	41.2	-22.4	0	0	0	120.6
198	M	35.6	Very low	36.2	Very low	166 Å²	166	126.4 Å²	126.4	82%	0.818	80%	0.801	S	S	*	*			trans	107.4	116.1	148.4	-60.6	-164.6	76.3	0	0	123.7
199	S	38	Very low	36.1	Very low	101 Å²	101	123.6 Å²	123.6	71%	0.706	79%	0.792	S	S	*	*			trans	78.8	168	140.8	-50.8	0	0	0	0	119.4
200	P	48.9	Very low	35.3	Very low	125 Å²	125	122.7 Å²	122.7	81%	0.812	79%	0.794	S	S	*	*				-128.7	-159	-89.4	40.5	-19.9	0	0	0	112.4
201	S	36.8	Very low	35.3	Very low	93 Å²	93	120.9 Å²	120.9	65%	0.65	79%	0.79	S	S	*	*			cis	-159.8	177.6	10.6	64	0	0	0	0	113.9
202	T	36.5	Very low	35.1	Very low	136 Å²	136	119.3 Å²	119.3	83%	0.834	79%	0.787	S	S	*	*			trans	53.5	113.9	151.6	48.6	0	0	0	0	121.9
203	G	32	Very low	34.9	Very low	73 Å²	73	120.9 Å²	120.9	75%	0.753	79%	0.786	S	S	*	*			trans	140.4	69.4	152.9	0	0	0	0	0	116.8
204	S	33.4	Very low	34.9	Very low	124 Å²	124	125 Å²	125	87%	0.867	79%	0.785	S	S	*	*			trans	-103.1	133.4	-165.4	-48.8	0	0	0	0	116.6
205	P	43.5	Very low	34.9	Very low	120 Å²	120	123.4 Å²	123.4	78%	0.779	79%	0.786	S	S	*	*			trans	-100.4	178.5	154.7	38.2	-31.4	0	0	0	112
206	I	31.4	Very low	34.7	Very low	164 Å²	164	122.7 Å²	122.7	84%	0.841	78%	0.781	S	S	*	*			trans	-129.9	141.3	178.2	-70.1	-179.1	0	0	0	112.6
207	N	30.1	Very low	35.1	Very low	153 Å²	153	125.6 Å²	125.6	82%	0.818	78%	0.783	S	S	*	*			trans	-167.9	163.8	172.6	-111.1	-57.6	0	0	0	109.4
208	V	30	Very low	34.2	Very low	130 Å²	130	124.7 Å²	124.7	79%	0.788	78%	0.78	S	S	*	*			cis	-139.2	-81.3	-3.2	57.3	0	0	0	0	113.1
209	A	29.2	Very low	34	Very low	80 Å²	80	122.3 Å²	122.3	66%	0.661	78%	0.779	S	S	*	*			trans	-162	174.6	-169.8	0	0	0	0	0	112.9
210	A	29.1	Very low	33.9	Very low	94 Å²	94	122.4 Å²	122.4	78%	0.777	78%	0.778	S	S	*	*			trans	74	157.7	159.4	0	0	0	0	0	120.3
211	T	30.1	Very low	32.9	Very low	123 Å²	123	124.1 Å²	124.1	76%	0.755	78%	0.775	S	S	*	*			cis	-172.7	144.6	-23.8	-94	0	0	0	0	112.3
212	V	29	Very low	32.4	Very low	121 Å²	121	127.6 Å²	127.6	73%	0.733	78%	0.78	S	S	*	*			trans	67.9	125.5	159.6	157.6	0	0	0	0	122.2
213	L	30	Very low	32	Very low	145 Å²	145	125.4 Å²	125.4	76%	0.759	77%	0.771	S	S	*	*			trans	29.9	155.8	141.9	-50.3	178.4	0	0	0	123.2
214	Q	33.9	Very low	31.9	Very low	161 Å²	161	129.3 Å²	129.3	75%	0.752	77%	0.773	S	S	*	*			cis	179.5	127	-21.8	175.3	175.8	18	0	0	110
215	N	35.7	Very low	31.6	Very low	175 Å²	175	132.5 Å²	132.5	94%	0.936	77%	0.771	S	S	*	*			trans	-178.3	167.5	155.6	-104.9	-34.7	0	0	0	112.3
216	A	32.8	Very low	30.8	Very low	96 Å²	96	133.7 Å²	133.7	79%	0.793	77%	0.771	S	S	*	*			trans	-145.4	157.9	-165.1	0	0	0	0	0	117.1
217	V	39	Very low	30.5	Very low	134 Å²	134	135 Å²	135	81%	0.812	77%	0.765	S	S	*	*			trans	-146.3	136.7	167	174.8	0	0	0	0	109.1
218	S	34.4	Very low	30.2	Very low	105 Å²	105	130.5 Å²	130.5	73%	0.734	75%	0.746	S	S	*	*			trans	40.4	105	166.6	-56.8	0	0	0	0	118
219	S	29.6	Very low	30.3	Very low	115 Å²	115	134.2 Å²	134.2	80%	0.804	75%	0.746	S	S	*	*			cis	58.7	149.1	34.3	-60	0	0	0	0	115.3
220	P	36.5	Very low	30.2	Very low	104 Å²	104	139.1 Å²	139.1	68%	0.675	76%	0.76	S	S	*	*			cis	-117.9	-178.2	7.1	44.3	-32.4	0	0	0	113
221	Q	27.9	Very low	30.2	Very low	160 Å²	160	141.4 Å²	141.4	75%	0.748	76%	0.759	S	S	*	*	S	Bend	cis	-140.5	153.5	10.1	-67.8	-73.5	-3.8	0	0	107.5
222	H	25.6	Very low	30.3	Very low	166 Å²	166	143.7 Å²	143.7	77%	0.769	76%	0.759	S	S	*	*			cis	-164.1	176.7	-17.7	-162.4	-95.6	0	0	0	107.9
223	S	28.3	Very low	30.5	Very low	90 Å²	90	144.9 Å²	144.9	63%	0.629	76%	0.759	S	S	*	*			trans	84	96	164.6	-157	0	0	0	0	119.2
224	I	31.5	Very low	31.1	Very low	155 Å²	155	142.9 Å²	142.9	80%	0.795	76%	0.755	S	S	*	*	S	Bend		-113.9	145.3	120.1	-93.7	176.2	0	0	0	106
225	F	26.5	Very low	31.2	Very low	192 Å²	192	140.6 Å²	140.6	84%	0.842	75%	0.754	S	S	*	*			trans	57.6	107.5	-170.2	-79	-79.9	0	0	0	116.1
226	D	27.1	Very low	31	Very low	145 Å²	145	138.9 Å²	138.9	78%	0.775	75%	0.745	S	S	*	*				-155.3	173.9	106.8	-155.1	-2.5	0	0	0	110.7
227	R	24.4	Very low	30.9	Very low	190 Å²	190	140.2 Å²	140.2	72%	0.717	74%	0.744	S	S	*	*			trans	-76.4	167.5	-174.4	-68.4	166.9	158.1	164.2	-9	114.6
228	S	24.6	Very low	30.6	Very low	59 Å²	59	138.1 Å²	138.1	41%	0.413	74%	0.735	S	S	.	*			trans	65.5	87.3	153.9	72	0	0	0	0	117.4
229	R	31.3	Very low	30.3	Very low	208 Å²	208	140.8 Å²	140.8	79%	0.785	74%	0.74	S	S	*	*				179.7	134.4	106.4	-93.8	157	-171.6	-117.1	-1.6	112.5	N231	R229-N231 HydrophobicContact CB-CB 4.41Å; R229-N231 PolarHBondContact O-N 2.75Å; R229-N231 VanDerWaalsContact O-N 3.08Å
230	L	26.2	Very low	30.2	Very low	184 Å²	184	140 Å²	140	96%	0.963	74%	0.74	S	S	*	*			trans	-64	101.9	149.5	-89.7	65.5	0	0	0	107.1
231	N	29.2	Very low	29.9	Very low	141 Å²	141	140.2 Å²	140.2	75%	0.754	74%	0.744	S	S	*	*			trans	-109.4	146.4	-179.2	-127.9	43.6	0	0	0	111.2	R229	R229-N231 HydrophobicContact CB-CB 4.41Å; R229-N231 PolarHBondContact O-N 2.75Å; R229-N231 VanDerWaalsContact O-N 3.08Å
232	K	32.4	Very low	30	Very low	171 Å²	171	137.4 Å²	137.4	74%	0.743	74%	0.742	S	S	*	*			trans	-112.1	121.6	-153	-125.8	-173.6	178.9	177.7	0	112.2
233	I	34.5	Very low	30.1	Very low	146 Å²	146	135.4 Å²	135.4	75%	0.749	75%	0.747	S	S	*	*			trans	68.4	-179.3	152.7	-4.4	-178.1	0	0	0	117
234	P	43.1	Very low	30.1	Very low	103 Å²	103	136 Å²	136	67%	0.669	75%	0.752	S	S	*	*				-125.5	-147.5	-117	46.2	-24.9	0	0	0	112.9
235	P	34.8	Very low	30.6	Very low	113 Å²	113	134.2 Å²	134.2	73%	0.734	75%	0.75	S	S	*	*			cis	-133.9	145.5	48.1	32.8	-11	0	0	0	118.5
236	N	31.6	Very low	30.8	Very low	140 Å²	140	129.8 Å²	129.8	75%	0.749	74%	0.743	S	S	*	*			trans	58.6	120.9	150.5	-68.4	8.3	0	0	0	122
237	T	31.8	Very low	30.9	Very low	124 Å²	124	130 Å²	130	76%	0.761	74%	0.744	S	S	*	*			trans	22.6	141.7	131.6	55.1	0	0	0	0	121.4
238	S	31.1	Very low	31.1	Very low	90 Å²	90	125.6 Å²	125.6	63%	0.629	75%	0.748	S	S	*	*			cis	177.9	164.6	-4	50.4	0	0	0	0	112.3
239	L	28.3	Very low	31.5	Very low	160 Å²	160	126.9 Å²	126.9	84%	0.838	76%	0.763	S	S	*	*			trans	72	136.4	150.8	-76.6	160	0	0	0	121.1
240	A	28.6	Very low	31.5	Very low	98 Å²	98	123.9 Å²	123.9	81%	0.81	76%	0.762	S	S	*	*			trans	61.5	148.9	145.8	0	0	0	0	0	119.5
241	S	28.7	Very low	31.8	Very low	109 Å²	109	121.8 Å²	121.8	76%	0.762	75%	0.752	S	S	*	*			cis	-150.9	-175.1	-14.8	60	0	0	0	0	108.3
242	S	30.4	Very low	32	Very low	101 Å²	101	121.5 Å²	121.5	71%	0.706	75%	0.75	S	S	*	*				173.1	152.8	85.5	46.7	0	0	0	0	113
243	S	27	Very low	32	Very low	124 Å²	124	122.1 Å²	122.1	87%	0.867	75%	0.753	S	S	*	*			trans	-152.7	116.7	144.4	59.6	0	0	0	0	108.7
244	S	30.2	Very low	32.3	Very low	104 Å²	104	120.3 Å²	120.3	73%	0.727	75%	0.751	S	S	*	*			trans	-97.4	-169.5	-179.1	-17.9	0	0	0	0	110.6
245	P	41	Very low	31.8	Very low	116 Å²	116	123.1 Å²	123.1	75%	0.753	76%	0.759	S	S	*	*			cis	-133	173.4	-29.6	37.7	-22.6	0	0	0	113.3
246	S	31.1	Very low	31.7	Very low	100 Å²	100	126.5 Å²	126.5	70%	0.699	77%	0.765	S	S	*	*				162.1	122.8	125.2	64.6	0	0	0	0	113.6
247	D	29.8	Very low	31.7	Very low	149 Å²	149	128.1 Å²	128.1	80%	0.797	77%	0.768	S	S	*	*			trans	26.1	121.7	137.4	-49	-53.1	0	0	0	119.7
248	A	27.9	Very low	31.7	Very low	98 Å²	98	134 Å²	134	81%	0.81	78%	0.776	S	S	*	*				73.4	144	70.1	0	0	0	0	0	113.6
249	A	31.9	Very low	31.7	Very low	86 Å²	86	137.3 Å²	137.3	71%	0.711	78%	0.781	S	S	*	*			cis	-154.9	-170.1	20.9	0	0	0	0	0	114.3
250	N	32.8	Very low	31.7	Very low	145 Å²	145	134.8 Å²	134.8	78%	0.775	78%	0.777	S	S	*	*			trans	84.5	117.4	164	-65.1	-14.1	0	0	0	120.3
251	N	31.6	Very low	31.9	Very low	139 Å²	139	137.3 Å²	137.3	74%	0.743	78%	0.775	S	S	*	*				42.5	139.6	128	-58.9	5.2	0	0	0	120.6
252	D	34.5	Very low	31.8	Very low	135 Å²	135	140.1 Å²	140.1	72%	0.722	78%	0.781	S	S	*	*			cis	-146.6	-178.9	23.4	-129.5	-49.4	0	0	0	114.8
253	K	32	Very low	31.7	Very low	184 Å²	184	139.8 Å²	139.8	80%	0.8	78%	0.779	S	S	*	*			trans	-86.6	-177.6	-175.7	-45.4	166.4	-174.4	165.3	0	112
254	P	39.6	Very low	31.8	Very low	109 Å²	109	141.2 Å²	141.2	71%	0.708	78%	0.776	S	S	*	*			cis	-130.2	173.8	-16.6	34.8	-16.9	0	0	0	114.3
255	I	33	Very low	31.8	Very low	162 Å²	162	143.4 Å²	143.4	83%	0.831	79%	0.785	S	S	*	*				177.6	151.4	122	-91.3	162.6	0	0	0	111.7
256	Q	32.9	Very low	31.2	Very low	184 Å²	184	149.5 Å²	149.5	86%	0.86	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-46.6	145.5	-163.2	-69	156	-23.9	0	0	119
257	Q	31.5	Very low	31.1	Very low	174 Å²	174	150.7 Å²	150.7	81%	0.813	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-71.7	149.5	174.6	-66.9	162.9	-91.5	0	0	113.3	H259	Q257-H259 PolarHBondContact O-N 3.22Å
258	R	31.5	Very low	31.1	Very low	246 Å²	246	151.6 Å²	151.6	93%	0.928	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-70.5	118.2	151	-74.2	174.8	168.3	148.4	-5	109.3
259	H	30.5	Very low	31.1	Very low	160 Å²	160	153.7 Å²	153.7	74%	0.741	80%	0.803	S	S	*	*			trans	-141.9	115.7	154.5	-117.5	-95.5	0	0	0	108.7	Q257	Q257-H259 PolarHBondContact O-N 3.22Å
260	S	28.8	Very low	31	Very low	107 Å²	107	158.8 Å²	158.8	75%	0.748	81%	0.812	S	S	*	*			trans	-147.3	158.6	174.4	-174.1	0	0	0	0	108.1
261	I	32.3	Very low	31	Very low	152 Å²	152	156.6 Å²	156.6	78%	0.779	81%	0.814	S	S	*	*	S	Bend	trans	64.3	45.1	-175.8	-34	-179.2	0	0	0	113.7
262	L	28.4	Very low	31.2	Very low	168 Å²	168	159 Å²	159	88%	0.88	82%	0.823	S	S	*	*			trans	-131.4	64.6	144	-86.7	-175.1	0	0	0	109.4
263	S	27	Very low	31.4	Very low	94 Å²	94	158.9 Å²	158.9	66%	0.657	83%	0.827	S	S	*	*			trans	-143.8	75.2	-178.1	57.3	0	0	0	0	110.2
264	N	30.5	Very low	31.8	Very low	153 Å²	153	157 Å²	157	82%	0.818	83%	0.826	S	S	*	*			trans	-158.5	26.1	165.9	-104.6	-8.1	0	0	0	113.6
265	V	29.3	Very low	31.7	Very low	151 Å²	151	159.7 Å²	159.7	92%	0.915	83%	0.834	S	S	*	*	S	Bend	trans	-125.3	54.1	171.5	-167.2	0	0	0	0	109.4
266	R	28.4	Very low	31.8	Very low	244 Å²	244	155.2 Å²	155.2	92%	0.921	83%	0.828	S	S	*	*			trans	-157.3	48.1	171.4	-145.5	175.1	-165.9	122.2	4.6	113.6
267	T	29.3	Very low	32.3	Very low	125 Å²	125	152.1 Å²	152.1	77%	0.767	82%	0.824	S	S	*	*			trans	-141.7	50.3	-178.5	-39.6	0	0	0	0	112
268	L	28.4	Very low	32.8	Very low	168 Å²	168	155 Å²	155	88%	0.88	83%	0.828	S	S	*	*	S	Bend	trans	-149.8	45.1	168.9	-150.9	102.6	0	0	0	112.6
269	T	28.2	Very low	33.2	Very low	141 Å²	141	148.8 Å²	148.8	87%	0.865	82%	0.817	S	S	*	*	S	Bend	trans	-150.5	141.8	176.5	-37.8	0	0	0	0	109.9
270	Q	31	Very low	33.4	Very low	193 Å²	193	148.1 Å²	148.1	90%	0.902	82%	0.818	S	S	*	*	S	Bend	trans	74.7	60.1	172.4	-156.4	163.3	38.7	0	0	117.2
271	A	32.3	Very low	34.4	Very low	100 Å²	100	147.9 Å²	147.9	83%	0.826	81%	0.812	S	S	*	*			trans	-148.6	30	163.5	0	0	0	0	0	114.9
272	M	36.3	Very low	35.2	Very low	189 Å²	189	143.4 Å²	143.4	93%	0.931	80%	0.803	S	S	*	*			trans	-136	136.1	162.3	-67.1	-165.2	85.1	0	0	109.8
273	V	38.4	Very low	36.3	Very low	133 Å²	133	141.6 Å²	141.6	81%	0.806	80%	0.795	S	S	*	*			trans	-128.8	109	179.1	173.4	0	0	0	0	107.9
274	N	39.2	Very low	37.7	Very low	144 Å²	144	141.7 Å²	141.7	77%	0.77	79%	0.788	S	S	*	*			trans	-175.5	151.2	131.7	-97.7	-10	0	0	0	112
275	D	37.7	Very low	38.8	Very low	165 Å²	165	140 Å²	140	88%	0.882	78%	0.776	S	S	*	*			trans	58.8	152.2	170.3	-64.1	-53	0	0	0	119.3
276	G	35.3	Very low	40.1	Very low	68 Å²	68	139.1 Å²	139.1	70%	0.701	77%	0.766	S	S	*	*			trans	-150.2	-126.3	-169.4	0	0	0	0	0	114
277	P	44.1	Very low	41.4	Very low	119 Å²	119	134.2 Å²	134.2	77%	0.773	75%	0.752	S	S	*	*				-131.5	155.1	-95.1	38.2	-28.1	0	0	0	115
278	R	41.5	Very low	42.6	Very low	236 Å²	236	133.8 Å²	133.8	89%	0.891	74%	0.742	S	S	*	*			trans	-174.3	132.9	145.2	-103.5	146.4	-167.8	-116.2	0.1	115
279	T	40.4	Very low	44.1	Very low	114 Å²	114	130.1 Å²	130.1	70%	0.699	73%	0.727	S	S	*	*			trans	13.8	146.7	131.3	58.9	0	0	0	0	119.9
280	L	34.8	Very low	45.8	Very low	147 Å²	147	126.9 Å²	126.9	77%	0.77	71%	0.71	S	S	*	*			cis	-166.7	155.3	0.8	-105.4	162.8	0	0	0	106.6
281	T	50.3	Low	47.6	Very low	102 Å²	102	124.5 Å²	124.5	63%	0.626	70%	0.699	S	S	*	*				178.6	174.1	95.3	32.5	0	0	0	0	110.1
282	G	47.8	Very low	49.5	Very low	57 Å²	57	126.5 Å²	126.5	59%	0.588	69%	0.691	S	S	*	*	S	Bend	trans	-82	-21.6	-166.3	0	0	0	0	0	117.4	D284	G282-D284 VanDerWaalsContact C-N 3.33Å; G282-D284 PolarHBondContact O-N 2.85Å
283	D	52.8	Low	51.2	Low	131 Å²	131	121.4 Å²	121.4	70%	0.701	67%	0.665	S	S	*	*	H	α-helix	trans	-75.8	-14.2	-165.8	-56.6	-70	0	0	0	115
284	D	55.4	Low	53	Low	95 Å²	95	123.6 Å²	123.6	51%	0.508	66%	0.659	S	S	.	*	H	α-helix	trans	-80.8	-20.2	-179	-69.6	-48	0	0	0	113.6	G282 K287 M288	G282-D284 VanDerWaalsContact C-N 3.33Å; G282-D284 PolarHBondContact O-N 2.85Å; D284-K287 PolarHBondContact O-N 2.83Å; D284-M288 PolarHBondContact O-N 3.45Å
285	M	53.1	Low	54.9	Low	118 Å²	118	119.6 Å²	119.6	58%	0.581	65%	0.645	S	S	*	*	H	α-helix	trans	-68.6	-44.5	178	-74.3	-75.1	100.8	0	0	112.2	K287 M288 V289	M285-K287 VanDerWaalsContact C-N 3.25Å; M285-K287 PolarHBondContact O-N 3.44Å; M285-M288 HydrophobicContact CE-SD 3.69Å; M285-M288 PolarHBondContact O-N 2.8Å; M285-V289 WeakPolarHBondContact O-CG2 3.4Å; M285-V289 PolarHBondContact O-N 3.32Å
286	D	56.5	Low	57.1	Low	132 Å²	132	120.5 Å²	120.5	71%	0.706	64%	0.636	S	S	*	*	H	α-helix	trans	-66.6	-28.6	178	-78.6	-25.8	0	0	0	112.2	S290	D286-S290 VanDerWaalsContact O-CB 3.24Å; D286-S290 WeakPolarHBondContact O-CB 3.33Å; D286-S290 PolarHBondContact O-N 3.36Å
287	K	55.7	Low	59.2	Low	142 Å²	142	122.8 Å²	122.8	62%	0.617	63%	0.627	S	S	*	*	H	α-helix	trans	-66.9	-49.8	169.3	-83.8	-179.2	179.6	168.2	0	112.1	D284 M285 V289 S290 E291	D284-K287 PolarHBondContact O-N 2.83Å; M285-K287 VanDerWaalsContact C-N 3.25Å; M285-K287 PolarHBondContact O-N 3.44Å; K287-V289 VanDerWaalsContact C-N 3.31Å; K287-V289 PolarHBondContact O-N 2.94Å; K287-S290 PolarHBondContact O-N 2.69Å; K287-S290 VanDerWaalsContact O-N 3.16Å; K287-E291 WeakPolarHBondContact O-CB 3.32Å; K287-E291 PolarHBondContact O-N 3.38Å
288	M	55.1	Low	60.9	Low	115 Å²	115	123.6 Å²	123.6	57%	0.567	62%	0.621	S	S	*	*	H	α-helix	trans	-57.9	-43.6	178.3	-77.9	-174.6	62.9	0	0	111.8	D284 M285 S290 E291 E292	D284-M288 PolarHBondContact O-N 3.45Å; M285-M288 HydrophobicContact CE-SD 3.69Å; M285-M288 PolarHBondContact O-N 2.8Å; M288-S290 PolarHBondContact O-N 2.82Å; M288-E291 PolarHBondContact O-N 2.74Å; M288-E292 WeakPolarHBondContact O-CB 3.32Å; M288-E292 PolarHBondContact O-N 3.42Å
289	V	60.2	Low	62.6	Low	92 Å²	92	119.1 Å²	119.1	56%	0.558	61%	0.61	S	S	*	*	H	α-helix	trans	-64.1	-40.9	176.6	174.1	0	0	0	0	111.7	M285 K287 E291 E293	M285-V289 WeakPolarHBondContact O-CG2 3.4Å; M285-V289 PolarHBondContact O-N 3.32Å; K287-V289 VanDerWaalsContact C-N 3.31Å; K287-V289 PolarHBondContact O-N 2.94Å; V289-E291 VanDerWaalsContact C-N 3.34Å; V289-E291 PolarHBondContact O-N 2.71Å; V289-E293 VanDerWaalsContact O-CB 3.25Å; V289-E293 WeakPolarHBondContact O-CB 3.14Å; V289-E293 PolarHBondContact O-N 2.74Å
290	S	64.2	Low	64.7	Low	72 Å²	72	120.1 Å²	120.1	50%	0.503	61%	0.607	S	S	.	*	H	α-helix	trans	-66.3	-33.7	176.6	-171.9	0	0	0	0	113.1	D286 K287 M288 R294	D286-S290 VanDerWaalsContact O-CB 3.24Å; D286-S290 WeakPolarHBondContact O-CB 3.33Å; D286-S290 PolarHBondContact O-N 3.36Å; K287-S290 PolarHBondContact O-N 2.69Å; K287-S290 VanDerWaalsContact O-N 3.16Å; M288-S290 PolarHBondContact O-N 2.82Å; S290-R294 WeakPolarHBondContact O-CB 3.42Å; S290-R294 PolarHBondContact O-N 2.71Å
291	E	69	Low	67	Low	143 Å²	143	118.6 Å²	118.6	67%	0.668	59%	0.594	S	S	*	*	H	α-helix	trans	-81.3	-38.1	179.7	-165	152.8	-131.7	0	0	112.2	K287 M288 V289 R294 A295	K287-E291 WeakPolarHBondContact O-CB 3.32Å; K287-E291 PolarHBondContact O-N 3.38Å; M288-E291 PolarHBondContact O-N 2.74Å; V289-E291 VanDerWaalsContact C-N 3.34Å; V289-E291 PolarHBondContact O-N 2.71Å; E291-R294 WeakPolarHBondContact O-CB 3.48Å; E291-R294 PolarHBondContact O-N 2.93Å; E291-A295 PolarHBondContact O-N 3.45Å
292	E	71.3	Confident	68.6	Low	142 Å²	142	122.7 Å²	122.7	66%	0.664	60%	0.598	S	S	*	*	H	α-helix	trans	-63.2	-45.1	171.7	-173.6	174.1	-175	0	0	111.5	M288 R294 A295 R296	M288-E292 WeakPolarHBondContact O-CB 3.32Å; M288-E292 PolarHBondContact O-N 3.42Å; E292-R294 PolarHBondContact O-N 3.21Å; E292-A295 PolarHBondContact O-N 3.32Å; E292-R296 VanDerWaalsContact O-CB 3.31Å; E292-R296 WeakPolarHBondContact O-CB 3.47Å; E292-R296 PolarHBondContact O-N 2.9Å
293	E	72.7	Confident	70.2	Confident	83 Å²	83	126.3 Å²	126.3	39%	0.388	60%	0.599	S	S	.	*	H	α-helix	trans	-62.5	-30.2	174.6	-179.1	61.6	-162.5	0	0	112.3	V289 K297	V289-E293 VanDerWaalsContact O-CB 3.25Å; V289-E293 WeakPolarHBondContact O-CB 3.14Å; V289-E293 PolarHBondContact O-N 2.74Å; E293-K297 PolarHBondContact O-N 2.89Å; E293-K297 IonicContact OE1-NZ 2.81Å; E293-K297 PolarHBondContact OE1-NZ 3.38Å
294	R	76.1	Confident	71.6	Confident	179 Å²	179	126.8 Å²	126.8	68%	0.675	60%	0.597	S	S	*	*	H	α-helix	trans	-72.9	-47.7	175.3	-158.7	-176.4	-153.9	101.8	-0.8	111.6	S290 E291 E292 R296 K297 E298	S290-R294 WeakPolarHBondContact O-CB 3.42Å; S290-R294 PolarHBondContact O-N 2.71Å; E291-R294 WeakPolarHBondContact O-CB 3.48Å; E291-R294 PolarHBondContact O-N 2.93Å; E292-R294 PolarHBondContact O-N 3.21Å; R294-R296 VanDerWaalsContact C-N 3.26Å; R294-R296 PolarHBondContact O-N 3Å; R294-K297 PolarHBondContact O-N 3.18Å; R294-E298 PolarHBondContact O-N 2.89Å
295	A	79.9	Confident	72.8	Confident	59 Å²	59	127.4 Å²	127.4	49%	0.488	60%	0.597	S	S	.	*	H	α-helix	trans	-59.4	-39.2	174.8	0	0	0	0	0	111.5	E291 E292 E298 Q299	E291-A295 PolarHBondContact O-N 3.45Å; E292-A295 PolarHBondContact O-N 3.32Å; A295-E298 PolarHBondContact O-N 3.25Å; A295-Q299 WeakPolarHBondContact O-CB 3.46Å; A295-Q299 PolarHBondContact O-N 3.23Å
296	R	82.6	Confident	74	Confident	184 Å²	184	126.6 Å²	126.6	69%	0.694	59%	0.592	S	S	*	*	H	α-helix	trans	-62.8	-44.2	177.4	-162.3	176.4	-169.6	-160.2	4.1	112.7	E292 R294 Q299 E300	E292-R296 VanDerWaalsContact O-CB 3.31Å; E292-R296 WeakPolarHBondContact O-CB 3.47Å; E292-R296 PolarHBondContact O-N 2.9Å; R294-R296 VanDerWaalsContact C-N 3.26Å; R294-R296 PolarHBondContact O-N 3Å; R296-Q299 PolarHBondContact O-N 2.83Å; R296-E300 WeakPolarHBondContact O-CB 3.43Å; R296-E300 PolarHBondContact O-N 2.67Å
297	K	79.2	Confident	75	Confident	116 Å²	116	126.6 Å²	126.6	50%	0.504	59%	0.586	S	S	.	*	H	α-helix	trans	-66.6	-35.8	174.2	-78.3	-172.6	171.6	81.9	0	113.2	E293 R294 E300 K301	E293-K297 PolarHBondContact O-N 2.89Å; E293-K297 IonicContact OE1-NZ 2.81Å; E293-K297 PolarHBondContact OE1-NZ 3.38Å; R294-K297 PolarHBondContact O-N 3.18Å; K297-E300 PolarHBondContact O-N 3.27Å; K297-K301 WeakPolarHBondContact O-CB 3.18Å; K297-K301 PolarHBondContact O-N 2.84Å
298	E	80.5	Confident	76	Confident	136 Å²	136	122.2 Å²	122.2	64%	0.636	58%	0.576	S	S	*	*	H	α-helix	trans	-69.9	-36.2	175.8	-172.2	157.8	-167.2	0	0	111.8	R294 A295 R302	R294-E298 PolarHBondContact O-N 2.89Å; A295-E298 PolarHBondContact O-N 3.25Å; E298-R302 WeakPolarHBondContact O-CB 3.34Å; E298-R302 PolarHBondContact O-N 2.93Å
299	Q	77.2	Confident	76.8	Confident	142 Å²	142	119.4 Å²	119.4	66%	0.664	57%	0.571	S	S	*	*	H	α-helix	trans	-68	-40.9	172.3	-173.3	162.8	-30.3	0	0	112.5	A295 R296 R302 E303	A295-Q299 WeakPolarHBondContact O-CB 3.46Å; A295-Q299 PolarHBondContact O-N 3.23Å; R296-Q299 PolarHBondContact O-N 2.83Å; Q299-R302 PolarHBondContact O-N 2.9Å; Q299-E303 PolarHBondContact O-N 2.85Å
300	E	83.6	Confident	77.3	Confident	136 Å²	136	122.9 Å²	122.9	64%	0.636	57%	0.574	S	S	*	*	H	α-helix	trans	-60.1	-46.2	173.4	-177.8	173.6	-148.4	0	0	111.6	R296 K297 R302 E303 E304	R296-E300 WeakPolarHBondContact O-CB 3.43Å; R296-E300 PolarHBondContact O-N 2.67Å; K297-E300 PolarHBondContact O-N 3.27Å; E300-R302 VanDerWaalsContact C-N 3.3Å; E300-R302 PolarHBondContact O-N 2.64Å; E300-E303 PolarHBondContact O-N 2.95Å; E300-E304 PolarHBondContact O-N 2.79Å
301	K	83.9	Confident	77.3	Confident	114 Å²	114	127.9 Å²	127.9	50%	0.496	58%	0.582	S	S	.	*	H	α-helix	trans	-58.3	-41.8	173.9	178.9	-179.7	175.3	-69.3	0	112	K297 E304 E305	K297-K301 WeakPolarHBondContact O-CB 3.18Å; K297-K301 PolarHBondContact O-N 2.84Å; K301-E304 PolarHBondContact O-N 3.42Å; K301-E305 IonicContact NZ-OE1 3.05Å; K301-E305 PolarHBondContact NZ-OE1 3.42Å; K301-E305 IonicContact NZ-OE2 2.79Å; K301-E305 PolarHBondContact NZ-OE2 3Å; K301-E305 PolarHBondContact O-N 2.78Å
302	R	84	Confident	76.9	Confident	188 Å²	188	127 Å²	127	71%	0.709	58%	0.58	S	S	*	*	H	α-helix	trans	-68.7	-38	-179.5	-155.8	177	-157.5	158.9	6.2	111.9	E298 Q299 E300 E305 E306	E298-R302 WeakPolarHBondContact O-CB 3.34Å; E298-R302 PolarHBondContact O-N 2.93Å; Q299-R302 PolarHBondContact O-N 2.9Å; E300-R302 VanDerWaalsContact C-N 3.3Å; E300-R302 PolarHBondContact O-N 2.64Å; R302-E305 PolarHBondContact O-N 3.27Å; R302-E306 PolarHBondContact O-N 3.4Å
303	E	81.9	Confident	76.2	Confident	133 Å²	133	126.4 Å²	126.4	62%	0.621	58%	0.582	S	S	*	*	H	α-helix	trans	-69.1	-34.5	173.8	-168.4	171.3	-154.3	0	0	111.5	Q299 E300 K307	Q299-E303 PolarHBondContact O-N 2.85Å; E300-E303 PolarHBondContact O-N 2.95Å; E303-K307 WeakPolarHBondContact O-CB 3.32Å; E303-K307 PolarHBondContact O-N 3.12Å
304	E	81	Confident	75.4	Confident	141 Å²	141	126.6 Å²	126.6	66%	0.659	59%	0.588	S	S	*	*	H	α-helix	trans	-69.1	-41.5	171.4	-173.8	163.2	-130.3	0	0	112.8	E300 K301 K307 A308	E300-E304 PolarHBondContact O-N 2.79Å; K301-E304 PolarHBondContact O-N 3.42Å; E304-K307 CarbonylContact O-C 3.54Å; E304-K307 PolarHBondContact O-N 2.94Å; E304-A308 WeakPolarHBondContact O-CB 3.37Å; E304-A308 PolarHBondContact O-N 3.03Å
305	E	80.2	Confident	74.2	Confident	109 Å²	109	125 Å²	125	51%	0.509	59%	0.589	S	S	.	*	H	α-helix	trans	-62.4	-41.1	173.7	-80.6	174.7	158.1	0	0	111.8	K301 R302 A308 A309	K301-E305 IonicContact NZ-OE1 3.05Å; K301-E305 PolarHBondContact NZ-OE1 3.42Å; K301-E305 IonicContact NZ-OE2 2.79Å; K301-E305 PolarHBondContact NZ-OE2 3Å; K301-E305 PolarHBondContact O-N 2.78Å; R302-E305 PolarHBondContact O-N 3.27Å; E305-A308 PolarHBondContact O-N 3.06Å; E305-A309 PolarHBondContact O-N 2.85Å
306	E	78.8	Confident	72.8	Confident	100 Å²	100	127.8 Å²	127.8	47%	0.467	60%	0.595	S	S	.	*	H	α-helix	trans	-65.5	-39.3	174.1	-158.5	-165.8	147.5	0	0	111.8	R302 A308 A309 R310	R302-E306 PolarHBondContact O-N 3.4Å; E306-A308 VanDerWaalsContact C-N 3.29Å; E306-A308 PolarHBondContact O-N 2.92Å; E306-A309 PolarHBondContact O-N 3.49Å; E306-R310 WeakPolarHBondContact O-CB 3.31Å; E306-R310 VanDerWaalsContact O-CG 3.22Å; E306-R310 WeakPolarHBondContact O-CG 3.45Å; E306-R310 PolarHBondContact O-N 3.13Å; E306-R310 IonicContact OE1-CZ 3.84Å; E306-R310 IonicContact OE1-NE 2.91Å; E306-R310 PolarHBondContact OE1-NE 3.26Å; E306-R310 IonicContact OE1-NH2 3.31Å; E306-R310 PolarHBondContact OE1-NH2 2.73Å
307	K	78.8	Confident	71.4	Confident	133 Å²	133	123.4 Å²	123.4	58%	0.578	59%	0.586	S	S	*	*	H	α-helix	trans	-69.5	-24.9	176.5	-169.9	178.6	-168.8	174	0	112.7	E303 E304 R311	E303-K307 WeakPolarHBondContact O-CB 3.32Å; E303-K307 PolarHBondContact O-N 3.12Å; E304-K307 CarbonylContact O-C 3.54Å; E304-K307 PolarHBondContact O-N 2.94Å; K307-R311 WeakPolarHBondContact O-CG 3.38Å
308	A	75.3	Confident	69.9	Low	49 Å²	49	123.2 Å²	123.2	41%	0.405	59%	0.585	S	S	.	*	H	α-helix	trans	-77	-45	169.5	0	0	0	0	0	111.7	E304 E305 E306 R310 R311 I312	E304-A308 WeakPolarHBondContact O-CB 3.37Å; E304-A308 PolarHBondContact O-N 3.03Å; E305-A308 PolarHBondContact O-N 3.06Å; E306-A308 VanDerWaalsContact C-N 3.29Å; E306-A308 PolarHBondContact O-N 2.92Å; A308-R310 VanDerWaalsContact C-N 3.33Å; A308-R310 PolarHBondContact O-N 3.39Å; A308-R311 WeakPolarHBondContact O-CB 3.34Å; A308-R311 PolarHBondContact O-N 3.29Å; A308-I312 PolarHBondContact O-N 2.82Å
309	A	73.5	Confident	68.6	Low	57 Å²	57	120.4 Å²	120.4	47%	0.471	58%	0.575	S	S	.	*	H	α-helix	trans	-57.4	-46.2	173.9	0	0	0	0	0	111.5	E305 E306 R311 I312 D313	E305-A309 PolarHBondContact O-N 2.85Å; E306-A309 PolarHBondContact O-N 3.49Å; A309-R311 PolarHBondContact O-N 3.39Å; A309-R311 VanDerWaalsContact O-N 3.11Å; A309-I312 PolarHBondContact O-N 3.08Å; A309-I312 VanDerWaalsContact O-N 3.12Å; A309-D313 PolarHBondContact O-N 2.8Å
310	R	69.8	Low	67.3	Low	164 Å²	164	115.4 Å²	115.4	62%	0.619	56%	0.557	S	S	*	*	H	α-helix	trans	-64	-8.9	174.1	-70.6	168.9	175.7	-137.5	15.1	114.9	E306 A308 V314	E306-R310 WeakPolarHBondContact O-CB 3.31Å; E306-R310 VanDerWaalsContact O-CG 3.22Å; E306-R310 WeakPolarHBondContact O-CG 3.45Å; E306-R310 PolarHBondContact O-N 3.13Å; E306-R310 IonicContact OE1-CZ 3.84Å; E306-R310 IonicContact OE1-NE 2.91Å; E306-R310 PolarHBondContact OE1-NE 3.26Å; E306-R310 IonicContact OE1-NH2 3.31Å; E306-R310 PolarHBondContact OE1-NH2 2.73Å; A308-R310 VanDerWaalsContact C-N 3.33Å; A308-R310 PolarHBondContact O-N 3.39Å; R310-V314 WeakPolarHBondContact O-CG2 3.4Å
311	R	64.6	Low	65.9	Low	177 Å²	177	114.9 Å²	114.9	67%	0.668	56%	0.555	S	S	*	*	H	α-helix	trans	-87.4	-40.1	169.8	-77.1	173.2	176.5	-175.4	0.4	111.9	K307 A308 A309 D313 V314 E315	K307-R311 WeakPolarHBondContact O-CG 3.38Å; A308-R311 WeakPolarHBondContact O-CB 3.34Å; A308-R311 PolarHBondContact O-N 3.29Å; A309-R311 PolarHBondContact O-N 3.39Å; A309-R311 VanDerWaalsContact O-N 3.11Å; R311-D313 VanDerWaalsContact C-N 3.35Å; R311-V314 PolarHBondContact O-N 3.39Å; R311-E315 PolarHBondContact O-N 2.8Å
312	I	59.6	Low	65.1	Low	124 Å²	124	114.8 Å²	114.8	64%	0.636	56%	0.556	S	S	*	*	H	α-helix	trans	-63.4	-44.4	179.7	-61.3	171.8	0	0	0	110.1	A308 A309 V314 E315 D316	A308-I312 PolarHBondContact O-N 2.82Å; A309-I312 PolarHBondContact O-N 3.08Å; A309-I312 VanDerWaalsContact O-N 3.12Å; I312-V314 PolarHBondContact O-N 3.47Å; I312-V314 VanDerWaalsContact O-N 3.12Å; I312-E315 PolarHBondContact O-N 2.68Å; I312-D316 PolarHBondContact O-N 3.12Å
313	D	56.5	Low	64.9	Low	131 Å²	131	112 Å²	112	70%	0.701	55%	0.549	S	S	*	.	H	α-helix	trans	-61.7	-19.8	179.3	-147.8	38	0	0	0	113.5	A309 R311	A309-D313 PolarHBondContact O-N 2.8Å; R311-D313 VanDerWaalsContact C-N 3.35Å
314	V	56.6	Low	65.1	Low	86 Å²	86	108.9 Å²	108.9	52%	0.521	54%	0.54	S	S	.	.	H	α-helix	trans	-93.3	-16.2	178.9	172.9	0	0	0	0	112.7	R310 R311 I312	R310-V314 WeakPolarHBondContact O-CG2 3.4Å; R311-V314 PolarHBondContact O-N 3.39Å; I312-V314 PolarHBondContact O-N 3.47Å; I312-V314 VanDerWaalsContact O-N 3.12Å
315	E	50.6	Low	65.6	Low	147 Å²	147	106.4 Å²	106.4	69%	0.687	53%	0.531	S	S	*	.	H	α-helix	trans	-88.2	-32.2	176.9	-66.6	-169.2	155.7	0	0	112.3	R311 I312	R311-E315 PolarHBondContact O-N 2.8Å; I312-E315 PolarHBondContact O-N 2.68Å
316	D	51.2	Low	66.1	Low	116 Å²	116	103.4 Å²	103.4	62%	0.62	52%	0.518	S	S	*	.	H	α-helix	trans	-73.7	-31.8	177.3	-135	-6.7	0	0	0	112.5	I312 F318 D319 A320	I312-D316 PolarHBondContact O-N 3.12Å; D316-F318 PolarHBondContact O-N 3.15Å; D316-D319 PolarHBondContact O-N 2.91Å; D316-A320 WeakPolarHBondContact O-CB 3.4Å; D316-A320 PolarHBondContact O-N 3.05Å
317	D	52.1	Low	66.8	Low	93 Å²	93	105.2 Å²	105.2	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-71.3	-14.8	177.2	-163.4	49.2	0	0	0	113.4
318	F	48.1	Very low	67.5	Low	111 Å²	111	99 Å²	99	49%	0.487	50%	0.498	S	S	.	.	H	α-helix	trans	-80.6	-48.5	169.6	-103.1	-90.8	0	0	0	111.8	D316 A320 Q321	D316-F318 PolarHBondContact O-N 3.15Å; F318-A320 PolarHBondContact O-N 2.81Å; F318-Q321 PolarHBondContact O-N 2.92Å
319	D	52.4	Low	68.2	Low	78 Å²	78	104.2 Å²	104.2	42%	0.417	51%	0.511	S	S	.	.	H	α-helix	trans	-72.3	-7.2	177.6	-71.7	3.7	0	0	0	111.8	K40 D316	K40-D319 WeakPolarHBondContact CE-OD1 3.33Å; K40-D319 IonicContact NZ-OD1 3.66Å; K40-D319 PolarHBondContact NZ-OD1 3.03Å; K40-D319 IonicContact NZ-OD2 2.72Å; K40-D319 PolarHBondContact NZ-OD2 3.31Å; D316-D319 PolarHBondContact O-N 2.91Å
320	A	51.5	Low	69.1	Low	36 Å²	36	106.3 Å²	106.3	30%	0.298	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-24.7	168.6	0	0	0	0	0	114.8	D316 F318	D316-A320 WeakPolarHBondContact O-CB 3.4Å; D316-A320 PolarHBondContact O-N 3.05Å; F318-A320 PolarHBondContact O-N 2.81Å
321	Q	54.5	Low	70.1	Confident	125 Å²	125	100 Å²	100	58%	0.584	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-23	-171.1	-64.1	-173.2	11.3	0	0	114.5	F318	F318-Q321 PolarHBondContact O-N 2.92Å
322	E	66.1	Low	71.7	Confident	113 Å²	113	94.4 Å²	94.4	53%	0.528	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	26.4	176	-67.1	-160.5	137.3	0	0	113.3	P324 F336 R350	E322-P324 WeakPolarHBondContact O-CD 3.39Å; E322-F336 HydrophobicContact CB-CE1 4.17Å; E322-F336 WeakPolarHBondContact O-CE1 3.43Å; E322-R350 IonicContact OE1-NH2 3.91Å
323	K	79.6	Confident	73.5	Confident	129 Å²	129	88.7 Å²	88.7	56%	0.561	45%	0.45	S	S	*	.			trans	-73.7	118.7	172.6	-74.4	171.2	-177.8	162.9	0	109.7
324	P	87.4	Confident	75.3	Confident	67 Å²	67	84.2 Å²	84.2	44%	0.435	43%	0.426	S	S	.	.			trans	-70.9	134.8	-177.3	29.7	-35.6	0	0	0	110.8	E322 L334 K335	E322-P324 WeakPolarHBondContact O-CD 3.39Å; P324-L334 HydrophobicContact CB-CB 3.97Å; P324-L334 HydrophobicContact CB-CD1 4.33Å; P324-L334 HydrophobicContact CB-CD2 4.21Å; P324-L334 HydrophobicContact CB-CG 4.4Å; P324-L334 HydrophobicContact CG-CD1 4.3Å; P324-L334 HydrophobicContact CG-CD2 4.32Å; P324-K335 CarbonylContact C-O 3.57Å; P324-K335 WeakPolarHBondContact CA-O 3.44Å
325	I	91.2	Very high	77.2	Confident	90 Å²	90	81 Å²	81	46%	0.462	41%	0.405	S	S	.	.	S	Bend	trans	-91.7	-20.8	-175	55.3	164.1	0	0	0	113.5	K335 D337	I325-K335 HydrophobicContact CD1-CD 3.83Å; I325-K335 HydrophobicContact CD1-CG 4.1Å; I325-K335 HydrophobicContact CG1-CB 4.19Å; I325-K335 HydrophobicContact CG1-CD 3.93Å; I325-K335 HydrophobicContact CG1-CG 3.95Å; I325-K335 WeakPolarHBondContact CG1-O 3.21Å; I325-K335 PolarHBondContact N-O 2.82Å; I325-D337 HydrophobicContact CD1-CB 4.28Å; I325-D337 HydrophobicContact CG2-CB 4.24Å
326	D	90.9	Very high	79.3	Confident	46 Å²	46	75 Å²	75	25%	0.246	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	166.5	174.2	-161.6	4.3	0	0	0	109.8	K335 W362 Y411	D326-K335 HydrophobicContact CB-CB 3.88Å; D326-K335 HydrophobicContact CB-CD 3.82Å; D326-K335 HydrophobicContact CB-CG 4.5Å; D326-K335 PolarHBondContact O-N 2.87Å; D326-W362 HydrophobicContact CB-CH2 4.14Å; D326-W362 HydrophobicContact CB-CZ2 3.95Å; D326-Y411 PolarHBondContact OD2-OH 3.08Å; D326-Y411 VanDerWaalsContact OD2-OH 3.1Å
327	K	93	Very high	81.2	Confident	137 Å²	137	74.4 Å²	74.4	60%	0.596	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.3	150	179.6	64	-177	179.1	179.8	0	112	F333 L334	K327-F333 CarbonylContact C-O 3.46Å; K327-F333 VanDerWaalsContact CA-O 3.26Å; K327-F333 WeakPolarHBondContact CA-O 3.32Å; K327-L334 HydrophobicContact CB-CD2 3.85Å
328	S	93.5	Very high	83.1	Confident	3 Å²	3	72.5 Å²	72.5	2%	0.021	36%	0.362	C	S	.	.			trans	-63.5	161.1	174.4	64.2	0	0	0	0	112	N330 G331 R332 F333	S328-N330 VanDerWaalsContact C-N 3.25Å; S328-N330 VanDerWaalsContact CB-OD1 3.31Å; S328-N330 WeakPolarHBondContact CB-OD1 3.45Å; S328-N330 PolarHBondContact O-N 3.1Å; S328-N330 PolarHBondContact OG-OD1 2.94Å; S328-G331 WeakPolarHBondContact O-CA 3.25Å; S328-G331 PolarHBondContact O-N 3.3Å; S328-G331 PolarHBondContact OG-N 3.18Å; S328-R332 PolarHBondContact OG-N 2.89Å; S328-R332 VanDerWaalsContact OG-N 3.09Å; S328-F333 PolarHBondContact N-O 3.24Å; S328-F333 PolarHBondContact OG-N 2.97Å
329	K	89.9	Confident	85.2	Confident	158 Å²	158	70.9 Å²	70.9	69%	0.687	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-31.7	-177.1	-63.5	179.5	-177.2	174.8	0	113.6	W400 E401	K329-W400 HydrophobicContact CD-CB 4.24Å; K329-W400 HydrophobicContact CD-CG 4.39Å; K329-W400 HydrophobicContact CG-CG 4.41Å; K329-E401 WeakPolarHBondContact CE-O 3.5Å; K329-E401 PolarHBondContact NZ-O 3.49Å
330	N	91.4	Very high	86.9	Confident	101 Å²	101	69 Å²	69	54%	0.54	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-4.1	173	54.1	11.7	0	0	0	113.3	S328 R332	S328-N330 VanDerWaalsContact C-N 3.25Å; S328-N330 VanDerWaalsContact CB-OD1 3.31Å; S328-N330 WeakPolarHBondContact CB-OD1 3.45Å; S328-N330 PolarHBondContact O-N 3.1Å; S328-N330 PolarHBondContact OG-OD1 2.94Å; N330-R332 PolarHBondContact O-N 3.44Å; N330-R332 PolarHBondContact OD1-N 3.1Å
331	G	92.6	Very high	88.5	Confident	31 Å²	31	68.7 Å²	68.7	32%	0.32	35%	0.346	S	S	.	.	S	Bend	trans	76.5	-6.1	-177.7	0	0	0	0	0	115.7	S328	S328-G331 WeakPolarHBondContact O-CA 3.25Å; S328-G331 PolarHBondContact O-N 3.3Å; S328-G331 PolarHBondContact OG-N 3.18Å
332	R	96.5	Very high	89.8	Confident	61 Å²	61	71 Å²	71	23%	0.23	35%	0.349	C	S	.	.			trans	-61.6	-41.8	-177	178	178.4	176.1	163.7	-12.2	113.8	S328 N330 D353 T354 E355	S328-R332 PolarHBondContact OG-N 2.89Å; S328-R332 VanDerWaalsContact OG-N 3.09Å; N330-R332 PolarHBondContact O-N 3.44Å; N330-R332 PolarHBondContact OD1-N 3.1Å; R332-D353 VanDerWaalsContact CG-OD1 3.24Å; R332-D353 WeakPolarHBondContact CG-OD1 3.35Å; R332-D353 IonicContact CZ-OD1 3.1Å; R332-D353 IonicContact CZ-OD2 3.04Å; R332-D353 IonicContact NE-OD1 2.72Å; R332-D353 PolarHBondContact NE-OD1 3.2Å; R332-D353 IonicContact NE-OD2 2.67Å; R332-D353 PolarHBondContact NE-OD2 3.03Å; R332-D353 IonicContact NH2-OD1 2.77Å; R332-D353 IonicContact NH2-OD2 2.59Å; R332-D353 PolarHBondContact NH2-OD2 2.97Å; R332-T354 PolarHBondContact O-N 3.47Å; R332-T354 PolarHBondContact O-OG1 2.89Å; R332-E355 WeakPolarHBondContact CD-OE1 3.31Å; R332-E355 WeakPolarHBondContact CD-OE2 3.41Å; R332-E355 HydrophobicContact CG-CB 4.49Å; R332-E355 HydrophobicContact CG-CG 3.99Å; R332-E355 IonicContact CZ-OE2 3.34Å; R332-E355 IonicContact NE-OE2 3.73Å; R332-E355 PolarHBondContact NE-OE2 3.16Å; R332-E355 IonicContact NH1-OE2 3.06Å; R332-E355 PolarHBondContact NH1-OE2 2.77Å; R332-E355 IonicContact NH2-OE2 3.57Å
333	F	97.5	Very high	89.9	Confident	4 Å²	4	67.5 Å²	67.5	2%	0.018	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	135	-176.7	-53.4	-72	0	0	0	110.2	K327 S328 L352 D353 V360 W362 D398 W400 V415	K327-F333 CarbonylContact C-O 3.46Å; K327-F333 VanDerWaalsContact CA-O 3.26Å; K327-F333 WeakPolarHBondContact CA-O 3.32Å; S328-F333 PolarHBondContact N-O 3.24Å; S328-F333 PolarHBondContact OG-N 2.97Å; F333-L352 WeakPolarHBondContact CA-O 3.44Å; F333-D353 HydrophobicContact CD1-CB 3.88Å; F333-D353 HydrophobicContact CE1-CB 3.8Å; F333-V360 HydrophobicContact CD1-CG2 4.28Å; F333-W362 HydrophobicContact CB-CE3 4.35Å; F333-W362 HydrophobicContact CB-CZ3 4.11Å; F333-D398 HydrophobicContact CD2-CB 4.5Å; F333-D398 HydrophobicContact CE2-CB 3.66Å; F333-D398 HydrophobicContact CZ-CB 4.32Å; F333-W400 HydrophobicContact CB-CH2 4.28Å; F333-W400 HydrophobicContact CD2-CH2 4.07Å; F333-W400 AromaticContact CD2-CZ3 3.92Å; F333-W400 HydrophobicContact CD2-CZ3 3.92Å; F333-V415 HydrophobicContact CB-CG2 4.35Å; F333-V415 HydrophobicContact CD1-CG1 3.76Å; F333-V415 HydrophobicContact CD2-CB 4.5Å; F333-V415 HydrophobicContact CD2-CG1 4.48Å; F333-V415 HydrophobicContact CD2-CG2 4.02Å; F333-V415 HydrophobicContact CE1-CG1 3.91Å; F333-V415 HydrophobicContact CG-CG1 4.06Å; F333-V415 HydrophobicContact CG-CG2 4.07Å; F333-V415 HydrophobicContact CZ-CG1 4.35Å
334	L	96	Very high	89	Confident	37 Å²	37	66.3 Å²	66.3	19%	0.194	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	144.1	174.9	-60.4	177.7	0	0	0	110.1	P324 K327 F336 G351 L352 T354	P324-L334 HydrophobicContact CB-CB 3.97Å; P324-L334 HydrophobicContact CB-CD1 4.33Å; P324-L334 HydrophobicContact CB-CD2 4.21Å; P324-L334 HydrophobicContact CB-CG 4.4Å; P324-L334 HydrophobicContact CG-CD1 4.3Å; P324-L334 HydrophobicContact CG-CD2 4.32Å; K327-L334 HydrophobicContact CB-CD2 3.85Å; L334-F336 HydrophobicContact CB-CE2 4.31Å; L334-F336 HydrophobicContact CB-CZ 4.44Å; L334-G351 CarbonylContact O-C 3.52Å; L334-G351 WeakPolarHBondContact O-CA 3.22Å; L334-L352 PolarHBondContact N-O 3.37Å; L334-L352 PolarHBondContact O-N 3.37Å; L334-T354 HydrophobicContact CD1-CG2 3.6Å; L334-T354 HydrophobicContact CG-CG2 3.72Å
335	K	95.7	Very high	88	Confident	18 Å²	18	66.8 Å²	66.8	8%	0.078	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	140.9	174.2	-171.9	-168.6	-177.2	179.7	0	110.7	P324 I325 D326 F349 W362 E364	P324-K335 CarbonylContact C-O 3.57Å; P324-K335 WeakPolarHBondContact CA-O 3.44Å; I325-K335 HydrophobicContact CD1-CD 3.83Å; I325-K335 HydrophobicContact CD1-CG 4.1Å; I325-K335 HydrophobicContact CG1-CB 4.19Å; I325-K335 HydrophobicContact CG1-CD 3.93Å; I325-K335 HydrophobicContact CG1-CG 3.95Å; I325-K335 WeakPolarHBondContact CG1-O 3.21Å; I325-K335 PolarHBondContact N-O 2.82Å; D326-K335 HydrophobicContact CB-CB 3.88Å; D326-K335 HydrophobicContact CB-CD 3.82Å; D326-K335 HydrophobicContact CB-CG 4.5Å; D326-K335 PolarHBondContact O-N 2.87Å; K335-F349 HydrophobicContact CG-CB 4.17Å; K335-F349 HydrophobicContact CG-CG 4.47Å; K335-W362 HydrophobicContact CB-CD2 3.76Å; K335-W362 HydrophobicContact CB-CE3 3.87Å; K335-W362 HydrophobicContact CB-CG 4.32Å; K335-W362 HydrophobicContact CB-CH2 3.94Å; K335-W362 HydrophobicContact CB-CZ2 3.88Å; K335-W362 HydrophobicContact CB-CZ3 3.96Å; K335-W362 HydrophobicContact CD-CD2 4.34Å; K335-W362 HydrophobicContact CD-CG 4.45Å; K335-W362 HydrophobicContact CD-CZ2 4.06Å; K335-W362 HydrophobicContact CG-CD2 3.94Å; K335-W362 HydrophobicContact CG-CG 4.01Å; K335-W362 HydrophobicContact CG-CZ2 4.34Å; K335-E364 WeakPolarHBondContact CE-OE1 3.39Å; K335-E364 IonicContact NZ-OE1 3.76Å; K335-E364 PolarHBondContact NZ-OE1 3.36Å; K335-E364 IonicContact NZ-OE2 3.45Å; K335-E364 PolarHBondContact NZ-OE2 3.28Å
336	F	94.4	Very high	87.4	Confident	22 Å²	22	65 Å²	65	10%	0.096	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	159.8	174.2	-58.5	-93	0	0	0	112	E322 L334 E338 R350 L352	E322-F336 HydrophobicContact CB-CE1 4.17Å; E322-F336 WeakPolarHBondContact O-CE1 3.43Å; L334-F336 HydrophobicContact CB-CE2 4.31Å; L334-F336 HydrophobicContact CB-CZ 4.44Å; F336-E338 PolarHBondContact O-N 2.93Å; F336-R350 PolarHBondContact N-O 3.4Å; F336-L352 HydrophobicContact CE2-CB 3.63Å; F336-L352 HydrophobicContact CZ-CB 4.03Å; F336-L352 HydrophobicContact CZ-CD2 4.47Å
337	D	91.2	Very high	87.2	Confident	103 Å²	103	63.3 Å²	63.3	55%	0.551	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	49	173	-171.2	54.1	0	0	0	112.4	K81 I325	K81-D337 PolarHBondContact NZ-O 2.96Å; K81-D337 IonicContact NZ-OD2 2.67Å; K81-D337 PolarHBondContact NZ-OD2 3.21Å; I325-D337 HydrophobicContact CD1-CB 4.28Å; I325-D337 HydrophobicContact CG2-CB 4.24Å
338	E	92.1	Very high	87	Confident	53 Å²	53	57.7 Å²	57.7	25%	0.248	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	93.2	173	-171.5	176.9	-170.2	0	0	108.8	R78 F336 L340 F349 R350	R78-E338 IonicContact CZ-OE1 2.69Å; R78-E338 IonicContact NE-OE1 3.72Å; R78-E338 IonicContact NH1-OE1 3.84Å; R78-E338 PolarHBondContact NH1-OE1 2.75Å; R78-E338 IonicContact NH1-OE2 2.91Å; F336-E338 PolarHBondContact O-N 2.93Å; E338-L340 HydrophobicContact CG-CD2 4.34Å; E338-L340 PolarHBondContact O-N 2.76Å; E338-F349 CarbonylContact O-C 3.54Å; E338-F349 WeakPolarHBondContact O-CA 3.38Å; E338-R350 HydrophobicContact CB-CB 4.1Å; E338-R350 PolarHBondContact O-N 3Å; E338-R350 WeakPolarHBondContact OE2-CD 3.42Å; E338-R350 IonicContact OE2-CZ 3.54Å; E338-R350 IonicContact OE2-NE 3.86Å; E338-R350 IonicContact OE2-NH1 2.71Å; E338-R350 PolarHBondContact OE2-NH1 3.22Å
339	E	92.6	Very high	87.1	Confident	77 Å²	77	58.6 Å²	58.6	36%	0.36	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	118.4	171.3	-170.5	175.8	125.7	0	0	109.1	R342 T347 F349	E339-R342 WeakPolarHBondContact OE1-CB 3.32Å; E339-R342 VanDerWaalsContact OE1-CD 3.31Å; E339-R342 WeakPolarHBondContact OE1-CD 3.49Å; E339-R342 IonicContact OE1-NH1 2.73Å; E339-R342 IonicContact OE2-NH1 3.93Å; E339-T347 HydrophobicContact CG-CG2 3.69Å; E339-F349 HydrophobicContact CB-CD1 4.28Å; E339-F349 HydrophobicContact CB-CE1 4.15Å; E339-F349 HydrophobicContact CG-CE1 4.49Å
340	L	88.4	Confident	87.4	Confident	39 Å²	39	54.8 Å²	54.8	20%	0.204	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-22.9	-179.1	-64.1	176.9	0	0	0	112.8	E338 V348 R350 L418	E338-L340 HydrophobicContact CG-CD2 4.34Å; E338-L340 PolarHBondContact O-N 2.76Å; L340-V348 HydrophobicContact CB-CB 4.49Å; L340-V348 HydrophobicContact CB-CG1 4.26Å; L340-V348 HydrophobicContact CD1-CG1 4.35Å; L340-V348 PolarHBondContact N-O 3.49Å; L340-R350 HydrophobicContact CD1-CB 4.1Å; L340-R350 HydrophobicContact CD2-CB 4.3Å; L340-R350 HydrophobicContact CG-CB 4.22Å; L340-L418 HydrophobicContact CD1-CD1 3.46Å; L340-L418 VanDerWaalsContact CD1-CD1 3.46Å
341	G	83.3	Confident	87.6	Confident	29 Å²	29	50 Å²	50	30%	0.299	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	171.8	161.1	179	0	0	0	0	0	112.8	V348	G341-V348 PolarHBondContact N-O 3.15Å; G341-V348 PolarHBondContact O-N 3.48Å
342	R	82.1	Confident	87.8	Confident	174 Å²	174	51.1 Å²	51.1	66%	0.657	26%	0.261	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.7	136.9	-172.5	-167.8	167.3	178.5	165.3	-3.8	111.2	E339 T347	E339-R342 WeakPolarHBondContact OE1-CB 3.32Å; E339-R342 VanDerWaalsContact OE1-CD 3.31Å; E339-R342 WeakPolarHBondContact OE1-CD 3.49Å; E339-R342 IonicContact OE1-NH1 2.73Å; E339-R342 IonicContact OE2-NH1 3.93Å; R342-T347 HydrophobicContact CG-CG2 4.44Å
343	G	69	Low	87.8	Confident	39 Å²	39	48.3 Å²	48.3	40%	0.402	25%	0.251	S	S	.	.			trans	-130.8	-178.7	174.6	0	0	0	0	0	111.6	F345 K346	G343-F345 PolarHBondContact O-N 3.03Å; G343-K346 PolarHBondContact N-O 3.49Å
344	S	59.9	Low	87.7	Confident	103 Å²	103	51.5 Å²	51.5	72%	0.72	27%	0.271	S	S	*	.	S	Bend	trans	-63.1	-15.3	-172	-48.4	0	0	0	0	115.6
345	F	67	Low	87.6	Confident	78 Å²	78	56 Å²	56	34%	0.342	29%	0.291	S	S	.	.	S	Bend	trans	-135.9	-17.6	-177.7	-55.8	-87.3	0	0	0	114.2	G343 L365 Q366 K369 I499	G343-F345 PolarHBondContact O-N 3.03Å; F345-L365 WeakPolarHBondContact O-CA 3.26Å; F345-Q366 PolarHBondContact O-N 3.48Å; F345-K369 HydrophobicContact CD1-CD 3.85Å; F345-K369 HydrophobicContact CE1-CD 3.55Å; F345-I499 HydrophobicContact CZ-CD1 4.37Å
346	K	79.4	Confident	87.6	Confident	51 Å²	51	59 Å²	59	22%	0.222	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	143.1	-175.6	83.2	-178.1	-170.2	-177.9	0	112.2	G343 V348 E364 L365 D483	G343-K346 PolarHBondContact N-O 3.49Å; K346-V348 HydrophobicContact CD-CG2 4.16Å; K346-V348 HydrophobicContact CG-CG2 4.3Å; K346-E364 WeakPolarHBondContact CA-O 3Å; K346-L365 HydrophobicContact CB-CD2 3.7Å; K346-D483 IonicContact NZ-OD1 2.71Å; K346-D483 PolarHBondContact NZ-OD1 3.29Å; K346-D483 IonicContact NZ-OD2 2.77Å; K346-D483 PolarHBondContact NZ-OD2 3.13Å
347	T	85.6	Confident	87.5	Confident	12 Å²	12	59.9 Å²	59.9	7%	0.074	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.5	159.4	-54	0	0	0	0	108.7	E339 R342 F349 E364	E339-T347 HydrophobicContact CG-CG2 3.69Å; R342-T347 HydrophobicContact CG-CG2 4.44Å; T347-F349 HydrophobicContact CG2-CD2 4.13Å; T347-F349 HydrophobicContact CG2-CE1 4.38Å; T347-F349 HydrophobicContact CG2-CE2 3.42Å; T347-F349 VanDerWaalsContact CG2-CE2 3.42Å; T347-F349 HydrophobicContact CG2-CZ 3.57Å; T347-E364 PolarHBondContact N-O 3.14Å; T347-E364 PolarHBondContact O-N 2.96Å
348	V	89.8	Confident	87.7	Confident	18 Å²	18	58.4 Å²	58.4	11%	0.109	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.7	-179.5	-171.9	0	0	0	0	109	L340 G341 K346 A361 W362	L340-V348 HydrophobicContact CB-CB 4.49Å; L340-V348 HydrophobicContact CB-CG1 4.26Å; L340-V348 HydrophobicContact CD1-CG1 4.35Å; L340-V348 PolarHBondContact N-O 3.49Å; G341-V348 PolarHBondContact N-O 3.15Å; G341-V348 PolarHBondContact O-N 3.48Å; K346-V348 HydrophobicContact CD-CG2 4.16Å; K346-V348 HydrophobicContact CG-CG2 4.3Å; V348-A361 HydrophobicContact CG1-CB 4.05Å; V348-W362 WeakPolarHBondContact CA-O 3.5Å
349	F	94.4	Very high	87.8	Confident	22 Å²	22	57.7 Å²	57.7	10%	0.096	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	158.8	176.5	-63.4	-91.3	0	0	0	110.4	K335 E338 E339 T347 W362 E364	K335-F349 HydrophobicContact CG-CB 4.17Å; K335-F349 HydrophobicContact CG-CG 4.47Å; E338-F349 CarbonylContact O-C 3.54Å; E338-F349 WeakPolarHBondContact O-CA 3.38Å; E339-F349 HydrophobicContact CB-CD1 4.28Å; E339-F349 HydrophobicContact CB-CE1 4.15Å; E339-F349 HydrophobicContact CG-CE1 4.49Å; T347-F349 HydrophobicContact CG2-CD2 4.13Å; T347-F349 HydrophobicContact CG2-CE1 4.38Å; T347-F349 HydrophobicContact CG2-CE2 3.42Å; T347-F349 VanDerWaalsContact CG2-CE2 3.42Å; T347-F349 HydrophobicContact CG2-CZ 3.57Å; F349-W362 HydrophobicContact CB-CB 4.33Å; F349-W362 PolarHBondContact N-O 2.78Å; F349-W362 PolarHBondContact O-N 3.18Å; F349-E364 HydrophobicContact CD2-CG 4.29Å; F349-E364 HydrophobicContact CE2-CG 4.3Å; F349-E364 WeakPolarHBondContact CE2-OE2 3.46Å
350	R	95.7	Very high	88	Confident	79 Å²	79	54 Å²	54	30%	0.298	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	137.3	165.2	-174.8	177.4	169.7	-162.5	-12	109.7	E322 F336 E338 L340	E322-R350 IonicContact OE1-NH2 3.91Å; F336-R350 PolarHBondContact N-O 3.4Å; E338-R350 HydrophobicContact CB-CB 4.1Å; E338-R350 PolarHBondContact O-N 3Å; E338-R350 WeakPolarHBondContact OE2-CD 3.42Å; E338-R350 IonicContact OE2-CZ 3.54Å; E338-R350 IonicContact OE2-NE 3.86Å; E338-R350 IonicContact OE2-NH1 2.71Å; E338-R350 PolarHBondContact OE2-NH1 3.22Å; L340-R350 HydrophobicContact CD1-CB 4.1Å; L340-R350 HydrophobicContact CD2-CB 4.3Å; L340-R350 HydrophobicContact CG-CB 4.22Å
351	G	95.8	Very high	88.3	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	178	167.7	0	0	0	0	0	112.8	L334 A359 V360	L334-G351 CarbonylContact O-C 3.52Å; L334-G351 WeakPolarHBondContact O-CA 3.22Å; G351-A359 WeakPolarHBondContact O-CA 3.35Å; G351-V360 VanDerWaalsContact C-CG2 3.5Å; G351-V360 PolarHBondContact N-O 3.31Å; G351-V360 PolarHBondContact O-N 3.05Å
352	L	96.6	Very high	88.8	Confident	54 Å²	54	51.1 Å²	51.1	28%	0.283	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	132.7	174.2	178.6	71	0	0	0	109	F333 L334 F336 G357	F333-L352 WeakPolarHBondContact CA-O 3.44Å; L334-L352 PolarHBondContact N-O 3.37Å; L334-L352 PolarHBondContact O-N 3.37Å; F336-L352 HydrophobicContact CE2-CB 3.63Å; F336-L352 HydrophobicContact CZ-CB 4.03Å; F336-L352 HydrophobicContact CZ-CD2 4.47Å; L352-G357 WeakPolarHBondContact CD1-O 3.38Å
353	D	97	Very high	89.2	Confident	2 Å²	2	43.5 Å²	43.5	1%	0.011	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	114	164.7	177.2	7.2	0	0	0	109.2	R332 F333 E355 T356 G357 V358 V360	R332-D353 VanDerWaalsContact CG-OD1 3.24Å; R332-D353 WeakPolarHBondContact CG-OD1 3.35Å; R332-D353 IonicContact CZ-OD1 3.1Å; R332-D353 IonicContact CZ-OD2 3.04Å; R332-D353 IonicContact NE-OD1 2.72Å; R332-D353 PolarHBondContact NE-OD1 3.2Å; R332-D353 IonicContact NE-OD2 2.67Å; R332-D353 PolarHBondContact NE-OD2 3.03Å; R332-D353 IonicContact NH2-OD1 2.77Å; R332-D353 IonicContact NH2-OD2 2.59Å; R332-D353 PolarHBondContact NH2-OD2 2.97Å; F333-D353 HydrophobicContact CD1-CB 3.88Å; F333-D353 HydrophobicContact CE1-CB 3.8Å; D353-E355 VanDerWaalsContact C-N 3.3Å; D353-E355 PolarHBondContact O-N 2.74Å; D353-E355 PolarHBondContact OD1-N 3.21Å; D353-E355 VanDerWaalsContact OD1-N 3.08Å; D353-T356 WeakPolarHBondContact CB-OG1 2.87Å; D353-T356 VanDerWaalsContact OD2-CG2 3.28Å; D353-T356 WeakPolarHBondContact OD2-CG2 3.33Å; D353-T356 PolarHBondContact OD2-OG1 2.9Å; D353-G357 VanDerWaalsContact O-CA 3.27Å; D353-G357 WeakPolarHBondContact O-CA 3.31Å; D353-G357 PolarHBondContact O-N 2.71Å; D353-V358 PolarHBondContact N-O 3.02Å; D353-V360 HydrophobicContact CB-CG1 4.05Å
354	T	95.2	Very high	90.1	Very high	72 Å²	72	42.9 Å²	42.9	44%	0.442	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-15.8	-176.3	63.5	0	0	0	0	113.7	R332 L334	R332-T354 PolarHBondContact O-N 3.47Å; R332-T354 PolarHBondContact O-OG1 2.89Å; L334-T354 HydrophobicContact CD1-CG2 3.6Å; L334-T354 HydrophobicContact CG-CG2 3.72Å
355	E	95.2	Very high	91	Very high	131 Å²	131	38.5 Å²	38.5	61%	0.612	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-39.2	175.5	-73.1	172.7	-163.6	0	0	111.5	R332 D353	R332-E355 WeakPolarHBondContact CD-OE1 3.31Å; R332-E355 WeakPolarHBondContact CD-OE2 3.41Å; R332-E355 HydrophobicContact CG-CB 4.49Å; R332-E355 HydrophobicContact CG-CG 3.99Å; R332-E355 IonicContact CZ-OE2 3.34Å; R332-E355 IonicContact NE-OE2 3.73Å; R332-E355 PolarHBondContact NE-OE2 3.16Å; R332-E355 IonicContact NH1-OE2 3.06Å; R332-E355 PolarHBondContact NH1-OE2 2.77Å; R332-E355 IonicContact NH2-OE2 3.57Å; D353-E355 VanDerWaalsContact C-N 3.3Å; D353-E355 PolarHBondContact O-N 2.74Å; D353-E355 PolarHBondContact OD1-N 3.21Å; D353-E355 VanDerWaalsContact OD1-N 3.08Å
356	T	94.5	Very high	91.2	Very high	81 Å²	81	39.2 Å²	39.2	50%	0.497	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-18.9	-176.5	61.4	0	0	0	0	114	D353 V358	D353-T356 WeakPolarHBondContact CB-OG1 2.87Å; D353-T356 VanDerWaalsContact OD2-CG2 3.28Å; D353-T356 WeakPolarHBondContact OD2-CG2 3.33Å; D353-T356 PolarHBondContact OD2-OG1 2.9Å; T356-V358 PolarHBondContact O-N 3.09Å; T356-V358 WeakPolarHBondContact OG1-CB 3.43Å; T356-V358 PolarHBondContact OG1-N 2.65Å
357	G	93	Very high	90.5	Very high	41 Å²	41	38.2 Å²	38.2	42%	0.423	21%	0.214	S	C	.	.			trans	73.8	8.3	-170.5	0	0	0	0	0	114.1	L352 D353	L352-G357 WeakPolarHBondContact CD1-O 3.38Å; D353-G357 VanDerWaalsContact O-CA 3.27Å; D353-G357 WeakPolarHBondContact O-CA 3.31Å; D353-G357 PolarHBondContact O-N 2.71Å
358	V	94.3	Very high	89.2	Confident	72 Å²	72	42.5 Å²	42.5	44%	0.436	25%	0.245	S	C	.	.			trans	-89.3	136.2	-175	179.2	0	0	0	0	110.8	D353 T356	D353-V358 PolarHBondContact N-O 3.02Å; T356-V358 PolarHBondContact O-N 3.09Å; T356-V358 WeakPolarHBondContact OG1-CB 3.43Å; T356-V358 PolarHBondContact OG1-N 2.65Å
359	A	95.2	Very high	87.8	Confident	37 Å²	37	48 Å²	48	31%	0.306	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	134.5	173.8	0	0	0	0	0	111.2	G351 L418	G351-A359 WeakPolarHBondContact O-CA 3.35Å; A359-L418 HydrophobicContact CB-CD2 3.79Å; A359-L418 WeakPolarHBondContact O-CB 3.29Å
360	V	95.8	Very high	86.2	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	161	-176.2	-64.6	0	0	0	0	111.2	F333 G351 D353 Y397 V415 T416	F333-V360 HydrophobicContact CD1-CG2 4.28Å; G351-V360 VanDerWaalsContact C-CG2 3.5Å; G351-V360 PolarHBondContact N-O 3.31Å; G351-V360 PolarHBondContact O-N 3.05Å; D353-V360 HydrophobicContact CB-CG1 4.05Å; V360-Y397 HydrophobicContact CG1-CD2 4Å; V360-Y397 HydrophobicContact CG1-CE2 3.72Å; V360-V415 HydrophobicContact CB-CG1 3.72Å; V360-V415 HydrophobicContact CG1-CG1 4.18Å; V360-V415 HydrophobicContact CG2-CG1 3.62Å; V360-T416 WeakPolarHBondContact CB-O 3.48Å
361	A	95.1	Very high	84.8	Confident	7 Å²	7	50.4 Å²	50.4	6%	0.058	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	125.1	168.1	0	0	0	0	0	109.1	V348 V415 T416 L418	V348-A361 HydrophobicContact CG1-CB 4.05Å; A361-V415 WeakPolarHBondContact O-CA 3.46Å; A361-T416 PolarHBondContact N-O 3.42Å; A361-T416 PolarHBondContact O-N 3.34Å; A361-L418 HydrophobicContact CB-CD1 4.23Å
362	W	94.2	Very high	83.8	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	105.6	177.1	177.3	-66.4	0	0	0	108.2	D326 F333 K335 V348 F349 E364 W400 V413	D326-W362 HydrophobicContact CB-CH2 4.14Å; D326-W362 HydrophobicContact CB-CZ2 3.95Å; F333-W362 HydrophobicContact CB-CE3 4.35Å; F333-W362 HydrophobicContact CB-CZ3 4.11Å; K335-W362 HydrophobicContact CB-CD2 3.76Å; K335-W362 HydrophobicContact CB-CE3 3.87Å; K335-W362 HydrophobicContact CB-CG 4.32Å; K335-W362 HydrophobicContact CB-CH2 3.94Å; K335-W362 HydrophobicContact CB-CZ2 3.88Å; K335-W362 HydrophobicContact CB-CZ3 3.96Å; K335-W362 HydrophobicContact CD-CD2 4.34Å; K335-W362 HydrophobicContact CD-CG 4.45Å; K335-W362 HydrophobicContact CD-CZ2 4.06Å; K335-W362 HydrophobicContact CG-CD2 3.94Å; K335-W362 HydrophobicContact CG-CG 4.01Å; K335-W362 HydrophobicContact CG-CZ2 4.34Å; V348-W362 WeakPolarHBondContact CA-O 3.5Å; F349-W362 HydrophobicContact CB-CB 4.33Å; F349-W362 PolarHBondContact N-O 2.78Å; F349-W362 PolarHBondContact O-N 3.18Å; W362-E364 PolarHBondContact NE1-OE1 3.17Å; W362-W400 HydrophobicContact CE3-CH2 4.35Å; W362-W400 HydrophobicContact CE3-CZ2 4.34Å; W362-W400 HydrophobicContact CH2-CH2 4.27Å; W362-W400 AromaticContact CH2-CZ2 3.57Å; W362-W400 HydrophobicContact CH2-CZ2 3.57Å; W362-W400 AromaticContact CZ2-CZ2 3.96Å; W362-W400 HydrophobicContact CZ2-CZ2 3.96Å; W362-W400 AromaticContact CZ3-CH2 3.98Å; W362-W400 HydrophobicContact CZ3-CH2 3.98Å; W362-W400 AromaticContact CZ3-CZ2 3.75Å; W362-W400 HydrophobicContact CZ3-CZ2 3.75Å; W362-V413 HydrophobicContact CD2-CG1 3.81Å; W362-V413 HydrophobicContact CE3-CG1 4.43Å; W362-V413 HydrophobicContact CG-CG1 4.11Å; W362-V413 HydrophobicContact CZ2-CG1 4.03Å; W362-V413 HydrophobicContact CZ2-CG2 4.19Å
363	C	91.2	Very high	82.5	Confident	14 Å²	14	61.1 Å²	61.1	10%	0.095	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	124.3	-174.1	-65.6	0	0	0	0	110.5	V413 L414	C363-V413 CarbonylContact O-C 3.59Å; C363-V413 VanDerWaalsContact O-CA 3.3Å; C363-V413 WeakPolarHBondContact O-CA 3.23Å; C363-L414 HydrophobicContact CB-CB 4.25Å; C363-L414 HydrophobicContact CB-CD1 4.25Å; C363-L414 PolarHBondContact N-O 3.31Å; C363-L414 PolarHBondContact O-N 3.27Å
364	E	87.2	Confident	81.1	Confident	26 Å²	26	64.2 Å²	64.2	12%	0.121	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	114.3	179.7	-57.7	-170.9	147.9	0	0	110.9	K335 K346 T347 F349 W362 Y411 I412 V413	K335-E364 WeakPolarHBondContact CE-OE1 3.39Å; K335-E364 IonicContact NZ-OE1 3.76Å; K335-E364 PolarHBondContact NZ-OE1 3.36Å; K335-E364 IonicContact NZ-OE2 3.45Å; K335-E364 PolarHBondContact NZ-OE2 3.28Å; K346-E364 WeakPolarHBondContact CA-O 3Å; T347-E364 PolarHBondContact N-O 3.14Å; T347-E364 PolarHBondContact O-N 2.96Å; F349-E364 HydrophobicContact CD2-CG 4.29Å; F349-E364 HydrophobicContact CE2-CG 4.3Å; F349-E364 WeakPolarHBondContact CE2-OE2 3.46Å; W362-E364 PolarHBondContact NE1-OE1 3.17Å; E364-Y411 HydrophobicContact CB-CD2 4.19Å; E364-Y411 HydrophobicContact CG-CD2 4.19Å; E364-Y411 HydrophobicContact CG-CE2 4.24Å; E364-Y411 WeakPolarHBondContact OE1-CE2 3.09Å; E364-I412 WeakPolarHBondContact CA-O 3.39Å; E364-V413 HydrophobicContact CG-CG2 4.47Å
365	L	78.7	Confident	80	Confident	11 Å²	11	62.3 Å²	62.3	6%	0.058	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	128.4	173.7	-68.4	178	0	0	0	111.2	F345 K346 E367 F378 Y411 I412 L414 L486	F345-L365 WeakPolarHBondContact O-CA 3.26Å; K346-L365 HydrophobicContact CB-CD2 3.7Å; L365-E367 PolarHBondContact O-N 3.06Å; L365-F378 HydrophobicContact CD1-CD2 4.41Å; L365-F378 HydrophobicContact CD1-CE2 3.34Å; L365-F378 HydrophobicContact CD1-CZ 3.45Å; L365-F378 VanDerWaalsContact CD1-CZ 3.45Å; L365-Y411 WeakPolarHBondContact O-CA 3.46Å; L365-Y411 VanDerWaalsContact O-CB 3.28Å; L365-Y411 WeakPolarHBondContact O-CB 3.41Å; L365-I412 HydrophobicContact CB-CB 4.38Å; L365-I412 PolarHBondContact N-O 2.73Å; L365-I412 PolarHBondContact O-N 2.89Å; L365-L414 HydrophobicContact CD1-CD1 3.73Å; L365-L414 HydrophobicContact CG-CD1 3.77Å; L365-L486 HydrophobicContact CD1-CD2 4.47Å
366	Q	71.5	Confident	79	Confident	94 Å²	94	60 Å²	60	44%	0.439	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	118.5	-179.3	-62.5	-174.9	25.7	0	0	111.7	F345 S368	F345-Q366 PolarHBondContact O-N 3.48Å; Q366-S368 VanDerWaalsContact C-N 3.26Å; Q366-S368 PolarHBondContact O-N 3.4Å
367	E	64.5	Low	77.7	Confident	29 Å²	29	59.3 Å²	59.3	14%	0.136	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-70.4	-16.4	-174.4	-169.2	179.3	115.1	0	0	114.3	L365 K369 L370 R375 K410	L365-E367 PolarHBondContact O-N 3.06Å; E367-K369 PolarHBondContact O-N 3.46Å; E367-L370 PolarHBondContact O-N 2.85Å; E367-R375 IonicContact OE1-CZ 2.7Å; E367-R375 IonicContact OE1-NH1 2.73Å; E367-R375 PolarHBondContact OE1-NH1 2.66Å; E367-R375 IonicContact OE1-NH2 3.47Å; E367-R375 PolarHBondContact OE1-NH2 3.32Å; E367-R375 IonicContact OE2-CZ 3.49Å; E367-R375 IonicContact OE2-NH1 3.39Å; E367-R375 PolarHBondContact OE2-NH1 2.93Å; E367-R375 IonicContact OE2-NH2 2.67Å; E367-R375 PolarHBondContact OE2-NH2 3.31Å; E367-K410 HydrophobicContact CB-CB 4.39Å; E367-K410 WeakPolarHBondContact CB-O 3.45Å; E367-K410 HydrophobicContact CG-CB 4.47Å; E367-K410 WeakPolarHBondContact OE1-CB 3.4Å; E367-K410 WeakPolarHBondContact OE1-CD 3.11Å; E367-K410 WeakPolarHBondContact OE2-CB 3.44Å
368	S	59.3	Low	76.8	Confident	103 Å²	103	58.1 Å²	58.1	72%	0.72	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-62.3	-0.6	-173.7	54.1	0	0	0	0	115.7	Q366	Q366-S368 VanDerWaalsContact C-N 3.26Å; Q366-S368 PolarHBondContact O-N 3.4Å
369	K	59.3	Low	76	Confident	132 Å²	132	58.4 Å²	58.4	57%	0.574	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-124.4	8.8	174.7	-58.5	-179	-176.6	173.1	0	113.7	F345 E367	F345-K369 HydrophobicContact CD1-CD 3.85Å; F345-K369 HydrophobicContact CE1-CD 3.55Å; E367-K369 PolarHBondContact O-N 3.46Å
370	L	61.4	Low	75	Confident	49 Å²	49	59.8 Å²	59.8	26%	0.257	29%	0.293	S	S	.	.			trans	-117.7	112.9	-173.2	-81.9	161	0	0	0	112.8	E367 E374 I412	E367-L370 PolarHBondContact O-N 2.85Å; L370-E374 WeakPolarHBondContact CA-OE2 3.37Å; L370-E374 HydrophobicContact CD2-CB 3.87Å; L370-I412 HydrophobicContact CD1-CD1 4.41Å
371	N	66.7	Low	74	Confident	103 Å²	103	60.6 Å²	60.6	55%	0.551	30%	0.296	S	S	*	.			trans	-68.2	163.5	176.5	-67.9	-55.3	0	0	0	112.7	T373 E374 R375	N371-T373 VanDerWaalsContact C-N 3.28Å; N371-T373 PolarHBondContact O-N 3.28Å; N371-E374 HydrophobicContact CB-CG 4.29Å; N371-E374 WeakPolarHBondContact CB-OE2 3.43Å; N371-E374 PolarHBondContact N-OE2 2.86Å; N371-E374 PolarHBondContact ND2-OE1 3.42Å; N371-E374 PolarHBondContact ND2-OE2 3.03Å; N371-E374 PolarHBondContact O-N 3.21Å; N371-R375 PolarHBondContact O-N 2.79Å
372	K	74	Confident	73.3	Confident	182 Å²	182	60.4 Å²	60.4	79%	0.791	29%	0.294	S	S	*	.	H	α-helix	trans	-57.8	-37.8	-179.2	-166.9	178.6	-179.4	-175.6	0	113	Q376	K372-Q376 PolarHBondContact O-N 2.99Å
373	T	68.8	Low	72.8	Confident	97 Å²	97	64.8 Å²	64.8	60%	0.595	32%	0.315	S	S	*	.	H	α-helix	trans	-73.4	-43	178.4	-45.4	0	0	0	0	112.3	N371 R375 Q376 R377	N371-T373 VanDerWaalsContact C-N 3.28Å; N371-T373 PolarHBondContact O-N 3.28Å; T373-R375 VanDerWaalsContact C-N 3.29Å; T373-R375 PolarHBondContact O-N 3.46Å; T373-Q376 PolarHBondContact O-N 2.85Å; T373-Q376 VanDerWaalsContact O-N 3.14Å; T373-R377 PolarHBondContact O-N 3.21Å
374	E	67.6	Low	72.3	Confident	68 Å²	68	66.3 Å²	66.3	32%	0.318	32%	0.321	S	S	.	.	H	α-helix	trans	-61.7	-40.3	176.5	-68	154.8	-165.9	0	0	110.6	L370 N371 Q376 R377 F378	L370-E374 WeakPolarHBondContact CA-OE2 3.37Å; L370-E374 HydrophobicContact CD2-CB 3.87Å; N371-E374 HydrophobicContact CB-CG 4.29Å; N371-E374 WeakPolarHBondContact CB-OE2 3.43Å; N371-E374 PolarHBondContact N-OE2 2.86Å; N371-E374 PolarHBondContact ND2-OE1 3.42Å; N371-E374 PolarHBondContact ND2-OE2 3.03Å; N371-E374 PolarHBondContact O-N 3.21Å; E374-Q376 PolarHBondContact O-N 2.93Å; E374-R377 PolarHBondContact O-N 2.74Å; E374-F378 WeakPolarHBondContact O-CB 3.43Å; E374-F378 PolarHBondContact O-N 2.9Å
375	R	71.9	Confident	72.1	Confident	32 Å²	32	65.3 Å²	65.3	12%	0.121	32%	0.317	C	S	.	.	H	α-helix	trans	-64.8	-35.1	173.8	-160.9	-168.9	-36.9	-149.6	-12.2	113.5	E367 N371 T373 F378 R379 E401 I412	E367-R375 IonicContact OE1-CZ 2.7Å; E367-R375 IonicContact OE1-NH1 2.73Å; E367-R375 PolarHBondContact OE1-NH1 2.66Å; E367-R375 IonicContact OE1-NH2 3.47Å; E367-R375 PolarHBondContact OE1-NH2 3.32Å; E367-R375 IonicContact OE2-CZ 3.49Å; E367-R375 IonicContact OE2-NH1 3.39Å; E367-R375 PolarHBondContact OE2-NH1 2.93Å; E367-R375 IonicContact OE2-NH2 2.67Å; E367-R375 PolarHBondContact OE2-NH2 3.31Å; N371-R375 PolarHBondContact O-N 2.79Å; T373-R375 VanDerWaalsContact C-N 3.29Å; T373-R375 PolarHBondContact O-N 3.46Å; R375-F378 PolarHBondContact O-N 2.96Å; R375-R379 WeakPolarHBondContact O-CG 3.4Å; R375-R379 PolarHBondContact O-N 2.92Å; R375-E401 WeakPolarHBondContact CD-OE1 3.44Å; R375-E401 WeakPolarHBondContact CD-OE2 3.43Å; R375-E401 IonicContact CZ-OE2 2.83Å; R375-E401 IonicContact NE-OE2 2.65Å; R375-E401 IonicContact NH1-OE2 3.75Å; R375-E401 PolarHBondContact NH1-OE2 3.3Å; R375-I412 HydrophobicContact CG-CD1 4.24Å
376	Q	74	Confident	72.5	Confident	82 Å²	82	66.5 Å²	66.5	38%	0.383	32%	0.321	S	S	.	.	H	α-helix	trans	-66.6	-44.8	175	176.9	56.5	30.7	0	0	111	K372 T373 E374 F378 R379 E380	K372-Q376 PolarHBondContact O-N 2.99Å; T373-Q376 PolarHBondContact O-N 2.85Å; T373-Q376 VanDerWaalsContact O-N 3.14Å; E374-Q376 PolarHBondContact O-N 2.93Å; Q376-F378 PolarHBondContact O-N 3.37Å; Q376-R379 PolarHBondContact O-N 2.92Å; Q376-E380 PolarHBondContact NE2-OE1 2.78Å; Q376-E380 PolarHBondContact O-N 2.98Å; Q376-E380 VanDerWaalsContact O-N 3.13Å
377	R	67.9	Low	73.1	Confident	67 Å²	67	68.6 Å²	68.6	25%	0.253	34%	0.336	S	S	.	.	H	α-helix	trans	-57.3	-48.3	171.7	-72.7	175.8	171.8	159.7	-4.4	111.5	T373 E374 R379 E380 E381 K492 F494	T373-R377 PolarHBondContact O-N 3.21Å; E374-R377 PolarHBondContact O-N 2.74Å; R377-R379 VanDerWaalsContact C-N 3.26Å; R377-R379 PolarHBondContact O-N 2.96Å; R377-E380 PolarHBondContact O-N 2.72Å; R377-E381 WeakPolarHBondContact O-CB 3.34Å; R377-E381 PolarHBondContact O-N 2.86Å; R377-K492 PolarHBondContact NE-O 3.49Å; R377-K492 PolarHBondContact NH2-O 2.98Å; R377-F494 PolarHBondContact NH1-O 2.84Å
378	F	73.9	Confident	74.2	Confident	16 Å²	16	67.6 Å²	67.6	7%	0.07	33%	0.331	C	S	.	.	H	α-helix	trans	-54.9	-39.5	177.3	-169.9	-78.1	0	0	0	112.6	L365 E374 R375 Q376 A382 I412 L414 G485	L365-F378 HydrophobicContact CD1-CD2 4.41Å; L365-F378 HydrophobicContact CD1-CE2 3.34Å; L365-F378 HydrophobicContact CD1-CZ 3.45Å; L365-F378 VanDerWaalsContact CD1-CZ 3.45Å; E374-F378 WeakPolarHBondContact O-CB 3.43Å; E374-F378 PolarHBondContact O-N 2.9Å; R375-F378 PolarHBondContact O-N 2.96Å; Q376-F378 PolarHBondContact O-N 3.37Å; F378-A382 HydrophobicContact CD1-CB 4.16Å; F378-A382 HydrophobicContact CE1-CB 3.84Å; F378-A382 WeakPolarHBondContact O-CB 3.45Å; F378-A382 PolarHBondContact O-N 3.13Å; F378-I412 HydrophobicContact CD1-CD1 3.63Å; F378-I412 HydrophobicContact CD1-CG2 4.21Å; F378-I412 HydrophobicContact CD2-CD1 4.49Å; F378-I412 HydrophobicContact CE1-CB 4.39Å; F378-I412 HydrophobicContact CE1-CD1 3.92Å; F378-I412 HydrophobicContact CE1-CG2 3.64Å; F378-I412 HydrophobicContact CG-CD1 3.97Å; F378-I412 HydrophobicContact CZ-CD1 4.43Å; F378-I412 HydrophobicContact CZ-CG2 4.33Å; F378-L414 HydrophobicContact CZ-CD1 4.18Å; F378-L414 HydrophobicContact CZ-CD2 3.82Å; F378-L414 HydrophobicContact CZ-CG 4.14Å; F378-G485 WeakPolarHBondContact CE2-O 3.5Å
379	R	77.2	Confident	75.8	Confident	77 Å²	77	69 Å²	69	29%	0.291	33%	0.327	S	S	.	.	H	α-helix	trans	-67.9	-42	175.5	-72.8	-170.3	-64.6	-115.5	1.7	112.8	R375 Q376 R377 E381 E383 Y399 E401	R375-R379 WeakPolarHBondContact O-CG 3.4Å; R375-R379 PolarHBondContact O-N 2.92Å; Q376-R379 PolarHBondContact O-N 2.92Å; R377-R379 VanDerWaalsContact C-N 3.26Å; R377-R379 PolarHBondContact O-N 2.96Å; R379-E381 VanDerWaalsContact C-N 3.32Å; R379-E383 WeakPolarHBondContact O-CB 3.49Å; R379-E383 PolarHBondContact O-N 2.99Å; R379-Y399 HydrophobicContact CB-CE2 4.48Å; R379-Y399 WeakPolarHBondContact CB-OH 3.43Å; R379-Y399 HydrophobicContact CG-CE2 3.96Å; R379-Y399 PolarHBondContact O-OH 3.48Å; R379-E401 IonicContact CZ-OE1 2.86Å; R379-E401 IonicContact NH1-OE1 3.55Å; R379-E401 PolarHBondContact NH1-OE1 3.02Å; R379-E401 IonicContact NH1-OE2 3.06Å
380	E	75.4	Confident	77.5	Confident	67 Å²	67	64.8 Å²	64.8	31%	0.313	31%	0.309	S	S	.	.	H	α-helix	trans	-65.2	-36.8	176	-70.2	174	-138.6	0	0	111.9	Q376 R377 M384 K492	Q376-E380 PolarHBondContact NE2-OE1 2.78Å; Q376-E380 PolarHBondContact O-N 2.98Å; Q376-E380 VanDerWaalsContact O-N 3.13Å; R377-E380 PolarHBondContact O-N 2.72Å; E380-M384 PolarHBondContact O-N 2.71Å; E380-K492 IonicContact OE2-NZ 2.72Å; E380-K492 PolarHBondContact OE2-NZ 3.13Å
381	E	74.8	Confident	79.1	Confident	17 Å²	17	66.9 Å²	66.9	8%	0.079	33%	0.325	C	S	.	.	H	α-helix	trans	-71.3	-54.1	176	-81.1	148.3	-172.4	0	0	111.7	R377 R379 E383 M384 L385 T488 L489	R377-E381 WeakPolarHBondContact O-CB 3.34Å; R377-E381 PolarHBondContact O-N 2.86Å; R379-E381 VanDerWaalsContact C-N 3.32Å; E381-E383 VanDerWaalsContact C-N 3.26Å; E381-E383 PolarHBondContact O-N 3.39Å; E381-M384 WeakPolarHBondContact O-CB 3.47Å; E381-M384 PolarHBondContact O-N 2.94Å; E381-L385 WeakPolarHBondContact O-CG 3.4Å; E381-L385 PolarHBondContact O-N 3.29Å; E381-T488 VanDerWaalsContact CD-CA 3.49Å; E381-T488 VanDerWaalsContact OE1-CA 3.3Å; E381-T488 WeakPolarHBondContact OE1-CA 3.48Å; E381-T488 WeakPolarHBondContact OE1-CB 3.46Å; E381-L489 HydrophobicContact CG-CD1 4.1Å; E381-L489 HydrophobicContact CG-CD2 4.23Å; E381-L489 HydrophobicContact CG-CG 3.65Å; E381-L489 PolarHBondContact OE1-N 3.37Å
382	A	80.9	Confident	80.5	Confident	2 Å²	2	62.5 Å²	62.5	2%	0.017	30%	0.302	C	S	.	.	H	α-helix	trans	-66.4	-23.9	-178	0	0	0	0	0	113.6	F378 F396 Y399	F378-A382 HydrophobicContact CD1-CB 4.16Å; F378-A382 HydrophobicContact CE1-CB 3.84Å; F378-A382 WeakPolarHBondContact O-CB 3.45Å; F378-A382 PolarHBondContact O-N 3.13Å; A382-F396 HydrophobicContact CB-CZ 4.17Å; A382-F396 WeakPolarHBondContact O-CE1 3.34Å; A382-Y399 VanDerWaalsContact C-CE1 3.47Å; A382-Y399 HydrophobicContact CB-CD1 3.35Å; A382-Y399 HydrophobicContact CB-CD2 4.17Å; A382-Y399 HydrophobicContact CB-CE1 3.63Å; A382-Y399 HydrophobicContact CB-CE2 4.44Å; A382-Y399 HydrophobicContact CB-CG 3.67Å; A382-Y399 WeakPolarHBondContact O-CD1 3.44Å
383	E	82.3	Confident	81.5	Confident	92 Å²	92	54 Å²	54	43%	0.43	27%	0.265	S	S	.	.	H	α-helix	trans	-70.4	-43.2	169.6	-157.7	67.8	-150.9	0	0	110.8	R379 E381 L385 K386 Y399	R379-E383 WeakPolarHBondContact O-CB 3.49Å; R379-E383 PolarHBondContact O-N 2.99Å; E381-E383 VanDerWaalsContact C-N 3.26Å; E381-E383 PolarHBondContact O-N 3.39Å; E383-L385 VanDerWaalsContact C-N 3.3Å; E383-L385 PolarHBondContact O-N 3.33Å; E383-K386 WeakPolarHBondContact O-CB 2.76Å; E383-K386 PolarHBondContact O-N 2.77Å; E383-K386 WeakPolarHBondContact OE1-CD 3.33Å; E383-K386 IonicContact OE1-NZ 3.18Å; E383-K386 PolarHBondContact OE1-NZ 2.91Å; E383-K386 IonicContact OE2-NZ 2.71Å; E383-K386 PolarHBondContact OE2-NZ 3.06Å; E383-Y399 HydrophobicContact CB-CE1 4.2Å; E383-Y399 WeakPolarHBondContact OE2-CE1 3.49Å; E383-Y399 PolarHBondContact OE2-OH 3.27Å
384	M	80.4	Confident	82.7	Confident	46 Å²	46	50.1 Å²	50.1	23%	0.227	24%	0.241	C	C	.	.	H	α-helix	trans	-62.9	-35.3	174.8	-170.5	-173.7	-55.1	0	0	112.5	E380 E381 K386 D387 P458 V460 L489	E380-M384 PolarHBondContact O-N 2.71Å; E381-M384 WeakPolarHBondContact O-CB 3.47Å; E381-M384 PolarHBondContact O-N 2.94Å; M384-K386 PolarHBondContact O-N 3.07Å; M384-D387 PolarHBondContact O-N 3.21Å; M384-P458 HydrophobicContact CE-CG 3.85Å; M384-V460 HydrophobicContact SD-CG2 3.8Å; M384-L489 HydrophobicContact CE-CD1 3.54Å; M384-L489 HydrophobicContact CE-CD2 3.62Å; M384-L489 HydrophobicContact CE-CG 4.23Å; M384-L489 HydrophobicContact SD-CD2 3.68Å
385	L	83.2	Confident	83.9	Confident	6 Å²	6	49.4 Å²	49.4	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-59.7	-31.9	176.7	-64.5	-178.6	0	0	0	112.3	E381 E383 D387 L388 F396 L484	E381-L385 WeakPolarHBondContact O-CG 3.4Å; E381-L385 PolarHBondContact O-N 3.29Å; E383-L385 VanDerWaalsContact C-N 3.3Å; E383-L385 PolarHBondContact O-N 3.33Å; L385-D387 PolarHBondContact O-N 3.24Å; L385-L388 HydrophobicContact CD2-CD1 3.58Å; L385-L388 WeakPolarHBondContact O-CB 3.47Å; L385-L388 PolarHBondContact O-N 3.31Å; L385-L388 VanDerWaalsContact O-N 3.09Å; L385-F396 HydrophobicContact CB-CB 4.15Å; L385-F396 HydrophobicContact CB-CD1 3.77Å; L385-F396 HydrophobicContact CB-CD2 4Å; L385-F396 HydrophobicContact CB-CE1 4.09Å; L385-F396 HydrophobicContact CB-CE2 4.31Å; L385-F396 HydrophobicContact CB-CG 3.72Å; L385-F396 HydrophobicContact CB-CZ 4.34Å; L385-F396 HydrophobicContact CD1-CD2 4.11Å; L385-F396 HydrophobicContact CD1-CE2 3.92Å; L385-F396 HydrophobicContact CD1-CZ 4.3Å; L385-F396 WeakPolarHBondContact O-CB 3.5Å; L385-L484 HydrophobicContact CD1-CB 4.42Å; L385-L484 WeakPolarHBondContact CD1-O 3.35Å; L385-L484 HydrophobicContact CD2-CB 3.94Å
386	K	87	Confident	84.9	Confident	35 Å²	35	48.4 Å²	48.4	15%	0.152	23%	0.232	C	C	.	.	H	α-helix	trans	-59.5	-30	178.1	-67.9	170.1	171.4	171.1	0	113.3	E383 M384 R395 F396 D398	E383-K386 WeakPolarHBondContact O-CB 2.76Å; E383-K386 PolarHBondContact O-N 2.77Å; E383-K386 WeakPolarHBondContact OE1-CD 3.33Å; E383-K386 IonicContact OE1-NZ 3.18Å; E383-K386 PolarHBondContact OE1-NZ 2.91Å; E383-K386 IonicContact OE2-NZ 2.71Å; E383-K386 PolarHBondContact OE2-NZ 3.06Å; M384-K386 PolarHBondContact O-N 3.07Å; K386-R395 PolarHBondContact O-NH1 2.78Å; K386-R395 PolarHBondContact O-NH2 3.06Å; K386-F396 HydrophobicContact CG-CD1 3.87Å; K386-F396 HydrophobicContact CG-CE1 4.05Å; K386-D398 WeakPolarHBondContact CE-OD1 3.41Å; K386-D398 IonicContact NZ-OD1 3.93Å; K386-D398 PolarHBondContact NZ-OD1 2.72Å
387	D	84.8	Confident	85.7	Confident	139 Å²	139	47.5 Å²	47.5	74%	0.743	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-5.1	-179.5	-67.8	-26.1	0	0	0	113.1	M384 L385 Q389	M384-D387 PolarHBondContact O-N 3.21Å; L385-D387 PolarHBondContact O-N 3.24Å; D387-Q389 PolarHBondContact O-N 2.94Å; D387-Q389 VanDerWaalsContact O-N 3.08Å
388	L	88.2	Confident	86.9	Confident	7 Å²	7	45.7 Å²	45.7	4%	0.037	22%	0.221	C	C	.	.			trans	-74.9	101.3	177.8	-58.8	-174.8	0	0	0	111.5	L385 R395 F452 L453 R456 L484	L385-L388 HydrophobicContact CD2-CD1 3.58Å; L385-L388 WeakPolarHBondContact O-CB 3.47Å; L385-L388 PolarHBondContact O-N 3.31Å; L385-L388 VanDerWaalsContact O-N 3.09Å; L388-R395 PolarHBondContact O-NH1 3.11Å; L388-F452 HydrophobicContact CB-CE1 4.11Å; L388-F452 HydrophobicContact CD2-CE1 3.86Å; L388-F452 HydrophobicContact CD2-CZ 4.22Å; L388-F452 HydrophobicContact CG-CE1 4.49Å; L388-L453 HydrophobicContact CD1-CD2 3.81Å; L388-R456 HydrophobicContact CD2-CG 3.79Å; L388-L484 HydrophobicContact CD1-CD1 4.18Å
389	Q	92.8	Very high	87.6	Confident	134 Å²	134	46.4 Å²	46.4	63%	0.626	22%	0.223	S	C	*	.			trans	-117.9	115.1	168.6	-63.5	-166.6	28.9	0	0	110.7	D387 R395 F452	D387-Q389 PolarHBondContact O-N 2.94Å; D387-Q389 VanDerWaalsContact O-N 3.08Å; Q389-R395 VanDerWaalsContact CG-CZ 3.47Å; Q389-F452 WeakPolarHBondContact O-CE2 3.34Å; Q389-F452 WeakPolarHBondContact O-CZ 3.47Å
390	H	95.3	Very high	88.2	Confident	43 Å²	43	43.4 Å²	43.4	20%	0.199	21%	0.212	C	C	.	.			trans	-155	139	173.9	-179.3	-99	0	0	0	109.1	N392 I393 F452	H390-N392 PolarHBondContact ND1-N 3.22Å; H390-N392 PolarHBondContact O-N 3.3Å; H390-I393 HydrophobicContact CB-CB 4.21Å; H390-I393 HydrophobicContact CB-CG1 3.85Å; H390-I393 PolarHBondContact O-N 2.95Å; H390-F452 HydrophobicContact CB-CB 4.33Å; 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 4.02Å; H390-F452 HydrophobicContact CB-CG 3.66Å; H390-F452 HydrophobicContact CB-CZ 3.96Å; H390-F452 AromaticContact CD2-CD2 3.82Å; H390-F452 AromaticContact CD2-CG 3.82Å; H390-F452 AromaticContact CG-CG 3.7Å
391	P	94.5	Very high	88.7	Confident	92 Å²	92	42.4 Å²	42.4	60%	0.597	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.5	-175.2	21.8	-35.4	0	0	0	114.7	K480	P391-K480 WeakPolarHBondContact O-CE 3.46Å; P391-K480 WeakPolarHBondContact O-CG 3.35Å
392	N	96.3	Very high	89.2	Confident	11 Å²	11	42.8 Å²	42.8	6%	0.059	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	19.1	176.8	-53.4	115	0	0	0	114.2	H390 Q445 V479 K480 I481	H390-N392 PolarHBondContact ND1-N 3.22Å; H390-N392 PolarHBondContact O-N 3.3Å; N392-Q445 VanDerWaalsContact CB-O 3.25Å; N392-Q445 WeakPolarHBondContact CB-O 3.3Å; N392-Q445 WeakPolarHBondContact ND2-CB 3.39Å; N392-Q445 WeakPolarHBondContact ND2-CG 3.28Å; N392-Q445 PolarHBondContact ND2-OE1 2.72Å; N392-V479 WeakPolarHBondContact CA-O 3.47Å; N392-V479 WeakPolarHBondContact CB-O 3.48Å; N392-V479 PolarHBondContact ND2-O 3.28Å; N392-K480 WeakPolarHBondContact O-CA 3.39Å; N392-I481 PolarHBondContact O-N 2.78Å
393	I	95.1	Very high	89.3	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.015	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-120	139.1	170.5	-59.3	-61.4	0	0	0	108.3	H390 R395 F452 L453 I481 L484	H390-I393 HydrophobicContact CB-CB 4.21Å; H390-I393 HydrophobicContact CB-CG1 3.85Å; H390-I393 PolarHBondContact O-N 2.95Å; I393-R395 PolarHBondContact O-N 3.06Å; I393-F452 HydrophobicContact CG1-CD1 4.05Å; I393-F452 HydrophobicContact CG1-CE1 4.5Å; I393-L453 HydrophobicContact CD1-CD1 3.82Å; I393-L453 HydrophobicContact CD1-CD2 4.16Å; I393-L453 HydrophobicContact CD1-CG 3.93Å; I393-I481 HydrophobicContact CD1-CB 3.98Å; I393-I481 HydrophobicContact CD1-CD1 4.23Å; I393-I481 HydrophobicContact CD1-CG1 4.4Å; I393-L484 HydrophobicContact CG2-CD1 3.57Å
394	V	93.4	Very high	89	Confident	16 Å²	16	42.9 Å²	42.9	10%	0.097	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-67.5	123.9	173.1	176.9	0	0	0	0	108.5	F396 E417 M419 F471 K480 I481	V394-F396 PolarHBondContact O-N 3.37Å; V394-E417 HydrophobicContact CG1-CB 3.92Å; V394-M419 HydrophobicContact CG1-CG 4.25Å; V394-M419 HydrophobicContact CG2-CG 3.86Å; V394-M419 HydrophobicContact CG2-SD 4.07Å; V394-F471 HydrophobicContact CG2-CD2 3.91Å; V394-F471 HydrophobicContact CG2-CG 4.49Å; V394-K480 HydrophobicContact CG2-CB 3.7Å; V394-I481 PolarHBondContact N-O 2.83Å
395	R	93	Very high	88.5	Confident	53 Å²	53	50 Å²	50	20%	0.2	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-63.4	125.2	-174.6	-177.5	70.1	-170.9	118.7	11.3	111	K386 L388 Q389 I393 Y397 T416 E417	K386-R395 PolarHBondContact O-NH1 2.78Å; K386-R395 PolarHBondContact O-NH2 3.06Å; L388-R395 PolarHBondContact O-NH1 3.11Å; Q389-R395 VanDerWaalsContact CG-CZ 3.47Å; I393-R395 PolarHBondContact O-N 3.06Å; R395-Y397 HydrophobicContact CB-CE1 4.39Å; R395-Y397 HydrophobicContact CG-CD1 3.92Å; R395-Y397 HydrophobicContact CG-CE1 3.52Å; R395-T416 CarbonylContact O-C 3.54Å; R395-T416 VanDerWaalsContact O-CA 3.25Å; R395-T416 WeakPolarHBondContact O-CA 3.5Å; R395-T416 WeakPolarHBondContact O-CB 3.16Å; R395-E417 HydrophobicContact CB-CB 3.98Å; R395-E417 PolarHBondContact N-OE2 2.96Å; R395-E417 VanDerWaalsContact N-OE2 3.11Å; R395-E417 PolarHBondContact O-N 3.33Å
396	F	91.7	Very high	88	Confident	12 Å²	12	53.4 Å²	53.4	5%	0.053	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	132	166.6	-160.3	-94.2	0	0	0	109.2	A382 L385 K386 V394 Y399 L414 T416	A382-F396 HydrophobicContact CB-CZ 4.17Å; A382-F396 WeakPolarHBondContact O-CE1 3.34Å; L385-F396 HydrophobicContact CB-CB 4.15Å; L385-F396 HydrophobicContact CB-CD1 3.77Å; L385-F396 HydrophobicContact CB-CD2 4Å; L385-F396 HydrophobicContact CB-CE1 4.09Å; L385-F396 HydrophobicContact CB-CE2 4.31Å; L385-F396 HydrophobicContact CB-CG 3.72Å; L385-F396 HydrophobicContact CB-CZ 4.34Å; L385-F396 HydrophobicContact CD1-CD2 4.11Å; L385-F396 HydrophobicContact CD1-CE2 3.92Å; L385-F396 HydrophobicContact CD1-CZ 4.3Å; L385-F396 WeakPolarHBondContact O-CB 3.5Å; K386-F396 HydrophobicContact CG-CD1 3.87Å; K386-F396 HydrophobicContact CG-CE1 4.05Å; V394-F396 PolarHBondContact O-N 3.37Å; F396-Y399 HydrophobicContact CE1-CD1 4.29Å; F396-L414 HydrophobicContact CE2-CB 3.94Å; F396-L414 HydrophobicContact CE2-CD2 3.68Å; F396-L414 HydrophobicContact CE2-CG 4.3Å; F396-L414 HydrophobicContact CZ-CB 4.05Å; F396-L414 HydrophobicContact CZ-CD2 4Å; F396-L414 HydrophobicContact CZ-CG 4.29Å; F396-T416 HydrophobicContact CD2-CG2 3.77Å; F396-T416 HydrophobicContact CE2-CG2 4.24Å
397	Y	92.4	Very high	87.1	Confident	62 Å²	62	54.4 Å²	54.4	24%	0.243	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-54.9	-177.6	-65.2	-65.4	0	0	0	112.5	V360 R395 V415 E417	V360-Y397 HydrophobicContact CG1-CD2 4Å; V360-Y397 HydrophobicContact CG1-CE2 3.72Å; R395-Y397 HydrophobicContact CB-CE1 4.39Å; R395-Y397 HydrophobicContact CG-CD1 3.92Å; R395-Y397 HydrophobicContact CG-CE1 3.52Å; Y397-V415 HydrophobicContact CD2-CG1 4.18Å; Y397-V415 PolarHBondContact N-O 2.96Å; Y397-E417 HydrophobicContact CE2-CB 4.23Å
398	D	91.7	Very high	86.5	Confident	29 Å²	29	55.8 Å²	55.8	16%	0.155	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	166.8	-175	-161.1	8.5	0	0	0	111.4	F333 K386 W400 V415	F333-D398 HydrophobicContact CD2-CB 4.5Å; F333-D398 HydrophobicContact CE2-CB 3.66Å; F333-D398 HydrophobicContact CZ-CB 4.32Å; K386-D398 WeakPolarHBondContact CE-OD1 3.41Å; K386-D398 IonicContact NZ-OD1 3.93Å; K386-D398 PolarHBondContact NZ-OD1 2.72Å; D398-W400 HydrophobicContact CB-CZ3 4.26Å; D398-V415 PolarHBondContact O-N 3.02Å
399	Y	89.3	Confident	85.7	Confident	32 Å²	32	64 Å²	64	13%	0.125	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	155.4	170.3	83.6	-89.9	0	0	0	111.5	R379 A382 E383 F396 I412 V413	R379-Y399 HydrophobicContact CB-CE2 4.48Å; R379-Y399 WeakPolarHBondContact CB-OH 3.43Å; R379-Y399 HydrophobicContact CG-CE2 3.96Å; R379-Y399 PolarHBondContact O-OH 3.48Å; A382-Y399 VanDerWaalsContact C-CE1 3.47Å; A382-Y399 HydrophobicContact CB-CD1 3.35Å; A382-Y399 HydrophobicContact CB-CD2 4.17Å; A382-Y399 HydrophobicContact CB-CE1 3.63Å; A382-Y399 HydrophobicContact CB-CE2 4.44Å; A382-Y399 HydrophobicContact CB-CG 3.67Å; A382-Y399 WeakPolarHBondContact O-CD1 3.44Å; E383-Y399 HydrophobicContact CB-CE1 4.2Å; E383-Y399 WeakPolarHBondContact OE2-CE1 3.49Å; E383-Y399 PolarHBondContact OE2-OH 3.27Å; F396-Y399 HydrophobicContact CE1-CD1 4.29Å; Y399-I412 HydrophobicContact CD2-CG2 4.28Å; Y399-V413 CarbonylContact C-O 3.58Å; Y399-V413 WeakPolarHBondContact CA-O 3.48Å; Y399-V413 VanDerWaalsContact CB-O 3.3Å; Y399-V413 WeakPolarHBondContact CB-O 3.48Å
400	W	88.8	Confident	85	Confident	14 Å²	14	62.9 Å²	62.9	5%	0.053	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	150.1	169	58.1	88.8	0	0	0	112.9	K329 F333 W362 D398 V413 V415	K329-W400 HydrophobicContact CD-CB 4.24Å; K329-W400 HydrophobicContact CD-CG 4.39Å; K329-W400 HydrophobicContact CG-CG 4.41Å; F333-W400 HydrophobicContact CB-CH2 4.28Å; F333-W400 HydrophobicContact CD2-CH2 4.07Å; F333-W400 AromaticContact CD2-CZ3 3.92Å; F333-W400 HydrophobicContact CD2-CZ3 3.92Å; W362-W400 HydrophobicContact CE3-CH2 4.35Å; W362-W400 HydrophobicContact CE3-CZ2 4.34Å; W362-W400 HydrophobicContact CH2-CH2 4.27Å; W362-W400 AromaticContact CH2-CZ2 3.57Å; W362-W400 HydrophobicContact CH2-CZ2 3.57Å; W362-W400 AromaticContact CZ2-CZ2 3.96Å; W362-W400 HydrophobicContact CZ2-CZ2 3.96Å; W362-W400 AromaticContact CZ3-CH2 3.98Å; W362-W400 HydrophobicContact CZ3-CH2 3.98Å; W362-W400 AromaticContact CZ3-CZ2 3.75Å; W362-W400 HydrophobicContact CZ3-CZ2 3.75Å; D398-W400 HydrophobicContact CB-CZ3 4.26Å; W400-V413 HydrophobicContact CD2-CB 4.19Å; W400-V413 HydrophobicContact CH2-CB 4.46Å; W400-V413 HydrophobicContact CH2-CG1 3.82Å; W400-V413 HydrophobicContact CZ2-CB 3.81Å; W400-V413 HydrophobicContact CZ2-CG1 3.46Å; W400-V413 VanDerWaalsContact CZ2-CG1 3.46Å; W400-V413 HydrophobicContact CZ2-CG2 4.27Å; W400-V413 PolarHBondContact N-O 2.98Å; W400-V413 PolarHBondContact O-N 3.49Å; W400-V415 HydrophobicContact CH2-CG2 3.4Å; W400-V415 VanDerWaalsContact CH2-CG2 3.4Å; W400-V415 HydrophobicContact CZ3-CG2 3.6Å
401	E	86.5	Confident	84.3	Confident	45 Å²	45	62.7 Å²	62.7	21%	0.21	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	128.1	162.2	-78.3	170.8	-110.5	0	0	110.3	K329 R375 R379 I412	K329-E401 WeakPolarHBondContact CE-O 3.5Å; K329-E401 PolarHBondContact NZ-O 3.49Å; R375-E401 WeakPolarHBondContact CD-OE1 3.44Å; R375-E401 WeakPolarHBondContact CD-OE2 3.43Å; R375-E401 IonicContact CZ-OE2 2.83Å; R375-E401 IonicContact NE-OE2 2.65Å; R375-E401 IonicContact NH1-OE2 3.75Å; R375-E401 PolarHBondContact NH1-OE2 3.3Å; R379-E401 IonicContact CZ-OE1 2.86Å; R379-E401 IonicContact NH1-OE1 3.55Å; R379-E401 PolarHBondContact NH1-OE1 3.02Å; R379-E401 IonicContact NH1-OE2 3.06Å; E401-I412 HydrophobicContact CG-CG1 4.24Å
402	S	86.6	Confident	83.8	Confident	26 Å²	26	58.4 Å²	58.4	18%	0.182	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	172.6	171.8	-162.9	0	0	0	0	110.6	K410 Y411	S402-K410 VanDerWaalsContact O-CA 3.28Å; S402-K410 WeakPolarHBondContact O-CA 3.23Å; S402-Y411 PolarHBondContact N-O 3.32Å; S402-Y411 PolarHBondContact O-N 2.97Å; S402-Y411 PolarHBondContact OG-OH 2.98Å
403	A	81.7	Confident	83.5	Confident	45 Å²	45	57.9 Å²	57.9	37%	0.372	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	149	173	0	0	0	0	0	110.4	R409 K410	A403-R409 CarbonylContact C-O 3.09Å; A403-R409 WeakPolarHBondContact CA-O 3.43Å; A403-K410 HydrophobicContact CB-CG 4.16Å
404	D	76.8	Confident	83.2	Confident	50 Å²	50	58.1 Å²	58.1	27%	0.267	30%	0.295	S	S	.	.			trans	-62.3	159.6	172.9	67.1	-1.6	0	0	0	111.3	C406 G407 K408 R409	D404-C406 PolarHBondContact O-N 3.36Å; D404-G407 PolarHBondContact O-N 3.37Å; D404-G407 PolarHBondContact OD1-N 3.21Å; D404-K408 PolarHBondContact OD1-N 3.1Å; D404-R409 HydrophobicContact CB-CB 4.4Å; D404-R409 VanDerWaalsContact CG-N 3.28Å; D404-R409 PolarHBondContact N-O 3.43Å; D404-R409 PolarHBondContact OD1-N 3.26Å; D404-R409 WeakPolarHBondContact OD2-CB 3.43Å; D404-R409 PolarHBondContact OD2-N 3.13Å
405	L	70.2	Confident	83.2	Confident	195 Å²	195	57.4 Å²	57.4	100%	1.021	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-8.5	-179.3	-65.2	170.5	0	0	0	113.9
406	C	71.3	Confident	83.2	Confident	78 Å²	78	56.1 Å²	56.1	53%	0.527	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-5.3	177.4	-148.6	0	0	0	0	113.3	D404 K408	D404-C406 PolarHBondContact O-N 3.36Å; C406-K408 HydrophobicContact CB-CD 4.15Å; C406-K408 HydrophobicContact CB-CG 4.34Å; C406-K408 PolarHBondContact O-N 3.4Å; C406-K408 WeakPolarHBondContact SG-CE 3.33Å; C406-K408 PolarHBondContact SG-NZ 3.16Å
407	G	69.7	Low	83.3	Confident	57 Å²	57	57.6 Å²	57.6	59%	0.588	30%	0.295	S	S	*	.	S	Bend	trans	67.4	11.5	-176.7	0	0	0	0	0	115	D404	D404-G407 PolarHBondContact O-N 3.37Å; D404-G407 PolarHBondContact OD1-N 3.21Å
408	K	70.5	Confident	83.4	Confident	168 Å²	168	55.8 Å²	55.8	73%	0.73	29%	0.29	S	S	*	.	S	Bend	trans	-98.5	-27.6	-171.1	-72.3	171.8	-172.5	164.7	0	113.1	D404 C406	D404-K408 PolarHBondContact OD1-N 3.1Å; C406-K408 HydrophobicContact CB-CD 4.15Å; C406-K408 HydrophobicContact CB-CG 4.34Å; C406-K408 PolarHBondContact O-N 3.4Å; C406-K408 WeakPolarHBondContact SG-CE 3.33Å; C406-K408 PolarHBondContact SG-NZ 3.16Å
409	R	72.6	Confident	83.4	Confident	180 Å²	180	55.1 Å²	55.1	68%	0.679	29%	0.286	S	S	*	.			trans	-122.7	112.3	172.2	-67.2	-178.2	171.1	-173	-1.8	109.8	A403 D404	A403-R409 CarbonylContact C-O 3.09Å; A403-R409 WeakPolarHBondContact CA-O 3.43Å; D404-R409 HydrophobicContact CB-CB 4.4Å; D404-R409 VanDerWaalsContact CG-N 3.28Å; D404-R409 PolarHBondContact N-O 3.43Å; D404-R409 PolarHBondContact OD1-N 3.26Å; D404-R409 WeakPolarHBondContact OD2-CB 3.43Å; D404-R409 PolarHBondContact OD2-N 3.13Å
410	K	77	Confident	83.4	Confident	110 Å²	110	56.3 Å²	56.3	48%	0.478	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	156.4	161.7	-64	174	-179.7	-179.6	0	110	E367 S402 A403	E367-K410 HydrophobicContact CB-CB 4.39Å; E367-K410 WeakPolarHBondContact CB-O 3.45Å; E367-K410 HydrophobicContact CG-CB 4.47Å; E367-K410 WeakPolarHBondContact OE1-CB 3.4Å; E367-K410 WeakPolarHBondContact OE1-CD 3.11Å; E367-K410 WeakPolarHBondContact OE2-CB 3.44Å; S402-K410 VanDerWaalsContact O-CA 3.28Å; S402-K410 WeakPolarHBondContact O-CA 3.23Å; A403-K410 HydrophobicContact CB-CG 4.16Å
411	Y	81.6	Confident	83.3	Confident	38 Å²	38	55.8 Å²	55.8	15%	0.149	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	157	177.9	56.7	-81.2	0	0	0	109.4	D326 E364 L365 S402 V413	D326-Y411 PolarHBondContact OD2-OH 3.08Å; D326-Y411 VanDerWaalsContact OD2-OH 3.1Å; E364-Y411 HydrophobicContact CB-CD2 4.19Å; E364-Y411 HydrophobicContact CG-CD2 4.19Å; E364-Y411 HydrophobicContact CG-CE2 4.24Å; E364-Y411 WeakPolarHBondContact OE1-CE2 3.09Å; L365-Y411 WeakPolarHBondContact O-CA 3.46Å; L365-Y411 VanDerWaalsContact O-CB 3.28Å; L365-Y411 WeakPolarHBondContact O-CB 3.41Å; S402-Y411 PolarHBondContact N-O 3.32Å; S402-Y411 PolarHBondContact O-N 2.97Å; S402-Y411 PolarHBondContact OG-OH 2.98Å; Y411-V413 HydrophobicContact CD2-CG2 3.79Å; Y411-V413 HydrophobicContact CE2-CG2 3.54Å
412	I	84	Confident	83.5	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	126.2	175.1	-43.2	-179.7	0	0	0	108.4	E364 L365 L370 R375 F378 Y399 E401	E364-I412 WeakPolarHBondContact CA-O 3.39Å; L365-I412 HydrophobicContact CB-CB 4.38Å; L365-I412 PolarHBondContact N-O 2.73Å; L365-I412 PolarHBondContact O-N 2.89Å; L370-I412 HydrophobicContact CD1-CD1 4.41Å; R375-I412 HydrophobicContact CG-CD1 4.24Å; F378-I412 HydrophobicContact CD1-CD1 3.63Å; F378-I412 HydrophobicContact CD1-CG2 4.21Å; F378-I412 HydrophobicContact CD2-CD1 4.49Å; F378-I412 HydrophobicContact CE1-CB 4.39Å; F378-I412 HydrophobicContact CE1-CD1 3.92Å; F378-I412 HydrophobicContact CE1-CG2 3.64Å; F378-I412 HydrophobicContact CG-CD1 3.97Å; F378-I412 HydrophobicContact CZ-CD1 4.43Å; F378-I412 HydrophobicContact CZ-CG2 4.33Å; Y399-I412 HydrophobicContact CD2-CG2 4.28Å; E401-I412 HydrophobicContact CG-CG1 4.24Å
413	V	89.4	Confident	83.8	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	136.4	171	-174.8	0	0	0	0	108.9	W362 C363 E364 Y399 W400 Y411 V415	W362-V413 HydrophobicContact CD2-CG1 3.81Å; W362-V413 HydrophobicContact CE3-CG1 4.43Å; W362-V413 HydrophobicContact CG-CG1 4.11Å; W362-V413 HydrophobicContact CZ2-CG1 4.03Å; W362-V413 HydrophobicContact CZ2-CG2 4.19Å; C363-V413 CarbonylContact O-C 3.59Å; C363-V413 VanDerWaalsContact O-CA 3.3Å; C363-V413 WeakPolarHBondContact O-CA 3.23Å; E364-V413 HydrophobicContact CG-CG2 4.47Å; Y399-V413 CarbonylContact C-O 3.58Å; Y399-V413 WeakPolarHBondContact CA-O 3.48Å; Y399-V413 VanDerWaalsContact CB-O 3.3Å; Y399-V413 WeakPolarHBondContact CB-O 3.48Å; W400-V413 HydrophobicContact CD2-CB 4.19Å; W400-V413 HydrophobicContact CH2-CB 4.46Å; W400-V413 HydrophobicContact CH2-CG1 3.82Å; W400-V413 HydrophobicContact CZ2-CB 3.81Å; W400-V413 HydrophobicContact CZ2-CG1 3.46Å; W400-V413 VanDerWaalsContact CZ2-CG1 3.46Å; W400-V413 HydrophobicContact CZ2-CG2 4.27Å; W400-V413 PolarHBondContact N-O 2.98Å; W400-V413 PolarHBondContact O-N 3.49Å; Y411-V413 HydrophobicContact CD2-CG2 3.79Å; Y411-V413 HydrophobicContact CE2-CG2 3.54Å; V413-V415 HydrophobicContact CG1-CG2 4.41Å
414	L	89.3	Confident	84.4	Confident	9 Å²	9	51.1 Å²	51.1	5%	0.047	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	141.2	168.7	-46.2	77.7	0	0	0	107.7	C363 L365 F378 F396	C363-L414 HydrophobicContact CB-CB 4.25Å; C363-L414 HydrophobicContact CB-CD1 4.25Å; C363-L414 PolarHBondContact N-O 3.31Å; C363-L414 PolarHBondContact O-N 3.27Å; L365-L414 HydrophobicContact CD1-CD1 3.73Å; L365-L414 HydrophobicContact CG-CD1 3.77Å; F378-L414 HydrophobicContact CZ-CD1 4.18Å; F378-L414 HydrophobicContact CZ-CD2 3.82Å; F378-L414 HydrophobicContact CZ-CG 4.14Å; F396-L414 HydrophobicContact CE2-CB 3.94Å; F396-L414 HydrophobicContact CE2-CD2 3.68Å; F396-L414 HydrophobicContact CE2-CG 4.3Å; F396-L414 HydrophobicContact CZ-CB 4.05Å; F396-L414 HydrophobicContact CZ-CD2 4Å; F396-L414 HydrophobicContact CZ-CG 4.29Å
415	V	93.3	Very high	85.1	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	123.9	176.5	-171.6	0	0	0	0	109.8	F333 V360 A361 Y397 D398 W400 V413	F333-V415 HydrophobicContact CB-CG2 4.35Å; F333-V415 HydrophobicContact CD1-CG1 3.76Å; F333-V415 HydrophobicContact CD2-CB 4.5Å; F333-V415 HydrophobicContact CD2-CG1 4.48Å; F333-V415 HydrophobicContact CD2-CG2 4.02Å; F333-V415 HydrophobicContact CE1-CG1 3.91Å; F333-V415 HydrophobicContact CG-CG1 4.06Å; F333-V415 HydrophobicContact CG-CG2 4.07Å; F333-V415 HydrophobicContact CZ-CG1 4.35Å; V360-V415 HydrophobicContact CB-CG1 3.72Å; V360-V415 HydrophobicContact CG1-CG1 4.18Å; V360-V415 HydrophobicContact CG2-CG1 3.62Å; A361-V415 WeakPolarHBondContact O-CA 3.46Å; Y397-V415 HydrophobicContact CD2-CG1 4.18Å; Y397-V415 PolarHBondContact N-O 2.96Å; D398-V415 PolarHBondContact O-N 3.02Å; W400-V415 HydrophobicContact CH2-CG2 3.4Å; W400-V415 VanDerWaalsContact CH2-CG2 3.4Å; W400-V415 HydrophobicContact CZ3-CG2 3.6Å; V413-V415 HydrophobicContact CG1-CG2 4.41Å
416	T	93.7	Very high	86.1	Confident	27 Å²	27	45.1 Å²	45.1	17%	0.166	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	167.9	-179.6	70.7	0	0	0	0	112.1	V360 A361 R395 F396 L418	V360-T416 WeakPolarHBondContact CB-O 3.48Å; A361-T416 PolarHBondContact N-O 3.42Å; A361-T416 PolarHBondContact O-N 3.34Å; R395-T416 CarbonylContact O-C 3.54Å; R395-T416 VanDerWaalsContact O-CA 3.25Å; R395-T416 WeakPolarHBondContact O-CA 3.5Å; R395-T416 WeakPolarHBondContact O-CB 3.16Å; F396-T416 HydrophobicContact CD2-CG2 3.77Å; F396-T416 HydrophobicContact CE2-CG2 4.24Å; T416-L418 PolarHBondContact O-N 2.91Å
417	E	93.4	Very high	87.1	Confident	42 Å²	42	41.4 Å²	41.4	20%	0.196	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	133.9	168.5	172.4	178.3	-164.1	0	0	111.6	V394 R395 Y397 M419 K480	V394-E417 HydrophobicContact CG1-CB 3.92Å; R395-E417 HydrophobicContact CB-CB 3.98Å; R395-E417 PolarHBondContact N-OE2 2.96Å; R395-E417 VanDerWaalsContact N-OE2 3.11Å; R395-E417 PolarHBondContact O-N 3.33Å; Y397-E417 HydrophobicContact CE2-CB 4.23Å; E417-M419 HydrophobicContact CG-SD 3.94Å; E417-M419 PolarHBondContact O-N 3.34Å; E417-K480 IonicContact OE1-NZ 2.91Å; E417-K480 PolarHBondContact OE1-NZ 2.98Å; E417-K480 IonicContact OE2-NZ 3.24Å; E417-K480 PolarHBondContact OE2-NZ 3.03Å
418	L	93.1	Very high	88.1	Confident	25 Å²	25	39.1 Å²	39.1	13%	0.131	18%	0.178	C	C	.	.			trans	-84.7	101.3	179.2	179.9	56.4	0	0	0	110.4	L340 A359 A361 T416 T420	L340-L418 HydrophobicContact CD1-CD1 3.46Å; L340-L418 VanDerWaalsContact CD1-CD1 3.46Å; A359-L418 HydrophobicContact CB-CD2 3.79Å; A359-L418 WeakPolarHBondContact O-CB 3.29Å; A361-L418 HydrophobicContact CB-CD1 4.23Å; T416-L418 PolarHBondContact O-N 2.91Å; L418-T420 HydrophobicContact CD2-CG2 4.24Å; L418-T420 HydrophobicContact CG-CG2 3.87Å; L418-T420 PolarHBondContact O-N 3.36Å
419	M	92.8	Very high	88.9	Confident	14 Å²	14	40.2 Å²	40.2	7%	0.069	18%	0.183	C	C	.	.			trans	-75.3	115.9	175.9	-59.9	-54.6	-61.7	0	0	110.6	W74 V394 E417 F471 K480	W74-M419 WeakPolarHBondContact CH2-O 3.42Å; V394-M419 HydrophobicContact CG1-CG 4.25Å; V394-M419 HydrophobicContact CG2-CG 3.86Å; V394-M419 HydrophobicContact CG2-SD 4.07Å; E417-M419 HydrophobicContact CG-SD 3.94Å; E417-M419 PolarHBondContact O-N 3.34Å; M419-F471 HydrophobicContact CB-CB 3.77Å; M419-F471 HydrophobicContact CB-CD1 3.48Å; M419-F471 VanDerWaalsContact CB-CD1 3.48Å; M419-F471 HydrophobicContact CB-CE1 4.27Å; M419-F471 HydrophobicContact CB-CG 3.76Å; M419-F471 HydrophobicContact CE-CB 3.68Å; M419-F471 HydrophobicContact CG-CB 3.58Å; M419-F471 HydrophobicContact CG-CD1 3.88Å; M419-F471 HydrophobicContact CG-CD2 4.26Å; M419-F471 HydrophobicContact CG-CG 3.64Å; M419-F471 HydrophobicContact SD-CB 4.37Å; M419-K480 HydrophobicContact CE-CB 4.12Å; M419-K480 HydrophobicContact CE-CD 3.97Å; M419-K480 HydrophobicContact CE-CG 4.31Å; M419-K480 HydrophobicContact SD-CD 3.98Å
420	T	88.5	Confident	89.5	Confident	58 Å²	58	36.7 Å²	36.7	36%	0.356	17%	0.17	S	C	.	.			trans	-108.7	7.5	-169.2	60.7	0	0	0	0	116.5	Q71 W74 L418	Q71-T420 WeakPolarHBondContact CG-O 3.48Å; Q71-T420 PolarHBondContact NE2-O 2.99Å; Q71-T420 PolarHBondContact NE2-OG1 3.12Å; W74-T420 VanDerWaalsContact CE3-O 3.25Å; W74-T420 HydrophobicContact CH2-CG2 4.14Å; W74-T420 VanDerWaalsContact CZ3-CA 3.43Å; W74-T420 HydrophobicContact CZ3-CG2 4.09Å; W74-T420 WeakPolarHBondContact CZ3-O 3.35Å; L418-T420 HydrophobicContact CD2-CG2 4.24Å; L418-T420 HydrophobicContact CG-CG2 3.87Å; L418-T420 PolarHBondContact O-N 3.36Å
421	S	88.4	Confident	89.7	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.014	15%	0.153	C	C	.	.	S	Bend	trans	-121.5	21.9	179.9	-50.1	0	0	0	0	113.1	V70 Q71 I472 G474	V70-S421 WeakPolarHBondContact CG1-O 3.46Å; Q71-S421 PolarHBondContact NE2-OG 2.98Å; S421-I472 WeakPolarHBondContact CB-O 3.25Å; S421-G474 WeakPolarHBondContact OG-CA 3.26Å; S421-G474 PolarHBondContact OG-N 3.37Å
422	G	90.2	Very high	89.4	Confident	2 Å²	2	39.5 Å²	39.5	2%	0.021	18%	0.183	C	C	.	.			trans	75.2	-164.6	176.9	0	0	0	0	0	114.5	I472	G422-I472 PolarHBondContact O-N 2.89Å
423	T	92.9	Very high	89.3	Confident	16 Å²	16	49.6 Å²	49.6	10%	0.098	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-112.9	164.8	-174.8	70.7	0	0	0	0	111	K425 M426 Y427 D468 I470 F471	T423-K425 VanDerWaalsContact C-N 3.25Å; T423-K425 PolarHBondContact O-N 3.43Å; T423-M426 WeakPolarHBondContact O-CB 3.41Å; T423-M426 PolarHBondContact O-N 3.25Å; T423-M426 VanDerWaalsContact O-N 3.11Å; T423-M426 WeakPolarHBondContact OG1-CG 3.42Å; T423-M426 PolarHBondContact OG1-N 3.38Å; T423-Y427 PolarHBondContact O-N 3.49Å; T423-D468 WeakPolarHBondContact CB-O 3.18Å; T423-D468 WeakPolarHBondContact CG2-O 3.46Å; T423-I470 CarbonylContact C-O 3.6Å; T423-I470 WeakPolarHBondContact CA-O 3.44Å; T423-F471 HydrophobicContact CG2-CD1 3.92Å; T423-F471 HydrophobicContact CG2-CE1 3.84Å
424	L	93.4	Very high	89.1	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-58.3	-37.7	175.2	179.5	56.8	0	0	0	111.9	Y427 L428 I434 W442 C467 I470 M530	L424-Y427 WeakPolarHBondContact O-CB 3.47Å; L424-Y427 PolarHBondContact O-N 3.48Å; L424-L428 HydrophobicContact CD1-CD1 4.45Å; L424-L428 HydrophobicContact CG-CD1 4.27Å; L424-L428 WeakPolarHBondContact O-CG 3.45Å; L424-L428 PolarHBondContact O-N 3.15Å; L424-I434 HydrophobicContact CD1-CD1 4.28Å; L424-W442 HydrophobicContact CD1-CE3 3.57Å; L424-W442 HydrophobicContact CD1-CZ3 3.51Å; L424-C467 HydrophobicContact CB-CB 4.07Å; L424-C467 WeakPolarHBondContact CB-O 3.22Å; L424-C467 HydrophobicContact CD2-CB 4.2Å; L424-C467 VanDerWaalsContact CD2-SG 3.6Å; L424-C467 HydrophobicContact CG-CB 4.03Å; L424-C467 PolarHBondContact N-O 2.7Å; L424-I470 HydrophobicContact CB-CB 4.18Å; L424-I470 HydrophobicContact CB-CG2 4.18Å; L424-I470 HydrophobicContact CD2-CB 4.32Å; L424-I470 HydrophobicContact CD2-CD1 4.13Å; L424-I470 HydrophobicContact CD2-CG2 4.1Å; L424-I470 PolarHBondContact N-O 3.07Å; L424-M530 HydrophobicContact CD1-CG 3.91Å; L424-M530 HydrophobicContact CD1-SD 3.86Å; L424-M530 HydrophobicContact CD2-CE 4.02Å; L424-M530 HydrophobicContact CD2-CG 3.83Å; L424-M530 HydrophobicContact CD2-SD 3.62Å; L424-M530 HydrophobicContact CG-CG 4.11Å; L424-M530 HydrophobicContact CG-SD 4.27Å
425	K	91.9	Very high	89	Confident	59 Å²	59	52.9 Å²	52.9	26%	0.257	24%	0.238	S	C	.	.	H	α-helix	trans	-66.1	-38.7	173.8	-164.7	-179.2	-153.6	174.6	0	112.8	T423 Y427 L428 K429 C467 D468	T423-K425 VanDerWaalsContact C-N 3.25Å; T423-K425 PolarHBondContact O-N 3.43Å; K425-Y427 VanDerWaalsContact C-N 3.32Å; K425-Y427 PolarHBondContact O-N 2.97Å; K425-L428 PolarHBondContact O-N 2.84Å; K425-K429 VanDerWaalsContact O-CB 3.31Å; K425-K429 WeakPolarHBondContact O-CB 3.41Å; K425-K429 PolarHBondContact O-N 2.74Å; K425-C467 HydrophobicContact CB-CB 3.92Å; K425-C467 PolarHBondContact N-O 3.39Å; K425-D468 WeakPolarHBondContact CD-OD1 3.44Å; K425-D468 WeakPolarHBondContact CD-OD2 3.42Å; K425-D468 IonicContact NZ-OD2 2.73Å; K425-D468 PolarHBondContact NZ-OD2 2.73Å
426	M	91.2	Very high	88.6	Confident	61 Å²	61	55 Å²	55	30%	0.3	25%	0.249	S	C	.	.	H	α-helix	trans	-63.1	-39.2	172.5	-73.3	-169.2	66.9	0	0	111.9	V70 W74 T423 R430	V70-M426 HydrophobicContact CG1-CB 4.48Å; W74-M426 HydrophobicContact CB-CE 3.98Å; W74-M426 HydrophobicContact CG-CE 4.29Å; T423-M426 WeakPolarHBondContact O-CB 3.41Å; T423-M426 PolarHBondContact O-N 3.25Å; T423-M426 VanDerWaalsContact O-N 3.11Å; T423-M426 WeakPolarHBondContact OG1-CG 3.42Å; T423-M426 PolarHBondContact OG1-N 3.38Å; M426-R430 PolarHBondContact O-N 3.31Å
427	Y	91.6	Very high	88.2	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-64.2	-48	175.3	-173	-83.7	0	0	0	111.6	R66 L67 V70 T423 L424 K425 K429 R430 F431 I434 W442 I472	R66-Y427 HydrophobicContact CB-CE2 4.2Å; L67-Y427 HydrophobicContact CD2-CD2 3.93Å; L67-Y427 HydrophobicContact CD2-CE2 3.77Å; L67-Y427 HydrophobicContact CG-CE2 4.28Å; V70-Y427 HydrophobicContact CG2-CD2 4.08Å; T423-Y427 PolarHBondContact O-N 3.49Å; L424-Y427 WeakPolarHBondContact O-CB 3.47Å; L424-Y427 PolarHBondContact O-N 3.48Å; K425-Y427 VanDerWaalsContact C-N 3.32Å; K425-Y427 PolarHBondContact O-N 2.97Å; Y427-K429 PolarHBondContact O-N 3.2Å; Y427-R430 PolarHBondContact O-N 3.33Å; Y427-F431 HydrophobicContact CD1-CD2 4.07Å; Y427-F431 AromaticContact CD2-CD2 3.81Å; Y427-F431 HydrophobicContact CD2-CD2 3.81Å; Y427-F431 HydrophobicContact CD2-CE2 4.04Å; Y427-F431 HydrophobicContact CE1-CB 4.16Å; Y427-F431 AromaticContact CE1-CD2 3.85Å; Y427-F431 HydrophobicContact CE1-CD2 3.85Å; Y427-F431 HydrophobicContact CE1-CG 4.48Å; Y427-F431 AromaticContact CE2-CD2 3.6Å; Y427-F431 HydrophobicContact CE2-CD2 3.6Å; Y427-F431 AromaticContact CE2-CE2 3.83Å; Y427-F431 HydrophobicContact CE2-CE2 3.83Å; Y427-F431 HydrophobicContact CG-CD2 4.04Å; Y427-F431 AromaticContact CZ-CD2 3.62Å; Y427-F431 PolarHBondContact O-N 2.69Å; Y427-I434 HydrophobicContact CD1-CD1 4.44Å; Y427-I434 HydrophobicContact CD1-CG1 4.38Å; Y427-I434 HydrophobicContact CE1-CG1 4.1Å; Y427-W442 AromaticContact CD1-CH2 3.86Å; Y427-W442 HydrophobicContact CD1-CH2 3.86Å; Y427-W442 AromaticContact CD1-CZ3 3.91Å; Y427-W442 HydrophobicContact CD1-CZ3 3.91Å; Y427-W442 AromaticContact CD2-CH2 3.93Å; Y427-W442 HydrophobicContact CD2-CH2 3.93Å; Y427-W442 AromaticContact CE1-CH2 3.85Å; Y427-W442 HydrophobicContact CE1-CH2 3.85Å; Y427-W442 HydrophobicContact CE1-CZ3 4.07Å; Y427-W442 AromaticContact CE2-CH2 3.91Å; Y427-W442 HydrophobicContact CE2-CH2 3.91Å; Y427-W442 AromaticContact CG-CH2 3.91Å; Y427-W442 HydrophobicContact CG-CH2 3.91Å; Y427-W442 HydrophobicContact CG-CZ3 4.26Å; Y427-W442 AromaticContact CZ-CH2 3.87Å; Y427-I472 HydrophobicContact CD2-CD1 3.97Å; Y427-I472 HydrophobicContact CG-CD1 3.98Å
428	L	91.2	Very high	88	Confident	8 Å²	8	57.5 Å²	57.5	4%	0.042	26%	0.258	C	S	.	.	H	α-helix	trans	-60.7	-44.8	177.6	-78.6	162.8	0	0	0	112.6	L424 K425 R430 F431 I434 E529 M530	L424-L428 HydrophobicContact CD1-CD1 4.45Å; L424-L428 HydrophobicContact CG-CD1 4.27Å; L424-L428 WeakPolarHBondContact O-CG 3.45Å; L424-L428 PolarHBondContact O-N 3.15Å; K425-L428 PolarHBondContact O-N 2.84Å; L428-R430 PolarHBondContact O-N 2.78Å; L428-F431 CarbonylContact O-C 3.59Å; L428-F431 VanDerWaalsContact O-C 3.28Å; L428-F431 PolarHBondContact O-N 3.45Å; L428-I434 HydrophobicContact CD2-CD1 3.7Å; L428-I434 HydrophobicContact CD2-CG1 3.9Å; L428-I434 HydrophobicContact CG-CD1 4.18Å; L428-E529 HydrophobicContact CD1-CG 4.1Å; L428-M530 HydrophobicContact CD1-CG 4.14Å
429	K	88.6	Confident	88	Confident	192 Å²	192	56.7 Å²	56.7	84%	0.835	25%	0.253	S	S	*	.	H	α-helix	trans	-58.2	-30.6	176.5	-175.1	173.4	-179.3	177	0	113	K425 Y427	K425-K429 VanDerWaalsContact O-CB 3.31Å; K425-K429 WeakPolarHBondContact O-CB 3.41Å; K425-K429 PolarHBondContact O-N 2.74Å; Y427-K429 PolarHBondContact O-N 3.2Å
430	R	84.4	Confident	87.9	Confident	105 Å²	105	58.5 Å²	58.5	40%	0.396	26%	0.261	S	S	.	.	H	α-helix	trans	-91.3	-31.5	176.6	-167.1	173.8	171.6	111.5	-6	113.1	V70 D73 M426 Y427 L428	V70-R430 HydrophobicContact CG2-CB 4.19Å; D73-R430 IonicContact OD1-NH1 3.39Å; D73-R430 PolarHBondContact OD1-NH1 3.36Å; D73-R430 IonicContact OD2-CZ 3.3Å; D73-R430 IonicContact OD2-NH1 3.22Å; D73-R430 PolarHBondContact OD2-NH1 2.69Å; M426-R430 PolarHBondContact O-N 3.31Å; Y427-R430 PolarHBondContact O-N 3.33Å; L428-R430 PolarHBondContact O-N 2.78Å
431	F	81.4	Confident	88	Confident	30 Å²	30	56.9 Å²	56.9	13%	0.132	25%	0.252	C	S	.	.			trans	-130	91	-177	-49.1	-59.2	0	0	0	111.7	R66 A69 V70 Y427 L428 R433	R66-F431 VanDerWaalsContact CA-CZ 3.49Å; R66-F431 HydrophobicContact CB-CD2 3.99Å; R66-F431 HydrophobicContact CB-CE1 4.16Å; R66-F431 HydrophobicContact CB-CE2 3.44Å; R66-F431 VanDerWaalsContact CB-CE2 3.44Å; R66-F431 HydrophobicContact CB-CZ 3.56Å; R66-F431 HydrophobicContact CG-CD1 3.96Å; R66-F431 HydrophobicContact CG-CD2 4.15Å; R66-F431 HydrophobicContact CG-CE1 3.7Å; R66-F431 HydrophobicContact CG-CE2 3.87Å; R66-F431 HydrophobicContact CG-CG 4.18Å; R66-F431 HydrophobicContact CG-CZ 3.65Å; R66-F431 WeakPolarHBondContact O-CE2 3.28Å; R66-F431 VanDerWaalsContact O-CZ 3.26Å; R66-F431 WeakPolarHBondContact O-CZ 3.48Å; A69-F431 HydrophobicContact CB-CZ 4.18Å; V70-F431 HydrophobicContact CG2-CD2 4.18Å; V70-F431 HydrophobicContact CG2-CE2 3.45Å; V70-F431 VanDerWaalsContact CG2-CE2 3.45Å; V70-F431 HydrophobicContact CG2-CZ 4.17Å; Y427-F431 HydrophobicContact CD1-CD2 4.07Å; Y427-F431 AromaticContact CD2-CD2 3.81Å; Y427-F431 HydrophobicContact CD2-CD2 3.81Å; Y427-F431 HydrophobicContact CD2-CE2 4.04Å; Y427-F431 HydrophobicContact CE1-CB 4.16Å; Y427-F431 AromaticContact CE1-CD2 3.85Å; Y427-F431 HydrophobicContact CE1-CD2 3.85Å; Y427-F431 HydrophobicContact CE1-CG 4.48Å; Y427-F431 AromaticContact CE2-CD2 3.6Å; Y427-F431 HydrophobicContact CE2-CD2 3.6Å; Y427-F431 AromaticContact CE2-CE2 3.83Å; Y427-F431 HydrophobicContact CE2-CE2 3.83Å; Y427-F431 HydrophobicContact CG-CD2 4.04Å; Y427-F431 AromaticContact CZ-CD2 3.62Å; Y427-F431 PolarHBondContact O-N 2.69Å; L428-F431 CarbonylContact O-C 3.59Å; L428-F431 VanDerWaalsContact O-C 3.28Å; L428-F431 PolarHBondContact O-N 3.45Å; F431-R433 PolarHBondContact O-N 3.01Å
432	K	75.5	Confident	88.3	Confident	178 Å²	178	56.9 Å²	56.9	77%	0.774	25%	0.252	S	S	*	.	S	Bend	trans	-56	-3.4	-179.5	-61.6	-169.6	175	-168.4	0	116.8
433	R	80.6	Confident	88.6	Confident	213 Å²	213	56.8 Å²	56.8	80%	0.804	25%	0.251	S	S	*	.			trans	-144.1	115.2	177	-69.9	-172.4	176.4	175.9	-1.6	110.2	R66 F431	R66-R433 PolarHBondContact NH1-O 3.13Å; F431-R433 PolarHBondContact O-N 3.01Å
434	I	86.7	Confident	88.7	Confident	23 Å²	23	57.4 Å²	57.4	12%	0.118	25%	0.251	C	S	.	.			trans	-83.2	144.8	170.5	-51.2	-173	0	0	0	108.9	L424 Y427 L428 V438 L439 W442 M530	L424-I434 HydrophobicContact CD1-CD1 4.28Å; Y427-I434 HydrophobicContact CD1-CD1 4.44Å; Y427-I434 HydrophobicContact CD1-CG1 4.38Å; Y427-I434 HydrophobicContact CE1-CG1 4.1Å; L428-I434 HydrophobicContact CD2-CD1 3.7Å; L428-I434 HydrophobicContact CD2-CG1 3.9Å; L428-I434 HydrophobicContact CG-CD1 4.18Å; I434-V438 HydrophobicContact CG2-CB 4.1Å; I434-V438 HydrophobicContact CG2-CG1 4.09Å; I434-L439 HydrophobicContact CG2-CB 4.03Å; I434-W442 HydrophobicContact CD1-CE3 4.29Å; I434-W442 HydrophobicContact CD1-CZ3 3.97Å; I434-W442 HydrophobicContact CG2-CZ3 4.41Å; I434-M530 HydrophobicContact CD1-CB 4.03Å; I434-M530 HydrophobicContact CD1-CG 3.77Å; I434-M530 HydrophobicContact CD1-SD 4.26Å
435	N	85.8	Confident	88.8	Confident	55 Å²	55	58.7 Å²	58.7	29%	0.294	26%	0.257	S	S	.	.			trans	-70.2	132.6	169.7	179	-20	0	0	0	110	E63 K437 V438 L439	E63-N435 WeakPolarHBondContact OE1-CB 3.23Å; E63-N435 PolarHBondContact OE1-ND2 3.22Å; N435-K437 PolarHBondContact O-N 3.39Å; N435-K437 VanDerWaalsContact O-N 3.1Å; N435-K437 PolarHBondContact OD1-N 3.43Å; N435-V438 HydrophobicContact CB-CB 4.47Å; N435-V438 HydrophobicContact CB-CG2 4.22Å; N435-V438 WeakPolarHBondContact O-CA 3.16Å; N435-V438 WeakPolarHBondContact O-CB 3.36Å; N435-V438 PolarHBondContact O-N 3.42Å; N435-L439 PolarHBondContact O-N 2.89Å
436	I	85.8	Confident	89.1	Confident	45 Å²	45	55.9 Å²	55.9	23%	0.231	25%	0.245	C	C	.	.	H	α-helix	trans	-49.9	-35.9	179	-173.2	57.5	0	0	0	113.7	L439 K440 Y566 I569 F595	I436-L439 HydrophobicContact CD1-CD2 4.36Å; I436-L439 PolarHBondContact O-N 2.92Å; I436-K440 HydrophobicContact CD1-CG 4.48Å; I436-K440 WeakPolarHBondContact O-CB 3.35Å; I436-K440 WeakPolarHBondContact O-CG 3.42Å; I436-K440 PolarHBondContact O-N 3.17Å; I436-Y566 HydrophobicContact CD1-CD1 4.45Å; I436-Y566 HydrophobicContact CD1-CE1 4.36Å; I436-Y566 HydrophobicContact CG1-CE1 4.15Å; I436-I569 HydrophobicContact CD1-CD1 3.68Å; I436-F595 HydrophobicContact CD1-CE2 3.87Å; I436-F595 HydrophobicContact CD1-CZ 3.67Å
437	K	84.6	Confident	89.4	Confident	116 Å²	116	53 Å²	53	50%	0.504	23%	0.231	S	C	.	.	H	α-helix	trans	-66	-43.1	176.4	-67.1	-173	176.6	-176.1	0	112.3	N435 S441	N435-K437 PolarHBondContact O-N 3.39Å; N435-K437 VanDerWaalsContact O-N 3.1Å; N435-K437 PolarHBondContact OD1-N 3.43Å; K437-S441 WeakPolarHBondContact O-CB 3.14Å; K437-S441 PolarHBondContact O-N 2.67Å; K437-S441 VanDerWaalsContact O-N 3.09Å
438	V	89.5	Confident	89.6	Confident	6 Å²	6	57.6 Å²	57.6	4%	0.036	25%	0.251	C	S	.	.	H	α-helix	trans	-68	-43	176.6	177.6	0	0	0	0	110.2	L59 E63 I434 N435 S441 W442	L59-V438 HydrophobicContact CD2-CG1 4.48Å; L59-V438 HydrophobicContact CD2-CG2 4.08Å; E63-V438 HydrophobicContact CG-CG2 3.99Å; I434-V438 HydrophobicContact CG2-CB 4.1Å; I434-V438 HydrophobicContact CG2-CG1 4.09Å; N435-V438 HydrophobicContact CB-CB 4.47Å; N435-V438 HydrophobicContact CB-CG2 4.22Å; N435-V438 WeakPolarHBondContact O-CA 3.16Å; N435-V438 WeakPolarHBondContact O-CB 3.36Å; N435-V438 PolarHBondContact O-N 3.42Å; V438-S441 WeakPolarHBondContact O-CB 3.43Å; V438-S441 PolarHBondContact O-N 3.11Å; V438-S441 VanDerWaalsContact O-N 3.14Å; V438-W442 HydrophobicContact CG1-CD2 3.7Å; V438-W442 VanDerWaalsContact CG1-CE2 3.43Å; V438-W442 HydrophobicContact CG1-CE3 4.06Å; V438-W442 HydrophobicContact CG1-CG 4.28Å; V438-W442 HydrophobicContact CG1-CH2 3.97Å; V438-W442 HydrophobicContact CG1-CZ2 3.59Å; V438-W442 HydrophobicContact CG1-CZ3 4.19Å; V438-W442 PolarHBondContact O-N 2.92Å
439	L	92.4	Very high	89.9	Confident	7 Å²	7	57.2 Å²	57.2	4%	0.037	25%	0.249	C	C	.	.	H	α-helix	trans	-59.4	-51.2	176.6	-173.6	147.3	0	0	0	111.8	I434 N435 I436 S441 W442 C443 L527 M530 V531 F595	I434-L439 HydrophobicContact CG2-CB 4.03Å; N435-L439 PolarHBondContact O-N 2.89Å; I436-L439 HydrophobicContact CD1-CD2 4.36Å; I436-L439 PolarHBondContact O-N 2.92Å; L439-S441 VanDerWaalsContact C-N 3.25Å; L439-S441 PolarHBondContact O-N 3Å; L439-W442 PolarHBondContact O-N 2.95Å; L439-C443 WeakPolarHBondContact O-CB 3.03Å; L439-C443 PolarHBondContact O-N 2.66Å; L439-C443 PolarHBondContact O-SG 3.46Å; L439-L527 HydrophobicContact CD2-CD1 3.81Å; L439-M530 HydrophobicContact CD1-CB 3.95Å; L439-V531 HydrophobicContact CD1-CG2 3.76Å; L439-F595 HydrophobicContact CD2-CE1 4.22Å; L439-F595 HydrophobicContact CD2-CZ 4.08Å
440	K	90.9	Very high	90.2	Very high	53 Å²	53	48 Å²	48	23%	0.23	21%	0.209	C	C	.	.	H	α-helix	trans	-54.1	-42.1	172.7	-79.8	-172.8	169.4	-157.5	0	112	I436 R444 F595	I436-K440 HydrophobicContact CD1-CG 4.48Å; I436-K440 WeakPolarHBondContact O-CB 3.35Å; I436-K440 WeakPolarHBondContact O-CG 3.42Å; I436-K440 PolarHBondContact O-N 3.17Å; K440-R444 VanDerWaalsContact O-CB 3.23Å; K440-R444 WeakPolarHBondContact O-CB 3.49Å; K440-R444 PolarHBondContact O-N 3.28Å; K440-F595 HydrophobicContact CD-CD2 4.42Å; K440-F595 HydrophobicContact CD-CE2 4.23Å; K440-F595 HydrophobicContact CD-CZ 4.27Å; K440-F595 VanDerWaalsContact CD-O 3.26Å; K440-F595 WeakPolarHBondContact CD-O 3.37Å; K440-F595 WeakPolarHBondContact CE-O 3.28Å; K440-F595 HydrophobicContact CG-CD1 4.2Å; K440-F595 HydrophobicContact CG-CD2 4.5Å; K440-F595 HydrophobicContact CG-CE1 3.69Å; K440-F595 HydrophobicContact CG-CE2 4.05Å; K440-F595 HydrophobicContact CG-CZ 3.58Å; K440-F595 PolarHBondContact NZ-O 3.22Å
441	S	91.2	Very high	90.8	Very high	24 Å²	24	44.3 Å²	44.3	17%	0.168	20%	0.199	C	C	.	.	H	α-helix	trans	-67.1	-46.7	179.6	-166.7	0	0	0	0	112.9	K437 V438 L439 Q445	K437-S441 WeakPolarHBondContact O-CB 3.14Å; K437-S441 PolarHBondContact O-N 2.67Å; K437-S441 VanDerWaalsContact O-N 3.09Å; V438-S441 WeakPolarHBondContact O-CB 3.43Å; V438-S441 PolarHBondContact O-N 3.11Å; V438-S441 VanDerWaalsContact O-N 3.14Å; L439-S441 VanDerWaalsContact C-N 3.25Å; L439-S441 PolarHBondContact O-N 3Å; S441-Q445 WeakPolarHBondContact O-CB 3.27Å; S441-Q445 VanDerWaalsContact O-CG 3.22Å; S441-Q445 WeakPolarHBondContact O-CG 3.46Å; S441-Q445 PolarHBondContact O-N 3.35Å; S441-Q445 VanDerWaalsContact O-N 3.07Å; S441-Q445 PolarHBondContact O-NE2 3.07Å; S441-Q445 VanDerWaalsContact O-NE2 3.16Å; S441-Q445 PolarHBondContact OG-NE2 3Å; S441-Q445 VanDerWaalsContact OG-NE2 3.07Å
442	W	94.8	Very high	91.4	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-67.8	-42.9	179.5	-70.7	-8.7	0	0	0	112.4	L67 L424 Y427 I434 V438 L439 R444 Q445 I446 I472 G477 V479 M530	L67-W442 HydrophobicContact CD2-CZ2 4.27Å; L424-W442 HydrophobicContact CD1-CE3 3.57Å; L424-W442 HydrophobicContact CD1-CZ3 3.51Å; Y427-W442 AromaticContact CD1-CH2 3.86Å; Y427-W442 HydrophobicContact CD1-CH2 3.86Å; Y427-W442 AromaticContact CD1-CZ3 3.91Å; Y427-W442 HydrophobicContact CD1-CZ3 3.91Å; Y427-W442 AromaticContact CD2-CH2 3.93Å; Y427-W442 HydrophobicContact CD2-CH2 3.93Å; Y427-W442 AromaticContact CE1-CH2 3.85Å; Y427-W442 HydrophobicContact CE1-CH2 3.85Å; Y427-W442 HydrophobicContact CE1-CZ3 4.07Å; Y427-W442 AromaticContact CE2-CH2 3.91Å; Y427-W442 HydrophobicContact CE2-CH2 3.91Å; Y427-W442 AromaticContact CG-CH2 3.91Å; Y427-W442 HydrophobicContact CG-CH2 3.91Å; Y427-W442 HydrophobicContact CG-CZ3 4.26Å; Y427-W442 AromaticContact CZ-CH2 3.87Å; I434-W442 HydrophobicContact CD1-CE3 4.29Å; I434-W442 HydrophobicContact CD1-CZ3 3.97Å; I434-W442 HydrophobicContact CG2-CZ3 4.41Å; V438-W442 HydrophobicContact CG1-CD2 3.7Å; V438-W442 VanDerWaalsContact CG1-CE2 3.43Å; V438-W442 HydrophobicContact CG1-CE3 4.06Å; V438-W442 HydrophobicContact CG1-CG 4.28Å; V438-W442 HydrophobicContact CG1-CH2 3.97Å; V438-W442 HydrophobicContact CG1-CZ2 3.59Å; V438-W442 HydrophobicContact CG1-CZ3 4.19Å; V438-W442 PolarHBondContact O-N 2.92Å; L439-W442 PolarHBondContact O-N 2.95Å; W442-R444 PolarHBondContact O-N 3.49Å; W442-Q445 WeakPolarHBondContact O-CB 3.11Å; W442-Q445 PolarHBondContact O-N 3.47Å; W442-Q445 VanDerWaalsContact O-N 3.11Å; W442-I446 WeakPolarHBondContact O-CD1 3.37Å; W442-I446 WeakPolarHBondContact O-CG1 3.41Å; W442-I446 PolarHBondContact O-N 3.35Å; W442-I472 HydrophobicContact CH2-CD1 3.79Å; W442-I472 HydrophobicContact CZ2-CD1 4.17Å; W442-I472 HydrophobicContact CZ2-CG2 4.26Å; W442-I472 HydrophobicContact CZ3-CD1 4.32Å; W442-G477 PolarHBondContact NE1-O 3.17Å; W442-V479 HydrophobicContact CB-CG1 4.22Å; W442-V479 HydrophobicContact CB-CG2 4.09Å; W442-V479 HydrophobicContact CD2-CG1 3.93Å; W442-V479 HydrophobicContact CG-CG1 3.71Å; W442-V479 HydrophobicContact CG-CG2 4.28Å; W442-M530 HydrophobicContact CE3-SD 4.41Å
443	C	96.4	Very high	92.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60	-48.4	177.3	-65.6	0	0	0	0	111.8	L439 Q445 I446 L447 F523 M530 F596	L439-C443 WeakPolarHBondContact O-CB 3.03Å; L439-C443 PolarHBondContact O-N 2.66Å; L439-C443 PolarHBondContact O-SG 3.46Å; C443-Q445 VanDerWaalsContact C-N 3.26Å; C443-Q445 PolarHBondContact O-N 3.26Å; C443-I446 PolarHBondContact O-N 3.39Å; C443-L447 WeakPolarHBondContact O-CG 3.17Å; C443-L447 PolarHBondContact O-N 3.49Å; C443-F523 HydrophobicContact CB-CE2 3.96Å; C443-F523 HydrophobicContact CB-CZ 4Å; C443-M530 WeakPolarHBondContact SG-CE 3.44Å; C443-F596 HydrophobicContact CB-CD1 3.93Å; C443-F596 HydrophobicContact CB-CE1 3.22Å; C443-F596 HydrophobicContact CB-CZ 3.9Å
444	R	94.8	Very high	92.8	Very high	28 Å²	28	26.9 Å²	26.9	11%	0.106	13%	0.129	C	C	.	.	H	α-helix	trans	-58.9	-34.1	173.7	168	171.3	43.4	-119.3	3.1	113.1	K440 W442 K448 F596 T597	K440-R444 VanDerWaalsContact O-CB 3.23Å; K440-R444 WeakPolarHBondContact O-CB 3.49Å; K440-R444 PolarHBondContact O-N 3.28Å; W442-R444 PolarHBondContact O-N 3.49Å; R444-K448 WeakPolarHBondContact O-CB 3.34Å; R444-K448 WeakPolarHBondContact O-CG 3.18Å; R444-K448 PolarHBondContact O-N 3.21Å; R444-F596 WeakPolarHBondContact CD-O 3.43Å; R444-F596 PolarHBondContact NH1-O 2.76Å; R444-T597 PolarHBondContact NH1-O 2.85Å
445	Q	96	Very high	93.1	Very high	27 Å²	27	28.9 Å²	28.9	13%	0.126	14%	0.143	C	C	.	.	H	α-helix	trans	-71.8	-40.3	175	-77.7	173.4	64.3	0	0	112.5	N392 S441 W442 C443 K448 G449 V479	N392-Q445 VanDerWaalsContact CB-O 3.25Å; N392-Q445 WeakPolarHBondContact CB-O 3.3Å; N392-Q445 WeakPolarHBondContact ND2-CB 3.39Å; N392-Q445 WeakPolarHBondContact ND2-CG 3.28Å; N392-Q445 PolarHBondContact ND2-OE1 2.72Å; S441-Q445 WeakPolarHBondContact O-CB 3.27Å; S441-Q445 VanDerWaalsContact O-CG 3.22Å; S441-Q445 WeakPolarHBondContact O-CG 3.46Å; S441-Q445 PolarHBondContact O-N 3.35Å; S441-Q445 VanDerWaalsContact O-N 3.07Å; S441-Q445 PolarHBondContact O-NE2 3.07Å; S441-Q445 VanDerWaalsContact O-NE2 3.16Å; S441-Q445 PolarHBondContact OG-NE2 3Å; S441-Q445 VanDerWaalsContact OG-NE2 3.07Å; W442-Q445 WeakPolarHBondContact O-CB 3.11Å; W442-Q445 PolarHBondContact O-N 3.47Å; W442-Q445 VanDerWaalsContact O-N 3.11Å; C443-Q445 VanDerWaalsContact C-N 3.26Å; C443-Q445 PolarHBondContact O-N 3.26Å; Q445-K448 PolarHBondContact O-N 3.06Å; Q445-G449 PolarHBondContact O-N 2.96Å; Q445-V479 HydrophobicContact CB-CG2 3.5Å; Q445-V479 HydrophobicContact CG-CG2 4.47Å
446	I	97.5	Very high	93.2	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-62	-48.7	172.4	-63.2	154.8	0	0	0	109.6	W442 C443 K448 G449 L450 L465 I470 V479 I481 F523 M530	W442-I446 WeakPolarHBondContact O-CD1 3.37Å; W442-I446 WeakPolarHBondContact O-CG1 3.41Å; W442-I446 PolarHBondContact O-N 3.35Å; C443-I446 PolarHBondContact O-N 3.39Å; I446-K448 VanDerWaalsContact C-N 3.32Å; I446-K448 PolarHBondContact O-N 3.37Å; I446-G449 CarbonylContact O-C 3.45Å; I446-G449 WeakPolarHBondContact O-CA 3.48Å; I446-G449 PolarHBondContact O-N 3.37Å; I446-L450 HydrophobicContact CG2-CD1 4.28Å; I446-L450 HydrophobicContact CG2-CG 4.39Å; I446-L450 PolarHBondContact O-N 3.46Å; I446-L465 HydrophobicContact CG2-CD2 4.5Å; I446-I470 HydrophobicContact CD1-CD1 3.82Å; I446-I470 HydrophobicContact CD1-CG2 4.19Å; I446-I470 HydrophobicContact CG1-CD1 4.18Å; I446-I470 HydrophobicContact CG1-CG2 4.16Å; I446-V479 HydrophobicContact CG1-CG2 4.08Å; I446-I481 HydrophobicContact CG2-CD1 4.02Å; I446-F523 HydrophobicContact CB-CD2 4.33Å; I446-F523 HydrophobicContact CB-CE2 4.42Å; I446-F523 HydrophobicContact CG2-CD2 3.83Å; I446-F523 HydrophobicContact CG2-CE2 4.41Å; I446-M530 HydrophobicContact CD1-CE 4.15Å
447	L	97.5	Very high	93	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.5	-38.5	177	-70.2	169.7	0	0	0	112.7	C443 L450 S451 F523 V587 L590 L591 F596	C443-L447 WeakPolarHBondContact O-CG 3.17Å; C443-L447 PolarHBondContact O-N 3.49Å; L447-L450 PolarHBondContact O-N 3.47Å; L447-S451 VanDerWaalsContact O-CB 3.29Å; L447-S451 WeakPolarHBondContact O-CB 3.29Å; L447-S451 PolarHBondContact O-N 2.97Å; L447-F523 HydrophobicContact CD1-CE1 4.19Å; L447-F523 HydrophobicContact CD1-CE2 4.22Å; L447-F523 HydrophobicContact CD1-CZ 3.7Å; L447-F523 HydrophobicContact CD2-CD1 3.95Å; L447-F523 HydrophobicContact CD2-CD2 4.14Å; L447-F523 HydrophobicContact CD2-CE1 3.82Å; L447-F523 HydrophobicContact CD2-CE2 4.01Å; L447-F523 HydrophobicContact CD2-CG 4.11Å; L447-F523 HydrophobicContact CD2-CZ 3.85Å; L447-F523 HydrophobicContact CG-CD2 4.27Å; L447-F523 HydrophobicContact CG-CE1 4.17Å; L447-F523 HydrophobicContact CG-CE2 3.73Å; L447-F523 HydrophobicContact CG-CZ 3.68Å; L447-V587 HydrophobicContact CB-CG1 4.28Å; L447-V587 HydrophobicContact CD2-CG1 3.97Å; L447-V587 VanDerWaalsContact O-CG1 3.22Å; L447-V587 WeakPolarHBondContact O-CG1 3.35Å; L447-L590 HydrophobicContact CD1-CB 3.84Å; L447-L590 HydrophobicContact CD2-CB 3.82Å; L447-L590 HydrophobicContact CD2-CD1 3.82Å; L447-L590 HydrophobicContact CD2-CG 4.48Å; L447-L590 HydrophobicContact CG-CB 4.49Å; L447-L591 HydrophobicContact CB-CD2 3.59Å; L447-L591 HydrophobicContact CB-CG 3.92Å; L447-F596 HydrophobicContact CD1-CD1 4.46Å; L447-F596 HydrophobicContact CD1-CD2 3.75Å; L447-F596 HydrophobicContact CD1-CE2 3.93Å; L447-F596 HydrophobicContact CD1-CG 4.03Å; L447-F596 HydrophobicContact CD1-CZ 4.4Å
448	K	96.6	Very high	92.8	Very high	96 Å²	96	32.4 Å²	32.4	42%	0.417	16%	0.163	S	C	.	.	H	α-helix	trans	-63.6	-41.8	171.2	-78.2	-179.1	176.4	-171	0	112.2	R444 Q445 I446 S451 F452 L591	R444-K448 WeakPolarHBondContact O-CB 3.34Å; R444-K448 WeakPolarHBondContact O-CG 3.18Å; R444-K448 PolarHBondContact O-N 3.21Å; Q445-K448 PolarHBondContact O-N 3.06Å; I446-K448 VanDerWaalsContact C-N 3.32Å; I446-K448 PolarHBondContact O-N 3.37Å; K448-S451 PolarHBondContact O-N 2.98Å; K448-F452 WeakPolarHBondContact O-CB 3.22Å; K448-F452 PolarHBondContact O-N 3.48Å; K448-L591 HydrophobicContact CG-CD2 3.96Å
449	G	96.3	Very high	92.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-58.4	-51.7	173.3	0	0	0	0	0	112.5	Q445 I446 F452 L453	Q445-G449 PolarHBondContact O-N 2.96Å; I446-G449 CarbonylContact O-C 3.45Å; I446-G449 WeakPolarHBondContact O-CA 3.48Å; I446-G449 PolarHBondContact O-N 3.37Å; G449-F452 WeakPolarHBondContact O-CB 3.35Å; G449-F452 PolarHBondContact O-N 2.89Å; G449-L453 WeakPolarHBondContact O-CG 3.28Å; G449-L453 PolarHBondContact O-N 2.96Å; G449-L453 VanDerWaalsContact O-N 3.14Å
450	L	96.2	Very high	92.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.7	-46.6	176.5	-65	-179.4	0	0	0	111.8	I446 L447 F452 L453 H454 L465 I481 D519 F523 V587	I446-L450 HydrophobicContact CG2-CD1 4.28Å; I446-L450 HydrophobicContact CG2-CG 4.39Å; I446-L450 PolarHBondContact O-N 3.46Å; L447-L450 PolarHBondContact O-N 3.47Å; L450-F452 PolarHBondContact O-N 3.11Å; L450-L453 PolarHBondContact O-N 3.48Å; L450-H454 WeakPolarHBondContact O-CB 3.44Å; L450-H454 VanDerWaalsContact O-CG 3.24Å; L450-H454 PolarHBondContact O-N 3.09Å; L450-L465 HydrophobicContact CD1-CD2 3.87Å; L450-L465 HydrophobicContact CD2-CD1 4.48Å; L450-L465 HydrophobicContact CD2-CD2 4.13Å; L450-L465 HydrophobicContact CG-CD2 4.48Å; L450-I481 HydrophobicContact CD2-CD1 3.92Å; L450-I481 HydrophobicContact CG-CD1 4.03Å; L450-D519 HydrophobicContact CD1-CB 4.23Å; L450-D519 HydrophobicContact CD2-CB 3.99Å; L450-F523 HydrophobicContact CD1-CB 4.2Å; L450-V587 HydrophobicContact CB-CG1 4.14Å; L450-V587 HydrophobicContact CB-CG2 4.2Å
451	S	95.8	Very high	92.1	Very high	26 Å²	26	30.8 Å²	30.8	18%	0.182	16%	0.159	C	C	.	.	H	α-helix	trans	-61.3	-29.6	177.3	-173.4	0	0	0	0	112.8	L447 K448 T455	L447-S451 VanDerWaalsContact O-CB 3.29Å; L447-S451 WeakPolarHBondContact O-CB 3.29Å; L447-S451 PolarHBondContact O-N 2.97Å; K448-S451 PolarHBondContact O-N 2.98Å; S451-T455 WeakPolarHBondContact O-CB 3.5Å; S451-T455 WeakPolarHBondContact O-CG2 3.34Å; S451-T455 PolarHBondContact O-N 3.06Å; S451-T455 PolarHBondContact O-OG1 3.4Å
452	F	95.5	Very high	91.9	Very high	28 Å²	28	29.9 Å²	29.9	12%	0.123	15%	0.152	C	C	.	.	H	α-helix	trans	-69.6	-43.7	172.8	170.2	-95	0	0	0	111.5	L388 Q389 H390 I393 K448 G449 L450 T455 R456	L388-F452 HydrophobicContact CB-CE1 4.11Å; L388-F452 HydrophobicContact CD2-CE1 3.86Å; L388-F452 HydrophobicContact CD2-CZ 4.22Å; L388-F452 HydrophobicContact CG-CE1 4.49Å; Q389-F452 WeakPolarHBondContact O-CE2 3.34Å; Q389-F452 WeakPolarHBondContact O-CZ 3.47Å; H390-F452 HydrophobicContact CB-CB 4.33Å; 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 4.02Å; H390-F452 HydrophobicContact CB-CG 3.66Å; H390-F452 HydrophobicContact CB-CZ 3.96Å; H390-F452 AromaticContact CD2-CD2 3.82Å; H390-F452 AromaticContact CD2-CG 3.82Å; H390-F452 AromaticContact CG-CG 3.7Å; I393-F452 HydrophobicContact CG1-CD1 4.05Å; I393-F452 HydrophobicContact CG1-CE1 4.5Å; K448-F452 WeakPolarHBondContact O-CB 3.22Å; K448-F452 PolarHBondContact O-N 3.48Å; G449-F452 WeakPolarHBondContact O-CB 3.35Å; G449-F452 PolarHBondContact O-N 2.89Å; L450-F452 PolarHBondContact O-N 3.11Å; F452-T455 PolarHBondContact O-N 2.95Å; F452-T455 PolarHBondContact O-OG1 2.92Å; F452-R456 PolarHBondContact O-N 3.13Å; F452-R456 PolarHBondContact O-NE 3.24Å
453	L	92.7	Very high	91.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-66.2	-46.9	177.8	-62.9	172.3	0	0	0	112.3	L388 I393 G449 L450 T455 R456 V460 L484	L388-L453 HydrophobicContact CD1-CD2 3.81Å; I393-L453 HydrophobicContact CD1-CD1 3.82Å; I393-L453 HydrophobicContact CD1-CD2 4.16Å; I393-L453 HydrophobicContact CD1-CG 3.93Å; G449-L453 WeakPolarHBondContact O-CG 3.28Å; G449-L453 PolarHBondContact O-N 2.96Å; G449-L453 VanDerWaalsContact O-N 3.14Å; L450-L453 PolarHBondContact O-N 3.48Å; L453-T455 PolarHBondContact O-N 3.29Å; L453-R456 WeakPolarHBondContact O-CB 3.37Å; L453-R456 WeakPolarHBondContact O-CG 3.46Å; L453-R456 PolarHBondContact O-N 3.29Å; L453-R456 VanDerWaalsContact O-N 3.13Å; L453-V460 CarbonylContact C-O 3.58Å; L453-V460 HydrophobicContact CB-CB 4.21Å; L453-V460 WeakPolarHBondContact CB-O 3.49Å; L453-V460 HydrophobicContact CD2-CB 4.33Å; L453-V460 HydrophobicContact CD2-CG1 4.13Å; L453-V460 PolarHBondContact O-N 3.07Å; L453-L484 HydrophobicContact CD1-CD1 4.42Å; L453-L484 HydrophobicContact CD1-CD2 3.82Å; L453-L484 HydrophobicContact CD2-CD1 3.88Å; L453-L484 HydrophobicContact CD2-CD2 4.35Å
454	H	92.8	Very high	90.6	Very high	28 Å²	28	33.1 Å²	33.1	13%	0.13	17%	0.167	C	C	.	.	H	α-helix	trans	-68.3	-17.8	179.1	-58.7	162.4	0	0	0	113.4	L450 V460 E516 D519	L450-H454 WeakPolarHBondContact O-CB 3.44Å; L450-H454 VanDerWaalsContact O-CG 3.24Å; L450-H454 PolarHBondContact O-N 3.09Å; H454-V460 PolarHBondContact CD2-O 3.16Å; H454-E516 HydrophobicContact CB-CB 4.48Å; H454-D519 IonicContact CD2-OD2 3.84Å; H454-D519 IonicContact CE1-OD2 3.97Å; H454-D519 IonicContact NE2-OD2 3.62Å; H454-D519 PolarHBondContact NE2-OD2 3.15Å
455	T	91.6	Very high	90.4	Very high	65 Å²	65	31.8 Å²	31.8	40%	0.399	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	13.3	174	59	0	0	0	0	113.8	S451 F452 L453	S451-T455 WeakPolarHBondContact O-CB 3.5Å; S451-T455 WeakPolarHBondContact O-CG2 3.34Å; S451-T455 PolarHBondContact O-N 3.06Å; S451-T455 PolarHBondContact O-OG1 3.4Å; F452-T455 PolarHBondContact O-N 2.95Å; F452-T455 PolarHBondContact O-OG1 2.92Å; L453-T455 PolarHBondContact O-N 3.29Å
456	R	89.1	Confident	90.2	Very high	82 Å²	82	31.3 Å²	31.3	31%	0.309	16%	0.16	S	C	.	.	S	Bend	trans	-73.3	161.7	164.5	-60.9	-52.1	85.6	-164.9	-4.6	110.2	L388 F452 L453 P458 P459 V460	L388-R456 HydrophobicContact CD2-CG 3.79Å; F452-R456 PolarHBondContact O-N 3.13Å; F452-R456 PolarHBondContact O-NE 3.24Å; L453-R456 WeakPolarHBondContact O-CB 3.37Å; L453-R456 WeakPolarHBondContact O-CG 3.46Å; L453-R456 PolarHBondContact O-N 3.29Å; L453-R456 VanDerWaalsContact O-N 3.13Å; R456-P458 VanDerWaalsContact C-C 3.41Å; R456-P458 CarbonylContact C-O 3.45Å; R456-P458 WeakPolarHBondContact CB-O 3.4Å; R456-P458 CarbonylContact O-C 3.53Å; R456-P459 WeakPolarHBondContact O-CA 3.24Å; R456-P459 VanDerWaalsContact O-N 3.08Å; R456-V460 HydrophobicContact CB-CG2 4.11Å; R456-V460 HydrophobicContact CG-CG2 4.11Å
457	N	81.1	Confident	90	Very high	165 Å²	165	31.3 Å²	31.3	88%	0.882	16%	0.16	S	C	*	.	S	Bend	trans	-121.5	105.9	174.8	-108.1	77.9	0	0	0	109.2
458	P	80.2	Confident	89.7	Confident	42 Å²	42	33.9 Å²	33.9	27%	0.273	17%	0.173	S	C	.	.	S	Bend	cis	-68.2	162.7	-5.6	32.3	-37.5	0	0	0	112.9	M384 R456 L489	M384-P458 HydrophobicContact CE-CG 3.85Å; R456-P458 VanDerWaalsContact C-C 3.41Å; R456-P458 CarbonylContact C-O 3.45Å; R456-P458 WeakPolarHBondContact CB-O 3.4Å; R456-P458 CarbonylContact O-C 3.53Å; P458-L489 HydrophobicContact CG-CD1 4.22Å; P458-L489 HydrophobicContact CG-CD2 4.36Å
459	P	86.2	Confident	89.5	Confident	32 Å²	32	29.7 Å²	29.7	21%	0.208	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-59.7	137	175.1	-26.9	36.4	0	0	0	112.7	R456	R456-P459 WeakPolarHBondContact O-CA 3.24Å; R456-P459 VanDerWaalsContact O-N 3.08Å
460	V	85	Confident	89.4	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.006	16%	0.156	C	C	.	.	B	Isolated β-bridge	trans	-97.8	121.6	173.9	178.4	0	0	0	0	108.2	M384 L453 H454 R456 A487 L489	M384-V460 HydrophobicContact SD-CG2 3.8Å; L453-V460 CarbonylContact C-O 3.58Å; L453-V460 HydrophobicContact CB-CB 4.21Å; L453-V460 WeakPolarHBondContact CB-O 3.49Å; L453-V460 HydrophobicContact CD2-CB 4.33Å; L453-V460 HydrophobicContact CD2-CG1 4.13Å; L453-V460 PolarHBondContact O-N 3.07Å; H454-V460 PolarHBondContact CD2-O 3.16Å; R456-V460 HydrophobicContact CB-CG2 4.11Å; R456-V460 HydrophobicContact CG-CG2 4.11Å; V460-A487 HydrophobicContact CG1-CB 4.36Å; V460-L489 HydrophobicContact CG2-CD2 4.24Å
461	I	86.4	Confident	89.4	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.			trans	-106.4	129.1	177.8	-53.7	163.9	0	0	0	107.7	R463 A487 K490 V518	I461-R463 HydrophobicContact CG2-CG 4.17Å; I461-R463 VanDerWaalsContact O-CD 3.23Å; I461-R463 WeakPolarHBondContact O-CD 3.38Å; I461-R463 PolarHBondContact O-NE 3.14Å; I461-R463 VanDerWaalsContact O-NE 3.13Å; I461-A487 WeakPolarHBondContact O-CB 3.42Å; I461-K490 HydrophobicContact CD1-CB 3.74Å; I461-K490 HydrophobicContact CD1-CD 4.13Å; I461-K490 HydrophobicContact CD1-CG 3.79Å; I461-K490 HydrophobicContact CG1-CB 4.47Å; I461-V518 HydrophobicContact CG2-CG2 3.64Å
462	H	87.7	Confident	89.3	Confident	5 Å²	5	30.4 Å²	30.4	2%	0.023	16%	0.156	C	C	.	.			trans	-72.8	-41	-172.8	-171.2	-60.9	0	0	0	113.1	D464 L465 I481 G482 L484 D519	H462-D464 VanDerWaalsContact CE1-C 3.44Å; H462-D464 PolarHBondContact CE1-O 3.46Å; H462-D464 VanDerWaalsContact ND1-C 3.25Å; H462-D464 PolarHBondContact ND1-N 3.47Å; H462-D464 PolarHBondContact ND1-O 3.47Å; H462-D464 PolarHBondContact O-N 3.29Å; H462-L465 PolarHBondContact ND1-N 3.08Å; H462-I481 WeakPolarHBondContact CD2-CG2 3.5Å; H462-I481 WeakPolarHBondContact NE2-CG2 3.23Å; H462-G482 PolarHBondContact NE2-O 3.49Å; H462-L484 HydrophobicContact CB-CD2 4.43Å; H462-L484 VanDerWaalsContact CD2-CD2 3.42Å; H462-L484 WeakPolarHBondContact CD2-CD2 3.49Å; H462-D519 WeakPolarHBondContact CB-OD1 3.22Å; H462-D519 PolarHBondContact N-OD1 3.09Å; H462-D519 PolarHBondContact N-OD2 3.35Å
463	R	80.2	Confident	89.1	Confident	31 Å²	31	30.1 Å²	30.1	12%	0.117	16%	0.156	C	C	.	.	S	Bend	trans	64.5	-53.2	-176.8	-48.8	114.1	-179.2	-70.8	-6.3	115.7	I461 L465 T488 M509 Y514 D519	I461-R463 HydrophobicContact CG2-CG 4.17Å; I461-R463 VanDerWaalsContact O-CD 3.23Å; I461-R463 WeakPolarHBondContact O-CD 3.38Å; I461-R463 PolarHBondContact O-NE 3.14Å; I461-R463 VanDerWaalsContact O-NE 3.13Å; R463-L465 VanDerWaalsContact C-N 3.34Å; R463-L465 PolarHBondContact O-N 3.28Å; R463-T488 VanDerWaalsContact CZ-O 3.27Å; R463-T488 PolarHBondContact NE-O 2.91Å; R463-T488 VanDerWaalsContact NE-O 3.16Å; R463-T488 PolarHBondContact NH1-OG1 3.03Å; R463-T488 VanDerWaalsContact NH1-OG1 3.11Å; R463-T488 PolarHBondContact NH2-O 3.1Å; R463-T488 PolarHBondContact NH2-OG1 3Å; R463-M509 HydrophobicContact CB-CE 4.48Å; R463-M509 HydrophobicContact CB-SD 4.09Å; R463-M509 HydrophobicContact CG-SD 4.39Å; R463-M509 VanDerWaalsContact O-CE 3.29Å; R463-M509 WeakPolarHBondContact O-CE 3.49Å; R463-Y514 VanDerWaalsContact CZ-CE2 3.47Å; R463-Y514 PolarHBondContact NH1-OH 2.98Å; R463-Y514 VanDerWaalsContact NH2-CE2 3.35Å; R463-D519 PolarHBondContact N-OD1 3.06Å
464	D	83	Confident	88.4	Confident	38 Å²	38	31.4 Å²	31.4	20%	0.203	17%	0.169	C	C	.	.	S	Bend	trans	-95	44	-178.7	-164.1	40.9	0	0	0	112.4	H462 K466 N469	H462-D464 VanDerWaalsContact CE1-C 3.44Å; H462-D464 PolarHBondContact CE1-O 3.46Å; H462-D464 VanDerWaalsContact ND1-C 3.25Å; H462-D464 PolarHBondContact ND1-N 3.47Å; H462-D464 PolarHBondContact ND1-O 3.47Å; H462-D464 PolarHBondContact O-N 3.29Å; D464-K466 PolarHBondContact O-N 2.88Å; D464-K466 IonicContact OD1-NZ 2.99Å; D464-K466 PolarHBondContact OD1-NZ 3.19Å; D464-K466 IonicContact OD2-NZ 3.26Å; D464-K466 PolarHBondContact OD2-NZ 3.38Å; D464-N469 PolarHBondContact O-ND2 2.82Å; D464-N469 PolarHBondContact OD2-ND2 3.44Å
465	L	91.3	Very high	87.3	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	20%	0.2	C	C	.	.			trans	-77	123.6	179.4	-175.9	74.9	0	0	0	109.5	I446 L450 H462 R463 I470 I481 D519 A522 F523	I446-L465 HydrophobicContact CG2-CD2 4.5Å; L450-L465 HydrophobicContact CD1-CD2 3.87Å; L450-L465 HydrophobicContact CD2-CD1 4.48Å; L450-L465 HydrophobicContact CD2-CD2 4.13Å; L450-L465 HydrophobicContact CG-CD2 4.48Å; H462-L465 PolarHBondContact ND1-N 3.08Å; R463-L465 VanDerWaalsContact C-N 3.34Å; R463-L465 PolarHBondContact O-N 3.28Å; L465-I470 HydrophobicContact CD1-CD1 4.19Å; L465-I470 HydrophobicContact CD1-CG1 4.12Å; L465-I481 HydrophobicContact CD1-CD1 4.37Å; L465-I481 HydrophobicContact CD1-CG2 3.73Å; L465-D519 WeakPolarHBondContact CD2-O 3.45Å; L465-A522 HydrophobicContact CB-CB 3.83Å; L465-A522 HydrophobicContact CD2-CB 4.2Å; L465-A522 HydrophobicContact CG-CB 4.4Å; L465-A522 WeakPolarHBondContact O-CB 3.45Å; L465-F523 HydrophobicContact CD2-CB 4.15Å
466	K	91.6	Very high	86.4	Confident	17 Å²	17	37 Å²	37	7%	0.074	21%	0.205	C	C	.	.	S	Bend	trans	-160	165.3	178.1	50.5	170.3	172	-103	0	111	D464 D468 N469 I470 T501 F504 C526	D464-K466 PolarHBondContact O-N 2.88Å; D464-K466 IonicContact OD1-NZ 2.99Å; D464-K466 PolarHBondContact OD1-NZ 3.19Å; D464-K466 IonicContact OD2-NZ 3.26Å; D464-K466 PolarHBondContact OD2-NZ 3.38Å; K466-D468 HydrophobicContact CD-CB 3.98Å; K466-D468 HydrophobicContact CG-CB 4.17Å; K466-D468 PolarHBondContact O-N 3.45Å; K466-D468 VanDerWaalsContact O-N 3.07Å; K466-N469 HydrophobicContact CG-CB 4.28Å; K466-N469 PolarHBondContact O-N 3.31Å; K466-I470 PolarHBondContact O-N 3.23Å; K466-T501 PolarHBondContact NZ-OG1 3.21Å; K466-F504 HydrophobicContact CB-CD1 4.27Å; K466-F504 HydrophobicContact CB-CD2 3.71Å; K466-F504 HydrophobicContact CB-CE1 4.21Å; K466-F504 HydrophobicContact CB-CE2 3.62Å; K466-F504 HydrophobicContact CB-CG 4.04Å; K466-F504 HydrophobicContact CB-CZ 3.89Å; K466-F504 HydrophobicContact CD-CD2 4.15Å; K466-F504 HydrophobicContact CD-CE2 4.11Å; K466-C526 VanDerWaalsContact CA-SG 3.54Å
467	C	94.1	Very high	86.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-15.3	177.6	-65.2	0	0	0	0	114.6	L424 K425 E529	L424-C467 HydrophobicContact CB-CB 4.07Å; L424-C467 WeakPolarHBondContact CB-O 3.22Å; L424-C467 HydrophobicContact CD2-CB 4.2Å; L424-C467 VanDerWaalsContact CD2-SG 3.6Å; L424-C467 HydrophobicContact CG-CB 4.03Å; L424-C467 PolarHBondContact N-O 2.7Å; K425-C467 HydrophobicContact CB-CB 3.92Å; K425-C467 PolarHBondContact N-O 3.39Å; C467-E529 VanDerWaalsContact CB-OE2 3.22Å; C467-E529 WeakPolarHBondContact CB-OE2 3.13Å; C467-E529 PolarHBondContact SG-OE2 2.87Å
468	D	90.3	Very high	86.7	Confident	54 Å²	54	26.6 Å²	26.6	29%	0.289	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-34.1	167.8	-78.3	-53.3	0	0	0	113	T423 K425 K466	T423-D468 WeakPolarHBondContact CB-O 3.18Å; T423-D468 WeakPolarHBondContact CG2-O 3.46Å; K425-D468 WeakPolarHBondContact CD-OD1 3.44Å; K425-D468 WeakPolarHBondContact CD-OD2 3.42Å; K425-D468 IonicContact NZ-OD2 2.73Å; K425-D468 PolarHBondContact NZ-OD2 2.73Å; K466-D468 HydrophobicContact CD-CB 3.98Å; K466-D468 HydrophobicContact CG-CB 4.17Å; K466-D468 PolarHBondContact O-N 3.45Å; K466-D468 VanDerWaalsContact O-N 3.07Å
469	N	91.8	Very high	87.4	Confident	9 Å²	9	24.6 Å²	24.6	5%	0.048	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-2.8	-173.5	-63.9	-2	0	0	0	112.2	D464 K466 F471 G482 D483	D464-N469 PolarHBondContact O-ND2 2.82Å; D464-N469 PolarHBondContact OD2-ND2 3.44Å; K466-N469 HydrophobicContact CG-CB 4.28Å; K466-N469 PolarHBondContact O-N 3.31Å; N469-F471 WeakPolarHBondContact O-CD2 3.44Å; N469-G482 PolarHBondContact O-N 3.4Å; N469-D483 HydrophobicContact CB-CB 4.28Å
470	I	95.4	Very high	87.9	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	108	171.7	-61.6	160.6	0	0	0	108.1	T423 L424 I446 L465 K466 V479 C526	T423-I470 CarbonylContact C-O 3.6Å; T423-I470 WeakPolarHBondContact CA-O 3.44Å; L424-I470 HydrophobicContact CB-CB 4.18Å; L424-I470 HydrophobicContact CB-CG2 4.18Å; L424-I470 HydrophobicContact CD2-CB 4.32Å; L424-I470 HydrophobicContact CD2-CD1 4.13Å; L424-I470 HydrophobicContact CD2-CG2 4.1Å; L424-I470 PolarHBondContact N-O 3.07Å; I446-I470 HydrophobicContact CD1-CD1 3.82Å; I446-I470 HydrophobicContact CD1-CG2 4.19Å; I446-I470 HydrophobicContact CG1-CD1 4.18Å; I446-I470 HydrophobicContact CG1-CG2 4.16Å; L465-I470 HydrophobicContact CD1-CD1 4.19Å; L465-I470 HydrophobicContact CD1-CG1 4.12Å; K466-I470 PolarHBondContact O-N 3.23Å; I470-V479 HydrophobicContact CG2-CB 3.99Å; I470-V479 HydrophobicContact CG2-CG1 4.22Å; I470-C526 HydrophobicContact CD1-CB 4.32Å
471	F	95.1	Very high	88.4	Confident	41 Å²	41	24.6 Å²	24.6	18%	0.18	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	148.1	-177.6	-64.9	-90.5	0	0	0	111.7	V394 M419 T423 N469 V479 K480	V394-F471 HydrophobicContact CG2-CD2 3.91Å; V394-F471 HydrophobicContact CG2-CG 4.49Å; M419-F471 HydrophobicContact CB-CB 3.77Å; M419-F471 HydrophobicContact CB-CD1 3.48Å; M419-F471 VanDerWaalsContact CB-CD1 3.48Å; M419-F471 HydrophobicContact CB-CE1 4.27Å; M419-F471 HydrophobicContact CB-CG 3.76Å; M419-F471 HydrophobicContact CE-CB 3.68Å; M419-F471 HydrophobicContact CG-CB 3.58Å; M419-F471 HydrophobicContact CG-CD1 3.88Å; M419-F471 HydrophobicContact CG-CD2 4.26Å; M419-F471 HydrophobicContact CG-CG 3.64Å; M419-F471 HydrophobicContact SD-CB 4.37Å; T423-F471 HydrophobicContact CG2-CD1 3.92Å; T423-F471 HydrophobicContact CG2-CE1 3.84Å; N469-F471 WeakPolarHBondContact O-CD2 3.44Å; F471-V479 CarbonylContact O-C 3.54Å; F471-V479 VanDerWaalsContact O-CA 3.28Å; F471-V479 WeakPolarHBondContact O-CA 3.4Å; F471-K480 PolarHBondContact N-O 3.25Å; F471-K480 PolarHBondContact O-N 2.65Å
472	I	94.3	Very high	88.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	141.5	176.4	-49.8	169.4	0	0	0	110.1	L67 S421 G422 Y427 W442 V479	L67-I472 HydrophobicContact CD2-CD1 4.38Å; L67-I472 HydrophobicContact CD2-CG2 3.62Å; S421-I472 WeakPolarHBondContact CB-O 3.25Å; G422-I472 PolarHBondContact O-N 2.89Å; Y427-I472 HydrophobicContact CD2-CD1 3.97Å; Y427-I472 HydrophobicContact CG-CD1 3.98Å; W442-I472 HydrophobicContact CH2-CD1 3.79Å; W442-I472 HydrophobicContact CZ2-CD1 4.17Å; W442-I472 HydrophobicContact CZ2-CG2 4.26Å; W442-I472 HydrophobicContact CZ3-CD1 4.32Å; I472-V479 HydrophobicContact CG1-CG1 4.13Å
473	T	91.5	Very high	88.4	Confident	21 Å²	21	27.2 Å²	27.2	13%	0.129	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	96.8	179.1	-47.2	0	0	0	0	109.9	T475 T476 G477 S478	T473-T475 PolarHBondContact O-N 2.55Å; T473-T475 VanDerWaalsContact O-N 3.09Å; T473-T476 PolarHBondContact O-N 2.91Å; T473-T476 VanDerWaalsContact O-N 3.09Å; T473-G477 WeakPolarHBondContact O-CA 3.38Å; T473-G477 PolarHBondContact O-N 3.21Å; T473-S478 WeakPolarHBondContact CB-O 3.39Å; T473-S478 WeakPolarHBondContact CB-OG 3.45Å; T473-S478 PolarHBondContact N-O 3.13Å; T473-S478 PolarHBondContact OG1-O 3.02Å; T473-S478 PolarHBondContact OG1-OG 3.04Å
474	G	78.1	Confident	88.1	Confident	27 Å²	27	26.3 Å²	26.3	28%	0.278	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.5	-171.2	0	0	0	0	0	116.1	S421 T476	S421-G474 WeakPolarHBondContact OG-CA 3.26Å; S421-G474 PolarHBondContact OG-N 3.37Å; G474-T476 VanDerWaalsContact C-N 3.28Å; G474-T476 PolarHBondContact O-N 3.33Å
475	T	70.6	Confident	86.9	Confident	127 Å²	127	25.3 Å²	25.3	78%	0.779	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-21.7	178.3	52.6	0	0	0	0	114.1	T473	T473-T475 PolarHBondContact O-N 2.55Å; T473-T475 VanDerWaalsContact O-N 3.09Å
476	T	70.7	Confident	85.2	Confident	83 Å²	83	29.2 Å²	29.2	51%	0.509	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.6	-13.7	-175.8	51.7	0	0	0	0	113.5	L59 T473 G474 S478	L59-T476 WeakPolarHBondContact CD1-O 3.36Å; T473-T476 PolarHBondContact O-N 2.91Å; T473-T476 VanDerWaalsContact O-N 3.09Å; G474-T476 VanDerWaalsContact C-N 3.28Å; G474-T476 PolarHBondContact O-N 3.33Å; T476-S478 PolarHBondContact O-N 3.36Å; T476-S478 PolarHBondContact OG1-N 3.06Å; T476-S478 PolarHBondContact OG1-OG 3.15Å
477	G	83.6	Confident	83.4	Confident	5 Å²	5	28.6 Å²	28.6	5%	0.052	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	61	19.6	-168	0	0	0	0	0	114	W442 T473	W442-G477 PolarHBondContact NE1-O 3.17Å; T473-G477 WeakPolarHBondContact O-CA 3.38Å; T473-G477 PolarHBondContact O-N 3.21Å
478	S	93.3	Very high	81.2	Confident	24 Å²	24	29.8 Å²	29.8	17%	0.168	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	160.9	171.9	61.7	0	0	0	0	111.7	T473 T476	T473-S478 WeakPolarHBondContact CB-O 3.39Å; T473-S478 WeakPolarHBondContact CB-OG 3.45Å; T473-S478 PolarHBondContact N-O 3.13Å; T473-S478 PolarHBondContact OG1-O 3.02Å; T473-S478 PolarHBondContact OG1-OG 3.04Å; T476-S478 PolarHBondContact O-N 3.36Å; T476-S478 PolarHBondContact OG1-N 3.06Å; T476-S478 PolarHBondContact OG1-OG 3.15Å
479	V	96.4	Very high	78.9	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	146	174.9	-70.2	0	0	0	0	112.3	N392 W442 Q445 I446 I470 F471 I472	N392-V479 WeakPolarHBondContact CA-O 3.47Å; N392-V479 WeakPolarHBondContact CB-O 3.48Å; N392-V479 PolarHBondContact ND2-O 3.28Å; W442-V479 HydrophobicContact CB-CG1 4.22Å; W442-V479 HydrophobicContact CB-CG2 4.09Å; W442-V479 HydrophobicContact CD2-CG1 3.93Å; W442-V479 HydrophobicContact CG-CG1 3.71Å; W442-V479 HydrophobicContact CG-CG2 4.28Å; Q445-V479 HydrophobicContact CB-CG2 3.5Å; Q445-V479 HydrophobicContact CG-CG2 4.47Å; I446-V479 HydrophobicContact CG1-CG2 4.08Å; I470-V479 HydrophobicContact CG2-CB 3.99Å; I470-V479 HydrophobicContact CG2-CG1 4.22Å; F471-V479 CarbonylContact O-C 3.54Å; F471-V479 VanDerWaalsContact O-CA 3.28Å; F471-V479 WeakPolarHBondContact O-CA 3.4Å; I472-V479 HydrophobicContact CG1-CG1 4.13Å
480	K	96.7	Very high	76.5	Confident	31 Å²	31	30.8 Å²	30.8	14%	0.135	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	129.8	177.6	-70.4	-173.4	169.5	-172	0	110.9	P391 N392 V394 E417 M419 F471	P391-K480 WeakPolarHBondContact O-CE 3.46Å; P391-K480 WeakPolarHBondContact O-CG 3.35Å; N392-K480 WeakPolarHBondContact O-CA 3.39Å; V394-K480 HydrophobicContact CG2-CB 3.7Å; E417-K480 IonicContact OE1-NZ 2.91Å; E417-K480 PolarHBondContact OE1-NZ 2.98Å; E417-K480 IonicContact OE2-NZ 3.24Å; E417-K480 PolarHBondContact OE2-NZ 3.03Å; M419-K480 HydrophobicContact CE-CB 4.12Å; M419-K480 HydrophobicContact CE-CD 3.97Å; M419-K480 HydrophobicContact CE-CG 4.31Å; M419-K480 HydrophobicContact SD-CD 3.98Å; F471-K480 PolarHBondContact N-O 3.25Å; F471-K480 PolarHBondContact O-N 2.65Å
481	I	95.7	Very high	73.7	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	124.6	173.5	-48.4	175.6	0	0	0	108.6	N392 I393 V394 I446 L450 H462 L465	N392-I481 PolarHBondContact O-N 2.78Å; I393-I481 HydrophobicContact CD1-CB 3.98Å; I393-I481 HydrophobicContact CD1-CD1 4.23Å; I393-I481 HydrophobicContact CD1-CG1 4.4Å; V394-I481 PolarHBondContact N-O 2.83Å; I446-I481 HydrophobicContact CG2-CD1 4.02Å; L450-I481 HydrophobicContact CD2-CD1 3.92Å; L450-I481 HydrophobicContact CG-CD1 4.03Å; H462-I481 WeakPolarHBondContact CD2-CG2 3.5Å; H462-I481 WeakPolarHBondContact NE2-CG2 3.23Å; L465-I481 HydrophobicContact CD1-CD1 4.37Å; L465-I481 HydrophobicContact CD1-CG2 3.73Å
482	G	90.3	Very high	71.2	Confident	3 Å²	3	40.8 Å²	40.8	3%	0.031	23%	0.231	C	C	.	.			trans	-116.4	-163.2	-179.2	0	0	0	0	0	113.2	H462 N469 L484	H462-G482 PolarHBondContact NE2-O 3.49Å; N469-G482 PolarHBondContact O-N 3.4Å; G482-L484 PolarHBondContact O-N 2.92Å
483	D	82.1	Confident	68.5	Low	58 Å²	58	41.3 Å²	41.3	31%	0.31	24%	0.235	S	C	.	.			trans	56.9	12.5	177.2	-86.2	15.7	0	0	0	117.7	K346 N469 G485 L486	K346-D483 IonicContact NZ-OD1 2.71Å; K346-D483 PolarHBondContact NZ-OD1 3.29Å; K346-D483 IonicContact NZ-OD2 2.77Å; K346-D483 PolarHBondContact NZ-OD2 3.13Å; N469-D483 HydrophobicContact CB-CB 4.28Å; D483-G485 PolarHBondContact O-N 3.22Å; D483-L486 PolarHBondContact O-N 2.9Å
484	L	75	Confident	65.8	Low	12 Å²	12	46.5 Å²	46.5	6%	0.063	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-52.6	-11.7	170.2	-67.3	175.9	0	0	0	115.3	L385 L388 I393 L453 H462 G482 L486 A487	L385-L484 HydrophobicContact CD1-CB 4.42Å; L385-L484 WeakPolarHBondContact CD1-O 3.35Å; L385-L484 HydrophobicContact CD2-CB 3.94Å; L388-L484 HydrophobicContact CD1-CD1 4.18Å; I393-L484 HydrophobicContact CG2-CD1 3.57Å; L453-L484 HydrophobicContact CD1-CD1 4.42Å; L453-L484 HydrophobicContact CD1-CD2 3.82Å; L453-L484 HydrophobicContact CD2-CD1 3.88Å; L453-L484 HydrophobicContact CD2-CD2 4.35Å; H462-L484 HydrophobicContact CB-CD2 4.43Å; H462-L484 VanDerWaalsContact CD2-CD2 3.42Å; H462-L484 WeakPolarHBondContact CD2-CD2 3.49Å; G482-L484 PolarHBondContact O-N 2.92Å; L484-L486 PolarHBondContact O-N 3.45Å; L484-A487 HydrophobicContact CB-CB 4.44Å; L484-A487 HydrophobicContact CD2-CB 4.01Å; L484-A487 VanDerWaalsContact O-CB 3.29Å; L484-A487 WeakPolarHBondContact O-CB 3.4Å; L484-A487 PolarHBondContact O-N 3.47Å
485	G	56.9	Low	64	Low	17 Å²	17	46.5 Å²	46.5	18%	0.175	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-62.6	-1.7	174.6	0	0	0	0	0	115.5	F378 D483	F378-G485 WeakPolarHBondContact CE2-O 3.5Å; D483-G485 PolarHBondContact O-N 3.22Å
486	L	55.6	Low	62.6	Low	83 Å²	83	48.3 Å²	48.3	44%	0.435	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-121.7	6.6	169.1	-61.1	175.5	0	0	0	112.9	L365 D483 L484 T488	L365-L486 HydrophobicContact CD1-CD2 4.47Å; D483-L486 PolarHBondContact O-N 2.9Å; L484-L486 PolarHBondContact O-N 3.45Å; L486-T488 PolarHBondContact O-N 2.95Å
487	A	55	Low	61	Low	4 Å²	4	47.5 Å²	47.5	3%	0.033	25%	0.248	C	C	.	.			trans	-81.4	109.7	179.5	0	0	0	0	0	110.5	V460 I461 L484	V460-A487 HydrophobicContact CG1-CB 4.36Å; I461-A487 WeakPolarHBondContact O-CB 3.42Å; L484-A487 HydrophobicContact CB-CB 4.44Å; L484-A487 HydrophobicContact CD2-CB 4.01Å; L484-A487 VanDerWaalsContact O-CB 3.29Å; L484-A487 WeakPolarHBondContact O-CB 3.4Å; L484-A487 PolarHBondContact O-N 3.47Å
488	T	48.1	Very low	58.7	Low	24 Å²	24	52.5 Å²	52.5	15%	0.147	28%	0.278	C	S	.	.			trans	-95.4	163.2	-175.1	88.8	0	0	0	0	112.1	E381 R463 L486 S493	E381-T488 VanDerWaalsContact CD-CA 3.49Å; E381-T488 VanDerWaalsContact OE1-CA 3.3Å; E381-T488 WeakPolarHBondContact OE1-CA 3.48Å; E381-T488 WeakPolarHBondContact OE1-CB 3.46Å; R463-T488 VanDerWaalsContact CZ-O 3.27Å; R463-T488 PolarHBondContact NE-O 2.91Å; R463-T488 VanDerWaalsContact NE-O 3.16Å; R463-T488 PolarHBondContact NH1-OG1 3.03Å; R463-T488 VanDerWaalsContact NH1-OG1 3.11Å; R463-T488 PolarHBondContact NH2-O 3.1Å; R463-T488 PolarHBondContact NH2-OG1 3Å; L486-T488 PolarHBondContact O-N 2.95Å; T488-S493 WeakPolarHBondContact CB-OG 3.34Å; T488-S493 WeakPolarHBondContact OG1-CB 3.42Å; T488-S493 PolarHBondContact OG1-OG 2.8Å
489	L	40.7	Very low	56.6	Low	11 Å²	11	55.3 Å²	55.3	6%	0.058	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-85.5	137.7	-169.9	-55.5	174.7	0	0	0	114.1	E381 M384 P458 V460 N491 K492 S493	E381-L489 HydrophobicContact CG-CD1 4.1Å; E381-L489 HydrophobicContact CG-CD2 4.23Å; E381-L489 HydrophobicContact CG-CG 3.65Å; E381-L489 PolarHBondContact OE1-N 3.37Å; M384-L489 HydrophobicContact CE-CD1 3.54Å; M384-L489 HydrophobicContact CE-CD2 3.62Å; M384-L489 HydrophobicContact CE-CG 4.23Å; M384-L489 HydrophobicContact SD-CD2 3.68Å; P458-L489 HydrophobicContact CG-CD1 4.22Å; P458-L489 HydrophobicContact CG-CD2 4.36Å; V460-L489 HydrophobicContact CG2-CD2 4.24Å; L489-N491 PolarHBondContact O-N 2.93Å; L489-K492 PolarHBondContact O-N 3.35Å; L489-S493 PolarHBondContact O-OG 3.42Å
490	K	41.1	Very low	54.1	Low	74 Å²	74	56.7 Å²	56.7	32%	0.322	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-35.2	-176.9	-169.6	174.3	-175.5	173.8	0	114.3	I461 E516	I461-K490 HydrophobicContact CD1-CB 3.74Å; I461-K490 HydrophobicContact CD1-CD 4.13Å; I461-K490 HydrophobicContact CD1-CG 3.79Å; I461-K490 HydrophobicContact CG1-CB 4.47Å; K490-E516 WeakPolarHBondContact CD-OE2 3.41Å; K490-E516 WeakPolarHBondContact CE-OE2 3.19Å; K490-E516 IonicContact NZ-OE1 2.71Å; K490-E516 PolarHBondContact NZ-OE1 3.33Å; K490-E516 IonicContact NZ-OE2 2.74Å; K490-E516 PolarHBondContact NZ-OE2 3.39Å
491	N	37.8	Very low	51.7	Low	128 Å²	128	56.9 Å²	56.9	68%	0.684	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	11	-169.2	-63.9	26	0	0	0	115.3	L489	L489-N491 PolarHBondContact O-N 2.93Å
492	K	41.1	Very low	49.4	Very low	122 Å²	122	58.2 Å²	58.2	53%	0.53	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.4	-10.5	-175.4	-81	-170.1	171.3	-179.6	0	116.7	R377 E380 L489	R377-K492 PolarHBondContact NE-O 3.49Å; R377-K492 PolarHBondContact NH2-O 2.98Å; E380-K492 IonicContact OE2-NZ 2.72Å; E380-K492 PolarHBondContact OE2-NZ 3.13Å; L489-K492 PolarHBondContact O-N 3.35Å
493	S	38.1	Very low	47.6	Very low	12 Å²	12	59.8 Å²	59.8	8%	0.084	32%	0.323	C	S	.	.			trans	-131.8	83.2	-163.5	58.4	0	0	0	0	115.1	T488 L489 A495 Y514	T488-S493 WeakPolarHBondContact CB-OG 3.34Å; T488-S493 WeakPolarHBondContact OG1-CB 3.42Å; T488-S493 PolarHBondContact OG1-OG 2.8Å; L489-S493 PolarHBondContact O-OG 3.42Å; S493-A495 VanDerWaalsContact C-N 3.32Å; S493-A495 PolarHBondContact O-N 3.04Å; S493-Y514 PolarHBondContact O-OH 3.47Å
494	F	35.3	Very low	46.3	Very low	130 Å²	130	57.4 Å²	57.4	57%	0.57	31%	0.31	S	S	*	.			trans	-51.2	99.7	144	-114.7	-99.2	0	0	0	107.7	R377 E512	R377-F494 PolarHBondContact NH1-O 2.84Å; F494-E512 HydrophobicContact CD1-CB 3.9Å; F494-E512 HydrophobicContact CD1-CG 4.2Å; F494-E512 VanDerWaalsContact CD1-OE1 3.27Å; F494-E512 WeakPolarHBondContact CD1-OE1 3.38Å; F494-E512 HydrophobicContact CE1-CB 3.84Å; F494-E512 HydrophobicContact CE1-CG 4.22Å; F494-E512 HydrophobicContact CG-CB 4.35Å; F494-E512 HydrophobicContact CZ-CB 4.24Å
495	A	39.3	Very low	45.5	Very low	27 Å²	27	57.4 Å²	57.4	22%	0.223	31%	0.31	C	S	.	.			trans	-108.1	85.2	-169.4	0	0	0	0	0	109.3	S493 S497	S493-A495 VanDerWaalsContact C-N 3.32Å; S493-A495 PolarHBondContact O-N 3.04Å; A495-S497 PolarHBondContact O-N 3.14Å
496	K	41.7	Very low	45.4	Very low	164 Å²	164	56.6 Å²	56.6	71%	0.713	30%	0.301	S	S	*	.			trans	-76.4	45.8	-169.9	-156.3	168.6	-156.7	70.1	0	114.2	E512	K496-E512 WeakPolarHBondContact CA-OE1 3.42Å; K496-E512 PolarHBondContact N-OE1 3Å; K496-E512 IonicContact NZ-OE2 3Å; K496-E512 PolarHBondContact NZ-OE2 2.85Å
497	S	37	Very low	45.4	Very low	67 Å²	67	53.4 Å²	53.4	47%	0.469	29%	0.285	S	S	.	.	S	Bend	trans	-142.4	111.6	-172.9	56.9	0	0	0	0	110.4	A495 I499	A495-S497 PolarHBondContact O-N 3.14Å; S497-I499 VanDerWaalsContact C-N 3.29Å; S497-I499 PolarHBondContact O-N 3.21Å
498	V	35.9	Very low	45.9	Very low	110 Å²	110	54 Å²	54	67%	0.667	29%	0.287	S	S	*	.			trans	-65.7	88.9	171.5	-177.9	0	0	0	0	108.7
499	I	48.3	Very low	46.1	Very low	83 Å²	83	54 Å²	54	43%	0.426	29%	0.286	S	S	.	.			trans	-131.7	93.1	-179.8	-59.2	179.1	0	0	0	107.7	F345 S497	F345-I499 HydrophobicContact CZ-CD1 4.37Å; S497-I499 VanDerWaalsContact C-N 3.29Å; S497-I499 PolarHBondContact O-N 3.21Å
500	G	45	Very low	46.6	Very low	29 Å²	29	57 Å²	57	30%	0.299	30%	0.297	S	S	.	.	S	Bend	trans	-172.4	159.6	174.6	0	0	0	0	0	108.4
501	T	45.5	Very low	47.2	Very low	35 Å²	35	59.4 Å²	59.4	22%	0.215	31%	0.31	C	S	.	.			trans	-81.6	114.1	167.5	-61.3	0	0	0	0	107.2	K466 E503 F504 Y535	K466-T501 PolarHBondContact NZ-OG1 3.21Å; T501-E503 HydrophobicContact CG2-CB 4.5Å; T501-E503 WeakPolarHBondContact CG2-OE2 3.42Å; T501-E503 PolarHBondContact O-N 2.87Å; T501-F504 HydrophobicContact CG2-CD2 3.96Å; T501-F504 HydrophobicContact CG2-CE2 4.43Å; T501-F504 PolarHBondContact O-N 3.49Å; T501-Y535 VanDerWaalsContact CG2-OH 3.3Å; T501-Y535 WeakPolarHBondContact CG2-OH 3.43Å
502	P	48.5	Very low	47.8	Very low	29 Å²	29	55.8 Å²	55.8	19%	0.188	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-64.1	-21.5	-164.8	24	-32	0	0	0	113.4	F504 M505 Y510 P543	P502-F504 VanDerWaalsContact C-N 3.26Å; P502-F504 PolarHBondContact O-N 3.33Å; P502-M505 HydrophobicContact CB-SD 4.5Å; P502-M505 PolarHBondContact O-N 3.25Å; P502-Y510 WeakPolarHBondContact CB-OH 3.48Å; P502-P543 HydrophobicContact CB-CB 3.99Å; P502-P543 HydrophobicContact CG-CB 3.6Å; P502-P543 HydrophobicContact CG-CG 3.67Å
503	E	51.8	Low	48.4	Very low	37 Å²	37	56.7 Å²	56.7	17%	0.173	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-65.3	-22.9	173.8	-53.9	100.1	-124.9	0	0	114.6	T501 Y535 I546	T501-E503 HydrophobicContact CG2-CB 4.5Å; T501-E503 WeakPolarHBondContact CG2-OE2 3.42Å; T501-E503 PolarHBondContact O-N 2.87Å; E503-Y535 HydrophobicContact CB-CE1 3.82Å; E503-Y535 HydrophobicContact CG-CE1 3.78Å; E503-Y535 WeakPolarHBondContact OE2-CE1 3.5Å; E503-Y535 VanDerWaalsContact OE2-CZ 3.3Å; E503-Y535 PolarHBondContact OE2-OH 3.42Å; E503-I546 HydrophobicContact CB-CD1 4.48Å; E503-I546 HydrophobicContact CG-CD1 3.47Å; E503-I546 VanDerWaalsContact CG-CD1 3.47Å
504	F	54.9	Low	49.8	Very low	7 Å²	7	57.3 Å²	57.3	3%	0.031	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-106.2	-4.2	179.3	-67.7	-73.2	0	0	0	113.8	K466 T501 P502 M525 Y535 P536	K466-F504 HydrophobicContact CB-CD1 4.27Å; K466-F504 HydrophobicContact CB-CD2 3.71Å; K466-F504 HydrophobicContact CB-CE1 4.21Å; K466-F504 HydrophobicContact CB-CE2 3.62Å; K466-F504 HydrophobicContact CB-CG 4.04Å; K466-F504 HydrophobicContact CB-CZ 3.89Å; K466-F504 HydrophobicContact CD-CD2 4.15Å; K466-F504 HydrophobicContact CD-CE2 4.11Å; T501-F504 HydrophobicContact CG2-CD2 3.96Å; T501-F504 HydrophobicContact CG2-CE2 4.43Å; T501-F504 PolarHBondContact O-N 3.49Å; P502-F504 VanDerWaalsContact C-N 3.26Å; P502-F504 PolarHBondContact O-N 3.33Å; F504-M525 HydrophobicContact CD1-CB 3.74Å; F504-M525 HydrophobicContact CE1-CB 4.05Å; F504-Y535 AromaticContact CE2-CE2 3.48Å; F504-Y535 HydrophobicContact CE2-CE2 3.48Å; F504-Y535 VanDerWaalsContact CE2-CE2 3.48Å; F504-Y535 AromaticContact CE2-CZ 3.6Å; F504-Y535 VanDerWaalsContact CE2-OH 3.26Å; F504-Y535 WeakPolarHBondContact CE2-OH 3.5Å; F504-Y535 HydrophobicContact CZ-CD2 4.27Å; F504-Y535 AromaticContact CZ-CE2 3.54Å; F504-Y535 HydrophobicContact CZ-CE2 3.54Å; F504-P536 HydrophobicContact CE1-CG 4.46Å
505	M	58.8	Low	52	Low	13 Å²	13	52.8 Å²	52.8	6%	0.064	28%	0.279	C	S	.	.			trans	-78.6	131	-176.7	-70.4	172.1	68.3	0	0	110.9	P502 M509 Y510 Y521	P502-M505 HydrophobicContact CB-SD 4.5Å; P502-M505 PolarHBondContact O-N 3.25Å; M505-M509 HydrophobicContact CB-CB 4.24Å; M505-M509 HydrophobicContact CB-CE 4.48Å; M505-M509 HydrophobicContact CB-CG 4.48Å; M505-M509 HydrophobicContact CE-CB 4.11Å; M505-M509 HydrophobicContact CE-CG 3.78Å; M505-M509 HydrophobicContact CG-CE 4.3Å; M505-M509 HydrophobicContact CG-CG 4.35Å; M505-Y510 HydrophobicContact CB-CE2 3.97Å; M505-Y510 HydrophobicContact CE-CD1 4.5Å; M505-Y510 HydrophobicContact CE-CD2 4.26Å; M505-Y510 HydrophobicContact CE-CE1 4.11Å; M505-Y510 HydrophobicContact CE-CE2 3.85Å; M505-Y510 HydrophobicContact SD-CE2 4.45Å; M505-Y521 WeakPolarHBondContact O-CE1 3.46Å
506	A	53.9	Low	54.3	Low	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.283	C	S	.	.			trans	-65.4	152.3	167.7	0	0	0	0	0	110.2	E508 M509 V518 Y521	A506-E508 VanDerWaalsContact C-N 3.29Å; A506-E508 WeakPolarHBondContact CB-OE1 3.25Å; A506-E508 WeakPolarHBondContact CB-OE2 3.42Å; A506-E508 PolarHBondContact O-N 3.03Å; A506-M509 WeakPolarHBondContact O-CB 3.38Å; A506-M509 PolarHBondContact O-N 3.39Å; A506-V518 HydrophobicContact CB-CB 4.27Å; A506-V518 HydrophobicContact CB-CG1 4.08Å; A506-Y521 HydrophobicContact CB-CD1 3.85Å; A506-Y521 HydrophobicContact CB-CD2 4.4Å; A506-Y521 HydrophobicContact CB-CE1 4.43Å; A506-Y521 HydrophobicContact CB-CG 3.83Å
507	P	55.7	Low	56.6	Low	15 Å²	15	47.4 Å²	47.4	10%	0.097	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-56.4	-40.9	-175.9	18.7	-29	0	0	0	113	M509 Y510 V550 I551 V579	P507-M509 VanDerWaalsContact C-N 3.25Å; P507-M509 PolarHBondContact O-N 3.31Å; P507-Y510 WeakPolarHBondContact O-CD2 3.49Å; P507-Y510 PolarHBondContact O-N 3Å; P507-V550 HydrophobicContact CB-CG1 3.99Å; P507-V550 HydrophobicContact CG-CG1 4.12Å; P507-I551 HydrophobicContact CB-CG2 4.01Å; P507-V579 HydrophobicContact CG-CG1 4.19Å
508	E	64.9	Low	59.1	Low	16 Å²	16	44.2 Å²	44.2	8%	0.075	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-74.9	-6.5	178.4	77.7	-71.3	176.3	0	0	114	A506 Y510 E511 V518 R584	A506-E508 VanDerWaalsContact C-N 3.29Å; A506-E508 WeakPolarHBondContact CB-OE1 3.25Å; A506-E508 WeakPolarHBondContact CB-OE2 3.42Å; A506-E508 PolarHBondContact O-N 3.03Å; E508-Y510 PolarHBondContact O-N 2.73Å; E508-E511 PolarHBondContact O-N 3.19Å; E508-E511 VanDerWaalsContact O-O 3.04Å; E508-V518 WeakPolarHBondContact OE1-CG1 3.49Å; E508-R584 IonicContact OE1-CZ 3.72Å; E508-R584 IonicContact OE1-NH1 2.67Å; E508-R584 PolarHBondContact OE1-NH1 2.72Å; E508-R584 IonicContact OE1-NH2 3.99Å; E508-R584 PolarHBondContact OE1-NH2 3Å; E508-R584 IonicContact OE2-CZ 2.6Å; E508-R584 IonicContact OE2-NH1 3.04Å; E508-R584 IonicContact OE2-NH2 3.71Å; E508-R584 PolarHBondContact OE2-NH2 2.78Å
509	M	51.9	Low	61.8	Low	24 Å²	24	39 Å²	39	12%	0.118	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-68.9	-10.9	173.3	-163.5	105.5	75.8	0	0	112.2	R463 M505 A506 P507 V518	R463-M509 HydrophobicContact CB-CE 4.48Å; R463-M509 HydrophobicContact CB-SD 4.09Å; R463-M509 HydrophobicContact CG-SD 4.39Å; R463-M509 VanDerWaalsContact O-CE 3.29Å; R463-M509 WeakPolarHBondContact O-CE 3.49Å; M505-M509 HydrophobicContact CB-CB 4.24Å; M505-M509 HydrophobicContact CB-CE 4.48Å; M505-M509 HydrophobicContact CB-CG 4.48Å; M505-M509 HydrophobicContact CE-CB 4.11Å; M505-M509 HydrophobicContact CE-CG 3.78Å; M505-M509 HydrophobicContact CG-CE 4.3Å; M505-M509 HydrophobicContact CG-CG 4.35Å; A506-M509 WeakPolarHBondContact O-CB 3.38Å; A506-M509 PolarHBondContact O-N 3.39Å; P507-M509 VanDerWaalsContact C-N 3.25Å; P507-M509 PolarHBondContact O-N 3.31Å; M509-V518 HydrophobicContact CE-CB 3.71Å; M509-V518 HydrophobicContact CE-CG1 4.21Å; M509-V518 HydrophobicContact CE-CG2 3.95Å; M509-V518 HydrophobicContact SD-CB 3.91Å; M509-V518 HydrophobicContact SD-CG1 3.88Å; M509-V518 HydrophobicContact SD-CG2 3.88Å
510	Y	51.6	Low	64	Low	74 Å²	74	35.3 Å²	35.3	29%	0.29	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-87.9	-12.2	171.5	-67.1	-94.7	0	0	0	112.8	P502 M505 P507 E508 Y547	P502-Y510 WeakPolarHBondContact CB-OH 3.48Å; M505-Y510 HydrophobicContact CB-CE2 3.97Å; M505-Y510 HydrophobicContact CE-CD1 4.5Å; M505-Y510 HydrophobicContact CE-CD2 4.26Å; M505-Y510 HydrophobicContact CE-CE1 4.11Å; M505-Y510 HydrophobicContact CE-CE2 3.85Å; M505-Y510 HydrophobicContact SD-CE2 4.45Å; P507-Y510 WeakPolarHBondContact O-CD2 3.49Å; P507-Y510 PolarHBondContact O-N 3Å; E508-Y510 PolarHBondContact O-N 2.73Å; Y510-Y547 HydrophobicContact CD1-CD2 4.38Å; Y510-Y547 HydrophobicContact CD1-CE2 4.16Å; Y510-Y547 AromaticContact CD2-CD2 3.78Å; Y510-Y547 HydrophobicContact CD2-CD2 3.78Å; Y510-Y547 AromaticContact CD2-CE2 3.46Å; Y510-Y547 HydrophobicContact CD2-CE2 3.46Å; Y510-Y547 VanDerWaalsContact CD2-CE2 3.46Å; Y510-Y547 HydrophobicContact CE1-CD2 4.18Å; Y510-Y547 HydrophobicContact CE1-CE2 4.42Å; Y510-Y547 AromaticContact CE2-CD2 3.54Å; Y510-Y547 HydrophobicContact CE2-CD2 3.54Å; Y510-Y547 AromaticContact CE2-CE2 3.77Å; Y510-Y547 HydrophobicContact CE2-CE2 3.77Å; Y510-Y547 HydrophobicContact CG-CD2 4.19Å; Y510-Y547 AromaticContact CG-CE2 3.67Å; Y510-Y547 HydrophobicContact CG-CE2 3.67Å; Y510-Y547 AromaticContact CZ-CD2 3.75Å
511	E	53.7	Low	66.4	Low	126 Å²	126	34.1 Å²	34.1	59%	0.589	17%	0.167	S	C	*	.	S	Bend	trans	-95.5	143.9	168.7	-65.4	172.2	-157.3	0	0	109.2	E508 M513 Y514	E508-E511 PolarHBondContact O-N 3.19Å; E508-E511 VanDerWaalsContact O-O 3.04Å; E511-M513 PolarHBondContact O-N 3.01Å; E511-Y514 WeakPolarHBondContact O-CD1 3.43Å
512	E	51.2	Low	68.7	Low	52 Å²	52	32.4 Å²	32.4	24%	0.243	16%	0.157	C	C	.	.	S	Bend	trans	-76.5	21.3	-174.9	-57.4	-169.6	77	0	0	113.2	F494 K496	F494-E512 HydrophobicContact CD1-CB 3.9Å; F494-E512 HydrophobicContact CD1-CG 4.2Å; F494-E512 VanDerWaalsContact CD1-OE1 3.27Å; F494-E512 WeakPolarHBondContact CD1-OE1 3.38Å; F494-E512 HydrophobicContact CE1-CB 3.84Å; F494-E512 HydrophobicContact CE1-CG 4.22Å; F494-E512 HydrophobicContact CG-CB 4.35Å; F494-E512 HydrophobicContact CZ-CB 4.24Å; K496-E512 WeakPolarHBondContact CA-OE1 3.42Å; K496-E512 PolarHBondContact N-OE1 3Å; K496-E512 IonicContact NZ-OE2 3Å; K496-E512 PolarHBondContact NZ-OE2 2.85Å
513	M	54.4	Low	71	Confident	140 Å²	140	31 Å²	31	69%	0.69	15%	0.148	S	C	*	.			trans	-134.7	47.2	-175.9	-64	-141.6	-56.3	0	0	115	E511 R581	E511-M513 PolarHBondContact O-N 3.01Å; M513-R581 PolarHBondContact O-NH1 2.73Å
514	Y	67.1	Low	73.2	Confident	26 Å²	26	29.3 Å²	29.3	10%	0.102	14%	0.139	C	C	.	.			trans	-75.5	162.3	170.4	43.5	-102.3	0	0	0	113.5	R463 S493 E511	R463-Y514 VanDerWaalsContact CZ-CE2 3.47Å; R463-Y514 PolarHBondContact NH1-OH 2.98Å; R463-Y514 VanDerWaalsContact NH2-CE2 3.35Å; S493-Y514 PolarHBondContact O-OH 3.47Å; E511-Y514 WeakPolarHBondContact O-CD1 3.43Å
515	D	81.1	Confident	75.1	Confident	35 Å²	35	29 Å²	29	19%	0.187	14%	0.138	C	C	.	.			trans	-135.1	-169.4	175.6	66.9	14.6	0	0	0	112.3	S517 V518	D515-S517 PolarHBondContact O-N 2.87Å; D515-S517 WeakPolarHBondContact OD1-CB 3.49Å; D515-S517 PolarHBondContact OD1-N 2.89Å; D515-S517 PolarHBondContact OD1-OG 3.31Å; D515-V518 WeakPolarHBondContact O-CG2 3.43Å; D515-V518 PolarHBondContact O-N 3.17Å
516	E	87.2	Confident	76.9	Confident	65 Å²	65	28.3 Å²	28.3	30%	0.304	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-16.7	176.3	50.2	-87.1	-164.6	0	0	115.5	H454 K490 V518 D519	H454-E516 HydrophobicContact CB-CB 4.48Å; K490-E516 WeakPolarHBondContact CD-OE2 3.41Å; K490-E516 WeakPolarHBondContact CE-OE2 3.19Å; K490-E516 IonicContact NZ-OE1 2.71Å; K490-E516 PolarHBondContact NZ-OE1 3.33Å; K490-E516 IonicContact NZ-OE2 2.74Å; K490-E516 PolarHBondContact NZ-OE2 3.39Å; E516-V518 VanDerWaalsContact C-N 3.26Å; E516-V518 PolarHBondContact O-N 3.09Å; E516-D519 PolarHBondContact O-N 2.98Å
517	S	90.7	Very high	78.9	Confident	13 Å²	13	28.3 Å²	28.3	9%	0.091	14%	0.135	C	C	.	.	H	α-helix	trans	-71.8	-15.4	177.8	73.4	0	0	0	0	114.1	D515 D519 V520 Y521 R581 R584	D515-S517 PolarHBondContact O-N 2.87Å; D515-S517 WeakPolarHBondContact OD1-CB 3.49Å; D515-S517 PolarHBondContact OD1-N 2.89Å; D515-S517 PolarHBondContact OD1-OG 3.31Å; S517-D519 VanDerWaalsContact C-N 3.32Å; S517-V520 WeakPolarHBondContact O-CB 3.12Å; S517-V520 PolarHBondContact O-N 2.93Å; S517-Y521 PolarHBondContact O-N 3.11Å; S517-R581 WeakPolarHBondContact OG-CB 3.46Å; S517-R584 PolarHBondContact O-NH1 3.1Å; S517-R584 VanDerWaalsContact O-NH1 3.13Å; S517-R584 PolarHBondContact OG-NH1 3.37Å
518	V	89.2	Confident	80.9	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-67.8	-36.2	171.6	-54.4	0	0	0	0	111.2	I461 A506 E508 M509 D515 E516 V520 Y521 A522	I461-V518 HydrophobicContact CG2-CG2 3.64Å; A506-V518 HydrophobicContact CB-CB 4.27Å; A506-V518 HydrophobicContact CB-CG1 4.08Å; E508-V518 WeakPolarHBondContact OE1-CG1 3.49Å; M509-V518 HydrophobicContact CE-CB 3.71Å; M509-V518 HydrophobicContact CE-CG1 4.21Å; M509-V518 HydrophobicContact CE-CG2 3.95Å; M509-V518 HydrophobicContact SD-CB 3.91Å; M509-V518 HydrophobicContact SD-CG1 3.88Å; M509-V518 HydrophobicContact SD-CG2 3.88Å; D515-V518 WeakPolarHBondContact O-CG2 3.43Å; D515-V518 PolarHBondContact O-N 3.17Å; E516-V518 VanDerWaalsContact C-N 3.26Å; E516-V518 PolarHBondContact O-N 3.09Å; V518-V520 VanDerWaalsContact C-N 3.3Å; V518-V520 PolarHBondContact O-N 2.91Å; V518-Y521 PolarHBondContact O-N 3.34Å; V518-A522 WeakPolarHBondContact O-CB 3.48Å; V518-A522 PolarHBondContact O-N 3.32Å
519	D	92.5	Very high	82.3	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-72.1	-27.9	177.6	-63.1	-19.1	0	0	0	111.1	L450 H454 H462 R463 L465 E516 S517 F523	L450-D519 HydrophobicContact CD1-CB 4.23Å; L450-D519 HydrophobicContact CD2-CB 3.99Å; H454-D519 IonicContact CD2-OD2 3.84Å; H454-D519 IonicContact CE1-OD2 3.97Å; H454-D519 IonicContact NE2-OD2 3.62Å; H454-D519 PolarHBondContact NE2-OD2 3.15Å; H462-D519 WeakPolarHBondContact CB-OD1 3.22Å; H462-D519 PolarHBondContact N-OD1 3.09Å; H462-D519 PolarHBondContact N-OD2 3.35Å; R463-D519 PolarHBondContact N-OD1 3.06Å; L465-D519 WeakPolarHBondContact CD2-O 3.45Å; E516-D519 PolarHBondContact O-N 2.98Å; S517-D519 VanDerWaalsContact C-N 3.32Å; D519-F523 VanDerWaalsContact O-CB 3.25Å; D519-F523 WeakPolarHBondContact O-CB 3.42Å; D519-F523 PolarHBondContact O-N 3.44Å
520	V	95.5	Very high	84.3	Confident	5 Å²	5	26.3 Å²	26.3	3%	0.03	12%	0.124	C	C	.	.	H	α-helix	trans	-67.6	-48.4	170.8	170.9	0	0	0	0	111	S517 V518 A522 F523 G524 C576 R584 S585 V587 L590	S517-V520 WeakPolarHBondContact O-CB 3.12Å; S517-V520 PolarHBondContact O-N 2.93Å; V518-V520 VanDerWaalsContact C-N 3.3Å; V518-V520 PolarHBondContact O-N 2.91Å; V520-A522 VanDerWaalsContact C-N 3.34Å; V520-A522 PolarHBondContact O-N 2.92Å; V520-F523 WeakPolarHBondContact O-CB 3.43Å; V520-F523 PolarHBondContact O-N 2.97Å; V520-G524 PolarHBondContact O-N 3.22Å; V520-C576 HydrophobicContact CG1-CB 4.2Å; V520-R584 HydrophobicContact CG1-CB 4.14Å; V520-S585 WeakPolarHBondContact CG1-O 3.41Å; V520-V587 HydrophobicContact CG2-CG2 3.71Å; V520-L590 HydrophobicContact CG1-CD1 4.27Å
521	Y	94.4	Very high	86.3	Confident	4 Å²	4	24 Å²	24	2%	0.016	12%	0.117	C	C	.	.	H	α-helix	trans	-58.6	-47.7	176.7	178.8	-88.4	0	0	0	111	M505 A506 S517 V518 F523 G524 M525 V550 C576 I577	M505-Y521 WeakPolarHBondContact O-CE1 3.46Å; A506-Y521 HydrophobicContact CB-CD1 3.85Å; A506-Y521 HydrophobicContact CB-CD2 4.4Å; A506-Y521 HydrophobicContact CB-CE1 4.43Å; A506-Y521 HydrophobicContact CB-CG 3.83Å; S517-Y521 PolarHBondContact O-N 3.11Å; V518-Y521 PolarHBondContact O-N 3.34Å; Y521-F523 PolarHBondContact O-N 3.39Å; Y521-G524 WeakPolarHBondContact O-CA 3.32Å; Y521-G524 PolarHBondContact O-N 3.05Å; Y521-G524 VanDerWaalsContact O-N 3.13Å; Y521-M525 HydrophobicContact CD1-CG 4.46Å; Y521-M525 HydrophobicContact CE1-CE 3.99Å; Y521-M525 HydrophobicContact CE1-CG 4.14Å; Y521-M525 HydrophobicContact CE2-CE 4.11Å; Y521-M525 PolarHBondContact O-N 2.86Å; Y521-M525 VanDerWaalsContact OH-CE 3.28Å; Y521-M525 WeakPolarHBondContact OH-CE 3.39Å; Y521-V550 WeakPolarHBondContact OH-CG1 3.44Å; Y521-V550 WeakPolarHBondContact OH-CG2 3.49Å; Y521-C576 WeakPolarHBondContact CA-O 3.23Å; Y521-I577 HydrophobicContact CD2-CB 4.2Å; Y521-I577 HydrophobicContact CE2-CB 4.05Å
522	A	94	Very high	88.2	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-63.6	-36.3	176.4	0	0	0	0	0	113	L465 V518 V520 M525 C526	L465-A522 HydrophobicContact CB-CB 3.83Å; L465-A522 HydrophobicContact CD2-CB 4.2Å; L465-A522 HydrophobicContact CG-CB 4.4Å; L465-A522 WeakPolarHBondContact O-CB 3.45Å; V518-A522 WeakPolarHBondContact O-CB 3.48Å; V518-A522 PolarHBondContact O-N 3.32Å; V520-A522 VanDerWaalsContact C-N 3.34Å; V520-A522 PolarHBondContact O-N 2.92Å; A522-M525 PolarHBondContact O-N 3.07Å; A522-C526 PolarHBondContact O-N 2.93Å; A522-C526 PolarHBondContact O-SG 3.29Å
523	F	97.4	Very high	90.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-62.4	-42.6	170.7	166.2	-97.2	0	0	0	111.7	C443 I446 L447 L450 L465 D519 V520 Y521 M525 C526 L527 L590 F596	C443-F523 HydrophobicContact CB-CE2 3.96Å; C443-F523 HydrophobicContact CB-CZ 4Å; I446-F523 HydrophobicContact CB-CD2 4.33Å; I446-F523 HydrophobicContact CB-CE2 4.42Å; I446-F523 HydrophobicContact CG2-CD2 3.83Å; I446-F523 HydrophobicContact CG2-CE2 4.41Å; L447-F523 HydrophobicContact CD1-CE1 4.19Å; L447-F523 HydrophobicContact CD1-CE2 4.22Å; L447-F523 HydrophobicContact CD1-CZ 3.7Å; L447-F523 HydrophobicContact CD2-CD1 3.95Å; L447-F523 HydrophobicContact CD2-CD2 4.14Å; L447-F523 HydrophobicContact CD2-CE1 3.82Å; L447-F523 HydrophobicContact CD2-CE2 4.01Å; L447-F523 HydrophobicContact CD2-CG 4.11Å; L447-F523 HydrophobicContact CD2-CZ 3.85Å; L447-F523 HydrophobicContact CG-CD2 4.27Å; L447-F523 HydrophobicContact CG-CE1 4.17Å; L447-F523 HydrophobicContact CG-CE2 3.73Å; L447-F523 HydrophobicContact CG-CZ 3.68Å; L450-F523 HydrophobicContact CD1-CB 4.2Å; L465-F523 HydrophobicContact CD2-CB 4.15Å; D519-F523 VanDerWaalsContact O-CB 3.25Å; D519-F523 WeakPolarHBondContact O-CB 3.42Å; D519-F523 PolarHBondContact O-N 3.44Å; V520-F523 WeakPolarHBondContact O-CB 3.43Å; V520-F523 PolarHBondContact O-N 2.97Å; Y521-F523 PolarHBondContact O-N 3.39Å; F523-M525 VanDerWaalsContact C-N 3.31Å; F523-M525 PolarHBondContact O-N 3.3Å; F523-C526 WeakPolarHBondContact O-CB 3.43Å; F523-C526 PolarHBondContact O-N 3.45Å; F523-L527 HydrophobicContact CE1-CD2 4.42Å; F523-L527 WeakPolarHBondContact O-CB 3.32Å; F523-L527 PolarHBondContact O-N 2.9Å; F523-L590 HydrophobicContact CD1-CD1 4.1Å; F523-L590 HydrophobicContact CE1-CD1 4.12Å; F523-F596 HydrophobicContact CE1-CE2 4.36Å; F523-F596 HydrophobicContact CE1-CZ 4.32Å; F523-F596 HydrophobicContact CZ-CE2 4.17Å; F523-F596 AromaticContact CZ-CZ 3.81Å; F523-F596 HydrophobicContact CZ-CZ 3.81Å
524	G	96.6	Very high	91.8	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58	-41.6	173.9	0	0	0	0	0	112.7	V520 Y521 L527 L528	V520-G524 PolarHBondContact O-N 3.22Å; Y521-G524 WeakPolarHBondContact O-CA 3.32Å; Y521-G524 PolarHBondContact O-N 3.05Å; Y521-G524 VanDerWaalsContact O-N 3.13Å; G524-L527 PolarHBondContact O-N 2.88Å; G524-L528 WeakPolarHBondContact O-CB 3.48Å; G524-L528 PolarHBondContact O-N 3.21Å
525	M	95.5	Very high	92.9	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-69.7	-37.6	174.8	-67.3	-58.4	-177.2	0	0	113.1	F504 Y521 A522 F523 L527 L528 E529 P536 Y537 P556 I577	F504-M525 HydrophobicContact CD1-CB 3.74Å; F504-M525 HydrophobicContact CE1-CB 4.05Å; Y521-M525 HydrophobicContact CD1-CG 4.46Å; Y521-M525 HydrophobicContact CE1-CE 3.99Å; Y521-M525 HydrophobicContact CE1-CG 4.14Å; Y521-M525 HydrophobicContact CE2-CE 4.11Å; Y521-M525 PolarHBondContact O-N 2.86Å; Y521-M525 VanDerWaalsContact OH-CE 3.28Å; Y521-M525 WeakPolarHBondContact OH-CE 3.39Å; A522-M525 PolarHBondContact O-N 3.07Å; F523-M525 VanDerWaalsContact C-N 3.31Å; F523-M525 PolarHBondContact O-N 3.3Å; M525-L527 VanDerWaalsContact C-N 3.32Å; M525-L527 PolarHBondContact O-N 2.94Å; M525-L528 PolarHBondContact O-N 2.81Å; M525-L528 HydrophobicContact SD-CD2 4.14Å; M525-E529 PolarHBondContact O-N 2.84Å; M525-P536 HydrophobicContact CB-CG 4.26Å; M525-P536 HydrophobicContact SD-CB 3.89Å; M525-P536 HydrophobicContact SD-CG 4.16Å; M525-Y537 HydrophobicContact CE-CE2 3.84Å; M525-P556 HydrophobicContact CE-CG 3.96Å; M525-P556 HydrophobicContact SD-CG 4.07Å; M525-I577 HydrophobicContact CE-CB 4.1Å; M525-I577 HydrophobicContact CE-CD1 4.25Å; M525-I577 HydrophobicContact CE-CG2 3.9Å; M525-I577 HydrophobicContact CG-CG2 4.27Å; M525-I577 HydrophobicContact SD-CG2 4.07Å
526	C	96.9	Very high	93.5	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-63	-38.8	171.9	-65.8	0	0	0	0	112	K466 I470 A522 F523 M530	K466-C526 VanDerWaalsContact CA-SG 3.54Å; I470-C526 HydrophobicContact CD1-CB 4.32Å; A522-C526 PolarHBondContact O-N 2.93Å; A522-C526 PolarHBondContact O-SG 3.29Å; F523-C526 WeakPolarHBondContact O-CB 3.43Å; F523-C526 PolarHBondContact O-N 3.45Å; C526-M530 WeakPolarHBondContact O-CB 3.25Å; C526-M530 WeakPolarHBondContact O-CG 3.48Å; C526-M530 PolarHBondContact O-N 2.82Å
527	L	96.6	Very high	93.8	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-66.1	-43.1	174.9	175.5	58.2	0	0	0	111.1	L439 F523 G524 M525 M530 V531 I569 I572 I573 F596	L439-L527 HydrophobicContact CD2-CD1 3.81Å; F523-L527 HydrophobicContact CE1-CD2 4.42Å; F523-L527 WeakPolarHBondContact O-CB 3.32Å; F523-L527 PolarHBondContact O-N 2.9Å; G524-L527 PolarHBondContact O-N 2.88Å; M525-L527 VanDerWaalsContact C-N 3.32Å; M525-L527 PolarHBondContact O-N 2.94Å; L527-M530 PolarHBondContact O-N 2.89Å; L527-V531 HydrophobicContact CD1-CG2 3.86Å; L527-V531 HydrophobicContact CG-CG2 4.45Å; L527-V531 WeakPolarHBondContact O-CB 3.45Å; L527-V531 WeakPolarHBondContact O-CG2 3.45Å; L527-V531 PolarHBondContact O-N 2.91Å; L527-I569 HydrophobicContact CD1-CG2 4.34Å; L527-I569 HydrophobicContact CG-CG2 4.48Å; L527-I572 HydrophobicContact CD2-CB 4.49Å; L527-I572 HydrophobicContact CD2-CG2 3.63Å; L527-I573 HydrophobicContact CB-CG1 4.25Å; L527-I573 HydrophobicContact CD2-CD1 4.41Å; L527-I573 HydrophobicContact CD2-CG1 3.62Å; L527-I573 HydrophobicContact CG-CD1 3.99Å; L527-I573 HydrophobicContact CG-CG1 3.65Å; L527-F596 HydrophobicContact CD2-CZ 4.25Å
528	L	95.9	Very high	93.8	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-60	-45.7	174.3	-178.8	60.5	0	0	0	112.3	G524 M525 M530 V531 T532 P536 P556 F559 I562 I573	G524-L528 WeakPolarHBondContact O-CB 3.48Å; G524-L528 PolarHBondContact O-N 3.21Å; M525-L528 PolarHBondContact O-N 2.81Å; M525-L528 HydrophobicContact SD-CD2 4.14Å; L528-M530 VanDerWaalsContact C-N 3.34Å; L528-M530 PolarHBondContact O-N 2.89Å; L528-V531 PolarHBondContact O-N 2.73Å; L528-T532 HydrophobicContact CD1-CG2 3.79Å; L528-T532 WeakPolarHBondContact O-CB 3.41Å; L528-T532 WeakPolarHBondContact O-CG2 3.45Å; L528-T532 PolarHBondContact O-N 3.19Å; L528-T532 PolarHBondContact O-OG1 3.13Å; L528-P536 HydrophobicContact CD2-CB 4.47Å; L528-P536 HydrophobicContact CD2-CG 4.37Å; L528-P556 HydrophobicContact CD2-CB 4.01Å; L528-P556 HydrophobicContact CD2-CG 3.79Å; L528-F559 HydrophobicContact CD1-CB 4.46Å; L528-I562 HydrophobicContact CD1-CD1 3.95Å; L528-I562 HydrophobicContact CD1-CG1 3.9Å; L528-I573 HydrophobicContact CB-CD1 4.18Å; L528-I573 HydrophobicContact CB-CG2 4.3Å; L528-I573 HydrophobicContact CD1-CD1 4.21Å
529	E	94.9	Very high	94	Very high	9 Å²	9	17.2 Å²	17.2	4%	0.042	10%	0.099	C	C	.	.	H	α-helix	trans	-62.1	-40.4	175.3	-162.5	-174.4	172	0	0	111.3	L428 C467 M525 V531 G533 E534 P536	L428-E529 HydrophobicContact CD1-CG 4.1Å; C467-E529 VanDerWaalsContact CB-OE2 3.22Å; C467-E529 WeakPolarHBondContact CB-OE2 3.13Å; C467-E529 PolarHBondContact SG-OE2 2.87Å; M525-E529 PolarHBondContact O-N 2.84Å; E529-V531 PolarHBondContact O-N 3.13Å; E529-G533 WeakPolarHBondContact O-CA 3.42Å; E529-G533 PolarHBondContact O-N 2.59Å; E529-E534 WeakPolarHBondContact CA-O 3.44Å; E529-P536 HydrophobicContact CB-CG 4.49Å
530	M	94.5	Very high	93.9	Very high	3 Å²	3	18 Å²	18	2%	0.015	10%	0.104	C	C	.	.	H	α-helix	trans	-65	-34.2	176.9	-85.5	-168.5	-77.7	0	0	114.6	L424 L428 I434 L439 W442 C443 I446 C526 L527 L528	L424-M530 HydrophobicContact CD1-CG 3.91Å; L424-M530 HydrophobicContact CD1-SD 3.86Å; L424-M530 HydrophobicContact CD2-CE 4.02Å; L424-M530 HydrophobicContact CD2-CG 3.83Å; L424-M530 HydrophobicContact CD2-SD 3.62Å; L424-M530 HydrophobicContact CG-CG 4.11Å; L424-M530 HydrophobicContact CG-SD 4.27Å; L428-M530 HydrophobicContact CD1-CG 4.14Å; I434-M530 HydrophobicContact CD1-CB 4.03Å; I434-M530 HydrophobicContact CD1-CG 3.77Å; I434-M530 HydrophobicContact CD1-SD 4.26Å; L439-M530 HydrophobicContact CD1-CB 3.95Å; W442-M530 HydrophobicContact CE3-SD 4.41Å; C443-M530 WeakPolarHBondContact SG-CE 3.44Å; I446-M530 HydrophobicContact CD1-CE 4.15Å; C526-M530 WeakPolarHBondContact O-CB 3.25Å; C526-M530 WeakPolarHBondContact O-CG 3.48Å; C526-M530 PolarHBondContact O-N 2.82Å; L527-M530 PolarHBondContact O-N 2.89Å; L528-M530 VanDerWaalsContact C-N 3.34Å; L528-M530 PolarHBondContact O-N 2.89Å
531	V	93.9	Very high	93.6	Very high	26 Å²	26	27 Å²	27	16%	0.158	15%	0.148	C	C	.	.	H	α-helix	trans	-84.6	-41.7	-175.1	172.6	0	0	0	0	111.5	L439 L527 L528 E529 I562 I569	L439-V531 HydrophobicContact CD1-CG2 3.76Å; L527-V531 HydrophobicContact CD1-CG2 3.86Å; L527-V531 HydrophobicContact CG-CG2 4.45Å; L527-V531 WeakPolarHBondContact O-CB 3.45Å; L527-V531 WeakPolarHBondContact O-CG2 3.45Å; L527-V531 PolarHBondContact O-N 2.91Å; L528-V531 PolarHBondContact O-N 2.73Å; E529-V531 PolarHBondContact O-N 3.13Å; V531-I562 HydrophobicContact CG1-CG2 4.16Å; V531-I569 HydrophobicContact CG1-CG2 4.3Å; V531-I569 HydrophobicContact CG2-CD1 4.41Å; V531-I569 HydrophobicContact CG2-CG2 3.58Å
532	T	92.4	Very high	93	Very high	26 Å²	26	30.2 Å²	30.2	16%	0.16	17%	0.165	C	C	.	.	H	α-helix	trans	-86.8	-29.3	-176.8	59.5	0	0	0	0	112.7	L528 E534 C558	L528-T532 HydrophobicContact CD1-CG2 3.79Å; L528-T532 WeakPolarHBondContact O-CB 3.41Å; L528-T532 WeakPolarHBondContact O-CG2 3.45Å; L528-T532 PolarHBondContact O-N 3.19Å; L528-T532 PolarHBondContact O-OG1 3.13Å; T532-E534 PolarHBondContact O-N 3.47Å; T532-E534 PolarHBondContact OG1-N 2.93Å; T532-E534 VanDerWaalsContact OG1-N 3.12Å; T532-E534 PolarHBondContact OG1-O 3.04Å; T532-C558 HydrophobicContact CG2-CB 4.14Å; T532-C558 WeakPolarHBondContact CG2-O 3.42Å
533	G	90.8	Very high	92.4	Very high	32 Å²	32	33.5 Å²	33.5	33%	0.33	19%	0.187	S	C	.	.	S	Bend	trans	71.9	8.9	-166.5	0	0	0	0	0	113.6	E529	E529-G533 WeakPolarHBondContact O-CA 3.42Å; E529-G533 PolarHBondContact O-N 2.59Å
534	E	90.7	Very high	91.6	Very high	72 Å²	72	36 Å²	36	34%	0.336	21%	0.207	S	C	.	.	S	Bend	trans	-116.1	147.9	-179.1	-68.1	-179.7	-175.9	0	0	110.8	E529 T532 C558 R561	E529-E534 WeakPolarHBondContact CA-O 3.44Å; T532-E534 PolarHBondContact O-N 3.47Å; T532-E534 PolarHBondContact OG1-N 2.93Å; T532-E534 VanDerWaalsContact OG1-N 3.12Å; T532-E534 PolarHBondContact OG1-O 3.04Å; E534-C558 HydrophobicContact CB-CB 4.24Å; E534-C558 WeakPolarHBondContact OE2-CB 3.48Å; E534-R561 IonicContact OE1-NE 2.78Å; E534-R561 PolarHBondContact OE1-NE 2.94Å; E534-R561 IonicContact OE2-CZ 3.2Å; E534-R561 IonicContact OE2-NE 2.72Å; E534-R561 PolarHBondContact OE2-NE 3.21Å; E534-R561 IonicContact OE2-NH2 3.18Å; E534-R561 PolarHBondContact OE2-NH2 3.47Å
535	Y	90.4	Very high	91.2	Very high	54 Å²	54	37.9 Å²	37.9	21%	0.212	22%	0.219	C	C	.	.			trans	-77.7	130.8	-179.6	-167.8	-102.1	0	0	0	110.7	T501 E503 F504 S538	T501-Y535 VanDerWaalsContact CG2-OH 3.3Å; T501-Y535 WeakPolarHBondContact CG2-OH 3.43Å; E503-Y535 HydrophobicContact CB-CE1 3.82Å; E503-Y535 HydrophobicContact CG-CE1 3.78Å; E503-Y535 WeakPolarHBondContact OE2-CE1 3.5Å; E503-Y535 VanDerWaalsContact OE2-CZ 3.3Å; E503-Y535 PolarHBondContact OE2-OH 3.42Å; F504-Y535 AromaticContact CE2-CE2 3.48Å; F504-Y535 HydrophobicContact CE2-CE2 3.48Å; F504-Y535 VanDerWaalsContact CE2-CE2 3.48Å; F504-Y535 AromaticContact CE2-CZ 3.6Å; F504-Y535 VanDerWaalsContact CE2-OH 3.26Å; F504-Y535 WeakPolarHBondContact CE2-OH 3.5Å; F504-Y535 HydrophobicContact CZ-CD2 4.27Å; F504-Y535 AromaticContact CZ-CE2 3.54Å; F504-Y535 HydrophobicContact CZ-CE2 3.54Å; Y535-S538 VanDerWaalsContact O-CB 3.27Å; Y535-S538 WeakPolarHBondContact O-CB 3.38Å; Y535-S538 PolarHBondContact O-N 2.84Å; Y535-S538 PolarHBondContact O-OG 3.15Å; Y535-S538 VanDerWaalsContact O-OG 3.07Å
536	P	92.9	Very high	90.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	141	178.6	-27.2	35.9	0	0	0	112.9	F504 M525 L528 E529 S538 P556	F504-P536 HydrophobicContact CE1-CG 4.46Å; M525-P536 HydrophobicContact CB-CG 4.26Å; M525-P536 HydrophobicContact SD-CB 3.89Å; M525-P536 HydrophobicContact SD-CG 4.16Å; L528-P536 HydrophobicContact CD2-CB 4.47Å; L528-P536 HydrophobicContact CD2-CG 4.37Å; E529-P536 HydrophobicContact CB-CG 4.49Å; P536-S538 PolarHBondContact O-N 3.18Å; P536-P556 HydrophobicContact CB-CG 4.26Å
537	Y	94	Very high	90.1	Very high	7 Å²	7	39.9 Å²	39.9	3%	0.027	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.8	22.4	-177.5	-62.7	-67.5	0	0	0	115.5	M525 E539 C540 I546 K549 V550 V554 P556	M525-Y537 HydrophobicContact CE-CE2 3.84Å; Y537-E539 VanDerWaalsContact CA-OE2 3.25Å; Y537-E539 WeakPolarHBondContact CA-OE2 3.49Å; Y537-E539 PolarHBondContact O-N 2.84Å; Y537-C540 WeakPolarHBondContact O-CB 3.43Å; Y537-C540 PolarHBondContact O-N 2.99Å; Y537-I546 HydrophobicContact CD1-CG2 4.48Å; Y537-I546 HydrophobicContact CD2-CG2 3.62Å; Y537-I546 HydrophobicContact CE2-CG2 4.18Å; Y537-I546 HydrophobicContact CG-CG2 3.79Å; Y537-K549 HydrophobicContact CD1-CD 3.95Å; Y537-K549 HydrophobicContact CE1-CB 3.97Å; Y537-K549 HydrophobicContact CE1-CD 3.91Å; Y537-V550 HydrophobicContact CD2-CG2 4.43Å; Y537-V550 HydrophobicContact CE2-CG2 3.51Å; Y537-V550 WeakPolarHBondContact OH-CG2 3.08Å; Y537-V554 WeakPolarHBondContact CE1-O 3.49Å; Y537-V554 PolarHBondContact OH-O 3.48Å; Y537-V554 VanDerWaalsContact OH-O 3.07Å; Y537-P556 HydrophobicContact CD1-CB 4.11Å; Y537-P556 HydrophobicContact CD1-CG 4.09Å; Y537-P556 HydrophobicContact CD2-CG 3.98Å; Y537-P556 HydrophobicContact CE1-CB 4.17Å; Y537-P556 HydrophobicContact CE1-CG 3.81Å; Y537-P556 HydrophobicContact CE2-CG 3.71Å; Y537-P556 HydrophobicContact CG-CB 4.33Å; Y537-P556 HydrophobicContact CG-CG 4.17Å
538	S	91.8	Very high	89.6	Confident	71 Å²	71	44.2 Å²	44.2	50%	0.497	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-15.4	177.8	55.3	0	0	0	0	114.9	Y535 P536 C540	Y535-S538 VanDerWaalsContact O-CB 3.27Å; Y535-S538 WeakPolarHBondContact O-CB 3.38Å; Y535-S538 PolarHBondContact O-N 2.84Å; Y535-S538 PolarHBondContact O-OG 3.15Å; Y535-S538 VanDerWaalsContact O-OG 3.07Å; P536-S538 PolarHBondContact O-N 3.18Å; S538-C540 PolarHBondContact O-N 2.97Å
539	E	92.1	Very high	89.4	Confident	53 Å²	53	46.5 Å²	46.5	25%	0.248	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.1	170.8	76.3	-73.1	172.4	0	0	113.9	Y537 K549 E557	Y537-E539 VanDerWaalsContact CA-OE2 3.25Å; Y537-E539 WeakPolarHBondContact CA-OE2 3.49Å; Y537-E539 PolarHBondContact O-N 2.84Å; E539-K549 IonicContact OE1-NZ 3.1Å; E539-K549 PolarHBondContact OE1-NZ 2.88Å; E539-E557 HydrophobicContact CB-CB 4.42Å; E539-E557 WeakPolarHBondContact CB-OE2 3.46Å; E539-E557 HydrophobicContact CG-CB 3.98Å; E539-E557 PolarHBondContact OE1-N 3.17Å
540	C	91.2	Very high	89.1	Confident	17 Å²	17	46.4 Å²	46.4	12%	0.115	25%	0.253	C	S	.	.			trans	-100.4	119	-176.3	-61.3	0	0	0	0	112.2	Y537 S538 N542 T545 I546 K549	Y537-C540 WeakPolarHBondContact O-CB 3.43Å; Y537-C540 PolarHBondContact O-N 2.99Å; S538-C540 PolarHBondContact O-N 2.97Å; C540-N542 VanDerWaalsContact C-N 3.28Å; C540-N542 PolarHBondContact O-N 3.28Å; C540-T545 HydrophobicContact CB-CG2 4.29Å; C540-I546 HydrophobicContact CB-CD1 3.82Å; C540-I546 HydrophobicContact CB-CG1 3.27Å; C540-K549 VanDerWaalsContact SG-CE 3.51Å
541	M	87.6	Confident	88.7	Confident	193 Å²	193	48.4 Å²	48.4	95%	0.951	26%	0.264	S	S	*	.	S	Bend	trans	-70.3	-14.5	-177.3	-62.5	-175.5	73.9	0	0	115.5
542	N	82.7	Confident	88.5	Confident	71 Å²	71	51 Å²	51	38%	0.38	28%	0.283	S	S	.	.	S	Bend	trans	-152.3	154.8	-179.3	71.5	69.6	0	0	0	113.3	C540 A544 T545 I546	C540-N542 VanDerWaalsContact C-N 3.28Å; C540-N542 PolarHBondContact O-N 3.28Å; N542-A544 VanDerWaalsContact C-N 3.3Å; N542-A544 PolarHBondContact O-N 3.19Å; N542-A544 WeakPolarHBondContact OD1-CA 3.49Å; N542-A544 WeakPolarHBondContact OD1-CB 3.48Å; N542-A544 PolarHBondContact OD1-N 3.01Å; N542-T545 PolarHBondContact O-N 3.44Å; N542-T545 PolarHBondContact OD1-N 2.64Å; N542-I546 PolarHBondContact O-N 3.14Å
543	P	80.5	Confident	88.3	Confident	69 Å²	69	51.3 Å²	51.3	45%	0.448	29%	0.291	S	S	.	.	H	α-helix	trans	-55.3	-32.4	178.1	-32.6	38.9	0	0	0	116.5	P502 I546 Y547	P502-P543 HydrophobicContact CB-CB 3.99Å; P502-P543 HydrophobicContact CG-CB 3.6Å; P502-P543 HydrophobicContact CG-CG 3.67Å; P543-I546 PolarHBondContact O-N 3.01Å; P543-Y547 WeakPolarHBondContact O-CB 3.1Å; P543-Y547 PolarHBondContact O-N 3.01Å
544	A	80.5	Confident	88.4	Confident	53 Å²	53	53.2 Å²	53.2	44%	0.438	30%	0.296	S	S	.	.	H	α-helix	trans	-74.2	-28.4	-177	0	0	0	0	0	112.6	N542 R548	N542-A544 VanDerWaalsContact C-N 3.3Å; N542-A544 PolarHBondContact O-N 3.19Å; N542-A544 WeakPolarHBondContact OD1-CA 3.49Å; N542-A544 WeakPolarHBondContact OD1-CB 3.48Å; N542-A544 PolarHBondContact OD1-N 3.01Å; A544-R548 WeakPolarHBondContact O-CG 3.46Å; A544-R548 PolarHBondContact O-N 3.29Å; A544-R548 VanDerWaalsContact O-N 3.17Å; A544-R548 PolarHBondContact O-NE 2.96Å
545	T	89.1	Confident	88.6	Confident	40 Å²	40	53.1 Å²	53.1	25%	0.245	30%	0.295	C	S	.	.	H	α-helix	trans	-71.6	-37.8	169.1	-64.8	0	0	0	0	111.3	C540 N542 R548 K549	C540-T545 HydrophobicContact CB-CG2 4.29Å; N542-T545 PolarHBondContact O-N 3.44Å; N542-T545 PolarHBondContact OD1-N 2.64Å; T545-R548 PolarHBondContact O-N 2.91Å; T545-R548 PolarHBondContact OG1-NH2 3.2Å; T545-K549 PolarHBondContact O-N 3.26Å
546	I	88.1	Confident	88.8	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.021	29%	0.286	C	S	.	.	H	α-helix	trans	-64.7	-47.7	175.3	-59.2	178.1	0	0	0	110.2	E503 Y537 C540 N542 P543 R548 K549 V550	E503-I546 HydrophobicContact CB-CD1 4.48Å; E503-I546 HydrophobicContact CG-CD1 3.47Å; E503-I546 VanDerWaalsContact CG-CD1 3.47Å; Y537-I546 HydrophobicContact CD1-CG2 4.48Å; Y537-I546 HydrophobicContact CD2-CG2 3.62Å; Y537-I546 HydrophobicContact CE2-CG2 4.18Å; Y537-I546 HydrophobicContact CG-CG2 3.79Å; C540-I546 HydrophobicContact CB-CD1 3.82Å; C540-I546 HydrophobicContact CB-CG1 3.27Å; N542-I546 PolarHBondContact O-N 3.14Å; P543-I546 PolarHBondContact O-N 3.01Å; I546-R548 PolarHBondContact O-N 3.32Å; I546-K549 WeakPolarHBondContact O-CB 3.29Å; I546-K549 PolarHBondContact O-N 3.46Å; I546-K549 VanDerWaalsContact O-N 3.13Å; I546-V550 HydrophobicContact CG2-CG2 4.2Å; I546-V550 VanDerWaalsContact O-CG2 3.31Å; I546-V550 WeakPolarHBondContact O-CG2 3.41Å; I546-V550 PolarHBondContact O-N 3.07Å
547	Y	81.5	Confident	88.9	Confident	37 Å²	37	55.1 Å²	55.1	15%	0.145	31%	0.307	C	S	.	.	H	α-helix	trans	-53.9	-49.2	175.5	-179.2	-106.8	0	0	0	112.3	Y510 P543 K549 V550 I551 M1502	Y510-Y547 HydrophobicContact CD1-CD2 4.38Å; Y510-Y547 HydrophobicContact CD1-CE2 4.16Å; Y510-Y547 AromaticContact CD2-CD2 3.78Å; Y510-Y547 HydrophobicContact CD2-CD2 3.78Å; Y510-Y547 AromaticContact CD2-CE2 3.46Å; Y510-Y547 HydrophobicContact CD2-CE2 3.46Å; Y510-Y547 VanDerWaalsContact CD2-CE2 3.46Å; Y510-Y547 HydrophobicContact CE1-CD2 4.18Å; Y510-Y547 HydrophobicContact CE1-CE2 4.42Å; Y510-Y547 AromaticContact CE2-CD2 3.54Å; Y510-Y547 HydrophobicContact CE2-CD2 3.54Å; Y510-Y547 AromaticContact CE2-CE2 3.77Å; Y510-Y547 HydrophobicContact CE2-CE2 3.77Å; Y510-Y547 HydrophobicContact CG-CD2 4.19Å; Y510-Y547 AromaticContact CG-CE2 3.67Å; Y510-Y547 HydrophobicContact CG-CE2 3.67Å; Y510-Y547 AromaticContact CZ-CD2 3.75Å; P543-Y547 WeakPolarHBondContact O-CB 3.1Å; P543-Y547 PolarHBondContact O-N 3.01Å; Y547-K549 PolarHBondContact O-N 3.13Å; Y547-V550 PolarHBondContact O-N 3.1Å; Y547-I551 HydrophobicContact CD1-CD1 4.38Å; Y547-I551 HydrophobicContact CD2-CG2 4.33Å; Y547-I551 HydrophobicContact CE1-CD1 3.91Å; Y547-I551 HydrophobicContact CE1-CG2 4.16Å; Y547-I551 HydrophobicContact CE2-CG2 3.74Å; Y547-I551 PolarHBondContact O-N 2.68Å; Y547-M1502 HydrophobicContact CE1-CE 4.26Å; Y547-M1502 WeakPolarHBondContact OH-CE 3.5Å; Y547-M1502 PolarHBondContact OH-SD 3.25Å
548	R	87	Confident	88.9	Confident	92 Å²	92	54.8 Å²	54.8	35%	0.347	31%	0.305	S	S	.	.	H	α-helix	trans	-60.9	-40	176	-77.4	-177.9	-65.4	171.5	5.1	113.3	A544 T545 I546 I551 S552 E1495	A544-R548 WeakPolarHBondContact O-CG 3.46Å; A544-R548 PolarHBondContact O-N 3.29Å; A544-R548 VanDerWaalsContact O-N 3.17Å; A544-R548 PolarHBondContact O-NE 2.96Å; T545-R548 PolarHBondContact O-N 2.91Å; T545-R548 PolarHBondContact OG1-NH2 3.2Å; I546-R548 PolarHBondContact O-N 3.32Å; R548-I551 WeakPolarHBondContact O-CG1 3.39Å; R548-S552 WeakPolarHBondContact O-CB 3.18Å; R548-S552 PolarHBondContact O-N 2.64Å; R548-S552 PolarHBondContact O-OG 3.3Å; R548-E1495 IonicContact NH1-OE1 2.69Å
549	K	91.5	Very high	89.1	Confident	47 Å²	47	52.4 Å²	52.4	20%	0.204	29%	0.286	C	S	.	.	H	α-helix	trans	-62.1	-45.4	172.6	-77.8	-164.2	-178.7	-165.5	0	112.2	Y537 E539 C540 T545 I546 Y547 S552 G553 V554	Y537-K549 HydrophobicContact CD1-CD 3.95Å; Y537-K549 HydrophobicContact CE1-CB 3.97Å; Y537-K549 HydrophobicContact CE1-CD 3.91Å; E539-K549 IonicContact OE1-NZ 3.1Å; E539-K549 PolarHBondContact OE1-NZ 2.88Å; C540-K549 VanDerWaalsContact SG-CE 3.51Å; T545-K549 PolarHBondContact O-N 3.26Å; I546-K549 WeakPolarHBondContact O-CB 3.29Å; I546-K549 PolarHBondContact O-N 3.46Å; I546-K549 VanDerWaalsContact O-N 3.13Å; Y547-K549 PolarHBondContact O-N 3.13Å; K549-S552 PolarHBondContact O-N 3.23Å; K549-S552 PolarHBondContact O-OG 2.99Å; K549-S552 VanDerWaalsContact O-OG 3.14Å; K549-G553 PolarHBondContact O-N 3.03Å; K549-G553 VanDerWaalsContact O-N 3.08Å; K549-V554 HydrophobicContact CB-CB 4.01Å; K549-V554 HydrophobicContact CB-CG1 4.38Å; K549-V554 HydrophobicContact CD-CB 4.45Å; K549-V554 HydrophobicContact CD-CG1 3.91Å; K549-V554 HydrophobicContact CG-CB 4.07Å; K549-V554 HydrophobicContact CG-CG1 3.99Å; K549-V554 PolarHBondContact O-N 2.72Å
550	V	88.8	Confident	89.1	Confident	7 Å²	7	54 Å²	54	4%	0.042	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-45.2	-177	172.3	0	0	0	0	111.8	P507 Y521 Y537 I546 Y547 G553	P507-V550 HydrophobicContact CB-CG1 3.99Å; P507-V550 HydrophobicContact CG-CG1 4.12Å; Y521-V550 WeakPolarHBondContact OH-CG1 3.44Å; Y521-V550 WeakPolarHBondContact OH-CG2 3.49Å; Y537-V550 HydrophobicContact CD2-CG2 4.43Å; Y537-V550 HydrophobicContact CE2-CG2 3.51Å; Y537-V550 WeakPolarHBondContact OH-CG2 3.08Å; I546-V550 HydrophobicContact CG2-CG2 4.2Å; I546-V550 VanDerWaalsContact O-CG2 3.31Å; I546-V550 WeakPolarHBondContact O-CG2 3.41Å; I546-V550 PolarHBondContact O-N 3.07Å; Y547-V550 PolarHBondContact O-N 3.1Å; V550-G553 PolarHBondContact O-N 2.89Å
551	I	85.4	Confident	89.2	Confident	45 Å²	45	57.8 Å²	57.8	23%	0.231	32%	0.315	C	S	.	.	H	α-helix	trans	-68.8	-33.3	177.7	66.1	-178.8	0	0	0	112.8	P507 Y547 R548 G553 V1499	P507-I551 HydrophobicContact CB-CG2 4.01Å; Y547-I551 HydrophobicContact CD1-CD1 4.38Å; Y547-I551 HydrophobicContact CD2-CG2 4.33Å; Y547-I551 HydrophobicContact CE1-CD1 3.91Å; Y547-I551 HydrophobicContact CE1-CG2 4.16Å; Y547-I551 HydrophobicContact CE2-CG2 3.74Å; Y547-I551 PolarHBondContact O-N 2.68Å; R548-I551 WeakPolarHBondContact O-CG1 3.39Å; I551-G553 VanDerWaalsContact C-N 3.27Å; I551-G553 PolarHBondContact O-N 2.98Å; I551-V1499 HydrophobicContact CD1-CG1 4.15Å; I551-V1499 HydrophobicContact CD1-CG2 3.93Å
552	S	88.4	Confident	89.3	Confident	80 Å²	80	49.2 Å²	49.2	56%	0.559	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	1.1	176	57.2	0	0	0	0	114	R548 K549 V554	R548-S552 WeakPolarHBondContact O-CB 3.18Å; R548-S552 PolarHBondContact O-N 2.64Å; R548-S552 PolarHBondContact O-OG 3.3Å; K549-S552 PolarHBondContact O-N 3.23Å; K549-S552 PolarHBondContact O-OG 2.99Å; K549-S552 VanDerWaalsContact O-OG 3.14Å; S552-V554 PolarHBondContact O-N 2.63Å
553	G	88.4	Confident	89.5	Confident	33 Å²	33	47.9 Å²	47.9	34%	0.34	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	10.4	-179.8	0	0	0	0	0	115.5	K549 V550 I551 K555	K549-G553 PolarHBondContact O-N 3.03Å; K549-G553 VanDerWaalsContact O-N 3.08Å; V550-G553 PolarHBondContact O-N 2.89Å; I551-G553 VanDerWaalsContact C-N 3.27Å; I551-G553 PolarHBondContact O-N 2.98Å; G553-K555 PolarHBondContact O-N 3.33Å
554	V	93.7	Very high	89.6	Confident	72 Å²	72	49 Å²	49	44%	0.436	28%	0.283	S	S	.	.			trans	-70.7	102.3	173.9	179.3	0	0	0	0	108.7	Y537 K549 S552	Y537-V554 WeakPolarHBondContact CE1-O 3.49Å; Y537-V554 PolarHBondContact OH-O 3.48Å; Y537-V554 VanDerWaalsContact OH-O 3.07Å; K549-V554 HydrophobicContact CB-CB 4.01Å; K549-V554 HydrophobicContact CB-CG1 4.38Å; K549-V554 HydrophobicContact CD-CB 4.45Å; K549-V554 HydrophobicContact CD-CG1 3.91Å; K549-V554 HydrophobicContact CG-CB 4.07Å; K549-V554 HydrophobicContact CG-CG1 3.99Å; K549-V554 PolarHBondContact O-N 2.72Å; S552-V554 PolarHBondContact O-N 2.63Å
555	K	95.2	Very high	89.6	Confident	70 Å²	70	51.2 Å²	51.2	30%	0.304	28%	0.284	S	S	.	.			trans	-61.1	159.1	179.5	-69.1	-173.1	168.6	80.2	0	112.8	G553 F559 D574 I577	G553-K555 PolarHBondContact O-N 3.33Å; K555-F559 HydrophobicContact CB-CB 4.3Å; K555-F559 HydrophobicContact CB-CD1 4.35Å; K555-F559 HydrophobicContact CB-CG 4.34Å; K555-F559 HydrophobicContact CD-CD1 3.54Å; K555-F559 HydrophobicContact CD-CD2 4.08Å; K555-F559 HydrophobicContact CD-CE1 3.48Å; K555-F559 VanDerWaalsContact CD-CE1 3.48Å; K555-F559 HydrophobicContact CD-CE2 4.04Å; K555-F559 HydrophobicContact CD-CG 3.85Å; K555-F559 HydrophobicContact CD-CZ 3.75Å; K555-D574 WeakPolarHBondContact CE-OD1 3.41Å; K555-D574 IonicContact NZ-OD1 2.63Å; K555-D574 PolarHBondContact NZ-OD1 3.08Å; K555-I577 HydrophobicContact CD-CD1 4.06Å; K555-I577 HydrophobicContact CG-CD1 4.1Å
556	P	94.6	Very high	89.2	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.019	29%	0.286	C	S	.	.			trans	-56.3	146	173.6	-24.2	33.6	0	0	0	112.5	M525 L528 P536 Y537 C558 F559	M525-P556 HydrophobicContact CE-CG 3.96Å; M525-P556 HydrophobicContact SD-CG 4.07Å; L528-P556 HydrophobicContact CD2-CB 4.01Å; L528-P556 HydrophobicContact CD2-CG 3.79Å; P536-P556 HydrophobicContact CB-CG 4.26Å; Y537-P556 HydrophobicContact CD1-CB 4.11Å; Y537-P556 HydrophobicContact CD1-CG 4.09Å; Y537-P556 HydrophobicContact CD2-CG 3.98Å; Y537-P556 HydrophobicContact CE1-CB 4.17Å; Y537-P556 HydrophobicContact CE1-CG 3.81Å; Y537-P556 HydrophobicContact CE2-CG 3.71Å; Y537-P556 HydrophobicContact CG-CB 4.33Å; Y537-P556 HydrophobicContact CG-CG 4.17Å; P556-C558 PolarHBondContact O-N 2.68Å; P556-F559 WeakPolarHBondContact O-CB 3.08Å; P556-F559 PolarHBondContact O-N 3.01Å
557	E	94.7	Very high	88.9	Confident	94 Å²	94	55.8 Å²	55.8	44%	0.439	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-59	-38.3	178.8	-165.4	-169.3	110.1	0	0	112	E539 F559 S560 R561	E539-E557 HydrophobicContact CB-CB 4.42Å; E539-E557 WeakPolarHBondContact CB-OE2 3.46Å; E539-E557 HydrophobicContact CG-CB 3.98Å; E539-E557 PolarHBondContact OE1-N 3.17Å; E557-F559 PolarHBondContact O-N 2.85Å; E557-F559 VanDerWaalsContact O-N 3.15Å; E557-S560 WeakPolarHBondContact O-CB 3.31Å; E557-S560 PolarHBondContact O-N 3.15Å; E557-S560 PolarHBondContact O-OG 2.9Å; E557-R561 IonicContact OE1-CZ 3.75Å; E557-R561 IonicContact OE1-NH1 3.86Å; E557-R561 PolarHBondContact OE1-NH1 2.76Å; E557-R561 IonicContact OE1-NH2 2.83Å; E557-R561 PolarHBondContact OE1-NH2 2.76Å
558	C	94	Very high	89.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-64.8	-13.9	176.9	63.8	0	0	0	0	114.4	T532 E534 P556 S560 R561	T532-C558 HydrophobicContact CG2-CB 4.14Å; T532-C558 WeakPolarHBondContact CG2-O 3.42Å; E534-C558 HydrophobicContact CB-CB 4.24Å; E534-C558 WeakPolarHBondContact OE2-CB 3.48Å; P556-C558 PolarHBondContact O-N 2.68Å; C558-S560 PolarHBondContact O-N 2.96Å; C558-R561 WeakPolarHBondContact O-CA 3.37Å; C558-R561 WeakPolarHBondContact O-CB 3.46Å; C558-R561 PolarHBondContact O-N 3.35Å
559	F	95.3	Very high	89.3	Confident	21 Å²	21	52.5 Å²	52.5	9%	0.092	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-63	-29.5	169.6	-177.6	-95.1	0	0	0	111.9	L528 K555 P556 E557 R561 I562 R570 I573 D574 I577	L528-F559 HydrophobicContact CD1-CB 4.46Å; K555-F559 HydrophobicContact CB-CB 4.3Å; K555-F559 HydrophobicContact CB-CD1 4.35Å; K555-F559 HydrophobicContact CB-CG 4.34Å; K555-F559 HydrophobicContact CD-CD1 3.54Å; K555-F559 HydrophobicContact CD-CD2 4.08Å; K555-F559 HydrophobicContact CD-CE1 3.48Å; K555-F559 VanDerWaalsContact CD-CE1 3.48Å; K555-F559 HydrophobicContact CD-CE2 4.04Å; K555-F559 HydrophobicContact CD-CG 3.85Å; K555-F559 HydrophobicContact CD-CZ 3.75Å; P556-F559 WeakPolarHBondContact O-CB 3.08Å; P556-F559 PolarHBondContact O-N 3.01Å; E557-F559 PolarHBondContact O-N 2.85Å; E557-F559 VanDerWaalsContact O-N 3.15Å; F559-R561 VanDerWaalsContact C-N 3.27Å; F559-R561 PolarHBondContact O-N 2.61Å; F559-I562 HydrophobicContact CD2-CD1 3.59Å; F559-I562 HydrophobicContact CE2-CD1 3.87Å; F559-I562 HydrophobicContact CG-CD1 4.12Å; F559-I562 WeakPolarHBondContact O-CD1 3.36Å; F559-I562 WeakPolarHBondContact O-CG1 3.29Å; F559-R570 HydrophobicContact CE1-CG 4.35Å; F559-R570 HydrophobicContact CE2-CG 4.27Å; F559-R570 HydrophobicContact CZ-CG 3.84Å; F559-I573 HydrophobicContact CD2-CG2 3.8Å; F559-I573 HydrophobicContact CE2-CB 4.14Å; F559-I573 HydrophobicContact CE2-CG2 3.76Å; F559-D574 HydrophobicContact CE2-CB 4.48Å; F559-D574 HydrophobicContact CZ-CB 4.17Å; F559-I577 HydrophobicContact CD2-CD1 4.06Å; F559-I577 HydrophobicContact CE2-CD1 4.35Å
560	S	93.3	Very high	89.3	Confident	86 Å²	86	56.6 Å²	56.6	60%	0.601	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-71.4	-22.1	171.8	71	0	0	0	0	113.2	E557 C558	E557-S560 WeakPolarHBondContact O-CB 3.31Å; E557-S560 PolarHBondContact O-N 3.15Å; E557-S560 PolarHBondContact O-OG 2.9Å; C558-S560 PolarHBondContact O-N 2.96Å
561	R	92	Very high	89.5	Confident	97 Å²	97	61.2 Å²	61.2	37%	0.366	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-90.6	6.4	-178.6	-66.1	-168.4	-84.2	-85.3	9.7	113.9	E534 E557 C558 F559	E534-R561 IonicContact OE1-NE 2.78Å; E534-R561 PolarHBondContact OE1-NE 2.94Å; E534-R561 IonicContact OE2-CZ 3.2Å; E534-R561 IonicContact OE2-NE 2.72Å; E534-R561 PolarHBondContact OE2-NE 3.21Å; E534-R561 IonicContact OE2-NH2 3.18Å; E534-R561 PolarHBondContact OE2-NH2 3.47Å; E557-R561 IonicContact OE1-CZ 3.75Å; E557-R561 IonicContact OE1-NH1 3.86Å; E557-R561 PolarHBondContact OE1-NH1 2.76Å; E557-R561 IonicContact OE1-NH2 2.83Å; E557-R561 PolarHBondContact OE1-NH2 2.76Å; C558-R561 WeakPolarHBondContact O-CA 3.37Å; C558-R561 WeakPolarHBondContact O-CB 3.46Å; C558-R561 PolarHBondContact O-N 3.35Å; F559-R561 VanDerWaalsContact C-N 3.27Å; F559-R561 PolarHBondContact O-N 2.61Å
562	I	91.6	Very high	89.9	Confident	13 Å²	13	59.1 Å²	59.1	7%	0.067	32%	0.32	C	S	.	.	S	Bend	trans	-61.5	125.2	171.3	-63.9	166	0	0	0	108.5	L528 V531 F559 A564 R570 I573	L528-I562 HydrophobicContact CD1-CD1 3.95Å; L528-I562 HydrophobicContact CD1-CG1 3.9Å; V531-I562 HydrophobicContact CG1-CG2 4.16Å; F559-I562 HydrophobicContact CD2-CD1 3.59Å; F559-I562 HydrophobicContact CE2-CD1 3.87Å; F559-I562 HydrophobicContact CG-CD1 4.12Å; F559-I562 WeakPolarHBondContact O-CD1 3.36Å; F559-I562 WeakPolarHBondContact O-CG1 3.29Å; I562-A564 PolarHBondContact O-N 3.07Å; I562-R570 HydrophobicContact CD1-CB 4.14Å; I562-R570 HydrophobicContact CD1-CG 4.03Å; I562-R570 HydrophobicContact CG2-CB 4.01Å; I562-I573 HydrophobicContact CD1-CD1 3.69Å; I562-I573 HydrophobicContact CG1-CD1 4.34Å
563	P	86.5	Confident	90.3	Very high	42 Å²	42	55.3 Å²	55.3	27%	0.273	29%	0.294	S	S	.	.			trans	-61.6	129.4	-174.5	-22.6	32.8	0	0	0	112.7	Q565 Y566	P563-Q565 VanDerWaalsContact C-OE1 3.29Å; P563-Q565 PolarHBondContact O-N 3.26Å; P563-Q565 VanDerWaalsContact O-N 3.08Å; P563-Y566 HydrophobicContact CB-CD2 4.11Å; P563-Y566 HydrophobicContact CG-CD2 4.49Å; P563-Y566 PolarHBondContact O-N 3.48Å
564	A	82.8	Confident	90.6	Very high	94 Å²	94	55.6 Å²	55.6	78%	0.777	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.9	-170.8	0	0	0	0	0	114.7	I562 Y566	I562-A564 PolarHBondContact O-N 3.07Å; A564-Y566 PolarHBondContact O-N 3.47Å
565	Q	78.8	Confident	90.6	Very high	98 Å²	98	54.3 Å²	54.3	46%	0.458	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-6.3	173.5	70.5	-87.7	42	0	0	114.2	P563 P567 R690	P563-Q565 VanDerWaalsContact C-OE1 3.29Å; P563-Q565 PolarHBondContact O-N 3.26Å; P563-Q565 VanDerWaalsContact O-N 3.08Å; Q565-P567 WeakPolarHBondContact O-CD 3.4Å; Q565-R690 PolarHBondContact O-NH1 2.74Å
566	Y	82	Confident	90.7	Very high	74 Å²	74	51 Å²	51	29%	0.29	26%	0.26	S	S	.	.			trans	-122.7	59.6	176.2	-53	-60.9	0	0	0	112.5	I436 P563 A564 E568 I569 R570	I436-Y566 HydrophobicContact CD1-CD1 4.45Å; I436-Y566 HydrophobicContact CD1-CE1 4.36Å; I436-Y566 HydrophobicContact CG1-CE1 4.15Å; P563-Y566 HydrophobicContact CB-CD2 4.11Å; P563-Y566 HydrophobicContact CG-CD2 4.49Å; P563-Y566 PolarHBondContact O-N 3.48Å; A564-Y566 PolarHBondContact O-N 3.47Å; Y566-E568 VanDerWaalsContact CA-OE2 3.29Å; Y566-E568 WeakPolarHBondContact CA-OE2 3.28Å; Y566-E568 PolarHBondContact O-N 2.74Å; Y566-I569 HydrophobicContact CD1-CD1 4.36Å; Y566-I569 HydrophobicContact CD2-CD1 4.31Å; Y566-I569 HydrophobicContact CG-CD1 3.85Å; Y566-I569 WeakPolarHBondContact O-CB 3.41Å; Y566-I569 PolarHBondContact O-N 3.12Å; Y566-I569 VanDerWaalsContact O-N 3.16Å; Y566-R570 PolarHBondContact O-N 2.96Å
567	P	81.4	Confident	90.7	Very high	66 Å²	66	51.4 Å²	51.4	43%	0.429	26%	0.262	S	S	.	.	H	α-helix	trans	-59.2	-32.3	-179.7	27.6	-35.7	0	0	0	112.6	Q565 I569 R570 E571	Q565-P567 WeakPolarHBondContact O-CD 3.4Å; P567-I569 VanDerWaalsContact C-N 3.3Å; P567-I569 PolarHBondContact O-N 3.44Å; P567-R570 WeakPolarHBondContact O-CB 3.23Å; P567-R570 PolarHBondContact O-N 3.34Å; P567-R570 VanDerWaalsContact O-N 3.13Å; P567-E571 PolarHBondContact O-N 3.11Å
568	E	85.1	Confident	90.6	Very high	58 Å²	58	50.7 Å²	50.7	27%	0.271	26%	0.256	S	S	.	.	H	α-helix	trans	-65.5	-33.3	179.3	76.2	-72.8	-178	0	0	112.2	Y566 E571 I572 F595	Y566-E568 VanDerWaalsContact CA-OE2 3.29Å; Y566-E568 WeakPolarHBondContact CA-OE2 3.28Å; Y566-E568 PolarHBondContact O-N 2.74Å; E568-E571 PolarHBondContact O-N 3.02Å; E568-I572 WeakPolarHBondContact O-CB 3.36Å; E568-I572 WeakPolarHBondContact O-CD1 3.49Å; E568-I572 VanDerWaalsContact O-CG1 3.23Å; E568-I572 WeakPolarHBondContact O-CG1 3.33Å; E568-I572 PolarHBondContact O-N 3.45Å; E568-F595 HydrophobicContact CG-CB 4.41Å; E568-F595 HydrophobicContact CG-CD2 3.35Å; E568-F595 HydrophobicContact CG-CE2 3.93Å; E568-F595 HydrophobicContact CG-CG 4.18Å; E568-F595 WeakPolarHBondContact OE1-CE2 3.45Å
569	I	91.9	Very high	90.3	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-66.8	-41.8	173.1	-62.1	-177.5	0	0	0	110.6	I436 L527 V531 Y566 P567 E571 I572 I573 F595	I436-I569 HydrophobicContact CD1-CD1 3.68Å; L527-I569 HydrophobicContact CD1-CG2 4.34Å; L527-I569 HydrophobicContact CG-CG2 4.48Å; V531-I569 HydrophobicContact CG1-CG2 4.3Å; V531-I569 HydrophobicContact CG2-CD1 4.41Å; V531-I569 HydrophobicContact CG2-CG2 3.58Å; Y566-I569 HydrophobicContact CD1-CD1 4.36Å; Y566-I569 HydrophobicContact CD2-CD1 4.31Å; Y566-I569 HydrophobicContact CG-CD1 3.85Å; Y566-I569 WeakPolarHBondContact O-CB 3.41Å; Y566-I569 PolarHBondContact O-N 3.12Å; Y566-I569 VanDerWaalsContact O-N 3.16Å; P567-I569 VanDerWaalsContact C-N 3.3Å; P567-I569 PolarHBondContact O-N 3.44Å; I569-E571 VanDerWaalsContact C-N 3.33Å; I569-E571 PolarHBondContact O-N 3.14Å; I569-I572 PolarHBondContact O-N 3.33Å; I569-I573 HydrophobicContact CG2-CD1 3.8Å; I569-I573 HydrophobicContact CG2-CG1 4.4Å; I569-I573 VanDerWaalsContact O-CG1 3.3Å; I569-I573 WeakPolarHBondContact O-CG1 3.43Å; I569-I573 PolarHBondContact O-N 3.02Å; I569-F595 HydrophobicContact CD1-CE2 3.8Å; I569-F595 HydrophobicContact CD1-CZ 3.56Å; I569-F595 HydrophobicContact CG1-CD2 4.24Å; I569-F595 HydrophobicContact CG1-CE1 4.14Å; I569-F595 HydrophobicContact CG1-CE2 3.39Å; I569-F595 HydrophobicContact CG1-CZ 3.36Å
570	R	91.9	Very high	89.8	Confident	134 Å²	134	59.2 Å²	59.2	51%	0.506	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-40.3	179	-177.4	174.8	173	-175.6	-4.5	111.5	F559 I562 Y566 P567 D574	F559-R570 HydrophobicContact CE1-CG 4.35Å; F559-R570 HydrophobicContact CE2-CG 4.27Å; F559-R570 HydrophobicContact CZ-CG 3.84Å; I562-R570 HydrophobicContact CD1-CB 4.14Å; I562-R570 HydrophobicContact CD1-CG 4.03Å; I562-R570 HydrophobicContact CG2-CB 4.01Å; Y566-R570 PolarHBondContact O-N 2.96Å; P567-R570 WeakPolarHBondContact O-CB 3.23Å; P567-R570 PolarHBondContact O-N 3.34Å; P567-R570 VanDerWaalsContact O-N 3.13Å; R570-D574 PolarHBondContact O-N 3.46Å
571	E	91.8	Very high	89.4	Confident	104 Å²	104	59.2 Å²	59.2	49%	0.486	28%	0.28	S	S	.	.	H	α-helix	trans	-66	-44.6	175.6	-164.5	-146.8	112.3	0	0	112.1	P567 E568 I569 I573 D574 R575	P567-E571 PolarHBondContact O-N 3.11Å; E568-E571 PolarHBondContact O-N 3.02Å; I569-E571 VanDerWaalsContact C-N 3.33Å; I569-E571 PolarHBondContact O-N 3.14Å; E571-I573 PolarHBondContact O-N 2.98Å; E571-D574 WeakPolarHBondContact O-CB 3.37Å; E571-D574 PolarHBondContact O-N 3.21Å; E571-R575 WeakPolarHBondContact O-CB 3.42Å; E571-R575 WeakPolarHBondContact O-CG 3.42Å; E571-R575 PolarHBondContact O-N 3.21Å; E571-R575 IonicContact OE1-CZ 2.61Å; E571-R575 IonicContact OE1-NE 2.76Å; E571-R575 PolarHBondContact OE1-NE 3.02Å; E571-R575 IonicContact OE1-NH2 2.73Å; E571-R575 PolarHBondContact OE1-NH2 3.21Å
572	I	94.6	Very high	89.2	Confident	1 Å²	1	61 Å²	61	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-61.2	-44.4	175.7	-71.9	164.4	0	0	0	111.2	L527 E568 I569 R575 C576 L590 F595 F596	L527-I572 HydrophobicContact CD2-CB 4.49Å; L527-I572 HydrophobicContact CD2-CG2 3.63Å; E568-I572 WeakPolarHBondContact O-CB 3.36Å; E568-I572 WeakPolarHBondContact O-CD1 3.49Å; E568-I572 VanDerWaalsContact O-CG1 3.23Å; E568-I572 WeakPolarHBondContact O-CG1 3.33Å; E568-I572 PolarHBondContact O-N 3.45Å; I569-I572 PolarHBondContact O-N 3.33Å; I572-R575 PolarHBondContact O-N 3.24Å; I572-C576 PolarHBondContact O-N 2.98Å; I572-C576 PolarHBondContact O-SG 3.42Å; I572-L590 HydrophobicContact CG2-CD2 4.25Å; I572-F595 HydrophobicContact CD1-CB 3.45Å; I572-F595 VanDerWaalsContact CD1-CB 3.45Å; I572-F595 HydrophobicContact CD1-CD1 3.68Å; I572-F595 HydrophobicContact CD1-CG 3.67Å; I572-F596 HydrophobicContact CD1-CD2 4.5Å; I572-F596 HydrophobicContact CD1-CE2 4.01Å; I572-F596 HydrophobicContact CD1-CZ 4.4Å; I572-F596 HydrophobicContact CG2-CE2 3.68Å; I572-F596 HydrophobicContact CG2-CZ 4Å
573	I	96.4	Very high	89.1	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.2	-47.7	175.7	-66.2	165.2	0	0	0	109.7	L527 L528 F559 I562 I569 E571 R575 C576 I577	L527-I573 HydrophobicContact CB-CG1 4.25Å; L527-I573 HydrophobicContact CD2-CD1 4.41Å; L527-I573 HydrophobicContact CD2-CG1 3.62Å; L527-I573 HydrophobicContact CG-CD1 3.99Å; L527-I573 HydrophobicContact CG-CG1 3.65Å; L528-I573 HydrophobicContact CB-CD1 4.18Å; L528-I573 HydrophobicContact CB-CG2 4.3Å; L528-I573 HydrophobicContact CD1-CD1 4.21Å; F559-I573 HydrophobicContact CD2-CG2 3.8Å; F559-I573 HydrophobicContact CE2-CB 4.14Å; F559-I573 HydrophobicContact CE2-CG2 3.76Å; I562-I573 HydrophobicContact CD1-CD1 3.69Å; I562-I573 HydrophobicContact CG1-CD1 4.34Å; I569-I573 HydrophobicContact CG2-CD1 3.8Å; I569-I573 HydrophobicContact CG2-CG1 4.4Å; I569-I573 VanDerWaalsContact O-CG1 3.3Å; I569-I573 WeakPolarHBondContact O-CG1 3.43Å; I569-I573 PolarHBondContact O-N 3.02Å; E571-I573 PolarHBondContact O-N 2.98Å; I573-R575 VanDerWaalsContact C-N 3.35Å; I573-R575 PolarHBondContact O-N 3.27Å; I573-C576 PolarHBondContact O-N 3.14Å; I573-I577 HydrophobicContact CG2-CD1 3.93Å; I573-I577 HydrophobicContact CG2-CG1 4.31Å; I573-I577 HydrophobicContact CG2-CG2 4.24Å; I573-I577 WeakPolarHBondContact O-CG1 3.38Å; I573-I577 PolarHBondContact O-N 3.11Å
574	D	94.3	Very high	89.5	Confident	39 Å²	39	62.6 Å²	62.6	21%	0.209	30%	0.295	C	S	.	.	H	α-helix	trans	-53.2	-51.3	176.2	-177.6	86.1	0	0	0	111.7	K555 F559 R570 E571 C576 I577 R578	K555-D574 WeakPolarHBondContact CE-OD1 3.41Å; K555-D574 IonicContact NZ-OD1 2.63Å; K555-D574 PolarHBondContact NZ-OD1 3.08Å; F559-D574 HydrophobicContact CE2-CB 4.48Å; F559-D574 HydrophobicContact CZ-CB 4.17Å; R570-D574 PolarHBondContact O-N 3.46Å; E571-D574 WeakPolarHBondContact O-CB 3.37Å; E571-D574 PolarHBondContact O-N 3.21Å; D574-C576 PolarHBondContact O-N 3.09Å; D574-I577 PolarHBondContact O-N 2.91Å; D574-R578 WeakPolarHBondContact O-CG 3.38Å; D574-R578 PolarHBondContact O-N 2.81Å; D574-R578 IonicContact OD2-CZ 3.21Å; D574-R578 IonicContact OD2-NE 3.13Å; D574-R578 PolarHBondContact OD2-NE 2.98Å; D574-R578 IonicContact OD2-NH2 2.75Å; D574-R578 PolarHBondContact OD2-NH2 2.84Å
575	R	94.4	Very high	89.9	Confident	45 Å²	45	58.6 Å²	58.6	17%	0.17	26%	0.262	C	S	.	.	H	α-helix	trans	-61.7	-19.3	177.3	-78.3	-164.4	-80.4	120.3	-10.1	114.2	E571 I572 I573 R584 S585 D593	E571-R575 WeakPolarHBondContact O-CB 3.42Å; E571-R575 WeakPolarHBondContact O-CG 3.42Å; E571-R575 PolarHBondContact O-N 3.21Å; E571-R575 IonicContact OE1-CZ 2.61Å; E571-R575 IonicContact OE1-NE 2.76Å; E571-R575 PolarHBondContact OE1-NE 3.02Å; E571-R575 IonicContact OE1-NH2 2.73Å; E571-R575 PolarHBondContact OE1-NH2 3.21Å; I572-R575 PolarHBondContact O-N 3.24Å; I573-R575 VanDerWaalsContact C-N 3.35Å; I573-R575 PolarHBondContact O-N 3.27Å; R575-R584 CarbonylContact O-C 3.51Å; R575-R584 VanDerWaalsContact O-CA 3.27Å; R575-R584 WeakPolarHBondContact O-CA 3.41Å; R575-S585 PolarHBondContact NH1-OG 3.33Å; R575-S585 PolarHBondContact O-N 2.82Å; R575-D593 IonicContact CZ-OD2 2.76Å; R575-D593 IonicContact NH1-OD2 3.15Å; R575-D593 PolarHBondContact NH1-OD2 2.89Å; R575-D593 IonicContact NH2-OD2 3.66Å; R575-D593 PolarHBondContact NH2-OD2 2.82Å
576	C	96.4	Very high	90.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-90.5	-39.3	174	-65.3	0	0	0	0	112.5	V520 Y521 I572 I573 D574 R584	V520-C576 HydrophobicContact CG1-CB 4.2Å; Y521-C576 WeakPolarHBondContact CA-O 3.23Å; I572-C576 PolarHBondContact O-N 2.98Å; I572-C576 PolarHBondContact O-SG 3.42Å; I573-C576 PolarHBondContact O-N 3.14Å; D574-C576 PolarHBondContact O-N 3.09Å; C576-R584 WeakPolarHBondContact O-CD 3.4Å
577	I	94.7	Very high	91.2	Very high	11 Å²	11	54.1 Å²	54.1	6%	0.056	25%	0.249	C	C	.	.	S	Bend	trans	-96.3	20.1	-170.2	74.7	174.7	0	0	0	114.8	Y521 M525 K555 F559 I573 D574	Y521-I577 HydrophobicContact CD2-CB 4.2Å; Y521-I577 HydrophobicContact CE2-CB 4.05Å; M525-I577 HydrophobicContact CE-CB 4.1Å; M525-I577 HydrophobicContact CE-CD1 4.25Å; M525-I577 HydrophobicContact CE-CG2 3.9Å; M525-I577 HydrophobicContact CG-CG2 4.27Å; M525-I577 HydrophobicContact SD-CG2 4.07Å; K555-I577 HydrophobicContact CD-CD1 4.06Å; K555-I577 HydrophobicContact CG-CD1 4.1Å; F559-I577 HydrophobicContact CD2-CD1 4.06Å; F559-I577 HydrophobicContact CE2-CD1 4.35Å; I573-I577 HydrophobicContact CG2-CD1 3.93Å; I573-I577 HydrophobicContact CG2-CG1 4.31Å; I573-I577 HydrophobicContact CG2-CG2 4.24Å; I573-I577 WeakPolarHBondContact O-CG1 3.38Å; I573-I577 PolarHBondContact O-N 3.11Å; D574-I577 PolarHBondContact O-N 2.91Å
578	R	92.5	Very high	91.7	Very high	80 Å²	80	57.9 Å²	57.9	30%	0.302	26%	0.258	S	S	.	.			trans	-65.1	145.5	176.8	-57.7	-165.8	173.1	161.3	-13.4	112	D574 E583 R584	D574-R578 WeakPolarHBondContact O-CG 3.38Å; D574-R578 PolarHBondContact O-N 2.81Å; D574-R578 IonicContact OD2-CZ 3.21Å; D574-R578 IonicContact OD2-NE 3.13Å; D574-R578 PolarHBondContact OD2-NE 2.98Å; D574-R578 IonicContact OD2-NH2 2.75Å; D574-R578 PolarHBondContact OD2-NH2 2.84Å; R578-E583 HydrophobicContact CB-CB 4.36Å; R578-E583 WeakPolarHBondContact CD-O 3.48Å; R578-E583 PolarHBondContact NH1-O 3.43Å; R578-E583 VanDerWaalsContact NH1-O 3.11Å; R578-R584 HydrophobicContact CB-CG 4.17Å; R578-R584 PolarHBondContact O-NE 3.4Å; R578-R584 PolarHBondContact O-NH2 3.09Å
579	V	88	Confident	92	Very high	53 Å²	53	60 Å²	60	32%	0.321	27%	0.268	S	S	.	.	S	Bend	trans	-61.8	-60.6	-179.5	-173.4	0	0	0	0	110.5	P507 R581 R584	P507-V579 HydrophobicContact CG-CG1 4.19Å; V579-R581 PolarHBondContact O-N 2.64Å; V579-R584 PolarHBondContact O-NH2 3.39Å
580	R	84.5	Confident	92.1	Very high	147 Å²	147	59.9 Å²	59.9	56%	0.555	27%	0.268	S	S	*	.	S	Bend	trans	-68.3	121.8	177	-73.3	-174.5	-78.5	110	7.1	110.2	E582 E583	R580-E582 VanDerWaalsContact C-N 3.27Å; R580-E582 PolarHBondContact O-N 3.37Å; R580-E583 HydrophobicContact CB-CG 4.2Å; R580-E583 IonicContact CZ-OE1 3.58Å; R580-E583 IonicContact CZ-OE2 3.27Å; R580-E583 IonicContact NH1-OE1 2.82Å; R580-E583 PolarHBondContact NH1-OE1 2.78Å; R580-E583 IonicContact NH1-OE2 3.08Å; R580-E583 IonicContact NH2-OE1 2.68Å; R580-E583 PolarHBondContact NH2-OE1 2.82Å; R580-E583 IonicContact NH2-OE2 3.47Å; R580-E583 PolarHBondContact NH2-OE2 2.72Å; R580-E583 PolarHBondContact O-N 2.81Å
581	R	86.8	Confident	92.1	Very high	86 Å²	86	55.7 Å²	55.7	33%	0.325	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-62.7	-33.1	-175.4	62.2	175.7	-179.1	-157.4	-9.8	113	M513 S517 V579 E583 R584	M513-R581 PolarHBondContact O-NH1 2.73Å; S517-R581 WeakPolarHBondContact OG-CB 3.46Å; V579-R581 PolarHBondContact O-N 2.64Å; R581-E583 PolarHBondContact O-N 3.28Å; R581-R584 WeakPolarHBondContact O-CB 3.37Å; R581-R584 PolarHBondContact O-N 3.33Å; R581-R584 VanDerWaalsContact O-N 3.13Å
582	E	87.4	Confident	91.8	Very high	133 Å²	133	56 Å²	56	62%	0.621	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-66.1	-20	-179.5	-62.6	74.9	-164.5	0	0	112.6	R580	R580-E582 VanDerWaalsContact C-N 3.27Å; R580-E582 PolarHBondContact O-N 3.37Å
583	E	89.8	Confident	91.3	Very high	76 Å²	76	56.9 Å²	56.9	36%	0.355	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-92.1	-6.3	177.6	-58.8	-167.9	136.9	0	0	113.8	R578 R580 R581	R578-E583 HydrophobicContact CB-CB 4.36Å; R578-E583 WeakPolarHBondContact CD-O 3.48Å; R578-E583 PolarHBondContact NH1-O 3.43Å; R578-E583 VanDerWaalsContact NH1-O 3.11Å; R580-E583 HydrophobicContact CB-CG 4.2Å; R580-E583 IonicContact CZ-OE1 3.58Å; R580-E583 IonicContact CZ-OE2 3.27Å; R580-E583 IonicContact NH1-OE1 2.82Å; R580-E583 PolarHBondContact NH1-OE1 2.78Å; R580-E583 IonicContact NH1-OE2 3.08Å; R580-E583 IonicContact NH2-OE1 2.68Å; R580-E583 PolarHBondContact NH2-OE1 2.82Å; R580-E583 IonicContact NH2-OE2 3.47Å; R580-E583 PolarHBondContact NH2-OE2 2.72Å; R580-E583 PolarHBondContact O-N 2.81Å; R581-E583 PolarHBondContact O-N 3.28Å
584	R	93.5	Very high	90.5	Very high	13 Å²	13	61 Å²	61	5%	0.049	29%	0.29	C	S	.	.	S	Bend	trans	-78	141.7	-178.3	-58.9	-180	-164.3	146.2	12.5	110.6	E508 S517 V520 R575 C576 R578 V579 R581 T586	E508-R584 IonicContact OE1-CZ 3.72Å; E508-R584 IonicContact OE1-NH1 2.67Å; E508-R584 PolarHBondContact OE1-NH1 2.72Å; E508-R584 IonicContact OE1-NH2 3.99Å; E508-R584 PolarHBondContact OE1-NH2 3Å; E508-R584 IonicContact OE2-CZ 2.6Å; E508-R584 IonicContact OE2-NH1 3.04Å; E508-R584 IonicContact OE2-NH2 3.71Å; E508-R584 PolarHBondContact OE2-NH2 2.78Å; S517-R584 PolarHBondContact O-NH1 3.1Å; S517-R584 VanDerWaalsContact O-NH1 3.13Å; S517-R584 PolarHBondContact OG-NH1 3.37Å; V520-R584 HydrophobicContact CG1-CB 4.14Å; R575-R584 CarbonylContact O-C 3.51Å; R575-R584 VanDerWaalsContact O-CA 3.27Å; R575-R584 WeakPolarHBondContact O-CA 3.41Å; C576-R584 WeakPolarHBondContact O-CD 3.4Å; R578-R584 HydrophobicContact CB-CG 4.17Å; R578-R584 PolarHBondContact O-NE 3.4Å; R578-R584 PolarHBondContact O-NH2 3.09Å; V579-R584 PolarHBondContact O-NH2 3.39Å; R581-R584 WeakPolarHBondContact O-CB 3.37Å; R581-R584 PolarHBondContact O-N 3.33Å; R581-R584 VanDerWaalsContact O-N 3.13Å; R584-T586 PolarHBondContact O-N 3.09Å
585	S	91.1	Very high	89.9	Confident	11 Å²	11	59.5 Å²	59.5	8%	0.077	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-66.1	123.2	175.3	-73.2	0	0	0	0	111.3	V520 R575	V520-S585 WeakPolarHBondContact CG1-O 3.41Å; R575-S585 PolarHBondContact NH1-OG 3.33Å; R575-S585 PolarHBondContact O-N 2.82Å
586	T	93.5	Very high	89.4	Confident	70 Å²	70	57.4 Å²	57.4	43%	0.429	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-61	152.9	173.7	64.7	0	0	0	0	111.2	R584 K588 Q589 L590	R584-T586 PolarHBondContact O-N 3.09Å; T586-K588 PolarHBondContact O-N 3.39Å; T586-Q589 WeakPolarHBondContact O-CB 3.4Å; T586-Q589 PolarHBondContact O-N 3.01Å; T586-Q589 WeakPolarHBondContact OG1-CG 3.18Å; T586-Q589 PolarHBondContact OG1-N 3.16Å; T586-Q589 PolarHBondContact OG1-OE1 2.87Å; T586-L590 PolarHBondContact O-N 3.27Å
587	V	95.3	Very high	88.4	Confident	8 Å²	8	59.3 Å²	59.3	5%	0.048	29%	0.286	C	S	.	.	H	α-helix	trans	-55.3	-29.9	175.9	-176.6	0	0	0	0	112.2	L447 L450 V520 L591	L447-V587 HydrophobicContact CB-CG1 4.28Å; L447-V587 HydrophobicContact CD2-CG1 3.97Å; L447-V587 VanDerWaalsContact O-CG1 3.22Å; L447-V587 WeakPolarHBondContact O-CG1 3.35Å; L450-V587 HydrophobicContact CB-CG1 4.14Å; L450-V587 HydrophobicContact CB-CG2 4.2Å; V520-V587 HydrophobicContact CG2-CG2 3.71Å; V587-L591 HydrophobicContact CG1-CD1 4.26Å; V587-L591 WeakPolarHBondContact O-CB 3.49Å; V587-L591 WeakPolarHBondContact O-CG 3.49Å; V587-L591 PolarHBondContact O-N 3.27Å
588	K	91.9	Very high	87.1	Confident	144 Å²	144	59.7 Å²	59.7	63%	0.626	29%	0.289	S	S	*	.	H	α-helix	trans	-66.8	-45.2	173.9	-68	179.2	-178.2	172.7	0	112.5	T586 L591 V592	T586-K588 PolarHBondContact O-N 3.39Å; K588-L591 PolarHBondContact O-N 2.84Å; K588-V592 PolarHBondContact O-N 2.86Å
589	Q	91.6	Very high	85.7	Confident	103 Å²	103	59 Å²	59	48%	0.481	29%	0.289	S	S	.	.	H	α-helix	trans	-63.6	-42.9	174.9	-74.3	157.1	-49.7	0	0	110.9	T586 L591 V592 D593	T586-Q589 WeakPolarHBondContact O-CB 3.4Å; T586-Q589 PolarHBondContact O-N 3.01Å; T586-Q589 WeakPolarHBondContact OG1-CG 3.18Å; T586-Q589 PolarHBondContact OG1-N 3.16Å; T586-Q589 PolarHBondContact OG1-OE1 2.87Å; Q589-L591 VanDerWaalsContact C-N 3.29Å; Q589-L591 PolarHBondContact O-N 3.46Å; Q589-V592 WeakPolarHBondContact O-CG2 3.36Å; Q589-V592 PolarHBondContact O-N 3.3Å; Q589-D593 PolarHBondContact O-N 3.36Å; Q589-D593 VanDerWaalsContact O-N 3.09Å
590	L	94.1	Very high	84.2	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.6	-29.2	176.1	-64.8	172.1	0	0	0	113	L447 V520 F523 I572 T586 D593 F596	L447-L590 HydrophobicContact CD1-CB 3.84Å; L447-L590 HydrophobicContact CD2-CB 3.82Å; L447-L590 HydrophobicContact CD2-CD1 3.82Å; L447-L590 HydrophobicContact CD2-CG 4.48Å; L447-L590 HydrophobicContact CG-CB 4.49Å; V520-L590 HydrophobicContact CG1-CD1 4.27Å; F523-L590 HydrophobicContact CD1-CD1 4.1Å; F523-L590 HydrophobicContact CE1-CD1 4.12Å; I572-L590 HydrophobicContact CG2-CD2 4.25Å; T586-L590 PolarHBondContact O-N 3.27Å; L590-D593 WeakPolarHBondContact O-CB 3.48Å; L590-F596 WeakPolarHBondContact O-CB 3.42Å; L590-F596 VanDerWaalsContact O-CD2 3.23Å; L590-F596 WeakPolarHBondContact O-CD2 3.28Å
591	L	91	Very high	82.7	Confident	46 Å²	46	60.2 Å²	60.2	24%	0.241	30%	0.304	C	S	.	.	H	α-helix	trans	-77.1	-17.5	176	-80.8	172.6	0	0	0	114.6	L447 K448 V587 K588 Q589	L447-L591 HydrophobicContact CB-CD2 3.59Å; L447-L591 HydrophobicContact CB-CG 3.92Å; K448-L591 HydrophobicContact CG-CD2 3.96Å; V587-L591 HydrophobicContact CG1-CD1 4.26Å; V587-L591 WeakPolarHBondContact O-CB 3.49Å; V587-L591 WeakPolarHBondContact O-CG 3.49Å; V587-L591 PolarHBondContact O-N 3.27Å; K588-L591 PolarHBondContact O-N 2.84Å; Q589-L591 VanDerWaalsContact C-N 3.29Å; Q589-L591 PolarHBondContact O-N 3.46Å
592	V	85.2	Confident	81.6	Confident	109 Å²	109	57 Å²	57	66%	0.661	29%	0.293	S	S	*	.	S	Bend	trans	-106.3	4.5	173.8	-57.2	0	0	0	0	113	K588 Q589	K588-V592 PolarHBondContact O-N 2.86Å; Q589-V592 WeakPolarHBondContact O-CG2 3.36Å; Q589-V592 PolarHBondContact O-N 3.3Å
593	D	85.5	Confident	80.6	Confident	21 Å²	21	50.8 Å²	50.8	11%	0.112	27%	0.265	C	S	.	.	S	Bend	trans	-65.6	138	173.4	-167.5	-66.2	0	0	0	109.8	R575 Q589 L590 F595 F596 T597	R575-D593 IonicContact CZ-OD2 2.76Å; R575-D593 IonicContact NH1-OD2 3.15Å; R575-D593 PolarHBondContact NH1-OD2 2.89Å; R575-D593 IonicContact NH2-OD2 3.66Å; R575-D593 PolarHBondContact NH2-OD2 2.82Å; Q589-D593 PolarHBondContact O-N 3.36Å; Q589-D593 VanDerWaalsContact O-N 3.09Å; L590-D593 WeakPolarHBondContact O-CB 3.48Å; D593-F595 PolarHBondContact O-N 2.95Å; D593-F595 WeakPolarHBondContact OD1-CB 3.4Å; D593-F595 PolarHBondContact OD1-N 3.32Å; D593-F595 VanDerWaalsContact OD1-N 3.1Å; D593-F596 HydrophobicContact CB-CD2 4.12Å; D593-F596 CarbonylContact O-C 3.51Å; D593-F596 WeakPolarHBondContact O-CA 3.5Å; D593-F596 PolarHBondContact O-N 2.93Å; D593-T597 PolarHBondContact O-N 3.46Å; D593-T597 PolarHBondContact O-OG1 3.38Å; D593-T597 VanDerWaalsContact O-OG1 3.05Å
594	D	78.8	Confident	80	Confident	86 Å²	86	47.2 Å²	47.2	46%	0.46	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-61.7	-35.1	-174	-56.4	-73.3	0	0	0	112.2	F596 T597 K679	D594-F596 PolarHBondContact O-N 3.11Å; D594-T597 PolarHBondContact O-N 3.31Å; D594-K679 VanDerWaalsContact CG-CE 3.47Å; D594-K679 VanDerWaalsContact OD1-CE 3.31Å; D594-K679 WeakPolarHBondContact OD1-CE 3.47Å; D594-K679 IonicContact OD1-NZ 2.74Å; D594-K679 PolarHBondContact OD1-NZ 2.9Å; D594-K679 IonicContact OD2-NZ 3.24Å; D594-K679 PolarHBondContact OD2-NZ 2.86Å
595	F	82.9	Confident	79.4	Confident	7 Å²	7	48.8 Å²	48.8	3%	0.031	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-62	-34.7	176	-177.5	-97.1	0	0	0	111.8	I436 L439 K440 E568 I569 I572 D593	I436-F595 HydrophobicContact CD1-CE2 3.87Å; I436-F595 HydrophobicContact CD1-CZ 3.67Å; L439-F595 HydrophobicContact CD2-CE1 4.22Å; L439-F595 HydrophobicContact CD2-CZ 4.08Å; K440-F595 HydrophobicContact CD-CD2 4.42Å; K440-F595 HydrophobicContact CD-CE2 4.23Å; K440-F595 HydrophobicContact CD-CZ 4.27Å; K440-F595 VanDerWaalsContact CD-O 3.26Å; K440-F595 WeakPolarHBondContact CD-O 3.37Å; K440-F595 WeakPolarHBondContact CE-O 3.28Å; K440-F595 HydrophobicContact CG-CD1 4.2Å; K440-F595 HydrophobicContact CG-CD2 4.5Å; K440-F595 HydrophobicContact CG-CE1 3.69Å; K440-F595 HydrophobicContact CG-CE2 4.05Å; K440-F595 HydrophobicContact CG-CZ 3.58Å; K440-F595 PolarHBondContact NZ-O 3.22Å; E568-F595 HydrophobicContact CG-CB 4.41Å; E568-F595 HydrophobicContact CG-CD2 3.35Å; E568-F595 HydrophobicContact CG-CE2 3.93Å; E568-F595 HydrophobicContact CG-CG 4.18Å; E568-F595 WeakPolarHBondContact OE1-CE2 3.45Å; I569-F595 HydrophobicContact CD1-CE2 3.8Å; I569-F595 HydrophobicContact CD1-CZ 3.56Å; I569-F595 HydrophobicContact CG1-CD2 4.24Å; I569-F595 HydrophobicContact CG1-CE1 4.14Å; I569-F595 HydrophobicContact CG1-CE2 3.39Å; I569-F595 HydrophobicContact CG1-CZ 3.36Å; I572-F595 HydrophobicContact CD1-CB 3.45Å; I572-F595 VanDerWaalsContact CD1-CB 3.45Å; I572-F595 HydrophobicContact CD1-CD1 3.68Å; I572-F595 HydrophobicContact CD1-CG 3.67Å; D593-F595 PolarHBondContact O-N 2.95Å; D593-F595 WeakPolarHBondContact OD1-CB 3.4Å; D593-F595 PolarHBondContact OD1-N 3.32Å; D593-F595 VanDerWaalsContact OD1-N 3.1Å
596	F	84	Confident	79.2	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.009	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-97.5	4.5	177.8	-61.4	-53.5	0	0	0	114.2	C443 R444 L447 F523 L527 I572 L590 D593 D594	C443-F596 HydrophobicContact CB-CD1 3.93Å; C443-F596 HydrophobicContact CB-CE1 3.22Å; C443-F596 HydrophobicContact CB-CZ 3.9Å; R444-F596 WeakPolarHBondContact CD-O 3.43Å; R444-F596 PolarHBondContact NH1-O 2.76Å; L447-F596 HydrophobicContact CD1-CD1 4.46Å; L447-F596 HydrophobicContact CD1-CD2 3.75Å; L447-F596 HydrophobicContact CD1-CE2 3.93Å; L447-F596 HydrophobicContact CD1-CG 4.03Å; L447-F596 HydrophobicContact CD1-CZ 4.4Å; F523-F596 HydrophobicContact CE1-CE2 4.36Å; F523-F596 HydrophobicContact CE1-CZ 4.32Å; F523-F596 HydrophobicContact CZ-CE2 4.17Å; F523-F596 AromaticContact CZ-CZ 3.81Å; F523-F596 HydrophobicContact CZ-CZ 3.81Å; L527-F596 HydrophobicContact CD2-CZ 4.25Å; I572-F596 HydrophobicContact CD1-CD2 4.5Å; I572-F596 HydrophobicContact CD1-CE2 4.01Å; I572-F596 HydrophobicContact CD1-CZ 4.4Å; I572-F596 HydrophobicContact CG2-CE2 3.68Å; I572-F596 HydrophobicContact CG2-CZ 4Å; L590-F596 WeakPolarHBondContact O-CB 3.42Å; L590-F596 VanDerWaalsContact O-CD2 3.23Å; L590-F596 WeakPolarHBondContact O-CD2 3.28Å; D593-F596 HydrophobicContact CB-CD2 4.12Å; D593-F596 CarbonylContact O-C 3.51Å; D593-F596 WeakPolarHBondContact O-CA 3.5Å; D593-F596 PolarHBondContact O-N 2.93Å; D594-F596 PolarHBondContact O-N 3.11Å
597	T	74.7	Confident	78.9	Confident	40 Å²	40	47.8 Å²	47.8	25%	0.245	24%	0.243	C	C	.	.	S	Bend	trans	-77.1	129.1	168.5	-62.1	0	0	0	0	109.5	R444 D593 D594 I602	R444-T597 PolarHBondContact NH1-O 2.85Å; D593-T597 PolarHBondContact O-N 3.46Å; D593-T597 PolarHBondContact O-OG1 3.38Å; D593-T597 VanDerWaalsContact O-OG1 3.05Å; D594-T597 PolarHBondContact O-N 3.31Å; T597-I602 HydrophobicContact CG2-CD1 4Å; T597-I602 HydrophobicContact CG2-CG1 3.68Å
598	P	66.6	Low	78.6	Confident	19 Å²	19	48.3 Å²	48.3	12%	0.123	25%	0.246	C	C	.	.			trans	-74.9	135.1	176.2	-10.2	24.5	0	0	0	111.3	D600 L601 I602	P598-D600 PolarHBondContact O-N 3.17Å; P598-L601 HydrophobicContact CB-CB 4.06Å; P598-L601 HydrophobicContact CG-CB 3.91Å; P598-L601 HydrophobicContact CG-CD1 4.23Å; P598-L601 HydrophobicContact CG-CD2 4.4Å; P598-L601 HydrophobicContact CG-CG 4.41Å; P598-L601 PolarHBondContact O-N 3.33Å; P598-I602 PolarHBondContact O-N 3.05Å
599	E	63.5	Low	78.4	Confident	66 Å²	66	45.5 Å²	45.5	31%	0.308	23%	0.234	S	C	.	.	H	α-helix	trans	-50.4	-43.8	174.2	-64.5	178.6	-151.4	0	0	111.1	L601 I602 R605	E599-L601 VanDerWaalsContact C-N 3.35Å; E599-L601 PolarHBondContact O-N 2.96Å; E599-I602 PolarHBondContact O-N 2.96Å; E599-R605 IonicContact OE2-CZ 2.72Å; E599-R605 IonicContact OE2-NE 2.74Å; E599-R605 PolarHBondContact OE2-NE 3.45Å; E599-R605 IonicContact OE2-NH2 3.48Å
600	D	55.7	Low	78.2	Confident	87 Å²	87	44.6 Å²	44.6	47%	0.465	23%	0.232	S	C	.	.	H	α-helix	trans	-62.7	-32	176.4	-62.9	31.9	0	0	0	114.5	W58 P598 G603	W58-D600 WeakPolarHBondContact CH2-OD1 3.43Å; W58-D600 HydrophobicContact CZ2-CB 4.3Å; W58-D600 WeakPolarHBondContact CZ2-OD1 3.19Å; W58-D600 VanDerWaalsContact CZ2-OD2 3.23Å; W58-D600 WeakPolarHBondContact CZ2-OD2 3.15Å; P598-D600 PolarHBondContact O-N 3.17Å; D600-G603 PolarHBondContact O-N 2.75Å
601	L	53	Low	77.8	Confident	137 Å²	137	47.7 Å²	47.7	72%	0.717	24%	0.244	S	C	*	.	H	α-helix	trans	-80.3	-20.4	-178.6	-117.1	80.2	0	0	0	112.9	P598 E599	P598-L601 HydrophobicContact CB-CB 4.06Å; P598-L601 HydrophobicContact CG-CB 3.91Å; P598-L601 HydrophobicContact CG-CD1 4.23Å; P598-L601 HydrophobicContact CG-CD2 4.4Å; P598-L601 HydrophobicContact CG-CG 4.41Å; P598-L601 PolarHBondContact O-N 3.33Å; E599-L601 VanDerWaalsContact C-N 3.35Å; E599-L601 PolarHBondContact O-N 2.96Å
602	I	63.7	Low	77.4	Confident	20 Å²	20	51.4 Å²	51.4	10%	0.103	26%	0.264	C	S	.	.	H	α-helix	trans	-69.3	-27.5	167.8	-55.6	172.9	0	0	0	109.6	T597 P598 E599 I604 K633 M676 L680	T597-I602 HydrophobicContact CG2-CD1 4Å; T597-I602 HydrophobicContact CG2-CG1 3.68Å; P598-I602 PolarHBondContact O-N 3.05Å; E599-I602 PolarHBondContact O-N 2.96Å; I602-I604 HydrophobicContact CG2-CB 4.1Å; I602-I604 HydrophobicContact CG2-CD1 4.36Å; I602-I604 PolarHBondContact O-N 3.34Å; I602-K633 PolarHBondContact O-NZ 3.43Å; I602-M676 HydrophobicContact CD1-SD 4.2Å; I602-M676 HydrophobicContact CG1-SD 4.28Å; I602-M676 HydrophobicContact CG2-CE 4.17Å; I602-M676 HydrophobicContact CG2-CG 3.36Å; I602-M676 HydrophobicContact CG2-SD 3.58Å; I602-M676 VanDerWaalsContact CG2-SD 3.58Å; I602-L680 HydrophobicContact CD1-CD2 4.12Å; I602-L680 HydrophobicContact CG2-CD1 4.16Å
603	G	67	Low	77.4	Confident	2 Å²	2	48.6 Å²	48.6	2%	0.021	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	1.4	-175.8	0	0	0	0	0	113.4	D600 V628 Y629 D630	D600-G603 PolarHBondContact O-N 2.75Å; G603-V628 CarbonylContact O-C 3.52Å; G603-V628 WeakPolarHBondContact O-CA 3.22Å; G603-Y629 PolarHBondContact O-N 2.85Å; G603-D630 PolarHBondContact O-N 3.42Å; G603-D630 VanDerWaalsContact O-N 3.16Å
604	I	77.9	Confident	77.4	Confident	1 Å²	1	48 Å²	48	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	138.6	-167.6	-50.6	156.4	0	0	0	107.8	I602 L626 R627 V628 K633 Y637 D673 I677 L680	I602-I604 HydrophobicContact CG2-CB 4.1Å; I602-I604 HydrophobicContact CG2-CD1 4.36Å; I602-I604 PolarHBondContact O-N 3.34Å; I604-L626 HydrophobicContact CG2-CD1 3.39Å; I604-L626 HydrophobicContact CG2-CG 4.37Å; I604-R627 CarbonylContact C-O 3.6Å; I604-R627 WeakPolarHBondContact CA-O 3.3Å; I604-V628 HydrophobicContact CG1-CG2 4.38Å; I604-V628 HydrophobicContact CG2-CG2 4.41Å; I604-K633 HydrophobicContact CD1-CD 4.23Å; I604-K633 HydrophobicContact CG1-CD 4.38Å; I604-Y637 WeakPolarHBondContact CD1-OH 3.26Å; I604-D673 HydrophobicContact CD1-CB 4.05Å; I604-D673 VanDerWaalsContact CD1-CG 3.46Å; I604-D673 WeakPolarHBondContact CD1-OD2 3.49Å; I604-I677 HydrophobicContact CD1-CD1 4.33Å; I604-I677 HydrophobicContact CD1-CG1 4.38Å; I604-I677 HydrophobicContact CG2-CD1 4.06Å; I604-I677 HydrophobicContact CG2-CG1 4.02Å; I604-L680 HydrophobicContact CB-CD1 4.26Å; I604-L680 HydrophobicContact CG2-CD1 4.13Å
605	R	80.7	Confident	77.8	Confident	46 Å²	46	45.3 Å²	45.3	17%	0.174	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	136.2	-173.8	-160.7	166.5	172.6	-95.4	-22.8	110.6	E599 E607 L626 R627 Y629	E599-R605 IonicContact OE2-CZ 2.72Å; E599-R605 IonicContact OE2-NE 2.74Å; E599-R605 PolarHBondContact OE2-NE 3.45Å; E599-R605 IonicContact OE2-NH2 3.48Å; R605-E607 VanDerWaalsContact CZ-CD 3.49Å; R605-E607 IonicContact CZ-OE1 3.06Å; R605-E607 IonicContact CZ-OE2 3.38Å; R605-E607 IonicContact NH1-OE1 3.9Å; R605-E607 PolarHBondContact NH1-OE1 3.37Å; R605-E607 IonicContact NH1-OE2 3.63Å; R605-E607 PolarHBondContact NH1-OE2 2.76Å; R605-E607 IonicContact NH2-OE1 3.67Å; R605-E607 PolarHBondContact NH2-OE1 2.91Å; R605-L626 WeakPolarHBondContact O-CA 3.47Å; R605-R627 PolarHBondContact N-O 2.94Å; R605-R627 PolarHBondContact O-N 3.39Å; R605-Y629 HydrophobicContact CB-CD2 4.08Å; R605-Y629 HydrophobicContact CB-CE2 3.69Å; R605-Y629 HydrophobicContact CG-CE2 4.4Å
606	V	87.3	Confident	77.8	Confident	1 Å²	1	49 Å²	49	1%	0.006	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.1	173.2	179.2	0	0	0	0	109.3	M624 Q625 L626 L680 I681 K684	V606-M624 HydrophobicContact CG1-CE 3.77Å; V606-Q625 WeakPolarHBondContact CA-O 3.33Å; V606-L626 HydrophobicContact CG2-CD1 3.65Å; V606-L680 HydrophobicContact CB-CB 4.21Å; V606-L680 HydrophobicContact CG2-CB 3.7Å; V606-L680 HydrophobicContact CG2-CD1 4.39Å; V606-I681 HydrophobicContact CG1-CG1 4.26Å; V606-I681 HydrophobicContact CG2-CG1 4.17Å; V606-K684 HydrophobicContact CB-CG 4.28Å; V606-K684 HydrophobicContact CG1-CG 4.16Å; V606-K684 WeakPolarHBondContact O-CD 3.5Å; V606-K684 WeakPolarHBondContact O-CE 3.21Å; V606-K684 PolarHBondContact O-NZ 2.85Å; V606-K684 VanDerWaalsContact O-NZ 3.1Å
607	E	86.1	Confident	78	Confident	58 Å²	58	54.5 Å²	54.5	27%	0.271	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	155.9	176.4	-61.7	-168.2	109.7	0	0	110.6	R605 M624 Q625	R605-E607 VanDerWaalsContact CZ-CD 3.49Å; R605-E607 IonicContact CZ-OE1 3.06Å; R605-E607 IonicContact CZ-OE2 3.38Å; R605-E607 IonicContact NH1-OE1 3.9Å; R605-E607 PolarHBondContact NH1-OE1 3.37Å; R605-E607 IonicContact NH1-OE2 3.63Å; R605-E607 PolarHBondContact NH1-OE2 2.76Å; R605-E607 IonicContact NH2-OE1 3.67Å; R605-E607 PolarHBondContact NH2-OE1 2.91Å; E607-M624 CarbonylContact O-C 3.28Å; E607-M624 VanDerWaalsContact O-CA 3.26Å; E607-M624 WeakPolarHBondContact O-CA 3.32Å; E607-Q625 PolarHBondContact N-O 3.28Å; E607-Q625 PolarHBondContact O-N 3.19Å
608	I	89.8	Confident	78.6	Confident	20 Å²	20	54.9 Å²	54.9	10%	0.103	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	119.9	169.5	-58.9	170.7	0	0	0	105.8	R611 I622 Q623 M624 F688	I608-R611 HydrophobicContact CB-CB 4.23Å; I608-R611 HydrophobicContact CG2-CB 4.14Å; I608-I622 HydrophobicContact CD1-CD1 3.75Å; I608-I622 HydrophobicContact CG1-CD1 4.14Å; I608-I622 HydrophobicContact CG2-CB 4.22Å; I608-I622 HydrophobicContact CG2-CD1 4.46Å; I608-Q623 CarbonylContact C-O 3.14Å; I608-Q623 WeakPolarHBondContact CA-O 3.3Å; I608-M624 HydrophobicContact CG1-CE 4.16Å; I608-M624 HydrophobicContact CG1-CG 4.41Å; I608-F688 HydrophobicContact CD1-CB 3.85Å; I608-F688 HydrophobicContact CD1-CD2 3.68Å; I608-F688 HydrophobicContact CD1-CG 4.02Å
609	K	86.5	Confident	79.5	Confident	85 Å²	85	56.8 Å²	56.8	37%	0.37	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-46.8	-169.9	-84.2	-161.7	174.4	-176.3	0	112.9	Q623 Q625 Q646 T1136	K609-Q623 PolarHBondContact N-O 3.28Å; K609-Q625 HydrophobicContact CG-CB 4.25Å; K609-Q646 VanDerWaalsContact CE-OE1 3.28Å; K609-T1136 PolarHBondContact NZ-OG1 2.88Å
610	N	87.6	Confident	80.8	Confident	84 Å²	84	55.9 Å²	55.9	45%	0.449	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	27.4	-172.4	-63.1	-10.8	0	0	0	112.2	D612 A613 D614	N610-D612 VanDerWaalsContact C-N 3.25Å; N610-D612 PolarHBondContact O-N 3.23Å; N610-A613 WeakPolarHBondContact O-CA 3.48Å; N610-A613 PolarHBondContact O-N 2.77Å; N610-D614 WeakPolarHBondContact CB-OD2 3.49Å; N610-D614 PolarHBondContact O-N 2.66Å
611	R	85.9	Confident	82.5	Confident	65 Å²	65	56.5 Å²	56.5	25%	0.245	29%	0.292	C	S	.	.	H	α-helix	trans	-42.3	-48.6	-168	-174.1	-177.9	179.4	91.5	-3.7	113.6	I608 L615 A687 F688 D691	I608-R611 HydrophobicContact CB-CB 4.23Å; I608-R611 HydrophobicContact CG2-CB 4.14Å; R611-L615 WeakPolarHBondContact O-CB 3.42Å; R611-L615 PolarHBondContact O-N 3.16Å; R611-A687 PolarHBondContact NH2-O 3.1Å; R611-F688 HydrophobicContact CG-CD2 4.06Å; R611-F688 HydrophobicContact CG-CE2 4.02Å; R611-D691 IonicContact CZ-OD2 3.25Å; R611-D691 IonicContact NE-OD2 3.89Å; R611-D691 IonicContact NH2-OD2 3.98Å; R611-D691 PolarHBondContact NH2-OD2 3.15Å
612	D	82.8	Confident	84.4	Confident	124 Å²	124	50 Å²	50	66%	0.663	26%	0.258	S	S	*	.	H	α-helix	trans	-73	-27.2	-174.8	-56.8	-31.2	0	0	0	113.3	N610 N616	N610-D612 VanDerWaalsContact C-N 3.25Å; N610-D612 PolarHBondContact O-N 3.23Å; D612-N616 PolarHBondContact O-ND2 3.05Å
613	A	84.4	Confident	85.8	Confident	49 Å²	49	52.9 Å²	52.9	41%	0.405	27%	0.271	S	S	.	.	H	α-helix	trans	-77.3	-51.6	171.9	0	0	0	0	0	110	N610 L615 N616 D617	N610-A613 WeakPolarHBondContact O-CA 3.48Å; N610-A613 PolarHBondContact O-N 2.77Å; A613-L615 PolarHBondContact O-N 3.44Å; A613-L615 VanDerWaalsContact O-N 3.13Å; A613-N616 PolarHBondContact O-N 2.96Å; A613-D617 PolarHBondContact O-N 3.36Å
614	D	87.3	Confident	87	Confident	10 Å²	10	52.8 Å²	52.8	5%	0.053	27%	0.27	C	S	.	.	H	α-helix	trans	-55.5	-35.5	179.8	-63.4	-33.7	0	0	0	112.4	N610 L618 N619 I622 F688	N610-D614 WeakPolarHBondContact CB-OD2 3.49Å; N610-D614 PolarHBondContact O-N 2.66Å; D614-L618 CarbonylContact O-C 3.47Å; D614-L618 WeakPolarHBondContact O-CA 3.27Å; D614-L618 PolarHBondContact O-N 3.11Å; D614-L618 VanDerWaalsContact O-N 3.1Å; D614-N619 HydrophobicContact CB-CB 4.18Å; D614-N619 PolarHBondContact O-N 3.13Å; D614-N619 PolarHBondContact OD1-ND2 3.44Å; D614-I622 HydrophobicContact CB-CG2 3.87Å; D614-F688 HydrophobicContact CB-CE2 4.1Å; D614-F688 HydrophobicContact CB-CZ 3.73Å
615	L	85.3	Confident	87.6	Confident	29 Å²	29	52.9 Å²	52.9	15%	0.152	27%	0.27	C	S	.	.	H	α-helix	trans	-77.8	-26.3	178.7	-160.2	78.8	0	0	0	113.8	R611 A613 F688 D691 R692	R611-L615 WeakPolarHBondContact O-CB 3.42Å; R611-L615 PolarHBondContact O-N 3.16Å; A613-L615 PolarHBondContact O-N 3.44Å; A613-L615 VanDerWaalsContact O-N 3.13Å; L615-F688 HydrophobicContact CB-CE2 4.07Å; L615-F688 HydrophobicContact CB-CZ 4.13Å; L615-F688 HydrophobicContact CD1-CD2 4.13Å; L615-F688 HydrophobicContact CD1-CE1 4.17Å; L615-F688 HydrophobicContact CD1-CE2 3.73Å; L615-F688 HydrophobicContact CD1-CZ 3.76Å; L615-D691 HydrophobicContact CD1-CB 3.71Å; L615-D691 HydrophobicContact CD2-CB 4.01Å; L615-D691 HydrophobicContact CG-CB 4.49Å; L615-R692 HydrophobicContact CD1-CB 4.17Å
616	N	84.6	Confident	88	Confident	85 Å²	85	50.7 Å²	50.7	46%	0.455	26%	0.262	S	S	.	.	H	α-helix	trans	-83.8	-40.1	176.6	-85.3	-63	0	0	0	111.9	D612 A613 L618 R695	D612-N616 PolarHBondContact O-ND2 3.05Å; A613-N616 PolarHBondContact O-N 2.96Å; N616-L618 PolarHBondContact O-N 2.91Å; N616-R695 PolarHBondContact OD1-NE 2.85Å; N616-R695 PolarHBondContact OD1-NH2 2.61Å
617	D	87.4	Confident	87.9	Confident	117 Å²	117	54.1 Å²	54.1	63%	0.626	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-7.3	177	-62.4	-28.6	0	0	0	112.4	A613 N619	A613-D617 PolarHBondContact O-N 3.36Å; D617-N619 VanDerWaalsContact C-N 3.29Å; D617-N619 PolarHBondContact O-N 3.06Å
618	L	86.8	Confident	87.6	Confident	48 Å²	48	52.1 Å²	52.1	25%	0.251	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	34.2	-178.5	-57.9	169.5	0	0	0	113.5	D614 N616 R692 R695 L696 I699	D614-L618 CarbonylContact O-C 3.47Å; D614-L618 WeakPolarHBondContact O-CA 3.27Å; D614-L618 PolarHBondContact O-N 3.11Å; D614-L618 VanDerWaalsContact O-N 3.1Å; N616-L618 PolarHBondContact O-N 2.91Å; L618-R692 HydrophobicContact CD2-CG 3.76Å; L618-R695 HydrophobicContact CD2-CB 4.48Å; L618-R695 HydrophobicContact CD2-CG 4.35Å; L618-L696 HydrophobicContact CD1-CD2 3.7Å; L618-L696 HydrophobicContact CD1-CG 4.19Å; L618-L696 HydrophobicContact CD2-CD2 4.49Å; L618-L696 HydrophobicContact CD2-CG 4.06Å; L618-I699 HydrophobicContact CD1-CD1 4.21Å
619	N	86.4	Confident	86.9	Confident	58 Å²	58	56.4 Å²	56.4	31%	0.31	28%	0.282	S	S	.	.			trans	-55.7	136.4	-177.7	-71.5	-20.2	0	0	0	111.9	D614 D617	D614-N619 HydrophobicContact CB-CB 4.18Å; D614-N619 PolarHBondContact O-N 3.13Å; D614-N619 PolarHBondContact OD1-ND2 3.44Å; D617-N619 VanDerWaalsContact C-N 3.29Å; D617-N619 PolarHBondContact O-N 3.06Å
620	V	89.8	Confident	86.1	Confident	47 Å²	47	55 Å²	55	29%	0.285	28%	0.279	S	S	.	.	S	Bend	trans	-84.9	-39.8	174.6	-176.9	0	0	0	0	111	D650 I651 E652	V620-D650 WeakPolarHBondContact CG1-OD1 3.45Å; V620-I651 WeakPolarHBondContact O-CB 3.41Å; V620-I651 WeakPolarHBondContact O-CD1 3.46Å; V620-I651 WeakPolarHBondContact O-CG1 3.41Å; V620-I651 PolarHBondContact O-N 3.16Å; V620-E652 HydrophobicContact CG1-CB 3.97Å; V620-E652 HydrophobicContact CG1-CG 3.99Å
621	E	92.5	Very high	85.3	Confident	101 Å²	101	57.8 Å²	57.8	47%	0.472	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	121.3	169.9	-174.8	170.4	-129	0	0	110.7	A648 F649 R1132	E621-A648 HydrophobicContact CG-CB 3.77Å; E621-A648 WeakPolarHBondContact OE1-CB 3.47Å; E621-F649 WeakPolarHBondContact CA-O 3.49Å; E621-R1132 IonicContact OE1-CZ 2.97Å; E621-R1132 IonicContact OE1-NE 2.89Å; E621-R1132 PolarHBondContact OE1-NE 2.76Å; E621-R1132 IonicContact OE1-NH2 3.17Å; E621-R1132 PolarHBondContact OE1-NH2 3.06Å
622	I	92.6	Very high	84.5	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	147.8	177.5	52.7	166.7	0	0	0	111.3	I608 D614 M624 A648 F649 I651 F688	I608-I622 HydrophobicContact CD1-CD1 3.75Å; I608-I622 HydrophobicContact CG1-CD1 4.14Å; I608-I622 HydrophobicContact CG2-CB 4.22Å; I608-I622 HydrophobicContact CG2-CD1 4.46Å; D614-I622 HydrophobicContact CB-CG2 3.87Å; I622-M624 HydrophobicContact CD1-CG 4.21Å; I622-M624 HydrophobicContact CD1-SD 4.45Å; I622-M624 HydrophobicContact CG1-CG 4.38Å; I622-A648 CarbonylContact O-C 3.55Å; I622-A648 WeakPolarHBondContact O-CA 3.42Å; I622-F649 HydrophobicContact CG1-CB 4.26Å; I622-F649 VanDerWaalsContact CG1-O 3.25Å; I622-F649 WeakPolarHBondContact CG1-O 3.38Å; I622-F649 PolarHBondContact N-O 3.03Å; I622-F649 PolarHBondContact O-N 3.23Å; I622-I651 HydrophobicContact CB-CD1 4.47Å; I622-I651 HydrophobicContact CD1-CD1 4.15Å; I622-I651 HydrophobicContact CD1-CG1 4.05Å; I622-I651 HydrophobicContact CG1-CD1 4.08Å; I622-I651 HydrophobicContact CG1-CG1 4.01Å; I622-I651 HydrophobicContact CG2-CD1 3.62Å; I622-I651 HydrophobicContact CG2-CG1 4.47Å; I622-F688 HydrophobicContact CD1-CG 4.5Å; I622-F688 HydrophobicContact CG2-CD1 4.35Å; I622-F688 HydrophobicContact CG2-CE1 3.82Å; I622-F688 HydrophobicContact CG2-CE2 4.28Å; I622-F688 HydrophobicContact CG2-CZ 3.78Å
623	Q	93.1	Very high	83.9	Confident	80 Å²	80	59.1 Å²	59.1	37%	0.374	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	111.3	175.8	-66.5	-165.3	-2.3	0	0	111.7	I608 K609 A648	I608-Q623 CarbonylContact C-O 3.14Å; I608-Q623 WeakPolarHBondContact CA-O 3.3Å; K609-Q623 PolarHBondContact N-O 3.28Å; Q623-A648 HydrophobicContact CG-CB 4.49Å
624	M	92.4	Very high	83.2	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	155.8	177.7	-55	-169.7	95	0	0	111.3	V606 E607 I608 I622 Q646 F647 F649 I681 K684 V685	V606-M624 HydrophobicContact CG1-CE 3.77Å; E607-M624 CarbonylContact O-C 3.28Å; E607-M624 VanDerWaalsContact O-CA 3.26Å; E607-M624 WeakPolarHBondContact O-CA 3.32Å; I608-M624 HydrophobicContact CG1-CE 4.16Å; I608-M624 HydrophobicContact CG1-CG 4.41Å; I622-M624 HydrophobicContact CD1-CG 4.21Å; I622-M624 HydrophobicContact CD1-SD 4.45Å; I622-M624 HydrophobicContact CG1-CG 4.38Å; M624-Q646 WeakPolarHBondContact O-CA 3.49Å; M624-Q646 WeakPolarHBondContact O-CG 3.47Å; M624-F647 HydrophobicContact CB-CD1 4.23Å; M624-F647 HydrophobicContact CB-CD2 4.11Å; M624-F647 HydrophobicContact CB-CE1 3.71Å; M624-F647 HydrophobicContact CB-CE2 3.59Å; M624-F647 HydrophobicContact CB-CG 4.4Å; M624-F647 HydrophobicContact CB-CZ 3.36Å; M624-F647 HydrophobicContact CG-CE2 4.04Å; M624-F647 HydrophobicContact CG-CZ 4.16Å; M624-F647 PolarHBondContact N-O 2.9Å; M624-F647 PolarHBondContact O-N 3.45Å; M624-F647 VanDerWaalsContact O-O 3.04Å; M624-F647 HydrophobicContact SD-CE2 3.64Å; M624-F647 HydrophobicContact SD-CZ 3.86Å; M624-F649 HydrophobicContact CG-CB 4.03Å; M624-F649 HydrophobicContact SD-CB 3.64Å; M624-F649 HydrophobicContact SD-CD2 4.2Å; M624-F649 HydrophobicContact SD-CG 3.93Å; M624-I681 HydrophobicContact CE-CG2 4.29Å; M624-I681 HydrophobicContact SD-CG2 4.06Å; M624-K684 HydrophobicContact CE-CB 3.66Å; M624-V685 HydrophobicContact CE-CG2 4Å; M624-V685 HydrophobicContact SD-CG2 4.22Å
625	Q	90.5	Very high	82.3	Confident	3 Å²	3	67.5 Å²	67.5	1%	0.014	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	124.7	172.7	-167.4	-177	37	0	0	111.1	V606 E607 K609 R627 L645 Q646 T1136	V606-Q625 WeakPolarHBondContact CA-O 3.33Å; E607-Q625 PolarHBondContact N-O 3.28Å; E607-Q625 PolarHBondContact O-N 3.19Å; K609-Q625 HydrophobicContact CG-CB 4.25Å; Q625-R627 HydrophobicContact CG-CG 4.34Å; Q625-R627 VanDerWaalsContact OE1-CZ 3.29Å; Q625-L645 WeakPolarHBondContact CA-O 3.48Å; Q625-Q646 HydrophobicContact CG-CB 4.42Å; Q625-T1136 PolarHBondContact NE2-OG1 3.35Å
626	L	89.3	Confident	81.7	Confident	0 Å²	0	70.4 Å²	70.4	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131.6	170.6	177.9	75.3	0	0	0	109.7	I604 R605 V606 F639 G644 L645 F647 I669 I677	I604-L626 HydrophobicContact CG2-CD1 3.39Å; I604-L626 HydrophobicContact CG2-CG 4.37Å; R605-L626 WeakPolarHBondContact O-CA 3.47Å; V606-L626 HydrophobicContact CG2-CD1 3.65Å; L626-F639 HydrophobicContact CD2-CE1 4.48Å; L626-F639 HydrophobicContact CD2-CZ 4.18Å; L626-F639 HydrophobicContact CG-CZ 4.45Å; L626-G644 CarbonylContact O-C 3.54Å; L626-G644 WeakPolarHBondContact O-CA 3.45Å; L626-L645 HydrophobicContact CB-CB 4.26Å; L626-L645 HydrophobicContact CD2-CD2 4.11Å; L626-L645 PolarHBondContact N-O 2.87Å; L626-L645 PolarHBondContact O-N 3.24Å; L626-F647 HydrophobicContact CB-CE1 4.23Å; L626-I669 HydrophobicContact CD2-CD1 3.48Å; L626-I669 VanDerWaalsContact CD2-CD1 3.48Å; L626-I669 HydrophobicContact CD2-CG1 3.99Å; L626-I677 HydrophobicContact CD1-CD1 4.12Å; L626-I677 HydrophobicContact CD1-CG1 4.24Å; L626-I677 HydrophobicContact CD1-CG2 4.01Å; L626-I677 HydrophobicContact CD2-CD1 4.13Å; L626-I677 HydrophobicContact CD2-CG2 4.41Å
627	R	84.1	Confident	81.4	Confident	74 Å²	74	67 Å²	67	28%	0.279	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	142.5	175.8	-62.8	-175.3	-175.7	-157	6.1	110.6	I604 R605 Q625 Y629	I604-R627 CarbonylContact C-O 3.6Å; I604-R627 WeakPolarHBondContact CA-O 3.3Å; R605-R627 PolarHBondContact N-O 2.94Å; R605-R627 PolarHBondContact O-N 3.39Å; Q625-R627 HydrophobicContact CG-CG 4.34Å; Q625-R627 VanDerWaalsContact OE1-CZ 3.29Å; R627-Y629 HydrophobicContact CB-CD2 4.35Å; R627-Y629 HydrophobicContact CB-CE2 3.71Å
628	V	81.4	Confident	80.6	Confident	15 Å²	15	70 Å²	70	9%	0.091	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	115.4	177.9	179.2	0	0	0	0	109.8	G603 I604 K633 R634 Y637 F639	G603-V628 CarbonylContact O-C 3.52Å; G603-V628 WeakPolarHBondContact O-CA 3.22Å; I604-V628 HydrophobicContact CG1-CG2 4.38Å; I604-V628 HydrophobicContact CG2-CG2 4.41Å; V628-K633 HydrophobicContact CG1-CB 4.25Å; V628-R634 HydrophobicContact CG1-CB 4.48Å; V628-Y637 HydrophobicContact CG1-CD2 4.26Å; V628-Y637 HydrophobicContact CG1-CE2 4.35Å; V628-Y637 HydrophobicContact CG2-CD1 3.78Å; V628-Y637 HydrophobicContact CG2-CD2 4.02Å; V628-Y637 HydrophobicContact CG2-CE1 3.75Å; V628-Y637 HydrophobicContact CG2-CE2 4.04Å; V628-Y637 HydrophobicContact CG2-CG 3.91Å; V628-F639 HydrophobicContact CB-CE2 4.16Å; V628-F639 HydrophobicContact CG2-CE2 3.76Å; V628-F639 HydrophobicContact CG2-CZ 3.75Å
629	Y	73.5	Confident	79.9	Confident	111 Å²	111	68 Å²	68	44%	0.435	30%	0.302	S	S	.	.			trans	-96.9	-29.7	-177.3	-69.4	-91.9	0	0	0	112.7	G603 R605 R627 E631	G603-Y629 PolarHBondContact O-N 2.85Å; R605-Y629 HydrophobicContact CB-CD2 4.08Å; R605-Y629 HydrophobicContact CB-CE2 3.69Å; R605-Y629 HydrophobicContact CG-CE2 4.4Å; R627-Y629 HydrophobicContact CB-CD2 4.35Å; R627-Y629 HydrophobicContact CB-CE2 3.71Å; Y629-E631 PolarHBondContact O-N 2.92Å
630	D	71.1	Confident	78.8	Confident	55 Å²	55	72.4 Å²	72.4	29%	0.294	32%	0.318	S	S	.	.			trans	-72.5	112.7	176.8	178.9	11.2	0	0	0	111.2	G603 K632 K633 R634	G603-D630 PolarHBondContact O-N 3.42Å; G603-D630 VanDerWaalsContact O-N 3.16Å; D630-K632 PolarHBondContact O-N 2.82Å; D630-K632 WeakPolarHBondContact OD1-CB 3.3Å; D630-K632 PolarHBondContact OD1-N 3.35Å; D630-K633 HydrophobicContact CB-CB 4.24Å; D630-K633 HydrophobicContact CB-CG 4.46Å; D630-K633 PolarHBondContact O-N 3.21Å; D630-R634 WeakPolarHBondContact O-CB 3.25Å; D630-R634 PolarHBondContact O-N 3.07Å
631	E	69.6	Low	77	Confident	142 Å²	142	75.3 Å²	75.3	66%	0.664	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-27	177.5	-171.4	180	-157	0	0	113.3	Y629	Y629-E631 PolarHBondContact O-N 2.92Å
632	K	70.1	Confident	75.3	Confident	172 Å²	172	76 Å²	76	75%	0.748	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-53.5	176.5	-61.7	174.8	-176.1	172.3	0	110.8	D630 R634	D630-K632 PolarHBondContact O-N 2.82Å; D630-K632 WeakPolarHBondContact OD1-CB 3.3Å; D630-K632 PolarHBondContact OD1-N 3.35Å; K632-R634 VanDerWaalsContact C-N 3.3Å; K632-R634 PolarHBondContact O-N 2.97Å
633	K	70.6	Confident	74.3	Confident	45 Å²	45	77.5 Å²	77.5	20%	0.196	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-62	-34.9	176.4	-76.8	-172.6	172.1	-166.6	0	112.9	I602 I604 V628 D630 K635 Q636 Y637 D673	I602-K633 PolarHBondContact O-NZ 3.43Å; I604-K633 HydrophobicContact CD1-CD 4.23Å; I604-K633 HydrophobicContact CG1-CD 4.38Å; V628-K633 HydrophobicContact CG1-CB 4.25Å; D630-K633 HydrophobicContact CB-CB 4.24Å; D630-K633 HydrophobicContact CB-CG 4.46Å; D630-K633 PolarHBondContact O-N 3.21Å; K633-K635 PolarHBondContact O-N 2.64Å; K633-Q636 WeakPolarHBondContact O-CB 3.29Å; K633-Q636 PolarHBondContact O-N 3.26Å; K633-Y637 HydrophobicContact CB-CE2 4.26Å; K633-Y637 WeakPolarHBondContact O-CD2 3.44Å; K633-D673 VanDerWaalsContact NZ-CG 3.35Å; K633-D673 IonicContact NZ-OD1 2.64Å; K633-D673 PolarHBondContact NZ-OD1 2.89Å; K633-D673 IonicContact NZ-OD2 2.72Å; K633-D673 PolarHBondContact NZ-OD2 3.39Å
634	R	68.2	Low	73.6	Confident	45 Å²	45	73.8 Å²	73.8	17%	0.17	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-47.8	-29.2	-177	-169.4	-177.2	-67.3	167.7	-13.3	114.7	V628 D630 K632 Q636 Y637 E641	V628-R634 HydrophobicContact CG1-CB 4.48Å; D630-R634 WeakPolarHBondContact O-CB 3.25Å; D630-R634 PolarHBondContact O-N 3.07Å; K632-R634 VanDerWaalsContact C-N 3.3Å; K632-R634 PolarHBondContact O-N 2.97Å; R634-Q636 VanDerWaalsContact C-N 3.3Å; R634-Q636 PolarHBondContact O-N 3.06Å; R634-Y637 PolarHBondContact O-N 3Å; R634-E641 VanDerWaalsContact CZ-CD 3.46Å; R634-E641 IonicContact CZ-OE1 3.27Å; R634-E641 IonicContact NH1-OE1 2.71Å; R634-E641 PolarHBondContact NH1-OE1 3.38Å; R634-E641 IonicContact NH1-OE2 3.19Å; R634-E641 PolarHBondContact NH1-OE2 3.03Å; R634-E641 IonicContact NH2-OE1 2.64Å; R634-E641 PolarHBondContact NH2-OE1 3.45Å
635	K	69.6	Low	73.4	Confident	191 Å²	191	73.8 Å²	73.8	83%	0.83	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-71.4	-18.2	177.3	-64	-179	-177.1	176.1	0	114.7	K633	K633-K635 PolarHBondContact O-N 2.64Å
636	Q	73.1	Confident	73.4	Confident	89 Å²	89	74.9 Å²	74.9	42%	0.416	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-90.9	-11	178.8	-61	167.9	-79.7	0	0	112.6	K633 R634 P670 E672	K633-Q636 WeakPolarHBondContact O-CB 3.29Å; K633-Q636 PolarHBondContact O-N 3.26Å; R634-Q636 VanDerWaalsContact C-N 3.3Å; R634-Q636 PolarHBondContact O-N 3.06Å; Q636-P670 HydrophobicContact CB-CB 4.17Å; Q636-P670 HydrophobicContact CB-CG 3.93Å; Q636-E672 PolarHBondContact NE2-OE2 3.02Å
637	Y	77	Confident	73.6	Confident	14 Å²	14	75 Å²	75	6%	0.055	33%	0.331	C	S	.	.	S	Bend	trans	-100.6	151.5	178.7	-69.3	-102.3	0	0	0	110.9	I604 V628 K633 R634 F639 I669 P670 D673 I677	I604-Y637 WeakPolarHBondContact CD1-OH 3.26Å; V628-Y637 HydrophobicContact CG1-CD2 4.26Å; V628-Y637 HydrophobicContact CG1-CE2 4.35Å; V628-Y637 HydrophobicContact CG2-CD1 3.78Å; V628-Y637 HydrophobicContact CG2-CD2 4.02Å; V628-Y637 HydrophobicContact CG2-CE1 3.75Å; V628-Y637 HydrophobicContact CG2-CE2 4.04Å; V628-Y637 HydrophobicContact CG2-CG 3.91Å; K633-Y637 HydrophobicContact CB-CE2 4.26Å; K633-Y637 WeakPolarHBondContact O-CD2 3.44Å; R634-Y637 PolarHBondContact O-N 3Å; Y637-F639 AromaticContact CD1-CE1 3.73Å; Y637-F639 HydrophobicContact CD1-CE1 3.73Å; Y637-F639 AromaticContact CD1-CZ 3.59Å; Y637-F639 HydrophobicContact CD1-CZ 3.59Å; Y637-F639 HydrophobicContact CE1-CZ 4.35Å; Y637-F639 HydrophobicContact CG-CE1 4.41Å; Y637-F639 HydrophobicContact CG-CZ 4.21Å; Y637-I669 HydrophobicContact CD1-CG1 4.39Å; Y637-I669 HydrophobicContact CE1-CB 4.34Å; Y637-I669 HydrophobicContact CE1-CG1 4.14Å; Y637-I669 HydrophobicContact CE1-CG2 4.11Å; Y637-P670 HydrophobicContact CD2-CG 4.3Å; Y637-P670 HydrophobicContact CE1-CG 4.48Å; Y637-P670 HydrophobicContact CE2-CG 3.81Å; Y637-D673 WeakPolarHBondContact OH-CB 3.26Å; Y637-D673 VanDerWaalsContact OH-CG 3.26Å; Y637-D673 PolarHBondContact OH-OD2 2.71Å; Y637-I677 HydrophobicContact CE1-CD1 4.09Å
638	R	71.9	Confident	74.1	Confident	179 Å²	179	72 Å²	72	68%	0.675	32%	0.322	S	S	*	.	S	Bend	trans	-81.2	-16.6	-177.9	-68.3	-67.4	-164.9	176.2	5.1	114.8	Q667	R638-Q667 WeakPolarHBondContact CG-O 3.42Å
639	F	72.1	Confident	74.7	Confident	6 Å²	6	71.2 Å²	71.2	3%	0.026	32%	0.318	C	S	.	.	S	Bend	trans	-99.4	149.6	-179.8	52.2	-93.5	0	0	0	111.8	L626 V628 Y637 E643 L645 V1135	L626-F639 HydrophobicContact CD2-CE1 4.48Å; L626-F639 HydrophobicContact CD2-CZ 4.18Å; L626-F639 HydrophobicContact CG-CZ 4.45Å; V628-F639 HydrophobicContact CB-CE2 4.16Å; V628-F639 HydrophobicContact CG2-CE2 3.76Å; V628-F639 HydrophobicContact CG2-CZ 3.75Å; Y637-F639 AromaticContact CD1-CE1 3.73Å; Y637-F639 HydrophobicContact CD1-CE1 3.73Å; Y637-F639 AromaticContact CD1-CZ 3.59Å; Y637-F639 HydrophobicContact CD1-CZ 3.59Å; Y637-F639 HydrophobicContact CE1-CZ 4.35Å; Y637-F639 HydrophobicContact CG-CE1 4.41Å; Y637-F639 HydrophobicContact CG-CZ 4.21Å; F639-E643 HydrophobicContact CB-CB 4.09Å; F639-E643 WeakPolarHBondContact CD2-O 3.35Å; F639-L645 HydrophobicContact CD1-CB 4.04Å; F639-L645 HydrophobicContact CE1-CB 3.8Å; F639-L645 HydrophobicContact CE1-CD2 4.48Å; F639-L645 HydrophobicContact CZ-CB 4.29Å; F639-V1135 HydrophobicContact CB-CG1 3.63Å; F639-V1135 HydrophobicContact CB-CG2 4.27Å
640	K	61.9	Low	75.7	Confident	151 Å²	151	67.4 Å²	67.4	66%	0.657	31%	0.305	S	S	*	.			trans	-86.4	177	-171.7	-62.4	-175.8	177	-176.7	0	113.6	N642 E643	K640-N642 PolarHBondContact O-N 2.96Å; K640-E643 HydrophobicContact CB-CG 4.3Å; K640-E643 WeakPolarHBondContact CB-OE2 3.2Å; K640-E643 PolarHBondContact N-OE2 3.47Å; K640-E643 WeakPolarHBondContact O-CB 3.27Å; K640-E643 PolarHBondContact O-N 3.01Å
641	E	53.3	Low	76.6	Confident	109 Å²	109	64.8 Å²	64.8	51%	0.509	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	132.8	167.6	-180	156.2	-125.4	0	0	111.4	R634 E643	R634-E641 VanDerWaalsContact CZ-CD 3.46Å; R634-E641 IonicContact CZ-OE1 3.27Å; R634-E641 IonicContact NH1-OE1 2.71Å; R634-E641 PolarHBondContact NH1-OE1 3.38Å; R634-E641 IonicContact NH1-OE2 3.19Å; R634-E641 PolarHBondContact NH1-OE2 3.03Å; R634-E641 IonicContact NH2-OE1 2.64Å; R634-E641 PolarHBondContact NH2-OE1 3.45Å; E641-E643 PolarHBondContact O-N 3.48Å; E641-E643 VanDerWaalsContact O-N 3.13Å
642	N	56.6	Low	77.6	Confident	115 Å²	115	63.3 Å²	63.3	62%	0.615	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	11.8	-173.4	-50.3	-40.6	0	0	0	115.2	K640 S1138	K640-N642 PolarHBondContact O-N 2.96Å; N642-S1138 WeakPolarHBondContact O-CB 3.37Å; N642-S1138 PolarHBondContact O-N 2.74Å; N642-S1138 PolarHBondContact O-OG 3.18Å
643	E	70.2	Confident	78.7	Confident	32 Å²	32	61.1 Å²	61.1	15%	0.15	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	136.9	158.9	-68.3	174.2	169.3	0	0	108.4	F639 K640 E641 V1135 T1136 K1137	F639-E643 HydrophobicContact CB-CB 4.09Å; F639-E643 WeakPolarHBondContact CD2-O 3.35Å; K640-E643 HydrophobicContact CB-CG 4.3Å; K640-E643 WeakPolarHBondContact CB-OE2 3.2Å; K640-E643 PolarHBondContact N-OE2 3.47Å; K640-E643 WeakPolarHBondContact O-CB 3.27Å; K640-E643 PolarHBondContact O-N 3.01Å; E641-E643 PolarHBondContact O-N 3.48Å; E641-E643 VanDerWaalsContact O-N 3.13Å; E643-V1135 HydrophobicContact CB-CG1 3.82Å; E643-V1135 HydrophobicContact CG-CG1 4.24Å; E643-T1136 WeakPolarHBondContact CA-O 3.42Å; E643-K1137 HydrophobicContact CG-CB 4.46Å; E643-K1137 HydrophobicContact CG-CG 3.65Å; E643-K1137 WeakPolarHBondContact OE1-CE 3.22Å; E643-K1137 VanDerWaalsContact OE1-CG 3.31Å; E643-K1137 WeakPolarHBondContact OE1-CG 3.16Å
644	G	80	Confident	79.8	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.01	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.7	174.3	0	0	0	0	0	110.3	L626 Q646 T1136	L626-G644 CarbonylContact O-C 3.54Å; L626-G644 WeakPolarHBondContact O-CA 3.45Å; G644-Q646 PolarHBondContact O-N 2.9Å; G644-Q646 VanDerWaalsContact O-N 3.12Å; G644-T1136 PolarHBondContact N-O 3.07Å; G644-T1136 PolarHBondContact O-N 3.23Å; G644-T1136 PolarHBondContact O-OG1 3.33Å
645	L	87.9	Confident	81	Confident	0 Å²	0	60 Å²	60	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	101.9	172.8	-175.1	76.1	0	0	0	108.1	Q625 L626 F639 M663 H668 I669 F1133 V1135	Q625-L645 WeakPolarHBondContact CA-O 3.48Å; L626-L645 HydrophobicContact CB-CB 4.26Å; L626-L645 HydrophobicContact CD2-CD2 4.11Å; L626-L645 PolarHBondContact N-O 2.87Å; L626-L645 PolarHBondContact O-N 3.24Å; F639-L645 HydrophobicContact CD1-CB 4.04Å; F639-L645 HydrophobicContact CE1-CB 3.8Å; F639-L645 HydrophobicContact CE1-CD2 4.48Å; F639-L645 HydrophobicContact CZ-CB 4.29Å; L645-M663 HydrophobicContact CD2-CE 4.32Å; L645-M663 HydrophobicContact CD2-CG 4.13Å; L645-M663 HydrophobicContact CD2-SD 4.31Å; L645-H668 HydrophobicContact CD1-CB 4Å; L645-H668 HydrophobicContact CD2-CB 3.75Å; L645-I669 HydrophobicContact CD2-CD1 4.41Å; L645-I669 HydrophobicContact CD2-CG1 4.5Å; L645-F1133 HydrophobicContact CD1-CB 4.12Å; L645-F1133 HydrophobicContact CD2-CD1 4.37Å; L645-V1135 HydrophobicContact CD1-CG2 4.02Å
646	Q	90.4	Very high	82.1	Confident	26 Å²	26	51.9 Å²	51.9	12%	0.121	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	140.1	172.6	-178.2	170.1	-19.1	0	0	109.4	K609 M624 Q625 G644 F1133 Q1134 T1136	K609-Q646 VanDerWaalsContact CE-OE1 3.28Å; M624-Q646 WeakPolarHBondContact O-CA 3.49Å; M624-Q646 WeakPolarHBondContact O-CG 3.47Å; Q625-Q646 HydrophobicContact CG-CB 4.42Å; G644-Q646 PolarHBondContact O-N 2.9Å; G644-Q646 VanDerWaalsContact O-N 3.12Å; Q646-F1133 WeakPolarHBondContact O-CA 3.2Å; Q646-Q1134 WeakPolarHBondContact CB-O 3.46Å; Q646-Q1134 PolarHBondContact N-O 2.95Å; Q646-Q1134 PolarHBondContact O-N 3.31Å; Q646-T1136 HydrophobicContact CB-CG2 4.02Å; Q646-T1136 VanDerWaalsContact OE1-CG2 3.27Å
647	F	93.5	Very high	83	Confident	2 Å²	2	52.4 Å²	52.4	1%	0.009	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	148.5	177.7	59.2	-76.8	0	0	0	108.6	M624 L626 F649 V659 M663 I681 R1132 F1133	M624-F647 HydrophobicContact CB-CD1 4.23Å; M624-F647 HydrophobicContact CB-CD2 4.11Å; M624-F647 HydrophobicContact CB-CE1 3.71Å; M624-F647 HydrophobicContact CB-CE2 3.59Å; M624-F647 HydrophobicContact CB-CG 4.4Å; M624-F647 HydrophobicContact CB-CZ 3.36Å; M624-F647 HydrophobicContact CG-CE2 4.04Å; M624-F647 HydrophobicContact CG-CZ 4.16Å; M624-F647 PolarHBondContact N-O 2.9Å; M624-F647 PolarHBondContact O-N 3.45Å; M624-F647 VanDerWaalsContact O-O 3.04Å; M624-F647 HydrophobicContact SD-CE2 3.64Å; M624-F647 HydrophobicContact SD-CZ 3.86Å; L626-F647 HydrophobicContact CB-CE1 4.23Å; F647-F649 HydrophobicContact CE2-CD2 4.46Å; F647-V659 HydrophobicContact CD2-CG1 3.89Å; F647-V659 HydrophobicContact CE2-CG1 3.99Å; F647-M663 HydrophobicContact CB-CE 4.43Å; F647-M663 HydrophobicContact CD1-CE 3.38Å; F647-M663 HydrophobicContact CD2-CE 3.64Å; F647-M663 HydrophobicContact CE1-CE 3.36Å; F647-M663 HydrophobicContact CE2-CE 3.59Å; F647-M663 HydrophobicContact CG-CE 3.55Å; F647-M663 HydrophobicContact CZ-CE 3.46Å; F647-M663 VanDerWaalsContact CZ-CE 3.46Å; F647-I681 HydrophobicContact CE2-CD1 3.87Å; F647-I681 HydrophobicContact CE2-CG1 4.39Å; F647-I681 HydrophobicContact CZ-CD1 3.59Å; F647-I681 HydrophobicContact CZ-CG1 3.9Å; F647-R1132 WeakPolarHBondContact CA-O 3.14Å; F647-F1133 HydrophobicContact CB-CD1 3.56Å; F647-F1133 HydrophobicContact CB-CE1 3.71Å; F647-F1133 HydrophobicContact CG-CD1 4.3Å; F647-F1133 HydrophobicContact CG-CE1 4.16Å
648	A	93.1	Very high	83.7	Confident	11 Å²	11	57.2 Å²	57.2	9%	0.091	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	153.3	168.7	0	0	0	0	0	110.2	E621 I622 Q623 R1132	E621-A648 HydrophobicContact CG-CB 3.77Å; E621-A648 WeakPolarHBondContact OE1-CB 3.47Å; I622-A648 CarbonylContact O-C 3.55Å; I622-A648 WeakPolarHBondContact O-CA 3.42Å; Q623-A648 HydrophobicContact CG-CB 4.49Å; A648-R1132 HydrophobicContact CB-CG 4.1Å; A648-R1132 WeakPolarHBondContact O-CD 3.45Å; A648-R1132 VanDerWaalsContact O-CZ 3.29Å; A648-R1132 PolarHBondContact O-NE 3.21Å; A648-R1132 VanDerWaalsContact O-NE 3.14Å
649	F	95.3	Very high	84.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	123.3	179.1	-170.1	-76.9	0	0	0	108.5	E621 I622 M624 F647 D654 P656 V659 I681 V685	E621-F649 WeakPolarHBondContact CA-O 3.49Å; I622-F649 HydrophobicContact CG1-CB 4.26Å; I622-F649 VanDerWaalsContact CG1-O 3.25Å; I622-F649 WeakPolarHBondContact CG1-O 3.38Å; I622-F649 PolarHBondContact N-O 3.03Å; I622-F649 PolarHBondContact O-N 3.23Å; M624-F649 HydrophobicContact CG-CB 4.03Å; M624-F649 HydrophobicContact SD-CB 3.64Å; M624-F649 HydrophobicContact SD-CD2 4.2Å; M624-F649 HydrophobicContact SD-CG 3.93Å; F647-F649 HydrophobicContact CE2-CD2 4.46Å; F649-D654 HydrophobicContact CD1-CB 4.28Å; F649-D654 HydrophobicContact CD2-CB 4.12Å; F649-D654 HydrophobicContact CE1-CB 3.9Å; F649-D654 HydrophobicContact CE2-CB 3.74Å; F649-D654 HydrophobicContact CG-CB 4.37Å; F649-D654 HydrophobicContact CZ-CB 3.61Å; F649-D654 WeakPolarHBondContact CZ-O 3.33Å; F649-P656 HydrophobicContact CE2-CG 4.38Å; F649-P656 HydrophobicContact CZ-CG 4.06Å; F649-V659 HydrophobicContact CD2-CB 4.3Å; F649-V659 HydrophobicContact CD2-CG1 4.25Å; F649-V659 HydrophobicContact CD2-CG2 3.88Å; F649-V659 HydrophobicContact CE2-CB 4.2Å; F649-V659 HydrophobicContact CE2-CG2 3.81Å; F649-I681 HydrophobicContact CD2-CG2 4Å; F649-I681 HydrophobicContact CE2-CG2 3.82Å; F649-V685 HydrophobicContact CD1-CG2 3.7Å; F649-V685 HydrophobicContact CE1-CB 4.39Å; F649-V685 HydrophobicContact CE1-CG1 3.92Å; F649-V685 HydrophobicContact CE1-CG2 3.57Å; F649-V685 HydrophobicContact CE2-CG2 4.49Å; F649-V685 HydrophobicContact CG-CG2 4.24Å; F649-V685 HydrophobicContact CZ-CG2 4Å
650	D	93.5	Very high	85.7	Confident	30 Å²	30	48.5 Å²	48.5	16%	0.16	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	116.2	174.6	-176.6	-45.1	0	0	0	108.7	V620 E652 N653 D654	V620-D650 WeakPolarHBondContact CG1-OD1 3.45Å; D650-E652 PolarHBondContact O-N 3.38Å; D650-E652 PolarHBondContact OD1-N 2.93Å; D650-N653 HydrophobicContact CB-CB 4.26Å; D650-N653 VanDerWaalsContact CG-ND2 3.27Å; D650-N653 PolarHBondContact OD1-N 3.47Å; D650-N653 PolarHBondContact OD1-ND2 3.1Å; D650-N653 VanDerWaalsContact OD1-ND2 3.17Å; D650-N653 PolarHBondContact OD2-ND2 2.85Å; D650-D654 WeakPolarHBondContact CA-OD2 3.5Å; D650-D654 VanDerWaalsContact CB-OD2 3.25Å; D650-D654 WeakPolarHBondContact CB-OD2 3.33Å; D650-D654 PolarHBondContact N-OD2 2.87Å; D650-D654 WeakPolarHBondContact O-CB 3.34Å; D650-D654 PolarHBondContact O-N 3.18Å
651	I	91.1	Very high	87.1	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-19.9	-173.7	-68.3	159.1	0	0	0	112.8	V620 I622 F688 R689	V620-I651 WeakPolarHBondContact O-CB 3.41Å; V620-I651 WeakPolarHBondContact O-CD1 3.46Å; V620-I651 WeakPolarHBondContact O-CG1 3.41Å; V620-I651 PolarHBondContact O-N 3.16Å; I622-I651 HydrophobicContact CB-CD1 4.47Å; I622-I651 HydrophobicContact CD1-CD1 4.15Å; I622-I651 HydrophobicContact CD1-CG1 4.05Å; I622-I651 HydrophobicContact CG1-CD1 4.08Å; I622-I651 HydrophobicContact CG1-CG1 4.01Å; I622-I651 HydrophobicContact CG2-CD1 3.62Å; I622-I651 HydrophobicContact CG2-CG1 4.47Å; I651-F688 HydrophobicContact CD1-CD1 3.36Å; I651-F688 HydrophobicContact CD1-CE1 3.39Å; I651-F688 HydrophobicContact CD1-CG 4.48Å; I651-F688 HydrophobicContact CG1-CD1 4.39Å; I651-R689 HydrophobicContact CG2-CG 3.46Å; I651-R689 VanDerWaalsContact CG2-CG 3.46Å; I651-R689 PolarHBondContact O-NE 3.5Å; I651-R689 PolarHBondContact O-NH2 3.04Å
652	E	90.5	Very high	88.9	Confident	111 Å²	111	44.3 Å²	44.3	52%	0.519	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-32.5	-173.9	-70.3	171.8	-166.5	0	0	112.2	V620 D650 R692	V620-E652 HydrophobicContact CG1-CB 3.97Å; V620-E652 HydrophobicContact CG1-CG 3.99Å; D650-E652 PolarHBondContact O-N 3.38Å; D650-E652 PolarHBondContact OD1-N 2.93Å; E652-R692 IonicContact OE1-CZ 3.35Å; E652-R692 IonicContact OE1-NH1 2.61Å; E652-R692 PolarHBondContact OE1-NH1 3.32Å; E652-R692 IonicContact OE1-NH2 2.76Å; E652-R692 PolarHBondContact OE1-NH2 2.88Å
653	N	92	Very high	90.5	Very high	127 Å²	127	38.9 Å²	38.9	68%	0.679	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.9	-25.5	-175.5	-59.4	-68.8	0	0	0	115.1	D650	D650-N653 HydrophobicContact CB-CB 4.26Å; D650-N653 VanDerWaalsContact CG-ND2 3.27Å; D650-N653 PolarHBondContact OD1-N 3.47Å; D650-N653 PolarHBondContact OD1-ND2 3.1Å; D650-N653 VanDerWaalsContact OD1-ND2 3.17Å; D650-N653 PolarHBondContact OD2-ND2 2.85Å
654	D	93.8	Very high	91.3	Very high	28 Å²	28	38.3 Å²	38.3	15%	0.15	20%	0.197	C	C	.	.			trans	-90	140.5	-177.7	-72.8	-58.5	0	0	0	113.6	F649 D650 V659 R1132	F649-D654 HydrophobicContact CD1-CB 4.28Å; F649-D654 HydrophobicContact CD2-CB 4.12Å; F649-D654 HydrophobicContact CE1-CB 3.9Å; F649-D654 HydrophobicContact CE2-CB 3.74Å; F649-D654 HydrophobicContact CG-CB 4.37Å; F649-D654 HydrophobicContact CZ-CB 3.61Å; F649-D654 WeakPolarHBondContact CZ-O 3.33Å; D650-D654 WeakPolarHBondContact CA-OD2 3.5Å; D650-D654 VanDerWaalsContact CB-OD2 3.25Å; D650-D654 WeakPolarHBondContact CB-OD2 3.33Å; D650-D654 PolarHBondContact N-OD2 2.87Å; D650-D654 WeakPolarHBondContact O-CB 3.34Å; D650-D654 PolarHBondContact O-N 3.18Å; D654-V659 HydrophobicContact CB-CG2 3.9Å; D654-R1132 IonicContact OD1-NH1 3.45Å; D654-R1132 PolarHBondContact OD1-NH1 2.86Å; D654-R1132 IonicContact OD2-CZ 3.33Å; D654-R1132 IonicContact OD2-NH1 3.17Å; D654-R1132 PolarHBondContact OD2-NH1 2.85Å; D654-R1132 IonicContact OD2-NH2 2.68Å; D654-R1132 PolarHBondContact OD2-NH2 2.9Å
655	S	93.5	Very high	91.6	Very high	38 Å²	38	45.5 Å²	45.5	27%	0.266	23%	0.23	S	C	.	.			trans	-91.3	133.2	163.8	177.6	0	0	0	0	111.1	D657 E658 V659	S655-D657 PolarHBondContact O-N 3.2Å; S655-D657 PolarHBondContact OG-N 3.35Å; S655-E658 PolarHBondContact O-N 2.93Å; S655-V659 PolarHBondContact O-N 3.42Å
656	P	92.4	Very high	91.5	Very high	20 Å²	20	49 Å²	49	13%	0.13	25%	0.247	C	C	.	.	H	α-helix	trans	-54.3	-38.1	173.2	-27.2	36.3	0	0	0	113.4	F649 V660 T678 I681 K682	F649-P656 HydrophobicContact CE2-CG 4.38Å; F649-P656 HydrophobicContact CZ-CG 4.06Å; P656-V660 WeakPolarHBondContact O-CG2 3.45Å; P656-V660 PolarHBondContact O-N 3.5Å; P656-V660 VanDerWaalsContact O-N 3.07Å; P656-T678 HydrophobicContact CB-CG2 4.07Å; P656-I681 HydrophobicContact CB-CB 4.46Å; P656-I681 HydrophobicContact CB-CG2 4.02Å; P656-I681 HydrophobicContact CG-CG2 4.44Å; P656-K682 HydrophobicContact CB-CB 4.23Å; P656-K682 HydrophobicContact CG-CB 4.02Å; P656-K682 HydrophobicContact CG-CG 4.47Å
657	D	92.6	Very high	90.8	Very high	100 Å²	100	53.2 Å²	53.2	54%	0.535	27%	0.266	S	S	.	.	H	α-helix	trans	-66.4	-42.4	178.7	-68.3	-94.9	0	0	0	111.9	S655 V660 Q661 T678	S655-D657 PolarHBondContact O-N 3.2Å; S655-D657 PolarHBondContact OG-N 3.35Å; D657-V660 PolarHBondContact O-N 3.25Å; D657-Q661 WeakPolarHBondContact O-CB 3.47Å; D657-Q661 PolarHBondContact O-N 2.88Å; D657-T678 HydrophobicContact CB-CG2 4.34Å; D657-T678 VanDerWaalsContact CG-CG2 3.45Å; D657-T678 WeakPolarHBondContact OD1-CG2 3.45Å; D657-T678 WeakPolarHBondContact OD2-CG2 3.44Å
658	E	93	Very high	90	Very high	116 Å²	116	54.6 Å²	54.6	54%	0.542	27%	0.272	S	S	.	.	H	α-helix	trans	-68.6	-41.2	178.5	-68.1	176.3	-163.4	0	0	112.1	S655 V660 Q661 Q662	S655-E658 PolarHBondContact O-N 2.93Å; E658-V660 VanDerWaalsContact C-N 3.34Å; E658-V660 PolarHBondContact O-N 2.92Å; E658-Q661 PolarHBondContact O-N 2.89Å; E658-Q662 WeakPolarHBondContact O-CG 3.39Å; E658-Q662 PolarHBondContact O-N 3.5Å
659	V	93.5	Very high	89.6	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-64.1	-40.5	176.9	170.4	0	0	0	0	110.8	F647 F649 D654 S655 Q662 M663 F1133	F647-V659 HydrophobicContact CD2-CG1 3.89Å; F647-V659 HydrophobicContact CE2-CG1 3.99Å; F649-V659 HydrophobicContact CD2-CB 4.3Å; F649-V659 HydrophobicContact CD2-CG1 4.25Å; F649-V659 HydrophobicContact CD2-CG2 3.88Å; F649-V659 HydrophobicContact CE2-CB 4.2Å; F649-V659 HydrophobicContact CE2-CG2 3.81Å; D654-V659 HydrophobicContact CB-CG2 3.9Å; S655-V659 PolarHBondContact O-N 3.42Å; V659-Q662 PolarHBondContact O-N 2.78Å; V659-M663 HydrophobicContact CG1-CE 3.97Å; V659-M663 WeakPolarHBondContact O-CG 3.42Å; V659-M663 PolarHBondContact O-N 3.27Å; V659-M663 VanDerWaalsContact O-N 3.11Å; V659-F1133 HydrophobicContact CG1-CE1 4.28Å; V659-F1133 HydrophobicContact CG1-CZ 4.31Å
660	V	92	Very high	88.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-70.3	-36.7	174	176.4	0	0	0	0	111.8	P656 D657 E658 Q662 M663 I664 T674 I677 I681	P656-V660 WeakPolarHBondContact O-CG2 3.45Å; P656-V660 PolarHBondContact O-N 3.5Å; P656-V660 VanDerWaalsContact O-N 3.07Å; D657-V660 PolarHBondContact O-N 3.25Å; E658-V660 VanDerWaalsContact C-N 3.34Å; E658-V660 PolarHBondContact O-N 2.92Å; V660-Q662 VanDerWaalsContact C-N 3.28Å; V660-Q662 PolarHBondContact O-N 3.21Å; V660-M663 HydrophobicContact CG2-SD 4.13Å; V660-M663 WeakPolarHBondContact O-CA 3.37Å; V660-M663 WeakPolarHBondContact O-CB 3.37Å; V660-M663 PolarHBondContact O-N 3.19Å; V660-I664 HydrophobicContact CG1-CD1 4.07Å; V660-I664 HydrophobicContact CG1-CG1 4.48Å; V660-I664 WeakPolarHBondContact O-CG1 3.25Å; V660-I664 PolarHBondContact O-N 3.03Å; V660-T674 HydrophobicContact CG1-CG2 3.98Å; V660-I677 HydrophobicContact CG2-CG2 3.98Å; V660-I681 HydrophobicContact CG2-CD1 3.62Å
661	Q	91.5	Very high	88.3	Confident	107 Å²	107	59.5 Å²	59.5	50%	0.5	30%	0.298	S	S	.	.	H	α-helix	trans	-62	-36.6	175.2	-169.8	55.4	74.1	0	0	112.1	D657 E658 I664 E665	D657-Q661 WeakPolarHBondContact O-CB 3.47Å; D657-Q661 PolarHBondContact O-N 2.88Å; E658-Q661 PolarHBondContact O-N 2.89Å; Q661-I664 PolarHBondContact O-N 2.99Å; Q661-E665 WeakPolarHBondContact O-CB 3.43Å; Q661-E665 PolarHBondContact O-N 2.99Å
662	Q	90.8	Very high	87.9	Confident	66 Å²	66	66.1 Å²	66.1	31%	0.308	33%	0.329	S	S	.	.	H	α-helix	trans	-67.2	-36.1	171	-68.9	170.8	48.3	0	0	112.8	E658 V659 V660 I664 E665 Q666 F1133	E658-Q662 WeakPolarHBondContact O-CG 3.39Å; E658-Q662 PolarHBondContact O-N 3.5Å; V659-Q662 PolarHBondContact O-N 2.78Å; V660-Q662 VanDerWaalsContact C-N 3.28Å; V660-Q662 PolarHBondContact O-N 3.21Å; Q662-I664 VanDerWaalsContact C-N 3.32Å; Q662-I664 PolarHBondContact O-N 3.18Å; Q662-E665 PolarHBondContact O-N 3.35Å; Q662-Q666 WeakPolarHBondContact O-CB 3.46Å; Q662-Q666 WeakPolarHBondContact O-CG 3.31Å; Q662-Q666 PolarHBondContact O-N 2.72Å; Q662-F1133 HydrophobicContact CB-CE2 3.84Å; Q662-F1133 HydrophobicContact CB-CZ 3.9Å
663	M	89.2	Confident	87.4	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-64.1	-36.1	173.4	-65.7	167.1	171.7	0	0	112.2	L645 F647 V659 V660 Q667 H668 I669 I681 F1133	L645-M663 HydrophobicContact CD2-CE 4.32Å; L645-M663 HydrophobicContact CD2-CG 4.13Å; L645-M663 HydrophobicContact CD2-SD 4.31Å; F647-M663 HydrophobicContact CB-CE 4.43Å; F647-M663 HydrophobicContact CD1-CE 3.38Å; F647-M663 HydrophobicContact CD2-CE 3.64Å; F647-M663 HydrophobicContact CE1-CE 3.36Å; F647-M663 HydrophobicContact CE2-CE 3.59Å; F647-M663 HydrophobicContact CG-CE 3.55Å; F647-M663 HydrophobicContact CZ-CE 3.46Å; F647-M663 VanDerWaalsContact CZ-CE 3.46Å; V659-M663 HydrophobicContact CG1-CE 3.97Å; V659-M663 WeakPolarHBondContact O-CG 3.42Å; V659-M663 PolarHBondContact O-N 3.27Å; V659-M663 VanDerWaalsContact O-N 3.11Å; V660-M663 HydrophobicContact CG2-SD 4.13Å; V660-M663 WeakPolarHBondContact O-CA 3.37Å; V660-M663 WeakPolarHBondContact O-CB 3.37Å; V660-M663 PolarHBondContact O-N 3.19Å; M663-Q667 PolarHBondContact O-N 2.85Å; M663-H668 PolarHBondContact O-N 3.11Å; M663-I669 HydrophobicContact CB-CD1 3.56Å; M663-I669 HydrophobicContact CB-CG1 4.04Å; M663-I669 HydrophobicContact CG-CD1 3.96Å; M663-I669 HydrophobicContact SD-CD1 3.32Å; M663-I669 WeakPolarHBondContact SD-CD1 3.19Å; M663-I681 HydrophobicContact CE-CD1 3.87Å; M663-I681 HydrophobicContact SD-CD1 4.31Å; M663-F1133 HydrophobicContact CB-CE1 4.48Å; M663-F1133 HydrophobicContact CE-CD1 4.22Å; M663-F1133 HydrophobicContact CE-CE1 3.65Å; M663-F1133 HydrophobicContact CG-CD1 3.8Å; M663-F1133 HydrophobicContact CG-CE1 3.26Å; M663-F1133 HydrophobicContact CG-CZ 3.84Å; M663-F1133 HydrophobicContact SD-CE1 4.29Å
664	I	87.4	Confident	87.2	Confident	21 Å²	21	57 Å²	57	11%	0.108	29%	0.285	C	S	.	.	H	α-helix	trans	-71	-46.8	175.8	-66.4	162.1	0	0	0	110.7	V660 Q661 Q662 Q666 Q667 D671 T674	V660-I664 HydrophobicContact CG1-CD1 4.07Å; V660-I664 HydrophobicContact CG1-CG1 4.48Å; V660-I664 WeakPolarHBondContact O-CG1 3.25Å; V660-I664 PolarHBondContact O-N 3.03Å; Q661-I664 PolarHBondContact O-N 2.99Å; Q662-I664 VanDerWaalsContact C-N 3.32Å; Q662-I664 PolarHBondContact O-N 3.18Å; I664-Q666 VanDerWaalsContact C-N 3.27Å; I664-Q666 PolarHBondContact O-N 3.31Å; I664-Q667 VanDerWaalsContact O-CA 3.27Å; I664-Q667 WeakPolarHBondContact O-CA 3.43Å; I664-Q667 PolarHBondContact O-N 2.82Å; I664-D671 WeakPolarHBondContact CG2-OD1 3.45Å; I664-T674 HydrophobicContact CD1-CG2 3.65Å; I664-T674 WeakPolarHBondContact CD1-OG1 3.45Å
665	E	87.5	Confident	86.8	Confident	152 Å²	152	65.2 Å²	65.2	71%	0.71	31%	0.314	S	S	*	.	H	α-helix	trans	-59.4	-39.2	178.5	-174.4	176.6	-153.5	0	0	111.7	Q661 Q662 Q667	Q661-E665 WeakPolarHBondContact O-CB 3.43Å; Q661-E665 PolarHBondContact O-N 2.99Å; Q662-E665 PolarHBondContact O-N 3.35Å; E665-Q667 PolarHBondContact O-N 2.99Å
666	Q	84.4	Confident	86.3	Confident	74 Å²	74	66.8 Å²	66.8	35%	0.346	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	9.1	173.6	-64	177.1	55.2	0	0	113.3	Q662 I664 H668 S1131	Q662-Q666 WeakPolarHBondContact O-CB 3.46Å; Q662-Q666 WeakPolarHBondContact O-CG 3.31Å; Q662-Q666 PolarHBondContact O-N 2.72Å; I664-Q666 VanDerWaalsContact C-N 3.27Å; I664-Q666 PolarHBondContact O-N 3.31Å; Q666-H668 PolarHBondContact O-N 3.12Å; Q666-H668 VanDerWaalsContact O-N 3.15Å; Q666-S1131 PolarHBondContact OE1-OG 3.32Å
667	Q	76.8	Confident	86	Confident	113 Å²	113	65.8 Å²	65.8	53%	0.528	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	24.3	179	-57.8	-169.2	-1	0	0	115.4	R638 M663 I664 E665 I669	R638-Q667 WeakPolarHBondContact CG-O 3.42Å; M663-Q667 PolarHBondContact O-N 2.85Å; I664-Q667 VanDerWaalsContact O-CA 3.27Å; I664-Q667 WeakPolarHBondContact O-CA 3.43Å; I664-Q667 PolarHBondContact O-N 2.82Å; E665-Q667 PolarHBondContact O-N 2.99Å; Q667-I669 VanDerWaalsContact C-N 3.28Å; Q667-I669 PolarHBondContact O-N 3.46Å
668	H	76.9	Confident	85.9	Confident	31 Å²	31	61.7 Å²	61.7	14%	0.144	29%	0.29	C	S	.	.	S	Bend	trans	-73.2	-22	178	-68.5	-54.4	0	0	0	113.1	L645 M663 Q666	L645-H668 HydrophobicContact CD1-CB 4Å; L645-H668 HydrophobicContact CD2-CB 3.75Å; M663-H668 PolarHBondContact O-N 3.11Å; Q666-H668 PolarHBondContact O-N 3.12Å; Q666-H668 VanDerWaalsContact O-N 3.15Å
669	I	83.2	Confident	85.6	Confident	7 Å²	7	59.7 Å²	59.7	4%	0.036	28%	0.28	C	S	.	.	S	Bend	trans	-138.3	142.4	-169	-62.1	-178.1	0	0	0	110.1	L626 Y637 L645 M663 Q667 I677	L626-I669 HydrophobicContact CD2-CD1 3.48Å; L626-I669 VanDerWaalsContact CD2-CD1 3.48Å; L626-I669 HydrophobicContact CD2-CG1 3.99Å; Y637-I669 HydrophobicContact CD1-CG1 4.39Å; Y637-I669 HydrophobicContact CE1-CB 4.34Å; Y637-I669 HydrophobicContact CE1-CG1 4.14Å; Y637-I669 HydrophobicContact CE1-CG2 4.11Å; L645-I669 HydrophobicContact CD2-CD1 4.41Å; L645-I669 HydrophobicContact CD2-CG1 4.5Å; M663-I669 HydrophobicContact CB-CD1 3.56Å; M663-I669 HydrophobicContact CB-CG1 4.04Å; M663-I669 HydrophobicContact CG-CD1 3.96Å; M663-I669 HydrophobicContact SD-CD1 3.32Å; M663-I669 WeakPolarHBondContact SD-CD1 3.19Å; Q667-I669 VanDerWaalsContact C-N 3.28Å; Q667-I669 PolarHBondContact O-N 3.46Å; I669-I677 HydrophobicContact CD1-CD1 3.9Å; I669-I677 HydrophobicContact CD1-CG2 4.11Å; I669-I677 HydrophobicContact CG1-CD1 4.44Å; I669-I677 HydrophobicContact CG2-CD1 3.71Å
670	P	81.2	Confident	85.3	Confident	21 Å²	21	60.5 Å²	60.5	14%	0.136	28%	0.284	C	S	.	.			trans	-82.4	143.4	172.8	33.8	-35.4	0	0	0	113.3	Q636 Y637 E672 D673	Q636-P670 HydrophobicContact CB-CB 4.17Å; Q636-P670 HydrophobicContact CB-CG 3.93Å; Y637-P670 HydrophobicContact CD2-CG 4.3Å; Y637-P670 HydrophobicContact CE1-CG 4.48Å; Y637-P670 HydrophobicContact CE2-CG 3.81Å; P670-E672 PolarHBondContact O-N 2.92Å; P670-D673 PolarHBondContact O-N 3.26Å; P670-D673 VanDerWaalsContact O-N 3.11Å
671	D	81.7	Confident	85.2	Confident	117 Å²	117	60.5 Å²	60.5	63%	0.626	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-24.2	-176.2	-53.3	-37.9	0	0	0	115.2	I664 D673 T674	I664-D671 WeakPolarHBondContact CG2-OD1 3.45Å; D671-D673 VanDerWaalsContact C-N 3.32Å; D671-D673 PolarHBondContact O-N 3.49Å; D671-T674 WeakPolarHBondContact CA-OG1 3.16Å; D671-T674 PolarHBondContact O-OG1 3.35Å
672	E	81	Confident	85.2	Confident	139 Å²	139	60.5 Å²	60.5	65%	0.65	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-35.7	179.8	-61.6	-177	153.7	0	0	112.3	Q636 P670	Q636-E672 PolarHBondContact NE2-OE2 3.02Å; P670-E672 PolarHBondContact O-N 2.92Å
673	D	81.8	Confident	84.9	Confident	14 Å²	14	61 Å²	61	8%	0.075	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-5.3	-174.4	-85.1	-39.4	0	0	0	113.7	I604 K633 Y637 P670 D671 R675 M676 I677	I604-D673 HydrophobicContact CD1-CB 4.05Å; I604-D673 VanDerWaalsContact CD1-CG 3.46Å; I604-D673 WeakPolarHBondContact CD1-OD2 3.49Å; K633-D673 VanDerWaalsContact NZ-CG 3.35Å; K633-D673 IonicContact NZ-OD1 2.64Å; K633-D673 PolarHBondContact NZ-OD1 2.89Å; K633-D673 IonicContact NZ-OD2 2.72Å; K633-D673 PolarHBondContact NZ-OD2 3.39Å; Y637-D673 WeakPolarHBondContact OH-CB 3.26Å; Y637-D673 VanDerWaalsContact OH-CG 3.26Å; Y637-D673 PolarHBondContact OH-OD2 2.71Å; P670-D673 PolarHBondContact O-N 3.26Å; P670-D673 VanDerWaalsContact O-N 3.11Å; D671-D673 VanDerWaalsContact C-N 3.32Å; D671-D673 PolarHBondContact O-N 3.49Å; D673-R675 PolarHBondContact O-N 2.9Å; D673-M676 WeakPolarHBondContact O-CA 3.14Å; D673-M676 VanDerWaalsContact O-CB 3.31Å; D673-M676 WeakPolarHBondContact O-CB 3.4Å; D673-M676 PolarHBondContact O-N 3.48Å; D673-I677 HydrophobicContact CB-CD1 4.15Å; D673-I677 PolarHBondContact O-N 2.88Å
674	T	86.5	Confident	84.8	Confident	32 Å²	32	63.5 Å²	63.5	20%	0.196	30%	0.298	C	S	.	.	H	α-helix	trans	-42.6	-59.2	-179.1	-59.9	0	0	0	0	113.4	V660 I664 D671 M676 I677 T678	V660-T674 HydrophobicContact CG1-CG2 3.98Å; I664-T674 HydrophobicContact CD1-CG2 3.65Å; I664-T674 WeakPolarHBondContact CD1-OG1 3.45Å; D671-T674 WeakPolarHBondContact CA-OG1 3.16Å; D671-T674 PolarHBondContact O-OG1 3.35Å; T674-M676 PolarHBondContact O-N 3.12Å; T674-M676 VanDerWaalsContact O-N 3.17Å; T674-I677 PolarHBondContact O-N 3.17Å; T674-I677 VanDerWaalsContact O-N 3.08Å; T674-T678 PolarHBondContact O-N 2.99Å; T674-T678 PolarHBondContact O-OG1 3.2Å; T674-T678 VanDerWaalsContact O-OG1 3.1Å
675	R	84.8	Confident	85	Confident	200 Å²	200	62.6 Å²	62.6	76%	0.755	29%	0.294	S	S	*	.	H	α-helix	trans	-59.8	-30.6	-178.4	-67.6	-175.6	-62.8	-80.9	-8.3	113.2	D673 K679	D673-R675 PolarHBondContact O-N 2.9Å; R675-K679 WeakPolarHBondContact O-CB 3.3Å; R675-K679 PolarHBondContact O-N 3.33Å
676	M	83.3	Confident	85	Confident	71 Å²	71	57.8 Å²	57.8	35%	0.35	27%	0.273	S	S	.	.	H	α-helix	trans	-75.2	-40.7	178	-174.8	64.1	73.7	0	0	110.9	I602 D673 T674 K679 L680	I602-M676 HydrophobicContact CD1-SD 4.2Å; I602-M676 HydrophobicContact CG1-SD 4.28Å; I602-M676 HydrophobicContact CG2-CE 4.17Å; I602-M676 HydrophobicContact CG2-CG 3.36Å; I602-M676 HydrophobicContact CG2-SD 3.58Å; I602-M676 VanDerWaalsContact CG2-SD 3.58Å; D673-M676 WeakPolarHBondContact O-CA 3.14Å; D673-M676 VanDerWaalsContact O-CB 3.31Å; D673-M676 WeakPolarHBondContact O-CB 3.4Å; D673-M676 PolarHBondContact O-N 3.48Å; T674-M676 PolarHBondContact O-N 3.12Å; T674-M676 VanDerWaalsContact O-N 3.17Å; M676-K679 PolarHBondContact O-N 3.46Å; M676-L680 HydrophobicContact CG-CD1 4.43Å; M676-L680 WeakPolarHBondContact O-CG 3.4Å; M676-L680 PolarHBondContact O-N 3.14Å
677	I	87.3	Confident	84.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-77.8	-39	-177.2	-64.2	175.1	0	0	0	111.5	I604 L626 Y637 V660 I669 D673 T674 K679 L680 I681	I604-I677 HydrophobicContact CD1-CD1 4.33Å; I604-I677 HydrophobicContact CD1-CG1 4.38Å; I604-I677 HydrophobicContact CG2-CD1 4.06Å; I604-I677 HydrophobicContact CG2-CG1 4.02Å; L626-I677 HydrophobicContact CD1-CD1 4.12Å; L626-I677 HydrophobicContact CD1-CG1 4.24Å; L626-I677 HydrophobicContact CD1-CG2 4.01Å; L626-I677 HydrophobicContact CD2-CD1 4.13Å; L626-I677 HydrophobicContact CD2-CG2 4.41Å; Y637-I677 HydrophobicContact CE1-CD1 4.09Å; V660-I677 HydrophobicContact CG2-CG2 3.98Å; I669-I677 HydrophobicContact CD1-CD1 3.9Å; I669-I677 HydrophobicContact CD1-CG2 4.11Å; I669-I677 HydrophobicContact CG1-CD1 4.44Å; I669-I677 HydrophobicContact CG2-CD1 3.71Å; D673-I677 HydrophobicContact CB-CD1 4.15Å; D673-I677 PolarHBondContact O-N 2.88Å; T674-I677 PolarHBondContact O-N 3.17Å; T674-I677 VanDerWaalsContact O-N 3.08Å; I677-K679 PolarHBondContact O-N 2.85Å; I677-L680 PolarHBondContact O-N 2.97Å; I677-I681 HydrophobicContact CG2-CD1 4.04Å; I677-I681 HydrophobicContact CG2-CG1 4.45Å; I677-I681 WeakPolarHBondContact O-CG1 3.39Å; I677-I681 PolarHBondContact O-N 3.05Å
678	T	90.9	Very high	85.5	Confident	13 Å²	13	50.1 Å²	50.1	8%	0.08	24%	0.241	C	C	.	.	H	α-helix	trans	-52.6	-46.6	168.9	-59.5	0	0	0	0	110.4	P656 D657 T674 I681 K682	P656-T678 HydrophobicContact CB-CG2 4.07Å; D657-T678 HydrophobicContact CB-CG2 4.34Å; D657-T678 VanDerWaalsContact CG-CG2 3.45Å; D657-T678 WeakPolarHBondContact OD1-CG2 3.45Å; D657-T678 WeakPolarHBondContact OD2-CG2 3.44Å; T674-T678 PolarHBondContact O-N 2.99Å; T674-T678 PolarHBondContact O-OG1 3.2Å; T674-T678 VanDerWaalsContact O-OG1 3.1Å; T678-I681 PolarHBondContact O-N 3.35Å; T678-K682 WeakPolarHBondContact O-CB 3.48Å; T678-K682 PolarHBondContact O-N 3.25Å
679	K	85.8	Confident	86.1	Confident	75 Å²	75	53 Å²	53	33%	0.326	25%	0.251	S	S	.	.	H	α-helix	trans	-64.3	-48.9	177.5	-171	170.4	-166.4	167.7	0	112.5	D594 R675 M676 I677 I681 K682 D683	D594-K679 VanDerWaalsContact CG-CE 3.47Å; D594-K679 VanDerWaalsContact OD1-CE 3.31Å; D594-K679 WeakPolarHBondContact OD1-CE 3.47Å; D594-K679 IonicContact OD1-NZ 2.74Å; D594-K679 PolarHBondContact OD1-NZ 2.9Å; D594-K679 IonicContact OD2-NZ 3.24Å; D594-K679 PolarHBondContact OD2-NZ 2.86Å; R675-K679 WeakPolarHBondContact O-CB 3.3Å; R675-K679 PolarHBondContact O-N 3.33Å; M676-K679 PolarHBondContact O-N 3.46Å; I677-K679 PolarHBondContact O-N 2.85Å; K679-I681 PolarHBondContact O-N 2.96Å; K679-K682 PolarHBondContact O-N 2.99Å; K679-D683 WeakPolarHBondContact O-CB 3.3Å; K679-D683 PolarHBondContact O-N 3.23Å
680	L	86.7	Confident	86.3	Confident	18 Å²	18	57.1 Å²	57.1	9%	0.094	27%	0.266	C	S	.	.	H	α-helix	trans	-59.7	-32.1	176.6	-75.7	174.8	0	0	0	113.2	I602 I604 V606 M676 I677 K684	I602-L680 HydrophobicContact CD1-CD2 4.12Å; I602-L680 HydrophobicContact CG2-CD1 4.16Å; I604-L680 HydrophobicContact CB-CD1 4.26Å; I604-L680 HydrophobicContact CG2-CD1 4.13Å; V606-L680 HydrophobicContact CB-CB 4.21Å; V606-L680 HydrophobicContact CG2-CB 3.7Å; V606-L680 HydrophobicContact CG2-CD1 4.39Å; M676-L680 HydrophobicContact CG-CD1 4.43Å; M676-L680 WeakPolarHBondContact O-CG 3.4Å; M676-L680 PolarHBondContact O-N 3.14Å; I677-L680 PolarHBondContact O-N 2.97Å; L680-K684 WeakPolarHBondContact O-CG 3.13Å
681	I	90.8	Very high	86.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-72.3	-52.8	173.3	-69.7	173.3	0	0	0	109.6	V606 M624 F647 F649 P656 V660 M663 I677 T678 K679 D683 K684 V685	V606-I681 HydrophobicContact CG1-CG1 4.26Å; V606-I681 HydrophobicContact CG2-CG1 4.17Å; M624-I681 HydrophobicContact CE-CG2 4.29Å; M624-I681 HydrophobicContact SD-CG2 4.06Å; F647-I681 HydrophobicContact CE2-CD1 3.87Å; F647-I681 HydrophobicContact CE2-CG1 4.39Å; F647-I681 HydrophobicContact CZ-CD1 3.59Å; F647-I681 HydrophobicContact CZ-CG1 3.9Å; F649-I681 HydrophobicContact CD2-CG2 4Å; F649-I681 HydrophobicContact CE2-CG2 3.82Å; P656-I681 HydrophobicContact CB-CB 4.46Å; P656-I681 HydrophobicContact CB-CG2 4.02Å; P656-I681 HydrophobicContact CG-CG2 4.44Å; V660-I681 HydrophobicContact CG2-CD1 3.62Å; M663-I681 HydrophobicContact CE-CD1 3.87Å; M663-I681 HydrophobicContact SD-CD1 4.31Å; I677-I681 HydrophobicContact CG2-CD1 4.04Å; I677-I681 HydrophobicContact CG2-CG1 4.45Å; I677-I681 WeakPolarHBondContact O-CG1 3.39Å; I677-I681 PolarHBondContact O-N 3.05Å; T678-I681 PolarHBondContact O-N 3.35Å; K679-I681 PolarHBondContact O-N 2.96Å; I681-D683 PolarHBondContact O-N 3.25Å; I681-K684 PolarHBondContact O-N 3.34Å; I681-V685 HydrophobicContact CG2-CG2 4.22Å; I681-V685 WeakPolarHBondContact O-CG2 3.07Å; I681-V685 PolarHBondContact O-N 3.46Å
682	K	90.7	Very high	86.8	Confident	106 Å²	106	54.9 Å²	54.9	46%	0.461	25%	0.25	S	S	.	.	H	α-helix	trans	-53.5	-51.3	178.4	-176.9	175.6	179.1	178	0	112.3	P656 T678 K679 K684 V685 D686	P656-K682 HydrophobicContact CB-CB 4.23Å; P656-K682 HydrophobicContact CG-CB 4.02Å; P656-K682 HydrophobicContact CG-CG 4.47Å; T678-K682 WeakPolarHBondContact O-CB 3.48Å; T678-K682 PolarHBondContact O-N 3.25Å; K679-K682 PolarHBondContact O-N 2.99Å; K682-K684 PolarHBondContact O-N 2.84Å; K682-K684 VanDerWaalsContact O-N 3.15Å; K682-V685 PolarHBondContact O-N 2.79Å; K682-V685 VanDerWaalsContact O-N 3.12Å; K682-D686 WeakPolarHBondContact CE-OD2 3.19Å; K682-D686 WeakPolarHBondContact CG-OD2 3.15Å; K682-D686 WeakPolarHBondContact O-CB 3.4Å; K682-D686 PolarHBondContact O-N 3.14Å
683	D	84.4	Confident	87.1	Confident	77 Å²	77	52 Å²	52	41%	0.412	24%	0.24	S	C	.	.	H	α-helix	trans	-56.8	-33.2	179.1	-68.4	-8	0	0	0	112.2	K679 I681 A687	K679-D683 WeakPolarHBondContact O-CB 3.3Å; K679-D683 PolarHBondContact O-N 3.23Å; I681-D683 PolarHBondContact O-N 3.25Å; D683-A687 WeakPolarHBondContact O-CB 3.05Å; D683-A687 PolarHBondContact O-N 3.44Å; D683-A687 VanDerWaalsContact O-N 3.14Å
684	K	87.7	Confident	87.3	Confident	52 Å²	52	57.2 Å²	57.2	23%	0.226	26%	0.263	C	S	.	.	H	α-helix	trans	-81.6	-36.1	179.1	-64.4	-78.3	167.4	159.5	0	112.3	V606 M624 L680 I681 K682 F688	V606-K684 HydrophobicContact CB-CG 4.28Å; V606-K684 HydrophobicContact CG1-CG 4.16Å; V606-K684 WeakPolarHBondContact O-CD 3.5Å; V606-K684 WeakPolarHBondContact O-CE 3.21Å; V606-K684 PolarHBondContact O-NZ 2.85Å; V606-K684 VanDerWaalsContact O-NZ 3.1Å; M624-K684 HydrophobicContact CE-CB 3.66Å; L680-K684 WeakPolarHBondContact O-CG 3.13Å; I681-K684 PolarHBondContact O-N 3.34Å; K682-K684 PolarHBondContact O-N 2.84Å; K682-K684 VanDerWaalsContact O-N 3.15Å; K684-F688 WeakPolarHBondContact O-CB 3.23Å; K684-F688 PolarHBondContact O-N 3.06Å
685	V	91.7	Very high	87.3	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.018	27%	0.268	C	S	.	.	H	α-helix	trans	-68.5	-48.5	174	172.4	0	0	0	0	110.4	M624 F649 I681 K682 A687 F688 R689	M624-V685 HydrophobicContact CE-CG2 4Å; M624-V685 HydrophobicContact SD-CG2 4.22Å; F649-V685 HydrophobicContact CD1-CG2 3.7Å; F649-V685 HydrophobicContact CE1-CB 4.39Å; F649-V685 HydrophobicContact CE1-CG1 3.92Å; F649-V685 HydrophobicContact CE1-CG2 3.57Å; F649-V685 HydrophobicContact CE2-CG2 4.49Å; F649-V685 HydrophobicContact CG-CG2 4.24Å; F649-V685 HydrophobicContact CZ-CG2 4Å; I681-V685 HydrophobicContact CG2-CG2 4.22Å; I681-V685 WeakPolarHBondContact O-CG2 3.07Å; I681-V685 PolarHBondContact O-N 3.46Å; K682-V685 PolarHBondContact O-N 2.79Å; K682-V685 VanDerWaalsContact O-N 3.12Å; V685-A687 VanDerWaalsContact C-N 3.28Å; V685-A687 PolarHBondContact O-N 3.22Å; V685-F688 CarbonylContact O-C 3.49Å; V685-F688 WeakPolarHBondContact O-CA 3.16Å; V685-F688 PolarHBondContact O-N 2.86Å; V685-R689 HydrophobicContact CG1-CG 4.43Å; V685-R689 WeakPolarHBondContact O-CG 3.3Å; V685-R689 PolarHBondContact O-N 3.03Å
686	D	88.2	Confident	87.5	Confident	50 Å²	50	53.6 Å²	53.6	27%	0.267	25%	0.252	S	S	.	.	H	α-helix	trans	-67.9	-26.9	177.7	-71.1	-23.5	0	0	0	112.2	K682 R689 R690	K682-D686 WeakPolarHBondContact CE-OD2 3.19Å; K682-D686 WeakPolarHBondContact CG-OD2 3.15Å; K682-D686 WeakPolarHBondContact O-CB 3.4Å; K682-D686 PolarHBondContact O-N 3.14Å; D686-R689 IonicContact OD1-NH1 2.75Å; D686-R689 PolarHBondContact OD1-NH1 3.22Å; D686-R690 WeakPolarHBondContact O-CG 3.48Å; D686-R690 PolarHBondContact O-N 2.81Å; D686-R690 PolarHBondContact O-NE 2.87Å
687	A	82	Confident	87.8	Confident	26 Å²	26	56 Å²	56	22%	0.215	27%	0.265	C	S	.	.	H	α-helix	trans	-82.6	-7.2	168.1	0	0	0	0	0	114.2	R611 D683 V685	R611-A687 PolarHBondContact NH2-O 3.1Å; D683-A687 WeakPolarHBondContact O-CB 3.05Å; D683-A687 PolarHBondContact O-N 3.44Å; D683-A687 VanDerWaalsContact O-N 3.14Å; V685-A687 VanDerWaalsContact C-N 3.28Å; V685-A687 PolarHBondContact O-N 3.22Å
688	F	89	Confident	87.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-96.8	-43.3	171	-172.2	-85.8	0	0	0	111.1	I608 R611 D614 L615 I622 I651 K684 V685 R690 D691 R692	I608-F688 HydrophobicContact CD1-CB 3.85Å; I608-F688 HydrophobicContact CD1-CD2 3.68Å; I608-F688 HydrophobicContact CD1-CG 4.02Å; R611-F688 HydrophobicContact CG-CD2 4.06Å; R611-F688 HydrophobicContact CG-CE2 4.02Å; D614-F688 HydrophobicContact CB-CE2 4.1Å; D614-F688 HydrophobicContact CB-CZ 3.73Å; L615-F688 HydrophobicContact CB-CE2 4.07Å; L615-F688 HydrophobicContact CB-CZ 4.13Å; L615-F688 HydrophobicContact CD1-CD2 4.13Å; L615-F688 HydrophobicContact CD1-CE1 4.17Å; L615-F688 HydrophobicContact CD1-CE2 3.73Å; L615-F688 HydrophobicContact CD1-CZ 3.76Å; I622-F688 HydrophobicContact CD1-CG 4.5Å; I622-F688 HydrophobicContact CG2-CD1 4.35Å; I622-F688 HydrophobicContact CG2-CE1 3.82Å; I622-F688 HydrophobicContact CG2-CE2 4.28Å; I622-F688 HydrophobicContact CG2-CZ 3.78Å; I651-F688 HydrophobicContact CD1-CD1 3.36Å; I651-F688 HydrophobicContact CD1-CE1 3.39Å; I651-F688 HydrophobicContact CD1-CG 4.48Å; I651-F688 HydrophobicContact CG1-CD1 4.39Å; K684-F688 WeakPolarHBondContact O-CB 3.23Å; K684-F688 PolarHBondContact O-N 3.06Å; V685-F688 CarbonylContact O-C 3.49Å; V685-F688 WeakPolarHBondContact O-CA 3.16Å; V685-F688 PolarHBondContact O-N 2.86Å; F688-R690 PolarHBondContact O-N 3.47Å; F688-D691 PolarHBondContact O-N 3Å; F688-D691 VanDerWaalsContact O-N 3.17Å; F688-R692 HydrophobicContact CE1-CB 4.49Å; F688-R692 WeakPolarHBondContact O-CB 3.37Å; F688-R692 PolarHBondContact O-N 3.13Å
689	R	90.2	Very high	87.8	Confident	93 Å²	93	62.5 Å²	62.5	35%	0.351	30%	0.296	S	S	.	.	H	α-helix	trans	-48.3	-55.3	170.9	-75.5	173.9	169.4	177.2	-8.9	111.2	I651 V685 D686 D691 R692 D693	I651-R689 HydrophobicContact CG2-CG 3.46Å; I651-R689 VanDerWaalsContact CG2-CG 3.46Å; I651-R689 PolarHBondContact O-NE 3.5Å; I651-R689 PolarHBondContact O-NH2 3.04Å; V685-R689 HydrophobicContact CG1-CG 4.43Å; V685-R689 WeakPolarHBondContact O-CG 3.3Å; V685-R689 PolarHBondContact O-N 3.03Å; D686-R689 IonicContact OD1-NH1 2.75Å; D686-R689 PolarHBondContact OD1-NH1 3.22Å; R689-D691 VanDerWaalsContact C-N 3.33Å; R689-D691 PolarHBondContact O-N 2.58Å; R689-R692 WeakPolarHBondContact O-CA 3.48Å; R689-R692 WeakPolarHBondContact O-CB 3.07Å; R689-R692 PolarHBondContact O-N 3.23Å; R689-D693 PolarHBondContact O-N 3.26Å
690	R	86.5	Confident	88.1	Confident	93 Å²	93	64.8 Å²	64.8	35%	0.351	31%	0.306	S	S	.	.	H	α-helix	trans	-59.4	-37.3	179.8	-69.8	-179	-65.1	136.3	-7.7	114.3	Q565 D686 F688 H694	Q565-R690 PolarHBondContact O-NH1 2.74Å; D686-R690 WeakPolarHBondContact O-CG 3.48Å; D686-R690 PolarHBondContact O-N 2.81Å; D686-R690 PolarHBondContact O-NE 2.87Å; F688-R690 PolarHBondContact O-N 3.47Å; R690-H694 WeakPolarHBondContact O-CB 3.06Å; R690-H694 PolarHBondContact O-N 3.07Å
691	D	83.8	Confident	88.3	Confident	58 Å²	58	72.9 Å²	72.9	31%	0.31	34%	0.335	S	S	.	.	H	α-helix	trans	-72.2	-36.6	175.7	-79.9	17.1	0	0	0	111	R611 L615 F688 R689 H694 R695	R611-D691 IonicContact CZ-OD2 3.25Å; R611-D691 IonicContact NE-OD2 3.89Å; R611-D691 IonicContact NH2-OD2 3.98Å; R611-D691 PolarHBondContact NH2-OD2 3.15Å; L615-D691 HydrophobicContact CD1-CB 3.71Å; L615-D691 HydrophobicContact CD2-CB 4.01Å; L615-D691 HydrophobicContact CG-CB 4.49Å; F688-D691 PolarHBondContact O-N 3Å; F688-D691 VanDerWaalsContact O-N 3.17Å; R689-D691 VanDerWaalsContact C-N 3.33Å; R689-D691 PolarHBondContact O-N 2.58Å; D691-H694 PolarHBondContact O-N 2.62Å; D691-R695 WeakPolarHBondContact O-CB 3.46Å; D691-R695 PolarHBondContact O-N 3.23Å
692	R	89	Confident	88.3	Confident	32 Å²	32	75.7 Å²	75.7	12%	0.121	36%	0.358	C	S	.	.	H	α-helix	trans	-64.4	-44.9	176.1	-170.3	-175	76.6	158.2	2.7	110.6	L615 L618 E652 F688 R689 R695 L696	L615-R692 HydrophobicContact CD1-CB 4.17Å; L618-R692 HydrophobicContact CD2-CG 3.76Å; E652-R692 IonicContact OE1-CZ 3.35Å; E652-R692 IonicContact OE1-NH1 2.61Å; E652-R692 PolarHBondContact OE1-NH1 3.32Å; E652-R692 IonicContact OE1-NH2 2.76Å; E652-R692 PolarHBondContact OE1-NH2 2.88Å; F688-R692 HydrophobicContact CE1-CB 4.49Å; F688-R692 WeakPolarHBondContact O-CB 3.37Å; F688-R692 PolarHBondContact O-N 3.13Å; R689-R692 WeakPolarHBondContact O-CA 3.48Å; R689-R692 WeakPolarHBondContact O-CB 3.07Å; R689-R692 PolarHBondContact O-N 3.23Å; R692-R695 PolarHBondContact O-N 3.39Å; R692-L696 HydrophobicContact CG-CD1 4.35Å; R692-L696 WeakPolarHBondContact O-CB 3.44Å; R692-L696 WeakPolarHBondContact O-CG 3.37Å; R692-L696 PolarHBondContact O-N 2.73Å
693	D	88.7	Confident	88.4	Confident	79 Å²	79	77.1 Å²	77.1	42%	0.422	36%	0.364	S	S	.	.	H	α-helix	trans	-66.1	-39.9	178.7	-56.8	-24.7	0	0	0	111.1	R689 L696 L697	R689-D693 PolarHBondContact O-N 3.26Å; D693-L696 PolarHBondContact O-N 2.9Å; D693-L697 WeakPolarHBondContact O-CB 3.28Å; D693-L697 PolarHBondContact O-N 3.17Å
694	H	85.6	Confident	88.8	Confident	124 Å²	124	77.7 Å²	77.7	57%	0.574	36%	0.364	S	S	*	.	H	α-helix	trans	-62.8	-41.7	171.7	-177.8	-79.9	0	0	0	112	R690 D691 L697 E698	R690-H694 WeakPolarHBondContact O-CB 3.06Å; R690-H694 PolarHBondContact O-N 3.07Å; D691-H694 PolarHBondContact O-N 2.62Å; H694-L697 PolarHBondContact O-N 3.19Å; H694-E698 PolarHBondContact O-N 3.12Å
695	R	86.4	Confident	88.9	Confident	77 Å²	77	79.3 Å²	79.3	29%	0.291	37%	0.373	S	S	.	.	H	α-helix	trans	-67.6	-39.3	178	-172.4	55.7	163.9	164.4	0.7	112.2	N616 L618 D691 R692 L697 E698 I699	N616-R695 PolarHBondContact OD1-NE 2.85Å; N616-R695 PolarHBondContact OD1-NH2 2.61Å; L618-R695 HydrophobicContact CD2-CB 4.48Å; L618-R695 HydrophobicContact CD2-CG 4.35Å; D691-R695 WeakPolarHBondContact O-CB 3.46Å; D691-R695 PolarHBondContact O-N 3.23Å; R692-R695 PolarHBondContact O-N 3.39Å; R695-L697 VanDerWaalsContact C-N 3.34Å; R695-E698 WeakPolarHBondContact CD-OE2 3.46Å; R695-E698 IonicContact CZ-OE2 2.88Å; R695-E698 IonicContact NH1-OE2 2.72Å; R695-E698 PolarHBondContact NH1-OE2 3.43Å; R695-E698 PolarHBondContact O-N 3.43Å; R695-I699 HydrophobicContact CG-CD1 4.08Å; R695-I699 WeakPolarHBondContact O-CB 3.43Å; R695-I699 VanDerWaalsContact O-CG1 3.28Å; R695-I699 WeakPolarHBondContact O-CG1 3.35Å; R695-I699 PolarHBondContact O-N 3.37Å
696	L	89.9	Confident	88.9	Confident	79 Å²	79	85.8 Å²	85.8	41%	0.414	40%	0.403	S	S	.	.	H	α-helix	trans	-58.3	-44.1	170	-82.7	161.8	0	0	0	111.7	L618 R692 D693 I699 K700	L618-L696 HydrophobicContact CD1-CD2 3.7Å; L618-L696 HydrophobicContact CD1-CG 4.19Å; L618-L696 HydrophobicContact CD2-CD2 4.49Å; L618-L696 HydrophobicContact CD2-CG 4.06Å; R692-L696 HydrophobicContact CG-CD1 4.35Å; R692-L696 WeakPolarHBondContact O-CB 3.44Å; R692-L696 WeakPolarHBondContact O-CG 3.37Å; R692-L696 PolarHBondContact O-N 2.73Å; D693-L696 PolarHBondContact O-N 2.9Å; L696-I699 PolarHBondContact O-N 2.86Å; L696-K700 WeakPolarHBondContact O-CB 3.49Å; L696-K700 PolarHBondContact O-N 3.1Å
697	L	88.9	Confident	89.2	Confident	121 Å²	121	89.3 Å²	89.3	63%	0.634	42%	0.418	S	S	*	.	H	α-helix	trans	-66.1	-38.2	178.3	-153.7	77	0	0	0	112.3	D693 H694 R695 R701	D693-L697 WeakPolarHBondContact O-CB 3.28Å; D693-L697 PolarHBondContact O-N 3.17Å; H694-L697 PolarHBondContact O-N 3.19Å; R695-L697 VanDerWaalsContact C-N 3.34Å; L697-R701 WeakPolarHBondContact O-CB 3.47Å; L697-R701 PolarHBondContact O-N 3.19Å
698	E	88.1	Confident	89.8	Confident	96 Å²	96	93.8 Å²	93.8	45%	0.449	43%	0.429	S	S	.	.	H	α-helix	trans	-66.5	-44.4	174.8	-173.5	177.9	-130.3	0	0	112	H694 R695 R701 A702	H694-E698 PolarHBondContact O-N 3.12Å; R695-E698 WeakPolarHBondContact CD-OE2 3.46Å; R695-E698 IonicContact CZ-OE2 2.88Å; R695-E698 IonicContact NH1-OE2 2.72Å; R695-E698 PolarHBondContact NH1-OE2 3.43Å; R695-E698 PolarHBondContact O-N 3.43Å; E698-R701 PolarHBondContact O-N 3.37Å; E698-A702 WeakPolarHBondContact O-CB 3.4Å; E698-A702 PolarHBondContact O-N 3.29Å
699	I	90.2	Very high	90	Very high	54 Å²	54	98.5 Å²	98.5	28%	0.277	45%	0.454	S	S	.	.	H	α-helix	trans	-63.3	-41	175.3	-69.5	164.5	0	0	0	111	L618 R695 L696 A702 K703	L618-I699 HydrophobicContact CD1-CD1 4.21Å; R695-I699 HydrophobicContact CG-CD1 4.08Å; R695-I699 WeakPolarHBondContact O-CB 3.43Å; R695-I699 VanDerWaalsContact O-CG1 3.28Å; R695-I699 WeakPolarHBondContact O-CG1 3.35Å; R695-I699 PolarHBondContact O-N 3.37Å; L696-I699 PolarHBondContact O-N 2.86Å; I699-A702 PolarHBondContact O-N 3.3Å; I699-K703 WeakPolarHBondContact O-CG 3.23Å; I699-K703 PolarHBondContact O-N 3.44Å; I699-K703 VanDerWaalsContact O-N 3.12Å
700	K	92.2	Very high	90.2	Very high	122 Å²	122	103.1 Å²	103.1	53%	0.53	47%	0.471	S	S	.	.	H	α-helix	trans	-59.7	-51.8	174.4	175.3	171.3	171.4	172.6	0	110.9	L696 A702 K703 E704	L696-K700 WeakPolarHBondContact O-CB 3.49Å; L696-K700 PolarHBondContact O-N 3.1Å; K700-A702 VanDerWaalsContact C-N 3.29Å; K700-A702 PolarHBondContact O-N 2.93Å; K700-K703 PolarHBondContact O-N 2.84Å; K700-K703 VanDerWaalsContact O-N 3.15Å; K700-E704 WeakPolarHBondContact CE-OE1 3.43Å; K700-E704 HydrophobicContact CG-CG 4.46Å; K700-E704 IonicContact NZ-OE1 2.73Å; K700-E704 WeakPolarHBondContact O-CG 3.43Å; K700-E704 PolarHBondContact O-N 3.11Å
701	R	90.8	Very high	90.5	Very high	189 Å²	189	104 Å²	104	71%	0.713	48%	0.479	S	S	*	.	H	α-helix	trans	-61.3	-36.1	179.1	-173.3	179.6	-179.3	-178.5	2.3	112.9	L697 E698 E704 E705	L697-R701 WeakPolarHBondContact O-CB 3.47Å; L697-R701 PolarHBondContact O-N 3.19Å; E698-R701 PolarHBondContact O-N 3.37Å; R701-E704 PolarHBondContact O-N 2.99Å; R701-E705 PolarHBondContact O-N 2.85Å
702	A	91.2	Very high	90.8	Very high	59 Å²	59	106.9 Å²	106.9	49%	0.488	49%	0.49	S	S	.	.	H	α-helix	trans	-64.7	-41.1	176	0	0	0	0	0	111.9	E698 I699 K700 E705 E706	E698-A702 WeakPolarHBondContact O-CB 3.4Å; E698-A702 PolarHBondContact O-N 3.29Å; I699-A702 PolarHBondContact O-N 3.3Å; K700-A702 VanDerWaalsContact C-N 3.29Å; K700-A702 PolarHBondContact O-N 2.93Å; A702-E705 PolarHBondContact O-N 2.76Å; A702-E706 WeakPolarHBondContact O-CB 3.48Å; A702-E706 PolarHBondContact O-N 3.24Å
703	K	92.9	Very high	91.1	Very high	135 Å²	135	108.1 Å²	108.1	59%	0.587	51%	0.508	S	S	*	.	H	α-helix	trans	-66.6	-42.6	174.7	-71.3	179.2	178.1	-175.1	0	112.5	I699 K700 E705 E706 E707	I699-K703 WeakPolarHBondContact O-CG 3.23Å; I699-K703 PolarHBondContact O-N 3.44Å; I699-K703 VanDerWaalsContact O-N 3.12Å; K700-K703 PolarHBondContact O-N 2.84Å; K700-K703 VanDerWaalsContact O-N 3.15Å; K703-E705 VanDerWaalsContact C-N 3.27Å; K703-E705 PolarHBondContact O-N 2.72Å; K703-E706 PolarHBondContact O-N 3.19Å; K703-E707 VanDerWaalsContact O-CB 3.28Å; K703-E707 WeakPolarHBondContact O-CB 3.5Å; K703-E707 PolarHBondContact O-N 2.86Å
704	E	92.2	Very high	91.3	Very high	89 Å²	89	111.1 Å²	111.1	42%	0.416	52%	0.519	S	S	.	.	H	α-helix	trans	-60.9	-35.8	176.2	-70	169.2	160.9	0	0	111.9	K700 R701 R708	K700-E704 WeakPolarHBondContact CE-OE1 3.43Å; K700-E704 HydrophobicContact CG-CG 4.46Å; K700-E704 IonicContact NZ-OE1 2.73Å; K700-E704 WeakPolarHBondContact O-CG 3.43Å; K700-E704 PolarHBondContact O-N 3.11Å; R701-E704 PolarHBondContact O-N 2.99Å; E704-R708 WeakPolarHBondContact O-CB 3.43Å; E704-R708 WeakPolarHBondContact O-CG 3.47Å; E704-R708 PolarHBondContact O-N 3.48Å; E704-R708 VanDerWaalsContact O-N 3.11Å
705	E	90.1	Very high	91.7	Very high	86 Å²	86	110.2 Å²	110.2	40%	0.402	52%	0.517	S	S	.	.	H	α-helix	trans	-75	-38.9	174.7	-164.6	65.6	-159.8	0	0	112.5	R701 A702 K703 R708 I709	R701-E705 PolarHBondContact O-N 2.85Å; A702-E705 PolarHBondContact O-N 2.76Å; K703-E705 VanDerWaalsContact C-N 3.27Å; K703-E705 PolarHBondContact O-N 2.72Å; E705-R708 PolarHBondContact O-N 2.74Å; E705-R708 IonicContact OE1-CZ 2.66Å; E705-R708 IonicContact OE1-NH1 3.6Å; E705-R708 PolarHBondContact OE1-NH1 3.38Å; E705-R708 IonicContact OE2-CZ 3.61Å; E705-R708 IonicContact OE2-NH1 2.74Å; E705-R708 PolarHBondContact OE2-NH1 2.71Å; E705-I709 HydrophobicContact CG-CD1 4.13Å; E705-I709 WeakPolarHBondContact O-CB 3.39Å; E705-I709 WeakPolarHBondContact O-CD1 3.35Å; E705-I709 VanDerWaalsContact O-CG1 3.24Å; E705-I709 WeakPolarHBondContact O-CG1 3Å; E705-I709 PolarHBondContact O-N 2.72Å
706	E	91.9	Very high	92	Very high	140 Å²	140	113.4 Å²	113.4	65%	0.654	53%	0.533	S	S	*	.	H	α-helix	trans	-63.4	-42	174.6	-175.2	175.6	-169.3	0	0	111.8	A702 K703 I709 R710	A702-E706 WeakPolarHBondContact O-CB 3.48Å; A702-E706 PolarHBondContact O-N 3.24Å; K703-E706 PolarHBondContact O-N 3.19Å; E706-I709 PolarHBondContact O-N 2.82Å; E706-R710 WeakPolarHBondContact O-CB 3.42Å; E706-R710 PolarHBondContact O-N 3.34Å
707	E	92.9	Very high	92.1	Very high	124 Å²	124	114.4 Å²	114.4	58%	0.579	54%	0.536	S	S	*	.	H	α-helix	trans	-62.3	-49.1	175	-171.9	160.2	-133.6	0	0	111	K703 I709 R710 E711	K703-E707 VanDerWaalsContact O-CB 3.28Å; K703-E707 WeakPolarHBondContact O-CB 3.5Å; K703-E707 PolarHBondContact O-N 2.86Å; E707-I709 PolarHBondContact O-N 3.25Å; E707-R710 WeakPolarHBondContact O-CB 3.47Å; E707-R710 PolarHBondContact O-N 3.36Å; E707-R710 VanDerWaalsContact O-N 3.09Å; E707-E711 WeakPolarHBondContact O-CG 3.3Å; E707-E711 PolarHBondContact O-N 2.86Å
708	R	94.3	Very high	92.3	Very high	119 Å²	119	113.9 Å²	113.9	45%	0.449	53%	0.53	S	S	.	.	H	α-helix	trans	-57	-42.7	173.3	-81	-175.5	59.2	-105.5	-27	113.8	E704 E705 R710 E711 E712	E704-R708 WeakPolarHBondContact O-CB 3.43Å; E704-R708 WeakPolarHBondContact O-CG 3.47Å; E704-R708 PolarHBondContact O-N 3.48Å; E704-R708 VanDerWaalsContact O-N 3.11Å; E705-R708 PolarHBondContact O-N 2.74Å; E705-R708 IonicContact OE1-CZ 2.66Å; E705-R708 IonicContact OE1-NH1 3.6Å; E705-R708 PolarHBondContact OE1-NH1 3.38Å; E705-R708 IonicContact OE2-CZ 3.61Å; E705-R708 IonicContact OE2-NH1 2.74Å; E705-R708 PolarHBondContact OE2-NH1 2.71Å; R708-R710 VanDerWaalsContact C-N 3.28Å; R708-R710 PolarHBondContact O-N 2.91Å; R708-E711 PolarHBondContact O-N 3.49Å; R708-E712 WeakPolarHBondContact O-CB 3.25Å; R708-E712 PolarHBondContact O-N 2.72Å
709	I	93.7	Very high	92.4	Very high	100 Å²	100	114.9 Å²	114.9	51%	0.513	54%	0.538	S	S	.	.	H	α-helix	trans	-65.9	-35	178.2	-72.4	166.2	0	0	0	110.5	E705 E706 E707 A713	E705-I709 HydrophobicContact CG-CD1 4.13Å; E705-I709 WeakPolarHBondContact O-CB 3.39Å; E705-I709 WeakPolarHBondContact O-CD1 3.35Å; E705-I709 VanDerWaalsContact O-CG1 3.24Å; E705-I709 WeakPolarHBondContact O-CG1 3Å; E705-I709 PolarHBondContact O-N 2.72Å; E706-I709 PolarHBondContact O-N 2.82Å; E707-I709 PolarHBondContact O-N 3.25Å; I709-A713 WeakPolarHBondContact O-CB 3.4Å; I709-A713 PolarHBondContact O-N 3.38Å
710	R	94.4	Very high	92.6	Very high	190 Å²	190	118.2 Å²	118.2	72%	0.717	55%	0.547	S	S	*	.	H	α-helix	trans	-69.5	-45.3	176.2	-167.5	179.8	-173.6	-167.8	0.9	112.1	E706 E707 R708 A713 E714	E706-R710 WeakPolarHBondContact O-CB 3.42Å; E706-R710 PolarHBondContact O-N 3.34Å; E707-R710 WeakPolarHBondContact O-CB 3.47Å; E707-R710 PolarHBondContact O-N 3.36Å; E707-R710 VanDerWaalsContact O-N 3.09Å; R708-R710 VanDerWaalsContact C-N 3.28Å; R708-R710 PolarHBondContact O-N 2.91Å; R710-A713 PolarHBondContact O-N 3.01Å; R710-E714 PolarHBondContact O-N 3.09Å
711	E	92.9	Very high	92.6	Very high	111 Å²	111	116.7 Å²	116.7	52%	0.519	54%	0.544	S	S	.	.	H	α-helix	trans	-59.5	-45	173.7	-70.2	-177.8	149.5	0	0	111.6	E707 R708 A713 E714 I715	E707-E711 WeakPolarHBondContact O-CG 3.3Å; E707-E711 PolarHBondContact O-N 2.86Å; R708-E711 PolarHBondContact O-N 3.49Å; E711-A713 VanDerWaalsContact C-N 3.31Å; E711-A713 PolarHBondContact O-N 3.26Å; E711-E714 PolarHBondContact O-N 3.42Å; E711-I715 WeakPolarHBondContact O-CB 3.39Å; E711-I715 VanDerWaalsContact O-CG1 3.28Å; E711-I715 WeakPolarHBondContact O-CG1 3.42Å; E711-I715 PolarHBondContact O-N 3.45Å
712	E	91.2	Very high	92.6	Very high	118 Å²	118	114.9 Å²	114.9	55%	0.551	54%	0.537	S	S	*	.	H	α-helix	trans	-61.9	-39.1	176.8	-167.6	-173.1	138.3	0	0	111.6	R708 K716	R708-E712 WeakPolarHBondContact O-CB 3.25Å; R708-E712 PolarHBondContact O-N 2.72Å; E712-K716 WeakPolarHBondContact O-CB 3.13Å; E712-K716 PolarHBondContact O-N 2.82Å; E712-K716 VanDerWaalsContact O-N 3.09Å
713	A	93.6	Very high	92.6	Very high	58 Å²	58	114.8 Å²	114.8	48%	0.479	54%	0.537	S	S	.	.	H	α-helix	trans	-66	-42.3	176.1	0	0	0	0	0	112.6	I709 R710 E711 K716 E717	I709-A713 WeakPolarHBondContact O-CB 3.4Å; I709-A713 PolarHBondContact O-N 3.38Å; R710-A713 PolarHBondContact O-N 3.01Å; E711-A713 VanDerWaalsContact C-N 3.31Å; E711-A713 PolarHBondContact O-N 3.26Å; A713-K716 PolarHBondContact O-N 2.75Å; A713-E717 PolarHBondContact O-N 2.88Å
714	E	94.6	Very high	92.6	Very high	142 Å²	142	111.2 Å²	111.2	66%	0.664	52%	0.522	S	S	*	.	H	α-helix	trans	-68.1	-46	179.7	-171.9	164.5	-179.2	0	0	111.8	R710 E711 K716 E717 E718	R710-E714 PolarHBondContact O-N 3.09Å; E711-E714 PolarHBondContact O-N 3.42Å; E714-K716 PolarHBondContact O-N 3.08Å; E714-E717 PolarHBondContact O-N 3.08Å; E714-E717 VanDerWaalsContact O-N 3.13Å; E714-E718 PolarHBondContact O-N 3.32Å
715	I	93	Very high	92.6	Very high	105 Å²	105	109.6 Å²	109.6	54%	0.538	52%	0.524	S	S	.	.	H	α-helix	trans	-57.9	-39.2	173.7	-69.3	166.4	0	0	0	111	E711 L719	E711-I715 WeakPolarHBondContact O-CB 3.39Å; E711-I715 VanDerWaalsContact O-CG1 3.28Å; E711-I715 WeakPolarHBondContact O-CG1 3.42Å; E711-I715 PolarHBondContact O-N 3.45Å; I715-L719 HydrophobicContact CG2-CD1 4.28Å; I715-L719 WeakPolarHBondContact O-CB 3.15Å; I715-L719 PolarHBondContact O-N 2.63Å
716	K	92.4	Very high	92.5	Very high	145 Å²	145	112.1 Å²	112.1	63%	0.63	53%	0.534	S	S	*	.	H	α-helix	trans	-70.9	-32.3	178.7	-174.5	175.8	-174.6	172.3	0	112.8	E712 A713 E714 R720	E712-K716 WeakPolarHBondContact O-CB 3.13Å; E712-K716 PolarHBondContact O-N 2.82Å; E712-K716 VanDerWaalsContact O-N 3.09Å; A713-K716 PolarHBondContact O-N 2.75Å; E714-K716 PolarHBondContact O-N 3.08Å; K716-R720 PolarHBondContact O-N 3.47Å; K716-R720 VanDerWaalsContact O-N 3.15Å
717	E	93	Very high	92.4	Very high	100 Å²	100	112.2 Å²	112.2	47%	0.467	53%	0.534	S	S	.	.	H	α-helix	trans	-73	-42.5	171.7	-178.6	138.4	-127.3	0	0	111.9	A713 E714 L719 R720 L721	A713-E717 PolarHBondContact O-N 2.88Å; E714-E717 PolarHBondContact O-N 3.08Å; E714-E717 VanDerWaalsContact O-N 3.13Å; E717-L719 VanDerWaalsContact C-N 3.32Å; E717-L719 PolarHBondContact O-N 3.47Å; E717-R720 WeakPolarHBondContact O-CB 3.3Å; E717-R720 PolarHBondContact O-N 3.41Å; E717-R720 IonicContact OE1-CZ 2.66Å; E717-R720 IonicContact OE1-NH1 3.88Å; E717-R720 PolarHBondContact OE1-NH1 3.34Å; E717-L721 HydrophobicContact CG-CD1 4.12Å; E717-L721 HydrophobicContact CG-CG 4.41Å; E717-L721 WeakPolarHBondContact O-CG 3.43Å; E717-L721 PolarHBondContact O-N 2.79Å
718	E	92	Very high	92.3	Very high	110 Å²	110	112.5 Å²	112.5	51%	0.514	53%	0.533	S	S	.	.	H	α-helix	trans	-58.2	-45.4	173.6	-162.8	-148.3	134	0	0	110.9	E714 R720 L721 R722	E714-E718 PolarHBondContact O-N 3.32Å; E718-R720 VanDerWaalsContact C-N 3.29Å; E718-R720 PolarHBondContact O-N 3.43Å; E718-L721 PolarHBondContact O-N 3.27Å; E718-R722 VanDerWaalsContact O-CB 3.22Å; E718-R722 WeakPolarHBondContact O-CB 3.39Å; E718-R722 PolarHBondContact O-N 3.29Å; E718-R722 IonicContact OE1-NH1 2.65Å; E718-R722 PolarHBondContact OE1-NH1 3.43Å
719	L	91.1	Very high	92.1	Very high	116 Å²	116	113.1 Å²	113.1	61%	0.607	54%	0.541	S	S	*	.	H	α-helix	trans	-58.7	-38.1	174.6	-96.6	160.5	0	0	0	112.8	I715 E717 A723	I715-L719 HydrophobicContact CG2-CD1 4.28Å; I715-L719 WeakPolarHBondContact O-CB 3.15Å; I715-L719 PolarHBondContact O-N 2.63Å; E717-L719 VanDerWaalsContact C-N 3.32Å; E717-L719 PolarHBondContact O-N 3.47Å; L719-A723 WeakPolarHBondContact O-CB 3.3Å; L719-A723 PolarHBondContact O-N 2.92Å
720	R	93.9	Very high	91.8	Very high	124 Å²	124	115 Å²	115	47%	0.468	55%	0.546	S	S	.	.	H	α-helix	trans	-67.4	-50.2	176.5	-155.5	-165.7	85.1	-125.3	-5.4	111.2	K716 E717 E718 R722 A723 E724	K716-R720 PolarHBondContact O-N 3.47Å; K716-R720 VanDerWaalsContact O-N 3.15Å; E717-R720 WeakPolarHBondContact O-CB 3.3Å; E717-R720 PolarHBondContact O-N 3.41Å; E717-R720 IonicContact OE1-CZ 2.66Å; E717-R720 IonicContact OE1-NH1 3.88Å; E717-R720 PolarHBondContact OE1-NH1 3.34Å; E718-R720 VanDerWaalsContact C-N 3.29Å; E718-R720 PolarHBondContact O-N 3.43Å; R720-R722 VanDerWaalsContact C-N 3.27Å; R720-R722 PolarHBondContact O-N 3.29Å; R720-A723 WeakPolarHBondContact O-CB 3.16Å; R720-A723 PolarHBondContact O-N 3.46Å; R720-A723 VanDerWaalsContact O-N 3.11Å; R720-E724 IonicContact CZ-OE1 3.84Å; R720-E724 VanDerWaalsContact CZ-OE1 3.31Å; R720-E724 IonicContact NE-OE1 2.68Å; R720-E724 PolarHBondContact NE-OE1 2.85Å; R720-E724 IonicContact NH2-OE1 3.48Å; R720-E724 PolarHBondContact NH2-OE1 2.94Å; R720-E724 WeakPolarHBondContact O-CG 3.31Å; R720-E724 PolarHBondContact O-N 3.01Å
721	L	93.1	Very high	91.5	Very high	90 Å²	90	112.4 Å²	112.4	47%	0.471	54%	0.542	S	S	.	.	H	α-helix	trans	-59.7	-38.7	177.9	-69.2	170.7	0	0	0	111.8	E717 E718 E724 A725	E717-L721 HydrophobicContact CG-CD1 4.12Å; E717-L721 HydrophobicContact CG-CG 4.41Å; E717-L721 WeakPolarHBondContact O-CG 3.43Å; E717-L721 PolarHBondContact O-N 2.79Å; E718-L721 PolarHBondContact O-N 3.27Å; L721-E724 PolarHBondContact O-N 3.43Å; L721-A725 WeakPolarHBondContact O-CB 3.39Å; L721-A725 PolarHBondContact O-N 3.38Å
722	R	90.5	Very high	91.3	Very high	151 Å²	151	116.4 Å²	116.4	57%	0.57	55%	0.552	S	S	*	*	H	α-helix	trans	-72.1	-27.8	177.2	-164.1	168.9	-173.4	165.8	-2.1	113.2	E718 R720 K726	E718-R722 VanDerWaalsContact O-CB 3.22Å; E718-R722 WeakPolarHBondContact O-CB 3.39Å; E718-R722 PolarHBondContact O-N 3.29Å; E718-R722 IonicContact OE1-NH1 2.65Å; E718-R722 PolarHBondContact OE1-NH1 3.43Å; R720-R722 VanDerWaalsContact C-N 3.27Å; R720-R722 PolarHBondContact O-N 3.29Å; R722-K726 WeakPolarHBondContact O-CG 3.48Å; R722-K726 PolarHBondContact O-N 2.95Å
723	A	90.4	Very high	91.2	Very high	57 Å²	57	116 Å²	116	47%	0.471	55%	0.553	S	S	.	*	H	α-helix	trans	-72.2	-48.2	169.3	0	0	0	0	0	111.4	L719 R720 A725 K726 E727	L719-A723 WeakPolarHBondContact O-CB 3.3Å; L719-A723 PolarHBondContact O-N 2.92Å; R720-A723 WeakPolarHBondContact O-CB 3.16Å; R720-A723 PolarHBondContact O-N 3.46Å; R720-A723 VanDerWaalsContact O-N 3.11Å; A723-A725 PolarHBondContact O-N 3.23Å; A723-K726 PolarHBondContact O-N 2.74Å; A723-K726 VanDerWaalsContact O-N 3.14Å; A723-E727 PolarHBondContact O-N 3.46Å
724	E	92.6	Very high	90.8	Very high	60 Å²	60	118.4 Å²	118.4	28%	0.28	56%	0.555	S	S	.	*	H	α-helix	trans	-57.2	-37.3	175.4	-69.7	178.7	-142.1	0	0	112.1	R720 L721 K728	R720-E724 IonicContact CZ-OE1 3.84Å; R720-E724 VanDerWaalsContact CZ-OE1 3.31Å; R720-E724 IonicContact NE-OE1 2.68Å; R720-E724 PolarHBondContact NE-OE1 2.85Å; R720-E724 IonicContact NH2-OE1 3.48Å; R720-E724 PolarHBondContact NH2-OE1 2.94Å; R720-E724 WeakPolarHBondContact O-CG 3.31Å; R720-E724 PolarHBondContact O-N 3.01Å; L721-E724 PolarHBondContact O-N 3.43Å; E724-K728 WeakPolarHBondContact O-CD 3.24Å; E724-K728 WeakPolarHBondContact O-CG 3.36Å; E724-K728 PolarHBondContact O-N 2.89Å; E724-K728 VanDerWaalsContact O-N 3.14Å; E724-K728 IonicContact OE2-NZ 2.98Å
725	A	92.2	Very high	90.4	Very high	56 Å²	56	118.7 Å²	118.7	46%	0.463	55%	0.554	S	S	.	*	H	α-helix	trans	-65.6	-45.6	175.5	0	0	0	0	0	112.6	L721 A723 E727 K728 E729	L721-A725 WeakPolarHBondContact O-CB 3.39Å; L721-A725 PolarHBondContact O-N 3.38Å; A723-A725 PolarHBondContact O-N 3.23Å; A725-E727 VanDerWaalsContact C-N 3.31Å; A725-E727 PolarHBondContact O-N 2.96Å; A725-K728 PolarHBondContact O-N 3.26Å; A725-E729 PolarHBondContact O-N 3.26Å
726	K	89.8	Confident	90.1	Very high	139 Å²	139	117.7 Å²	117.7	60%	0.604	55%	0.547	S	S	*	.	H	α-helix	trans	-63.5	-35.2	175.9	-77.4	180	174.6	-174.8	0	112.5	R722 A723 K730	R722-K726 WeakPolarHBondContact O-CG 3.48Å; R722-K726 PolarHBondContact O-N 2.95Å; A723-K726 PolarHBondContact O-N 2.74Å; A723-K726 VanDerWaalsContact O-N 3.14Å; K726-K730 WeakPolarHBondContact O-CB 3.42Å; K726-K730 PolarHBondContact O-N 3.31Å
727	E	89	Confident	89.7	Confident	141 Å²	141	120.2 Å²	120.2	66%	0.659	55%	0.552	S	S	*	*	H	α-helix	trans	-67	-46.3	176.6	-173.9	162.9	-139.9	0	0	111.6	A723 A725 E729 K730 E731	A723-E727 PolarHBondContact O-N 3.46Å; A725-E727 VanDerWaalsContact C-N 3.31Å; A725-E727 PolarHBondContact O-N 2.96Å; E727-E729 VanDerWaalsContact C-N 3.32Å; E727-E729 PolarHBondContact O-N 3.33Å; E727-K730 WeakPolarHBondContact O-CB 3.4Å; E727-K730 PolarHBondContact O-N 2.87Å; E727-E731 PolarHBondContact O-N 2.91Å
728	K	90.7	Very high	89.1	Confident	130 Å²	130	120.6 Å²	120.6	57%	0.565	56%	0.557	S	S	*	*	H	α-helix	trans	-63.2	-35.7	174.9	-69.8	164.7	-174.4	159.9	0	112.6	E724 A725 R732	E724-K728 WeakPolarHBondContact O-CD 3.24Å; E724-K728 WeakPolarHBondContact O-CG 3.36Å; E724-K728 PolarHBondContact O-N 2.89Å; E724-K728 VanDerWaalsContact O-N 3.14Å; E724-K728 IonicContact OE2-NZ 2.98Å; A725-K728 PolarHBondContact O-N 3.26Å; K728-R732 WeakPolarHBondContact O-CB 3.45Å; K728-R732 PolarHBondContact O-N 2.67Å; K728-R732 VanDerWaalsContact O-N 3.11Å
729	E	89.2	Confident	88.6	Confident	132 Å²	132	121.7 Å²	121.7	62%	0.617	56%	0.562	S	S	*	*	H	α-helix	trans	-64.5	-46.5	172.6	-176.2	175.1	-152.4	0	0	111.6	A725 E727 R732 L733	A725-E729 PolarHBondContact O-N 3.26Å; E727-E729 VanDerWaalsContact C-N 3.32Å; E727-E729 PolarHBondContact O-N 3.33Å; E729-R732 PolarHBondContact O-N 2.82Å; E729-L733 PolarHBondContact O-N 2.6Å
730	K	88.9	Confident	88	Confident	140 Å²	140	122.5 Å²	122.5	61%	0.609	56%	0.561	S	S	*	*	H	α-helix	trans	-60.2	-46.8	176.4	-176.8	-165.1	169.4	-161.1	0	111.9	K726 E727 R732 L733 E734	K726-K730 WeakPolarHBondContact O-CB 3.42Å; K726-K730 PolarHBondContact O-N 3.31Å; E727-K730 WeakPolarHBondContact O-CB 3.4Å; E727-K730 PolarHBondContact O-N 2.87Å; K730-R732 VanDerWaalsContact C-N 3.33Å; K730-R732 PolarHBondContact O-N 2.92Å; K730-L733 PolarHBondContact O-N 3.04Å; K730-E734 WeakPolarHBondContact O-CB 3.2Å; K730-E734 PolarHBondContact O-N 2.58Å
731	E	88.2	Confident	87.2	Confident	136 Å²	136	124.2 Å²	124.2	64%	0.636	57%	0.572	S	S	*	*	H	α-helix	trans	-59.4	-43.8	177.9	-170.9	-169.2	178.7	0	0	111.3	E727 L733 E734 K735	E727-E731 PolarHBondContact O-N 2.91Å; E731-L733 PolarHBondContact O-N 3.3Å; E731-E734 PolarHBondContact O-N 2.86Å; E731-K735 WeakPolarHBondContact O-CB 3.27Å; E731-K735 PolarHBondContact O-N 2.84Å
732	R	88.9	Confident	86.2	Confident	195 Å²	195	122.8 Å²	122.8	74%	0.736	57%	0.573	S	S	*	*	H	α-helix	trans	-60.5	-43	175.8	-177.1	179	176.1	-176.2	-0.5	112.1	K728 E729 K730 K735 E736	K728-R732 WeakPolarHBondContact O-CB 3.45Å; K728-R732 PolarHBondContact O-N 2.67Å; K728-R732 VanDerWaalsContact O-N 3.11Å; E729-R732 PolarHBondContact O-N 2.82Å; K730-R732 VanDerWaalsContact C-N 3.33Å; K730-R732 PolarHBondContact O-N 2.92Å; R732-K735 PolarHBondContact O-N 2.87Å; R732-E736 PolarHBondContact O-N 3.48Å
733	L	87.3	Confident	85.2	Confident	108 Å²	108	118.6 Å²	118.6	57%	0.565	57%	0.57	S	S	*	*	H	α-helix	trans	-68.2	-36.7	178.3	-124.4	169.2	0	0	0	112.2	E729 K730 E731 R737	E729-L733 PolarHBondContact O-N 2.6Å; K730-L733 PolarHBondContact O-N 3.04Å; E731-L733 PolarHBondContact O-N 3.3Å; L733-R737 WeakPolarHBondContact O-CB 3.47Å; L733-R737 PolarHBondContact O-N 2.95Å
734	E	86.5	Confident	84.1	Confident	110 Å²	110	119.2 Å²	119.2	51%	0.514	58%	0.576	S	S	.	*	H	α-helix	trans	-68.9	-40.8	174.8	-177.5	153.7	-154.6	0	0	111.9	K730 E731 R737 L738	K730-E734 WeakPolarHBondContact O-CB 3.2Å; K730-E734 PolarHBondContact O-N 2.58Å; E731-E734 PolarHBondContact O-N 2.86Å; E734-R737 WeakPolarHBondContact O-CB 3.49Å; E734-R737 PolarHBondContact O-N 2.8Å; E734-L738 HydrophobicContact CG-CD1 4.37Å; E734-L738 WeakPolarHBondContact O-CG 3.49Å; E734-L738 PolarHBondContact O-N 2.92Å
735	K	86.1	Confident	82.6	Confident	147 Å²	147	119.8 Å²	119.8	64%	0.639	59%	0.59	S	S	*	*	H	α-helix	trans	-60.4	-47	172.9	-173.6	176.1	-179.5	177.9	0	111.9	E731 R732 R737 L738 E739	E731-K735 WeakPolarHBondContact O-CB 3.27Å; E731-K735 PolarHBondContact O-N 2.84Å; R732-K735 PolarHBondContact O-N 2.87Å; K735-R737 VanDerWaalsContact C-N 3.28Å; K735-R737 PolarHBondContact O-N 2.92Å; K735-L738 PolarHBondContact O-N 2.99Å; K735-E739 WeakPolarHBondContact O-CB 3.4Å; K735-E739 PolarHBondContact O-N 3.28Å
736	E	85.7	Confident	81.1	Confident	84 Å²	84	121 Å²	121	39%	0.393	60%	0.6	S	S	.	*	H	α-helix	trans	-61.2	-37.3	175.9	-166.2	-166.8	128.9	0	0	111.8	R732 E739 K740	R732-E736 PolarHBondContact O-N 3.48Å; E736-E739 PolarHBondContact O-N 3.03Å; E736-K740 HydrophobicContact CG-CD 4.4Å; E736-K740 WeakPolarHBondContact O-CB 3.25Å; E736-K740 WeakPolarHBondContact O-CG 3.42Å; E736-K740 PolarHBondContact O-N 2.94Å; E736-K740 WeakPolarHBondContact OE1-CE 3.37Å; E736-K740 IonicContact OE1-NZ 3Å; E736-K740 PolarHBondContact OE1-NZ 3.29Å
737	R	84.8	Confident	79.6	Confident	199 Å²	199	118.7 Å²	118.7	75%	0.751	61%	0.607	S	S	*	*	H	α-helix	trans	-68	-38.2	176	-174.1	175.7	-178.4	164	0.9	112.6	L733 E734 K735 K741	L733-R737 WeakPolarHBondContact O-CB 3.47Å; L733-R737 PolarHBondContact O-N 2.95Å; E734-R737 WeakPolarHBondContact O-CB 3.49Å; E734-R737 PolarHBondContact O-N 2.8Å; K735-R737 VanDerWaalsContact C-N 3.28Å; K735-R737 PolarHBondContact O-N 2.92Å; R737-K741 WeakPolarHBondContact O-CB 3.39Å; R737-K741 PolarHBondContact O-N 3.38Å; R737-K741 VanDerWaalsContact O-N 3.1Å
738	L	80.9	Confident	77.7	Confident	108 Å²	108	115.8 Å²	115.8	57%	0.565	61%	0.608	S	S	*	*	H	α-helix	trans	-68	-41.9	173.8	-74.9	167.8	0	0	0	111.5	E734 K735 K741 A742	E734-L738 HydrophobicContact CG-CD1 4.37Å; E734-L738 WeakPolarHBondContact O-CG 3.49Å; E734-L738 PolarHBondContact O-N 2.92Å; K735-L738 PolarHBondContact O-N 2.99Å; L738-K741 CarbonylContact O-C 3.52Å; L738-K741 WeakPolarHBondContact O-CB 3.15Å; L738-K741 PolarHBondContact O-N 2.78Å; L738-K741 VanDerWaalsContact O-N 3.17Å; L738-A742 PolarHBondContact O-N 3.45Å
739	E	80	Confident	75.6	Confident	133 Å²	133	116.8 Å²	116.8	62%	0.621	62%	0.619	S	S	*	*	H	α-helix	trans	-62.9	-46.2	176.6	-173.8	167.8	-166.8	0	0	111.8	K735 E736 K741 A742 A743	K735-E739 WeakPolarHBondContact O-CB 3.4Å; K735-E739 PolarHBondContact O-N 3.28Å; E736-E739 PolarHBondContact O-N 3.03Å; E739-K741 VanDerWaalsContact C-N 3.27Å; E739-K741 PolarHBondContact O-N 2.82Å; E739-A742 PolarHBondContact O-N 2.92Å; E739-A742 VanDerWaalsContact O-N 3.16Å; E739-A743 PolarHBondContact O-N 2.95Å
740	K	80.3	Confident	73.6	Confident	133 Å²	133	115.9 Å²	115.9	58%	0.578	62%	0.624	S	S	*	*	H	α-helix	trans	-60.3	-34.4	172.2	-77.3	172.4	172.3	171.8	0	112.8	E736 A744	E736-K740 HydrophobicContact CG-CD 4.4Å; E736-K740 WeakPolarHBondContact O-CB 3.25Å; E736-K740 WeakPolarHBondContact O-CG 3.42Å; E736-K740 PolarHBondContact O-N 2.94Å; E736-K740 WeakPolarHBondContact OE1-CE 3.37Å; E736-K740 IonicContact OE1-NZ 3Å; E736-K740 PolarHBondContact OE1-NZ 3.29Å; K740-A744 WeakPolarHBondContact O-CB 3.04Å; K740-A744 PolarHBondContact O-N 3.31Å; K740-A744 VanDerWaalsContact O-N 3.1Å
741	K	75.1	Confident	71.5	Confident	160 Å²	160	116.6 Å²	116.6	70%	0.696	64%	0.635	S	S	*	*	H	α-helix	trans	-72.6	-35.3	175.3	-165.7	179.6	-179.2	-173	0	112.4	R737 L738 E739 A745	R737-K741 WeakPolarHBondContact O-CB 3.39Å; R737-K741 PolarHBondContact O-N 3.38Å; R737-K741 VanDerWaalsContact O-N 3.1Å; L738-K741 CarbonylContact O-C 3.52Å; L738-K741 WeakPolarHBondContact O-CB 3.15Å; L738-K741 PolarHBondContact O-N 2.78Å; L738-K741 VanDerWaalsContact O-N 3.17Å; E739-K741 VanDerWaalsContact C-N 3.27Å; E739-K741 PolarHBondContact O-N 2.82Å; K741-A745 PolarHBondContact O-N 3.11Å
742	A	73.3	Confident	69.5	Low	60 Å²	60	114.9 Å²	114.9	50%	0.496	64%	0.636	S	S	.	*	H	α-helix	trans	-68.7	-43.2	173.6	0	0	0	0	0	111.7	L738 E739 A744 A745 A746	L738-A742 PolarHBondContact O-N 3.45Å; E739-A742 PolarHBondContact O-N 2.92Å; E739-A742 VanDerWaalsContact O-N 3.16Å; A742-A744 VanDerWaalsContact C-N 3.33Å; A742-A744 PolarHBondContact O-N 3.17Å; A742-A745 PolarHBondContact O-N 3.4Å; A742-A745 VanDerWaalsContact O-N 3.12Å; A742-A746 PolarHBondContact O-N 2.8Å
743	A	69.2	Low	67.2	Low	62 Å²	62	111.8 Å²	111.8	51%	0.512	64%	0.639	S	S	.	*	H	α-helix	trans	-60	-41	174.2	0	0	0	0	0	112.2	E739 A745 A746 A747	E739-A743 PolarHBondContact O-N 2.95Å; A743-A745 VanDerWaalsContact C-N 3.31Å; A743-A745 PolarHBondContact O-N 3.2Å; A743-A746 PolarHBondContact O-N 2.66Å; A743-A747 PolarHBondContact O-N 3.46Å
744	A	67.1	Low	65.1	Low	71 Å²	71	111.8 Å²	111.8	59%	0.587	65%	0.645	S	S	*	*	H	α-helix	trans	-64.1	-32.8	174.5	0	0	0	0	0	113.3	K740 A742	K740-A744 WeakPolarHBondContact O-CB 3.04Å; K740-A744 PolarHBondContact O-N 3.31Å; K740-A744 VanDerWaalsContact O-N 3.1Å; A742-A744 VanDerWaalsContact C-N 3.33Å; A742-A744 PolarHBondContact O-N 3.17Å
745	A	61	Low	62.9	Low	71 Å²	71	114.1 Å²	114.1	59%	0.587	66%	0.659	S	S	*	*	H	α-helix	trans	-75.4	-34.9	174.4	0	0	0	0	0	112.7	K741 A742 A743 A747 A748	K741-A745 PolarHBondContact O-N 3.11Å; A742-A745 PolarHBondContact O-N 3.4Å; A742-A745 VanDerWaalsContact O-N 3.12Å; A743-A745 VanDerWaalsContact C-N 3.31Å; A743-A745 PolarHBondContact O-N 3.2Å; A745-A747 VanDerWaalsContact C-N 3.26Å; A745-A747 PolarHBondContact O-N 3.47Å; A745-A748 PolarHBondContact O-N 3.36Å
746	A	60.2	Low	60.9	Low	81 Å²	81	112.4 Å²	112.4	67%	0.669	66%	0.663	S	S	*	*	H	α-helix	trans	-68.5	-22	178.6	0	0	0	0	0	113.6	A742 A743 A748	A742-A746 PolarHBondContact O-N 2.8Å; A743-A746 PolarHBondContact O-N 2.66Å; A746-A748 PolarHBondContact O-N 3.09Å
747	A	58.2	Low	59.1	Low	91 Å²	91	113.5 Å²	113.5	75%	0.752	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	0	178	0	0	0	0	0	114.7	A743 A745	A743-A747 PolarHBondContact O-N 3.46Å; A745-A747 VanDerWaalsContact C-N 3.26Å; A745-A747 PolarHBondContact O-N 3.47Å
748	A	50.5	Low	56.8	Low	81 Å²	81	110.7 Å²	110.7	67%	0.669	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.8	28.5	-164.8	0	0	0	0	0	116	A745 A746	A745-A748 PolarHBondContact O-N 3.36Å; A746-A748 PolarHBondContact O-N 3.09Å
749	N	47.1	Very low	55.1	Low	150 Å²	150	111.5 Å²	111.5	80%	0.802	70%	0.695	S	S	*	*			trans	-157.1	132.1	164.2	-146	3	0	0	0	113.1
750	P	45.8	Very low	53.1	Low	113 Å²	113	110 Å²	110	73%	0.734	71%	0.705	S	S	*	*			trans	-108	149	-173.9	37.7	-32.5	0	0	0	117
751	N	44.3	Very low	51	Low	156 Å²	156	110 Å²	110	83%	0.834	72%	0.716	S	S	*	*			trans	85.7	170.6	152.3	-127.8	16.8	0	0	0	118.4
752	P	46.7	Very low	49.4	Very low	100 Å²	100	106.8 Å²	106.8	65%	0.649	71%	0.712	S	S	*	*				-113.2	-168.6	-106.1	36.9	-18.7	0	0	0	113.7
753	T	40.4	Very low	47.7	Very low	130 Å²	130	112.4 Å²	112.4	80%	0.798	73%	0.727	S	S	*	*			cis	-162.7	160.6	29.6	-26.3	0	0	0	0	111
754	P	43.5	Very low	46.2	Very low	108 Å²	108	114 Å²	114	70%	0.701	74%	0.735	S	S	*	*			trans	-122.5	-162.6	-168.1	36.5	-18.4	0	0	0	117.2
755	I	41.4	Very low	44.7	Very low	158 Å²	158	116 Å²	116	81%	0.81	75%	0.745	S	S	*	*			trans	85.7	151.3	163.8	32.9	-177.9	0	0	0	120.1
756	P	42.8	Very low	43.6	Very low	112 Å²	112	117.1 Å²	117.1	73%	0.727	75%	0.754	S	S	*	*				-135.1	-127.2	-122.1	36.8	-10.9	0	0	0	116.8
757	P	48.9	Very low	42.4	Very low	106 Å²	106	120.5 Å²	120.5	69%	0.688	76%	0.756	S	S	*	*				-120.2	174.9	-83.6	32.9	-14.7	0	0	0	116.1
758	T	36.5	Very low	41.3	Very low	141 Å²	141	123.4 Å²	123.4	87%	0.865	75%	0.754	S	S	*	*			trans	173	163.5	130.3	29.6	0	0	0	0	113.2
759	P	45.6	Very low	40.6	Very low	125 Å²	125	127.3 Å²	127.3	81%	0.812	76%	0.758	S	S	*	*			trans	-126.2	157	-163.8	41.1	-27.6	0	0	0	118.1
760	A	36.6	Very low	40.1	Very low	102 Å²	102	125.8 Å²	125.8	84%	0.843	76%	0.756	S	S	*	*			trans	-161.7	142.5	154.6	0	0	0	0	0	115.6
761	T	37.5	Very low	39.4	Very low	132 Å²	132	127.6 Å²	127.6	81%	0.81	76%	0.758	S	S	*	*			trans	-55.6	-179.4	170.2	40.6	0	0	0	0	118.6
762	P	41.9	Very low	39.1	Very low	93 Å²	93	125.9 Å²	125.9	60%	0.604	76%	0.756	S	S	*	*			cis	-144.4	-179.3	-29.5	37.7	-18.5	0	0	0	116.8
763	H	37.2	Very low	38.8	Very low	177 Å²	177	126.5 Å²	126.5	82%	0.819	76%	0.76	S	S	*	*			trans	65.3	148.6	156.8	-65.1	-49.7	0	0	0	119
764	S	37.1	Very low	38.7	Very low	97 Å²	97	126 Å²	126	68%	0.678	76%	0.759	S	S	*	*			cis	-176.4	167.7	-10.7	-96.4	0	0	0	0	107.1
765	S	36.3	Very low	38.1	Very low	112 Å²	112	128.1 Å²	128.1	78%	0.783	76%	0.763	S	S	*	*			cis	-175.2	170.5	-17.8	60.3	0	0	0	0	106.8
766	A	36.9	Very low	37.6	Very low	94 Å²	94	126.7 Å²	126.7	78%	0.777	77%	0.767	S	S	*	*			cis	-130.6	-103.9	3.6	0	0	0	0	0	111.1
767	Q	35.2	Very low	37	Very low	153 Å²	153	126.4 Å²	126.4	72%	0.715	76%	0.763	S	S	*	*			cis	-159.7	159.3	-4.1	-159.3	-143.1	94.4	0	0	110.9
768	Q	35.8	Very low	36.1	Very low	152 Å²	152	130.7 Å²	130.7	71%	0.71	77%	0.774	S	S	*	*			trans	76.5	141.7	166.6	-117.6	175.2	89.1	0	0	119.5
769	Q	34.6	Very low	35.8	Very low	163 Å²	163	129.4 Å²	129.4	76%	0.762	77%	0.766	S	S	*	*	S	Bend	trans	74.7	145.8	-177.6	-55.8	-63.2	-19.5	0	0	117
770	P	36.4	Very low	35.1	Very low	117 Å²	117	129.3 Å²	129.3	76%	0.76	77%	0.769	S	S	*	*			trans	-101.3	157.3	-152	38.5	-37.2	0	0	0	117.5
771	I	32.7	Very low	34.9	Very low	152 Å²	152	128.7 Å²	128.7	78%	0.779	76%	0.763	S	S	*	*			trans	-145.1	133.5	-176.7	-72.2	169	0	0	0	106.2
772	P	37.9	Very low	34.4	Very low	120 Å²	120	130.3 Å²	130.3	78%	0.779	76%	0.762	S	S	*	*				-158.9	-179.4	94.4	41.9	-22.1	0	0	0	116.7
773	P	40.1	Very low	34	Very low	113 Å²	113	131.9 Å²	131.9	73%	0.734	76%	0.764	S	S	*	*			cis	-124	163.8	-31.2	30	-12.5	0	0	0	113.2
774	P	37.9	Very low	33.8	Very low	119 Å²	119	131.1 Å²	131.1	77%	0.773	76%	0.761	S	S	*	*			trans	-91	168.2	176.7	37	-35.9	0	0	0	114.4
775	L	30	Very low	33.6	Very low	153 Å²	153	134 Å²	134	80%	0.801	76%	0.763	S	S	*	*			trans	-57.2	154	165.1	-98.2	62.1	0	0	0	112.8	T777	L775-T777 HydrophobicContact CD2-CG2 4.36Å
776	S	31.9	Very low	33.4	Very low	127 Å²	127	133.6 Å²	133.6	89%	0.888	76%	0.761	S	S	*	*			trans	-122.3	125.9	150.5	-70.4	0	0	0	0	108.7
777	T	31.1	Very low	33.3	Very low	106 Å²	106	133.4 Å²	133.4	65%	0.65	76%	0.759	S	S	*	*			trans	-103	153.4	179.7	48	0	0	0	0	111.5	L775	L775-T777 HydrophobicContact CD2-CG2 4.36Å
778	Q	29.5	Very low	33.1	Very low	196 Å²	196	135 Å²	135	92%	0.916	77%	0.766	S	S	*	*			trans	-149	152.6	130.3	-118.7	173.2	61.8	0	0	110.6
779	T	29.4	Very low	32.9	Very low	114 Å²	114	136.4 Å²	136.4	70%	0.699	77%	0.773	S	S	*	*			trans	-150.6	137	-163.6	33.3	0	0	0	0	110.3
780	S	30.7	Very low	33.1	Very low	124 Å²	124	133.5 Å²	133.5	87%	0.867	77%	0.768	S	S	*	*			trans	64.6	148	152	-54.4	0	0	0	0	117.5
781	A	31.9	Very low	32.9	Very low	88 Å²	88	132.7 Å²	132.7	73%	0.727	77%	0.766	S	S	*	*			cis	-146.9	173.6	-15.2	0	0	0	0	0	107.2
782	E	28.7	Very low	32.9	Very low	167 Å²	167	131.8 Å²	131.8	78%	0.78	77%	0.767	S	S	*	*				-176.3	160.4	84.8	-103.2	-168.4	90.2	0	0	113.2
783	I	32.6	Very low	33.1	Very low	126 Å²	126	131.2 Å²	131.2	65%	0.646	76%	0.763	S	S	*	*			trans	71.8	109.2	147.2	-73.3	173.7	0	0	0	121.1
784	Q	32	Very low	32.7	Very low	161 Å²	161	132 Å²	132	75%	0.752	77%	0.765	S	S	*	*			trans	83.2	143.7	136	-81.3	-173.6	4.4	0	0	125.8
785	Q	34.2	Very low	32.4	Very low	156 Å²	156	133 Å²	133	73%	0.729	77%	0.769	S	S	*	*			trans	85.7	85.4	147.4	-77.3	174.4	50.6	0	0	121.9
786	S	32.5	Very low	32.5	Very low	105 Å²	105	133.6 Å²	133.6	73%	0.734	77%	0.77	S	S	*	*				82.5	133.8	112.7	68	0	0	0	0	122.7
787	A	34.3	Very low	32.5	Very low	89 Å²	89	135.4 Å²	135.4	74%	0.736	77%	0.768	S	S	*	*			trans	68.2	149.3	153.8	0	0	0	0	0	118.8
788	Q	31.7	Very low	32.5	Very low	186 Å²	186	134.4 Å²	134.4	87%	0.869	77%	0.771	S	S	*	*			cis	-164.6	135.3	-15.8	-114.3	179.1	3.9	0	0	108.1
789	Q	31.1	Very low	32.7	Very low	183 Å²	183	132.9 Å²	132.9	86%	0.855	77%	0.769	S	S	*	*			trans	-152.7	158	149.5	-82.3	-145.6	4.2	0	0	110.7
790	P	38.1	Very low	32.9	Very low	102 Å²	102	134.9 Å²	134.9	66%	0.662	77%	0.774	S	S	*	*			trans	-127.8	156.6	-150.1	41.2	-26.9	0	0	0	117.1
791	S	32.7	Very low	33.3	Very low	100 Å²	100	134.9 Å²	134.9	70%	0.699	77%	0.771	S	S	*	*			trans	57.5	143.2	138.1	66.1	0	0	0	0	121
792	V	33.6	Very low	33.4	Very low	133 Å²	133	135 Å²	135	81%	0.806	77%	0.771	S	S	*	*			cis	-171.2	-179	-9.2	-89.7	0	0	0	0	105.3
793	P	40.1	Very low	33.8	Very low	107 Å²	107	135.4 Å²	135.4	70%	0.695	78%	0.776	S	S	*	*			cis	-143.2	161.6	12	41.5	-20.3	0	0	0	120.6
794	V	32.7	Very low	34.1	Very low	130 Å²	130	134.5 Å²	134.5	79%	0.788	78%	0.78	S	S	*	*			trans	64.2	118	140.2	173	0	0	0	0	121.4
795	T	31.3	Very low	34.8	Very low	139 Å²	139	132.5 Å²	132.5	85%	0.853	78%	0.782	S	S	*	*				-140.9	161.2	122	-70.8	0	0	0	0	107.9
796	M	31.6	Very low	34.8	Very low	167 Å²	167	131.6 Å²	131.6	82%	0.823	79%	0.787	S	S	*	*			trans	-68.9	175.1	-174.5	-54.4	-175.3	-174.2	0	0	112.2
797	I	31.7	Very low	35	Very low	164 Å²	164	131.9 Å²	131.9	84%	0.841	79%	0.789	S	S	*	*			cis	-152.1	159.9	25.3	-52.7	166	0	0	0	107.7
798	A	31.8	Very low	35.1	Very low	86 Å²	86	132 Å²	132	71%	0.711	79%	0.79	S	S	*	*			cis	179.2	157.6	-45.2	0	0	0	0	0	106.7
799	N	33.9	Very low	35.2	Very low	163 Å²	163	131.8 Å²	131.8	87%	0.872	79%	0.789	S	S	*	*			trans	-157.3	142.4	168.2	-144	5	0	0	0	113.4
800	I	33.3	Very low	35.5	Very low	156 Å²	156	127.4 Å²	127.4	80%	0.8	78%	0.776	S	S	*	*			trans	-143.7	130	178.9	-55.2	174.4	0	0	0	109.8
801	P	40.3	Very low	35.1	Very low	124 Å²	124	130.9 Å²	130.9	81%	0.805	78%	0.784	S	S	*	*			trans	-101.1	123.5	164.4	33.4	-25.4	0	0	0	112.9
802	A	33.9	Very low	35.4	Very low	90 Å²	90	130.7 Å²	130.7	74%	0.744	78%	0.78	S	S	*	*			trans	-14.8	145.9	169.3	0	0	0	0	0	121.8
803	M	37.5	Very low	35.2	Very low	176 Å²	176	130.2 Å²	130.2	87%	0.867	78%	0.777	S	S	*	*				-154.4	103.3	117.4	-81.5	-140.8	76.7	0	0	113.4
804	S	38.7	Very low	34.9	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	78%	0.783	S	S	*	*			trans	59.2	154	145.2	-57.9	0	0	0	0	124.1
805	P	46.2	Very low	35	Very low	120 Å²	120	131.3 Å²	131.3	78%	0.779	78%	0.78	S	S	*	*			trans	-131.8	-164.8	-163.4	43.4	-24.4	0	0	0	115.1
806	T	33.9	Very low	35.5	Very low	137 Å²	137	130.4 Å²	130.4	84%	0.84	78%	0.777	S	S	*	*			trans	-142.9	149.7	159	-64.6	0	0	0	0	111.3
807	S	36.9	Very low	35.5	Very low	110 Å²	110	129.4 Å²	129.4	77%	0.769	78%	0.78	S	S	*	*			trans	-57.5	166.6	-171.9	51.6	0	0	0	0	116.7
808	A	36.8	Very low	35.6	Very low	93 Å²	93	126.7 Å²	126.7	77%	0.769	78%	0.776	S	S	*	*			cis	-144.4	150.8	18.4	0	0	0	0	0	110.7
809	Q	32.3	Very low	35.6	Very low	180 Å²	180	126.9 Å²	126.9	84%	0.841	78%	0.778	S	S	*	*			cis	105	147.1	40.1	-102.3	-135.2	-48.1	0	0	113.6
810	P	38	Very low	35.6	Very low	91 Å²	91	123.3 Å²	123.3	59%	0.591	77%	0.771	S	S	*	*				-152.8	-178.5	-111.2	45.8	-25.3	0	0	0	119.4
811	Q	29.1	Very low	35.8	Very low	175 Å²	175	122.4 Å²	122.4	82%	0.818	77%	0.772	S	S	*	*			trans	66.3	175.3	145.1	-70.2	-102.6	-15.4	0	0	118.1
812	P	40.2	Very low	36.4	Very low	96 Å²	96	121.9 Å²	121.9	62%	0.623	77%	0.769	S	S	*	*			cis	-134.8	172.4	-26.7	36.2	-17.9	0	0	0	116.6
813	V	28.9	Very low	36.7	Very low	123 Å²	123	123.3 Å²	123.3	75%	0.745	77%	0.768	S	S	*	*			trans	33.7	132.6	151.1	-58.1	0	0	0	0	124.3
814	L	34.6	Very low	37.2	Very low	156 Å²	156	120 Å²	120	82%	0.817	76%	0.76	S	S	*	*				172.9	151.8	101.5	-93.1	176.9	0	0	0	115.6
815	S	34.5	Very low	37.1	Very low	104 Å²	104	120.2 Å²	120.2	73%	0.727	76%	0.756	S	S	*	*			trans	48.3	126.6	151.9	58.4	0	0	0	0	123.2
816	P	41.9	Very low	36.7	Very low	121 Å²	121	119.9 Å²	119.9	79%	0.786	75%	0.752	S	S	*	*			trans	-107.2	154.8	162.6	38.4	-30.7	0	0	0	114.3
817	T	31.7	Very low	36.8	Very low	146 Å²	146	120.6 Å²	120.6	90%	0.896	75%	0.748	S	S	*	*			trans	167.6	150.8	131.1	-68.7	0	0	0	0	111.4
818	S	33.8	Very low	36.6	Very low	106 Å²	106	121.8 Å²	121.8	74%	0.741	74%	0.744	S	S	*	*			trans	-106.4	154.7	-168.9	-179.2	0	0	0	0	114.9
819	A	31.7	Very low	36.3	Very low	91 Å²	91	125.4 Å²	125.4	75%	0.752	75%	0.745	S	S	*	*			trans	-172.7	131.7	148.1	0	0	0	0	0	108.9
820	A	33.4	Very low	36.3	Very low	88 Å²	88	122.2 Å²	122.2	73%	0.727	74%	0.737	S	S	*	*			cis	76.2	115.4	9.3	0	0	0	0	0	117.4
821	V	38	Very low	36.3	Very low	137 Å²	137	123.6 Å²	123.6	83%	0.83	75%	0.746	S	S	*	*			trans	-155.3	139.4	177.5	-169.1	0	0	0	0	106.2
822	P	52	Low	36.2	Very low	112 Å²	112	124.9 Å²	124.9	73%	0.727	75%	0.749	S	S	*	*			cis	-122.4	-111	21.5	39.1	-21	0	0	0	115.3
823	V	39.9	Very low	36	Very low	120 Å²	120	125.5 Å²	125.5	73%	0.727	75%	0.753	S	S	*	*			trans	-156.4	178.5	-160	-64.3	0	0	0	0	108.1
824	P	48.2	Very low	35.9	Very low	107 Å²	107	125.1 Å²	125.1	70%	0.695	76%	0.756	S	S	*	*			cis	-139.4	140.1	9.4	33	-9.6	0	0	0	120
825	T	38	Very low	35.5	Very low	111 Å²	111	126.1 Å²	126.1	68%	0.681	76%	0.757	S	S	*	*				58.4	132.5	123.2	-29	0	0	0	0	118.8
826	T	37.8	Very low	35.3	Very low	113 Å²	113	128.5 Å²	128.5	69%	0.693	76%	0.76	S	S	*	*				-173.5	114.3	64.1	-51.2	0	0	0	0	114.6
827	M	34.9	Very low	34.8	Very low	152 Å²	152	128.1 Å²	128.1	75%	0.749	76%	0.757	S	S	*	*			trans	59	155.8	143.7	-52.4	-56.2	-175.7	0	0	121.4
828	I	33.2	Very low	34.8	Very low	136 Å²	136	127.4 Å²	127.4	70%	0.697	75%	0.753	S	S	*	*			cis	-162.3	150.5	-10.6	-114.5	168.3	0	0	0	112.1
829	H	29.8	Very low	34.7	Very low	168 Å²	168	131.1 Å²	131.1	78%	0.778	76%	0.758	S	S	*	*			trans	59.2	161.4	160.7	-98.2	34.1	0	0	0	121.7
830	V	33.4	Very low	34.5	Very low	113 Å²	113	134.1 Å²	134.1	69%	0.685	76%	0.762	S	S	*	*			cis	-173.6	153.1	-49.9	124.7	0	0	0	0	109.4
831	P	37.2	Very low	34.3	Very low	120 Å²	120	136.4 Å²	136.4	78%	0.779	77%	0.766	S	S	*	*			trans	-105	163.8	-166.1	39.5	-36.9	0	0	0	116.7
832	K	27.2	Very low	33.8	Very low	202 Å²	202	134 Å²	134	88%	0.878	76%	0.761	S	S	*	*			trans	-159.3	147.7	147	-158	164.7	-176	177.6	0	113
833	P	35.8	Very low	32.6	Very low	109 Å²	109	134.7 Å²	134.7	71%	0.708	76%	0.763	S	S	*	*			trans	-107.4	-174.9	179.5	41.5	-36.5	0	0	0	114.9
834	S	27.8	Very low	32.3	Very low	115 Å²	115	135 Å²	135	80%	0.804	77%	0.765	S	S	*	*			trans	91.3	158.1	158.8	-57.3	0	0	0	0	119.6
835	E	25.1	Very low	31.8	Very low	177 Å²	177	134.1 Å²	134.1	83%	0.827	77%	0.767	S	S	*	*			trans	-65.5	159.9	-164.9	-56.3	157.7	93.8	0	0	116.4
836	I	29.5	Very low	31.3	Very low	154 Å²	154	133.1 Å²	133.1	79%	0.79	77%	0.77	S	S	*	*				-163.2	135.1	117.7	-95.3	150.7	0	0	0	109.2	V838	I836-V838 HydrophobicContact CG2-CG2 4.38Å
837	P	33.2	Very low	31.4	Very low	114 Å²	114	133.2 Å²	133.2	74%	0.74	77%	0.773	S	S	*	*			trans	-92.4	151	173.5	35.8	-33.6	0	0	0	112.9
838	V	30.3	Very low	31	Very low	131 Å²	131	132.9 Å²	132.9	79%	0.794	78%	0.779	S	S	*	*			trans	-142.2	154.6	166.5	-154	0	0	0	0	109.9	I836	I836-V838 HydrophobicContact CG2-CG2 4.38Å
839	Q	31.2	Very low	31	Very low	184 Å²	184	131.4 Å²	131.4	86%	0.86	79%	0.787	S	S	*	*			trans	-82.7	158	-168.8	-63.4	144.3	-73.8	0	0	114.6
840	N	28.3	Very low	31.1	Very low	154 Å²	154	127.7 Å²	127.7	82%	0.824	79%	0.785	S	S	*	*			trans	-73.4	154.1	160.7	-75.3	-17	0	0	0	111.5
841	V	29.5	Very low	30.9	Very low	135 Å²	135	129.1 Å²	129.1	82%	0.818	79%	0.789	S	S	*	*				162	121.3	112.7	160.8	0	0	0	0	111.6
842	A	27.2	Very low	30.4	Very low	87 Å²	87	130.9 Å²	130.9	72%	0.719	79%	0.792	S	S	*	*			trans	59.1	162.6	161.6	0	0	0	0	0	117.9
843	T	27.4	Very low	30.8	Very low	127 Å²	127	127.4 Å²	127.4	78%	0.779	79%	0.787	S	S	*	*			cis	-137.2	-163.8	-8	-16.4	0	0	0	0	107.1
844	T	32.5	Very low	31.1	Very low	126 Å²	126	127.7 Å²	127.7	77%	0.773	79%	0.789	S	S	*	*			cis	-160	-179	17.4	-21.2	0	0	0	0	109.6
845	A	38.9	Very low	31.7	Very low	88 Å²	88	127.4 Å²	127.4	73%	0.727	79%	0.785	S	S	*	*			trans	33.8	123.2	150.5	0	0	0	0	0	120.1
846	A	26.1	Very low	31.8	Very low	91 Å²	91	124 Å²	124	75%	0.752	78%	0.781	S	S	*	*			cis	64.7	142.4	9.3	0	0	0	0	0	117.6
847	P	40.3	Very low	32.2	Very low	115 Å²	115	122.8 Å²	122.8	75%	0.747	78%	0.783	S	S	*	*			cis	-145.2	179.2	-29.1	38.1	-17.9	0	0	0	116.5
848	V	27.9	Very low	32.1	Very low	145 Å²	145	121.7 Å²	121.7	88%	0.879	78%	0.783	S	S	*	*			trans	68.6	102.2	161.1	-158.5	0	0	0	0	120.8
849	A	31.6	Very low	32.7	Very low	105 Å²	105	121.1 Å²	121.1	87%	0.868	78%	0.782	S	S	*	*			trans	-156.5	166.6	141.7	0	0	0	0	0	108.9
850	A	32.5	Very low	32.6	Very low	90 Å²	90	121.3 Å²	121.3	74%	0.744	78%	0.781	S	S	*	*			trans	-117.2	159.5	-159.8	0	0	0	0	0	117.2
851	N	29.5	Very low	32.6	Very low	143 Å²	143	123.4 Å²	123.4	77%	0.765	78%	0.782	S	S	*	*			trans	57.6	107.4	159.8	-64.3	-0.1	0	0	0	120
852	N	27.1	Very low	32.8	Very low	157 Å²	157	122.8 Å²	122.8	84%	0.84	78%	0.779	S	S	*	*				-175.8	174.9	95.1	-102	-14.3	0	0	0	114.6
853	V	34.6	Very low	32.8	Very low	128 Å²	128	126.6 Å²	126.6	78%	0.776	78%	0.782	S	S	*	*			trans	-148.9	158.5	-174	179.3	0	0	0	0	106.3
854	P	43.1	Very low	32.9	Very low	115 Å²	115	127.4 Å²	127.4	75%	0.747	78%	0.781	S	S	*	*			cis	-113.9	-107	-12	21.4	3	0	0	0	115.4
855	P	39.9	Very low	32.9	Very low	109 Å²	109	127.5 Å²	127.5	71%	0.708	78%	0.776	S	S	*	*				-126.6	174.7	-114.5	40.1	-22.8	0	0	0	117.2
856	S	27.6	Very low	32.4	Very low	107 Å²	107	131.2 Å²	131.2	75%	0.748	78%	0.778	S	S	*	*			trans	71.6	132.1	166.1	-160.8	0	0	0	0	117
857	P	37.9	Very low	32.6	Very low	128 Å²	128	133 Å²	133	83%	0.831	78%	0.78	S	S	*	*			trans	-76.8	138.5	172.2	31.9	-33.4	0	0	0	111.4
858	A	30.8	Very low	32.6	Very low	91 Å²	91	133 Å²	133	75%	0.752	78%	0.779	S	S	*	*			trans	-131.5	146.6	171.2	0	0	0	0	0	110.4
859	P	42.1	Very low	32.7	Very low	118 Å²	118	132 Å²	132	77%	0.766	77%	0.774	S	S	*	*			trans	-90.1	109.5	-177.8	32.9	-32.5	0	0	0	114
860	F	29.5	Very low	32.7	Very low	189 Å²	189	135.2 Å²	135.2	83%	0.829	78%	0.776	S	S	*	*			trans	35.3	120.1	143.9	-53.5	-83.6	0	0	0	121.6
861	K	28.4	Very low	32.7	Very low	198 Å²	198	135.1 Å²	135.1	86%	0.861	78%	0.775	S	S	*	*				176.7	136.1	97	-100.8	-176	178.5	178.5	0	117.5
862	T	33	Very low	32.8	Very low	121 Å²	121	136.8 Å²	136.8	74%	0.742	78%	0.778	S	S	*	*			trans	73.4	164.1	145.3	-40.8	0	0	0	0	119.9
863	E	28.2	Very low	32.9	Very low	168 Å²	168	136.1 Å²	136.1	79%	0.785	78%	0.775	S	S	*	*			trans	-102.9	152.9	-152.3	-58.2	136.1	116.9	0	0	115.3
864	D	29.7	Very low	32.8	Very low	143 Å²	143	135.5 Å²	135.5	77%	0.765	77%	0.771	S	S	*	*				-179.8	147.2	101.9	-122.4	-22.4	0	0	0	117.1
865	I	32.3	Very low	32.1	Very low	128 Å²	128	136.1 Å²	136.1	66%	0.656	77%	0.773	S	S	*	*			trans	45.1	113.6	147.7	-72.7	161.4	0	0	0	124.9
866	Q	28.5	Very low	31.6	Very low	166 Å²	166	136.3 Å²	136.3	78%	0.776	77%	0.774	S	S	*	*			trans	74.6	127.9	135.5	-68.6	-178.4	12.1	0	0	127.5
867	T	29.8	Very low	31.7	Very low	130 Å²	130	143.1 Å²	143.1	80%	0.798	78%	0.783	S	S	*	*			trans	76	150.9	140.2	53.9	0	0	0	0	124.6
868	P	40.6	Very low	31.2	Very low	113 Å²	113	143.2 Å²	143.2	73%	0.734	78%	0.781	S	S	*	*			trans	-141.1	-170.5	-152.2	40.1	-17.6	0	0	0	118.6
869	T	29.5	Very low	31.2	Very low	124 Å²	124	146.8 Å²	146.8	76%	0.761	79%	0.786	S	S	*	*			trans	106.3	110.2	148.9	-29.4	0	0	0	0	120.2
870	L	32.1	Very low	30.4	Very low	173 Å²	173	144.6 Å²	144.6	91%	0.906	77%	0.774	S	S	*	*				-167.8	-172.8	121.6	-140.5	71	0	0	0	111
871	A	32.6	Very low	31.2	Very low	88 Å²	88	142.1 Å²	142.1	73%	0.727	77%	0.774	S	S	*	*			trans	-146.4	177.3	-159.1	0	0	0	0	0	116.6
872	Q	31.4	Very low	31.7	Very low	179 Å²	179	138 Å²	138	84%	0.836	76%	0.762	S	S	*	*			trans	94.3	106.2	162.2	-64.7	-164.5	-2.3	0	0	121.5
873	N	30	Very low	31.6	Very low	143 Å²	143	136.9 Å²	136.9	77%	0.765	77%	0.765	S	S	*	*				81.8	127	121.2	-86.5	2.4	0	0	0	125.7
874	T	31.1	Very low	31.7	Very low	114 Å²	114	134.4 Å²	134.4	70%	0.699	77%	0.766	S	S	*	*			trans	92.2	93.9	133.4	-55.6	0	0	0	0	121
875	V	29.4	Very low	31.8	Very low	129 Å²	129	130.8 Å²	130.8	78%	0.782	76%	0.763	S	S	*	*			trans	55.7	113.6	135.4	-173.8	0	0	0	0	119.6
876	P	29.5	Very low	31.7	Very low	113 Å²	113	132.8 Å²	132.8	73%	0.734	77%	0.774	S	S	*	*			trans	-94.8	159.1	167.1	37.9	-33.5	0	0	0	113
877	R	29.9	Very low	31.9	Very low	250 Å²	250	130.4 Å²	130.4	94%	0.943	77%	0.77	S	S	*	*			trans	-167.5	97.6	141.9	-114.2	178	-171.3	-161	2	113.8
878	T	26.3	Very low	31.9	Very low	129 Å²	129	131 Å²	131	79%	0.791	77%	0.767	S	S	*	*			trans	-147.2	119.8	153.4	13.5	0	0	0	0	107.5
879	I	32.2	Very low	31.2	Very low	166 Å²	166	132.1 Å²	132.1	85%	0.851	77%	0.767	S	S	*	*			trans	-131.1	82.2	157	-54.5	-179.6	0	0	0	106.4
880	S	25.2	Very low	31.1	Very low	73 Å²	73	132.5 Å²	132.5	51%	0.51	77%	0.769	S	S	.	*				-124	144.5	129.3	-74.8	0	0	0	0	104.8	D882	S880-D882 WeakPolarHBondContact CB-OD1 3.22Å; S880-D882 WeakPolarHBondContact CB-OD2 3.49Å
881	T	45.7	Very low	31.2	Very low	136 Å²	136	130 Å²	130	83%	0.834	76%	0.763	S	S	*	*			cis	74.1	21.4	-5.2	141.4	0	0	0	0	113
882	D	38.2	Very low	31	Very low	112 Å²	112	130.8 Å²	130.8	60%	0.599	77%	0.77	S	S	*	*			cis	36.2	107	35.9	-52.6	-28.8	0	0	0	114	S880 S884	S880-D882 WeakPolarHBondContact CB-OD1 3.22Å; S880-D882 WeakPolarHBondContact CB-OD2 3.49Å; D882-S884 PolarHBondContact O-N 3.26Å
883	A	30.8	Very low	30.8	Very low	97 Å²	97	127.6 Å²	127.6	80%	0.802	77%	0.767	S	S	*	*	S	Bend	trans	-69	114.7	166.5	0	0	0	0	0	110.3
884	S	31.9	Very low	30.6	Very low	116 Å²	116	128.2 Å²	128.2	81%	0.811	77%	0.769	S	S	*	*			trans	57	90.1	131.7	-52.5	0	0	0	0	119.2	D882	D882-S884 PolarHBondContact O-N 3.26Å
885	G	30.5	Very low	30.4	Very low	68 Å²	68	127.2 Å²	127.2	70%	0.701	77%	0.772	S	S	*	*				92.4	146.6	102.5	0	0	0	0	0	120.5
886	L	30.9	Very low	30.4	Very low	170 Å²	170	126.9 Å²	126.9	89%	0.89	78%	0.776	S	S	*	*			trans	67.8	160	166.5	-76.3	81.6	0	0	0	117.8
887	V	32	Very low	30.6	Very low	115 Å²	115	127.5 Å²	127.5	70%	0.697	78%	0.78	S	S	*	*			cis	-175.6	133.3	-47.3	125.6	0	0	0	0	108
888	I	30.7	Very low	30.5	Very low	144 Å²	144	121.2 Å²	121.2	74%	0.738	77%	0.774	S	S	*	*			trans	60.6	117.1	160.1	-65.2	170.7	0	0	0	119.7
889	N	26.3	Very low	31	Very low	135 Å²	135	120.7 Å²	120.7	72%	0.722	77%	0.773	S	S	*	*			trans	24.9	143.5	139.2	-54.9	-9.7	0	0	0	123.6
890	T	27.5	Very low	30.9	Very low	133 Å²	133	116.6 Å²	116.6	82%	0.816	76%	0.764	S	S	*	*			trans	68.3	158.5	145.4	44.9	0	0	0	0	119.7
891	P	32.3	Very low	31.6	Very low	119 Å²	119	119.5 Å²	119.5	77%	0.773	78%	0.781	S	S	*	*			cis	-122.1	175.9	-19.7	33.7	-16.4	0	0	0	112.8
892	A	28.4	Very low	31	Very low	106 Å²	106	118 Å²	118	88%	0.876	78%	0.776	S	S	*	*			trans	-82.7	122.8	177.9	0	0	0	0	0	113.1
893	S	27.4	Very low	30.9	Very low	111 Å²	111	117.2 Å²	117.2	78%	0.776	79%	0.785	S	S	*	*			trans	-168.3	161.5	131.7	-162.3	0	0	0	0	110.7
894	I	25.4	Very low	31.2	Very low	157 Å²	157	118.2 Å²	118.2	81%	0.805	78%	0.781	S	S	*	*	S	Bend	trans	70.9	114.7	177.1	-53	176.4	0	0	0	115.3
895	A	28.2	Very low	31.1	Very low	93 Å²	93	119.6 Å²	119.6	77%	0.769	78%	0.78	S	S	*	*			trans	27.8	113.4	157.1	0	0	0	0	0	120
896	S	29.2	Very low	31.3	Very low	122 Å²	122	122.4 Å²	122.4	85%	0.853	78%	0.783	S	S	*	*			trans	-150.2	154.5	155.7	-81.3	0	0	0	0	111.6
897	P	34.3	Very low	31.5	Very low	126 Å²	126	118.9 Å²	118.9	82%	0.818	78%	0.778	S	S	*	*			trans	-122.9	178.9	-149.3	31.5	-11.5	0	0	0	115.6
898	S	26.5	Very low	31.5	Very low	117 Å²	117	118.5 Å²	118.5	82%	0.818	78%	0.781	S	S	*	*			trans	-146.8	175.4	170.2	-128.1	0	0	0	0	109.2
899	P	36.6	Very low	31.6	Very low	119 Å²	119	117.4 Å²	117.4	77%	0.773	78%	0.781	S	S	*	*				-115.5	171	-113.6	39.3	-27.9	0	0	0	115.5
900	A	30	Very low	32	Very low	79 Å²	79	117.2 Å²	117.2	65%	0.653	79%	0.785	S	S	*	*			trans	-144.5	159.5	165	0	0	0	0	0	107.8
901	P	40.3	Very low	31.9	Very low	135 Å²	135	115 Å²	115	88%	0.877	78%	0.78	S	S	*	*				-106.1	161.2	55.4	35.9	-37.1	0	0	0	115.2
902	S	33.5	Very low	32.4	Very low	104 Å²	104	115 Å²	115	73%	0.727	78%	0.78	S	S	*	*			trans	-142.2	140.1	-179.1	-45.6	0	0	0	0	110.1
903	A	36	Very low	32.6	Very low	96 Å²	96	115.9 Å²	115.9	79%	0.793	77%	0.774	S	S	*	*			trans	-170.4	144.7	154.7	0	0	0	0	0	110.8
904	T	37.9	Very low	32.6	Very low	118 Å²	118	116.6 Å²	116.6	72%	0.724	77%	0.774	S	S	*	*				-159.8	148.9	-57	7.2	0	0	0	0	108.2
905	D	29.5	Very low	33.5	Very low	144 Å²	144	114.5 Å²	114.5	77%	0.77	77%	0.771	S	S	*	*			trans	153.6	137.5	137.3	-84.6	-1.5	0	0	0	111.3
906	V	34.2	Very low	33.7	Very low	128 Å²	128	114.7 Å²	114.7	78%	0.776	77%	0.772	S	S	*	*			cis	-167.8	160.9	-37.1	-98	0	0	0	0	104.6
907	A	34.9	Very low	34.4	Very low	95 Å²	95	114.1 Å²	114.1	79%	0.785	77%	0.766	S	S	*	*			cis	-171.1	171.6	-28	0	0	0	0	0	104.9
908	S	33.1	Very low	34.2	Very low	107 Å²	107	114.7 Å²	114.7	75%	0.748	77%	0.767	S	S	*	*			cis	-159.4	-156.1	4.5	-165.2	0	0	0	0	107.4
909	T	32.8	Very low	34.9	Very low	121 Å²	121	114.2 Å²	114.2	74%	0.742	76%	0.761	S	S	*	*			trans	72	130.2	151.6	-64	0	0	0	0	117.6
910	T	33.5	Very low	34.5	Very low	131 Å²	131	114.7 Å²	114.7	80%	0.804	76%	0.762	S	S	*	*			cis	-153.7	171.3	-8	15.5	0	0	0	0	110.9
911	A	25.6	Very low	34.6	Very low	87 Å²	87	116.9 Å²	116.9	72%	0.719	77%	0.767	S	S	*	*			trans	-157.8	-163.4	173.5	0	0	0	0	0	107.7
912	P	42.3	Very low	34.2	Very low	120 Å²	120	115.9 Å²	115.9	78%	0.779	76%	0.759	S	S	*	*			cis	-110.2	-142.2	-13.4	17	9.2	0	0	0	112.4
913	V	32.7	Very low	34.1	Very low	124 Å²	124	116.2 Å²	116.2	75%	0.752	76%	0.757	S	S	*	*			cis	-154.7	-162.5	17.1	-141.5	0	0	0	0	113.2
914	T	28.7	Very low	33.8	Very low	125 Å²	125	119 Å²	119	77%	0.767	76%	0.758	S	S	*	*			trans	-155.5	-173.8	-164.9	43.9	0	0	0	0	111
915	P	42.6	Very low	33.4	Very low	113 Å²	113	117.2 Å²	117.2	73%	0.734	76%	0.763	S	S	*	*				-141.1	159.5	-52.7	39.6	-22.1	0	0	0	118.5
916	A	33.8	Very low	33.4	Very low	98 Å²	98	113.6 Å²	113.6	81%	0.81	76%	0.76	S	S	*	*			trans	60.8	172.9	149.9	0	0	0	0	0	122
917	P	42.8	Very low	33.1	Very low	109 Å²	109	112.6 Å²	112.6	71%	0.708	77%	0.766	S	S	*	*			cis	-141.9	152.4	-6.7	40.8	-21	0	0	0	120.6
918	T	31.6	Very low	32.9	Very low	139 Å²	139	112.7 Å²	112.7	85%	0.853	77%	0.766	S	S	*	*			trans	55.8	167	148.1	50.9	0	0	0	0	123.5
919	P	40	Very low	32.8	Very low	107 Å²	107	111.9 Å²	111.9	70%	0.695	77%	0.766	S	S	*	*			cis	-135.4	179.1	-0	43.4	-25.8	0	0	0	118.8
920	T	28.7	Very low	32.6	Very low	129 Å²	129	110.9 Å²	110.9	79%	0.791	77%	0.77	S	S	*	*			trans	65.9	146.7	161.1	47.8	0	0	0	0	119.8
921	T	32.8	Very low	32.3	Very low	124 Å²	124	109.4 Å²	109.4	76%	0.761	77%	0.765	S	S	*	*			cis	-153.8	159.4	14.6	-21.7	0	0	0	0	114.2
922	T	30.1	Very low	32.4	Very low	114 Å²	114	111 Å²	111	70%	0.699	77%	0.766	S	S	*	*			trans	86.6	113.9	149.7	-47.8	0	0	0	0	121.4
923	T	31.8	Very low	31.6	Very low	111 Å²	111	111.2 Å²	111.2	68%	0.681	77%	0.765	S	S	*	*			trans	45.9	130.8	158	60.5	0	0	0	0	121.1
924	D	30.1	Very low	31.5	Very low	154 Å²	154	111.2 Å²	111.2	82%	0.824	77%	0.766	S	S	*	*			cis	-156.9	148.8	-13.9	-84.8	-40.8	0	0	0	106.1
925	G	30.4	Very low	31.3	Very low	81 Å²	81	112.4 Å²	112.4	84%	0.835	76%	0.762	S	S	*	*			cis	123.1	112.4	6.2	0	0	0	0	0	110.6
926	G	28.9	Very low	30.6	Very low	68 Å²	68	114.8 Å²	114.8	70%	0.701	77%	0.769	S	S	*	*			cis	-145.1	163.1	-10.3	0	0	0	0	0	109.2
927	A	28.6	Very low	30.5	Very low	108 Å²	108	119.9 Å²	119.9	89%	0.893	77%	0.773	S	S	*	*				58.9	134.7	61.7	0	0	0	0	0	112.6
928	A	29.9	Very low	29.8	Very low	96 Å²	96	123.5 Å²	123.5	79%	0.793	78%	0.78	S	S	*	*			cis	-173	173.4	2	0	0	0	0	0	108
929	A	30.1	Very low	29.6	Very low	91 Å²	91	124.4 Å²	124.4	75%	0.752	78%	0.775	S	S	*	*			cis	-172.8	175.8	-25.7	0	0	0	0	0	108.4
930	A	29.5	Very low	28.9	Very low	99 Å²	99	128.9 Å²	128.9	82%	0.818	78%	0.783	S	S	*	*			trans	67.2	145.9	161.9	0	0	0	0	0	118.4
931	S	27.4	Very low	29.1	Very low	100 Å²	100	133.4 Å²	133.4	70%	0.699	79%	0.786	S	S	*	*			cis	-160.7	159.1	-8.3	42.8	0	0	0	0	113.2
932	T	26.8	Very low	29	Very low	121 Å²	121	137 Å²	137	74%	0.742	79%	0.791	S	S	*	*			trans	70.5	134.4	151	41.1	0	0	0	0	122.1
933	T	26.3	Very low	29.1	Very low	124 Å²	124	134.9 Å²	134.9	76%	0.761	78%	0.781	S	S	*	*			trans	82.9	138	145.8	38.7	0	0	0	0	123.2
934	T	29.9	Very low	29.4	Very low	124 Å²	124	136.1 Å²	136.1	76%	0.761	78%	0.783	S	S	*	*			trans	68.7	97.6	155.2	44.5	0	0	0	0	120.3
935	E	25.9	Very low	30.1	Very low	150 Å²	150	132.9 Å²	132.9	70%	0.701	76%	0.762	S	S	*	*			trans	-4.6	115.6	138.9	-60.6	176.7	164.5	0	0	116	R1532	E935-R1532 IonicContact OE1-CZ 3.79Å; E935-R1532 IonicContact OE1-NH1 2.63Å; E935-R1532 PolarHBondContact OE1-NH1 3.04Å; E935-R1532 IonicContact OE1-NH2 2.68Å; E935-R1532 PolarHBondContact OE1-NH2 3.3Å
936	N	26.7	Very low	31.9	Very low	163 Å²	163	134.5 Å²	134.5	87%	0.872	74%	0.743	S	S	*	*			trans	-136.1	110.8	157.2	-109.1	-45.3	0	0	0	108.8
937	K	32.2	Very low	34.4	Very low	206 Å²	206	136.8 Å²	136.8	90%	0.896	73%	0.734	S	S	*	*			trans	-102.9	113.1	169.7	-167.7	169.8	-174.7	173.1	0	107.7	E939	K937-E939 PolarHBondContact O-N 2.9Å; K937-E939 VanDerWaalsContact O-N 3.14Å
938	E	27.6	Very low	37.4	Very low	184 Å²	184	131.7 Å²	131.7	86%	0.86	69%	0.691	S	S	*	*			trans	-68.1	106.7	-160.8	-166.2	-176.7	146.6	0	0	113.4
939	E	27.8	Very low	40.4	Very low	159 Å²	159	128.1 Å²	128.1	74%	0.743	66%	0.66	S	S	*	*			trans	-93.1	115.3	167.7	-169.5	-178.9	-135.9	0	0	110	K937 R941	K937-E939 PolarHBondContact O-N 2.9Å; K937-E939 VanDerWaalsContact O-N 3.14Å; E939-R941 PolarHBondContact O-N 3.48Å
940	K	26.1	Very low	43.4	Very low	200 Å²	200	123.9 Å²	123.9	87%	0.87	62%	0.624	S	S	*	*			trans	-69.6	78.3	-168.1	-167.8	170.9	-175.1	168.1	0	113.5	K942	K940-K942 PolarHBondContact O-N 3.48Å
941	R	31.3	Very low	46.6	Very low	225 Å²	225	120.5 Å²	120.5	85%	0.849	59%	0.592	S	S	*	*			trans	-68	114.6	-177.8	-76.8	-176.6	169.4	-174.7	-2.4	113.3	E939	E939-R941 PolarHBondContact O-N 3.48Å
942	K	31	Very low	49.7	Very low	200 Å²	200	115.9 Å²	115.9	87%	0.87	56%	0.559	S	S	*	*			trans	-78.3	123	171.5	-162.4	169.8	-174.8	174.5	0	110	K940 N944	K940-K942 PolarHBondContact O-N 3.48Å; K942-N944 PolarHBondContact O-N 3.44Å
943	S	32.5	Very low	52.8	Low	69 Å²	69	113.7 Å²	113.7	48%	0.483	54%	0.542	S	S	.	.			trans	-76.6	114.9	-175.7	-173.9	0	0	0	0	112.3
944	N	38	Very low	55.8	Low	136 Å²	136	108.8 Å²	108.8	73%	0.727	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-100.8	117.7	164.3	-85.7	2.8	0	0	0	109	K942 R946	K942-N944 PolarHBondContact O-N 3.44Å; N944-R946 PolarHBondContact O-N 3.22Å
945	K	45.8	Very low	58.4	Low	87 Å²	87	104.4 Å²	104.4	38%	0.378	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-59.3	130.6	172.1	-62.7	-166.1	-173.9	-148.1	0	109.8	W84 V1033 D1035	W84-K945 HydrophobicContact CH2-CG 4.44Å; W84-K945 HydrophobicContact CZ2-CD 4.04Å; W84-K945 HydrophobicContact CZ2-CG 4Å; K945-V1033 HydrophobicContact CB-CG1 4.19Å; K945-V1033 HydrophobicContact CD-CG1 4.29Å; K945-D1035 VanDerWaalsContact CD-OD1 3.32Å; K945-D1035 WeakPolarHBondContact CD-OD1 3.24Å; K945-D1035 WeakPolarHBondContact CE-OD1 3.41Å; K945-D1035 IonicContact NZ-OD1 3.42Å; K945-D1035 PolarHBondContact NZ-OD1 2.68Å; K945-D1035 IonicContact NZ-OD2 2.84Å; K945-D1035 PolarHBondContact NZ-OD2 2.71Å
946	R	67.3	Low	60.8	Low	115 Å²	115	100.7 Å²	100.7	43%	0.434	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	126	-177.3	-60.6	-177.5	-172.5	-179.9	1.4	109.7	N944 L1034	N944-R946 PolarHBondContact O-N 3.22Å; R946-L1034 HydrophobicContact CB-CB 4.32Å; R946-L1034 HydrophobicContact CB-CD1 4.06Å; R946-L1034 PolarHBondContact O-N 2.83Å
947	K	82.8	Confident	62.8	Low	116 Å²	116	97.9 Å²	97.9	50%	0.504	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	138.4	174.6	-165.3	179.1	-174.4	-174.6	0	109.6	V949 T1032 V1033	K947-V949 HydrophobicContact CD-CG2 3.87Å; K947-V949 HydrophobicContact CG-CG2 3.87Å; K947-T1032 WeakPolarHBondContact CA-O 3.07Å; K947-V1033 HydrophobicContact CG-CG2 4.11Å
948	V	90.1	Very high	63.9	Low	0 Å²	0	92.7 Å²	92.7	0%	0	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	128.1	169.9	-178.7	0	0	0	0	107.1	L968 H1003 I1006 V1007 Q1010 T1032	V948-L968 HydrophobicContact CG1-CD1 3.68Å; V948-H1003 HydrophobicContact CG2-CB 4.46Å; V948-I1006 HydrophobicContact CB-CG2 4.12Å; V948-I1006 HydrophobicContact CG1-CG2 4.2Å; V948-V1007 HydrophobicContact CG1-CG2 4.17Å; V948-Q1010 PolarHBondContact O-NE2 2.82Å; V948-T1032 PolarHBondContact N-O 2.98Å; V948-T1032 PolarHBondContact O-N 2.96Å
949	V	93.2	Very high	65	Low	22 Å²	22	92.1 Å²	92.1	13%	0.133	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	133.8	-178.1	-175	0	0	0	0	109.7	K947 L968 D969 L1030 A1031	K947-V949 HydrophobicContact CD-CG2 3.87Å; K947-V949 HydrophobicContact CG-CG2 3.87Å; V949-L968 CarbonylContact O-C 3.43Å; V949-L968 WeakPolarHBondContact O-CA 3.42Å; V949-D969 HydrophobicContact CB-CB 4.42Å; V949-D969 PolarHBondContact N-O 2.93Å; V949-D969 PolarHBondContact O-N 3Å; V949-L1030 CarbonylContact C-O 3.58Å; V949-L1030 VanDerWaalsContact CA-O 3.32Å; V949-L1030 WeakPolarHBondContact CA-O 3.45Å; V949-A1031 HydrophobicContact CG2-CB 4.19Å
950	M	94.2	Very high	66.2	Low	2 Å²	2	92.3 Å²	92.3	1%	0.01	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	136.5	172.9	-165	178.4	-61.2	0	0	109.6	C966 R967 L968 V1007 Q1010 L1011 V1014 K1029 L1030	M950-C966 HydrophobicContact CG-CB 4.31Å; M950-R967 CarbonylContact C-O 3.46Å; M950-R967 VanDerWaalsContact CA-O 3.31Å; M950-R967 WeakPolarHBondContact CA-O 3.36Å; M950-L968 HydrophobicContact CE-CD1 4.22Å; M950-V1007 HydrophobicContact CE-CB 4.44Å; M950-V1007 HydrophobicContact CE-CG1 3.87Å; M950-V1007 HydrophobicContact CE-CG2 4.47Å; M950-Q1010 HydrophobicContact CB-CB 4.5Å; M950-Q1010 HydrophobicContact CE-CB 3.67Å; M950-Q1010 HydrophobicContact SD-CB 4.13Å; M950-L1011 HydrophobicContact CE-CG 4.04Å; M950-L1011 HydrophobicContact SD-CD2 4.24Å; M950-L1011 HydrophobicContact SD-CG 4.21Å; M950-V1014 HydrophobicContact SD-CG2 3.97Å; M950-K1029 CarbonylContact O-C 3.53Å; M950-K1029 WeakPolarHBondContact O-CA 3.38Å; M950-L1030 PolarHBondContact N-O 2.87Å; M950-L1030 PolarHBondContact O-N 2.84Å
951	E	94.8	Very high	67.6	Low	28 Å²	28	89.9 Å²	89.9	13%	0.131	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	126.5	-179.4	-179.4	169.5	-160	0	0	110	L953 C966 R967 T1028 K1029	E951-L953 HydrophobicContact CG-CD2 4.14Å; E951-L953 PolarHBondContact O-N 2.76Å; E951-C966 CarbonylContact O-C 3.55Å; E951-C966 VanDerWaalsContact O-CA 3.25Å; E951-C966 WeakPolarHBondContact O-CA 3.46Å; E951-R967 PolarHBondContact N-O 3.04Å; E951-R967 PolarHBondContact O-N 2.84Å; E951-R967 IonicContact OE2-CZ 3.57Å; E951-R967 IonicContact OE2-NH1 3.71Å; E951-R967 PolarHBondContact OE2-NH1 2.85Å; E951-R967 IonicContact OE2-NH2 3.78Å; E951-R967 PolarHBondContact OE2-NH2 2.98Å; E951-T1028 WeakPolarHBondContact CA-O 3.48Å; E951-K1029 HydrophobicContact CB-CG 4.01Å; E951-K1029 VanDerWaalsContact CD-CE 3.41Å; E951-K1029 HydrophobicContact CG-CG 3.93Å; E951-K1029 IonicContact OE1-NZ 3.99Å; E951-K1029 PolarHBondContact OE1-NZ 3.48Å; E951-K1029 WeakPolarHBondContact OE2-CE 3.4Å; E951-K1029 IonicContact OE2-NZ 3.69Å; E951-K1029 PolarHBondContact OE2-NZ 2.68Å
952	I	93.9	Very high	69.6	Low	2 Å²	2	81.1 Å²	81.1	1%	0.01	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	115.6	173.4	-56	171.3	0	0	0	108.1	V1014 L1017 I1018 G1025 G1027 T1028	I952-V1014 HydrophobicContact CD1-CB 4.36Å; I952-V1014 HydrophobicContact CD1-CG1 3.89Å; I952-V1014 HydrophobicContact CD1-CG2 4.04Å; I952-V1014 HydrophobicContact CG1-CG1 3.96Å; I952-V1014 HydrophobicContact CG1-CG2 3.96Å; I952-L1017 HydrophobicContact CD1-CD2 3.91Å; I952-I1018 HydrophobicContact CD1-CD1 4.25Å; I952-I1018 HydrophobicContact CD1-CG1 4.49Å; I952-I1018 HydrophobicContact CG2-CD1 4.15Å; I952-G1025 WeakPolarHBondContact CD1-O 3.28Å; I952-G1027 WeakPolarHBondContact O-CA 3.35Å; I952-G1027 PolarHBondContact O-N 2.81Å; I952-T1028 PolarHBondContact N-O 2.9Å; I952-T1028 VanDerWaalsContact N-O 3.13Å
953	L	91.6	Very high	72.3	Confident	76 Å²	76	73.7 Å²	73.7	40%	0.398	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-29.2	-178.1	-60.9	-176.5	0	0	0	113.2	E951 S965 R967 T976	E951-L953 HydrophobicContact CG-CD2 4.14Å; E951-L953 PolarHBondContact O-N 2.76Å; L953-S965 PolarHBondContact N-O 2.71Å; L953-R967 HydrophobicContact CD1-CB 4.18Å; L953-R967 HydrophobicContact CD2-CB 4.31Å; L953-R967 HydrophobicContact CG-CB 4.34Å; L953-T976 HydrophobicContact CD1-CG2 3.53Å
954	G	88.3	Confident	75	Confident	21 Å²	21	70.4 Å²	70.4	22%	0.216	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	176.7	162.6	-178.7	0	0	0	0	0	112.5	S965	G954-S965 PolarHBondContact N-O 2.83Å; G954-S965 PolarHBondContact O-N 2.95Å
955	C	84.7	Confident	77.6	Confident	32 Å²	32	65 Å²	65	22%	0.216	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	125	169.5	-169.3	0	0	0	0	107.2	L963	C955-L963 WeakPolarHBondContact CA-O 3.34Å
956	D	77.6	Confident	80	Confident	71 Å²	71	60.9 Å²	60.9	38%	0.38	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	115.6	178.8	-173.4	2.6	0	0	0	109.9	S958 A962 L963	D956-S958 VanDerWaalsContact CG-OG 3.29Å; D956-S958 VanDerWaalsContact OD1-CB 3.23Å; D956-S958 WeakPolarHBondContact OD1-CB 3.34Å; D956-S958 PolarHBondContact OD1-N 3Å; D956-S958 PolarHBondContact OD1-OG 3.43Å; D956-S958 PolarHBondContact OD2-OG 2.72Å; D956-A962 WeakPolarHBondContact O-CA 3.33Å; D956-L963 PolarHBondContact N-O 3.01Å; D956-L963 PolarHBondContact O-N 2.91Å
957	E	67.8	Low	81.3	Confident	105 Å²	105	58.4 Å²	58.4	49%	0.491	30%	0.3	S	S	.	.			trans	-95.5	-2.1	178.5	-65.2	171.3	178.7	0	0	112.4	R959 K1023	E957-R959 PolarHBondContact O-N 3.25Å; E957-R959 VanDerWaalsContact O-N 3.07Å; E957-K1023 VanDerWaalsContact CD-CE 3.48Å; E957-K1023 WeakPolarHBondContact OE1-CE 3.46Å; E957-K1023 IonicContact OE1-NZ 3.96Å; E957-K1023 PolarHBondContact OE1-NZ 2.92Å; E957-K1023 VanDerWaalsContact OE2-CE 3.3Å; E957-K1023 WeakPolarHBondContact OE2-CE 3.22Å; E957-K1023 IonicContact OE2-NZ 3.69Å; E957-K1023 PolarHBondContact OE2-NZ 3.41Å
958	S	54.8	Low	81.9	Confident	96 Å²	96	52.9 Å²	52.9	67%	0.671	28%	0.276	S	S	*	.	S	Bend	trans	-75.3	6.9	-172.8	69.5	0	0	0	0	115.1	D956	D956-S958 VanDerWaalsContact CG-OG 3.29Å; D956-S958 VanDerWaalsContact OD1-CB 3.23Å; D956-S958 WeakPolarHBondContact OD1-CB 3.34Å; D956-S958 PolarHBondContact OD1-N 3Å; D956-S958 PolarHBondContact OD1-OG 3.43Å; D956-S958 PolarHBondContact OD2-OG 2.72Å
959	R	51.6	Low	82	Confident	172 Å²	172	54.9 Å²	54.9	65%	0.649	29%	0.287	S	S	*	.	S	Bend	trans	-133	155.9	178.4	-59.4	-175.1	-178.5	-158.9	-3	109.5	E957 F961	E957-R959 PolarHBondContact O-N 3.25Å; E957-R959 VanDerWaalsContact O-N 3.07Å; R959-F961 CarbonylContact O-C 3.58Å; R959-F961 PolarHBondContact O-N 3.21Å
960	N	53.2	Low	81.8	Confident	163 Å²	163	54.8 Å²	54.8	87%	0.872	29%	0.287	S	S	*	.	S	Bend	trans	-57.5	-7.9	-175.2	-69.7	5.2	0	0	0	115.9
961	F	56.1	Low	81	Confident	149 Å²	149	58.2 Å²	58.2	65%	0.654	31%	0.311	S	S	*	.	S	Bend	trans	-131.8	126.5	168.8	-49.5	-77.4	0	0	0	107.9	R959 L963	R959-F961 CarbonylContact O-C 3.58Å; R959-F961 PolarHBondContact O-N 3.21Å; F961-L963 PolarHBondContact O-N 3.03Å
962	A	72.8	Confident	80.2	Confident	41 Å²	41	61.3 Å²	61.3	34%	0.339	33%	0.325	S	S	.	.			trans	-61.3	127.2	177.7	0	0	0	0	0	110.3	D956 P981	D956-A962 WeakPolarHBondContact O-CA 3.33Å; A962-P981 VanDerWaalsContact O-CD 3.24Å; A962-P981 WeakPolarHBondContact O-CD 3.48Å
963	L	87	Confident	79.8	Confident	44 Å²	44	65.2 Å²	65.2	23%	0.23	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	119.4	-178.5	-82.7	165.2	0	0	0	110.7	C955 D956 F961 A980	C955-L963 WeakPolarHBondContact CA-O 3.34Å; D956-L963 PolarHBondContact N-O 3.01Å; D956-L963 PolarHBondContact O-N 2.91Å; F961-L963 PolarHBondContact O-N 3.03Å; L963-A980 HydrophobicContact CD2-CB 4.36Å
964	V	90.5	Very high	79.7	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	128.1	178.9	177.3	0	0	0	0	109.1	Q978 F979 P981 V1014 I1018	V964-Q978 CarbonylContact O-C 3.56Å; V964-Q978 VanDerWaalsContact O-CA 3.22Å; V964-Q978 WeakPolarHBondContact O-CA 3.23Å; V964-F979 HydrophobicContact CB-CD1 4.34Å; V964-F979 HydrophobicContact CB-CE1 3.96Å; V964-F979 HydrophobicContact CB-CE2 4.41Å; V964-F979 HydrophobicContact CB-CZ 4.01Å; V964-F979 HydrophobicContact CG1-CD1 4.46Å; V964-F979 HydrophobicContact CG1-CE1 3.69Å; V964-F979 HydrophobicContact CG1-CZ 3.8Å; V964-F979 PolarHBondContact N-O 3.26Å; V964-F979 PolarHBondContact O-N 3.31Å; V964-P981 HydrophobicContact CG2-CG 3.89Å; V964-V1014 HydrophobicContact CG1-CG1 3.96Å; V964-I1018 HydrophobicContact CB-CD1 4.09Å; V964-I1018 HydrophobicContact CG1-CD1 3.37Å; V964-I1018 HydrophobicContact CG2-CD1 3.49Å; V964-I1018 VanDerWaalsContact CG2-CD1 3.49Å; V964-I1018 HydrophobicContact CG2-CG2 4.06Å
965	S	92.6	Very high	80	Confident	24 Å²	24	65.1 Å²	65.1	17%	0.168	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	129.1	174.8	-164.3	0	0	0	0	111.5	L953 G954 F977	L953-S965 PolarHBondContact N-O 2.71Å; G954-S965 PolarHBondContact N-O 2.83Å; G954-S965 PolarHBondContact O-N 2.95Å; S965-F977 WeakPolarHBondContact CA-O 3.39Å; S965-F977 PolarHBondContact OG-O 2.81Å
966	C	94.8	Very high	80.4	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	147.1	-179.5	-72.4	0	0	0	0	111.8	M950 E951 T976 F977	M950-C966 HydrophobicContact CG-CB 4.31Å; E951-C966 CarbonylContact O-C 3.55Å; E951-C966 VanDerWaalsContact O-CA 3.25Å; E951-C966 WeakPolarHBondContact O-CA 3.46Å; C966-T976 WeakPolarHBondContact O-CA 3.25Å; C966-F977 HydrophobicContact CB-CE1 4.23Å; C966-F977 HydrophobicContact CB-CE2 4.27Å; C966-F977 HydrophobicContact CB-CZ 3.95Å; C966-F977 PolarHBondContact N-O 3.32Å; C966-F977 PolarHBondContact O-N 3.13Å
967	R	95.7	Very high	81.2	Confident	63 Å²	63	65.7 Å²	65.7	24%	0.238	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	138	160.4	-166.5	175.9	78.1	-94.9	-13.4	109.7	M950 E951 L953 D969 V975 T976	M950-R967 CarbonylContact C-O 3.46Å; M950-R967 VanDerWaalsContact CA-O 3.31Å; M950-R967 WeakPolarHBondContact CA-O 3.36Å; E951-R967 PolarHBondContact N-O 3.04Å; E951-R967 PolarHBondContact O-N 2.84Å; E951-R967 IonicContact OE2-CZ 3.57Å; E951-R967 IonicContact OE2-NH1 3.71Å; E951-R967 PolarHBondContact OE2-NH1 2.85Å; E951-R967 IonicContact OE2-NH2 3.78Å; E951-R967 PolarHBondContact OE2-NH2 2.98Å; L953-R967 HydrophobicContact CD1-CB 4.18Å; L953-R967 HydrophobicContact CD2-CB 4.31Å; L953-R967 HydrophobicContact CG-CB 4.34Å; R967-D969 IonicContact CZ-OD2 2.78Å; R967-D969 VanDerWaalsContact CZ-OD2 3.26Å; R967-D969 IonicContact NE-OD1 3.1Å; R967-D969 PolarHBondContact NE-OD1 2.84Å; R967-D969 IonicContact NE-OD2 3.6Å; R967-D969 PolarHBondContact NE-OD2 3Å; R967-D969 IonicContact NH2-OD2 3.83Å; R967-D969 PolarHBondContact NH2-OD2 2.82Å; R967-V975 CarbonylContact C-O 3.18Å; R967-V975 WeakPolarHBondContact CA-O 3.48Å; R967-V975 WeakPolarHBondContact CG-O 3.29Å; R967-T976 HydrophobicContact CB-CG2 3.72Å; R967-T976 HydrophobicContact CG-CG2 3.81Å
968	L	94.9	Very high	82.4	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	113.2	175.7	168.8	62.2	0	0	0	108.8	V948 V949 M950 T970 S974 V975 F977 L993 L999 V1007	V948-L968 HydrophobicContact CG1-CD1 3.68Å; V949-L968 CarbonylContact O-C 3.43Å; V949-L968 WeakPolarHBondContact O-CA 3.42Å; M950-L968 HydrophobicContact CE-CD1 4.22Å; L968-T970 HydrophobicContact CD1-CG2 4.35Å; L968-T970 HydrophobicContact CG-CG2 4.24Å; L968-S974 WeakPolarHBondContact O-CA 3.36Å; L968-V975 HydrophobicContact CB-CG1 3.9Å; L968-V975 HydrophobicContact CD2-CG1 4.15Å; L968-V975 HydrophobicContact CG-CG1 4.25Å; L968-V975 PolarHBondContact N-O 3.42Å; L968-V975 PolarHBondContact O-N 2.8Å; L968-F977 HydrophobicContact CB-CE1 3.93Å; L968-F977 HydrophobicContact CD2-CE1 4.31Å; L968-L993 HydrophobicContact CD2-CD1 3.91Å; L968-L999 HydrophobicContact CD2-CD1 4.29Å; L968-L999 HydrophobicContact CD2-CD2 4.13Å; L968-L999 HydrophobicContact CD2-CG 4.31Å; L968-V1007 HydrophobicContact CD1-CG2 3.87Å; L968-V1007 HydrophobicContact CD2-CG1 4.16Å; L968-V1007 HydrophobicContact CD2-CG2 3.94Å
969	D	91.8	Very high	84.3	Confident	42 Å²	42	62.4 Å²	62.4	23%	0.225	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	116.3	178.8	-61.4	-41.8	0	0	0	109.6	V949 R967 S974	V949-D969 HydrophobicContact CB-CB 4.42Å; V949-D969 PolarHBondContact N-O 2.93Å; V949-D969 PolarHBondContact O-N 3Å; R967-D969 IonicContact CZ-OD2 2.78Å; R967-D969 VanDerWaalsContact CZ-OD2 3.26Å; R967-D969 IonicContact NE-OD1 3.1Å; R967-D969 PolarHBondContact NE-OD1 2.84Å; R967-D969 IonicContact NE-OD2 3.6Å; R967-D969 PolarHBondContact NE-OD2 3Å; R967-D969 IonicContact NH2-OD2 3.83Å; R967-D969 PolarHBondContact NH2-OD2 2.82Å; D969-S974 VanDerWaalsContact OD1-CB 3.29Å; D969-S974 WeakPolarHBondContact OD1-CB 3.37Å; D969-S974 PolarHBondContact OD1-OG 2.87Å
970	T	88.8	Confident	86.1	Confident	20 Å²	20	54.7 Å²	54.7	12%	0.123	29%	0.293	C	S	.	.			trans	-112.5	173	175.6	75.6	0	0	0	0	110.8	L968 H972 K973 L999	L968-T970 HydrophobicContact CD1-CG2 4.35Å; L968-T970 HydrophobicContact CG-CG2 4.24Å; T970-H972 PolarHBondContact O-N 2.81Å; T970-H972 PolarHBondContact OG1-CE1 2.8Å; T970-H972 VanDerWaalsContact OG1-CE1 3.28Å; T970-H972 PolarHBondContact OG1-N 2.69Å; T970-H972 PolarHBondContact OG1-ND1 2.81Å; T970-K973 PolarHBondContact N-O 3.37Å; T970-K973 PolarHBondContact OG1-N 2.81Å; T970-K973 PolarHBondContact OG1-O 2.57Å; T970-L999 HydrophobicContact CG2-CD2 3.82Å
971	S	78.6	Confident	87.6	Confident	74 Å²	74	48 Å²	48	52%	0.517	26%	0.258	S	S	.	.	S	Bend	trans	-65.1	-0.2	178	70.7	0	0	0	0	116.3
972	H	77.7	Confident	88.7	Confident	93 Å²	93	44.6 Å²	44.6	43%	0.431	27%	0.266	S	S	.	.	S	Bend	trans	-148.3	-15.9	-172.7	58.6	-69.8	0	0	0	114.4	T970 H1003	T970-H972 PolarHBondContact O-N 2.81Å; T970-H972 PolarHBondContact OG1-CE1 2.8Å; T970-H972 VanDerWaalsContact OG1-CE1 3.28Å; T970-H972 PolarHBondContact OG1-N 2.69Å; T970-H972 PolarHBondContact OG1-ND1 2.81Å; H972-H1003 AromaticContact CE1-CE1 3.8Å; H972-H1003 AromaticContact CE1-ND1 3.94Å
973	K	84.3	Confident	89.3	Confident	83 Å²	83	47.1 Å²	47.1	36%	0.361	28%	0.277	S	S	.	.			trans	-151	146.1	177	-143.1	-175.9	-162.3	171.2	0	110.3	T970 E996 D997 C998	T970-K973 PolarHBondContact N-O 3.37Å; T970-K973 PolarHBondContact OG1-N 2.81Å; T970-K973 PolarHBondContact OG1-O 2.57Å; K973-E996 PolarHBondContact NZ-O 3Å; K973-D997 VanDerWaalsContact CD-O 3.29Å; K973-D997 WeakPolarHBondContact CD-O 3.28Å; K973-D997 PolarHBondContact NZ-O 2.99Å; K973-C998 HydrophobicContact CD-CB 4.16Å; K973-C998 PolarHBondContact NZ-SG 2.77Å
974	S	89.9	Confident	89.4	Confident	70 Å²	70	47.8 Å²	47.8	49%	0.49	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	135.2	164	179.3	0	0	0	0	107.7	L968 D969	L968-S974 WeakPolarHBondContact O-CA 3.36Å; D969-S974 VanDerWaalsContact OD1-CB 3.29Å; D969-S974 WeakPolarHBondContact OD1-CB 3.37Å; D969-S974 PolarHBondContact OD1-OG 2.87Å
975	V	93.7	Very high	89.4	Confident	25 Å²	25	54.6 Å²	54.6	15%	0.152	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	141.7	-179.4	63.4	0	0	0	0	110	R967 L968 F977 L993 C998	R967-V975 CarbonylContact C-O 3.18Å; R967-V975 WeakPolarHBondContact CA-O 3.48Å; R967-V975 WeakPolarHBondContact CG-O 3.29Å; L968-V975 HydrophobicContact CB-CG1 3.9Å; L968-V975 HydrophobicContact CD2-CG1 4.15Å; L968-V975 HydrophobicContact CG-CG1 4.25Å; L968-V975 PolarHBondContact N-O 3.42Å; L968-V975 PolarHBondContact O-N 2.8Å; V975-F977 HydrophobicContact CG1-CD1 4.49Å; V975-L993 HydrophobicContact CG1-CD2 4.19Å; V975-L993 HydrophobicContact CG2-CD2 4.34Å; V975-C998 HydrophobicContact CG1-CB 4.26Å
976	T	94.5	Very high	89.4	Confident	89 Å²	89	55 Å²	55	55%	0.546	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.8	168.2	26.9	0	0	0	0	108.9	L953 C966 R967	L953-T976 HydrophobicContact CD1-CG2 3.53Å; C966-T976 WeakPolarHBondContact O-CA 3.25Å; R967-T976 HydrophobicContact CB-CG2 3.72Å; R967-T976 HydrophobicContact CG-CG2 3.81Å
977	F	94.5	Very high	89.2	Confident	26 Å²	26	57.7 Å²	57.7	11%	0.114	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	167.5	179	62.5	-87.2	0	0	0	110.8	S965 C966 L968 V975 F979 I989 L993 L1011	S965-F977 WeakPolarHBondContact CA-O 3.39Å; S965-F977 PolarHBondContact OG-O 2.81Å; C966-F977 HydrophobicContact CB-CE1 4.23Å; C966-F977 HydrophobicContact CB-CE2 4.27Å; C966-F977 HydrophobicContact CB-CZ 3.95Å; C966-F977 PolarHBondContact N-O 3.32Å; C966-F977 PolarHBondContact O-N 3.13Å; L968-F977 HydrophobicContact CB-CE1 3.93Å; L968-F977 HydrophobicContact CD2-CE1 4.31Å; V975-F977 HydrophobicContact CG1-CD1 4.49Å; F977-F979 HydrophobicContact CD2-CD1 4Å; F977-F979 AromaticContact CE2-CD1 3.66Å; F977-F979 HydrophobicContact CE2-CD1 3.66Å; F977-F979 HydrophobicContact CE2-CE1 4Å; F977-I989 HydrophobicContact CD2-CG2 4.12Å; F977-I989 HydrophobicContact CE2-CG2 3.75Å; F977-I989 HydrophobicContact CZ-CG2 4.33Å; F977-L993 HydrophobicContact CD1-CD1 4.16Å; F977-L993 HydrophobicContact CD1-CD2 4.37Å; F977-L993 HydrophobicContact CE1-CD1 3.9Å; F977-L993 HydrophobicContact CZ-CD1 4.18Å; F977-L1011 HydrophobicContact CE2-CD2 3.99Å; F977-L1011 HydrophobicContact CZ-CD2 4.09Å
978	Q	93.4	Very high	89	Confident	129 Å²	129	57.9 Å²	57.9	60%	0.603	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	150.1	171.9	-71.7	-177.9	-5.3	0	0	109.8	V964	V964-Q978 CarbonylContact O-C 3.56Å; V964-Q978 VanDerWaalsContact O-CA 3.22Å; V964-Q978 WeakPolarHBondContact O-CA 3.23Å
979	F	93.2	Very high	88.9	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.018	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	155.5	175	69.2	-81.3	0	0	0	110.3	V964 F977 P981 D984 I989 L1011 V1014 I1015	V964-F979 HydrophobicContact CB-CD1 4.34Å; V964-F979 HydrophobicContact CB-CE1 3.96Å; V964-F979 HydrophobicContact CB-CE2 4.41Å; V964-F979 HydrophobicContact CB-CZ 4.01Å; V964-F979 HydrophobicContact CG1-CD1 4.46Å; V964-F979 HydrophobicContact CG1-CE1 3.69Å; V964-F979 HydrophobicContact CG1-CZ 3.8Å; V964-F979 PolarHBondContact N-O 3.26Å; V964-F979 PolarHBondContact O-N 3.31Å; F977-F979 HydrophobicContact CD2-CD1 4Å; F977-F979 AromaticContact CE2-CD1 3.66Å; F977-F979 HydrophobicContact CE2-CD1 3.66Å; F977-F979 HydrophobicContact CE2-CE1 4Å; F979-P981 HydrophobicContact CE2-CB 4.17Å; F979-D984 HydrophobicContact CB-CB 3.95Å; F979-D984 HydrophobicContact CD2-CB 4.42Å; F979-I989 HydrophobicContact CB-CD1 3.72Å; F979-I989 HydrophobicContact CB-CG1 4.41Å; F979-I989 HydrophobicContact CD1-CD1 4.29Å; F979-I989 HydrophobicContact CD2-CD1 3.67Å; F979-I989 HydrophobicContact CE2-CD1 4.33Å; F979-I989 HydrophobicContact CG-CD1 3.64Å; F979-L1011 HydrophobicContact CD1-CD2 4.23Å; F979-L1011 HydrophobicContact CE1-CD2 3.62Å; F979-L1011 HydrophobicContact CE2-CD2 4.24Å; F979-L1011 HydrophobicContact CZ-CD2 3.62Å; F979-V1014 HydrophobicContact CE1-CG1 4.43Å; F979-V1014 HydrophobicContact CZ-CG1 3.83Å; F979-I1015 HydrophobicContact CE2-CD1 4.14Å; F979-I1015 HydrophobicContact CE2-CG1 3.74Å; F979-I1015 HydrophobicContact CZ-CG1 4.36Å
980	A	89.8	Confident	88.9	Confident	10 Å²	10	56.6 Å²	56.6	8%	0.083	33%	0.332	C	S	.	.			trans	-99.6	115.1	174.4	0	0	0	0	0	109.5	L963 G982 T983 D984	L963-A980 HydrophobicContact CD2-CB 4.36Å; A980-G982 PolarHBondContact O-N 2.86Å; A980-T983 WeakPolarHBondContact CB-OG1 3.43Å; A980-T983 PolarHBondContact O-N 2.92Å; A980-T983 PolarHBondContact O-OG1 3.38Å; A980-D984 PolarHBondContact N-OD2 2.85Å; A980-D984 PolarHBondContact O-N 3.09Å
981	P	85.2	Confident	89	Confident	21 Å²	21	59.4 Å²	59.4	14%	0.136	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-12.2	-168.7	29.1	-35.4	0	0	0	113.8	A962 V964 F979 I1015	A962-P981 VanDerWaalsContact O-CD 3.24Å; A962-P981 WeakPolarHBondContact O-CD 3.48Å; V964-P981 HydrophobicContact CG2-CG 3.89Å; F979-P981 HydrophobicContact CE2-CB 4.17Å; P981-I1015 HydrophobicContact CB-CB 4.48Å; P981-I1015 HydrophobicContact CB-CG1 3.91Å; P981-I1015 HydrophobicContact CB-CG2 4.25Å
982	G	79.5	Confident	89.6	Confident	78 Å²	78	62 Å²	62	80%	0.804	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-12.3	172.7	0	0	0	0	0	115.3	A980	A980-G982 PolarHBondContact O-N 2.86Å
983	T	85.4	Confident	90.3	Very high	95 Å²	95	57.9 Å²	57.9	58%	0.583	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.9	-38.6	-176.1	55.8	0	0	0	0	113.7	A980	A980-T983 WeakPolarHBondContact CB-OG1 3.43Å; A980-T983 PolarHBondContact O-N 2.92Å; A980-T983 PolarHBondContact O-OG1 3.38Å
984	D	88.9	Confident	90.6	Very high	57 Å²	57	56.1 Å²	56.1	31%	0.305	33%	0.327	S	S	.	.			trans	-85.9	115	-177	-69	-57.9	0	0	0	111.5	F979 A980 I989	F979-D984 HydrophobicContact CB-CB 3.95Å; F979-D984 HydrophobicContact CD2-CB 4.42Å; A980-D984 PolarHBondContact N-OD2 2.85Å; A980-D984 PolarHBondContact O-N 3.09Å; D984-I989 HydrophobicContact CB-CD1 3.91Å; D984-I989 HydrophobicContact CB-CG1 4.08Å
985	K	89.9	Confident	90.6	Very high	144 Å²	144	56.9 Å²	56.9	63%	0.626	34%	0.337	S	S	*	.			trans	-78	136.3	178.4	-65.2	179.5	-179.3	177	0	111	C987 T988 I989	K985-C987 VanDerWaalsContact C-N 3.27Å; K985-C987 PolarHBondContact O-N 2.92Å; K985-C987 VanDerWaalsContact O-N 3.11Å; K985-T988 WeakPolarHBondContact O-CA 3.34Å; K985-T988 WeakPolarHBondContact O-CB 3.14Å; K985-T988 PolarHBondContact O-N 2.76Å; K985-I989 PolarHBondContact O-N 2.71Å; K985-I989 VanDerWaalsContact O-N 3.16Å
986	P	92	Very high	90.3	Very high	33 Å²	33	61.3 Å²	61.3	21%	0.214	36%	0.356	C	S	.	.	H	α-helix	trans	-46.4	-43.9	178	-34.8	38	0	0	0	115.2	T988 I989 A990 L1011 I1015	P986-T988 VanDerWaalsContact C-N 3.32Å; P986-T988 PolarHBondContact O-N 3.38Å; P986-I989 PolarHBondContact O-N 3.04Å; P986-A990 WeakPolarHBondContact O-CB 3.26Å; P986-A990 PolarHBondContact O-N 2.83Å; P986-L1011 HydrophobicContact CB-CB 3.8Å; P986-L1011 HydrophobicContact CB-CD1 4.46Å; P986-L1011 HydrophobicContact CG-CB 4.07Å; P986-I1015 HydrophobicContact CG-CD1 3.68Å
987	C	91.6	Very high	89.9	Confident	56 Å²	56	63.2 Å²	63.2	38%	0.378	36%	0.363	S	S	.	.	H	α-helix	trans	-65.2	-32.1	178.3	59.6	0	0	0	0	113.8	K985 T991 E1008	K985-C987 VanDerWaalsContact C-N 3.27Å; K985-C987 PolarHBondContact O-N 2.92Å; K985-C987 VanDerWaalsContact O-N 3.11Å; C987-T991 WeakPolarHBondContact O-CB 3.46Å; C987-T991 PolarHBondContact O-N 2.81Å; C987-T991 PolarHBondContact O-OG1 3.43Å; C987-E1008 WeakPolarHBondContact CA-OE1 3.21Å; C987-E1008 HydrophobicContact CB-CG 4.49Å; C987-E1008 WeakPolarHBondContact CB-OE1 3.07Å
988	T	91.5	Very high	89.4	Confident	67 Å²	67	62.2 Å²	62.2	41%	0.411	36%	0.359	S	S	.	.	H	α-helix	trans	-73	-41.4	177.1	-54.7	0	0	0	0	110.5	K985 P986 T991 K992	K985-T988 WeakPolarHBondContact O-CA 3.34Å; K985-T988 WeakPolarHBondContact O-CB 3.14Å; K985-T988 PolarHBondContact O-N 2.76Å; P986-T988 VanDerWaalsContact C-N 3.32Å; P986-T988 PolarHBondContact O-N 3.38Å; T988-T991 PolarHBondContact O-N 2.73Å; T988-K992 PolarHBondContact O-N 3.42Å
989	I	92.6	Very high	89.1	Confident	14 Å²	14	56.2 Å²	56.2	7%	0.072	33%	0.331	C	S	.	.	H	α-helix	trans	-62.9	-51.1	174.2	-56.2	165.5	0	0	0	110.1	F977 F979 D984 K985 P986 T991 K992 L993 L1011	F977-I989 HydrophobicContact CD2-CG2 4.12Å; F977-I989 HydrophobicContact CE2-CG2 3.75Å; F977-I989 HydrophobicContact CZ-CG2 4.33Å; F979-I989 HydrophobicContact CB-CD1 3.72Å; F979-I989 HydrophobicContact CB-CG1 4.41Å; F979-I989 HydrophobicContact CD1-CD1 4.29Å; F979-I989 HydrophobicContact CD2-CD1 3.67Å; F979-I989 HydrophobicContact CE2-CD1 4.33Å; F979-I989 HydrophobicContact CG-CD1 3.64Å; D984-I989 HydrophobicContact CB-CD1 3.91Å; D984-I989 HydrophobicContact CB-CG1 4.08Å; K985-I989 PolarHBondContact O-N 2.71Å; K985-I989 VanDerWaalsContact O-N 3.16Å; P986-I989 PolarHBondContact O-N 3.04Å; I989-T991 VanDerWaalsContact C-N 3.3Å; I989-T991 PolarHBondContact O-N 2.59Å; I989-K992 PolarHBondContact O-N 2.94Å; I989-L993 HydrophobicContact CG2-CD1 3.9Å; I989-L993 HydrophobicContact CG2-CG 4.44Å; I989-L993 WeakPolarHBondContact O-CG 3.16Å; I989-L993 PolarHBondContact O-N 2.67Å; I989-L1011 HydrophobicContact CB-CD1 3.77Å; I989-L1011 HydrophobicContact CD1-CD1 4.07Å; I989-L1011 HydrophobicContact CD1-CD2 4.09Å; I989-L1011 HydrophobicContact CG2-CD1 3.68Å
990	A	92.7	Very high	88.8	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-62.6	-35.2	179.7	0	0	0	0	0	112.7	P986 L994 V1004 V1007 E1008	P986-A990 WeakPolarHBondContact O-CB 3.26Å; P986-A990 PolarHBondContact O-N 2.83Å; A990-L994 WeakPolarHBondContact O-CB 3.46Å; A990-L994 PolarHBondContact O-N 2.86Å; A990-V1004 HydrophobicContact CB-CG1 4.13Å; A990-V1007 HydrophobicContact CB-CG1 4.15Å; A990-E1008 HydrophobicContact CB-CG 3.58Å
991	T	90.5	Very high	88.5	Confident	79 Å²	79	67.1 Å²	67.1	49%	0.485	38%	0.38	S	S	.	.	H	α-helix	trans	-70.7	-39.3	175	-59	0	0	0	0	112.3	C987 T988 I989 L994 A995	C987-T991 WeakPolarHBondContact O-CB 3.46Å; C987-T991 PolarHBondContact O-N 2.81Å; C987-T991 PolarHBondContact O-OG1 3.43Å; T988-T991 PolarHBondContact O-N 2.73Å; I989-T991 VanDerWaalsContact C-N 3.3Å; I989-T991 PolarHBondContact O-N 2.59Å; T991-L994 WeakPolarHBondContact O-CB 3.48Å; T991-L994 PolarHBondContact O-N 3.04Å; T991-A995 PolarHBondContact O-N 2.9Å
992	K	90.1	Very high	88.5	Confident	128 Å²	128	70.8 Å²	70.8	56%	0.557	40%	0.401	S	S	*	.	H	α-helix	trans	-62.3	-47.1	171.7	-79.3	-176.3	174.2	-177.6	0	111.6	T988 I989 L994 A995 E996	T988-K992 PolarHBondContact O-N 3.42Å; I989-K992 PolarHBondContact O-N 2.94Å; K992-L994 PolarHBondContact O-N 2.81Å; K992-A995 WeakPolarHBondContact O-CB 3.48Å; K992-A995 PolarHBondContact O-N 3.01Å; K992-E996 PolarHBondContact O-N 2.65Å
993	L	92	Very high	89	Confident	8 Å²	8	67 Å²	67	4%	0.042	36%	0.363	C	S	.	.	H	α-helix	trans	-63.4	-27.7	176.7	-68.7	172	0	0	0	112.8	L968 V975 F977 I989 C998 L999 V1007	L968-L993 HydrophobicContact CD2-CD1 3.91Å; V975-L993 HydrophobicContact CG1-CD2 4.19Å; V975-L993 HydrophobicContact CG2-CD2 4.34Å; F977-L993 HydrophobicContact CD1-CD1 4.16Å; F977-L993 HydrophobicContact CD1-CD2 4.37Å; F977-L993 HydrophobicContact CE1-CD1 3.9Å; F977-L993 HydrophobicContact CZ-CD1 4.18Å; I989-L993 HydrophobicContact CG2-CD1 3.9Å; I989-L993 HydrophobicContact CG2-CG 4.44Å; I989-L993 WeakPolarHBondContact O-CG 3.16Å; I989-L993 PolarHBondContact O-N 2.67Å; L993-C998 HydrophobicContact CB-CB 4.3Å; L993-C998 HydrophobicContact CD2-CB 4.06Å; L993-C998 CarbonylContact O-C 3.49Å; L993-C998 VanDerWaalsContact O-CA 3.26Å; L993-C998 WeakPolarHBondContact O-CA 2.93Å; L993-C998 WeakPolarHBondContact O-CB 2.91Å; L993-C998 PolarHBondContact O-N 2.8Å; L993-L999 HydrophobicContact CB-CD1 3.65Å; L993-L999 HydrophobicContact CB-CG 4.23Å; L993-L999 HydrophobicContact CD1-CD1 4.37Å; L993-L999 PolarHBondContact O-N 2.75Å; L993-V1007 HydrophobicContact CD1-CG1 4.44Å
994	L	91.4	Very high	89.1	Confident	46 Å²	46	63.3 Å²	63.3	24%	0.241	34%	0.34	C	S	.	.	H	α-helix	trans	-70.7	-40.7	168.6	178.7	68.2	0	0	0	112.1	A990 T991 K992 E996 D997 L999 K1001 V1004	A990-L994 WeakPolarHBondContact O-CB 3.46Å; A990-L994 PolarHBondContact O-N 2.86Å; T991-L994 WeakPolarHBondContact O-CB 3.48Å; T991-L994 PolarHBondContact O-N 3.04Å; K992-L994 PolarHBondContact O-N 2.81Å; L994-E996 VanDerWaalsContact C-N 3.35Å; L994-D997 PolarHBondContact O-N 3.08Å; L994-L999 WeakPolarHBondContact CD1-O 3.43Å; L994-K1001 HydrophobicContact CD1-CG 3.87Å; L994-K1001 HydrophobicContact CD2-CG 4.1Å; L994-V1004 HydrophobicContact CB-CG2 4.37Å; L994-V1004 HydrophobicContact CD1-CG2 4.32Å; L994-V1004 HydrophobicContact CD2-CG2 4.01Å; L994-V1004 HydrophobicContact CG-CG2 4.47Å
995	A	89.2	Confident	89	Confident	85 Å²	85	67.3 Å²	67.3	70%	0.702	36%	0.357	S	S	*	.	H	α-helix	trans	-70.3	-27.4	-178.9	0	0	0	0	0	113.6	T991 K992 D997	T991-A995 PolarHBondContact O-N 2.9Å; K992-A995 WeakPolarHBondContact O-CB 3.48Å; K992-A995 PolarHBondContact O-N 3.01Å; A995-D997 VanDerWaalsContact C-N 3.27Å; A995-D997 PolarHBondContact O-N 2.83Å
996	E	88.7	Confident	89	Confident	118 Å²	118	60.8 Å²	60.8	55%	0.551	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	15.6	176.8	-66.6	174.7	-172.6	0	0	113.7	K973 K992 L994 C998	K973-E996 PolarHBondContact NZ-O 3Å; K992-E996 PolarHBondContact O-N 2.65Å; L994-E996 VanDerWaalsContact C-N 3.35Å; E996-C998 PolarHBondContact O-N 2.85Å; E996-C998 VanDerWaalsContact O-N 3.11Å
997	D	85.5	Confident	89	Confident	129 Å²	129	59.2 Å²	59.2	69%	0.69	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	34.5	-171	-78.9	-38.8	0	0	0	112.4	K973 L994 A995	K973-D997 VanDerWaalsContact CD-O 3.29Å; K973-D997 WeakPolarHBondContact CD-O 3.28Å; K973-D997 PolarHBondContact NZ-O 2.99Å; L994-D997 PolarHBondContact O-N 3.08Å; A995-D997 VanDerWaalsContact C-N 3.27Å; A995-D997 PolarHBondContact O-N 2.83Å
998	C	84	Confident	89.1	Confident	6 Å²	6	58.7 Å²	58.7	4%	0.041	31%	0.31	C	S	.	.	S	Bend	trans	-92.6	-13.3	174.8	-66	0	0	0	0	112.7	K973 V975 L993 E996	K973-C998 HydrophobicContact CD-CB 4.16Å; K973-C998 PolarHBondContact NZ-SG 2.77Å; V975-C998 HydrophobicContact CG1-CB 4.26Å; L993-C998 HydrophobicContact CB-CB 4.3Å; L993-C998 HydrophobicContact CD2-CB 4.06Å; L993-C998 CarbonylContact O-C 3.49Å; L993-C998 VanDerWaalsContact O-CA 3.26Å; L993-C998 WeakPolarHBondContact O-CA 2.93Å; L993-C998 WeakPolarHBondContact O-CB 2.91Å; L993-C998 PolarHBondContact O-N 2.8Å; E996-C998 PolarHBondContact O-N 2.85Å; E996-C998 VanDerWaalsContact O-N 3.11Å
999	L	86.7	Confident	89	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.016	31%	0.306	C	S	.	.	S	Bend	trans	-137.5	158.5	175.4	-75.8	166.6	0	0	0	111.8	L968 T970 L993 L994 H1003 V1007	L968-L999 HydrophobicContact CD2-CD1 4.29Å; L968-L999 HydrophobicContact CD2-CD2 4.13Å; L968-L999 HydrophobicContact CD2-CG 4.31Å; T970-L999 HydrophobicContact CG2-CD2 3.82Å; L993-L999 HydrophobicContact CB-CD1 3.65Å; L993-L999 HydrophobicContact CB-CG 4.23Å; L993-L999 HydrophobicContact CD1-CD1 4.37Å; L993-L999 PolarHBondContact O-N 2.75Å; L994-L999 WeakPolarHBondContact CD1-O 3.43Å; L999-H1003 HydrophobicContact CD2-CB 3.57Å; L999-V1007 HydrophobicContact CD1-CB 4.01Å; L999-V1007 HydrophobicContact CD1-CG1 3.99Å; L999-V1007 HydrophobicContact CD1-CG2 3.82Å; L999-V1007 HydrophobicContact CD2-CG2 3.67Å; L999-V1007 HydrophobicContact CG-CG2 4.4Å
1000	L	87.2	Confident	89	Confident	69 Å²	69	56.7 Å²	56.7	36%	0.361	30%	0.303	S	S	.	.			trans	-93.7	153.3	162.8	-63.1	174.8	0	0	0	109.1	V1002 H1003	L1000-V1002 PolarHBondContact O-N 3.09Å; L1000-H1003 WeakPolarHBondContact O-CB 3.02Å; L1000-H1003 PolarHBondContact O-N 2.73Å
1001	K	84.9	Confident	89.1	Confident	174 Å²	174	56.7 Å²	56.7	76%	0.757	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-50.3	-36.5	177.4	-70	-172.9	175.3	-176.8	0	113.7	L994 H1003 V1004	L994-K1001 HydrophobicContact CD1-CG 3.87Å; L994-K1001 HydrophobicContact CD2-CG 4.1Å; K1001-H1003 PolarHBondContact O-N 3.06Å; K1001-V1004 WeakPolarHBondContact O-CG2 3.3Å; K1001-V1004 PolarHBondContact O-N 2.77Å
1002	V	84.9	Confident	89.1	Confident	97 Å²	97	54.4 Å²	54.4	59%	0.588	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-64.9	-22.1	177.1	174.5	0	0	0	0	113.4	L1000 L1034	L1000-V1002 PolarHBondContact O-N 3.09Å; V1002-L1034 HydrophobicContact CG1-CD1 4.28Å; V1002-L1034 HydrophobicContact CG1-CD2 4.09Å
1003	H	88.3	Confident	89.1	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-92.7	-9.5	-177.5	-55.4	170.5	0	0	0	113.4	V948 H972 L999 L1000 K1001 I1006 V1007	V948-H1003 HydrophobicContact CG2-CB 4.46Å; H972-H1003 AromaticContact CE1-CE1 3.8Å; H972-H1003 AromaticContact CE1-ND1 3.94Å; L999-H1003 HydrophobicContact CD2-CB 3.57Å; L1000-H1003 WeakPolarHBondContact O-CB 3.02Å; L1000-H1003 PolarHBondContact O-N 2.73Å; K1001-H1003 PolarHBondContact O-N 3.06Å; H1003-I1006 PolarHBondContact O-N 3.45Å; H1003-V1007 PolarHBondContact O-N 2.87Å
1004	V	88.8	Confident	89	Confident	17 Å²	17	51.5 Å²	51.5	10%	0.103	28%	0.282	C	S	.	.	H	α-helix	trans	-57.7	-59.2	-172.2	175.4	0	0	0	0	111.4	A990 L994 K1001 I1006 V1007 E1008	A990-V1004 HydrophobicContact CB-CG1 4.13Å; L994-V1004 HydrophobicContact CB-CG2 4.37Å; L994-V1004 HydrophobicContact CD1-CG2 4.32Å; L994-V1004 HydrophobicContact CD2-CG2 4.01Å; L994-V1004 HydrophobicContact CG-CG2 4.47Å; K1001-V1004 WeakPolarHBondContact O-CG2 3.3Å; K1001-V1004 PolarHBondContact O-N 2.77Å; V1004-I1006 PolarHBondContact O-N 3.1Å; V1004-I1006 VanDerWaalsContact O-N 3.15Å; V1004-V1007 PolarHBondContact O-N 3.16Å; V1004-E1008 HydrophobicContact CG1-CG 4.28Å; V1004-E1008 WeakPolarHBondContact O-CG 3.46Å; V1004-E1008 PolarHBondContact O-N 2.91Å
1005	H	86.8	Confident	88.9	Confident	141 Å²	141	50.5 Å²	50.5	65%	0.653	28%	0.277	S	S	*	.	H	α-helix	trans	-61.9	-25.7	-178.6	-61.9	-41.7	0	0	0	114.1	E1008 A1009	H1005-E1008 WeakPolarHBondContact CA-OE2 3.3Å; H1005-E1008 IonicContact CE1-OE2 2.64Å; H1005-E1008 IonicContact CG-OE2 2.66Å; H1005-E1008 IonicContact ND1-OE2 2.81Å; H1005-E1008 PolarHBondContact ND1-OE2 2.83Å; H1005-A1009 WeakPolarHBondContact O-CB 3.32Å; H1005-A1009 PolarHBondContact O-N 3.36Å; H1005-A1009 VanDerWaalsContact O-N 3.08Å
1006	I	89.3	Confident	88.7	Confident	7 Å²	7	53.2 Å²	53.2	4%	0.036	28%	0.275	C	S	.	.	H	α-helix	trans	-71.8	-43.1	173.7	-70	170.5	0	0	0	110.6	V948 H1003 V1004 A1009 Q1010 T1032 L1034 P1042	V948-I1006 HydrophobicContact CB-CG2 4.12Å; V948-I1006 HydrophobicContact CG1-CG2 4.2Å; H1003-I1006 PolarHBondContact O-N 3.45Å; V1004-I1006 PolarHBondContact O-N 3.1Å; V1004-I1006 VanDerWaalsContact O-N 3.15Å; I1006-A1009 PolarHBondContact O-N 2.82Å; I1006-Q1010 WeakPolarHBondContact O-CB 3.33Å; I1006-Q1010 VanDerWaalsContact O-CG 3.31Å; I1006-Q1010 WeakPolarHBondContact O-CG 3.41Å; I1006-Q1010 PolarHBondContact O-N 3.43Å; I1006-T1032 HydrophobicContact CD1-CG2 3.89Å; I1006-T1032 HydrophobicContact CG1-CG2 4.1Å; I1006-T1032 HydrophobicContact CG2-CG2 3.81Å; I1006-L1034 HydrophobicContact CD1-CD1 3.84Å; I1006-L1034 HydrophobicContact CD1-CD2 3.59Å; I1006-L1034 HydrophobicContact CD1-CG 3.58Å; I1006-P1042 HydrophobicContact CD1-CB 4.33Å; I1006-P1042 HydrophobicContact CG1-CB 3.91Å; I1006-P1042 HydrophobicContact CG1-CG 3.95Å
1007	V	91.9	Very high	88.6	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-71	-35.7	177.5	170.2	0	0	0	0	111.5	V948 M950 L968 A990 L993 L999 H1003 V1004 L1011	V948-V1007 HydrophobicContact CG1-CG2 4.17Å; M950-V1007 HydrophobicContact CE-CB 4.44Å; M950-V1007 HydrophobicContact CE-CG1 3.87Å; M950-V1007 HydrophobicContact CE-CG2 4.47Å; L968-V1007 HydrophobicContact CD1-CG2 3.87Å; L968-V1007 HydrophobicContact CD2-CG1 4.16Å; L968-V1007 HydrophobicContact CD2-CG2 3.94Å; A990-V1007 HydrophobicContact CB-CG1 4.15Å; L993-V1007 HydrophobicContact CD1-CG1 4.44Å; L999-V1007 HydrophobicContact CD1-CB 4.01Å; L999-V1007 HydrophobicContact CD1-CG1 3.99Å; L999-V1007 HydrophobicContact CD1-CG2 3.82Å; L999-V1007 HydrophobicContact CD2-CG2 3.67Å; L999-V1007 HydrophobicContact CG-CG2 4.4Å; H1003-V1007 PolarHBondContact O-N 2.87Å; V1004-V1007 PolarHBondContact O-N 3.16Å; V1007-L1011 HydrophobicContact CG1-CD1 3.87Å; V1007-L1011 HydrophobicContact CG1-CG 4.47Å; V1007-L1011 VanDerWaalsContact O-CB 3.29Å; V1007-L1011 WeakPolarHBondContact O-CB 3.24Å; V1007-L1011 WeakPolarHBondContact O-CG 3.4Å; V1007-L1011 PolarHBondContact O-N 2.92Å
1008	E	93.3	Very high	88.4	Confident	45 Å²	45	44.2 Å²	44.2	21%	0.21	23%	0.231	C	C	.	.	H	α-helix	trans	-59.5	-46.8	170.9	-69.5	177.9	138.6	0	0	111.7	C987 A990 V1004 H1005 L1011 G1012	C987-E1008 WeakPolarHBondContact CA-OE1 3.21Å; C987-E1008 HydrophobicContact CB-CG 4.49Å; C987-E1008 WeakPolarHBondContact CB-OE1 3.07Å; A990-E1008 HydrophobicContact CB-CG 3.58Å; V1004-E1008 HydrophobicContact CG1-CG 4.28Å; V1004-E1008 WeakPolarHBondContact O-CG 3.46Å; V1004-E1008 PolarHBondContact O-N 2.91Å; H1005-E1008 WeakPolarHBondContact CA-OE2 3.3Å; H1005-E1008 IonicContact CE1-OE2 2.64Å; H1005-E1008 IonicContact CG-OE2 2.66Å; H1005-E1008 IonicContact ND1-OE2 2.81Å; H1005-E1008 PolarHBondContact ND1-OE2 2.83Å; E1008-L1011 PolarHBondContact O-N 3.47Å; E1008-G1012 PolarHBondContact O-N 3.37Å
1009	A	90.5	Very high	88.3	Confident	39 Å²	39	49.3 Å²	49.3	32%	0.322	26%	0.257	S	S	.	.	H	α-helix	trans	-67.7	-42.9	178.6	0	0	0	0	0	112.5	H1005 I1006 G1012 E1013 I1044	H1005-A1009 WeakPolarHBondContact O-CB 3.32Å; H1005-A1009 PolarHBondContact O-N 3.36Å; H1005-A1009 VanDerWaalsContact O-N 3.08Å; I1006-A1009 PolarHBondContact O-N 2.82Å; A1009-G1012 WeakPolarHBondContact O-CA 3.28Å; A1009-G1012 PolarHBondContact O-N 2.85Å; A1009-G1012 VanDerWaalsContact O-N 3.16Å; A1009-E1013 PolarHBondContact O-N 3Å; A1009-E1013 VanDerWaalsContact O-N 3.07Å; A1009-I1044 HydrophobicContact CB-CD1 3.93Å
1010	Q	93.5	Very high	87.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.5	-41.4	174.7	-73.6	178.7	-2.1	0	0	111.8	V948 M950 I1006 G1012 E1013 V1014 L1030 T1032 I1044	V948-Q1010 PolarHBondContact O-NE2 2.82Å; M950-Q1010 HydrophobicContact CB-CB 4.5Å; M950-Q1010 HydrophobicContact CE-CB 3.67Å; M950-Q1010 HydrophobicContact SD-CB 4.13Å; I1006-Q1010 WeakPolarHBondContact O-CB 3.33Å; I1006-Q1010 VanDerWaalsContact O-CG 3.31Å; I1006-Q1010 WeakPolarHBondContact O-CG 3.41Å; I1006-Q1010 PolarHBondContact O-N 3.43Å; Q1010-G1012 VanDerWaalsContact C-N 3.31Å; Q1010-G1012 PolarHBondContact O-N 2.9Å; Q1010-E1013 PolarHBondContact O-N 3.06Å; Q1010-V1014 WeakPolarHBondContact O-CG2 3.42Å; Q1010-V1014 PolarHBondContact O-N 2.99Å; Q1010-L1030 HydrophobicContact CB-CD1 4.04Å; Q1010-L1030 HydrophobicContact CG-CB 4.12Å; Q1010-L1030 HydrophobicContact CG-CD1 4.34Å; Q1010-L1030 VanDerWaalsContact O-CD1 3.28Å; Q1010-L1030 WeakPolarHBondContact O-CD1 3.38Å; Q1010-T1032 PolarHBondContact NE2-OG1 3.18Å; Q1010-I1044 HydrophobicContact CG-CD1 4.07Å; Q1010-I1044 HydrophobicContact CG-CG1 4.37Å; Q1010-I1044 HydrophobicContact CG-CG2 4.46Å
1011	L	93.9	Very high	86.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.8	-35.4	172.9	-82.1	164.2	0	0	0	112.5	M950 F977 F979 P986 I989 V1007 E1008 V1014 I1015	M950-L1011 HydrophobicContact CE-CG 4.04Å; M950-L1011 HydrophobicContact SD-CD2 4.24Å; M950-L1011 HydrophobicContact SD-CG 4.21Å; F977-L1011 HydrophobicContact CE2-CD2 3.99Å; F977-L1011 HydrophobicContact CZ-CD2 4.09Å; F979-L1011 HydrophobicContact CD1-CD2 4.23Å; F979-L1011 HydrophobicContact CE1-CD2 3.62Å; F979-L1011 HydrophobicContact CE2-CD2 4.24Å; F979-L1011 HydrophobicContact CZ-CD2 3.62Å; P986-L1011 HydrophobicContact CB-CB 3.8Å; P986-L1011 HydrophobicContact CB-CD1 4.46Å; P986-L1011 HydrophobicContact CG-CB 4.07Å; I989-L1011 HydrophobicContact CB-CD1 3.77Å; I989-L1011 HydrophobicContact CD1-CD1 4.07Å; I989-L1011 HydrophobicContact CD1-CD2 4.09Å; I989-L1011 HydrophobicContact CG2-CD1 3.68Å; V1007-L1011 HydrophobicContact CG1-CD1 3.87Å; V1007-L1011 HydrophobicContact CG1-CG 4.47Å; V1007-L1011 VanDerWaalsContact O-CB 3.29Å; V1007-L1011 WeakPolarHBondContact O-CB 3.24Å; V1007-L1011 WeakPolarHBondContact O-CG 3.4Å; V1007-L1011 PolarHBondContact O-N 2.92Å; E1008-L1011 PolarHBondContact O-N 3.47Å; L1011-V1014 PolarHBondContact O-N 2.83Å; L1011-I1015 VanDerWaalsContact O-CG1 3.31Å; L1011-I1015 WeakPolarHBondContact O-CG1 3.44Å; L1011-I1015 PolarHBondContact O-N 3.11Å
1012	G	90.7	Very high	85.8	Confident	30 Å²	30	46.3 Å²	46.3	31%	0.309	26%	0.263	S	S	.	.	H	α-helix	trans	-57.3	-49.8	171.6	0	0	0	0	0	112.4	E1008 A1009 Q1010 I1015 Q1016	E1008-G1012 PolarHBondContact O-N 3.37Å; A1009-G1012 WeakPolarHBondContact O-CA 3.28Å; A1009-G1012 PolarHBondContact O-N 2.85Å; A1009-G1012 VanDerWaalsContact O-N 3.16Å; Q1010-G1012 VanDerWaalsContact C-N 3.31Å; Q1010-G1012 PolarHBondContact O-N 2.9Å; G1012-I1015 PolarHBondContact O-N 2.82Å; G1012-Q1016 WeakPolarHBondContact O-CB 3.41Å; G1012-Q1016 PolarHBondContact O-N 3.45Å
1013	E	89.3	Confident	84.8	Confident	74 Å²	74	48.6 Å²	48.6	35%	0.346	27%	0.265	S	S	.	.	H	α-helix	trans	-63.9	-40.2	174.8	-78.1	-165.8	176.5	0	0	112.7	A1009 Q1010 I1015 Q1016 L1017 L1030 I1044	A1009-E1013 PolarHBondContact O-N 3Å; A1009-E1013 VanDerWaalsContact O-N 3.07Å; Q1010-E1013 PolarHBondContact O-N 3.06Å; E1013-I1015 PolarHBondContact O-N 3.07Å; E1013-Q1016 PolarHBondContact O-N 3.25Å; E1013-L1017 VanDerWaalsContact O-CB 3.23Å; E1013-L1017 WeakPolarHBondContact O-CB 3.21Å; E1013-L1017 PolarHBondContact O-N 2.98Å; E1013-L1030 HydrophobicContact CB-CD1 3.78Å; E1013-L1030 WeakPolarHBondContact OE2-CD2 3.29Å; E1013-I1044 HydrophobicContact CG-CD1 4.28Å; E1013-I1044 WeakPolarHBondContact OE2-CG2 3.49Å
1014	V	89.7	Confident	83.8	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-59.5	-45.8	176.1	172.8	0	0	0	0	111.2	M950 I952 V964 F979 Q1010 L1011 L1017 I1018 L1030	M950-V1014 HydrophobicContact SD-CG2 3.97Å; I952-V1014 HydrophobicContact CD1-CB 4.36Å; I952-V1014 HydrophobicContact CD1-CG1 3.89Å; I952-V1014 HydrophobicContact CD1-CG2 4.04Å; I952-V1014 HydrophobicContact CG1-CG1 3.96Å; I952-V1014 HydrophobicContact CG1-CG2 3.96Å; V964-V1014 HydrophobicContact CG1-CG1 3.96Å; F979-V1014 HydrophobicContact CE1-CG1 4.43Å; F979-V1014 HydrophobicContact CZ-CG1 3.83Å; Q1010-V1014 WeakPolarHBondContact O-CG2 3.42Å; Q1010-V1014 PolarHBondContact O-N 2.99Å; L1011-V1014 PolarHBondContact O-N 2.83Å; V1014-L1017 PolarHBondContact O-N 2.92Å; V1014-I1018 HydrophobicContact CG1-CD1 3.78Å; V1014-I1018 WeakPolarHBondContact O-CB 3.16Å; V1014-I1018 WeakPolarHBondContact O-CG1 3.46Å; V1014-I1018 PolarHBondContact O-N 3.45Å; V1014-L1030 HydrophobicContact CG2-CD1 3.86Å
1015	I	89.2	Confident	82.9	Confident	26 Å²	26	54.1 Å²	54.1	13%	0.133	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-46	176.4	-69.8	171.6	0	0	0	110.4	F979 P981 P986 L1011 G1012 E1013 L1017 I1018 N1019	F979-I1015 HydrophobicContact CE2-CD1 4.14Å; F979-I1015 HydrophobicContact CE2-CG1 3.74Å; F979-I1015 HydrophobicContact CZ-CG1 4.36Å; P981-I1015 HydrophobicContact CB-CB 4.48Å; P981-I1015 HydrophobicContact CB-CG1 3.91Å; P981-I1015 HydrophobicContact CB-CG2 4.25Å; P986-I1015 HydrophobicContact CG-CD1 3.68Å; L1011-I1015 VanDerWaalsContact O-CG1 3.31Å; L1011-I1015 WeakPolarHBondContact O-CG1 3.44Å; L1011-I1015 PolarHBondContact O-N 3.11Å; G1012-I1015 PolarHBondContact O-N 2.82Å; E1013-I1015 PolarHBondContact O-N 3.07Å; I1015-L1017 PolarHBondContact O-N 2.78Å; I1015-I1018 PolarHBondContact O-N 3.4Å; I1015-N1019 WeakPolarHBondContact CG2-ND2 3.31Å; I1015-N1019 VanDerWaalsContact O-CB 3.22Å; I1015-N1019 WeakPolarHBondContact O-CB 3.31Å; I1015-N1019 PolarHBondContact O-N 2.97Å; I1015-N1019 PolarHBondContact O-ND2 3.05Å
1016	Q	86	Confident	82.8	Confident	141 Å²	141	50.1 Å²	50.1	66%	0.659	27%	0.273	S	S	*	.	H	α-helix	trans	-64.9	-38.5	-179.3	-170	171.4	7.6	0	0	112.6	G1012 E1013 S1020	G1012-Q1016 WeakPolarHBondContact O-CB 3.41Å; G1012-Q1016 PolarHBondContact O-N 3.45Å; E1013-Q1016 PolarHBondContact O-N 3.25Å; Q1016-S1020 WeakPolarHBondContact O-CB 3.44Å; Q1016-S1020 PolarHBondContact O-N 3.1Å; Q1016-S1020 PolarHBondContact O-OG 2.75Å
1017	L	85.6	Confident	82.5	Confident	44 Å²	44	51.1 Å²	51.1	23%	0.23	29%	0.285	C	S	.	.	H	α-helix	trans	-68.9	-41.2	178.9	-170.8	68	0	0	0	111.9	I952 E1013 V1014 I1015 S1020 D1021 T1028 M1048	I952-L1017 HydrophobicContact CD1-CD2 3.91Å; E1013-L1017 VanDerWaalsContact O-CB 3.23Å; E1013-L1017 WeakPolarHBondContact O-CB 3.21Å; E1013-L1017 PolarHBondContact O-N 2.98Å; V1014-L1017 PolarHBondContact O-N 2.92Å; I1015-L1017 PolarHBondContact O-N 2.78Å; L1017-S1020 PolarHBondContact O-N 3.47Å; L1017-S1020 PolarHBondContact O-OG 2.8Å; L1017-S1020 VanDerWaalsContact O-OG 3.1Å; L1017-D1021 PolarHBondContact O-N 2.83Å; L1017-D1021 VanDerWaalsContact O-N 3.08Å; L1017-T1028 HydrophobicContact CD2-CG2 4Å; L1017-M1048 HydrophobicContact CD1-CE 4.12Å; L1017-M1048 HydrophobicContact CD2-CE 4.37Å
1018	I	83	Confident	82.3	Confident	14 Å²	14	51.2 Å²	51.2	7%	0.072	29%	0.285	C	S	.	.	H	α-helix	trans	-76.9	-33.8	-180	-67.5	174.1	0	0	0	111.4	I952 V964 V1014 I1015 S1020 G1022	I952-I1018 HydrophobicContact CD1-CD1 4.25Å; I952-I1018 HydrophobicContact CD1-CG1 4.49Å; I952-I1018 HydrophobicContact CG2-CD1 4.15Å; V964-I1018 HydrophobicContact CB-CD1 4.09Å; V964-I1018 HydrophobicContact CG1-CD1 3.37Å; V964-I1018 HydrophobicContact CG2-CD1 3.49Å; V964-I1018 VanDerWaalsContact CG2-CD1 3.49Å; V964-I1018 HydrophobicContact CG2-CG2 4.06Å; V1014-I1018 HydrophobicContact CG1-CD1 3.78Å; V1014-I1018 WeakPolarHBondContact O-CB 3.16Å; V1014-I1018 WeakPolarHBondContact O-CG1 3.46Å; V1014-I1018 PolarHBondContact O-N 3.45Å; I1015-I1018 PolarHBondContact O-N 3.4Å; I1018-S1020 PolarHBondContact O-N 3.46Å; I1018-G1022 VanDerWaalsContact O-CA 3.23Å; I1018-G1022 WeakPolarHBondContact O-CA 3.46Å; I1018-G1022 PolarHBondContact O-N 2.7Å
1019	N	81.9	Confident	82.2	Confident	113 Å²	113	52.8 Å²	52.8	60%	0.604	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-10.2	173.2	-69.8	-7.4	0	0	0	113.8	I1015	I1015-N1019 WeakPolarHBondContact CG2-ND2 3.31Å; I1015-N1019 VanDerWaalsContact O-CB 3.22Å; I1015-N1019 WeakPolarHBondContact O-CB 3.31Å; I1015-N1019 PolarHBondContact O-N 2.97Å; I1015-N1019 PolarHBondContact O-ND2 3.05Å
1020	S	77	Confident	82.2	Confident	84 Å²	84	51.3 Å²	51.3	59%	0.587	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-33.8	178.2	47.5	0	0	0	0	114	Q1016 L1017 I1018	Q1016-S1020 WeakPolarHBondContact O-CB 3.44Å; Q1016-S1020 PolarHBondContact O-N 3.1Å; Q1016-S1020 PolarHBondContact O-OG 2.75Å; L1017-S1020 PolarHBondContact O-N 3.47Å; L1017-S1020 PolarHBondContact O-OG 2.8Å; L1017-S1020 VanDerWaalsContact O-OG 3.1Å; I1018-S1020 PolarHBondContact O-N 3.46Å
1021	D	66	Low	82	Confident	74 Å²	74	52 Å²	52	40%	0.396	28%	0.284	S	S	.	.			trans	-149.8	82	174.3	-108.9	-57.2	0	0	0	110.2	L1017 K1023 K1024	L1017-D1021 PolarHBondContact O-N 2.83Å; L1017-D1021 VanDerWaalsContact O-N 3.08Å; D1021-K1023 PolarHBondContact O-N 3.27Å; D1021-K1024 HydrophobicContact CB-CB 4.01Å; D1021-K1024 HydrophobicContact CB-CD 3.97Å; D1021-K1024 HydrophobicContact CB-CG 4.03Å; D1021-K1024 PolarHBondContact O-N 2.91Å; D1021-K1024 VanDerWaalsContact OD1-CE 3.28Å; D1021-K1024 WeakPolarHBondContact OD1-CE 3.36Å; D1021-K1024 IonicContact OD1-NZ 2.68Å; D1021-K1024 PolarHBondContact OD1-NZ 3.46Å; D1021-K1024 WeakPolarHBondContact OD2-CD 3.42Å; D1021-K1024 IonicContact OD2-NZ 2.75Å; D1021-K1024 PolarHBondContact OD2-NZ 2.84Å
1022	G	61.9	Low	81.5	Confident	25 Å²	25	52.1 Å²	52.1	26%	0.258	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-13.6	-165.5	0	0	0	0	0	118	I1018	I1018-G1022 VanDerWaalsContact O-CA 3.23Å; I1018-G1022 WeakPolarHBondContact O-CA 3.46Å; I1018-G1022 PolarHBondContact O-N 2.7Å
1023	K	64.7	Low	80.9	Confident	146 Å²	146	54.7 Å²	54.7	64%	0.635	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.1	-10.8	175.6	-75.4	167.6	-179.6	139.8	0	115.4	E957 D1021	E957-K1023 VanDerWaalsContact CD-CE 3.48Å; E957-K1023 WeakPolarHBondContact OE1-CE 3.46Å; E957-K1023 IonicContact OE1-NZ 3.96Å; E957-K1023 PolarHBondContact OE1-NZ 2.92Å; E957-K1023 VanDerWaalsContact OE2-CE 3.3Å; E957-K1023 WeakPolarHBondContact OE2-CE 3.22Å; E957-K1023 IonicContact OE2-NZ 3.69Å; E957-K1023 PolarHBondContact OE2-NZ 3.41Å; D1021-K1023 PolarHBondContact O-N 3.27Å
1024	K	66.4	Low	79.8	Confident	132 Å²	132	53 Å²	53	57%	0.574	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-18.5	177.6	-57.2	-176.8	-169.9	139.8	0	113.6	D1021 V1026	D1021-K1024 HydrophobicContact CB-CB 4.01Å; D1021-K1024 HydrophobicContact CB-CD 3.97Å; D1021-K1024 HydrophobicContact CB-CG 4.03Å; D1021-K1024 PolarHBondContact O-N 2.91Å; D1021-K1024 VanDerWaalsContact OD1-CE 3.28Å; D1021-K1024 WeakPolarHBondContact OD1-CE 3.36Å; D1021-K1024 IonicContact OD1-NZ 2.68Å; D1021-K1024 PolarHBondContact OD1-NZ 3.46Å; D1021-K1024 WeakPolarHBondContact OD2-CD 3.42Å; D1021-K1024 IonicContact OD2-NZ 2.75Å; D1021-K1024 PolarHBondContact OD2-NZ 2.84Å; K1024-V1026 VanDerWaalsContact C-N 3.3Å; K1024-V1026 PolarHBondContact O-N 2.86Å
1025	G	71.2	Confident	78.4	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.01	30%	0.301	C	S	.	.	S	Bend	trans	-68.1	-25.2	178.6	0	0	0	0	0	114.5	I952 G1027 T1028	I952-G1025 WeakPolarHBondContact CD1-O 3.28Å; G1025-G1027 PolarHBondContact O-N 2.83Å; G1025-T1028 WeakPolarHBondContact O-CB 3.43Å; G1025-T1028 PolarHBondContact O-N 2.95Å; G1025-T1028 PolarHBondContact O-OG1 3.49Å
1026	V	83.8	Confident	76.4	Confident	57 Å²	57	58.4 Å²	58.4	35%	0.345	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	131.2	-174.3	-177	0	0	0	0	111.5	K1024 T1028	K1024-V1026 VanDerWaalsContact C-N 3.3Å; K1024-V1026 PolarHBondContact O-N 2.86Å; V1026-T1028 VanDerWaalsContact C-N 3.33Å
1027	G	84	Confident	74.4	Confident	27 Å²	27	59.1 Å²	59.1	28%	0.278	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	-6.2	-174	0	0	0	0	0	115	I952 G1025 K1029	I952-G1027 WeakPolarHBondContact O-CA 3.35Å; I952-G1027 PolarHBondContact O-N 2.81Å; G1025-G1027 PolarHBondContact O-N 2.83Å; G1027-K1029 PolarHBondContact O-N 3.08Å
1028	T	86.7	Confident	72.7	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.012	34%	0.342	C	S	.	.			trans	-66.7	133.4	175.6	-57.2	0	0	0	0	110.6	E951 I952 L1017 G1025 V1026 L1030 M1048	E951-T1028 WeakPolarHBondContact CA-O 3.48Å; I952-T1028 PolarHBondContact N-O 2.9Å; I952-T1028 VanDerWaalsContact N-O 3.13Å; L1017-T1028 HydrophobicContact CD2-CG2 4Å; G1025-T1028 WeakPolarHBondContact O-CB 3.43Å; G1025-T1028 PolarHBondContact O-N 2.95Å; G1025-T1028 PolarHBondContact O-OG1 3.49Å; V1026-T1028 VanDerWaalsContact C-N 3.33Å; T1028-L1030 HydrophobicContact CG2-CD2 4.25Å; T1028-M1048 HydrophobicContact CG2-CG 4.08Å; T1028-M1048 WeakPolarHBondContact OG1-CE 3.22Å
1029	K	91.3	Very high	70.8	Confident	79 Å²	79	66.9 Å²	66.9	34%	0.343	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	117.5	174.5	-77.9	-174.4	168.3	76.9	0	110.9	M950 E951 G1027 V1047	M950-K1029 CarbonylContact O-C 3.53Å; M950-K1029 WeakPolarHBondContact O-CA 3.38Å; E951-K1029 HydrophobicContact CB-CG 4.01Å; E951-K1029 VanDerWaalsContact CD-CE 3.41Å; E951-K1029 HydrophobicContact CG-CG 3.93Å; E951-K1029 IonicContact OE1-NZ 3.99Å; E951-K1029 PolarHBondContact OE1-NZ 3.48Å; E951-K1029 WeakPolarHBondContact OE2-CE 3.4Å; E951-K1029 IonicContact OE2-NZ 3.69Å; E951-K1029 PolarHBondContact OE2-NZ 2.68Å; G1027-K1029 PolarHBondContact O-N 3.08Å; K1029-V1047 PolarHBondContact N-O 3.1Å; K1029-V1047 PolarHBondContact O-N 2.82Å
1030	L	90.3	Very high	69	Low	7 Å²	7	68.8 Å²	68.8	4%	0.037	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	128.4	168.4	-55.4	-175.6	0	0	0	108.7	V949 M950 Q1010 E1013 V1014 T1028 I1044 A1046	V949-L1030 CarbonylContact C-O 3.58Å; V949-L1030 VanDerWaalsContact CA-O 3.32Å; V949-L1030 WeakPolarHBondContact CA-O 3.45Å; M950-L1030 PolarHBondContact N-O 2.87Å; M950-L1030 PolarHBondContact O-N 2.84Å; Q1010-L1030 HydrophobicContact CB-CD1 4.04Å; Q1010-L1030 HydrophobicContact CG-CB 4.12Å; Q1010-L1030 HydrophobicContact CG-CD1 4.34Å; Q1010-L1030 VanDerWaalsContact O-CD1 3.28Å; Q1010-L1030 WeakPolarHBondContact O-CD1 3.38Å; E1013-L1030 HydrophobicContact CB-CD1 3.78Å; E1013-L1030 WeakPolarHBondContact OE2-CD2 3.29Å; V1014-L1030 HydrophobicContact CG2-CD1 3.86Å; T1028-L1030 HydrophobicContact CG2-CD2 4.25Å; L1030-I1044 HydrophobicContact CB-CG2 3.97Å; L1030-I1044 HydrophobicContact CD2-CG2 4.17Å; L1030-I1044 HydrophobicContact CG-CG2 4.46Å; L1030-A1046 HydrophobicContact CD2-CB 3.64Å
1031	A	88.9	Confident	67.6	Low	15 Å²	15	70 Å²	70	12%	0.124	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	133.3	-179.7	0	0	0	0	0	111.9	V949 T1045	V949-A1031 HydrophobicContact CG2-CB 4.19Å; A1031-T1045 PolarHBondContact N-O 3.44Å; A1031-T1045 PolarHBondContact O-N 3.14Å
1032	T	85.2	Confident	67.2	Low	2 Å²	2	69.5 Å²	69.5	1%	0.012	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	139.2	177.5	-58.3	0	0	0	0	109.5	K947 V948 I1006 Q1010 P1042	K947-T1032 WeakPolarHBondContact CA-O 3.07Å; V948-T1032 PolarHBondContact N-O 2.98Å; V948-T1032 PolarHBondContact O-N 2.96Å; I1006-T1032 HydrophobicContact CD1-CG2 3.89Å; I1006-T1032 HydrophobicContact CG1-CG2 4.1Å; I1006-T1032 HydrophobicContact CG2-CG2 3.81Å; Q1010-T1032 PolarHBondContact NE2-OG1 3.18Å; T1032-P1042 HydrophobicContact CG2-CB 3.71Å
1033	V	76.9	Confident	67.3	Low	84 Å²	84	73.7 Å²	73.7	51%	0.509	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	119.8	177.2	-179.9	0	0	0	0	109.1	K945 K947 D1035	K945-V1033 HydrophobicContact CB-CG1 4.19Å; K945-V1033 HydrophobicContact CD-CG1 4.29Å; K947-V1033 HydrophobicContact CG-CG2 4.11Å; V1033-D1035 PolarHBondContact O-N 2.93Å
1034	L	67	Low	67.8	Low	40 Å²	40	68.3 Å²	68.3	21%	0.209	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	111.9	172.5	-77.3	148.7	0	0	0	110.1	R946 V1002 I1006	R946-L1034 HydrophobicContact CB-CB 4.32Å; R946-L1034 HydrophobicContact CB-CD1 4.06Å; R946-L1034 PolarHBondContact O-N 2.83Å; V1002-L1034 HydrophobicContact CG1-CD1 4.28Å; V1002-L1034 HydrophobicContact CG1-CD2 4.09Å; I1006-L1034 HydrophobicContact CD1-CD1 3.84Å; I1006-L1034 HydrophobicContact CD1-CD2 3.59Å; I1006-L1034 HydrophobicContact CD1-CG 3.58Å
1035	D	59	Low	68.4	Low	53 Å²	53	66 Å²	66	28%	0.283	39%	0.39	S	S	.	.			trans	-88.1	118.7	154.3	-102.6	-28.3	0	0	0	108.2	R89 K945 V1033 N1037 S1038	R89-D1035 IonicContact NH1-OD2 2.58Å; R89-D1035 PolarHBondContact NH1-OD2 2.91Å; R89-D1035 VanDerWaalsContact NH1-OD2 3.14Å; K945-D1035 VanDerWaalsContact CD-OD1 3.32Å; K945-D1035 WeakPolarHBondContact CD-OD1 3.24Å; K945-D1035 WeakPolarHBondContact CE-OD1 3.41Å; K945-D1035 IonicContact NZ-OD1 3.42Å; K945-D1035 PolarHBondContact NZ-OD1 2.68Å; K945-D1035 IonicContact NZ-OD2 2.84Å; K945-D1035 PolarHBondContact NZ-OD2 2.71Å; V1033-D1035 PolarHBondContact O-N 2.93Å; D1035-N1037 PolarHBondContact O-N 3.35Å; D1035-S1038 PolarHBondContact O-N 2.81Å
1036	P	47.4	Very low	68.6	Low	87 Å²	87	68.6 Å²	68.6	57%	0.565	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	0.3	-167.3	29.3	-36.6	0	0	0	115.5
1037	N	44.9	Very low	67.8	Low	156 Å²	156	70.1 Å²	70.1	83%	0.834	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.2	10.7	-177.3	-73.4	44.2	0	0	0	113.1	D1035	D1035-N1037 PolarHBondContact O-N 3.35Å
1038	S	48.5	Very low	66.5	Low	69 Å²	69	73.5 Å²	73.5	48%	0.483	43%	0.43	S	S	.	.			trans	-96.4	135.7	175.9	-170.6	0	0	0	0	112.1	D1035 E1040	D1035-S1038 PolarHBondContact O-N 2.81Å; S1038-E1040 PolarHBondContact OG-N 3.41Å
1039	T	44.8	Very low	64.5	Low	151 Å²	151	76.8 Å²	76.8	93%	0.926	45%	0.452	S	S	*	.			trans	-93.3	-3.4	171.2	-17.2	0	0	0	0	112.7
1040	E	42.6	Very low	61.7	Low	154 Å²	154	82.2 Å²	82.2	72%	0.72	48%	0.475	S	S	*	.	S	Bend	trans	-76.6	152.5	178.5	-68.6	-165.8	136.5	0	0	112.5	S1038	S1038-E1040 PolarHBondContact OG-N 3.41Å
1041	P	49.1	Very low	58.7	Low	110 Å²	110	89 Å²	89	71%	0.714	51%	0.512	S	S	*	.			trans	-60.4	143.1	177	25.3	-34.8	0	0	0	111.9	T1043	P1041-T1043 PolarHBondContact O-N 2.85Å; P1041-T1043 VanDerWaalsContact O-N 3.1Å
1042	P	57.4	Low	55.8	Low	63 Å²	63	94.2 Å²	94.2	41%	0.409	55%	0.547	S	S	.	.			trans	-66.4	112	-172.8	25.4	-34.1	0	0	0	112	I1006 T1032 I1044	I1006-P1042 HydrophobicContact CD1-CB 4.33Å; I1006-P1042 HydrophobicContact CG1-CB 3.91Å; I1006-P1042 HydrophobicContact CG1-CG 3.95Å; T1032-P1042 HydrophobicContact CG2-CB 3.71Å; P1042-I1044 PolarHBondContact O-N 3.31Å; P1042-I1044 VanDerWaalsContact O-N 3.09Å
1043	T	62.8	Low	53	Low	112 Å²	112	98.9 Å²	98.9	69%	0.687	58%	0.58	S	S	*	*			trans	-61.8	113.7	176.2	-38.5	0	0	0	0	110.6	P1041	P1041-T1043 PolarHBondContact O-N 2.85Å; P1041-T1043 VanDerWaalsContact O-N 3.1Å
1044	I	76	Confident	50.7	Low	34 Å²	34	99.5 Å²	99.5	17%	0.174	59%	0.594	C	S	.	*			trans	-80.9	130	169.1	-55.8	176.4	0	0	0	107.9	A1009 Q1010 E1013 L1030 P1042	A1009-I1044 HydrophobicContact CB-CD1 3.93Å; Q1010-I1044 HydrophobicContact CG-CD1 4.07Å; Q1010-I1044 HydrophobicContact CG-CG1 4.37Å; Q1010-I1044 HydrophobicContact CG-CG2 4.46Å; E1013-I1044 HydrophobicContact CG-CD1 4.28Å; E1013-I1044 WeakPolarHBondContact OE2-CG2 3.49Å; L1030-I1044 HydrophobicContact CB-CG2 3.97Å; L1030-I1044 HydrophobicContact CD2-CG2 4.17Å; L1030-I1044 HydrophobicContact CG-CG2 4.46Å; P1042-I1044 PolarHBondContact O-N 3.31Å; P1042-I1044 VanDerWaalsContact O-N 3.09Å
1045	T	78.2	Confident	48.8	Very low	82 Å²	82	101.9 Å²	101.9	50%	0.503	62%	0.62	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.6	104.2	170.9	-50.4	0	0	0	0	108.5	A1031	A1031-T1045 PolarHBondContact N-O 3.44Å; A1031-T1045 PolarHBondContact O-N 3.14Å
1046	A	75	Confident	47.2	Very low	56 Å²	56	106.5 Å²	106.5	46%	0.463	65%	0.65	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.1	131.1	171.9	0	0	0	0	0	110.7	L1030	L1030-A1046 HydrophobicContact CD2-CB 3.64Å
1047	V	68.8	Low	46.3	Very low	90 Å²	90	107 Å²	107	55%	0.545	66%	0.662	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.8	103.5	169.3	-177.4	0	0	0	0	107.5	K1029	K1029-V1047 PolarHBondContact N-O 3.1Å; K1029-V1047 PolarHBondContact O-N 2.82Å
1048	M	54.9	Low	45.7	Very low	97 Å²	97	105 Å²	105	48%	0.478	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-77.3	149.4	172	-57.8	-160	82	0	0	110.2	L1017 T1028	L1017-M1048 HydrophobicContact CD1-CE 4.12Å; L1017-M1048 HydrophobicContact CD2-CE 4.37Å; T1028-M1048 HydrophobicContact CG2-CG 4.08Å; T1028-M1048 WeakPolarHBondContact OG1-CE 3.22Å
1049	P	44.7	Very low	44.7	Very low	72 Å²	72	109.2 Å²	109.2	47%	0.468	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-62.2	141.3	170.9	27.3	-34	0	0	0	110.3
1050	K	33.2	Very low	44.1	Very low	192 Å²	192	108.1 Å²	108.1	84%	0.835	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-70.1	134.2	164.7	-81.4	-170.2	172.4	-172.3	0	109	S1052	K1050-S1052 PolarHBondContact O-N 2.81Å; K1050-S1052 VanDerWaalsContact O-N 3.11Å; K1050-S1052 PolarHBondContact O-OG 3Å
1051	D	28.2	Very low	43.5	Very low	150 Å²	150	109.8 Å²	109.8	80%	0.802	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-47.8	117.8	-178.5	-65.9	-71	0	0	0	112.2
1052	S	26.4	Very low	42.4	Very low	124 Å²	124	110.6 Å²	110.6	87%	0.867	68%	0.68	S	S	*	*			trans	-120.4	42.2	174.9	-59.4	0	0	0	0	109.1	K1050	K1050-S1052 PolarHBondContact O-N 2.81Å; K1050-S1052 VanDerWaalsContact O-N 3.11Å; K1050-S1052 PolarHBondContact O-OG 3Å
1053	S	27.1	Very low	41.1	Very low	100 Å²	100	115 Å²	115	70%	0.699	69%	0.693	S	S	*	*			trans	-110.5	70.7	-171.7	52.4	0	0	0	0	111
1054	A	27.6	Very low	39.5	Very low	98 Å²	98	118 Å²	118	81%	0.81	70%	0.703	S	S	*	*			trans	-139.5	60.3	173.2	0	0	0	0	0	110.4
1055	A	27.8	Very low	37.3	Very low	90 Å²	90	123.2 Å²	123.2	74%	0.744	73%	0.726	S	S	*	*			trans	-74.5	126.6	165.6	0	0	0	0	0	109.3	A1057	A1055-A1057 PolarHBondContact O-N 3.43Å
1056	T	25.8	Very low	35	Very low	150 Å²	150	127.3 Å²	127.3	92%	0.92	74%	0.744	S	S	*	*			trans	35.9	69.8	156.4	-41.9	0	0	0	0	116.7
1057	A	28	Very low	32.7	Very low	98 Å²	98	133.9 Å²	133.9	81%	0.81	77%	0.765	S	S	*	*			trans	-109.6	139.2	160.6	0	0	0	0	0	109.9	A1055	A1055-A1057 PolarHBondContact O-N 3.43Å
1058	S	32.6	Very low	30.8	Very low	114 Å²	114	138.5 Å²	138.5	80%	0.797	78%	0.777	S	S	*	*			trans	-69.5	146.8	-172.7	49.9	0	0	0	0	113.9	T1060	S1058-T1060 PolarHBondContact O-N 2.98Å; S1058-T1060 VanDerWaalsContact O-N 3.16Å
1059	N	27.3	Very low	29.7	Very low	157 Å²	157	139.9 Å²	139.9	84%	0.84	79%	0.792	S	S	*	*			trans	-74.7	94.6	-175.1	176.2	23.9	0	0	0	113.9
1060	T	32.8	Very low	29.1	Very low	127 Å²	127	142.5 Å²	142.5	78%	0.779	81%	0.809	S	S	*	*			trans	-149.1	89.4	159.5	19.2	0	0	0	0	113.8	S1058	S1058-T1060 PolarHBondContact O-N 2.98Å; S1058-T1060 VanDerWaalsContact O-N 3.16Å
1061	K	28.9	Very low	29.4	Very low	189 Å²	189	138.5 Å²	138.5	82%	0.822	80%	0.802	S	S	*	*			trans	-11.4	117.3	152.3	-179.1	-175	-176.1	179.9	0	117.1
1062	P	27.8	Very low	29.5	Very low	128 Å²	128	137.7 Å²	137.7	83%	0.831	80%	0.803	S	S	*	*			trans	-86.1	134.3	166.4	33.1	-32.1	0	0	0	112.4
1063	K	28.9	Very low	29.7	Very low	156 Å²	156	141.9 Å²	141.9	68%	0.678	80%	0.8	S	S	*	*			trans	-147.6	119.4	152.1	-173.8	-166.5	177.2	-168.6	0	109	E1065	K1063-E1065 WeakPolarHBondContact CE-OE2 3.38Å; K1063-E1065 IonicContact NZ-OE2 2.78Å; K1063-E1065 PolarHBondContact NZ-OE2 3Å
1064	I	30.4	Very low	29.8	Very low	175 Å²	175	143.7 Å²	143.7	90%	0.897	80%	0.801	S	S	*	*			trans	-139.5	148.5	150.5	-93.9	139	0	0	0	106.9
1065	E	28.6	Very low	29.8	Very low	142 Å²	142	143.2 Å²	143.2	66%	0.664	80%	0.798	S	S	*	*			trans	-120.5	144.9	-167.8	-166.7	166.3	166.8	0	0	107.7	K1063 E1067	K1063-E1065 WeakPolarHBondContact CE-OE2 3.38Å; K1063-E1065 IonicContact NZ-OE2 2.78Å; K1063-E1065 PolarHBondContact NZ-OE2 3Å; E1065-E1067 PolarHBondContact O-N 3.28Å
1066	I	29.7	Very low	30	Very low	169 Å²	169	144.1 Å²	144.1	87%	0.867	80%	0.798	S	S	*	*			trans	-90.4	108.1	-171.6	-58.2	172.8	0	0	0	110
1067	E	26.8	Very low	30.3	Very low	193 Å²	193	145.6 Å²	145.6	90%	0.902	80%	0.795	S	S	*	*			trans	-155.5	177.9	145.8	-127.1	-170.7	143.9	0	0	113.9	E1065	E1065-E1067 PolarHBondContact O-N 3.28Å
1068	K	30.4	Very low	30.2	Very low	187 Å²	187	149.5 Å²	149.5	81%	0.813	80%	0.796	S	S	*	*			trans	-109.4	137.7	-166	-67.5	175.7	177.4	174.4	0	113.4
1069	T	30.9	Very low	30.6	Very low	127 Å²	127	148.2 Å²	148.2	78%	0.779	79%	0.785	S	S	*	*			trans	10.1	135.5	146.9	56.5	0	0	0	0	119.5
1070	P	31.7	Very low	30.9	Very low	127 Å²	127	147.7 Å²	147.7	83%	0.825	78%	0.783	S	S	*	*				-134.5	165.7	93.6	38.9	-31.1	0	0	0	115.4
1071	P	39.1	Very low	30.7	Very low	107 Å²	107	148.2 Å²	148.2	70%	0.695	78%	0.781	S	S	*	*			trans	-117.4	168.9	-172.7	41.6	-32	0	0	0	116.4
1072	T	30.3	Very low	30.8	Very low	134 Å²	134	144.5 Å²	144.5	82%	0.822	77%	0.773	S	S	*	*			trans	67	155.1	167	36.1	0	0	0	0	116.7
1073	R	31.9	Very low	30.7	Very low	212 Å²	212	146.6 Å²	146.6	80%	0.8	77%	0.772	S	S	*	*			cis	-161	154.3	25.8	-153.2	-177.2	158.6	142.6	0.1	114.8
1074	D	28.4	Very low	30.6	Very low	137 Å²	137	144.5 Å²	144.5	73%	0.733	77%	0.772	S	S	*	*			trans	62.8	167.9	153.3	-89.6	-51.1	0	0	0	121.2
1075	A	28.8	Very low	30.6	Very low	89 Å²	89	141.8 Å²	141.8	74%	0.736	76%	0.764	S	S	*	*			trans	-135.6	173	-159.5	0	0	0	0	0	115.5
1076	S	30.8	Very low	30.6	Very low	108 Å²	108	142 Å²	142	76%	0.755	77%	0.769	S	S	*	*			trans	-163.1	126.8	161.6	-82.5	0	0	0	0	114
1077	Q	32.1	Very low	30.7	Very low	182 Å²	182	139.3 Å²	139.3	85%	0.85	76%	0.761	S	S	*	*			trans	55	113.8	143.6	-60.8	174.2	-27	0	0	119.8
1078	E	26.6	Very low	30.8	Very low	180 Å²	180	141.5 Å²	141.5	84%	0.841	76%	0.761	S	S	*	*				52	153.3	61.9	-78.3	-141.1	119.1	0	0	116.6
1079	P	41.2	Very low	30.7	Very low	86 Å²	86	141.6 Å²	141.6	56%	0.558	76%	0.761	S	S	*	*			cis	-142.9	-172.2	-31.1	38.2	-19.4	0	0	0	114.7
1080	N	31.9	Very low	30.7	Very low	147 Å²	147	141.1 Å²	141.1	79%	0.786	76%	0.758	S	S	*	*			trans	70.1	150.9	157.1	-70	-37.6	0	0	0	120.1
1081	N	29.4	Very low	30.6	Very low	138 Å²	138	140.2 Å²	140.2	74%	0.738	75%	0.754	S	S	*	*			cis	-166.4	164.9	-23	-169.7	8.1	0	0	0	110.4
1082	V	30.2	Very low	30.1	Very low	110 Å²	110	143 Å²	143	67%	0.667	76%	0.758	S	S	*	*			trans	68.5	103.7	162.9	-136.2	0	0	0	0	121.1
1083	Q	25.8	Very low	29.9	Very low	173 Å²	173	144.1 Å²	144.1	81%	0.808	75%	0.754	S	S	*	*				156	143.4	114.6	-88	-149.8	13.4	0	0	115.6
1084	V	27.7	Very low	30	Very low	112 Å²	112	139 Å²	139	68%	0.679	75%	0.751	S	S	*	*			trans	74.9	101.3	148.8	171.9	0	0	0	0	120.7
1085	T	31	Very low	30	Very low	117 Å²	117	139.8 Å²	139.8	72%	0.718	76%	0.755	S	S	*	*			trans	67.2	126.9	143.1	60.8	0	0	0	0	124.5
1086	N	28.4	Very low	30	Very low	147 Å²	147	139.1 Å²	139.1	79%	0.786	75%	0.749	S	S	*	*			trans	81.7	119.5	131.9	-79.4	-7.8	0	0	0	124.4
1087	V	31.9	Very low	29.8	Very low	113 Å²	113	142 Å²	142	69%	0.685	75%	0.751	S	S	*	*			trans	86.5	110.8	134.5	175.4	0	0	0	0	120.6
1088	R	28.3	Very low	29.6	Very low	239 Å²	239	138 Å²	138	90%	0.902	74%	0.743	S	S	*	*			trans	49.5	147.9	143.1	-61.3	175.8	170.6	153.4	-5.1	118.6
1089	K	27.6	Very low	29.7	Very low	189 Å²	189	134.6 Å²	134.6	82%	0.822	73%	0.734	S	S	*	*			cis	-167.6	177.3	31.9	-161.1	-177.3	176.1	-175.3	0	109.9
1090	V	30.8	Very low	29.1	Very low	117 Å²	117	138 Å²	138	71%	0.709	74%	0.743	S	S	*	*			trans	77.1	112.9	169.5	-165.4	0	0	0	0	112.1
1091	S	29.8	Very low	29	Very low	107 Å²	107	136.8 Å²	136.8	75%	0.748	75%	0.746	S	S	*	*				69.9	140.6	67.3	-48.3	0	0	0	0	112.5
1092	Q	28.8	Very low	29.1	Very low	165 Å²	165	136.7 Å²	136.7	77%	0.771	74%	0.744	S	S	*	*			cis	-153.4	167.9	21.7	-163.2	166.2	-12.9	0	0	113.6
1093	E	27.3	Very low	29.3	Very low	159 Å²	159	137.3 Å²	137.3	74%	0.743	75%	0.75	S	S	*	*			trans	-29.3	161.9	171.5	-61.2	151.7	131.9	0	0	118.7
1094	S	33.1	Very low	29.6	Very low	105 Å²	105	139.2 Å²	139.2	73%	0.734	75%	0.75	S	S	*	*			cis	-153	-175.6	7.8	51.3	0	0	0	0	108.9
1095	N	27.6	Very low	30.2	Very low	152 Å²	152	140.1 Å²	140.1	81%	0.813	76%	0.758	S	S	*	*			cis	-161.4	-174.3	24.4	-148	-10	0	0	0	113.1
1096	A	28.7	Very low	30.1	Very low	75 Å²	75	138.4 Å²	138.4	62%	0.62	76%	0.763	S	S	*	*			trans	-44.2	166.9	-178.6	0	0	0	0	0	118.6
1097	E	27.4	Very low	30.1	Very low	169 Å²	169	135 Å²	135	79%	0.79	76%	0.764	S	S	*	*			cis	-167.2	169.1	10.9	-143.3	178.7	113.7	0	0	113.2
1098	S	27.7	Very low	29.9	Very low	97 Å²	97	137.5 Å²	137.5	68%	0.678	77%	0.771	S	S	*	*			trans	67.4	151.8	154.7	-84	0	0	0	0	120.2
1099	V	29.8	Very low	30	Very low	109 Å²	109	133.9 Å²	133.9	66%	0.661	77%	0.768	S	S	*	*			cis	-157	145.4	-5.8	109.2	0	0	0	0	113.7
1100	Q	28	Very low	30	Very low	159 Å²	159	130.4 Å²	130.4	74%	0.743	76%	0.763	S	S	*	*			trans	40.3	135.4	154.5	-62.3	164.2	4.7	0	0	125
1101	S	30.7	Very low	29.9	Very low	121 Å²	121	133.8 Å²	133.8	85%	0.846	77%	0.773	S	S	*	*				-156.6	151.6	114	39.9	0	0	0	0	112
1102	I	30.2	Very low	29.8	Very low	135 Å²	135	133.8 Å²	133.8	69%	0.692	77%	0.773	S	S	*	*			trans	-149.2	131.7	-162.1	-72.1	169.6	0	0	0	108.8	R1104	I1102-R1104 HydrophobicContact CG2-CG 4.31Å
1103	P	35.5	Very low	30.3	Very low	123 Å²	123	131.9 Å²	131.9	80%	0.799	78%	0.775	S	S	*	*				-158.4	172.1	104.5	39.4	-20	0	0	0	116.5
1104	R	30.9	Very low	30.5	Very low	214 Å²	214	131.2 Å²	131.2	81%	0.808	78%	0.782	S	S	*	*			cis	-161.6	160.2	-32.4	-108.1	-168.4	177.7	-163.1	-0.2	108.5	I1102	I1102-R1104 HydrophobicContact CG2-CG 4.31Å
1105	P	41.7	Very low	30.1	Very low	130 Å²	130	133.7 Å²	133.7	84%	0.844	79%	0.787	S	S	*	*			trans	-112.8	175.4	-172.9	41.9	-34.7	0	0	0	115.9
1106	G	28.3	Very low	30.3	Very low	81 Å²	81	135.1 Å²	135.1	84%	0.835	79%	0.788	S	S	*	*			trans	177.6	148.2	162.8	0	0	0	0	0	110.7
1107	G	28.8	Very low	30.4	Very low	77 Å²	77	137.4 Å²	137.4	79%	0.794	80%	0.795	S	S	*	*			cis	-164.2	178.8	-2.5	0	0	0	0	0	111.4
1108	I	26.8	Very low	30.6	Very low	165 Å²	165	136.4 Å²	136.4	85%	0.846	80%	0.795	S	S	*	*			trans	-111.1	130.7	-172.7	-59.2	166.6	0	0	0	111
1109	I	31.2	Very low	30.8	Very low	162 Å²	162	136.6 Å²	136.6	83%	0.831	80%	0.797	S	S	*	*			trans	-140.7	109.8	154.9	-61.8	-173	0	0	0	111.1
1110	V	27.2	Very low	30.9	Very low	117 Å²	117	136 Å²	136	71%	0.709	80%	0.803	S	S	*	*			trans	24.3	125.5	135.3	-173.8	0	0	0	0	120
1111	M	28.9	Very low	31.3	Very low	187 Å²	187	134.1 Å²	134.1	92%	0.921	81%	0.805	S	S	*	*				-164.8	161.6	118.4	-108.3	-175.1	136	0	0	113.5
1112	S	27	Very low	31.7	Very low	108 Å²	108	134 Å²	134	76%	0.755	80%	0.801	S	S	*	*			trans	-114.7	169.8	-170.7	-55.8	0	0	0	0	111.6
1113	P	39.8	Very low	32.2	Very low	124 Å²	124	133.6 Å²	133.6	81%	0.805	81%	0.807	S	S	*	*			trans	-92.2	168.9	-153.5	36.9	-37.8	0	0	0	116.1
1114	T	30.4	Very low	32	Very low	145 Å²	145	134.6 Å²	134.6	89%	0.89	81%	0.811	S	S	*	*			trans	-145	148.7	165.3	25.5	0	0	0	0	111.5
1115	N	26.5	Very low	32.1	Very low	157 Å²	157	127.7 Å²	127.7	84%	0.84	81%	0.807	S	S	*	*			trans	-79	148	178.8	-83.6	-26.9	0	0	0	113.1
1116	Q	31.4	Very low	31.6	Very low	182 Å²	182	126.6 Å²	126.6	85%	0.85	81%	0.809	S	S	*	*				-173.3	137.9	116.5	-101.7	167.3	39.8	0	0	114
1117	T	29.1	Very low	31.9	Very low	123 Å²	123	127 Å²	127	76%	0.755	80%	0.804	S	S	*	*			trans	7.9	137.1	150.7	50.9	0	0	0	0	119.4
1118	D	31.6	Very low	32.3	Very low	148 Å²	148	128 Å²	128	79%	0.791	81%	0.805	S	S	*	*				-162.1	153.3	76	-152.4	-11.5	0	0	0	116.3
1119	S	32	Very low	33	Very low	102 Å²	102	129.5 Å²	129.5	71%	0.713	81%	0.805	S	S	*	*			trans	52.9	139.2	148.7	-75.3	0	0	0	0	126.5
1120	A	33.3	Very low	34.3	Very low	96 Å²	96	127.6 Å²	127.6	79%	0.793	80%	0.803	S	S	*	*			trans	86	113.5	148.6	0	0	0	0	0	120.9
1121	P	36.2	Very low	36.2	Very low	120 Å²	120	124.7 Å²	124.7	78%	0.779	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-89.8	152.2	167.5	36.1	-33.4	0	0	0	113
1122	P	39.7	Very low	38.9	Very low	117 Å²	117	119.1 Å²	119.1	76%	0.76	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-75.5	152.4	172.2	32.1	-34.7	0	0	0	112.1
1123	P	39	Very low	41.7	Very low	127 Å²	127	114.6 Å²	114.6	83%	0.825	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-73.3	146.7	-174.4	29.5	-35.6	0	0	0	113.4	G1125	P1123-G1125 PolarHBondContact O-N 2.99Å
1124	T	31.1	Very low	43.7	Very low	144 Å²	144	114.5 Å²	114.5	88%	0.883	71%	0.712	S	S	*	*			trans	-69.5	87	176.6	47.9	0	0	0	0	112.3	A1126	T1124-A1126 PolarHBondContact O-N 3.22Å
1125	G	33.9	Very low	45.8	Very low	70 Å²	70	110.7 Å²	110.7	72%	0.722	69%	0.689	S	S	*	*			trans	-68.3	109.7	161.8	0	0	0	0	0	110	P1123 A1127	P1123-G1125 PolarHBondContact O-N 2.99Å; G1125-A1127 PolarHBondContact O-N 3.48Å
1126	A	30.6	Very low	47.8	Very low	107 Å²	107	104.7 Å²	104.7	88%	0.884	66%	0.658	S	S	*	*			trans	-72.7	74	179.4	0	0	0	0	0	111.7	T1124 A1128	T1124-A1126 PolarHBondContact O-N 3.22Å; A1126-A1128 PolarHBondContact O-N 3.32Å
1127	A	34.7	Very low	49	Very low	90 Å²	90	103.8 Å²	103.8	74%	0.744	65%	0.651	S	S	*	*			trans	-65.6	113.1	167.6	0	0	0	0	0	108.8	G1125 K1129	G1125-A1127 PolarHBondContact O-N 3.48Å; A1127-K1129 PolarHBondContact O-N 2.94Å; A1127-K1129 VanDerWaalsContact O-N 3.08Å
1128	A	38.4	Very low	49.6	Very low	97 Å²	97	100.4 Å²	100.4	80%	0.802	63%	0.632	S	S	*	*			trans	-59.3	115.4	172.6	0	0	0	0	0	108.9	A1126	A1126-A1128 PolarHBondContact O-N 3.32Å
1129	K	40.6	Very low	49.6	Very low	197 Å²	197	98.2 Å²	98.2	86%	0.857	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-55.5	129.6	174.5	-70.9	-176.5	177.1	-178.3	0	108	A1127 S1131	A1127-K1129 PolarHBondContact O-N 2.94Å; A1127-K1129 VanDerWaalsContact O-N 3.08Å; K1129-S1131 PolarHBondContact O-N 3.23Å
1130	P	58.4	Low	49.7	Very low	121 Å²	121	100.3 Å²	100.3	79%	0.786	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-59.4	135.4	173.8	26.5	-33.7	0	0	0	108.4	R1132	P1130-R1132 PolarHBondContact O-N 3.26Å
1131	S	66.9	Low	49.9	Very low	56 Å²	56	100.7 Å²	100.7	39%	0.392	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-61.3	130.1	-178.4	179.6	0	0	0	0	110.3	Q666 K1129 F1133	Q666-S1131 PolarHBondContact OE1-OG 3.32Å; K1129-S1131 PolarHBondContact O-N 3.23Å; S1131-F1133 PolarHBondContact O-N 2.89Å; S1131-F1133 WeakPolarHBondContact OG-CD2 3.33Å; S1131-F1133 PolarHBondContact OG-N 3.41Å; S1131-F1133 VanDerWaalsContact OG-N 3.15Å
1132	R	86.6	Confident	49.5	Very low	70 Å²	70	102.8 Å²	102.8	26%	0.264	64%	0.635	S	S	.	*	S	Bend	trans	-66.7	-14.9	173.6	-154.2	178.9	-162.4	-175.5	-5.1	112.3	E621 F647 A648 D654 P1130	E621-R1132 IonicContact OE1-CZ 2.97Å; E621-R1132 IonicContact OE1-NE 2.89Å; E621-R1132 PolarHBondContact OE1-NE 2.76Å; E621-R1132 IonicContact OE1-NH2 3.17Å; E621-R1132 PolarHBondContact OE1-NH2 3.06Å; F647-R1132 WeakPolarHBondContact CA-O 3.14Å; A648-R1132 HydrophobicContact CB-CG 4.1Å; A648-R1132 WeakPolarHBondContact O-CD 3.45Å; A648-R1132 VanDerWaalsContact O-CZ 3.29Å; A648-R1132 PolarHBondContact O-NE 3.21Å; A648-R1132 VanDerWaalsContact O-NE 3.14Å; D654-R1132 IonicContact OD1-NH1 3.45Å; D654-R1132 PolarHBondContact OD1-NH1 2.86Å; D654-R1132 IonicContact OD2-CZ 3.33Å; D654-R1132 IonicContact OD2-NH1 3.17Å; D654-R1132 PolarHBondContact OD2-NH1 2.85Å; D654-R1132 IonicContact OD2-NH2 2.68Å; D654-R1132 PolarHBondContact OD2-NH2 2.9Å; P1130-R1132 PolarHBondContact O-N 3.26Å
1133	F	85.8	Confident	49.1	Very low	13 Å²	13	102 Å²	102	6%	0.057	64%	0.639	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.9	122.7	-174.9	-56	-80.4	0	0	0	110.7	L645 Q646 F647 V659 Q662 M663 S1131	L645-F1133 HydrophobicContact CD1-CB 4.12Å; L645-F1133 HydrophobicContact CD2-CD1 4.37Å; Q646-F1133 WeakPolarHBondContact O-CA 3.2Å; F647-F1133 HydrophobicContact CB-CD1 3.56Å; F647-F1133 HydrophobicContact CB-CE1 3.71Å; F647-F1133 HydrophobicContact CG-CD1 4.3Å; F647-F1133 HydrophobicContact CG-CE1 4.16Å; V659-F1133 HydrophobicContact CG1-CE1 4.28Å; V659-F1133 HydrophobicContact CG1-CZ 4.31Å; Q662-F1133 HydrophobicContact CB-CE2 3.84Å; Q662-F1133 HydrophobicContact CB-CZ 3.9Å; M663-F1133 HydrophobicContact CB-CE1 4.48Å; M663-F1133 HydrophobicContact CE-CD1 4.22Å; M663-F1133 HydrophobicContact CE-CE1 3.65Å; M663-F1133 HydrophobicContact CG-CD1 3.8Å; M663-F1133 HydrophobicContact CG-CE1 3.26Å; M663-F1133 HydrophobicContact CG-CZ 3.84Å; M663-F1133 HydrophobicContact SD-CE1 4.29Å; S1131-F1133 PolarHBondContact O-N 2.89Å; S1131-F1133 WeakPolarHBondContact OG-CD2 3.33Å; S1131-F1133 PolarHBondContact OG-N 3.41Å; S1131-F1133 VanDerWaalsContact OG-N 3.15Å
1134	Q	80.4	Confident	48.6	Very low	123 Å²	123	102.1 Å²	102.1	58%	0.575	64%	0.637	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-128.6	122.6	-178.4	-61.2	-172.7	12.8	0	0	110.5	Q646 T1136	Q646-Q1134 WeakPolarHBondContact CB-O 3.46Å; Q646-Q1134 PolarHBondContact N-O 2.95Å; Q646-Q1134 PolarHBondContact O-N 3.31Å; Q1134-T1136 PolarHBondContact O-N 2.92Å
1135	V	75.4	Confident	48.7	Very low	64 Å²	64	100.9 Å²	100.9	39%	0.388	63%	0.632	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.7	104	175.8	179.9	0	0	0	0	109.2	F639 E643 L645	F639-V1135 HydrophobicContact CB-CG1 3.63Å; F639-V1135 HydrophobicContact CB-CG2 4.27Å; E643-V1135 HydrophobicContact CB-CG1 3.82Å; E643-V1135 HydrophobicContact CG-CG1 4.24Å; L645-V1135 HydrophobicContact CD1-CG2 4.02Å
1136	T	69.1	Low	48.5	Very low	31 Å²	31	104.8 Å²	104.8	19%	0.19	63%	0.634	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.1	129.3	-178.5	67	0	0	0	0	111.8	K609 Q625 E643 G644 Q646 Q1134	K609-T1136 PolarHBondContact NZ-OG1 2.88Å; Q625-T1136 PolarHBondContact NE2-OG1 3.35Å; E643-T1136 WeakPolarHBondContact CA-O 3.42Å; G644-T1136 PolarHBondContact N-O 3.07Å; G644-T1136 PolarHBondContact O-N 3.23Å; G644-T1136 PolarHBondContact O-OG1 3.33Å; Q646-T1136 HydrophobicContact CB-CG2 4.02Å; Q646-T1136 VanDerWaalsContact OE1-CG2 3.27Å; Q1134-T1136 PolarHBondContact O-N 2.92Å
1137	K	55.7	Low	48.5	Very low	164 Å²	164	105.8 Å²	105.8	71%	0.713	64%	0.635	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.7	136.8	170.1	-72.1	166.2	-179.3	168	0	110.9	E643	E643-K1137 HydrophobicContact CG-CB 4.46Å; E643-K1137 HydrophobicContact CG-CG 3.65Å; E643-K1137 WeakPolarHBondContact OE1-CE 3.22Å; E643-K1137 VanDerWaalsContact OE1-CG 3.31Å; E643-K1137 WeakPolarHBondContact OE1-CG 3.16Å
1138	S	42.1	Very low	48.2	Very low	52 Å²	52	107.1 Å²	107.1	36%	0.364	64%	0.639	S	S	.	*	P	Polyproline II helix	trans	-70.2	131.3	172.5	-76.6	0	0	0	0	113	N642	N642-S1138 WeakPolarHBondContact O-CB 3.37Å; N642-S1138 PolarHBondContact O-N 2.74Å; N642-S1138 PolarHBondContact O-OG 3.18Å
1139	A	31.9	Very low	47.8	Very low	101 Å²	101	108.1 Å²	108.1	84%	0.835	64%	0.64	S	S	*	*			trans	-148.3	125.2	160.2	0	0	0	0	0	108.2
1140	D	33.9	Very low	47.2	Very low	146 Å²	146	106.2 Å²	106.2	78%	0.781	64%	0.637	S	S	*	*			trans	-119.6	160.4	-176	-67	-54.3	0	0	0	109.6
1141	P	38.3	Very low	45.9	Very low	105 Å²	105	106.1 Å²	106.1	68%	0.682	64%	0.64	S	S	*	*			cis	-135.1	169.6	-25	36.5	-19.4	0	0	0	114.5
1142	I	27.2	Very low	44	Very low	163 Å²	163	109.6 Å²	109.6	84%	0.836	66%	0.659	S	S	*	*			trans	57.5	108.3	157.2	-60	155	0	0	0	118.5
1143	A	30.1	Very low	41.3	Very low	102 Å²	102	111 Å²	111	84%	0.843	69%	0.685	S	S	*	*			trans	-159.9	106.1	137.1	0	0	0	0	0	111
1144	T	30	Very low	38.6	Very low	129 Å²	129	116.4 Å²	116.4	79%	0.791	72%	0.72	S	S	*	*			trans	-106.4	147.9	168.4	53.6	0	0	0	0	109.8
1145	P	32.9	Very low	36.2	Very low	118 Å²	118	116.8 Å²	116.8	77%	0.766	73%	0.73	S	S	*	*				-144.7	130.6	97.2	35.2	-19.4	0	0	0	116.1
1146	I	29	Very low	34.2	Very low	151 Å²	151	121 Å²	121	77%	0.774	75%	0.749	S	S	*	*				31.8	113.8	129.3	-48.7	171.3	0	0	0	117.8
1147	S	31.4	Very low	32.7	Very low	129 Å²	129	124.3 Å²	124.3	90%	0.902	77%	0.771	S	S	*	*				-162.2	131.1	127.9	-81.6	0	0	0	0	110.8
1148	S	27.4	Very low	31.5	Very low	117 Å²	117	123.9 Å²	123.9	82%	0.818	78%	0.775	S	S	*	*			trans	-121.1	132.5	-177.5	52.5	0	0	0	0	110.6
1149	S	31.5	Very low	31	Very low	118 Å²	118	127.5 Å²	127.5	83%	0.825	79%	0.794	S	S	*	*			trans	-149.2	103.8	168.7	61.3	0	0	0	0	112.6
1150	I	27.1	Very low	31	Very low	157 Å²	157	127.2 Å²	127.2	81%	0.805	79%	0.792	S	S	*	*			trans	-26.1	139	154.9	-61.8	148.7	0	0	0	113.2
1151	S	30.3	Very low	30.9	Very low	120 Å²	120	124.7 Å²	124.7	84%	0.839	79%	0.791	S	S	*	*			trans	-160.2	134.8	136	-81.3	0	0	0	0	112.5
1152	T	28.4	Very low	30.5	Very low	128 Å²	128	125.9 Å²	125.9	79%	0.785	80%	0.797	S	S	*	*			trans	-63.1	156.8	175.6	41.6	0	0	0	0	113.8
1153	A	28.8	Very low	31.3	Very low	99 Å²	99	123.1 Å²	123.1	82%	0.818	79%	0.789	S	S	*	*			trans	-87.2	142.9	170.8	0	0	0	0	0	111.9
1154	T	30.3	Very low	31.5	Very low	127 Å²	127	124.7 Å²	124.7	78%	0.779	79%	0.789	S	S	*	*			trans	-141.4	135.6	163.9	-63.6	0	0	0	0	108.6
1155	V	29.1	Very low	31.6	Very low	132 Å²	132	124.7 Å²	124.7	80%	0.8	78%	0.784	S	S	*	*			trans	-106.4	131	178.1	174.7	0	0	0	0	110.1
1156	I	32.8	Very low	31.7	Very low	153 Å²	153	126.4 Å²	126.4	79%	0.785	79%	0.785	S	S	*	*			trans	-138.8	128.4	158.2	-56.8	-177.9	0	0	0	107.7
1157	P	37.6	Very low	31.8	Very low	99 Å²	99	123.8 Å²	123.8	64%	0.643	78%	0.777	S	S	*	*			trans	-92.6	166.5	179.7	37.1	-35.8	0	0	0	113.1
1158	I	31.4	Very low	31.9	Very low	156 Å²	156	122.3 Å²	122.3	80%	0.8	77%	0.766	S	S	*	*			trans	177.8	116.2	134	-93.1	156.9	0	0	0	113
1159	V	32.6	Very low	31.9	Very low	127 Å²	127	125.3 Å²	125.3	77%	0.77	77%	0.767	S	S	*	*			trans	48.6	117.6	135.3	-170.2	0	0	0	0	123
1160	A	30.5	Very low	32.7	Very low	95 Å²	95	124.4 Å²	124.4	79%	0.785	76%	0.759	S	S	*	*			trans	62.6	151.7	142.2	0	0	0	0	0	121.8
1161	A	32.3	Very low	32.8	Very low	93 Å²	93	123 Å²	123	77%	0.769	76%	0.757	S	S	*	*			cis	-161.5	170.1	-16.7	0	0	0	0	0	113
1162	T	30.6	Very low	32.7	Very low	130 Å²	130	124.3 Å²	124.3	80%	0.798	75%	0.753	S	S	*	*			trans	-63	-170	176.6	56.1	0	0	0	0	115.7
1163	P	44.2	Very low	32.8	Very low	105 Å²	105	124 Å²	124	68%	0.682	75%	0.75	S	S	*	*			cis	-139.6	179.9	-1.8	34.3	-11.8	0	0	0	117.1
1164	T	33.6	Very low	32.9	Very low	136 Å²	136	127.6 Å²	127.6	83%	0.834	75%	0.75	S	S	*	*				162.6	139.1	123.1	36.8	0	0	0	0	111.4
1165	N	31.8	Very low	33.6	Very low	129 Å²	129	126.1 Å²	126.1	69%	0.69	74%	0.743	S	S	*	*			cis	-134.8	-129.1	-12.3	-167.3	2.9	0	0	0	109.1	T1167	N1165-T1167 PolarHBondContact ND2-OG1 3.16Å
1166	I	34.3	Very low	33.8	Very low	153 Å²	153	127 Å²	127	79%	0.785	74%	0.742	S	S	*	*			cis	-140.8	108.5	5	-61.7	169.2	0	0	0	110.6
1167	T	32.4	Very low	33.9	Very low	97 Å²	97	125 Å²	125	60%	0.595	74%	0.737	S	S	*	*			trans	47.9	77.9	131.2	-38.7	0	0	0	0	122.4	N1165	N1165-T1167 PolarHBondContact ND2-OG1 3.16Å
1168	S	32.7	Very low	33.7	Very low	97 Å²	97	124.8 Å²	124.8	68%	0.678	74%	0.743	S	S	*	*				59	119.4	115.4	72.8	0	0	0	0	126.2
1169	E	28.6	Very low	34	Very low	180 Å²	180	125.7 Å²	125.7	84%	0.841	74%	0.744	S	S	*	*				72.1	160.8	117.8	-69	-68.3	89.9	0	0	124.1
1170	P	47.4	Very low	34	Very low	100 Å²	100	125.6 Å²	125.6	65%	0.649	74%	0.743	S	S	*	*			trans	-132.3	-166.3	-145.5	46.8	-31.5	0	0	0	116.3
1171	V	29.5	Very low	34.2	Very low	128 Å²	128	127.7 Å²	127.7	78%	0.776	74%	0.74	S	S	*	*			trans	174.6	137.8	135.9	146.2	0	0	0	0	115.4
1172	I	28.5	Very low	34.2	Very low	147 Å²	147	128 Å²	128	75%	0.754	73%	0.732	S	S	*	*			trans	-14.3	144.1	154.1	-15.5	176.9	0	0	0	117
1173	V	30.2	Very low	34.4	Very low	120 Å²	120	129.5 Å²	129.5	73%	0.727	73%	0.73	S	S	*	*				-173.4	135.9	65.8	173	0	0	0	0	114.2
1174	Q	30.7	Very low	33.7	Very low	175 Å²	175	131.9 Å²	131.9	82%	0.818	74%	0.736	S	S	*	*			trans	13.5	175.7	143	-62.7	-167.5	14.3	0	0	124.8
1175	P	44.7	Very low	33.5	Very low	97 Å²	97	129.8 Å²	129.8	63%	0.63	73%	0.733	S	S	*	*			cis	-142.9	-162	-38.7	38.1	-17	0	0	0	115.9
1176	I	33.5	Very low	33.8	Very low	151 Å²	151	130.1 Å²	130.1	77%	0.774	74%	0.74	S	S	*	*			trans	83.6	143.6	155.4	-70.6	164.7	0	0	0	119
1177	T	34.5	Very low	33.9	Very low	111 Å²	111	128.6 Å²	128.6	68%	0.681	74%	0.74	S	S	*	*			cis	-174.2	139.5	-27.8	-78.4	0	0	0	0	109.5
1178	A	34.7	Very low	34	Very low	94 Å²	94	129.2 Å²	129.2	78%	0.777	75%	0.748	S	S	*	*			trans	166.2	147.8	142.7	0	0	0	0	0	112.5
1179	Q	36.6	Very low	34.7	Very low	175 Å²	175	130 Å²	130	82%	0.818	75%	0.751	S	S	*	*			cis	-164.7	179.4	-33.1	-140.5	-175.6	10.4	0	0	109.3
1180	V	33.2	Very low	34.8	Very low	124 Å²	124	128.7 Å²	128.7	75%	0.752	76%	0.755	S	S	*	*			trans	75.7	139.1	174.1	171.2	0	0	0	0	114.7
1181	I	34.5	Very low	33.8	Very low	139 Å²	139	128.6 Å²	128.6	71%	0.713	76%	0.756	S	S	*	*			cis	-164.5	144.6	-19.1	-97.5	-173.3	0	0	0	104.1
1182	T	33.1	Very low	33.9	Very low	99 Å²	99	131.8 Å²	131.8	61%	0.607	76%	0.763	S	S	*	*			cis	-160.7	157.2	-17	35.7	0	0	0	0	110.2
1183	H	33.1	Very low	33.7	Very low	162 Å²	162	129.7 Å²	129.7	75%	0.75	76%	0.761	S	S	*	*			trans	26.6	153.7	137.4	-51.2	-43.5	0	0	0	124
1184	L	29.2	Very low	33.6	Very low	156 Å²	156	131.2 Å²	131.2	82%	0.817	76%	0.764	S	S	*	*			cis	-174	164.6	-30.5	-151.7	73.3	0	0	0	109.2
1185	A	31	Very low	33.4	Very low	92 Å²	92	127.5 Å²	127.5	76%	0.76	76%	0.758	S	S	*	*			trans	79.2	145.3	155.8	0	0	0	0	0	121.3
1186	T	37.3	Very low	32.6	Very low	135 Å²	135	127.4 Å²	127.4	83%	0.828	76%	0.759	S	S	*	*			trans	-89.1	174.6	170.3	36.8	0	0	0	0	110.7
1187	P	36.1	Very low	32.3	Very low	122 Å²	122	127.4 Å²	127.4	79%	0.792	76%	0.761	S	S	*	*			cis	-139.2	-169.9	23.8	42.1	-20.6	0	0	0	117.5
1188	S	34.4	Very low	31.9	Very low	110 Å²	110	127 Å²	127	77%	0.769	76%	0.762	S	S	*	*			trans	-87.4	-168.7	-177.7	-24.1	0	0	0	0	113.4
1189	P	47.2	Very low	31.7	Very low	112 Å²	112	128.1 Å²	128.1	73%	0.727	77%	0.765	S	S	*	*			cis	-134.3	171.8	-23	38.1	-21.8	0	0	0	114.8
1190	V	30.5	Very low	31.7	Very low	154 Å²	154	125.6 Å²	125.6	93%	0.933	76%	0.763	S	S	*	*			trans	-153.2	165.8	150.8	-116.6	0	0	0	0	112.1
1191	S	28.4	Very low	31.4	Very low	97 Å²	97	125.3 Å²	125.3	68%	0.678	77%	0.767	S	S	*	*			trans	-138.8	142.9	-162.8	-45	0	0	0	0	114.9
1192	H	29.8	Very low	31.2	Very low	196 Å²	196	122.9 Å²	122.9	91%	0.907	77%	0.767	S	S	*	*			trans	-159	126.3	152.3	-68.9	-69	0	0	0	106.4
1193	S	26.2	Very low	31	Very low	103 Å²	103	123.5 Å²	123.5	72%	0.72	77%	0.771	S	S	*	*			cis	87.8	122.6	11.8	-142.4	0	0	0	0	117.4
1194	L	28	Very low	30.9	Very low	152 Å²	152	122.7 Å²	122.7	80%	0.796	78%	0.778	S	S	*	*			trans	83.8	103.4	163.5	-53.6	-178.8	0	0	0	122.1
1195	S	26	Very low	30.8	Very low	97 Å²	97	123.6 Å²	123.6	68%	0.678	78%	0.778	S	S	*	*				76.6	104.3	112	-54.3	0	0	0	0	124.2
1196	S	28.1	Very low	30.9	Very low	94 Å²	94	124.9 Å²	124.9	66%	0.657	78%	0.781	S	S	*	*				73.8	132.7	119.8	70	0	0	0	0	124.1
1197	N	26	Very low	30.6	Very low	152 Å²	152	125.8 Å²	125.8	81%	0.813	78%	0.78	S	S	*	*			trans	73.3	149.3	155.1	-53.3	-17.8	0	0	0	116.9
1198	S	27.5	Very low	30.4	Very low	102 Å²	102	127 Å²	127	71%	0.713	78%	0.778	S	S	*	*			cis	-153.9	150.2	13	-28.3	0	0	0	0	113.3
1199	S	29.2	Very low	30.3	Very low	118 Å²	118	126.9 Å²	126.9	83%	0.825	78%	0.777	S	S	*	*			trans	64.4	177.9	142.2	-60.6	0	0	0	0	117.9
1200	P	36.2	Very low	29.5	Very low	122 Å²	122	126.9 Å²	126.9	79%	0.792	78%	0.779	S	S	*	*			cis	-129.9	-165.5	3	44.6	-27.5	0	0	0	115.5
1201	S	26.8	Very low	29.6	Very low	117 Å²	117	126 Å²	126	82%	0.818	77%	0.767	S	S	*	*			trans	-107.1	176.5	175	-48.7	0	0	0	0	112.8
1202	A	31.1	Very low	29.7	Very low	88 Å²	88	129.5 Å²	129.5	73%	0.727	77%	0.773	S	S	*	*			trans	107.7	103	153.1	0	0	0	0	0	119.8
1203	T	28.2	Very low	29.6	Very low	113 Å²	113	125.5 Å²	125.5	69%	0.693	77%	0.767	S	S	*	*				71.9	114.5	126.1	-45.5	0	0	0	0	121.4
1204	T	31	Very low	29.8	Very low	144 Å²	144	127.8 Å²	127.8	88%	0.883	78%	0.777	S	S	*	*				-170.8	168	116.3	18.9	0	0	0	0	112.2
1205	H	28.4	Very low	29.9	Very low	176 Å²	176	126.8 Å²	126.8	82%	0.815	78%	0.778	S	S	*	*			trans	-123.1	138.7	-167.7	-57.8	-114.4	0	0	0	114.3
1206	S	32.1	Very low	30.2	Very low	118 Å²	118	128.2 Å²	128.2	83%	0.825	79%	0.787	S	S	*	*			trans	177.7	116.1	140.8	51.5	0	0	0	0	108.4
1207	N	31.4	Very low	30.6	Very low	154 Å²	154	129.8 Å²	129.8	82%	0.824	79%	0.793	S	S	*	*			cis	100.2	136.7	38.9	-165.5	25.2	0	0	0	112.9
1208	M	31.8	Very low	31.7	Very low	149 Å²	149	128.6 Å²	128.6	73%	0.734	79%	0.794	S	S	*	*			trans	68.8	86.4	174.2	-55.1	-143.7	73.4	0	0	120.6
1209	S	32	Very low	32	Very low	107 Å²	107	127 Å²	127	75%	0.748	79%	0.793	S	S	*	*				49.9	107.9	112.7	-49.1	0	0	0	0	121.6
1210	S	32	Very low	32.5	Very low	111 Å²	111	133.2 Å²	133.2	78%	0.776	80%	0.799	S	S	*	*				138.8	159.4	93	-151.3	0	0	0	0	117.5
1211	I	31.5	Very low	32.3	Very low	135 Å²	135	136.4 Å²	136.4	69%	0.692	80%	0.795	S	S	*	*			trans	73.1	93.3	161.7	-42.6	-168.9	0	0	0	120.1
1212	Q	29.8	Very low	32.7	Very low	171 Å²	171	138 Å²	138	80%	0.799	79%	0.787	S	S	*	*			trans	64.7	103.5	133.8	-61	174.1	-10.8	0	0	122.8
1213	S	27.9	Very low	32.9	Very low	112 Å²	112	139.7 Å²	139.7	78%	0.783	79%	0.789	S	S	*	*				51.3	125.9	108.8	-49.9	0	0	0	0	122.3
1214	T	31	Very low	33	Very low	151 Å²	151	140.1 Å²	140.1	93%	0.926	79%	0.791	S	S	*	*				-155.2	154.4	125.7	9.2	0	0	0	0	110.8
1215	T	29.9	Very low	33.1	Very low	132 Å²	132	141.8 Å²	141.8	81%	0.81	79%	0.788	S	S	*	*			trans	-114.5	145.6	-178.1	48.6	0	0	0	0	111.8
1216	S	33.4	Very low	33.9	Very low	126 Å²	126	138.3 Å²	138.3	88%	0.881	78%	0.782	S	S	*	*			trans	-88	126.8	176.8	55.2	0	0	0	0	113.2
1217	V	35.6	Very low	33.9	Very low	127 Å²	127	138.7 Å²	138.7	77%	0.77	78%	0.779	S	S	*	*			trans	-86.9	-175.3	172.6	-153.8	0	0	0	0	110.1
1218	P	49.6	Very low	34.3	Very low	128 Å²	128	136.6 Å²	136.6	83%	0.831	78%	0.776	S	S	*	*				-153.2	149.1	107.4	36.6	-18.7	0	0	0	119.3
1219	G	32.3	Very low	34.4	Very low	68 Å²	68	138.8 Å²	138.8	70%	0.701	79%	0.785	S	S	*	*			trans	113.5	142.7	150.3	0	0	0	0	0	116.4
1220	R	39.8	Very low	34.5	Very low	249 Å²	249	138.1 Å²	138.1	94%	0.94	79%	0.785	S	S	*	*			cis	-166.3	164.1	2	-97.2	169.6	-176.7	169.3	0.6	106.9
1221	R	32.5	Very low	34.8	Very low	189 Å²	189	141.3 Å²	141.3	71%	0.713	79%	0.788	S	S	*	*			cis	-167.4	170.8	-4.8	173.7	-178.4	174	-157.4	-2.5	107.7
1222	F	35.1	Very low	34.9	Very low	150 Å²	150	140.8 Å²	140.8	66%	0.658	80%	0.796	S	S	*	*			trans	83.1	117.2	168.4	-50	-77.4	0	0	0	115.3
1223	T	35	Very low	35.1	Very low	124 Å²	124	136 Å²	136	76%	0.761	79%	0.794	S	S	*	*			cis	83.8	137	39.9	67.2	0	0	0	0	114.1
1224	V	31.2	Very low	35.5	Very low	122 Å²	122	138.6 Å²	138.6	74%	0.739	80%	0.797	S	S	*	*			cis	-150.5	135.4	33.3	-178.9	0	0	0	0	108.6
1225	Q	32.2	Very low	35.6	Very low	178 Å²	178	137.4 Å²	137.4	83%	0.832	80%	0.795	S	S	*	*				52.9	155	87.4	-92.7	-163.4	-6.9	0	0	118.3
1226	P	45.9	Very low	35.6	Very low	104 Å²	104	136.9 Å²	136.9	68%	0.675	80%	0.796	S	S	*	*			cis	-142.6	-157.5	-41.7	38.2	-16.4	0	0	0	115.4
1227	V	32.1	Very low	35.5	Very low	125 Å²	125	136 Å²	136	76%	0.758	79%	0.79	S	S	*	*			trans	101.7	87	164.7	-172.9	0	0	0	0	117.6
1228	S	38.8	Very low	35.3	Very low	110 Å²	110	137.4 Å²	137.4	77%	0.769	79%	0.792	S	S	*	*				93.7	170.9	96.2	-58.9	0	0	0	0	114.2
1229	Q	35.1	Very low	34.3	Very low	196 Å²	196	136 Å²	136	92%	0.916	79%	0.785	S	S	*	*			cis	-132.1	-102.3	12	-69.3	176.2	-113.1	0	0	116.3
1230	A	34.2	Very low	34.3	Very low	92 Å²	92	139.2 Å²	139.2	76%	0.76	79%	0.791	S	S	*	*			trans	-151.1	175.6	-160.9	0	0	0	0	0	112.3
1231	E	37.1	Very low	34.4	Very low	178 Å²	178	132.6 Å²	132.6	83%	0.832	78%	0.78	S	S	*	*			cis	-148.8	153.7	29.9	-62.4	-173.2	99.4	0	0	117.3
1232	S	34.6	Very low	34.5	Very low	124 Å²	124	131.4 Å²	131.4	87%	0.867	78%	0.782	S	S	*	*			trans	66.4	139.1	147.3	77.5	0	0	0	0	121.7
1233	G	33.6	Very low	34.8	Very low	72 Å²	72	130 Å²	130	74%	0.742	79%	0.788	S	S	*	*			trans	167.8	32.7	176.7	0	0	0	0	0	120.1
1234	I	35.8	Very low	34.7	Very low	166 Å²	166	130.3 Å²	130.3	85%	0.851	78%	0.781	S	S	*	*			trans	46.3	102.7	169.7	54.4	168.8	0	0	0	120.9
1235	S	33.1	Very low	35.3	Very low	126 Å²	126	130 Å²	130	88%	0.881	78%	0.782	S	S	*	*			trans	72.2	131.5	140.1	-58.2	0	0	0	0	120.6
1236	S	31.3	Very low	35.4	Very low	120 Å²	120	126.7 Å²	126.7	84%	0.839	77%	0.774	S	S	*	*			trans	-143.7	177	-167.4	56.6	0	0	0	0	112
1237	S	30.5	Very low	35.3	Very low	108 Å²	108	127.3 Å²	127.3	76%	0.755	78%	0.778	S	S	*	*	S	Bend	trans	-90.3	153.4	165	-63.2	0	0	0	0	111.5
1238	I	31.2	Very low	35.3	Very low	157 Å²	157	125.4 Å²	125.4	81%	0.805	78%	0.775	S	S	*	*			trans	82.3	94.4	158.9	-67.8	171.3	0	0	0	118.3
1239	S	29	Very low	35.2	Very low	99 Å²	99	128 Å²	128	69%	0.692	78%	0.778	S	S	*	*				88.2	156.8	121	-62.6	0	0	0	0	124.6
1240	T	32.8	Very low	35.1	Very low	135 Å²	135	123.9 Å²	123.9	83%	0.828	77%	0.767	S	S	*	*			trans	93.6	162.2	163.5	76.6	0	0	0	0	117.7
1241	P	41.8	Very low	35	Very low	109 Å²	109	124.8 Å²	124.8	71%	0.708	77%	0.768	S	S	*	*				-143.6	162.1	-70.4	41.4	-25	0	0	0	117.7
1242	H	33.8	Very low	34.7	Very low	164 Å²	164	122 Å²	122	76%	0.759	77%	0.766	S	S	*	*			trans	61.8	164.8	157.4	-104.7	-124.6	0	0	0	118.2
1243	P	41.6	Very low	35.1	Very low	120 Å²	120	121.7 Å²	121.7	78%	0.779	76%	0.762	S	S	*	*			cis	-130.4	177.9	21.6	42.8	-25.3	0	0	0	118.8
1244	E	33	Very low	35.9	Very low	132 Å²	132	123.8 Å²	123.8	62%	0.617	76%	0.762	S	S	*	*			trans	-60.7	174.9	164.3	-106.5	-165.1	98.6	0	0	114.3
1245	P	43.9	Very low	36	Very low	115 Å²	115	121.8 Å²	121.8	75%	0.747	76%	0.76	S	S	*	*			cis	-143.5	171.7	32.4	31.6	-6.2	0	0	0	121
1246	T	33.5	Very low	36.4	Very low	108 Å²	108	122.2 Å²	122.2	66%	0.663	76%	0.757	S	S	*	*			trans	-28.5	-175.6	155.2	50.1	0	0	0	0	121
1247	P	44.4	Very low	36.8	Very low	118 Å²	118	121.8 Å²	121.8	77%	0.766	75%	0.751	S	S	*	*			cis	-137.2	172.6	-18.6	27.1	-5.7	0	0	0	116.2
1248	A	33	Very low	36.8	Very low	85 Å²	85	121.5 Å²	121.5	70%	0.702	75%	0.75	S	S	*	*			trans	-168.5	124.9	141.7	0	0	0	0	0	115.3
1249	I	35.3	Very low	36.7	Very low	163 Å²	163	120.4 Å²	120.4	84%	0.836	75%	0.75	S	S	*	*			trans	58.8	138	136.1	-59.3	172.3	0	0	0	120.3
1250	T	33	Very low	37.9	Very low	111 Å²	111	121.2 Å²	121.2	68%	0.681	75%	0.753	S	S	*	*			cis	-171.7	153.9	-19.8	-84.3	0	0	0	0	109.9
1251	S	33.8	Very low	38.2	Very low	111 Å²	111	120.3 Å²	120.3	78%	0.776	75%	0.749	S	S	*	*			trans	76.1	144.2	156.3	60.2	0	0	0	0	123.9
1252	C	28.8	Very low	37.5	Very low	118 Å²	118	121.1 Å²	121.1	80%	0.797	75%	0.752	S	S	*	*			trans	-104.4	-164.1	171.4	-39.1	0	0	0	0	110
1253	P	43.1	Very low	37.3	Very low	118 Å²	118	118.3 Å²	118.3	77%	0.766	75%	0.746	S	S	*	*			cis	-127.9	-154	-31.3	36.4	-13.3	0	0	0	110.8
1254	P	51.1	Low	36.7	Very low	117 Å²	117	117.5 Å²	117.5	76%	0.76	74%	0.743	S	S	*	*			trans	-96.8	179	-165.6	42.4	-38.7	0	0	0	115.8
1255	P	37.4	Very low	36.7	Very low	123 Å²	123	118.5 Å²	118.5	80%	0.799	75%	0.753	S	S	*	*				-148.5	172	104.7	41.1	-26.3	0	0	0	116.7
1256	V	42.5	Very low	36	Very low	135 Å²	135	116.3 Å²	116.3	82%	0.818	75%	0.751	S	S	*	*			trans	-82.7	148.8	160.6	-76.7	0	0	0	0	110.4
1257	P	39.4	Very low	35.8	Very low	111 Å²	111	117 Å²	117	72%	0.721	76%	0.755	S	S	*	*				-157.1	-174.7	87.9	42.9	-23.4	0	0	0	116.6
1258	S	30	Very low	35.4	Very low	103 Å²	103	118.3 Å²	118.3	72%	0.72	76%	0.755	S	S	*	*			trans	63	117.6	156.4	-58.9	0	0	0	0	119
1259	V	30.3	Very low	35.4	Very low	134 Å²	134	119.9 Å²	119.9	81%	0.812	75%	0.751	S	S	*	*				76.3	128.2	61.3	177	0	0	0	0	112.5
1260	P	53.5	Low	35.3	Very low	116 Å²	116	118.4 Å²	118.4	75%	0.753	74%	0.744	S	S	*	*			trans	-105.4	162.1	-151.2	40.6	-36.8	0	0	0	116.1
1261	P	39.1	Very low	35.2	Very low	116 Å²	116	120.3 Å²	120.3	75%	0.753	75%	0.746	S	S	*	*			trans	-135.1	162.5	150.5	39.2	-25	0	0	0	112.5
1262	V	28	Very low	35.1	Very low	125 Å²	125	121.5 Å²	121.5	76%	0.758	75%	0.748	S	S	*	*			cis	-168.9	143.7	-10.3	122.9	0	0	0	0	109.2
1263	V	29.5	Very low	35.4	Very low	106 Å²	106	119.8 Å²	119.8	64%	0.642	74%	0.742	S	S	*	*			trans	45.8	111.2	141.9	-176.5	0	0	0	0	118.4
1264	S	28.4	Very low	35.3	Very low	103 Å²	103	119.8 Å²	119.8	72%	0.72	74%	0.743	S	S	*	*				68	135.8	77.2	-43.6	0	0	0	0	116.9
1265	N	33.2	Very low	34.2	Very low	153 Å²	153	123.4 Å²	123.4	82%	0.818	75%	0.746	S	S	*	*			trans	174.9	148.7	130.7	-83	-23.8	0	0	0	106
1266	G	29.9	Very low	33.8	Very low	68 Å²	68	126.6 Å²	126.6	70%	0.701	75%	0.751	S	S	*	*			cis	120.1	150	30.9	0	0	0	0	0	107.2
1267	T	29.1	Very low	33.4	Very low	124 Å²	124	125.9 Å²	125.9	76%	0.761	75%	0.747	S	S	*	*			cis	-159.6	-162	8	-54.1	0	0	0	0	107.3
1268	L	35.2	Very low	33	Very low	145 Å²	145	126.4 Å²	126.4	76%	0.759	75%	0.75	S	S	*	*			trans	88.9	126.8	170.1	-44.1	-179.2	0	0	0	114.5
1269	N	32.9	Very low	32.7	Very low	117 Å²	117	126.4 Å²	126.4	63%	0.626	75%	0.75	S	S	*	*			cis	-157.9	144.8	-0.3	-126	11.7	0	0	0	114.7
1270	L	33.4	Very low	32.5	Very low	132 Å²	132	124.5 Å²	124.5	69%	0.691	75%	0.748	S	S	*	*			trans	58.4	149	148.5	-94.7	58.1	0	0	0	120.3
1271	E	31.1	Very low	31.1	Very low	151 Å²	151	124.1 Å²	124.1	71%	0.706	74%	0.744	S	S	*	*			cis	-151.3	120.9	-5.8	-157.5	153.5	86.6	0	0	106.6
1272	V	32	Very low	30.5	Very low	136 Å²	136	124.8 Å²	124.8	82%	0.824	74%	0.741	S	S	*	*				54.3	136.3	92.5	173.3	0	0	0	0	113.3
1273	A	33.7	Very low	30.6	Very low	82 Å²	82	125.8 Å²	125.8	68%	0.678	74%	0.737	S	S	*	*			cis	-174.3	-156.4	-13.2	0	0	0	0	0	106.2
1274	P	41.3	Very low	30.6	Very low	119 Å²	119	127.2 Å²	127.2	77%	0.773	74%	0.742	S	S	*	*			cis	-134	168.8	-13.2	39.5	-20.7	0	0	0	117.5
1275	K	28.8	Very low	30.8	Very low	193 Å²	193	127.7 Å²	127.7	84%	0.839	74%	0.74	S	S	*	*			trans	-26.9	149.9	154.7	-53.2	165.3	175.5	176.4	0	116.1
1276	Q	28.7	Very low	30.7	Very low	190 Å²	190	127.4 Å²	127.4	89%	0.888	74%	0.738	S	S	*	*				-169.7	156.8	100.1	-100.8	179.4	40	0	0	114.2
1277	T	33.4	Very low	30.9	Very low	120 Å²	120	129.3 Å²	129.3	74%	0.736	74%	0.737	S	S	*	*			trans	-94.9	141.6	173.8	47.5	0	0	0	0	111.5
1278	P	31.7	Very low	31.1	Very low	121 Å²	121	131.2 Å²	131.2	79%	0.786	74%	0.737	S	S	*	*				-126.1	141.4	114.6	34.6	-27.4	0	0	0	109.4
1279	S	24.6	Very low	31	Very low	104 Å²	104	131.6 Å²	131.6	73%	0.727	73%	0.734	S	S	*	*			cis	56.9	120.6	34.7	-75.4	0	0	0	0	115.7
1280	A	25.6	Very low	31	Very low	94 Å²	94	130.2 Å²	130.2	78%	0.777	73%	0.734	S	S	*	*			trans	74.4	152.1	157.9	0	0	0	0	0	116.6
1281	T	24.8	Very low	31	Very low	108 Å²	108	129.2 Å²	129.2	66%	0.663	74%	0.738	S	S	*	*			cis	-175.8	153.4	-15.8	-99	0	0	0	0	109.2
1282	N	25.8	Very low	31	Very low	129 Å²	129	126.5 Å²	126.5	69%	0.69	74%	0.736	S	S	*	*			trans	68.4	158.7	163.6	-75.7	-14.8	0	0	0	117
1283	Q	29.8	Very low	30.9	Very low	146 Å²	146	126.1 Å²	126.1	68%	0.682	73%	0.734	S	S	*	*			cis	-156.6	150.1	0.2	-131.9	162	48.9	0	0	111.5
1284	N	28.5	Very low	30.8	Very low	137 Å²	137	127 Å²	127	73%	0.733	74%	0.742	S	S	*	*			trans	55.8	152	143.6	-86.5	12.1	0	0	0	121.1
1285	V	33	Very low	30.3	Very low	113 Å²	113	126.8 Å²	126.8	69%	0.685	74%	0.742	S	S	*	*			cis	-141.4	160.8	0.9	-148.3	0	0	0	0	110.1
1286	D	31.6	Very low	30.3	Very low	146 Å²	146	124.5 Å²	124.5	78%	0.781	75%	0.745	S	S	*	*			trans	87.4	146.6	139.4	-97.1	-45	0	0	0	125.3
1287	T	33.9	Very low	30.3	Very low	109 Å²	109	119.3 Å²	119.3	67%	0.669	74%	0.735	S	S	*	*			trans	77.1	86.5	156.8	-47.6	0	0	0	0	121.3
1288	Q	33	Very low	30.1	Very low	163 Å²	163	119.4 Å²	119.4	76%	0.762	74%	0.735	S	S	*	*				90.6	122.1	129.7	-72.8	-175.6	11	0	0	124.9
1289	H	34.5	Very low	30.1	Very low	153 Å²	153	121.1 Å²	121.1	71%	0.708	74%	0.737	S	S	*	*			trans	80.6	90.5	136.5	-74	-57.6	0	0	0	124.2
1290	S	32.1	Very low	30.4	Very low	89 Å²	89	121.8 Å²	121.8	62%	0.622	74%	0.737	S	S	*	*				53.3	115.1	122.8	39.6	0	0	0	0	120.5
1291	S	32.7	Very low	30.5	Very low	110 Å²	110	122.1 Å²	122.1	77%	0.769	73%	0.733	S	S	*	*				80.3	141	58.6	75.7	0	0	0	0	114.7
1292	S	31.8	Very low	30.7	Very low	94 Å²	94	125.9 Å²	125.9	66%	0.657	74%	0.743	S	S	*	*			cis	-177.2	152.4	-8	45.1	0	0	0	0	112.6
1293	T	30.2	Very low	31	Very low	128 Å²	128	125.8 Å²	125.8	79%	0.785	75%	0.748	S	S	*	*			trans	57.9	137.6	144.2	54.2	0	0	0	0	124.2
1294	A	30.6	Very low	31.4	Very low	102 Å²	102	124.4 Å²	124.4	84%	0.843	75%	0.751	S	S	*	*			trans	81.5	159.5	139.2	0	0	0	0	0	120.8
1295	S	32	Very low	31.4	Very low	113 Å²	113	121.7 Å²	121.7	79%	0.79	75%	0.748	S	S	*	*			trans	-109.1	167.8	-175.5	-49.4	0	0	0	0	112.1
1296	T	27.8	Very low	31.3	Very low	145 Å²	145	122.2 Å²	122.2	89%	0.89	75%	0.752	S	S	*	*			trans	107.6	146.4	159.7	-39.1	0	0	0	0	116.3
1297	A	29.6	Very low	31.3	Very low	82 Å²	82	121.7 Å²	121.7	68%	0.678	75%	0.753	S	S	*	*			trans	90.9	93.2	160.9	0	0	0	0	0	121.2
1298	T	28	Very low	31	Very low	122 Å²	122	122.7 Å²	122.7	75%	0.748	75%	0.75	S	S	*	*				44.1	125.5	118.3	-27.6	0	0	0	0	122.3
1299	L	32.4	Very low	31.1	Very low	156 Å²	156	122 Å²	122	82%	0.817	76%	0.756	S	S	*	*				163.1	107.4	115.2	-87.7	171.5	0	0	0	115.8
1300	V	30.1	Very low	30.8	Very low	119 Å²	119	119.2 Å²	119.2	72%	0.721	75%	0.75	S	S	*	*				30.2	114.8	121.6	-176.1	0	0	0	0	121.3
1301	S	28.3	Very low	31.5	Very low	101 Å²	101	120 Å²	120	71%	0.706	75%	0.754	S	S	*	*			trans	67.6	148.1	137.1	-63.3	0	0	0	0	126.3
1302	E	28.4	Very low	31.5	Very low	186 Å²	186	122.3 Å²	122.3	87%	0.869	76%	0.755	S	S	*	*			trans	93	144.6	143.7	-88.9	165.3	-147.4	0	0	122.2
1303	T	32.6	Very low	31.7	Very low	128 Å²	128	123.1 Å²	123.1	79%	0.785	76%	0.761	S	S	*	*			trans	-105.5	-176.4	-171.5	57.9	0	0	0	0	109.2
1304	P	38.6	Very low	31.8	Very low	116 Å²	116	123.6 Å²	123.6	75%	0.753	76%	0.764	S	S	*	*			cis	-138.3	-171	1.2	42.6	-23.7	0	0	0	116
1305	A	29.2	Very low	32.4	Very low	80 Å²	80	124.6 Å²	124.6	66%	0.661	76%	0.761	S	S	*	*			trans	77.1	106.8	141.3	0	0	0	0	0	123.4
1306	T	29.2	Very low	32.4	Very low	125 Å²	125	123.4 Å²	123.4	77%	0.767	76%	0.758	S	S	*	*				72	128.5	114.2	-51.7	0	0	0	0	122
1307	V	31.4	Very low	33.2	Very low	135 Å²	135	122 Å²	122	82%	0.818	75%	0.752	S	S	*	*				-171.6	136.3	118	146.6	0	0	0	0	113.4
1308	H	28.6	Very low	33.3	Very low	130 Å²	130	123.4 Å²	123.4	60%	0.602	75%	0.752	S	S	*	*			trans	-17.7	145.9	172.6	-76.5	-98.4	0	0	0	123.7	T1310	H1308-T1310 WeakPolarHBondContact ND1-CG2 3.22Å; H1308-T1310 PolarHBondContact ND1-OG1 3.41Å
1309	V	35.3	Very low	33.4	Very low	147 Å²	147	125.7 Å²	125.7	89%	0.891	75%	0.754	S	S	*	*				-132.5	150.5	101	-178.6	0	0	0	0	109.6
1310	T	28.8	Very low	33.2	Very low	95 Å²	95	126.3 Å²	126.3	58%	0.583	75%	0.753	S	S	*	*			trans	-136.1	-172.2	-173.7	31.2	0	0	0	0	109.3	H1308	H1308-T1310 WeakPolarHBondContact ND1-CG2 3.22Å; H1308-T1310 PolarHBondContact ND1-OG1 3.41Å
1311	P	45.1	Very low	33.6	Very low	107 Å²	107	125.3 Å²	125.3	70%	0.695	75%	0.749	S	S	*	*			cis	-152.9	-161.5	23.6	38.7	-11.4	0	0	0	118.7
1312	I	33.2	Very low	33.5	Very low	157 Å²	157	127.8 Å²	127.8	81%	0.805	75%	0.753	S	S	*	*			trans	80.1	129	162.6	-59.1	160.8	0	0	0	115.9
1313	S	37	Very low	33.5	Very low	111 Å²	111	124.3 Å²	124.3	78%	0.776	74%	0.744	S	S	*	*			cis	-156.1	176.3	-8.4	-128.9	0	0	0	0	113.1
1314	V	32.2	Very low	33.3	Very low	138 Å²	138	125 Å²	125	84%	0.836	74%	0.742	S	S	*	*			trans	-112.5	-176.7	176.5	-114.2	0	0	0	0	110.7
1315	P	43.6	Very low	32.9	Very low	123 Å²	123	125.6 Å²	125.6	80%	0.799	74%	0.739	S	S	*	*			cis	-139.1	-167.4	17.9	43.7	-22.1	0	0	0	118.3
1316	A	31.4	Very low	33	Very low	88 Å²	88	130.9 Å²	130.9	73%	0.727	75%	0.75	S	S	*	*			trans	-65.8	-165.2	-177.5	0	0	0	0	0	115.9
1317	P	44.2	Very low	33.1	Very low	116 Å²	116	133 Å²	133	75%	0.753	75%	0.75	S	S	*	*			cis	-144.8	-163.3	9.5	34	-7.2	0	0	0	117.8
1318	V	31.5	Very low	32.9	Very low	112 Å²	112	131.4 Å²	131.4	68%	0.679	75%	0.745	S	S	*	*			trans	122.8	115.7	144.8	179.8	0	0	0	0	118.4
1319	Q	30.5	Very low	33	Very low	169 Å²	169	132.4 Å²	132.4	79%	0.79	76%	0.755	S	S	*	*			trans	53.3	157.4	150.9	-71.3	169.4	-36.2	0	0	121.7
1320	E	27.2	Very low	32.7	Very low	169 Å²	169	129.7 Å²	129.7	79%	0.79	74%	0.738	S	S	*	*			cis	172.4	168.1	-31.6	-107.6	-161.9	131	0	0	106.4
1321	P	40.4	Very low	32.8	Very low	99 Å²	99	132.9 Å²	132.9	64%	0.643	75%	0.751	S	S	*	*			trans	-134.9	-159.4	-138.7	35.6	-12.3	0	0	0	116
1322	L	26	Very low	32.2	Very low	153 Å²	153	132.6 Å²	132.6	80%	0.801	75%	0.748	S	S	*	*			trans	75.9	152.1	158.9	-64.8	165.2	0	0	0	117.6
1323	V	27.6	Very low	32.2	Very low	112 Å²	112	133.1 Å²	133.1	68%	0.679	75%	0.747	S	S	*	*			cis	-171.9	173.7	-21.6	70.3	0	0	0	0	110.8
1324	I	28.1	Very low	31.8	Very low	144 Å²	144	134.3 Å²	134.3	74%	0.738	74%	0.744	S	S	*	*			trans	74.1	102.6	160.5	-68.9	168.3	0	0	0	118.8
1325	D	30.4	Very low	31.7	Very low	128 Å²	128	131.5 Å²	131.5	68%	0.684	72%	0.724	S	S	*	*				27.3	125.3	120	-169.7	19.7	0	0	0	121.6
1326	H	30.7	Very low	31.2	Very low	191 Å²	191	128.7 Å²	128.7	88%	0.884	71%	0.707	S	S	*	*			trans	-152.4	153.2	141.8	-124.5	27.8	0	0	0	113.6
1327	H	31.9	Very low	31.4	Very low	168 Å²	168	130.6 Å²	130.6	78%	0.778	70%	0.701	S	S	*	*			trans	-87.2	171.7	-177.3	-118	-112	0	0	0	113.1
1328	S	26.6	Very low	30.8	Very low	102 Å²	102	131.8 Å²	131.8	71%	0.713	70%	0.7	S	S	*	*			trans	56.9	100.1	162.7	59.7	0	0	0	0	119
1329	D	32.2	Very low	30.7	Very low	151 Å²	151	135.6 Å²	135.6	81%	0.807	70%	0.702	S	S	*	*				-150.1	118.3	116	-104.1	-18.9	0	0	0	108
1330	V	28.8	Very low	30.6	Very low	90 Å²	90	134.2 Å²	134.2	55%	0.545	69%	0.694	S	S	.	*				89	102.2	74.6	160	0	0	0	0	112.6	T1332	V1330-T1332 PolarHBondContact O-N 3.11Å; V1330-T1332 PolarHBondContact O-OG1 2.87Å
1331	L	31.2	Very low	30.5	Very low	162 Å²	162	131.6 Å²	131.6	85%	0.848	69%	0.693	S	S	*	*	S	Bend		49.2	23.1	119.2	-102.6	162.4	0	0	0	119.1
1332	T	32.1	Very low	29.9	Very low	102 Å²	102	136.3 Å²	136.3	63%	0.626	70%	0.704	S	S	*	*	S	Bend	trans	-122.4	-29.7	179.9	50.4	0	0	0	0	112.5	V1330 L1334	V1330-T1332 PolarHBondContact O-N 3.11Å; V1330-T1332 PolarHBondContact O-OG1 2.87Å; T1332-L1334 PolarHBondContact O-N 3Å
1333	Q	32.3	Very low	30	Very low	168 Å²	168	137.8 Å²	137.8	79%	0.785	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-8.5	177.1	-152	71.6	19.2	0	0	114.1	S1336	Q1333-S1336 PolarHBondContact O-OG 2.86Å
1334	L	29.1	Very low	30.2	Very low	135 Å²	135	139.2 Å²	139.2	71%	0.707	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	-10.2	-174.9	-144.1	74.9	0	0	0	114.6	T1332	T1332-L1334 PolarHBondContact O-N 3Å
1335	D	29.6	Very low	30.2	Very low	80 Å²	80	137.9 Å²	137.9	43%	0.428	72%	0.718	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.6	-2.5	175.7	-168.6	33.1	0	0	0	112.5	R1339	D1335-R1339 WeakPolarHBondContact O-CG 3.39Å; D1335-R1339 IonicContact OD1-CZ 3.22Å; D1335-R1339 IonicContact OD1-NE 3.98Å; D1335-R1339 PolarHBondContact OD1-NE 3.25Å; D1335-R1339 IonicContact OD1-NH2 3.42Å; D1335-R1339 PolarHBondContact OD1-NH2 3.35Å; D1335-R1339 IonicContact OD2-CZ 2.71Å; D1335-R1339 VanDerWaalsContact OD2-CZ 3.27Å; D1335-R1339 IonicContact OD2-NE 2.69Å; D1335-R1339 PolarHBondContact OD2-NE 2.88Å; D1335-R1339 VanDerWaalsContact OD2-NE 3.08Å; D1335-R1339 IonicContact OD2-NH2 2.76Å; D1335-R1339 PolarHBondContact OD2-NH2 2.88Å
1336	S	33.2	Very low	30	Very low	63 Å²	63	135.2 Å²	135.2	44%	0.441	72%	0.721	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.7	-28.2	179	51.6	0	0	0	0	114.2	Q1333	Q1333-S1336 PolarHBondContact O-OG 2.86Å
1337	E	35.7	Very low	30	Very low	128 Å²	128	133.3 Å²	133.3	60%	0.598	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101	-24.2	179.2	-77.2	-60.6	118.6	0	0	113.7	R1339 K1340	E1337-R1339 VanDerWaalsContact C-N 3.29Å; E1337-R1339 PolarHBondContact O-N 3.28Å; E1337-K1340 IonicContact OE1-NZ 2.66Å; E1337-K1340 PolarHBondContact OE1-NZ 2.96Å; E1337-K1340 IonicContact OE2-NZ 3.4Å
1338	L	30.6	Very low	29.7	Very low	142 Å²	142	129.7 Å²	129.7	74%	0.743	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-6.9	177.8	-89.4	162.6	0	0	0	114.5
1339	R	30.4	Very low	29.7	Very low	191 Å²	191	133.3 Å²	133.3	72%	0.721	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	28.3	178.3	-65	-172.8	-174.4	-136.7	12.8	114.8	D1335 E1337	D1335-R1339 WeakPolarHBondContact O-CG 3.39Å; D1335-R1339 IonicContact OD1-CZ 3.22Å; D1335-R1339 IonicContact OD1-NE 3.98Å; D1335-R1339 PolarHBondContact OD1-NE 3.25Å; D1335-R1339 IonicContact OD1-NH2 3.42Å; D1335-R1339 PolarHBondContact OD1-NH2 3.35Å; D1335-R1339 IonicContact OD2-CZ 2.71Å; D1335-R1339 VanDerWaalsContact OD2-CZ 3.27Å; D1335-R1339 IonicContact OD2-NE 2.69Å; D1335-R1339 PolarHBondContact OD2-NE 2.88Å; D1335-R1339 VanDerWaalsContact OD2-NE 3.08Å; D1335-R1339 IonicContact OD2-NH2 2.76Å; D1335-R1339 PolarHBondContact OD2-NH2 2.88Å; E1337-R1339 VanDerWaalsContact C-N 3.29Å; E1337-R1339 PolarHBondContact O-N 3.28Å
1340	K	28.4	Very low	29.5	Very low	141 Å²	141	132.3 Å²	132.3	61%	0.613	73%	0.727	S	S	*	*	S	Bend	trans	-117.6	-5.4	-178.5	-78.7	176.1	-174.2	160.5	0	116.7	E1337	E1337-K1340 IonicContact OE1-NZ 2.66Å; E1337-K1340 PolarHBondContact OE1-NZ 2.96Å; E1337-K1340 IonicContact OE2-NZ 3.4Å
1341	C	25.5	Very low	29.6	Very low	113 Å²	113	132.2 Å²	132.2	76%	0.764	74%	0.735	S	S	*	*	S	Bend	trans	-134.1	84.7	-176.1	-73.6	0	0	0	0	113.4
1342	F	28.2	Very low	29.5	Very low	199 Å²	199	129.7 Å²	129.7	87%	0.873	73%	0.731	S	S	*	*	S	Bend		174.4	135.9	125.1	-103.1	-71.2	0	0	0	111.8
1343	Q	26.9	Very low	29.6	Very low	184 Å²	184	130.9 Å²	130.9	86%	0.86	74%	0.741	S	S	*	*			trans	60.6	120.8	174.5	-57.3	-178.7	1.6	0	0	115.2
1344	V	31.9	Very low	29.5	Very low	142 Å²	142	128.5 Å²	128.5	86%	0.861	74%	0.742	S	S	*	*				-151.3	154	75.2	149.3	0	0	0	0	111.4
1345	S	28.2	Very low	29.8	Very low	115 Å²	115	128.4 Å²	128.4	80%	0.804	75%	0.747	S	S	*	*			trans	-80.3	142.1	-179.3	-52.4	0	0	0	0	114.1
1346	G	26.5	Very low	30	Very low	73 Å²	73	130.4 Å²	130.4	75%	0.753	76%	0.763	S	S	*	*			trans	65.5	110.2	138.8	0	0	0	0	0	119.8
1347	V	29.9	Very low	30.2	Very low	151 Å²	151	133.6 Å²	133.6	92%	0.915	78%	0.779	S	S	*	*			trans	-128.9	137.4	143.8	-176.1	0	0	0	0	108.2
1348	S	26.3	Very low	30	Very low	91 Å²	91	136.2 Å²	136.2	64%	0.636	79%	0.791	S	S	*	*			trans	-89.8	162.9	-175.9	-53.1	0	0	0	0	113.2
1349	H	27.4	Very low	30.2	Very low	179 Å²	179	134.2 Å²	134.2	83%	0.829	79%	0.789	S	S	*	*			trans	76.3	138.9	155.4	-59.8	-61.1	0	0	0	121.6
1350	S	28	Very low	30.3	Very low	130 Å²	130	132.3 Å²	132.3	91%	0.909	79%	0.792	S	S	*	*			trans	85.1	138.4	154.4	75.7	0	0	0	0	117.5
1351	A	29.5	Very low	30.7	Very low	88 Å²	88	131.4 Å²	131.4	73%	0.727	80%	0.799	S	S	*	*			trans	-121	158.5	-173.5	0	0	0	0	0	110.7
1352	S	30.5	Very low	31.1	Very low	108 Å²	108	131.2 Å²	131.2	76%	0.755	80%	0.798	S	S	*	*			trans	62.7	100.9	160	-56.6	0	0	0	0	117.7
1353	P	34.1	Very low	31.4	Very low	128 Å²	128	129.2 Å²	129.2	83%	0.831	79%	0.794	S	S	*	*			trans	-74.4	131.5	158.8	32	-31.5	0	0	0	110
1354	S	30.7	Very low	31.7	Very low	118 Å²	118	126.2 Å²	126.2	83%	0.825	79%	0.788	S	S	*	*			trans	-151.3	135.8	164.1	-79.8	0	0	0	0	111.6	V1356	S1354-V1356 PolarHBondContact O-N 3.43Å
1355	T	34.1	Very low	31.8	Very low	132 Å²	132	125 Å²	125	81%	0.81	78%	0.783	S	S	*	*			trans	-51	115.2	-172.1	45.3	0	0	0	0	116.3
1356	V	34.6	Very low	31.7	Very low	123 Å²	123	128.2 Å²	128.2	75%	0.745	79%	0.786	S	S	*	*				50.2	95.8	118.2	-179.1	0	0	0	0	116.8	S1354	S1354-V1356 PolarHBondContact O-N 3.43Å
1357	V	36.1	Very low	31.8	Very low	130 Å²	130	130 Å²	130	79%	0.788	78%	0.782	S	S	*	*			trans	45.3	141.9	155.1	-79.5	0	0	0	0	120.2
1358	E	32.4	Very low	31.9	Very low	183 Å²	183	129.5 Å²	129.5	86%	0.855	77%	0.773	S	S	*	*			cis	-142.6	152	26	-143	166.7	-175.3	0	0	114.4
1359	S	34.1	Very low	32.3	Very low	99 Å²	99	130.8 Å²	130.8	69%	0.692	78%	0.779	S	S	*	*			trans	-60.5	137.4	-171.7	-44.3	0	0	0	0	117
1360	L	33	Very low	32.3	Very low	152 Å²	152	127.6 Å²	127.6	80%	0.796	77%	0.767	S	S	*	*				169.1	119.4	105.9	-91.2	167.8	0	0	0	116.4
1361	T	36.3	Very low	32.4	Very low	122 Å²	122	126.8 Å²	126.8	75%	0.748	77%	0.769	S	S	*	*			trans	66	143.9	145	45.3	0	0	0	0	124.7
1362	S	35.5	Very low	32.2	Very low	108 Å²	108	127.4 Å²	127.4	76%	0.755	77%	0.766	S	S	*	*			trans	67.3	73.3	158	54	0	0	0	0	121.2
1363	M	34	Very low	32	Very low	158 Å²	158	129.3 Å²	129.3	78%	0.778	76%	0.763	S	S	*	*				52.4	101.3	108.7	-67.7	-71.4	97.4	0	0	121
1364	T	32.4	Very low	31.7	Very low	120 Å²	120	130.2 Å²	130.2	74%	0.736	77%	0.767	S	S	*	*				65.1	142.8	123.2	42.1	0	0	0	0	121.4
1365	P	33.9	Very low	31.5	Very low	116 Å²	116	129.5 Å²	129.5	75%	0.753	76%	0.757	S	S	*	*				-136	158.4	-116.3	39.7	-23.5	0	0	0	117.2
1366	Q	27.4	Very low	31.8	Very low	184 Å²	184	128.6 Å²	128.6	86%	0.86	75%	0.754	S	S	*	*			trans	-132.7	117.1	147.1	-81.5	-159.3	13.7	0	0	111.3
1367	T	26.8	Very low	31.6	Very low	109 Å²	109	126.8 Å²	126.8	67%	0.669	75%	0.752	S	S	*	*			trans	65.5	145.9	133.8	-32.4	0	0	0	0	120.8
1368	I	32.4	Very low	31.4	Very low	142 Å²	142	126.2 Å²	126.2	73%	0.728	75%	0.753	S	S	*	*			trans	64	157.6	166.6	37.4	-178.7	0	0	0	117.3	L1370	I1368-L1370 HydrophobicContact CG2-CD1 3.7Å
1369	P	35.8	Very low	31.3	Very low	118 Å²	118	125.5 Å²	125.5	77%	0.766	75%	0.753	S	S	*	*			cis	-126.1	147.8	15.6	39.9	-23.6	0	0	0	119.3
1370	L	27.3	Very low	31.1	Very low	111 Å²	111	124.2 Å²	124.2	58%	0.581	76%	0.756	S	S	*	*			trans	7.6	127.5	147.8	-73	63.3	0	0	0	119.9	I1368 C1372	I1368-L1370 HydrophobicContact CG2-CD1 3.7Å; L1370-C1372 HydrophobicContact CB-CB 4.25Å; L1370-C1372 HydrophobicContact CD2-CB 4.26Å; L1370-C1372 HydrophobicContact CG-CB 3.95Å
1371	A	28.9	Very low	30.9	Very low	114 Å²	114	126.3 Å²	126.3	94%	0.942	76%	0.762	S	S	*	*	S	Bend		-106.4	93	122.4	0	0	0	0	0	108
1372	C	25.6	Very low	30.4	Very low	100 Å²	100	124.8 Å²	124.8	68%	0.676	76%	0.761	S	S	*	*			trans	-159.4	164.6	-176.5	-153.4	0	0	0	0	112.4	L1370	L1370-C1372 HydrophobicContact CB-CB 4.25Å; L1370-C1372 HydrophobicContact CD2-CB 4.26Å; L1370-C1372 HydrophobicContact CG-CB 3.95Å
1373	Q	25.8	Very low	30.5	Very low	148 Å²	148	125.2 Å²	125.2	69%	0.692	76%	0.762	S	S	*	*			trans	71.9	120.9	-179.9	-58.8	-169.6	10.4	0	0	118.2	V1375	Q1373-V1375 HydrophobicContact CB-CG2 4.14Å; Q1373-V1375 HydrophobicContact CG-CG2 4.38Å
1374	T	28.9	Very low	30.2	Very low	147 Å²	147	121.9 Å²	121.9	90%	0.902	76%	0.76	S	S	*	*				-128.9	140	125.4	-60.3	0	0	0	0	107.7
1375	V	27	Very low	29.9	Very low	104 Å²	104	122.2 Å²	122.2	63%	0.63	76%	0.761	S	S	*	*			trans	-139.3	162.9	-177.6	-124.5	0	0	0	0	104.7	Q1373	Q1373-V1375 HydrophobicContact CB-CG2 4.14Å; Q1373-V1375 HydrophobicContact CG-CG2 4.38Å
1376	P	38.8	Very low	29.7	Very low	113 Å²	113	124 Å²	124	73%	0.734	76%	0.762	S	S	*	*			cis	-150.5	172.8	28.4	44.6	-23.9	0	0	0	120
1377	A	30.8	Very low	29.7	Very low	85 Å²	85	119.8 Å²	119.8	70%	0.702	76%	0.759	S	S	*	*			trans	69.5	147.4	134.7	0	0	0	0	0	125.4
1378	S	31.6	Very low	29.8	Very low	118 Å²	118	119.3 Å²	119.3	83%	0.825	77%	0.767	S	S	*	*			trans	70.4	139.2	165.9	-59.9	0	0	0	0	117.3
1379	I	31	Very low	29.6	Very low	167 Å²	167	116.5 Å²	116.5	86%	0.856	76%	0.764	S	S	*	*			cis	-124.9	122.7	9.1	-62.1	168.1	0	0	0	107.4
1380	G	29.4	Very low	29.3	Very low	73 Å²	73	119.5 Å²	119.5	75%	0.753	77%	0.768	S	S	*	*				90.4	144.6	90.7	0	0	0	0	0	111.9
1381	Q	29.5	Very low	29.5	Very low	196 Å²	196	118.3 Å²	118.3	92%	0.916	77%	0.774	S	S	*	*			cis	-160.7	157	-2.4	-165.2	177.2	27.5	0	0	109.1
1382	A	24.9	Very low	29.6	Very low	89 Å²	89	117.3 Å²	117.3	74%	0.736	77%	0.766	S	S	*	*			trans	-118.3	144.1	166.4	0	0	0	0	0	110.3
1383	P	38.1	Very low	29.6	Very low	118 Å²	118	117.7 Å²	117.7	77%	0.766	77%	0.769	S	S	*	*				-138.2	128.9	113	34.3	-21.2	0	0	0	111.6
1384	A	27.5	Very low	29.9	Very low	88 Å²	88	117.5 Å²	117.5	73%	0.727	77%	0.773	S	S	*	*				98.4	165.7	65.3	0	0	0	0	0	112.4
1385	V	27.4	Very low	30	Very low	127 Å²	127	117.8 Å²	117.8	77%	0.77	77%	0.767	S	S	*	*			trans	82.4	114.8	163.2	-173.8	0	0	0	0	118.8
1386	I	28.9	Very low	30.5	Very low	152 Å²	152	117.6 Å²	117.6	78%	0.779	77%	0.768	S	S	*	*			trans	71.1	104.1	150.3	-64.8	169.7	0	0	0	120.8
1387	A	27.2	Very low	30.1	Very low	96 Å²	96	119.8 Å²	119.8	79%	0.793	77%	0.773	S	S	*	*				49.2	164.5	119.9	0	0	0	0	0	125.1
1388	A	29	Very low	30.1	Very low	100 Å²	100	120 Å²	120	83%	0.826	78%	0.775	S	S	*	*			trans	85.9	106.2	162.2	0	0	0	0	0	119.4
1389	A	28.5	Very low	29.9	Very low	82 Å²	82	119.8 Å²	119.8	68%	0.678	77%	0.774	S	S	*	*			trans	-72.6	175.8	151.9	0	0	0	0	0	110.1
1390	H	30.2	Very low	29.9	Very low	181 Å²	181	117.9 Å²	117.9	84%	0.838	77%	0.769	S	S	*	*			cis	-145.7	141.1	18.5	-113.1	-76.2	0	0	0	111.4
1391	A	30.4	Very low	30.1	Very low	86 Å²	86	120.3 Å²	120.3	71%	0.711	77%	0.772	S	S	*	*			trans	-86.2	142	155.7	0	0	0	0	0	108.7
1392	A	30.9	Very low	30.1	Very low	93 Å²	93	120.1 Å²	120.1	77%	0.769	77%	0.771	S	S	*	*			cis	95.8	109.7	29.9	0	0	0	0	0	114.2
1393	S	26.2	Very low	30.3	Very low	108 Å²	108	121.6 Å²	121.6	76%	0.755	78%	0.776	S	S	*	*			trans	20	127.9	154.6	-162.1	0	0	0	0	120.4
1394	L	31	Very low	30.1	Very low	145 Å²	145	121.4 Å²	121.4	76%	0.759	78%	0.775	S	S	*	*				175.5	141.3	109	-91.9	163.5	0	0	0	114
1395	I	31	Very low	30.2	Very low	152 Å²	152	122.3 Å²	122.3	78%	0.779	78%	0.776	S	S	*	*			trans	72.8	147.5	149.1	-70.9	165.9	0	0	0	118.4
1396	P	39	Very low	30.2	Very low	100 Å²	100	126.7 Å²	126.7	65%	0.649	78%	0.779	S	S	*	*			trans	-134.9	-164.6	-149.3	44.5	-26.1	0	0	0	116.4
1397	N	30.6	Very low	30.3	Very low	159 Å²	159	127.2 Å²	127.2	85%	0.85	78%	0.782	S	S	*	*			trans	92.6	148	161.9	-65.8	-12.5	0	0	0	118.3
1398	A	29.4	Very low	30.2	Very low	90 Å²	90	129.8 Å²	129.8	74%	0.744	78%	0.783	S	S	*	*			trans	-138.8	163.6	-169.2	0	0	0	0	0	111.4
1399	S	28.1	Very low	30.4	Very low	113 Å²	113	130 Å²	130	79%	0.79	78%	0.784	S	S	*	*			trans	62.6	110.5	159.8	-57.9	0	0	0	0	118.3
1400	V	30.4	Very low	30.3	Very low	127 Å²	127	135.1 Å²	135.1	77%	0.77	79%	0.794	S	S	*	*				-177.1	139.4	104.1	150.2	0	0	0	0	108.8
1401	P	35	Very low	30.5	Very low	125 Å²	125	133.5 Å²	133.5	81%	0.812	80%	0.797	S	S	*	*			trans	-128.3	137.3	144.1	35.2	-25.1	0	0	0	112.4
1402	Q	29	Very low	30.6	Very low	192 Å²	192	132.4 Å²	132.4	90%	0.897	79%	0.794	S	S	*	*			trans	-108.9	143.3	154.3	-74.8	-172	-13	0	0	108.2
1403	S	28	Very low	30.6	Very low	119 Å²	119	136.6 Å²	136.6	83%	0.832	80%	0.803	S	S	*	*			trans	-121.6	146.9	-178.3	53.8	0	0	0	0	111.6
1404	P	35.5	Very low	30.8	Very low	115 Å²	115	136.1 Å²	136.1	75%	0.747	81%	0.805	S	S	*	*			trans	-120.1	123.7	166.4	35.2	-23.4	0	0	0	113.8
1405	S	28.8	Very low	31	Very low	106 Å²	106	131 Å²	131	74%	0.741	79%	0.788	S	S	*	*			trans	60.7	127	140.6	64.1	0	0	0	0	123.4
1406	R	27	Very low	31.3	Very low	220 Å²	220	130.4 Å²	130.4	83%	0.83	79%	0.785	S	S	*	*			trans	66.8	116.6	138.4	-86.6	-178.6	160.4	174.6	-6.4	120.3
1407	L	31.9	Very low	31.4	Very low	162 Å²	162	132 Å²	132	85%	0.848	78%	0.784	S	S	*	*				-164.2	161.6	86.3	-99.9	168.3	0	0	0	110.9
1408	D	24.5	Very low	31.9	Very low	151 Å²	151	131.5 Å²	131.5	81%	0.807	78%	0.776	S	S	*	*			trans	-94.8	139.1	-173.1	-50	-92.3	0	0	0	112.6
1409	A	32.9	Very low	32.6	Very low	103 Å²	103	134.8 Å²	134.8	85%	0.851	77%	0.774	S	S	*	*			trans	-160.2	135	160.2	0	0	0	0	0	110.7
1410	E	26.5	Very low	33.3	Very low	191 Å²	191	135.3 Å²	135.3	89%	0.893	77%	0.767	S	S	*	*			trans	-82.9	135.4	171.7	-58.9	178.6	116.4	0	0	110.6
1411	T	35.1	Very low	33.8	Very low	146 Å²	146	134.2 Å²	134.2	90%	0.896	75%	0.754	S	S	*	*			trans	-171.6	149.7	148.8	4.1	0	0	0	0	113.3
1412	G	32.2	Very low	34.5	Very low	64 Å²	64	131.1 Å²	131.1	66%	0.66	74%	0.739	S	S	*	*			trans	84.1	95.1	142.8	0	0	0	0	0	118.5	A1414	G1412-A1414 PolarHBondContact O-N 2.97Å
1413	L	29.6	Very low	35	Very low	181 Å²	181	128 Å²	128	95%	0.948	73%	0.728	S	S	*	*			trans	-72.9	72.3	155.3	-82.5	164.2	0	0	0	110.5
1414	A	31.9	Very low	35.8	Very low	97 Å²	97	128.2 Å²	128.2	80%	0.802	71%	0.714	S	S	*	*			trans	-137.1	122.7	173.9	0	0	0	0	0	109.6	G1412	G1412-A1414 PolarHBondContact O-N 2.97Å
1415	G	34.2	Very low	36.1	Very low	39 Å²	39	129.7 Å²	129.7	40%	0.402	71%	0.712	S	S	.	*	S	Bend	trans	129.4	-3	-176.2	0	0	0	0	0	115.7
1416	L	37	Very low	36.7	Very low	138 Å²	138	128.3 Å²	128.3	72%	0.723	69%	0.694	S	S	*	*	H	α-helix	trans	-77.2	-22.3	175.3	-116.3	169	0	0	0	113.5
1417	H	40.9	Very low	37.4	Very low	134 Å²	134	124.4 Å²	124.4	62%	0.62	69%	0.685	S	S	*	*	H	α-helix	trans	-73.8	-51.3	175.2	-161.3	-77.1	0	0	0	111.4	K1419 L1420 E1421	H1417-K1419 VanDerWaalsContact C-N 3.3Å; H1417-K1419 PolarHBondContact O-N 2.96Å; H1417-L1420 WeakPolarHBondContact O-CA 3.48Å; H1417-L1420 WeakPolarHBondContact O-CB 3.49Å; H1417-L1420 PolarHBondContact O-N 3.3Å; H1417-E1421 VanDerWaalsContact CE1-CD 3.45Å; H1417-E1421 IonicContact CE1-OE1 2.85Å; H1417-E1421 IonicContact CE1-OE2 3.93Å; H1417-E1421 PolarHBondContact CE1-OE2 2.98Å; H1417-E1421 VanDerWaalsContact CE1-OE2 3.26Å; H1417-E1421 IonicContact CG-OE2 2.64Å; H1417-E1421 VanDerWaalsContact ND1-CD 3.34Å; H1417-E1421 IonicContact ND1-OE1 2.74Å; H1417-E1421 IonicContact ND1-OE2 2.76Å; H1417-E1421 PolarHBondContact ND1-OE2 3.26Å; H1417-E1421 PolarHBondContact O-N 3.46Å
1418	E	43	Very low	37.5	Very low	148 Å²	148	122.1 Å²	122.1	69%	0.692	67%	0.674	S	S	*	*	H	α-helix	trans	-60.2	-36.6	-177.4	-169.5	175.6	-168.6	0	0	112.6	A1422	E1418-A1422 WeakPolarHBondContact O-CB 3.39Å; E1418-A1422 PolarHBondContact O-N 2.95Å
1419	K	42.7	Very low	37.9	Very low	159 Å²	159	123.3 Å²	123.3	69%	0.691	67%	0.667	S	S	*	*	H	α-helix	trans	-73.5	-22.1	172.3	-84	-176.7	173.9	176.3	0	114.6	H1417 L1423	H1417-K1419 VanDerWaalsContact C-N 3.3Å; H1417-K1419 PolarHBondContact O-N 2.96Å; K1419-L1423 WeakPolarHBondContact O-CG 3.49Å; K1419-L1423 PolarHBondContact O-N 2.93Å
1420	L	43.7	Very low	38	Very low	125 Å²	125	127.4 Å²	127.4	65%	0.654	66%	0.661	S	S	*	*	H	α-helix	trans	-78.6	-41.2	175	-159.7	69.3	0	0	0	110.6	H1417 L1423 K1424	H1417-L1420 WeakPolarHBondContact O-CA 3.48Å; H1417-L1420 WeakPolarHBondContact O-CB 3.49Å; H1417-L1420 PolarHBondContact O-N 3.3Å; L1420-L1423 PolarHBondContact O-N 3.46Å; L1420-K1424 WeakPolarHBondContact O-CB 3.42Å; L1420-K1424 PolarHBondContact O-N 3.07Å
1421	E	39.6	Very low	38.1	Very low	103 Å²	103	126.8 Å²	126.8	48%	0.481	66%	0.658	S	S	.	*	H	α-helix	trans	-66.7	-38.9	173.6	-71.6	172.8	119.7	0	0	112.3	H1417 L1423 K1424 M1425	H1417-E1421 VanDerWaalsContact CE1-CD 3.45Å; H1417-E1421 IonicContact CE1-OE1 2.85Å; H1417-E1421 IonicContact CE1-OE2 3.93Å; H1417-E1421 PolarHBondContact CE1-OE2 2.98Å; H1417-E1421 VanDerWaalsContact CE1-OE2 3.26Å; H1417-E1421 IonicContact CG-OE2 2.64Å; H1417-E1421 VanDerWaalsContact ND1-CD 3.34Å; H1417-E1421 IonicContact ND1-OE1 2.74Å; H1417-E1421 IonicContact ND1-OE2 2.76Å; H1417-E1421 PolarHBondContact ND1-OE2 3.26Å; H1417-E1421 PolarHBondContact O-N 3.46Å; E1421-L1423 VanDerWaalsContact C-N 3.3Å; E1421-L1423 PolarHBondContact O-N 2.91Å; E1421-K1424 WeakPolarHBondContact O-CB 3.29Å; E1421-K1424 PolarHBondContact O-N 3.16Å; E1421-M1425 PolarHBondContact O-N 2.94Å
1422	A	49.6	Very low	37.8	Very low	61 Å²	61	127.1 Å²	127.1	50%	0.504	65%	0.654	S	S	.	*	H	α-helix	trans	-62.1	-34.6	174.7	0	0	0	0	0	113.3	E1418	E1418-A1422 WeakPolarHBondContact O-CB 3.39Å; E1418-A1422 PolarHBondContact O-N 2.95Å
1423	L	40.4	Very low	37.8	Very low	127 Å²	127	132.7 Å²	132.7	67%	0.665	67%	0.665	S	S	*	*	H	α-helix	trans	-78	-33.2	174.3	-74.8	170.5	0	0	0	112.4	K1419 L1420 E1421 M1425 E1426 Q1427	K1419-L1423 WeakPolarHBondContact O-CG 3.49Å; K1419-L1423 PolarHBondContact O-N 2.93Å; L1420-L1423 PolarHBondContact O-N 3.46Å; E1421-L1423 VanDerWaalsContact C-N 3.3Å; E1421-L1423 PolarHBondContact O-N 2.91Å; L1423-M1425 VanDerWaalsContact C-N 3.34Å; L1423-M1425 PolarHBondContact O-N 2.65Å; L1423-E1426 PolarHBondContact O-N 2.84Å; L1423-Q1427 PolarHBondContact O-N 3.39Å
1424	K	44.3	Very low	37.9	Very low	122 Å²	122	127.9 Å²	127.9	53%	0.53	66%	0.659	S	S	.	*	H	α-helix	trans	-58.3	-45.7	171.9	-170.6	67.1	-177.8	160.5	0	111.2	L1420 E1421 E1426 Q1427 D1428	L1420-K1424 WeakPolarHBondContact O-CB 3.42Å; L1420-K1424 PolarHBondContact O-N 3.07Å; E1421-K1424 WeakPolarHBondContact O-CB 3.29Å; E1421-K1424 PolarHBondContact O-N 3.16Å; K1424-E1426 PolarHBondContact O-N 3.17Å; K1424-Q1427 PolarHBondContact O-N 3.19Å; K1424-D1428 IonicContact NZ-OD1 2.82Å; K1424-D1428 PolarHBondContact O-N 3.03Å; K1424-D1428 VanDerWaalsContact O-N 3.07Å
1425	M	41.4	Very low	37.7	Very low	146 Å²	146	131 Å²	131	72%	0.719	66%	0.662	S	S	*	*	H	α-helix	trans	-70.1	-26.3	-178.1	-73.3	-168.6	178.2	0	0	115.7	E1421 L1423	E1421-M1425 PolarHBondContact O-N 2.94Å; L1423-M1425 VanDerWaalsContact C-N 3.34Å; L1423-M1425 PolarHBondContact O-N 2.65Å
1426	E	43.2	Very low	37.7	Very low	77 Å²	77	136.7 Å²	136.7	36%	0.36	68%	0.684	S	S	.	*	H	α-helix	trans	-84.5	-22.3	174.3	177.3	58.7	-164	0	0	112.2	L1423 K1424 R1429 R1430	L1423-E1426 PolarHBondContact O-N 2.84Å; K1424-E1426 PolarHBondContact O-N 3.17Å; E1426-R1429 IonicContact OE2-NE 3.26Å; E1426-R1430 IonicContact OE1-CZ 3.64Å; E1426-R1430 VanDerWaalsContact OE1-CZ 3.24Å; E1426-R1430 IonicContact OE1-NE 3.93Å; E1426-R1430 PolarHBondContact OE1-NE 2.69Å; E1426-R1430 IonicContact OE1-NH2 2.72Å; E1426-R1430 PolarHBondContact OE1-NH2 3.2Å
1427	Q	40.3	Very low	37.5	Very low	138 Å²	138	133.5 Å²	133.5	65%	0.645	68%	0.677	S	S	*	*	H	α-helix	trans	-76.1	-44.9	172.6	-169	166.1	-1.3	0	0	111.6	L1423 K1424 R1429 R1430	L1423-Q1427 PolarHBondContact O-N 3.39Å; K1424-Q1427 PolarHBondContact O-N 3.19Å; Q1427-R1429 PolarHBondContact O-N 3.37Å; Q1427-R1430 PolarHBondContact O-N 3.31Å
1428	D	34.5	Very low	37.1	Very low	115 Å²	115	135.5 Å²	135.5	62%	0.615	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	8	175.3	-65	-18.9	0	0	0	113.2	K1424	K1424-D1428 IonicContact NZ-OD1 2.82Å; K1424-D1428 PolarHBondContact O-N 3.03Å; K1424-D1428 VanDerWaalsContact O-N 3.07Å
1429	R	34	Very low	36.5	Very low	176 Å²	176	132 Å²	132	66%	0.664	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114	12.6	179.5	-141.8	-169.7	71.4	73.4	3.2	114.8	E1426 Q1427	E1426-R1429 IonicContact OE2-NE 3.26Å; Q1427-R1429 PolarHBondContact O-N 3.37Å
1430	R	34.1	Very low	35.9	Very low	188 Å²	188	130.6 Å²	130.6	71%	0.709	70%	0.699	S	S	*	*	S	Bend	trans	-129.2	0.8	-176.9	-64.9	-170.6	-178.4	-147.1	1.6	115.9	E1426 Q1427	E1426-R1430 IonicContact OE1-CZ 3.64Å; E1426-R1430 VanDerWaalsContact OE1-CZ 3.24Å; E1426-R1430 IonicContact OE1-NE 3.93Å; E1426-R1430 PolarHBondContact OE1-NE 2.69Å; E1426-R1430 IonicContact OE1-NH2 2.72Å; E1426-R1430 PolarHBondContact OE1-NH2 3.2Å; Q1427-R1430 PolarHBondContact O-N 3.31Å
1431	E	28.6	Very low	35.3	Very low	179 Å²	179	130.9 Å²	130.9	84%	0.836	71%	0.706	S	S	*	*	S	Bend	trans	-125.2	50.6	-178.6	-64.6	-171.3	175.2	0	0	112.6
1432	D	27.7	Very low	34.8	Very low	153 Å²	153	131.2 Å²	131.2	82%	0.818	72%	0.716	S	S	*	*			trans	-148.7	153.4	158.1	-159.5	-0.1	0	0	0	110.4
1433	M	32.6	Very low	34.2	Very low	181 Å²	181	134.3 Å²	134.3	89%	0.892	73%	0.728	S	S	*	*			trans	81.1	101.9	-163.1	-56.3	-81.5	-83.3	0	0	114.7
1434	G	32.2	Very low	33.9	Very low	79 Å²	79	134.9 Å²	134.9	81%	0.814	73%	0.732	S	S	*	*			trans	-101.2	-167.9	-177.9	0	0	0	0	0	116.3
1435	D	28	Very low	33.4	Very low	163 Å²	163	132 Å²	132	87%	0.872	74%	0.738	S	S	*	*			trans	-64.9	151.3	-177.1	-57.3	-84.1	0	0	0	114.9
1436	D	33.6	Very low	33	Very low	159 Å²	159	133 Å²	133	85%	0.85	74%	0.738	S	S	*	*				-168.8	152.4	110.1	-127.1	-31.7	0	0	0	117
1437	A	33.6	Very low	32.5	Very low	70 Å²	70	134.3 Å²	134.3	58%	0.579	75%	0.747	S	S	*	*			trans	54.7	97.6	149.7	0	0	0	0	0	125.4
1438	I	31.2	Very low	31.9	Very low	176 Å²	176	134.8 Å²	134.8	90%	0.903	75%	0.749	S	S	*	*				56.5	132.1	112.4	-59.4	154.2	0	0	0	121.7
1439	G	31.3	Very low	31.6	Very low	76 Å²	76	136 Å²	136	78%	0.784	76%	0.755	S	S	*	*			trans	169.2	78.9	159.6	0	0	0	0	0	119
1440	T	29.7	Very low	31.4	Very low	128 Å²	128	133.7 Å²	133.7	79%	0.785	76%	0.762	S	S	*	*			trans	-68.2	156.4	-174.2	46.9	0	0	0	0	118.5
1441	T	32	Very low	31.1	Very low	131 Å²	131	131 Å²	131	80%	0.804	76%	0.761	S	S	*	*			trans	140.6	157.4	130.5	53.1	0	0	0	0	115
1442	T	29.4	Very low	31.2	Very low	111 Å²	111	129 Å²	129	68%	0.681	76%	0.756	S	S	*	*			cis	-161.2	166.5	-46.2	-52.2	0	0	0	0	108.6
1443	T	35.8	Very low	31.8	Very low	126 Å²	126	127.1 Å²	127.1	77%	0.773	75%	0.75	S	S	*	*			trans	75.1	142.2	167.9	72.5	0	0	0	0	116.9
1444	D	34.4	Very low	31.5	Very low	138 Å²	138	125.2 Å²	125.2	74%	0.738	74%	0.743	S	S	*	*			cis	-148.5	131	-16.1	-136.9	-42	0	0	0	105.6
1445	G	33.7	Very low	31.4	Very low	63 Å²	63	129.6 Å²	129.6	65%	0.649	74%	0.739	S	S	*	*				91.7	134.9	88	0	0	0	0	0	111.3
1446	K	33.3	Very low	31.6	Very low	167 Å²	167	124 Å²	124	73%	0.726	72%	0.719	S	S	*	*			cis	-160.6	163	10.5	-72.5	-164.3	145.6	-67.5	0	109.9
1447	D	32.2	Very low	31.5	Very low	103 Å²	103	123.1 Å²	123.1	55%	0.551	71%	0.714	S	S	*	*			cis	-156.7	129.3	-23.7	-83.3	-19.5	0	0	0	103.3
1448	E	28.7	Very low	31.3	Very low	148 Å²	148	123.3 Å²	123.3	69%	0.692	72%	0.716	S	S	*	*				59.5	149.2	101.3	-56.8	-163.2	153.5	0	0	116.4
1449	I	28.3	Very low	31.4	Very low	142 Å²	142	121 Å²	121	73%	0.728	70%	0.701	S	S	*	*			cis	-136.6	129.9	24.4	-57.5	157.3	0	0	0	110
1450	P	28.4	Very low	31.5	Very low	127 Å²	127	120.4 Å²	120.4	83%	0.825	69%	0.689	S	S	*	*				-130.2	133.6	109.9	35.4	-27.9	0	0	0	111.9
1451	I	28.7	Very low	31.5	Very low	131 Å²	131	120.9 Å²	120.9	67%	0.672	69%	0.686	S	S	*	*			trans	-125.8	147.8	171.7	-67.6	-176.7	0	0	0	109.9
1452	D	29.8	Very low	31.5	Very low	137 Å²	137	117.8 Å²	117.8	73%	0.733	68%	0.68	S	S	*	*			trans	-88.9	163.2	-155.6	-119.2	-61.6	0	0	0	116.8
1453	T	41.2	Very low	31.5	Very low	113 Å²	113	120 Å²	120	69%	0.693	68%	0.68	S	S	*	*			trans	1.9	118.1	135.5	-51.8	0	0	0	0	116.7
1454	L	26.9	Very low	31.2	Very low	142 Å²	142	119.9 Å²	119.9	74%	0.743	68%	0.679	S	S	*	*			trans	-170.4	155.7	135.9	-131.2	71	0	0	0	114.3	G1456	L1454-G1456 VanDerWaalsContact C-N 3.28Å; L1454-G1456 PolarHBondContact O-N 2.85Å
1455	K	30.1	Very low	30.8	Very low	171 Å²	171	120.2 Å²	120.2	74%	0.743	68%	0.679	S	S	*	*	S	Bend	trans	51.6	-39	139.6	-126.7	156.5	178.3	170.4	0	121.9	L1457 A1458	K1455-L1457 PolarHBondContact O-N 3.28Å; K1455-A1458 PolarHBondContact O-N 3.32Å; K1455-A1458 VanDerWaalsContact O-N 3.12Å
1456	G	31.9	Very low	30.5	Very low	44 Å²	44	125.7 Å²	125.7	45%	0.454	69%	0.687	S	S	.	*	H	α-helix	trans	-63.5	-23	-174.3	0	0	0	0	0	114.8	L1454 A1458 E1459 A1460	L1454-G1456 VanDerWaalsContact C-N 3.28Å; L1454-G1456 PolarHBondContact O-N 2.85Å; G1456-A1458 VanDerWaalsContact C-N 3.28Å; G1456-A1458 PolarHBondContact O-N 3.23Å; G1456-E1459 PolarHBondContact O-N 3.23Å; G1456-A1460 WeakPolarHBondContact O-CB 3.26Å; G1456-A1460 PolarHBondContact O-N 3.45Å
1457	L	30.6	Very low	30.2	Very low	141 Å²	141	122 Å²	122	74%	0.738	69%	0.688	S	S	*	*	H	α-helix	trans	-67	-28.2	176	-156.4	79.5	0	0	0	112.7	K1455 L1461	K1455-L1457 PolarHBondContact O-N 3.28Å; L1457-L1461 PolarHBondContact O-N 3.45Å
1458	A	30.4	Very low	30.2	Very low	74 Å²	74	124.6 Å²	124.6	61%	0.612	70%	0.702	S	S	*	*	H	α-helix	trans	-73.6	-45.1	177.1	0	0	0	0	0	111.3	K1455 G1456 A1460 L1461 G1462	K1455-A1458 PolarHBondContact O-N 3.32Å; K1455-A1458 VanDerWaalsContact O-N 3.12Å; G1456-A1458 VanDerWaalsContact C-N 3.28Å; G1456-A1458 PolarHBondContact O-N 3.23Å; A1458-A1460 VanDerWaalsContact C-N 3.3Å; A1458-A1460 PolarHBondContact O-N 3.33Å; A1458-L1461 PolarHBondContact O-N 2.81Å; A1458-G1462 PolarHBondContact O-N 2.69Å
1459	E	33.5	Very low	30.4	Very low	128 Å²	128	121.3 Å²	121.3	60%	0.598	71%	0.708	S	S	*	*	H	α-helix	trans	-67.1	-29.5	174.8	-72.9	-163.7	84	0	0	113.2	G1456 L1461 G1462 K1463	G1456-E1459 PolarHBondContact O-N 3.23Å; E1459-L1461 VanDerWaalsContact C-N 3.3Å; E1459-L1461 PolarHBondContact O-N 2.95Å; E1459-G1462 PolarHBondContact O-N 2.82Å; E1459-K1463 IonicContact OE1-NZ 3.7Å
1460	A	32.4	Very low	30.4	Very low	63 Å²	63	126.4 Å²	126.4	52%	0.521	72%	0.718	S	S	.	*	H	α-helix	trans	-68.1	-26.5	175.5	0	0	0	0	0	113.3	G1456 A1458	G1456-A1460 WeakPolarHBondContact O-CB 3.26Å; G1456-A1460 PolarHBondContact O-N 3.45Å; A1458-A1460 VanDerWaalsContact C-N 3.3Å; A1458-A1460 PolarHBondContact O-N 3.33Å
1461	L	30.3	Very low	30.6	Very low	138 Å²	138	129.6 Å²	129.6	72%	0.723	72%	0.722	S	S	*	*	H	α-helix	trans	-88.9	-20.3	177.8	-71.5	170.1	0	0	0	113.2	L1457 A1458 E1459 K1463	L1457-L1461 PolarHBondContact O-N 3.45Å; A1458-L1461 PolarHBondContact O-N 2.81Å; E1459-L1461 VanDerWaalsContact C-N 3.3Å; E1459-L1461 PolarHBondContact O-N 2.95Å; L1461-K1463 VanDerWaalsContact C-N 3.28Å; L1461-K1463 PolarHBondContact O-N 3.29Å
1462	G	30.6	Very low	30.6	Very low	66 Å²	66	129.2 Å²	129.2	68%	0.68	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-0.7	176.8	0	0	0	0	0	116	A1458 E1459	A1458-G1462 PolarHBondContact O-N 2.69Å; E1459-G1462 PolarHBondContact O-N 2.82Å
1463	K	30.3	Very low	30.8	Very low	157 Å²	157	128.9 Å²	128.9	68%	0.683	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.2	22.1	-169.8	-71.8	174.9	179.6	159.6	0	114.9	E1459 L1461	E1459-K1463 IonicContact OE1-NZ 3.7Å; L1461-K1463 VanDerWaalsContact C-N 3.28Å; L1461-K1463 PolarHBondContact O-N 3.29Å
1464	V	28.6	Very low	30.3	Very low	125 Å²	125	128.5 Å²	128.5	76%	0.758	73%	0.728	S	S	*	*	S	Bend	trans	-117.7	34.5	176.1	-160.3	0	0	0	0	111.8
1465	I	27	Very low	30.4	Very low	144 Å²	144	129.6 Å²	129.6	74%	0.738	73%	0.731	S	S	*	*	S	Bend	trans	-136.7	128.1	165.8	-58.7	-178.3	0	0	0	107.4
1466	H	27.6	Very low	30.7	Very low	178 Å²	178	127 Å²	127	82%	0.824	73%	0.732	S	S	*	*			trans	58.5	86	177.9	-63.8	-56.8	0	0	0	119.2
1467	A	27.6	Very low	30.8	Very low	89 Å²	89	129.4 Å²	129.4	74%	0.736	74%	0.74	S	S	*	*				-117.5	150.6	117.6	0	0	0	0	0	106.8
1468	D	31.4	Very low	30.7	Very low	159 Å²	159	130 Å²	130	85%	0.85	74%	0.744	S	S	*	*	S	Bend	cis	-115.7	-179.2	10.1	-65.6	-61.4	0	0	0	113.3
1469	G	33.3	Very low	30.6	Very low	79 Å²	79	134.6 Å²	134.6	81%	0.814	75%	0.752	S	S	*	*			trans	99.7	83.6	155.1	0	0	0	0	0	116.7
1470	R	28.2	Very low	30.7	Very low	249 Å²	249	134 Å²	134	94%	0.94	76%	0.76	S	S	*	*			trans	-80.2	129.4	157.8	-78.8	176.9	168.6	159.4	-5.1	109.5
1471	E	31.8	Very low	30.4	Very low	193 Å²	193	138.3 Å²	138.3	90%	0.902	77%	0.774	S	S	*	*				-155.9	159.2	123.6	-120	171.1	-168.2	0	0	112.4
1472	T	30	Very low	30.3	Very low	123 Å²	123	137.9 Å²	137.9	76%	0.755	77%	0.772	S	S	*	*			trans	-67.4	149.7	-167.1	44.1	0	0	0	0	113.8
1473	T	32.2	Very low	30.1	Very low	130 Å²	130	140.5 Å²	140.5	80%	0.798	78%	0.775	S	S	*	*				-167.3	143.9	80.2	-60.2	0	0	0	0	111.5
1474	P	31.6	Very low	29.8	Very low	106 Å²	106	140.7 Å²	140.7	69%	0.688	78%	0.783	S	S	*	*			trans	-111.5	144.6	-172.4	38.7	-31	0	0	0	117
1475	M	29.7	Very low	29.8	Very low	164 Å²	164	139.3 Å²	139.3	81%	0.808	78%	0.784	S	S	*	*			trans	64.7	170.6	151.2	-91.6	173.8	78.3	0	0	117.9	P1477	M1475-P1477 HydrophobicContact CE-CG 4.26Å
1476	P	34.9	Very low	29.7	Very low	117 Å²	117	138.6 Å²	138.6	76%	0.76	79%	0.793	S	S	*	*			cis	-122.2	172	15.6	42.7	-29.2	0	0	0	117.3
1477	P	34.3	Very low	29.7	Very low	94 Å²	94	136.3 Å²	136.3	61%	0.61	79%	0.791	S	S	*	*			trans	-105.5	143.8	173.5	38.3	-31	0	0	0	114.5	M1475	M1475-P1477 HydrophobicContact CE-CG 4.26Å
1478	D	29.1	Very low	29.6	Very low	153 Å²	153	135.6 Å²	135.6	82%	0.818	79%	0.793	S	S	*	*			trans	-154	149.9	156.7	-79.7	-53.7	0	0	0	104.4
1479	H	29.2	Very low	29.3	Very low	171 Å²	171	135.6 Å²	135.6	79%	0.792	79%	0.787	S	S	*	*			cis	-150.2	156.5	14.4	-124.2	-80.6	0	0	0	107.8
1480	P	35.8	Very low	29.1	Very low	116 Å²	116	139.5 Å²	139.5	75%	0.753	79%	0.786	S	S	*	*			trans	-98.7	130.5	168.5	34.2	-28.7	0	0	0	112.8
1481	D	24.3	Very low	29	Very low	153 Å²	153	133.3 Å²	133.3	82%	0.818	77%	0.772	S	S	*	*				-172.6	165.9	126.4	-141.4	-23.3	0	0	0	113.2
1482	L	28.1	Very low	29	Very low	130 Å²	130	130.2 Å²	130.2	68%	0.681	76%	0.761	S	S	*	*			trans	70.7	93.1	157.9	-64.3	175.4	0	0	0	122.2
1483	T	26.7	Very low	28.9	Very low	121 Å²	121	133.5 Å²	133.5	74%	0.742	77%	0.768	S	S	*	*				77.1	140.2	125.7	53.8	0	0	0	0	123.8
1484	D	24.2	Very low	29	Very low	161 Å²	161	133 Å²	133	86%	0.861	77%	0.769	S	S	*	*			trans	64.1	81.2	151.8	-68.1	6.6	0	0	0	121.4
1485	A	28.6	Very low	29.2	Very low	95 Å²	95	131.5 Å²	131.5	79%	0.785	75%	0.753	S	S	*	*			trans	-140.1	122.4	138.7	0	0	0	0	0	110.2	T1487	A1485-T1487 PolarHBondContact O-N 3.06Å
1486	S	24.8	Very low	30.4	Very low	130 Å²	130	127.9 Å²	127.9	91%	0.909	74%	0.737	S	S	*	*			trans	-73.8	115.3	-175.3	48.3	0	0	0	0	112.5
1487	T	28.1	Very low	31.6	Very low	130 Å²	130	126.8 Å²	126.8	80%	0.798	73%	0.73	S	S	*	*			trans	-117.2	116.9	164.2	-58	0	0	0	0	108.2	A1485 Q1489	A1485-T1487 PolarHBondContact O-N 3.06Å; T1487-Q1489 PolarHBondContact O-N 3Å
1488	G	26.5	Very low	32.4	Very low	74 Å²	74	129.5 Å²	129.5	76%	0.763	74%	0.735	S	S	*	*			trans	-69.5	97.9	179.1	0	0	0	0	0	111	M1490	G1488-M1490 PolarHBondContact O-N 3.15Å; G1488-M1490 VanDerWaalsContact O-N 3.14Å
1489	Q	24.5	Very low	33.4	Very low	159 Å²	159	123.5 Å²	123.5	74%	0.743	70%	0.703	S	S	*	*			trans	-67.6	107	171	-174.6	170.6	-40.4	0	0	108.7	T1487 D1491	T1487-Q1489 PolarHBondContact O-N 3Å; Q1489-D1491 PolarHBondContact NE2-OD1 3.38Å; Q1489-D1491 PolarHBondContact O-N 2.86Å
1490	M	28	Very low	34.9	Very low	160 Å²	160	119.4 Å²	119.4	79%	0.788	69%	0.686	S	S	*	*			trans	-81.8	98	167.3	-71.1	-168	-61.5	0	0	107.9	G1488 L1492	G1488-M1490 PolarHBondContact O-N 3.15Å; G1488-M1490 VanDerWaalsContact O-N 3.14Å; M1490-L1492 PolarHBondContact O-N 3.05Å; M1490-L1492 VanDerWaalsContact O-N 3.11Å
1491	D	27.3	Very low	36	Very low	120 Å²	120	119.6 Å²	119.6	64%	0.642	68%	0.677	S	S	*	*			trans	-61.9	113.4	170.9	-65.2	-38.4	0	0	0	109.1	Q1489	Q1489-D1491 PolarHBondContact NE2-OD1 3.38Å; Q1489-D1491 PolarHBondContact O-N 2.86Å
1492	L	31.2	Very low	37.4	Very low	127 Å²	127	115 Å²	115	67%	0.665	65%	0.652	S	S	*	*			trans	-111.4	40.4	178.2	-81.8	168.2	0	0	0	110.5	M1490 S1494	M1490-L1492 PolarHBondContact O-N 3.05Å; M1490-L1492 VanDerWaalsContact O-N 3.11Å; L1492-S1494 VanDerWaalsContact C-N 3.32Å; L1492-S1494 PolarHBondContact O-N 3.27Å
1493	E	28.2	Very low	39	Very low	193 Å²	193	111.2 Å²	111.2	90%	0.902	63%	0.632	S	S	*	*			trans	-92.7	58.9	176.2	-62.6	-156.7	146.8	0	0	111.8
1494	S	34	Very low	41	Very low	119 Å²	119	109.2 Å²	109.2	83%	0.832	62%	0.619	S	S	*	*			trans	-166.3	44.6	166.1	64.2	0	0	0	0	113.3	L1492	L1492-S1494 VanDerWaalsContact C-N 3.32Å; L1492-S1494 PolarHBondContact O-N 3.27Å
1495	E	35.9	Very low	43.2	Very low	74 Å²	74	107.9 Å²	107.9	35%	0.346	60%	0.602	S	S	.	*			trans	-111.4	142.9	164.6	-74.4	-159.1	165.7	0	0	111.2	R548 I1500	R548-E1495 IonicContact NH1-OE1 2.69Å; E1495-I1500 HydrophobicContact CB-CD1 4.37Å; E1495-I1500 HydrophobicContact CB-CG1 4.21Å
1496	D	54.1	Low	44.9	Very low	89 Å²	89	107.1 Å²	107.1	48%	0.476	58%	0.582	S	S	.	*			trans	-63.4	136.8	-177.3	-174.7	-54.2	0	0	0	111.7	E1498 V1499 I1500	D1496-E1498 PolarHBondContact O-N 3.47Å; D1496-E1498 PolarHBondContact OD1-N 2.92Å; D1496-V1499 HydrophobicContact CB-CB 4.29Å; D1496-V1499 HydrophobicContact CB-CG2 3.99Å; D1496-V1499 WeakPolarHBondContact O-CA 3.36Å; D1496-V1499 WeakPolarHBondContact O-CB 3.43Å; D1496-V1499 PolarHBondContact O-N 3.43Å; D1496-I1500 PolarHBondContact O-N 2.96Å
1497	P	60.7	Low	47	Very low	94 Å²	94	109.9 Å²	109.9	61%	0.61	57%	0.572	S	S	*	*	H	α-helix	trans	-58	-28.8	-179.5	23.4	-34.5	0	0	0	114.4	Q1501	P1497-Q1501 WeakPolarHBondContact O-CG 3.42Å; P1497-Q1501 PolarHBondContact O-N 2.86Å
1498	E	50.6	Low	49.2	Very low	150 Å²	150	108.7 Å²	108.7	70%	0.701	56%	0.559	S	S	*	*	H	α-helix	trans	-70.1	-39.6	173.1	-67.6	-151.6	119	0	0	111.8	D1496 I1500 Q1501 M1502	D1496-E1498 PolarHBondContact O-N 3.47Å; D1496-E1498 PolarHBondContact OD1-N 2.92Å; E1498-I1500 VanDerWaalsContact C-N 3.35Å; E1498-Q1501 PolarHBondContact O-N 3.09Å; E1498-M1502 WeakPolarHBondContact O-CB 3.37Å; E1498-M1502 PolarHBondContact O-N 3.07Å
1499	V	50.6	Low	51.7	Low	27 Å²	27	110.2 Å²	110.2	16%	0.164	55%	0.546	C	S	.	.	H	α-helix	trans	-64.1	-42	175.3	177.2	0	0	0	0	110.2	I551 D1496 M1502 I1503	I551-V1499 HydrophobicContact CD1-CG1 4.15Å; I551-V1499 HydrophobicContact CD1-CG2 3.93Å; D1496-V1499 HydrophobicContact CB-CB 4.29Å; D1496-V1499 HydrophobicContact CB-CG2 3.99Å; D1496-V1499 WeakPolarHBondContact O-CA 3.36Å; D1496-V1499 WeakPolarHBondContact O-CB 3.43Å; D1496-V1499 PolarHBondContact O-N 3.43Å; V1499-M1502 PolarHBondContact O-N 3.12Å; V1499-I1503 HydrophobicContact CG1-CD1 3.83Å; V1499-I1503 HydrophobicContact CG1-CG1 4.43Å; V1499-I1503 WeakPolarHBondContact O-CB 3.37Å; V1499-I1503 VanDerWaalsContact O-CG1 3.3Å; V1499-I1503 WeakPolarHBondContact O-CG1 3.44Å; V1499-I1503 PolarHBondContact O-N 3.12Å
1500	I	60.8	Low	53.8	Low	85 Å²	85	107 Å²	107	44%	0.436	53%	0.531	S	S	.	.	H	α-helix	trans	-62.9	-48.7	174.9	-63.9	172.8	0	0	0	110.8	E1495 D1496 E1498 M1502 I1503 V1504	E1495-I1500 HydrophobicContact CB-CD1 4.37Å; E1495-I1500 HydrophobicContact CB-CG1 4.21Å; D1496-I1500 PolarHBondContact O-N 2.96Å; E1498-I1500 VanDerWaalsContact C-N 3.35Å; I1500-M1502 VanDerWaalsContact C-N 3.25Å; I1500-M1502 PolarHBondContact O-N 3.45Å; I1500-I1503 PolarHBondContact O-N 3.08Å; I1500-V1504 WeakPolarHBondContact O-CB 3.29Å; I1500-V1504 WeakPolarHBondContact O-CG2 3.31Å; I1500-V1504 PolarHBondContact O-N 3.4Å
1501	Q	58.7	Low	56.1	Low	121 Å²	121	105.3 Å²	105.3	57%	0.565	52%	0.521	S	S	*	.	H	α-helix	trans	-58.1	-38.3	175.3	-79.9	-164.5	37.1	0	0	112.4	P1497 E1498 V1504 R1505	P1497-Q1501 WeakPolarHBondContact O-CG 3.42Å; P1497-Q1501 PolarHBondContact O-N 2.86Å; E1498-Q1501 PolarHBondContact O-N 3.09Å; Q1501-V1504 PolarHBondContact O-N 3.26Å; Q1501-R1505 VanDerWaalsContact O-CB 3.3Å; Q1501-R1505 WeakPolarHBondContact O-CB 3.31Å; Q1501-R1505 PolarHBondContact O-N 3.42Å
1502	M	53.5	Low	58.7	Low	57 Å²	57	106.3 Å²	106.3	28%	0.281	52%	0.52	S	S	.	.	H	α-helix	trans	-72.9	-38.6	-179.4	-176.5	152.7	50.1	0	0	112.6	Y547 E1498 V1499 I1500 R1505 H1506	Y547-M1502 HydrophobicContact CE1-CE 4.26Å; Y547-M1502 WeakPolarHBondContact OH-CE 3.5Å; Y547-M1502 PolarHBondContact OH-SD 3.25Å; E1498-M1502 WeakPolarHBondContact O-CB 3.37Å; E1498-M1502 PolarHBondContact O-N 3.07Å; V1499-M1502 PolarHBondContact O-N 3.12Å; I1500-M1502 VanDerWaalsContact C-N 3.25Å; I1500-M1502 PolarHBondContact O-N 3.45Å; M1502-R1505 PolarHBondContact O-N 2.96Å; M1502-H1506 WeakPolarHBondContact O-CB 3.42Å; M1502-H1506 PolarHBondContact O-N 3.32Å
1503	I	62.6	Low	60.9	Low	50 Å²	50	104.7 Å²	104.7	26%	0.256	51%	0.511	S	S	.	.	H	α-helix	trans	-63.6	-41.6	171	-70.8	168.3	0	0	0	110.5	V1499 I1500 H1506 R1507	V1499-I1503 HydrophobicContact CG1-CD1 3.83Å; V1499-I1503 HydrophobicContact CG1-CG1 4.43Å; V1499-I1503 WeakPolarHBondContact O-CB 3.37Å; V1499-I1503 VanDerWaalsContact O-CG1 3.3Å; V1499-I1503 WeakPolarHBondContact O-CG1 3.44Å; V1499-I1503 PolarHBondContact O-N 3.12Å; I1500-I1503 PolarHBondContact O-N 3.08Å; I1503-H1506 PolarHBondContact O-N 2.74Å; I1503-R1507 WeakPolarHBondContact O-CB 3.28Å; I1503-R1507 PolarHBondContact O-N 3.38Å
1504	V	68.7	Low	63.2	Low	78 Å²	78	100.6 Å²	100.6	47%	0.473	50%	0.495	S	S	.	.	H	α-helix	trans	-62.9	-46.3	173.9	169.3	0	0	0	0	111	I1500 Q1501 H1506 R1507 M1508	I1500-V1504 WeakPolarHBondContact O-CB 3.29Å; I1500-V1504 WeakPolarHBondContact O-CG2 3.31Å; I1500-V1504 PolarHBondContact O-N 3.4Å; Q1501-V1504 PolarHBondContact O-N 3.26Å; V1504-H1506 PolarHBondContact O-N 3.29Å; V1504-R1507 PolarHBondContact O-N 2.89Å; V1504-M1508 WeakPolarHBondContact O-CB 3.23Å; V1504-M1508 PolarHBondContact O-N 3.47Å
1505	R	69.9	Low	65.6	Low	133 Å²	133	98.1 Å²	98.1	50%	0.502	47%	0.47	S	S	.	.	H	α-helix	trans	-58.6	-47.2	176.1	-168.8	179.3	-64.3	136.5	3	111.2	Q1501 M1502 M1508 E1509	Q1501-R1505 VanDerWaalsContact O-CB 3.3Å; Q1501-R1505 WeakPolarHBondContact O-CB 3.31Å; Q1501-R1505 PolarHBondContact O-N 3.42Å; M1502-R1505 PolarHBondContact O-N 2.96Å; R1505-M1508 WeakPolarHBondContact O-CB 3.29Å; R1505-M1508 PolarHBondContact O-N 3.17Å; R1505-E1509 PolarHBondContact O-N 3.25Å
1506	H	64.5	Low	67.7	Low	80 Å²	80	102.2 Å²	102.2	37%	0.37	49%	0.487	S	S	.	.	H	α-helix	trans	-64.4	-42.5	177.7	-169	84.1	0	0	0	112.5	M1502 I1503 V1504 M1508 E1509 Q1510	M1502-H1506 WeakPolarHBondContact O-CB 3.42Å; M1502-H1506 PolarHBondContact O-N 3.32Å; I1503-H1506 PolarHBondContact O-N 2.74Å; V1504-H1506 PolarHBondContact O-N 3.29Å; H1506-M1508 VanDerWaalsContact C-N 3.3Å; H1506-M1508 PolarHBondContact O-N 2.83Å; H1506-E1509 PolarHBondContact O-N 2.67Å; H1506-Q1510 PolarHBondContact NE2-NE2 3.38Å; H1506-Q1510 WeakPolarHBondContact O-CB 3.32Å; H1506-Q1510 VanDerWaalsContact O-CG 3.25Å; H1506-Q1510 WeakPolarHBondContact O-CG 3.37Å; H1506-Q1510 PolarHBondContact O-N 3.29Å
1507	R	68.5	Low	69	Low	188 Å²	188	103.2 Å²	103.2	71%	0.709	49%	0.489	S	S	*	.	H	α-helix	trans	-59.7	-40.4	172.2	-82.8	-176.5	170	179.8	-1	111.9	I1503 V1504 Q1510 H1511	I1503-R1507 WeakPolarHBondContact O-CB 3.28Å; I1503-R1507 PolarHBondContact O-N 3.38Å; V1504-R1507 PolarHBondContact O-N 2.89Å; R1507-Q1510 PolarHBondContact O-N 3.41Å; R1507-H1511 WeakPolarHBondContact O-CB 3.38Å; R1507-H1511 PolarHBondContact O-N 3.1Å
1508	M	75.1	Confident	70.1	Confident	104 Å²	104	106 Å²	106	51%	0.512	49%	0.487	S	S	.	.	H	α-helix	trans	-66.6	-37.1	178.5	-154.8	-163.8	-52.6	0	0	112.1	V1504 R1505 H1506 K1512	V1504-M1508 WeakPolarHBondContact O-CB 3.23Å; V1504-M1508 PolarHBondContact O-N 3.47Å; R1505-M1508 WeakPolarHBondContact O-CB 3.29Å; R1505-M1508 PolarHBondContact O-N 3.17Å; H1506-M1508 VanDerWaalsContact C-N 3.3Å; H1506-M1508 PolarHBondContact O-N 2.83Å; M1508-K1512 WeakPolarHBondContact O-CB 3.34Å; M1508-K1512 PolarHBondContact O-N 3.14Å
1509	E	79.4	Confident	71.5	Confident	106 Å²	106	102.8 Å²	102.8	50%	0.495	48%	0.478	S	S	.	.	H	α-helix	trans	-72.8	-40.6	174.9	-70.5	-169.9	149.9	0	0	112.7	R1505 H1506 H1511 K1512 L1513	R1505-E1509 PolarHBondContact O-N 3.25Å; H1506-E1509 PolarHBondContact O-N 2.67Å; E1509-H1511 VanDerWaalsContact C-N 3.32Å; E1509-H1511 PolarHBondContact O-N 3.32Å; E1509-K1512 PolarHBondContact O-N 3Å; E1509-L1513 WeakPolarHBondContact O-CB 3.25Å; E1509-L1513 PolarHBondContact O-N 3.5Å
1510	Q	67.6	Low	72.8	Confident	92 Å²	92	105.5 Å²	105.5	43%	0.43	49%	0.489	S	S	.	.	H	α-helix	trans	-56.3	-45.6	169.4	-71.4	-77.8	-3.5	0	0	111	H1506 R1507 L1513 L1514	H1506-Q1510 PolarHBondContact NE2-NE2 3.38Å; H1506-Q1510 WeakPolarHBondContact O-CB 3.32Å; H1506-Q1510 VanDerWaalsContact O-CG 3.25Å; H1506-Q1510 WeakPolarHBondContact O-CG 3.37Å; H1506-Q1510 PolarHBondContact O-N 3.29Å; R1507-Q1510 PolarHBondContact O-N 3.41Å; Q1510-L1513 PolarHBondContact O-N 3.42Å; Q1510-L1514 WeakPolarHBondContact O-CB 3.16Å; Q1510-L1514 WeakPolarHBondContact O-CG 3.46Å; Q1510-L1514 PolarHBondContact O-N 2.93Å
1511	H	77.6	Confident	73.6	Confident	124 Å²	124	105.4 Å²	105.4	57%	0.574	49%	0.488	S	S	*	.	H	α-helix	trans	-67.3	-38.4	177.9	-159.7	-50.4	0	0	0	112.4	R1507 E1509 L1513 L1514 E1515	R1507-H1511 WeakPolarHBondContact O-CB 3.38Å; R1507-H1511 PolarHBondContact O-N 3.1Å; E1509-H1511 VanDerWaalsContact C-N 3.32Å; E1509-H1511 PolarHBondContact O-N 3.32Å; H1511-L1513 VanDerWaalsContact C-N 3.31Å; H1511-L1513 PolarHBondContact O-N 2.79Å; H1511-L1514 PolarHBondContact O-N 3.27Å; H1511-E1515 WeakPolarHBondContact O-CB 3.49Å; H1511-E1515 PolarHBondContact O-N 3.11Å
1512	K	81.9	Confident	74.4	Confident	142 Å²	142	104.1 Å²	104.1	62%	0.617	48%	0.482	S	S	*	.	H	α-helix	trans	-64.3	-34.2	171.6	-84.6	176.3	175.6	167.9	0	112.5	M1508 E1509 K1516	M1508-K1512 WeakPolarHBondContact O-CB 3.34Å; M1508-K1512 PolarHBondContact O-N 3.14Å; E1509-K1512 PolarHBondContact O-N 3Å; K1512-K1516 WeakPolarHBondContact O-CB 3.3Å; K1512-K1516 PolarHBondContact O-N 2.91Å
1513	L	76	Confident	75.6	Confident	93 Å²	93	108 Å²	108	49%	0.487	49%	0.494	S	S	.	.	H	α-helix	trans	-72.8	-42.5	177	-174	63.2	0	0	0	111.6	E1509 Q1510 H1511 K1516 Q1517	E1509-L1513 WeakPolarHBondContact O-CB 3.25Å; E1509-L1513 PolarHBondContact O-N 3.5Å; Q1510-L1513 PolarHBondContact O-N 3.42Å; H1511-L1513 VanDerWaalsContact C-N 3.31Å; H1511-L1513 PolarHBondContact O-N 2.79Å; L1513-K1516 PolarHBondContact O-N 2.82Å; L1513-Q1517 WeakPolarHBondContact O-CG 3.21Å; L1513-Q1517 PolarHBondContact O-N 3.2Å
1514	L	77.3	Confident	76.1	Confident	107 Å²	107	109.9 Å²	109.9	56%	0.56	50%	0.504	S	S	*	.	H	α-helix	trans	-62.4	-45.3	173.3	-78	167.5	0	0	0	111.6	Q1510 H1511 K1516 Q1517 R1518	Q1510-L1514 WeakPolarHBondContact O-CB 3.16Å; Q1510-L1514 WeakPolarHBondContact O-CG 3.46Å; Q1510-L1514 PolarHBondContact O-N 2.93Å; H1511-L1514 PolarHBondContact O-N 3.27Å; L1514-K1516 VanDerWaalsContact C-N 3.34Å; L1514-K1516 PolarHBondContact O-N 3.37Å; L1514-Q1517 PolarHBondContact O-N 3.34Å; L1514-Q1517 VanDerWaalsContact O-N 3.16Å; L1514-R1518 WeakPolarHBondContact O-CB 3.44Å; L1514-R1518 PolarHBondContact O-N 2.82Å
1515	E	83	Confident	76.1	Confident	67 Å²	67	113.4 Å²	113.4	31%	0.313	51%	0.509	S	S	.	.	H	α-helix	trans	-67.8	-34.9	177.4	-159.5	61.1	-143.8	0	0	111.3	H1511 R1518 V1519	H1511-E1515 WeakPolarHBondContact O-CB 3.49Å; H1511-E1515 PolarHBondContact O-N 3.11Å; E1515-R1518 VanDerWaalsContact CD-NH1 3.29Å; E1515-R1518 PolarHBondContact O-N 3.29Å; E1515-R1518 WeakPolarHBondContact OE1-CD 3.03Å; E1515-R1518 IonicContact OE1-CZ 2.74Å; E1515-R1518 IonicContact OE1-NE 2.83Å; E1515-R1518 IonicContact OE1-NH1 3.72Å; E1515-R1518 PolarHBondContact OE1-NH1 3.11Å; E1515-R1518 IonicContact OE2-NH1 2.65Å; E1515-R1518 PolarHBondContact OE2-NH1 3.14Å; E1515-R1518 VanDerWaalsContact OE2-NH1 3.1Å; E1515-V1519 WeakPolarHBondContact O-CB 3.41Å; E1515-V1519 VanDerWaalsContact O-CG2 3.29Å; E1515-V1519 WeakPolarHBondContact O-CG2 3.32Å; E1515-V1519 PolarHBondContact O-N 3.24Å
1516	K	80.9	Confident	75.7	Confident	159 Å²	159	110.5 Å²	110.5	69%	0.691	51%	0.508	S	S	*	.	H	α-helix	trans	-60.5	-43.2	168.3	-97.9	-173.5	173.8	180	0	112.7	K1512 L1513 L1514 E1520	K1512-K1516 WeakPolarHBondContact O-CB 3.3Å; K1512-K1516 PolarHBondContact O-N 2.91Å; L1513-K1516 PolarHBondContact O-N 2.82Å; L1514-K1516 VanDerWaalsContact C-N 3.34Å; L1514-K1516 PolarHBondContact O-N 3.37Å; K1516-E1520 PolarHBondContact O-N 3.03Å
1517	Q	80.9	Confident	75.5	Confident	110 Å²	110	112.3 Å²	112.3	51%	0.514	52%	0.515	S	S	.	.	H	α-helix	trans	-65.9	-42.3	176.4	-73.6	-173.4	40.8	0	0	111.2	L1513 L1514 E1520 I1521	L1513-Q1517 WeakPolarHBondContact O-CG 3.21Å; L1513-Q1517 PolarHBondContact O-N 3.2Å; L1514-Q1517 PolarHBondContact O-N 3.34Å; L1514-Q1517 VanDerWaalsContact O-N 3.16Å; Q1517-E1520 PolarHBondContact O-N 3.48Å; Q1517-I1521 WeakPolarHBondContact O-CB 3.16Å; Q1517-I1521 WeakPolarHBondContact O-CD1 3.41Å; Q1517-I1521 WeakPolarHBondContact O-CG1 3.45Å; Q1517-I1521 PolarHBondContact O-N 3.45Å
1518	R	85.4	Confident	74.6	Confident	152 Å²	152	110.3 Å²	110.3	57%	0.574	52%	0.517	S	S	*	.	H	α-helix	trans	-60.1	-47.7	175.2	-177.1	174.6	171.9	-133.1	-1.2	111.5	L1514 E1515 I1521 E1522	L1514-R1518 WeakPolarHBondContact O-CB 3.44Å; L1514-R1518 PolarHBondContact O-N 2.82Å; E1515-R1518 VanDerWaalsContact CD-NH1 3.29Å; E1515-R1518 PolarHBondContact O-N 3.29Å; E1515-R1518 WeakPolarHBondContact OE1-CD 3.03Å; E1515-R1518 IonicContact OE1-CZ 2.74Å; E1515-R1518 IonicContact OE1-NE 2.83Å; E1515-R1518 IonicContact OE1-NH1 3.72Å; E1515-R1518 PolarHBondContact OE1-NH1 3.11Å; E1515-R1518 IonicContact OE2-NH1 2.65Å; E1515-R1518 PolarHBondContact OE2-NH1 3.14Å; E1515-R1518 VanDerWaalsContact OE2-NH1 3.1Å; R1518-I1521 PolarHBondContact O-N 2.64Å; R1518-E1522 WeakPolarHBondContact O-CB 3.35Å; R1518-E1522 PolarHBondContact O-N 2.81Å
1519	V	79.9	Confident	72.8	Confident	83 Å²	83	115.6 Å²	115.6	50%	0.503	53%	0.531	S	S	.	.	H	α-helix	trans	-65.2	-39	176.8	170.7	0	0	0	0	111.9	E1515 E1522 R1523	E1515-V1519 WeakPolarHBondContact O-CB 3.41Å; E1515-V1519 VanDerWaalsContact O-CG2 3.29Å; E1515-V1519 WeakPolarHBondContact O-CG2 3.32Å; E1515-V1519 PolarHBondContact O-N 3.24Å; V1519-E1522 PolarHBondContact O-N 2.97Å; V1519-R1523 WeakPolarHBondContact O-CB 3.47Å; V1519-R1523 PolarHBondContact O-N 2.96Å
1520	E	78	Confident	70.8	Confident	85 Å²	85	116.1 Å²	116.1	40%	0.397	54%	0.542	S	S	.	.	H	α-helix	trans	-71.8	-34.5	174.9	-167	62.6	-140.1	0	0	111.9	K1516 Q1517 R1523 L1524 K1527	K1516-E1520 PolarHBondContact O-N 3.03Å; Q1517-E1520 PolarHBondContact O-N 3.48Å; E1520-R1523 CarbonylContact O-C 3.55Å; E1520-R1523 PolarHBondContact O-N 2.91Å; E1520-R1523 WeakPolarHBondContact OE2-CD 3.42Å; E1520-R1523 IonicContact OE2-NE 2.89Å; E1520-L1524 HydrophobicContact CG-CD1 4.32Å; E1520-L1524 WeakPolarHBondContact O-CB 3.41Å; E1520-L1524 WeakPolarHBondContact O-CG 3.43Å; E1520-L1524 PolarHBondContact O-N 2.66Å; E1520-K1527 IonicContact OE1-NZ 3.14Å
1521	I	77.5	Confident	69.3	Low	83 Å²	83	117 Å²	117	43%	0.426	56%	0.555	S	S	.	*	H	α-helix	trans	-62.5	-42.8	171.1	-73.2	164.6	0	0	0	110.4	Q1517 R1518 L1524 R1525	Q1517-I1521 WeakPolarHBondContact O-CB 3.16Å; Q1517-I1521 WeakPolarHBondContact O-CD1 3.41Å; Q1517-I1521 WeakPolarHBondContact O-CG1 3.45Å; Q1517-I1521 PolarHBondContact O-N 3.45Å; R1518-I1521 PolarHBondContact O-N 2.64Å; I1521-L1524 PolarHBondContact O-N 2.9Å; I1521-R1525 HydrophobicContact CG2-CG 4.5Å; I1521-R1525 WeakPolarHBondContact O-CB 3.32Å; I1521-R1525 VanDerWaalsContact O-CG 3.3Å; I1521-R1525 WeakPolarHBondContact O-CG 3.22Å; I1521-R1525 PolarHBondContact O-N 2.98Å
1522	E	74.8	Confident	66.9	Low	94 Å²	94	121.7 Å²	121.7	44%	0.439	57%	0.568	S	S	.	*	H	α-helix	trans	-71.7	-31.8	177.4	-145.5	55.9	-121.9	0	0	111.8	R1518 V1519 L1524 R1525 S1526	R1518-E1522 WeakPolarHBondContact O-CB 3.35Å; R1518-E1522 PolarHBondContact O-N 2.81Å; V1519-E1522 PolarHBondContact O-N 2.97Å; E1522-L1524 VanDerWaalsContact C-N 3.34Å; E1522-R1525 PolarHBondContact O-N 2.84Å; E1522-R1525 IonicContact OE2-NH1 3.12Å; E1522-R1525 PolarHBondContact OE2-NH1 3.34Å; E1522-S1526 WeakPolarHBondContact O-CB 3.45Å; E1522-S1526 PolarHBondContact O-N 2.9Å; E1522-S1526 PolarHBondContact O-OG 3.38Å
1523	R	79.2	Confident	64.4	Low	138 Å²	138	118.7 Å²	118.7	52%	0.521	57%	0.569	S	S	.	*	H	α-helix	trans	-69.2	-27.2	170	-174.4	171.9	173.7	80.4	-8.1	113	V1519 E1520 S1526 K1527	V1519-R1523 WeakPolarHBondContact O-CB 3.47Å; V1519-R1523 PolarHBondContact O-N 2.96Å; E1520-R1523 CarbonylContact O-C 3.55Å; E1520-R1523 PolarHBondContact O-N 2.91Å; E1520-R1523 WeakPolarHBondContact OE2-CD 3.42Å; E1520-R1523 IonicContact OE2-NE 2.89Å; R1523-S1526 VanDerWaalsContact CA-OG 3.29Å; R1523-S1526 WeakPolarHBondContact CA-OG 3.36Å; R1523-S1526 PolarHBondContact O-OG 3.46Å; R1523-K1527 WeakPolarHBondContact O-CB 3.3Å; R1523-K1527 VanDerWaalsContact O-CD 3.25Å; R1523-K1527 WeakPolarHBondContact O-CD 3.09Å; R1523-K1527 WeakPolarHBondContact O-CG 3.43Å; R1523-K1527 PolarHBondContact O-N 3.29Å
1524	L	71.5	Confident	62.1	Low	90 Å²	90	120.6 Å²	120.6	47%	0.471	59%	0.585	S	S	.	*	H	α-helix	trans	-81.5	-41	171.6	-72.6	165.9	0	0	0	111.1	E1520 I1521 E1522 K1527 I1528	E1520-L1524 HydrophobicContact CG-CD1 4.32Å; E1520-L1524 WeakPolarHBondContact O-CB 3.41Å; E1520-L1524 WeakPolarHBondContact O-CG 3.43Å; E1520-L1524 PolarHBondContact O-N 2.66Å; I1521-L1524 PolarHBondContact O-N 2.9Å; E1522-L1524 VanDerWaalsContact C-N 3.34Å; L1524-K1527 PolarHBondContact O-N 3.18Å; L1524-I1528 VanDerWaalsContact O-CG1 3.3Å; L1524-I1528 WeakPolarHBondContact O-CG1 2.92Å; L1524-I1528 PolarHBondContact O-N 3.22Å
1525	R	69.7	Low	59.8	Low	152 Å²	152	120.7 Å²	120.7	57%	0.574	60%	0.595	S	S	*	*	H	α-helix	trans	-61.5	-43.4	173.6	-75.6	171.3	168.4	-169.5	-5.2	112.3	I1521 E1522 I1528 R1529	I1521-R1525 HydrophobicContact CG2-CG 4.5Å; I1521-R1525 WeakPolarHBondContact O-CB 3.32Å; I1521-R1525 VanDerWaalsContact O-CG 3.3Å; I1521-R1525 WeakPolarHBondContact O-CG 3.22Å; I1521-R1525 PolarHBondContact O-N 2.98Å; E1522-R1525 PolarHBondContact O-N 2.84Å; E1522-R1525 IonicContact OE2-NH1 3.12Å; E1522-R1525 PolarHBondContact OE2-NH1 3.34Å; R1525-I1528 CarbonylContact O-C 2.99Å; R1525-I1528 PolarHBondContact O-N 3.02Å; R1525-I1528 VanDerWaalsContact O-N 3.17Å; R1525-R1529 WeakPolarHBondContact O-CB 3.5Å; R1525-R1529 PolarHBondContact O-N 2.93Å
1526	S	61.5	Low	57.2	Low	71 Å²	71	123 Å²	123	50%	0.497	61%	0.613	S	S	.	*	H	α-helix	trans	-67.2	-34	174.1	49.4	0	0	0	0	113.1	E1522 R1523 I1528 R1529	E1522-S1526 WeakPolarHBondContact O-CB 3.45Å; E1522-S1526 PolarHBondContact O-N 2.9Å; E1522-S1526 PolarHBondContact O-OG 3.38Å; R1523-S1526 VanDerWaalsContact CA-OG 3.29Å; R1523-S1526 WeakPolarHBondContact CA-OG 3.36Å; R1523-S1526 PolarHBondContact O-OG 3.46Å; S1526-I1528 VanDerWaalsContact C-N 3.3Å; S1526-I1528 PolarHBondContact O-N 3.49Å; S1526-R1529 PolarHBondContact O-N 2.91Å
1527	K	59.3	Low	54.7	Low	119 Å²	119	122.9 Å²	122.9	52%	0.517	62%	0.62	S	S	.	*	H	α-helix	trans	-68.4	-25.4	169.5	-75.7	168	-170.9	165.4	0	113.8	E1520 R1523 L1524	E1520-K1527 IonicContact OE1-NZ 3.14Å; R1523-K1527 WeakPolarHBondContact O-CB 3.3Å; R1523-K1527 VanDerWaalsContact O-CD 3.25Å; R1523-K1527 WeakPolarHBondContact O-CD 3.09Å; R1523-K1527 WeakPolarHBondContact O-CG 3.43Å; R1523-K1527 PolarHBondContact O-N 3.29Å; L1524-K1527 PolarHBondContact O-N 3.18Å
1528	I	50.8	Low	52.4	Low	145 Å²	145	122.6 Å²	122.6	74%	0.744	63%	0.628	S	S	*	*	H	α-helix	trans	-83.2	-25.9	173.8	-69.1	164.2	0	0	0	111	L1524 R1525 S1526 V1530	L1524-I1528 VanDerWaalsContact O-CG1 3.3Å; L1524-I1528 WeakPolarHBondContact O-CG1 2.92Å; L1524-I1528 PolarHBondContact O-N 3.22Å; R1525-I1528 CarbonylContact O-C 2.99Å; R1525-I1528 PolarHBondContact O-N 3.02Å; R1525-I1528 VanDerWaalsContact O-N 3.17Å; S1526-I1528 VanDerWaalsContact C-N 3.3Å; S1526-I1528 PolarHBondContact O-N 3.49Å; I1528-V1530 VanDerWaalsContact C-N 3.34Å; I1528-V1530 PolarHBondContact O-N 3.4Å; I1528-V1530 VanDerWaalsContact O-N 3.11Å
1529	R	37.4	Very low	49.7	Very low	216 Å²	216	123 Å²	123	82%	0.815	64%	0.636	S	S	*	*			trans	-84.3	69.7	174.4	-172.6	175.9	-87.2	169.1	-7.1	111.8	R1525 S1526	R1525-R1529 WeakPolarHBondContact O-CB 3.5Å; R1525-R1529 PolarHBondContact O-N 2.93Å; S1526-R1529 PolarHBondContact O-N 2.91Å
1530	V	36.2	Very low	47.3	Very low	117 Å²	117	128 Å²	128	71%	0.709	66%	0.656	S	S	*	*			trans	-94.6	130.2	161.4	-179.3	0	0	0	0	108.6	I1528	I1528-V1530 VanDerWaalsContact C-N 3.34Å; I1528-V1530 PolarHBondContact O-N 3.4Å; I1528-V1530 VanDerWaalsContact O-N 3.11Å
1531	P	36.8	Very low	45	Very low	110 Å²	110	130.5 Å²	130.5	71%	0.714	67%	0.671	S	S	*	*			trans	-74.2	137.3	-177.3	29.2	-34.5	0	0	0	112.6	A1533	P1531-A1533 PolarHBondContact O-N 3.3Å
1532	R	26.4	Very low	42.8	Very low	223 Å²	223	129.5 Å²	129.5	84%	0.842	68%	0.681	S	S	*	*			trans	-85.2	77.1	175.1	-174.8	175.3	179	161.2	-2.3	110.1	E935	E935-R1532 IonicContact OE1-CZ 3.79Å; E935-R1532 IonicContact OE1-NH1 2.63Å; E935-R1532 PolarHBondContact OE1-NH1 3.04Å; E935-R1532 IonicContact OE1-NH2 2.68Å; E935-R1532 PolarHBondContact OE1-NH2 3.3Å
1533	A	28.9	Very low	40.6	Very low	78 Å²	78	131.8 Å²	131.8	65%	0.645	70%	0.697	S	S	*	*			trans	-142.6	113.6	177.5	0	0	0	0	0	113.8	P1531	P1531-A1533 PolarHBondContact O-N 3.3Å
1534	T	29	Very low	38.5	Very low	134 Å²	134	132.6 Å²	132.6	82%	0.822	71%	0.711	S	S	*	*			trans	40.5	104.9	147.4	56	0	0	0	0	121.5
1535	S	29.8	Very low	36.6	Very low	109 Å²	109	137.2 Å²	137.2	76%	0.762	73%	0.73	S	S	*	*				-141.7	121.3	124.5	-159.1	0	0	0	0	105
1536	V	27.4	Very low	35	Very low	116 Å²	116	133.9 Å²	133.9	70%	0.703	74%	0.736	S	S	*	*				62.9	105.2	53.3	-170.5	0	0	0	0	110.3
1537	N	28	Very low	33.5	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	75%	0.75	S	S	*	*			trans	-89	133.7	171	-70.8	-7.1	0	0	0	109.2
1538	P	33.4	Very low	32.4	Very low	104 Å²	104	137.3 Å²	137.3	68%	0.675	76%	0.758	S	S	*	*			trans	-84.1	158.1	157.3	34.8	-31.5	0	0	0	111.5
1539	E	27.9	Very low	31.5	Very low	162 Å²	162	135.8 Å²	135.8	76%	0.757	76%	0.756	S	S	*	*			trans	54.6	95.2	154	-63.9	175.4	128.1	0	0	119.2
1540	M	29.4	Very low	31.2	Very low	186 Å²	186	133.2 Å²	133.2	92%	0.916	76%	0.757	S	S	*	*				-127	116.4	119	-87.2	-64.6	-59.8	0	0	107.1
1541	I	30	Very low	30.8	Very low	138 Å²	138	133.8 Å²	133.8	71%	0.708	76%	0.761	S	S	*	*			trans	-102.6	145.8	173.1	-67.6	174.9	0	0	0	108.1
1542	G	31.3	Very low	30.5	Very low	63 Å²	63	132.5 Å²	132.5	65%	0.649	76%	0.76	S	S	*	*			trans	159.4	134	159.2	0	0	0	0	0	111.9
1543	D	29.7	Very low	30.6	Very low	142 Å²	142	128.9 Å²	128.9	76%	0.759	76%	0.756	S	S	*	*			cis	-157.5	-158.4	-15.2	-106.6	-38.4	0	0	0	107.6
1544	D	33.5	Very low	30.5	Very low	155 Å²	155	133.2 Å²	133.2	83%	0.829	76%	0.763	S	S	*	*			trans	78.3	131.1	179.5	-53.1	-34	0	0	0	115.2
1545	E	31.7	Very low	30.5	Very low	186 Å²	186	132.1 Å²	132.1	87%	0.869	76%	0.761	S	S	*	*			cis	-154.6	179.6	2.5	-140.4	-167.2	164.8	0	0	112.8
1546	A	35.8	Very low	30.5	Very low	83 Å²	83	131 Å²	131	69%	0.686	76%	0.759	S	S	*	*			trans	82.7	105.3	163.2	0	0	0	0	0	121
1547	D	31.3	Very low	30.4	Very low	149 Å²	149	134.1 Å²	134.1	80%	0.797	77%	0.771	S	S	*	*				46.3	144.8	129.4	-79.1	-38.2	0	0	0	122.6
1548	T	35	Very low	30.4	Very low	113 Å²	113	129.5 Å²	129.5	69%	0.693	76%	0.76	S	S	*	*			cis	-155.5	139.1	27.6	-13.4	0	0	0	0	114
1549	T	33.8	Very low	30.3	Very low	113 Å²	113	132.9 Å²	132.9	69%	0.693	77%	0.772	S	S	*	*			trans	44.1	124	144.6	50.6	0	0	0	0	125.6
1550	L	29.9	Very low	30.6	Very low	161 Å²	161	129.2 Å²	129.2	84%	0.843	77%	0.77	S	S	*	*				90.5	169.5	125.9	-80.2	169.5	0	0	0	122.8
1551	T	27.3	Very low	30.9	Very low	129 Å²	129	125.5 Å²	125.5	79%	0.791	76%	0.762	S	S	*	*			trans	-149.4	160	-147.2	-43.3	0	0	0	0	111.6
1552	A	31	Very low	30.9	Very low	83 Å²	83	126.5 Å²	126.5	69%	0.686	77%	0.767	S	S	*	*			trans	109.3	135.4	143.8	0	0	0	0	0	120.5
1553	L	28.3	Very low	31	Very low	147 Å²	147	128.6 Å²	128.6	77%	0.77	77%	0.772	S	S	*	*			trans	70.2	86	145.7	-65.4	166.1	0	0	0	122.2
1554	Q	27.4	Very low	31.1	Very low	169 Å²	169	129.3 Å²	129.3	79%	0.79	78%	0.775	S	S	*	*				73.7	133.8	104.2	-163.5	165.4	22.6	0	0	122.2
1555	S	28	Very low	31.5	Very low	112 Å²	112	127.4 Å²	127.4	78%	0.783	77%	0.772	S	S	*	*			trans	98.6	116.1	153.4	73.8	0	0	0	0	122
1556	A	29.6	Very low	31.5	Very low	86 Å²	86	123 Å²	123	71%	0.711	77%	0.767	S	S	*	*			trans	72.7	132	136.9	0	0	0	0	0	123
1557	L	26.9	Very low	31.2	Very low	181 Å²	181	124.1 Å²	124.1	95%	0.948	77%	0.769	S	S	*	*			trans	68.1	145.4	161.6	-57.7	156	0	0	0	115.9
1558	G	27	Very low	32.2	Very low	58 Å²	58	122.7 Å²	122.7	60%	0.598	77%	0.768	S	S	*	*			cis	175	166	-5.6	0	0	0	0	0	111.5
1559	N	31.6	Very low	32.3	Very low	174 Å²	174	122.9 Å²	122.9	93%	0.93	77%	0.771	S	S	*	*			trans	74.3	142.6	-175.8	-49.5	-30.3	0	0	0	114.8
1560	A	34.3	Very low	33.1	Very low	86 Å²	86	122.6 Å²	122.6	71%	0.711	77%	0.772	S	S	*	*			cis	-143.8	162.9	3.4	0	0	0	0	0	112.9
1561	S	35.7	Very low	33.2	Very low	107 Å²	107	120.2 Å²	120.2	75%	0.748	76%	0.76	S	S	*	*			trans	60.6	102.1	166.6	-54.4	0	0	0	0	117
1562	L	30.5	Very low	33.6	Very low	159 Å²	159	117.9 Å²	117.9	83%	0.832	75%	0.745	S	S	*	*				60.2	129.8	60.2	-51.5	171.4	0	0	0	112.4
1563	S	32.3	Very low	33.5	Very low	107 Å²	107	117.5 Å²	117.5	75%	0.748	73%	0.73	S	S	*	*			cis	-149.9	133.2	15	47.6	0	0	0	0	110.5
1564	L	32.1	Very low	33.7	Very low	157 Å²	157	116.8 Å²	116.8	82%	0.822	73%	0.731	S	S	*	*				74.5	150.6	84.5	-66.9	175.9	0	0	0	116.6
1565	P	42.9	Very low	34.2	Very low	116 Å²	116	115.5 Å²	115.5	75%	0.753	74%	0.735	S	S	*	*			trans	-129	-165.2	-148.1	44.2	-28.3	0	0	0	116.6
1566	A	30.3	Very low	34.5	Very low	93 Å²	93	116.8 Å²	116.8	77%	0.769	73%	0.727	S	S	*	*			trans	80.8	153.4	178.2	0	0	0	0	0	114.8
1567	S	29.5	Very low	34.5	Very low	106 Å²	106	117 Å²	117	74%	0.741	72%	0.719	S	S	*	*			cis	-151.9	165.8	9.9	-43.5	0	0	0	0	111.9
1568	P	53.5	Low	34.6	Very low	119 Å²	119	111.8 Å²	111.8	77%	0.773	69%	0.692	S	S	*	*			trans	-79.5	173.6	145.8	36.7	-33.7	0	0	0	110.5
1569	P	35.8	Very low	34.6	Very low	117 Å²	117	112.7 Å²	112.7	76%	0.76	69%	0.686	S	S	*	*			cis	-124.3	-177.9	8.7	43.1	-27.9	0	0	0	113.9
1570	P	50.9	Low	34.3	Very low	107 Å²	107	109.8 Å²	109.8	70%	0.695	68%	0.675	S	S	*	*			trans	-95.1	157.1	-178.3	36.9	-34.7	0	0	0	114.5
1571	N	33.1	Very low	33.9	Very low	112 Å²	112	111.4 Å²	111.4	60%	0.599	68%	0.675	S	S	*	*			trans	-152	125.9	152	-104.8	-11.9	0	0	0	109.6	N1578 T1579	N1571-N1578 WeakPolarHBondContact CA-OD1 3.42Å; N1571-N1578 WeakPolarHBondContact CB-OD1 3.25Å; N1571-N1578 VanDerWaalsContact CG-CG 3.48Å; N1571-N1578 PolarHBondContact OD1-OD1 3.39Å; N1571-N1578 VanDerWaalsContact OD1-OD1 3.06Å; N1571-T1579 WeakPolarHBondContact OD1-CB 3.46Å; N1571-T1579 PolarHBondContact OD1-OG1 3.21Å
1572	T	35.2	Very low	33.7	Very low	79 Å²	79	113.9 Å²	113.9	49%	0.485	68%	0.679	S	S	.	*			trans	-78.2	-170.9	-174.1	8.1	0	0	0	0	114.3	K1576 V1577 N1578	T1572-K1576 VanDerWaalsContact CB-O 3.24Å; T1572-K1576 WeakPolarHBondContact CB-O 3.31Å; T1572-V1577 WeakPolarHBondContact CB-O 3.5Å; T1572-V1577 VanDerWaalsContact OG1-C 3.32Å; T1572-V1577 PolarHBondContact OG1-O 3.23Å; T1572-N1578 PolarHBondContact N-OD1 2.89Å; T1572-N1578 PolarHBondContact O-OD1 2.58Å; T1572-N1578 VanDerWaalsContact O-OD1 3.09Å; T1572-N1578 VanDerWaalsContact OG1-CA 3.3Å; T1572-N1578 WeakPolarHBondContact OG1-CA 3.4Å; T1572-N1578 PolarHBondContact OG1-N 3.31Å
1573	E	29.5	Very low	33.7	Very low	76 Å²	76	111.7 Å²	111.7	36%	0.355	67%	0.674	S	S	.	*			trans	75.3	128.1	-166.1	-154.2	71.7	104.1	0	0	112.8	K1576 V1577	E1573-K1576 VanDerWaalsContact CA-O 3.3Å; E1573-K1576 WeakPolarHBondContact CA-O 3.07Å; E1573-K1576 PolarHBondContact N-O 3.05Å; E1573-K1576 WeakPolarHBondContact OE1-CG 3.38Å; E1573-K1576 IonicContact OE1-NZ 3.01Å; E1573-K1576 PolarHBondContact OE1-NZ 2.93Å; E1573-K1576 WeakPolarHBondContact OE2-CG 3.47Å; E1573-K1576 PolarHBondContact OE2-N 2.79Å; E1573-K1576 IonicContact OE2-NZ 2.69Å; E1573-V1577 HydrophobicContact CB-CG2 4.42Å; E1573-V1577 WeakPolarHBondContact OE1-CB 3.36Å
1574	T	32.3	Very low	33.6	Very low	132 Å²	132	112 Å²	112	81%	0.81	68%	0.677	S	S	*	*	S	Bend	cis	-125.3	131.8	7.3	-26.6	0	0	0	0	108.1
1575	T	37.5	Very low	33.4	Very low	142 Å²	142	111.9 Å²	111.9	87%	0.871	68%	0.676	S	S	*	*	S	Bend	cis	-97.6	119.1	12.9	-49.8	0	0	0	0	113.9
1576	K	33.4	Very low	32.8	Very low	139 Å²	139	112.6 Å²	112.6	60%	0.604	68%	0.678	S	S	*	*	S	Bend	trans	116.4	132.2	161	-49.1	-177.8	-171.8	-62.1	0	109.3	T1572 E1573	T1572-K1576 VanDerWaalsContact CB-O 3.24Å; T1572-K1576 WeakPolarHBondContact CB-O 3.31Å; E1573-K1576 VanDerWaalsContact CA-O 3.3Å; E1573-K1576 WeakPolarHBondContact CA-O 3.07Å; E1573-K1576 PolarHBondContact N-O 3.05Å; E1573-K1576 WeakPolarHBondContact OE1-CG 3.38Å; E1573-K1576 IonicContact OE1-NZ 3.01Å; E1573-K1576 PolarHBondContact OE1-NZ 2.93Å; E1573-K1576 WeakPolarHBondContact OE2-CG 3.47Å; E1573-K1576 PolarHBondContact OE2-N 2.79Å; E1573-K1576 IonicContact OE2-NZ 2.69Å
1577	V	30.4	Very low	32.6	Very low	91 Å²	91	115.5 Å²	115.5	55%	0.552	68%	0.68	S	S	*	*			trans	-91.9	173.3	-151.2	76.8	0	0	0	0	115.9	T1572 E1573	T1572-V1577 WeakPolarHBondContact CB-O 3.5Å; T1572-V1577 VanDerWaalsContact OG1-C 3.32Å; T1572-V1577 PolarHBondContact OG1-O 3.23Å; E1573-V1577 HydrophobicContact CB-CG2 4.42Å; E1573-V1577 WeakPolarHBondContact OE1-CB 3.36Å
1578	N	29.3	Very low	32.6	Very low	71 Å²	71	115.5 Å²	115.5	38%	0.38	69%	0.687	S	S	.	*			trans	-55.1	138.2	177.6	-72.6	-30	0	0	0	115.2	N1571 T1572	N1571-N1578 WeakPolarHBondContact CA-OD1 3.42Å; N1571-N1578 WeakPolarHBondContact CB-OD1 3.25Å; N1571-N1578 VanDerWaalsContact CG-CG 3.48Å; N1571-N1578 PolarHBondContact OD1-OD1 3.39Å; N1571-N1578 VanDerWaalsContact OD1-OD1 3.06Å; T1572-N1578 PolarHBondContact N-OD1 2.89Å; T1572-N1578 PolarHBondContact O-OD1 2.58Å; T1572-N1578 VanDerWaalsContact O-OD1 3.09Å; T1572-N1578 VanDerWaalsContact OG1-CA 3.3Å; T1572-N1578 WeakPolarHBondContact OG1-CA 3.4Å; T1572-N1578 PolarHBondContact OG1-N 3.31Å
1579	T	25.9	Very low	31.5	Very low	77 Å²	77	116 Å²	116	47%	0.472	69%	0.688	S	S	.	*				10.3	118.9	115.6	-20.3	0	0	0	0	116.2	N1571	N1571-T1579 WeakPolarHBondContact OD1-CB 3.46Å; N1571-T1579 PolarHBondContact OD1-OG1 3.21Å
1580	T	25.3	Very low	31.2	Very low	113 Å²	113	120.3 Å²	120.3	69%	0.693	69%	0.689	S	S	*	*				150	147.1	105.1	-41.1	0	0	0	0	110.5
1581	V	26	Very low	30.3	Very low	119 Å²	119	121.9 Å²	121.9	72%	0.721	69%	0.689	S	S	*	*			trans	68.2	108.8	167.6	-150.2	0	0	0	0	116.8
1582	I	32.5	Very low	30.3	Very low	159 Å²	159	122.6 Å²	122.6	82%	0.815	70%	0.697	S	S	*	*				176	127	113	-85.7	160	0	0	0	106.8
1583	P	31.3	Very low	30.2	Very low	114 Å²	114	127.8 Å²	127.8	74%	0.74	72%	0.718	S	S	*	*			trans	-96	134.6	179.1	34.9	-30.7	0	0	0	112.7
1584	S	29.5	Very low	30.2	Very low	114 Å²	114	129.7 Å²	129.7	80%	0.797	74%	0.74	S	S	*	*			trans	-164.9	147.4	148.9	-94.9	0	0	0	0	111.1
1585	D	28.1	Very low	30.1	Very low	153 Å²	153	132.1 Å²	132.1	82%	0.818	74%	0.742	S	S	*	*			trans	64.6	153.7	166.6	-71.3	-46.6	0	0	0	122.7
1586	V	29.2	Very low	29.8	Very low	131 Å²	131	130.3 Å²	130.3	79%	0.794	74%	0.735	S	S	*	*			trans	75.6	138.9	172.2	-165.4	0	0	0	0	118
1587	L	27	Very low	29.6	Very low	154 Å²	154	128.4 Å²	128.4	81%	0.806	74%	0.739	S	S	*	*			trans	63.9	88.1	173.7	-112	74.1	0	0	0	118.5	T1589	L1587-T1589 PolarHBondContact O-N 3.31Å; L1587-T1589 VanDerWaalsContact O-N 3.09Å
1588	A	29.4	Very low	29.7	Very low	107 Å²	107	130.4 Å²	130.4	88%	0.884	75%	0.752	S	S	*	*			trans	-76.7	89.1	169.5	0	0	0	0	0	113.4
1589	T	29.6	Very low	29.8	Very low	129 Å²	129	136 Å²	136	79%	0.791	77%	0.773	S	S	*	*			trans	-119.6	75.2	156.8	-58.5	0	0	0	0	111.3	L1587	L1587-T1589 PolarHBondContact O-N 3.31Å; L1587-T1589 VanDerWaalsContact O-N 3.09Å
1590	R	30.1	Very low	29.9	Very low	208 Å²	208	138 Å²	138	79%	0.785	79%	0.79	S	S	*	*			trans	40.7	106.5	140.8	-164.2	173.6	-174.1	169.8	3.9	119.8
1591	M	32.6	Very low	30.4	Very low	140 Å²	140	137.6 Å²	137.6	69%	0.69	79%	0.792	S	S	*	*			trans	83.2	106.2	140.8	-72.1	170.3	155.4	0	0	121.6
1592	T	32.8	Very low	30.7	Very low	126 Å²	126	138.9 Å²	138.9	77%	0.773	80%	0.795	S	S	*	*			trans	68.2	143.2	131.9	61.8	0	0	0	0	119.2
1593	M	31.8	Very low	30.7	Very low	189 Å²	189	137.1 Å²	137.1	93%	0.931	79%	0.791	S	S	*	*			cis	-133.9	180	33.8	-74	-171.2	163.8	0	0	115.2
1594	S	30.5	Very low	30.7	Very low	115 Å²	115	136.2 Å²	136.2	80%	0.804	79%	0.788	S	S	*	*			trans	-138.7	155.5	-169.7	53	0	0	0	0	112.9
1595	Q	30.1	Very low	30.8	Very low	184 Å²	184	137 Å²	137	86%	0.86	79%	0.787	S	S	*	*			trans	-151.8	145.6	161.4	-72	-157.4	41.8	0	0	112.6
1596	S	31.3	Very low	31.1	Very low	103 Å²	103	134.5 Å²	134.5	72%	0.72	78%	0.782	S	S	*	*			trans	40.4	146.2	148.8	54.2	0	0	0	0	122.7
1597	S	29.2	Very low	31.6	Very low	100 Å²	100	130 Å²	130	70%	0.699	76%	0.756	S	S	*	*			cis	-176.9	153.6	-13.1	53.3	0	0	0	0	110.8
1598	T	31.6	Very low	32	Very low	132 Å²	132	130 Å²	130	81%	0.81	75%	0.745	S	S	*	*			trans	-179	157.1	132.5	21.5	0	0	0	0	115.2
1599	K	31.5	Very low	32.1	Very low	188 Å²	188	128.9 Å²	128.9	82%	0.817	72%	0.722	S	S	*	*			trans	-21.9	140.7	169.1	-54.3	160.1	-174.3	175.5	0	116.6
1600	S	29.5	Very low	32.4	Very low	119 Å²	119	132.1 Å²	132.1	83%	0.832	72%	0.72	S	S	*	*			cis	89.8	99	22.2	-49.5	0	0	0	0	117.8
1601	S	34	Very low	32.7	Very low	106 Å²	106	124.3 Å²	124.3	74%	0.741	69%	0.693	S	S	*	*			trans	-170.6	142.3	155	53.9	0	0	0	0	107.3
1602	N	33	Very low	33	Very low	145 Å²	145	120.8 Å²	120.8	78%	0.775	68%	0.677	S	S	*	*			cis	-151.2	135	2.6	-105.2	-7.3	0	0	0	109.4
1603	V	33.1	Very low	33.3	Very low	122 Å²	122	121.4 Å²	121.4	74%	0.739	67%	0.672	S	S	*	*				70.5	123.5	109.7	174.4	0	0	0	0	115
1604	S	30.5	Very low	33.6	Very low	96 Å²	96	117.5 Å²	117.5	67%	0.671	66%	0.663	S	S	*	*			cis	-154.2	157.9	-7	-104.2	0	0	0	0	109.3
1605	V	32.4	Very low	34.1	Very low	129 Å²	129	116.2 Å²	116.2	78%	0.782	66%	0.659	S	S	*	*			cis	83.3	74.1	18.8	-168	0	0	0	0	115.6
1606	S	34.9	Very low	34.6	Very low	102 Å²	102	113 Å²	113	71%	0.713	65%	0.654	S	S	*	*			trans	-174	145.5	150.8	-84.1	0	0	0	0	110.7	N1641	S1606-N1641 CarbonylContact C-O 3.5Å
1607	S	38.7	Very low	35.4	Very low	37 Å²	37	113.1 Å²	113.1	26%	0.259	65%	0.652	S	S	.	*			cis	-173.7	-168.1	-12	66.6	0	0	0	0	106.7	N1641 H1642	S1607-N1641 PolarHBondContact N-O 3.22Å; S1607-N1641 VanDerWaalsContact N-O 3.1Å; S1607-N1641 CarbonylContact O-C 3.59Å; S1607-N1641 VanDerWaalsContact OG-C 3.22Å; S1607-N1641 PolarHBondContact OG-N 3.47Å; S1607-N1641 PolarHBondContact OG-O 3.35Å; S1607-H1642 PolarHBondContact N-O 3.24Å; S1607-H1642 CarbonylContact O-C 3.56Å; S1607-H1642 WeakPolarHBondContact O-CA 3.44Å; S1607-H1642 PolarHBondContact O-N 3.31Å
1608	R	34.6	Very low	35.8	Very low	152 Å²	152	118.2 Å²	118.2	57%	0.574	66%	0.657	S	S	*	*			cis	-155	-171.1	-3.2	-128.6	154.2	176.9	-153.4	-0.6	103.6	P1639	R1608-P1639 WeakPolarHBondContact CD-O 3.24Å; R1608-P1639 PolarHBondContact NH1-O 3.06Å
1609	H	33.2	Very low	36.1	Very low	85 Å²	85	118.4 Å²	118.4	39%	0.394	65%	0.648	S	S	.	*			cis	-147.2	-179	13.7	-128.9	-42.4	0	0	0	111.2	H1637 P1639	H1609-H1637 AromaticContact CD2-CE1 3.39Å; H1609-H1637 PolarHBondContact CD2-CE1 3.06Å; H1609-H1637 AromaticContact CD2-NE2 3.58Å; H1609-H1637 AromaticContact CE1-CD2 3.82Å; H1609-H1637 AromaticContact CE1-CE1 3.63Å; H1609-H1637 AromaticContact CE1-NE2 3.23Å; H1609-H1637 PolarHBondContact CE1-NE2 3.03Å; H1609-H1637 AromaticContact CG-CE1 3.97Å; H1609-H1637 AromaticContact CG-NE2 3.72Å; H1609-H1637 AromaticContact ND1-NE2 3.57Å; H1609-H1637 AromaticContact NE2-CE1 3.15Å; H1609-H1637 PolarHBondContact NE2-CE1 3.49Å; H1609-H1637 AromaticContact NE2-ND1 3.84Å; H1609-H1637 AromaticContact NE2-NE2 3.28Å; H1609-H1637 PolarHBondContact NE2-NE2 2.87Å; H1609-P1639 PolarHBondContact NE2-O 3.2Å
1610	R	34.8	Very low	36.3	Very low	196 Å²	196	116.2 Å²	116.2	74%	0.74	64%	0.64	S	S	*	*			trans	-167	161.4	-167.2	-166.1	-173.3	-162.9	177.9	5.4	109.2	H1635	R1610-H1635 PolarHBondContact O-CE1 3.16Å; R1610-H1635 VanDerWaalsContact O-CE1 3.22Å
1611	D	36.7	Very low	36.6	Very low	44 Å²	44	117.6 Å²	117.6	24%	0.235	63%	0.633	C	S	.	*			trans	151.4	156.7	140.3	-83.5	-28.8	0	0	0	114.8	Q1633 N1634 H1635	D1611-Q1633 VanDerWaalsContact O-CG 3.3Å; D1611-Q1633 WeakPolarHBondContact O-CG 3.34Å; D1611-Q1633 PolarHBondContact O-NE2 3.31Å; D1611-N1634 PolarHBondContact O-OD1 2.89Å; D1611-H1635 HydrophobicContact CB-CB 4.42Å; D1611-H1635 PolarHBondContact O-CD2 3.5Å
1612	N	38.6	Very low	36.7	Very low	66 Å²	66	120.6 Å²	120.6	35%	0.353	64%	0.635	S	S	.	*			cis	-172.4	169.9	-33.3	-142.1	-32.7	0	0	0	110.9	N1634	N1612-N1634 CarbonylContact O-C 3.57Å; N1612-N1634 VanDerWaalsContact O-CA 3.25Å; N1612-N1634 WeakPolarHBondContact O-CA 3.41Å; N1612-N1634 PolarHBondContact O-N 3.38Å; N1612-N1634 VanDerWaalsContact O-O 3.08Å
1613	Q	38.7	Very low	36.7	Very low	140 Å²	140	122.5 Å²	122.5	65%	0.654	64%	0.64	S	S	*	*			trans	65.1	154.2	152.8	-70.6	169.4	67.5	0	0	118.7
1614	S	38.5	Very low	37.2	Very low	106 Å²	106	122.4 Å²	122.4	74%	0.741	64%	0.641	S	S	*	*			cis	-157.5	-170.7	-8.9	-101.1	0	0	0	0	108.1
1615	A	41.6	Very low	37.3	Very low	89 Å²	89	126.5 Å²	126.5	74%	0.736	65%	0.649	S	S	*	*			cis	-155.6	166.6	14.7	0	0	0	0	0	112.4
1616	P	39.9	Very low	37.5	Very low	116 Å²	116	125.8 Å²	125.8	75%	0.753	65%	0.647	S	S	*	*			trans	-97.3	-162.5	169.9	43.7	-37.8	0	0	0	111.2
1617	P	49.3	Very low	38	Very low	105 Å²	105	126.1 Å²	126.1	68%	0.682	65%	0.647	S	S	*	*			cis	-140.9	-170.3	2.6	37.6	-14.4	0	0	0	117.6
1618	R	36	Very low	37.7	Very low	208 Å²	208	132.3 Å²	132.3	79%	0.785	67%	0.672	S	S	*	*			trans	81.9	162.7	167.6	-51	171.7	78.1	165.4	5.8	115.5
1619	H	38.5	Very low	37.7	Very low	135 Å²	135	133.4 Å²	133.4	63%	0.625	68%	0.683	S	S	*	*			cis	-138.9	-133.3	5.2	-150.2	15.3	0	0	0	115.1
1620	H	36.1	Very low	38.2	Very low	142 Å²	142	133.9 Å²	133.9	66%	0.657	69%	0.694	S	S	*	*			trans	-73.4	141.8	-164.4	-87.2	-75.6	0	0	0	119.7
1621	H	36.4	Very low	38.1	Very low	148 Å²	148	131.8 Å²	131.8	69%	0.685	69%	0.692	S	S	*	*			trans	67.1	104.3	151.3	-79.4	-47.3	0	0	0	123.5
1622	H	35.6	Very low	37.9	Very low	169 Å²	169	136 Å²	136	78%	0.782	71%	0.714	S	S	*	*			trans	43.5	94.5	131.4	-61.9	-28.3	0	0	0	121.2
1623	Q	32.4	Very low	37.8	Very low	186 Å²	186	137.7 Å²	137.7	87%	0.869	72%	0.72	S	S	*	*				-160.4	159	108.1	-105.2	-174.2	5	0	0	110.6	H1625	Q1623-H1625 PolarHBondContact O-N 2.99Å
1624	P	43.2	Very low	37.7	Very low	119 Å²	119	136.7 Å²	136.7	77%	0.773	72%	0.718	S	S	*	*			trans	-90	97.1	-164.8	33.8	-34.8	0	0	0	116
1625	H	32.5	Very low	37.6	Very low	182 Å²	182	135.5 Å²	135.5	84%	0.843	70%	0.701	S	S	*	*			trans	65	139.6	142.2	-84.5	-82.8	0	0	0	124.4	Q1623	Q1623-H1625 PolarHBondContact O-N 2.99Å
1626	P	38.1	Very low	37.3	Very low	114 Å²	114	141.7 Å²	141.7	74%	0.74	71%	0.707	S	S	*	*			trans	-120.2	-162.1	179.1	48.9	-36.5	0	0	0	112.8
1627	P	44.8	Very low	36.9	Very low	109 Å²	109	140.8 Å²	140.8	71%	0.708	69%	0.693	S	S	*	*			trans	-111.6	174.1	-168.9	42.2	-35.2	0	0	0	118.4
1628	H	32.8	Very low	36.9	Very low	168 Å²	168	140.7 Å²	140.7	78%	0.778	69%	0.692	S	S	*	*			trans	71.2	107.4	157.7	-69.3	-72.5	0	0	0	124.6
1629	H	33.4	Very low	37.7	Very low	174 Å²	174	133.8 Å²	133.8	81%	0.806	67%	0.674	S	S	*	*			trans	77.4	168.8	131.3	-93.8	-82.1	0	0	0	122.7
1630	P	44.4	Very low	37.5	Very low	96 Å²	96	133.8 Å²	133.8	62%	0.623	67%	0.674	S	S	*	*				-138.6	-171.1	-125.1	46.5	-27.3	0	0	0	120.8
1631	H	33.2	Very low	37.7	Very low	152 Å²	152	130.7 Å²	130.7	70%	0.704	66%	0.663	S	S	*	*			trans	115.9	119.2	146.4	-86.1	-54.1	0	0	0	125.3
1632	L	32.8	Very low	37.8	Very low	132 Å²	132	129.3 Å²	129.3	69%	0.691	66%	0.656	S	S	*	*			trans	65.8	159.7	143.1	-53.9	-176.4	0	0	0	124
1633	Q	35	Very low	37.9	Very low	102 Å²	102	127.3 Å²	127.3	48%	0.477	66%	0.656	S	S	.	*			cis	163.4	138.2	-36.7	177.8	-177	-48.7	0	0	112.4	D1611	D1611-Q1633 VanDerWaalsContact O-CG 3.3Å; D1611-Q1633 WeakPolarHBondContact O-CG 3.34Å; D1611-Q1633 PolarHBondContact O-NE2 3.31Å
1634	N	37.2	Very low	38.1	Very low	118 Å²	118	123.4 Å²	123.4	63%	0.631	65%	0.649	S	S	*	*			trans	159.4	160.6	138.5	-84.8	-21.8	0	0	0	114.7	D1611 N1612	D1611-N1634 PolarHBondContact O-OD1 2.89Å; N1612-N1634 CarbonylContact O-C 3.57Å; N1612-N1634 VanDerWaalsContact O-CA 3.25Å; N1612-N1634 WeakPolarHBondContact O-CA 3.41Å; N1612-N1634 PolarHBondContact O-N 3.38Å; N1612-N1634 VanDerWaalsContact O-O 3.08Å
1635	H	36.3	Very low	37.5	Very low	81 Å²	81	122.1 Å²	122.1	38%	0.375	65%	0.648	S	S	.	*			cis	175	131.5	-30.2	-160.7	-35.7	0	0	0	110.1	R1610 D1611 H1637	R1610-H1635 PolarHBondContact O-CE1 3.16Å; R1610-H1635 VanDerWaalsContact O-CE1 3.22Å; D1611-H1635 HydrophobicContact CB-CB 4.42Å; D1611-H1635 PolarHBondContact O-CD2 3.5Å; H1635-H1637 AromaticContact CE1-CD2 3.72Å; H1635-H1637 AromaticContact CE1-NE2 3.54Å; H1635-H1637 AromaticContact ND1-CD2 3.96Å
1636	Y	34.7	Very low	37.5	Very low	219 Å²	219	120 Å²	120	86%	0.859	65%	0.648	S	S	*	*			trans	-165	172.1	158.9	-107.4	-64.4	0	0	0	115.3
1637	H	31.4	Very low	37.2	Very low	98 Å²	98	119 Å²	119	45%	0.454	65%	0.651	S	S	.	*			trans	-142.8	-174.1	-143.4	-110.2	-137.5	0	0	0	114.7	H1609 H1635	H1609-H1637 AromaticContact CD2-CE1 3.39Å; H1609-H1637 PolarHBondContact CD2-CE1 3.06Å; H1609-H1637 AromaticContact CD2-NE2 3.58Å; H1609-H1637 AromaticContact CE1-CD2 3.82Å; H1609-H1637 AromaticContact CE1-CE1 3.63Å; H1609-H1637 AromaticContact CE1-NE2 3.23Å; H1609-H1637 PolarHBondContact CE1-NE2 3.03Å; H1609-H1637 AromaticContact CG-CE1 3.97Å; H1609-H1637 AromaticContact CG-NE2 3.72Å; H1609-H1637 AromaticContact ND1-NE2 3.57Å; H1609-H1637 AromaticContact NE2-CE1 3.15Å; H1609-H1637 PolarHBondContact NE2-CE1 3.49Å; H1609-H1637 AromaticContact NE2-ND1 3.84Å; H1609-H1637 AromaticContact NE2-NE2 3.28Å; H1609-H1637 PolarHBondContact NE2-NE2 2.87Å; H1635-H1637 AromaticContact CE1-CD2 3.72Å; H1635-H1637 AromaticContact CE1-NE2 3.54Å; H1635-H1637 AromaticContact ND1-CD2 3.96Å
1638	P	50.5	Low	37.3	Very low	102 Å²	102	119.8 Å²	119.8	66%	0.662	66%	0.655	S	S	*	*			cis	-123.9	-172.8	4.6	42.8	-26.8	0	0	0	114.2
1639	P	51.5	Low	37.1	Very low	63 Å²	63	118 Å²	118	41%	0.409	66%	0.661	S	S	.	*			cis	-133.3	-155.1	8.2	42.4	-22.5	0	0	0	115.6	R1608 H1609	R1608-P1639 WeakPolarHBondContact CD-O 3.24Å; R1608-P1639 PolarHBondContact NH1-O 3.06Å; H1609-P1639 PolarHBondContact NE2-O 3.2Å
1640	Q	36.2	Very low	37.5	Very low	135 Å²	135	114.9 Å²	114.9	63%	0.631	66%	0.656	S	S	*	*			trans	-32.5	172.2	161.5	-76.3	94.8	-59.4	0	0	117.4
1641	N	39.9	Very low	36.7	Very low	78 Å²	78	116 Å²	116	42%	0.417	67%	0.665	S	S	.	*			cis	-170.3	174	-11.7	-99.5	2.7	0	0	0	108	S1606 S1607	S1606-N1641 CarbonylContact C-O 3.5Å; S1607-N1641 PolarHBondContact N-O 3.22Å; S1607-N1641 VanDerWaalsContact N-O 3.1Å; S1607-N1641 CarbonylContact O-C 3.59Å; S1607-N1641 VanDerWaalsContact OG-C 3.22Å; S1607-N1641 PolarHBondContact OG-N 3.47Å; S1607-N1641 PolarHBondContact OG-O 3.35Å
1642	H	39	Very low	36.5	Very low	118 Å²	118	113.4 Å²	113.4	55%	0.546	67%	0.67	S	S	.	*			cis	-157.9	175	-14	-107.5	-9.2	0	0	0	106.4	S1607	S1607-H1642 PolarHBondContact N-O 3.24Å; S1607-H1642 CarbonylContact O-C 3.56Å; S1607-H1642 WeakPolarHBondContact O-CA 3.44Å; S1607-H1642 PolarHBondContact O-N 3.31Å
1643	T	37.4	Very low	36.4	Very low	127 Å²	127	115.6 Å²	115.6	78%	0.779	68%	0.679	S	S	*	*			cis	-160.1	179.6	8.3	-2.3	0	0	0	0	109.9
1644	S	35	Very low	36.4	Very low	105 Å²	105	117 Å²	117	73%	0.734	70%	0.695	S	S	*	*			trans	-138.4	151.6	168.8	56.3	0	0	0	0	111.8
1645	A	32.4	Very low	36	Very low	91 Å²	91	119.3 Å²	119.3	75%	0.752	70%	0.701	S	S	*	*			cis	101	161.4	12.7	0	0	0	0	0	117.1
1646	T	32.4	Very low	35.8	Very low	137 Å²	137	123.7 Å²	123.7	84%	0.84	73%	0.727	S	S	*	*			trans	80.8	137.4	166.8	16.4	0	0	0	0	123.2
1647	A	30.6	Very low	35.6	Very low	95 Å²	95	121.1 Å²	121.1	79%	0.785	72%	0.723	S	S	*	*			trans	83.8	154	133.8	0	0	0	0	0	123.7
1648	P	47.4	Very low	35.6	Very low	124 Å²	124	121 Å²	121	81%	0.805	74%	0.738	S	S	*	*			trans	-118	175.4	-176.3	44	-33.3	0	0	0	115.8
1649	C	27.9	Very low	34.8	Very low	132 Å²	132	122.5 Å²	122.5	89%	0.892	75%	0.745	S	S	*	*			trans	-158.4	169.9	165.4	-116.8	0	0	0	0	113.1
1650	P	42	Very low	33.8	Very low	108 Å²	108	124 Å²	124	70%	0.701	76%	0.758	S	S	*	*			trans	-118.3	166.6	-160.9	42.6	-34.9	0	0	0	118.7
1651	S	28.1	Very low	33.7	Very low	118 Å²	118	124.1 Å²	124.1	83%	0.825	76%	0.763	S	S	*	*			trans	77.9	130.2	149.1	-68.6	0	0	0	0	123.4
1652	A	29.1	Very low	33.4	Very low	98 Å²	98	127.4 Å²	127.4	81%	0.81	78%	0.78	S	S	*	*			trans	66.4	117.2	149.5	0	0	0	0	0	121.2
1653	M	30.9	Very low	33.2	Very low	178 Å²	178	128.6 Å²	128.6	88%	0.877	79%	0.79	S	S	*	*				-172	155.3	107.5	-119.1	-166.6	164.1	0	0	115.9
1654	V	34.2	Very low	33.3	Very low	132 Å²	132	128.3 Å²	128.3	80%	0.8	79%	0.788	S	S	*	*			trans	69.7	144.2	152.3	173.9	0	0	0	0	119.7
1655	Q	28.9	Very low	33.2	Very low	166 Å²	166	130.6 Å²	130.6	78%	0.776	79%	0.792	S	S	*	*			trans	-145.2	134.9	-174.8	174.5	-177.4	4.8	0	0	108
1656	L	31.5	Very low	33.5	Very low	173 Å²	173	131.3 Å²	131.3	91%	0.906	79%	0.789	S	S	*	*			trans	-168	159.1	160.2	-110.1	167.7	0	0	0	111.2
1657	Q	30.3	Very low	33.6	Very low	166 Å²	166	132.4 Å²	132.4	78%	0.776	79%	0.789	S	S	*	*			trans	-131.2	149.3	-170.4	-66	164	-106.5	0	0	112.3
1658	A	33.2	Very low	33.7	Very low	94 Å²	94	135 Å²	135	78%	0.777	79%	0.785	S	S	*	*			trans	165	107.8	141	0	0	0	0	0	108.9
1659	V	32.9	Very low	32.8	Very low	134 Å²	134	137.2 Å²	137.2	81%	0.812	78%	0.784	S	S	*	*				75.4	108.9	73.4	173.7	0	0	0	0	113.9
1660	S	31.6	Very low	33.2	Very low	96 Å²	96	135.8 Å²	135.8	67%	0.671	77%	0.774	S	S	*	*				-178.4	134.5	111.7	-161.7	0	0	0	0	113.6
1661	N	32.9	Very low	33.3	Very low	137 Å²	137	136.8 Å²	136.8	73%	0.733	78%	0.78	S	S	*	*			trans	22.7	139.6	148.8	-55.2	-3.9	0	0	0	120.3
1662	N	34.6	Very low	33.4	Very low	147 Å²	147	139.2 Å²	139.2	79%	0.786	78%	0.778	S	S	*	*				-173.4	151.3	64.7	-129	-12.8	0	0	0	116.5
1663	N	34.9	Very low	34.1	Very low	142 Å²	142	139.4 Å²	139.4	76%	0.759	77%	0.771	S	S	*	*			trans	83.3	141.4	140.4	-131.1	6.8	0	0	0	125
1664	V	38.4	Very low	34.1	Very low	122 Å²	122	136.8 Å²	136.8	74%	0.739	77%	0.765	S	S	*	*			trans	65.1	121	159.1	-161.6	0	0	0	0	122.4
1665	N	32.1	Very low	34	Very low	153 Å²	153	135.6 Å²	135.6	82%	0.818	76%	0.762	S	S	*	*			trans	-110	167	154.3	-120.5	-15.9	0	0	0	107.6
1666	P	40.3	Very low	34.2	Very low	106 Å²	106	132.1 Å²	132.1	69%	0.688	76%	0.756	S	S	*	*			cis	-139.5	-175	13.8	42.4	-23.7	0	0	0	115.3
1667	L	33.5	Very low	34.4	Very low	159 Å²	159	132.6 Å²	132.6	83%	0.832	75%	0.754	S	S	*	*				179.1	-174.8	113.5	-142.7	68.1	0	0	0	113
1668	H	32.7	Very low	34.9	Very low	151 Å²	151	132.4 Å²	132.4	70%	0.699	76%	0.756	S	S	*	*			trans	-66.5	146.4	-163.1	-83.8	-22.3	0	0	0	119.9
1669	Q	29.3	Very low	35.7	Very low	169 Å²	169	133.2 Å²	133.2	79%	0.79	75%	0.754	S	S	*	*			trans	58.6	148.5	130.8	-64.1	-176.9	-17.6	0	0	122.3
1670	P	34.8	Very low	36.6	Very low	103 Å²	103	132.1 Å²	132.1	67%	0.669	75%	0.749	S	S	*	*			trans	-94.7	154.7	-177.9	38	-35.6	0	0	0	114.2
1671	P	46	Very low	37	Very low	129 Å²	129	136.9 Å²	136.9	84%	0.838	76%	0.761	S	S	*	*			trans	-83.9	133.8	168.5	32.8	-32.4	0	0	0	113
1672	H	29.8	Very low	37.2	Very low	168 Å²	168	138.9 Å²	138.9	78%	0.778	80%	0.797	S	S	*	*			trans	-89.5	-173.5	165.1	-93.7	-88.9	0	0	0	109.2
1673	P	42.5	Very low	37.4	Very low	103 Å²	103	138.5 Å²	138.5	67%	0.669	80%	0.797	S	S	*	*				-139.8	-151.4	-80.2	38.5	-15.9	0	0	0	114
1674	V	31	Very low	37.5	Very low	123 Å²	123	138.3 Å²	138.3	75%	0.745	80%	0.799	S	S	*	*			trans	85.1	141.9	159.4	-140.2	0	0	0	0	120.4
1675	S	33.2	Very low	37.5	Very low	106 Å²	106	139.2 Å²	139.2	74%	0.741	80%	0.803	S	S	*	*			trans	80	140.7	156.1	-65.5	0	0	0	0	119.8
1676	S	32.1	Very low	37.8	Very low	93 Å²	93	138.4 Å²	138.4	65%	0.65	80%	0.802	S	S	*	*			cis	-174.4	165.3	-22.5	50.9	0	0	0	0	110.4
1677	Q	35.6	Very low	37.6	Very low	184 Å²	184	140.4 Å²	140.4	86%	0.86	81%	0.809	S	S	*	*			trans	83.9	136.3	164.6	-54.9	-174.6	7	0	0	118.9
1678	I	42.3	Very low	37.9	Very low	161 Å²	161	139.2 Å²	139.2	83%	0.826	81%	0.807	S	S	*	*			trans	-118.3	131.5	172.9	-72.7	162.4	0	0	0	105.4
1679	P	48.5	Very low	38.3	Very low	112 Å²	112	138.4 Å²	138.4	73%	0.727	82%	0.815	S	S	*	*				-153.9	172.2	112.8	37.5	-19.9	0	0	0	115.3
1680	P	53.1	Low	38.9	Very low	110 Å²	110	136 Å²	136	71%	0.714	82%	0.817	S	S	*	*			cis	-131.4	160.8	-31.2	35.3	-19.2	0	0	0	114.4
1681	Q	38.4	Very low	39.3	Very low	196 Å²	196	138.8 Å²	138.8	92%	0.916	83%	0.829	S	S	*	*			trans	27.8	113.5	151.6	-66.3	-178.1	-19.2	0	0	121.1
1682	A	38.9	Very low	38.7	Very low	180 Å²	180	139.6 Å²	139.6	100%	1.488	83%	0.829	S	S	*	*			trans	-144.1	0	132	0	0	0	0	0	108.7

Retrieved 1,682 of 1,682 residues in 1545.3 ms (Link to these results)

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