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Isoform h 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 X5M5N0-9 (canonical: X5M5N0), Species CAEEL (Caenorhabditis elegans), Gene wnk-1, Length 1,680 aa.

						>WNK_CAEEL|X5M5N0-9|wnk-1
MPDSITNGGRPPAPPSSVSSTTASTTGNFGTRRRLVNRIKKVDELHPAQENPTMGSHWLSEQERSRLEAVQQDWRRTRPMKWTSKKRPDDPTTSSPSTVSISNALENSTPSLNNVSSITNSSSPFSLSSAATSTASAIIPFTSNVATNHPHLNHHVSRIPQAIVTGGTNGSLPPLLISPTSAAAATPLISGKAGPMSPSTGSPINVAATVLQNAVSSPQHSIFDRSRLNKIPPNTSLASSSSPSDAANNDKPIQQRHSILSNVRTLTQAMVNDGPRTLTGDDMDKMVSEEERARKEQEKREEEEKAARRIDVEDDFDAQEKPIDKSKNGRFLKFDEELGRGSFKTVFRGLDTETGVAVAWCELQESKLNKTERQRFREEAEMLKDLQHPNIVRFYDYWESADLCGKRKYIVLVTELMTSGTLKMYLKRFKRINIKVLKSWCRQILKGLSFLHTRNPPVIHRDLKCDNIFITGTTGSVKIGDLGLATLKNKSFAKSVIGTPEFMAPEMYEEMYDESVDVYAFGMCLLEMVTGEYPYSECMNPATIYRKVISGVKPECFSRIPAQYPEIREIIDRCIRVRREERSTVKQLLVDDFFTPEDLIGIRVEIKNRDADLNDLNVEIQMQLRVYDEKKRKQYRFKENEGLQFAFDIENDSPDEVVQQMIEQQHIPDEDTRMITKLIKDKVDAFRRDRDHRLLEIKRAKEEEERIREEAEIKEELRLRAEAKEKEKERLEKERLEKKAAAAAAANPNPTPIPPTPATPHSSAQQQPIPPPLSTQTSAEIQQSAQQPSVPVTMIANIPAMSPTSAQPQPVLSPTSAAVPVPTTMIHVPKPSEIPVQNVATTAAPVAANNVPPSPAPFKTEDIQTPTLAQNTVPRTISTDASGLVINTPASIASPSPAPSATDVASTTAPVTPAPTPTTTTDGGAAAASTTTENKEEKRKSNKRKVVMEILGCDESRNFALVSCRLDTSHKSVTFQFAPGTDKPCTIATKLLAEDCLLKVHVHIVEAQLGEVIQLINSDGKKGVGTKLATVLDPNSTEPPTITAVMPKDSSAATASNTKPKIEIEKTPPTRDASQEPNNVQVTNVRKVSQESNAESVQSIPRPGGIIVMSPTNQTDSAPPPTGAAAKPSRFQVTKSADPIATPISSSISTATVIPIVAATPTNITSEPVIVQPITAQVITHLATPSPVSHSLSSNSSPSATTHSNMSSIQSTTSVPGRRFTVQPVSQAESGISSSISTPHPEPTPAITSCPPPVPSVPPVVSNGTLNLEVAPKQTPSATNQNVDTQHSSSTASTATLVSETPATVHVTPISVPAPVQEPLVIDHHSDVLTQLDSELRKCFQVSGVSHSASPSTVVESLTSMTPQTIPLACQTVPASIGQAPAVIAAAHAASLIPNASVPQSPSRLDAETGLAGLHEKLEALKMEQDRREDMGDDAIGTTTTDGKDEIPIDTLKGLAEALGKVIHADGRETTPMPPDHPDLTDASTGQMDLESEDPEVIQMIVRHRMEQHKLLEKQRVEIERLRSKIRVPRATSVNPEMIGDDEADTTLTALQSALGNASLSLPASPPPNTETTKVNTTVIPSDVLATRMTMSQSSTKSSNVSVSSRHRDNQSAPPRHHHHQPHPPHHPHLQNHYHPPQNHTSATAPCPSAMVQLQAVSNNNVNPLHQPPHPVSSQIPPQA
					

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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	30	Very low	36.8	Very low	226 Å²	226	133.6 Å²	133.6	100%	1.113	80%	0.796	S	S	*	*				0	133.2	0	-75.4	-57.2	-176.8	0	0	106.6
2	P	46.7	Very low	37.6	Very low	106 Å²	106	131.8 Å²	131.8	69%	0.688	79%	0.791	S	S	*	*				-108.1	169.4	-118.1	-0.7	23.5	0	0	0	114.4
3	D	38	Very low	37.5	Very low	147 Å²	147	127.5 Å²	127.5	79%	0.786	78%	0.777	S	S	*	*			cis	78.2	134.4	29.2	-50.6	-56.9	0	0	0	114.3
4	S	36.7	Very low	37.7	Very low	103 Å²	103	127.1 Å²	127.1	72%	0.72	78%	0.779	S	S	*	*			cis	-146.1	166.1	-0.5	-63	0	0	0	0	108.1
5	I	37.2	Very low	38.3	Very low	142 Å²	142	127.7 Å²	127.7	73%	0.728	79%	0.785	S	S	*	*			cis	74.6	88.5	35.8	-54.6	179.9	0	0	0	112.5
6	T	37.9	Very low	37.9	Very low	111 Å²	111	127 Å²	127	68%	0.681	79%	0.788	S	S	*	*				76	139.9	75.3	74.7	0	0	0	0	116.9
7	N	36.6	Very low	38.3	Very low	162 Å²	162	125.9 Å²	125.9	87%	0.866	79%	0.786	S	S	*	*				172.9	157.4	121.2	-88.2	-17.9	0	0	0	117.4
8	G	33.4	Very low	38.2	Very low	83 Å²	83	126.4 Å²	126.4	86%	0.856	79%	0.787	S	S	*	*			trans	120.8	127.9	167.1	0	0	0	0	0	113.7
9	G	33.8	Very low	38.1	Very low	82 Å²	82	125.3 Å²	125.3	85%	0.845	79%	0.785	S	S	*	*			cis	-175.2	139.5	-9	0	0	0	0	0	109.3
10	R	34	Very low	37.8	Very low	193 Å²	193	124.4 Å²	124.4	73%	0.728	78%	0.783	S	S	*	*			trans	-119.7	158.1	-163.2	-151.8	-141.8	172.1	174	1.8	113.2
11	P	40.7	Very low	37.6	Very low	115 Å²	115	124.7 Å²	124.7	75%	0.747	78%	0.784	S	S	*	*				-140.5	-166.4	119.2	46.7	-33.6	0	0	0	112.3
12	P	45.6	Very low	37.9	Very low	112 Å²	112	119.7 Å²	119.7	73%	0.727	77%	0.766	S	S	*	*				-113	-173.8	-126.6	14.9	12.9	0	0	0	115.6
13	A	36.9	Very low	37.4	Very low	75 Å²	75	119.2 Å²	119.2	62%	0.62	77%	0.772	S	S	*	*			trans	-133.6	163.3	-171.2	0	0	0	0	0	113.6
14	P	39.7	Very low	37.4	Very low	123 Å²	123	117.4 Å²	117.4	80%	0.799	77%	0.77	S	S	*	*			trans	-101.2	166.8	159.2	36.5	-29	0	0	0	113.1
15	P	47	Very low	37.3	Very low	135 Å²	135	118.3 Å²	118.3	88%	0.877	77%	0.772	S	S	*	*			trans	-108	-178.5	-158	41.4	-37	0	0	0	116.8
16	S	32.9	Very low	37.2	Very low	117 Å²	117	118 Å²	118	82%	0.818	78%	0.777	S	S	*	*			trans	-143.5	148.1	-177.9	60.2	0	0	0	0	114.6
17	S	43.5	Very low	37	Very low	109 Å²	109	115.9 Å²	115.9	76%	0.762	78%	0.777	S	S	*	*			trans	-157.5	130	167.6	52.9	0	0	0	0	108.2
18	V	37.8	Very low	36.8	Very low	134 Å²	134	114.5 Å²	114.5	81%	0.812	77%	0.769	S	S	*	*			cis	58.4	131.8	38.3	-58.5	0	0	0	0	115.5
19	S	34.7	Very low	36.7	Very low	106 Å²	106	119.7 Å²	119.7	74%	0.741	77%	0.769	S	S	*	*			cis	-166.9	151.8	-8.7	44.9	0	0	0	0	114.2
20	S	32.6	Very low	36.5	Very low	107 Å²	107	118.7 Å²	118.7	75%	0.748	76%	0.758	S	S	*	*			trans	-6.6	154.1	159.4	57.9	0	0	0	0	124
21	T	34.3	Very low	36.5	Very low	130 Å²	130	115.8 Å²	115.8	80%	0.798	76%	0.762	S	S	*	*			trans	-170.1	147.7	131.5	-80.6	0	0	0	0	114
22	T	35.9	Very low	36.1	Very low	121 Å²	121	119.9 Å²	119.9	74%	0.742	76%	0.762	S	S	*	*			trans	-8.2	133	177.4	55.9	0	0	0	0	121.1
23	A	37.1	Very low	35.4	Very low	97 Å²	97	122.7 Å²	122.7	80%	0.802	76%	0.759	S	S	*	*			cis	74.6	150.9	43.6	0	0	0	0	0	113.8
24	S	36.6	Very low	35	Very low	109 Å²	109	128.8 Å²	128.8	76%	0.762	77%	0.766	S	S	*	*			cis	-106.3	-129.7	18	53.9	0	0	0	0	116.1
25	T	34.3	Very low	34.5	Very low	121 Å²	121	129.9 Å²	129.9	74%	0.742	76%	0.764	S	S	*	*			cis	-148.2	-159.5	22.9	-54.4	0	0	0	0	111.7
26	T	36.8	Very low	33.6	Very low	136 Å²	136	128.7 Å²	128.7	83%	0.834	75%	0.754	S	S	*	*			trans	-73.3	144.7	-165.6	50.4	0	0	0	0	116.9
27	G	32	Very low	33.3	Very low	66 Å²	66	130 Å²	130	68%	0.68	75%	0.752	S	S	*	*			cis	162.1	160.1	-8	0	0	0	0	0	114.6
28	N	33.2	Very low	32.6	Very low	134 Å²	134	136.5 Å²	136.5	72%	0.717	76%	0.76	S	S	*	*			trans	61	146.5	167.6	-60.3	-4.2	0	0	0	117.9
29	F	31.6	Very low	32.4	Very low	192 Å²	192	137.8 Å²	137.8	84%	0.842	76%	0.76	S	S	*	*			cis	-162.5	170.2	-14.3	-88.6	-34.6	0	0	0	107.3
30	G	30.5	Very low	32.3	Very low	60 Å²	60	142.9 Å²	142.9	62%	0.619	77%	0.769	S	S	*	*			cis	173.6	123.2	-6.6	0	0	0	0	0	114.2
31	T	33.7	Very low	32.2	Very low	132 Å²	132	144.8 Å²	144.8	81%	0.81	76%	0.764	S	S	*	*			trans	55.9	103.4	154.4	32.7	0	0	0	0	124.4
32	R	31.3	Very low	32	Very low	201 Å²	201	144.7 Å²	144.7	76%	0.758	76%	0.763	S	S	*	*				70.6	123.2	115	-77.6	-173.9	174.5	-178.7	0.4	124.4
33	R	30.3	Very low	31.8	Very low	171 Å²	171	143.7 Å²	143.7	65%	0.645	75%	0.753	S	S	*	*				92.6	124.3	123.4	-82.1	-177.9	173.1	-179.3	-2.5	122.3
34	R	30.1	Very low	31.5	Very low	204 Å²	204	145.2 Å²	145.2	77%	0.77	74%	0.743	S	S	*	*			trans	72.8	148.1	138.5	-72.5	-178.9	176.4	-179.6	-4.6	117.8
35	L	28.1	Very low	31.2	Very low	146 Å²	146	142.6 Å²	142.6	76%	0.764	72%	0.721	S	S	*	*			cis	-169.9	146	-13.1	175.6	63.6	0	0	0	110.6
36	V	28.9	Very low	31.1	Very low	110 Å²	110	143.7 Å²	143.7	67%	0.667	72%	0.717	S	S	*	*			trans	77.5	120.7	157.1	151.7	0	0	0	0	122.5
37	N	26.2	Very low	31.6	Very low	144 Å²	144	140.7 Å²	140.7	77%	0.77	70%	0.7	S	S	*	*			trans	49.4	117.8	143.1	-54.2	0.1	0	0	0	124.9
38	R	28.9	Very low	31.7	Very low	246 Å²	246	141.9 Å²	141.9	93%	0.928	70%	0.703	S	S	*	*				-176.7	122.4	118.4	-115.8	-177.9	173.4	174.1	-2.4	113.2
39	I	32.8	Very low	31.6	Very low	160 Å²	160	142.1 Å²	142.1	82%	0.821	70%	0.7	S	S	*	*			trans	-148.2	137.4	155.7	-62.3	-171.4	0	0	0	110.3
40	K	33.2	Very low	31.7	Very low	214 Å²	214	142.2 Å²	142.2	93%	0.93	70%	0.703	S	S	*	*			trans	-140	132.7	161.8	-76	-175.1	177.8	-178.5	0	107.3
41	K	31	Very low	31.8	Very low	146 Å²	146	146.3 Å²	146.3	64%	0.635	71%	0.71	S	S	*	*			cis	-114.1	-98.5	-21.7	-174.4	-171	170.9	-164.6	0	110.7	D43	K41-D43 WeakPolarHBondContact CD-OD2 3.45Å; K41-D43 VanDerWaalsContact CE-OD1 3.22Å; K41-D43 WeakPolarHBondContact CE-OD1 3.3Å; K41-D43 VanDerWaalsContact CE-OD2 3.27Å; K41-D43 WeakPolarHBondContact CE-OD2 3.32Å; K41-D43 IonicContact NZ-OD1 3.64Å; K41-D43 PolarHBondContact NZ-OD1 3.14Å; K41-D43 IonicContact NZ-OD2 3.32Å; K41-D43 PolarHBondContact NZ-OD2 3.12Å
42	V	30.5	Very low	32.1	Very low	128 Å²	128	145.3 Å²	145.3	78%	0.776	71%	0.706	S	S	*	*			cis	-142	165.1	-2	-175.2	0	0	0	0	108.4
43	D	31.1	Very low	32.4	Very low	100 Å²	100	142.7 Å²	142.7	54%	0.535	71%	0.713	S	S	.	*			trans	-86.3	169.1	-174.3	-53.4	-80.3	0	0	0	113.8	K41	K41-D43 WeakPolarHBondContact CD-OD2 3.45Å; K41-D43 VanDerWaalsContact CE-OD1 3.22Å; K41-D43 WeakPolarHBondContact CE-OD1 3.3Å; K41-D43 VanDerWaalsContact CE-OD2 3.27Å; K41-D43 WeakPolarHBondContact CE-OD2 3.32Å; K41-D43 IonicContact NZ-OD1 3.64Å; K41-D43 PolarHBondContact NZ-OD1 3.14Å; K41-D43 IonicContact NZ-OD2 3.32Å; K41-D43 PolarHBondContact NZ-OD2 3.12Å
44	E	31.3	Very low	32.5	Very low	130 Å²	130	143.5 Å²	143.5	61%	0.607	73%	0.726	S	S	*	*			cis	-163.3	162.5	10.7	-145.1	-177.5	165.8	0	0	115.4	T209	E44-T209 WeakPolarHBondContact O-CA 3.37Å
45	L	29.8	Very low	32.4	Very low	54 Å²	54	137.4 Å²	137.4	28%	0.283	73%	0.727	S	S	.	*			trans	71.1	156.8	157.4	-59.9	179.4	0	0	0	120.4	A208 T209 V210 L211	L45-A208 CarbonylContact O-C 3.2Å; L45-T209 CarbonylContact O-C 3.22Å; L45-T209 WeakPolarHBondContact O-CA 3.3Å; L45-T209 PolarHBondContact O-N 3.32Å; L45-V210 HydrophobicContact CD1-CG2 4.3Å; L45-V210 PolarHBondContact O-N 2.9Å; L45-L211 HydrophobicContact CD1-CG 4.42Å
46	H	32.7	Very low	32.7	Very low	144 Å²	144	135.9 Å²	135.9	67%	0.667	73%	0.729	S	S	*	*			cis	165.8	177.2	-36.2	-110.4	-134.5	0	0	0	108.9
47	P	46.7	Very low	33	Very low	73 Å²	73	135.6 Å²	135.6	47%	0.474	72%	0.72	S	S	.	*			cis	-136.3	-169.9	-22.9	41	-23.3	0	0	0	114.7	Q212	P47-Q212 WeakPolarHBondContact CG-O 3.45Å
48	A	34.5	Very low	33.8	Very low	90 Å²	90	139 Å²	139	74%	0.744	72%	0.722	S	S	*	*			trans	129.4	150	143	0	0	0	0	0	115.7
49	Q	30.5	Very low	34.6	Very low	139 Å²	139	130.3 Å²	130.3	65%	0.65	69%	0.694	S	S	*	*			cis	-169.8	129.1	-30.1	173.2	-180	-10.5	0	0	109.6
50	E	34	Very low	36.2	Very low	195 Å²	195	125.3 Å²	125.3	91%	0.911	67%	0.673	S	S	*	*			trans	-147.1	168.1	157.1	-80.3	-153.2	143	0	0	110.8
51	N	32.7	Very low	37.1	Very low	145 Å²	145	123 Å²	123	78%	0.775	67%	0.665	S	S	*	*			trans	-122.6	168.1	-154.5	-108.9	-5.9	0	0	0	116
52	P	40.7	Very low	38.3	Very low	111 Å²	111	122.9 Å²	122.9	72%	0.721	67%	0.667	S	S	*	*			trans	-103.9	-175.8	-161.6	41.3	-38.9	0	0	0	116.1
53	T	36.5	Very low	39.7	Very low	146 Å²	146	121.2 Å²	121.2	90%	0.896	65%	0.651	S	S	*	*			trans	-142.2	153.5	167.8	-56.3	0	0	0	0	111.3
54	M	33.4	Very low	41.2	Very low	188 Å²	188	123.1 Å²	123.1	93%	0.926	65%	0.651	S	S	*	*			trans	-74.5	161.5	-174.6	-57.3	-178.4	-168.6	0	0	113.4
55	G	27.9	Very low	42.8	Very low	77 Å²	77	120.5 Å²	120.5	79%	0.794	65%	0.646	S	S	*	*			cis	160.2	153.9	-8.2	0	0	0	0	0	113.2
56	S	33.2	Very low	44.6	Very low	114 Å²	114	126.6 Å²	126.6	80%	0.797	67%	0.666	S	S	*	*			trans	-160	111.2	174.3	60.9	0	0	0	0	111.5
57	H	35.4	Very low	46	Very low	103 Å²	103	121.9 Å²	121.9	48%	0.477	65%	0.645	S	S	.	*			trans	-145.2	96.2	177.1	-158.2	-64.1	0	0	0	111.4	L59 R64	H57-L59 PolarHBondContact CE1-O 3.34Å; H57-L59 PolarHBondContact ND1-O 3.16Å; H57-R64 WeakPolarHBondContact NE2-CD 3.32Å; H57-R64 PolarHBondContact NE2-NE 3.06Å; H57-R64 VanDerWaalsContact NE2-NE 3.14Å; H57-R64 PolarHBondContact NE2-NH1 3.32Å
58	W	42.2	Very low	47.1	Very low	216 Å²	216	124 Å²	124	82%	0.818	65%	0.649	S	S	*	*			trans	-103.6	27.9	-172.7	-87.2	102	0	0	0	114.1
59	L	45.6	Very low	48.8	Very low	63 Å²	63	122.4 Å²	122.4	33%	0.33	64%	0.636	S	S	.	*	S	Bend	trans	-136	140.1	177.6	-75.3	158.5	0	0	0	108.6	H57 E63 L67	H57-L59 PolarHBondContact CE1-O 3.34Å; H57-L59 PolarHBondContact ND1-O 3.16Å; L59-E63 HydrophobicContact CB-CB 4.4Å; L59-E63 HydrophobicContact CD2-CB 3.78Å; L59-L67 HydrophobicContact CD1-CD1 3.66Å; L59-L67 HydrophobicContact CD2-CD1 4.02Å
60	S	67.3	Low	50.2	Low	55 Å²	55	118 Å²	118	39%	0.385	62%	0.618	S	S	.	*			trans	-65.6	158.1	167.1	62.2	0	0	0	0	110.9	Q62 E63 R64	S60-Q62 PolarHBondContact O-N 3.27Å; S60-E63 WeakPolarHBondContact CB-OE2 3.43Å; S60-E63 PolarHBondContact N-OE2 2.86Å; S60-E63 PolarHBondContact O-N 3.5Å; S60-E63 VanDerWaalsContact O-N 3.11Å; S60-E63 VanDerWaalsContact OG-CG 3.25Å; S60-E63 WeakPolarHBondContact OG-CG 3.46Å; S60-E63 PolarHBondContact OG-N 2.87Å; S60-E63 VanDerWaalsContact OG-N 3.17Å; S60-E63 PolarHBondContact OG-OE2 3.33Å; S60-R64 PolarHBondContact O-N 3.34Å
61	E	52.8	Low	51.4	Low	166 Å²	166	112.5 Å²	112.5	78%	0.776	59%	0.592	S	S	*	*	H	α-helix	trans	-58.1	-34.4	173.1	-67.1	-166.9	125.5	0	0	111.8	E63 R64 S65	E61-E63 PolarHBondContact O-N 3.34Å; E61-R64 PolarHBondContact O-N 2.98Å; E61-S65 WeakPolarHBondContact O-CB 3.35Å; E61-S65 PolarHBondContact O-N 3.03Å
62	Q	55.9	Low	52.6	Low	144 Å²	144	109.8 Å²	109.8	67%	0.673	58%	0.575	S	S	*	*	H	α-helix	trans	-62.4	-41.2	175.7	-157.8	72.9	0	0	0	112.1	S60 R66	S60-Q62 PolarHBondContact O-N 3.27Å; Q62-R66 WeakPolarHBondContact O-CB 3.31Å; Q62-R66 WeakPolarHBondContact O-CG 2.91Å; Q62-R66 PolarHBondContact O-N 3.17Å
63	E	59.2	Low	53.8	Low	92 Å²	92	107.7 Å²	107.7	43%	0.43	56%	0.558	S	S	.	*	H	α-helix	trans	-75.4	-36.1	175.4	-69.2	163.6	115.4	0	0	112.3	L59 S60 E61 R66 L67	L59-E63 HydrophobicContact CB-CB 4.4Å; L59-E63 HydrophobicContact CD2-CB 3.78Å; S60-E63 WeakPolarHBondContact CB-OE2 3.43Å; S60-E63 PolarHBondContact N-OE2 2.86Å; S60-E63 PolarHBondContact O-N 3.5Å; S60-E63 VanDerWaalsContact O-N 3.11Å; S60-E63 VanDerWaalsContact OG-CG 3.25Å; S60-E63 WeakPolarHBondContact OG-CG 3.46Å; S60-E63 PolarHBondContact OG-N 2.87Å; S60-E63 VanDerWaalsContact OG-N 3.17Å; S60-E63 PolarHBondContact OG-OE2 3.33Å; E61-E63 PolarHBondContact O-N 3.34Å; E63-R66 PolarHBondContact O-N 2.96Å; E63-L67 WeakPolarHBondContact O-CB 3.44Å; E63-L67 PolarHBondContact O-N 3.48Å
64	R	63.2	Low	54.2	Low	141 Å²	141	105.6 Å²	105.6	53%	0.532	53%	0.534	S	S	.	.	H	α-helix	trans	-65.5	-44.4	176.2	-146.1	-169.7	-156.5	-172.1	8.5	110.9	H57 S60 E61 L67 E68	H57-R64 WeakPolarHBondContact NE2-CD 3.32Å; H57-R64 PolarHBondContact NE2-NE 3.06Å; H57-R64 VanDerWaalsContact NE2-NE 3.14Å; H57-R64 PolarHBondContact NE2-NH1 3.32Å; S60-R64 PolarHBondContact O-N 3.34Å; E61-R64 PolarHBondContact O-N 2.98Å; R64-L67 PolarHBondContact O-N 3.05Å; R64-E68 WeakPolarHBondContact O-CB 3.42Å; R64-E68 PolarHBondContact O-N 2.83Å
65	S	64.3	Low	55.4	Low	74 Å²	74	105 Å²	105	52%	0.517	52%	0.521	S	S	.	.	H	α-helix	trans	-62.9	-39.3	173.3	-177.7	0	0	0	0	111.8	E61 E68 A69	E61-S65 WeakPolarHBondContact O-CB 3.35Å; E61-S65 PolarHBondContact O-N 3.03Å; S65-E68 PolarHBondContact O-N 3.37Å; S65-A69 WeakPolarHBondContact O-CB 3.46Å; S65-A69 PolarHBondContact O-N 3Å
66	R	67.8	Low	56.4	Low	183 Å²	183	110.1 Å²	110.1	69%	0.691	52%	0.516	S	S	*	.	H	α-helix	trans	-63.2	-43.4	170.1	-83.8	176.9	148.5	-176.2	-6.1	113	Q62 E63 A69 V70	Q62-R66 WeakPolarHBondContact O-CB 3.31Å; Q62-R66 WeakPolarHBondContact O-CG 2.91Å; Q62-R66 PolarHBondContact O-N 3.17Å; E63-R66 PolarHBondContact O-N 2.96Å; R66-A69 PolarHBondContact O-N 3.33Å; R66-V70 WeakPolarHBondContact O-CB 3.48Å; R66-V70 VanDerWaalsContact O-CG2 3.28Å; R66-V70 WeakPolarHBondContact O-CG2 3.27Å; R66-V70 PolarHBondContact O-N 3.17Å
67	L	63.2	Low	56.9	Low	44 Å²	44	108.7 Å²	108.7	23%	0.23	50%	0.503	C	S	.	.	H	α-helix	trans	-64.8	-40.6	176.3	-97.6	158.9	0	0	0	111.9	L59 E63 R64 V70 Q71 T474	L59-L67 HydrophobicContact CD1-CD1 3.66Å; L59-L67 HydrophobicContact CD2-CD1 4.02Å; E63-L67 WeakPolarHBondContact O-CB 3.44Å; E63-L67 PolarHBondContact O-N 3.48Å; R64-L67 PolarHBondContact O-N 3.05Å; L67-V70 PolarHBondContact O-N 3.49Å; L67-Q71 WeakPolarHBondContact O-CG 3.48Å; L67-Q71 PolarHBondContact O-N 3.13Å; L67-T474 HydrophobicContact CD1-CG2 4.13Å; L67-T474 HydrophobicContact CD2-CG2 4.22Å
68	E	69.9	Low	57	Low	118 Å²	118	110.6 Å²	110.6	55%	0.551	51%	0.506	S	S	*	.	H	α-helix	trans	-69.9	-40.2	177.2	-173.8	164.3	-143.9	0	0	111.7	R64 S65 V70 Q71 Q72	R64-E68 WeakPolarHBondContact O-CB 3.42Å; R64-E68 PolarHBondContact O-N 2.83Å; S65-E68 PolarHBondContact O-N 3.37Å; E68-V70 VanDerWaalsContact C-N 3.33Å; E68-V70 PolarHBondContact O-N 3.4Å; E68-Q71 PolarHBondContact O-N 2.82Å; E68-Q72 WeakPolarHBondContact O-CB 3.47Å; E68-Q72 WeakPolarHBondContact O-CG 3.15Å; E68-Q72 PolarHBondContact O-N 2.73Å
69	A	68.9	Low	56.4	Low	57 Å²	57	106.3 Å²	106.3	47%	0.471	51%	0.506	S	S	.	.	H	α-helix	trans	-61	-40.1	170	0	0	0	0	0	111.9	S65 R66 Q72 D73	S65-A69 WeakPolarHBondContact O-CB 3.46Å; S65-A69 PolarHBondContact O-N 3Å; R66-A69 PolarHBondContact O-N 3.33Å; A69-Q72 PolarHBondContact O-N 2.71Å; A69-D73 WeakPolarHBondContact O-CB 3.38Å; A69-D73 PolarHBondContact O-N 3.35Å
70	V	60.1	Low	55.8	Low	45 Å²	45	111.5 Å²	111.5	27%	0.273	53%	0.531	S	S	.	.	H	α-helix	trans	-69.6	-35.4	174.7	167.6	0	0	0	0	112.1	R66 L67 E68 D73 W74 F429	R66-V70 WeakPolarHBondContact O-CB 3.48Å; R66-V70 VanDerWaalsContact O-CG2 3.28Å; R66-V70 WeakPolarHBondContact O-CG2 3.27Å; R66-V70 PolarHBondContact O-N 3.17Å; L67-V70 PolarHBondContact O-N 3.49Å; E68-V70 VanDerWaalsContact C-N 3.33Å; E68-V70 PolarHBondContact O-N 3.4Å; V70-D73 PolarHBondContact O-N 3.27Å; V70-W74 WeakPolarHBondContact O-CB 3.5Å; V70-W74 PolarHBondContact O-N 3.46Å; V70-F429 HydrophobicContact CG1-CE1 4.27Å; V70-F429 HydrophobicContact CG1-CZ 4.11Å
71	Q	58.3	Low	53.9	Low	80 Å²	80	118.4 Å²	118.4	37%	0.374	55%	0.554	S	S	.	*	H	α-helix	trans	-70.8	-35.7	172.4	-75.4	-170.7	5.8	0	0	112.2	L67 E68 W74 R75	L67-Q71 WeakPolarHBondContact O-CG 3.48Å; L67-Q71 PolarHBondContact O-N 3.13Å; E68-Q71 PolarHBondContact O-N 2.82Å; Q71-W74 PolarHBondContact O-N 2.9Å; Q71-R75 WeakPolarHBondContact O-CB 3.48Å; Q71-R75 VanDerWaalsContact O-CG 3.28Å; Q71-R75 WeakPolarHBondContact O-CG 3.34Å; Q71-R75 PolarHBondContact O-N 3.17Å
72	Q	58	Low	52.9	Low	88 Å²	88	118 Å²	118	41%	0.411	55%	0.545	S	S	.	.	H	α-helix	trans	-65.7	-42.8	170.3	-75.7	-159.2	33.4	0	0	111.5	E68 A69 R75 R76	E68-Q72 WeakPolarHBondContact O-CB 3.47Å; E68-Q72 WeakPolarHBondContact O-CG 3.15Å; E68-Q72 PolarHBondContact O-N 2.73Å; A69-Q72 PolarHBondContact O-N 2.71Å; Q72-R75 PolarHBondContact O-N 2.99Å; Q72-R76 WeakPolarHBondContact O-CB 3.4Å; Q72-R76 WeakPolarHBondContact O-CD 3.45Å; Q72-R76 WeakPolarHBondContact O-CG 3.34Å; Q72-R76 PolarHBondContact O-N 3.46Å
73	D	66.2	Low	51.5	Low	68 Å²	68	117 Å²	117	36%	0.364	55%	0.549	S	S	.	.	H	α-helix	trans	-61.5	-42.3	174.1	-179.3	73.8	0	0	0	111.7	A69 V70 R75 R76 T77 R428	A69-D73 WeakPolarHBondContact O-CB 3.38Å; A69-D73 PolarHBondContact O-N 3.35Å; V70-D73 PolarHBondContact O-N 3.27Å; D73-R75 PolarHBondContact O-N 3.01Å; D73-R76 CarbonylContact O-C 3.44Å; D73-R76 PolarHBondContact O-N 3.08Å; D73-R76 VanDerWaalsContact O-N 3.16Å; D73-T77 WeakPolarHBondContact O-CB 3.5Å; D73-T77 WeakPolarHBondContact O-CG2 3.47Å; D73-T77 PolarHBondContact O-N 3.28Å; D73-T77 PolarHBondContact O-OG1 2.71Å; D73-R428 IonicContact OD2-CZ 2.72Å; D73-R428 IonicContact OD2-NH2 3.69Å; D73-R428 PolarHBondContact OD2-NH2 3.41Å
74	W	46	Very low	50.3	Low	102 Å²	102	117.7 Å²	117.7	39%	0.386	56%	0.564	S	S	.	*	H	α-helix	trans	-62.8	-40.3	174.3	-170.2	79.7	0	0	0	112.6	V70 Q71 T77 T418	V70-W74 WeakPolarHBondContact O-CB 3.5Å; V70-W74 PolarHBondContact O-N 3.46Å; Q71-W74 PolarHBondContact O-N 2.9Å; W74-T77 WeakPolarHBondContact CA-OG1 3.5Å; W74-T77 PolarHBondContact O-N 3.32Å; W74-T77 PolarHBondContact O-OG1 3.5Å; W74-T418 WeakPolarHBondContact CZ2-O 3.24Å
75	R	57.2	Low	48.9	Very low	176 Å²	176	120.9 Å²	120.9	66%	0.664	58%	0.582	S	S	*	*	H	α-helix	trans	-66.7	-35.2	172.2	-70.7	174.4	-169.3	-172.1	6.5	112.5	Q71 Q72 D73	Q71-R75 WeakPolarHBondContact O-CB 3.48Å; Q71-R75 VanDerWaalsContact O-CG 3.28Å; Q71-R75 WeakPolarHBondContact O-CG 3.34Å; Q71-R75 PolarHBondContact O-N 3.17Å; Q72-R75 PolarHBondContact O-N 2.99Å; D73-R75 PolarHBondContact O-N 3.01Å
76	R	49	Very low	47.4	Very low	184 Å²	184	127 Å²	127	69%	0.694	60%	0.599	S	S	*	*	H	α-helix	trans	-78.5	-18.4	178.1	-70.2	164.5	-169.2	-115	8.1	113.9	Q72 D73	Q72-R76 WeakPolarHBondContact O-CB 3.4Å; Q72-R76 WeakPolarHBondContact O-CD 3.45Å; Q72-R76 WeakPolarHBondContact O-CG 3.34Å; Q72-R76 PolarHBondContact O-N 3.46Å; D73-R76 CarbonylContact O-C 3.44Å; D73-R76 PolarHBondContact O-N 3.08Å; D73-R76 VanDerWaalsContact O-N 3.16Å
77	T	44.1	Very low	45.5	Very low	84 Å²	84	128.6 Å²	128.6	52%	0.515	61%	0.605	S	S	.	*	S	Bend	trans	-95.4	-1.9	178.9	45.5	0	0	0	0	113.8	D73 W74	D73-T77 WeakPolarHBondContact O-CB 3.5Å; D73-T77 WeakPolarHBondContact O-CG2 3.47Å; D73-T77 PolarHBondContact O-N 3.28Å; D73-T77 PolarHBondContact O-OG1 2.71Å; W74-T77 WeakPolarHBondContact CA-OG1 3.5Å; W74-T77 PolarHBondContact O-N 3.32Å; W74-T77 PolarHBondContact O-OG1 3.5Å
78	R	38.1	Very low	44.4	Very low	142 Å²	142	131.9 Å²	131.9	54%	0.536	63%	0.629	S	S	.	*	S	Bend	trans	-65.5	137.9	156.1	-86.3	-170.6	167	-131.2	-6.1	109.6	M80	R78-M80 PolarHBondContact O-N 2.62Å
79	P	29.8	Very low	42.8	Very low	127 Å²	127	132.4 Å²	132.4	83%	0.825	64%	0.636	S	S	*	*			trans	-77.3	62.1	-180	33.3	-36.8	0	0	0	112.5	K81	P79-K81 PolarHBondContact O-N 3.07Å
80	M	32.9	Very low	41	Very low	172 Å²	172	136.4 Å²	136.4	85%	0.847	65%	0.649	S	S	*	*			trans	-69.9	110.6	168.7	-90.1	-173.4	158.1	0	0	110.3	R78 W82	R78-M80 PolarHBondContact O-N 2.62Å; M80-W82 PolarHBondContact O-N 2.83Å
81	K	27.6	Very low	40.1	Very low	199 Å²	199	138.8 Å²	138.8	87%	0.865	67%	0.665	S	S	*	*			trans	-72.4	91.4	172.3	-68.5	176.1	-178.5	169.7	0	110.5	P79	P79-K81 PolarHBondContact O-N 3.07Å
82	W	30.7	Very low	38.8	Very low	158 Å²	158	141 Å²	141	60%	0.598	69%	0.685	S	S	*	*			trans	-147.4	126.7	149.3	-144	-73.5	0	0	0	112.3	M80 F316	M80-W82 PolarHBondContact O-N 2.83Å; W82-F316 HydrophobicContact CE3-CE2 4.46Å; W82-F316 HydrophobicContact CH2-CE2 4.35Å; W82-F316 HydrophobicContact CZ3-CD2 4.12Å; W82-F316 AromaticContact CZ3-CE2 3.58Å; W82-F316 HydrophobicContact CZ3-CE2 3.58Å; W82-F316 HydrophobicContact CZ3-CZ 4.02Å
83	T	28	Very low	37.7	Very low	122 Å²	122	142.4 Å²	142.4	75%	0.748	70%	0.7	S	S	*	*			trans	-106.7	101.5	177.3	57.8	0	0	0	0	110.8
84	S	32.5	Very low	36.1	Very low	107 Å²	107	143.8 Å²	143.8	75%	0.748	72%	0.715	S	S	*	*			trans	-119.1	99.6	172.9	-68.5	0	0	0	0	110.7
85	K	33.2	Very low	35.2	Very low	208 Å²	208	144.6 Å²	144.6	90%	0.904	74%	0.736	S	S	*	*			trans	-131.4	116	167.7	-169.4	170.4	-175.3	176.5	0	109.2
86	K	34.2	Very low	34.2	Very low	204 Å²	204	142.3 Å²	142.3	89%	0.887	74%	0.744	S	S	*	*			trans	-62.4	143.3	-179.5	-66.2	-174.8	174.7	-174	0	111.3
87	R	28.5	Very low	33.2	Very low	215 Å²	215	138.9 Å²	138.9	81%	0.811	75%	0.748	S	S	*	*			trans	-82.3	167.3	155.2	-89.7	-169.5	174	-162.9	-1.6	110.1
88	P	39.6	Very low	32.5	Very low	114 Å²	114	141.7 Å²	141.7	74%	0.74	77%	0.765	S	S	*	*				-116.3	129.2	109.8	33.5	-33.4	0	0	0	112.1
89	D	35.4	Very low	32.2	Very low	129 Å²	129	141 Å²	141	69%	0.69	78%	0.777	S	S	*	*				31.8	145.9	117.3	-33.4	-38.4	0	0	0	118.4
90	D	32.2	Very low	32	Very low	141 Å²	141	140.6 Å²	140.6	75%	0.754	78%	0.776	S	S	*	*			cis	-143.3	-155.1	24.6	-152.2	11.5	0	0	0	112.5
91	P	40.4	Very low	31.8	Very low	94 Å²	94	139.4 Å²	139.4	61%	0.61	77%	0.772	S	S	*	*				-123.1	-177.1	-114.9	39.4	-22.6	0	0	0	119
92	T	32	Very low	31.9	Very low	128 Å²	128	135.2 Å²	135.2	79%	0.785	77%	0.768	S	S	*	*			trans	83.7	164.6	179.4	81.5	0	0	0	0	114.8
93	T	33.7	Very low	31.9	Very low	117 Å²	117	135.3 Å²	135.3	72%	0.718	78%	0.78	S	S	*	*			cis	-144.4	151.5	9.8	-24.8	0	0	0	0	112.8
94	S	32.9	Very low	32	Very low	97 Å²	97	133.9 Å²	133.9	68%	0.678	78%	0.781	S	S	*	*			trans	32	113.6	157.1	60.9	0	0	0	0	122.3
95	S	27.5	Very low	31.8	Very low	119 Å²	119	136 Å²	136	83%	0.832	78%	0.783	S	S	*	*			trans	71.3	158.4	142.8	-56.9	0	0	0	0	118.9
96	P	35.3	Very low	31.7	Very low	128 Å²	128	133.4 Å²	133.4	83%	0.831	77%	0.774	S	S	*	*			cis	-122.9	-169.5	7.2	43	-28.4	0	0	0	115.1
97	S	28.1	Very low	31.6	Very low	112 Å²	112	130.3 Å²	130.3	78%	0.783	77%	0.767	S	S	*	*			trans	-94.2	164.2	-174.8	52.1	0	0	0	0	114.8
98	T	29.8	Very low	31.7	Very low	142 Å²	142	124.5 Å²	124.5	87%	0.871	76%	0.759	S	S	*	*			trans	-158.1	155.8	160.3	-4.1	0	0	0	0	111.7
99	V	31.1	Very low	31.4	Very low	129 Å²	129	125.2 Å²	125.2	78%	0.782	76%	0.762	S	S	*	*			trans	-80.8	160	-167.3	175.4	0	0	0	0	113.1	I101	V99-I101 HydrophobicContact CG1-CG1 4.35Å
100	S	26.2	Very low	31.7	Very low	117 Å²	117	124.4 Å²	124.4	82%	0.818	76%	0.764	S	S	*	*			trans	-120.6	147.7	165.6	-62.6	0	0	0	0	110.5
101	I	29.2	Very low	31.6	Very low	148 Å²	148	122.7 Å²	122.7	76%	0.759	76%	0.763	S	S	*	*			trans	-131.1	128.9	179.6	-58.5	176.1	0	0	0	109.9	V99	V99-I101 HydrophobicContact CG1-CG1 4.35Å
102	S	29.6	Very low	31.2	Very low	110 Å²	110	125 Å²	125	77%	0.769	77%	0.769	S	S	*	*			trans	-166.9	110.8	159.6	-76.5	0	0	0	0	105.9
103	N	30.3	Very low	31.1	Very low	160 Å²	160	125.2 Å²	125.2	86%	0.856	77%	0.766	S	S	*	*				79.2	147.7	84.2	-78.1	8.9	0	0	0	113.4
104	A	29.5	Very low	31	Very low	93 Å²	93	126.2 Å²	126.2	77%	0.769	77%	0.766	S	S	*	*			trans	-128.7	164	-157.1	0	0	0	0	0	113.8
105	L	30.1	Very low	31	Very low	151 Å²	151	127.4 Å²	127.4	79%	0.791	77%	0.769	S	S	*	*			trans	161.2	148.4	154.5	-108.4	65	0	0	0	107.6
106	E	30.9	Very low	31.2	Very low	153 Å²	153	126.5 Å²	126.5	72%	0.715	76%	0.763	S	S	*	*			cis	-159.2	166.6	-11.4	-144.5	168.6	-169.1	0	0	112.2
107	N	31	Very low	31	Very low	140 Å²	140	125 Å²	125	75%	0.749	76%	0.756	S	S	*	*			trans	-18.1	161.3	166.5	-65.6	-37.4	0	0	0	121.7
108	S	30.6	Very low	31.4	Very low	92 Å²	92	126.6 Å²	126.6	64%	0.643	75%	0.754	S	S	*	*			cis	-179.1	-165.5	-17.7	64.9	0	0	0	0	111.1
109	T	33.1	Very low	31.8	Very low	129 Å²	129	125.3 Å²	125.3	79%	0.791	75%	0.746	S	S	*	*			trans	103.6	156.6	166.6	73.5	0	0	0	0	118.8
110	P	42.3	Very low	31.9	Very low	113 Å²	113	125.8 Å²	125.8	73%	0.734	74%	0.744	S	S	*	*				-144.8	155.2	-52.2	41.8	-25.3	0	0	0	118.9
111	S	29.9	Very low	32.4	Very low	105 Å²	105	125.4 Å²	125.4	73%	0.734	74%	0.741	S	S	*	*			trans	79.7	157.6	138.1	-148.6	0	0	0	0	125.5
112	L	31.8	Very low	32.7	Very low	142 Å²	142	123.2 Å²	123.2	74%	0.743	74%	0.739	S	S	*	*			trans	72	138.9	168.8	-49.3	-178.9	0	0	0	116.9
113	N	31.5	Very low	33.1	Very low	133 Å²	133	123.3 Å²	123.3	71%	0.711	74%	0.74	S	S	*	*			cis	-168.3	176.7	-0.7	-104.3	-16.9	0	0	0	108.4
114	N	31.4	Very low	33.7	Very low	137 Å²	137	120.7 Å²	120.7	73%	0.733	73%	0.732	S	S	*	*			cis	179.3	174.6	-33.3	-168.5	1	0	0	0	108.7
115	V	33.1	Very low	33.8	Very low	122 Å²	122	125.7 Å²	125.7	74%	0.739	74%	0.736	S	S	*	*			trans	75	133.1	166.2	-177.6	0	0	0	0	117.1
116	S	30.5	Very low	33.9	Very low	100 Å²	100	123.2 Å²	123.2	70%	0.699	73%	0.732	S	S	*	*			cis	-165.6	159.6	-17.4	-90	0	0	0	0	108.7
117	S	32.3	Very low	33.8	Very low	98 Å²	98	124.3 Å²	124.3	69%	0.685	74%	0.742	S	S	*	*				167	171.3	76	56.6	0	0	0	0	113.6
118	I	36	Very low	33.8	Very low	144 Å²	144	123.3 Å²	123.3	74%	0.738	75%	0.745	S	S	*	*			trans	82.8	100.9	156.4	-66.3	161.3	0	0	0	120.5
119	T	38.3	Very low	33.7	Very low	115 Å²	115	124.7 Å²	124.7	71%	0.706	76%	0.755	S	S	*	*			trans	57.6	150.8	143.8	63.7	0	0	0	0	121.8
120	N	33.1	Very low	33.6	Very low	140 Å²	140	123.2 Å²	123.2	75%	0.749	76%	0.756	S	S	*	*			cis	-162.4	150.5	-5.3	-116.5	-1.7	0	0	0	111.1
121	S	36.6	Very low	32.9	Very low	108 Å²	108	122.2 Å²	122.2	76%	0.755	76%	0.757	S	S	*	*			trans	50.4	141	153.7	50.7	0	0	0	0	121.6
122	S	35.7	Very low	33	Very low	102 Å²	102	124.2 Å²	124.2	71%	0.713	77%	0.766	S	S	*	*			cis	-172.3	134.9	1.4	45	0	0	0	0	115.4
123	S	36.4	Very low	33	Very low	113 Å²	113	121.7 Å²	121.7	79%	0.79	76%	0.76	S	S	*	*			trans	79.9	165.8	137.9	90.7	0	0	0	0	119.2
124	P	43.7	Very low	33.1	Very low	104 Å²	104	121.5 Å²	121.5	68%	0.675	76%	0.764	S	S	*	*				-143.8	172	-114	35.3	-11.2	0	0	0	118.2
125	F	32.2	Very low	33.1	Very low	198 Å²	198	119.1 Å²	119.1	87%	0.868	76%	0.763	S	S	*	*				173.1	-173.1	122.4	-105.4	-79.7	0	0	0	111.9
126	S	30.6	Very low	33	Very low	100 Å²	100	119.6 Å²	119.6	70%	0.699	77%	0.771	S	S	*	*			trans	-141.6	-178.1	-145.2	-51	0	0	0	0	116.4
127	L	29.4	Very low	33	Very low	176 Å²	176	119.1 Å²	119.1	92%	0.921	77%	0.774	S	S	*	*			trans	89.9	142.8	177.7	-52.5	170.6	0	0	0	114
128	S	31	Very low	33.1	Very low	118 Å²	118	122.8 Å²	122.8	83%	0.825	78%	0.784	S	S	*	*			cis	-146.2	171.3	9.9	59.1	0	0	0	0	114.3
129	S	28.6	Very low	33	Very low	121 Å²	121	123.1 Å²	123.1	85%	0.846	79%	0.785	S	S	*	*			trans	-149.9	166.5	166.4	70.5	0	0	0	0	108.3
130	A	31.4	Very low	33.1	Very low	98 Å²	98	122.4 Å²	122.4	81%	0.81	78%	0.783	S	S	*	*			cis	-153.5	175.1	-0.6	0	0	0	0	0	109.1
131	A	28.2	Very low	33	Very low	92 Å²	92	124.1 Å²	124.1	76%	0.76	78%	0.784	S	S	*	*			trans	-157.5	123.2	172.6	0	0	0	0	0	115.9
132	T	31.1	Very low	32.8	Very low	148 Å²	148	124.2 Å²	124.2	91%	0.908	78%	0.78	S	S	*	*			trans	179	158	157.6	6.1	0	0	0	0	109.1
133	S	32.5	Very low	32.6	Very low	89 Å²	89	124 Å²	124	62%	0.622	78%	0.779	S	S	*	*			cis	-160	157.2	2.9	-162.4	0	0	0	0	112.4
134	T	33.1	Very low	32.3	Very low	129 Å²	129	125.7 Å²	125.7	79%	0.791	78%	0.779	S	S	*	*			trans	32.7	154.8	142.5	53.7	0	0	0	0	123.8
135	A	32.3	Very low	31.8	Very low	87 Å²	87	127 Å²	127	72%	0.719	78%	0.784	S	S	*	*			cis	179.1	161.8	-18	0	0	0	0	0	110.3
136	S	30.2	Very low	31.9	Very low	131 Å²	131	121.3 Å²	121.3	92%	0.916	77%	0.774	S	S	*	*			trans	145.4	161.1	151.1	-69.1	0	0	0	0	112.3
137	A	30.5	Very low	32	Very low	91 Å²	91	122.2 Å²	122.2	75%	0.752	78%	0.776	S	S	*	*			trans	-135	155.6	-167.3	0	0	0	0	0	114.8
138	I	33.6	Very low	32.1	Very low	174 Å²	174	121.4 Å²	121.4	89%	0.892	77%	0.772	S	S	*	*			trans	-163.7	161.1	149.6	-101.3	154.1	0	0	0	108.7
139	I	33.3	Very low	32.2	Very low	151 Å²	151	124.4 Å²	124.4	77%	0.774	77%	0.773	S	S	*	*			trans	-130.7	158.8	-161.3	-74.9	165.6	0	0	0	107.4
140	P	41.6	Very low	33	Very low	101 Å²	101	123.4 Å²	123.4	66%	0.656	76%	0.764	S	S	*	*			cis	-135.9	-165.6	18.8	18.6	10.4	0	0	0	116.8
141	F	30.3	Very low	33.1	Very low	176 Å²	176	126.9 Å²	126.9	77%	0.772	76%	0.763	S	S	*	*			trans	112.6	96.5	151.2	-83.2	-84.5	0	0	0	120.4
142	T	32.2	Very low	33.2	Very low	109 Å²	109	129 Å²	129	67%	0.669	76%	0.76	S	S	*	*			trans	54.7	102.8	132.4	57.8	0	0	0	0	121.6
143	S	31.6	Very low	33.1	Very low	98 Å²	98	127.8 Å²	127.8	69%	0.685	75%	0.749	S	S	*	*				67.5	135.4	120.4	69.8	0	0	0	0	122.7
144	N	30.8	Very low	33.1	Very low	149 Å²	149	130.8 Å²	130.8	80%	0.797	75%	0.753	S	S	*	*			trans	95.6	115.4	139.5	-77	9.5	0	0	0	121.9
145	V	33.6	Very low	33	Very low	130 Å²	130	132.3 Å²	132.3	79%	0.788	75%	0.75	S	S	*	*				99.3	127.2	129	169.3	0	0	0	0	120.2
146	A	33.3	Very low	33	Very low	79 Å²	79	133.5 Å²	133.5	65%	0.653	75%	0.748	S	S	*	*			trans	59	98.2	155	0	0	0	0	0	121
147	T	33.2	Very low	33	Very low	120 Å²	120	132 Å²	132	74%	0.736	74%	0.737	S	S	*	*				5.5	123.6	121.6	53.5	0	0	0	0	118.5
148	N	32.3	Very low	33.1	Very low	158 Å²	158	138.8 Å²	138.8	85%	0.845	74%	0.744	S	S	*	*				-170.3	170.1	102.9	-104.1	-47	0	0	0	115.1
149	H	32.9	Very low	32.9	Very low	182 Å²	182	137.7 Å²	137.7	84%	0.843	74%	0.738	S	S	*	*			trans	-84.7	175.3	-174.3	-105.3	-69.6	0	0	0	113.3
150	P	45.6	Very low	33.5	Very low	100 Å²	100	136 Å²	136	65%	0.649	74%	0.737	S	S	*	*				-134	-155	-127	44	-24.3	0	0	0	115.3
151	H	32.2	Very low	33.1	Very low	171 Å²	171	140 Å²	140	79%	0.792	75%	0.747	S	S	*	*			trans	102.5	144.2	156.1	-95.5	-64.8	0	0	0	121.4
152	L	31.3	Very low	33.2	Very low	135 Å²	135	135.2 Å²	135.2	71%	0.707	74%	0.74	S	S	*	*			trans	78.9	100.5	162.8	-92.5	76.9	0	0	0	121.5
153	N	29.1	Very low	33.3	Very low	124 Å²	124	137.7 Å²	137.7	66%	0.663	75%	0.747	S	S	*	*				68.6	121.5	114.7	-69.3	8.2	0	0	0	123.3
154	H	32.8	Very low	33.5	Very low	152 Å²	152	139.1 Å²	139.1	70%	0.704	75%	0.752	S	S	*	*				91.5	103.3	124.8	-82.5	-36.4	0	0	0	123.3
155	H	30.3	Very low	33.6	Very low	160 Å²	160	138.7 Å²	138.7	74%	0.741	76%	0.755	S	S	*	*				98.5	143	103	-138.7	-28.7	0	0	0	120.4
156	V	31.4	Very low	33.2	Very low	113 Å²	113	136.4 Å²	136.4	69%	0.685	76%	0.758	S	S	*	*			trans	103.9	114.4	149	-174.8	0	0	0	0	120.2
157	S	30.9	Very low	32.9	Very low	98 Å²	98	135.8 Å²	135.8	69%	0.685	76%	0.759	S	S	*	*			trans	71.2	156	149.2	-69.6	0	0	0	0	120.8
158	R	33.2	Very low	32.9	Very low	234 Å²	234	136.6 Å²	136.6	88%	0.883	76%	0.764	S	S	*	*			cis	-148.3	170.2	-2.4	-129.6	170.2	-167.9	-173.9	2.7	113
159	I	29.3	Very low	32.8	Very low	152 Å²	152	136.7 Å²	136.7	78%	0.779	76%	0.764	S	S	*	*			trans	-112.8	146.9	-175.9	-65.9	156.3	0	0	0	109.6
160	P	44.6	Very low	32.7	Very low	116 Å²	116	131.4 Å²	131.4	75%	0.753	76%	0.759	S	S	*	*				-150.6	118.6	115.9	34.6	-15.1	0	0	0	117.2
161	Q	33.6	Very low	32	Very low	183 Å²	183	131.7 Å²	131.7	86%	0.855	76%	0.764	S	S	*	*			trans	56.5	159.4	135.8	-46.5	-170.5	-6.3	0	0	120.3
162	A	33.6	Very low	32.1	Very low	76 Å²	76	131.4 Å²	131.4	63%	0.628	77%	0.767	S	S	*	*			cis	-155.6	175.3	13	0	0	0	0	0	113.9
163	I	34.3	Very low	32.5	Very low	161 Å²	161	130 Å²	130	83%	0.826	77%	0.766	S	S	*	*	S	Bend	trans	86.3	138.1	153.3	-67.6	157.5	0	0	0	119.1
164	V	34	Very low	33	Very low	129 Å²	129	129.5 Å²	129.5	78%	0.782	77%	0.77	S	S	*	*			trans	58.6	58.3	-174.1	-154.8	0	0	0	0	117.5
165	T	33.1	Very low	32.9	Very low	139 Å²	139	129.2 Å²	129.2	85%	0.853	77%	0.773	S	S	*	*			trans	-0.4	129	139.5	52.1	0	0	0	0	120
166	G	26.5	Very low	32.9	Very low	83 Å²	83	128.3 Å²	128.3	86%	0.856	77%	0.772	S	S	*	*			trans	-153	115.2	151.5	0	0	0	0	0	112.1
167	G	27.3	Very low	32.8	Very low	66 Å²	66	129.8 Å²	129.8	68%	0.68	78%	0.775	S	S	*	*			trans	105.1	160.5	166.6	0	0	0	0	0	118.2
168	T	32	Very low	33	Very low	137 Å²	137	130.3 Å²	130.3	84%	0.84	78%	0.778	S	S	*	*			trans	74.2	147.8	177.3	78.2	0	0	0	0	115.9
169	N	30.7	Very low	33	Very low	159 Å²	159	124.7 Å²	124.7	85%	0.85	77%	0.772	S	S	*	*			cis	-157.4	156.4	11.1	-134.8	-15.3	0	0	0	114.7
170	G	31.4	Very low	32.9	Very low	71 Å²	71	123.8 Å²	123.8	73%	0.732	77%	0.774	S	S	*	*			trans	83.9	159	163.6	0	0	0	0	0	118.5
171	S	30.8	Very low	32.2	Very low	106 Å²	106	124.3 Å²	124.3	74%	0.741	78%	0.78	S	S	*	*			cis	-166.4	139.3	-12.5	-168.8	0	0	0	0	112.6
172	L	33.1	Very low	31.9	Very low	165 Å²	165	120.7 Å²	120.7	86%	0.864	78%	0.782	S	S	*	*			trans	64.3	159.5	160.4	-73	170.3	0	0	0	120.7
173	P	40	Very low	31.8	Very low	105 Å²	105	121.2 Å²	121.2	68%	0.682	79%	0.786	S	S	*	*			trans	-96	171	-171.2	42.3	-38.5	0	0	0	112.5
174	P	39.8	Very low	31.5	Very low	114 Å²	114	118.4 Å²	118.4	74%	0.74	79%	0.787	S	S	*	*			cis	-151.8	-168.9	47	41.5	-17.8	0	0	0	118.8
175	L	31.3	Very low	31.3	Very low	147 Å²	147	117.2 Å²	117.2	77%	0.77	79%	0.791	S	S	*	*			trans	81.4	112.5	163	-61.7	169.9	0	0	0	120.3
176	L	29.6	Very low	31.1	Very low	140 Å²	140	117.1 Å²	117.1	73%	0.733	79%	0.79	S	S	*	*				72	126.2	129.7	-67.7	173.9	0	0	0	122.5
177	I	30.4	Very low	31.8	Very low	145 Å²	145	118 Å²	118	74%	0.744	78%	0.781	S	S	*	*			trans	87.4	122.3	143.4	-64.1	160.7	0	0	0	119.4
178	S	33.7	Very low	31.8	Very low	108 Å²	108	122.1 Å²	122.1	76%	0.755	79%	0.786	S	S	*	*			trans	64.4	120.2	155.4	-65.3	0	0	0	0	122.2
179	P	33.1	Very low	31.8	Very low	116 Å²	116	122.7 Å²	122.7	75%	0.753	78%	0.783	S	S	*	*			trans	-90	132.1	155.7	34.7	-29.6	0	0	0	112.7
180	T	28.2	Very low	31.9	Very low	134 Å²	134	120.7 Å²	120.7	82%	0.822	78%	0.781	S	S	*	*	S	Bend	trans	37.1	95.2	149.4	56.1	0	0	0	0	120.2
181	S	29.4	Very low	31.8	Very low	126 Å²	126	120.4 Å²	120.4	88%	0.881	78%	0.778	S	S	*	*				171.9	92	111.6	62.3	0	0	0	0	114.5
182	A	28.5	Very low	31.9	Very low	108 Å²	108	125.4 Å²	125.4	89%	0.893	79%	0.787	S	S	*	*			trans	-168.3	164.6	164.6	0	0	0	0	0	107.3
183	A	30.3	Very low	31.9	Very low	86 Å²	86	122.5 Å²	122.5	71%	0.711	79%	0.787	S	S	*	*			cis	-138.7	143.5	-4.2	0	0	0	0	0	106.4
184	A	28.9	Very low	31.4	Very low	102 Å²	102	120.9 Å²	120.9	84%	0.843	79%	0.789	S	S	*	*				51.7	109.7	72.6	0	0	0	0	0	113.9
185	A	30	Very low	31.5	Very low	104 Å²	104	121.5 Å²	121.5	86%	0.86	79%	0.793	S	S	*	*			trans	-128.3	103.6	171.3	0	0	0	0	0	110.5
186	T	28.7	Very low	31.5	Very low	137 Å²	137	123 Å²	123	84%	0.84	80%	0.798	S	S	*	*			trans	-70.5	166.8	151.2	10.5	0	0	0	0	108.8
187	P	40	Very low	31.5	Very low	103 Å²	103	121.5 Å²	121.5	67%	0.669	80%	0.799	S	S	*	*			cis	-147.9	-178.9	26.9	41.9	-20.8	0	0	0	119.1
188	L	27.6	Very low	32	Very low	151 Å²	151	120.9 Å²	120.9	79%	0.791	81%	0.805	S	S	*	*			trans	86.4	134.9	135.5	-91.4	161.8	0	0	0	123.5
189	I	32.5	Very low	31.8	Very low	150 Å²	150	120.5 Å²	120.5	77%	0.769	80%	0.802	S	S	*	*			trans	92.5	111	152.3	-62.1	156.5	0	0	0	119.7
190	S	33.3	Very low	31.8	Very low	116 Å²	116	121.9 Å²	121.9	81%	0.811	81%	0.809	S	S	*	*			trans	61.3	142.5	150.9	-159.8	0	0	0	0	120.3
191	G	29.6	Very low	31.9	Very low	65 Å²	65	119.3 Å²	119.3	67%	0.67	81%	0.808	S	S	*	*			cis	145.4	154.5	-10.1	0	0	0	0	0	115.1
192	K	31.8	Very low	32.1	Very low	211 Å²	211	118.9 Å²	118.9	92%	0.917	81%	0.805	S	S	*	*			trans	74.6	136	171.3	-77.1	-175.6	173.5	179	0	120.6
193	A	34	Very low	32.8	Very low	105 Å²	105	119.3 Å²	119.3	87%	0.868	80%	0.799	S	S	*	*			trans	66.1	147.2	152.4	0	0	0	0	0	119.1
194	G	29	Very low	32.8	Very low	70 Å²	70	122.6 Å²	122.6	72%	0.722	80%	0.803	S	S	*	*			cis	138	112.3	-3.3	0	0	0	0	0	111.9
195	P	42	Very low	33.1	Very low	128 Å²	128	124.8 Å²	124.8	83%	0.831	80%	0.801	S	S	*	*			trans	-94.5	148.4	-167.5	35.5	-35.1	0	0	0	114.4
196	M	31	Very low	33.3	Very low	178 Å²	178	126.3 Å²	126.3	88%	0.877	80%	0.799	S	S	*	*			trans	-144.6	139	156.6	-68.6	-167.5	74.9	0	0	111.1
197	S	30.4	Very low	33.4	Very low	109 Å²	109	124.3 Å²	124.3	76%	0.762	80%	0.797	S	S	*	*			trans	15.6	146.2	141.8	-56	0	0	0	0	120.6
198	P	39.7	Very low	32.9	Very low	131 Å²	131	123.6 Å²	123.6	85%	0.851	80%	0.799	S	S	*	*			cis	-140.2	-160.5	43.1	42.1	-22.8	0	0	0	116.3
199	S	31	Very low	32.9	Very low	100 Å²	100	121.2 Å²	121.2	70%	0.699	79%	0.791	S	S	*	*			trans	-111.3	179.2	-159.1	52.8	0	0	0	0	115.1
200	T	32.8	Very low	32.7	Very low	146 Å²	146	118.1 Å²	118.1	90%	0.896	78%	0.779	S	S	*	*			trans	81.5	137.3	170.1	73.5	0	0	0	0	117.2
201	G	30.2	Very low	32.5	Very low	79 Å²	79	118.5 Å²	118.5	81%	0.814	77%	0.771	S	S	*	*			trans	139.3	37.2	176.3	0	0	0	0	0	118.2
202	S	33.4	Very low	32.6	Very low	117 Å²	117	121.4 Å²	121.4	82%	0.818	77%	0.767	S	S	*	*			trans	-76.8	171.3	178.8	-47.2	0	0	0	0	113.4
203	P	42.4	Very low	32.6	Very low	118 Å²	118	118.8 Å²	118.8	77%	0.766	76%	0.764	S	S	*	*				-138.5	154.1	-51.7	37.8	-22.5	0	0	0	113.9
204	I	31.4	Very low	32.8	Very low	155 Å²	155	116.7 Å²	116.7	80%	0.795	75%	0.746	S	S	*	*			trans	-141.9	120.1	163.6	-57.6	-179.5	0	0	0	111.1
205	N	34.7	Very low	32.9	Very low	147 Å²	147	120.1 Å²	120.1	79%	0.786	75%	0.752	S	S	*	*			trans	170	109.4	149.6	-89.3	-28.5	0	0	0	106.1
206	V	35	Very low	32.4	Very low	136 Å²	136	118.7 Å²	118.7	82%	0.824	75%	0.745	S	S	*	*				66.2	121.6	78.1	179.9	0	0	0	0	111.2
207	A	30.4	Very low	32.3	Very low	96 Å²	96	115.4 Å²	115.4	79%	0.793	74%	0.74	S	S	*	*			trans	-111.8	163.1	-148.2	0	0	0	0	0	115.7
208	A	27.9	Very low	32.8	Very low	87 Å²	87	115.8 Å²	115.8	72%	0.719	74%	0.74	S	S	*	*			trans	-156	48.8	163.1	0	0	0	0	0	112	L45	L45-A208 CarbonylContact O-C 3.2Å
209	T	27.6	Very low	32.5	Very low	102 Å²	102	116.8 Å²	116.8	63%	0.626	73%	0.734	S	S	*	*	S	Bend	trans	-157.7	130.7	166.2	-62.3	0	0	0	0	110.6	E44 L45	E44-T209 WeakPolarHBondContact O-CA 3.37Å; L45-T209 CarbonylContact O-C 3.22Å; L45-T209 WeakPolarHBondContact O-CA 3.3Å; L45-T209 PolarHBondContact O-N 3.32Å
210	V	28.5	Very low	32.4	Very low	84 Å²	84	120.2 Å²	120.2	51%	0.509	74%	0.738	S	S	.	*	S	Bend	trans	64.5	121.7	162.9	167.5	0	0	0	0	119.2	L45	L45-V210 HydrophobicContact CD1-CG2 4.3Å; L45-V210 PolarHBondContact O-N 2.9Å
211	L	30.8	Very low	32.1	Very low	124 Å²	124	117.3 Å²	117.3	65%	0.649	72%	0.724	S	S	*	*			trans	35.3	116.1	150.5	-61.7	172.7	0	0	0	119.8	L45	L45-L211 HydrophobicContact CD1-CG 4.42Å
212	Q	31.9	Very low	32.3	Very low	127 Å²	127	120.5 Å²	120.5	59%	0.593	72%	0.721	S	S	*	*			trans	-142.9	112.5	148.4	-117.8	164.5	4.4	0	0	113.5	P47 A214	P47-Q212 WeakPolarHBondContact CG-O 3.45Å; Q212-A214 HydrophobicContact CG-CB 4.28Å
213	N	30.1	Very low	32.5	Very low	156 Å²	156	123.4 Å²	123.4	83%	0.834	72%	0.719	S	S	*	*	S	Bend		-133.9	81.3	114.2	-94.8	-26.9	0	0	0	105.6
214	A	38.9	Very low	31.9	Very low	60 Å²	60	123.1 Å²	123.1	50%	0.496	71%	0.711	S	S	.	*			trans	-143.2	113.1	-165.7	0	0	0	0	0	112.2	Q212	Q212-A214 HydrophobicContact CG-CB 4.28Å
215	V	32	Very low	31.9	Very low	142 Å²	142	125.5 Å²	125.5	86%	0.861	71%	0.71	S	S	*	*			trans	-157.2	142.3	177.9	179.4	0	0	0	0	107.1
216	S	30	Very low	31.6	Very low	98 Å²	98	122.6 Å²	122.6	69%	0.685	70%	0.701	S	S	*	*			cis	-169.7	151.5	-34.6	-97.6	0	0	0	0	108.6
217	S	29.5	Very low	31.3	Very low	109 Å²	109	126.5 Å²	126.5	76%	0.762	70%	0.701	S	S	*	*			trans	66	166	172.2	-57.9	0	0	0	0	115.7
218	P	41.4	Very low	31.2	Very low	118 Å²	118	128.1 Å²	128.1	77%	0.766	70%	0.696	S	S	*	*			cis	-98.6	141.5	-3.1	36.4	-27.3	0	0	0	113.2
219	Q	32.2	Very low	31.2	Very low	152 Å²	152	128.8 Å²	128.8	71%	0.71	69%	0.687	S	S	*	*				67.3	135.1	82.9	-68.2	-81.1	-0.8	0	0	115.7
220	H	29.8	Very low	31.5	Very low	171 Å²	171	133.3 Å²	133.3	79%	0.792	70%	0.698	S	S	*	*			trans	30	139.1	147.6	-89.7	-113.2	0	0	0	120
221	S	27.2	Very low	31.8	Very low	85 Å²	85	135 Å²	135	59%	0.594	70%	0.703	S	S	*	*			cis	144.1	132.3	11.8	152	0	0	0	0	105.2
222	I	34.1	Very low	32.5	Very low	147 Å²	147	134 Å²	134	75%	0.754	70%	0.704	S	S	*	*			trans	179.2	126.2	140.7	-97.7	154.2	0	0	0	109.5
223	F	36.7	Very low	33.2	Very low	177 Å²	177	132.9 Å²	132.9	78%	0.776	71%	0.707	S	S	*	*			trans	38.1	139.2	145.8	-70	-102.9	0	0	0	121.6
224	D	30.5	Very low	33.3	Very low	112 Å²	112	132.3 Å²	132.3	60%	0.599	71%	0.705	S	S	*	*			cis	-161	174	-11.7	-152.4	1.1	0	0	0	113
225	R	31.1	Very low	32.9	Very low	205 Å²	205	135.1 Å²	135.1	77%	0.774	72%	0.716	S	S	*	*			trans	-19.7	125.6	153	-69.7	155.9	-176.6	-170.2	-1.3	114.2
226	S	27.6	Very low	32.9	Very low	86 Å²	86	133.2 Å²	133.2	60%	0.601	71%	0.709	S	S	*	*				71.3	149.9	60.7	85.6	0	0	0	0	114.9
227	R	29.2	Very low	33	Very low	219 Å²	219	136.4 Å²	136.4	83%	0.826	72%	0.717	S	S	*	*			trans	76	167.7	173.8	-53.6	175.1	171.5	-119.4	-2.6	113.9
228	L	29	Very low	33.1	Very low	130 Å²	130	134.9 Å²	134.9	68%	0.681	71%	0.711	S	S	*	*			cis	-156.9	177.6	-13.3	-136.2	62.1	0	0	0	106.4
229	N	28.2	Very low	32.6	Very low	100 Å²	100	134.5 Å²	134.5	54%	0.535	71%	0.711	S	S	.	*			cis	-159.7	160.5	-2.6	-158.4	-8.2	0	0	0	108.7	I231	N229-I231 HydrophobicContact CB-CD1 4.19Å; N229-I231 HydrophobicContact CB-CG1 4.4Å; N229-I231 WeakPolarHBondContact ND2-CG1 3.38Å
230	K	32.9	Very low	32.4	Very low	197 Å²	197	132 Å²	132	86%	0.857	71%	0.71	S	S	*	*			trans	-179.2	138.3	133.8	-103.9	169.4	179.8	-176	0	113.9
231	I	35.8	Very low	32.4	Very low	120 Å²	120	128.7 Å²	128.7	62%	0.615	71%	0.707	S	S	*	*			cis	-163.9	155.1	-43	-114.8	157.9	0	0	0	109.2	N229	N229-I231 HydrophobicContact CB-CD1 4.19Å; N229-I231 HydrophobicContact CB-CG1 4.4Å; N229-I231 WeakPolarHBondContact ND2-CG1 3.38Å
232	P	45.4	Very low	32.3	Very low	102 Å²	102	130.1 Å²	130.1	66%	0.662	72%	0.717	S	S	*	*			trans	-91.9	-158.1	-176.4	36.9	-32.4	0	0	0	112.8
233	P	46.9	Very low	32.5	Very low	104 Å²	104	128.6 Å²	128.6	68%	0.675	72%	0.716	S	S	*	*				-149.2	152.8	99.5	38.9	-22.8	0	0	0	118.1
234	N	30.4	Very low	32.1	Very low	145 Å²	145	124.3 Å²	124.3	78%	0.775	71%	0.709	S	S	*	*			trans	66.7	153.7	146.5	-60.3	-6.4	0	0	0	119.4
235	T	31.9	Very low	31.9	Very low	118 Å²	118	126.6 Å²	126.6	72%	0.724	72%	0.721	S	S	*	*			cis	-154.6	148.9	7.2	-16.5	0	0	0	0	112.6
236	S	31.7	Very low	31.8	Very low	103 Å²	103	121.7 Å²	121.7	72%	0.72	72%	0.724	S	S	*	*			trans	60.2	159.1	150.3	55.7	0	0	0	0	120.3
237	L	31.3	Very low	32.1	Very low	164 Å²	164	121.6 Å²	121.6	86%	0.859	73%	0.728	S	S	*	*			cis	-164.8	169	-16.2	-109.9	167.8	0	0	0	109.1
238	A	32.2	Very low	32.3	Very low	77 Å²	77	118 Å²	118	64%	0.636	73%	0.726	S	S	*	*			trans	57.3	120.7	153.8	0	0	0	0	0	119.5
239	S	30.3	Very low	32.3	Very low	110 Å²	110	118.1 Å²	118.1	77%	0.769	73%	0.727	S	S	*	*				57.7	140.4	71.2	77	0	0	0	0	115.2
240	S	27.8	Very low	32.5	Very low	99 Å²	99	118.9 Å²	118.9	69%	0.692	73%	0.731	S	S	*	*			cis	177.3	165.2	-10.6	46.9	0	0	0	0	108.3
241	S	29.7	Very low	32.5	Very low	102 Å²	102	117.8 Å²	117.8	71%	0.713	73%	0.726	S	S	*	*			trans	57.3	116.2	166.7	50.5	0	0	0	0	118.6
242	S	26.8	Very low	32.8	Very low	115 Å²	115	117.2 Å²	117.2	80%	0.804	73%	0.73	S	S	*	*				63.8	144.3	87.2	-55.9	0	0	0	0	116
243	P	37.3	Very low	32	Very low	115 Å²	115	118.9 Å²	118.9	75%	0.747	73%	0.732	S	S	*	*			cis	-141.3	-156.5	-8.9	39.8	-17.3	0	0	0	115
244	S	27.4	Very low	31.1	Very low	88 Å²	88	121.7 Å²	121.7	62%	0.615	74%	0.736	S	S	*	*			trans	77.4	105.2	146.1	54.5	0	0	0	0	123.6
245	D	26.7	Very low	31.1	Very low	159 Å²	159	123.4 Å²	123.4	85%	0.85	74%	0.74	S	S	*	*				84.4	154.4	118.6	-65.8	-56.4	0	0	0	124.8
246	A	30.3	Very low	31	Very low	102 Å²	102	128.5 Å²	128.5	84%	0.843	75%	0.746	S	S	*	*			trans	74.1	132.1	174.5	0	0	0	0	0	118.4
247	A	33.8	Very low	30.8	Very low	84 Å²	84	131.9 Å²	131.9	69%	0.694	75%	0.75	S	S	*	*			cis	-161.3	157.7	-10.7	0	0	0	0	0	113.4
248	N	33.4	Very low	30.6	Very low	145 Å²	145	128.2 Å²	128.2	78%	0.775	74%	0.738	S	S	*	*			trans	64.5	141	164.7	-59.5	-17.7	0	0	0	118.2
249	N	29.1	Very low	30.4	Very low	131 Å²	131	131.6 Å²	131.6	70%	0.701	74%	0.744	S	S	*	*			cis	69.2	143.2	40.9	-73	-26.5	0	0	0	113.9
250	D	32	Very low	30.2	Very low	116 Å²	116	134.3 Å²	134.3	62%	0.62	75%	0.748	S	S	*	*			cis	-142.6	139.2	22.4	-112.9	-54.8	0	0	0	114.5
251	K	31.7	Very low	30.2	Very low	175 Å²	175	134.8 Å²	134.8	76%	0.761	75%	0.752	S	S	*	*				53.9	161.4	127.6	-76.7	-175.1	-166.8	126.4	0	124.7
252	P	42.8	Very low	30.2	Very low	107 Å²	107	137.3 Å²	137.3	70%	0.695	76%	0.758	S	S	*	*			trans	-135.4	-157.8	-149.5	33.1	-7.5	0	0	0	114.2
253	I	29.3	Very low	30.3	Very low	137 Å²	137	138.7 Å²	138.7	70%	0.703	76%	0.761	S	S	*	*			trans	129.8	133.9	142.8	-68.1	163.1	0	0	0	116
254	Q	28.2	Very low	29.9	Very low	164 Å²	164	144 Å²	144	77%	0.766	77%	0.766	S	S	*	*			trans	84.3	136.1	152.7	-90.3	159.1	5.3	0	0	125.3
255	Q	29.3	Very low	30.1	Very low	181 Å²	181	146.5 Å²	146.5	85%	0.846	78%	0.778	S	S	*	*			trans	97.2	139.4	135.8	-101.2	171.5	-53.2	0	0	122.1
256	R	29	Very low	30.1	Very low	225 Å²	225	146.7 Å²	146.7	85%	0.849	78%	0.778	S	S	*	*			trans	-77.5	135.6	173.6	-59.4	164.7	170.7	147.3	-6.6	108.6
257	H	28.6	Very low	30	Very low	173 Å²	173	147.9 Å²	147.9	80%	0.801	78%	0.775	S	S	*	*				-168.4	158.9	102.7	-115.7	-106	0	0	0	111.8
258	S	26.9	Very low	29.7	Very low	87 Å²	87	153.6 Å²	153.6	61%	0.608	79%	0.787	S	S	*	*			trans	32.7	116.2	143.9	-158.7	0	0	0	0	120.5
259	I	28.6	Very low	29.7	Very low	149 Å²	149	151.7 Å²	151.7	76%	0.764	79%	0.791	S	S	*	*	S	Bend		32.8	126.4	119.8	-62	158.7	0	0	0	117.5
260	L	26.1	Very low	29.6	Very low	166 Å²	166	154.3 Å²	154.3	87%	0.869	80%	0.802	S	S	*	*			trans	79.4	79.6	169.5	-67.4	165.3	0	0	0	118.8
261	S	26.4	Very low	29.9	Very low	110 Å²	110	154.8 Å²	154.8	77%	0.769	81%	0.808	S	S	*	*			trans	-159.1	99.5	138	63	0	0	0	0	113.1
262	N	31.4	Very low	30.2	Very low	155 Å²	155	153.2 Å²	153.2	83%	0.829	81%	0.808	S	S	*	*			trans	-169.2	45.5	144.3	-102.1	-7.5	0	0	0	112.9
263	V	27.7	Very low	30	Very low	143 Å²	143	155.4 Å²	155.4	87%	0.867	81%	0.814	S	S	*	*	S	Bend	trans	-120.2	59.1	164.9	-172.7	0	0	0	0	108.6
264	R	29.1	Very low	30.2	Very low	228 Å²	228	151.6 Å²	151.6	86%	0.86	81%	0.808	S	S	*	*			trans	-168.5	65.9	166.7	-123.4	-178.5	-174.4	120.4	0.6	116
265	T	31.2	Very low	30.8	Very low	140 Å²	140	150.1 Å²	150.1	86%	0.859	81%	0.813	S	S	*	*			trans	-138.1	56.5	158.9	-39.2	0	0	0	0	111.9
266	L	27.3	Very low	31.5	Very low	163 Å²	163	153 Å²	153	85%	0.853	82%	0.816	S	S	*	*	S	Bend	trans	-140.6	51.7	170.9	-165.2	96.3	0	0	0	111.2
267	T	28	Very low	31.8	Very low	127 Å²	127	148.8 Å²	148.8	78%	0.779	82%	0.816	S	S	*	*	S	Bend	trans	-158.1	30.9	173.6	-12.9	0	0	0	0	116
268	Q	27.4	Very low	32.4	Very low	203 Å²	203	147.9 Å²	147.9	95%	0.949	82%	0.816	S	S	*	*	S	Bend	trans	-157.4	68	166.3	-125.9	168.9	11.2	0	0	114.7
269	A	33.5	Very low	33.6	Very low	105 Å²	105	148.4 Å²	148.4	87%	0.868	82%	0.816	S	S	*	*			trans	-157.7	46.5	166.6	0	0	0	0	0	112.1
270	M	28.2	Very low	34.6	Very low	187 Å²	187	144 Å²	144	92%	0.921	81%	0.807	S	S	*	*			trans	-97.3	116.9	163.1	-66.5	-178.3	79.9	0	0	108.2
271	V	37.5	Very low	35.8	Very low	125 Å²	125	142.7 Å²	142.7	76%	0.758	80%	0.801	S	S	*	*			trans	159.1	126.3	154.7	152.5	0	0	0	0	107.9
272	N	37.6	Very low	37.1	Very low	142 Å²	142	141.4 Å²	141.4	76%	0.759	79%	0.786	S	S	*	*			trans	65.6	142.3	-179.8	-53.8	-9	0	0	0	115.2
273	D	38	Very low	38.1	Very low	154 Å²	154	139.1 Å²	139.1	82%	0.824	77%	0.771	S	S	*	*			cis	-142.5	175.9	1.8	-137	-47.6	0	0	0	112.7
274	G	34.1	Very low	39.5	Very low	56 Å²	56	138.6 Å²	138.6	58%	0.577	76%	0.763	S	S	*	*			trans	-65.6	162.1	-161.7	0	0	0	0	0	118.3
275	P	41.1	Very low	40.6	Very low	134 Å²	134	135.1 Å²	135.1	87%	0.87	76%	0.755	S	S	*	*			trans	-77.9	148.7	-171.9	32.4	-36.5	0	0	0	113.6
276	R	43	Very low	41.5	Very low	241 Å²	241	133.9 Å²	133.9	91%	0.909	74%	0.741	S	S	*	*			trans	-119.1	128.4	160.8	-84.7	-170	166.4	-152.3	-3.9	110.7
277	T	37.1	Very low	43.1	Very low	137 Å²	137	130.3 Å²	130.3	84%	0.84	73%	0.725	S	S	*	*			trans	-74.4	128.9	174.9	50.1	0	0	0	0	111.1
278	L	39.8	Very low	44.8	Very low	153 Å²	153	127.7 Å²	127.7	80%	0.801	71%	0.712	S	S	*	*			trans	-127.3	166.9	162.3	-72	176.3	0	0	0	109.6
279	T	52.4	Low	46.7	Very low	99 Å²	99	124.9 Å²	124.9	61%	0.607	70%	0.699	S	S	*	*			trans	-95.9	166.7	-151.1	39.7	0	0	0	0	114.8	D281 D282	T279-D281 PolarHBondContact O-N 2.96Å; T279-D282 PolarHBondContact O-N 3.1Å
280	G	50.1	Low	48.4	Very low	57 Å²	57	126.2 Å²	126.2	59%	0.588	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-23.4	-166.3	0	0	0	0	0	116.6	D282 M283	G280-D282 PolarHBondContact O-N 3.15Å; G280-M283 PolarHBondContact O-N 3.1Å
281	D	51	Low	50.5	Low	137 Å²	137	121.7 Å²	121.7	73%	0.733	66%	0.664	S	S	*	*	H	α-helix	trans	-67.7	-19.6	-178.3	-51.9	-70.9	0	0	0	113.9	T279	T279-D281 PolarHBondContact O-N 2.96Å
282	D	52.9	Low	52.3	Low	84 Å²	84	124.3 Å²	124.3	45%	0.449	66%	0.66	S	S	.	*	H	α-helix	trans	-79.1	-19.7	175.8	-73.9	-51.1	0	0	0	112.8	T279 G280 M286	T279-D282 PolarHBondContact O-N 3.1Å; G280-D282 PolarHBondContact O-N 3.15Å; D282-M286 PolarHBondContact O-N 2.98Å; D282-M286 VanDerWaalsContact O-N 3.14Å
283	M	52.7	Low	54.2	Low	107 Å²	107	120.5 Å²	120.5	53%	0.527	65%	0.648	S	S	.	*	H	α-helix	trans	-71.7	-45.3	-178.4	-70.4	-76.5	95	0	0	112.7	G280 K285 M286 V287	G280-M283 PolarHBondContact O-N 3.1Å; M283-K285 PolarHBondContact O-N 2.71Å; M283-M286 HydrophobicContact CE-SD 3.7Å; M283-M286 PolarHBondContact O-N 2.86Å; M283-M286 VanDerWaalsContact O-N 3.17Å; M283-V287 WeakPolarHBondContact O-CG2 3.44Å; M283-V287 PolarHBondContact O-N 2.95Å
284	D	56.8	Low	56.3	Low	131 Å²	131	122 Å²	122	70%	0.701	64%	0.642	S	S	*	*	H	α-helix	trans	-62.6	-29.4	178.1	-80.4	-22.6	0	0	0	112.1	S288	D284-S288 WeakPolarHBondContact O-CB 3.29Å; D284-S288 PolarHBondContact O-N 2.82Å
285	K	52.7	Low	58.3	Low	156 Å²	156	124.9 Å²	124.9	68%	0.678	64%	0.639	S	S	*	*	H	α-helix	trans	-69.6	-48.6	172.5	-110	-177.6	178.2	178.8	0	112.4	M283 V287 S288 E289	M283-K285 PolarHBondContact O-N 2.71Å; K285-V287 VanDerWaalsContact C-N 3.33Å; K285-V287 PolarHBondContact O-N 3.21Å; K285-S288 PolarHBondContact O-N 3.43Å; K285-E289 PolarHBondContact O-N 2.75Å
286	M	50.7	Low	60.2	Low	114 Å²	114	124.8 Å²	124.8	56%	0.562	63%	0.627	S	S	*	*	H	α-helix	trans	-58.6	-44.9	175.3	-80.9	-173.8	60.5	0	0	111.5	D282 M283 S288 E289 E290	D282-M286 PolarHBondContact O-N 2.98Å; D282-M286 VanDerWaalsContact O-N 3.14Å; M283-M286 HydrophobicContact CE-SD 3.7Å; M283-M286 PolarHBondContact O-N 2.86Å; M283-M286 VanDerWaalsContact O-N 3.17Å; M286-S288 VanDerWaalsContact C-N 3.34Å; M286-S288 PolarHBondContact O-N 3.2Å; M286-E289 PolarHBondContact O-N 2.87Å; M286-E290 VanDerWaalsContact O-CB 3.31Å; M286-E290 WeakPolarHBondContact O-CB 3.1Å; M286-E290 PolarHBondContact O-N 2.74Å
287	V	60	Low	61.7	Low	87 Å²	87	119 Å²	119	53%	0.527	61%	0.61	S	S	.	*	H	α-helix	trans	-61.1	-42.2	177	172	0	0	0	0	111.2	M283 K285 E289 E291	M283-V287 WeakPolarHBondContact O-CG2 3.44Å; M283-V287 PolarHBondContact O-N 2.95Å; K285-V287 VanDerWaalsContact C-N 3.33Å; K285-V287 PolarHBondContact O-N 3.21Å; V287-E289 VanDerWaalsContact C-N 3.33Å; V287-E289 PolarHBondContact O-N 2.82Å; V287-E291 WeakPolarHBondContact O-CB 3.29Å; V287-E291 PolarHBondContact O-N 3.26Å
288	S	63.8	Low	63.8	Low	73 Å²	73	118.8 Å²	118.8	51%	0.51	60%	0.6	S	S	.	*	H	α-helix	trans	-66.9	-30.3	177.6	-172.6	0	0	0	0	113.8	D284 K285 M286 R292	D284-S288 WeakPolarHBondContact O-CB 3.29Å; D284-S288 PolarHBondContact O-N 2.82Å; K285-S288 PolarHBondContact O-N 3.43Å; M286-S288 VanDerWaalsContact C-N 3.34Å; M286-S288 PolarHBondContact O-N 3.2Å; S288-R292 PolarHBondContact O-N 2.95Å
289	E	67.3	Low	65.9	Low	144 Å²	144	117.8 Å²	117.8	67%	0.673	59%	0.589	S	S	*	*	H	α-helix	trans	-84.8	-36.6	178.9	-164.7	151.4	-135.4	0	0	112	K285 M286 V287 R292 A293	K285-E289 PolarHBondContact O-N 2.75Å; M286-E289 PolarHBondContact O-N 2.87Å; V287-E289 VanDerWaalsContact C-N 3.33Å; V287-E289 PolarHBondContact O-N 2.82Å; E289-R292 WeakPolarHBondContact O-CB 3.29Å; E289-R292 PolarHBondContact O-N 3.27Å; E289-A293 PolarHBondContact O-N 3.19Å
290	E	68.9	Low	67.3	Low	133 Å²	133	121.9 Å²	121.9	62%	0.621	59%	0.593	S	S	*	*	H	α-helix	trans	-64.8	-44.9	171.7	-173	172.9	-174.8	0	0	111.6	M286 R292 A293 R294	M286-E290 VanDerWaalsContact O-CB 3.31Å; M286-E290 WeakPolarHBondContact O-CB 3.1Å; M286-E290 PolarHBondContact O-N 2.74Å; E290-R292 PolarHBondContact O-N 2.72Å; E290-A293 PolarHBondContact O-N 2.97Å; E290-R294 VanDerWaalsContact O-CB 3.29Å; E290-R294 WeakPolarHBondContact O-CB 3.38Å; E290-R294 PolarHBondContact O-N 3.42Å
291	E	73.2	Confident	68.8	Low	91 Å²	91	124.5 Å²	124.5	43%	0.425	59%	0.59	S	S	.	*	H	α-helix	trans	-55.7	-34.4	171.6	-179.8	69.6	-148.2	0	0	111.9	V287 K295	V287-E291 WeakPolarHBondContact O-CB 3.29Å; V287-E291 PolarHBondContact O-N 3.26Å; E291-K295 PolarHBondContact O-N 2.86Å; E291-K295 IonicContact OE1-NZ 2.56Å; E291-K295 PolarHBondContact OE1-NZ 3.23Å
292	R	75.3	Confident	70.1	Confident	181 Å²	181	124.3 Å²	124.3	68%	0.683	59%	0.585	S	S	*	*	H	α-helix	trans	-74.6	-47	178.7	-155.2	-177.2	-155.8	111	1.2	111.8	S288 E289 E290 R294 K295 E296	S288-R292 PolarHBondContact O-N 2.95Å; E289-R292 WeakPolarHBondContact O-CB 3.29Å; E289-R292 PolarHBondContact O-N 3.27Å; E290-R292 PolarHBondContact O-N 2.72Å; R292-R294 VanDerWaalsContact C-N 3.28Å; R292-R294 PolarHBondContact O-N 3.35Å; R292-K295 PolarHBondContact O-N 3.15Å; R292-E296 PolarHBondContact O-N 2.93Å
293	A	77.9	Confident	71.4	Confident	61 Å²	61	126 Å²	126	50%	0.504	59%	0.59	S	S	.	*	H	α-helix	trans	-60.1	-39.5	174.3	0	0	0	0	0	111.5	E289 E290 E296 Q297	E289-A293 PolarHBondContact O-N 3.19Å; E290-A293 PolarHBondContact O-N 2.97Å; A293-E296 PolarHBondContact O-N 3.22Å; A293-Q297 PolarHBondContact O-N 3.38Å
294	R	80.9	Confident	72.7	Confident	186 Å²	186	125.8 Å²	125.8	70%	0.702	59%	0.588	S	S	*	*	H	α-helix	trans	-63.6	-43.8	178	-155	175.6	-163.9	-169.7	6.2	112.2	E290 R292 Q297 E298	E290-R294 VanDerWaalsContact O-CB 3.29Å; E290-R294 WeakPolarHBondContact O-CB 3.38Å; E290-R294 PolarHBondContact O-N 3.42Å; R292-R294 VanDerWaalsContact C-N 3.28Å; R292-R294 PolarHBondContact O-N 3.35Å; R294-Q297 PolarHBondContact O-N 2.92Å; R294-E298 WeakPolarHBondContact O-CB 3.43Å; R294-E298 PolarHBondContact O-N 3.31Å
295	K	77.9	Confident	73.7	Confident	116 Å²	116	125.9 Å²	125.9	50%	0.504	58%	0.582	S	S	.	*	H	α-helix	trans	-65.6	-35.7	173.2	-77.6	-168.6	173.5	78.3	0	113.4	E291 R292 K299	E291-K295 PolarHBondContact O-N 2.86Å; E291-K295 IonicContact OE1-NZ 2.56Å; E291-K295 PolarHBondContact OE1-NZ 3.23Å; R292-K295 PolarHBondContact O-N 3.15Å; K295-K299 WeakPolarHBondContact O-CB 3.37Å; K295-K299 PolarHBondContact O-N 2.86Å
296	E	79.3	Confident	74.7	Confident	133 Å²	133	120.5 Å²	120.5	62%	0.621	57%	0.566	S	S	*	*	H	α-helix	trans	-73.1	-33.2	177.5	-171.2	156.6	-163.1	0	0	112.4	R292 A293 R300	R292-E296 PolarHBondContact O-N 2.93Å; A293-E296 PolarHBondContact O-N 3.22Å; E296-R300 PolarHBondContact O-N 2.64Å
297	Q	74.7	Confident	75.8	Confident	120 Å²	120	117.7 Å²	117.7	56%	0.561	56%	0.562	S	S	*	*	H	α-helix	trans	-70.9	-43.2	169.8	-176.5	165.2	-28.5	0	0	112.4	A293 R294 K299 R300 E301	A293-Q297 PolarHBondContact O-N 3.38Å; R294-Q297 PolarHBondContact O-N 2.92Å; Q297-K299 VanDerWaalsContact C-N 3.29Å; Q297-K299 PolarHBondContact O-N 2.83Å; Q297-R300 WeakPolarHBondContact O-CB 3.48Å; Q297-R300 PolarHBondContact O-N 2.85Å; Q297-R300 VanDerWaalsContact O-N 3.07Å; Q297-E301 HydrophobicContact CG-CG 4.44Å; Q297-E301 PolarHBondContact NE2-OE1 2.91Å; Q297-E301 PolarHBondContact O-N 2.92Å
298	E	82.4	Confident	76.1	Confident	132 Å²	132	121.6 Å²	121.6	62%	0.617	57%	0.567	S	S	*	*	H	α-helix	trans	-57	-43.3	173.8	-178.5	174.1	-148	0	0	111.2	R294 R300 E301 E302	R294-E298 WeakPolarHBondContact O-CB 3.43Å; R294-E298 PolarHBondContact O-N 3.31Å; E298-R300 PolarHBondContact O-N 3.2Å; E298-E301 PolarHBondContact O-N 2.84Å; E298-E302 PolarHBondContact O-N 2.85Å
299	K	82.3	Confident	76.1	Confident	131 Å²	131	125.8 Å²	125.8	57%	0.57	57%	0.571	S	S	*	*	H	α-helix	trans	-60.6	-44	173.2	-173.7	-168.8	171.1	-161.4	0	112.1	K295 Q297 E302 E303	K295-K299 WeakPolarHBondContact O-CB 3.37Å; K295-K299 PolarHBondContact O-N 2.86Å; Q297-K299 VanDerWaalsContact C-N 3.29Å; Q297-K299 PolarHBondContact O-N 2.83Å; K299-E302 PolarHBondContact O-N 2.84Å; K299-E303 VanDerWaalsContact O-CB 3.29Å; K299-E303 WeakPolarHBondContact O-CB 3.39Å; K299-E303 PolarHBondContact O-N 2.96Å
300	R	82.7	Confident	75.8	Confident	185 Å²	185	124.6 Å²	124.6	70%	0.698	57%	0.569	S	S	*	*	H	α-helix	trans	-64	-41.3	176.6	-102.3	-176	176.5	163.1	2.8	112.5	E296 Q297 E298 E302 E303 E304	E296-R300 PolarHBondContact O-N 2.64Å; Q297-R300 WeakPolarHBondContact O-CB 3.48Å; Q297-R300 PolarHBondContact O-N 2.85Å; Q297-R300 VanDerWaalsContact O-N 3.07Å; E298-R300 PolarHBondContact O-N 3.2Å; R300-E302 VanDerWaalsContact C-N 3.35Å; R300-E303 PolarHBondContact O-N 2.8Å; R300-E304 WeakPolarHBondContact O-CB 3.38Å; R300-E304 PolarHBondContact O-N 2.8Å
301	E	80.5	Confident	75	Confident	112 Å²	112	125.1 Å²	125.1	52%	0.523	58%	0.576	S	S	.	*	H	α-helix	trans	-66.8	-36.3	175.9	-73	-178.6	-156.6	0	0	111.3	Q297 E298 K305	Q297-E301 HydrophobicContact CG-CG 4.44Å; Q297-E301 PolarHBondContact NE2-OE1 2.91Å; Q297-E301 PolarHBondContact O-N 2.92Å; E298-E301 PolarHBondContact O-N 2.84Å; E301-K305 WeakPolarHBondContact O-CB 3.39Å; E301-K305 PolarHBondContact O-N 3.46Å
302	E	80	Confident	74	Confident	134 Å²	134	125.6 Å²	125.6	63%	0.626	59%	0.585	S	S	*	*	H	α-helix	trans	-68.9	-39.9	172	-174.9	162.1	-131	0	0	112.6	E298 K299 R300 K305 A306	E298-E302 PolarHBondContact O-N 2.85Å; K299-E302 PolarHBondContact O-N 2.84Å; R300-E302 VanDerWaalsContact C-N 3.35Å; E302-K305 CarbonylContact O-C 3.49Å; E302-K305 PolarHBondContact O-N 2.91Å; E302-A306 WeakPolarHBondContact O-CB 3.49Å; E302-A306 PolarHBondContact O-N 3.43Å
303	E	80.4	Confident	72.8	Confident	120 Å²	120	122.6 Å²	122.6	56%	0.561	58%	0.578	S	S	*	*	H	α-helix	trans	-67.7	-40.1	178.1	-164.6	162	-125.2	0	0	111.6	K299 R300 A306 A307	K299-E303 VanDerWaalsContact O-CB 3.29Å; K299-E303 WeakPolarHBondContact O-CB 3.39Å; K299-E303 PolarHBondContact O-N 2.96Å; R300-E303 PolarHBondContact O-N 2.8Å; E303-A306 PolarHBondContact O-N 3.08Å; E303-A307 PolarHBondContact O-N 2.94Å
304	E	78.7	Confident	71.4	Confident	101 Å²	101	126.8 Å²	126.8	47%	0.472	59%	0.592	S	S	.	*	H	α-helix	trans	-67.3	-38.3	171	-164.3	-171	141.3	0	0	111.7	R300 A306 A307 R308	R300-E304 WeakPolarHBondContact O-CB 3.38Å; R300-E304 PolarHBondContact O-N 2.8Å; E304-A306 VanDerWaalsContact C-N 3.28Å; E304-A306 PolarHBondContact O-N 2.99Å; E304-A307 PolarHBondContact O-N 3.28Å; E304-R308 WeakPolarHBondContact O-CB 3.45Å; E304-R308 VanDerWaalsContact O-CG 3.3Å; E304-R308 WeakPolarHBondContact O-CG 3.49Å; E304-R308 PolarHBondContact O-N 3.35Å; E304-R308 IonicContact OE1-CZ 3.59Å; E304-R308 IonicContact OE1-NE 3.76Å; E304-R308 PolarHBondContact OE1-NE 2.94Å; E304-R308 IonicContact OE1-NH2 2.68Å; E304-R308 PolarHBondContact OE1-NH2 2.76Å
305	K	77.9	Confident	69.9	Low	133 Å²	133	122.9 Å²	122.9	58%	0.578	59%	0.585	S	S	*	*	H	α-helix	trans	-72.5	-19.7	176.5	-169.8	177.1	-164.1	169	0	112.9	E301 E302 R309	E301-K305 WeakPolarHBondContact O-CB 3.39Å; E301-K305 PolarHBondContact O-N 3.46Å; E302-K305 CarbonylContact O-C 3.49Å; E302-K305 PolarHBondContact O-N 2.91Å; K305-R309 WeakPolarHBondContact O-CD 3.32Å; K305-R309 VanDerWaalsContact O-CG 3.31Å; K305-R309 WeakPolarHBondContact O-CG 3.43Å
306	A	74.9	Confident	68.5	Low	43 Å²	43	123.4 Å²	123.4	36%	0.355	59%	0.588	S	S	.	*	H	α-helix	trans	-78.1	-45.5	166.4	0	0	0	0	0	111.1	E302 E303 E304 R308 R309 I310	E302-A306 WeakPolarHBondContact O-CB 3.49Å; E302-A306 PolarHBondContact O-N 3.43Å; E303-A306 PolarHBondContact O-N 3.08Å; E304-A306 VanDerWaalsContact C-N 3.28Å; E304-A306 PolarHBondContact O-N 2.99Å; A306-R308 PolarHBondContact O-N 2.82Å; A306-R309 WeakPolarHBondContact O-CB 3.41Å; A306-R309 PolarHBondContact O-N 2.7Å; A306-I310 PolarHBondContact O-N 3.14Å
307	A	73.3	Confident	67.3	Low	56 Å²	56	124.8 Å²	124.8	46%	0.463	60%	0.6	S	S	.	*	H	α-helix	trans	-58	-46.3	174	0	0	0	0	0	111.9	E303 E304 R309 I310 D311	E303-A307 PolarHBondContact O-N 2.94Å; E304-A307 PolarHBondContact O-N 3.28Å; A307-R309 PolarHBondContact O-N 3.15Å; A307-I310 PolarHBondContact O-N 2.98Å; A307-I310 VanDerWaalsContact O-N 3.12Å; A307-D311 PolarHBondContact O-N 3.14Å
308	R	66.9	Low	66.2	Low	169 Å²	169	120.9 Å²	120.9	64%	0.638	59%	0.588	S	S	*	*	H	α-helix	trans	-66	-9.5	174.2	-70.2	173.9	-179.6	-113.6	11.3	114.7	E304 A306 V312	E304-R308 WeakPolarHBondContact O-CB 3.45Å; E304-R308 VanDerWaalsContact O-CG 3.3Å; E304-R308 WeakPolarHBondContact O-CG 3.49Å; E304-R308 PolarHBondContact O-N 3.35Å; E304-R308 IonicContact OE1-CZ 3.59Å; E304-R308 IonicContact OE1-NE 3.76Å; E304-R308 PolarHBondContact OE1-NE 2.94Å; E304-R308 IonicContact OE1-NH2 2.68Å; E304-R308 PolarHBondContact OE1-NH2 2.76Å; A306-R308 PolarHBondContact O-N 2.82Å; R308-V312 WeakPolarHBondContact O-CG2 3.35Å
309	R	63.4	Low	64.9	Low	160 Å²	160	122.1 Å²	122.1	60%	0.604	59%	0.593	S	S	*	*	H	α-helix	trans	-87.7	-39	168.9	-80.1	169.4	176.1	165.4	1.6	111.6	K305 A306 A307 D311 V312 E313	K305-R309 WeakPolarHBondContact O-CD 3.32Å; K305-R309 VanDerWaalsContact O-CG 3.31Å; K305-R309 WeakPolarHBondContact O-CG 3.43Å; A306-R309 WeakPolarHBondContact O-CB 3.41Å; A306-R309 PolarHBondContact O-N 2.7Å; A307-R309 PolarHBondContact O-N 3.15Å; R309-D311 VanDerWaalsContact C-N 3.32Å; R309-D311 PolarHBondContact O-N 2.83Å; R309-V312 PolarHBondContact O-N 2.84Å; R309-V312 VanDerWaalsContact O-N 3.11Å; R309-E313 PolarHBondContact O-N 3.43Å
310	I	59.6	Low	64.2	Low	120 Å²	120	120.9 Å²	120.9	62%	0.615	59%	0.59	S	S	*	*	H	α-helix	trans	-63.4	-40.9	177.9	-63.2	166.9	0	0	0	110.3	A306 A307 V312 E313	A306-I310 PolarHBondContact O-N 3.14Å; A307-I310 PolarHBondContact O-N 2.98Å; A307-I310 VanDerWaalsContact O-N 3.12Å; I310-V312 PolarHBondContact O-N 2.78Å; I310-V312 VanDerWaalsContact O-N 3.1Å; I310-E313 PolarHBondContact O-N 3.38Å; I310-E313 VanDerWaalsContact O-N 3.09Å
311	D	52.1	Low	64.2	Low	143 Å²	143	119.5 Å²	119.5	77%	0.765	59%	0.589	S	S	*	*	H	α-helix	trans	-68.4	-4.6	176.5	-130.3	27.7	0	0	0	114	A307 R309	A307-D311 PolarHBondContact O-N 3.14Å; R309-D311 VanDerWaalsContact C-N 3.32Å; R309-D311 PolarHBondContact O-N 2.83Å
312	V	54.2	Low	64.6	Low	102 Å²	102	117.5 Å²	117.5	62%	0.618	59%	0.585	S	S	*	*	H	α-helix	trans	-108.3	-12.8	175	175.2	0	0	0	0	111.7	R308 R309 I310	R308-V312 WeakPolarHBondContact O-CG2 3.35Å; R309-V312 PolarHBondContact O-N 2.84Å; R309-V312 VanDerWaalsContact O-N 3.11Å; I310-V312 PolarHBondContact O-N 2.78Å; I310-V312 VanDerWaalsContact O-N 3.1Å
313	E	49.5	Very low	65.2	Low	117 Å²	117	115.3 Å²	115.3	55%	0.547	58%	0.577	S	S	.	*	H	α-helix	trans	-84.1	-16.6	176.2	-71.9	-178.9	161	0	0	112.9	R309 I310 D315	R309-E313 PolarHBondContact O-N 3.43Å; I310-E313 PolarHBondContact O-N 3.38Å; I310-E313 VanDerWaalsContact O-N 3.09Å; E313-D315 VanDerWaalsContact C-N 3.32Å
314	D	48.2	Very low	65.8	Low	150 Å²	150	111.7 Å²	111.7	80%	0.802	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-82.3	-5.4	171.5	-134.8	32.3	0	0	0	112.6	F316	D314-F316 PolarHBondContact O-N 2.9Å
315	D	49.2	Very low	66.5	Low	103 Å²	103	113.6 Å²	113.6	55%	0.551	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-82.2	14	175.8	-159.8	45.7	0	0	0	113	E313 D317 A318	E313-D315 VanDerWaalsContact C-N 3.32Å; D315-D317 PolarHBondContact O-N 2.99Å; D315-A318 WeakPolarHBondContact O-CB 3.43Å; D315-A318 PolarHBondContact O-N 3.07Å; D315-A318 VanDerWaalsContact OD1-CB 3.25Å; D315-A318 WeakPolarHBondContact OD1-CB 3.3Å
316	F	49.2	Very low	67.2	Low	127 Å²	127	107.4 Å²	107.4	56%	0.557	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-66.6	-21.8	-177	-140.4	-94.7	0	0	0	113.3	W82 D314 A318	W82-F316 HydrophobicContact CE3-CE2 4.46Å; W82-F316 HydrophobicContact CH2-CE2 4.35Å; W82-F316 HydrophobicContact CZ3-CD2 4.12Å; W82-F316 AromaticContact CZ3-CE2 3.58Å; W82-F316 HydrophobicContact CZ3-CE2 3.58Å; W82-F316 HydrophobicContact CZ3-CZ 4.02Å; D314-F316 PolarHBondContact O-N 2.9Å; F316-A318 VanDerWaalsContact C-N 3.3Å; F316-A318 PolarHBondContact O-N 2.82Å
317	D	52.8	Low	68	Low	163 Å²	163	112.9 Å²	112.9	87%	0.872	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-75.1	-12.6	172.6	-79.6	-18.9	0	0	0	113.2	D315 Q319	D315-D317 PolarHBondContact O-N 2.99Å; D317-Q319 VanDerWaalsContact C-N 3.35Å; D317-Q319 PolarHBondContact O-N 2.95Å
318	A	51.9	Low	68.9	Low	38 Å²	38	115 Å²	115	31%	0.314	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-83.9	-2	-174.8	0	0	0	0	0	115.2	D315 F316	D315-A318 WeakPolarHBondContact O-CB 3.43Å; D315-A318 PolarHBondContact O-N 3.07Å; D315-A318 VanDerWaalsContact OD1-CB 3.25Å; D315-A318 WeakPolarHBondContact OD1-CB 3.3Å; F316-A318 VanDerWaalsContact C-N 3.3Å; F316-A318 PolarHBondContact O-N 2.82Å
319	Q	54.6	Low	70.1	Confident	157 Å²	157	108.5 Å²	108.5	73%	0.734	55%	0.547	S	S	*	.	S	Bend	trans	-93	-23.4	-173.1	-64.6	-167.2	0.6	0	0	115.2	D317 K321	D317-Q319 VanDerWaalsContact C-N 3.35Å; D317-Q319 PolarHBondContact O-N 2.95Å; Q319-K321 PolarHBondContact O-N 3.12Å
320	E	68.5	Low	71.7	Confident	106 Å²	106	103.8 Å²	103.8	50%	0.495	53%	0.529	S	S	.	.			trans	-80.4	60.8	171.2	-76.8	-169	-173.5	0	0	111.6	F334 R348	E320-F334 HydrophobicContact CB-CD1 4.01Å; E320-F334 HydrophobicContact CB-CE1 3.96Å; E320-F334 HydrophobicContact CG-CD1 4.47Å; E320-F334 WeakPolarHBondContact O-CE1 3.13Å; E320-R348 IonicContact OE1-CZ 3.57Å; E320-R348 IonicContact OE1-NH1 3.68Å; E320-R348 PolarHBondContact OE1-NH1 3.41Å; E320-R348 IonicContact OE1-NH2 2.67Å; E320-R348 PolarHBondContact OE1-NH2 3.42Å; E320-R348 IonicContact OE2-CZ 2.67Å; E320-R348 IonicContact OE2-NH2 2.64Å; E320-R348 PolarHBondContact OE2-NH2 3.05Å
321	K	82.3	Confident	73.6	Confident	156 Å²	156	98.2 Å²	98.2	68%	0.678	50%	0.5	S	S	*	.			trans	-74.7	126.6	168.4	-74.3	179.5	-177.7	171.7	0	109.6	Q319	Q319-K321 PolarHBondContact O-N 3.12Å
322	P	89.8	Confident	75.7	Confident	69 Å²	69	93 Å²	93	45%	0.448	47%	0.473	S	S	.	.			trans	-71.1	132.9	178.8	29.9	-35.1	0	0	0	110.6	L332 K333 F334	P322-L332 HydrophobicContact CB-CB 3.96Å; P322-L332 HydrophobicContact CB-CD1 4.28Å; P322-L332 HydrophobicContact CB-CD2 4.16Å; P322-L332 HydrophobicContact CB-CG 4.36Å; P322-L332 HydrophobicContact CG-CD1 4.29Å; P322-L332 HydrophobicContact CG-CD2 4.34Å; P322-K333 CarbonylContact C-O 3.49Å; P322-K333 WeakPolarHBondContact CA-O 3.13Å; P322-F334 HydrophobicContact CB-CE1 4.25Å
323	I	92.1	Very high	77.7	Confident	89 Å²	89	89.1 Å²	89.1	46%	0.456	45%	0.447	S	S	.	.	S	Bend	trans	-91.7	-21.8	-177	53.3	162.1	0	0	0	113.4	K333 D335	I323-K333 HydrophobicContact CD1-CD 3.77Å; I323-K333 HydrophobicContact CD1-CG 4.07Å; I323-K333 HydrophobicContact CG1-CB 4.2Å; I323-K333 HydrophobicContact CG1-CD 3.93Å; I323-K333 HydrophobicContact CG1-CG 3.94Å; I323-K333 WeakPolarHBondContact CG1-O 3.39Å; I323-K333 PolarHBondContact N-O 2.89Å; I323-D335 HydrophobicContact CD1-CB 3.98Å; I323-D335 HydrophobicContact CG2-CB 4.16Å
324	D	91.9	Very high	79.9	Confident	44 Å²	44	84.2 Å²	84.2	24%	0.235	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	165.5	173.9	-163.6	8.4	0	0	0	110.2	K333 W360 Y409	D324-K333 HydrophobicContact CB-CB 3.89Å; D324-K333 HydrophobicContact CB-CD 3.84Å; D324-K333 PolarHBondContact O-N 2.97Å; D324-W360 HydrophobicContact CB-CH2 4.14Å; D324-W360 HydrophobicContact CB-CZ2 3.96Å; D324-W360 WeakPolarHBondContact OD2-CZ2 3.41Å; D324-Y409 PolarHBondContact OD2-OH 2.97Å
325	K	93.6	Very high	82	Confident	141 Å²	141	83.4 Å²	83.4	61%	0.613	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.8	144.9	179.8	64.7	-173.7	178	-177.2	0	111.8	F331 L332	K325-F331 CarbonylContact C-O 3.53Å; K325-F331 WeakPolarHBondContact CA-O 3.21Å; K325-L332 HydrophobicContact CB-CD2 3.86Å
326	S	94	Very high	84.1	Confident	3 Å²	3	82 Å²	82	2%	0.021	41%	0.41	C	S	.	.			trans	-56.2	157.8	170.9	57.3	0	0	0	0	113	N328 G329 R330 F331	S326-N328 WeakPolarHBondContact CB-OD1 3.47Å; S326-N328 PolarHBondContact O-N 3.13Å; S326-N328 PolarHBondContact OG-OD1 3.43Å; S326-G329 WeakPolarHBondContact O-CA 3.45Å; S326-G329 PolarHBondContact O-N 3.13Å; S326-G329 PolarHBondContact OG-N 3.44Å; S326-R330 PolarHBondContact OG-N 2.93Å; S326-F331 PolarHBondContact N-O 2.96Å; S326-F331 PolarHBondContact OG-N 2.95Å; S326-F331 PolarHBondContact OG-O 2.94Å
327	K	90.6	Very high	86.2	Confident	158 Å²	158	80.2 Å²	80.2	69%	0.687	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-28.3	-176.2	-62.2	-177.9	-177.3	177.5	0	114.1	W398 E399	K327-W398 HydrophobicContact CD-CB 4.3Å; K327-W398 HydrophobicContact CD-CG 4.45Å; K327-W398 HydrophobicContact CG-CG 4.41Å; K327-E399 WeakPolarHBondContact CE-O 3.14Å; K327-E399 PolarHBondContact NZ-O 3.19Å
328	N	92.1	Very high	88	Confident	100 Å²	100	76 Å²	76	54%	0.535	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-1.9	173.7	56	8.1	0	0	0	113	S326 R330	S326-N328 WeakPolarHBondContact CB-OD1 3.47Å; S326-N328 PolarHBondContact O-N 3.13Å; S326-N328 PolarHBondContact OG-OD1 3.43Å; N328-R330 PolarHBondContact O-N 2.97Å; N328-R330 WeakPolarHBondContact OD1-CB 3.34Å; N328-R330 PolarHBondContact OD1-N 3.32Å
329	G	93.4	Very high	89.6	Confident	33 Å²	33	75.6 Å²	75.6	34%	0.34	38%	0.38	S	S	.	.	S	Bend	trans	76.6	-4.7	-178.2	0	0	0	0	0	115.4	S326	S326-G329 WeakPolarHBondContact O-CA 3.45Å; S326-G329 PolarHBondContact O-N 3.13Å; S326-G329 PolarHBondContact OG-N 3.44Å
330	R	96.9	Very high	91	Very high	60 Å²	60	76.5 Å²	76.5	23%	0.226	38%	0.377	C	S	.	.			trans	-64.7	-45.5	-174.6	177	178.5	176.2	162.6	-10.1	113.4	S326 N328 D351 T352 E353	S326-R330 PolarHBondContact OG-N 2.93Å; N328-R330 PolarHBondContact O-N 2.97Å; N328-R330 WeakPolarHBondContact OD1-CB 3.34Å; N328-R330 PolarHBondContact OD1-N 3.32Å; R330-D351 VanDerWaalsContact CG-OD1 3.25Å; R330-D351 WeakPolarHBondContact CG-OD1 3.14Å; R330-D351 IonicContact CZ-OD1 3.64Å; R330-D351 IonicContact CZ-OD2 2.93Å; R330-D351 IonicContact NE-OD1 3.18Å; R330-D351 PolarHBondContact NE-OD1 2.77Å; R330-D351 IonicContact NE-OD2 3.93Å; R330-D351 PolarHBondContact NE-OD2 2.89Å; R330-D351 IonicContact NH2-OD1 2.67Å; R330-D351 IonicContact NH2-OD2 3.27Å; R330-D351 PolarHBondContact NH2-OD2 2.81Å; R330-T352 WeakPolarHBondContact O-CB 3.28Å; R330-T352 WeakPolarHBondContact O-CG2 3.45Å; R330-T352 PolarHBondContact O-N 2.88Å; R330-T352 PolarHBondContact O-OG1 3.17Å; R330-E353 VanDerWaalsContact CD-CD 3.44Å; R330-E353 WeakPolarHBondContact CD-OE1 3.42Å; R330-E353 HydrophobicContact CG-CB 4.49Å; R330-E353 HydrophobicContact CG-CG 3.99Å; R330-E353 IonicContact CZ-OE2 3.72Å; R330-E353 IonicContact NE-OE1 3.81Å; R330-E353 IonicContact NE-OE2 2.73Å; R330-E353 PolarHBondContact NE-OE2 2.89Å; R330-E353 IonicContact NH1-OE1 3.74Å; R330-E353 IonicContact NH1-OE2 3.43Å; R330-E353 PolarHBondContact NH1-OE2 2.95Å; R330-E353 IonicContact NH2-OE2 3.45Å
331	F	97.8	Very high	91	Very high	3 Å²	3	73.4 Å²	73.4	1%	0.013	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	135.7	-179.9	-51.3	-71.5	0	0	0	110.9	K325 S326 L350 D351 V358 W360 D396 W398 V413	K325-F331 CarbonylContact C-O 3.53Å; K325-F331 WeakPolarHBondContact CA-O 3.21Å; S326-F331 PolarHBondContact N-O 2.96Å; S326-F331 PolarHBondContact OG-N 2.95Å; S326-F331 PolarHBondContact OG-O 2.94Å; F331-L350 WeakPolarHBondContact CA-O 3.49Å; F331-D351 HydrophobicContact CD1-CB 3.87Å; F331-D351 HydrophobicContact CE1-CB 3.8Å; F331-V358 HydrophobicContact CD1-CG2 4.31Å; F331-W360 HydrophobicContact CB-CE3 4.37Å; F331-W360 HydrophobicContact CB-CZ3 4.15Å; F331-D396 HydrophobicContact CE2-CB 3.76Å; F331-D396 HydrophobicContact CZ-CB 4.43Å; F331-W398 HydrophobicContact CB-CH2 4.26Å; F331-W398 HydrophobicContact CD2-CH2 4.04Å; F331-W398 AromaticContact CD2-CZ3 3.9Å; F331-W398 HydrophobicContact CD2-CZ3 3.9Å; F331-V413 HydrophobicContact CB-CG2 4.3Å; F331-V413 HydrophobicContact CD1-CG1 3.73Å; F331-V413 HydrophobicContact CD2-CB 4.46Å; F331-V413 HydrophobicContact CD2-CG1 4.46Å; F331-V413 HydrophobicContact CD2-CG2 3.99Å; F331-V413 HydrophobicContact CE1-CG1 3.92Å; F331-V413 HydrophobicContact CE2-CG2 4.49Å; F331-V413 HydrophobicContact CG-CB 4.45Å; F331-V413 HydrophobicContact CG-CG1 4.01Å; F331-V413 HydrophobicContact CG-CG2 4.03Å; F331-V413 HydrophobicContact CZ-CG1 4.37Å
332	L	96.6	Very high	90.1	Very high	35 Å²	35	70.7 Å²	70.7	18%	0.183	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	144.5	173.7	-60.3	177.9	0	0	0	110.3	P322 K325 F334 G349 L350 T352	P322-L332 HydrophobicContact CB-CB 3.96Å; P322-L332 HydrophobicContact CB-CD1 4.28Å; P322-L332 HydrophobicContact CB-CD2 4.16Å; P322-L332 HydrophobicContact CB-CG 4.36Å; P322-L332 HydrophobicContact CG-CD1 4.29Å; P322-L332 HydrophobicContact CG-CD2 4.34Å; K325-L332 HydrophobicContact CB-CD2 3.86Å; L332-F334 HydrophobicContact CB-CZ 4.4Å; L332-G349 CarbonylContact O-C 3.57Å; L332-G349 WeakPolarHBondContact O-CA 3.27Å; L332-L350 PolarHBondContact N-O 3.35Å; L332-L350 PolarHBondContact O-N 3.24Å; L332-T352 HydrophobicContact CD1-CG2 3.64Å; L332-T352 HydrophobicContact CG-CG2 3.75Å
333	K	96.3	Very high	89.1	Confident	19 Å²	19	71.3 Å²	71.3	8%	0.083	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	138.3	173.5	-172.8	-169.5	-177.3	178.8	0	110.4	P322 I323 D324 F347 W360 E362	P322-K333 CarbonylContact C-O 3.49Å; P322-K333 WeakPolarHBondContact CA-O 3.13Å; I323-K333 HydrophobicContact CD1-CD 3.77Å; I323-K333 HydrophobicContact CD1-CG 4.07Å; I323-K333 HydrophobicContact CG1-CB 4.2Å; I323-K333 HydrophobicContact CG1-CD 3.93Å; I323-K333 HydrophobicContact CG1-CG 3.94Å; I323-K333 WeakPolarHBondContact CG1-O 3.39Å; I323-K333 PolarHBondContact N-O 2.89Å; D324-K333 HydrophobicContact CB-CB 3.89Å; D324-K333 HydrophobicContact CB-CD 3.84Å; D324-K333 PolarHBondContact O-N 2.97Å; K333-F347 HydrophobicContact CG-CB 4.15Å; K333-F347 HydrophobicContact CG-CG 4.46Å; K333-W360 HydrophobicContact CB-CD2 3.74Å; K333-W360 HydrophobicContact CB-CE3 3.85Å; K333-W360 HydrophobicContact CB-CG 4.29Å; K333-W360 HydrophobicContact CB-CH2 3.95Å; K333-W360 HydrophobicContact CB-CZ2 3.89Å; K333-W360 HydrophobicContact CB-CZ3 3.95Å; K333-W360 HydrophobicContact CD-CD2 4.36Å; K333-W360 HydrophobicContact CD-CG 4.47Å; K333-W360 HydrophobicContact CD-CZ2 4.11Å; K333-W360 HydrophobicContact CG-CD2 3.97Å; K333-W360 HydrophobicContact CG-CG 4.03Å; K333-W360 HydrophobicContact CG-CZ2 4.38Å; K333-E362 WeakPolarHBondContact CE-OE1 3.46Å; K333-E362 IonicContact NZ-OE1 3.14Å; K333-E362 PolarHBondContact NZ-OE1 3.48Å; K333-E362 IonicContact NZ-OE2 3.72Å; K333-E362 PolarHBondContact NZ-OE2 2.86Å
334	F	95.2	Very high	88.5	Confident	15 Å²	15	69.8 Å²	69.8	7%	0.066	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	160	169.8	-54.7	-81.2	0	0	0	111.2	E320 P322 L332 E336 R348 L350	E320-F334 HydrophobicContact CB-CD1 4.01Å; E320-F334 HydrophobicContact CB-CE1 3.96Å; E320-F334 HydrophobicContact CG-CD1 4.47Å; E320-F334 WeakPolarHBondContact O-CE1 3.13Å; P322-F334 HydrophobicContact CB-CE1 4.25Å; L332-F334 HydrophobicContact CB-CZ 4.4Å; F334-E336 PolarHBondContact O-N 3Å; F334-R348 PolarHBondContact N-O 3.39Å; F334-L350 HydrophobicContact CE2-CB 3.66Å; F334-L350 HydrophobicContact CZ-CB 4.02Å
335	D	92.3	Very high	88.3	Confident	133 Å²	133	68.3 Å²	68.3	71%	0.711	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	45.7	178.3	-156.4	28.9	0	0	0	112.6	I323	I323-D335 HydrophobicContact CD1-CB 3.98Å; I323-D335 HydrophobicContact CG2-CB 4.16Å
336	E	93.5	Very high	88.1	Confident	72 Å²	72	62.5 Å²	62.5	34%	0.336	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	93.8	173.9	-173.2	-178	159.7	0	0	108.2	F334 L338 F347 R348	F334-E336 PolarHBondContact O-N 3Å; E336-L338 HydrophobicContact CG-CD2 4.25Å; E336-L338 PolarHBondContact O-N 3.25Å; E336-F347 CarbonylContact O-C 3.55Å; E336-F347 VanDerWaalsContact O-CA 3.32Å; E336-F347 WeakPolarHBondContact O-CA 3.45Å; E336-R348 HydrophobicContact CB-CB 4.01Å; E336-R348 HydrophobicContact CG-CB 4.42Å; E336-R348 PolarHBondContact O-N 2.76Å; E336-R348 WeakPolarHBondContact OE2-CD 3.38Å; E336-R348 IonicContact OE2-CZ 2.73Å; E336-R348 IonicContact OE2-NE 2.72Å; E336-R348 IonicContact OE2-NH1 3.73Å; E336-R348 PolarHBondContact OE2-NH1 3.29Å
337	E	93.9	Very high	88.2	Confident	90 Å²	90	63.5 Å²	63.5	42%	0.421	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	113.1	172.2	-168.4	-176.8	109.4	0	0	109.1	R340 T345 V346 F347	E337-R340 WeakPolarHBondContact OE1-CB 3.38Å; E337-R340 WeakPolarHBondContact OE1-CD 3.24Å; E337-R340 IonicContact OE2-NH1 2.64Å; E337-R340 PolarHBondContact OE2-NH1 2.95Å; E337-T345 HydrophobicContact CG-CG2 3.69Å; E337-T345 WeakPolarHBondContact OE2-CG2 3.47Å; E337-V346 CarbonylContact C-O 3.54Å; E337-F347 HydrophobicContact CB-CD1 4.4Å; E337-F347 HydrophobicContact CB-CE1 4.26Å
338	L	90.5	Very high	88.5	Confident	74 Å²	74	58.7 Å²	58.7	39%	0.387	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-22	179.2	-63.5	175.7	0	0	0	112.6	E336 V346 R348 L416	E336-L338 HydrophobicContact CG-CD2 4.25Å; E336-L338 PolarHBondContact O-N 3.25Å; L338-V346 HydrophobicContact CB-CG1 4.33Å; L338-V346 HydrophobicContact CD1-CG1 4.42Å; L338-V346 PolarHBondContact N-O 3.02Å; L338-R348 HydrophobicContact CD1-CB 4.02Å; L338-R348 HydrophobicContact CD2-CB 4.27Å; L338-R348 HydrophobicContact CG-CB 4.16Å; L338-L416 HydrophobicContact CD1-CD1 3.45Å; L338-L416 VanDerWaalsContact CD1-CD1 3.45Å
339	G	85.1	Confident	88.7	Confident	30 Å²	30	54 Å²	54	31%	0.309	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	169.1	160.9	176.9	0	0	0	0	0	113.4	V346	G339-V346 PolarHBondContact N-O 2.73Å; G339-V346 PolarHBondContact O-N 3.36Å
340	R	83.7	Confident	88.9	Confident	177 Å²	177	55 Å²	55	67%	0.668	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.3	139.3	-170.8	-169	167.8	179.4	168.8	-5.4	111.4	E337 T345	E337-R340 WeakPolarHBondContact OE1-CB 3.38Å; E337-R340 WeakPolarHBondContact OE1-CD 3.24Å; E337-R340 IonicContact OE2-NH1 2.64Å; E337-R340 PolarHBondContact OE2-NH1 2.95Å; R340-T345 HydrophobicContact CG-CG2 4.4Å
341	G	70.3	Confident	88.9	Confident	40 Å²	40	52.1 Å²	52.1	41%	0.412	27%	0.271	S	S	.	.			trans	-134.7	-178.9	176.5	0	0	0	0	0	111.5	F343 K344	G341-F343 PolarHBondContact O-N 2.95Å; G341-K344 PolarHBondContact N-O 3.1Å
342	S	62.3	Low	88.8	Confident	100 Å²	100	55.5 Å²	55.5	70%	0.699	29%	0.292	S	S	*	.	S	Bend	trans	-63.8	-12.5	-171.4	-43.8	0	0	0	0	116	K367	S342-K367 PolarHBondContact O-NZ 3.42Å
343	F	68.3	Low	88.8	Confident	81 Å²	81	60 Å²	60	36%	0.355	31%	0.313	S	S	.	.	S	Bend	trans	-138.6	-18.8	-177.4	-56.3	-86.6	0	0	0	114.2	G341 L363 Q364 K367 I497	G341-F343 PolarHBondContact O-N 2.95Å; F343-L363 WeakPolarHBondContact O-CA 3.16Å; F343-Q364 PolarHBondContact O-N 2.71Å; F343-K367 HydrophobicContact CD1-CD 3.79Å; F343-K367 HydrophobicContact CE1-CD 3.56Å; F343-I497 HydrophobicContact CZ-CD1 4.32Å
344	K	80.4	Confident	88.7	Confident	57 Å²	57	62.9 Å²	62.9	25%	0.248	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	144.3	-179.3	67.9	169.7	174	166.7	0	112.7	G341 V346 E362 L363 D481	G341-K344 PolarHBondContact N-O 3.1Å; K344-V346 HydrophobicContact CD-CG2 3.96Å; K344-V346 HydrophobicContact CG-CG2 4.47Å; K344-E362 VanDerWaalsContact CA-O 3.31Å; K344-E362 WeakPolarHBondContact CA-O 3.31Å; K344-L363 HydrophobicContact CB-CD2 3.81Å; K344-D481 IonicContact NZ-OD1 3.95Å; K344-D481 PolarHBondContact NZ-OD1 3.26Å; K344-D481 IonicContact NZ-OD2 2.96Å; K344-D481 PolarHBondContact NZ-OD2 2.84Å
345	T	86.8	Confident	88.7	Confident	13 Å²	13	64.9 Å²	64.9	8%	0.08	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	139.4	157.3	-52.8	0	0	0	0	108.5	E337 R340 F347 C361 E362	E337-T345 HydrophobicContact CG-CG2 3.69Å; E337-T345 WeakPolarHBondContact OE2-CG2 3.47Å; R340-T345 HydrophobicContact CG-CG2 4.4Å; T345-F347 HydrophobicContact CG2-CD2 4.09Å; T345-F347 HydrophobicContact CG2-CE1 4.45Å; T345-F347 HydrophobicContact CG2-CE2 3.39Å; T345-F347 HydrophobicContact CG2-CZ 3.61Å; T345-C361 CarbonylContact O-C 3.57Å; T345-C361 WeakPolarHBondContact O-CA 3.44Å; T345-E362 PolarHBondContact N-O 2.93Å; T345-E362 PolarHBondContact O-N 2.91Å
346	V	90.7	Very high	88.8	Confident	20 Å²	20	62 Å²	62	12%	0.121	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.6	-179.8	-172.7	0	0	0	0	108.9	E337 L338 G339 K344 A359 W360	E337-V346 CarbonylContact C-O 3.54Å; L338-V346 HydrophobicContact CB-CG1 4.33Å; L338-V346 HydrophobicContact CD1-CG1 4.42Å; L338-V346 PolarHBondContact N-O 3.02Å; G339-V346 PolarHBondContact N-O 2.73Å; G339-V346 PolarHBondContact O-N 3.36Å; K344-V346 HydrophobicContact CD-CG2 3.96Å; K344-V346 HydrophobicContact CG-CG2 4.47Å; V346-A359 HydrophobicContact CG1-CB 4.04Å; V346-W360 WeakPolarHBondContact CA-O 3.48Å
347	F	95	Very high	89	Confident	23 Å²	23	60.4 Å²	60.4	10%	0.101	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	158.3	176.9	-64	-92.5	0	0	0	110.5	K333 E336 E337 T345 W360 E362	K333-F347 HydrophobicContact CG-CB 4.15Å; K333-F347 HydrophobicContact CG-CG 4.46Å; E336-F347 CarbonylContact O-C 3.55Å; E336-F347 VanDerWaalsContact O-CA 3.32Å; E336-F347 WeakPolarHBondContact O-CA 3.45Å; E337-F347 HydrophobicContact CB-CD1 4.4Å; E337-F347 HydrophobicContact CB-CE1 4.26Å; T345-F347 HydrophobicContact CG2-CD2 4.09Å; T345-F347 HydrophobicContact CG2-CE1 4.45Å; T345-F347 HydrophobicContact CG2-CE2 3.39Å; T345-F347 HydrophobicContact CG2-CZ 3.61Å; F347-W360 HydrophobicContact CB-CB 4.33Å; F347-W360 PolarHBondContact N-O 3.22Å; F347-W360 PolarHBondContact O-N 2.85Å; F347-E362 HydrophobicContact CD2-CG 4.37Å; F347-E362 HydrophobicContact CE2-CG 4.4Å; F347-E362 WeakPolarHBondContact CE2-OE2 3.26Å
348	R	96.4	Very high	89.1	Confident	58 Å²	58	56.1 Å²	56.1	22%	0.219	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	139.5	166	-172.6	179.8	158.6	-148.6	-18.2	110	E320 F334 E336 L338 L416	E320-R348 IonicContact OE1-CZ 3.57Å; E320-R348 IonicContact OE1-NH1 3.68Å; E320-R348 PolarHBondContact OE1-NH1 3.41Å; E320-R348 IonicContact OE1-NH2 2.67Å; E320-R348 PolarHBondContact OE1-NH2 3.42Å; E320-R348 IonicContact OE2-CZ 2.67Å; E320-R348 IonicContact OE2-NH2 2.64Å; E320-R348 PolarHBondContact OE2-NH2 3.05Å; F334-R348 PolarHBondContact N-O 3.39Å; E336-R348 HydrophobicContact CB-CB 4.01Å; E336-R348 HydrophobicContact CG-CB 4.42Å; E336-R348 PolarHBondContact O-N 2.76Å; E336-R348 WeakPolarHBondContact OE2-CD 3.38Å; E336-R348 IonicContact OE2-CZ 2.73Å; E336-R348 IonicContact OE2-NE 2.72Å; E336-R348 IonicContact OE2-NH1 3.73Å; E336-R348 PolarHBondContact OE2-NH1 3.29Å; L338-R348 HydrophobicContact CD1-CB 4.02Å; L338-R348 HydrophobicContact CD2-CB 4.27Å; L338-R348 HydrophobicContact CG-CB 4.16Å; R348-L416 HydrophobicContact CG-CD2 4.42Å
349	G	96.5	Very high	89.4	Confident	0 Å²	0	53 Å²	53	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	179.1	170.7	0	0	0	0	0	112.9	L332 A357 V358	L332-G349 CarbonylContact O-C 3.57Å; L332-G349 WeakPolarHBondContact O-CA 3.27Å; G349-A357 CarbonylContact O-C 3.46Å; G349-A357 WeakPolarHBondContact O-CA 3.42Å; G349-V358 PolarHBondContact N-O 3.36Å; G349-V358 PolarHBondContact O-N 3.29Å
350	L	97.3	Very high	89.8	Confident	54 Å²	54	51.5 Å²	51.5	28%	0.283	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	133.7	175.9	177.1	70.2	0	0	0	109.6	F331 L332 F334 G355	F331-L350 WeakPolarHBondContact CA-O 3.49Å; L332-L350 PolarHBondContact N-O 3.35Å; L332-L350 PolarHBondContact O-N 3.24Å; F334-L350 HydrophobicContact CE2-CB 3.66Å; F334-L350 HydrophobicContact CZ-CB 4.02Å; L350-G355 WeakPolarHBondContact CD1-O 3.44Å
351	D	97.5	Very high	90.2	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	110.7	164.9	176.7	9.8	0	0	0	109.4	R330 F331 E353 T354 G355 V356 V358	R330-D351 VanDerWaalsContact CG-OD1 3.25Å; R330-D351 WeakPolarHBondContact CG-OD1 3.14Å; R330-D351 IonicContact CZ-OD1 3.64Å; R330-D351 IonicContact CZ-OD2 2.93Å; R330-D351 IonicContact NE-OD1 3.18Å; R330-D351 PolarHBondContact NE-OD1 2.77Å; R330-D351 IonicContact NE-OD2 3.93Å; R330-D351 PolarHBondContact NE-OD2 2.89Å; R330-D351 IonicContact NH2-OD1 2.67Å; R330-D351 IonicContact NH2-OD2 3.27Å; R330-D351 PolarHBondContact NH2-OD2 2.81Å; F331-D351 HydrophobicContact CD1-CB 3.87Å; F331-D351 HydrophobicContact CE1-CB 3.8Å; D351-E353 VanDerWaalsContact C-N 3.27Å; D351-E353 PolarHBondContact O-N 3.41Å; D351-E353 PolarHBondContact OD1-N 3.01Å; D351-E353 VanDerWaalsContact OD1-N 3.13Å; D351-T354 WeakPolarHBondContact CB-OG1 3.33Å; D351-T354 PolarHBondContact O-N 3.44Å; D351-T354 VanDerWaalsContact OD2-CG2 3.27Å; D351-T354 WeakPolarHBondContact OD2-CG2 3.5Å; D351-T354 PolarHBondContact OD2-OG1 3.32Å; D351-G355 WeakPolarHBondContact O-CA 3.05Å; D351-G355 PolarHBondContact O-N 3.08Å; D351-V356 PolarHBondContact N-O 3.18Å; D351-V358 HydrophobicContact CB-CG1 4.05Å
352	T	96.2	Very high	91.1	Very high	73 Å²	73	43 Å²	43	45%	0.448	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-17.1	-176	64.3	0	0	0	0	113.6	R330 L332	R330-T352 WeakPolarHBondContact O-CB 3.28Å; R330-T352 WeakPolarHBondContact O-CG2 3.45Å; R330-T352 PolarHBondContact O-N 2.88Å; R330-T352 PolarHBondContact O-OG1 3.17Å; L332-T352 HydrophobicContact CD1-CG2 3.64Å; L332-T352 HydrophobicContact CG-CG2 3.75Å
353	E	96	Very high	91.9	Very high	131 Å²	131	39 Å²	39	61%	0.612	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-32.2	175.2	-74.1	175.6	-162.8	0	0	112.1	R330 D351	R330-E353 VanDerWaalsContact CD-CD 3.44Å; R330-E353 WeakPolarHBondContact CD-OE1 3.42Å; R330-E353 HydrophobicContact CG-CB 4.49Å; R330-E353 HydrophobicContact CG-CG 3.99Å; R330-E353 IonicContact CZ-OE2 3.72Å; R330-E353 IonicContact NE-OE1 3.81Å; R330-E353 IonicContact NE-OE2 2.73Å; R330-E353 PolarHBondContact NE-OE2 2.89Å; R330-E353 IonicContact NH1-OE1 3.74Å; R330-E353 IonicContact NH1-OE2 3.43Å; R330-E353 PolarHBondContact NH1-OE2 2.95Å; R330-E353 IonicContact NH2-OE2 3.45Å; D351-E353 VanDerWaalsContact C-N 3.27Å; D351-E353 PolarHBondContact O-N 3.41Å; D351-E353 PolarHBondContact OD1-N 3.01Å; D351-E353 VanDerWaalsContact OD1-N 3.13Å
354	T	95.3	Very high	92.1	Very high	79 Å²	79	39.8 Å²	39.8	49%	0.485	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-16.2	-174.5	62.2	0	0	0	0	114.1	D351 V356	D351-T354 WeakPolarHBondContact CB-OG1 3.33Å; D351-T354 PolarHBondContact O-N 3.44Å; D351-T354 VanDerWaalsContact OD2-CG2 3.27Å; D351-T354 WeakPolarHBondContact OD2-CG2 3.5Å; D351-T354 PolarHBondContact OD2-OG1 3.32Å; T354-V356 PolarHBondContact O-N 3Å; T354-V356 WeakPolarHBondContact OG1-CB 3.49Å; T354-V356 PolarHBondContact OG1-N 2.86Å
355	G	94	Very high	91.3	Very high	57 Å²	57	38.4 Å²	38.4	59%	0.588	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.7	11	-171.6	0	0	0	0	0	113.9	L350 D351	L350-G355 WeakPolarHBondContact CD1-O 3.44Å; D351-G355 WeakPolarHBondContact O-CA 3.05Å; D351-G355 PolarHBondContact O-N 3.08Å
356	V	96	Very high	90.1	Very high	71 Å²	71	42.7 Å²	42.7	43%	0.43	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	134.1	-175	179.6	0	0	0	0	110.8	D351 T354	D351-V356 PolarHBondContact N-O 3.18Å; T354-V356 PolarHBondContact O-N 3Å; T354-V356 WeakPolarHBondContact OG1-CB 3.49Å; T354-V356 PolarHBondContact OG1-N 2.86Å
357	A	96.5	Very high	88.6	Confident	40 Å²	40	47.4 Å²	47.4	33%	0.331	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	135	173.8	0	0	0	0	0	111.2	G349 L416	G349-A357 CarbonylContact O-C 3.46Å; G349-A357 WeakPolarHBondContact O-CA 3.42Å; A357-L416 HydrophobicContact CB-CD2 3.74Å; A357-L416 WeakPolarHBondContact O-CB 3.47Å
358	V	96.6	Very high	87	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	160.9	-176	-65.6	0	0	0	0	111	F331 G349 D351 Y395 V413 T414	F331-V358 HydrophobicContact CD1-CG2 4.31Å; G349-V358 PolarHBondContact N-O 3.36Å; G349-V358 PolarHBondContact O-N 3.29Å; D351-V358 HydrophobicContact CB-CG1 4.05Å; V358-Y395 HydrophobicContact CG1-CD2 4.04Å; V358-Y395 HydrophobicContact CG1-CE2 3.74Å; V358-V413 HydrophobicContact CB-CG1 3.71Å; V358-V413 HydrophobicContact CG1-CG1 4.15Å; V358-V413 HydrophobicContact CG2-CG1 3.62Å; V358-T414 WeakPolarHBondContact CB-O 3.35Å
359	A	95.8	Very high	85.7	Confident	7 Å²	7	51.1 Å²	51.1	6%	0.058	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	121.4	168.8	0	0	0	0	0	109.1	V346 V413 T414 L416	V346-A359 HydrophobicContact CG1-CB 4.04Å; A359-V413 WeakPolarHBondContact O-CA 3.45Å; A359-T414 PolarHBondContact N-O 2.93Å; A359-T414 PolarHBondContact O-N 3.33Å; A359-L416 HydrophobicContact CB-CD1 4.2Å
360	W	94.8	Very high	84.6	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	105.3	176.9	177.7	-67.8	0	0	0	108.2	D324 F331 K333 V346 F347 E362 W398 V411	D324-W360 HydrophobicContact CB-CH2 4.14Å; D324-W360 HydrophobicContact CB-CZ2 3.96Å; D324-W360 WeakPolarHBondContact OD2-CZ2 3.41Å; F331-W360 HydrophobicContact CB-CE3 4.37Å; F331-W360 HydrophobicContact CB-CZ3 4.15Å; K333-W360 HydrophobicContact CB-CD2 3.74Å; K333-W360 HydrophobicContact CB-CE3 3.85Å; K333-W360 HydrophobicContact CB-CG 4.29Å; K333-W360 HydrophobicContact CB-CH2 3.95Å; K333-W360 HydrophobicContact CB-CZ2 3.89Å; K333-W360 HydrophobicContact CB-CZ3 3.95Å; K333-W360 HydrophobicContact CD-CD2 4.36Å; K333-W360 HydrophobicContact CD-CG 4.47Å; K333-W360 HydrophobicContact CD-CZ2 4.11Å; K333-W360 HydrophobicContact CG-CD2 3.97Å; K333-W360 HydrophobicContact CG-CG 4.03Å; K333-W360 HydrophobicContact CG-CZ2 4.38Å; V346-W360 WeakPolarHBondContact CA-O 3.48Å; F347-W360 HydrophobicContact CB-CB 4.33Å; F347-W360 PolarHBondContact N-O 3.22Å; F347-W360 PolarHBondContact O-N 2.85Å; W360-E362 PolarHBondContact NE1-OE1 3.45Å; W360-W398 HydrophobicContact CE3-CH2 4.37Å; W360-W398 HydrophobicContact CE3-CZ2 4.34Å; W360-W398 HydrophobicContact CH2-CH2 4.29Å; W360-W398 AromaticContact CH2-CZ2 3.57Å; W360-W398 HydrophobicContact CH2-CZ2 3.57Å; W360-W398 AromaticContact CZ2-CZ2 3.98Å; W360-W398 HydrophobicContact CZ2-CZ2 3.98Å; W360-W398 HydrophobicContact CZ3-CH2 4Å; W360-W398 AromaticContact CZ3-CZ2 3.75Å; W360-W398 HydrophobicContact CZ3-CZ2 3.75Å; W360-V411 HydrophobicContact CD2-CG1 3.79Å; W360-V411 HydrophobicContact CE3-CG1 4.4Å; W360-V411 HydrophobicContact CG-CG1 4.11Å; W360-V411 HydrophobicContact CZ2-CG1 4Å; W360-V411 HydrophobicContact CZ2-CG2 4.14Å
361	C	91.7	Very high	83.3	Confident	13 Å²	13	61.8 Å²	61.8	9%	0.088	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	127.8	-176.4	-59.3	0	0	0	0	110.6	T345 V411 L412	T345-C361 CarbonylContact O-C 3.57Å; T345-C361 WeakPolarHBondContact O-CA 3.44Å; C361-V411 CarbonylContact O-C 3.59Å; C361-V411 VanDerWaalsContact O-CA 3.29Å; C361-V411 WeakPolarHBondContact O-CA 3.27Å; C361-L412 HydrophobicContact CB-CB 4.27Å; C361-L412 HydrophobicContact CB-CD1 4.23Å; C361-L412 PolarHBondContact N-O 2.85Å; C361-L412 PolarHBondContact O-N 3.46Å
362	E	87.9	Confident	81.9	Confident	26 Å²	26	64.4 Å²	64.4	12%	0.121	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	115.3	179	-59.1	-173.5	151	0	0	110.5	K333 K344 T345 F347 W360 Y409 I410 V411	K333-E362 WeakPolarHBondContact CE-OE1 3.46Å; K333-E362 IonicContact NZ-OE1 3.14Å; K333-E362 PolarHBondContact NZ-OE1 3.48Å; K333-E362 IonicContact NZ-OE2 3.72Å; K333-E362 PolarHBondContact NZ-OE2 2.86Å; K344-E362 VanDerWaalsContact CA-O 3.31Å; K344-E362 WeakPolarHBondContact CA-O 3.31Å; T345-E362 PolarHBondContact N-O 2.93Å; T345-E362 PolarHBondContact O-N 2.91Å; F347-E362 HydrophobicContact CD2-CG 4.37Å; F347-E362 HydrophobicContact CE2-CG 4.4Å; F347-E362 WeakPolarHBondContact CE2-OE2 3.26Å; W360-E362 PolarHBondContact NE1-OE1 3.45Å; E362-Y409 HydrophobicContact CB-CD2 4.2Å; E362-Y409 HydrophobicContact CG-CD2 4.18Å; E362-Y409 HydrophobicContact CG-CE2 4.24Å; E362-Y409 WeakPolarHBondContact OE1-CE2 3.24Å; E362-I410 WeakPolarHBondContact CA-O 3.32Å; E362-V411 HydrophobicContact CG-CG2 4.49Å
363	L	79.7	Confident	80.8	Confident	14 Å²	14	62.6 Å²	62.6	7%	0.073	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	127.5	173.4	-69.6	177	0	0	0	111.1	F343 K344 E365 F376 Y409 I410 L412 L484	F343-L363 WeakPolarHBondContact O-CA 3.16Å; K344-L363 HydrophobicContact CB-CD2 3.81Å; L363-E365 PolarHBondContact O-N 2.89Å; L363-F376 HydrophobicContact CD1-CD2 4.39Å; L363-F376 HydrophobicContact CD1-CE2 3.34Å; L363-F376 HydrophobicContact CD1-CZ 3.54Å; L363-Y409 VanDerWaalsContact O-CA 3.32Å; L363-Y409 WeakPolarHBondContact O-CA 3.44Å; L363-Y409 VanDerWaalsContact O-CB 3.27Å; L363-Y409 WeakPolarHBondContact O-CB 3.39Å; L363-I410 HydrophobicContact CB-CB 4.37Å; L363-I410 PolarHBondContact N-O 3.13Å; L363-I410 PolarHBondContact O-N 3.14Å; L363-L412 HydrophobicContact CD1-CD1 3.71Å; L363-L412 HydrophobicContact CG-CD1 3.75Å; L363-L484 HydrophobicContact CD1-CD2 4.42Å
364	Q	72.4	Confident	79.7	Confident	98 Å²	98	60.1 Å²	60.1	46%	0.458	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	121.4	179.5	-63.8	-173.8	3.9	0	0	111.8	F343 S366	F343-Q364 PolarHBondContact O-N 2.71Å; Q364-S366 VanDerWaalsContact C-N 3.3Å; Q364-S366 PolarHBondContact O-N 3.45Å
365	E	64.3	Low	78.5	Confident	28 Å²	28	59.7 Å²	59.7	13%	0.131	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-72	-19.2	-175.2	-172	175.6	119	0	0	114.2	L363 K367 L368 R373 K408	L363-E365 PolarHBondContact O-N 2.89Å; E365-K367 PolarHBondContact O-N 2.66Å; E365-L368 PolarHBondContact O-N 3.13Å; E365-R373 IonicContact OE1-CZ 2.62Å; E365-R373 IonicContact OE1-NH1 3.7Å; E365-R373 PolarHBondContact OE1-NH1 2.71Å; E365-R373 IonicContact OE1-NH2 3.64Å; E365-R373 PolarHBondContact OE1-NH2 3.24Å; E365-R373 IonicContact OE2-CZ 2.78Å; E365-R373 IonicContact OE2-NE 2.73Å; E365-R373 IonicContact OE2-NH1 3.78Å; E365-R373 PolarHBondContact OE2-NH1 2.78Å; E365-R373 IonicContact OE2-NH2 2.69Å; E365-R373 PolarHBondContact OE2-NH2 3.23Å; E365-K408 HydrophobicContact CB-CB 4.35Å; E365-K408 WeakPolarHBondContact CB-O 3.38Å; E365-K408 HydrophobicContact CG-CB 4.44Å; E365-K408 WeakPolarHBondContact OE1-CB 3.38Å; E365-K408 WeakPolarHBondContact OE1-CD 3.36Å; E365-K408 WeakPolarHBondContact OE2-CB 3.5Å
366	S	60.8	Low	77.6	Confident	104 Å²	104	57.8 Å²	57.8	73%	0.727	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-62	-0.4	-173.4	56	0	0	0	0	115.7	Q364	Q364-S366 VanDerWaalsContact C-N 3.3Å; Q364-S366 PolarHBondContact O-N 3.45Å
367	K	60.4	Low	76.7	Confident	119 Å²	119	58.1 Å²	58.1	52%	0.517	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-125	9.6	175.9	-55.6	-180	-173	171.5	0	113.6	S342 F343 E365	S342-K367 PolarHBondContact O-NZ 3.42Å; F343-K367 HydrophobicContact CD1-CD 3.79Å; F343-K367 HydrophobicContact CE1-CD 3.56Å; E365-K367 PolarHBondContact O-N 2.66Å
368	L	61.9	Low	75.7	Confident	50 Å²	50	59.5 Å²	59.5	26%	0.262	29%	0.291	S	S	.	.			trans	-120.7	113.1	-174.2	-82.2	161.2	0	0	0	112.4	E365 E372 I410	E365-L368 PolarHBondContact O-N 3.13Å; L368-E372 HydrophobicContact CD2-CB 3.9Å; L368-I410 HydrophobicContact CD1-CD1 4.42Å
369	N	67.6	Low	74.7	Confident	109 Å²	109	60.5 Å²	60.5	58%	0.583	30%	0.296	S	S	*	.			trans	-69.4	162.2	177.4	-66.6	-66.6	0	0	0	112.6	T371 E372 R373	N369-T371 VanDerWaalsContact C-N 3.26Å; N369-T371 PolarHBondContact O-N 2.77Å; N369-E372 HydrophobicContact CB-CG 4.32Å; N369-E372 WeakPolarHBondContact CB-OE2 3.46Å; N369-E372 PolarHBondContact N-OE2 2.89Å; N369-E372 PolarHBondContact ND2-OE2 2.91Å; N369-E372 PolarHBondContact O-N 3.32Å; N369-E372 VanDerWaalsContact O-N 3.08Å; N369-R373 PolarHBondContact O-N 2.92Å
370	K	74.5	Confident	74.1	Confident	181 Å²	181	60.3 Å²	60.3	79%	0.787	29%	0.294	S	S	*	.	H	α-helix	trans	-54.8	-38.9	-179.1	-166.5	175.5	-178.5	-179.1	0	113.2	Q374	K370-Q374 PolarHBondContact O-N 3.12Å; K370-Q374 VanDerWaalsContact O-N 3.17Å
371	T	68.9	Low	73.5	Confident	96 Å²	96	64.5 Å²	64.5	59%	0.589	31%	0.314	S	S	*	.	H	α-helix	trans	-71.8	-39.8	177.4	-45.9	0	0	0	0	112.7	N369 R373 Q374 R375	N369-T371 VanDerWaalsContact C-N 3.26Å; N369-T371 PolarHBondContact O-N 2.77Å; T371-R373 VanDerWaalsContact C-N 3.32Å; T371-Q374 PolarHBondContact O-N 2.74Å; T371-R375 PolarHBondContact O-N 3.45Å
372	E	68.5	Low	73	Confident	57 Å²	57	66.4 Å²	66.4	27%	0.266	32%	0.322	S	S	.	.	H	α-helix	trans	-67.1	-37.8	178.3	-64.4	167.4	146.2	0	0	110.4	L368 N369 R375 F376	L368-E372 HydrophobicContact CD2-CB 3.9Å; N369-E372 HydrophobicContact CB-CG 4.32Å; N369-E372 WeakPolarHBondContact CB-OE2 3.46Å; N369-E372 PolarHBondContact N-OE2 2.89Å; N369-E372 PolarHBondContact ND2-OE2 2.91Å; N369-E372 PolarHBondContact O-N 3.32Å; N369-E372 VanDerWaalsContact O-N 3.08Å; E372-R375 PolarHBondContact O-N 2.77Å; E372-F376 WeakPolarHBondContact O-CB 3.41Å; E372-F376 PolarHBondContact O-N 2.7Å
373	R	72.5	Confident	72.8	Confident	35 Å²	35	65.5 Å²	65.5	13%	0.132	32%	0.318	C	S	.	.	H	α-helix	trans	-66.1	-38.1	172.7	-160.9	-170.6	-34.6	-156.7	-10.1	113.4	E365 N369 T371 F376 R377 E399 I410	E365-R373 IonicContact OE1-CZ 2.62Å; E365-R373 IonicContact OE1-NH1 3.7Å; E365-R373 PolarHBondContact OE1-NH1 2.71Å; E365-R373 IonicContact OE1-NH2 3.64Å; E365-R373 PolarHBondContact OE1-NH2 3.24Å; E365-R373 IonicContact OE2-CZ 2.78Å; E365-R373 IonicContact OE2-NE 2.73Å; E365-R373 IonicContact OE2-NH1 3.78Å; E365-R373 PolarHBondContact OE2-NH1 2.78Å; E365-R373 IonicContact OE2-NH2 2.69Å; E365-R373 PolarHBondContact OE2-NH2 3.23Å; N369-R373 PolarHBondContact O-N 2.92Å; T371-R373 VanDerWaalsContact C-N 3.32Å; R373-F376 WeakPolarHBondContact O-CB 3.09Å; R373-F376 PolarHBondContact O-N 3Å; R373-R377 WeakPolarHBondContact O-CG 3.41Å; R373-R377 PolarHBondContact O-N 2.74Å; R373-E399 WeakPolarHBondContact CD-OE1 3.39Å; R373-E399 WeakPolarHBondContact CD-OE2 3.41Å; R373-E399 IonicContact CZ-OE2 3.65Å; R373-E399 IonicContact NE-OE2 3.77Å; R373-E399 IonicContact NH1-OE2 2.76Å; R373-E399 PolarHBondContact NH1-OE2 3.01Å; R373-I410 HydrophobicContact CG-CD1 4.21Å
374	Q	74.3	Confident	73.2	Confident	78 Å²	78	67 Å²	67	36%	0.364	32%	0.324	S	S	.	.	H	α-helix	trans	-63.6	-44.4	174.7	176.2	55.5	31	0	0	111.1	K370 T371 R377 E378	K370-Q374 PolarHBondContact O-N 3.12Å; K370-Q374 VanDerWaalsContact O-N 3.17Å; T371-Q374 PolarHBondContact O-N 2.74Å; Q374-R377 PolarHBondContact O-N 3.25Å; Q374-E378 PolarHBondContact NE2-OE1 2.89Å; Q374-E378 PolarHBondContact O-N 3.37Å; Q374-E378 VanDerWaalsContact O-N 3.17Å
375	R	69.1	Low	73.8	Confident	71 Å²	71	69.1 Å²	69.1	27%	0.268	34%	0.338	S	S	.	.	H	α-helix	trans	-57.4	-50.7	171.6	-72.5	167.7	166.8	-176.2	-2.6	110.9	T371 E372 R377 E378 E379 K490 F492	T371-R375 PolarHBondContact O-N 3.45Å; E372-R375 PolarHBondContact O-N 2.77Å; R375-R377 VanDerWaalsContact C-N 3.26Å; R375-R377 PolarHBondContact O-N 3.31Å; R375-E378 PolarHBondContact O-N 3.09Å; R375-E379 WeakPolarHBondContact O-CB 3.4Å; R375-E379 WeakPolarHBondContact O-CG 3.44Å; R375-E379 PolarHBondContact O-N 2.87Å; R375-K490 PolarHBondContact NH2-O 2.61Å; R375-F492 PolarHBondContact NH1-O 3.14Å
376	F	74.9	Confident	75	Confident	16 Å²	16	68 Å²	68	7%	0.07	33%	0.333	C	S	.	.	H	α-helix	trans	-52.9	-41.3	177.9	-172.7	-77.9	0	0	0	112.7	L363 E372 R373 E379 A380 I410 L412 G483	L363-F376 HydrophobicContact CD1-CD2 4.39Å; L363-F376 HydrophobicContact CD1-CE2 3.34Å; L363-F376 HydrophobicContact CD1-CZ 3.54Å; E372-F376 WeakPolarHBondContact O-CB 3.41Å; E372-F376 PolarHBondContact O-N 2.7Å; R373-F376 WeakPolarHBondContact O-CB 3.09Å; R373-F376 PolarHBondContact O-N 3Å; F376-E379 PolarHBondContact O-N 3.38Å; F376-A380 HydrophobicContact CD1-CB 4.18Å; F376-A380 HydrophobicContact CE1-CB 3.85Å; F376-A380 WeakPolarHBondContact O-CB 3.24Å; F376-A380 PolarHBondContact O-N 3.27Å; F376-I410 HydrophobicContact CD1-CD1 3.67Å; F376-I410 HydrophobicContact CD1-CG2 4.24Å; F376-I410 HydrophobicContact CD2-CD1 4.49Å; F376-I410 HydrophobicContact CE1-CB 4.39Å; F376-I410 HydrophobicContact CE1-CD1 3.92Å; F376-I410 HydrophobicContact CE1-CG2 3.62Å; F376-I410 HydrophobicContact CG-CD1 4.01Å; F376-I410 HydrophobicContact CZ-CD1 4.4Å; F376-I410 HydrophobicContact CZ-CG2 4.23Å; F376-L412 HydrophobicContact CZ-CD1 4.21Å; F376-L412 HydrophobicContact CZ-CD2 3.75Å; F376-L412 HydrophobicContact CZ-CG 4.09Å; F376-G483 WeakPolarHBondContact CE2-O 3.18Å
377	R	77.8	Confident	76.5	Confident	79 Å²	79	70 Å²	70	30%	0.298	33%	0.331	S	S	.	.	H	α-helix	trans	-65.8	-46.4	176	-70.2	-171.3	-67.1	-115.8	3.4	112.7	R373 Q374 R375 E379 E381 Y397 E399	R373-R377 WeakPolarHBondContact O-CG 3.41Å; R373-R377 PolarHBondContact O-N 2.74Å; Q374-R377 PolarHBondContact O-N 3.25Å; R375-R377 VanDerWaalsContact C-N 3.26Å; R375-R377 PolarHBondContact O-N 3.31Å; R377-E379 PolarHBondContact O-N 3.41Å; R377-E381 WeakPolarHBondContact O-CB 3.35Å; R377-E381 PolarHBondContact O-N 3.47Å; R377-Y397 HydrophobicContact CB-CE2 4.41Å; R377-Y397 HydrophobicContact CG-CE2 4.04Å; R377-Y397 PolarHBondContact O-OH 3.23Å; R377-E399 WeakPolarHBondContact CD-OE1 3.45Å; R377-E399 IonicContact CZ-OE1 3.72Å; R377-E399 IonicContact NE-OE1 2.72Å; R377-E399 IonicContact NH1-OE1 2.85Å; R377-E399 PolarHBondContact NH1-OE1 3.07Å; R377-E399 IonicContact NH1-OE2 2.61Å
378	E	76.3	Confident	78.2	Confident	69 Å²	69	66.2 Å²	66.2	32%	0.322	32%	0.315	S	S	.	.	H	α-helix	trans	-61.8	-32.9	176.2	-71.2	176.2	-133.5	0	0	112.3	Q374 R375 K490	Q374-E378 PolarHBondContact NE2-OE1 2.89Å; Q374-E378 PolarHBondContact O-N 3.37Å; Q374-E378 VanDerWaalsContact O-N 3.17Å; R375-E378 PolarHBondContact O-N 3.09Å; E378-K490 IonicContact OE2-NZ 3.89Å; E378-K490 PolarHBondContact OE2-NZ 3.24Å
379	E	75.5	Confident	79.8	Confident	21 Å²	21	68.1 Å²	68.1	10%	0.098	33%	0.331	C	S	.	.	H	α-helix	trans	-79.2	-48.1	-179.5	-66	174.4	152.8	0	0	110.7	R375 F376 R377 E381 M382 L383 T486 L487 S491	R375-E379 WeakPolarHBondContact O-CB 3.4Å; R375-E379 WeakPolarHBondContact O-CG 3.44Å; R375-E379 PolarHBondContact O-N 2.87Å; F376-E379 PolarHBondContact O-N 3.38Å; R377-E379 PolarHBondContact O-N 3.41Å; E379-E381 PolarHBondContact O-N 3.43Å; E379-M382 WeakPolarHBondContact O-CB 3.4Å; E379-M382 PolarHBondContact O-N 3.35Å; E379-M382 VanDerWaalsContact O-N 3.13Å; E379-L383 WeakPolarHBondContact O-CG 3.5Å; E379-L383 PolarHBondContact O-N 3.01Å; E379-L383 VanDerWaalsContact O-N 3.09Å; E379-T486 WeakPolarHBondContact OE1-CA 3.48Å; E379-T486 VanDerWaalsContact OE1-CG2 3.3Å; E379-T486 WeakPolarHBondContact OE1-CG2 3.14Å; E379-T486 WeakPolarHBondContact OE2-CG2 3.49Å; E379-L487 HydrophobicContact CG-CD1 3.71Å; E379-L487 HydrophobicContact CG-CG 3.83Å; E379-L487 PolarHBondContact OE1-N 2.69Å; E379-S491 PolarHBondContact OE1-OG 2.67Å
380	A	81.4	Confident	81.2	Confident	2 Å²	2	63.5 Å²	63.5	2%	0.017	31%	0.306	C	S	.	.	H	α-helix	trans	-66.4	-29.6	178.2	0	0	0	0	0	113.9	F376 L383 K384 F394 Y397	F376-A380 HydrophobicContact CD1-CB 4.18Å; F376-A380 HydrophobicContact CE1-CB 3.85Å; F376-A380 WeakPolarHBondContact O-CB 3.24Å; F376-A380 PolarHBondContact O-N 3.27Å; A380-L383 PolarHBondContact O-N 2.98Å; A380-K384 PolarHBondContact O-N 3.09Å; A380-F394 HydrophobicContact CB-CZ 4.24Å; A380-F394 WeakPolarHBondContact O-CE1 2.75Å; A380-Y397 HydrophobicContact CB-CD1 3.49Å; A380-Y397 VanDerWaalsContact CB-CD1 3.49Å; A380-Y397 HydrophobicContact CB-CD2 4.08Å; A380-Y397 HydrophobicContact CB-CE1 3.78Å; A380-Y397 HydrophobicContact CB-CE2 4.34Å; A380-Y397 HydrophobicContact CB-CG 3.69Å
381	E	83	Confident	82.2	Confident	89 Å²	89	55 Å²	55	42%	0.416	27%	0.269	S	S	.	.	H	α-helix	trans	-65.1	-41.5	171.1	-153.5	69.8	-130.3	0	0	111	R377 E379 L383 K384 Y397	R377-E381 WeakPolarHBondContact O-CB 3.35Å; R377-E381 PolarHBondContact O-N 3.47Å; E379-E381 PolarHBondContact O-N 3.43Å; E381-L383 VanDerWaalsContact C-N 3.29Å; E381-L383 PolarHBondContact O-N 3.03Å; E381-K384 WeakPolarHBondContact O-CB 3.35Å; E381-K384 PolarHBondContact O-N 2.96Å; E381-K384 VanDerWaalsContact O-N 3.12Å; E381-K384 WeakPolarHBondContact OE1-CD 3.33Å; E381-K384 VanDerWaalsContact OE1-CE 3.25Å; E381-K384 WeakPolarHBondContact OE1-CE 3.42Å; E381-K384 IonicContact OE1-NZ 3.25Å; E381-K384 PolarHBondContact OE1-NZ 3.36Å; E381-Y397 HydrophobicContact CB-CE1 4.26Å; E381-Y397 WeakPolarHBondContact OE2-CE1 3.4Å; E381-Y397 PolarHBondContact OE2-OH 2.96Å
382	M	81.1	Confident	83.5	Confident	52 Å²	52	51.1 Å²	51.1	26%	0.256	25%	0.245	S	C	.	.	H	α-helix	trans	-66.1	-30	175.3	-166.1	-176.6	-57.7	0	0	112.7	E379 K384 D385 P456 V458 L487	E379-M382 WeakPolarHBondContact O-CB 3.4Å; E379-M382 PolarHBondContact O-N 3.35Å; E379-M382 VanDerWaalsContact O-N 3.13Å; M382-K384 VanDerWaalsContact C-N 3.26Å; M382-K384 PolarHBondContact O-N 3.48Å; M382-D385 PolarHBondContact O-N 3.14Å; M382-P456 HydrophobicContact CE-CG 3.89Å; M382-V458 HydrophobicContact SD-CG2 3.99Å; M382-L487 HydrophobicContact CE-CD1 3.54Å; M382-L487 HydrophobicContact CE-CD2 3.9Å; M382-L487 HydrophobicContact CE-CG 4.39Å; M382-L487 HydrophobicContact SD-CD1 4.34Å; M382-L487 HydrophobicContact SD-CD2 3.67Å
383	L	83.7	Confident	84.7	Confident	7 Å²	7	51.1 Å²	51.1	4%	0.037	24%	0.243	C	C	.	.	H	α-helix	trans	-62.7	-31.4	172.9	-60.7	-177.9	0	0	0	112.4	E379 A380 E381 D385 L386 F394 L482	E379-L383 WeakPolarHBondContact O-CG 3.5Å; E379-L383 PolarHBondContact O-N 3.01Å; E379-L383 VanDerWaalsContact O-N 3.09Å; A380-L383 PolarHBondContact O-N 2.98Å; E381-L383 VanDerWaalsContact C-N 3.29Å; E381-L383 PolarHBondContact O-N 3.03Å; L383-D385 VanDerWaalsContact C-N 3.25Å; L383-D385 PolarHBondContact O-N 3.31Å; L383-L386 HydrophobicContact CD2-CD1 3.66Å; L383-L386 WeakPolarHBondContact O-CB 3.13Å; L383-L386 PolarHBondContact O-N 3.27Å; L383-L386 VanDerWaalsContact O-N 3.08Å; L383-F394 HydrophobicContact CB-CB 4.1Å; L383-F394 HydrophobicContact CB-CD1 3.65Å; L383-F394 HydrophobicContact CB-CD2 3.97Å; L383-F394 HydrophobicContact CB-CE1 3.95Å; L383-F394 HydrophobicContact CB-CE2 4.25Å; L383-F394 HydrophobicContact CB-CG 3.65Å; L383-F394 HydrophobicContact CB-CZ 4.24Å; L383-F394 HydrophobicContact CD1-CD2 4Å; L383-F394 HydrophobicContact CD1-CE2 3.79Å; L383-F394 HydrophobicContact CD1-CZ 4.15Å; L383-F394 WeakPolarHBondContact O-CB 3.5Å; L383-L482 HydrophobicContact CD1-CB 4.43Å; L383-L482 WeakPolarHBondContact CD1-O 3.29Å; L383-L482 HydrophobicContact CD2-CB 3.94Å
384	K	87.5	Confident	85.6	Confident	46 Å²	46	50 Å²	50	20%	0.2	24%	0.239	C	C	.	.	H	α-helix	trans	-64.7	-27.4	179.9	-67.8	166.5	57.8	175.6	0	113.1	A380 E381 M382 R393 F394 D396 Y397	A380-K384 PolarHBondContact O-N 3.09Å; E381-K384 WeakPolarHBondContact O-CB 3.35Å; E381-K384 PolarHBondContact O-N 2.96Å; E381-K384 VanDerWaalsContact O-N 3.12Å; E381-K384 WeakPolarHBondContact OE1-CD 3.33Å; E381-K384 VanDerWaalsContact OE1-CE 3.25Å; E381-K384 WeakPolarHBondContact OE1-CE 3.42Å; E381-K384 IonicContact OE1-NZ 3.25Å; E381-K384 PolarHBondContact OE1-NZ 3.36Å; M382-K384 VanDerWaalsContact C-N 3.26Å; M382-K384 PolarHBondContact O-N 3.48Å; K384-R393 VanDerWaalsContact O-CZ 3.23Å; K384-R393 PolarHBondContact O-NH1 2.98Å; K384-R393 PolarHBondContact O-NH2 3.05Å; K384-F394 HydrophobicContact CB-CD1 4.47Å; K384-F394 HydrophobicContact CG-CD1 3.64Å; K384-F394 HydrophobicContact CG-CE1 3.77Å; K384-D396 WeakPolarHBondContact CE-OD1 3.44Å; K384-D396 IonicContact NZ-OD1 2.77Å; K384-D396 PolarHBondContact NZ-OD1 3.02Å; K384-Y397 HydrophobicContact CD-CD1 3.87Å; K384-Y397 HydrophobicContact CD-CE1 3.99Å
385	D	85.6	Confident	86.5	Confident	143 Å²	143	49.3 Å²	49.3	77%	0.765	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-7	175.6	-68.2	-24.4	0	0	0	113.7	M382 L383 Q387	M382-D385 PolarHBondContact O-N 3.14Å; L383-D385 VanDerWaalsContact C-N 3.25Å; L383-D385 PolarHBondContact O-N 3.31Å; D385-Q387 PolarHBondContact O-N 2.96Å; D385-Q387 VanDerWaalsContact O-N 3.12Å
386	L	88.9	Confident	87.6	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.026	23%	0.228	C	C	.	.			trans	-76.7	100.1	178.7	-84.1	163.2	0	0	0	111.8	L383 R393 F450 L451 R454 V458	L383-L386 HydrophobicContact CD2-CD1 3.66Å; L383-L386 WeakPolarHBondContact O-CB 3.13Å; L383-L386 PolarHBondContact O-N 3.27Å; L383-L386 VanDerWaalsContact O-N 3.08Å; L386-R393 PolarHBondContact O-NH1 3.34Å; L386-F450 HydrophobicContact CB-CE1 4.5Å; L386-F450 HydrophobicContact CD2-CD1 4Å; L386-F450 HydrophobicContact CD2-CE1 3.25Å; L386-F450 HydrophobicContact CD2-CZ 3.83Å; L386-F450 HydrophobicContact CG-CE1 4.48Å; L386-L451 HydrophobicContact CD1-CD2 4.11Å; L386-L451 HydrophobicContact CD2-CD2 3.88Å; L386-R454 HydrophobicContact CD2-CG 3.78Å; L386-V458 HydrophobicContact CD1-CG2 4.35Å
387	Q	93.4	Very high	88.3	Confident	144 Å²	144	48.1 Å²	48.1	67%	0.673	23%	0.231	S	C	*	.			trans	-124.4	114.9	173.9	-172.8	175.1	21.3	0	0	111.7	D385 F450	D385-Q387 PolarHBondContact O-N 2.96Å; D385-Q387 VanDerWaalsContact O-N 3.12Å; Q387-F450 VanDerWaalsContact O-CZ 3.25Å; Q387-F450 WeakPolarHBondContact O-CZ 3.27Å
388	H	96.2	Very high	88.9	Confident	41 Å²	41	45.2 Å²	45.2	19%	0.19	22%	0.219	C	C	.	.			trans	-154	142.6	175.7	175.4	-98.2	0	0	0	109.8	N390 I391 F450	H388-N390 PolarHBondContact ND1-N 2.77Å; H388-N390 PolarHBondContact O-N 3.06Å; H388-I391 HydrophobicContact CB-CB 4.3Å; H388-I391 HydrophobicContact CB-CG1 3.92Å; H388-I391 PolarHBondContact O-N 3.19Å; H388-F450 HydrophobicContact CB-CB 4.45Å; H388-F450 HydrophobicContact CB-CD1 3.38Å; H388-F450 HydrophobicContact CB-CD2 4Å; H388-F450 HydrophobicContact CB-CE1 3.36Å; H388-F450 HydrophobicContact CB-CE2 4.02Å; H388-F450 HydrophobicContact CB-CG 3.69Å; H388-F450 HydrophobicContact CB-CZ 3.71Å; H388-F450 AromaticContact CD2-CD2 3.91Å; H388-F450 AromaticContact CD2-CG 3.8Å; H388-F450 AromaticContact CG-CD1 3.81Å; H388-F450 AromaticContact CG-CG 3.71Å
389	P	95.7	Very high	89.4	Confident	90 Å²	90	44.1 Å²	44.1	58%	0.584	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-21.5	-174.9	21.4	-35.7	0	0	0	115.4	K478	P389-K478 WeakPolarHBondContact O-CE 3.48Å; P389-K478 WeakPolarHBondContact O-CG 3.43Å
390	N	97	Very high	89.9	Confident	11 Å²	11	44.5 Å²	44.5	6%	0.059	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	18.9	176.2	-53.8	117	0	0	0	114	H388 Q443 V477 K478 I479	H388-N390 PolarHBondContact ND1-N 2.77Å; H388-N390 PolarHBondContact O-N 3.06Å; N390-Q443 VanDerWaalsContact CB-O 3.26Å; N390-Q443 WeakPolarHBondContact CB-O 3.5Å; N390-Q443 WeakPolarHBondContact ND2-CB 3.5Å; N390-Q443 WeakPolarHBondContact ND2-CG 3.42Å; N390-Q443 PolarHBondContact ND2-OE1 2.73Å; N390-Q443 VanDerWaalsContact ND2-OE1 3.14Å; N390-V477 WeakPolarHBondContact CA-O 3.39Å; N390-V477 PolarHBondContact ND2-O 3.46Å; N390-K478 WeakPolarHBondContact O-CA 3.29Å; N390-I479 PolarHBondContact O-N 3.35Å
391	I	95.7	Very high	90	Very high	3 Å²	3	46.5 Å²	46.5	2%	0.015	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-119.1	140.7	169.5	-58.2	-60.9	0	0	0	108	H388 R393 F450 L451 I479 L482	H388-I391 HydrophobicContact CB-CB 4.3Å; H388-I391 HydrophobicContact CB-CG1 3.92Å; H388-I391 PolarHBondContact O-N 3.19Å; I391-R393 PolarHBondContact O-N 3.24Å; I391-F450 HydrophobicContact CG1-CD1 3.95Å; I391-F450 HydrophobicContact CG1-CE1 4.32Å; I391-L451 HydrophobicContact CD1-CD1 3.82Å; I391-L451 HydrophobicContact CD1-CD2 4.21Å; I391-L451 HydrophobicContact CD1-CG 3.93Å; I391-I479 WeakPolarHBondContact CA-O 3.31Å; I391-I479 HydrophobicContact CD1-CB 4.01Å; I391-I479 HydrophobicContact CD1-CD1 4.27Å; I391-I479 HydrophobicContact CD1-CG1 4.45Å; I391-L482 HydrophobicContact CG2-CD1 3.57Å
392	V	94.4	Very high	89.8	Confident	14 Å²	14	44.7 Å²	44.7	9%	0.085	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-67.6	124.7	172	176.3	0	0	0	0	108.2	F394 E415 M417 F469 K478 I479	V392-F394 PolarHBondContact O-N 3.15Å; V392-E415 HydrophobicContact CG1-CB 3.93Å; V392-M417 HydrophobicContact CG1-CG 4.23Å; V392-M417 HydrophobicContact CG2-CG 3.85Å; V392-M417 HydrophobicContact CG2-SD 4.13Å; V392-F469 HydrophobicContact CG2-CD2 3.9Å; V392-F469 HydrophobicContact CG2-CG 4.49Å; V392-K478 HydrophobicContact CG2-CB 3.72Å; V392-I479 PolarHBondContact N-O 3.33Å
393	R	93.9	Very high	89.3	Confident	58 Å²	58	51.6 Å²	51.6	22%	0.219	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-65.2	126.7	-175.8	-172.6	69.3	-176.9	109.4	13.2	110.5	K384 L386 I391 Y395 T414 E415	K384-R393 VanDerWaalsContact O-CZ 3.23Å; K384-R393 PolarHBondContact O-NH1 2.98Å; K384-R393 PolarHBondContact O-NH2 3.05Å; L386-R393 PolarHBondContact O-NH1 3.34Å; I391-R393 PolarHBondContact O-N 3.24Å; R393-Y395 HydrophobicContact CB-CE1 4.31Å; R393-Y395 HydrophobicContact CG-CD1 3.97Å; R393-Y395 HydrophobicContact CG-CE1 3.61Å; R393-T414 CarbonylContact O-C 3.41Å; R393-T414 VanDerWaalsContact O-CA 3.25Å; R393-T414 WeakPolarHBondContact O-CA 3.48Å; R393-T414 WeakPolarHBondContact O-CB 3.19Å; R393-E415 HydrophobicContact CB-CB 4.07Å; R393-E415 PolarHBondContact N-OE2 3.19Å; R393-E415 VanDerWaalsContact N-OE2 3.08Å; R393-E415 PolarHBondContact O-N 3.45Å
394	F	92.3	Very high	88.8	Confident	12 Å²	12	55.6 Å²	55.6	5%	0.053	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	130.6	167.6	-163.6	-90.4	0	0	0	108.6	A380 L383 K384 V392 Y397 L412 T414	A380-F394 HydrophobicContact CB-CZ 4.24Å; A380-F394 WeakPolarHBondContact O-CE1 2.75Å; L383-F394 HydrophobicContact CB-CB 4.1Å; L383-F394 HydrophobicContact CB-CD1 3.65Å; L383-F394 HydrophobicContact CB-CD2 3.97Å; L383-F394 HydrophobicContact CB-CE1 3.95Å; L383-F394 HydrophobicContact CB-CE2 4.25Å; L383-F394 HydrophobicContact CB-CG 3.65Å; L383-F394 HydrophobicContact CB-CZ 4.24Å; L383-F394 HydrophobicContact CD1-CD2 4Å; L383-F394 HydrophobicContact CD1-CE2 3.79Å; L383-F394 HydrophobicContact CD1-CZ 4.15Å; L383-F394 WeakPolarHBondContact O-CB 3.5Å; K384-F394 HydrophobicContact CB-CD1 4.47Å; K384-F394 HydrophobicContact CG-CD1 3.64Å; K384-F394 HydrophobicContact CG-CE1 3.77Å; V392-F394 PolarHBondContact O-N 3.15Å; F394-Y397 HydrophobicContact CE1-CD1 4.23Å; F394-L412 HydrophobicContact CE2-CB 3.9Å; F394-L412 HydrophobicContact CE2-CD2 3.66Å; F394-L412 HydrophobicContact CE2-CG 4.27Å; F394-L412 HydrophobicContact CZ-CB 4.06Å; F394-L412 HydrophobicContact CZ-CD2 4Å; F394-L412 HydrophobicContact CZ-CG 4.3Å; F394-T414 HydrophobicContact CD2-CG2 3.74Å; F394-T414 HydrophobicContact CE2-CG2 4.28Å
395	Y	92.9	Very high	88	Confident	63 Å²	63	55.8 Å²	55.8	25%	0.247	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-53.4	-175.6	-63.5	-67	0	0	0	112.2	V358 R393 V413 E415	V358-Y395 HydrophobicContact CG1-CD2 4.04Å; V358-Y395 HydrophobicContact CG1-CE2 3.74Å; R393-Y395 HydrophobicContact CB-CE1 4.31Å; R393-Y395 HydrophobicContact CG-CD1 3.97Å; R393-Y395 HydrophobicContact CG-CE1 3.61Å; Y395-V413 HydrophobicContact CD2-CG1 4.18Å; Y395-V413 PolarHBondContact N-O 3.45Å; Y395-E415 HydrophobicContact CE2-CB 4.25Å
396	D	92.2	Very high	87.4	Confident	28 Å²	28	55.6 Å²	55.6	15%	0.15	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	168.7	-177	-153.4	6.9	0	0	0	111.7	F331 K384 W398 V413	F331-D396 HydrophobicContact CE2-CB 3.76Å; F331-D396 HydrophobicContact CZ-CB 4.43Å; K384-D396 WeakPolarHBondContact CE-OD1 3.44Å; K384-D396 IonicContact NZ-OD1 2.77Å; K384-D396 PolarHBondContact NZ-OD1 3.02Å; D396-W398 HydrophobicContact CB-CZ3 4.36Å; D396-V413 PolarHBondContact O-N 2.89Å
397	Y	89.8	Confident	86.7	Confident	34 Å²	34	64.5 Å²	64.5	13%	0.133	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	157.3	171.3	77.8	-82.3	0	0	0	111.5	R377 A380 E381 K384 F394 I410 V411	R377-Y397 HydrophobicContact CB-CE2 4.41Å; R377-Y397 HydrophobicContact CG-CE2 4.04Å; R377-Y397 PolarHBondContact O-OH 3.23Å; A380-Y397 HydrophobicContact CB-CD1 3.49Å; A380-Y397 VanDerWaalsContact CB-CD1 3.49Å; A380-Y397 HydrophobicContact CB-CD2 4.08Å; A380-Y397 HydrophobicContact CB-CE1 3.78Å; A380-Y397 HydrophobicContact CB-CE2 4.34Å; A380-Y397 HydrophobicContact CB-CG 3.69Å; E381-Y397 HydrophobicContact CB-CE1 4.26Å; E381-Y397 WeakPolarHBondContact OE2-CE1 3.4Å; E381-Y397 PolarHBondContact OE2-OH 2.96Å; K384-Y397 HydrophobicContact CD-CD1 3.87Å; K384-Y397 HydrophobicContact CD-CE1 3.99Å; F394-Y397 HydrophobicContact CE1-CD1 4.23Å; Y397-I410 HydrophobicContact CD2-CG2 4.44Å; Y397-V411 CarbonylContact C-O 3.54Å; Y397-V411 WeakPolarHBondContact CA-O 3.25Å; Y397-V411 VanDerWaalsContact CB-O 3.3Å; Y397-V411 WeakPolarHBondContact CB-O 3.4Å
398	W	89.6	Confident	86	Confident	17 Å²	17	63 Å²	63	6%	0.064	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	150.5	168.7	57.7	89.1	0	0	0	112.7	K327 F331 W360 D396 V411 V413	K327-W398 HydrophobicContact CD-CB 4.3Å; K327-W398 HydrophobicContact CD-CG 4.45Å; K327-W398 HydrophobicContact CG-CG 4.41Å; F331-W398 HydrophobicContact CB-CH2 4.26Å; F331-W398 HydrophobicContact CD2-CH2 4.04Å; F331-W398 AromaticContact CD2-CZ3 3.9Å; F331-W398 HydrophobicContact CD2-CZ3 3.9Å; W360-W398 HydrophobicContact CE3-CH2 4.37Å; W360-W398 HydrophobicContact CE3-CZ2 4.34Å; W360-W398 HydrophobicContact CH2-CH2 4.29Å; W360-W398 AromaticContact CH2-CZ2 3.57Å; W360-W398 HydrophobicContact CH2-CZ2 3.57Å; W360-W398 AromaticContact CZ2-CZ2 3.98Å; W360-W398 HydrophobicContact CZ2-CZ2 3.98Å; W360-W398 HydrophobicContact CZ3-CH2 4Å; W360-W398 AromaticContact CZ3-CZ2 3.75Å; W360-W398 HydrophobicContact CZ3-CZ2 3.75Å; D396-W398 HydrophobicContact CB-CZ3 4.36Å; W398-V411 HydrophobicContact CD2-CB 4.17Å; W398-V411 HydrophobicContact CH2-CB 4.44Å; W398-V411 HydrophobicContact CH2-CG1 3.81Å; W398-V411 HydrophobicContact CZ2-CB 3.8Å; W398-V411 HydrophobicContact CZ2-CG1 3.45Å; W398-V411 VanDerWaalsContact CZ2-CG1 3.45Å; W398-V411 HydrophobicContact CZ2-CG2 4.25Å; W398-V411 PolarHBondContact N-O 3.35Å; W398-V411 PolarHBondContact O-N 2.96Å; W398-V413 HydrophobicContact CH2-CG2 3.4Å; W398-V413 VanDerWaalsContact CH2-CG2 3.4Å; W398-V413 HydrophobicContact CZ3-CG2 3.6Å
399	E	86.8	Confident	85.3	Confident	47 Å²	47	62.7 Å²	62.7	22%	0.22	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	129.2	162.6	-78.5	169.5	-111.7	0	0	110.1	K327 R373 R377 I410	K327-E399 WeakPolarHBondContact CE-O 3.14Å; K327-E399 PolarHBondContact NZ-O 3.19Å; R373-E399 WeakPolarHBondContact CD-OE1 3.39Å; R373-E399 WeakPolarHBondContact CD-OE2 3.41Å; R373-E399 IonicContact CZ-OE2 3.65Å; R373-E399 IonicContact NE-OE2 3.77Å; R373-E399 IonicContact NH1-OE2 2.76Å; R373-E399 PolarHBondContact NH1-OE2 3.01Å; R377-E399 WeakPolarHBondContact CD-OE1 3.45Å; R377-E399 IonicContact CZ-OE1 3.72Å; R377-E399 IonicContact NE-OE1 2.72Å; R377-E399 IonicContact NH1-OE1 2.85Å; R377-E399 PolarHBondContact NH1-OE1 3.07Å; R377-E399 IonicContact NH1-OE2 2.61Å; E399-I410 HydrophobicContact CG-CG1 4.2Å
400	S	87.3	Confident	84.8	Confident	28 Å²	28	58.4 Å²	58.4	20%	0.196	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	172.2	172.7	-162.6	0	0	0	0	110.3	K408 Y409	S400-K408 VanDerWaalsContact O-CA 3.27Å; S400-K408 WeakPolarHBondContact O-CA 3.16Å; S400-Y409 PolarHBondContact N-O 2.82Å; S400-Y409 PolarHBondContact O-N 2.97Å; S400-Y409 PolarHBondContact OG-OH 3.31Å
401	A	82.8	Confident	84.5	Confident	45 Å²	45	57.9 Å²	57.9	37%	0.372	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	150.8	171.4	0	0	0	0	0	109.9	R407 K408 Y409	A401-R407 WeakPolarHBondContact CA-O 3.34Å; A401-K408 HydrophobicContact CB-CG 4.14Å; A401-Y409 VanDerWaalsContact C-CE1 3.49Å
402	D	78	Confident	84.2	Confident	51 Å²	51	58.2 Å²	58.2	27%	0.273	29%	0.294	S	S	.	.			trans	-66	164	173.1	63.8	1.5	0	0	0	111.4	C404 G405 K406 R407	D402-C404 PolarHBondContact O-N 3.34Å; D402-G405 PolarHBondContact O-N 2.93Å; D402-G405 PolarHBondContact OD1-N 2.91Å; D402-K406 PolarHBondContact OD1-N 2.91Å; D402-R407 VanDerWaalsContact CG-N 3.32Å; D402-R407 PolarHBondContact N-O 3.48Å; D402-R407 PolarHBondContact OD1-N 3.06Å; D402-R407 VanDerWaalsContact OD2-CB 3.28Å; D402-R407 WeakPolarHBondContact OD2-CB 3.42Å; D402-R407 PolarHBondContact OD2-N 3.38Å
403	L	71.1	Confident	84.2	Confident	197 Å²	197	57.5 Å²	57.5	100%	1.031	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-13	-176.5	-66.1	169.7	0	0	0	113.9
404	C	73.5	Confident	84.2	Confident	91 Å²	91	56.1 Å²	56.1	62%	0.615	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-8	176.4	-163.9	0	0	0	0	112.8	D402 K406	D402-C404 PolarHBondContact O-N 3.34Å; C404-K406 HydrophobicContact CB-CG 4.42Å; C404-K406 PolarHBondContact O-N 3.42Å; C404-K406 VanDerWaalsContact O-N 3.14Å
405	G	71.6	Confident	84.3	Confident	49 Å²	49	57.6 Å²	57.6	51%	0.505	30%	0.295	S	S	.	.	S	Bend	trans	69.8	-1.9	-175.1	0	0	0	0	0	115	D402	D402-G405 PolarHBondContact O-N 2.93Å; D402-G405 PolarHBondContact OD1-N 2.91Å
406	K	72.1	Confident	84.4	Confident	139 Å²	139	56.4 Å²	56.4	60%	0.604	29%	0.292	S	S	*	.	S	Bend	trans	-79.5	-27.9	-174.2	-71.9	-167.4	175.5	-165.9	0	112.9	D402 C404 E1493	D402-K406 PolarHBondContact OD1-N 2.91Å; C404-K406 HydrophobicContact CB-CG 4.42Å; C404-K406 PolarHBondContact O-N 3.42Å; C404-K406 VanDerWaalsContact O-N 3.14Å; K406-E1493 IonicContact NZ-OE1 3.09Å; K406-E1493 PolarHBondContact NZ-OE1 3.18Å
407	R	74	Confident	84.5	Confident	192 Å²	192	56.1 Å²	56.1	73%	0.725	29%	0.29	S	S	*	.			trans	-125.2	113.3	176.1	-57.3	178.3	175.5	176.5	0.9	110.8	A401 D402	A401-R407 WeakPolarHBondContact CA-O 3.34Å; D402-R407 VanDerWaalsContact CG-N 3.32Å; D402-R407 PolarHBondContact N-O 3.48Å; D402-R407 PolarHBondContact OD1-N 3.06Å; D402-R407 VanDerWaalsContact OD2-CB 3.28Å; D402-R407 WeakPolarHBondContact OD2-CB 3.42Å; D402-R407 PolarHBondContact OD2-N 3.38Å
408	K	78.5	Confident	84.5	Confident	112 Å²	112	58.3 Å²	58.3	49%	0.487	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	155.4	164.5	-65.1	168.7	-175.8	173.9	0	110.3	E365 S400 A401	E365-K408 HydrophobicContact CB-CB 4.35Å; E365-K408 WeakPolarHBondContact CB-O 3.38Å; E365-K408 HydrophobicContact CG-CB 4.44Å; E365-K408 WeakPolarHBondContact OE1-CB 3.38Å; E365-K408 WeakPolarHBondContact OE1-CD 3.36Å; E365-K408 WeakPolarHBondContact OE2-CB 3.5Å; S400-K408 VanDerWaalsContact O-CA 3.27Å; S400-K408 WeakPolarHBondContact O-CA 3.16Å; A401-K408 HydrophobicContact CB-CG 4.14Å
409	Y	82.9	Confident	84.6	Confident	35 Å²	35	59.1 Å²	59.1	14%	0.137	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	157.9	177.7	56.8	-82.6	0	0	0	109.6	D324 E362 L363 S400 A401 V411	D324-Y409 PolarHBondContact OD2-OH 2.97Å; E362-Y409 HydrophobicContact CB-CD2 4.2Å; E362-Y409 HydrophobicContact CG-CD2 4.18Å; E362-Y409 HydrophobicContact CG-CE2 4.24Å; E362-Y409 WeakPolarHBondContact OE1-CE2 3.24Å; L363-Y409 VanDerWaalsContact O-CA 3.32Å; L363-Y409 WeakPolarHBondContact O-CA 3.44Å; L363-Y409 VanDerWaalsContact O-CB 3.27Å; L363-Y409 WeakPolarHBondContact O-CB 3.39Å; S400-Y409 PolarHBondContact N-O 2.82Å; S400-Y409 PolarHBondContact O-N 2.97Å; S400-Y409 PolarHBondContact OG-OH 3.31Å; A401-Y409 VanDerWaalsContact C-CE1 3.49Å; Y409-V411 HydrophobicContact CD2-CG2 3.82Å; Y409-V411 HydrophobicContact CE2-CG2 3.56Å
410	I	84.6	Confident	84.9	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.9	176	-42.7	-179.9	0	0	0	108.7	E362 L363 L368 R373 F376 Y397 E399	E362-I410 WeakPolarHBondContact CA-O 3.32Å; L363-I410 HydrophobicContact CB-CB 4.37Å; L363-I410 PolarHBondContact N-O 3.13Å; L363-I410 PolarHBondContact O-N 3.14Å; L368-I410 HydrophobicContact CD1-CD1 4.42Å; R373-I410 HydrophobicContact CG-CD1 4.21Å; F376-I410 HydrophobicContact CD1-CD1 3.67Å; F376-I410 HydrophobicContact CD1-CG2 4.24Å; F376-I410 HydrophobicContact CD2-CD1 4.49Å; F376-I410 HydrophobicContact CE1-CB 4.39Å; F376-I410 HydrophobicContact CE1-CD1 3.92Å; F376-I410 HydrophobicContact CE1-CG2 3.62Å; F376-I410 HydrophobicContact CG-CD1 4.01Å; F376-I410 HydrophobicContact CZ-CD1 4.4Å; F376-I410 HydrophobicContact CZ-CG2 4.23Å; Y397-I410 HydrophobicContact CD2-CG2 4.44Å; E399-I410 HydrophobicContact CG-CG1 4.2Å
411	V	90	Very high	85.2	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	137.1	171.5	-174.7	0	0	0	0	109.2	W360 C361 E362 Y397 W398 Y409 V413	W360-V411 HydrophobicContact CD2-CG1 3.79Å; W360-V411 HydrophobicContact CE3-CG1 4.4Å; W360-V411 HydrophobicContact CG-CG1 4.11Å; W360-V411 HydrophobicContact CZ2-CG1 4Å; W360-V411 HydrophobicContact CZ2-CG2 4.14Å; C361-V411 CarbonylContact O-C 3.59Å; C361-V411 VanDerWaalsContact O-CA 3.29Å; C361-V411 WeakPolarHBondContact O-CA 3.27Å; E362-V411 HydrophobicContact CG-CG2 4.49Å; Y397-V411 CarbonylContact C-O 3.54Å; Y397-V411 WeakPolarHBondContact CA-O 3.25Å; Y397-V411 VanDerWaalsContact CB-O 3.3Å; Y397-V411 WeakPolarHBondContact CB-O 3.4Å; W398-V411 HydrophobicContact CD2-CB 4.17Å; W398-V411 HydrophobicContact CH2-CB 4.44Å; W398-V411 HydrophobicContact CH2-CG1 3.81Å; W398-V411 HydrophobicContact CZ2-CB 3.8Å; W398-V411 HydrophobicContact CZ2-CG1 3.45Å; W398-V411 VanDerWaalsContact CZ2-CG1 3.45Å; W398-V411 HydrophobicContact CZ2-CG2 4.25Å; W398-V411 PolarHBondContact N-O 3.35Å; W398-V411 PolarHBondContact O-N 2.96Å; Y409-V411 HydrophobicContact CD2-CG2 3.82Å; Y409-V411 HydrophobicContact CE2-CG2 3.56Å; V411-V413 HydrophobicContact CG1-CG2 4.38Å
412	L	90	Very high	85.7	Confident	9 Å²	9	54.6 Å²	54.6	5%	0.047	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	137	170	-46.1	79.3	0	0	0	107.9	C361 L363 F376 F394	C361-L412 HydrophobicContact CB-CB 4.27Å; C361-L412 HydrophobicContact CB-CD1 4.23Å; C361-L412 PolarHBondContact N-O 2.85Å; C361-L412 PolarHBondContact O-N 3.46Å; L363-L412 HydrophobicContact CD1-CD1 3.71Å; L363-L412 HydrophobicContact CG-CD1 3.75Å; F376-L412 HydrophobicContact CZ-CD1 4.21Å; F376-L412 HydrophobicContact CZ-CD2 3.75Å; F376-L412 HydrophobicContact CZ-CG 4.09Å; F394-L412 HydrophobicContact CE2-CB 3.9Å; F394-L412 HydrophobicContact CE2-CD2 3.66Å; F394-L412 HydrophobicContact CE2-CG 4.27Å; F394-L412 HydrophobicContact CZ-CB 4.06Å; F394-L412 HydrophobicContact CZ-CD2 4Å; F394-L412 HydrophobicContact CZ-CG 4.3Å
413	V	93.8	Very high	86.4	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	123.1	177.6	-171.2	0	0	0	0	110.1	F331 V358 A359 Y395 D396 W398 V411	F331-V413 HydrophobicContact CB-CG2 4.3Å; F331-V413 HydrophobicContact CD1-CG1 3.73Å; F331-V413 HydrophobicContact CD2-CB 4.46Å; F331-V413 HydrophobicContact CD2-CG1 4.46Å; F331-V413 HydrophobicContact CD2-CG2 3.99Å; F331-V413 HydrophobicContact CE1-CG1 3.92Å; F331-V413 HydrophobicContact CE2-CG2 4.49Å; F331-V413 HydrophobicContact CG-CB 4.45Å; F331-V413 HydrophobicContact CG-CG1 4.01Å; F331-V413 HydrophobicContact CG-CG2 4.03Å; F331-V413 HydrophobicContact CZ-CG1 4.37Å; V358-V413 HydrophobicContact CB-CG1 3.71Å; V358-V413 HydrophobicContact CG1-CG1 4.15Å; V358-V413 HydrophobicContact CG2-CG1 3.62Å; A359-V413 WeakPolarHBondContact O-CA 3.45Å; Y395-V413 HydrophobicContact CD2-CG1 4.18Å; Y395-V413 PolarHBondContact N-O 3.45Å; D396-V413 PolarHBondContact O-N 2.89Å; W398-V413 HydrophobicContact CH2-CG2 3.4Å; W398-V413 VanDerWaalsContact CH2-CG2 3.4Å; W398-V413 HydrophobicContact CZ3-CG2 3.6Å; V411-V413 HydrophobicContact CG1-CG2 4.38Å
414	T	94.3	Very high	87.4	Confident	28 Å²	28	51.6 Å²	51.6	17%	0.172	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	167.4	-179.2	71.4	0	0	0	0	112.5	V358 A359 R393 F394 L416	V358-T414 WeakPolarHBondContact CB-O 3.35Å; A359-T414 PolarHBondContact N-O 2.93Å; A359-T414 PolarHBondContact O-N 3.33Å; R393-T414 CarbonylContact O-C 3.41Å; R393-T414 VanDerWaalsContact O-CA 3.25Å; R393-T414 WeakPolarHBondContact O-CA 3.48Å; R393-T414 WeakPolarHBondContact O-CB 3.19Å; F394-T414 HydrophobicContact CD2-CG2 3.74Å; F394-T414 HydrophobicContact CE2-CG2 4.28Å; T414-L416 PolarHBondContact O-N 3.25Å
415	E	94.7	Very high	88.3	Confident	44 Å²	44	48.8 Å²	48.8	21%	0.206	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56	133.2	169.8	176.7	-179.4	-171.9	0	0	111.8	V392 R393 Y395 M417 K478	V392-E415 HydrophobicContact CG1-CB 3.93Å; R393-E415 HydrophobicContact CB-CB 4.07Å; R393-E415 PolarHBondContact N-OE2 3.19Å; R393-E415 VanDerWaalsContact N-OE2 3.08Å; R393-E415 PolarHBondContact O-N 3.45Å; Y395-E415 HydrophobicContact CE2-CB 4.25Å; E415-M417 HydrophobicContact CG-SD 4.05Å; E415-M417 PolarHBondContact O-N 2.89Å; E415-K478 IonicContact OE1-NZ 3.39Å; E415-K478 PolarHBondContact OE1-NZ 3.37Å; E415-K478 IonicContact OE2-NZ 2.61Å; E415-K478 PolarHBondContact OE2-NZ 3.21Å
416	L	94.7	Very high	89.2	Confident	37 Å²	37	46.9 Å²	46.9	19%	0.194	22%	0.222	C	C	.	.			trans	-83.4	104.5	-178.7	-180	57	0	0	0	111.5	L338 R348 A357 A359 T414 T418	L338-L416 HydrophobicContact CD1-CD1 3.45Å; L338-L416 VanDerWaalsContact CD1-CD1 3.45Å; R348-L416 HydrophobicContact CG-CD2 4.42Å; A357-L416 HydrophobicContact CB-CD2 3.74Å; A357-L416 WeakPolarHBondContact O-CB 3.47Å; A359-L416 HydrophobicContact CB-CD1 4.2Å; T414-L416 PolarHBondContact O-N 3.25Å; L416-T418 HydrophobicContact CD2-CG2 4.22Å; L416-T418 HydrophobicContact CG-CG2 3.94Å; L416-T418 PolarHBondContact O-N 3.35Å; L416-T418 VanDerWaalsContact O-N 3.11Å
417	M	94.2	Very high	90.1	Very high	23 Å²	23	49.2 Å²	49.2	11%	0.113	23%	0.232	C	C	.	.			trans	-83.1	86.4	-178.7	-62.6	-55.7	-60.2	0	0	112.2	V392 E415 S419 F469 T471 K478	V392-M417 HydrophobicContact CG1-CG 4.23Å; V392-M417 HydrophobicContact CG2-CG 3.85Å; V392-M417 HydrophobicContact CG2-SD 4.13Å; E415-M417 HydrophobicContact CG-SD 4.05Å; E415-M417 PolarHBondContact O-N 2.89Å; M417-S419 PolarHBondContact O-N 3.12Å; M417-F469 HydrophobicContact CB-CB 3.74Å; M417-F469 HydrophobicContact CB-CD1 3.41Å; M417-F469 VanDerWaalsContact CB-CD1 3.41Å; M417-F469 HydrophobicContact CB-CE1 4.18Å; M417-F469 HydrophobicContact CB-CG 3.71Å; M417-F469 HydrophobicContact CE-CB 3.59Å; M417-F469 HydrophobicContact CG-CB 3.64Å; M417-F469 HydrophobicContact CG-CD1 3.91Å; M417-F469 HydrophobicContact CG-CD2 4.3Å; M417-F469 HydrophobicContact CG-CG 3.69Å; M417-F469 HydrophobicContact SD-CB 4.37Å; M417-T471 HydrophobicContact CE-CG2 3.87Å; M417-K478 HydrophobicContact CE-CB 4.1Å; M417-K478 HydrophobicContact CE-CD 4.04Å; M417-K478 HydrophobicContact CE-CG 4.36Å; M417-K478 HydrophobicContact SD-CD 3.99Å
418	T	91	Very high	90.7	Very high	80 Å²	80	45.6 Å²	45.6	49%	0.491	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-24.6	-170.2	55	0	0	0	0	116.1	W74 L416 G420	W74-T418 WeakPolarHBondContact CZ2-O 3.24Å; L416-T418 HydrophobicContact CD2-CG2 4.22Å; L416-T418 HydrophobicContact CG-CG2 3.94Å; L416-T418 PolarHBondContact O-N 3.35Å; L416-T418 VanDerWaalsContact O-N 3.11Å; T418-G420 VanDerWaalsContact C-N 3.32Å; T418-G420 PolarHBondContact O-N 2.72Å
419	S	91.4	Very high	90.9	Very high	34 Å²	34	43.8 Å²	43.8	24%	0.238	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-0.2	-177.8	-65.3	0	0	0	0	114.3	M417 I470 T471	M417-S419 PolarHBondContact O-N 3.12Å; S419-I470 WeakPolarHBondContact CB-O 3.42Å; S419-I470 WeakPolarHBondContact O-CD1 3.39Å; S419-T471 PolarHBondContact OG-O 2.82Å
420	G	91.8	Very high	90.6	Very high	10 Å²	10	50 Å²	50	10%	0.103	24%	0.238	C	C	.	.			trans	85.8	-162.6	176.5	0	0	0	0	0	114.7	T418 F469 I470	T418-G420 VanDerWaalsContact C-N 3.32Å; T418-G420 PolarHBondContact O-N 2.72Å; G420-F469 WeakPolarHBondContact O-CA 3.4Å; G420-I470 WeakPolarHBondContact O-CG1 3.49Å; G420-I470 PolarHBondContact O-N 3.01Å
421	T	93.7	Very high	90.4	Very high	14 Å²	14	60.7 Å²	60.7	9%	0.086	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-107.5	163.3	-170.7	75.9	0	0	0	0	112.7	K423 M424 Y425 D466 I468 F469	T421-K423 VanDerWaalsContact C-N 3.26Å; T421-K423 PolarHBondContact O-N 3.17Å; T421-M424 HydrophobicContact CG2-SD 4.09Å; T421-M424 WeakPolarHBondContact O-CB 3.44Å; T421-M424 PolarHBondContact O-N 3.3Å; T421-M424 VanDerWaalsContact O-N 3.15Å; T421-M424 WeakPolarHBondContact OG1-CG 3.49Å; T421-M424 PolarHBondContact OG1-N 3.24Å; T421-M424 VanDerWaalsContact OG1-N 3.16Å; T421-Y425 PolarHBondContact O-N 3.44Å; T421-D466 WeakPolarHBondContact CB-O 3.44Å; T421-D466 WeakPolarHBondContact CG2-O 3.45Å; T421-I468 CarbonylContact C-O 3.54Å; T421-I468 WeakPolarHBondContact CA-O 3.41Å; T421-F469 HydrophobicContact CG2-CD1 3.99Å; T421-F469 HydrophobicContact CG2-CE1 3.9Å
422	L	93.8	Very high	90.2	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-59.5	-36.5	175.1	178	58.3	0	0	0	112	Y425 L426 I432 W440 C465 I468 M528	L422-Y425 WeakPolarHBondContact O-CB 3.33Å; L422-Y425 PolarHBondContact O-N 2.7Å; L422-L426 HydrophobicContact CG-CD1 4.35Å; L422-L426 WeakPolarHBondContact O-CG 3.41Å; L422-L426 PolarHBondContact O-N 3.4Å; L422-I432 HydrophobicContact CD1-CD1 4.16Å; L422-W440 HydrophobicContact CD1-CE3 3.65Å; L422-W440 HydrophobicContact CD1-CZ3 3.58Å; L422-C465 HydrophobicContact CB-CB 4.16Å; L422-C465 WeakPolarHBondContact CB-O 3.25Å; L422-C465 HydrophobicContact CD2-CB 4.21Å; L422-C465 HydrophobicContact CG-CB 4.09Å; L422-C465 PolarHBondContact N-O 3.46Å; L422-I468 HydrophobicContact CB-CB 4.2Å; L422-I468 HydrophobicContact CB-CG2 4.18Å; L422-I468 HydrophobicContact CD2-CB 4.3Å; L422-I468 HydrophobicContact CD2-CD1 4.19Å; L422-I468 HydrophobicContact CD2-CG2 4.07Å; L422-I468 PolarHBondContact N-O 2.95Å; L422-M528 HydrophobicContact CD1-CG 3.94Å; L422-M528 HydrophobicContact CD1-SD 3.87Å; L422-M528 HydrophobicContact CD2-CE 4.01Å; L422-M528 HydrophobicContact CD2-CG 3.85Å; L422-M528 HydrophobicContact CD2-SD 3.64Å; L422-M528 HydrophobicContact CG-CG 4.15Å; L422-M528 HydrophobicContact CG-SD 4.29Å
423	K	92.5	Very high	90.1	Very high	68 Å²	68	66 Å²	66	30%	0.296	31%	0.307	S	S	.	.	H	α-helix	trans	-67.2	-40	173.3	-166.3	-174.5	-158.6	174.5	0	112.5	T421 Y425 L426 K427 C465 D466	T421-K423 VanDerWaalsContact C-N 3.26Å; T421-K423 PolarHBondContact O-N 3.17Å; K423-Y425 VanDerWaalsContact C-N 3.3Å; K423-Y425 PolarHBondContact O-N 3.28Å; K423-L426 PolarHBondContact O-N 2.72Å; K423-K427 WeakPolarHBondContact O-CB 3.41Å; K423-K427 PolarHBondContact O-N 3.43Å; K423-C465 HydrophobicContact CB-CB 3.95Å; K423-C465 PolarHBondContact N-O 2.85Å; K423-D466 WeakPolarHBondContact CD-OD1 3.42Å; K423-D466 VanDerWaalsContact CD-OD2 3.27Å; K423-D466 WeakPolarHBondContact CD-OD2 3.3Å; K423-D466 IonicContact NZ-OD1 2.71Å; K423-D466 IonicContact NZ-OD2 3.12Å; K423-D466 PolarHBondContact NZ-OD2 3.37Å
424	M	92.4	Very high	89.7	Confident	117 Å²	117	68.2 Å²	68.2	58%	0.576	32%	0.318	S	S	*	.	H	α-helix	trans	-62.2	-39.3	172.6	-68.9	171	69.5	0	0	111.3	T421 R428	T421-M424 HydrophobicContact CG2-SD 4.09Å; T421-M424 WeakPolarHBondContact O-CB 3.44Å; T421-M424 PolarHBondContact O-N 3.3Å; T421-M424 VanDerWaalsContact O-N 3.15Å; T421-M424 WeakPolarHBondContact OG1-CG 3.49Å; T421-M424 PolarHBondContact OG1-N 3.24Å; T421-M424 VanDerWaalsContact OG1-N 3.16Å; M424-R428 WeakPolarHBondContact O-CB 3.49Å; M424-R428 PolarHBondContact O-N 3.37Å
425	Y	92.1	Very high	89.4	Confident	33 Å²	33	72.5 Å²	72.5	13%	0.129	33%	0.334	C	S	.	.	H	α-helix	trans	-63.3	-50.5	174.6	-173	-82.9	0	0	0	111.5	T421 L422 K423 K427 R428 F429 I432 W440 I470	T421-Y425 PolarHBondContact O-N 3.44Å; L422-Y425 WeakPolarHBondContact O-CB 3.33Å; L422-Y425 PolarHBondContact O-N 2.7Å; K423-Y425 VanDerWaalsContact C-N 3.3Å; K423-Y425 PolarHBondContact O-N 3.28Å; Y425-K427 PolarHBondContact O-N 3.27Å; Y425-R428 PolarHBondContact O-N 2.93Å; Y425-F429 HydrophobicContact CD1-CB 4.39Å; Y425-F429 AromaticContact CD1-CD2 3.94Å; Y425-F429 HydrophobicContact CD1-CD2 3.94Å; Y425-F429 AromaticContact CD2-CD2 3.52Å; Y425-F429 HydrophobicContact CD2-CD2 3.52Å; Y425-F429 AromaticContact CD2-CE2 3.67Å; Y425-F429 HydrophobicContact CD2-CE2 3.67Å; Y425-F429 HydrophobicContact CE1-CB 4.01Å; Y425-F429 AromaticContact CE1-CD2 3.87Å; Y425-F429 HydrophobicContact CE1-CD2 3.87Å; Y425-F429 HydrophobicContact CE1-CG 4.23Å; Y425-F429 AromaticContact CE2-CD2 3.47Å; Y425-F429 HydrophobicContact CE2-CD2 3.47Å; Y425-F429 VanDerWaalsContact CE2-CD2 3.47Å; Y425-F429 AromaticContact CE2-CE2 3.63Å; Y425-F429 HydrophobicContact CE2-CE2 3.63Å; Y425-F429 HydrophobicContact CE2-CG 4.34Å; Y425-F429 AromaticContact CG-CD2 3.76Å; Y425-F429 HydrophobicContact CG-CD2 3.76Å; Y425-F429 HydrophobicContact CG-CE2 4.32Å; Y425-F429 AromaticContact CZ-CD2 3.66Å; Y425-F429 WeakPolarHBondContact O-CD2 3.29Å; Y425-F429 PolarHBondContact O-N 2.95Å; Y425-I432 HydrophobicContact CD1-CG1 4.41Å; Y425-I432 HydrophobicContact CE1-CG1 4.12Å; Y425-W440 AromaticContact CD1-CH2 3.88Å; Y425-W440 HydrophobicContact CD1-CH2 3.88Å; Y425-W440 AromaticContact CD1-CZ3 3.9Å; Y425-W440 HydrophobicContact CD1-CZ3 3.9Å; Y425-W440 AromaticContact CD2-CH2 3.86Å; Y425-W440 HydrophobicContact CD2-CH2 3.86Å; Y425-W440 AromaticContact CE1-CH2 3.82Å; Y425-W440 HydrophobicContact CE1-CH2 3.82Å; Y425-W440 AromaticContact CE1-CZ3 4Å; Y425-W440 HydrophobicContact CE1-CZ3 4Å; Y425-W440 AromaticContact CE2-CH2 3.77Å; Y425-W440 HydrophobicContact CE2-CH2 3.77Å; Y425-W440 AromaticContact CG-CH2 3.91Å; Y425-W440 HydrophobicContact CG-CH2 3.91Å; Y425-W440 HydrophobicContact CG-CZ3 4.23Å; Y425-W440 AromaticContact CZ-CH2 3.75Å; Y425-I470 HydrophobicContact CD2-CD1 3.87Å; Y425-I470 HydrophobicContact CG-CD1 4.5Å
426	L	91.5	Very high	89.1	Confident	9 Å²	9	72.4 Å²	72.4	5%	0.047	34%	0.337	C	S	.	.	H	α-helix	trans	-57.7	-47	178.2	-77.9	164.8	0	0	0	112	L422 K423 R428 F429 K430 I432 E527 M528	L422-L426 HydrophobicContact CG-CD1 4.35Å; L422-L426 WeakPolarHBondContact O-CG 3.41Å; L422-L426 PolarHBondContact O-N 3.4Å; K423-L426 PolarHBondContact O-N 2.72Å; L426-R428 PolarHBondContact O-N 2.97Å; L426-F429 PolarHBondContact O-N 2.85Å; L426-K430 WeakPolarHBondContact O-CA 3.39Å; L426-K430 PolarHBondContact O-N 3.02Å; L426-I432 HydrophobicContact CD2-CD1 3.71Å; L426-I432 HydrophobicContact CD2-CG1 3.85Å; L426-I432 HydrophobicContact CG-CD1 4.26Å; L426-E527 HydrophobicContact CD1-CG 4.07Å; L426-M528 HydrophobicContact CD1-CG 4.19Å
427	K	89.8	Confident	89	Confident	187 Å²	187	70.9 Å²	70.9	81%	0.813	33%	0.329	S	S	*	.	H	α-helix	trans	-58.9	-30.4	176	-172.7	173.7	-178.7	177	0	113.2	K423 Y425	K423-K427 WeakPolarHBondContact O-CB 3.41Å; K423-K427 PolarHBondContact O-N 3.43Å; Y425-K427 PolarHBondContact O-N 3.27Å
428	R	86.6	Confident	88.8	Confident	117 Å²	117	72.3 Å²	72.3	44%	0.442	33%	0.334	S	S	.	.	H	α-helix	trans	-88	-38.4	179.6	-174.4	168.2	178	140.9	6.1	113.6	D73 M424 Y425 L426	D73-R428 IonicContact OD2-CZ 2.72Å; D73-R428 IonicContact OD2-NH2 3.69Å; D73-R428 PolarHBondContact OD2-NH2 3.41Å; M424-R428 WeakPolarHBondContact O-CB 3.49Å; M424-R428 PolarHBondContact O-N 3.37Å; Y425-R428 PolarHBondContact O-N 2.93Å; L426-R428 PolarHBondContact O-N 2.97Å
429	F	82.6	Confident	88.9	Confident	74 Å²	74	70.5 Å²	70.5	33%	0.325	33%	0.325	S	S	.	.	H	α-helix	trans	-109.9	-13.9	-168.4	-63.8	-71.9	0	0	0	115.3	V70 Y425 L426 R431	V70-F429 HydrophobicContact CG1-CE1 4.27Å; V70-F429 HydrophobicContact CG1-CZ 4.11Å; Y425-F429 HydrophobicContact CD1-CB 4.39Å; Y425-F429 AromaticContact CD1-CD2 3.94Å; Y425-F429 HydrophobicContact CD1-CD2 3.94Å; Y425-F429 AromaticContact CD2-CD2 3.52Å; Y425-F429 HydrophobicContact CD2-CD2 3.52Å; Y425-F429 AromaticContact CD2-CE2 3.67Å; Y425-F429 HydrophobicContact CD2-CE2 3.67Å; Y425-F429 HydrophobicContact CE1-CB 4.01Å; Y425-F429 AromaticContact CE1-CD2 3.87Å; Y425-F429 HydrophobicContact CE1-CD2 3.87Å; Y425-F429 HydrophobicContact CE1-CG 4.23Å; Y425-F429 AromaticContact CE2-CD2 3.47Å; Y425-F429 HydrophobicContact CE2-CD2 3.47Å; Y425-F429 VanDerWaalsContact CE2-CD2 3.47Å; Y425-F429 AromaticContact CE2-CE2 3.63Å; Y425-F429 HydrophobicContact CE2-CE2 3.63Å; Y425-F429 HydrophobicContact CE2-CG 4.34Å; Y425-F429 AromaticContact CG-CD2 3.76Å; Y425-F429 HydrophobicContact CG-CD2 3.76Å; Y425-F429 HydrophobicContact CG-CE2 4.32Å; Y425-F429 AromaticContact CZ-CD2 3.66Å; Y425-F429 WeakPolarHBondContact O-CD2 3.29Å; Y425-F429 PolarHBondContact O-N 2.95Å; L426-F429 PolarHBondContact O-N 2.85Å; F429-R431 PolarHBondContact O-N 3.38Å
430	K	76.5	Confident	89	Confident	165 Å²	165	69 Å²	69	72%	0.717	31%	0.314	S	S	*	.	S	Bend	trans	58	-27.5	176.9	-67.5	-167.5	174.1	-169.3	0	118.7	L426	L426-K430 WeakPolarHBondContact O-CA 3.39Å; L426-K430 PolarHBondContact O-N 3.02Å
431	R	81.3	Confident	89.2	Confident	226 Å²	226	68.5 Å²	68.5	85%	0.853	31%	0.309	S	S	*	.	S	Bend	trans	-138.8	127.6	176.2	-71.8	-174.8	173	-179.9	-2.5	110	F429	F429-R431 PolarHBondContact O-N 3.38Å
432	I	86.3	Confident	89.3	Confident	22 Å²	22	69.6 Å²	69.6	11%	0.113	31%	0.311	C	S	.	.			trans	-90.7	138.6	174	-52.1	-174.7	0	0	0	108.9	L422 Y425 L426 I434 V436 L437 W440 M528	L422-I432 HydrophobicContact CD1-CD1 4.16Å; Y425-I432 HydrophobicContact CD1-CG1 4.41Å; Y425-I432 HydrophobicContact CE1-CG1 4.12Å; L426-I432 HydrophobicContact CD2-CD1 3.71Å; L426-I432 HydrophobicContact CD2-CG1 3.85Å; L426-I432 HydrophobicContact CG-CD1 4.26Å; I432-I434 PolarHBondContact O-N 2.82Å; I432-V436 HydrophobicContact CG2-CB 3.98Å; I432-V436 HydrophobicContact CG2-CG1 3.99Å; I432-L437 HydrophobicContact CB-CB 4.48Å; I432-L437 HydrophobicContact CB-CD1 4.4Å; I432-L437 HydrophobicContact CG2-CB 3.93Å; I432-W440 HydrophobicContact CD1-CE3 4.22Å; I432-W440 HydrophobicContact CD1-CZ3 3.96Å; I432-W440 HydrophobicContact CG2-CZ3 4.42Å; I432-M528 HydrophobicContact CD1-CB 3.99Å; I432-M528 HydrophobicContact CD1-CG 3.7Å; I432-M528 HydrophobicContact CD1-SD 4.1Å
433	N	86.5	Confident	89.4	Confident	99 Å²	99	70.9 Å²	70.9	53%	0.529	32%	0.318	S	S	.	.			trans	-65.8	131.6	170.3	-180	-44.1	0	0	0	109.8	K435 V436 L437	N433-K435 PolarHBondContact O-N 2.67Å; N433-K435 PolarHBondContact OD1-N 3.27Å; N433-V436 HydrophobicContact CB-CB 4.5Å; N433-V436 HydrophobicContact CB-CG2 4.17Å; N433-V436 WeakPolarHBondContact O-CA 3.35Å; N433-V436 WeakPolarHBondContact O-CB 3.44Å; N433-V436 PolarHBondContact O-N 2.9Å; N433-L437 PolarHBondContact O-N 2.99Å
434	I	87.1	Confident	89.7	Confident	46 Å²	46	67.7 Å²	67.7	24%	0.236	30%	0.304	C	S	.	.	H	α-helix	trans	-50.8	-34.9	-177.7	-173.7	56.8	0	0	0	114.2	I432 L437 K438 Y564 I567 F593	I432-I434 PolarHBondContact O-N 2.82Å; I434-L437 HydrophobicContact CD1-CD2 4.28Å; I434-L437 PolarHBondContact O-N 3.16Å; I434-K438 HydrophobicContact CD1-CG 4.48Å; I434-K438 WeakPolarHBondContact O-CB 3.3Å; I434-K438 WeakPolarHBondContact O-CG 3.31Å; I434-K438 PolarHBondContact O-N 2.56Å; I434-Y564 HydrophobicContact CD1-CE1 4.49Å; I434-Y564 HydrophobicContact CG1-CE1 4.23Å; I434-I567 HydrophobicContact CD1-CD1 3.68Å; I434-F593 HydrophobicContact CD1-CE2 3.92Å; I434-F593 HydrophobicContact CD1-CZ 3.72Å
435	K	86.5	Confident	89.9	Confident	117 Å²	117	62.1 Å²	62.1	51%	0.509	28%	0.276	S	S	.	.	H	α-helix	trans	-67	-40.7	175.6	-67	-170.2	174.9	-171.6	0	112.4	N433 S439	N433-K435 PolarHBondContact O-N 2.67Å; N433-K435 PolarHBondContact OD1-N 3.27Å; K435-S439 WeakPolarHBondContact O-CB 3.49Å; K435-S439 PolarHBondContact O-N 3.34Å; K435-S439 VanDerWaalsContact O-N 3.1Å
436	V	89.4	Confident	90.1	Very high	43 Å²	43	65.2 Å²	65.2	26%	0.261	29%	0.29	S	S	.	.	H	α-helix	trans	-68	-44.4	175.8	178.9	0	0	0	0	109.8	I432 N433 S439 W440	I432-V436 HydrophobicContact CG2-CB 3.98Å; I432-V436 HydrophobicContact CG2-CG1 3.99Å; N433-V436 HydrophobicContact CB-CB 4.5Å; N433-V436 HydrophobicContact CB-CG2 4.17Å; N433-V436 WeakPolarHBondContact O-CA 3.35Å; N433-V436 WeakPolarHBondContact O-CB 3.44Å; N433-V436 PolarHBondContact O-N 2.9Å; V436-S439 WeakPolarHBondContact O-CB 3.21Å; V436-S439 PolarHBondContact O-N 3.42Å; V436-S439 VanDerWaalsContact O-N 3.11Å; V436-W440 HydrophobicContact CG1-CD2 3.69Å; V436-W440 VanDerWaalsContact CG1-CE2 3.49Å; V436-W440 HydrophobicContact CG1-CE3 4.02Å; V436-W440 HydrophobicContact CG1-CG 4.28Å; V436-W440 HydrophobicContact CG1-CH2 4.01Å; V436-W440 HydrophobicContact CG1-CZ2 3.67Å; V436-W440 HydrophobicContact CG1-CZ3 4.17Å; V436-W440 PolarHBondContact O-N 3.34Å
437	L	92.1	Very high	90.4	Very high	5 Å²	5	64.8 Å²	64.8	3%	0.026	29%	0.288	C	S	.	.	H	α-helix	trans	-58.6	-50.9	177.2	-172.5	144	0	0	0	111.7	I432 N433 I434 S439 W440 C441 L525 M528 V529 F593	I432-L437 HydrophobicContact CB-CB 4.48Å; I432-L437 HydrophobicContact CB-CD1 4.4Å; I432-L437 HydrophobicContact CG2-CB 3.93Å; N433-L437 PolarHBondContact O-N 2.99Å; I434-L437 HydrophobicContact CD1-CD2 4.28Å; I434-L437 PolarHBondContact O-N 3.16Å; L437-S439 VanDerWaalsContact C-N 3.27Å; L437-S439 PolarHBondContact O-N 2.91Å; L437-W440 PolarHBondContact O-N 3.12Å; L437-C441 WeakPolarHBondContact O-CB 3.37Å; L437-C441 PolarHBondContact O-N 3.06Å; L437-C441 PolarHBondContact O-SG 3.09Å; L437-L525 HydrophobicContact CD2-CD1 3.82Å; L437-M528 HydrophobicContact CD1-CB 3.91Å; L437-V529 HydrophobicContact CD1-CG2 3.75Å; L437-V529 HydrophobicContact CD2-CG2 4.47Å; L437-F593 HydrophobicContact CD2-CE1 4.24Å; L437-F593 HydrophobicContact CD2-CZ 4.07Å
438	K	90.9	Very high	90.7	Very high	52 Å²	52	55.9 Å²	55.9	23%	0.226	25%	0.249	C	C	.	.	H	α-helix	trans	-54.2	-42.8	172.5	-79.6	-173	170	-155.1	0	112.2	I434 R442 F593	I434-K438 HydrophobicContact CD1-CG 4.48Å; I434-K438 WeakPolarHBondContact O-CB 3.3Å; I434-K438 WeakPolarHBondContact O-CG 3.31Å; I434-K438 PolarHBondContact O-N 2.56Å; K438-R442 VanDerWaalsContact O-CB 3.25Å; K438-R442 WeakPolarHBondContact O-CB 3.35Å; K438-R442 PolarHBondContact O-N 3.43Å; K438-R442 VanDerWaalsContact O-N 3.16Å; K438-F593 HydrophobicContact CD-CD2 4.43Å; K438-F593 HydrophobicContact CD-CE2 4.23Å; K438-F593 HydrophobicContact CD-CZ 4.29Å; K438-F593 VanDerWaalsContact CD-O 3.3Å; K438-F593 WeakPolarHBondContact CD-O 3.27Å; K438-F593 WeakPolarHBondContact CE-O 3.14Å; K438-F593 HydrophobicContact CG-CD1 4.22Å; K438-F593 HydrophobicContact CG-CD2 4.48Å; K438-F593 HydrophobicContact CG-CE1 3.7Å; K438-F593 HydrophobicContact CG-CE2 4.01Å; K438-F593 HydrophobicContact CG-CZ 3.56Å; K438-F593 PolarHBondContact NZ-O 2.91Å
439	S	91.3	Very high	91.2	Very high	42 Å²	42	51.5 Å²	51.5	29%	0.294	24%	0.237	S	C	.	.	H	α-helix	trans	-66.7	-47.5	-179.8	-167.4	0	0	0	0	112.7	K435 V436 L437 Q443	K435-S439 WeakPolarHBondContact O-CB 3.49Å; K435-S439 PolarHBondContact O-N 3.34Å; K435-S439 VanDerWaalsContact O-N 3.1Å; V436-S439 WeakPolarHBondContact O-CB 3.21Å; V436-S439 PolarHBondContact O-N 3.42Å; V436-S439 VanDerWaalsContact O-N 3.11Å; L437-S439 VanDerWaalsContact C-N 3.27Å; L437-S439 PolarHBondContact O-N 2.91Å; S439-Q443 WeakPolarHBondContact O-CB 3.12Å; S439-Q443 WeakPolarHBondContact O-CG 3.49Å; S439-Q443 PolarHBondContact O-N 3.06Å; S439-Q443 PolarHBondContact O-NE2 3.43Å; S439-Q443 PolarHBondContact OG-NE2 3.32Å
440	W	94.8	Very high	91.8	Very high	3 Å²	3	49.5 Å²	49.5	1%	0.011	23%	0.228	C	C	.	.	H	α-helix	trans	-68.1	-42	179.7	-71	-9.8	0	0	0	112.3	L422 Y425 I432 V436 L437 R442 Q443 I444 I470 G475 V477	L422-W440 HydrophobicContact CD1-CE3 3.65Å; L422-W440 HydrophobicContact CD1-CZ3 3.58Å; Y425-W440 AromaticContact CD1-CH2 3.88Å; Y425-W440 HydrophobicContact CD1-CH2 3.88Å; Y425-W440 AromaticContact CD1-CZ3 3.9Å; Y425-W440 HydrophobicContact CD1-CZ3 3.9Å; Y425-W440 AromaticContact CD2-CH2 3.86Å; Y425-W440 HydrophobicContact CD2-CH2 3.86Å; Y425-W440 AromaticContact CE1-CH2 3.82Å; Y425-W440 HydrophobicContact CE1-CH2 3.82Å; Y425-W440 AromaticContact CE1-CZ3 4Å; Y425-W440 HydrophobicContact CE1-CZ3 4Å; Y425-W440 AromaticContact CE2-CH2 3.77Å; Y425-W440 HydrophobicContact CE2-CH2 3.77Å; Y425-W440 AromaticContact CG-CH2 3.91Å; Y425-W440 HydrophobicContact CG-CH2 3.91Å; Y425-W440 HydrophobicContact CG-CZ3 4.23Å; Y425-W440 AromaticContact CZ-CH2 3.75Å; I432-W440 HydrophobicContact CD1-CE3 4.22Å; I432-W440 HydrophobicContact CD1-CZ3 3.96Å; I432-W440 HydrophobicContact CG2-CZ3 4.42Å; V436-W440 HydrophobicContact CG1-CD2 3.69Å; V436-W440 VanDerWaalsContact CG1-CE2 3.49Å; V436-W440 HydrophobicContact CG1-CE3 4.02Å; V436-W440 HydrophobicContact CG1-CG 4.28Å; V436-W440 HydrophobicContact CG1-CH2 4.01Å; V436-W440 HydrophobicContact CG1-CZ2 3.67Å; V436-W440 HydrophobicContact CG1-CZ3 4.17Å; V436-W440 PolarHBondContact O-N 3.34Å; L437-W440 PolarHBondContact O-N 3.12Å; W440-R442 PolarHBondContact O-N 3.25Å; W440-Q443 WeakPolarHBondContact O-CB 3.41Å; W440-Q443 PolarHBondContact O-N 3.48Å; W440-Q443 VanDerWaalsContact O-N 3.11Å; W440-I444 WeakPolarHBondContact O-CG1 3.49Å; W440-I444 PolarHBondContact O-N 2.72Å; W440-I470 HydrophobicContact CH2-CG2 4.01Å; W440-I470 HydrophobicContact CZ2-CG2 3.85Å; W440-G475 PolarHBondContact NE1-O 2.96Å; W440-V477 HydrophobicContact CB-CG1 4.08Å; W440-V477 HydrophobicContact CB-CG2 4.01Å; W440-V477 HydrophobicContact CD2-CG1 3.89Å; W440-V477 HydrophobicContact CG-CG1 3.67Å; W440-V477 HydrophobicContact CG-CG2 4.23Å; W440-V477 WeakPolarHBondContact O-CG2 3.38Å
441	C	96.2	Very high	92.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-60.6	-47.7	176.6	-66.1	0	0	0	0	112	L437 Q443 I444 L445 F521 M528 F594	L437-C441 WeakPolarHBondContact O-CB 3.37Å; L437-C441 PolarHBondContact O-N 3.06Å; L437-C441 PolarHBondContact O-SG 3.09Å; C441-Q443 PolarHBondContact O-N 2.91Å; C441-I444 PolarHBondContact O-N 2.95Å; C441-L445 WeakPolarHBondContact O-CG 3.33Å; C441-L445 PolarHBondContact O-N 3.18Å; C441-F521 HydrophobicContact CB-CE2 3.98Å; C441-F521 HydrophobicContact CB-CZ 4.03Å; C441-M528 WeakPolarHBondContact SG-CE 3.4Å; C441-F594 HydrophobicContact CB-CD1 3.97Å; C441-F594 HydrophobicContact CB-CE1 3.23Å; C441-F594 HydrophobicContact CB-CZ 3.91Å
442	R	94.8	Very high	93.2	Very high	36 Å²	36	32.2 Å²	32.2	14%	0.136	16%	0.16	C	C	.	.	H	α-helix	trans	-58.3	-34.9	173.1	167.6	171.8	46.8	-115.2	3.7	112.8	K438 W440 K446 F594	K438-R442 VanDerWaalsContact O-CB 3.25Å; K438-R442 WeakPolarHBondContact O-CB 3.35Å; K438-R442 PolarHBondContact O-N 3.43Å; K438-R442 VanDerWaalsContact O-N 3.16Å; W440-R442 PolarHBondContact O-N 3.25Å; R442-K446 WeakPolarHBondContact O-CG 3.35Å; R442-K446 PolarHBondContact O-N 2.98Å; R442-F594 WeakPolarHBondContact CD-O 3.16Å; R442-F594 VanDerWaalsContact NH1-C 3.34Å; R442-F594 PolarHBondContact NH1-O 3.13Å
443	Q	96.3	Very high	93.4	Very high	28 Å²	28	34.6 Å²	34.6	13%	0.131	18%	0.175	C	C	.	.	H	α-helix	trans	-72.1	-39.9	176.2	-77.8	173.9	62.6	0	0	112.6	N390 S439 W440 C441 K446 G447 V477	N390-Q443 VanDerWaalsContact CB-O 3.26Å; N390-Q443 WeakPolarHBondContact CB-O 3.5Å; N390-Q443 WeakPolarHBondContact ND2-CB 3.5Å; N390-Q443 WeakPolarHBondContact ND2-CG 3.42Å; N390-Q443 PolarHBondContact ND2-OE1 2.73Å; N390-Q443 VanDerWaalsContact ND2-OE1 3.14Å; S439-Q443 WeakPolarHBondContact O-CB 3.12Å; S439-Q443 WeakPolarHBondContact O-CG 3.49Å; S439-Q443 PolarHBondContact O-N 3.06Å; S439-Q443 PolarHBondContact O-NE2 3.43Å; S439-Q443 PolarHBondContact OG-NE2 3.32Å; W440-Q443 WeakPolarHBondContact O-CB 3.41Å; W440-Q443 PolarHBondContact O-N 3.48Å; W440-Q443 VanDerWaalsContact O-N 3.11Å; C441-Q443 PolarHBondContact O-N 2.91Å; Q443-K446 PolarHBondContact O-N 3.46Å; Q443-G447 PolarHBondContact O-N 2.95Å; Q443-V477 HydrophobicContact CB-CG2 3.46Å; Q443-V477 VanDerWaalsContact CB-CG2 3.46Å; Q443-V477 HydrophobicContact CG-CG2 4.46Å
444	I	97.8	Very high	93.6	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.2	-48.9	171.6	-63.6	154.4	0	0	0	109.5	W440 C441 K446 G447 L448 I468 V477 I479 F521 M528	W440-I444 WeakPolarHBondContact O-CG1 3.49Å; W440-I444 PolarHBondContact O-N 2.72Å; C441-I444 PolarHBondContact O-N 2.95Å; I444-K446 VanDerWaalsContact C-N 3.31Å; I444-K446 PolarHBondContact O-N 3.45Å; I444-G447 CarbonylContact O-C 3.52Å; I444-G447 WeakPolarHBondContact O-CA 3.43Å; I444-G447 PolarHBondContact O-N 3.31Å; I444-L448 HydrophobicContact CG2-CD1 4.24Å; I444-L448 HydrophobicContact CG2-CG 4.38Å; I444-L448 WeakPolarHBondContact O-CG 3.23Å; I444-L448 PolarHBondContact O-N 3.41Å; I444-I468 HydrophobicContact CD1-CD1 3.85Å; I444-I468 HydrophobicContact CD1-CG2 4.2Å; I444-I468 HydrophobicContact CG1-CD1 4.18Å; I444-I468 HydrophobicContact CG1-CG2 4.16Å; I444-V477 HydrophobicContact CG1-CG2 4.02Å; I444-I479 HydrophobicContact CG2-CD1 4.04Å; I444-F521 HydrophobicContact CB-CD2 4.32Å; I444-F521 HydrophobicContact CB-CE2 4.41Å; I444-F521 HydrophobicContact CG2-CD2 3.82Å; I444-F521 HydrophobicContact CG2-CE2 4.4Å; I444-M528 HydrophobicContact CD1-CE 4.07Å
445	L	97.7	Very high	93.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59.6	-37.6	177	-69.6	169.6	0	0	0	112.7	C441 S449 F521 V585 L588 L589 F594	C441-L445 WeakPolarHBondContact O-CG 3.33Å; C441-L445 PolarHBondContact O-N 3.18Å; L445-S449 WeakPolarHBondContact O-CB 3.44Å; L445-S449 PolarHBondContact O-N 3.14Å; L445-F521 HydrophobicContact CD1-CE1 4.18Å; L445-F521 HydrophobicContact CD1-CE2 4.21Å; L445-F521 HydrophobicContact CD1-CZ 3.7Å; L445-F521 HydrophobicContact CD2-CD1 3.93Å; L445-F521 HydrophobicContact CD2-CD2 4.12Å; L445-F521 HydrophobicContact CD2-CE1 3.82Å; L445-F521 HydrophobicContact CD2-CE2 4.01Å; L445-F521 HydrophobicContact CD2-CG 4.09Å; L445-F521 HydrophobicContact CD2-CZ 3.85Å; L445-F521 HydrophobicContact CG-CD2 4.26Å; L445-F521 HydrophobicContact CG-CE1 4.17Å; L445-F521 HydrophobicContact CG-CE2 3.74Å; L445-F521 HydrophobicContact CG-CZ 3.68Å; L445-V585 HydrophobicContact CB-CG1 4.3Å; L445-V585 HydrophobicContact CD2-CG1 4.01Å; L445-V585 VanDerWaalsContact O-CG1 3.22Å; L445-V585 WeakPolarHBondContact O-CG1 3.43Å; L445-L588 HydrophobicContact CD1-CB 3.83Å; L445-L588 HydrophobicContact CD2-CB 3.82Å; L445-L588 HydrophobicContact CD2-CD1 3.77Å; L445-L588 HydrophobicContact CD2-CG 4.46Å; L445-L588 HydrophobicContact CG-CB 4.48Å; L445-L589 HydrophobicContact CB-CD2 3.59Å; L445-L589 HydrophobicContact CB-CG 3.92Å; L445-F594 HydrophobicContact CD1-CD1 4.45Å; L445-F594 HydrophobicContact CD1-CD2 3.73Å; L445-F594 HydrophobicContact CD1-CE2 3.86Å; L445-F594 HydrophobicContact CD1-CG 4.04Å; L445-F594 HydrophobicContact CD1-CZ 4.32Å
446	K	97.1	Very high	93.2	Very high	98 Å²	98	35.6 Å²	35.6	43%	0.426	18%	0.182	S	C	.	.	H	α-helix	trans	-64.1	-42.1	171.2	-78.4	-177.9	177.1	-169.5	0	112.1	R442 Q443 I444 S449 F450 L589	R442-K446 WeakPolarHBondContact O-CG 3.35Å; R442-K446 PolarHBondContact O-N 2.98Å; Q443-K446 PolarHBondContact O-N 3.46Å; I444-K446 VanDerWaalsContact C-N 3.31Å; I444-K446 PolarHBondContact O-N 3.45Å; K446-S449 PolarHBondContact O-N 3.32Å; K446-F450 WeakPolarHBondContact O-CB 3.42Å; K446-F450 PolarHBondContact O-N 2.86Å; K446-L589 HydrophobicContact CG-CD2 3.96Å
447	G	96.7	Very high	93	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59	-50.9	173.9	0	0	0	0	0	112.5	Q443 I444 F450 L451	Q443-G447 PolarHBondContact O-N 2.95Å; I444-G447 CarbonylContact O-C 3.52Å; I444-G447 WeakPolarHBondContact O-CA 3.43Å; I444-G447 PolarHBondContact O-N 3.31Å; G447-F450 WeakPolarHBondContact O-CB 3.22Å; G447-F450 PolarHBondContact O-N 3.33Å; G447-L451 WeakPolarHBondContact O-CG 3.2Å; G447-L451 PolarHBondContact O-N 3.34Å; G447-L451 VanDerWaalsContact O-N 3.12Å
448	L	96.5	Very high	92.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61	-46.4	176.6	-64.8	-179.7	0	0	0	112	I444 F450 L451 H452 L463 I479 D517 F521 V585	I444-L448 HydrophobicContact CG2-CD1 4.24Å; I444-L448 HydrophobicContact CG2-CG 4.38Å; I444-L448 WeakPolarHBondContact O-CG 3.23Å; I444-L448 PolarHBondContact O-N 3.41Å; L448-F450 VanDerWaalsContact C-N 3.25Å; L448-F450 PolarHBondContact O-N 2.9Å; L448-L451 HydrophobicContact CD2-CD1 4.5Å; L448-L451 PolarHBondContact O-N 3.45Å; L448-H452 WeakPolarHBondContact O-CB 3.32Å; L448-H452 PolarHBondContact O-N 2.65Å; L448-H452 PolarHBondContact O-ND1 3.24Å; L448-L463 HydrophobicContact CD1-CD2 3.86Å; L448-L463 HydrophobicContact CD2-CD1 4.4Å; L448-L463 HydrophobicContact CD2-CD2 4.1Å; L448-L463 HydrophobicContact CG-CD2 4.47Å; L448-I479 HydrophobicContact CD2-CD1 3.93Å; L448-I479 HydrophobicContact CG-CD1 4.05Å; L448-D517 HydrophobicContact CD1-CB 4.24Å; L448-D517 HydrophobicContact CD2-CB 4Å; L448-F521 HydrophobicContact CD1-CB 4.2Å; L448-V585 HydrophobicContact CB-CG1 4.16Å; L448-V585 HydrophobicContact CB-CG2 4.2Å
449	S	96.2	Very high	92.5	Very high	26 Å²	26	32.4 Å²	32.4	18%	0.182	17%	0.167	C	C	.	.	H	α-helix	trans	-58	-38	177.1	-172.5	0	0	0	0	112.2	L445 K446 T453	L445-S449 WeakPolarHBondContact O-CB 3.44Å; L445-S449 PolarHBondContact O-N 3.14Å; K446-S449 PolarHBondContact O-N 3.32Å; S449-T453 VanDerWaalsContact O-CB 3.32Å; S449-T453 WeakPolarHBondContact O-CB 3.21Å; S449-T453 VanDerWaalsContact O-CG2 3.23Å; S449-T453 WeakPolarHBondContact O-CG2 3.44Å; S449-T453 PolarHBondContact O-N 3.01Å; S449-T453 PolarHBondContact O-OG1 3.49Å
450	F	95.9	Very high	92.4	Very high	31 Å²	31	30.6 Å²	30.6	14%	0.136	15%	0.154	C	C	.	.	H	α-helix	trans	-65.6	-40.9	174.4	172.1	-103	0	0	0	112.9	L386 Q387 H388 I391 K446 G447 L448 T453 R454	L386-F450 HydrophobicContact CB-CE1 4.5Å; L386-F450 HydrophobicContact CD2-CD1 4Å; L386-F450 HydrophobicContact CD2-CE1 3.25Å; L386-F450 HydrophobicContact CD2-CZ 3.83Å; L386-F450 HydrophobicContact CG-CE1 4.48Å; Q387-F450 VanDerWaalsContact O-CZ 3.25Å; Q387-F450 WeakPolarHBondContact O-CZ 3.27Å; H388-F450 HydrophobicContact CB-CB 4.45Å; H388-F450 HydrophobicContact CB-CD1 3.38Å; H388-F450 HydrophobicContact CB-CD2 4Å; H388-F450 HydrophobicContact CB-CE1 3.36Å; H388-F450 HydrophobicContact CB-CE2 4.02Å; H388-F450 HydrophobicContact CB-CG 3.69Å; H388-F450 HydrophobicContact CB-CZ 3.71Å; H388-F450 AromaticContact CD2-CD2 3.91Å; H388-F450 AromaticContact CD2-CG 3.8Å; H388-F450 AromaticContact CG-CD1 3.81Å; H388-F450 AromaticContact CG-CG 3.71Å; I391-F450 HydrophobicContact CG1-CD1 3.95Å; I391-F450 HydrophobicContact CG1-CE1 4.32Å; K446-F450 WeakPolarHBondContact O-CB 3.42Å; K446-F450 PolarHBondContact O-N 2.86Å; G447-F450 WeakPolarHBondContact O-CB 3.22Å; G447-F450 PolarHBondContact O-N 3.33Å; L448-F450 VanDerWaalsContact C-N 3.25Å; L448-F450 PolarHBondContact O-N 2.9Å; F450-T453 PolarHBondContact O-OG1 2.89Å; F450-R454 PolarHBondContact O-N 3.33Å; F450-R454 PolarHBondContact O-NE 2.97Å
451	L	93.1	Very high	91.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-67.9	-47.7	176.1	-64.8	170.3	0	0	0	112.1	L386 I391 G447 L448 T453 R454 V458 L482	L386-L451 HydrophobicContact CD1-CD2 4.11Å; L386-L451 HydrophobicContact CD2-CD2 3.88Å; I391-L451 HydrophobicContact CD1-CD1 3.82Å; I391-L451 HydrophobicContact CD1-CD2 4.21Å; I391-L451 HydrophobicContact CD1-CG 3.93Å; G447-L451 WeakPolarHBondContact O-CG 3.2Å; G447-L451 PolarHBondContact O-N 3.34Å; G447-L451 VanDerWaalsContact O-N 3.12Å; L448-L451 HydrophobicContact CD2-CD1 4.5Å; L448-L451 PolarHBondContact O-N 3.45Å; L451-T453 PolarHBondContact O-N 3.26Å; L451-R454 WeakPolarHBondContact O-CB 3.35Å; L451-R454 WeakPolarHBondContact O-CG 3.44Å; L451-R454 PolarHBondContact O-N 3.35Å; L451-R454 VanDerWaalsContact O-N 3.09Å; L451-V458 CarbonylContact C-O 3.52Å; L451-V458 HydrophobicContact CB-CB 4.22Å; L451-V458 WeakPolarHBondContact CB-O 3.24Å; L451-V458 HydrophobicContact CD2-CB 4.25Å; L451-V458 HydrophobicContact CD2-CG1 4.03Å; L451-V458 PolarHBondContact O-N 3.48Å; L451-L482 HydrophobicContact CD1-CD1 4.46Å; L451-L482 HydrophobicContact CD1-CD2 3.89Å; L451-L482 HydrophobicContact CD2-CD1 3.88Å; L451-L482 HydrophobicContact CD2-CD2 4.33Å
452	H	93.2	Very high	91.1	Very high	29 Å²	29	33.7 Å²	33.7	13%	0.134	17%	0.169	C	C	.	.	H	α-helix	trans	-67.3	-18.7	179.1	-59.3	163.2	0	0	0	113.3	L448 V458 D517	L448-H452 WeakPolarHBondContact O-CB 3.32Å; L448-H452 PolarHBondContact O-N 2.65Å; L448-H452 PolarHBondContact O-ND1 3.24Å; H452-V458 PolarHBondContact CD2-O 3.16Å; H452-D517 IonicContact CD2-OD2 2.67Å; H452-D517 IonicContact CE1-OD2 2.63Å; H452-D517 IonicContact NE2-OD2 2.68Å; H452-D517 PolarHBondContact NE2-OD2 3.45Å
453	T	92.1	Very high	90.9	Very high	71 Å²	71	32 Å²	32	44%	0.436	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.8	10.7	173.6	57.8	0	0	0	0	114	S449 F450 L451	S449-T453 VanDerWaalsContact O-CB 3.32Å; S449-T453 WeakPolarHBondContact O-CB 3.21Å; S449-T453 VanDerWaalsContact O-CG2 3.23Å; S449-T453 WeakPolarHBondContact O-CG2 3.44Å; S449-T453 PolarHBondContact O-N 3.01Å; S449-T453 PolarHBondContact O-OG1 3.49Å; F450-T453 PolarHBondContact O-OG1 2.89Å; L451-T453 PolarHBondContact O-N 3.26Å
454	R	89.8	Confident	90.7	Very high	88 Å²	88	31.6 Å²	31.6	33%	0.332	16%	0.16	S	C	.	.	S	Bend	trans	-68.6	163.4	161.7	-64	-49.3	86.7	-166.1	-7.4	110.2	L386 F450 L451 P456 P457 V458	L386-R454 HydrophobicContact CD2-CG 3.78Å; F450-R454 PolarHBondContact O-N 3.33Å; F450-R454 PolarHBondContact O-NE 2.97Å; L451-R454 WeakPolarHBondContact O-CB 3.35Å; L451-R454 WeakPolarHBondContact O-CG 3.44Å; L451-R454 PolarHBondContact O-N 3.35Å; L451-R454 VanDerWaalsContact O-N 3.09Å; R454-P456 VanDerWaalsContact C-C 3.44Å; R454-P456 CarbonylContact C-O 3.59Å; R454-P456 VanDerWaalsContact CB-O 3.31Å; R454-P456 WeakPolarHBondContact CB-O 3.34Å; R454-P456 CarbonylContact O-C 3.57Å; R454-P456 VanDerWaalsContact O-C 3.22Å; R454-P457 WeakPolarHBondContact O-CA 3.49Å; R454-P457 VanDerWaalsContact O-N 3.15Å; R454-V458 HydrophobicContact CB-CG2 4.05Å; R454-V458 HydrophobicContact CG-CG2 4.03Å
455	N	82.8	Confident	90.6	Very high	157 Å²	157	31.6 Å²	31.6	84%	0.84	16%	0.16	S	C	*	.	S	Bend	trans	-130.6	102.6	176.9	-168.6	81.8	0	0	0	110.3
456	P	81.7	Confident	90.2	Very high	38 Å²	38	34 Å²	34	25%	0.247	17%	0.173	C	C	.	.	S	Bend	cis	-67.8	158.8	1.2	30.3	-37	0	0	0	113.4	M382 R454 L487	M382-P456 HydrophobicContact CE-CG 3.89Å; R454-P456 VanDerWaalsContact C-C 3.44Å; R454-P456 CarbonylContact C-O 3.59Å; R454-P456 VanDerWaalsContact CB-O 3.31Å; R454-P456 WeakPolarHBondContact CB-O 3.34Å; R454-P456 CarbonylContact O-C 3.57Å; R454-P456 VanDerWaalsContact O-C 3.22Å; P456-L487 HydrophobicContact CG-CD2 4.26Å
457	P	86.4	Confident	90	Very high	30 Å²	30	29.7 Å²	29.7	20%	0.195	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-59.9	138.3	175	-26.7	36.3	0	0	0	112.9	R454	R454-P457 WeakPolarHBondContact O-CA 3.49Å; R454-P457 VanDerWaalsContact O-N 3.15Å
458	V	85.6	Confident	89.9	Confident	3 Å²	3	29.7 Å²	29.7	2%	0.018	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-98.8	122.8	174.2	179	0	0	0	0	108.2	M382 L386 L451 H452 R454 A485 L487	M382-V458 HydrophobicContact SD-CG2 3.99Å; L386-V458 HydrophobicContact CD1-CG2 4.35Å; L451-V458 CarbonylContact C-O 3.52Å; L451-V458 HydrophobicContact CB-CB 4.22Å; L451-V458 WeakPolarHBondContact CB-O 3.24Å; L451-V458 HydrophobicContact CD2-CB 4.25Å; L451-V458 HydrophobicContact CD2-CG1 4.03Å; L451-V458 PolarHBondContact O-N 3.48Å; H452-V458 PolarHBondContact CD2-O 3.16Å; R454-V458 HydrophobicContact CB-CG2 4.05Å; R454-V458 HydrophobicContact CG-CG2 4.03Å; V458-A485 HydrophobicContact CG1-CB 4.35Å; V458-L487 HydrophobicContact CG2-CD2 3.87Å
459	I	86.9	Confident	89.9	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.163	C	C	.	.			trans	-105.1	131.4	176.9	-55.3	165.4	0	0	0	107.3	R461 A485 K488 V516	I459-R461 HydrophobicContact CB-CG 4.22Å; I459-R461 HydrophobicContact CG2-CG 3.79Å; I459-A485 WeakPolarHBondContact O-CB 3.47Å; I459-K488 HydrophobicContact CD1-CB 3.89Å; I459-K488 HydrophobicContact CD1-CD 4.08Å; I459-K488 HydrophobicContact CD1-CG 3.86Å; I459-V516 HydrophobicContact CG2-CG2 3.68Å
460	H	88.3	Confident	89.8	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.019	16%	0.156	C	C	.	.			trans	-73	-40.9	-175	-170.6	-60.1	0	0	0	112.9	D462 L463 I479 G480 L482 D517	H460-D462 VanDerWaalsContact CE1-C 3.48Å; H460-D462 PolarHBondContact CE1-O 3.2Å; H460-D462 PolarHBondContact ND1-O 2.89Å; H460-D462 PolarHBondContact O-N 3.3Å; H460-L463 HydrophobicContact CB-CB 4.44Å; H460-L463 PolarHBondContact ND1-N 3.1Å; H460-I479 WeakPolarHBondContact CD2-CG2 3.39Å; H460-I479 WeakPolarHBondContact NE2-CG2 3.5Å; H460-G480 PolarHBondContact NE2-O 2.96Å; H460-L482 HydrophobicContact CB-CD2 4.48Å; H460-L482 VanDerWaalsContact CD2-CD2 3.43Å; H460-L482 WeakPolarHBondContact CD2-CD2 3.34Å; H460-D517 WeakPolarHBondContact CB-OD1 3.42Å; H460-D517 PolarHBondContact N-OD1 3.02Å; H460-D517 PolarHBondContact N-OD2 2.95Å
461	R	80.8	Confident	89.7	Confident	31 Å²	31	31.8 Å²	31.8	12%	0.117	17%	0.166	C	C	.	.	S	Bend	trans	68.2	-48.6	176.8	-49.2	174.7	-172.5	-145.2	-4	115	I459 T486 L487 M507 Y512 D517	I459-R461 HydrophobicContact CB-CG 4.22Å; I459-R461 HydrophobicContact CG2-CG 3.79Å; R461-T486 WeakPolarHBondContact CD-OG1 3.45Å; R461-T486 PolarHBondContact NE-O 3.1Å; R461-T486 VanDerWaalsContact NE-O 3.11Å; R461-T486 PolarHBondContact NE-OG1 2.91Å; R461-T486 PolarHBondContact NH1-OG1 2.97Å; R461-T486 PolarHBondContact NH2-O 3.18Å; R461-L487 PolarHBondContact NH2-O 3.38Å; R461-M507 HydrophobicContact CB-SD 4.26Å; R461-M507 WeakPolarHBondContact O-CE 3.44Å; R461-Y512 VanDerWaalsContact NH1-CZ 3.26Å; R461-Y512 PolarHBondContact NH1-OH 2.93Å; R461-D517 PolarHBondContact N-OD1 3.16Å
462	D	83.6	Confident	89.2	Confident	38 Å²	38	32.6 Å²	32.6	20%	0.203	17%	0.174	C	C	.	.	S	Bend	trans	-102.7	47.7	176.3	-167.9	40.9	0	0	0	112.7	H460 K464 N467	H460-D462 VanDerWaalsContact CE1-C 3.48Å; H460-D462 PolarHBondContact CE1-O 3.2Å; H460-D462 PolarHBondContact ND1-O 2.89Å; H460-D462 PolarHBondContact O-N 3.3Å; D462-K464 PolarHBondContact O-N 3.31Å; D462-K464 IonicContact OD1-NZ 3.67Å; D462-K464 PolarHBondContact OD1-NZ 2.92Å; D462-K464 IonicContact OD2-NZ 2.77Å; D462-K464 PolarHBondContact OD2-NZ 3.07Å; D462-N467 PolarHBondContact O-ND2 2.96Å; D462-N467 PolarHBondContact OD2-ND2 2.91Å
463	L	91.6	Very high	88.3	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	18%	0.178	C	C	.	.			trans	-77.5	124.7	179.2	-175.5	75.6	0	0	0	110.1	L448 H460 I468 I479 D517 A520 F521	L448-L463 HydrophobicContact CD1-CD2 3.86Å; L448-L463 HydrophobicContact CD2-CD1 4.4Å; L448-L463 HydrophobicContact CD2-CD2 4.1Å; L448-L463 HydrophobicContact CG-CD2 4.47Å; H460-L463 HydrophobicContact CB-CB 4.44Å; H460-L463 PolarHBondContact ND1-N 3.1Å; L463-I468 HydrophobicContact CD1-CD1 4.25Å; L463-I468 HydrophobicContact CD1-CG1 4.18Å; L463-I479 HydrophobicContact CD1-CD1 4.36Å; L463-I479 HydrophobicContact CD1-CG2 3.71Å; L463-D517 WeakPolarHBondContact CD2-O 3.35Å; L463-A520 HydrophobicContact CB-CB 3.82Å; L463-A520 HydrophobicContact CD2-CB 4.19Å; L463-A520 HydrophobicContact CG-CB 4.4Å; L463-A520 WeakPolarHBondContact O-CB 3.44Å; L463-F521 HydrophobicContact CD2-CB 4.19Å
464	K	91.6	Very high	87.5	Confident	18 Å²	18	34.5 Å²	34.5	8%	0.078	19%	0.188	C	C	.	.	S	Bend	trans	-159.8	165.2	178.5	50.4	170.8	172.4	-105	0	112.2	D462 D466 N467 I468 T499 F502 C524	D462-K464 PolarHBondContact O-N 3.31Å; D462-K464 IonicContact OD1-NZ 3.67Å; D462-K464 PolarHBondContact OD1-NZ 2.92Å; D462-K464 IonicContact OD2-NZ 2.77Å; D462-K464 PolarHBondContact OD2-NZ 3.07Å; K464-D466 HydrophobicContact CD-CB 3.94Å; K464-D466 HydrophobicContact CG-CB 4.14Å; K464-D466 PolarHBondContact O-N 3.49Å; K464-D466 VanDerWaalsContact O-N 3.09Å; K464-N467 WeakPolarHBondContact CE-OD1 3.35Å; K464-N467 HydrophobicContact CG-CB 4.19Å; K464-N467 PolarHBondContact O-N 3.37Å; K464-I468 WeakPolarHBondContact O-CG1 3.49Å; K464-I468 PolarHBondContact O-N 3.11Å; K464-T499 PolarHBondContact NZ-OG1 2.95Å; K464-F502 HydrophobicContact CB-CD2 3.52Å; K464-F502 HydrophobicContact CB-CE1 4.42Å; K464-F502 HydrophobicContact CB-CE2 3.32Å; K464-F502 HydrophobicContact CB-CG 4.13Å; K464-F502 HydrophobicContact CB-CZ 3.83Å; K464-F502 HydrophobicContact CD-CD2 4.04Å; K464-F502 HydrophobicContact CD-CE2 3.94Å; K464-F502 HydrophobicContact CG-CD2 4.37Å; K464-F502 HydrophobicContact CG-CE2 4.28Å; K464-C524 VanDerWaalsContact CA-SG 3.54Å
465	C	94.5	Very high	87.1	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-15.5	176.3	-65.3	0	0	0	0	114.7	L422 K423 E527	L422-C465 HydrophobicContact CB-CB 4.16Å; L422-C465 WeakPolarHBondContact CB-O 3.25Å; L422-C465 HydrophobicContact CD2-CB 4.21Å; L422-C465 HydrophobicContact CG-CB 4.09Å; L422-C465 PolarHBondContact N-O 3.46Å; K423-C465 HydrophobicContact CB-CB 3.95Å; K423-C465 PolarHBondContact N-O 2.85Å; C465-E527 VanDerWaalsContact CB-OE2 3.26Å; C465-E527 WeakPolarHBondContact CB-OE2 3.42Å; C465-E527 PolarHBondContact SG-OE2 3.4Å
466	D	90.6	Very high	87.6	Confident	51 Å²	51	25.8 Å²	25.8	27%	0.273	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-38.1	166.9	-74.6	-58.7	0	0	0	112.5	T421 K423 K464 I468	T421-D466 WeakPolarHBondContact CB-O 3.44Å; T421-D466 WeakPolarHBondContact CG2-O 3.45Å; K423-D466 WeakPolarHBondContact CD-OD1 3.42Å; K423-D466 VanDerWaalsContact CD-OD2 3.27Å; K423-D466 WeakPolarHBondContact CD-OD2 3.3Å; K423-D466 IonicContact NZ-OD1 2.71Å; K423-D466 IonicContact NZ-OD2 3.12Å; K423-D466 PolarHBondContact NZ-OD2 3.37Å; K464-D466 HydrophobicContact CD-CB 3.94Å; K464-D466 HydrophobicContact CG-CB 4.14Å; K464-D466 PolarHBondContact O-N 3.49Å; K464-D466 VanDerWaalsContact O-N 3.09Å; D466-I468 VanDerWaalsContact C-N 3.35Å
467	N	92.1	Very high	88.4	Confident	8 Å²	8	24 Å²	24	4%	0.043	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-1.7	-172.8	-60.9	3.4	0	0	0	112	D462 K464 F469 G480 D481	D462-N467 PolarHBondContact O-ND2 2.96Å; D462-N467 PolarHBondContact OD2-ND2 2.91Å; K464-N467 WeakPolarHBondContact CE-OD1 3.35Å; K464-N467 HydrophobicContact CG-CB 4.19Å; K464-N467 PolarHBondContact O-N 3.37Å; N467-F469 WeakPolarHBondContact O-CD2 3.46Å; N467-G480 PolarHBondContact O-N 2.92Å; N467-D481 HydrophobicContact CB-CB 4.33Å
468	I	95.6	Very high	88.9	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	107.9	172.2	-62	160.8	0	0	0	108.1	T421 L422 I444 L463 K464 D466 V477 C524	T421-I468 CarbonylContact C-O 3.54Å; T421-I468 WeakPolarHBondContact CA-O 3.41Å; L422-I468 HydrophobicContact CB-CB 4.2Å; L422-I468 HydrophobicContact CB-CG2 4.18Å; L422-I468 HydrophobicContact CD2-CB 4.3Å; L422-I468 HydrophobicContact CD2-CD1 4.19Å; L422-I468 HydrophobicContact CD2-CG2 4.07Å; L422-I468 PolarHBondContact N-O 2.95Å; I444-I468 HydrophobicContact CD1-CD1 3.85Å; I444-I468 HydrophobicContact CD1-CG2 4.2Å; I444-I468 HydrophobicContact CG1-CD1 4.18Å; I444-I468 HydrophobicContact CG1-CG2 4.16Å; L463-I468 HydrophobicContact CD1-CD1 4.25Å; L463-I468 HydrophobicContact CD1-CG1 4.18Å; K464-I468 WeakPolarHBondContact O-CG1 3.49Å; K464-I468 PolarHBondContact O-N 3.11Å; D466-I468 VanDerWaalsContact C-N 3.35Å; I468-V477 HydrophobicContact CG2-CB 3.93Å; I468-V477 HydrophobicContact CG2-CG1 4Å; I468-C524 HydrophobicContact CD1-CB 4.32Å
469	F	95.6	Very high	89.4	Confident	38 Å²	38	24 Å²	24	17%	0.167	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	144.6	-178.2	-64.3	-91.3	0	0	0	111.5	V392 M417 G420 T421 N467 V477 K478	V392-F469 HydrophobicContact CG2-CD2 3.9Å; V392-F469 HydrophobicContact CG2-CG 4.49Å; M417-F469 HydrophobicContact CB-CB 3.74Å; M417-F469 HydrophobicContact CB-CD1 3.41Å; M417-F469 VanDerWaalsContact CB-CD1 3.41Å; M417-F469 HydrophobicContact CB-CE1 4.18Å; M417-F469 HydrophobicContact CB-CG 3.71Å; M417-F469 HydrophobicContact CE-CB 3.59Å; M417-F469 HydrophobicContact CG-CB 3.64Å; M417-F469 HydrophobicContact CG-CD1 3.91Å; M417-F469 HydrophobicContact CG-CD2 4.3Å; M417-F469 HydrophobicContact CG-CG 3.69Å; M417-F469 HydrophobicContact SD-CB 4.37Å; G420-F469 WeakPolarHBondContact O-CA 3.4Å; T421-F469 HydrophobicContact CG2-CD1 3.99Å; T421-F469 HydrophobicContact CG2-CE1 3.9Å; N467-F469 WeakPolarHBondContact O-CD2 3.46Å; F469-V477 CarbonylContact O-C 3.56Å; F469-V477 VanDerWaalsContact O-CA 3.27Å; F469-V477 WeakPolarHBondContact O-CA 3.42Å; F469-K478 PolarHBondContact N-O 2.65Å; F469-K478 PolarHBondContact O-N 3.08Å
470	I	95.1	Very high	89.6	Confident	7 Å²	7	24.1 Å²	24.1	4%	0.036	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	144.4	170.9	48.5	168.3	0	0	0	110.6	S419 G420 Y425 W440 V477	S419-I470 WeakPolarHBondContact CB-O 3.42Å; S419-I470 WeakPolarHBondContact O-CD1 3.39Å; G420-I470 WeakPolarHBondContact O-CG1 3.49Å; G420-I470 PolarHBondContact O-N 3.01Å; Y425-I470 HydrophobicContact CD2-CD1 3.87Å; Y425-I470 HydrophobicContact CG-CD1 4.5Å; W440-I470 HydrophobicContact CH2-CG2 4.01Å; W440-I470 HydrophobicContact CZ2-CG2 3.85Å; I470-V477 HydrophobicContact CG2-CG1 3.71Å
471	T	92.4	Very high	89.3	Confident	56 Å²	56	26.6 Å²	26.6	34%	0.344	16%	0.156	S	C	.	.	S	Bend	trans	-80.7	-26.6	170.2	53.7	0	0	0	0	112.3	M417 S419 S476 K478	M417-T471 HydrophobicContact CE-CG2 3.87Å; S419-T471 PolarHBondContact OG-O 2.82Å; T471-S476 VanDerWaalsContact CG2-OG 3.31Å; T471-S476 WeakPolarHBondContact CG2-OG 3.34Å; T471-S476 PolarHBondContact N-O 2.99Å; T471-S476 PolarHBondContact OG1-N 3.1Å; T471-S476 PolarHBondContact OG1-O 3.06Å; T471-S476 VanDerWaalsContact OG1-O 3.13Å; T471-S476 PolarHBondContact OG1-OG 3.19Å; T471-K478 HydrophobicContact CG2-CD 4.4Å
472	G	83.6	Confident	89	Confident	16 Å²	16	25.8 Å²	25.8	17%	0.165	15%	0.154	C	C	.	.	S	Bend	trans	-174.5	175.5	176.5	0	0	0	0	0	112.5	T474 G475	G472-T474 PolarHBondContact O-N 2.92Å; G472-G475 PolarHBondContact O-N 3.41Å
473	T	73.7	Confident	87.8	Confident	35 Å²	35	24.8 Å²	24.8	22%	0.215	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-27	-176.4	49.8	0	0	0	0	114.5
474	T	75	Confident	86.1	Confident	106 Å²	106	29 Å²	29	65%	0.65	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.5	17.2	171.6	55.7	0	0	0	0	111.8	L67 G472	L67-T474 HydrophobicContact CD1-CG2 4.13Å; L67-T474 HydrophobicContact CD2-CG2 4.22Å; G472-T474 PolarHBondContact O-N 2.92Å
475	G	82.2	Confident	84.3	Confident	21 Å²	21	28.3 Å²	28.3	22%	0.216	17%	0.172	C	C	.	.	S	Bend	trans	-90.1	-174.5	-168.4	0	0	0	0	0	114.9	W440 G472	W440-G475 PolarHBondContact NE1-O 2.96Å; G472-G475 PolarHBondContact O-N 3.41Å
476	S	93.5	Very high	82.2	Confident	40 Å²	40	29.6 Å²	29.6	28%	0.28	18%	0.18	S	C	.	.			trans	-77.6	160.6	170.6	59.5	0	0	0	0	112.2	T471	T471-S476 VanDerWaalsContact CG2-OG 3.31Å; T471-S476 WeakPolarHBondContact CG2-OG 3.34Å; T471-S476 PolarHBondContact N-O 2.99Å; T471-S476 PolarHBondContact OG1-N 3.1Å; T471-S476 PolarHBondContact OG1-O 3.06Å; T471-S476 VanDerWaalsContact OG1-O 3.13Å; T471-S476 PolarHBondContact OG1-OG 3.19Å
477	V	96.8	Very high	79.9	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.012	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	147.2	166.7	-74.6	0	0	0	0	111.4	N390 W440 Q443 I444 I468 F469 I470	N390-V477 WeakPolarHBondContact CA-O 3.39Å; N390-V477 PolarHBondContact ND2-O 3.46Å; W440-V477 HydrophobicContact CB-CG1 4.08Å; W440-V477 HydrophobicContact CB-CG2 4.01Å; W440-V477 HydrophobicContact CD2-CG1 3.89Å; W440-V477 HydrophobicContact CG-CG1 3.67Å; W440-V477 HydrophobicContact CG-CG2 4.23Å; W440-V477 WeakPolarHBondContact O-CG2 3.38Å; Q443-V477 HydrophobicContact CB-CG2 3.46Å; Q443-V477 VanDerWaalsContact CB-CG2 3.46Å; Q443-V477 HydrophobicContact CG-CG2 4.46Å; I444-V477 HydrophobicContact CG1-CG2 4.02Å; I468-V477 HydrophobicContact CG2-CB 3.93Å; I468-V477 HydrophobicContact CG2-CG1 4Å; F469-V477 CarbonylContact O-C 3.56Å; F469-V477 VanDerWaalsContact O-CA 3.27Å; F469-V477 WeakPolarHBondContact O-CA 3.42Å; I470-V477 HydrophobicContact CG2-CG1 3.71Å
478	K	97.3	Very high	77.5	Confident	30 Å²	30	31 Å²	31	13%	0.13	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	130.8	174.9	-72.9	-173.9	166.1	-172.2	0	110.3	P389 N390 V392 E415 M417 F469 T471	P389-K478 WeakPolarHBondContact O-CE 3.48Å; P389-K478 WeakPolarHBondContact O-CG 3.43Å; N390-K478 WeakPolarHBondContact O-CA 3.29Å; V392-K478 HydrophobicContact CG2-CB 3.72Å; E415-K478 IonicContact OE1-NZ 3.39Å; E415-K478 PolarHBondContact OE1-NZ 3.37Å; E415-K478 IonicContact OE2-NZ 2.61Å; E415-K478 PolarHBondContact OE2-NZ 3.21Å; M417-K478 HydrophobicContact CE-CB 4.1Å; M417-K478 HydrophobicContact CE-CD 4.04Å; M417-K478 HydrophobicContact CE-CG 4.36Å; M417-K478 HydrophobicContact SD-CD 3.99Å; F469-K478 PolarHBondContact N-O 2.65Å; F469-K478 PolarHBondContact O-N 3.08Å; T471-K478 HydrophobicContact CG2-CD 4.4Å
479	I	96	Very high	74.6	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	126	174.2	-49	175.4	0	0	0	108.6	N390 I391 V392 I444 L448 H460 L463	N390-I479 PolarHBondContact O-N 3.35Å; I391-I479 WeakPolarHBondContact CA-O 3.31Å; I391-I479 HydrophobicContact CD1-CB 4.01Å; I391-I479 HydrophobicContact CD1-CD1 4.27Å; I391-I479 HydrophobicContact CD1-CG1 4.45Å; V392-I479 PolarHBondContact N-O 3.33Å; I444-I479 HydrophobicContact CG2-CD1 4.04Å; L448-I479 HydrophobicContact CD2-CD1 3.93Å; L448-I479 HydrophobicContact CG-CD1 4.05Å; H460-I479 WeakPolarHBondContact CD2-CG2 3.39Å; H460-I479 WeakPolarHBondContact NE2-CG2 3.5Å; L463-I479 HydrophobicContact CD1-CD1 4.36Å; L463-I479 HydrophobicContact CD1-CG2 3.71Å
480	G	91	Very high	72.1	Confident	3 Å²	3	41.3 Å²	41.3	3%	0.031	24%	0.235	C	C	.	.			trans	-121.5	-165.7	-179.1	0	0	0	0	0	112.9	H460 N467 L482	H460-G480 PolarHBondContact NE2-O 2.96Å; N467-G480 PolarHBondContact O-N 2.92Å; G480-L482 PolarHBondContact O-N 2.73Å
481	D	82.6	Confident	69.3	Low	56 Å²	56	41.4 Å²	41.4	30%	0.299	24%	0.236	S	C	.	.			trans	56.7	18	-178.5	-77.4	-7.1	0	0	0	116.8	K344 N467 G483 L484	K344-D481 IonicContact NZ-OD1 3.95Å; K344-D481 PolarHBondContact NZ-OD1 3.26Å; K344-D481 IonicContact NZ-OD2 2.96Å; K344-D481 PolarHBondContact NZ-OD2 2.84Å; N467-D481 HydrophobicContact CB-CB 4.33Å; D481-G483 PolarHBondContact O-N 3.32Å; D481-L484 PolarHBondContact O-N 3.24Å
482	L	74.9	Confident	66.6	Low	14 Å²	14	44.7 Å²	44.7	7%	0.073	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-55.9	-10.3	168.4	-66.5	176.8	0	0	0	114.7	L383 I391 L451 H460 G480 L484 A485	L383-L482 HydrophobicContact CD1-CB 4.43Å; L383-L482 WeakPolarHBondContact CD1-O 3.29Å; L383-L482 HydrophobicContact CD2-CB 3.94Å; I391-L482 HydrophobicContact CG2-CD1 3.57Å; L451-L482 HydrophobicContact CD1-CD1 4.46Å; L451-L482 HydrophobicContact CD1-CD2 3.89Å; L451-L482 HydrophobicContact CD2-CD1 3.88Å; L451-L482 HydrophobicContact CD2-CD2 4.33Å; H460-L482 HydrophobicContact CB-CD2 4.48Å; H460-L482 VanDerWaalsContact CD2-CD2 3.43Å; H460-L482 WeakPolarHBondContact CD2-CD2 3.34Å; G480-L482 PolarHBondContact O-N 2.73Å; L482-L484 PolarHBondContact O-N 2.82Å; L482-A485 HydrophobicContact CB-CB 4.29Å; L482-A485 HydrophobicContact CD2-CB 3.91Å; L482-A485 VanDerWaalsContact O-CB 3.23Å; L482-A485 WeakPolarHBondContact O-CB 3.47Å; L482-A485 PolarHBondContact O-N 3.17Å
483	G	57.2	Low	64.4	Low	18 Å²	18	45 Å²	45	19%	0.186	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-61.6	-8	175.4	0	0	0	0	0	115.3	F376 D481	F376-G483 WeakPolarHBondContact CE2-O 3.18Å; D481-G483 PolarHBondContact O-N 3.32Å
484	L	56.8	Low	62.9	Low	88 Å²	88	51.5 Å²	51.5	46%	0.461	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-116.4	1.9	169.9	-58.8	176.1	0	0	0	112.8	L363 D481 L482 T486	L363-L484 HydrophobicContact CD1-CD2 4.42Å; D481-L484 PolarHBondContact O-N 3.24Å; L482-L484 PolarHBondContact O-N 2.82Å; L484-T486 PolarHBondContact O-N 3.17Å; L484-T486 PolarHBondContact O-OG1 3.05Å
485	A	54.9	Low	61.1	Low	4 Å²	4	49.4 Å²	49.4	3%	0.033	26%	0.261	C	S	.	.			trans	-73.2	109.5	179	0	0	0	0	0	110.1	V458 I459 L482	V458-A485 HydrophobicContact CG1-CB 4.35Å; I459-A485 WeakPolarHBondContact O-CB 3.47Å; L482-A485 HydrophobicContact CB-CB 4.29Å; L482-A485 HydrophobicContact CD2-CB 3.91Å; L482-A485 VanDerWaalsContact O-CB 3.23Å; L482-A485 WeakPolarHBondContact O-CB 3.47Å; L482-A485 PolarHBondContact O-N 3.17Å
486	T	48.6	Very low	58.9	Low	27 Å²	27	54.1 Å²	54.1	17%	0.166	29%	0.286	C	S	.	.			trans	-93.9	153.1	-172	10.5	0	0	0	0	110.1	E379 R461 L484	E379-T486 WeakPolarHBondContact OE1-CA 3.48Å; E379-T486 VanDerWaalsContact OE1-CG2 3.3Å; E379-T486 WeakPolarHBondContact OE1-CG2 3.14Å; E379-T486 WeakPolarHBondContact OE2-CG2 3.49Å; R461-T486 WeakPolarHBondContact CD-OG1 3.45Å; R461-T486 PolarHBondContact NE-O 3.1Å; R461-T486 VanDerWaalsContact NE-O 3.11Å; R461-T486 PolarHBondContact NE-OG1 2.91Å; R461-T486 PolarHBondContact NH1-OG1 2.97Å; R461-T486 PolarHBondContact NH2-O 3.18Å; L484-T486 PolarHBondContact O-N 3.17Å; L484-T486 PolarHBondContact O-OG1 3.05Å
487	L	42.7	Very low	56.8	Low	10 Å²	10	56.3 Å²	56.3	5%	0.052	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-85.8	141.9	-171.4	-67.6	168.5	0	0	0	114.2	E379 M382 P456 V458 R461 N489 S491	E379-L487 HydrophobicContact CG-CD1 3.71Å; E379-L487 HydrophobicContact CG-CG 3.83Å; E379-L487 PolarHBondContact OE1-N 2.69Å; M382-L487 HydrophobicContact CE-CD1 3.54Å; M382-L487 HydrophobicContact CE-CD2 3.9Å; M382-L487 HydrophobicContact CE-CG 4.39Å; M382-L487 HydrophobicContact SD-CD1 4.34Å; M382-L487 HydrophobicContact SD-CD2 3.67Å; P456-L487 HydrophobicContact CG-CD2 4.26Å; V458-L487 HydrophobicContact CG2-CD2 3.87Å; R461-L487 PolarHBondContact NH2-O 3.38Å; L487-N489 VanDerWaalsContact C-N 3.26Å; L487-N489 PolarHBondContact O-N 2.99Å; L487-S491 PolarHBondContact N-OG 3.01Å; L487-S491 PolarHBondContact O-OG 3.33Å; L487-S491 VanDerWaalsContact O-OG 3.09Å
488	K	41	Very low	54.4	Low	79 Å²	79	57.5 Å²	57.5	34%	0.343	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-31.4	-175.3	-166.7	175.7	-173.9	176.4	0	114	I459 E514	I459-K488 HydrophobicContact CD1-CB 3.89Å; I459-K488 HydrophobicContact CD1-CD 4.08Å; I459-K488 HydrophobicContact CD1-CG 3.86Å; K488-E514 WeakPolarHBondContact CE-OE2 3.39Å; K488-E514 IonicContact NZ-OE1 3.92Å; K488-E514 PolarHBondContact NZ-OE1 3.08Å; K488-E514 IonicContact NZ-OE2 3.32Å; K488-E514 PolarHBondContact NZ-OE2 3.41Å
489	N	36.6	Very low	52	Low	120 Å²	120	58 Å²	58	64%	0.642	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	4.6	-165.8	-66.4	20.4	0	0	0	115.7	L487	L487-N489 VanDerWaalsContact C-N 3.26Å; L487-N489 PolarHBondContact O-N 2.99Å
490	K	41.5	Very low	49.7	Very low	135 Å²	135	59.3 Å²	59.3	59%	0.587	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.6	-15.3	-175.2	-82	-174.8	167	-174.9	0	115.8	R375 E378	R375-K490 PolarHBondContact NH2-O 2.61Å; E378-K490 IonicContact OE2-NZ 3.89Å; E378-K490 PolarHBondContact OE2-NZ 3.24Å
491	S	36.9	Very low	48	Very low	8 Å²	8	61 Å²	61	6%	0.056	33%	0.327	C	S	.	.			trans	-133.3	87.8	-167.3	33.3	0	0	0	0	113.5	E379 L487 A493	E379-S491 PolarHBondContact OE1-OG 2.67Å; L487-S491 PolarHBondContact N-OG 3.01Å; L487-S491 PolarHBondContact O-OG 3.33Å; L487-S491 VanDerWaalsContact O-OG 3.09Å; S491-A493 VanDerWaalsContact C-N 3.33Å; S491-A493 PolarHBondContact O-N 2.84Å
492	F	34.9	Very low	46.8	Very low	126 Å²	126	58.6 Å²	58.6	55%	0.553	31%	0.314	S	S	*	.			trans	-50.5	99.8	148.1	-120.2	-100.8	0	0	0	106.8	R375 K494 E510	R375-F492 PolarHBondContact NH1-O 3.14Å; F492-K494 PolarHBondContact O-N 2.62Å; F492-E510 HydrophobicContact CD1-CB 3.61Å; F492-E510 HydrophobicContact CD1-CG 4.17Å; F492-E510 HydrophobicContact CE1-CB 3.47Å; F492-E510 VanDerWaalsContact CE1-CB 3.47Å; F492-E510 HydrophobicContact CE1-CG 4.17Å; F492-E510 WeakPolarHBondContact CE1-OE2 3.5Å; F492-E510 HydrophobicContact CG-CB 4.38Å; F492-E510 HydrophobicContact CZ-CB 4.13Å
493	A	38.9	Very low	46.1	Very low	22 Å²	22	58.5 Å²	58.5	18%	0.182	31%	0.314	C	S	.	.			trans	-95.4	84.9	-168.6	0	0	0	0	0	109.4	S491 S495 Y512	S491-A493 VanDerWaalsContact C-N 3.33Å; S491-A493 PolarHBondContact O-N 2.84Å; A493-S495 PolarHBondContact O-N 3.3Å; A493-Y512 WeakPolarHBondContact CB-OH 3.1Å; A493-Y512 PolarHBondContact N-OH 2.78Å
494	K	41.1	Very low	46	Very low	171 Å²	171	57.6 Å²	57.6	74%	0.743	31%	0.305	S	S	*	.			trans	-76.1	52.5	-172.6	-165.4	159.1	-175.6	160	0	113.4	F492 E510	F492-K494 PolarHBondContact O-N 2.62Å; K494-E510 VanDerWaalsContact CA-OE1 3.3Å; K494-E510 WeakPolarHBondContact CA-OE1 3.45Å; K494-E510 WeakPolarHBondContact CB-OE1 3.47Å; K494-E510 WeakPolarHBondContact CG-OE1 3.5Å
495	S	37.2	Very low	46.1	Very low	62 Å²	62	54.2 Å²	54.2	43%	0.434	29%	0.288	S	S	.	.			trans	-148.3	117.4	-179.6	61.8	0	0	0	0	110.8	A493 I497	A493-S495 PolarHBondContact O-N 3.3Å; S495-I497 VanDerWaalsContact C-N 3.26Å; S495-I497 PolarHBondContact O-N 3.32Å
496	V	37	Very low	46.6	Very low	121 Å²	121	55.1 Å²	55.1	73%	0.733	29%	0.291	S	S	*	.			trans	-73.3	83.9	171.8	-177.1	0	0	0	0	108.6
497	I	48.3	Very low	46.8	Very low	85 Å²	85	55.1 Å²	55.1	44%	0.436	29%	0.29	S	S	.	.			trans	-123.8	95.2	177.7	-60.2	176.6	0	0	0	107.8	F343 S495	F343-I497 HydrophobicContact CZ-CD1 4.32Å; S495-I497 VanDerWaalsContact C-N 3.26Å; S495-I497 PolarHBondContact O-N 3.32Å
498	G	46.1	Very low	47.3	Very low	28 Å²	28	58.5 Å²	58.5	29%	0.289	30%	0.302	S	S	.	.	S	Bend	trans	-172.4	156.1	176.7	0	0	0	0	0	109.1	P500	G498-P500 WeakPolarHBondContact O-CD 3.25Å
499	T	46.7	Very low	47.9	Very low	39 Å²	39	61 Å²	61	24%	0.239	32%	0.315	C	S	.	.			trans	-78.2	112.1	169.9	-58.4	0	0	0	0	107.5	K464 E501 F502 Y533	K464-T499 PolarHBondContact NZ-OG1 2.95Å; T499-E501 HydrophobicContact CG2-CB 4.49Å; T499-E501 WeakPolarHBondContact CG2-OE2 3.34Å; T499-E501 PolarHBondContact O-N 3.46Å; T499-F502 HydrophobicContact CG2-CD2 4.13Å; T499-F502 PolarHBondContact O-N 2.93Å; T499-Y533 WeakPolarHBondContact CG2-OH 3.49Å
500	P	49.7	Very low	48.7	Very low	29 Å²	29	58.6 Å²	58.6	19%	0.188	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-63.5	-20.1	-163.8	23.9	-32.7	0	0	0	113.8	G498 F502 M503 Y508 P541	G498-P500 WeakPolarHBondContact O-CD 3.25Å; P500-F502 VanDerWaalsContact C-N 3.29Å; P500-F502 PolarHBondContact O-N 3.13Å; P500-M503 HydrophobicContact CB-SD 4.48Å; P500-M503 PolarHBondContact O-N 2.93Å; P500-Y508 WeakPolarHBondContact CB-OH 3.35Å; P500-P541 HydrophobicContact CB-CB 3.95Å; P500-P541 HydrophobicContact CG-CB 3.56Å; P500-P541 HydrophobicContact CG-CG 3.58Å
501	E	54.7	Low	49.4	Very low	39 Å²	39	58.5 Å²	58.5	18%	0.182	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-65.3	-26.4	172.9	-61.9	98.7	-131.7	0	0	114.5	T499 Y533 I544	T499-E501 HydrophobicContact CG2-CB 4.49Å; T499-E501 WeakPolarHBondContact CG2-OE2 3.34Å; T499-E501 PolarHBondContact O-N 3.46Å; E501-Y533 HydrophobicContact CB-CE1 3.7Å; E501-Y533 HydrophobicContact CG-CE1 3.79Å; E501-Y533 PolarHBondContact OE2-OH 2.87Å; E501-I544 HydrophobicContact CG-CD1 3.41Å; E501-I544 VanDerWaalsContact CG-CD1 3.41Å
502	F	56.9	Low	50.8	Low	6 Å²	6	59.4 Å²	59.4	3%	0.026	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-99.8	-5	178.4	-69.5	-61.4	0	0	0	113.7	K464 T499 P500 M523 Y533 P534	K464-F502 HydrophobicContact CB-CD2 3.52Å; K464-F502 HydrophobicContact CB-CE1 4.42Å; K464-F502 HydrophobicContact CB-CE2 3.32Å; K464-F502 HydrophobicContact CB-CG 4.13Å; K464-F502 HydrophobicContact CB-CZ 3.83Å; K464-F502 HydrophobicContact CD-CD2 4.04Å; K464-F502 HydrophobicContact CD-CE2 3.94Å; K464-F502 HydrophobicContact CG-CD2 4.37Å; K464-F502 HydrophobicContact CG-CE2 4.28Å; T499-F502 HydrophobicContact CG2-CD2 4.13Å; T499-F502 PolarHBondContact O-N 2.93Å; P500-F502 VanDerWaalsContact C-N 3.29Å; P500-F502 PolarHBondContact O-N 3.13Å; F502-M523 HydrophobicContact CD1-CB 3.69Å; F502-M523 HydrophobicContact CD1-CG 4.49Å; F502-M523 HydrophobicContact CE1-CB 3.99Å; F502-Y533 VanDerWaalsContact CD2-OH 3.27Å; F502-Y533 WeakPolarHBondContact CD2-OH 3.47Å; F502-Y533 HydrophobicContact CE1-CE2 4.36Å; F502-Y533 AromaticContact CE2-CE2 3.54Å; F502-Y533 HydrophobicContact CE2-CE2 3.54Å; F502-Y533 AromaticContact CE2-CZ 3.65Å; F502-Y533 WeakPolarHBondContact CE2-OH 3.48Å; F502-Y533 HydrophobicContact CZ-CD2 4.37Å; F502-Y533 AromaticContact CZ-CE2 3.4Å; F502-Y533 HydrophobicContact CZ-CE2 3.4Å; F502-Y533 AromaticContact CZ-CZ 3.85Å; F502-P534 HydrophobicContact CE1-CG 4.36Å
503	M	61.2	Low	53.1	Low	11 Å²	11	54.6 Å²	54.6	5%	0.054	29%	0.286	C	S	.	.			trans	-78.9	131.5	-173.5	-61.8	-176	68.2	0	0	111.7	P500 M507 Y508 Y519	P500-M503 HydrophobicContact CB-SD 4.48Å; P500-M503 PolarHBondContact O-N 2.93Å; M503-M507 HydrophobicContact CB-CE 3.93Å; M503-M507 HydrophobicContact CE-CB 4.17Å; M503-M507 HydrophobicContact CE-CE 4.09Å; M503-M507 HydrophobicContact CE-CG 3.92Å; M503-M507 HydrophobicContact CG-CE 3.8Å; M503-Y508 HydrophobicContact CB-CE2 3.97Å; M503-Y508 HydrophobicContact CE-CE1 4.41Å; M503-Y508 HydrophobicContact CE-CE2 4.36Å; M503-Y508 HydrophobicContact SD-CE1 4.5Å; M503-Y508 HydrophobicContact SD-CE2 4.48Å; M503-Y519 WeakPolarHBondContact O-CE1 3.35Å
504	A	54.8	Low	55.4	Low	0 Å²	0	57 Å²	57	0%	0	29%	0.294	C	S	.	.			trans	-66.2	149.8	168.7	0	0	0	0	0	110.4	E506 M507 V516 Y519	A504-E506 VanDerWaalsContact C-N 3.28Å; A504-E506 VanDerWaalsContact CB-OE1 3.31Å; A504-E506 WeakPolarHBondContact CB-OE1 3.44Å; A504-E506 WeakPolarHBondContact CB-OE2 3.42Å; A504-E506 PolarHBondContact O-N 3.47Å; A504-M507 WeakPolarHBondContact O-CB 3.37Å; A504-M507 PolarHBondContact O-N 3.48Å; A504-V516 HydrophobicContact CB-CB 4.27Å; A504-V516 HydrophobicContact CB-CG1 4.06Å; A504-Y519 HydrophobicContact CB-CD1 3.86Å; A504-Y519 HydrophobicContact CB-CD2 4.39Å; A504-Y519 HydrophobicContact CB-CE1 4.43Å; A504-Y519 HydrophobicContact CB-CG 3.84Å
505	P	57.8	Low	57.8	Low	16 Å²	16	49.5 Å²	49.5	10%	0.104	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-57.4	-38.6	-174.4	18	-28.1	0	0	0	113.3	M507 V548 I549 V577	P505-M507 VanDerWaalsContact C-N 3.28Å; P505-M507 PolarHBondContact O-N 3.04Å; P505-V548 HydrophobicContact CB-CG1 3.93Å; P505-V548 HydrophobicContact CG-CG1 4.06Å; P505-I549 HydrophobicContact CB-CG2 4.05Å; P505-V577 HydrophobicContact CG-CG1 4.16Å
506	E	64.9	Low	60.3	Low	23 Å²	23	46.6 Å²	46.6	11%	0.107	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-75	-10	178.3	75.8	-72.5	176.9	0	0	113.8	A504 Y508 E509 V516 R582	A504-E506 VanDerWaalsContact C-N 3.28Å; A504-E506 VanDerWaalsContact CB-OE1 3.31Å; A504-E506 WeakPolarHBondContact CB-OE1 3.44Å; A504-E506 WeakPolarHBondContact CB-OE2 3.42Å; A504-E506 PolarHBondContact O-N 3.47Å; E506-Y508 PolarHBondContact O-N 3.26Å; E506-E509 CarbonylContact O-C 3.55Å; E506-E509 WeakPolarHBondContact O-CA 3.31Å; E506-E509 WeakPolarHBondContact O-CB 3.39Å; E506-E509 PolarHBondContact O-N 3.28Å; E506-V516 WeakPolarHBondContact OE1-CG1 3.47Å; E506-R582 IonicContact OE1-CZ 3.89Å; E506-R582 IonicContact OE1-NH1 3Å; E506-R582 PolarHBondContact OE1-NH1 3.47Å; E506-R582 IonicContact OE1-NH2 3.08Å; E506-R582 PolarHBondContact OE1-NH2 3.45Å; E506-R582 IonicContact OE2-CZ 3.94Å; E506-R582 IonicContact OE2-NH1 2.67Å; E506-R582 IonicContact OE2-NH2 3.29Å; E506-R582 PolarHBondContact OE2-NH2 2.89Å
507	M	53.4	Low	63	Low	28 Å²	28	40.9 Å²	40.9	14%	0.138	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-75.8	-0.2	177.1	-161.5	151.2	61.7	0	0	113.2	R461 M503 A504 P505 Y512 V516	R461-M507 HydrophobicContact CB-SD 4.26Å; R461-M507 WeakPolarHBondContact O-CE 3.44Å; M503-M507 HydrophobicContact CB-CE 3.93Å; M503-M507 HydrophobicContact CE-CB 4.17Å; M503-M507 HydrophobicContact CE-CE 4.09Å; M503-M507 HydrophobicContact CE-CG 3.92Å; M503-M507 HydrophobicContact CG-CE 3.8Å; A504-M507 WeakPolarHBondContact O-CB 3.37Å; A504-M507 PolarHBondContact O-N 3.48Å; P505-M507 VanDerWaalsContact C-N 3.28Å; P505-M507 PolarHBondContact O-N 3.04Å; M507-Y512 HydrophobicContact CG-CD1 3.97Å; M507-Y512 HydrophobicContact CG-CG 4.4Å; M507-V516 HydrophobicContact CB-CG1 4.3Å; M507-V516 HydrophobicContact CE-CB 4.48Å; M507-V516 HydrophobicContact SD-CB 3.94Å; M507-V516 HydrophobicContact SD-CG1 3.99Å; M507-V516 HydrophobicContact SD-CG2 3.92Å
508	Y	52.7	Low	65.2	Low	80 Å²	80	37 Å²	37	31%	0.314	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-92	-5.8	164.9	-64.8	-88.5	0	0	0	112.8	P500 M503 E506 Y545	P500-Y508 WeakPolarHBondContact CB-OH 3.35Å; M503-Y508 HydrophobicContact CB-CE2 3.97Å; M503-Y508 HydrophobicContact CE-CE1 4.41Å; M503-Y508 HydrophobicContact CE-CE2 4.36Å; M503-Y508 HydrophobicContact SD-CE1 4.5Å; M503-Y508 HydrophobicContact SD-CE2 4.48Å; E506-Y508 PolarHBondContact O-N 3.26Å; Y508-Y545 HydrophobicContact CD1-CD2 4.43Å; Y508-Y545 HydrophobicContact CD1-CE2 4.31Å; Y508-Y545 AromaticContact CD2-CD2 3.7Å; Y508-Y545 HydrophobicContact CD2-CD2 3.7Å; Y508-Y545 AromaticContact CD2-CE2 3.57Å; Y508-Y545 HydrophobicContact CD2-CE2 3.57Å; Y508-Y545 HydrophobicContact CE1-CD2 4.35Å; Y508-Y545 AromaticContact CE2-CD2 3.6Å; Y508-Y545 HydrophobicContact CE2-CD2 3.6Å; Y508-Y545 AromaticContact CE2-CE2 4Å; Y508-Y545 HydrophobicContact CE2-CE2 4Å; Y508-Y545 HydrophobicContact CG-CD2 4.12Å; Y508-Y545 AromaticContact CG-CE2 3.74Å; Y508-Y545 HydrophobicContact CG-CE2 3.74Å; Y508-Y545 AromaticContact CZ-CD2 3.94Å
509	E	55	Low	67.5	Low	131 Å²	131	35.9 Å²	35.9	61%	0.612	18%	0.175	S	C	*	.	S	Bend	trans	-107.1	139.8	169.5	-58.4	-176.8	171.4	0	0	107.7	E506 M511 Y512	E506-E509 CarbonylContact O-C 3.55Å; E506-E509 WeakPolarHBondContact O-CA 3.31Å; E506-E509 WeakPolarHBondContact O-CB 3.39Å; E506-E509 PolarHBondContact O-N 3.28Å; E509-M511 PolarHBondContact O-N 3.4Å; E509-Y512 WeakPolarHBondContact O-CD1 3.4Å
510	E	52.1	Low	69.8	Low	70 Å²	70	34.2 Å²	34.2	33%	0.327	17%	0.165	S	C	.	.	S	Bend	trans	-77.2	24.2	-168	-61.1	-179.8	105.9	0	0	113.7	F492 K494	F492-E510 HydrophobicContact CD1-CB 3.61Å; F492-E510 HydrophobicContact CD1-CG 4.17Å; F492-E510 HydrophobicContact CE1-CB 3.47Å; F492-E510 VanDerWaalsContact CE1-CB 3.47Å; F492-E510 HydrophobicContact CE1-CG 4.17Å; F492-E510 WeakPolarHBondContact CE1-OE2 3.5Å; F492-E510 HydrophobicContact CG-CB 4.38Å; F492-E510 HydrophobicContact CZ-CB 4.13Å; K494-E510 VanDerWaalsContact CA-OE1 3.3Å; K494-E510 WeakPolarHBondContact CA-OE1 3.45Å; K494-E510 WeakPolarHBondContact CB-OE1 3.47Å; K494-E510 WeakPolarHBondContact CG-OE1 3.5Å
511	M	56.5	Low	72.1	Confident	134 Å²	134	32.8 Å²	32.8	66%	0.66	16%	0.156	S	C	*	.			trans	-131.8	43.4	-174.6	-61	-156.4	-54.8	0	0	114.5	E509 R579	E509-M511 PolarHBondContact O-N 3.4Å; M511-R579 PolarHBondContact O-NH1 3.08Å
512	Y	67.6	Low	74.1	Confident	26 Å²	26	31 Å²	31	10%	0.102	15%	0.147	C	C	.	.			trans	-73.6	161.1	172	42.1	-101.4	0	0	0	113.3	R461 A493 M507 E509	R461-Y512 VanDerWaalsContact NH1-CZ 3.26Å; R461-Y512 PolarHBondContact NH1-OH 2.93Å; A493-Y512 WeakPolarHBondContact CB-OH 3.1Å; A493-Y512 PolarHBondContact N-OH 2.78Å; M507-Y512 HydrophobicContact CG-CD1 3.97Å; M507-Y512 HydrophobicContact CG-CG 4.4Å; E509-Y512 WeakPolarHBondContact O-CD1 3.4Å
513	D	82.1	Confident	76	Confident	26 Å²	26	30.7 Å²	30.7	14%	0.139	15%	0.146	C	C	.	.			trans	-135.6	-171.7	176.3	56.9	45.3	0	0	0	111.1	S515 V516 R579	D513-S515 PolarHBondContact O-N 3.04Å; D513-S515 WeakPolarHBondContact OD1-CB 3.48Å; D513-S515 PolarHBondContact OD1-N 2.82Å; D513-S515 PolarHBondContact OD1-OG 3Å; D513-V516 WeakPolarHBondContact O-CG2 3.33Å; D513-V516 PolarHBondContact O-N 3.46Å; D513-R579 WeakPolarHBondContact OD2-CD 3.36Å; D513-R579 IonicContact OD2-CZ 2.76Å; D513-R579 IonicContact OD2-NE 2.66Å; D513-R579 IonicContact OD2-NH1 3.57Å; D513-R579 PolarHBondContact OD2-NH1 3.02Å
514	E	87.7	Confident	77.7	Confident	72 Å²	72	30.1 Å²	30.1	34%	0.336	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-16.3	176.8	51.4	-87.7	-162.6	0	0	115.5	K488 V516 D517	K488-E514 WeakPolarHBondContact CE-OE2 3.39Å; K488-E514 IonicContact NZ-OE1 3.92Å; K488-E514 PolarHBondContact NZ-OE1 3.08Å; K488-E514 IonicContact NZ-OE2 3.32Å; K488-E514 PolarHBondContact NZ-OE2 3.41Å; E514-V516 VanDerWaalsContact C-N 3.27Å; E514-V516 PolarHBondContact O-N 2.86Å; E514-D517 PolarHBondContact O-N 3.39Å
515	S	91.1	Very high	79.7	Confident	13 Å²	13	30.1 Å²	30.1	9%	0.091	14%	0.144	C	C	.	.	H	α-helix	trans	-72.3	-14	177.1	73.3	0	0	0	0	114.3	D513 D517 V518 Y519 R579 R582	D513-S515 PolarHBondContact O-N 3.04Å; D513-S515 WeakPolarHBondContact OD1-CB 3.48Å; D513-S515 PolarHBondContact OD1-N 2.82Å; D513-S515 PolarHBondContact OD1-OG 3Å; S515-D517 VanDerWaalsContact C-N 3.34Å; S515-V518 WeakPolarHBondContact O-CB 3.14Å; S515-V518 PolarHBondContact O-N 3.26Å; S515-Y519 PolarHBondContact O-N 3.05Å; S515-Y519 VanDerWaalsContact O-N 3.08Å; S515-R579 WeakPolarHBondContact OG-CB 3.14Å; S515-R582 PolarHBondContact O-NH1 3.23Å; S515-R582 PolarHBondContact OG-NH1 3.22Å
516	V	89.8	Confident	81.5	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.012	14%	0.139	C	C	.	.	H	α-helix	trans	-68.1	-37.4	170.6	-54.9	0	0	0	0	111	I459 A504 E506 M507 D513 E514 V518 Y519 A520	I459-V516 HydrophobicContact CG2-CG2 3.68Å; A504-V516 HydrophobicContact CB-CB 4.27Å; A504-V516 HydrophobicContact CB-CG1 4.06Å; E506-V516 WeakPolarHBondContact OE1-CG1 3.47Å; M507-V516 HydrophobicContact CB-CG1 4.3Å; M507-V516 HydrophobicContact CE-CB 4.48Å; M507-V516 HydrophobicContact SD-CB 3.94Å; M507-V516 HydrophobicContact SD-CG1 3.99Å; M507-V516 HydrophobicContact SD-CG2 3.92Å; D513-V516 WeakPolarHBondContact O-CG2 3.33Å; D513-V516 PolarHBondContact O-N 3.46Å; E514-V516 VanDerWaalsContact C-N 3.27Å; E514-V516 PolarHBondContact O-N 2.86Å; V516-V518 VanDerWaalsContact C-N 3.29Å; V516-V518 PolarHBondContact O-N 3.38Å; V516-Y519 PolarHBondContact O-N 3.06Å; V516-A520 WeakPolarHBondContact O-CB 3.45Å; V516-A520 PolarHBondContact O-N 3.32Å
517	D	92.9	Very high	83	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-70.8	-28.9	177.4	-62	-19.5	0	0	0	111.1	L448 H452 H460 R461 L463 E514 S515 F521	L448-D517 HydrophobicContact CD1-CB 4.24Å; L448-D517 HydrophobicContact CD2-CB 4Å; H452-D517 IonicContact CD2-OD2 2.67Å; H452-D517 IonicContact CE1-OD2 2.63Å; H452-D517 IonicContact NE2-OD2 2.68Å; H452-D517 PolarHBondContact NE2-OD2 3.45Å; H460-D517 WeakPolarHBondContact CB-OD1 3.42Å; H460-D517 PolarHBondContact N-OD1 3.02Å; H460-D517 PolarHBondContact N-OD2 2.95Å; R461-D517 PolarHBondContact N-OD1 3.16Å; L463-D517 WeakPolarHBondContact CD2-O 3.35Å; E514-D517 PolarHBondContact O-N 3.39Å; S515-D517 VanDerWaalsContact C-N 3.34Å; D517-F521 VanDerWaalsContact O-CB 3.25Å; D517-F521 WeakPolarHBondContact O-CB 3.46Å; D517-F521 PolarHBondContact O-N 3.08Å
518	V	95.9	Very high	84.9	Confident	5 Å²	5	27.6 Å²	27.6	3%	0.03	13%	0.13	C	C	.	.	H	α-helix	trans	-66.7	-48.2	170.9	170.4	0	0	0	0	111.1	S515 V516 A520 F521 G522 C574 R582 S583 V585 L588	S515-V518 WeakPolarHBondContact O-CB 3.14Å; S515-V518 PolarHBondContact O-N 3.26Å; V516-V518 VanDerWaalsContact C-N 3.29Å; V516-V518 PolarHBondContact O-N 3.38Å; V518-A520 VanDerWaalsContact C-N 3.34Å; V518-A520 PolarHBondContact O-N 2.98Å; V518-F521 WeakPolarHBondContact O-CB 3.41Å; V518-F521 PolarHBondContact O-N 3.07Å; V518-G522 PolarHBondContact O-N 3.31Å; V518-C574 HydrophobicContact CG1-CB 4.21Å; V518-R582 HydrophobicContact CG1-CB 4.13Å; V518-S583 WeakPolarHBondContact CG1-O 3.5Å; V518-V585 HydrophobicContact CG2-CG2 3.71Å; V518-L588 HydrophobicContact CG1-CD1 4.32Å
519	Y	94.9	Very high	86.9	Confident	4 Å²	4	25 Å²	25	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-59.4	-47	177	178.1	-87.5	0	0	0	110.9	M503 A504 S515 V516 F521 G522 M523 V548 C574 I575	M503-Y519 WeakPolarHBondContact O-CE1 3.35Å; A504-Y519 HydrophobicContact CB-CD1 3.86Å; A504-Y519 HydrophobicContact CB-CD2 4.39Å; A504-Y519 HydrophobicContact CB-CE1 4.43Å; A504-Y519 HydrophobicContact CB-CG 3.84Å; S515-Y519 PolarHBondContact O-N 3.05Å; S515-Y519 VanDerWaalsContact O-N 3.08Å; V516-Y519 PolarHBondContact O-N 3.06Å; Y519-F521 PolarHBondContact O-N 3.3Å; Y519-G522 WeakPolarHBondContact O-CA 3.37Å; Y519-G522 PolarHBondContact O-N 3.14Å; Y519-G522 VanDerWaalsContact O-N 3.13Å; Y519-M523 HydrophobicContact CD1-CG 4.46Å; Y519-M523 HydrophobicContact CE1-CE 3.98Å; Y519-M523 HydrophobicContact CE1-CG 4.15Å; Y519-M523 HydrophobicContact CE2-CE 4.09Å; Y519-M523 PolarHBondContact O-N 3.37Å; Y519-M523 VanDerWaalsContact OH-CE 3.29Å; Y519-M523 WeakPolarHBondContact OH-CE 3.41Å; Y519-V548 WeakPolarHBondContact OH-CG1 3.36Å; Y519-V548 WeakPolarHBondContact OH-CG2 3.44Å; Y519-C574 WeakPolarHBondContact CA-O 3.39Å; Y519-I575 HydrophobicContact CD2-CB 4.22Å; Y519-I575 HydrophobicContact CE2-CB 4.08Å
520	A	94.4	Very high	88.7	Confident	3 Å²	3	20.1 Å²	20.1	3%	0.025	10%	0.102	C	C	.	.	H	α-helix	trans	-63.8	-37.4	176.4	0	0	0	0	0	113	L463 V516 V518 M523 C524	L463-A520 HydrophobicContact CB-CB 3.82Å; L463-A520 HydrophobicContact CD2-CB 4.19Å; L463-A520 HydrophobicContact CG-CB 4.4Å; L463-A520 WeakPolarHBondContact O-CB 3.44Å; V516-A520 WeakPolarHBondContact O-CB 3.45Å; V516-A520 PolarHBondContact O-N 3.32Å; V518-A520 VanDerWaalsContact C-N 3.34Å; V518-A520 PolarHBondContact O-N 2.98Å; A520-M523 PolarHBondContact O-N 3.47Å; A520-C524 PolarHBondContact O-N 3.36Å; A520-C524 PolarHBondContact O-SG 3.02Å
521	F	97.7	Very high	90.6	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.3	-42.8	170.6	166.5	-97.9	0	0	0	111.7	C441 I444 L445 L448 L463 D517 V518 Y519 M523 C524 L525 L588 F594	C441-F521 HydrophobicContact CB-CE2 3.98Å; C441-F521 HydrophobicContact CB-CZ 4.03Å; I444-F521 HydrophobicContact CB-CD2 4.32Å; I444-F521 HydrophobicContact CB-CE2 4.41Å; I444-F521 HydrophobicContact CG2-CD2 3.82Å; I444-F521 HydrophobicContact CG2-CE2 4.4Å; L445-F521 HydrophobicContact CD1-CE1 4.18Å; L445-F521 HydrophobicContact CD1-CE2 4.21Å; L445-F521 HydrophobicContact CD1-CZ 3.7Å; L445-F521 HydrophobicContact CD2-CD1 3.93Å; L445-F521 HydrophobicContact CD2-CD2 4.12Å; L445-F521 HydrophobicContact CD2-CE1 3.82Å; L445-F521 HydrophobicContact CD2-CE2 4.01Å; L445-F521 HydrophobicContact CD2-CG 4.09Å; L445-F521 HydrophobicContact CD2-CZ 3.85Å; L445-F521 HydrophobicContact CG-CD2 4.26Å; L445-F521 HydrophobicContact CG-CE1 4.17Å; L445-F521 HydrophobicContact CG-CE2 3.74Å; L445-F521 HydrophobicContact CG-CZ 3.68Å; L448-F521 HydrophobicContact CD1-CB 4.2Å; L463-F521 HydrophobicContact CD2-CB 4.19Å; D517-F521 VanDerWaalsContact O-CB 3.25Å; D517-F521 WeakPolarHBondContact O-CB 3.46Å; D517-F521 PolarHBondContact O-N 3.08Å; V518-F521 WeakPolarHBondContact O-CB 3.41Å; V518-F521 PolarHBondContact O-N 3.07Å; Y519-F521 PolarHBondContact O-N 3.3Å; F521-M523 VanDerWaalsContact C-N 3.3Å; F521-M523 PolarHBondContact O-N 2.91Å; F521-C524 PolarHBondContact O-N 3.1Å; F521-L525 HydrophobicContact CE1-CD2 4.36Å; F521-L525 HydrophobicContact CZ-CD2 4.45Å; F521-L525 WeakPolarHBondContact O-CB 3.48Å; F521-L525 PolarHBondContact O-N 3.2Å; F521-L588 HydrophobicContact CD1-CD1 4.07Å; F521-L588 HydrophobicContact CE1-CD1 4.1Å; F521-F594 HydrophobicContact CE1-CE2 4.39Å; F521-F594 HydrophobicContact CE1-CZ 4.32Å; F521-F594 HydrophobicContact CZ-CE2 4.18Å; F521-F594 AromaticContact CZ-CZ 3.8Å; F521-F594 HydrophobicContact CZ-CZ 3.8Å
522	G	97	Very high	92.3	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-57.8	-40.6	173.9	0	0	0	0	0	113	V518 Y519 L525 L526	V518-G522 PolarHBondContact O-N 3.31Å; Y519-G522 WeakPolarHBondContact O-CA 3.37Å; Y519-G522 PolarHBondContact O-N 3.14Å; Y519-G522 VanDerWaalsContact O-N 3.13Å; G522-L525 PolarHBondContact O-N 2.91Å; G522-L526 WeakPolarHBondContact O-CB 3.26Å; G522-L526 PolarHBondContact O-N 3.29Å
523	M	95.9	Very high	93.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-71.9	-36.7	175.6	-66.9	-58.9	-176.7	0	0	113	F502 Y519 A520 F521 L525 L526 E527 P534 Y535 P554 I575	F502-M523 HydrophobicContact CD1-CB 3.69Å; F502-M523 HydrophobicContact CD1-CG 4.49Å; F502-M523 HydrophobicContact CE1-CB 3.99Å; Y519-M523 HydrophobicContact CD1-CG 4.46Å; Y519-M523 HydrophobicContact CE1-CE 3.98Å; Y519-M523 HydrophobicContact CE1-CG 4.15Å; Y519-M523 HydrophobicContact CE2-CE 4.09Å; Y519-M523 PolarHBondContact O-N 3.37Å; Y519-M523 VanDerWaalsContact OH-CE 3.29Å; Y519-M523 WeakPolarHBondContact OH-CE 3.41Å; A520-M523 PolarHBondContact O-N 3.47Å; F521-M523 VanDerWaalsContact C-N 3.3Å; F521-M523 PolarHBondContact O-N 2.91Å; M523-L525 VanDerWaalsContact C-N 3.34Å; M523-L526 PolarHBondContact O-N 2.92Å; M523-L526 HydrophobicContact SD-CD2 4.15Å; M523-E527 PolarHBondContact O-N 3.43Å; M523-P534 HydrophobicContact CB-CG 4.31Å; M523-P534 HydrophobicContact SD-CB 3.98Å; M523-P534 HydrophobicContact SD-CG 4.27Å; M523-Y535 HydrophobicContact CE-CE2 3.85Å; M523-P554 HydrophobicContact CE-CG 3.98Å; M523-P554 HydrophobicContact SD-CG 4.05Å; M523-I575 HydrophobicContact CE-CB 4.08Å; M523-I575 HydrophobicContact CE-CD1 4.28Å; M523-I575 HydrophobicContact CE-CG2 3.85Å; M523-I575 HydrophobicContact CG-CG2 4.26Å; M523-I575 HydrophobicContact SD-CG2 4.02Å
524	C	97.1	Very high	93.9	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-64.2	-39.3	172	-65.7	0	0	0	0	111.8	K464 I468 A520 F521 M528	K464-C524 VanDerWaalsContact CA-SG 3.54Å; I468-C524 HydrophobicContact CD1-CB 4.32Å; A520-C524 PolarHBondContact O-N 3.36Å; A520-C524 PolarHBondContact O-SG 3.02Å; F521-C524 PolarHBondContact O-N 3.1Å; C524-M528 WeakPolarHBondContact O-CB 3.25Å; C524-M528 WeakPolarHBondContact O-CG 3.45Å; C524-M528 PolarHBondContact O-N 3.4Å
525	L	97	Very high	94.3	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-65.2	-42.5	174.1	175.2	58.7	0	0	0	111.2	L437 F521 G522 M523 M528 V529 I567 I570 I571 F594	L437-L525 HydrophobicContact CD2-CD1 3.82Å; F521-L525 HydrophobicContact CE1-CD2 4.36Å; F521-L525 HydrophobicContact CZ-CD2 4.45Å; F521-L525 WeakPolarHBondContact O-CB 3.48Å; F521-L525 PolarHBondContact O-N 3.2Å; G522-L525 PolarHBondContact O-N 2.91Å; M523-L525 VanDerWaalsContact C-N 3.34Å; L525-M528 PolarHBondContact O-N 3.11Å; L525-V529 HydrophobicContact CD1-CG2 3.91Å; L525-V529 WeakPolarHBondContact O-CB 3.49Å; L525-V529 WeakPolarHBondContact O-CG2 3.22Å; L525-V529 PolarHBondContact O-N 3.48Å; L525-V529 VanDerWaalsContact O-N 3.08Å; L525-I567 HydrophobicContact CD1-CG2 4.36Å; L525-I570 HydrophobicContact CD2-CB 4.44Å; L525-I570 HydrophobicContact CD2-CG2 3.6Å; L525-I571 HydrophobicContact CB-CG1 4.22Å; L525-I571 HydrophobicContact CD2-CD1 4.42Å; L525-I571 HydrophobicContact CD2-CG1 3.61Å; L525-I571 HydrophobicContact CG-CD1 3.99Å; L525-I571 HydrophobicContact CG-CG1 3.63Å; L525-F594 HydrophobicContact CD2-CZ 4.28Å
526	L	96.3	Very high	94.3	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-59.1	-50.5	173.8	-179.4	60.6	0	0	0	111.8	G522 M523 M528 V529 T530 P534 P554 F557 I560 I571	G522-L526 WeakPolarHBondContact O-CB 3.26Å; G522-L526 PolarHBondContact O-N 3.29Å; M523-L526 PolarHBondContact O-N 2.92Å; M523-L526 HydrophobicContact SD-CD2 4.15Å; L526-M528 VanDerWaalsContact C-N 3.3Å; L526-M528 PolarHBondContact O-N 2.98Å; L526-V529 PolarHBondContact O-N 3.05Å; L526-V529 VanDerWaalsContact O-N 3.16Å; L526-T530 HydrophobicContact CD1-CG2 3.81Å; L526-T530 PolarHBondContact O-N 3.12Å; L526-T530 PolarHBondContact O-OG1 3.32Å; L526-P534 HydrophobicContact CD2-CB 4.45Å; L526-P534 HydrophobicContact CD2-CG 4.38Å; L526-P554 HydrophobicContact CD2-CB 3.96Å; L526-P554 HydrophobicContact CD2-CG 3.77Å; L526-F557 HydrophobicContact CD1-CB 4.47Å; L526-I560 HydrophobicContact CD1-CD1 3.95Å; L526-I560 HydrophobicContact CD1-CG1 3.93Å; L526-I571 HydrophobicContact CB-CD1 4.17Å; L526-I571 HydrophobicContact CB-CG2 4.3Å; L526-I571 HydrophobicContact CD1-CD1 4.21Å
527	E	95.2	Very high	94.5	Very high	10 Å²	10	18 Å²	18	5%	0.047	10%	0.104	C	C	.	.	H	α-helix	trans	-59.6	-39	177	-163.6	-174.3	172.8	0	0	111.8	L426 C465 M523 V529 G531 P534	L426-E527 HydrophobicContact CD1-CG 4.07Å; C465-E527 VanDerWaalsContact CB-OE2 3.26Å; C465-E527 WeakPolarHBondContact CB-OE2 3.42Å; C465-E527 PolarHBondContact SG-OE2 3.4Å; M523-E527 PolarHBondContact O-N 3.43Å; E527-V529 VanDerWaalsContact C-N 3.34Å; E527-V529 PolarHBondContact O-N 2.83Å; E527-G531 WeakPolarHBondContact O-CA 3.45Å; E527-G531 PolarHBondContact O-N 2.86Å; E527-P534 HydrophobicContact CB-CG 4.42Å
528	M	94.6	Very high	94.5	Very high	3 Å²	3	18.8 Å²	18.8	2%	0.015	11%	0.11	C	C	.	.	H	α-helix	trans	-65.5	-31.1	176.4	-85.1	-167.8	-79.6	0	0	114.5	L422 L426 I432 L437 C441 I444 C524 L525 L526	L422-M528 HydrophobicContact CD1-CG 3.94Å; L422-M528 HydrophobicContact CD1-SD 3.87Å; L422-M528 HydrophobicContact CD2-CE 4.01Å; L422-M528 HydrophobicContact CD2-CG 3.85Å; L422-M528 HydrophobicContact CD2-SD 3.64Å; L422-M528 HydrophobicContact CG-CG 4.15Å; L422-M528 HydrophobicContact CG-SD 4.29Å; L426-M528 HydrophobicContact CD1-CG 4.19Å; I432-M528 HydrophobicContact CD1-CB 3.99Å; I432-M528 HydrophobicContact CD1-CG 3.7Å; I432-M528 HydrophobicContact CD1-SD 4.1Å; L437-M528 HydrophobicContact CD1-CB 3.91Å; C441-M528 WeakPolarHBondContact SG-CE 3.4Å; I444-M528 HydrophobicContact CD1-CE 4.07Å; C524-M528 WeakPolarHBondContact O-CB 3.25Å; C524-M528 WeakPolarHBondContact O-CG 3.45Å; C524-M528 PolarHBondContact O-N 3.4Å; L525-M528 PolarHBondContact O-N 3.11Å; L526-M528 VanDerWaalsContact C-N 3.3Å; L526-M528 PolarHBondContact O-N 2.98Å
529	V	94.4	Very high	94.1	Very high	27 Å²	27	26.5 Å²	26.5	16%	0.164	15%	0.148	C	C	.	.	H	α-helix	trans	-89	-40.3	-174.4	172.4	0	0	0	0	111.5	L437 L525 L526 E527 I560 I567	L437-V529 HydrophobicContact CD1-CG2 3.75Å; L437-V529 HydrophobicContact CD2-CG2 4.47Å; L525-V529 HydrophobicContact CD1-CG2 3.91Å; L525-V529 WeakPolarHBondContact O-CB 3.49Å; L525-V529 WeakPolarHBondContact O-CG2 3.22Å; L525-V529 PolarHBondContact O-N 3.48Å; L525-V529 VanDerWaalsContact O-N 3.08Å; L526-V529 PolarHBondContact O-N 3.05Å; L526-V529 VanDerWaalsContact O-N 3.16Å; E527-V529 VanDerWaalsContact C-N 3.34Å; E527-V529 PolarHBondContact O-N 2.83Å; V529-I560 HydrophobicContact CG1-CG2 4.14Å; V529-I567 HydrophobicContact CB-CG2 4.49Å; V529-I567 HydrophobicContact CG1-CG2 4.25Å; V529-I567 HydrophobicContact CG2-CD1 4.41Å; V529-I567 HydrophobicContact CG2-CG2 3.59Å
530	T	92.8	Very high	93.6	Very high	28 Å²	28	29.6 Å²	29.6	17%	0.172	17%	0.165	C	C	.	.	H	α-helix	trans	-85.6	-30.6	-179.4	60.3	0	0	0	0	112.4	L526 E532 C556	L526-T530 HydrophobicContact CD1-CG2 3.81Å; L526-T530 PolarHBondContact O-N 3.12Å; L526-T530 PolarHBondContact O-OG1 3.32Å; T530-E532 PolarHBondContact OG1-N 2.97Å; T530-E532 PolarHBondContact OG1-O 3.01Å; T530-C556 HydrophobicContact CG2-CB 4.09Å; T530-C556 WeakPolarHBondContact CG2-O 3.49Å
531	G	91.7	Very high	93	Very high	37 Å²	37	32.6 Å²	32.6	38%	0.381	18%	0.184	S	C	.	.	S	Bend	trans	73.4	10.9	-165.3	0	0	0	0	0	113.3	E527	E527-G531 WeakPolarHBondContact O-CA 3.45Å; E527-G531 PolarHBondContact O-N 2.86Å
532	E	91.2	Very high	92.2	Very high	68 Å²	68	35 Å²	35	32%	0.318	20%	0.204	S	C	.	.	S	Bend	trans	-121.8	141.9	-174	-61.7	-176.9	147	0	0	111.2	T530 C556 R559	T530-E532 PolarHBondContact OG1-N 2.97Å; T530-E532 PolarHBondContact OG1-O 3.01Å; E532-C556 HydrophobicContact CB-CB 4.33Å; E532-C556 WeakPolarHBondContact OE2-CB 3.4Å; E532-R559 IonicContact OE1-NH1 3.74Å; E532-R559 PolarHBondContact OE1-NH1 2.85Å; E532-R559 WeakPolarHBondContact OE2-CD 3.46Å; E532-R559 IonicContact OE2-CZ 2.68Å; E532-R559 IonicContact OE2-NE 2.99Å; E532-R559 IonicContact OE2-NH1 3.86Å; E532-R559 PolarHBondContact OE2-NH1 2.64Å
533	Y	91.3	Very high	91.9	Very high	53 Å²	53	36.9 Å²	36.9	21%	0.208	22%	0.215	C	C	.	.			trans	-70.2	130.1	-178.9	-164.7	-105.8	0	0	0	111.3	T499 E501 F502 S536	T499-Y533 WeakPolarHBondContact CG2-OH 3.49Å; E501-Y533 HydrophobicContact CB-CE1 3.7Å; E501-Y533 HydrophobicContact CG-CE1 3.79Å; E501-Y533 PolarHBondContact OE2-OH 2.87Å; F502-Y533 VanDerWaalsContact CD2-OH 3.27Å; F502-Y533 WeakPolarHBondContact CD2-OH 3.47Å; F502-Y533 HydrophobicContact CE1-CE2 4.36Å; F502-Y533 AromaticContact CE2-CE2 3.54Å; F502-Y533 HydrophobicContact CE2-CE2 3.54Å; F502-Y533 AromaticContact CE2-CZ 3.65Å; F502-Y533 WeakPolarHBondContact CE2-OH 3.48Å; F502-Y533 HydrophobicContact CZ-CD2 4.37Å; F502-Y533 AromaticContact CZ-CE2 3.4Å; F502-Y533 HydrophobicContact CZ-CE2 3.4Å; F502-Y533 AromaticContact CZ-CZ 3.85Å; Y533-S536 VanDerWaalsContact O-CB 3.23Å; Y533-S536 WeakPolarHBondContact O-CB 3.45Å; Y533-S536 PolarHBondContact O-N 3.1Å; Y533-S536 PolarHBondContact O-OG 2.8Å
534	P	93.7	Very high	91.6	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	141.7	177.4	-26.7	35.8	0	0	0	112.7	F502 M523 L526 E527 S536 P554	F502-P534 HydrophobicContact CE1-CG 4.36Å; M523-P534 HydrophobicContact CB-CG 4.31Å; M523-P534 HydrophobicContact SD-CB 3.98Å; M523-P534 HydrophobicContact SD-CG 4.27Å; L526-P534 HydrophobicContact CD2-CB 4.45Å; L526-P534 HydrophobicContact CD2-CG 4.38Å; E527-P534 HydrophobicContact CB-CG 4.42Å; P534-S536 PolarHBondContact O-N 3.06Å; P534-S536 VanDerWaalsContact O-N 3.13Å; P534-P554 HydrophobicContact CB-CG 4.25Å
535	Y	94.7	Very high	90.9	Very high	7 Å²	7	41.2 Å²	41.2	3%	0.027	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	19.8	-178	-64.7	-66	0	0	0	115.8	M523 E537 C538 I544 K547 V548 V552 P554	M523-Y535 HydrophobicContact CE-CE2 3.85Å; Y535-E537 WeakPolarHBondContact CA-OE2 3.42Å; Y535-E537 PolarHBondContact O-N 2.88Å; Y535-C538 VanDerWaalsContact O-CB 3.27Å; Y535-C538 WeakPolarHBondContact O-CB 3.44Å; Y535-C538 PolarHBondContact O-N 3.04Å; Y535-I544 HydrophobicContact CD1-CG2 4.38Å; Y535-I544 HydrophobicContact CD2-CG2 3.56Å; Y535-I544 HydrophobicContact CE2-CG2 4.13Å; Y535-I544 HydrophobicContact CG-CG2 3.7Å; Y535-K547 HydrophobicContact CD1-CD 3.95Å; Y535-K547 HydrophobicContact CE1-CB 3.96Å; Y535-K547 HydrophobicContact CE1-CD 3.91Å; Y535-V548 HydrophobicContact CD2-CG2 4.44Å; Y535-V548 HydrophobicContact CE2-CG2 3.54Å; Y535-V552 WeakPolarHBondContact CE1-O 3.49Å; Y535-V552 PolarHBondContact OH-O 2.93Å; Y535-P554 HydrophobicContact CD1-CB 4.14Å; Y535-P554 HydrophobicContact CD1-CG 4.1Å; Y535-P554 HydrophobicContact CD2-CG 3.95Å; Y535-P554 HydrophobicContact CE1-CB 4.22Å; Y535-P554 HydrophobicContact CE1-CG 3.86Å; Y535-P554 HydrophobicContact CE2-CG 3.69Å; Y535-P554 HydrophobicContact CG-CB 4.34Å; Y535-P554 HydrophobicContact CG-CG 4.15Å
536	S	92.7	Very high	90.5	Very high	74 Å²	74	47.3 Å²	47.3	52%	0.517	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-15.6	178.3	46.6	0	0	0	0	114.9	Y533 P534 C538	Y533-S536 VanDerWaalsContact O-CB 3.23Å; Y533-S536 WeakPolarHBondContact O-CB 3.45Å; Y533-S536 PolarHBondContact O-N 3.1Å; Y533-S536 PolarHBondContact O-OG 2.8Å; P534-S536 PolarHBondContact O-N 3.06Å; P534-S536 VanDerWaalsContact O-N 3.13Å; S536-C538 PolarHBondContact O-N 3.14Å
537	E	93	Very high	90.3	Very high	58 Å²	58	49.7 Å²	49.7	27%	0.271	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-6.5	170	76.8	-76.6	178.7	0	0	114.1	Y535 K547 E555	Y535-E537 WeakPolarHBondContact CA-OE2 3.42Å; Y535-E537 PolarHBondContact O-N 2.88Å; E537-K547 IonicContact OE1-NZ 3.6Å; E537-K547 PolarHBondContact OE1-NZ 3.42Å; E537-E555 HydrophobicContact CB-CB 4.42Å; E537-E555 HydrophobicContact CG-CB 4Å; E537-E555 PolarHBondContact OE1-N 3.21Å
538	C	92.3	Very high	90.1	Very high	18 Å²	18	49.5 Å²	49.5	12%	0.122	27%	0.266	C	S	.	.			trans	-104.9	122.3	-174.6	-57.4	0	0	0	0	112.5	Y535 S536 N540 T543 I544 K547	Y535-C538 VanDerWaalsContact O-CB 3.27Å; Y535-C538 WeakPolarHBondContact O-CB 3.44Å; Y535-C538 PolarHBondContact O-N 3.04Å; S536-C538 PolarHBondContact O-N 3.14Å; C538-N540 VanDerWaalsContact C-N 3.31Å; C538-N540 PolarHBondContact O-N 2.87Å; C538-T543 HydrophobicContact CB-CG2 4.3Å; C538-I544 HydrophobicContact CB-CD1 3.73Å; C538-I544 HydrophobicContact CB-CG1 3.29Å; C538-K547 PolarHBondContact SG-NZ 3.14Å
539	M	88.4	Confident	89.7	Confident	166 Å²	166	52.7 Å²	52.7	82%	0.818	28%	0.282	S	S	*	.	S	Bend	trans	-74.8	-9.2	-176.4	-64.5	-175.7	70	0	0	115.7
540	N	84.1	Confident	89.4	Confident	70 Å²	70	55.1 Å²	55.1	37%	0.374	30%	0.3	S	S	.	.	S	Bend	trans	-157.5	152.4	178.9	55.8	65.3	0	0	0	113.5	C538 A542 T543 I544	C538-N540 VanDerWaalsContact C-N 3.31Å; C538-N540 PolarHBondContact O-N 2.87Å; N540-A542 VanDerWaalsContact C-N 3.27Å; N540-A542 PolarHBondContact O-N 3.11Å; N540-T543 WeakPolarHBondContact O-CB 3.41Å; N540-T543 PolarHBondContact O-N 3.06Å; N540-T543 WeakPolarHBondContact OD1-CB 3.34Å; N540-T543 PolarHBondContact OD1-N 3.34Å; N540-T543 PolarHBondContact OD1-OG1 3.19Å; N540-I544 PolarHBondContact O-N 2.92Å
541	P	81.5	Confident	89.3	Confident	65 Å²	65	55.4 Å²	55.4	42%	0.422	31%	0.308	S	S	.	.	H	α-helix	trans	-50.7	-38.3	176.3	-34.1	38.9	0	0	0	115.5	P500 T543 I544 Y545	P500-P541 HydrophobicContact CB-CB 3.95Å; P500-P541 HydrophobicContact CG-CB 3.56Å; P500-P541 HydrophobicContact CG-CG 3.58Å; P541-T543 VanDerWaalsContact C-N 3.25Å; P541-T543 PolarHBondContact O-N 2.84Å; P541-I544 PolarHBondContact O-N 2.88Å; P541-I544 VanDerWaalsContact O-N 3.09Å; P541-Y545 PolarHBondContact O-N 3.49Å
542	A	82.2	Confident	89.4	Confident	52 Å²	52	56.9 Å²	56.9	43%	0.43	31%	0.31	S	S	.	.	H	α-helix	trans	-65.6	-28.4	-179	0	0	0	0	0	112.9	N540 R546	N540-A542 VanDerWaalsContact C-N 3.27Å; N540-A542 PolarHBondContact O-N 3.11Å; A542-R546 WeakPolarHBondContact O-CG 3.38Å; A542-R546 PolarHBondContact O-N 2.9Å; A542-R546 PolarHBondContact O-NE 2.87Å
543	T	90	Very high	89.7	Confident	39 Å²	39	57.1 Å²	57.1	24%	0.239	31%	0.31	C	S	.	.	H	α-helix	trans	-74.9	-35	173.4	-58	0	0	0	0	111.5	C538 N540 P541 R546 K547	C538-T543 HydrophobicContact CB-CG2 4.3Å; N540-T543 WeakPolarHBondContact O-CB 3.41Å; N540-T543 PolarHBondContact O-N 3.06Å; N540-T543 WeakPolarHBondContact OD1-CB 3.34Å; N540-T543 PolarHBondContact OD1-N 3.34Å; N540-T543 PolarHBondContact OD1-OG1 3.19Å; P541-T543 VanDerWaalsContact C-N 3.25Å; P541-T543 PolarHBondContact O-N 2.84Å; T543-R546 PolarHBondContact O-N 3.17Å; T543-R546 PolarHBondContact OG1-NH2 3.27Å; T543-K547 PolarHBondContact O-N 3.14Å
544	I	88.8	Confident	89.8	Confident	4 Å²	4	54.7 Å²	54.7	2%	0.021	30%	0.301	C	S	.	.	H	α-helix	trans	-70.9	-47.5	178.6	-57.7	176.4	0	0	0	109.7	E501 Y535 C538 N540 P541 R546 K547 V548	E501-I544 HydrophobicContact CG-CD1 3.41Å; E501-I544 VanDerWaalsContact CG-CD1 3.41Å; Y535-I544 HydrophobicContact CD1-CG2 4.38Å; Y535-I544 HydrophobicContact CD2-CG2 3.56Å; Y535-I544 HydrophobicContact CE2-CG2 4.13Å; Y535-I544 HydrophobicContact CG-CG2 3.7Å; C538-I544 HydrophobicContact CB-CD1 3.73Å; C538-I544 HydrophobicContact CB-CG1 3.29Å; N540-I544 PolarHBondContact O-N 2.92Å; P541-I544 PolarHBondContact O-N 2.88Å; P541-I544 VanDerWaalsContact O-N 3.09Å; I544-R546 VanDerWaalsContact C-N 3.32Å; I544-R546 PolarHBondContact O-N 3.04Å; I544-K547 WeakPolarHBondContact O-CB 3.47Å; I544-K547 PolarHBondContact O-N 2.72Å; I544-V548 HydrophobicContact CG2-CG2 4.18Å; I544-V548 VanDerWaalsContact O-CG2 3.31Å; I544-V548 WeakPolarHBondContact O-CG2 3.32Å; I544-V548 PolarHBondContact O-N 3.38Å
545	Y	83.6	Confident	89.9	Confident	87 Å²	87	59 Å²	59	34%	0.341	32%	0.321	S	S	.	.	H	α-helix	trans	-51	-49.4	170.6	177.8	-107.8	0	0	0	112	Y508 P541 K547 V548 I549	Y508-Y545 HydrophobicContact CD1-CD2 4.43Å; Y508-Y545 HydrophobicContact CD1-CE2 4.31Å; Y508-Y545 AromaticContact CD2-CD2 3.7Å; Y508-Y545 HydrophobicContact CD2-CD2 3.7Å; Y508-Y545 AromaticContact CD2-CE2 3.57Å; Y508-Y545 HydrophobicContact CD2-CE2 3.57Å; Y508-Y545 HydrophobicContact CE1-CD2 4.35Å; Y508-Y545 AromaticContact CE2-CD2 3.6Å; Y508-Y545 HydrophobicContact CE2-CD2 3.6Å; Y508-Y545 AromaticContact CE2-CE2 4Å; Y508-Y545 HydrophobicContact CE2-CE2 4Å; Y508-Y545 HydrophobicContact CG-CD2 4.12Å; Y508-Y545 AromaticContact CG-CE2 3.74Å; Y508-Y545 HydrophobicContact CG-CE2 3.74Å; Y508-Y545 AromaticContact CZ-CD2 3.94Å; P541-Y545 PolarHBondContact O-N 3.49Å; Y545-K547 VanDerWaalsContact C-N 3.35Å; Y545-K547 PolarHBondContact O-N 3.07Å; Y545-V548 PolarHBondContact O-N 2.64Å; Y545-I549 HydrophobicContact CD1-CD1 4.27Å; Y545-I549 HydrophobicContact CD2-CG2 4.07Å; Y545-I549 HydrophobicContact CE1-CD1 3.85Å; Y545-I549 HydrophobicContact CE1-CG2 4.37Å; Y545-I549 HydrophobicContact CE2-CG2 3.65Å; Y545-I549 WeakPolarHBondContact O-CG1 3.36Å; Y545-I549 WeakPolarHBondContact O-CG2 3.49Å; Y545-I549 PolarHBondContact O-N 3.48Å
546	R	88.3	Confident	89.9	Confident	127 Å²	127	58.8 Å²	58.8	48%	0.479	32%	0.32	S	S	.	.	H	α-helix	trans	-58.3	-40.6	175.4	-78.7	-174	-63.6	-109	0.2	113.4	A542 T543 I544 I549 S550	A542-R546 WeakPolarHBondContact O-CG 3.38Å; A542-R546 PolarHBondContact O-N 2.9Å; A542-R546 PolarHBondContact O-NE 2.87Å; T543-R546 PolarHBondContact O-N 3.17Å; T543-R546 PolarHBondContact OG1-NH2 3.27Å; I544-R546 VanDerWaalsContact C-N 3.32Å; I544-R546 PolarHBondContact O-N 3.04Å; R546-I549 WeakPolarHBondContact O-CG1 3.35Å; R546-S550 WeakPolarHBondContact O-CB 3.46Å; R546-S550 PolarHBondContact O-N 3.24Å; R546-S550 PolarHBondContact O-OG 2.98Å
547	K	92.3	Very high	90.1	Very high	50 Å²	50	56.1 Å²	56.1	22%	0.217	30%	0.299	C	S	.	.	H	α-helix	trans	-66.2	-47.8	175.3	-82.5	-172.6	170.2	173.1	0	111.9	Y535 E537 C538 T543 I544 Y545 S550 G551 V552	Y535-K547 HydrophobicContact CD1-CD 3.95Å; Y535-K547 HydrophobicContact CE1-CB 3.96Å; Y535-K547 HydrophobicContact CE1-CD 3.91Å; E537-K547 IonicContact OE1-NZ 3.6Å; E537-K547 PolarHBondContact OE1-NZ 3.42Å; C538-K547 PolarHBondContact SG-NZ 3.14Å; T543-K547 PolarHBondContact O-N 3.14Å; I544-K547 WeakPolarHBondContact O-CB 3.47Å; I544-K547 PolarHBondContact O-N 2.72Å; Y545-K547 VanDerWaalsContact C-N 3.35Å; Y545-K547 PolarHBondContact O-N 3.07Å; K547-S550 CarbonylContact O-C 3.6Å; K547-S550 PolarHBondContact O-N 2.89Å; K547-S550 PolarHBondContact O-OG 2.92Å; K547-S550 VanDerWaalsContact O-OG 3.08Å; K547-G551 PolarHBondContact O-N 3.27Å; K547-V552 HydrophobicContact CB-CB 3.96Å; K547-V552 HydrophobicContact CB-CG1 4.33Å; K547-V552 HydrophobicContact CD-CB 4.49Å; K547-V552 HydrophobicContact CD-CG1 3.93Å; K547-V552 HydrophobicContact CG-CB 3.93Å; K547-V552 HydrophobicContact CG-CG1 3.85Å; K547-V552 PolarHBondContact O-N 3.09Å
548	V	89.5	Confident	90.1	Very high	7 Å²	7	57.4 Å²	57.4	4%	0.042	32%	0.315	C	S	.	.	H	α-helix	trans	-62	-47.5	-177	174.2	0	0	0	0	111.2	P505 Y519 Y535 I544 Y545 S550 G551	P505-V548 HydrophobicContact CB-CG1 3.93Å; P505-V548 HydrophobicContact CG-CG1 4.06Å; Y519-V548 WeakPolarHBondContact OH-CG1 3.36Å; Y519-V548 WeakPolarHBondContact OH-CG2 3.44Å; Y535-V548 HydrophobicContact CD2-CG2 4.44Å; Y535-V548 HydrophobicContact CE2-CG2 3.54Å; I544-V548 HydrophobicContact CG2-CG2 4.18Å; I544-V548 VanDerWaalsContact O-CG2 3.31Å; I544-V548 WeakPolarHBondContact O-CG2 3.32Å; I544-V548 PolarHBondContact O-N 3.38Å; Y545-V548 PolarHBondContact O-N 2.64Å; V548-S550 VanDerWaalsContact C-N 3.27Å; V548-S550 PolarHBondContact O-N 3.47Å; V548-G551 PolarHBondContact O-N 3.38Å
549	I	86.5	Confident	90.2	Very high	69 Å²	69	62 Å²	62	35%	0.354	33%	0.33	S	S	.	.	H	α-helix	trans	-68.2	-23.4	178.2	69.7	-177.1	0	0	0	113.6	P505 Y545 R546	P505-I549 HydrophobicContact CB-CG2 4.05Å; Y545-I549 HydrophobicContact CD1-CD1 4.27Å; Y545-I549 HydrophobicContact CD2-CG2 4.07Å; Y545-I549 HydrophobicContact CE1-CD1 3.85Å; Y545-I549 HydrophobicContact CE1-CG2 4.37Å; Y545-I549 HydrophobicContact CE2-CG2 3.65Å; Y545-I549 WeakPolarHBondContact O-CG1 3.36Å; Y545-I549 WeakPolarHBondContact O-CG2 3.49Å; Y545-I549 PolarHBondContact O-N 3.48Å; R546-I549 WeakPolarHBondContact O-CG1 3.35Å
550	S	89.6	Confident	90.4	Very high	79 Å²	79	54.7 Å²	54.7	55%	0.552	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	2.2	176	56.8	0	0	0	0	113.7	R546 K547 V548 V552	R546-S550 WeakPolarHBondContact O-CB 3.46Å; R546-S550 PolarHBondContact O-N 3.24Å; R546-S550 PolarHBondContact O-OG 2.98Å; K547-S550 CarbonylContact O-C 3.6Å; K547-S550 PolarHBondContact O-N 2.89Å; K547-S550 PolarHBondContact O-OG 2.92Å; K547-S550 VanDerWaalsContact O-OG 3.08Å; V548-S550 VanDerWaalsContact C-N 3.27Å; V548-S550 PolarHBondContact O-N 3.47Å; S550-V552 PolarHBondContact O-N 3.19Å
551	G	89.9	Confident	90.6	Very high	33 Å²	33	53.3 Å²	53.3	34%	0.34	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	11.4	-179.6	0	0	0	0	0	115.2	K547 V548 K553	K547-G551 PolarHBondContact O-N 3.27Å; V548-G551 PolarHBondContact O-N 3.38Å; G551-K553 PolarHBondContact O-N 3.03Å; G551-K553 VanDerWaalsContact O-N 3.16Å
552	V	94.7	Very high	90.7	Very high	69 Å²	69	54.7 Å²	54.7	42%	0.418	31%	0.305	S	S	.	.			trans	-73	106.8	173.3	179.7	0	0	0	0	108.4	Y535 K547 S550	Y535-V552 WeakPolarHBondContact CE1-O 3.49Å; Y535-V552 PolarHBondContact OH-O 2.93Å; K547-V552 HydrophobicContact CB-CB 3.96Å; K547-V552 HydrophobicContact CB-CG1 4.33Å; K547-V552 HydrophobicContact CD-CB 4.49Å; K547-V552 HydrophobicContact CD-CG1 3.93Å; K547-V552 HydrophobicContact CG-CB 3.93Å; K547-V552 HydrophobicContact CG-CG1 3.85Å; K547-V552 PolarHBondContact O-N 3.09Å; S550-V552 PolarHBondContact O-N 3.19Å
553	K	95.6	Very high	90.6	Very high	72 Å²	72	57.4 Å²	57.4	31%	0.313	31%	0.309	S	S	.	.			trans	-68.6	159.1	-179.2	-70.1	168.2	-176.5	163.9	0	111.5	G551 F557 D572 I575	G551-K553 PolarHBondContact O-N 3.03Å; G551-K553 VanDerWaalsContact O-N 3.16Å; K553-F557 HydrophobicContact CB-CB 4.33Å; K553-F557 HydrophobicContact CB-CD1 4.27Å; K553-F557 HydrophobicContact CB-CG 4.33Å; K553-F557 HydrophobicContact CD-CD1 3.98Å; K553-F557 HydrophobicContact CD-CE1 3.81Å; K553-F557 HydrophobicContact CD-CG 4.45Å; K553-F557 HydrophobicContact CD-CZ 4.15Å; K553-D572 IonicContact NZ-OD1 3.58Å; K553-D572 PolarHBondContact NZ-OD1 2.95Å; K553-D572 IonicContact NZ-OD2 3.99Å; K553-I575 HydrophobicContact CB-CD1 4.45Å; K553-I575 HydrophobicContact CD-CD1 4.28Å; K553-I575 HydrophobicContact CG-CD1 3.98Å
554	P	95.3	Very high	90.4	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.019	31%	0.312	C	S	.	.			trans	-55.1	145.7	175.2	-25.4	34.6	0	0	0	112.1	M523 L526 P534 Y535 C556 F557	M523-P554 HydrophobicContact CE-CG 3.98Å; M523-P554 HydrophobicContact SD-CG 4.05Å; L526-P554 HydrophobicContact CD2-CB 3.96Å; L526-P554 HydrophobicContact CD2-CG 3.77Å; P534-P554 HydrophobicContact CB-CG 4.25Å; Y535-P554 HydrophobicContact CD1-CB 4.14Å; Y535-P554 HydrophobicContact CD1-CG 4.1Å; Y535-P554 HydrophobicContact CD2-CG 3.95Å; Y535-P554 HydrophobicContact CE1-CB 4.22Å; Y535-P554 HydrophobicContact CE1-CG 3.86Å; Y535-P554 HydrophobicContact CE2-CG 3.69Å; Y535-P554 HydrophobicContact CG-CB 4.34Å; Y535-P554 HydrophobicContact CG-CG 4.15Å; P554-C556 PolarHBondContact O-N 3.03Å; P554-F557 WeakPolarHBondContact O-CB 3.49Å; P554-F557 PolarHBondContact O-N 3.46Å
555	E	95.4	Very high	90.1	Very high	91 Å²	91	62.3 Å²	62.3	43%	0.425	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-59.8	-37.3	179.1	-161.9	-163.4	124.8	0	0	111.9	E537 F557 S558 R559	E537-E555 HydrophobicContact CB-CB 4.42Å; E537-E555 HydrophobicContact CG-CB 4Å; E537-E555 PolarHBondContact OE1-N 3.21Å; E555-F557 PolarHBondContact O-N 3.22Å; E555-F557 VanDerWaalsContact O-N 3.14Å; E555-S558 WeakPolarHBondContact O-CB 3.31Å; E555-S558 PolarHBondContact O-N 3.32Å; E555-S558 PolarHBondContact O-OG 3.41Å; E555-R559 IonicContact OE1-CZ 2.74Å; E555-R559 IonicContact OE1-NE 2.8Å; E555-R559 IonicContact OE1-NH2 2.78Å; E555-R559 PolarHBondContact OE1-NH2 3.28Å
556	C	94.7	Very high	90.2	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.007	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-64.6	-14	176.8	64.9	0	0	0	0	114.4	T530 E532 P554 S558 R559	T530-C556 HydrophobicContact CG2-CB 4.09Å; T530-C556 WeakPolarHBondContact CG2-O 3.49Å; E532-C556 HydrophobicContact CB-CB 4.33Å; E532-C556 WeakPolarHBondContact OE2-CB 3.4Å; P554-C556 PolarHBondContact O-N 3.03Å; C556-S558 PolarHBondContact O-N 3.19Å; C556-R559 WeakPolarHBondContact O-CB 3.46Å; C556-R559 PolarHBondContact O-N 2.96Å
557	F	96	Very high	90.4	Very high	19 Å²	19	55.1 Å²	55.1	8%	0.083	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-62.9	-28.1	168.9	-177.5	-98.5	0	0	0	112.3	L526 K553 P554 E555 R559 I560 R568 I571 D572 I575	L526-F557 HydrophobicContact CD1-CB 4.47Å; K553-F557 HydrophobicContact CB-CB 4.33Å; K553-F557 HydrophobicContact CB-CD1 4.27Å; K553-F557 HydrophobicContact CB-CG 4.33Å; K553-F557 HydrophobicContact CD-CD1 3.98Å; K553-F557 HydrophobicContact CD-CE1 3.81Å; K553-F557 HydrophobicContact CD-CG 4.45Å; K553-F557 HydrophobicContact CD-CZ 4.15Å; P554-F557 WeakPolarHBondContact O-CB 3.49Å; P554-F557 PolarHBondContact O-N 3.46Å; E555-F557 PolarHBondContact O-N 3.22Å; E555-F557 VanDerWaalsContact O-N 3.14Å; F557-R559 VanDerWaalsContact C-N 3.28Å; F557-I560 HydrophobicContact CD2-CD1 3.6Å; F557-I560 HydrophobicContact CE2-CD1 3.92Å; F557-I560 HydrophobicContact CG-CD1 4.17Å; F557-I560 WeakPolarHBondContact O-CD1 3.37Å; F557-I560 WeakPolarHBondContact O-CG1 3.41Å; F557-R568 HydrophobicContact CE1-CG 4.5Å; F557-R568 HydrophobicContact CE2-CG 4.29Å; F557-R568 HydrophobicContact CZ-CG 3.95Å; F557-I571 HydrophobicContact CD2-CG2 3.81Å; F557-I571 HydrophobicContact CE2-CB 4.16Å; F557-I571 HydrophobicContact CE2-CG2 3.76Å; F557-D572 HydrophobicContact CE2-CB 4.4Å; F557-D572 HydrophobicContact CZ-CB 4.05Å; F557-I575 HydrophobicContact CD2-CD1 4.04Å; F557-I575 HydrophobicContact CE2-CD1 4.29Å
558	S	94.2	Very high	90.4	Very high	85 Å²	85	59 Å²	59	59%	0.594	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-74.8	-18.9	172.9	69.1	0	0	0	0	113.3	E555 C556	E555-S558 WeakPolarHBondContact O-CB 3.31Å; E555-S558 PolarHBondContact O-N 3.32Å; E555-S558 PolarHBondContact O-OG 3.41Å; C556-S558 PolarHBondContact O-N 3.19Å
559	R	93.3	Very high	90.6	Very high	114 Å²	114	63.7 Å²	63.7	43%	0.43	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-91.7	2.5	-175.7	-52.3	176.7	-170.3	-177	-1.1	113.1	E532 E555 C556 F557	E532-R559 IonicContact OE1-NH1 3.74Å; E532-R559 PolarHBondContact OE1-NH1 2.85Å; E532-R559 WeakPolarHBondContact OE2-CD 3.46Å; E532-R559 IonicContact OE2-CZ 2.68Å; E532-R559 IonicContact OE2-NE 2.99Å; E532-R559 IonicContact OE2-NH1 3.86Å; E532-R559 PolarHBondContact OE2-NH1 2.64Å; E555-R559 IonicContact OE1-CZ 2.74Å; E555-R559 IonicContact OE1-NE 2.8Å; E555-R559 IonicContact OE1-NH2 2.78Å; E555-R559 PolarHBondContact OE1-NH2 3.28Å; C556-R559 WeakPolarHBondContact O-CB 3.46Å; C556-R559 PolarHBondContact O-N 2.96Å; F557-R559 VanDerWaalsContact C-N 3.28Å
560	I	92.7	Very high	91	Very high	12 Å²	12	60.4 Å²	60.4	6%	0.062	33%	0.326	C	S	.	.	S	Bend	trans	-59.8	125.7	174.4	-63.3	167.9	0	0	0	108.7	L526 V529 F557 A562 R568 I571	L526-I560 HydrophobicContact CD1-CD1 3.95Å; L526-I560 HydrophobicContact CD1-CG1 3.93Å; V529-I560 HydrophobicContact CG1-CG2 4.14Å; F557-I560 HydrophobicContact CD2-CD1 3.6Å; F557-I560 HydrophobicContact CE2-CD1 3.92Å; F557-I560 HydrophobicContact CG-CD1 4.17Å; F557-I560 WeakPolarHBondContact O-CD1 3.37Å; F557-I560 WeakPolarHBondContact O-CG1 3.41Å; I560-A562 PolarHBondContact O-N 3.32Å; I560-R568 HydrophobicContact CD1-CB 4.18Å; I560-R568 HydrophobicContact CD1-CG 4.03Å; I560-R568 HydrophobicContact CG2-CB 4.05Å; I560-I571 HydrophobicContact CD1-CD1 3.72Å; I560-I571 HydrophobicContact CG1-CD1 4.44Å
561	P	88.3	Confident	91.4	Very high	41 Å²	41	56.7 Å²	56.7	27%	0.266	30%	0.3	S	S	.	.			trans	-61.1	128.4	-173.6	-23.3	32.9	0	0	0	112.7	Q563 Y564	P561-Q563 PolarHBondContact O-N 3.09Å; P561-Y564 HydrophobicContact CB-CD2 4.09Å; P561-Y564 HydrophobicContact CB-CE2 4.47Å; P561-Y564 HydrophobicContact CG-CD2 4.46Å; P561-Y564 PolarHBondContact O-N 2.82Å
562	A	84.1	Confident	91.6	Very high	94 Å²	94	57.1 Å²	57.1	78%	0.777	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.1	-171.6	0	0	0	0	0	114.7	I560 Y564	I560-A562 PolarHBondContact O-N 3.32Å; A562-Y564 PolarHBondContact O-N 3.35Å
563	Q	80.8	Confident	91.7	Very high	110 Å²	110	56 Å²	56	51%	0.514	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-12.5	173	67.6	-94.6	48.4	0	0	114.2	P561 P565 R688	P561-Q563 PolarHBondContact O-N 3.09Å; Q563-P565 WeakPolarHBondContact O-CD 3.34Å; Q563-R688 PolarHBondContact O-NH1 2.58Å
564	Y	83.9	Confident	91.7	Very high	74 Å²	74	52.6 Å²	52.6	29%	0.29	27%	0.268	S	S	.	.			trans	-119.4	60.1	-179.8	-51.6	-58.2	0	0	0	112.8	I434 P561 A562 E566 I567 R568	I434-Y564 HydrophobicContact CD1-CE1 4.49Å; I434-Y564 HydrophobicContact CG1-CE1 4.23Å; P561-Y564 HydrophobicContact CB-CD2 4.09Å; P561-Y564 HydrophobicContact CB-CE2 4.47Å; P561-Y564 HydrophobicContact CG-CD2 4.46Å; P561-Y564 PolarHBondContact O-N 2.82Å; A562-Y564 PolarHBondContact O-N 3.35Å; Y564-E566 VanDerWaalsContact CA-OE2 3.27Å; Y564-E566 WeakPolarHBondContact CA-OE2 3.33Å; Y564-E566 PolarHBondContact O-N 2.73Å; Y564-I567 HydrophobicContact CD1-CD1 4.43Å; Y564-I567 HydrophobicContact CD2-CD1 4.21Å; Y564-I567 HydrophobicContact CG-CD1 3.84Å; Y564-I567 PolarHBondContact O-N 2.92Å; Y564-R568 PolarHBondContact O-N 3.41Å
565	P	82.6	Confident	91.7	Very high	71 Å²	71	53 Å²	53	46%	0.461	27%	0.269	S	S	.	.	H	α-helix	trans	-59.2	-31	-179.9	27.4	-35.9	0	0	0	112.9	Q563 I567 R568 E569	Q563-P565 WeakPolarHBondContact O-CD 3.34Å; P565-I567 VanDerWaalsContact C-N 3.34Å; P565-I567 PolarHBondContact O-N 3.19Å; P565-R568 WeakPolarHBondContact O-CB 3.22Å; P565-R568 PolarHBondContact O-N 2.98Å; P565-E569 PolarHBondContact O-N 3.11Å
566	E	85.9	Confident	91.7	Very high	62 Å²	62	52.7 Å²	52.7	29%	0.29	26%	0.264	S	S	.	.	H	α-helix	trans	-66.2	-34.8	179.5	76.1	-72.3	-178.2	0	0	112.3	Y564 E569 I570 F593	Y564-E566 VanDerWaalsContact CA-OE2 3.27Å; Y564-E566 WeakPolarHBondContact CA-OE2 3.33Å; Y564-E566 PolarHBondContact O-N 2.73Å; E566-E569 PolarHBondContact O-N 3.42Å; E566-I570 WeakPolarHBondContact O-CD1 3.37Å; E566-I570 VanDerWaalsContact O-CG1 3.24Å; E566-I570 WeakPolarHBondContact O-CG1 3.47Å; E566-I570 PolarHBondContact O-N 3.2Å; E566-F593 HydrophobicContact CG-CB 4.38Å; E566-F593 HydrophobicContact CG-CD2 3.36Å; E566-F593 HydrophobicContact CG-CE2 3.95Å; E566-F593 HydrophobicContact CG-CG 4.17Å; E566-F593 WeakPolarHBondContact OE1-CE2 3.31Å
567	I	92.8	Very high	91.4	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-65.3	-42.7	173.3	-63.2	-178.3	0	0	0	110.5	I434 L525 V529 Y564 P565 E569 I570 I571 F593	I434-I567 HydrophobicContact CD1-CD1 3.68Å; L525-I567 HydrophobicContact CD1-CG2 4.36Å; V529-I567 HydrophobicContact CB-CG2 4.49Å; V529-I567 HydrophobicContact CG1-CG2 4.25Å; V529-I567 HydrophobicContact CG2-CD1 4.41Å; V529-I567 HydrophobicContact CG2-CG2 3.59Å; Y564-I567 HydrophobicContact CD1-CD1 4.43Å; Y564-I567 HydrophobicContact CD2-CD1 4.21Å; Y564-I567 HydrophobicContact CG-CD1 3.84Å; Y564-I567 PolarHBondContact O-N 2.92Å; P565-I567 VanDerWaalsContact C-N 3.34Å; P565-I567 PolarHBondContact O-N 3.19Å; I567-E569 VanDerWaalsContact C-N 3.32Å; I567-E569 PolarHBondContact O-N 2.67Å; I567-I570 PolarHBondContact O-N 2.81Å; I567-I571 HydrophobicContact CG2-CD1 3.82Å; I567-I571 HydrophobicContact CG2-CG1 4.44Å; I567-I571 WeakPolarHBondContact O-CG1 3.49Å; I567-I571 PolarHBondContact O-N 3.21Å; I567-F593 HydrophobicContact CD1-CE2 3.84Å; I567-F593 HydrophobicContact CD1-CZ 3.62Å; I567-F593 HydrophobicContact CG1-CD2 4.25Å; I567-F593 HydrophobicContact CG1-CE1 4.17Å; I567-F593 HydrophobicContact CG1-CE2 3.4Å; I567-F593 VanDerWaalsContact CG1-CE2 3.4Å; I567-F593 HydrophobicContact CG1-CZ 3.37Å
568	R	92.8	Very high	91	Very high	131 Å²	131	61.5 Å²	61.5	49%	0.494	30%	0.303	S	S	.	.	H	α-helix	trans	-62.1	-42.1	178.9	-176.6	173.8	176.4	-172.2	-3.6	111.2	F557 I560 Y564 P565 D572	F557-R568 HydrophobicContact CE1-CG 4.5Å; F557-R568 HydrophobicContact CE2-CG 4.29Å; F557-R568 HydrophobicContact CZ-CG 3.95Å; I560-R568 HydrophobicContact CD1-CB 4.18Å; I560-R568 HydrophobicContact CD1-CG 4.03Å; I560-R568 HydrophobicContact CG2-CB 4.05Å; Y564-R568 PolarHBondContact O-N 3.41Å; P565-R568 WeakPolarHBondContact O-CB 3.22Å; P565-R568 PolarHBondContact O-N 2.98Å; R568-D572 WeakPolarHBondContact O-CB 3.2Å; R568-D572 PolarHBondContact O-N 3.16Å
569	E	93.1	Very high	90.7	Very high	105 Å²	105	61.8 Å²	61.8	49%	0.491	29%	0.291	S	S	.	.	H	α-helix	trans	-66	-42.1	176.8	-162.9	-147.2	109.6	0	0	112.4	P565 E566 I567 D572 R573	P565-E569 PolarHBondContact O-N 3.11Å; E566-E569 PolarHBondContact O-N 3.42Å; I567-E569 VanDerWaalsContact C-N 3.32Å; I567-E569 PolarHBondContact O-N 2.67Å; E569-D572 WeakPolarHBondContact O-CB 3.47Å; E569-D572 PolarHBondContact O-N 2.64Å; E569-R573 WeakPolarHBondContact O-CG 3.48Å; E569-R573 PolarHBondContact O-N 3.34Å; E569-R573 IonicContact OE1-CZ 3.78Å; E569-R573 IonicContact OE1-NE 2.58Å; E569-R573 PolarHBondContact OE1-NE 2.84Å; E569-R573 IonicContact OE1-NH2 3.99Å; E569-R573 PolarHBondContact OE1-NH2 2.86Å
570	I	95.6	Very high	90.5	Very high	1 Å²	1	62.8 Å²	62.8	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-62.3	-46.6	175.9	-71.6	163.6	0	0	0	111	L525 E566 I567 D572 R573 C574 L588 F593 F594	L525-I570 HydrophobicContact CD2-CB 4.44Å; L525-I570 HydrophobicContact CD2-CG2 3.6Å; E566-I570 WeakPolarHBondContact O-CD1 3.37Å; E566-I570 VanDerWaalsContact O-CG1 3.24Å; E566-I570 WeakPolarHBondContact O-CG1 3.47Å; E566-I570 PolarHBondContact O-N 3.2Å; I567-I570 PolarHBondContact O-N 2.81Å; I570-D572 VanDerWaalsContact C-N 3.34Å; I570-R573 PolarHBondContact O-N 3.21Å; I570-C574 PolarHBondContact O-N 2.82Å; I570-C574 PolarHBondContact O-SG 3.26Å; I570-L588 HydrophobicContact CG2-CD2 4.21Å; I570-F593 HydrophobicContact CD1-CB 3.41Å; I570-F593 VanDerWaalsContact CD1-CB 3.41Å; I570-F593 HydrophobicContact CD1-CD1 3.67Å; I570-F593 HydrophobicContact CD1-CG 3.65Å; I570-F594 HydrophobicContact CD1-CE2 4.01Å; I570-F594 HydrophobicContact CD1-CZ 4.4Å; I570-F594 HydrophobicContact CG2-CE2 3.7Å; I570-F594 HydrophobicContact CG2-CZ 4.02Å
571	I	97	Very high	90.4	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.2	-47.1	174.8	-65.6	164.4	0	0	0	109.4	L525 L526 F557 I560 I567 R573 C574 I575	L525-I571 HydrophobicContact CB-CG1 4.22Å; L525-I571 HydrophobicContact CD2-CD1 4.42Å; L525-I571 HydrophobicContact CD2-CG1 3.61Å; L525-I571 HydrophobicContact CG-CD1 3.99Å; L525-I571 HydrophobicContact CG-CG1 3.63Å; L526-I571 HydrophobicContact CB-CD1 4.17Å; L526-I571 HydrophobicContact CB-CG2 4.3Å; L526-I571 HydrophobicContact CD1-CD1 4.21Å; F557-I571 HydrophobicContact CD2-CG2 3.81Å; F557-I571 HydrophobicContact CE2-CB 4.16Å; F557-I571 HydrophobicContact CE2-CG2 3.76Å; I560-I571 HydrophobicContact CD1-CD1 3.72Å; I560-I571 HydrophobicContact CG1-CD1 4.44Å; I567-I571 HydrophobicContact CG2-CD1 3.82Å; I567-I571 HydrophobicContact CG2-CG1 4.44Å; I567-I571 WeakPolarHBondContact O-CG1 3.49Å; I567-I571 PolarHBondContact O-N 3.21Å; I571-R573 PolarHBondContact O-N 2.78Å; I571-C574 WeakPolarHBondContact O-CA 3.35Å; I571-C574 WeakPolarHBondContact O-CB 3.43Å; I571-C574 PolarHBondContact O-N 2.97Å; I571-I575 HydrophobicContact CG2-CD1 3.95Å; I571-I575 HydrophobicContact CG2-CG1 4.3Å; I571-I575 HydrophobicContact CG2-CG2 4.2Å; I571-I575 WeakPolarHBondContact O-CG1 3.44Å; I571-I575 PolarHBondContact O-N 3.4Å
572	D	95.2	Very high	90.7	Very high	42 Å²	42	64.4 Å²	64.4	23%	0.225	30%	0.304	C	S	.	.	H	α-helix	trans	-54.5	-48.7	178.7	-164	94	0	0	0	112.2	K553 F557 R568 E569 I570 C574 I575 R576	K553-D572 IonicContact NZ-OD1 3.58Å; K553-D572 PolarHBondContact NZ-OD1 2.95Å; K553-D572 IonicContact NZ-OD2 3.99Å; F557-D572 HydrophobicContact CE2-CB 4.4Å; F557-D572 HydrophobicContact CZ-CB 4.05Å; R568-D572 WeakPolarHBondContact O-CB 3.2Å; R568-D572 PolarHBondContact O-N 3.16Å; E569-D572 WeakPolarHBondContact O-CB 3.47Å; E569-D572 PolarHBondContact O-N 2.64Å; I570-D572 VanDerWaalsContact C-N 3.34Å; D572-C574 VanDerWaalsContact C-N 3.25Å; D572-C574 PolarHBondContact O-N 2.9Å; D572-I575 PolarHBondContact O-N 2.89Å; D572-R576 WeakPolarHBondContact O-CG 3.43Å; D572-R576 IonicContact OD2-NE 3.16Å
573	R	95.5	Very high	91.1	Very high	47 Å²	47	60.4 Å²	60.4	18%	0.177	27%	0.27	C	S	.	.	H	α-helix	trans	-65.8	-21.2	175.5	-74.1	-167.9	-86.1	126.2	-9.2	114	E569 I570 I571 R582 S583 D591	E569-R573 WeakPolarHBondContact O-CG 3.48Å; E569-R573 PolarHBondContact O-N 3.34Å; E569-R573 IonicContact OE1-CZ 3.78Å; E569-R573 IonicContact OE1-NE 2.58Å; E569-R573 PolarHBondContact OE1-NE 2.84Å; E569-R573 IonicContact OE1-NH2 3.99Å; E569-R573 PolarHBondContact OE1-NH2 2.86Å; I570-R573 PolarHBondContact O-N 3.21Å; I571-R573 PolarHBondContact O-N 2.78Å; R573-R582 VanDerWaalsContact O-CA 3.25Å; R573-R582 WeakPolarHBondContact O-CA 3.33Å; R573-S583 WeakPolarHBondContact CB-OG 3.38Å; R573-S583 PolarHBondContact NH1-OG 2.88Å; R573-S583 PolarHBondContact O-N 3.36Å; R573-D591 IonicContact CZ-OD2 2.73Å; R573-D591 IonicContact NH1-OD2 3.53Å; R573-D591 PolarHBondContact NH1-OD2 2.96Å; R573-D591 IonicContact NH2-OD2 3.06Å; R573-D591 PolarHBondContact NH2-OD2 2.8Å
574	C	97.1	Very high	91.8	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-86.1	-40.4	175.4	-65.8	0	0	0	0	112.1	V518 Y519 I570 I571 D572 R576 R582	V518-C574 HydrophobicContact CG1-CB 4.21Å; Y519-C574 WeakPolarHBondContact CA-O 3.39Å; I570-C574 PolarHBondContact O-N 2.82Å; I570-C574 PolarHBondContact O-SG 3.26Å; I571-C574 WeakPolarHBondContact O-CA 3.35Å; I571-C574 WeakPolarHBondContact O-CB 3.43Å; I571-C574 PolarHBondContact O-N 2.97Å; D572-C574 VanDerWaalsContact C-N 3.25Å; D572-C574 PolarHBondContact O-N 2.9Å; C574-R576 PolarHBondContact O-N 3.43Å; C574-R582 WeakPolarHBondContact O-CD 3.43Å
575	I	95.5	Very high	92.4	Very high	10 Å²	10	55.4 Å²	55.4	5%	0.051	26%	0.255	C	S	.	.	S	Bend	trans	-94.2	22	-170.7	73.9	174.2	0	0	0	114.6	Y519 M523 K553 F557 I571 D572	Y519-I575 HydrophobicContact CD2-CB 4.22Å; Y519-I575 HydrophobicContact CE2-CB 4.08Å; M523-I575 HydrophobicContact CE-CB 4.08Å; M523-I575 HydrophobicContact CE-CD1 4.28Å; M523-I575 HydrophobicContact CE-CG2 3.85Å; M523-I575 HydrophobicContact CG-CG2 4.26Å; M523-I575 HydrophobicContact SD-CG2 4.02Å; K553-I575 HydrophobicContact CB-CD1 4.45Å; K553-I575 HydrophobicContact CD-CD1 4.28Å; K553-I575 HydrophobicContact CG-CD1 3.98Å; F557-I575 HydrophobicContact CD2-CD1 4.04Å; F557-I575 HydrophobicContact CE2-CD1 4.29Å; I571-I575 HydrophobicContact CG2-CD1 3.95Å; I571-I575 HydrophobicContact CG2-CG1 4.3Å; I571-I575 HydrophobicContact CG2-CG2 4.2Å; I571-I575 WeakPolarHBondContact O-CG1 3.44Å; I571-I575 PolarHBondContact O-N 3.4Å; D572-I575 PolarHBondContact O-N 2.89Å
576	R	93.8	Very high	92.9	Very high	86 Å²	86	58.9 Å²	58.9	33%	0.325	26%	0.263	S	S	.	.			trans	-67.4	145.2	177.9	-60.5	-168.3	174	160.4	-13.6	111.8	D572 C574 E581 R582	D572-R576 WeakPolarHBondContact O-CG 3.43Å; D572-R576 IonicContact OD2-NE 3.16Å; C574-R576 PolarHBondContact O-N 3.43Å; R576-E581 HydrophobicContact CB-CB 4.33Å; R576-E581 WeakPolarHBondContact CD-O 3.36Å; R576-E581 PolarHBondContact NH1-O 2.95Å; R576-R582 HydrophobicContact CB-CG 4.13Å; R576-R582 PolarHBondContact O-NE 3.2Å; R576-R582 PolarHBondContact O-NH2 3.43Å
577	V	89.2	Confident	93.2	Very high	57 Å²	57	61 Å²	61	35%	0.345	27%	0.273	S	S	.	.	S	Bend	trans	-62.3	-58.9	-178.8	-173.8	0	0	0	0	110.7	P505 R579 R582	P505-V577 HydrophobicContact CG-CG1 4.16Å; V577-R579 PolarHBondContact O-N 2.95Å; V577-R582 PolarHBondContact O-NH2 3.24Å
578	R	87.1	Confident	93.3	Very high	148 Å²	148	60.9 Å²	60.9	56%	0.558	27%	0.272	S	S	*	.	S	Bend	trans	-69.9	123.4	175.9	-75.5	-177.5	-78.6	116.1	8.5	109.7	E580 E581	R578-E580 VanDerWaalsContact C-N 3.27Å; R578-E580 PolarHBondContact O-N 2.96Å; R578-E581 HydrophobicContact CB-CG 4.15Å; R578-E581 IonicContact CZ-OE1 2.76Å; R578-E581 IonicContact CZ-OE2 3.57Å; R578-E581 VanDerWaalsContact CZ-OE2 3.29Å; R578-E581 IonicContact NE-OE2 2.71Å; R578-E581 IonicContact NH1-OE1 3.59Å; R578-E581 PolarHBondContact NH1-OE1 3.03Å; R578-E581 IonicContact NH1-OE2 3.49Å; R578-E581 IonicContact NH2-OE1 3.54Å; R578-E581 PolarHBondContact NH2-OE1 3.41Å; R578-E581 IonicContact NH2-OE2 2.7Å; R578-E581 PolarHBondContact NH2-OE2 3.5Å; R578-E581 PolarHBondContact O-N 2.97Å
579	R	87.9	Confident	93.3	Very high	90 Å²	90	56.8 Å²	56.8	34%	0.34	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-63.4	-33.3	-176.2	60.4	172.6	-178.5	-173.2	-13.1	112.8	M511 D513 S515 V577 E581 R582	M511-R579 PolarHBondContact O-NH1 3.08Å; D513-R579 WeakPolarHBondContact OD2-CD 3.36Å; D513-R579 IonicContact OD2-CZ 2.76Å; D513-R579 IonicContact OD2-NE 2.66Å; D513-R579 IonicContact OD2-NH1 3.57Å; D513-R579 PolarHBondContact OD2-NH1 3.02Å; S515-R579 WeakPolarHBondContact OG-CB 3.14Å; V577-R579 PolarHBondContact O-N 2.95Å; R579-E581 PolarHBondContact O-N 3.23Å; R579-R582 WeakPolarHBondContact O-CB 3.2Å; R579-R582 PolarHBondContact O-N 2.9Å; R579-R582 VanDerWaalsContact O-N 3.09Å
580	E	88.9	Confident	92.9	Very high	135 Å²	135	57.1 Å²	57.1	63%	0.631	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-66.6	-20.2	-178.8	-59.5	75.4	-164.5	0	0	112.2	R578	R578-E580 VanDerWaalsContact C-N 3.27Å; R578-E580 PolarHBondContact O-N 2.96Å
581	E	91.8	Very high	92.5	Very high	75 Å²	75	58.1 Å²	58.1	35%	0.35	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-90.3	-6.5	176.9	-59.5	-169.1	134.5	0	0	113.6	R576 R578 R579	R576-E581 HydrophobicContact CB-CB 4.33Å; R576-E581 WeakPolarHBondContact CD-O 3.36Å; R576-E581 PolarHBondContact NH1-O 2.95Å; R578-E581 HydrophobicContact CB-CG 4.15Å; R578-E581 IonicContact CZ-OE1 2.76Å; R578-E581 IonicContact CZ-OE2 3.57Å; R578-E581 VanDerWaalsContact CZ-OE2 3.29Å; R578-E581 IonicContact NE-OE2 2.71Å; R578-E581 IonicContact NH1-OE1 3.59Å; R578-E581 PolarHBondContact NH1-OE1 3.03Å; R578-E581 IonicContact NH1-OE2 3.49Å; R578-E581 IonicContact NH2-OE1 3.54Å; R578-E581 PolarHBondContact NH2-OE1 3.41Å; R578-E581 IonicContact NH2-OE2 2.7Å; R578-E581 PolarHBondContact NH2-OE2 3.5Å; R578-E581 PolarHBondContact O-N 2.97Å; R579-E581 PolarHBondContact O-N 3.23Å
582	R	94.7	Very high	91.7	Very high	13 Å²	13	62 Å²	62	5%	0.049	30%	0.295	C	S	.	.	S	Bend	trans	-79.3	144.2	-176	-59.8	179.3	-165	146.7	13.5	111.2	E506 S515 V518 R573 C574 R576 V577 R579 T584	E506-R582 IonicContact OE1-CZ 3.89Å; E506-R582 IonicContact OE1-NH1 3Å; E506-R582 PolarHBondContact OE1-NH1 3.47Å; E506-R582 IonicContact OE1-NH2 3.08Å; E506-R582 PolarHBondContact OE1-NH2 3.45Å; E506-R582 IonicContact OE2-CZ 3.94Å; E506-R582 IonicContact OE2-NH1 2.67Å; E506-R582 IonicContact OE2-NH2 3.29Å; E506-R582 PolarHBondContact OE2-NH2 2.89Å; S515-R582 PolarHBondContact O-NH1 3.23Å; S515-R582 PolarHBondContact OG-NH1 3.22Å; V518-R582 HydrophobicContact CG1-CB 4.13Å; R573-R582 VanDerWaalsContact O-CA 3.25Å; R573-R582 WeakPolarHBondContact O-CA 3.33Å; C574-R582 WeakPolarHBondContact O-CD 3.43Å; R576-R582 HydrophobicContact CB-CG 4.13Å; R576-R582 PolarHBondContact O-NE 3.2Å; R576-R582 PolarHBondContact O-NH2 3.43Å; V577-R582 PolarHBondContact O-NH2 3.24Å; R579-R582 WeakPolarHBondContact O-CB 3.2Å; R579-R582 PolarHBondContact O-N 2.9Å; R579-R582 VanDerWaalsContact O-N 3.09Å; R582-T584 PolarHBondContact O-N 3.5Å
583	S	92.9	Very high	91.2	Very high	9 Å²	9	60.2 Å²	60.2	6%	0.063	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-63.9	124.8	173.4	-63.9	0	0	0	0	110.8	V518 R573	V518-S583 WeakPolarHBondContact CG1-O 3.5Å; R573-S583 WeakPolarHBondContact CB-OG 3.38Å; R573-S583 PolarHBondContact NH1-OG 2.88Å; R573-S583 PolarHBondContact O-N 3.36Å
584	T	94.5	Very high	90.7	Very high	70 Å²	70	58 Å²	58	43%	0.429	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-62.3	153.5	170.2	63.6	0	0	0	0	111.1	R582 K586 Q587 L588	R582-T584 PolarHBondContact O-N 3.5Å; T584-K586 PolarHBondContact O-N 2.9Å; T584-K586 VanDerWaalsContact O-N 3.09Å; T584-Q587 WeakPolarHBondContact O-CB 3.48Å; T584-Q587 PolarHBondContact O-N 3.15Å; T584-Q587 WeakPolarHBondContact OG1-CG 3.42Å; T584-Q587 PolarHBondContact OG1-N 2.96Å; T584-Q587 PolarHBondContact OG1-OE1 2.89Å; T584-L588 PolarHBondContact O-N 2.81Å
585	V	96	Very high	89.8	Confident	9 Å²	9	59.6 Å²	59.6	6%	0.055	29%	0.286	C	S	.	.	H	α-helix	trans	-56	-30.1	175.6	-177.9	0	0	0	0	112.1	L445 L448 V518 L589	L445-V585 HydrophobicContact CB-CG1 4.3Å; L445-V585 HydrophobicContact CD2-CG1 4.01Å; L445-V585 VanDerWaalsContact O-CG1 3.22Å; L445-V585 WeakPolarHBondContact O-CG1 3.43Å; L448-V585 HydrophobicContact CB-CG1 4.16Å; L448-V585 HydrophobicContact CB-CG2 4.2Å; V518-V585 HydrophobicContact CG2-CG2 3.71Å; V585-L589 HydrophobicContact CG1-CD1 4.27Å; V585-L589 WeakPolarHBondContact O-CB 3.43Å; V585-L589 WeakPolarHBondContact O-CG 3.46Å; V585-L589 PolarHBondContact O-N 3.42Å
586	K	93.2	Very high	88.5	Confident	145 Å²	145	60 Å²	60	63%	0.63	29%	0.289	S	S	*	.	H	α-helix	trans	-66.2	-46.4	173.6	-67.9	179.4	-178.3	173.6	0	112.2	T584 L588 L589 V590	T584-K586 PolarHBondContact O-N 2.9Å; T584-K586 VanDerWaalsContact O-N 3.09Å; K586-L588 VanDerWaalsContact C-N 3.34Å; K586-L589 PolarHBondContact O-N 3.21Å; K586-V590 PolarHBondContact O-N 2.86Å
587	Q	92.9	Very high	87.1	Confident	106 Å²	106	60 Å²	60	50%	0.495	29%	0.293	S	S	.	.	H	α-helix	trans	-62.9	-40.2	175.1	-74.4	157.6	-44.5	0	0	111.5	T584 L589 V590 D591	T584-Q587 WeakPolarHBondContact O-CB 3.48Å; T584-Q587 PolarHBondContact O-N 3.15Å; T584-Q587 WeakPolarHBondContact OG1-CG 3.42Å; T584-Q587 PolarHBondContact OG1-N 2.96Å; T584-Q587 PolarHBondContact OG1-OE1 2.89Å; Q587-L589 VanDerWaalsContact C-N 3.35Å; Q587-L589 PolarHBondContact O-N 3.39Å; Q587-V590 WeakPolarHBondContact O-CG2 3.43Å; Q587-V590 PolarHBondContact O-N 3.38Å; Q587-D591 PolarHBondContact O-N 2.86Å; Q587-D591 VanDerWaalsContact O-N 3.14Å
588	L	94.8	Very high	85.6	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.5	-32.6	175.3	-65.4	172.4	0	0	0	112.8	L445 V518 F521 I570 T584 K586 V590 D591 F594	L445-L588 HydrophobicContact CD1-CB 3.83Å; L445-L588 HydrophobicContact CD2-CB 3.82Å; L445-L588 HydrophobicContact CD2-CD1 3.77Å; L445-L588 HydrophobicContact CD2-CG 4.46Å; L445-L588 HydrophobicContact CG-CB 4.48Å; V518-L588 HydrophobicContact CG1-CD1 4.32Å; F521-L588 HydrophobicContact CD1-CD1 4.07Å; F521-L588 HydrophobicContact CE1-CD1 4.1Å; I570-L588 HydrophobicContact CG2-CD2 4.21Å; T584-L588 PolarHBondContact O-N 2.81Å; K586-L588 VanDerWaalsContact C-N 3.34Å; L588-V590 VanDerWaalsContact C-N 3.34Å; L588-D591 WeakPolarHBondContact O-CB 3.42Å; L588-D591 PolarHBondContact O-N 2.78Å; L588-F594 VanDerWaalsContact O-CD2 3.24Å; L588-F594 WeakPolarHBondContact O-CD2 3.38Å
589	L	92.2	Very high	84.1	Confident	44 Å²	44	63.1 Å²	63.1	23%	0.23	32%	0.318	C	S	.	.	H	α-helix	trans	-73.7	-21.4	177.1	-81.1	172.3	0	0	0	114.4	L445 K446 V585 K586 Q587	L445-L589 HydrophobicContact CB-CD2 3.59Å; L445-L589 HydrophobicContact CB-CG 3.92Å; K446-L589 HydrophobicContact CG-CD2 3.96Å; V585-L589 HydrophobicContact CG1-CD1 4.27Å; V585-L589 WeakPolarHBondContact O-CB 3.43Å; V585-L589 WeakPolarHBondContact O-CG 3.46Å; V585-L589 PolarHBondContact O-N 3.42Å; K586-L589 PolarHBondContact O-N 3.21Å; Q587-L589 VanDerWaalsContact C-N 3.35Å; Q587-L589 PolarHBondContact O-N 3.39Å
590	V	86.3	Confident	83	Confident	113 Å²	113	59.8 Å²	59.8	69%	0.685	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	4.3	173.4	-56.5	0	0	0	0	112.9	K586 Q587 L588	K586-V590 PolarHBondContact O-N 2.86Å; Q587-V590 WeakPolarHBondContact O-CG2 3.43Å; Q587-V590 PolarHBondContact O-N 3.38Å; L588-V590 VanDerWaalsContact C-N 3.34Å
591	D	86.8	Confident	82.1	Confident	21 Å²	21	53.4 Å²	53.4	11%	0.112	28%	0.278	C	S	.	.	S	Bend	trans	-65.9	137.1	175.7	-167.9	-69.1	0	0	0	110	R573 Q587 L588 F593 F594 T595	R573-D591 IonicContact CZ-OD2 2.73Å; R573-D591 IonicContact NH1-OD2 3.53Å; R573-D591 PolarHBondContact NH1-OD2 2.96Å; R573-D591 IonicContact NH2-OD2 3.06Å; R573-D591 PolarHBondContact NH2-OD2 2.8Å; Q587-D591 PolarHBondContact O-N 2.86Å; Q587-D591 VanDerWaalsContact O-N 3.14Å; L588-D591 WeakPolarHBondContact O-CB 3.42Å; L588-D591 PolarHBondContact O-N 2.78Å; D591-F593 PolarHBondContact O-N 2.76Å; D591-F593 WeakPolarHBondContact OD1-CB 3.42Å; D591-F593 PolarHBondContact OD1-N 2.63Å; D591-F594 HydrophobicContact CB-CD2 4.11Å; D591-F594 CarbonylContact O-C 3.59Å; D591-F594 WeakPolarHBondContact O-CA 3.25Å; D591-F594 PolarHBondContact O-N 2.84Å; D591-T595 PolarHBondContact O-N 3.12Å; D591-T595 PolarHBondContact O-OG1 3.45Å
592	D	80.3	Confident	81.4	Confident	81 Å²	81	50 Å²	50	43%	0.433	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-35.5	-178.5	-74.4	-79.3	0	0	0	113.5	F594 T595 K677	D592-F594 VanDerWaalsContact C-N 3.27Å; D592-F594 PolarHBondContact O-N 2.92Å; D592-T595 PolarHBondContact O-N 2.68Å; D592-K677 VanDerWaalsContact CB-NZ 3.3Å; D592-K677 WeakPolarHBondContact OD1-CE 3.45Å; D592-K677 IonicContact OD1-NZ 3.87Å; D592-K677 PolarHBondContact OD1-NZ 2.94Å; D592-K677 VanDerWaalsContact OD2-CE 3.24Å; D592-K677 WeakPolarHBondContact OD2-CE 3.49Å; D592-K677 IonicContact OD2-NZ 2.98Å
593	F	84.3	Confident	80.8	Confident	6 Å²	6	51.7 Å²	51.7	3%	0.026	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-34	177.8	-178.8	-99.1	0	0	0	112	I434 L437 K438 E566 I567 I570 D591	I434-F593 HydrophobicContact CD1-CE2 3.92Å; I434-F593 HydrophobicContact CD1-CZ 3.72Å; L437-F593 HydrophobicContact CD2-CE1 4.24Å; L437-F593 HydrophobicContact CD2-CZ 4.07Å; K438-F593 HydrophobicContact CD-CD2 4.43Å; K438-F593 HydrophobicContact CD-CE2 4.23Å; K438-F593 HydrophobicContact CD-CZ 4.29Å; K438-F593 VanDerWaalsContact CD-O 3.3Å; K438-F593 WeakPolarHBondContact CD-O 3.27Å; K438-F593 WeakPolarHBondContact CE-O 3.14Å; K438-F593 HydrophobicContact CG-CD1 4.22Å; K438-F593 HydrophobicContact CG-CD2 4.48Å; K438-F593 HydrophobicContact CG-CE1 3.7Å; K438-F593 HydrophobicContact CG-CE2 4.01Å; K438-F593 HydrophobicContact CG-CZ 3.56Å; K438-F593 PolarHBondContact NZ-O 2.91Å; E566-F593 HydrophobicContact CG-CB 4.38Å; E566-F593 HydrophobicContact CG-CD2 3.36Å; E566-F593 HydrophobicContact CG-CE2 3.95Å; E566-F593 HydrophobicContact CG-CG 4.17Å; E566-F593 WeakPolarHBondContact OE1-CE2 3.31Å; I567-F593 HydrophobicContact CD1-CE2 3.84Å; I567-F593 HydrophobicContact CD1-CZ 3.62Å; I567-F593 HydrophobicContact CG1-CD2 4.25Å; I567-F593 HydrophobicContact CG1-CE1 4.17Å; I567-F593 HydrophobicContact CG1-CE2 3.4Å; I567-F593 VanDerWaalsContact CG1-CE2 3.4Å; I567-F593 HydrophobicContact CG1-CZ 3.37Å; I570-F593 HydrophobicContact CD1-CB 3.41Å; I570-F593 VanDerWaalsContact CD1-CB 3.41Å; I570-F593 HydrophobicContact CD1-CD1 3.67Å; I570-F593 HydrophobicContact CD1-CG 3.65Å; D591-F593 PolarHBondContact O-N 2.76Å; D591-F593 WeakPolarHBondContact OD1-CB 3.42Å; D591-F593 PolarHBondContact OD1-N 2.63Å
594	F	85.6	Confident	80.6	Confident	1 Å²	1	51.3 Å²	51.3	0%	0.004	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-1	-180	-62.4	-54.4	0	0	0	114.1	C441 R442 L445 F521 L525 I570 L588 D591 D592 P596	C441-F594 HydrophobicContact CB-CD1 3.97Å; C441-F594 HydrophobicContact CB-CE1 3.23Å; C441-F594 HydrophobicContact CB-CZ 3.91Å; R442-F594 WeakPolarHBondContact CD-O 3.16Å; R442-F594 VanDerWaalsContact NH1-C 3.34Å; R442-F594 PolarHBondContact NH1-O 3.13Å; L445-F594 HydrophobicContact CD1-CD1 4.45Å; L445-F594 HydrophobicContact CD1-CD2 3.73Å; L445-F594 HydrophobicContact CD1-CE2 3.86Å; L445-F594 HydrophobicContact CD1-CG 4.04Å; L445-F594 HydrophobicContact CD1-CZ 4.32Å; F521-F594 HydrophobicContact CE1-CE2 4.39Å; F521-F594 HydrophobicContact CE1-CZ 4.32Å; F521-F594 HydrophobicContact CZ-CE2 4.18Å; F521-F594 AromaticContact CZ-CZ 3.8Å; F521-F594 HydrophobicContact CZ-CZ 3.8Å; L525-F594 HydrophobicContact CD2-CZ 4.28Å; I570-F594 HydrophobicContact CD1-CE2 4.01Å; I570-F594 HydrophobicContact CD1-CZ 4.4Å; I570-F594 HydrophobicContact CG2-CE2 3.7Å; I570-F594 HydrophobicContact CG2-CZ 4.02Å; L588-F594 VanDerWaalsContact O-CD2 3.24Å; L588-F594 WeakPolarHBondContact O-CD2 3.38Å; D591-F594 HydrophobicContact CB-CD2 4.11Å; D591-F594 CarbonylContact O-C 3.59Å; D591-F594 WeakPolarHBondContact O-CA 3.25Å; D591-F594 PolarHBondContact O-N 2.84Å; D592-F594 VanDerWaalsContact C-N 3.27Å; D592-F594 PolarHBondContact O-N 2.92Å; F594-P596 WeakPolarHBondContact O-CD 3.35Å
595	T	76.6	Confident	80.2	Confident	33 Å²	33	50.4 Å²	50.4	20%	0.202	26%	0.256	C	S	.	.	S	Bend	trans	-71.5	125.9	169.8	-58.9	0	0	0	0	109.4	D591 D592 I600	D591-T595 PolarHBondContact O-N 3.12Å; D591-T595 PolarHBondContact O-OG1 3.45Å; D592-T595 PolarHBondContact O-N 2.68Å; T595-I600 HydrophobicContact CG2-CD1 4.09Å; T595-I600 HydrophobicContact CG2-CG1 3.55Å
596	P	68.6	Low	80	Confident	17 Å²	17	51 Å²	51	11%	0.11	26%	0.259	C	S	.	.			trans	-69.7	135.8	177.7	-14.1	26.7	0	0	0	111.5	F594 D598 L599 I600	F594-P596 WeakPolarHBondContact O-CD 3.35Å; P596-D598 PolarHBondContact O-N 2.89Å; P596-D598 VanDerWaalsContact O-N 3.12Å; P596-L599 HydrophobicContact CB-CB 4.06Å; P596-L599 HydrophobicContact CB-CD1 4.29Å; P596-L599 HydrophobicContact CG-CB 3.99Å; P596-L599 HydrophobicContact CG-CD1 4.15Å; P596-L599 HydrophobicContact CG-CD2 4.12Å; P596-L599 HydrophobicContact CG-CG 4.31Å; P596-L599 PolarHBondContact O-N 2.94Å; P596-I600 PolarHBondContact O-N 3.23Å; P596-I600 VanDerWaalsContact O-N 3.13Å
597	E	64.6	Low	79.7	Confident	87 Å²	87	47.9 Å²	47.9	41%	0.407	25%	0.245	S	C	.	.	H	α-helix	trans	-52.2	-36.2	174.5	-67.7	177.2	-137.3	0	0	111.5	R603	E597-R603 IonicContact OE2-NE 3.47Å; E597-R603 PolarHBondContact OE2-NE 2.97Å
598	D	58	Low	79.5	Confident	138 Å²	138	46.6 Å²	46.6	74%	0.738	24%	0.242	S	C	*	.	H	α-helix	trans	-68.7	-31.3	177.7	-35.1	-68.6	0	0	0	113.5	P596 G601	P596-D598 PolarHBondContact O-N 2.89Å; P596-D598 VanDerWaalsContact O-N 3.12Å; D598-G601 PolarHBondContact O-N 2.85Å
599	L	55.3	Low	79.2	Confident	132 Å²	132	49.7 Å²	49.7	69%	0.691	25%	0.254	S	S	*	.	H	α-helix	trans	-85.8	-22.2	-179	-103	71.3	0	0	0	113.1	P596 G601	P596-L599 HydrophobicContact CB-CB 4.06Å; P596-L599 HydrophobicContact CB-CD1 4.29Å; P596-L599 HydrophobicContact CG-CB 3.99Å; P596-L599 HydrophobicContact CG-CD1 4.15Å; P596-L599 HydrophobicContact CG-CD2 4.12Å; P596-L599 HydrophobicContact CG-CG 4.31Å; P596-L599 PolarHBondContact O-N 2.94Å; L599-G601 PolarHBondContact O-N 3.34Å
600	I	65.9	Low	78.8	Confident	21 Å²	21	53.3 Å²	53.3	11%	0.108	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-31.9	167	-58	173.9	0	0	0	109.1	T595 P596 I602 M674 L678	T595-I600 HydrophobicContact CG2-CD1 4.09Å; T595-I600 HydrophobicContact CG2-CG1 3.55Å; P596-I600 PolarHBondContact O-N 3.23Å; P596-I600 VanDerWaalsContact O-N 3.13Å; I600-I602 HydrophobicContact CG2-CB 4.1Å; I600-I602 WeakPolarHBondContact CG2-O 3.34Å; I600-I602 WeakPolarHBondContact O-CG1 3.43Å; I600-I602 PolarHBondContact O-N 3.33Å; I600-I602 VanDerWaalsContact O-N 3.12Å; I600-M674 HydrophobicContact CD1-SD 4.5Å; I600-M674 HydrophobicContact CG1-SD 4.43Å; I600-M674 HydrophobicContact CG2-CE 4.45Å; I600-M674 HydrophobicContact CG2-CG 3.64Å; I600-M674 HydrophobicContact CG2-SD 3.7Å; I600-L678 HydrophobicContact CD1-CD2 4.34Å; I600-L678 HydrophobicContact CG2-CD1 4.04Å
601	G	68.2	Low	78.9	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.01	26%	0.26	C	S	.	.			trans	70.3	-1	-178.9	0	0	0	0	0	113.6	D598 L599 V626 Y627 D628	D598-G601 PolarHBondContact O-N 2.85Å; L599-G601 PolarHBondContact O-N 3.34Å; G601-V626 CarbonylContact O-C 3.48Å; G601-V626 WeakPolarHBondContact O-CA 3.24Å; G601-Y627 PolarHBondContact O-N 3.48Å; G601-D628 PolarHBondContact O-N 3.31Å
602	I	78.5	Confident	79	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	136.7	-170	-50.3	155.3	0	0	0	107.1	I600 L624 R625 V626 K631 Y635 D671 M674 I675 L678	I600-I602 HydrophobicContact CG2-CB 4.1Å; I600-I602 WeakPolarHBondContact CG2-O 3.34Å; I600-I602 WeakPolarHBondContact O-CG1 3.43Å; I600-I602 PolarHBondContact O-N 3.33Å; I600-I602 VanDerWaalsContact O-N 3.12Å; I602-L624 HydrophobicContact CG2-CD1 3.39Å; I602-L624 HydrophobicContact CG2-CG 4.33Å; I602-R625 CarbonylContact C-O 3.52Å; I602-R625 WeakPolarHBondContact CA-O 3.12Å; I602-V626 HydrophobicContact CG1-CG2 4.37Å; I602-V626 HydrophobicContact CG2-CG2 4.48Å; I602-K631 HydrophobicContact CD1-CD 4.47Å; I602-Y635 VanDerWaalsContact CD1-OH 3.26Å; I602-Y635 WeakPolarHBondContact CD1-OH 3.27Å; I602-D671 HydrophobicContact CD1-CB 4.07Å; I602-D671 WeakPolarHBondContact CD1-OD2 3.41Å; I602-M674 HydrophobicContact CD1-CG 4.49Å; I602-I675 HydrophobicContact CD1-CG1 4.49Å; I602-I675 HydrophobicContact CG2-CG1 4.3Å; I602-L678 HydrophobicContact CB-CD1 4.18Å; I602-L678 HydrophobicContact CG2-CD1 4.01Å
603	R	81.7	Confident	79.3	Confident	50 Å²	50	47.1 Å²	47.1	19%	0.189	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	136.5	-177.5	-161.7	159.2	167.3	-88	-18.2	110.2	E597 E605 R625 Y627	E597-R603 IonicContact OE2-NE 3.47Å; E597-R603 PolarHBondContact OE2-NE 2.97Å; R603-E605 IonicContact CZ-OE1 3.67Å; R603-E605 IonicContact NH1-OE1 2.71Å; R603-E605 PolarHBondContact NH1-OE1 3.05Å; R603-E605 IonicContact NH1-OE2 2.66Å; R603-E605 PolarHBondContact NH1-OE2 2.8Å; R603-E605 IonicContact NH2-OE1 2.79Å; R603-E605 PolarHBondContact NH2-OE1 3.26Å; R603-R625 PolarHBondContact N-O 2.78Å; R603-R625 PolarHBondContact O-N 2.72Å; R603-Y627 HydrophobicContact CB-CD2 4.07Å; R603-Y627 HydrophobicContact CB-CE2 3.73Å
604	V	88.1	Confident	79.4	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	130.8	172.5	178.9	0	0	0	0	109.3	M622 Q623 L624 L678 I679 K682	V604-M622 HydrophobicContact CG1-CE 3.7Å; V604-Q623 WeakPolarHBondContact CA-O 3.47Å; V604-L624 HydrophobicContact CG2-CD1 3.62Å; V604-L678 HydrophobicContact CB-CB 4.22Å; V604-L678 HydrophobicContact CG2-CB 3.68Å; V604-L678 HydrophobicContact CG2-CD1 4.32Å; V604-I679 HydrophobicContact CG1-CG1 4.26Å; V604-I679 HydrophobicContact CG2-CG1 4.14Å; V604-K682 HydrophobicContact CB-CG 4.19Å; V604-K682 HydrophobicContact CG1-CB 4.44Å; V604-K682 HydrophobicContact CG1-CG 4.05Å; V604-K682 WeakPolarHBondContact O-CD 3.46Å; V604-K682 WeakPolarHBondContact O-CE 3.36Å; V604-K682 PolarHBondContact O-NZ 3.11Å
605	E	87.3	Confident	79.5	Confident	51 Å²	51	56.3 Å²	56.3	24%	0.238	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	157.2	176.9	-61.5	-170.6	115.1	0	0	110.2	R603 M622 Q623 R625	R603-E605 IonicContact CZ-OE1 3.67Å; R603-E605 IonicContact NH1-OE1 2.71Å; R603-E605 PolarHBondContact NH1-OE1 3.05Å; R603-E605 IonicContact NH1-OE2 2.66Å; R603-E605 PolarHBondContact NH1-OE2 2.8Å; R603-E605 IonicContact NH2-OE1 2.79Å; R603-E605 PolarHBondContact NH2-OE1 3.26Å; E605-M622 CarbonylContact O-C 3.5Å; E605-M622 VanDerWaalsContact O-CA 3.28Å; E605-M622 WeakPolarHBondContact O-CA 3.13Å; E605-Q623 PolarHBondContact N-O 3.31Å; E605-Q623 PolarHBondContact O-N 2.96Å; E605-R625 IonicContact OE2-CZ 2.66Å; E605-R625 IonicContact OE2-NE 2.69Å
606	I	90.9	Very high	80	Confident	20 Å²	20	57.1 Å²	57.1	10%	0.103	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	119.2	169.6	-59.8	170.3	0	0	0	105.3	R609 I620 Q621 M622 F686	I606-R609 HydrophobicContact CB-CB 4.26Å; I606-R609 HydrophobicContact CG2-CB 4.16Å; I606-I620 HydrophobicContact CD1-CD1 3.78Å; I606-I620 HydrophobicContact CG1-CD1 4.17Å; I606-I620 HydrophobicContact CG2-CB 4.27Å; I606-I620 HydrophobicContact CG2-CD1 4.43Å; I606-Q621 CarbonylContact C-O 3.6Å; I606-Q621 WeakPolarHBondContact CA-O 3.3Å; I606-M622 HydrophobicContact CG1-CE 4.14Å; I606-M622 HydrophobicContact CG1-CG 4.38Å; I606-F686 HydrophobicContact CD1-CB 3.84Å; I606-F686 HydrophobicContact CD1-CD2 3.71Å; I606-F686 HydrophobicContact CD1-CG 4.04Å
607	K	87.6	Confident	80.9	Confident	81 Å²	81	59.1 Å²	59.1	35%	0.352	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-47.9	-170	-85.5	-162.7	175.3	-178.6	0	112.4	Q621 Q623 Q644 T1134	K607-Q621 PolarHBondContact N-O 3.47Å; K607-Q623 VanDerWaalsContact CE-CD 3.42Å; K607-Q623 HydrophobicContact CG-CB 4.33Å; K607-Q644 VanDerWaalsContact CE-OE1 3.24Å; K607-T1134 PolarHBondContact NZ-OG1 3.08Å
608	N	89.2	Confident	82.2	Confident	79 Å²	79	57.3 Å²	57.3	42%	0.422	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	28.4	-171.7	-60.6	-10.8	0	0	0	112.1	D610 A611 D612	N608-D610 VanDerWaalsContact C-N 3.26Å; N608-D610 PolarHBondContact O-N 3.01Å; N608-A611 PolarHBondContact O-N 3.27Å; N608-D612 WeakPolarHBondContact CB-OD2 3.43Å; N608-D612 PolarHBondContact O-N 3.4Å
609	R	87.3	Confident	83.9	Confident	65 Å²	65	55.7 Å²	55.7	25%	0.245	29%	0.288	C	S	.	.	H	α-helix	trans	-42.3	-49.4	-167.3	-174.8	-177	-178.3	86.8	-3	113.4	I606 L613 A685 F686 D689	I606-R609 HydrophobicContact CB-CB 4.26Å; I606-R609 HydrophobicContact CG2-CB 4.16Å; R609-L613 WeakPolarHBondContact O-CB 3.47Å; R609-L613 PolarHBondContact O-N 3.21Å; R609-A685 PolarHBondContact NH2-O 3.13Å; R609-F686 HydrophobicContact CG-CD2 4.12Å; R609-F686 HydrophobicContact CG-CE2 4.08Å; R609-D689 IonicContact CZ-OD2 3.57Å; R609-D689 IonicContact NE-OD2 2.75Å; R609-D689 VanDerWaalsContact NH2-CG 3.34Å; R609-D689 IonicContact NH2-OD2 2.64Å; R609-D689 PolarHBondContact NH2-OD2 3.06Å
610	D	84.9	Confident	85.6	Confident	119 Å²	119	49.4 Å²	49.4	64%	0.636	26%	0.255	S	S	*	.	H	α-helix	trans	-74.9	-26.7	-173.3	-55.3	-32.9	0	0	0	113.1	N608 N614	N608-D610 VanDerWaalsContact C-N 3.26Å; N608-D610 PolarHBondContact O-N 3.01Å; D610-N614 PolarHBondContact O-N 3.35Å; D610-N614 PolarHBondContact O-ND2 3.4Å
611	A	86.9	Confident	87	Confident	51 Å²	51	52.2 Å²	52.2	42%	0.421	27%	0.267	S	S	.	.	H	α-helix	trans	-75.9	-51.8	171.3	0	0	0	0	0	110	N608 L613 N614 D615	N608-A611 PolarHBondContact O-N 3.27Å; A611-L613 PolarHBondContact O-N 2.87Å; A611-L613 VanDerWaalsContact O-N 3.13Å; A611-N614 PolarHBondContact O-N 2.75Å; A611-D615 PolarHBondContact O-N 2.82Å
612	D	88.8	Confident	88.1	Confident	8 Å²	8	52.1 Å²	52.1	4%	0.043	27%	0.267	C	S	.	.	H	α-helix	trans	-54.9	-36	179.2	-66	-31.3	0	0	0	112.4	N608 L616 N617 I620 F686	N608-D612 WeakPolarHBondContact CB-OD2 3.43Å; N608-D612 PolarHBondContact O-N 3.4Å; D612-L616 WeakPolarHBondContact O-CA 3.39Å; D612-L616 PolarHBondContact O-N 3.47Å; D612-L616 VanDerWaalsContact O-N 3.13Å; D612-N617 HydrophobicContact CB-CB 4.2Å; D612-N617 PolarHBondContact O-N 2.69Å; D612-N617 PolarHBondContact OD1-ND2 2.92Å; D612-I620 HydrophobicContact CB-CG2 3.86Å; D612-F686 HydrophobicContact CB-CE2 4.07Å; D612-F686 HydrophobicContact CB-CZ 3.71Å
613	L	86.9	Confident	88.7	Confident	27 Å²	27	52.2 Å²	52.2	14%	0.141	27%	0.267	C	S	.	.	H	α-helix	trans	-77.3	-28	178.9	-158.3	80.7	0	0	0	113.7	R609 A611 F686 D689 R690	R609-L613 WeakPolarHBondContact O-CB 3.47Å; R609-L613 PolarHBondContact O-N 3.21Å; A611-L613 PolarHBondContact O-N 2.87Å; A611-L613 VanDerWaalsContact O-N 3.13Å; L613-F686 HydrophobicContact CB-CE2 4.1Å; L613-F686 HydrophobicContact CB-CZ 4.15Å; L613-F686 HydrophobicContact CD1-CD1 4.49Å; L613-F686 HydrophobicContact CD1-CD2 4.06Å; L613-F686 HydrophobicContact CD1-CE1 4.14Å; L613-F686 HydrophobicContact CD1-CE2 3.68Å; L613-F686 HydrophobicContact CD1-CG 4.46Å; L613-F686 HydrophobicContact CD1-CZ 3.72Å; L613-D689 HydrophobicContact CD1-CB 3.71Å; L613-D689 HydrophobicContact CD2-CB 4.01Å; L613-D689 HydrophobicContact CG-CB 4.49Å; L613-R690 HydrophobicContact CD1-CB 4.18Å
614	N	86.1	Confident	89.1	Confident	82 Å²	82	49.8 Å²	49.8	44%	0.439	26%	0.258	S	S	.	.	H	α-helix	trans	-81.9	-41.2	177.2	-85.1	-60.4	0	0	0	111.9	D610 A611 L616 R693	D610-N614 PolarHBondContact O-N 3.35Å; D610-N614 PolarHBondContact O-ND2 3.4Å; A611-N614 PolarHBondContact O-N 2.75Å; N614-L616 PolarHBondContact O-N 3.25Å; N614-R693 PolarHBondContact OD1-NE 2.99Å; N614-R693 PolarHBondContact OD1-NH2 2.89Å
615	D	88.6	Confident	88.9	Confident	117 Å²	117	53.7 Å²	53.7	63%	0.626	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-6.9	177.3	-61.9	-28.7	0	0	0	112.4	A611 N617	A611-D615 PolarHBondContact O-N 2.82Å; D615-N617 VanDerWaalsContact C-N 3.28Å; D615-N617 PolarHBondContact O-N 2.88Å
616	L	87.6	Confident	88.7	Confident	50 Å²	50	52 Å²	52	26%	0.262	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.7	33.2	-179.2	-58.6	166.3	0	0	0	113.2	D612 N614 R690 R693 L694 I697	D612-L616 WeakPolarHBondContact O-CA 3.39Å; D612-L616 PolarHBondContact O-N 3.47Å; D612-L616 VanDerWaalsContact O-N 3.13Å; N614-L616 PolarHBondContact O-N 3.25Å; L616-R690 HydrophobicContact CD2-CG 3.78Å; L616-R693 HydrophobicContact CD2-CG 4.41Å; L616-L694 HydrophobicContact CD1-CD2 3.68Å; L616-L694 HydrophobicContact CD1-CG 4.41Å; L616-L694 HydrophobicContact CD2-CD2 4.17Å; L616-L694 HydrophobicContact CD2-CG 3.98Å; L616-I697 HydrophobicContact CD1-CD1 4.16Å
617	N	87.6	Confident	87.9	Confident	59 Å²	59	56.5 Å²	56.5	32%	0.316	28%	0.282	S	S	.	.			trans	-55.1	136.5	-176.8	-72.3	-19.5	0	0	0	112	D612 D615	D612-N617 HydrophobicContact CB-CB 4.2Å; D612-N617 PolarHBondContact O-N 2.69Å; D612-N617 PolarHBondContact OD1-ND2 2.92Å; D615-N617 VanDerWaalsContact C-N 3.28Å; D615-N617 PolarHBondContact O-N 2.88Å
618	V	90.5	Very high	87.1	Confident	49 Å²	49	55.2 Å²	55.2	30%	0.297	28%	0.279	S	S	.	.	S	Bend	trans	-85.6	-37.9	174.5	-178	0	0	0	0	110.9	D648 I649 E650	V618-D648 WeakPolarHBondContact CG1-OD1 3.26Å; V618-I649 WeakPolarHBondContact O-CB 3.38Å; V618-I649 WeakPolarHBondContact O-CD1 3.4Å; V618-I649 WeakPolarHBondContact O-CG1 3.25Å; V618-I649 PolarHBondContact O-N 2.89Å; V618-E650 HydrophobicContact CG1-CB 3.99Å; V618-E650 HydrophobicContact CG1-CG 3.99Å
619	E	93.2	Very high	86.2	Confident	104 Å²	104	58 Å²	58	49%	0.486	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	123.4	169.2	-179.3	168.7	-132.9	0	0	110.4	A646 F647 R1130	E619-A646 HydrophobicContact CG-CB 3.83Å; E619-A646 WeakPolarHBondContact OE1-CB 3.27Å; E619-F647 WeakPolarHBondContact CA-O 3.35Å; E619-R1130 IonicContact OE1-CZ 3.34Å; E619-R1130 VanDerWaalsContact OE1-CZ 3.25Å; E619-R1130 IonicContact OE1-NE 3.5Å; E619-R1130 PolarHBondContact OE1-NE 3.04Å; E619-R1130 IonicContact OE1-NH2 3.44Å; E619-R1130 PolarHBondContact OE1-NH2 3.06Å
620	I	92.9	Very high	85.5	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	147.3	177.7	54.6	167	0	0	0	111.7	I606 D612 M622 A646 F647 I649 F686	I606-I620 HydrophobicContact CD1-CD1 3.78Å; I606-I620 HydrophobicContact CG1-CD1 4.17Å; I606-I620 HydrophobicContact CG2-CB 4.27Å; I606-I620 HydrophobicContact CG2-CD1 4.43Å; D612-I620 HydrophobicContact CB-CG2 3.86Å; I620-M622 HydrophobicContact CD1-CG 4.18Å; I620-M622 HydrophobicContact CD1-SD 4.35Å; I620-M622 HydrophobicContact CG1-CG 4.3Å; I620-A646 CarbonylContact O-C 3.4Å; I620-A646 VanDerWaalsContact O-CA 3.3Å; I620-A646 WeakPolarHBondContact O-CA 3.4Å; I620-F647 HydrophobicContact CG1-CB 4.25Å; I620-F647 WeakPolarHBondContact CG1-O 3.45Å; I620-F647 PolarHBondContact N-O 3.22Å; I620-F647 PolarHBondContact O-N 3.4Å; I620-I649 HydrophobicContact CB-CD1 4.47Å; I620-I649 HydrophobicContact CD1-CD1 4.12Å; I620-I649 HydrophobicContact CD1-CG1 4.05Å; I620-I649 HydrophobicContact CG1-CD1 4.1Å; I620-I649 HydrophobicContact CG1-CG1 4.05Å; I620-I649 HydrophobicContact CG2-CD1 3.59Å; I620-I649 HydrophobicContact CG2-CG1 4.45Å; I620-F686 HydrophobicContact CD1-CG 4.44Å; I620-F686 HydrophobicContact CG2-CD1 4.37Å; I620-F686 HydrophobicContact CG2-CE1 3.83Å; I620-F686 HydrophobicContact CG2-CE2 4.33Å; I620-F686 HydrophobicContact CG2-CZ 3.81Å
621	Q	93.6	Very high	84.8	Confident	80 Å²	80	59.8 Å²	59.8	37%	0.374	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	112.6	176.5	-66.9	-168.5	-6.6	0	0	111.4	I606 K607	I606-Q621 CarbonylContact C-O 3.6Å; I606-Q621 WeakPolarHBondContact CA-O 3.3Å; K607-Q621 PolarHBondContact N-O 3.47Å
622	M	92.8	Very high	84	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	154.7	179	-55	-169	86.7	0	0	111.4	V604 E605 I606 I620 Q644 F645 F647 I679 K682 V683	V604-M622 HydrophobicContact CG1-CE 3.7Å; E605-M622 CarbonylContact O-C 3.5Å; E605-M622 VanDerWaalsContact O-CA 3.28Å; E605-M622 WeakPolarHBondContact O-CA 3.13Å; I606-M622 HydrophobicContact CG1-CE 4.14Å; I606-M622 HydrophobicContact CG1-CG 4.38Å; I620-M622 HydrophobicContact CD1-CG 4.18Å; I620-M622 HydrophobicContact CD1-SD 4.35Å; I620-M622 HydrophobicContact CG1-CG 4.3Å; M622-Q644 WeakPolarHBondContact O-CA 3.23Å; M622-Q644 WeakPolarHBondContact O-CG 3.19Å; M622-F645 WeakPolarHBondContact CA-O 3.23Å; M622-F645 HydrophobicContact CB-CD1 4.27Å; M622-F645 HydrophobicContact CB-CD2 4.11Å; M622-F645 HydrophobicContact CB-CE1 3.76Å; M622-F645 HydrophobicContact CB-CE2 3.59Å; M622-F645 HydrophobicContact CB-CG 4.42Å; M622-F645 HydrophobicContact CB-CZ 3.38Å; M622-F645 HydrophobicContact CG-CE2 4.07Å; M622-F645 HydrophobicContact CG-CZ 4.22Å; M622-F645 PolarHBondContact N-O 3.05Å; M622-F645 PolarHBondContact O-N 2.88Å; M622-F645 HydrophobicContact SD-CE2 3.7Å; M622-F645 HydrophobicContact SD-CZ 3.96Å; M622-F647 HydrophobicContact CG-CB 4.02Å; M622-F647 HydrophobicContact SD-CB 3.57Å; M622-F647 VanDerWaalsContact SD-CB 3.57Å; M622-F647 HydrophobicContact SD-CD2 4.22Å; M622-F647 HydrophobicContact SD-CG 3.9Å; M622-I679 HydrophobicContact CE-CG2 4.28Å; M622-I679 HydrophobicContact SD-CG2 4.1Å; M622-K682 HydrophobicContact CE-CB 3.66Å; M622-V683 HydrophobicContact CE-CG2 4.06Å; M622-V683 HydrophobicContact SD-CG2 4.12Å
623	Q	91	Very high	83.1	Confident	3 Å²	3	68.3 Å²	68.3	1%	0.014	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	127.4	173.7	-166.4	178.8	35.8	0	0	111.8	V604 E605 K607 R625 G642 L643 Q644 T1134	V604-Q623 WeakPolarHBondContact CA-O 3.47Å; E605-Q623 PolarHBondContact N-O 3.31Å; E605-Q623 PolarHBondContact O-N 2.96Å; K607-Q623 VanDerWaalsContact CE-CD 3.42Å; K607-Q623 HydrophobicContact CG-CB 4.33Å; Q623-R625 HydrophobicContact CG-CG 4.3Å; Q623-R625 VanDerWaalsContact OE1-CZ 3.32Å; Q623-G642 PolarHBondContact NE2-O 3.13Å; Q623-L643 WeakPolarHBondContact CA-O 3.46Å; Q623-Q644 HydrophobicContact CG-CB 4.42Å; Q623-T1134 PolarHBondContact NE2-OG1 3.04Å
624	L	89.7	Confident	82.5	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	130.3	171.8	-179.6	72.3	0	0	0	109.6	I602 V604 G642 L643 F645 M661 I667 I675	I602-L624 HydrophobicContact CG2-CD1 3.39Å; I602-L624 HydrophobicContact CG2-CG 4.33Å; V604-L624 HydrophobicContact CG2-CD1 3.62Å; L624-G642 CarbonylContact O-C 3.54Å; L624-G642 WeakPolarHBondContact O-CA 3.4Å; L624-L643 HydrophobicContact CB-CB 4.3Å; L624-L643 HydrophobicContact CD2-CD2 4.12Å; L624-L643 PolarHBondContact N-O 2.79Å; L624-L643 PolarHBondContact O-N 3.19Å; L624-F645 HydrophobicContact CB-CE1 4.22Å; L624-M661 HydrophobicContact CD2-SD 4.3Å; L624-I667 HydrophobicContact CD2-CG2 3.68Å; L624-I675 HydrophobicContact CD1-CG1 4.33Å; L624-I675 HydrophobicContact CD1-CG2 4.11Å; L624-I675 HydrophobicContact CD2-CD1 4.25Å; L624-I675 HydrophobicContact CD2-CG2 4.27Å
625	R	84.8	Confident	82.1	Confident	82 Å²	82	68 Å²	68	31%	0.309	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139.8	178.2	-64.4	-177.6	-176.7	-165.1	3.9	111.1	I602 R603 E605 Q623 Y627	I602-R625 CarbonylContact C-O 3.52Å; I602-R625 WeakPolarHBondContact CA-O 3.12Å; R603-R625 PolarHBondContact N-O 2.78Å; R603-R625 PolarHBondContact O-N 2.72Å; E605-R625 IonicContact OE2-CZ 2.66Å; E605-R625 IonicContact OE2-NE 2.69Å; Q623-R625 HydrophobicContact CG-CG 4.3Å; Q623-R625 VanDerWaalsContact OE1-CZ 3.32Å; R625-Y627 HydrophobicContact CB-CD2 4.3Å; R625-Y627 HydrophobicContact CB-CE2 3.69Å
626	V	82.3	Confident	81.3	Confident	15 Å²	15	71.2 Å²	71.2	9%	0.091	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	109.9	178.3	177.4	0	0	0	0	110.5	G601 I602 K631 R632 Y635 F637	G601-V626 CarbonylContact O-C 3.48Å; G601-V626 WeakPolarHBondContact O-CA 3.24Å; I602-V626 HydrophobicContact CG1-CG2 4.37Å; I602-V626 HydrophobicContact CG2-CG2 4.48Å; V626-K631 HydrophobicContact CG1-CB 4.2Å; V626-R632 HydrophobicContact CG1-CB 4.42Å; V626-R632 PolarHBondContact O-NH2 2.89Å; V626-Y635 HydrophobicContact CG1-CD2 4.2Å; V626-Y635 HydrophobicContact CG1-CE2 4.28Å; V626-Y635 HydrophobicContact CG2-CD1 3.84Å; V626-Y635 HydrophobicContact CG2-CD2 3.88Å; V626-Y635 HydrophobicContact CG2-CE1 3.78Å; V626-Y635 HydrophobicContact CG2-CE2 3.87Å; V626-Y635 HydrophobicContact CG2-CG 3.89Å; V626-F637 HydrophobicContact CB-CE2 4.21Å; V626-F637 HydrophobicContact CB-CZ 4.49Å; V626-F637 HydrophobicContact CG2-CE2 3.92Å; V626-F637 HydrophobicContact CG2-CZ 3.7Å
627	Y	73.8	Confident	80.6	Confident	115 Å²	115	69.5 Å²	69.5	45%	0.451	31%	0.308	S	S	.	.			trans	-89.6	-32.3	-178.2	-71.7	-91.5	0	0	0	112.5	G601 R603 R625 E629 R632	G601-Y627 PolarHBondContact O-N 3.48Å; R603-Y627 HydrophobicContact CB-CD2 4.07Å; R603-Y627 HydrophobicContact CB-CE2 3.73Å; R625-Y627 HydrophobicContact CB-CD2 4.3Å; R625-Y627 HydrophobicContact CB-CE2 3.69Å; Y627-E629 PolarHBondContact O-N 2.81Å; Y627-R632 PolarHBondContact O-NH2 3.35Å
628	D	71.7	Confident	79.3	Confident	54 Å²	54	74.1 Å²	74.1	29%	0.289	33%	0.325	S	S	.	.			trans	-71.7	114.1	176.6	179.2	11.1	0	0	0	111.3	G601 K630 K631 R632	G601-D628 PolarHBondContact O-N 3.31Å; D628-K630 PolarHBondContact O-N 3.44Å; D628-K630 WeakPolarHBondContact OD1-CB 3.3Å; D628-K630 PolarHBondContact OD1-N 3.33Å; D628-K631 HydrophobicContact CB-CB 4.2Å; D628-K631 HydrophobicContact CB-CG 4.48Å; D628-K631 PolarHBondContact O-N 2.94Å; D628-R632 WeakPolarHBondContact O-CB 2.93Å; D628-R632 PolarHBondContact O-N 3.09Å
629	E	70.6	Confident	77.5	Confident	139 Å²	139	77.1 Å²	77.1	65%	0.65	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.7	177.9	-172.2	178.9	-158.8	0	0	113.3	Y627	Y627-E629 PolarHBondContact O-N 2.81Å
630	K	71.3	Confident	75.7	Confident	175 Å²	175	78 Å²	78	76%	0.761	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-50.9	176.1	-63.2	177.1	-178.4	175.6	0	110.7	D628 R632	D628-K630 PolarHBondContact O-N 3.44Å; D628-K630 WeakPolarHBondContact OD1-CB 3.3Å; D628-K630 PolarHBondContact OD1-N 3.33Å; K630-R632 VanDerWaalsContact C-N 3.32Å; K630-R632 PolarHBondContact O-N 3.4Å
631	K	71.4	Confident	74.6	Confident	46 Å²	46	79.6 Å²	79.6	20%	0.2	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-64.1	-32.9	175.3	-77.4	-172.7	169.3	-160.2	0	113.2	I602 V626 D628 K633 Q634 Y635 D671	I602-K631 HydrophobicContact CD1-CD 4.47Å; V626-K631 HydrophobicContact CG1-CB 4.2Å; D628-K631 HydrophobicContact CB-CB 4.2Å; D628-K631 HydrophobicContact CB-CG 4.48Å; D628-K631 PolarHBondContact O-N 2.94Å; K631-K633 PolarHBondContact O-N 2.88Å; K631-Q634 WeakPolarHBondContact O-CB 3.27Å; K631-Q634 PolarHBondContact O-N 2.85Å; K631-Y635 HydrophobicContact CB-CE2 4.25Å; K631-Y635 WeakPolarHBondContact O-CD2 3.33Å; K631-D671 WeakPolarHBondContact CE-OD2 3.34Å; K631-D671 IonicContact NZ-OD1 2.75Å; K631-D671 PolarHBondContact NZ-OD1 2.9Å; K631-D671 IonicContact NZ-OD2 3.53Å; K631-D671 PolarHBondContact NZ-OD2 3.47Å
632	R	68.3	Low	74	Confident	50 Å²	50	75.8 Å²	75.8	19%	0.189	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-47.7	-29.4	-178.1	-174.5	171.3	-67.6	135.7	14.4	114.3	V626 Y627 D628 K630 E639	V626-R632 HydrophobicContact CG1-CB 4.42Å; V626-R632 PolarHBondContact O-NH2 2.89Å; Y627-R632 PolarHBondContact O-NH2 3.35Å; D628-R632 WeakPolarHBondContact O-CB 2.93Å; D628-R632 PolarHBondContact O-N 3.09Å; K630-R632 VanDerWaalsContact C-N 3.32Å; K630-R632 PolarHBondContact O-N 3.4Å; R632-E639 WeakPolarHBondContact CD-OE1 3.4Å; R632-E639 IonicContact CZ-OE1 3.2Å; R632-E639 IonicContact NE-OE1 2.72Å; R632-E639 IonicContact NH1-OE1 3.87Å; R632-E639 PolarHBondContact NH1-OE1 2.93Å
633	K	70.8	Confident	73.7	Confident	188 Å²	188	75.8 Å²	75.8	82%	0.817	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-74.5	-17.6	178.2	-62.8	-177.8	-177.9	178.4	0	115	K631	K631-K633 PolarHBondContact O-N 2.88Å
634	Q	73.8	Confident	73.7	Confident	90 Å²	90	76.6 Å²	76.6	42%	0.421	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-19.5	178.5	-62.6	170.1	-79.6	0	0	112.5	K631 P668 E670	K631-Q634 WeakPolarHBondContact O-CB 3.27Å; K631-Q634 PolarHBondContact O-N 2.85Å; Q634-P668 HydrophobicContact CB-CB 4.43Å; Q634-P668 HydrophobicContact CB-CG 3.7Å; Q634-E670 PolarHBondContact NE2-OE2 2.84Å
635	Y	78.1	Confident	73.9	Confident	12 Å²	12	76.6 Å²	76.6	5%	0.047	34%	0.338	C	S	.	.	S	Bend	trans	-89.2	151	178.2	-68.4	-101.4	0	0	0	111.1	I602 V626 K631 F637 I667 P668 D671 I675	I602-Y635 VanDerWaalsContact CD1-OH 3.26Å; I602-Y635 WeakPolarHBondContact CD1-OH 3.27Å; V626-Y635 HydrophobicContact CG1-CD2 4.2Å; V626-Y635 HydrophobicContact CG1-CE2 4.28Å; V626-Y635 HydrophobicContact CG2-CD1 3.84Å; V626-Y635 HydrophobicContact CG2-CD2 3.88Å; V626-Y635 HydrophobicContact CG2-CE1 3.78Å; V626-Y635 HydrophobicContact CG2-CE2 3.87Å; V626-Y635 HydrophobicContact CG2-CG 3.89Å; K631-Y635 HydrophobicContact CB-CE2 4.25Å; K631-Y635 WeakPolarHBondContact O-CD2 3.33Å; Y635-F637 AromaticContact CD1-CE1 3.64Å; Y635-F637 HydrophobicContact CD1-CE1 3.64Å; Y635-F637 HydrophobicContact CD1-CE2 4.5Å; Y635-F637 AromaticContact CD1-CZ 3.52Å; Y635-F637 HydrophobicContact CD1-CZ 3.52Å; Y635-F637 HydrophobicContact CE1-CZ 4.33Å; Y635-F637 HydrophobicContact CG-CE1 4.26Å; Y635-F637 AromaticContact CG-CZ 3.98Å; Y635-F637 HydrophobicContact CG-CZ 3.98Å; Y635-I667 HydrophobicContact CD1-CB 4.3Å; Y635-I667 HydrophobicContact CD1-CG2 4.04Å; Y635-I667 HydrophobicContact CE1-CB 3.97Å; Y635-I667 HydrophobicContact CE1-CG2 3.84Å; Y635-P668 HydrophobicContact CD2-CG 4.16Å; Y635-P668 VanDerWaalsContact CE1-CD 3.46Å; Y635-P668 HydrophobicContact CE1-CG 4.42Å; Y635-P668 HydrophobicContact CE2-CG 3.89Å; Y635-P668 VanDerWaalsContact CZ-CD 3.43Å; Y635-D671 VanDerWaalsContact OH-CB 3.32Å; Y635-D671 WeakPolarHBondContact OH-CB 3.35Å; Y635-D671 PolarHBondContact OH-OD2 2.94Å; Y635-I675 HydrophobicContact CE1-CD1 4.06Å
636	R	71.6	Confident	74.3	Confident	184 Å²	184	73.3 Å²	73.3	69%	0.694	33%	0.328	S	S	*	.	S	Bend	trans	-91.5	-12.1	-175.8	-66	-63.2	-158.7	-179.6	6	115.5	Q665	R636-Q665 WeakPolarHBondContact CB-O 3.41Å; R636-Q665 HydrophobicContact CG-CB 4.48Å; R636-Q665 WeakPolarHBondContact CG-O 3.43Å; R636-Q665 VanDerWaalsContact NH2-OE1 3.15Å
637	F	72.8	Confident	74.9	Confident	15 Å²	15	72.6 Å²	72.6	7%	0.066	32%	0.324	C	S	.	.	S	Bend	trans	-85.8	152.5	173.2	48.7	-98.5	0	0	0	111.3	V626 Y635 E641 L643 H666 V1133	V626-F637 HydrophobicContact CB-CE2 4.21Å; V626-F637 HydrophobicContact CB-CZ 4.49Å; V626-F637 HydrophobicContact CG2-CE2 3.92Å; V626-F637 HydrophobicContact CG2-CZ 3.7Å; Y635-F637 AromaticContact CD1-CE1 3.64Å; Y635-F637 HydrophobicContact CD1-CE1 3.64Å; Y635-F637 HydrophobicContact CD1-CE2 4.5Å; Y635-F637 AromaticContact CD1-CZ 3.52Å; Y635-F637 HydrophobicContact CD1-CZ 3.52Å; Y635-F637 HydrophobicContact CE1-CZ 4.33Å; Y635-F637 HydrophobicContact CG-CE1 4.26Å; Y635-F637 AromaticContact CG-CZ 3.98Å; Y635-F637 HydrophobicContact CG-CZ 3.98Å; F637-E641 WeakPolarHBondContact CD2-O 3.48Å; F637-L643 HydrophobicContact CD1-CB 3.9Å; F637-L643 HydrophobicContact CE1-CB 3.88Å; F637-H666 WeakPolarHBondContact CE1-O 3.41Å; F637-V1133 HydrophobicContact CB-CG1 3.88Å; F637-V1133 HydrophobicContact CB-CG2 4.23Å
638	K	60.5	Low	75.9	Confident	155 Å²	155	68.6 Å²	68.6	67%	0.674	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-79.7	167.6	-173.5	-61.5	-174.2	173.2	-174.3	0	113	N640 E641	K638-N640 PolarHBondContact O-N 3.44Å; K638-E641 HydrophobicContact CB-CG 4.17Å; K638-E641 VanDerWaalsContact CB-OE2 3.29Å; K638-E641 WeakPolarHBondContact CB-OE2 3.41Å; K638-E641 PolarHBondContact N-OE2 2.77Å; K638-E641 WeakPolarHBondContact O-CB 3.41Å; K638-E641 PolarHBondContact O-N 3.02Å
639	E	51.8	Low	76.9	Confident	112 Å²	112	66 Å²	66	52%	0.523	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.9	127.6	173.4	-169.6	151.3	-106	0	0	112.2	R632 E641	R632-E639 WeakPolarHBondContact CD-OE1 3.4Å; R632-E639 IonicContact CZ-OE1 3.2Å; R632-E639 IonicContact NE-OE1 2.72Å; R632-E639 IonicContact NH1-OE1 3.87Å; R632-E639 PolarHBondContact NH1-OE1 2.93Å; E639-E641 PolarHBondContact O-N 3.33Å; E639-E641 VanDerWaalsContact O-N 3.15Å
640	N	56	Low	77.9	Confident	124 Å²	124	64.8 Å²	64.8	66%	0.663	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	1.3	-174.1	-50.1	-50	0	0	0	116.6	K638 S1136	K638-N640 PolarHBondContact O-N 3.44Å; N640-S1136 PolarHBondContact O-OG 3.42Å; N640-S1136 VanDerWaalsContact O-OG 3.1Å
641	E	69.8	Low	78.9	Confident	32 Å²	32	62.4 Å²	62.4	15%	0.15	29%	0.287	C	S	.	.			trans	-84.6	120.2	164.9	-60.5	-178.7	155.2	0	0	108.6	F637 K638 E639 V1133 T1134 K1135	F637-E641 WeakPolarHBondContact CD2-O 3.48Å; K638-E641 HydrophobicContact CB-CG 4.17Å; K638-E641 VanDerWaalsContact CB-OE2 3.29Å; K638-E641 WeakPolarHBondContact CB-OE2 3.41Å; K638-E641 PolarHBondContact N-OE2 2.77Å; K638-E641 WeakPolarHBondContact O-CB 3.41Å; K638-E641 PolarHBondContact O-N 3.02Å; E639-E641 PolarHBondContact O-N 3.33Å; E639-E641 VanDerWaalsContact O-N 3.15Å; E641-V1133 HydrophobicContact CB-CG1 3.64Å; E641-V1133 HydrophobicContact CG-CG1 4.24Å; E641-V1133 VanDerWaalsContact OE2-CG1 3.29Å; E641-V1133 WeakPolarHBondContact OE2-CG1 3.47Å; E641-T1134 WeakPolarHBondContact CA-O 3.35Å; E641-K1135 HydrophobicContact CG-CG 4.16Å; E641-K1135 WeakPolarHBondContact OE1-CE 3.43Å; E641-K1135 WeakPolarHBondContact OE1-CG 3.32Å
642	G	80.3	Confident	80	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.01	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	130.7	173.3	0	0	0	0	0	110.7	Q623 L624 Q644 T1134	Q623-G642 PolarHBondContact NE2-O 3.13Å; L624-G642 CarbonylContact O-C 3.54Å; L624-G642 WeakPolarHBondContact O-CA 3.4Å; G642-Q644 PolarHBondContact O-N 3.28Å; G642-Q644 VanDerWaalsContact O-N 3.08Å; G642-T1134 PolarHBondContact O-N 3.04Å
643	L	88.2	Confident	81.2	Confident	0 Å²	0	61 Å²	61	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	107.2	172.6	179.2	74.7	0	0	0	109.1	Q623 L624 F637 M661 H666 F1131 V1133	Q623-L643 WeakPolarHBondContact CA-O 3.46Å; L624-L643 HydrophobicContact CB-CB 4.3Å; L624-L643 HydrophobicContact CD2-CD2 4.12Å; L624-L643 PolarHBondContact N-O 2.79Å; L624-L643 PolarHBondContact O-N 3.19Å; F637-L643 HydrophobicContact CD1-CB 3.9Å; F637-L643 HydrophobicContact CE1-CB 3.88Å; L643-M661 HydrophobicContact CD2-CE 4.23Å; L643-M661 HydrophobicContact CD2-CG 4.12Å; L643-M661 HydrophobicContact CD2-SD 3.95Å; L643-H666 HydrophobicContact CD1-CB 4.21Å; L643-H666 HydrophobicContact CD2-CB 3.79Å; L643-F1131 HydrophobicContact CD1-CB 4.23Å; L643-F1131 HydrophobicContact CD1-CD1 4.48Å; L643-F1131 HydrophobicContact CD2-CD1 4.41Å; L643-V1133 HydrophobicContact CD1-CG2 4.16Å
644	Q	90.3	Very high	82.3	Confident	19 Å²	19	52.9 Å²	52.9	9%	0.089	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	141.9	172.6	177.8	170.9	-19.3	0	0	109.7	K607 M622 Q623 G642 F1131 Q1132 T1134	K607-Q644 VanDerWaalsContact CE-OE1 3.24Å; M622-Q644 WeakPolarHBondContact O-CA 3.23Å; M622-Q644 WeakPolarHBondContact O-CG 3.19Å; Q623-Q644 HydrophobicContact CG-CB 4.42Å; G642-Q644 PolarHBondContact O-N 3.28Å; G642-Q644 VanDerWaalsContact O-N 3.08Å; Q644-F1131 WeakPolarHBondContact O-CA 3.49Å; Q644-Q1132 WeakPolarHBondContact CA-O 3.22Å; Q644-Q1132 WeakPolarHBondContact CB-O 3.37Å; Q644-Q1132 PolarHBondContact N-O 3.38Å; Q644-Q1132 PolarHBondContact O-N 3.19Å; Q644-T1134 HydrophobicContact CB-CG2 3.99Å; Q644-T1134 VanDerWaalsContact OE1-CG2 3.3Å
645	F	93.6	Very high	83.2	Confident	1 Å²	1	53.4 Å²	53.4	0%	0.004	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	147.4	175.8	59.2	-76.6	0	0	0	108.2	M622 L624 V657 M661 I679 R1130 F1131	M622-F645 WeakPolarHBondContact CA-O 3.23Å; M622-F645 HydrophobicContact CB-CD1 4.27Å; M622-F645 HydrophobicContact CB-CD2 4.11Å; M622-F645 HydrophobicContact CB-CE1 3.76Å; M622-F645 HydrophobicContact CB-CE2 3.59Å; M622-F645 HydrophobicContact CB-CG 4.42Å; M622-F645 HydrophobicContact CB-CZ 3.38Å; M622-F645 HydrophobicContact CG-CE2 4.07Å; M622-F645 HydrophobicContact CG-CZ 4.22Å; M622-F645 PolarHBondContact N-O 3.05Å; M622-F645 PolarHBondContact O-N 2.88Å; M622-F645 HydrophobicContact SD-CE2 3.7Å; M622-F645 HydrophobicContact SD-CZ 3.96Å; L624-F645 HydrophobicContact CB-CE1 4.22Å; F645-V657 HydrophobicContact CD2-CG1 3.82Å; F645-V657 HydrophobicContact CE2-CG1 3.99Å; F645-M661 HydrophobicContact CB-CE 4.49Å; F645-M661 HydrophobicContact CD1-CE 3.41Å; F645-M661 VanDerWaalsContact CD1-CE 3.41Å; F645-M661 HydrophobicContact CD2-CE 3.79Å; F645-M661 HydrophobicContact CE1-CE 3.41Å; F645-M661 VanDerWaalsContact CE1-CE 3.41Å; F645-M661 HydrophobicContact CE2-CE 3.76Å; F645-M661 HydrophobicContact CG-CE 3.63Å; F645-M661 HydrophobicContact CZ-CE 3.58Å; F645-I679 HydrophobicContact CE1-CD1 4.48Å; F645-I679 HydrophobicContact CE2-CD1 3.83Å; F645-I679 HydrophobicContact CE2-CG1 4.35Å; F645-I679 HydrophobicContact CZ-CD1 3.54Å; F645-I679 HydrophobicContact CZ-CG1 3.86Å; F645-R1130 WeakPolarHBondContact CA-O 3.26Å; F645-F1131 HydrophobicContact CB-CD1 3.58Å; F645-F1131 HydrophobicContact CB-CE1 3.68Å; F645-F1131 HydrophobicContact CB-CG 4.48Å; F645-F1131 HydrophobicContact CG-CD1 4.4Å; F645-F1131 HydrophobicContact CG-CE1 4.2Å
646	A	93.4	Very high	83.9	Confident	13 Å²	13	58.5 Å²	58.5	11%	0.107	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	153.1	168.6	0	0	0	0	0	110.4	E619 I620 R1130	E619-A646 HydrophobicContact CG-CB 3.83Å; E619-A646 WeakPolarHBondContact OE1-CB 3.27Å; I620-A646 CarbonylContact O-C 3.4Å; I620-A646 VanDerWaalsContact O-CA 3.3Å; I620-A646 WeakPolarHBondContact O-CA 3.4Å; A646-R1130 HydrophobicContact CB-CG 4Å; A646-R1130 VanDerWaalsContact O-CD 3.31Å; A646-R1130 WeakPolarHBondContact O-CD 3.43Å; A646-R1130 VanDerWaalsContact O-CZ 3.32Å; A646-R1130 PolarHBondContact O-NE 2.85Å
647	F	95.8	Very high	85	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	127.5	-179.1	-170.5	-78.5	0	0	0	108.9	E619 I620 M622 D652 P654 V657 I679 V683	E619-F647 WeakPolarHBondContact CA-O 3.35Å; I620-F647 HydrophobicContact CG1-CB 4.25Å; I620-F647 WeakPolarHBondContact CG1-O 3.45Å; I620-F647 PolarHBondContact N-O 3.22Å; I620-F647 PolarHBondContact O-N 3.4Å; M622-F647 HydrophobicContact CG-CB 4.02Å; M622-F647 HydrophobicContact SD-CB 3.57Å; M622-F647 VanDerWaalsContact SD-CB 3.57Å; M622-F647 HydrophobicContact SD-CD2 4.22Å; M622-F647 HydrophobicContact SD-CG 3.9Å; F647-D652 WeakPolarHBondContact CA-OD2 3.43Å; F647-D652 HydrophobicContact CD1-CB 4.35Å; F647-D652 HydrophobicContact CD2-CB 4.19Å; F647-D652 HydrophobicContact CE1-CB 3.94Å; F647-D652 HydrophobicContact CE2-CB 3.76Å; F647-D652 HydrophobicContact CG-CB 4.45Å; F647-D652 HydrophobicContact CZ-CB 3.62Å; F647-D652 WeakPolarHBondContact CZ-O 3.46Å; F647-P654 HydrophobicContact CE2-CG 4.36Å; F647-P654 HydrophobicContact CZ-CG 4.07Å; F647-V657 HydrophobicContact CD2-CB 4.29Å; F647-V657 HydrophobicContact CD2-CG1 4.26Å; F647-V657 HydrophobicContact CD2-CG2 3.86Å; F647-V657 HydrophobicContact CE2-CB 4.22Å; F647-V657 HydrophobicContact CE2-CG2 3.81Å; F647-I679 HydrophobicContact CD2-CG2 4.02Å; F647-I679 HydrophobicContact CE2-CG2 3.9Å; F647-V683 HydrophobicContact CD1-CG1 4.45Å; F647-V683 HydrophobicContact CD1-CG2 3.67Å; F647-V683 HydrophobicContact CE1-CB 4.36Å; F647-V683 HydrophobicContact CE1-CG1 3.86Å; F647-V683 HydrophobicContact CE1-CG2 3.58Å; F647-V683 HydrophobicContact CE2-CG2 4.44Å; F647-V683 HydrophobicContact CG-CG2 4.18Å; F647-V683 HydrophobicContact CZ-CG2 3.99Å
648	D	94.3	Very high	85.9	Confident	30 Å²	30	49.2 Å²	49.2	16%	0.16	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	115.4	174.4	-176.2	-44.4	0	0	0	109.2	V618 E650 N651 D652	V618-D648 WeakPolarHBondContact CG1-OD1 3.26Å; D648-E650 PolarHBondContact O-N 2.71Å; D648-E650 PolarHBondContact OD1-N 2.67Å; D648-N651 HydrophobicContact CB-CB 4.27Å; D648-N651 VanDerWaalsContact CG-ND2 3.28Å; D648-N651 PolarHBondContact OD1-N 2.89Å; D648-N651 PolarHBondContact OD1-ND2 3.08Å; D648-N651 VanDerWaalsContact OD1-ND2 3.15Å; D648-N651 PolarHBondContact OD2-ND2 3.18Å; D648-D652 HydrophobicContact CB-CB 4.49Å; D648-D652 WeakPolarHBondContact CB-OD2 3.43Å; D648-D652 PolarHBondContact N-OD2 3.45Å; D648-D652 WeakPolarHBondContact O-CB 3.43Å; D648-D652 PolarHBondContact O-N 3.35Å; D648-D652 VanDerWaalsContact O-N 3.07Å
649	I	92	Very high	87.4	Confident	1 Å²	1	47 Å²	47	1%	0.005	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-20.5	-173.4	-67.9	158.9	0	0	0	112.9	V618 I620 F686 R687	V618-I649 WeakPolarHBondContact O-CB 3.38Å; V618-I649 WeakPolarHBondContact O-CD1 3.4Å; V618-I649 WeakPolarHBondContact O-CG1 3.25Å; V618-I649 PolarHBondContact O-N 2.89Å; I620-I649 HydrophobicContact CB-CD1 4.47Å; I620-I649 HydrophobicContact CD1-CD1 4.12Å; I620-I649 HydrophobicContact CD1-CG1 4.05Å; I620-I649 HydrophobicContact CG1-CD1 4.1Å; I620-I649 HydrophobicContact CG1-CG1 4.05Å; I620-I649 HydrophobicContact CG2-CD1 3.59Å; I620-I649 HydrophobicContact CG2-CG1 4.45Å; I649-F686 HydrophobicContact CD1-CD1 3.37Å; I649-F686 HydrophobicContact CD1-CE1 3.4Å; I649-F686 HydrophobicContact CD1-CG 4.5Å; I649-F686 HydrophobicContact CG1-CD1 4.39Å; I649-R687 HydrophobicContact CG2-CG 3.5Å; I649-R687 PolarHBondContact O-NE 3.21Å; I649-R687 PolarHBondContact O-NH2 3.3Å
650	E	91.1	Very high	89.3	Confident	112 Å²	112	45.1 Å²	45.1	52%	0.523	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111	-31.4	-173.5	-68.4	176.1	-168.4	0	0	112.4	V618 D648 R690	V618-E650 HydrophobicContact CG1-CB 3.99Å; V618-E650 HydrophobicContact CG1-CG 3.99Å; D648-E650 PolarHBondContact O-N 2.71Å; D648-E650 PolarHBondContact OD1-N 2.67Å; E650-R690 IonicContact OE1-CZ 2.77Å; E650-R690 IonicContact OE1-NH1 3.63Å; E650-R690 PolarHBondContact OE1-NH1 3.06Å; E650-R690 IonicContact OE1-NH2 2.71Å; E650-R690 PolarHBondContact OE1-NH2 3.29Å
651	N	92.6	Very high	90.9	Very high	126 Å²	126	39.2 Å²	39.2	67%	0.674	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105	-24.3	-175.6	-59.2	-70.4	0	0	0	115.2	D648	D648-N651 HydrophobicContact CB-CB 4.27Å; D648-N651 VanDerWaalsContact CG-ND2 3.28Å; D648-N651 PolarHBondContact OD1-N 2.89Å; D648-N651 PolarHBondContact OD1-ND2 3.08Å; D648-N651 VanDerWaalsContact OD1-ND2 3.15Å; D648-N651 PolarHBondContact OD2-ND2 3.18Å
652	D	94.4	Very high	91.7	Very high	28 Å²	28	39 Å²	39	15%	0.15	20%	0.2	C	C	.	.			trans	-91.7	143.1	-178	-69	-36.2	0	0	0	113.6	F647 D648 V657 R1130	F647-D652 WeakPolarHBondContact CA-OD2 3.43Å; F647-D652 HydrophobicContact CD1-CB 4.35Å; F647-D652 HydrophobicContact CD2-CB 4.19Å; F647-D652 HydrophobicContact CE1-CB 3.94Å; F647-D652 HydrophobicContact CE2-CB 3.76Å; F647-D652 HydrophobicContact CG-CB 4.45Å; F647-D652 HydrophobicContact CZ-CB 3.62Å; F647-D652 WeakPolarHBondContact CZ-O 3.46Å; D648-D652 HydrophobicContact CB-CB 4.49Å; D648-D652 WeakPolarHBondContact CB-OD2 3.43Å; D648-D652 PolarHBondContact N-OD2 3.45Å; D648-D652 WeakPolarHBondContact O-CB 3.43Å; D648-D652 PolarHBondContact O-N 3.35Å; D648-D652 VanDerWaalsContact O-N 3.07Å; D652-V657 HydrophobicContact CB-CG2 3.94Å; D652-R1130 IonicContact OD1-NH1 2.63Å; D652-R1130 PolarHBondContact OD1-NH1 3.03Å; D652-R1130 IonicContact OD2-CZ 3.08Å; D652-R1130 IonicContact OD2-NH1 2.67Å; D652-R1130 PolarHBondContact OD2-NH1 3.18Å; D652-R1130 IonicContact OD2-NH2 2.71Å; D652-R1130 PolarHBondContact OD2-NH2 3.43Å
653	S	94	Very high	92.1	Very high	37 Å²	37	46.1 Å²	46.1	26%	0.259	23%	0.233	S	C	.	.			trans	-92.1	134.6	162.1	-179.8	0	0	0	0	111	D655 E656 V657	S653-D655 PolarHBondContact O-N 3.14Å; S653-D655 PolarHBondContact OG-N 3.14Å; S653-E656 PolarHBondContact O-N 3.41Å; S653-V657 PolarHBondContact O-N 3.48Å; S653-V657 VanDerWaalsContact O-N 3.08Å
654	P	93.2	Very high	92	Very high	19 Å²	19	49.4 Å²	49.4	12%	0.123	25%	0.249	C	C	.	.	H	α-helix	trans	-53.4	-39.6	171.8	-27.1	36.3	0	0	0	113	F647 V657 V658 T676 I679 K680	F647-P654 HydrophobicContact CE2-CG 4.36Å; F647-P654 HydrophobicContact CZ-CG 4.07Å; P654-V657 PolarHBondContact O-N 2.8Å; P654-V658 WeakPolarHBondContact O-CG2 3.42Å; P654-V658 PolarHBondContact O-N 3.09Å; P654-T676 HydrophobicContact CB-CG2 4.09Å; P654-I679 HydrophobicContact CB-CB 4.49Å; P654-I679 HydrophobicContact CB-CG2 4.08Å; P654-K680 HydrophobicContact CB-CB 4.21Å; P654-K680 HydrophobicContact CG-CB 3.99Å; P654-K680 HydrophobicContact CG-CG 4.39Å
655	D	93.3	Very high	91.4	Very high	101 Å²	101	54.2 Å²	54.2	54%	0.54	27%	0.271	S	S	.	.	H	α-helix	trans	-64	-41.3	179.2	-61.9	-100.9	0	0	0	111.9	S653 V658 Q659 T676	S653-D655 PolarHBondContact O-N 3.14Å; S653-D655 PolarHBondContact OG-N 3.14Å; D655-V658 PolarHBondContact O-N 3Å; D655-Q659 VanDerWaalsContact O-CB 3.32Å; D655-Q659 WeakPolarHBondContact O-CB 3.46Å; D655-Q659 PolarHBondContact O-N 3.41Å; D655-T676 HydrophobicContact CB-CG2 4.31Å; D655-T676 WeakPolarHBondContact OD1-CG2 3.04Å
656	E	93.8	Very high	90.6	Very high	118 Å²	118	55.9 Å²	55.9	55%	0.551	28%	0.279	S	S	*	.	H	α-helix	trans	-70	-39.7	178.2	-69.7	176.8	-160.4	0	0	112.4	S653 V658 Q659 Q660	S653-E656 PolarHBondContact O-N 3.41Å; E656-V658 VanDerWaalsContact C-N 3.35Å; E656-Q659 PolarHBondContact O-N 2.92Å; E656-Q660 WeakPolarHBondContact O-CG 3.37Å; E656-Q660 PolarHBondContact O-N 3.34Å; E656-Q660 PolarHBondContact O-NE2 3.42Å
657	V	94	Very high	90.2	Very high	4 Å²	4	55.7 Å²	55.7	2%	0.024	28%	0.276	C	S	.	.	H	α-helix	trans	-66.7	-38.2	177.1	171.7	0	0	0	0	110.9	F645 F647 D652 S653 P654 Q660 M661 F1131	F645-V657 HydrophobicContact CD2-CG1 3.82Å; F645-V657 HydrophobicContact CE2-CG1 3.99Å; F647-V657 HydrophobicContact CD2-CB 4.29Å; F647-V657 HydrophobicContact CD2-CG1 4.26Å; F647-V657 HydrophobicContact CD2-CG2 3.86Å; F647-V657 HydrophobicContact CE2-CB 4.22Å; F647-V657 HydrophobicContact CE2-CG2 3.81Å; D652-V657 HydrophobicContact CB-CG2 3.94Å; S653-V657 PolarHBondContact O-N 3.48Å; S653-V657 VanDerWaalsContact O-N 3.08Å; P654-V657 PolarHBondContact O-N 2.8Å; V657-Q660 PolarHBondContact O-N 3.06Å; V657-M661 HydrophobicContact CG1-CE 4.18Å; V657-M661 WeakPolarHBondContact O-CG 3.25Å; V657-M661 PolarHBondContact O-N 2.88Å; V657-F1131 HydrophobicContact CG1-CE1 4.45Å; V657-F1131 HydrophobicContact CG1-CZ 4.36Å
658	V	92.5	Very high	89.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-71.5	-37.5	173.5	175.7	0	0	0	0	111.8	P654 D655 E656 Q660 M661 I662 I667 T672 I675 T676 I679	P654-V658 WeakPolarHBondContact O-CG2 3.42Å; P654-V658 PolarHBondContact O-N 3.09Å; D655-V658 PolarHBondContact O-N 3Å; E656-V658 VanDerWaalsContact C-N 3.35Å; V658-Q660 VanDerWaalsContact C-N 3.25Å; V658-Q660 PolarHBondContact O-N 3.13Å; V658-M661 WeakPolarHBondContact O-CA 3.47Å; V658-M661 WeakPolarHBondContact O-CB 3.34Å; V658-M661 PolarHBondContact O-N 3.04Å; V658-I662 HydrophobicContact CG1-CD1 4.39Å; V658-I662 WeakPolarHBondContact O-CG1 3.46Å; V658-I662 PolarHBondContact O-N 3.09Å; V658-I667 HydrophobicContact CG1-CD1 3.59Å; V658-T672 HydrophobicContact CG1-CG2 3.94Å; V658-I675 HydrophobicContact CG1-CG2 4.5Å; V658-I675 HydrophobicContact CG2-CG2 3.88Å; V658-T676 WeakPolarHBondContact CG1-OG1 3.38Å; V658-I679 HydrophobicContact CG2-CD1 3.63Å
659	Q	91.9	Very high	88.9	Confident	110 Å²	110	60.7 Å²	60.7	51%	0.514	30%	0.304	S	S	.	.	H	α-helix	trans	-61.2	-36.2	175.2	-171.3	56.9	79.5	0	0	111.9	D655 E656 I662 E663	D655-Q659 VanDerWaalsContact O-CB 3.32Å; D655-Q659 WeakPolarHBondContact O-CB 3.46Å; D655-Q659 PolarHBondContact O-N 3.41Å; E656-Q659 PolarHBondContact O-N 2.92Å; Q659-I662 PolarHBondContact O-N 3.18Å; Q659-E663 WeakPolarHBondContact O-CB 3.36Å; Q659-E663 PolarHBondContact O-N 2.93Å
660	Q	91	Very high	88.4	Confident	72 Å²	72	67.1 Å²	67.1	34%	0.336	33%	0.334	S	S	.	.	H	α-helix	trans	-67.5	-34	171.1	-71	167.9	57.3	0	0	113	E656 V657 V658 I662 Q664 F1131	E656-Q660 WeakPolarHBondContact O-CG 3.37Å; E656-Q660 PolarHBondContact O-N 3.34Å; E656-Q660 PolarHBondContact O-NE2 3.42Å; V657-Q660 PolarHBondContact O-N 3.06Å; V658-Q660 VanDerWaalsContact C-N 3.25Å; V658-Q660 PolarHBondContact O-N 3.13Å; Q660-I662 VanDerWaalsContact C-N 3.35Å; Q660-Q664 WeakPolarHBondContact O-CB 3.16Å; Q660-Q664 WeakPolarHBondContact O-CG 3.45Å; Q660-Q664 PolarHBondContact O-N 3.16Å; Q660-Q664 PolarHBondContact O-NE2 2.75Å; Q660-F1131 HydrophobicContact CB-CE2 3.88Å; Q660-F1131 HydrophobicContact CB-CZ 3.89Å
661	M	89.3	Confident	88	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-65.5	-36.7	172.1	-66.8	179.8	-174.7	0	0	112.2	L624 L643 F645 V657 V658 Q665 H666 I667 I675 I679 F1131	L624-M661 HydrophobicContact CD2-SD 4.3Å; L643-M661 HydrophobicContact CD2-CE 4.23Å; L643-M661 HydrophobicContact CD2-CG 4.12Å; L643-M661 HydrophobicContact CD2-SD 3.95Å; F645-M661 HydrophobicContact CB-CE 4.49Å; F645-M661 HydrophobicContact CD1-CE 3.41Å; F645-M661 VanDerWaalsContact CD1-CE 3.41Å; F645-M661 HydrophobicContact CD2-CE 3.79Å; F645-M661 HydrophobicContact CE1-CE 3.41Å; F645-M661 VanDerWaalsContact CE1-CE 3.41Å; F645-M661 HydrophobicContact CE2-CE 3.76Å; F645-M661 HydrophobicContact CG-CE 3.63Å; F645-M661 HydrophobicContact CZ-CE 3.58Å; V657-M661 HydrophobicContact CG1-CE 4.18Å; V657-M661 WeakPolarHBondContact O-CG 3.25Å; V657-M661 PolarHBondContact O-N 2.88Å; V658-M661 WeakPolarHBondContact O-CA 3.47Å; V658-M661 WeakPolarHBondContact O-CB 3.34Å; V658-M661 PolarHBondContact O-N 3.04Å; M661-Q665 PolarHBondContact O-N 3.38Å; M661-H666 PolarHBondContact O-N 3.4Å; M661-I667 HydrophobicContact CB-CD1 3.59Å; M661-I667 HydrophobicContact CB-CG1 3.8Å; M661-I667 HydrophobicContact CB-CG2 4.28Å; M661-I667 HydrophobicContact SD-CD1 4.17Å; M661-I667 HydrophobicContact SD-CG2 4.33Å; M661-I675 HydrophobicContact SD-CG2 4.29Å; M661-I679 HydrophobicContact CE-CD1 3.83Å; M661-F1131 HydrophobicContact CE-CD1 4.44Å; M661-F1131 HydrophobicContact CE-CE1 3.78Å; M661-F1131 HydrophobicContact CG-CD1 4.03Å; M661-F1131 HydrophobicContact CG-CE1 3.37Å; M661-F1131 HydrophobicContact CG-CZ 3.98Å; M661-F1131 HydrophobicContact SD-CE1 4.44Å
662	I	88	Confident	87.8	Confident	27 Å²	27	58 Å²	58	14%	0.138	29%	0.29	C	S	.	.	H	α-helix	trans	-68.4	-47.6	175.2	-63	166.2	0	0	0	110.2	V658 Q659 Q660 Q664 Q665 I667 D669 T672	V658-I662 HydrophobicContact CG1-CD1 4.39Å; V658-I662 WeakPolarHBondContact O-CG1 3.46Å; V658-I662 PolarHBondContact O-N 3.09Å; Q659-I662 PolarHBondContact O-N 3.18Å; Q660-I662 VanDerWaalsContact C-N 3.35Å; I662-Q664 VanDerWaalsContact C-N 3.28Å; I662-Q664 PolarHBondContact O-N 2.93Å; I662-Q665 VanDerWaalsContact O-CA 3.32Å; I662-Q665 WeakPolarHBondContact O-CA 3.34Å; I662-Q665 PolarHBondContact O-N 2.89Å; I662-I667 HydrophobicContact CG1-CD1 3.9Å; I662-I667 HydrophobicContact CG1-CG1 3.84Å; I662-D669 VanDerWaalsContact CG2-OD1 3.3Å; I662-D669 WeakPolarHBondContact CG2-OD1 3.28Å; I662-T672 HydrophobicContact CD1-CG2 3.72Å; I662-T672 VanDerWaalsContact CD1-OG1 3.3Å; I662-T672 WeakPolarHBondContact CD1-OG1 3.49Å
663	E	88.1	Confident	87.4	Confident	150 Å²	150	66.1 Å²	66.1	70%	0.701	32%	0.319	S	S	*	.	H	α-helix	trans	-59.1	-38.8	179.6	-173.7	175.8	-154	0	0	111.9	Q659 Q665	Q659-E663 WeakPolarHBondContact O-CB 3.36Å; Q659-E663 PolarHBondContact O-N 2.93Å; E663-Q665 PolarHBondContact O-N 2.77Å
664	Q	85.2	Confident	86.9	Confident	70 Å²	70	67.2 Å²	67.2	33%	0.327	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	10.2	174.1	-67	173	64.8	0	0	113.6	Q660 I662 H666 S1129 F1131	Q660-Q664 WeakPolarHBondContact O-CB 3.16Å; Q660-Q664 WeakPolarHBondContact O-CG 3.45Å; Q660-Q664 PolarHBondContact O-N 3.16Å; Q660-Q664 PolarHBondContact O-NE2 2.75Å; I662-Q664 VanDerWaalsContact C-N 3.28Å; I662-Q664 PolarHBondContact O-N 2.93Å; Q664-H666 PolarHBondContact O-N 3.08Å; Q664-H666 VanDerWaalsContact O-N 3.13Å; Q664-S1129 PolarHBondContact OE1-OG 3.12Å; Q664-F1131 VanDerWaalsContact NE2-CD2 3.33Å
665	Q	77.7	Confident	86.7	Confident	120 Å²	120	66.3 Å²	66.3	56%	0.561	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	26.6	-177.3	-60.6	-165.1	6.6	0	0	115	R636 M661 I662 E663 I667	R636-Q665 WeakPolarHBondContact CB-O 3.41Å; R636-Q665 HydrophobicContact CG-CB 4.48Å; R636-Q665 WeakPolarHBondContact CG-O 3.43Å; R636-Q665 VanDerWaalsContact NH2-OE1 3.15Å; M661-Q665 PolarHBondContact O-N 3.38Å; I662-Q665 VanDerWaalsContact O-CA 3.32Å; I662-Q665 WeakPolarHBondContact O-CA 3.34Å; I662-Q665 PolarHBondContact O-N 2.89Å; E663-Q665 PolarHBondContact O-N 2.77Å; Q665-I667 VanDerWaalsContact C-N 3.33Å
666	H	77.6	Confident	86.6	Confident	35 Å²	35	62.2 Å²	62.2	16%	0.162	29%	0.293	C	S	.	.	S	Bend	trans	-74.5	-24.5	-180	-70.1	-33.9	0	0	0	113.3	F637 L643 M661 Q664	F637-H666 WeakPolarHBondContact CE1-O 3.41Å; L643-H666 HydrophobicContact CD1-CB 4.21Å; L643-H666 HydrophobicContact CD2-CB 3.79Å; M661-H666 PolarHBondContact O-N 3.4Å; Q664-H666 PolarHBondContact O-N 3.08Å; Q664-H666 VanDerWaalsContact O-N 3.13Å
667	I	83.7	Confident	86.2	Confident	9 Å²	9	59.6 Å²	59.6	5%	0.046	28%	0.28	C	S	.	.	S	Bend	trans	-137	155.8	-174.4	66.4	175.3	0	0	0	111.6	L624 Y635 V658 M661 I662 Q665 I675	L624-I667 HydrophobicContact CD2-CG2 3.68Å; Y635-I667 HydrophobicContact CD1-CB 4.3Å; Y635-I667 HydrophobicContact CD1-CG2 4.04Å; Y635-I667 HydrophobicContact CE1-CB 3.97Å; Y635-I667 HydrophobicContact CE1-CG2 3.84Å; V658-I667 HydrophobicContact CG1-CD1 3.59Å; M661-I667 HydrophobicContact CB-CD1 3.59Å; M661-I667 HydrophobicContact CB-CG1 3.8Å; M661-I667 HydrophobicContact CB-CG2 4.28Å; M661-I667 HydrophobicContact SD-CD1 4.17Å; M661-I667 HydrophobicContact SD-CG2 4.33Å; I662-I667 HydrophobicContact CG1-CD1 3.9Å; I662-I667 HydrophobicContact CG1-CG1 3.84Å; Q665-I667 VanDerWaalsContact C-N 3.33Å; I667-I675 HydrophobicContact CB-CD1 3.89Å; I667-I675 HydrophobicContact CD1-CD1 3.85Å; I667-I675 HydrophobicContact CD1-CG2 4.39Å; I667-I675 HydrophobicContact CG1-CD1 4.44Å; I667-I675 HydrophobicContact CG2-CD1 3.89Å
668	P	81.9	Confident	85.9	Confident	21 Å²	21	60.3 Å²	60.3	14%	0.136	28%	0.284	C	S	.	.			trans	-86.3	144.6	176.6	-2.9	21.9	0	0	0	112.7	Q634 Y635 E670 D671	Q634-P668 HydrophobicContact CB-CB 4.43Å; Q634-P668 HydrophobicContact CB-CG 3.7Å; Y635-P668 HydrophobicContact CD2-CG 4.16Å; Y635-P668 VanDerWaalsContact CE1-CD 3.46Å; Y635-P668 HydrophobicContact CE1-CG 4.42Å; Y635-P668 HydrophobicContact CE2-CG 3.89Å; Y635-P668 VanDerWaalsContact CZ-CD 3.43Å; P668-E670 PolarHBondContact O-N 2.87Å; P668-E670 VanDerWaalsContact O-N 3.1Å; P668-D671 PolarHBondContact O-N 3.28Å; P668-D671 VanDerWaalsContact O-N 3.1Å
669	D	81.9	Confident	85.9	Confident	115 Å²	115	60.3 Å²	60.3	62%	0.615	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-52.8	-35.3	179.4	-57	-26.6	0	0	0	113.6	I662 D671 T672	I662-D669 VanDerWaalsContact CG2-OD1 3.3Å; I662-D669 WeakPolarHBondContact CG2-OD1 3.28Å; D669-D671 VanDerWaalsContact C-N 3.29Å; D669-D671 PolarHBondContact O-N 3.32Å; D669-T672 WeakPolarHBondContact CA-OG1 3.47Å; D669-T672 VanDerWaalsContact O-CB 3.27Å; D669-T672 WeakPolarHBondContact O-CB 3.22Å; D669-T672 PolarHBondContact O-N 3.39Å; D669-T672 PolarHBondContact O-OG1 3.37Å
670	E	82.1	Confident	85.9	Confident	136 Å²	136	60.1 Å²	60.1	64%	0.636	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-56.4	-39.8	-179.9	-61.8	-179.2	157.8	0	0	112.8	Q634 P668	Q634-E670 PolarHBondContact NE2-OE2 2.84Å; P668-E670 PolarHBondContact O-N 2.87Å; P668-E670 VanDerWaalsContact O-N 3.1Å
671	D	82.8	Confident	85.6	Confident	16 Å²	16	60 Å²	60	9%	0.086	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-94.3	-3.1	-175.1	-87.1	-35.6	0	0	0	113.6	I602 K631 Y635 P668 D669 R673 M674 I675	I602-D671 HydrophobicContact CD1-CB 4.07Å; I602-D671 WeakPolarHBondContact CD1-OD2 3.41Å; K631-D671 WeakPolarHBondContact CE-OD2 3.34Å; K631-D671 IonicContact NZ-OD1 2.75Å; K631-D671 PolarHBondContact NZ-OD1 2.9Å; K631-D671 IonicContact NZ-OD2 3.53Å; K631-D671 PolarHBondContact NZ-OD2 3.47Å; Y635-D671 VanDerWaalsContact OH-CB 3.32Å; Y635-D671 WeakPolarHBondContact OH-CB 3.35Å; Y635-D671 PolarHBondContact OH-OD2 2.94Å; P668-D671 PolarHBondContact O-N 3.28Å; P668-D671 VanDerWaalsContact O-N 3.1Å; D669-D671 VanDerWaalsContact C-N 3.29Å; D669-D671 PolarHBondContact O-N 3.32Å; D671-R673 PolarHBondContact O-N 3.31Å; D671-M674 WeakPolarHBondContact O-CA 3.42Å; D671-M674 WeakPolarHBondContact O-CB 3.21Å; D671-M674 PolarHBondContact O-N 2.9Å; D671-I675 HydrophobicContact CB-CD1 4.08Å; D671-I675 HydrophobicContact CB-CG1 4.46Å; D671-I675 PolarHBondContact O-N 3.23Å
672	T	87.4	Confident	85.6	Confident	31 Å²	31	63 Å²	63	19%	0.19	30%	0.296	C	S	.	.	H	α-helix	trans	-41.7	-57.6	178.9	-59.6	0	0	0	0	112.8	V658 I662 D669 M674 I675 T676	V658-T672 HydrophobicContact CG1-CG2 3.94Å; I662-T672 HydrophobicContact CD1-CG2 3.72Å; I662-T672 VanDerWaalsContact CD1-OG1 3.3Å; I662-T672 WeakPolarHBondContact CD1-OG1 3.49Å; D669-T672 WeakPolarHBondContact CA-OG1 3.47Å; D669-T672 VanDerWaalsContact O-CB 3.27Å; D669-T672 WeakPolarHBondContact O-CB 3.22Å; D669-T672 PolarHBondContact O-N 3.39Å; D669-T672 PolarHBondContact O-OG1 3.37Å; T672-M674 VanDerWaalsContact C-N 3.26Å; T672-M674 PolarHBondContact O-N 3.42Å; T672-I675 PolarHBondContact O-N 3.41Å; T672-I675 VanDerWaalsContact O-N 3.15Å; T672-T676 WeakPolarHBondContact O-CB 3.22Å; T672-T676 PolarHBondContact O-N 2.77Å; T672-T676 PolarHBondContact O-OG1 3.28Å
673	R	85.5	Confident	85.8	Confident	197 Å²	197	61.8 Å²	61.8	74%	0.743	29%	0.29	S	S	*	.	H	α-helix	trans	-61.5	-34.9	-176.6	-66.1	-176.2	-63.3	-80.5	-6.2	112.5	D671 K677	D671-R673 PolarHBondContact O-N 3.31Å; R673-K677 VanDerWaalsContact O-CB 3.31Å; R673-K677 WeakPolarHBondContact O-CB 3.42Å; R673-K677 PolarHBondContact O-N 2.84Å
674	M	84.2	Confident	85.8	Confident	60 Å²	60	57 Å²	57	30%	0.296	27%	0.269	S	S	.	.	H	α-helix	trans	-70.7	-44.4	177.3	-174.9	62.2	71.2	0	0	110.6	I600 I602 D671 T672 K677 L678	I600-M674 HydrophobicContact CD1-SD 4.5Å; I600-M674 HydrophobicContact CG1-SD 4.43Å; I600-M674 HydrophobicContact CG2-CE 4.45Å; I600-M674 HydrophobicContact CG2-CG 3.64Å; I600-M674 HydrophobicContact CG2-SD 3.7Å; I602-M674 HydrophobicContact CD1-CG 4.49Å; D671-M674 WeakPolarHBondContact O-CA 3.42Å; D671-M674 WeakPolarHBondContact O-CB 3.21Å; D671-M674 PolarHBondContact O-N 2.9Å; T672-M674 VanDerWaalsContact C-N 3.26Å; T672-M674 PolarHBondContact O-N 3.42Å; M674-K677 PolarHBondContact O-N 3.08Å; M674-L678 HydrophobicContact CG-CD1 4.27Å; M674-L678 WeakPolarHBondContact O-CB 3.43Å; M674-L678 VanDerWaalsContact O-CG 3.27Å; M674-L678 WeakPolarHBondContact O-CG 3.18Å; M674-L678 PolarHBondContact O-N 3.22Å
675	I	88.2	Confident	85.8	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.9	-45	-179.3	-63.3	169.6	0	0	0	111	I602 L624 Y635 V658 M661 I667 D671 T672 K677 L678 I679	I602-I675 HydrophobicContact CD1-CG1 4.49Å; I602-I675 HydrophobicContact CG2-CG1 4.3Å; L624-I675 HydrophobicContact CD1-CG1 4.33Å; L624-I675 HydrophobicContact CD1-CG2 4.11Å; L624-I675 HydrophobicContact CD2-CD1 4.25Å; L624-I675 HydrophobicContact CD2-CG2 4.27Å; Y635-I675 HydrophobicContact CE1-CD1 4.06Å; V658-I675 HydrophobicContact CG1-CG2 4.5Å; V658-I675 HydrophobicContact CG2-CG2 3.88Å; M661-I675 HydrophobicContact SD-CG2 4.29Å; I667-I675 HydrophobicContact CB-CD1 3.89Å; I667-I675 HydrophobicContact CD1-CD1 3.85Å; I667-I675 HydrophobicContact CD1-CG2 4.39Å; I667-I675 HydrophobicContact CG1-CD1 4.44Å; I667-I675 HydrophobicContact CG2-CD1 3.89Å; D671-I675 HydrophobicContact CB-CD1 4.08Å; D671-I675 HydrophobicContact CB-CG1 4.46Å; D671-I675 PolarHBondContact O-N 3.23Å; T672-I675 PolarHBondContact O-N 3.41Å; T672-I675 VanDerWaalsContact O-N 3.15Å; I675-K677 VanDerWaalsContact C-N 3.28Å; I675-K677 PolarHBondContact O-N 2.95Å; I675-L678 PolarHBondContact O-N 2.92Å; I675-I679 HydrophobicContact CG2-CD1 4.05Å; I675-I679 WeakPolarHBondContact O-CG1 3.48Å; I675-I679 PolarHBondContact O-N 2.82Å
676	T	91.5	Very high	86.3	Confident	15 Å²	15	49.1 Å²	49.1	9%	0.092	24%	0.236	C	C	.	.	H	α-helix	trans	-54.2	-47.6	174.1	-57.3	0	0	0	0	110.8	P654 D655 V658 T672 I679 K680	P654-T676 HydrophobicContact CB-CG2 4.09Å; D655-T676 HydrophobicContact CB-CG2 4.31Å; D655-T676 WeakPolarHBondContact OD1-CG2 3.04Å; V658-T676 WeakPolarHBondContact CG1-OG1 3.38Å; T672-T676 WeakPolarHBondContact O-CB 3.22Å; T672-T676 PolarHBondContact O-N 2.77Å; T672-T676 PolarHBondContact O-OG1 3.28Å; T676-I679 PolarHBondContact O-N 3.33Å; T676-K680 WeakPolarHBondContact O-CB 3.27Å; T676-K680 PolarHBondContact O-N 3.21Å
677	K	86.2	Confident	87	Confident	63 Å²	63	51.6 Å²	51.6	27%	0.274	24%	0.244	S	C	.	.	H	α-helix	trans	-66.9	-43.6	178.1	-175.4	172.4	173.5	-70	0	112.4	D592 R673 M674 I675 I679 K680 D681	D592-K677 VanDerWaalsContact CB-NZ 3.3Å; D592-K677 WeakPolarHBondContact OD1-CE 3.45Å; D592-K677 IonicContact OD1-NZ 3.87Å; D592-K677 PolarHBondContact OD1-NZ 2.94Å; D592-K677 VanDerWaalsContact OD2-CE 3.24Å; D592-K677 WeakPolarHBondContact OD2-CE 3.49Å; D592-K677 IonicContact OD2-NZ 2.98Å; R673-K677 VanDerWaalsContact O-CB 3.31Å; R673-K677 WeakPolarHBondContact O-CB 3.42Å; R673-K677 PolarHBondContact O-N 2.84Å; M674-K677 PolarHBondContact O-N 3.08Å; I675-K677 VanDerWaalsContact C-N 3.28Å; I675-K677 PolarHBondContact O-N 2.95Å; K677-I679 VanDerWaalsContact C-N 3.26Å; K677-I679 PolarHBondContact O-N 2.82Å; K677-K680 PolarHBondContact O-N 3.5Å; K677-D681 IonicContact NZ-OD1 2.74Å; K677-D681 IonicContact NZ-OD2 2.87Å; K677-D681 PolarHBondContact NZ-OD2 2.88Å; K677-D681 WeakPolarHBondContact O-CB 3.3Å; K677-D681 PolarHBondContact O-N 3.46Å
678	L	87.8	Confident	87.2	Confident	20 Å²	20	56.2 Å²	56.2	11%	0.105	26%	0.261	C	S	.	.	H	α-helix	trans	-59.3	-35.8	175.5	-76.4	173.6	0	0	0	112.7	I600 I602 V604 M674 I675 K682	I600-L678 HydrophobicContact CD1-CD2 4.34Å; I600-L678 HydrophobicContact CG2-CD1 4.04Å; I602-L678 HydrophobicContact CB-CD1 4.18Å; I602-L678 HydrophobicContact CG2-CD1 4.01Å; V604-L678 HydrophobicContact CB-CB 4.22Å; V604-L678 HydrophobicContact CG2-CB 3.68Å; V604-L678 HydrophobicContact CG2-CD1 4.32Å; M674-L678 HydrophobicContact CG-CD1 4.27Å; M674-L678 WeakPolarHBondContact O-CB 3.43Å; M674-L678 VanDerWaalsContact O-CG 3.27Å; M674-L678 WeakPolarHBondContact O-CG 3.18Å; M674-L678 PolarHBondContact O-N 3.22Å; I675-L678 PolarHBondContact O-N 2.92Å; L678-K682 WeakPolarHBondContact O-CB 3.49Å; L678-K682 WeakPolarHBondContact O-CG 3.15Å; L678-K682 PolarHBondContact O-N 2.83Å
679	I	91.6	Very high	87.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-69.4	-51.2	174.4	-68.6	174.6	0	0	0	109.7	V604 M622 F645 F647 P654 V658 M661 I675 T676 K677 D681 K682 V683	V604-I679 HydrophobicContact CG1-CG1 4.26Å; V604-I679 HydrophobicContact CG2-CG1 4.14Å; M622-I679 HydrophobicContact CE-CG2 4.28Å; M622-I679 HydrophobicContact SD-CG2 4.1Å; F645-I679 HydrophobicContact CE1-CD1 4.48Å; F645-I679 HydrophobicContact CE2-CD1 3.83Å; F645-I679 HydrophobicContact CE2-CG1 4.35Å; F645-I679 HydrophobicContact CZ-CD1 3.54Å; F645-I679 HydrophobicContact CZ-CG1 3.86Å; F647-I679 HydrophobicContact CD2-CG2 4.02Å; F647-I679 HydrophobicContact CE2-CG2 3.9Å; P654-I679 HydrophobicContact CB-CB 4.49Å; P654-I679 HydrophobicContact CB-CG2 4.08Å; V658-I679 HydrophobicContact CG2-CD1 3.63Å; M661-I679 HydrophobicContact CE-CD1 3.83Å; I675-I679 HydrophobicContact CG2-CD1 4.05Å; I675-I679 WeakPolarHBondContact O-CG1 3.48Å; I675-I679 PolarHBondContact O-N 2.82Å; T676-I679 PolarHBondContact O-N 3.33Å; K677-I679 VanDerWaalsContact C-N 3.26Å; K677-I679 PolarHBondContact O-N 2.82Å; I679-D681 PolarHBondContact O-N 2.83Å; I679-K682 WeakPolarHBondContact O-CB 3.16Å; I679-K682 PolarHBondContact O-N 3.38Å; I679-V683 HydrophobicContact CG2-CG2 4.23Å; I679-V683 WeakPolarHBondContact O-CG2 3.43Å; I679-V683 PolarHBondContact O-N 3.35Å
680	K	91.2	Very high	87.8	Confident	106 Å²	106	54.5 Å²	54.5	46%	0.461	25%	0.248	S	C	.	.	H	α-helix	trans	-55	-50.8	177.5	-175.4	179.8	177.6	-178.5	0	112.4	P654 T676 K677 K682 V683 D684	P654-K680 HydrophobicContact CB-CB 4.21Å; P654-K680 HydrophobicContact CG-CB 3.99Å; P654-K680 HydrophobicContact CG-CG 4.39Å; T676-K680 WeakPolarHBondContact O-CB 3.27Å; T676-K680 PolarHBondContact O-N 3.21Å; K677-K680 PolarHBondContact O-N 3.5Å; K680-K682 PolarHBondContact O-N 2.92Å; K680-K682 VanDerWaalsContact O-N 3.14Å; K680-V683 PolarHBondContact O-N 2.81Å; K680-V683 VanDerWaalsContact O-N 3.14Å; K680-D684 VanDerWaalsContact CE-OD2 3.29Å; K680-D684 WeakPolarHBondContact CE-OD2 3.17Å; K680-D684 WeakPolarHBondContact CG-OD2 3Å; K680-D684 WeakPolarHBondContact O-CB 3.46Å; K680-D684 PolarHBondContact O-N 3.24Å
681	D	85	Confident	88.2	Confident	70 Å²	70	51.6 Å²	51.6	37%	0.374	24%	0.237	S	C	.	.	H	α-helix	trans	-55.8	-32.5	178.3	-69.7	-13.2	0	0	0	111.9	K677 I679 A685	K677-D681 IonicContact NZ-OD1 2.74Å; K677-D681 IonicContact NZ-OD2 2.87Å; K677-D681 PolarHBondContact NZ-OD2 2.88Å; K677-D681 WeakPolarHBondContact O-CB 3.3Å; K677-D681 PolarHBondContact O-N 3.46Å; I679-D681 PolarHBondContact O-N 2.83Å; D681-A685 WeakPolarHBondContact O-CB 3.44Å; D681-A685 PolarHBondContact O-N 2.88Å
682	K	89	Confident	88.4	Confident	63 Å²	63	56.8 Å²	56.8	27%	0.274	26%	0.261	S	S	.	.	H	α-helix	trans	-82.5	-38.2	178.7	-66.9	-78.9	164.4	154.9	0	112.7	V604 M622 L678 I679 K680 A685 F686	V604-K682 HydrophobicContact CB-CG 4.19Å; V604-K682 HydrophobicContact CG1-CB 4.44Å; V604-K682 HydrophobicContact CG1-CG 4.05Å; V604-K682 WeakPolarHBondContact O-CD 3.46Å; V604-K682 WeakPolarHBondContact O-CE 3.36Å; V604-K682 PolarHBondContact O-NZ 3.11Å; M622-K682 HydrophobicContact CE-CB 3.66Å; L678-K682 WeakPolarHBondContact O-CB 3.49Å; L678-K682 WeakPolarHBondContact O-CG 3.15Å; L678-K682 PolarHBondContact O-N 2.83Å; I679-K682 WeakPolarHBondContact O-CB 3.16Å; I679-K682 PolarHBondContact O-N 3.38Å; K680-K682 PolarHBondContact O-N 2.92Å; K680-K682 VanDerWaalsContact O-N 3.14Å; K682-A685 CarbonylContact O-C 3.41Å; K682-F686 WeakPolarHBondContact O-CB 3.35Å; K682-F686 PolarHBondContact O-N 3.32Å
683	V	92.4	Very high	88.4	Confident	1 Å²	1	59 Å²	59	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-67.4	-47.6	175.2	172.3	0	0	0	0	110.4	M622 F647 I679 K680 A685 F686 R687	M622-V683 HydrophobicContact CE-CG2 4.06Å; M622-V683 HydrophobicContact SD-CG2 4.12Å; F647-V683 HydrophobicContact CD1-CG1 4.45Å; F647-V683 HydrophobicContact CD1-CG2 3.67Å; F647-V683 HydrophobicContact CE1-CB 4.36Å; F647-V683 HydrophobicContact CE1-CG1 3.86Å; F647-V683 HydrophobicContact CE1-CG2 3.58Å; F647-V683 HydrophobicContact CE2-CG2 4.44Å; F647-V683 HydrophobicContact CG-CG2 4.18Å; F647-V683 HydrophobicContact CZ-CG2 3.99Å; I679-V683 HydrophobicContact CG2-CG2 4.23Å; I679-V683 WeakPolarHBondContact O-CG2 3.43Å; I679-V683 PolarHBondContact O-N 3.35Å; K680-V683 PolarHBondContact O-N 2.81Å; K680-V683 VanDerWaalsContact O-N 3.14Å; V683-A685 VanDerWaalsContact C-N 3.27Å; V683-A685 PolarHBondContact O-N 3.45Å; V683-F686 CarbonylContact O-C 3.52Å; V683-F686 WeakPolarHBondContact O-CA 3.5Å; V683-F686 PolarHBondContact O-N 2.75Å; V683-R687 HydrophobicContact CG1-CG 4.44Å; V683-R687 WeakPolarHBondContact O-CG 3.34Å; V683-R687 PolarHBondContact O-N 2.88Å
684	D	89.4	Confident	88.6	Confident	49 Å²	49	53.1 Å²	53.1	26%	0.262	25%	0.248	S	C	.	.	H	α-helix	trans	-70.4	-22.4	177.9	-69	-24.1	0	0	0	112.5	K680 R687 R688	K680-D684 VanDerWaalsContact CE-OD2 3.29Å; K680-D684 WeakPolarHBondContact CE-OD2 3.17Å; K680-D684 WeakPolarHBondContact CG-OD2 3Å; K680-D684 WeakPolarHBondContact O-CB 3.46Å; K680-D684 PolarHBondContact O-N 3.24Å; D684-R687 IonicContact OD1-CZ 2.62Å; D684-R687 IonicContact OD1-NH1 3.25Å; D684-R687 PolarHBondContact OD1-NH1 3.29Å; D684-R688 WeakPolarHBondContact O-CG 3.27Å; D684-R688 PolarHBondContact O-NE 2.91Å
685	A	83.6	Confident	88.9	Confident	24 Å²	24	56.2 Å²	56.2	20%	0.198	27%	0.265	C	S	.	.	H	α-helix	trans	-83.3	-11.9	166.7	0	0	0	0	0	114.1	R609 D681 K682 V683	R609-A685 PolarHBondContact NH2-O 3.13Å; D681-A685 WeakPolarHBondContact O-CB 3.44Å; D681-A685 PolarHBondContact O-N 2.88Å; K682-A685 CarbonylContact O-C 3.41Å; V683-A685 VanDerWaalsContact C-N 3.27Å; V683-A685 PolarHBondContact O-N 3.45Å
686	F	90.2	Very high	89	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-92.8	-42.4	171.7	-172.1	-86.3	0	0	0	111	I606 R609 D612 L613 I620 I649 K682 V683 R688 D689 R690	I606-F686 HydrophobicContact CD1-CB 3.84Å; I606-F686 HydrophobicContact CD1-CD2 3.71Å; I606-F686 HydrophobicContact CD1-CG 4.04Å; R609-F686 HydrophobicContact CG-CD2 4.12Å; R609-F686 HydrophobicContact CG-CE2 4.08Å; D612-F686 HydrophobicContact CB-CE2 4.07Å; D612-F686 HydrophobicContact CB-CZ 3.71Å; L613-F686 HydrophobicContact CB-CE2 4.1Å; L613-F686 HydrophobicContact CB-CZ 4.15Å; L613-F686 HydrophobicContact CD1-CD1 4.49Å; L613-F686 HydrophobicContact CD1-CD2 4.06Å; L613-F686 HydrophobicContact CD1-CE1 4.14Å; L613-F686 HydrophobicContact CD1-CE2 3.68Å; L613-F686 HydrophobicContact CD1-CG 4.46Å; L613-F686 HydrophobicContact CD1-CZ 3.72Å; I620-F686 HydrophobicContact CD1-CG 4.44Å; I620-F686 HydrophobicContact CG2-CD1 4.37Å; I620-F686 HydrophobicContact CG2-CE1 3.83Å; I620-F686 HydrophobicContact CG2-CE2 4.33Å; I620-F686 HydrophobicContact CG2-CZ 3.81Å; I649-F686 HydrophobicContact CD1-CD1 3.37Å; I649-F686 HydrophobicContact CD1-CE1 3.4Å; I649-F686 HydrophobicContact CD1-CG 4.5Å; I649-F686 HydrophobicContact CG1-CD1 4.39Å; K682-F686 WeakPolarHBondContact O-CB 3.35Å; K682-F686 PolarHBondContact O-N 3.32Å; V683-F686 CarbonylContact O-C 3.52Å; V683-F686 WeakPolarHBondContact O-CA 3.5Å; V683-F686 PolarHBondContact O-N 2.75Å; F686-R688 PolarHBondContact O-N 2.59Å; F686-D689 PolarHBondContact O-N 3.08Å; F686-R690 HydrophobicContact CE1-CB 4.49Å; F686-R690 WeakPolarHBondContact O-CB 3.34Å; F686-R690 PolarHBondContact O-N 3.31Å
687	R	90.8	Very high	89	Confident	87 Å²	87	62.4 Å²	62.4	33%	0.328	29%	0.294	S	S	.	.	H	α-helix	trans	-49.8	-53.8	171.5	-74.9	172.2	171.6	165.5	-8.6	111.5	I649 V683 D684 D689 R690 D691	I649-R687 HydrophobicContact CG2-CG 3.5Å; I649-R687 PolarHBondContact O-NE 3.21Å; I649-R687 PolarHBondContact O-NH2 3.3Å; V683-R687 HydrophobicContact CG1-CG 4.44Å; V683-R687 WeakPolarHBondContact O-CG 3.34Å; V683-R687 PolarHBondContact O-N 2.88Å; D684-R687 IonicContact OD1-CZ 2.62Å; D684-R687 IonicContact OD1-NH1 3.25Å; D684-R687 PolarHBondContact OD1-NH1 3.29Å; R687-D689 VanDerWaalsContact C-N 3.33Å; R687-D689 PolarHBondContact O-N 3.07Å; R687-R690 WeakPolarHBondContact O-CB 3.37Å; R687-R690 PolarHBondContact O-N 2.87Å; R687-R690 VanDerWaalsContact O-N 3.08Å; R687-D691 PolarHBondContact O-N 3.2Å
688	R	88.4	Confident	89.3	Confident	107 Å²	107	65.4 Å²	65.4	40%	0.404	31%	0.307	S	S	.	.	H	α-helix	trans	-58.6	-39.9	178.9	-72.4	-176.6	-66.5	147.5	-5.2	113.9	Q563 D684 F686 H692	Q563-R688 PolarHBondContact O-NH1 2.58Å; D684-R688 WeakPolarHBondContact O-CG 3.27Å; D684-R688 PolarHBondContact O-NE 2.91Å; F686-R688 PolarHBondContact O-N 2.59Å; R688-H692 WeakPolarHBondContact O-CB 3.44Å; R688-H692 PolarHBondContact O-N 2.93Å
689	D	86	Confident	89.5	Confident	68 Å²	68	73.6 Å²	73.6	36%	0.364	34%	0.337	S	S	.	.	H	α-helix	trans	-71.5	-36	177.2	-76.6	19.2	0	0	0	111	R609 L613 F686 R687 H692 R693	R609-D689 IonicContact CZ-OD2 3.57Å; R609-D689 IonicContact NE-OD2 2.75Å; R609-D689 VanDerWaalsContact NH2-CG 3.34Å; R609-D689 IonicContact NH2-OD2 2.64Å; R609-D689 PolarHBondContact NH2-OD2 3.06Å; L613-D689 HydrophobicContact CD1-CB 3.71Å; L613-D689 HydrophobicContact CD2-CB 4.01Å; L613-D689 HydrophobicContact CG-CB 4.49Å; F686-D689 PolarHBondContact O-N 3.08Å; R687-D689 VanDerWaalsContact C-N 3.33Å; R687-D689 PolarHBondContact O-N 3.07Å; D689-H692 PolarHBondContact O-N 2.84Å; D689-R693 WeakPolarHBondContact O-CB 3.47Å; D689-R693 PolarHBondContact O-N 3.4Å
690	R	90.2	Very high	89.5	Confident	32 Å²	32	76.4 Å²	76.4	12%	0.121	36%	0.36	C	S	.	.	H	α-helix	trans	-64.7	-45	175.6	-169.6	-175.2	76.7	157.7	2.9	110.6	L613 L616 E650 F686 R687 R693 L694	L613-R690 HydrophobicContact CD1-CB 4.18Å; L616-R690 HydrophobicContact CD2-CG 3.78Å; E650-R690 IonicContact OE1-CZ 2.77Å; E650-R690 IonicContact OE1-NH1 3.63Å; E650-R690 PolarHBondContact OE1-NH1 3.06Å; E650-R690 IonicContact OE1-NH2 2.71Å; E650-R690 PolarHBondContact OE1-NH2 3.29Å; F686-R690 HydrophobicContact CE1-CB 4.49Å; F686-R690 WeakPolarHBondContact O-CB 3.34Å; F686-R690 PolarHBondContact O-N 3.31Å; R687-R690 WeakPolarHBondContact O-CB 3.37Å; R687-R690 PolarHBondContact O-N 2.87Å; R687-R690 VanDerWaalsContact O-N 3.08Å; R690-R693 PolarHBondContact O-N 3.3Å; R690-L694 HydrophobicContact CG-CD1 4.42Å; R690-L694 WeakPolarHBondContact O-CB 3.36Å; R690-L694 WeakPolarHBondContact O-CG 3.48Å; R690-L694 PolarHBondContact O-N 3.17Å
691	D	89.9	Confident	89.6	Confident	75 Å²	75	77.7 Å²	77.7	40%	0.401	37%	0.366	S	S	.	.	H	α-helix	trans	-65.1	-40.9	177.6	-59.5	-22.4	0	0	0	111.1	R687 L694 L695	R687-D691 PolarHBondContact O-N 3.2Å; D691-L694 WeakPolarHBondContact O-CB 3.44Å; D691-L694 PolarHBondContact O-N 3.36Å; D691-L695 VanDerWaalsContact O-CD1 3.24Å; D691-L695 WeakPolarHBondContact O-CD1 3.18Å; D691-L695 PolarHBondContact O-N 2.71Å
692	H	87.3	Confident	90	Very high	125 Å²	125	78.8 Å²	78.8	58%	0.579	37%	0.369	S	S	*	.	H	α-helix	trans	-61.5	-42.7	172.1	-176.4	-83.5	0	0	0	112	R688 D689 L695 E696	R688-H692 WeakPolarHBondContact O-CB 3.44Å; R688-H692 PolarHBondContact O-N 2.93Å; D689-H692 PolarHBondContact O-N 2.84Å; H692-L695 PolarHBondContact O-N 2.66Å; H692-E696 PolarHBondContact O-N 2.66Å
693	R	88.3	Confident	90	Very high	77 Å²	77	80 Å²	80	29%	0.291	38%	0.375	S	S	.	.	H	α-helix	trans	-66.4	-37.2	177.3	-170.9	55.6	164.5	164	0.9	112.2	N614 L616 D689 R690 E696 I697	N614-R693 PolarHBondContact OD1-NE 2.99Å; N614-R693 PolarHBondContact OD1-NH2 2.89Å; L616-R693 HydrophobicContact CD2-CG 4.41Å; D689-R693 WeakPolarHBondContact O-CB 3.47Å; D689-R693 PolarHBondContact O-N 3.4Å; R690-R693 PolarHBondContact O-N 3.3Å; R693-E696 IonicContact CZ-OE2 3.82Å; R693-E696 IonicContact NH1-OE2 2.79Å; R693-E696 PolarHBondContact NH1-OE2 3.16Å; R693-E696 PolarHBondContact O-N 2.69Å; R693-I697 HydrophobicContact CG-CD1 4.03Å; R693-I697 WeakPolarHBondContact O-CB 3.48Å; R693-I697 VanDerWaalsContact O-CG1 3.29Å; R693-I697 WeakPolarHBondContact O-CG1 3.28Å; R693-I697 PolarHBondContact O-N 3.15Å
694	L	90.3	Very high	90.1	Very high	74 Å²	74	86 Å²	86	39%	0.387	40%	0.403	S	S	.	.	H	α-helix	trans	-61.3	-44	171.3	-77.9	165.2	0	0	0	112	L616 R690 D691 K698	L616-L694 HydrophobicContact CD1-CD2 3.68Å; L616-L694 HydrophobicContact CD1-CG 4.41Å; L616-L694 HydrophobicContact CD2-CD2 4.17Å; L616-L694 HydrophobicContact CD2-CG 3.98Å; R690-L694 HydrophobicContact CG-CD1 4.42Å; R690-L694 WeakPolarHBondContact O-CB 3.36Å; R690-L694 WeakPolarHBondContact O-CG 3.48Å; R690-L694 PolarHBondContact O-N 3.17Å; D691-L694 WeakPolarHBondContact O-CB 3.44Å; D691-L694 PolarHBondContact O-N 3.36Å; L694-K698 WeakPolarHBondContact O-CB 3.37Å; L694-K698 PolarHBondContact O-N 3.18Å
695	L	90.2	Very high	90.3	Very high	124 Å²	124	89.7 Å²	89.7	65%	0.649	42%	0.419	S	S	*	.	H	α-helix	trans	-62.9	-40	174.1	-95.8	75.9	0	0	0	112.3	D691 H692 K698 R699	D691-L695 VanDerWaalsContact O-CD1 3.24Å; D691-L695 WeakPolarHBondContact O-CD1 3.18Å; D691-L695 PolarHBondContact O-N 2.71Å; H692-L695 PolarHBondContact O-N 2.66Å; L695-K698 PolarHBondContact O-N 3.07Å; L695-R699 WeakPolarHBondContact O-CB 3.47Å; L695-R699 PolarHBondContact O-N 2.79Å
696	E	89.3	Confident	90.8	Very high	94 Å²	94	94.3 Å²	94.3	44%	0.439	43%	0.431	S	S	.	.	H	α-helix	trans	-67.2	-44.5	178.1	-171.8	175.2	-124.5	0	0	112.1	H692 R693 K698 R699 A700	H692-E696 PolarHBondContact O-N 2.66Å; R693-E696 IonicContact CZ-OE2 3.82Å; R693-E696 IonicContact NH1-OE2 2.79Å; R693-E696 PolarHBondContact NH1-OE2 3.16Å; R693-E696 PolarHBondContact O-N 2.69Å; E696-K698 VanDerWaalsContact C-N 3.33Å; E696-K698 PolarHBondContact O-N 3.29Å; E696-R699 PolarHBondContact O-N 2.86Å; E696-A700 WeakPolarHBondContact O-CB 3.47Å; E696-A700 PolarHBondContact O-N 2.87Å
697	I	91.1	Very high	90.9	Very high	52 Å²	52	99.1 Å²	99.1	27%	0.267	46%	0.456	S	S	.	.	H	α-helix	trans	-62.7	-40.6	174.6	-69.5	165.3	0	0	0	110.9	L616 R693 A700 K701	L616-I697 HydrophobicContact CD1-CD1 4.16Å; R693-I697 HydrophobicContact CG-CD1 4.03Å; R693-I697 WeakPolarHBondContact O-CB 3.48Å; R693-I697 VanDerWaalsContact O-CG1 3.29Å; R693-I697 WeakPolarHBondContact O-CG1 3.28Å; R693-I697 PolarHBondContact O-N 3.15Å; I697-A700 PolarHBondContact O-N 2.85Å; I697-K701 WeakPolarHBondContact O-CG 3.25Å; I697-K701 PolarHBondContact O-N 3.35Å; I697-K701 VanDerWaalsContact O-N 3.13Å
698	K	92.8	Very high	91.1	Very high	126 Å²	126	103.4 Å²	103.4	55%	0.548	47%	0.472	S	S	.	.	H	α-helix	trans	-60.8	-51.3	174.6	176	173.6	169.3	173.9	0	111	L694 L695 E696 A700 K701 E702	L694-K698 WeakPolarHBondContact O-CB 3.37Å; L694-K698 PolarHBondContact O-N 3.18Å; L695-K698 PolarHBondContact O-N 3.07Å; E696-K698 VanDerWaalsContact C-N 3.33Å; E696-K698 PolarHBondContact O-N 3.29Å; K698-A700 VanDerWaalsContact C-N 3.29Å; K698-A700 PolarHBondContact O-N 3.49Å; K698-K701 PolarHBondContact O-N 3.49Å; K698-K701 VanDerWaalsContact O-N 3.14Å; K698-E702 WeakPolarHBondContact CE-OE1 3.42Å; K698-E702 HydrophobicContact CG-CG 4.46Å; K698-E702 IonicContact NZ-OE1 2.86Å; K698-E702 WeakPolarHBondContact O-CG 3.2Å; K698-E702 PolarHBondContact O-N 2.71Å
699	R	91.8	Very high	91.3	Very high	191 Å²	191	103.5 Å²	103.5	72%	0.721	48%	0.477	S	S	*	.	H	α-helix	trans	-61.2	-36.7	179.3	-174.7	-179.7	179.2	-173	0.6	112.6	L695 E696 E702 E703	L695-R699 WeakPolarHBondContact O-CB 3.47Å; L695-R699 PolarHBondContact O-N 2.79Å; E696-R699 PolarHBondContact O-N 2.86Å; R699-E702 PolarHBondContact O-N 2.75Å; R699-E703 PolarHBondContact O-N 2.79Å
700	A	92.1	Very high	91.6	Very high	59 Å²	59	105.9 Å²	105.9	49%	0.488	49%	0.486	S	S	.	.	H	α-helix	trans	-64.2	-41.1	175.7	0	0	0	0	0	111.9	E696 I697 K698 E703 E704	E696-A700 WeakPolarHBondContact O-CB 3.47Å; E696-A700 PolarHBondContact O-N 2.87Å; I697-A700 PolarHBondContact O-N 2.85Å; K698-A700 VanDerWaalsContact C-N 3.29Å; K698-A700 PolarHBondContact O-N 3.49Å; A700-E703 PolarHBondContact O-N 3.47Å; A700-E704 WeakPolarHBondContact O-CB 3.36Å; A700-E704 PolarHBondContact O-N 2.98Å
701	K	93.6	Very high	91.7	Very high	133 Å²	133	107 Å²	107	58%	0.578	50%	0.503	S	S	*	.	H	α-helix	trans	-67	-42.4	174.9	-71.4	177.7	178.5	-176.6	0	112.6	I697 K698 E703 E704 E705	I697-K701 WeakPolarHBondContact O-CG 3.25Å; I697-K701 PolarHBondContact O-N 3.35Å; I697-K701 VanDerWaalsContact O-N 3.13Å; K698-K701 PolarHBondContact O-N 3.49Å; K698-K701 VanDerWaalsContact O-N 3.14Å; K701-E703 VanDerWaalsContact C-N 3.26Å; K701-E703 PolarHBondContact O-N 3.33Å; K701-E704 PolarHBondContact O-N 3.48Å; K701-E705 VanDerWaalsContact O-CB 3.29Å; K701-E705 WeakPolarHBondContact O-CB 3.43Å; K701-E705 PolarHBondContact O-N 2.7Å
702	E	92.7	Very high	91.9	Very high	94 Å²	94	110 Å²	110	44%	0.439	51%	0.514	S	S	.	.	H	α-helix	trans	-61.3	-34.9	175.9	-70.2	171.1	156.8	0	0	111.8	K698 R699 R706	K698-E702 WeakPolarHBondContact CE-OE1 3.42Å; K698-E702 HydrophobicContact CG-CG 4.46Å; K698-E702 IonicContact NZ-OE1 2.86Å; K698-E702 WeakPolarHBondContact O-CG 3.2Å; K698-E702 PolarHBondContact O-N 2.71Å; R699-E702 PolarHBondContact O-N 2.75Å; E702-R706 WeakPolarHBondContact O-CG 3.47Å; E702-R706 PolarHBondContact O-N 3.26Å; E702-R706 VanDerWaalsContact O-N 3.15Å
703	E	90.6	Very high	92.2	Very high	87 Å²	87	109.4 Å²	109.4	41%	0.407	51%	0.514	S	S	.	.	H	α-helix	trans	-75.4	-39	174.3	-164.7	65.2	-158.7	0	0	112.6	R699 A700 K701 R706 I707	R699-E703 PolarHBondContact O-N 2.79Å; A700-E703 PolarHBondContact O-N 3.47Å; K701-E703 VanDerWaalsContact C-N 3.26Å; K701-E703 PolarHBondContact O-N 3.33Å; E703-R706 PolarHBondContact O-N 2.86Å; E703-R706 IonicContact OE1-CZ 2.77Å; E703-R706 IonicContact OE1-NH1 2.7Å; E703-R706 PolarHBondContact OE1-NH1 3.47Å; E703-R706 IonicContact OE2-CZ 3.7Å; E703-R706 IonicContact OE2-NH1 3.88Å; E703-R706 PolarHBondContact OE2-NH1 3.11Å; E703-I707 HydrophobicContact CG-CD1 4.12Å; E703-I707 WeakPolarHBondContact O-CB 3.38Å; E703-I707 WeakPolarHBondContact O-CD1 3.39Å; E703-I707 VanDerWaalsContact O-CG1 3.24Å; E703-I707 WeakPolarHBondContact O-CG1 3.07Å; E703-I707 PolarHBondContact O-N 2.83Å
704	E	92.9	Very high	92.4	Very high	129 Å²	129	112.7 Å²	112.7	60%	0.603	53%	0.53	S	S	*	.	H	α-helix	trans	-63.4	-41.3	174.6	-173.4	-179.6	178.1	0	0	111.8	A700 K701 I707 R708	A700-E704 WeakPolarHBondContact O-CB 3.36Å; A700-E704 PolarHBondContact O-N 2.98Å; K701-E704 PolarHBondContact O-N 3.48Å; E704-I707 PolarHBondContact O-N 2.67Å; E704-R708 PolarHBondContact O-N 3.39Å
705	E	93.3	Very high	92.5	Very high	125 Å²	125	113.9 Å²	113.9	58%	0.584	53%	0.534	S	S	*	.	H	α-helix	trans	-62.3	-49.1	175.4	-172.1	160.9	-134.9	0	0	110.8	K701 I707 R708 E709	K701-E705 VanDerWaalsContact O-CB 3.29Å; K701-E705 WeakPolarHBondContact O-CB 3.43Å; K701-E705 PolarHBondContact O-N 2.7Å; E705-I707 VanDerWaalsContact C-N 3.33Å; E705-I707 PolarHBondContact O-N 3.37Å; E705-R708 WeakPolarHBondContact O-CB 3.48Å; E705-R708 PolarHBondContact O-N 2.94Å; E705-R708 VanDerWaalsContact O-N 3.12Å; E705-E709 WeakPolarHBondContact O-CG 3.49Å; E705-E709 PolarHBondContact O-N 3.48Å
706	R	94	Very high	92.6	Very high	122 Å²	122	113 Å²	113	46%	0.46	53%	0.527	S	S	.	.	H	α-helix	trans	-57	-41.4	172.9	-80.2	-175.8	59	-105.7	-27.2	113.6	E702 E703 R708 E709 E710	E702-R706 WeakPolarHBondContact O-CG 3.47Å; E702-R706 PolarHBondContact O-N 3.26Å; E702-R706 VanDerWaalsContact O-N 3.15Å; E703-R706 PolarHBondContact O-N 2.86Å; E703-R706 IonicContact OE1-CZ 2.77Å; E703-R706 IonicContact OE1-NH1 2.7Å; E703-R706 PolarHBondContact OE1-NH1 3.47Å; E703-R706 IonicContact OE2-CZ 3.7Å; E703-R706 IonicContact OE2-NH1 3.88Å; E703-R706 PolarHBondContact OE2-NH1 3.11Å; R706-R708 VanDerWaalsContact C-N 3.33Å; R706-E709 PolarHBondContact O-N 3.46Å; R706-E710 PolarHBondContact O-N 3.17Å
707	I	93.8	Very high	92.7	Very high	100 Å²	100	114.4 Å²	114.4	51%	0.513	54%	0.536	S	S	.	.	H	α-helix	trans	-67.8	-36	178.5	-71.8	166	0	0	0	110.8	E703 E704 E705 A711	E703-I707 HydrophobicContact CG-CD1 4.12Å; E703-I707 WeakPolarHBondContact O-CB 3.38Å; E703-I707 WeakPolarHBondContact O-CD1 3.39Å; E703-I707 VanDerWaalsContact O-CG1 3.24Å; E703-I707 WeakPolarHBondContact O-CG1 3.07Å; E703-I707 PolarHBondContact O-N 2.83Å; E704-I707 PolarHBondContact O-N 2.67Å; E705-I707 VanDerWaalsContact C-N 3.33Å; E705-I707 PolarHBondContact O-N 3.37Å; I707-A711 WeakPolarHBondContact O-CB 3.48Å; I707-A711 PolarHBondContact O-N 3.41Å; I707-A711 VanDerWaalsContact O-N 3.1Å
708	R	94.6	Very high	92.8	Very high	177 Å²	177	117.9 Å²	117.9	67%	0.668	55%	0.546	S	S	*	.	H	α-helix	trans	-65.6	-47.9	172.6	177	-178.3	-76.3	-162.3	-2.7	111.6	E704 E705 R706 E710 A711 E712	E704-R708 PolarHBondContact O-N 3.39Å; E705-R708 WeakPolarHBondContact O-CB 3.48Å; E705-R708 PolarHBondContact O-N 2.94Å; E705-R708 VanDerWaalsContact O-N 3.12Å; R706-R708 VanDerWaalsContact C-N 3.33Å; R708-E710 PolarHBondContact O-N 3.43Å; R708-A711 WeakPolarHBondContact O-CB 3.47Å; R708-A711 PolarHBondContact O-N 3.13Å; R708-E712 PolarHBondContact O-N 3.44Å
709	E	92.8	Very high	92.9	Very high	110 Å²	110	116.1 Å²	116.1	51%	0.514	54%	0.542	S	S	.	.	H	α-helix	trans	-58.7	-45.2	177.5	-71.3	-177	149.6	0	0	111.7	E705 R706 A711 E712 I713	E705-E709 WeakPolarHBondContact O-CG 3.49Å; E705-E709 PolarHBondContact O-N 3.48Å; R706-E709 PolarHBondContact O-N 3.46Å; E709-A711 VanDerWaalsContact C-N 3.31Å; E709-A711 PolarHBondContact O-N 2.78Å; E709-E712 PolarHBondContact O-N 3.29Å; E709-I713 WeakPolarHBondContact O-CB 3.29Å; E709-I713 VanDerWaalsContact O-CG1 3.27Å; E709-I713 WeakPolarHBondContact O-CG1 3.48Å; E709-I713 PolarHBondContact O-N 3.05Å
710	E	91.1	Very high	92.8	Very high	117 Å²	117	114.1 Å²	114.1	55%	0.547	54%	0.535	S	S	.	.	H	α-helix	trans	-62.3	-39.1	176.6	-167.5	-173.9	138.8	0	0	111.7	R706 R708 K714	R706-E710 PolarHBondContact O-N 3.17Å; R708-E710 PolarHBondContact O-N 3.43Å; E710-K714 WeakPolarHBondContact O-CB 3.31Å; E710-K714 PolarHBondContact O-N 3.42Å
711	A	93.6	Very high	92.7	Very high	57 Å²	57	113.9 Å²	113.9	47%	0.471	53%	0.533	S	S	.	.	H	α-helix	trans	-66.4	-41.8	176.3	0	0	0	0	0	112.6	I707 R708 E709 K714 E715	I707-A711 WeakPolarHBondContact O-CB 3.48Å; I707-A711 PolarHBondContact O-N 3.41Å; I707-A711 VanDerWaalsContact O-N 3.1Å; R708-A711 WeakPolarHBondContact O-CB 3.47Å; R708-A711 PolarHBondContact O-N 3.13Å; E709-A711 VanDerWaalsContact C-N 3.31Å; E709-A711 PolarHBondContact O-N 2.78Å; A711-K714 PolarHBondContact O-N 3.37Å; A711-E715 PolarHBondContact O-N 3.22Å
712	E	94.5	Very high	92.7	Very high	138 Å²	138	110.3 Å²	110.3	65%	0.645	52%	0.518	S	S	*	.	H	α-helix	trans	-68.5	-45.3	179.4	-172.7	165	-173.8	0	0	111.7	R708 E709 K714 E715 E716	R708-E712 PolarHBondContact O-N 3.44Å; E709-E712 PolarHBondContact O-N 3.29Å; E712-K714 VanDerWaalsContact C-N 3.26Å; E712-K714 PolarHBondContact O-N 3.03Å; E712-E715 PolarHBondContact O-N 3.35Å; E712-E715 VanDerWaalsContact O-N 3.14Å; E712-E716 PolarHBondContact O-N 2.99Å
713	I	92.3	Very high	92.7	Very high	111 Å²	111	108.5 Å²	108.5	57%	0.569	52%	0.519	S	S	*	.	H	α-helix	trans	-58.2	-40.6	173.2	-68.8	166.4	0	0	0	110.8	E709 E716 L717	E709-I713 WeakPolarHBondContact O-CB 3.29Å; E709-I713 VanDerWaalsContact O-CG1 3.27Å; E709-I713 WeakPolarHBondContact O-CG1 3.48Å; E709-I713 PolarHBondContact O-N 3.05Å; I713-E716 PolarHBondContact O-N 3.21Å; I713-L717 WeakPolarHBondContact O-CB 3.36Å; I713-L717 PolarHBondContact O-N 2.95Å
714	K	92.7	Very high	92.7	Very high	146 Å²	146	110.9 Å²	110.9	64%	0.635	53%	0.528	S	S	*	.	H	α-helix	trans	-68.9	-32.4	178.5	-174.4	175.7	-174.8	172.8	0	112.9	E710 A711 E712 R718	E710-K714 WeakPolarHBondContact O-CB 3.31Å; E710-K714 PolarHBondContact O-N 3.42Å; A711-K714 PolarHBondContact O-N 3.37Å; E712-K714 VanDerWaalsContact C-N 3.26Å; E712-K714 PolarHBondContact O-N 3.03Å; K714-R718 PolarHBondContact O-N 2.96Å
715	E	93.3	Very high	92.5	Very high	100 Å²	100	111.3 Å²	111.3	47%	0.467	53%	0.53	S	S	.	.	H	α-helix	trans	-73.6	-42.6	172	-178.7	138.5	-127	0	0	112.1	A711 E712 L717 R718 L719	A711-E715 PolarHBondContact O-N 3.22Å; E712-E715 PolarHBondContact O-N 3.35Å; E712-E715 VanDerWaalsContact O-N 3.14Å; E715-L717 VanDerWaalsContact C-N 3.29Å; E715-L717 PolarHBondContact O-N 3.38Å; E715-R718 WeakPolarHBondContact O-CB 3.47Å; E715-R718 PolarHBondContact O-N 2.82Å; E715-R718 VanDerWaalsContact O-N 3.1Å; E715-R718 IonicContact OE1-CZ 3.85Å; E715-R718 IonicContact OE1-NH1 2.88Å; E715-R718 PolarHBondContact OE1-NH1 3.26Å; E715-R718 IonicContact OE1-NH2 3.77Å; E715-L719 HydrophobicContact CG-CD1 4.04Å; E715-L719 HydrophobicContact CG-CG 4.37Å; E715-L719 WeakPolarHBondContact O-CG 3.49Å; E715-L719 PolarHBondContact O-N 3.49Å
716	E	92.4	Very high	92.4	Very high	106 Å²	106	111.4 Å²	111.4	50%	0.495	53%	0.529	S	S	.	.	H	α-helix	trans	-57.2	-45	173	-163.5	-143.6	132.3	0	0	110.5	E712 I713 R718 L719 R720	E712-E716 PolarHBondContact O-N 2.99Å; I713-E716 PolarHBondContact O-N 3.21Å; E716-R718 VanDerWaalsContact C-N 3.28Å; E716-R718 PolarHBondContact O-N 2.96Å; E716-L719 PolarHBondContact O-N 2.96Å; E716-R720 WeakPolarHBondContact O-CB 3.48Å; E716-R720 PolarHBondContact O-N 2.82Å; E716-R720 IonicContact OE1-NH1 3.09Å; E716-R720 PolarHBondContact OE1-NH1 2.76Å
717	L	90.5	Very high	92.2	Very high	123 Å²	123	111.9 Å²	111.9	64%	0.644	54%	0.536	S	S	*	.	H	α-helix	trans	-61	-37.2	178.1	-137.5	79.8	0	0	0	112.2	I713 E715 A721	I713-L717 WeakPolarHBondContact O-CB 3.36Å; I713-L717 PolarHBondContact O-N 2.95Å; E715-L717 VanDerWaalsContact C-N 3.29Å; E715-L717 PolarHBondContact O-N 3.38Å; L717-A721 WeakPolarHBondContact O-CB 3.25Å; L717-A721 PolarHBondContact O-N 2.9Å
718	R	93.9	Very high	91.9	Very high	124 Å²	124	114 Å²	114	47%	0.468	54%	0.541	S	S	.	.	H	α-helix	trans	-68.4	-50.6	176.7	-157.8	-166.2	83.7	-124.2	-6.2	111.1	K714 E715 E716 R720 A721 E722	K714-R718 PolarHBondContact O-N 2.96Å; E715-R718 WeakPolarHBondContact O-CB 3.47Å; E715-R718 PolarHBondContact O-N 2.82Å; E715-R718 VanDerWaalsContact O-N 3.1Å; E715-R718 IonicContact OE1-CZ 3.85Å; E715-R718 IonicContact OE1-NH1 2.88Å; E715-R718 PolarHBondContact OE1-NH1 3.26Å; E715-R718 IonicContact OE1-NH2 3.77Å; E716-R718 VanDerWaalsContact C-N 3.28Å; E716-R718 PolarHBondContact O-N 2.96Å; R718-R720 PolarHBondContact O-N 3.17Å; R718-A721 WeakPolarHBondContact O-CB 3.41Å; R718-A721 PolarHBondContact O-N 2.91Å; R718-E722 IonicContact CZ-OE1 3.49Å; R718-E722 IonicContact NE-OE1 3.94Å; R718-E722 PolarHBondContact NE-OE1 2.67Å; R718-E722 IonicContact NH2-OE1 2.65Å; R718-E722 PolarHBondContact NH2-OE1 3.27Å; R718-E722 WeakPolarHBondContact O-CG 3.46Å; R718-E722 PolarHBondContact O-N 2.88Å
719	L	93.5	Very high	91.6	Very high	90 Å²	90	112 Å²	112	47%	0.471	54%	0.539	S	S	.	.	H	α-helix	trans	-58.8	-37.6	177.2	-70	170.6	0	0	0	111.7	E715 E716 E722 A723	E715-L719 HydrophobicContact CG-CD1 4.04Å; E715-L719 HydrophobicContact CG-CG 4.37Å; E715-L719 WeakPolarHBondContact O-CG 3.49Å; E715-L719 PolarHBondContact O-N 3.49Å; E716-L719 PolarHBondContact O-N 2.96Å; L719-E722 PolarHBondContact O-N 2.88Å; L719-A723 WeakPolarHBondContact O-CB 3.41Å; L719-A723 PolarHBondContact O-N 3Å
720	R	90.3	Very high	91.4	Very high	148 Å²	148	115.8 Å²	115.8	56%	0.558	55%	0.549	S	S	*	.	H	α-helix	trans	-73.4	-26.7	176.9	-163.5	168.8	-171.5	163.6	-1.9	113.5	E716 R718 K724	E716-R720 WeakPolarHBondContact O-CB 3.48Å; E716-R720 PolarHBondContact O-N 2.82Å; E716-R720 IonicContact OE1-NH1 3.09Å; E716-R720 PolarHBondContact OE1-NH1 2.76Å; R718-R720 PolarHBondContact O-N 3.17Å; R720-K724 WeakPolarHBondContact O-CG 3.4Å; R720-K724 PolarHBondContact O-N 2.81Å
721	A	90.6	Very high	91.2	Very high	54 Å²	54	115.4 Å²	115.4	45%	0.446	55%	0.55	S	S	.	*	H	α-helix	trans	-72.5	-48.8	168.8	0	0	0	0	0	111.2	L717 R718 A723 K724 E725	L717-A721 WeakPolarHBondContact O-CB 3.25Å; L717-A721 PolarHBondContact O-N 2.9Å; R718-A721 WeakPolarHBondContact O-CB 3.41Å; R718-A721 PolarHBondContact O-N 2.91Å; A721-A723 VanDerWaalsContact C-N 3.26Å; A721-A723 PolarHBondContact O-N 2.84Å; A721-K724 PolarHBondContact O-N 2.95Å; A721-K724 VanDerWaalsContact O-N 3.14Å; A721-E725 PolarHBondContact O-N 2.87Å
722	E	93.1	Very high	90.8	Very high	59 Å²	59	118 Å²	118	28%	0.276	55%	0.553	S	S	.	*	H	α-helix	trans	-56.9	-38.2	175.2	-68.4	177	-141.3	0	0	112.2	R718 L719 E725 K726	R718-E722 IonicContact CZ-OE1 3.49Å; R718-E722 IonicContact NE-OE1 3.94Å; R718-E722 PolarHBondContact NE-OE1 2.67Å; R718-E722 IonicContact NH2-OE1 2.65Å; R718-E722 PolarHBondContact NH2-OE1 3.27Å; R718-E722 WeakPolarHBondContact O-CG 3.46Å; R718-E722 PolarHBondContact O-N 2.88Å; L719-E722 PolarHBondContact O-N 2.88Å; E722-E725 PolarHBondContact O-N 2.84Å; E722-K726 WeakPolarHBondContact O-CD 3.4Å; E722-K726 WeakPolarHBondContact O-CG 3.36Å; E722-K726 PolarHBondContact O-N 2.86Å; E722-K726 VanDerWaalsContact O-N 3.11Å; E722-K726 IonicContact OE2-NZ 3.14Å
723	A	92.5	Very high	90.4	Very high	55 Å²	55	118.4 Å²	118.4	46%	0.455	55%	0.552	S	S	.	*	H	α-helix	trans	-66	-44.2	176	0	0	0	0	0	112.5	L719 A721 E725 K726 E727	L719-A723 WeakPolarHBondContact O-CB 3.41Å; L719-A723 PolarHBondContact O-N 3Å; A721-A723 VanDerWaalsContact C-N 3.26Å; A721-A723 PolarHBondContact O-N 2.84Å; A723-E725 VanDerWaalsContact C-N 3.32Å; A723-E725 PolarHBondContact O-N 3.43Å; A723-K726 PolarHBondContact O-N 2.81Å; A723-E727 WeakPolarHBondContact O-CB 3.47Å; A723-E727 PolarHBondContact O-N 2.86Å
724	K	90.4	Very high	90	Very high	137 Å²	137	117.1 Å²	117.1	60%	0.596	54%	0.544	S	S	*	.	H	α-helix	trans	-65.1	-34.5	175.9	-77.2	176.8	176.1	-177.8	0	112.6	R720 A721 K728	R720-K724 WeakPolarHBondContact O-CG 3.4Å; R720-K724 PolarHBondContact O-N 2.81Å; A721-K724 PolarHBondContact O-N 2.95Å; A721-K724 VanDerWaalsContact O-N 3.14Å; K724-K728 WeakPolarHBondContact O-CB 3.37Å; K724-K728 PolarHBondContact O-N 2.9Å
725	E	89.3	Confident	89.6	Confident	139 Å²	139	119.7 Å²	119.7	65%	0.65	55%	0.55	S	S	*	.	H	α-helix	trans	-66.4	-47.1	175.5	-173.8	163.3	-141	0	0	111.3	A721 E722 A723 E727 K728 E729	A721-E725 PolarHBondContact O-N 2.87Å; E722-E725 PolarHBondContact O-N 2.84Å; A723-E725 VanDerWaalsContact C-N 3.32Å; A723-E725 PolarHBondContact O-N 3.43Å; E725-E727 VanDerWaalsContact C-N 3.33Å; E725-E727 PolarHBondContact O-N 3.26Å; E725-K728 WeakPolarHBondContact O-CB 3.32Å; E725-K728 PolarHBondContact O-N 2.82Å; E725-E729 PolarHBondContact O-N 2.84Å
726	K	91.2	Very high	89	Confident	127 Å²	127	120.3 Å²	120.3	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-62.8	-36	174.3	-71.2	163.6	-176.5	157.6	0	112.8	E722 A723 R730	E722-K726 WeakPolarHBondContact O-CD 3.4Å; E722-K726 WeakPolarHBondContact O-CG 3.36Å; E722-K726 PolarHBondContact O-N 2.86Å; E722-K726 VanDerWaalsContact O-N 3.11Å; E722-K726 IonicContact OE2-NZ 3.14Å; A723-K726 PolarHBondContact O-N 2.81Å; K726-R730 WeakPolarHBondContact O-CB 3.27Å; K726-R730 PolarHBondContact O-N 3.24Å
727	E	89.4	Confident	88.3	Confident	131 Å²	131	121.5 Å²	121.5	61%	0.612	56%	0.561	S	S	*	*	H	α-helix	trans	-64.6	-47	173	-177.1	175.1	-149.3	0	0	111.5	A723 E725 R730 L731	A723-E727 WeakPolarHBondContact O-CB 3.47Å; A723-E727 PolarHBondContact O-N 2.86Å; E725-E727 VanDerWaalsContact C-N 3.33Å; E725-E727 PolarHBondContact O-N 3.26Å; E727-R730 PolarHBondContact O-N 3.31Å; E727-L731 WeakPolarHBondContact O-CB 3.22Å; E727-L731 PolarHBondContact O-N 3.03Å
728	K	88	Confident	87.8	Confident	144 Å²	144	122 Å²	122	63%	0.626	56%	0.558	S	S	*	*	H	α-helix	trans	-59.7	-47.3	176	-177.3	-163.5	168	-156.9	0	111.7	K724 E725 R730 L731 E732	K724-K728 WeakPolarHBondContact O-CB 3.37Å; K724-K728 PolarHBondContact O-N 2.9Å; E725-K728 WeakPolarHBondContact O-CB 3.32Å; E725-K728 PolarHBondContact O-N 2.82Å; K728-R730 VanDerWaalsContact C-N 3.33Å; K728-R730 PolarHBondContact O-N 2.94Å; K728-L731 PolarHBondContact O-N 2.84Å; K728-E732 WeakPolarHBondContact O-CB 3.4Å; K728-E732 PolarHBondContact O-N 2.93Å
729	E	88.3	Confident	86.8	Confident	135 Å²	135	123.8 Å²	123.8	63%	0.631	57%	0.569	S	S	*	*	H	α-helix	trans	-59.3	-44	177.8	-172.1	-171.2	-176.1	0	0	111.4	E725 L731 E732 K733	E725-E729 PolarHBondContact O-N 2.84Å; E729-L731 PolarHBondContact O-N 2.89Å; E729-E732 PolarHBondContact O-N 2.8Å; E729-K733 WeakPolarHBondContact O-CB 3.13Å; E729-K733 PolarHBondContact O-N 2.92Å
730	R	88.6	Confident	85.8	Confident	190 Å²	190	122.5 Å²	122.5	72%	0.717	57%	0.572	S	S	*	*	H	α-helix	trans	-61	-43.1	175.6	-178.7	179.3	174.4	-175	-1.9	112.2	K726 E727 K728 K733 E734	K726-R730 WeakPolarHBondContact O-CB 3.27Å; K726-R730 PolarHBondContact O-N 3.24Å; E727-R730 PolarHBondContact O-N 3.31Å; K728-R730 VanDerWaalsContact C-N 3.33Å; K728-R730 PolarHBondContact O-N 2.94Å; R730-K733 PolarHBondContact O-N 3.31Å; R730-E734 PolarHBondContact O-N 3.38Å
731	L	86.2	Confident	84.7	Confident	110 Å²	110	118.3 Å²	118.3	58%	0.576	57%	0.569	S	S	*	*	H	α-helix	trans	-69.8	-35.9	179.7	-142.7	170.8	0	0	0	111.5	E727 K728 E729 R735	E727-L731 WeakPolarHBondContact O-CB 3.22Å; E727-L731 PolarHBondContact O-N 3.03Å; K728-L731 PolarHBondContact O-N 2.84Å; E729-L731 PolarHBondContact O-N 2.89Å; L731-R735 WeakPolarHBondContact O-CB 3.48Å; L731-R735 PolarHBondContact O-N 2.82Å
732	E	86.8	Confident	83.4	Confident	110 Å²	110	119 Å²	119	51%	0.514	58%	0.575	S	S	.	*	H	α-helix	trans	-67	-41.5	173	-177	155.4	-158.4	0	0	112	K728 E729 R735 L736	K728-E732 WeakPolarHBondContact O-CB 3.4Å; K728-E732 PolarHBondContact O-N 2.93Å; E729-E732 PolarHBondContact O-N 2.8Å; E732-R735 PolarHBondContact O-N 3.47Å; E732-L736 HydrophobicContact CG-CD1 4.46Å; E732-L736 PolarHBondContact O-N 2.71Å
733	K	85.8	Confident	81.9	Confident	147 Å²	147	119.7 Å²	119.7	64%	0.639	59%	0.59	S	S	*	*	H	α-helix	trans	-61.4	-45.9	172.7	-174	175.2	179.8	177.3	0	112.1	E729 R730 R735 L736 E737	E729-K733 WeakPolarHBondContact O-CB 3.13Å; E729-K733 PolarHBondContact O-N 2.92Å; R730-K733 PolarHBondContact O-N 3.31Å; K733-R735 VanDerWaalsContact C-N 3.29Å; K733-R735 PolarHBondContact O-N 3.29Å; K733-L736 PolarHBondContact O-N 3.13Å; K733-E737 WeakPolarHBondContact O-CB 3.21Å; K733-E737 PolarHBondContact O-N 3.16Å
734	E	84.1	Confident	80.3	Confident	84 Å²	84	120.9 Å²	120.9	39%	0.393	60%	0.6	S	S	.	*	H	α-helix	trans	-62.6	-36.2	175.9	-165.7	-168.3	129.4	0	0	111.8	R730 E737 K738	R730-E734 PolarHBondContact O-N 3.38Å; E734-E737 PolarHBondContact O-N 3.41Å; E734-K738 HydrophobicContact CG-CD 4.38Å; E734-K738 WeakPolarHBondContact O-CB 3.41Å; E734-K738 WeakPolarHBondContact O-CG 3.27Å; E734-K738 PolarHBondContact O-N 2.83Å; E734-K738 WeakPolarHBondContact OE1-CE 3.44Å; E734-K738 IonicContact OE1-NZ 2.71Å; E734-K738 PolarHBondContact OE1-NZ 2.68Å
735	R	83.4	Confident	78.7	Confident	200 Å²	200	118.5 Å²	118.5	76%	0.755	61%	0.606	S	S	*	*	H	α-helix	trans	-67.9	-37.5	175.1	-175.2	175.1	-180	159.3	0.4	112.5	L731 E732 K733 K739	L731-R735 WeakPolarHBondContact O-CB 3.48Å; L731-R735 PolarHBondContact O-N 2.82Å; E732-R735 PolarHBondContact O-N 3.47Å; K733-R735 VanDerWaalsContact C-N 3.29Å; K733-R735 PolarHBondContact O-N 3.29Å; R735-K739 WeakPolarHBondContact O-CB 3.49Å; R735-K739 PolarHBondContact O-N 2.63Å; R735-K739 VanDerWaalsContact O-N 3.08Å
736	L	80.2	Confident	76.8	Confident	114 Å²	114	115.9 Å²	115.9	60%	0.597	61%	0.608	S	S	*	*	H	α-helix	trans	-66.6	-43.6	172.5	-80.2	162	0	0	0	111.5	E732 K733 K739 A740	E732-L736 HydrophobicContact CG-CD1 4.46Å; E732-L736 PolarHBondContact O-N 2.71Å; K733-L736 PolarHBondContact O-N 3.13Å; L736-K739 WeakPolarHBondContact O-CB 3.24Å; L736-K739 PolarHBondContact O-N 3.28Å; L736-A740 PolarHBondContact O-N 3.47Å
737	E	79.2	Confident	74.8	Confident	131 Å²	131	117 Å²	117	61%	0.612	62%	0.62	S	S	*	*	H	α-helix	trans	-63.5	-45.2	177.4	-173.1	167.8	-168.1	0	0	112	K733 E734 K739 A740 A741	K733-E737 WeakPolarHBondContact O-CB 3.21Å; K733-E737 PolarHBondContact O-N 3.16Å; E734-E737 PolarHBondContact O-N 3.41Å; E737-K739 VanDerWaalsContact C-N 3.28Å; E737-K739 PolarHBondContact O-N 3.42Å; E737-A740 PolarHBondContact O-N 2.83Å; E737-A740 VanDerWaalsContact O-N 3.15Å; E737-A741 PolarHBondContact O-N 3.18Å
738	K	78.1	Confident	72.7	Confident	133 Å²	133	116.4 Å²	116.4	58%	0.578	63%	0.628	S	S	*	*	H	α-helix	trans	-61.6	-33.9	172.3	-77.9	172.8	171.7	170.5	0	112.8	E734 A742	E734-K738 HydrophobicContact CG-CD 4.38Å; E734-K738 WeakPolarHBondContact O-CB 3.41Å; E734-K738 WeakPolarHBondContact O-CG 3.27Å; E734-K738 PolarHBondContact O-N 2.83Å; E734-K738 WeakPolarHBondContact OE1-CE 3.44Å; E734-K738 IonicContact OE1-NZ 2.71Å; E734-K738 PolarHBondContact OE1-NZ 2.68Å; K738-A742 WeakPolarHBondContact O-CB 3.38Å; K738-A742 PolarHBondContact O-N 3.42Å
739	K	74.6	Confident	70.4	Confident	161 Å²	161	117.1 Å²	117.1	70%	0.7	64%	0.638	S	S	*	*	H	α-helix	trans	-71.1	-35.7	174.2	-166.7	179.3	-179.4	-173.7	0	112.2	R735 L736 E737 A743	R735-K739 WeakPolarHBondContact O-CB 3.49Å; R735-K739 PolarHBondContact O-N 2.63Å; R735-K739 VanDerWaalsContact O-N 3.08Å; L736-K739 WeakPolarHBondContact O-CB 3.24Å; L736-K739 PolarHBondContact O-N 3.28Å; E737-K739 VanDerWaalsContact C-N 3.28Å; E737-K739 PolarHBondContact O-N 3.42Å; K739-A743 PolarHBondContact O-N 3.46Å
740	A	71.7	Confident	68.2	Low	63 Å²	63	115.6 Å²	115.6	52%	0.521	64%	0.64	S	S	.	*	H	α-helix	trans	-68.3	-43.3	173.2	0	0	0	0	0	111.8	L736 E737 A742 A743 A744	L736-A740 PolarHBondContact O-N 3.47Å; E737-A740 PolarHBondContact O-N 2.83Å; E737-A740 VanDerWaalsContact O-N 3.15Å; A740-A742 VanDerWaalsContact C-N 3.34Å; A740-A742 PolarHBondContact O-N 3.23Å; A740-A743 PolarHBondContact O-N 2.91Å; A740-A743 VanDerWaalsContact O-N 3.14Å; A740-A744 PolarHBondContact O-N 2.95Å
741	A	67.1	Low	66	Low	60 Å²	60	113.4 Å²	113.4	50%	0.496	65%	0.648	S	S	.	*	H	α-helix	trans	-61	-40.8	174.7	0	0	0	0	0	112.3	E737 A743 A744 A745	E737-A741 PolarHBondContact O-N 3.18Å; A741-A743 VanDerWaalsContact C-N 3.31Å; A741-A743 PolarHBondContact O-N 2.97Å; A741-A744 PolarHBondContact O-N 3.25Å; A741-A745 PolarHBondContact O-N 2.96Å
742	A	64.4	Low	63.8	Low	70 Å²	70	113.8 Å²	113.8	58%	0.579	66%	0.657	S	S	*	*	H	α-helix	trans	-63.9	-33	174.4	0	0	0	0	0	113.1	K738 A740	K738-A742 WeakPolarHBondContact O-CB 3.38Å; K738-A742 PolarHBondContact O-N 3.42Å; A740-A742 VanDerWaalsContact C-N 3.34Å; A740-A742 PolarHBondContact O-N 3.23Å
743	A	60.1	Low	61.6	Low	72 Å²	72	116.4 Å²	116.4	60%	0.595	67%	0.673	S	S	*	*	H	α-helix	trans	-74.6	-34	173.4	0	0	0	0	0	112.7	K739 A740 A741 A745	K739-A743 PolarHBondContact O-N 3.46Å; A740-A743 PolarHBondContact O-N 2.91Å; A740-A743 VanDerWaalsContact O-N 3.14Å; A741-A743 VanDerWaalsContact C-N 3.31Å; A741-A743 PolarHBondContact O-N 2.97Å; A743-A745 VanDerWaalsContact C-N 3.29Å; A743-A745 PolarHBondContact O-N 3.11Å
744	A	59.9	Low	59.7	Low	80 Å²	80	114.8 Å²	114.8	66%	0.661	68%	0.677	S	S	*	*	H	α-helix	trans	-70.6	-21.4	178.1	0	0	0	0	0	113.7	A740 A741 A746	A740-A744 PolarHBondContact O-N 2.95Å; A741-A744 PolarHBondContact O-N 3.25Å; A744-A746 PolarHBondContact O-N 2.82Å; A744-A746 VanDerWaalsContact O-N 3.14Å
745	A	56.8	Low	57.8	Low	88 Å²	88	115.7 Å²	115.7	73%	0.727	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-1.4	178.5	0	0	0	0	0	114.8	A741 A743	A741-A745 PolarHBondContact O-N 2.96Å; A743-A745 VanDerWaalsContact C-N 3.29Å; A743-A745 PolarHBondContact O-N 3.11Å
746	A	49.9	Very low	55.6	Low	84 Å²	84	112.2 Å²	112.2	69%	0.694	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	30.8	-168.3	0	0	0	0	0	115.3	A744	A744-A746 PolarHBondContact O-N 2.82Å; A744-A746 VanDerWaalsContact O-N 3.14Å
747	N	48.1	Very low	53.6	Low	150 Å²	150	112.7 Å²	112.7	80%	0.802	70%	0.702	S	S	*	*			trans	-154.7	120.6	167.9	-154.1	-2.2	0	0	0	113.8
748	P	44.9	Very low	51.6	Low	118 Å²	118	110.5 Å²	110.5	77%	0.766	71%	0.706	S	S	*	*			trans	-111.5	109.9	-177.5	36.5	-27	0	0	0	114.6
749	N	39.8	Very low	49.7	Very low	159 Å²	159	110.7 Å²	110.7	85%	0.85	72%	0.718	S	S	*	*			trans	-163.2	136.7	137.2	-139.2	6	0	0	0	112.3
750	P	42.7	Very low	48.1	Very low	103 Å²	103	107.6 Å²	107.6	67%	0.669	72%	0.715	S	S	*	*			trans	-111.3	156.6	-179.2	38.5	-30.6	0	0	0	114.3
751	T	41.8	Very low	46.5	Very low	145 Å²	145	112.9 Å²	112.9	89%	0.89	73%	0.728	S	S	*	*			trans	-169.7	130.1	138.8	7.4	0	0	0	0	110.7
752	P	39.5	Very low	45.1	Very low	117 Å²	117	114.9 Å²	114.9	76%	0.76	74%	0.739	S	S	*	*			trans	-111.3	140.5	-179.8	37.5	-29.6	0	0	0	113.7
753	I	41.8	Very low	43.6	Very low	165 Å²	165	117 Å²	117	85%	0.846	75%	0.749	S	S	*	*			trans	-143.7	127.5	162.3	-39.6	178.8	0	0	0	109.8
754	P	46	Very low	42.7	Very low	113 Å²	113	118.2 Å²	118.2	73%	0.734	76%	0.76	S	S	*	*			trans	-85.3	-171.1	169.8	40.2	-38.3	0	0	0	110.5
755	P	44.7	Very low	41.8	Very low	103 Å²	103	122.2 Å²	122.2	67%	0.669	76%	0.764	S	S	*	*			cis	-148.3	-160.8	16.8	44.1	-21.3	0	0	0	117.1
756	T	37.1	Very low	40.9	Very low	127 Å²	127	125.1 Å²	125.1	78%	0.779	76%	0.763	S	S	*	*			trans	71.8	128.5	155.5	44.3	0	0	0	0	120.9
757	P	38.3	Very low	40.2	Very low	125 Å²	125	129.7 Å²	129.7	81%	0.812	77%	0.77	S	S	*	*			trans	-109.3	152.3	173.9	39.1	-31.5	0	0	0	114.5
758	A	35.5	Very low	39.7	Very low	84 Å²	84	128.1 Å²	128.1	69%	0.694	77%	0.768	S	S	*	*			trans	-178.1	103	144.3	0	0	0	0	0	116.6
759	T	38.4	Very low	39.2	Very low	137 Å²	137	129.5 Å²	129.5	84%	0.84	77%	0.767	S	S	*	*			trans	69.3	172.6	136.6	70.7	0	0	0	0	119.2
760	P	41.8	Very low	39.3	Very low	96 Å²	96	127.7 Å²	127.7	62%	0.623	76%	0.764	S	S	*	*				-139.4	-163.3	-95.7	38.7	-15.5	0	0	0	116.9
761	H	38.5	Very low	39	Very low	174 Å²	174	128.4 Å²	128.4	81%	0.806	77%	0.769	S	S	*	*			trans	82.1	143.1	176.7	-52.1	-69.8	0	0	0	114.5
762	S	36.5	Very low	39	Very low	103 Å²	103	126.7 Å²	126.7	72%	0.72	76%	0.76	S	S	*	*			cis	167.3	155.4	-1.1	-89	0	0	0	0	103.3
763	S	32.7	Very low	38.5	Very low	113 Å²	113	128.8 Å²	128.8	79%	0.79	76%	0.764	S	S	*	*			cis	-174.7	138.1	-1.9	45.6	0	0	0	0	109.8
764	A	42.7	Very low	37.9	Very low	99 Å²	99	125.2 Å²	125.2	82%	0.818	75%	0.754	S	S	*	*			trans	-163.5	126.2	162.8	0	0	0	0	0	115.6
765	Q	41.2	Very low	37.2	Very low	163 Å²	163	125.5 Å²	125.5	76%	0.762	75%	0.754	S	S	*	*			trans	68.5	107.8	134.4	-156.2	158	-8.7	0	0	124.2
766	Q	37.5	Very low	36.6	Very low	149 Å²	149	129 Å²	129	70%	0.696	76%	0.761	S	S	*	*			trans	73.8	100.7	139.5	-74.4	167.2	-19.8	0	0	124.1
767	Q	34	Very low	36.3	Very low	181 Å²	181	128.5 Å²	128.5	85%	0.846	76%	0.758	S	S	*	*				60.2	157	127.2	-64.5	-170	4.8	0	0	122.4
768	P	37.6	Very low	36	Very low	116 Å²	116	127.7 Å²	127.7	75%	0.753	76%	0.755	S	S	*	*			cis	-113	159.2	-9.3	38.4	-27.3	0	0	0	114
769	I	35.4	Very low	35.9	Very low	147 Å²	147	128.4 Å²	128.4	75%	0.754	76%	0.761	S	S	*	*			trans	-133	128.1	-179.6	-69.3	174.5	0	0	0	110.4
770	P	41.9	Very low	35.6	Very low	122 Å²	122	130 Å²	130	79%	0.792	76%	0.759	S	S	*	*			trans	-87.7	146.2	150.2	33.4	-29.6	0	0	0	111.2
771	P	36.9	Very low	35.2	Very low	117 Å²	117	131.6 Å²	131.6	76%	0.76	76%	0.761	S	S	*	*			trans	-113.7	177.2	-135.9	4.9	19.2	0	0	0	116.6
772	P	41.6	Very low	35	Very low	109 Å²	109	130.7 Å²	130.7	71%	0.708	76%	0.757	S	S	*	*			trans	-126.4	-159.5	-167.5	43.5	-27.8	0	0	0	114.6
773	L	29.4	Very low	34.9	Very low	161 Å²	161	133.9 Å²	133.9	84%	0.843	76%	0.76	S	S	*	*			trans	108.1	158.9	143	-133.5	80.1	0	0	0	119.1
774	S	28.9	Very low	35	Very low	90 Å²	90	133.5 Å²	133.5	63%	0.629	76%	0.758	S	S	*	*			trans	-138.7	162.5	172	59.5	0	0	0	0	110.1
775	T	30	Very low	34.8	Very low	119 Å²	119	133.4 Å²	133.4	73%	0.73	76%	0.757	S	S	*	*			trans	77.8	120	174.7	68.7	0	0	0	0	119.4
776	Q	32.4	Very low	34.3	Very low	178 Å²	178	134.8 Å²	134.8	83%	0.832	76%	0.764	S	S	*	*			trans	51	139.3	139.5	-54.9	-176.5	10.9	0	0	119.9
777	T	30.9	Very low	34	Very low	116 Å²	116	136.2 Å²	136.2	71%	0.712	77%	0.77	S	S	*	*			cis	-158.6	155	14	-15.2	0	0	0	0	112.1
778	S	31.6	Very low	34.1	Very low	108 Å²	108	134 Å²	134	76%	0.755	77%	0.771	S	S	*	*			trans	62.5	128.8	151.8	-57.8	0	0	0	0	122.4
779	A	34.4	Very low	33.9	Very low	98 Å²	98	133.3 Å²	133.3	81%	0.81	77%	0.769	S	S	*	*			trans	65.8	133.6	154	0	0	0	0	0	118.9
780	E	31.3	Very low	33.8	Very low	171 Å²	171	133.1 Å²	133.1	80%	0.799	78%	0.775	S	S	*	*			cis	-161.9	165.3	-10.3	-149.7	-176.6	108.2	0	0	111.3
781	I	33.8	Very low	33.6	Very low	129 Å²	129	132.5 Å²	132.5	66%	0.662	77%	0.771	S	S	*	*			trans	80.9	116.3	161	-57	-176.7	0	0	0	120.3
782	Q	34	Very low	33.4	Very low	156 Å²	156	133.1 Å²	133.1	73%	0.729	77%	0.772	S	S	*	*			trans	80.3	113.8	150.1	-78.7	169.7	-16.9	0	0	124.9
783	Q	34.9	Very low	33	Very low	169 Å²	169	133.3 Å²	133.3	79%	0.79	77%	0.772	S	S	*	*			trans	67.3	138.7	132.2	-66.5	171.3	6.7	0	0	120.1
784	S	34.9	Very low	33	Very low	106 Å²	106	133.4 Å²	133.4	74%	0.741	77%	0.77	S	S	*	*			cis	-167.2	148.7	-7.1	49.6	0	0	0	0	112.6
785	A	37.5	Very low	33.2	Very low	97 Å²	97	136.6 Å²	136.6	80%	0.802	78%	0.778	S	S	*	*			trans	64.2	156.3	164.1	0	0	0	0	0	119
786	Q	32.5	Very low	33.5	Very low	191 Å²	191	135 Å²	135	89%	0.893	78%	0.777	S	S	*	*			cis	-164.6	145.5	-43.1	-145.3	168.4	3.3	0	0	108.2
787	Q	29.9	Very low	33.6	Very low	179 Å²	179	133.3 Å²	133.3	84%	0.836	77%	0.774	S	S	*	*			trans	-110.3	166.9	170.5	-75.6	-174.4	-33.8	0	0	110.9
788	P	36.1	Very low	33.8	Very low	134 Å²	134	134.8 Å²	134.8	87%	0.87	78%	0.776	S	S	*	*				-142.6	177.9	121.8	39.6	-27.3	0	0	0	114.4
789	S	33	Very low	34.3	Very low	102 Å²	102	134.7 Å²	134.7	71%	0.713	77%	0.772	S	S	*	*			trans	-151.3	159.9	172.7	62.1	0	0	0	0	112.6
790	V	33.2	Very low	34.1	Very low	143 Å²	143	133.4 Å²	133.4	87%	0.867	76%	0.762	S	S	*	*			trans	60.3	155.4	170.8	-59.1	0	0	0	0	120
791	P	38.9	Very low	34.3	Very low	109 Å²	109	131.8 Å²	131.8	71%	0.708	76%	0.756	S	S	*	*			trans	-126	167.9	-164.3	41.8	-26	0	0	0	117
792	V	31.6	Very low	34.2	Very low	130 Å²	130	129.8 Å²	129.8	79%	0.788	75%	0.753	S	S	*	*			trans	63.7	141.7	167.9	-120.9	0	0	0	0	115.6
793	T	33.4	Very low	34.7	Very low	114 Å²	114	127.2 Å²	127.2	70%	0.699	75%	0.75	S	S	*	*			cis	-158.1	136.6	23.6	-42.2	0	0	0	0	114
794	M	29.7	Very low	34.7	Very low	163 Å²	163	125.4 Å²	125.4	80%	0.803	75%	0.751	S	S	*	*			trans	66	142.9	149	-75.7	-67.9	179.2	0	0	125.3
795	I	33.9	Very low	34.7	Very low	156 Å²	156	125.8 Å²	125.8	80%	0.8	75%	0.753	S	S	*	*			trans	85.1	98.8	151.6	-64.3	153.8	0	0	0	121.4
796	A	35.6	Very low	34.7	Very low	86 Å²	86	125.4 Å²	125.4	71%	0.711	75%	0.751	S	S	*	*				60.1	122.1	129.2	0	0	0	0	0	126.1
797	N	34.1	Very low	34.8	Very low	142 Å²	142	125.1 Å²	125.1	76%	0.759	75%	0.749	S	S	*	*				84.6	97	127.3	-88.4	19	0	0	0	126.2
798	I	36.3	Very low	35.5	Very low	147 Å²	147	121.5 Å²	121.5	75%	0.754	74%	0.741	S	S	*	*			trans	63.2	167.8	130.1	11.5	178.8	0	0	0	121.3
799	P	40.5	Very low	35.2	Very low	106 Å²	106	122.8 Å²	122.8	69%	0.688	74%	0.736	S	S	*	*				-143.6	-176.4	-109.5	50.1	-31.5	0	0	0	120.2
800	A	32.1	Very low	35.9	Very low	71 Å²	71	123.3 Å²	123.3	59%	0.587	74%	0.737	S	S	*	*			trans	86.6	161.2	135.1	0	0	0	0	0	124
801	M	34.4	Very low	36	Very low	138 Å²	138	121.6 Å²	121.6	68%	0.68	73%	0.726	S	S	*	*			trans	85.8	112.5	169.9	-49.3	-156.9	78.1	0	0	116.6
802	S	31.3	Very low	35.8	Very low	86 Å²	86	123.6 Å²	123.6	60%	0.601	73%	0.73	S	S	*	*			cis	81.2	154.9	49	83.2	0	0	0	0	113.5
803	P	44.8	Very low	35.9	Very low	102 Å²	102	121.6 Å²	121.6	66%	0.662	72%	0.722	S	S	*	*			cis	-149.9	-174.6	24.3	42.3	-20.6	0	0	0	118.8
804	T	35.1	Very low	36.4	Very low	132 Å²	132	121.7 Å²	121.7	81%	0.81	72%	0.724	S	S	*	*			trans	62.2	144.1	155.2	43	0	0	0	0	120.1
805	S	36	Very low	36.6	Very low	113 Å²	113	120.4 Å²	120.4	79%	0.79	73%	0.726	S	S	*	*			cis	-162.9	174.1	-9.3	59.9	0	0	0	0	107.8
806	A	36.5	Very low	36.5	Very low	90 Å²	90	118.4 Å²	118.4	74%	0.744	73%	0.726	S	S	*	*			cis	-135.1	-147	6.1	0	0	0	0	0	108.5
807	Q	34.5	Very low	36.2	Very low	184 Å²	184	118.7 Å²	118.7	86%	0.86	73%	0.728	S	S	*	*			cis	-139.5	175.1	2.4	-116.1	-136.6	6.3	0	0	109
808	P	45.3	Very low	36	Very low	104 Å²	104	116.9 Å²	116.9	68%	0.675	73%	0.733	S	S	*	*			trans	-103.6	140.1	-143.3	39.8	-38	0	0	0	117.9
809	Q	29.7	Very low	36.5	Very low	160 Å²	160	116.5 Å²	116.5	75%	0.748	74%	0.737	S	S	*	*			trans	-44.1	161.1	142.2	-71.8	-106	-24.6	0	0	112.6
810	P	46.3	Very low	36.5	Very low	114 Å²	114	116.9 Å²	116.9	74%	0.74	74%	0.74	S	S	*	*				-147.2	118.3	96.4	38	-20.5	0	0	0	114.3
811	V	35.1	Very low	37.3	Very low	107 Å²	107	119.4 Å²	119.4	65%	0.648	75%	0.748	S	S	*	*				78.1	171.8	95.7	-50.3	0	0	0	0	115.3
812	L	35.7	Very low	37.2	Very low	151 Å²	151	118.7 Å²	118.7	79%	0.791	75%	0.753	S	S	*	*			cis	-146.6	164.6	-4.9	-98.9	-168.2	0	0	0	104.6
813	S	32.9	Very low	37.5	Very low	87 Å²	87	120 Å²	120	61%	0.608	76%	0.758	S	S	*	*			cis	-173	156.5	-24.5	48.3	0	0	0	0	108.7
814	P	44.8	Very low	37.1	Very low	116 Å²	116	120.5 Å²	120.5	75%	0.753	76%	0.759	S	S	*	*			trans	-89	-177.8	-179.4	38.4	-37.9	0	0	0	112.8
815	T	32.9	Very low	36.9	Very low	136 Å²	136	121.9 Å²	121.9	83%	0.834	76%	0.759	S	S	*	*			trans	-163.6	116.4	131	-75.4	0	0	0	0	112.9
816	S	32	Very low	36.7	Very low	114 Å²	114	124 Å²	124	80%	0.797	76%	0.759	S	S	*	*			trans	27.7	148.4	140.5	-143.3	0	0	0	0	125.2
817	A	29.9	Very low	36.3	Very low	92 Å²	92	127.4 Å²	127.4	76%	0.76	76%	0.759	S	S	*	*			trans	105	141.7	139.4	0	0	0	0	0	120.6
818	A	29.8	Very low	36	Very low	105 Å²	105	123.9 Å²	123.9	87%	0.868	75%	0.75	S	S	*	*			trans	70.8	134.3	169.1	0	0	0	0	0	120.2
819	V	48	Very low	35.4	Very low	138 Å²	138	124.3 Å²	124.3	84%	0.836	75%	0.753	S	S	*	*			trans	-97	138.5	164.1	177	0	0	0	0	105
820	P	39.1	Very low	35.2	Very low	115 Å²	115	126.1 Å²	126.1	75%	0.747	76%	0.759	S	S	*	*				-144.5	-177.3	55.3	40.7	-20.4	0	0	0	117.4
821	V	49.1	Very low	34.5	Very low	123 Å²	123	126.1 Å²	126.1	75%	0.745	76%	0.758	S	S	*	*			trans	-75.4	151	174	-148.1	0	0	0	0	111.3
822	P	33.5	Very low	34.3	Very low	123 Å²	123	126.3 Å²	126.3	80%	0.799	77%	0.765	S	S	*	*				-138.4	164.7	118.4	38.4	-28.3	0	0	0	114.4
823	T	35.7	Very low	34	Very low	114 Å²	114	127.5 Å²	127.5	70%	0.699	77%	0.766	S	S	*	*			trans	-101.2	156.5	175.6	-60.8	0	0	0	0	110.1
824	T	37.3	Very low	34	Very low	112 Å²	112	130.2 Å²	130.2	69%	0.687	77%	0.772	S	S	*	*				159.3	106.5	118.7	-65.7	0	0	0	0	114.8
825	M	31.6	Very low	33.8	Very low	162 Å²	162	130 Å²	130	80%	0.798	77%	0.771	S	S	*	*			trans	62.5	158.5	149.3	-55.1	-61.3	161.2	0	0	118
826	I	31.1	Very low	33.9	Very low	158 Å²	158	129 Å²	129	81%	0.81	76%	0.764	S	S	*	*			cis	-147.4	136.7	39.3	-75.3	171.6	0	0	0	112.7
827	H	28.6	Very low	33.9	Very low	160 Å²	160	131.2 Å²	131.2	74%	0.741	76%	0.762	S	S	*	*			trans	43.6	113.2	148.5	-135.8	69.6	0	0	0	120.4
828	V	27.6	Very low	33.9	Very low	110 Å²	110	133.5 Å²	133.5	67%	0.667	76%	0.761	S	S	*	*				49.2	124.6	83.3	172.5	0	0	0	0	112.6
829	P	32.4	Very low	34.1	Very low	113 Å²	113	135.2 Å²	135.2	73%	0.734	76%	0.761	S	S	*	*			cis	-148.6	169.1	43.7	40.1	-19.7	0	0	0	120.2
830	K	26.6	Very low	33.3	Very low	199 Å²	199	132.6 Å²	132.6	87%	0.865	75%	0.754	S	S	*	*			trans	73.3	138.8	153.7	-151.6	171.7	-176	-177	0	118.1
831	P	31.3	Very low	33	Very low	113 Å²	113	133 Å²	133	73%	0.734	75%	0.754	S	S	*	*			trans	-88.4	-172.5	-177.5	37.7	-39.4	0	0	0	114
832	S	29.6	Very low	32.4	Very low	112 Å²	112	133.5 Å²	133.5	78%	0.783	76%	0.758	S	S	*	*			trans	86.7	150	-174	-51.1	0	0	0	0	112.8
833	E	30.4	Very low	32.3	Very low	175 Å²	175	132.1 Å²	132.1	82%	0.818	76%	0.757	S	S	*	*			cis	-162.1	-168.4	14	-147.4	176.4	164.3	0	0	112.9
834	I	33.2	Very low	32.1	Very low	145 Å²	145	131.2 Å²	131.2	74%	0.744	76%	0.761	S	S	*	*			trans	89.6	137.6	158.3	-48	-160.9	0	0	0	116.3
835	P	40.8	Very low	32.1	Very low	110 Å²	110	131.5 Å²	131.5	71%	0.714	77%	0.765	S	S	*	*			cis	-119.3	148.3	4.2	16.3	7.8	0	0	0	118.7
836	V	33.3	Very low	32	Very low	116 Å²	116	130.5 Å²	130.5	70%	0.703	77%	0.767	S	S	*	*			trans	-15.9	166.6	144	-65.7	0	0	0	0	120.1
837	Q	32.2	Very low	32	Very low	160 Å²	160	127.4 Å²	127.4	75%	0.748	77%	0.766	S	S	*	*			cis	-164.1	147.5	28	-146	152	29.3	0	0	116
838	N	31.6	Very low	32.3	Very low	140 Å²	140	123.7 Å²	123.7	75%	0.749	76%	0.762	S	S	*	*			trans	18.6	162.1	145.2	-52.8	-1.2	0	0	0	122.2
839	V	32.1	Very low	32.6	Very low	141 Å²	141	125.1 Å²	125.1	86%	0.855	77%	0.766	S	S	*	*			cis	-152.3	153.8	41	178.7	0	0	0	0	113.7
840	A	31.6	Very low	32.6	Very low	84 Å²	84	126.7 Å²	126.7	69%	0.694	77%	0.769	S	S	*	*			trans	-65.7	179.5	-175.8	0	0	0	0	0	119
841	T	34	Very low	33	Very low	122 Å²	122	122.9 Å²	122.9	75%	0.748	76%	0.762	S	S	*	*			trans	-174.1	132.2	132.9	-74	0	0	0	0	113.4
842	T	35.2	Very low	33.3	Very low	135 Å²	135	122.9 Å²	122.9	83%	0.828	76%	0.762	S	S	*	*			trans	57	166.7	165.8	53.1	0	0	0	0	120.1
843	A	31.7	Very low	33.5	Very low	94 Å²	94	123 Å²	123	78%	0.777	76%	0.76	S	S	*	*			cis	-168.6	157.7	-37.4	0	0	0	0	0	109.3
844	A	31	Very low	33.6	Very low	94 Å²	94	119.6 Å²	119.6	78%	0.777	76%	0.755	S	S	*	*			trans	-95.1	157.6	169.5	0	0	0	0	0	111.2
845	P	38.7	Very low	33.6	Very low	119 Å²	119	117.8 Å²	117.8	77%	0.773	75%	0.753	S	S	*	*				-153	150.2	102.3	38.6	-21.1	0	0	0	118.1
846	V	29	Very low	33.5	Very low	140 Å²	140	117 Å²	117	85%	0.848	76%	0.756	S	S	*	*				30	122.4	129.9	-172.5	0	0	0	0	120.3
847	A	31.3	Very low	33.3	Very low	94 Å²	94	115.6 Å²	115.6	78%	0.777	75%	0.749	S	S	*	*				-171.8	150.4	122.9	0	0	0	0	0	114.8
848	A	34	Very low	33.2	Very low	81 Å²	81	117 Å²	117	67%	0.669	75%	0.753	S	S	*	*			trans	65.2	102.9	149.1	0	0	0	0	0	122.4
849	N	34.8	Very low	32.9	Very low	141 Å²	141	120.5 Å²	120.5	75%	0.754	76%	0.762	S	S	*	*				82.4	131.6	121.7	-63.1	-0.1	0	0	0	122.8
850	N	32.5	Very low	32.7	Very low	146 Å²	146	119.6 Å²	119.6	78%	0.781	76%	0.756	S	S	*	*			trans	68.6	143.7	146.5	-64.1	-0.2	0	0	0	118.6
851	V	33.9	Very low	32.5	Very low	119 Å²	119	124 Å²	124	72%	0.721	76%	0.763	S	S	*	*			cis	168.3	136.3	-22.5	131.6	0	0	0	0	103
852	P	37.5	Very low	32	Very low	113 Å²	113	126.1 Å²	126.1	73%	0.734	77%	0.769	S	S	*	*			trans	-80.1	160.9	176.6	38.9	-38.5	0	0	0	110
853	P	33.9	Very low	31.7	Very low	115 Å²	115	125.5 Å²	125.5	75%	0.747	76%	0.76	S	S	*	*				-148.7	176.7	82	40.6	-22.9	0	0	0	115.2
854	S	32.6	Very low	31.6	Very low	103 Å²	103	128.9 Å²	128.9	72%	0.72	76%	0.76	S	S	*	*			trans	-60.6	147.9	152.7	-177.3	0	0	0	0	109.6	A856	S854-A856 PolarHBondContact OG-N 2.89Å
855	P	34.3	Very low	31.5	Very low	106 Å²	106	130 Å²	130	69%	0.688	76%	0.757	S	S	*	*				-135	126.5	111.8	35.1	-25.5	0	0	0	113
856	A	37.7	Very low	31.2	Very low	95 Å²	95	130.1 Å²	130.1	79%	0.785	76%	0.757	S	S	*	*			trans	-78.8	133.9	136.1	0	0	0	0	0	107.9	S854	S854-A856 PolarHBondContact OG-N 2.89Å
857	P	29.9	Very low	31	Very low	86 Å²	86	129.1 Å²	129.1	56%	0.558	75%	0.752	S	S	*	*			trans	-133.5	160.9	160	41.3	-29.6	0	0	0	113.6
858	F	30.8	Very low	31	Very low	189 Å²	189	132.4 Å²	132.4	83%	0.829	76%	0.755	S	S	*	*			trans	64.7	71.9	162.1	-45.3	-50	0	0	0	118
859	K	24.7	Very low	30.9	Very low	214 Å²	214	132.4 Å²	132.4	93%	0.93	76%	0.755	S	S	*	*			trans	-116.8	64.9	135.3	-93.3	-161.8	172	-169.7	0	109.7
860	T	26.8	Very low	30.9	Very low	121 Å²	121	134 Å²	134	74%	0.742	76%	0.759	S	S	*	*			trans	-156	82.3	172.8	-31.6	0	0	0	0	111.8
861	E	27.7	Very low	30.8	Very low	177 Å²	177	133.9 Å²	133.9	83%	0.827	76%	0.758	S	S	*	*			trans	-143	81	145.6	-81.9	-152	123.3	0	0	108	I863	E861-I863 PolarHBondContact O-N 2.67Å
862	D	24.2	Very low	30.8	Very low	166 Å²	166	133.1 Å²	133.1	89%	0.888	75%	0.753	S	S	*	*			trans	-75.6	96.4	158.5	-92.6	-59.4	0	0	0	108
863	I	29.7	Very low	30.7	Very low	122 Å²	122	134.2 Å²	134.2	63%	0.626	76%	0.758	S	S	*	*			trans	-123.4	125.2	164.4	-66.5	-177	0	0	0	108	E861	E861-I863 PolarHBondContact O-N 2.67Å
864	Q	28.8	Very low	31.2	Very low	166 Å²	166	133.6 Å²	133.6	78%	0.776	75%	0.754	S	S	*	*			trans	67.9	98.8	174.1	-68.4	169.8	16.9	0	0	116.8
865	T	28.9	Very low	31	Very low	117 Å²	117	139.6 Å²	139.6	72%	0.718	76%	0.761	S	S	*	*				31.7	126.7	112.8	57.5	0	0	0	0	117.3
866	P	32.1	Very low	30.8	Very low	121 Å²	121	139.9 Å²	139.9	79%	0.786	76%	0.761	S	S	*	*				-131.6	142.1	60.8	37.3	-25.6	0	0	0	116.4
867	T	24.5	Very low	30.5	Very low	120 Å²	120	142.7 Å²	142.7	74%	0.736	76%	0.761	S	S	*	*			trans	-72.9	168.1	154	-28.3	0	0	0	0	109.6
868	L	32.1	Very low	30.6	Very low	162 Å²	162	143.3 Å²	143.3	85%	0.848	77%	0.767	S	S	*	*			trans	77.5	139.1	-171.6	-74.7	69	0	0	0	113.4
869	A	31.7	Very low	30.7	Very low	81 Å²	81	140.2 Å²	140.2	67%	0.669	76%	0.764	S	S	*	*			cis	-151.3	144.9	-1.1	0	0	0	0	0	113.3
870	Q	33.8	Very low	31	Very low	176 Å²	176	138 Å²	138	82%	0.822	76%	0.762	S	S	*	*				28.1	123.1	129.8	-75.1	172.7	-6.2	0	0	119.4
871	N	32	Very low	31.3	Very low	143 Å²	143	136.1 Å²	136.1	77%	0.765	76%	0.759	S	S	*	*				74	140.9	83.2	-92.3	19.2	0	0	0	115.2
872	T	33.7	Very low	31.6	Very low	102 Å²	102	134 Å²	134	63%	0.626	76%	0.764	S	S	*	*			cis	-168.7	124.6	-20.2	9.8	0	0	0	0	111.1
873	V	36	Very low	32	Very low	136 Å²	136	129.3 Å²	129.3	82%	0.824	76%	0.755	S	S	*	*			trans	50.6	-157.3	154.7	-97.1	0	0	0	0	117.4
874	P	42.5	Very low	32.2	Very low	103 Å²	103	131.3 Å²	131.3	67%	0.669	77%	0.766	S	S	*	*				-132.3	159.2	-97.3	39	-21.2	0	0	0	117.4
875	R	30.1	Very low	32.3	Very low	229 Å²	229	129.5 Å²	129.5	86%	0.864	77%	0.766	S	S	*	*				173.7	141.1	110.8	-96.8	176.4	175.6	177.2	-0	115.5
876	T	29.1	Very low	32.5	Very low	112 Å²	112	130.7 Å²	130.7	69%	0.687	77%	0.766	S	S	*	*			trans	43.5	118.1	133.4	-42.9	0	0	0	0	121.3
877	I	31.5	Very low	32.5	Very low	154 Å²	154	131.6 Å²	131.6	79%	0.79	76%	0.764	S	S	*	*			trans	33.9	117.9	140.5	-49.5	172	0	0	0	117
878	S	31.6	Very low	32.9	Very low	98 Å²	98	132.2 Å²	132.2	69%	0.685	77%	0.768	S	S	*	*			cis	-162.4	152.9	-2.9	-93.4	0	0	0	0	110.3
879	T	33.7	Very low	33.2	Very low	125 Å²	125	130.2 Å²	130.2	77%	0.767	77%	0.765	S	S	*	*			trans	26.8	114.8	156.5	55.2	0	0	0	0	120.4
880	D	29.9	Very low	33.4	Very low	166 Å²	166	131.2 Å²	131.2	89%	0.888	77%	0.774	S	S	*	*			trans	63.4	136.5	158	-68.6	-32	0	0	0	118.4
881	A	33.3	Very low	33.4	Very low	82 Å²	82	128 Å²	128	68%	0.678	77%	0.77	S	S	*	*			cis	-154.2	177.8	10	0	0	0	0	0	112.9
882	S	35.1	Very low	33.4	Very low	132 Å²	132	128.8 Å²	128.8	92%	0.923	77%	0.773	S	S	*	*			trans	77.3	141.2	165	-53.8	0	0	0	0	118.4
883	G	32.4	Very low	33.4	Very low	68 Å²	68	127.9 Å²	127.9	70%	0.701	78%	0.776	S	S	*	*			trans	-178.4	168.3	175	0	0	0	0	0	114.1
884	L	33.1	Very low	33.3	Very low	165 Å²	165	126.8 Å²	126.8	86%	0.864	77%	0.774	S	S	*	*			trans	-174.5	125.1	170	-122.5	69.6	0	0	0	104
885	V	30.7	Very low	33.4	Very low	128 Å²	128	127.3 Å²	127.3	78%	0.776	78%	0.778	S	S	*	*			cis	78.9	115.8	33.8	-162.4	0	0	0	0	114.4
886	I	34.1	Very low	33.4	Very low	141 Å²	141	121.8 Å²	121.8	72%	0.723	77%	0.774	S	S	*	*			trans	152.3	114.4	137.8	-76.8	168.6	0	0	0	113
887	N	31.2	Very low	33.9	Very low	140 Å²	140	121.9 Å²	121.9	75%	0.749	78%	0.777	S	S	*	*			trans	35.5	155.8	140	-50	-13.8	0	0	0	122.3
888	T	33.7	Very low	33.7	Very low	133 Å²	133	119.1 Å²	119.1	82%	0.816	78%	0.777	S	S	*	*			cis	-165.3	159.2	41.5	-36.8	0	0	0	0	111.5
889	P	37.5	Very low	33.7	Very low	121 Å²	121	119.8 Å²	119.8	79%	0.786	78%	0.778	S	S	*	*			trans	-122.9	165.4	-165.1	41.9	-30.9	0	0	0	118.4
890	A	35.4	Very low	33.4	Very low	102 Å²	102	119.5 Å²	119.5	84%	0.843	78%	0.782	S	S	*	*			trans	-161	138.9	160.5	0	0	0	0	0	116.5
891	S	35	Very low	33.4	Very low	107 Å²	107	115.1 Å²	115.1	75%	0.748	77%	0.769	S	S	*	*			trans	47	95.6	151.6	-161.8	0	0	0	0	124.8
892	I	32.5	Very low	33.2	Very low	161 Å²	161	116.9 Å²	116.9	83%	0.826	77%	0.771	S	S	*	*				46.7	133.2	114.4	-63.8	173.6	0	0	0	122.4
893	A	33.7	Very low	32.8	Very low	83 Å²	83	117.7 Å²	117.7	69%	0.686	77%	0.765	S	S	*	*			trans	85.3	81.8	154.2	0	0	0	0	0	122.2
894	S	32.9	Very low	33.1	Very low	113 Å²	113	120.1 Å²	120.1	79%	0.79	77%	0.766	S	S	*	*				39.1	152.8	114.4	-48.7	0	0	0	0	123.4
895	P	44.3	Very low	33.2	Very low	114 Å²	114	116.2 Å²	116.2	74%	0.74	76%	0.758	S	S	*	*			cis	-144.4	151.7	-40.4	38.7	-21.4	0	0	0	115.8
896	S	31.5	Very low	33.3	Very low	113 Å²	113	115.2 Å²	115.2	79%	0.79	76%	0.756	S	S	*	*			trans	69.5	160.2	152.8	-134.4	0	0	0	0	118.5
897	P	38.6	Very low	33.3	Very low	114 Å²	114	114.8 Å²	114.8	74%	0.74	76%	0.761	S	S	*	*				-128.7	146.4	-59.4	35.2	-22.7	0	0	0	113.3
898	A	27.1	Very low	33.8	Very low	96 Å²	96	114.5 Å²	114.5	79%	0.793	76%	0.764	S	S	*	*			trans	-138.5	118.6	155.3	0	0	0	0	0	108.7
899	P	32.3	Very low	33.6	Very low	111 Å²	111	113 Å²	113	72%	0.721	77%	0.765	S	S	*	*			trans	-76.4	177.8	161.8	36.1	-34.5	0	0	0	109.3
900	S	27.7	Very low	34	Very low	119 Å²	119	113 Å²	113	83%	0.832	77%	0.765	S	S	*	*			trans	102.1	138.1	170.9	-49.8	0	0	0	0	114.9
901	A	29.4	Very low	34.3	Very low	75 Å²	75	114.4 Å²	114.4	62%	0.62	76%	0.763	S	S	*	*			cis	-166.4	-164.4	-16.8	0	0	0	0	0	108.8
902	T	28.9	Very low	34.2	Very low	119 Å²	119	115.5 Å²	115.5	73%	0.73	77%	0.765	S	S	*	*			trans	55.5	127.3	140.6	48.3	0	0	0	0	119
903	D	27.5	Very low	34.9	Very low	149 Å²	149	113.7 Å²	113.7	80%	0.797	76%	0.764	S	S	*	*	S	Bend		-103.7	153.5	103.2	-103.9	-37.6	0	0	0	108.8
904	V	37.4	Very low	34.8	Very low	119 Å²	119	113.9 Å²	113.9	72%	0.721	77%	0.766	S	S	*	*	S	Bend	cis	-137.6	158.2	9.9	-128.2	0	0	0	0	112.6
905	A	35	Very low	35.5	Very low	83 Å²	83	113.6 Å²	113.6	69%	0.686	76%	0.761	S	S	*	*			trans	80.8	85.8	152.9	0	0	0	0	0	120.9
906	S	33.3	Very low	35	Very low	106 Å²	106	114.1 Å²	114.1	74%	0.741	76%	0.762	S	S	*	*				90.1	102.9	119.5	-55.3	0	0	0	0	122.3
907	T	33.6	Very low	35.7	Very low	133 Å²	133	114 Å²	114	82%	0.816	76%	0.758	S	S	*	*				49.1	133.2	122.5	1.1	0	0	0	0	120
908	T	42.4	Very low	35.3	Very low	133 Å²	133	114.5 Å²	114.5	82%	0.816	76%	0.76	S	S	*	*			cis	-156.2	144.5	44.8	49.5	0	0	0	0	115
909	A	30.2	Very low	35.6	Very low	101 Å²	101	116.3 Å²	116.3	84%	0.835	76%	0.761	S	S	*	*			trans	-166.6	135.1	170.1	0	0	0	0	0	116.4
910	P	46.4	Very low	35.6	Very low	123 Å²	123	116.6 Å²	116.6	80%	0.799	76%	0.761	S	S	*	*			trans	-131.5	-169.5	155.8	28.6	-6.3	0	0	0	111.6
911	V	41.3	Very low	35.9	Very low	131 Å²	131	116.2 Å²	116.2	79%	0.794	75%	0.754	S	S	*	*			cis	-151.2	-178.4	14.6	-139.1	0	0	0	0	111.5
912	T	32.9	Very low	36.1	Very low	129 Å²	129	120.2 Å²	120.2	79%	0.791	77%	0.765	S	S	*	*			trans	-146.7	178.2	179	53.9	0	0	0	0	110.2
913	P	45.8	Very low	36.2	Very low	124 Å²	124	117.9 Å²	117.9	81%	0.805	77%	0.765	S	S	*	*			cis	-144.6	-138.2	16.9	45.6	-22	0	0	0	115.8
914	A	31.9	Very low	36.3	Very low	87 Å²	87	114.7 Å²	114.7	72%	0.719	77%	0.767	S	S	*	*			trans	-148.1	-154.6	179	0	0	0	0	0	108.6
915	P	47.1	Very low	35.9	Very low	106 Å²	106	113.8 Å²	113.8	69%	0.688	77%	0.772	S	S	*	*			cis	-144.4	-160.6	-4.9	41.3	-18.1	0	0	0	116.3
916	T	34.2	Very low	35.7	Very low	126 Å²	126	114.8 Å²	114.8	77%	0.773	78%	0.78	S	S	*	*			trans	71.7	157.2	150	43.1	0	0	0	0	123.1
917	P	45.9	Very low	35.5	Very low	109 Å²	109	114.2 Å²	114.2	71%	0.708	78%	0.782	S	S	*	*			cis	-133.4	-161.2	-18	41.8	-22.9	0	0	0	111.7
918	T	31.4	Very low	35.3	Very low	126 Å²	126	112.4 Å²	112.4	77%	0.773	78%	0.78	S	S	*	*			cis	-159.9	139.8	-18	5.2	0	0	0	0	109.5
919	T	33.1	Very low	34.4	Very low	134 Å²	134	111.3 Å²	111.3	82%	0.822	78%	0.778	S	S	*	*			trans	-165.5	135.9	139.8	-11.4	0	0	0	0	111.6
920	T	32.7	Very low	34.1	Very low	117 Å²	117	112.4 Å²	112.4	72%	0.718	77%	0.774	S	S	*	*			trans	37.5	87.5	159.1	-43.5	0	0	0	0	117.9
921	T	33.8	Very low	33	Very low	110 Å²	110	112.3 Å²	112.3	68%	0.675	77%	0.772	S	S	*	*				52.5	131.4	71.8	75.1	0	0	0	0	114.8
922	D	32.7	Very low	32.3	Very low	159 Å²	159	111.5 Å²	111.5	85%	0.85	77%	0.768	S	S	*	*			cis	-164.5	167.4	-10.3	-106.6	-50.4	0	0	0	106.8
923	G	31.4	Very low	32	Very low	71 Å²	71	113 Å²	113	73%	0.732	77%	0.765	S	S	*	*			cis	144.3	148.2	9.5	0	0	0	0	0	107.9
924	G	30.6	Very low	31.1	Very low	81 Å²	81	113.8 Å²	113.8	84%	0.835	76%	0.763	S	S	*	*			cis	-153.9	-171.1	-3.1	0	0	0	0	0	110
925	A	29	Very low	31	Very low	101 Å²	101	119.5 Å²	119.5	84%	0.835	77%	0.771	S	S	*	*			trans	-139.2	158	-163.9	0	0	0	0	0	116.4
926	A	29.7	Very low	30	Very low	104 Å²	104	122.9 Å²	122.9	86%	0.86	78%	0.778	S	S	*	*			trans	67.3	162.5	160.7	0	0	0	0	0	117.3
927	A	29	Very low	29.7	Very low	93 Å²	93	125.2 Å²	125.2	77%	0.769	78%	0.78	S	S	*	*			cis	-148.6	155	3	0	0	0	0	0	113.8
928	A	30	Very low	29	Very low	96 Å²	96	129.5 Å²	129.5	79%	0.793	79%	0.788	S	S	*	*			trans	39.2	112.2	149.6	0	0	0	0	0	122.1
929	S	23.9	Very low	28.8	Very low	110 Å²	110	132.1 Å²	132.1	77%	0.769	78%	0.783	S	S	*	*				179.9	155.7	106.1	42.5	0	0	0	0	113.8
930	T	24.1	Very low	28.8	Very low	123 Å²	123	133.8 Å²	133.8	76%	0.755	78%	0.779	S	S	*	*			trans	58.6	129.1	164.1	44.4	0	0	0	0	121.8
931	T	23.5	Very low	28.8	Very low	122 Å²	122	132.8 Å²	132.8	75%	0.748	78%	0.777	S	S	*	*			trans	68	148	148.3	42.4	0	0	0	0	122.1
932	T	26.2	Very low	28.9	Very low	114 Å²	114	133.9 Å²	133.9	70%	0.699	78%	0.779	S	S	*	*			trans	63.9	117.9	158.7	40.1	0	0	0	0	117.5
933	E	25.3	Very low	29.6	Very low	160 Å²	160	132.3 Å²	132.3	75%	0.748	77%	0.765	S	S	*	*				57.6	121.9	91.6	-62	-175	170.5	0	0	112.5
934	N	28.6	Very low	31.3	Very low	141 Å²	141	134.7 Å²	134.7	75%	0.754	75%	0.751	S	S	*	*			cis	-147.8	148	43.3	-82.5	-92.6	0	0	0	113.5
935	K	28.3	Very low	33.9	Very low	206 Å²	206	136.2 Å²	136.2	90%	0.896	74%	0.735	S	S	*	*			trans	-93.8	113.2	152.6	-172.5	175.2	-175.8	177.4	0	106.3	E937	K935-E937 PolarHBondContact O-N 3.49Å
936	E	25.9	Very low	36.8	Very low	177 Å²	177	131.4 Å²	131.4	83%	0.827	70%	0.695	S	S	*	*			trans	-69	94.8	-164.6	-167.8	175.6	168.8	0	0	112.9
937	E	29.5	Very low	39.9	Very low	176 Å²	176	127.4 Å²	127.4	82%	0.822	66%	0.66	S	S	*	*			trans	-80	126.7	173.7	-167.3	175.2	-141.2	0	0	110.7	K935 R939	K935-E937 PolarHBondContact O-N 3.49Å; E937-R939 PolarHBondContact O-N 2.8Å
938	K	29.7	Very low	43	Very low	198 Å²	198	123 Å²	123	86%	0.861	62%	0.624	S	S	*	*			trans	-57.8	102.6	-167.1	-166	166.7	-172.7	164	0	112.7	K940	K938-K940 PolarHBondContact O-N 3.1Å; K938-K940 VanDerWaalsContact O-N 3.08Å
939	R	28.5	Very low	46.1	Very low	181 Å²	181	119.8 Å²	119.8	68%	0.683	59%	0.592	S	S	*	*			trans	-51.7	108.2	-174.2	-75.2	171.2	146.9	-146.4	-16.7	113.5	E937 P1034 N1035	E937-R939 PolarHBondContact O-N 2.8Å; R939-P1034 PolarHBondContact NH2-O 3.34Å; R939-N1035 VanDerWaalsContact CZ-OD1 3.28Å; R939-N1035 PolarHBondContact NH1-OD1 3.14Å; R939-N1035 PolarHBondContact NH2-OD1 3.19Å
940	K	31.5	Very low	49.5	Very low	169 Å²	169	114.7 Å²	114.7	74%	0.735	56%	0.556	S	S	*	*			trans	-117	113.2	161.1	-165.4	171.3	-175	176.2	0	108.3	K938 N942	K938-K940 PolarHBondContact O-N 3.1Å; K938-K940 VanDerWaalsContact O-N 3.08Å; K940-N942 VanDerWaalsContact C-N 3.31Å; K940-N942 PolarHBondContact O-N 3.25Å
941	S	32.9	Very low	52.8	Low	96 Å²	96	112.6 Å²	112.6	67%	0.671	54%	0.54	S	S	*	.			trans	-77.6	67.4	-165.3	44.5	0	0	0	0	114.5	K943	S941-K943 PolarHBondContact O-N 2.87Å; S941-K943 VanDerWaalsContact O-N 3.09Å
942	N	36.8	Very low	55.9	Low	133 Å²	133	107.6 Å²	107.6	71%	0.711	51%	0.513	S	S	*	.			trans	-68	102.4	159.5	-82.1	9	0	0	0	108.9	K940 R944	K940-N942 VanDerWaalsContact C-N 3.31Å; K940-N942 PolarHBondContact O-N 3.25Å; N942-R944 PolarHBondContact O-N 2.9Å; N942-R944 VanDerWaalsContact O-N 3.15Å
943	K	47.4	Very low	58.8	Low	127 Å²	127	103.8 Å²	103.8	55%	0.552	49%	0.49	S	S	*	.			trans	-54.7	117.7	174	-59.3	-159.4	179.6	-150.6	0	109.7	S941 K945 V1031 D1033	S941-K943 PolarHBondContact O-N 2.87Å; S941-K943 VanDerWaalsContact O-N 3.09Å; K943-K945 PolarHBondContact O-N 2.65Å; K943-V1031 HydrophobicContact CB-CG1 3.91Å; K943-V1031 HydrophobicContact CD-CG1 4.02Å; K943-D1033 VanDerWaalsContact CD-OD1 3.31Å; K943-D1033 WeakPolarHBondContact CD-OD1 3.23Å; K943-D1033 WeakPolarHBondContact CE-OD1 3.34Å; K943-D1033 WeakPolarHBondContact CE-OD2 3.18Å; K943-D1033 WeakPolarHBondContact CG-OD1 3.45Å; K943-D1033 VanDerWaalsContact NZ-CG 3.28Å; K943-D1033 IonicContact NZ-OD1 2.82Å; K943-D1033 PolarHBondContact NZ-OD1 3.07Å; K943-D1033 VanDerWaalsContact NZ-OD1 3.09Å; K943-D1033 IonicContact NZ-OD2 2.78Å; K943-D1033 PolarHBondContact NZ-OD2 3.36Å
944	R	67.5	Low	61.4	Low	120 Å²	120	98.8 Å²	98.8	45%	0.453	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	106.1	-175.3	-62.5	-176.3	-175.6	179.4	1.7	108.4	N942 L1032	N942-R944 PolarHBondContact O-N 2.9Å; N942-R944 VanDerWaalsContact O-N 3.15Å; R944-L1032 HydrophobicContact CB-CB 4.22Å; R944-L1032 HydrophobicContact CB-CD1 4.45Å; R944-L1032 PolarHBondContact N-O 3.48Å; R944-L1032 WeakPolarHBondContact O-CB 3.48Å; R944-L1032 PolarHBondContact O-N 2.94Å
945	K	84.5	Confident	63.5	Low	113 Å²	113	97 Å²	97	49%	0.491	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	132.7	176.5	-165.4	178.2	-172.8	-176.7	0	110	K943 V947 T1030 V1031	K943-K945 PolarHBondContact O-N 2.65Å; K945-V947 HydrophobicContact CD-CG2 3.81Å; K945-V947 HydrophobicContact CG-CG2 3.77Å; K945-T1030 WeakPolarHBondContact CA-O 3.43Å; K945-V1031 HydrophobicContact CD-CG2 4.46Å; K945-V1031 HydrophobicContact CG-CG2 4.08Å
946	V	90.6	Very high	64.8	Low	1 Å²	1	92 Å²	92	1%	0.006	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	124.9	169.9	-178.8	0	0	0	0	107.2	L966 H1001 I1004 V1005 Q1008 T1030	V946-L966 HydrophobicContact CG1-CD1 3.66Å; V946-H1001 HydrophobicContact CG2-CB 4.42Å; V946-I1004 HydrophobicContact CB-CG2 4.24Å; V946-I1004 HydrophobicContact CG1-CG2 4.31Å; V946-V1005 HydrophobicContact CG1-CG2 4.15Å; V946-Q1008 PolarHBondContact O-NE2 2.81Å; V946-T1030 PolarHBondContact N-O 2.95Å; V946-T1030 PolarHBondContact O-N 2.87Å
947	V	93.8	Very high	66.2	Low	19 Å²	19	90.1 Å²	90.1	12%	0.115	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	128	-177.6	-173	0	0	0	0	110	K945 L966 D967 K1027 L1028 A1029	K945-V947 HydrophobicContact CD-CG2 3.81Å; K945-V947 HydrophobicContact CG-CG2 3.77Å; V947-L966 CarbonylContact O-C 3.46Å; V947-L966 WeakPolarHBondContact O-CA 3.44Å; V947-D967 HydrophobicContact CB-CB 4.44Å; V947-D967 PolarHBondContact N-O 3.22Å; V947-D967 PolarHBondContact O-N 3.06Å; V947-K1027 HydrophobicContact CG1-CB 4.46Å; V947-K1027 HydrophobicContact CG1-CD 4.34Å; V947-K1027 HydrophobicContact CG1-CG 4.48Å; V947-L1028 CarbonylContact C-O 3.35Å; V947-L1028 WeakPolarHBondContact CA-O 3.45Å; V947-A1029 HydrophobicContact CG2-CB 4.3Å
948	M	94.5	Very high	67.5	Low	1 Å²	1	89.3 Å²	89.3	1%	0.005	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	135	171	-163.2	175.9	-61	0	0	109.7	C964 R965 L966 F975 V1005 Q1008 L1009 V1012 K1027 L1028	M948-C964 HydrophobicContact CG-CB 4.27Å; M948-R965 CarbonylContact C-O 3.5Å; M948-R965 VanDerWaalsContact CA-O 3.32Å; M948-R965 WeakPolarHBondContact CA-O 3.27Å; M948-L966 HydrophobicContact CB-CD1 4.45Å; M948-L966 HydrophobicContact CE-CD1 4.14Å; M948-F975 HydrophobicContact SD-CZ 4.49Å; M948-V1005 HydrophobicContact CE-CB 4.45Å; M948-V1005 HydrophobicContact CE-CG1 3.91Å; M948-V1005 HydrophobicContact CE-CG2 4.49Å; M948-Q1008 HydrophobicContact CB-CB 4.45Å; M948-Q1008 HydrophobicContact CE-CB 3.74Å; M948-Q1008 HydrophobicContact SD-CB 4.17Å; M948-L1009 HydrophobicContact CE-CG 4.06Å; M948-L1009 HydrophobicContact SD-CD2 4.27Å; M948-L1009 HydrophobicContact SD-CG 4.18Å; M948-V1012 HydrophobicContact SD-CG2 4.01Å; M948-K1027 CarbonylContact O-C 3.57Å; M948-K1027 WeakPolarHBondContact O-CA 3.38Å; M948-L1028 PolarHBondContact N-O 2.74Å; M948-L1028 PolarHBondContact O-N 3.45Å
949	E	95.6	Very high	69	Low	29 Å²	29	86.7 Å²	86.7	14%	0.136	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	122.4	-178.4	179.7	169.8	-156.7	0	0	109.7	L951 C964 R965 T1026 K1027	E949-L951 HydrophobicContact CG-CD2 4.15Å; E949-L951 PolarHBondContact O-N 2.96Å; E949-C964 CarbonylContact O-C 3.59Å; E949-C964 VanDerWaalsContact O-CA 3.32Å; E949-C964 WeakPolarHBondContact O-CA 3.06Å; E949-R965 PolarHBondContact N-O 2.95Å; E949-R965 PolarHBondContact O-N 3.13Å; E949-R965 IonicContact OE2-CZ 3.38Å; E949-R965 IonicContact OE2-NH1 2.8Å; E949-R965 PolarHBondContact OE2-NH1 3.47Å; E949-R965 IonicContact OE2-NH2 3.06Å; E949-R965 PolarHBondContact OE2-NH2 2.81Å; E949-T1026 WeakPolarHBondContact CA-O 3.08Å; E949-K1027 HydrophobicContact CB-CG 3.99Å; E949-K1027 HydrophobicContact CG-CG 3.96Å; E949-K1027 WeakPolarHBondContact OE1-CE 3.39Å; E949-K1027 IonicContact OE1-NZ 3.33Å; E949-K1027 PolarHBondContact OE1-NZ 3.18Å; E949-K1027 WeakPolarHBondContact OE2-CE 3.37Å; E949-K1027 IonicContact OE2-NZ 3.86Å; E949-K1027 PolarHBondContact OE2-NZ 3.05Å
950	I	94.6	Very high	71.3	Confident	2 Å²	2	80 Å²	80	1%	0.01	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	114	174.3	-57.6	169.1	0	0	0	107.9	V1012 L1015 I1016 G1023 V1024 G1025 T1026	I950-V1012 HydrophobicContact CD1-CB 4.37Å; I950-V1012 HydrophobicContact CD1-CG1 3.88Å; I950-V1012 HydrophobicContact CD1-CG2 4.03Å; I950-V1012 HydrophobicContact CG1-CG1 3.91Å; I950-V1012 HydrophobicContact CG1-CG2 3.96Å; I950-L1015 HydrophobicContact CD1-CD2 3.95Å; I950-I1016 HydrophobicContact CD1-CD1 4.17Å; I950-I1016 HydrophobicContact CD1-CG1 4.41Å; I950-I1016 HydrophobicContact CG2-CD1 4.07Å; I950-G1023 WeakPolarHBondContact CD1-O 3.1Å; I950-V1024 HydrophobicContact CG2-CG2 4.46Å; I950-G1025 WeakPolarHBondContact O-CA 3.41Å; I950-G1025 PolarHBondContact O-N 2.97Å; I950-T1026 PolarHBondContact N-O 3Å; I950-T1026 VanDerWaalsContact N-O 3.13Å
951	L	92.4	Very high	74	Confident	79 Å²	79	73.7 Å²	73.7	41%	0.414	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-27	-178.2	-61.8	-178.7	0	0	0	113.3	E949 S963 R965 T974	E949-L951 HydrophobicContact CG-CD2 4.15Å; E949-L951 PolarHBondContact O-N 2.96Å; L951-S963 PolarHBondContact N-O 2.85Å; L951-R965 HydrophobicContact CD1-CB 4.14Å; L951-R965 HydrophobicContact CD2-CB 4.26Å; L951-R965 HydrophobicContact CG-CB 4.28Å; L951-T974 HydrophobicContact CD1-CG2 3.64Å
952	G	90.4	Very high	76.8	Confident	18 Å²	18	69.1 Å²	69.1	19%	0.186	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.3	159.2	-178.4	0	0	0	0	0	112.5	S963	G952-S963 PolarHBondContact O-N 2.95Å
953	C	86.6	Confident	79.5	Confident	33 Å²	33	64 Å²	64	22%	0.223	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	123.4	169.6	-167.9	0	0	0	0	107.9	L961	C953-L961 WeakPolarHBondContact CA-O 3.35Å
954	D	80.4	Confident	81.8	Confident	56 Å²	56	58 Å²	58	30%	0.299	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	109.9	177.9	-177.5	11.2	0	0	0	109.7	S956 R957 A960 L961	D954-S956 VanDerWaalsContact CG-OG 3.31Å; D954-S956 VanDerWaalsContact OD1-CB 3.22Å; D954-S956 WeakPolarHBondContact OD1-CB 3.3Å; D954-S956 PolarHBondContact OD1-N 3.49Å; D954-S956 PolarHBondContact OD1-OG 2.98Å; D954-S956 PolarHBondContact OD2-OG 2.81Å; D954-R957 IonicContact OD2-NE 3.28Å; D954-A960 WeakPolarHBondContact O-CA 3.32Å; D954-L961 HydrophobicContact CB-CB 4.5Å; D954-L961 PolarHBondContact N-O 2.83Å; D954-L961 PolarHBondContact O-N 3.02Å
955	E	72.5	Confident	83.2	Confident	104 Å²	104	55.3 Å²	55.3	49%	0.486	29%	0.286	S	S	.	.			trans	-91.2	-2.2	177	-64.2	170.4	173.8	0	0	112.5	R957 K1021	E955-R957 PolarHBondContact O-N 2.7Å; E955-K1021 IonicContact OE1-NZ 3.01Å; E955-K1021 PolarHBondContact OE1-NZ 2.79Å; E955-K1021 IonicContact OE2-NZ 2.71Å; E955-K1021 PolarHBondContact OE2-NZ 3.32Å
956	S	56	Low	83.7	Confident	101 Å²	101	49.9 Å²	49.9	71%	0.706	26%	0.263	S	S	*	.	S	Bend	trans	-76.9	0	-173.3	71.8	0	0	0	0	114.9	D954	D954-S956 VanDerWaalsContact CG-OG 3.31Å; D954-S956 VanDerWaalsContact OD1-CB 3.22Å; D954-S956 WeakPolarHBondContact OD1-CB 3.3Å; D954-S956 PolarHBondContact OD1-N 3.49Å; D954-S956 PolarHBondContact OD1-OG 2.98Å; D954-S956 PolarHBondContact OD2-OG 2.81Å
957	R	55.1	Low	83.8	Confident	136 Å²	136	51.9 Å²	51.9	51%	0.513	27%	0.273	S	S	.	.	S	Bend	trans	-120.4	155.2	179.8	-59.7	179.8	-177.2	-151.6	-1.9	109.4	D954 E955 F959	D954-R957 IonicContact OD2-NE 3.28Å; E955-R957 PolarHBondContact O-N 2.7Å; R957-F959 CarbonylContact O-C 3.6Å; R957-F959 PolarHBondContact O-N 3Å
958	N	56.9	Low	83.6	Confident	159 Å²	159	51.9 Å²	51.9	85%	0.85	27%	0.274	S	S	*	.	S	Bend	trans	-55.9	-11.4	-176.2	-69.6	17	0	0	0	115.6
959	F	59.4	Low	82.9	Confident	144 Å²	144	55.4 Å²	55.4	63%	0.632	30%	0.298	S	S	*	.	S	Bend	trans	-132.5	128.1	170	-40.9	-75.5	0	0	0	107.2	R957 L961 A978	R957-F959 CarbonylContact O-C 3.6Å; R957-F959 PolarHBondContact O-N 3Å; F959-L961 PolarHBondContact O-N 2.84Å; F959-A978 HydrophobicContact CB-CB 4.44Å
960	A	77.1	Confident	82	Confident	41 Å²	41	58.4 Å²	58.4	34%	0.339	31%	0.312	S	S	.	.			trans	-60.6	131	177.9	0	0	0	0	0	110.3	D954 A978 P979	D954-A960 WeakPolarHBondContact O-CA 3.32Å; A960-A978 WeakPolarHBondContact O-CA 3.35Å; A960-P979 VanDerWaalsContact O-CD 3.27Å; A960-P979 WeakPolarHBondContact O-CD 3.38Å
961	L	88.9	Confident	81.6	Confident	36 Å²	36	62.2 Å²	62.2	19%	0.188	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	118.1	-175.6	-88.3	157.7	0	0	0	111.2	C953 D954 F959 Q976 A978	C953-L961 WeakPolarHBondContact CA-O 3.35Å; D954-L961 HydrophobicContact CB-CB 4.5Å; D954-L961 PolarHBondContact N-O 2.83Å; D954-L961 PolarHBondContact O-N 3.02Å; F959-L961 PolarHBondContact O-N 2.84Å; L961-Q976 HydrophobicContact CD2-CB 4.4Å; L961-A978 HydrophobicContact CD2-CB 4.42Å
962	V	92.4	Very high	81.5	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	124.7	-178.2	178	0	0	0	0	109.3	Q976 F977 P979 V1012 I1016	V962-Q976 VanDerWaalsContact O-CA 3.24Å; V962-Q976 WeakPolarHBondContact O-CA 3.29Å; V962-F977 HydrophobicContact CB-CD1 4.32Å; V962-F977 HydrophobicContact CB-CE1 3.92Å; V962-F977 HydrophobicContact CB-CE2 4.32Å; V962-F977 HydrophobicContact CB-CZ 3.93Å; V962-F977 HydrophobicContact CG1-CD1 4.5Å; V962-F977 HydrophobicContact CG1-CE1 3.7Å; V962-F977 HydrophobicContact CG1-CZ 3.77Å; V962-F977 PolarHBondContact N-O 2.86Å; V962-F977 PolarHBondContact O-N 2.87Å; V962-F977 VanDerWaalsContact O-N 3.1Å; V962-P979 HydrophobicContact CG2-CG 3.94Å; V962-V1012 HydrophobicContact CG1-CG1 3.98Å; V962-I1016 HydrophobicContact CB-CD1 4.1Å; V962-I1016 HydrophobicContact CG1-CD1 3.4Å; V962-I1016 VanDerWaalsContact CG1-CD1 3.4Å; V962-I1016 HydrophobicContact CG2-CD1 3.49Å; V962-I1016 VanDerWaalsContact CG2-CD1 3.49Å; V962-I1016 HydrophobicContact CG2-CG2 4.03Å
963	S	93.7	Very high	81.7	Confident	25 Å²	25	62.1 Å²	62.1	18%	0.175	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	124.8	172.7	-58.5	0	0	0	0	110.4	L951 G952 Q976	L951-S963 PolarHBondContact N-O 2.85Å; G952-S963 PolarHBondContact O-N 2.95Å; S963-Q976 WeakPolarHBondContact OG-CG 3.47Å; S963-Q976 PolarHBondContact OG-NE2 3.22Å
964	C	95.3	Very high	82.1	Confident	0 Å²	0	65 Å²	65	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	145.6	174.5	-75.7	0	0	0	0	111.8	M948 E949 T974 F975	M948-C964 HydrophobicContact CG-CB 4.27Å; E949-C964 CarbonylContact O-C 3.59Å; E949-C964 VanDerWaalsContact O-CA 3.32Å; E949-C964 WeakPolarHBondContact O-CA 3.06Å; C964-T974 VanDerWaalsContact O-CA 3.3Å; C964-T974 WeakPolarHBondContact O-CA 3.17Å; C964-F975 HydrophobicContact CB-CE1 4.15Å; C964-F975 HydrophobicContact CB-CE2 4.2Å; C964-F975 HydrophobicContact CB-CZ 3.87Å; C964-F975 PolarHBondContact N-O 2.61Å; C964-F975 PolarHBondContact O-N 3.01Å
965	R	95.9	Very high	82.8	Confident	64 Å²	64	63.8 Å²	63.8	24%	0.242	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	139.5	157.5	-166.6	169.9	82.8	-98.8	-14	109.3	M948 E949 L951 D967 S972 V973 T974	M948-R965 CarbonylContact C-O 3.5Å; M948-R965 VanDerWaalsContact CA-O 3.32Å; M948-R965 WeakPolarHBondContact CA-O 3.27Å; E949-R965 PolarHBondContact N-O 2.95Å; E949-R965 PolarHBondContact O-N 3.13Å; E949-R965 IonicContact OE2-CZ 3.38Å; E949-R965 IonicContact OE2-NH1 2.8Å; E949-R965 PolarHBondContact OE2-NH1 3.47Å; E949-R965 IonicContact OE2-NH2 3.06Å; E949-R965 PolarHBondContact OE2-NH2 2.81Å; L951-R965 HydrophobicContact CD1-CB 4.14Å; L951-R965 HydrophobicContact CD2-CB 4.26Å; L951-R965 HydrophobicContact CG-CB 4.28Å; R965-D967 WeakPolarHBondContact CD-OD1 3.32Å; R965-D967 IonicContact CZ-OD2 3.3Å; R965-D967 VanDerWaalsContact CZ-OD2 3.25Å; R965-D967 IonicContact NE-OD1 2.71Å; R965-D967 PolarHBondContact NE-OD1 2.8Å; R965-D967 IonicContact NE-OD2 3.65Å; R965-D967 PolarHBondContact NE-OD2 2.79Å; R965-D967 IonicContact NH2-OD2 2.65Å; R965-D967 PolarHBondContact NH2-OD2 2.68Å; R965-S972 WeakPolarHBondContact CD-OG 3.46Å; R965-V973 CarbonylContact C-O 3.59Å; R965-V973 WeakPolarHBondContact CA-O 3.5Å; R965-V973 WeakPolarHBondContact CG-O 3.45Å; R965-T974 HydrophobicContact CB-CG2 3.7Å; R965-T974 HydrophobicContact CG-CG2 3.72Å
966	L	95.5	Very high	83.9	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	115.1	172.7	171.2	63	0	0	0	108.6	V946 V947 M948 T968 S972 V973 F975 L991 L997 V1005	V946-L966 HydrophobicContact CG1-CD1 3.66Å; V947-L966 CarbonylContact O-C 3.46Å; V947-L966 WeakPolarHBondContact O-CA 3.44Å; M948-L966 HydrophobicContact CB-CD1 4.45Å; M948-L966 HydrophobicContact CE-CD1 4.14Å; L966-T968 HydrophobicContact CD1-CG2 4.5Å; L966-T968 HydrophobicContact CG-CG2 4.27Å; L966-S972 WeakPolarHBondContact O-CA 3.46Å; L966-V973 HydrophobicContact CB-CG1 3.86Å; L966-V973 HydrophobicContact CD2-CG1 4.23Å; L966-V973 HydrophobicContact CG-CG1 4.3Å; L966-V973 PolarHBondContact N-O 2.77Å; L966-V973 PolarHBondContact O-N 2.71Å; L966-F975 HydrophobicContact CB-CE1 3.95Å; L966-F975 HydrophobicContact CD2-CE1 4.44Å; L966-L991 HydrophobicContact CD2-CD1 4.02Å; L966-L997 HydrophobicContact CD2-CD1 3.76Å; L966-V1005 HydrophobicContact CD1-CG2 4Å; L966-V1005 HydrophobicContact CD2-CG1 4.1Å; L966-V1005 HydrophobicContact CD2-CG2 3.82Å
967	D	92.4	Very high	85.7	Confident	42 Å²	42	60 Å²	60	23%	0.225	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	116.9	177.5	-61.2	-41.5	0	0	0	109.3	V947 R965 S972	V947-D967 HydrophobicContact CB-CB 4.44Å; V947-D967 PolarHBondContact N-O 3.22Å; V947-D967 PolarHBondContact O-N 3.06Å; R965-D967 WeakPolarHBondContact CD-OD1 3.32Å; R965-D967 IonicContact CZ-OD2 3.3Å; R965-D967 VanDerWaalsContact CZ-OD2 3.25Å; R965-D967 IonicContact NE-OD1 2.71Å; R965-D967 PolarHBondContact NE-OD1 2.8Å; R965-D967 IonicContact NE-OD2 3.65Å; R965-D967 PolarHBondContact NE-OD2 2.79Å; R965-D967 IonicContact NH2-OD2 2.65Å; R965-D967 PolarHBondContact NH2-OD2 2.68Å; D967-S972 VanDerWaalsContact OD1-CB 3.27Å; D967-S972 WeakPolarHBondContact OD1-CB 3.5Å; D967-S972 PolarHBondContact OD1-OG 2.96Å
968	T	89.8	Confident	87.4	Confident	20 Å²	20	54 Å²	54	12%	0.123	29%	0.29	C	S	.	.			trans	-110	178.2	174.3	72	0	0	0	0	110.8	L966 H970 K971 L997	L966-T968 HydrophobicContact CD1-CG2 4.5Å; L966-T968 HydrophobicContact CG-CG2 4.27Å; T968-H970 PolarHBondContact O-N 2.81Å; T968-H970 VanDerWaalsContact O-N 3.11Å; T968-H970 PolarHBondContact OG1-CE1 3.36Å; T968-H970 PolarHBondContact OG1-N 2.8Å; T968-K971 PolarHBondContact N-O 2.57Å; T968-K971 PolarHBondContact OG1-N 2.77Å; T968-K971 PolarHBondContact OG1-O 2.99Å; T968-L997 HydrophobicContact CG2-CD1 3.98Å
969	S	80.1	Confident	88.9	Confident	74 Å²	74	47.2 Å²	47.2	52%	0.517	26%	0.255	S	S	.	.	S	Bend	trans	-64.6	-9.6	177.1	62.7	0	0	0	0	115.8
970	H	77.6	Confident	89.9	Confident	92 Å²	92	44 Å²	44	43%	0.426	26%	0.262	S	S	.	.	S	Bend	trans	-142.4	-19.3	-169.4	52.1	-77.8	0	0	0	114.2	T968 H1001	T968-H970 PolarHBondContact O-N 2.81Å; T968-H970 VanDerWaalsContact O-N 3.11Å; T968-H970 PolarHBondContact OG1-CE1 3.36Å; T968-H970 PolarHBondContact OG1-N 2.8Å; H970-H1001 AromaticContact CE1-CE1 3.9Å
971	K	85.9	Confident	90.4	Very high	82 Å²	82	46.4 Å²	46.4	36%	0.357	27%	0.273	S	S	.	.			trans	-145.7	144.9	177.1	-141.4	-175.3	-160.8	170.4	0	110.9	T968 E994 D995 C996	T968-K971 PolarHBondContact N-O 2.57Å; T968-K971 PolarHBondContact OG1-N 2.77Å; T968-K971 PolarHBondContact OG1-O 2.99Å; K971-E994 PolarHBondContact NZ-O 3.04Å; K971-D995 VanDerWaalsContact CD-O 3.31Å; K971-D995 WeakPolarHBondContact CD-O 3.37Å; K971-D995 PolarHBondContact NZ-O 2.71Å; K971-C996 HydrophobicContact CD-CB 4.22Å; K971-C996 PolarHBondContact NZ-SG 3.4Å
972	S	90.8	Very high	90.5	Very high	72 Å²	72	47.8 Å²	47.8	50%	0.503	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	130.9	163.5	-179.8	0	0	0	0	107.7	R965 L966 D967	R965-S972 WeakPolarHBondContact CD-OG 3.46Å; L966-S972 WeakPolarHBondContact O-CA 3.46Å; D967-S972 VanDerWaalsContact OD1-CB 3.27Å; D967-S972 WeakPolarHBondContact OD1-CB 3.5Å; D967-S972 PolarHBondContact OD1-OG 2.96Å
973	V	94.1	Very high	90.5	Very high	23 Å²	23	54.5 Å²	54.5	14%	0.139	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	144.4	-179.6	63.6	0	0	0	0	109.8	R965 L966 F975 L991 C996	R965-V973 CarbonylContact C-O 3.59Å; R965-V973 WeakPolarHBondContact CA-O 3.5Å; R965-V973 WeakPolarHBondContact CG-O 3.45Å; L966-V973 HydrophobicContact CB-CG1 3.86Å; L966-V973 HydrophobicContact CD2-CG1 4.23Å; L966-V973 HydrophobicContact CG-CG1 4.3Å; L966-V973 PolarHBondContact N-O 2.77Å; L966-V973 PolarHBondContact O-N 2.71Å; V973-F975 HydrophobicContact CG1-CD1 4.41Å; V973-L991 HydrophobicContact CG1-CD2 4.18Å; V973-L991 HydrophobicContact CG2-CD2 4.28Å; V973-C996 HydrophobicContact CB-CB 4.43Å; V973-C996 HydrophobicContact CG1-CB 4.34Å; V973-C996 HydrophobicContact CG2-CB 4.39Å
974	T	95.2	Very high	90.4	Very high	95 Å²	95	54.9 Å²	54.9	58%	0.583	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.4	169	34.8	0	0	0	0	108.6	L951 C964 R965	L951-T974 HydrophobicContact CD1-CG2 3.64Å; C964-T974 VanDerWaalsContact O-CA 3.3Å; C964-T974 WeakPolarHBondContact O-CA 3.17Å; R965-T974 HydrophobicContact CB-CG2 3.7Å; R965-T974 HydrophobicContact CG-CG2 3.72Å
975	F	95.1	Very high	90.3	Very high	30 Å²	30	57.6 Å²	57.6	13%	0.132	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	159.7	-177.2	64	-89.2	0	0	0	110.8	M948 C964 L966 V973 F977 I987 L991 L1009	M948-F975 HydrophobicContact SD-CZ 4.49Å; C964-F975 HydrophobicContact CB-CE1 4.15Å; C964-F975 HydrophobicContact CB-CE2 4.2Å; C964-F975 HydrophobicContact CB-CZ 3.87Å; C964-F975 PolarHBondContact N-O 2.61Å; C964-F975 PolarHBondContact O-N 3.01Å; L966-F975 HydrophobicContact CB-CE1 3.95Å; L966-F975 HydrophobicContact CD2-CE1 4.44Å; V973-F975 HydrophobicContact CG1-CD1 4.41Å; F975-F977 AromaticContact CD2-CD1 3.99Å; F975-F977 HydrophobicContact CD2-CD1 3.99Å; F975-F977 AromaticContact CE2-CD1 3.65Å; F975-F977 HydrophobicContact CE2-CD1 3.65Å; F975-F977 AromaticContact CE2-CE1 3.97Å; F975-F977 HydrophobicContact CE2-CE1 3.97Å; F975-I987 HydrophobicContact CD2-CG2 4.09Å; F975-I987 HydrophobicContact CE2-CG2 3.75Å; F975-I987 HydrophobicContact CZ-CG2 4.36Å; F975-L991 HydrophobicContact CD1-CD1 4.23Å; F975-L991 HydrophobicContact CD1-CD2 4.26Å; F975-L991 HydrophobicContact CE1-CD1 3.93Å; F975-L991 HydrophobicContact CZ-CD1 4.2Å; F975-L1009 HydrophobicContact CE2-CD2 4.02Å; F975-L1009 HydrophobicContact CZ-CD2 4.15Å
976	Q	94.3	Very high	90.2	Very high	121 Å²	121	58 Å²	58	57%	0.565	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.3	148.1	174	-75.8	-178.4	-12.1	0	0	110.6	L961 V962 S963	L961-Q976 HydrophobicContact CD2-CB 4.4Å; V962-Q976 VanDerWaalsContact O-CA 3.24Å; V962-Q976 WeakPolarHBondContact O-CA 3.29Å; S963-Q976 WeakPolarHBondContact OG-CG 3.47Å; S963-Q976 PolarHBondContact OG-NE2 3.22Å
977	F	94.2	Very high	90.1	Very high	3 Å²	3	58.8 Å²	58.8	1%	0.013	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	156.1	174.2	68.7	-82	0	0	0	110.4	V962 F975 P979 D982 I987 L1009 V1012 I1013	V962-F977 HydrophobicContact CB-CD1 4.32Å; V962-F977 HydrophobicContact CB-CE1 3.92Å; V962-F977 HydrophobicContact CB-CE2 4.32Å; V962-F977 HydrophobicContact CB-CZ 3.93Å; V962-F977 HydrophobicContact CG1-CD1 4.5Å; V962-F977 HydrophobicContact CG1-CE1 3.7Å; V962-F977 HydrophobicContact CG1-CZ 3.77Å; V962-F977 PolarHBondContact N-O 2.86Å; V962-F977 PolarHBondContact O-N 2.87Å; V962-F977 VanDerWaalsContact O-N 3.1Å; F975-F977 AromaticContact CD2-CD1 3.99Å; F975-F977 HydrophobicContact CD2-CD1 3.99Å; F975-F977 AromaticContact CE2-CD1 3.65Å; F975-F977 HydrophobicContact CE2-CD1 3.65Å; F975-F977 AromaticContact CE2-CE1 3.97Å; F975-F977 HydrophobicContact CE2-CE1 3.97Å; F977-P979 HydrophobicContact CE2-CB 4.21Å; F977-D982 WeakPolarHBondContact CA-OD2 3.15Å; F977-D982 HydrophobicContact CB-CB 3.97Å; F977-I987 HydrophobicContact CB-CD1 3.71Å; F977-I987 HydrophobicContact CB-CG1 4.38Å; F977-I987 HydrophobicContact CD1-CD1 4.29Å; F977-I987 HydrophobicContact CD2-CD1 3.73Å; F977-I987 HydrophobicContact CE2-CD1 4.42Å; F977-I987 HydrophobicContact CG-CD1 3.65Å; F977-L1009 HydrophobicContact CD1-CD2 4.19Å; F977-L1009 HydrophobicContact CE1-CD2 3.6Å; F977-L1009 HydrophobicContact CE2-CD2 4.2Å; F977-L1009 HydrophobicContact CZ-CD2 3.6Å; F977-V1012 HydrophobicContact CE1-CG1 4.46Å; F977-V1012 HydrophobicContact CZ-CG1 3.81Å; F977-I1013 HydrophobicContact CE2-CD1 4.18Å; F977-I1013 HydrophobicContact CE2-CG1 3.72Å; F977-I1013 HydrophobicContact CZ-CG1 4.38Å
978	A	91.2	Very high	90.2	Very high	10 Å²	10	56.8 Å²	56.8	8%	0.083	33%	0.333	C	S	.	.			trans	-100.5	116.2	174.3	0	0	0	0	0	109.7	F959 A960 L961 G980 T981 D982	F959-A978 HydrophobicContact CB-CB 4.44Å; A960-A978 WeakPolarHBondContact O-CA 3.35Å; L961-A978 HydrophobicContact CD2-CB 4.42Å; A978-G980 PolarHBondContact O-N 2.94Å; A978-T981 WeakPolarHBondContact CB-OG1 3.27Å; A978-T981 PolarHBondContact O-N 3.26Å; A978-T981 PolarHBondContact O-OG1 3.42Å; A978-D982 PolarHBondContact N-OD2 2.95Å; A978-D982 PolarHBondContact O-N 3.14Å
979	P	87.7	Confident	90.2	Very high	17 Å²	17	59.8 Å²	59.8	11%	0.11	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-11	-168.9	28.6	-35.1	0	0	0	114	A960 V962 F977 I1013	A960-P979 VanDerWaalsContact O-CD 3.27Å; A960-P979 WeakPolarHBondContact O-CD 3.38Å; V962-P979 HydrophobicContact CG2-CG 3.94Å; F977-P979 HydrophobicContact CE2-CB 4.21Å; P979-I1013 HydrophobicContact CB-CB 4.43Å; P979-I1013 HydrophobicContact CB-CG1 3.91Å; P979-I1013 HydrophobicContact CB-CG2 4.2Å
980	G	81.9	Confident	90.8	Very high	76 Å²	76	62.7 Å²	62.7	78%	0.784	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-13	172.9	0	0	0	0	0	115.2	A978	A978-G980 PolarHBondContact O-N 2.94Å
981	T	87.3	Confident	91.5	Very high	93 Å²	93	58.7 Å²	58.7	57%	0.571	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.2	-37.5	-177	57.1	0	0	0	0	113.6	A978	A978-T981 WeakPolarHBondContact CB-OG1 3.27Å; A978-T981 PolarHBondContact O-N 3.26Å; A978-T981 PolarHBondContact O-OG1 3.42Å
982	D	90.3	Very high	91.8	Very high	65 Å²	65	57 Å²	57	35%	0.348	33%	0.331	S	S	.	.			trans	-90.7	115.4	-173.2	-63.5	-42.2	0	0	0	111.5	F977 A978 I987	F977-D982 WeakPolarHBondContact CA-OD2 3.15Å; F977-D982 HydrophobicContact CB-CB 3.97Å; A978-D982 PolarHBondContact N-OD2 2.95Å; A978-D982 PolarHBondContact O-N 3.14Å; D982-I987 HydrophobicContact CB-CD1 3.94Å; D982-I987 HydrophobicContact CB-CG1 4.15Å
983	K	91.5	Very high	91.8	Very high	141 Å²	141	57.6 Å²	57.6	61%	0.613	34%	0.34	S	S	*	.			trans	-78.4	138	-179.8	-64.4	178.7	-178.7	176.5	0	111	C985 T986 I987	K983-C985 VanDerWaalsContact C-N 3.27Å; K983-C985 PolarHBondContact O-N 3Å; K983-C985 VanDerWaalsContact O-N 3.13Å; K983-T986 WeakPolarHBondContact O-CB 3.12Å; K983-T986 PolarHBondContact O-N 2.86Å; K983-I987 PolarHBondContact O-N 2.76Å; K983-I987 VanDerWaalsContact O-N 3.14Å
984	P	93.4	Very high	91.6	Very high	32 Å²	32	62.4 Å²	62.4	21%	0.208	36%	0.361	C	S	.	.	H	α-helix	trans	-46.9	-44.4	177.7	-34	37.6	0	0	0	114.8	T986 I987 A988 E1006 L1009 I1013	P984-T986 VanDerWaalsContact C-N 3.35Å; P984-T986 PolarHBondContact O-N 2.77Å; P984-I987 PolarHBondContact O-N 2.71Å; P984-A988 WeakPolarHBondContact O-CB 3.44Å; P984-A988 PolarHBondContact O-N 2.83Å; P984-E1006 HydrophobicContact CB-CB 4.49Å; P984-L1009 HydrophobicContact CB-CB 3.78Å; P984-L1009 HydrophobicContact CB-CD1 4.48Å; P984-L1009 HydrophobicContact CG-CB 4.08Å; P984-I1013 HydrophobicContact CG-CD1 3.69Å
985	C	92.9	Very high	91.2	Very high	58 Å²	58	64.1 Å²	64.1	39%	0.392	37%	0.367	S	S	.	.	H	α-helix	trans	-65.2	-34.4	179	59.7	0	0	0	0	113.7	K983 T989 E1006	K983-C985 VanDerWaalsContact C-N 3.27Å; K983-C985 PolarHBondContact O-N 3Å; K983-C985 VanDerWaalsContact O-N 3.13Å; C985-T989 WeakPolarHBondContact O-CB 3.38Å; C985-T989 PolarHBondContact O-N 2.76Å; C985-T989 PolarHBondContact O-OG1 3.22Å; C985-E1006 WeakPolarHBondContact CA-OE1 3.44Å; C985-E1006 WeakPolarHBondContact CB-OE1 3.45Å
986	T	93.1	Very high	90.8	Very high	72 Å²	72	63.1 Å²	63.1	44%	0.442	36%	0.363	S	S	.	.	H	α-helix	trans	-70.6	-40	176.6	-51.5	0	0	0	0	110.9	K983 P984 K990	K983-T986 WeakPolarHBondContact O-CB 3.12Å; K983-T986 PolarHBondContact O-N 2.86Å; P984-T986 VanDerWaalsContact C-N 3.35Å; P984-T986 PolarHBondContact O-N 2.77Å; T986-K990 PolarHBondContact O-N 3.49Å
987	I	93.6	Very high	90.6	Very high	17 Å²	17	57.5 Å²	57.5	9%	0.087	34%	0.337	C	S	.	.	H	α-helix	trans	-65.2	-51.2	174.7	-57.1	164.1	0	0	0	110.1	F975 F977 D982 K983 P984 T989 K990 L991 L1009	F975-I987 HydrophobicContact CD2-CG2 4.09Å; F975-I987 HydrophobicContact CE2-CG2 3.75Å; F975-I987 HydrophobicContact CZ-CG2 4.36Å; F977-I987 HydrophobicContact CB-CD1 3.71Å; F977-I987 HydrophobicContact CB-CG1 4.38Å; F977-I987 HydrophobicContact CD1-CD1 4.29Å; F977-I987 HydrophobicContact CD2-CD1 3.73Å; F977-I987 HydrophobicContact CE2-CD1 4.42Å; F977-I987 HydrophobicContact CG-CD1 3.65Å; D982-I987 HydrophobicContact CB-CD1 3.94Å; D982-I987 HydrophobicContact CB-CG1 4.15Å; K983-I987 PolarHBondContact O-N 2.76Å; K983-I987 VanDerWaalsContact O-N 3.14Å; P984-I987 PolarHBondContact O-N 2.71Å; I987-T989 VanDerWaalsContact C-N 3.32Å; I987-T989 PolarHBondContact O-N 2.98Å; I987-K990 PolarHBondContact O-N 2.98Å; I987-L991 HydrophobicContact CG2-CD1 4.01Å; I987-L991 HydrophobicContact CG2-CG 4.46Å; I987-L991 WeakPolarHBondContact O-CG 3.49Å; I987-L991 PolarHBondContact O-N 2.96Å; I987-L1009 HydrophobicContact CB-CD1 3.76Å; I987-L1009 HydrophobicContact CD1-CD1 4.1Å; I987-L1009 HydrophobicContact CD1-CD2 4.07Å; I987-L1009 HydrophobicContact CG2-CD1 3.66Å
988	A	93.9	Very high	90.3	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-62.5	-36.7	-179.9	0	0	0	0	0	112.7	P984 L991 L992 V1002 V1005 E1006	P984-A988 WeakPolarHBondContact O-CB 3.44Å; P984-A988 PolarHBondContact O-N 2.83Å; A988-L991 PolarHBondContact O-N 3.47Å; A988-L992 PolarHBondContact O-N 2.92Å; A988-V1002 HydrophobicContact CB-CG1 4.13Å; A988-V1005 HydrophobicContact CB-CG1 4.13Å; A988-E1006 HydrophobicContact CB-CG 3.58Å
989	T	91.3	Very high	90.1	Very high	83 Å²	83	68.4 Å²	68.4	51%	0.509	39%	0.386	S	S	.	.	H	α-helix	trans	-67.9	-38.9	174.7	-58	0	0	0	0	112	C985 I987 L992 A993	C985-T989 WeakPolarHBondContact O-CB 3.38Å; C985-T989 PolarHBondContact O-N 2.76Å; C985-T989 PolarHBondContact O-OG1 3.22Å; I987-T989 VanDerWaalsContact C-N 3.32Å; I987-T989 PolarHBondContact O-N 2.98Å; T989-L992 PolarHBondContact O-N 3.37Å; T989-A993 WeakPolarHBondContact O-CB 2.93Å; T989-A993 PolarHBondContact O-N 3.06Å
990	K	91.3	Very high	90	Very high	135 Å²	135	72.2 Å²	72.2	59%	0.587	41%	0.409	S	S	*	.	H	α-helix	trans	-64.7	-44.5	171.9	-80	-172.8	173.8	-174.7	0	112.1	T986 I987 L992 A993 E994	T986-K990 PolarHBondContact O-N 3.49Å; I987-K990 PolarHBondContact O-N 2.98Å; K990-L992 PolarHBondContact O-N 3.42Å; K990-A993 PolarHBondContact O-N 3.45Å; K990-E994 PolarHBondContact O-N 3.49Å
991	L	93.3	Very high	90.4	Very high	8 Å²	8	68.6 Å²	68.6	4%	0.042	37%	0.371	C	S	.	.	H	α-helix	trans	-61.6	-33.2	176.2	-68.9	171.9	0	0	0	112.1	L966 V973 F975 I987 A988 C996 L997 V1005	L966-L991 HydrophobicContact CD2-CD1 4.02Å; V973-L991 HydrophobicContact CG1-CD2 4.18Å; V973-L991 HydrophobicContact CG2-CD2 4.28Å; F975-L991 HydrophobicContact CD1-CD1 4.23Å; F975-L991 HydrophobicContact CD1-CD2 4.26Å; F975-L991 HydrophobicContact CE1-CD1 3.93Å; F975-L991 HydrophobicContact CZ-CD1 4.2Å; I987-L991 HydrophobicContact CG2-CD1 4.01Å; I987-L991 HydrophobicContact CG2-CG 4.46Å; I987-L991 WeakPolarHBondContact O-CG 3.49Å; I987-L991 PolarHBondContact O-N 2.96Å; A988-L991 PolarHBondContact O-N 3.47Å; L991-C996 HydrophobicContact CB-CB 4.29Å; L991-C996 HydrophobicContact CD2-CB 3.97Å; L991-C996 CarbonylContact O-C 3.42Å; L991-C996 VanDerWaalsContact O-CA 3.22Å; L991-C996 WeakPolarHBondContact O-CA 3.33Å; L991-C996 VanDerWaalsContact O-CB 3.23Å; L991-C996 WeakPolarHBondContact O-CB 3.01Å; L991-C996 PolarHBondContact O-N 3.49Å; L991-L997 HydrophobicContact CB-CB 4.31Å; L991-L997 PolarHBondContact O-N 3.02Å; L991-V1005 HydrophobicContact CD1-CG1 4.22Å
992	L	92.6	Very high	90.6	Very high	46 Å²	46	65 Å²	65	24%	0.241	35%	0.349	C	S	.	.	H	α-helix	trans	-67.5	-43.2	169.4	176.4	64.4	0	0	0	112.2	A988 T989 K990 E994 D995 L997 K999 V1002	A988-L992 PolarHBondContact O-N 2.92Å; T989-L992 PolarHBondContact O-N 3.37Å; K990-L992 PolarHBondContact O-N 3.42Å; L992-E994 VanDerWaalsContact C-N 3.3Å; L992-E994 PolarHBondContact O-N 3.48Å; L992-D995 PolarHBondContact O-N 2.91Å; L992-L997 VanDerWaalsContact CD1-O 3.32Å; L992-L997 WeakPolarHBondContact CD1-O 3.32Å; L992-K999 HydrophobicContact CD1-CG 3.82Å; L992-K999 HydrophobicContact CD2-CG 3.94Å; L992-V1002 HydrophobicContact CB-CG2 4.37Å; L992-V1002 HydrophobicContact CD2-CG2 4.05Å
993	A	89.9	Confident	90.5	Very high	84 Å²	84	68.8 Å²	68.8	69%	0.694	37%	0.365	S	S	*	.	H	α-helix	trans	-68.8	-23.1	-178.2	0	0	0	0	0	114.3	T989 K990	T989-A993 WeakPolarHBondContact O-CB 2.93Å; T989-A993 PolarHBondContact O-N 3.06Å; K990-A993 PolarHBondContact O-N 3.45Å
994	E	90.3	Very high	90.5	Very high	125 Å²	125	62.6 Å²	62.6	58%	0.584	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	17.2	176.9	-65.8	176.8	-171	0	0	113.3	K971 K990 L992 C996	K971-E994 PolarHBondContact NZ-O 3.04Å; K990-E994 PolarHBondContact O-N 3.49Å; L992-E994 VanDerWaalsContact C-N 3.3Å; L992-E994 PolarHBondContact O-N 3.48Å; E994-C996 PolarHBondContact O-N 2.97Å; E994-C996 PolarHBondContact O-SG 3.26Å
995	D	86.9	Confident	90.5	Very high	130 Å²	130	61 Å²	61	70%	0.695	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	29.8	-170.9	-80.1	-40.9	0	0	0	112.6	K971 L992 L997	K971-D995 VanDerWaalsContact CD-O 3.31Å; K971-D995 WeakPolarHBondContact CD-O 3.37Å; K971-D995 PolarHBondContact NZ-O 2.71Å; L992-D995 PolarHBondContact O-N 2.91Å; D995-L997 VanDerWaalsContact C-N 3.33Å
996	C	86.4	Confident	90.6	Very high	9 Å²	9	60.4 Å²	60.4	6%	0.061	32%	0.319	C	S	.	.	S	Bend	trans	-88.5	-5.7	174.3	-69	0	0	0	0	112.4	K971 V973 L991 E994	K971-C996 HydrophobicContact CD-CB 4.22Å; K971-C996 PolarHBondContact NZ-SG 3.4Å; V973-C996 HydrophobicContact CB-CB 4.43Å; V973-C996 HydrophobicContact CG1-CB 4.34Å; V973-C996 HydrophobicContact CG2-CB 4.39Å; L991-C996 HydrophobicContact CB-CB 4.29Å; L991-C996 HydrophobicContact CD2-CB 3.97Å; L991-C996 CarbonylContact O-C 3.42Å; L991-C996 VanDerWaalsContact O-CA 3.22Å; L991-C996 WeakPolarHBondContact O-CA 3.33Å; L991-C996 VanDerWaalsContact O-CB 3.23Å; L991-C996 WeakPolarHBondContact O-CB 3.01Å; L991-C996 PolarHBondContact O-N 3.49Å; E994-C996 PolarHBondContact O-N 2.97Å; E994-C996 PolarHBondContact O-SG 3.26Å
997	L	89.4	Confident	90.5	Very high	4 Å²	4	59.3 Å²	59.3	2%	0.021	32%	0.317	C	S	.	.	S	Bend	trans	-148.7	150.5	-179.1	-144.9	75.5	0	0	0	112	L966 T968 L991 L992 D995 H1001 V1002 V1005	L966-L997 HydrophobicContact CD2-CD1 3.76Å; T968-L997 HydrophobicContact CG2-CD1 3.98Å; L991-L997 HydrophobicContact CB-CB 4.31Å; L991-L997 PolarHBondContact O-N 3.02Å; L992-L997 VanDerWaalsContact CD1-O 3.32Å; L992-L997 WeakPolarHBondContact CD1-O 3.32Å; D995-L997 VanDerWaalsContact C-N 3.33Å; L997-H1001 HydrophobicContact CD1-CB 4.2Å; L997-H1001 HydrophobicContact CD2-CB 4.1Å; L997-H1001 HydrophobicContact CG-CB 3.92Å; L997-V1002 HydrophobicContact CD2-CB 4.46Å; L997-V1002 HydrophobicContact CD2-CG2 3.99Å; L997-V1005 HydrophobicContact CD1-CG2 3.73Å; L997-V1005 HydrophobicContact CD2-CB 4.07Å; L997-V1005 HydrophobicContact CD2-CG1 4.47Å; L997-V1005 HydrophobicContact CD2-CG2 3.94Å; L997-V1005 HydrophobicContact CG-CG2 4.47Å
998	L	88.3	Confident	90.6	Very high	74 Å²	74	58.5 Å²	58.5	39%	0.387	31%	0.313	S	S	.	.			trans	-89.5	148.7	164.2	-70.8	169.4	0	0	0	110	V1000 H1001	L998-V1000 PolarHBondContact O-N 3.47Å; L998-V1000 VanDerWaalsContact O-N 3.12Å; L998-H1001 PolarHBondContact O-N 3.46Å
999	K	86.9	Confident	90.6	Very high	167 Å²	167	58.5 Å²	58.5	73%	0.726	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-48.3	-42.1	176.9	-73	-174.3	176	177.9	0	113.2	L992 H1001 V1002	L992-K999 HydrophobicContact CD1-CG 3.82Å; L992-K999 HydrophobicContact CD2-CG 3.94Å; K999-H1001 PolarHBondContact O-N 2.95Å; K999-H1001 VanDerWaalsContact O-N 3.17Å; K999-V1002 WeakPolarHBondContact O-CB 3.44Å; K999-V1002 WeakPolarHBondContact O-CG2 3.48Å; K999-V1002 PolarHBondContact O-N 2.68Å; K999-V1002 VanDerWaalsContact O-N 3.16Å
1000	V	86.2	Confident	90.7	Very high	97 Å²	97	55.9 Å²	55.9	59%	0.588	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-61.2	-22.7	179.5	-177.7	0	0	0	0	113.4	L998 L1032	L998-V1000 PolarHBondContact O-N 3.47Å; L998-V1000 VanDerWaalsContact O-N 3.12Å; V1000-L1032 HydrophobicContact CG1-CD1 4.34Å
1001	H	90.1	Very high	90.6	Very high	1 Å²	1	53 Å²	53	1%	0.005	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-95	-6.6	-179.7	-56.3	163.6	0	0	0	113.6	V946 H970 L997 L998 K999 H1003 I1004 V1005	V946-H1001 HydrophobicContact CG2-CB 4.42Å; H970-H1001 AromaticContact CE1-CE1 3.9Å; L997-H1001 HydrophobicContact CD1-CB 4.2Å; L997-H1001 HydrophobicContact CD2-CB 4.1Å; L997-H1001 HydrophobicContact CG-CB 3.92Å; L998-H1001 PolarHBondContact O-N 3.46Å; K999-H1001 PolarHBondContact O-N 2.95Å; K999-H1001 VanDerWaalsContact O-N 3.17Å; H1001-H1003 PolarHBondContact O-N 3.1Å; H1001-I1004 WeakPolarHBondContact O-CB 3.44Å; H1001-I1004 PolarHBondContact O-N 2.82Å; H1001-V1005 PolarHBondContact O-N 3.28Å
1002	V	90.6	Very high	90.5	Very high	18 Å²	18	52.7 Å²	52.7	11%	0.109	29%	0.29	C	S	.	.	H	α-helix	trans	-55.9	-57.4	-173.1	172.5	0	0	0	0	111.5	A988 L992 L997 K999 I1004 V1005 E1006	A988-V1002 HydrophobicContact CB-CG1 4.13Å; L992-V1002 HydrophobicContact CB-CG2 4.37Å; L992-V1002 HydrophobicContact CD2-CG2 4.05Å; L997-V1002 HydrophobicContact CD2-CB 4.46Å; L997-V1002 HydrophobicContact CD2-CG2 3.99Å; K999-V1002 WeakPolarHBondContact O-CB 3.44Å; K999-V1002 WeakPolarHBondContact O-CG2 3.48Å; K999-V1002 PolarHBondContact O-N 2.68Å; K999-V1002 VanDerWaalsContact O-N 3.16Å; V1002-I1004 PolarHBondContact O-N 3.27Å; V1002-V1005 PolarHBondContact O-N 2.9Å; V1002-E1006 HydrophobicContact CG1-CG 4.27Å; V1002-E1006 WeakPolarHBondContact O-CG 3.48Å; V1002-E1006 PolarHBondContact O-N 2.96Å
1003	H	89.1	Confident	90.4	Very high	144 Å²	144	51.8 Å²	51.8	67%	0.667	29%	0.285	S	S	*	.	H	α-helix	trans	-63.1	-26.2	-178.6	-62.2	-42.3	0	0	0	114.1	H1001 E1006 A1007	H1001-H1003 PolarHBondContact O-N 3.1Å; H1003-E1006 WeakPolarHBondContact CA-OE2 3.44Å; H1003-E1006 IonicContact CE1-OE2 3.13Å; H1003-E1006 IonicContact CG-OE2 2.67Å; H1003-E1006 IonicContact ND1-OE2 2.76Å; H1003-E1006 PolarHBondContact ND1-OE2 3.49Å; H1003-A1007 WeakPolarHBondContact O-CB 3.22Å; H1003-A1007 PolarHBondContact O-N 3.21Å
1004	I	91.5	Very high	90.3	Very high	10 Å²	10	54.1 Å²	54.1	5%	0.051	28%	0.282	C	S	.	.	H	α-helix	trans	-70.2	-44	174	-61	172.8	0	0	0	110.1	V946 H1001 V1002 A1007 Q1008 T1030 L1032 P1040	V946-I1004 HydrophobicContact CB-CG2 4.24Å; V946-I1004 HydrophobicContact CG1-CG2 4.31Å; H1001-I1004 WeakPolarHBondContact O-CB 3.44Å; H1001-I1004 PolarHBondContact O-N 2.82Å; V1002-I1004 PolarHBondContact O-N 3.27Å; I1004-A1007 PolarHBondContact O-N 2.95Å; I1004-Q1008 HydrophobicContact CG2-CG 4.49Å; I1004-Q1008 WeakPolarHBondContact O-CB 3.31Å; I1004-Q1008 WeakPolarHBondContact O-CG 3.27Å; I1004-Q1008 PolarHBondContact O-N 3.3Å; I1004-T1030 HydrophobicContact CD1-CG2 4.29Å; I1004-T1030 HydrophobicContact CG1-CG2 4.46Å; I1004-T1030 HydrophobicContact CG2-CG2 3.79Å; I1004-L1032 HydrophobicContact CD1-CD1 3.62Å; I1004-L1032 HydrophobicContact CD1-CD2 3.92Å; I1004-L1032 HydrophobicContact CD1-CG 3.68Å; I1004-P1040 HydrophobicContact CG1-CG 4.45Å
1005	V	93.3	Very high	90.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-71.3	-35.2	178.9	169.1	0	0	0	0	111.5	V946 M948 L966 A988 L991 L997 H1001 V1002 L1009	V946-V1005 HydrophobicContact CG1-CG2 4.15Å; M948-V1005 HydrophobicContact CE-CB 4.45Å; M948-V1005 HydrophobicContact CE-CG1 3.91Å; M948-V1005 HydrophobicContact CE-CG2 4.49Å; L966-V1005 HydrophobicContact CD1-CG2 4Å; L966-V1005 HydrophobicContact CD2-CG1 4.1Å; L966-V1005 HydrophobicContact CD2-CG2 3.82Å; A988-V1005 HydrophobicContact CB-CG1 4.13Å; L991-V1005 HydrophobicContact CD1-CG1 4.22Å; L997-V1005 HydrophobicContact CD1-CG2 3.73Å; L997-V1005 HydrophobicContact CD2-CB 4.07Å; L997-V1005 HydrophobicContact CD2-CG1 4.47Å; L997-V1005 HydrophobicContact CD2-CG2 3.94Å; L997-V1005 HydrophobicContact CG-CG2 4.47Å; H1001-V1005 PolarHBondContact O-N 3.28Å; V1002-V1005 PolarHBondContact O-N 2.9Å; V1005-L1009 HydrophobicContact CG1-CD1 3.99Å; V1005-L1009 VanDerWaalsContact O-CB 3.26Å; V1005-L1009 WeakPolarHBondContact O-CB 3.28Å; V1005-L1009 WeakPolarHBondContact O-CG 3.23Å; V1005-L1009 PolarHBondContact O-N 3.02Å
1006	E	94.2	Very high	90.1	Very high	45 Å²	45	45.3 Å²	45.3	21%	0.21	24%	0.238	C	C	.	.	H	α-helix	trans	-60.2	-45.9	169.9	-69.9	178.4	137.9	0	0	111.9	P984 C985 A988 V1002 H1003 L1009 G1010	P984-E1006 HydrophobicContact CB-CB 4.49Å; C985-E1006 WeakPolarHBondContact CA-OE1 3.44Å; C985-E1006 WeakPolarHBondContact CB-OE1 3.45Å; A988-E1006 HydrophobicContact CB-CG 3.58Å; V1002-E1006 HydrophobicContact CG1-CG 4.27Å; V1002-E1006 WeakPolarHBondContact O-CG 3.48Å; V1002-E1006 PolarHBondContact O-N 2.96Å; H1003-E1006 WeakPolarHBondContact CA-OE2 3.44Å; H1003-E1006 IonicContact CE1-OE2 3.13Å; H1003-E1006 IonicContact CG-OE2 2.67Å; H1003-E1006 IonicContact ND1-OE2 2.76Å; H1003-E1006 PolarHBondContact ND1-OE2 3.49Å; E1006-L1009 PolarHBondContact O-N 2.84Å; E1006-G1010 PolarHBondContact O-N 3.02Å
1007	A	92.2	Very high	89.9	Confident	48 Å²	48	50 Å²	50	40%	0.397	26%	0.263	S	S	.	.	H	α-helix	trans	-68	-43.9	178.9	0	0	0	0	0	112.4	H1003 I1004 L1009 G1010 E1011 I1042	H1003-A1007 WeakPolarHBondContact O-CB 3.22Å; H1003-A1007 PolarHBondContact O-N 3.21Å; I1004-A1007 PolarHBondContact O-N 2.95Å; A1007-L1009 PolarHBondContact O-N 2.87Å; A1007-G1010 WeakPolarHBondContact O-CA 3.31Å; A1007-G1010 PolarHBondContact O-N 2.93Å; A1007-G1010 VanDerWaalsContact O-N 3.14Å; A1007-E1011 PolarHBondContact O-N 2.87Å; A1007-I1042 HydrophobicContact CB-CD1 3.94Å
1008	Q	94.4	Very high	89.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.4	-41.1	174.1	-73.2	179.1	-4.2	0	0	111.6	V946 M948 I1004 G1010 E1011 V1012 L1028 T1030 I1042	V946-Q1008 PolarHBondContact O-NE2 2.81Å; M948-Q1008 HydrophobicContact CB-CB 4.45Å; M948-Q1008 HydrophobicContact CE-CB 3.74Å; M948-Q1008 HydrophobicContact SD-CB 4.17Å; I1004-Q1008 HydrophobicContact CG2-CG 4.49Å; I1004-Q1008 WeakPolarHBondContact O-CB 3.31Å; I1004-Q1008 WeakPolarHBondContact O-CG 3.27Å; I1004-Q1008 PolarHBondContact O-N 3.3Å; Q1008-G1010 VanDerWaalsContact C-N 3.32Å; Q1008-G1010 PolarHBondContact O-N 2.77Å; Q1008-E1011 PolarHBondContact O-N 2.78Å; Q1008-V1012 VanDerWaalsContact O-CG2 3.31Å; Q1008-V1012 WeakPolarHBondContact O-CG2 3.31Å; Q1008-V1012 PolarHBondContact O-N 3.11Å; Q1008-L1028 HydrophobicContact CB-CD1 4.07Å; Q1008-L1028 HydrophobicContact CG-CB 4.12Å; Q1008-L1028 HydrophobicContact CG-CD1 4.34Å; Q1008-L1028 WeakPolarHBondContact O-CD1 3.39Å; Q1008-T1030 PolarHBondContact NE2-OG1 2.82Å; Q1008-I1042 HydrophobicContact CG-CD1 4.23Å
1009	L	94.8	Very high	88.7	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64	-36.1	172.9	-84.7	164.9	0	0	0	112.7	M948 F975 F977 P984 I987 V1005 E1006 A1007 V1012 I1013	M948-L1009 HydrophobicContact CE-CG 4.06Å; M948-L1009 HydrophobicContact SD-CD2 4.27Å; M948-L1009 HydrophobicContact SD-CG 4.18Å; F975-L1009 HydrophobicContact CE2-CD2 4.02Å; F975-L1009 HydrophobicContact CZ-CD2 4.15Å; F977-L1009 HydrophobicContact CD1-CD2 4.19Å; F977-L1009 HydrophobicContact CE1-CD2 3.6Å; F977-L1009 HydrophobicContact CE2-CD2 4.2Å; F977-L1009 HydrophobicContact CZ-CD2 3.6Å; P984-L1009 HydrophobicContact CB-CB 3.78Å; P984-L1009 HydrophobicContact CB-CD1 4.48Å; P984-L1009 HydrophobicContact CG-CB 4.08Å; I987-L1009 HydrophobicContact CB-CD1 3.76Å; I987-L1009 HydrophobicContact CD1-CD1 4.1Å; I987-L1009 HydrophobicContact CD1-CD2 4.07Å; I987-L1009 HydrophobicContact CG2-CD1 3.66Å; V1005-L1009 HydrophobicContact CG1-CD1 3.99Å; V1005-L1009 VanDerWaalsContact O-CB 3.26Å; V1005-L1009 WeakPolarHBondContact O-CB 3.28Å; V1005-L1009 WeakPolarHBondContact O-CG 3.23Å; V1005-L1009 PolarHBondContact O-N 3.02Å; E1006-L1009 PolarHBondContact O-N 2.84Å; A1007-L1009 PolarHBondContact O-N 2.87Å; L1009-V1012 PolarHBondContact O-N 3.22Å; L1009-I1013 VanDerWaalsContact O-CG1 3.31Å; L1009-I1013 WeakPolarHBondContact O-CG1 3.42Å; L1009-I1013 PolarHBondContact O-N 2.82Å
1010	G	92.2	Very high	87.6	Confident	29 Å²	29	47 Å²	47	30%	0.299	27%	0.266	S	S	.	.	H	α-helix	trans	-57.9	-49.7	172.1	0	0	0	0	0	112.2	E1006 A1007 Q1008 I1013 Q1014	E1006-G1010 PolarHBondContact O-N 3.02Å; A1007-G1010 WeakPolarHBondContact O-CA 3.31Å; A1007-G1010 PolarHBondContact O-N 2.93Å; A1007-G1010 VanDerWaalsContact O-N 3.14Å; Q1008-G1010 VanDerWaalsContact C-N 3.32Å; Q1008-G1010 PolarHBondContact O-N 2.77Å; G1010-I1013 PolarHBondContact O-N 2.88Å; G1010-Q1014 WeakPolarHBondContact O-CB 3.23Å; G1010-Q1014 PolarHBondContact O-N 3.07Å
1011	E	91	Very high	86.7	Confident	75 Å²	75	49.1 Å²	49.1	35%	0.35	27%	0.268	S	S	.	.	H	α-helix	trans	-62.7	-41.6	174.6	-78.3	-168	177.2	0	0	112.6	A1007 Q1008 I1013 Q1014 L1015 L1028 I1042	A1007-E1011 PolarHBondContact O-N 2.87Å; Q1008-E1011 PolarHBondContact O-N 2.78Å; E1011-I1013 PolarHBondContact O-N 2.95Å; E1011-Q1014 PolarHBondContact O-N 3.46Å; E1011-L1015 VanDerWaalsContact O-CB 3.23Å; E1011-L1015 WeakPolarHBondContact O-CB 3.49Å; E1011-L1015 PolarHBondContact O-N 3.31Å; E1011-L1028 HydrophobicContact CB-CD1 3.71Å; E1011-L1028 WeakPolarHBondContact OE2-CD2 3.29Å; E1011-I1042 HydrophobicContact CG-CD1 4.48Å; E1011-I1042 WeakPolarHBondContact OE2-CG2 3.39Å
1012	V	91	Very high	85.8	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-60.2	-45.7	176.8	172.5	0	0	0	0	111.3	M948 I950 V962 F977 Q1008 L1009 L1015 I1016 L1028	M948-V1012 HydrophobicContact SD-CG2 4.01Å; I950-V1012 HydrophobicContact CD1-CB 4.37Å; I950-V1012 HydrophobicContact CD1-CG1 3.88Å; I950-V1012 HydrophobicContact CD1-CG2 4.03Å; I950-V1012 HydrophobicContact CG1-CG1 3.91Å; I950-V1012 HydrophobicContact CG1-CG2 3.96Å; V962-V1012 HydrophobicContact CG1-CG1 3.98Å; F977-V1012 HydrophobicContact CE1-CG1 4.46Å; F977-V1012 HydrophobicContact CZ-CG1 3.81Å; Q1008-V1012 VanDerWaalsContact O-CG2 3.31Å; Q1008-V1012 WeakPolarHBondContact O-CG2 3.31Å; Q1008-V1012 PolarHBondContact O-N 3.11Å; L1009-V1012 PolarHBondContact O-N 3.22Å; V1012-L1015 PolarHBondContact O-N 2.96Å; V1012-I1016 HydrophobicContact CG1-CD1 3.79Å; V1012-I1016 WeakPolarHBondContact O-CB 3.43Å; V1012-I1016 WeakPolarHBondContact O-CG1 3.32Å; V1012-I1016 PolarHBondContact O-N 3.43Å; V1012-L1028 HydrophobicContact CG2-CD1 3.91Å
1013	I	90.3	Very high	85	Confident	26 Å²	26	54.6 Å²	54.6	13%	0.133	29%	0.29	C	S	.	.	H	α-helix	trans	-61.1	-46.7	176.1	-71.1	171.5	0	0	0	110.2	F977 P979 P984 L1009 G1010 E1011 L1015 I1016 N1017	F977-I1013 HydrophobicContact CE2-CD1 4.18Å; F977-I1013 HydrophobicContact CE2-CG1 3.72Å; F977-I1013 HydrophobicContact CZ-CG1 4.38Å; P979-I1013 HydrophobicContact CB-CB 4.43Å; P979-I1013 HydrophobicContact CB-CG1 3.91Å; P979-I1013 HydrophobicContact CB-CG2 4.2Å; P984-I1013 HydrophobicContact CG-CD1 3.69Å; L1009-I1013 VanDerWaalsContact O-CG1 3.31Å; L1009-I1013 WeakPolarHBondContact O-CG1 3.42Å; L1009-I1013 PolarHBondContact O-N 2.82Å; G1010-I1013 PolarHBondContact O-N 2.88Å; E1011-I1013 PolarHBondContact O-N 2.95Å; I1013-L1015 PolarHBondContact O-N 2.84Å; I1013-I1016 PolarHBondContact O-N 2.88Å; I1013-N1017 WeakPolarHBondContact CG2-ND2 3.34Å; I1013-N1017 WeakPolarHBondContact O-CB 3.34Å; I1013-N1017 PolarHBondContact O-N 3.21Å; I1013-N1017 PolarHBondContact O-ND2 2.97Å
1014	Q	87.2	Confident	84.9	Confident	134 Å²	134	50.3 Å²	50.3	63%	0.626	27%	0.274	S	S	*	.	H	α-helix	trans	-65.2	-40	-179	-169.3	170.7	9.5	0	0	112.3	G1010 E1011 S1018	G1010-Q1014 WeakPolarHBondContact O-CB 3.23Å; G1010-Q1014 PolarHBondContact O-N 3.07Å; E1011-Q1014 PolarHBondContact O-N 3.46Å; Q1014-S1018 WeakPolarHBondContact O-CB 3.39Å; Q1014-S1018 PolarHBondContact O-N 3.28Å; Q1014-S1018 VanDerWaalsContact O-N 3.1Å; Q1014-S1018 PolarHBondContact O-OG 3.42Å
1015	L	87.4	Confident	84.7	Confident	55 Å²	55	51.1 Å²	51.1	29%	0.288	28%	0.284	S	S	.	.	H	α-helix	trans	-65.8	-44.4	178.7	-171	67	0	0	0	111.7	I950 E1011 V1012 I1013 S1018 D1019 T1026	I950-L1015 HydrophobicContact CD1-CD2 3.95Å; E1011-L1015 VanDerWaalsContact O-CB 3.23Å; E1011-L1015 WeakPolarHBondContact O-CB 3.49Å; E1011-L1015 PolarHBondContact O-N 3.31Å; V1012-L1015 PolarHBondContact O-N 2.96Å; I1013-L1015 PolarHBondContact O-N 2.84Å; L1015-S1018 PolarHBondContact O-N 2.96Å; L1015-D1019 PolarHBondContact O-N 2.94Å; L1015-T1026 HydrophobicContact CD2-CG2 4.11Å
1016	I	85.1	Confident	84.4	Confident	14 Å²	14	51.2 Å²	51.2	7%	0.072	29%	0.285	C	S	.	.	H	α-helix	trans	-75.8	-34.8	-178.5	-66.7	176	0	0	0	111.7	I950 V962 V1012 I1013 S1018 G1020	I950-I1016 HydrophobicContact CD1-CD1 4.17Å; I950-I1016 HydrophobicContact CD1-CG1 4.41Å; I950-I1016 HydrophobicContact CG2-CD1 4.07Å; V962-I1016 HydrophobicContact CB-CD1 4.1Å; V962-I1016 HydrophobicContact CG1-CD1 3.4Å; V962-I1016 VanDerWaalsContact CG1-CD1 3.4Å; V962-I1016 HydrophobicContact CG2-CD1 3.49Å; V962-I1016 VanDerWaalsContact CG2-CD1 3.49Å; V962-I1016 HydrophobicContact CG2-CG2 4.03Å; V1012-I1016 HydrophobicContact CG1-CD1 3.79Å; V1012-I1016 WeakPolarHBondContact O-CB 3.43Å; V1012-I1016 WeakPolarHBondContact O-CG1 3.32Å; V1012-I1016 PolarHBondContact O-N 3.43Å; I1013-I1016 PolarHBondContact O-N 2.88Å; I1016-S1018 PolarHBondContact O-N 3.39Å; I1016-G1020 VanDerWaalsContact O-CA 3.23Å; I1016-G1020 WeakPolarHBondContact O-CA 3.2Å; I1016-G1020 PolarHBondContact O-N 3.13Å
1017	N	83.7	Confident	84.3	Confident	108 Å²	108	52.7 Å²	52.7	58%	0.578	29%	0.291	S	S	*	.	H	α-helix	trans	-69.7	-16.8	171.1	-69.6	-8.5	0	0	0	113	I1013	I1013-N1017 WeakPolarHBondContact CG2-ND2 3.34Å; I1013-N1017 WeakPolarHBondContact O-CB 3.34Å; I1013-N1017 PolarHBondContact O-N 3.21Å; I1013-N1017 PolarHBondContact O-ND2 2.97Å
1018	S	80.7	Confident	84.3	Confident	90 Å²	90	50.7 Å²	50.7	63%	0.629	27%	0.273	S	S	*	.	H	α-helix	trans	-87.3	-45	175.3	-59.3	0	0	0	0	112.4	Q1014 L1015 I1016	Q1014-S1018 WeakPolarHBondContact O-CB 3.39Å; Q1014-S1018 PolarHBondContact O-N 3.28Å; Q1014-S1018 VanDerWaalsContact O-N 3.1Å; Q1014-S1018 PolarHBondContact O-OG 3.42Å; L1015-S1018 PolarHBondContact O-N 2.96Å; I1016-S1018 PolarHBondContact O-N 3.39Å
1019	D	70	Confident	84	Confident	73 Å²	73	51.3 Å²	51.3	39%	0.39	28%	0.279	S	S	.	.			trans	-158.2	79.3	-174.4	-142.3	-37.3	0	0	0	110.7	L1015 K1021 K1022	L1015-D1019 PolarHBondContact O-N 2.94Å; D1019-K1021 PolarHBondContact O-N 3.14Å; D1019-K1022 HydrophobicContact CB-CB 4.27Å; D1019-K1022 HydrophobicContact CB-CD 4.12Å; D1019-K1022 HydrophobicContact CB-CG 4.32Å; D1019-K1022 PolarHBondContact O-N 2.92Å; D1019-K1022 IonicContact OD1-NZ 2.77Å; D1019-K1022 WeakPolarHBondContact OD2-CD 3.34Å; D1019-K1022 WeakPolarHBondContact OD2-CE 3.43Å; D1019-K1022 IonicContact OD2-NZ 2.86Å; D1019-K1022 PolarHBondContact OD2-NZ 3.43Å
1020	G	65.7	Low	83.6	Confident	19 Å²	19	51.4 Å²	51.4	20%	0.196	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-19	-160.7	0	0	0	0	0	117.7	I1016	I1016-G1020 VanDerWaalsContact O-CA 3.23Å; I1016-G1020 WeakPolarHBondContact O-CA 3.2Å; I1016-G1020 PolarHBondContact O-N 3.13Å
1021	K	66.4	Low	82.9	Confident	142 Å²	142	53.4 Å²	53.4	62%	0.617	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-17	176.5	-67.2	-174.7	176.3	74.8	0	114.6	E955 D1019	E955-K1021 IonicContact OE1-NZ 3.01Å; E955-K1021 PolarHBondContact OE1-NZ 2.79Å; E955-K1021 IonicContact OE2-NZ 2.71Å; E955-K1021 PolarHBondContact OE2-NZ 3.32Å; D1019-K1021 PolarHBondContact O-N 3.14Å
1022	K	71.2	Confident	81.8	Confident	133 Å²	133	51.9 Å²	51.9	58%	0.578	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-18.9	178.2	-64.4	-176.7	-171.1	156.4	0	113.8	D1019 V1024 M1046	D1019-K1022 HydrophobicContact CB-CB 4.27Å; D1019-K1022 HydrophobicContact CB-CD 4.12Å; D1019-K1022 HydrophobicContact CB-CG 4.32Å; D1019-K1022 PolarHBondContact O-N 2.92Å; D1019-K1022 IonicContact OD1-NZ 2.77Å; D1019-K1022 WeakPolarHBondContact OD2-CD 3.34Å; D1019-K1022 WeakPolarHBondContact OD2-CE 3.43Å; D1019-K1022 IonicContact OD2-NZ 2.86Å; D1019-K1022 PolarHBondContact OD2-NZ 3.43Å; K1022-V1024 VanDerWaalsContact C-N 3.33Å; K1022-V1024 PolarHBondContact O-N 3.02Å; K1022-M1046 VanDerWaalsContact O-CE 3.29Å; K1022-M1046 WeakPolarHBondContact O-CE 3.39Å
1023	G	74.5	Confident	80.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.296	C	S	.	.	S	Bend	trans	-69.5	-27.1	178.2	0	0	0	0	0	114.1	I950 G1025 T1026	I950-G1023 WeakPolarHBondContact CD1-O 3.1Å; G1023-G1025 PolarHBondContact O-N 3.01Å; G1023-T1026 WeakPolarHBondContact O-CB 3.17Å; G1023-T1026 PolarHBondContact O-N 3.32Å; G1023-T1026 PolarHBondContact O-OG1 3.38Å
1024	V	86.6	Confident	78.3	Confident	55 Å²	55	57.7 Å²	57.7	33%	0.333	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	131.6	-173.3	-176.4	0	0	0	0	111.6	I950 K1022 T1026	I950-V1024 HydrophobicContact CG2-CG2 4.46Å; K1022-V1024 VanDerWaalsContact C-N 3.33Å; K1022-V1024 PolarHBondContact O-N 3.02Å; V1024-T1026 VanDerWaalsContact C-N 3.32Å
1025	G	86.7	Confident	76.3	Confident	26 Å²	26	57.4 Å²	57.4	27%	0.268	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	-7.5	-174.5	0	0	0	0	0	115	I950 G1023 K1027	I950-G1025 WeakPolarHBondContact O-CA 3.41Å; I950-G1025 PolarHBondContact O-N 2.97Å; G1023-G1025 PolarHBondContact O-N 3.01Å; G1025-K1027 PolarHBondContact O-N 2.91Å
1026	T	88.1	Confident	74.3	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.012	33%	0.328	C	S	.	.			trans	-65.9	132.7	176.5	-56.1	0	0	0	0	110.7	E949 I950 L1015 G1023 V1024 L1028 M1046	E949-T1026 WeakPolarHBondContact CA-O 3.08Å; I950-T1026 PolarHBondContact N-O 3Å; I950-T1026 VanDerWaalsContact N-O 3.13Å; L1015-T1026 HydrophobicContact CD2-CG2 4.11Å; G1023-T1026 WeakPolarHBondContact O-CB 3.17Å; G1023-T1026 PolarHBondContact O-N 3.32Å; G1023-T1026 PolarHBondContact O-OG1 3.38Å; V1024-T1026 VanDerWaalsContact C-N 3.32Å; T1026-L1028 HydrophobicContact CG2-CD2 4.24Å; T1026-M1046 HydrophobicContact CG2-CG 4.13Å
1027	K	92.1	Very high	72.2	Confident	77 Å²	77	64.7 Å²	64.7	34%	0.335	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	117.6	172	-77.4	-172.4	165.1	84.3	0	111.1	V947 M948 E949 G1025 V1045	V947-K1027 HydrophobicContact CG1-CB 4.46Å; V947-K1027 HydrophobicContact CG1-CD 4.34Å; V947-K1027 HydrophobicContact CG1-CG 4.48Å; M948-K1027 CarbonylContact O-C 3.57Å; M948-K1027 WeakPolarHBondContact O-CA 3.38Å; E949-K1027 HydrophobicContact CB-CG 3.99Å; E949-K1027 HydrophobicContact CG-CG 3.96Å; E949-K1027 WeakPolarHBondContact OE1-CE 3.39Å; E949-K1027 IonicContact OE1-NZ 3.33Å; E949-K1027 PolarHBondContact OE1-NZ 3.18Å; E949-K1027 WeakPolarHBondContact OE2-CE 3.37Å; E949-K1027 IonicContact OE2-NZ 3.86Å; E949-K1027 PolarHBondContact OE2-NZ 3.05Å; G1025-K1027 PolarHBondContact O-N 2.91Å; K1027-V1045 PolarHBondContact N-O 3.44Å; K1027-V1045 PolarHBondContact O-N 3.39Å
1028	L	90.8	Very high	70	Confident	6 Å²	6	66.9 Å²	66.9	3%	0.031	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	124.2	166	-55.8	-175	0	0	0	108.3	V947 M948 Q1008 E1011 V1012 T1026 I1042 A1044	V947-L1028 CarbonylContact C-O 3.35Å; V947-L1028 WeakPolarHBondContact CA-O 3.45Å; M948-L1028 PolarHBondContact N-O 2.74Å; M948-L1028 PolarHBondContact O-N 3.45Å; Q1008-L1028 HydrophobicContact CB-CD1 4.07Å; Q1008-L1028 HydrophobicContact CG-CB 4.12Å; Q1008-L1028 HydrophobicContact CG-CD1 4.34Å; Q1008-L1028 WeakPolarHBondContact O-CD1 3.39Å; E1011-L1028 HydrophobicContact CB-CD1 3.71Å; E1011-L1028 WeakPolarHBondContact OE2-CD2 3.29Å; V1012-L1028 HydrophobicContact CG2-CD1 3.91Å; T1026-L1028 HydrophobicContact CG2-CD2 4.24Å; L1028-I1042 HydrophobicContact CB-CG2 4.09Å; L1028-I1042 HydrophobicContact CD2-CG2 4.34Å; L1028-A1044 HydrophobicContact CD2-CB 3.64Å
1029	A	89.5	Confident	68.2	Low	13 Å²	13	67.9 Å²	67.9	11%	0.107	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	128.7	179.5	0	0	0	0	0	111.1	V947 T1043	V947-A1029 HydrophobicContact CG2-CB 4.3Å; A1029-T1043 PolarHBondContact N-O 3.37Å; A1029-T1043 PolarHBondContact O-N 2.92Å
1030	T	85.3	Confident	67.6	Low	2 Å²	2	67.7 Å²	67.7	1%	0.012	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	134	174.9	-55.7	0	0	0	0	108.9	K945 V946 I1004 Q1008 P1040	K945-T1030 WeakPolarHBondContact CA-O 3.43Å; V946-T1030 PolarHBondContact N-O 2.95Å; V946-T1030 PolarHBondContact O-N 2.87Å; I1004-T1030 HydrophobicContact CD1-CG2 4.29Å; I1004-T1030 HydrophobicContact CG1-CG2 4.46Å; I1004-T1030 HydrophobicContact CG2-CG2 3.79Å; Q1008-T1030 PolarHBondContact NE2-OG1 2.82Å; T1030-P1040 HydrophobicContact CG2-CB 3.75Å
1031	V	76.8	Confident	67	Low	70 Å²	70	72.2 Å²	72.2	42%	0.424	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	115	179.5	-179.9	0	0	0	0	108.8	K943 K945 D1033	K943-V1031 HydrophobicContact CB-CG1 3.91Å; K943-V1031 HydrophobicContact CD-CG1 4.02Å; K945-V1031 HydrophobicContact CD-CG2 4.46Å; K945-V1031 HydrophobicContact CG-CG2 4.08Å; V1031-D1033 PolarHBondContact O-N 3.31Å
1032	L	68.1	Low	67	Low	43 Å²	43	67.3 Å²	67.3	23%	0.225	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	112.2	170.3	-79.1	167.2	0	0	0	110.3	R944 V1000 I1004	R944-L1032 HydrophobicContact CB-CB 4.22Å; R944-L1032 HydrophobicContact CB-CD1 4.45Å; R944-L1032 PolarHBondContact N-O 3.48Å; R944-L1032 WeakPolarHBondContact O-CB 3.48Å; R944-L1032 PolarHBondContact O-N 2.94Å; V1000-L1032 HydrophobicContact CG1-CD1 4.34Å; I1004-L1032 HydrophobicContact CD1-CD1 3.62Å; I1004-L1032 HydrophobicContact CD1-CD2 3.92Å; I1004-L1032 HydrophobicContact CD1-CG 3.68Å
1033	D	59.3	Low	66.9	Low	69 Å²	69	64.8 Å²	64.8	37%	0.369	38%	0.382	S	S	.	.			trans	-90.1	118.6	155.8	-91.8	-53.7	0	0	0	108.9	K943 V1031 N1035 S1036	K943-D1033 VanDerWaalsContact CD-OD1 3.31Å; K943-D1033 WeakPolarHBondContact CD-OD1 3.23Å; K943-D1033 WeakPolarHBondContact CE-OD1 3.34Å; K943-D1033 WeakPolarHBondContact CE-OD2 3.18Å; K943-D1033 WeakPolarHBondContact CG-OD1 3.45Å; K943-D1033 VanDerWaalsContact NZ-CG 3.28Å; K943-D1033 IonicContact NZ-OD1 2.82Å; K943-D1033 PolarHBondContact NZ-OD1 3.07Å; K943-D1033 VanDerWaalsContact NZ-OD1 3.09Å; K943-D1033 IonicContact NZ-OD2 2.78Å; K943-D1033 PolarHBondContact NZ-OD2 3.36Å; V1031-D1033 PolarHBondContact O-N 3.31Å; D1033-N1035 PolarHBondContact O-N 3.14Å; D1033-S1036 PolarHBondContact O-N 3.36Å
1034	P	49.8	Very low	66.1	Low	80 Å²	80	67.7 Å²	67.7	52%	0.519	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	31.6	-169.4	34.3	-38.8	0	0	0	113.9	R939	R939-P1034 PolarHBondContact NH2-O 3.34Å
1035	N	44.6	Very low	64.3	Low	129 Å²	129	69.2 Å²	69.2	69%	0.69	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-151	9.3	-173.3	-115.4	23.4	0	0	0	113.4	R939 D1033	R939-N1035 VanDerWaalsContact CZ-OD1 3.28Å; R939-N1035 PolarHBondContact NH1-OD1 3.14Å; R939-N1035 PolarHBondContact NH2-OD1 3.19Å; D1033-N1035 PolarHBondContact O-N 3.14Å
1036	S	46.3	Very low	62.1	Low	71 Å²	71	72.9 Å²	72.9	50%	0.497	43%	0.427	S	S	.	.			trans	-103.4	142.9	172.8	-172.8	0	0	0	0	111.1	D1033 E1038	D1033-S1036 PolarHBondContact O-N 3.36Å; S1036-E1038 PolarHBondContact OG-N 2.92Å
1037	T	40.6	Very low	59.7	Low	150 Å²	150	76.2 Å²	76.2	92%	0.92	45%	0.448	S	S	*	.			trans	-96.6	-1.2	173.6	-26.9	0	0	0	0	112.3
1038	E	37.8	Very low	56.6	Low	155 Å²	155	81.6 Å²	81.6	72%	0.724	47%	0.472	S	S	*	.	S	Bend	trans	-80.4	150.6	176.9	-67.6	-170.6	145.1	0	0	112.1	S1036	S1036-E1038 PolarHBondContact OG-N 2.92Å
1039	P	43.1	Very low	53.6	Low	111 Å²	111	88.5 Å²	88.5	72%	0.721	51%	0.509	S	S	*	.			trans	-62.2	142.6	177.7	26.2	-34.9	0	0	0	111.8	T1041	P1039-T1041 PolarHBondContact O-N 2.84Å
1040	P	55.6	Low	50.6	Low	69 Å²	69	93.7 Å²	93.7	45%	0.448	54%	0.544	S	S	.	.			trans	-71.2	104	-171.2	28.7	-35.7	0	0	0	111.8	I1004 T1030 I1042	I1004-P1040 HydrophobicContact CG1-CG 4.45Å; T1030-P1040 HydrophobicContact CG2-CB 3.75Å; P1040-I1042 PolarHBondContact O-N 3.31Å
1041	T	53.8	Low	47.7	Very low	114 Å²	114	98.6 Å²	98.6	70%	0.699	58%	0.578	S	S	*	*			trans	-59.6	117.3	180	-56.1	0	0	0	0	111.3	P1039	P1039-T1041 PolarHBondContact O-N 2.84Å
1042	I	67.6	Low	45.4	Very low	39 Å²	39	100 Å²	100	20%	0.2	60%	0.597	C	S	.	*			trans	-75.5	129.2	170.3	-54.8	178.6	0	0	0	108	A1007 Q1008 E1011 L1028 P1040	A1007-I1042 HydrophobicContact CB-CD1 3.94Å; Q1008-I1042 HydrophobicContact CG-CD1 4.23Å; E1011-I1042 HydrophobicContact CG-CD1 4.48Å; E1011-I1042 WeakPolarHBondContact OE2-CG2 3.39Å; L1028-I1042 HydrophobicContact CB-CG2 4.09Å; L1028-I1042 HydrophobicContact CD2-CG2 4.34Å; P1040-I1042 PolarHBondContact O-N 3.31Å
1043	T	68.1	Low	43.4	Very low	80 Å²	80	102.3 Å²	102.3	49%	0.491	62%	0.623	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.6	104.9	173.3	-48.9	0	0	0	0	109	A1029	A1029-T1043 PolarHBondContact N-O 3.37Å; A1029-T1043 PolarHBondContact O-N 2.92Å
1044	A	57.5	Low	42.1	Very low	60 Å²	60	105.6 Å²	105.6	50%	0.496	65%	0.646	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.4	130.7	172.2	0	0	0	0	0	110.8	L1028	L1028-A1044 HydrophobicContact CD2-CB 3.64Å
1045	V	49.1	Very low	41.2	Very low	88 Å²	88	106.2 Å²	106.2	53%	0.533	66%	0.658	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-123.9	104.5	171.5	-176.7	0	0	0	0	107.9	K1027	K1027-V1045 PolarHBondContact N-O 3.44Å; K1027-V1045 PolarHBondContact O-N 3.39Å
1046	M	40.3	Very low	40.8	Very low	102 Å²	102	105.3 Å²	105.3	50%	0.502	66%	0.661	S	S	.	*	P	Polyproline II helix	trans	-77.3	148.7	171.1	-60	-164.2	75.6	0	0	110.2	K1022 T1026	K1022-M1046 VanDerWaalsContact O-CE 3.29Å; K1022-M1046 WeakPolarHBondContact O-CE 3.39Å; T1026-M1046 HydrophobicContact CG2-CG 4.13Å
1047	P	37.7	Very low	40	Very low	72 Å²	72	108.9 Å²	108.9	47%	0.468	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-63.4	140.8	172.5	27.6	-33.8	0	0	0	110.4
1048	K	28.2	Very low	39.7	Very low	191 Å²	191	107.1 Å²	107.1	83%	0.83	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-80.2	124.3	165.8	-90.7	-171.3	172.3	-175.7	0	109.2	S1050	K1048-S1050 PolarHBondContact O-N 3.06Å; K1048-S1050 PolarHBondContact O-OG 2.95Å
1049	D	27.5	Very low	39.2	Very low	151 Å²	151	108.3 Å²	108.3	81%	0.807	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-52.1	128.2	172.7	-64.1	-58.1	0	0	0	111
1050	S	25.8	Very low	38.5	Very low	122 Å²	122	109 Å²	109	85%	0.853	67%	0.672	S	S	*	*			trans	-120	47.6	-179	-61.7	0	0	0	0	109.9	K1048	K1048-S1050 PolarHBondContact O-N 3.06Å; K1048-S1050 PolarHBondContact O-OG 2.95Å
1051	S	25	Very low	37.3	Very low	104 Å²	104	115 Å²	115	73%	0.727	69%	0.691	S	S	*	*			trans	-143.6	60.8	-175.5	60.9	0	0	0	0	112.1
1052	A	28.4	Very low	36.2	Very low	99 Å²	99	116.2 Å²	116.2	82%	0.818	69%	0.691	S	S	*	*			trans	-154.5	131.1	162.4	0	0	0	0	0	110
1053	A	26.4	Very low	34.3	Very low	93 Å²	93	121.9 Å²	121.9	77%	0.769	72%	0.717	S	S	*	*			trans	-81.9	150.5	164.8	0	0	0	0	0	110
1054	T	31.4	Very low	32.6	Very low	138 Å²	138	125.1 Å²	125.1	85%	0.847	73%	0.73	S	S	*	*			trans	50.1	110	155.6	-48.8	0	0	0	0	118.5
1055	A	30.6	Very low	31.2	Very low	93 Å²	93	131 Å²	131	77%	0.769	75%	0.747	S	S	*	*			trans	-63.8	151.6	168.9	0	0	0	0	0	112.1
1056	S	36.1	Very low	30.3	Very low	110 Å²	110	135 Å²	135	77%	0.769	76%	0.757	S	S	*	*				-143.5	137.6	78	53.4	0	0	0	0	113.4
1057	N	30.6	Very low	29.8	Very low	146 Å²	146	136.3 Å²	136.3	78%	0.781	77%	0.771	S	S	*	*				59.8	128.3	72.9	-123.4	3	0	0	0	112.4
1058	T	32.9	Very low	29.6	Very low	112 Å²	112	138.4 Å²	138.4	69%	0.687	78%	0.784	S	S	*	*			cis	-150.8	138	22.9	49.5	0	0	0	0	115.7
1059	K	26.8	Very low	30.2	Very low	180 Å²	180	134.5 Å²	134.5	78%	0.783	78%	0.779	S	S	*	*				51.9	125.7	125.3	-165.8	-180	-172.5	176.2	0	122.6
1060	P	28.6	Very low	30.3	Very low	127 Å²	127	134.2 Å²	134.2	83%	0.825	78%	0.782	S	S	*	*			trans	-103.8	176.3	144.4	37	-30.4	0	0	0	112.8
1061	K	31.8	Very low	30.4	Very low	195 Å²	195	139 Å²	139	85%	0.848	78%	0.782	S	S	*	*			trans	-134.2	139.9	-179.3	-164.6	-162.6	170.6	-170.4	0	111.5
1062	I	29.2	Very low	30.5	Very low	139 Å²	139	141.6 Å²	141.6	71%	0.713	79%	0.787	S	S	*	*			trans	-67.6	160.2	169	-2.7	179.6	0	0	0	110
1063	E	27.9	Very low	30.6	Very low	158 Å²	158	140.6 Å²	140.6	74%	0.738	78%	0.779	S	S	*	*			cis	-154.6	-177.4	15.2	-149.8	156.4	107.1	0	0	106.4
1064	I	32.3	Very low	30.7	Very low	148 Å²	148	141.9 Å²	141.9	76%	0.759	78%	0.782	S	S	*	*			cis	-145.9	162.1	22.1	-49	166.7	0	0	0	105.3
1065	E	28.1	Very low	30.6	Very low	183 Å²	183	144.8 Å²	144.8	86%	0.855	79%	0.787	S	S	*	*				-168.1	168.2	61.8	-174.1	160.5	-159.3	0	0	114.3
1066	K	31.3	Very low	30.4	Very low	173 Å²	173	148.6 Å²	148.6	75%	0.752	79%	0.788	S	S	*	*			trans	-65.2	136.4	-162	-70.7	173.4	171.1	171.3	0	120.4
1067	T	29.7	Very low	30.6	Very low	129 Å²	129	147.7 Å²	147.7	79%	0.791	78%	0.78	S	S	*	*			trans	76.6	150.5	131.2	54	0	0	0	0	123.7
1068	P	33.9	Very low	30.6	Very low	115 Å²	115	147.5 Å²	147.5	75%	0.747	78%	0.779	S	S	*	*			trans	-126.6	-140.3	-177.4	45.9	-26.2	0	0	0	110.6
1069	P	39.1	Very low	30.4	Very low	110 Å²	110	148.9 Å²	148.9	71%	0.714	78%	0.782	S	S	*	*			cis	-122.4	166	-42.5	35.7	-21.4	0	0	0	113
1070	T	30.5	Very low	30.6	Very low	144 Å²	144	146.5 Å²	146.5	88%	0.883	78%	0.782	S	S	*	*			trans	-150.9	153.8	155.9	-41.4	0	0	0	0	112.5
1071	R	27.7	Very low	30.7	Very low	223 Å²	223	148.9 Å²	148.9	84%	0.842	78%	0.783	S	S	*	*			trans	-57.9	158	164.6	-69.1	173.1	170.7	152.7	-7.2	110.3
1072	D	26.9	Very low	30.5	Very low	158 Å²	158	145.8 Å²	145.8	85%	0.845	78%	0.78	S	S	*	*				-164.8	-177.7	68.3	-133.4	-40.6	0	0	0	115.1
1073	A	31.6	Very low	30.4	Very low	79 Å²	79	144.4 Å²	144.4	65%	0.653	78%	0.778	S	S	*	*			trans	-101.9	142.2	176.9	0	0	0	0	0	113.5
1074	S	26.9	Very low	30.4	Very low	119 Å²	119	143.5 Å²	143.5	83%	0.832	78%	0.778	S	S	*	*			trans	46.1	103.7	150.8	-56	0	0	0	0	120.1
1075	Q	30.1	Very low	30.3	Very low	200 Å²	200	142.4 Å²	142.4	94%	0.935	78%	0.778	S	S	*	*			trans	-133.8	110.3	141	-106.8	-177.4	4.7	0	0	112
1076	E	26.6	Very low	30.3	Very low	172 Å²	172	144.5 Å²	144.5	80%	0.804	78%	0.778	S	S	*	*			trans	-84.6	-175.4	158.7	-108.2	-149.1	118.3	0	0	109.5
1077	P	40.2	Very low	30.2	Very low	91 Å²	91	144.6 Å²	144.6	59%	0.591	78%	0.779	S	S	*	*			cis	-132.4	164.5	4.2	34.4	-15.3	0	0	0	115.9
1078	N	31.2	Very low	30	Very low	142 Å²	142	144 Å²	144	76%	0.759	77%	0.774	S	S	*	*				174.9	127.7	107.7	-95.6	-61.7	0	0	0	115.1
1079	N	28.7	Very low	29.7	Very low	141 Å²	141	143.2 Å²	143.2	75%	0.754	77%	0.772	S	S	*	*			trans	59.4	82	144.7	-167.1	34.1	0	0	0	119.7
1080	V	30	Very low	29	Very low	130 Å²	130	146.4 Å²	146.4	79%	0.788	78%	0.777	S	S	*	*				-143	125.6	106.4	175.9	0	0	0	0	108.5	V1082	V1080-V1082 HydrophobicContact CG1-CG2 4.5Å
1081	Q	30.2	Very low	28.8	Very low	178 Å²	178	149 Å²	149	83%	0.832	78%	0.779	S	S	*	*			trans	-94.9	149.5	166.8	-74.8	-172.8	-10.9	0	0	111.2
1082	V	28.4	Very low	28.7	Very low	130 Å²	130	143.8 Å²	143.8	79%	0.788	78%	0.777	S	S	*	*			trans	-128.1	115.2	167.2	178.8	0	0	0	0	110.2	V1080	V1080-V1082 HydrophobicContact CG1-CG2 4.5Å
1083	T	27.4	Very low	28.6	Very low	110 Å²	110	144.4 Å²	144.4	68%	0.675	78%	0.78	S	S	*	*			trans	-144.6	160	158.9	54.7	0	0	0	0	109.2
1084	N	27.5	Very low	28.3	Very low	139 Å²	139	144.6 Å²	144.6	74%	0.743	78%	0.782	S	S	*	*			trans	68.5	154.1	-174	-47	-62.1	0	0	0	113.4
1085	V	31.4	Very low	28.3	Very low	124 Å²	124	148 Å²	148	75%	0.752	78%	0.784	S	S	*	*			cis	-135	136.3	11	177.8	0	0	0	0	106
1086	R	28	Very low	28	Very low	227 Å²	227	142.9 Å²	142.9	86%	0.857	77%	0.771	S	S	*	*				53.9	155.5	84.2	-103.1	174.7	-171.6	158.5	0.9	113.1
1087	K	28.6	Very low	28.2	Very low	176 Å²	176	139.8 Å²	139.8	77%	0.765	76%	0.763	S	S	*	*			cis	-159	151	20.5	-161.3	-172.9	171.7	-168.1	0	112.7
1088	V	25	Very low	27.7	Very low	116 Å²	116	144 Å²	144	70%	0.703	78%	0.775	S	S	*	*			trans	-40.7	141.4	153.2	174.4	0	0	0	0	116.8
1089	S	28.3	Very low	27.6	Very low	99 Å²	99	141.5 Å²	141.5	69%	0.692	77%	0.769	S	S	*	*			trans	175.4	136.7	132.6	-68.7	0	0	0	0	107
1090	Q	24.6	Very low	27.7	Very low	176 Å²	176	142.5 Å²	142.5	82%	0.822	77%	0.772	S	S	*	*			cis	69.6	93.7	37	-165	-176.6	13.2	0	0	114.1
1091	E	25.9	Very low	27.9	Very low	200 Å²	200	141.9 Å²	141.9	94%	0.935	77%	0.771	S	S	*	*			trans	-167.3	159.2	141.4	-118.4	173.6	169	0	0	112
1092	S	26.1	Very low	28.1	Very low	112 Å²	112	144.8 Å²	144.8	78%	0.783	78%	0.775	S	S	*	*			trans	-160.4	104.1	175.6	59.4	0	0	0	0	112
1093	N	24.8	Very low	28.4	Very low	171 Å²	171	145 Å²	145	91%	0.914	78%	0.779	S	S	*	*			trans	-160.2	170.7	143	-132.6	-28.8	0	0	0	114.1
1094	A	24.2	Very low	28.5	Very low	84 Å²	84	143.3 Å²	143.3	69%	0.694	78%	0.783	S	S	*	*			trans	-71.6	149.9	-169.7	0	0	0	0	0	116.1
1095	E	26.8	Very low	28.5	Very low	189 Å²	189	140.4 Å²	140.4	88%	0.883	79%	0.786	S	S	*	*				-162.6	154.6	117.4	-92.9	-167.9	107	0	0	105.7
1096	S	24.1	Very low	28.6	Very low	94 Å²	94	142.5 Å²	142.5	66%	0.657	79%	0.791	S	S	*	*			cis	169.2	-174.1	-11.5	-176.7	0	0	0	0	104
1097	V	30	Very low	28.7	Very low	106 Å²	106	138.6 Å²	138.6	64%	0.642	79%	0.786	S	S	*	*			trans	72.9	94.9	163	-168.2	0	0	0	0	118.8
1098	Q	30.2	Very low	28.9	Very low	180 Å²	180	136.9 Å²	136.9	84%	0.841	79%	0.79	S	S	*	*			trans	63.6	153.9	135.5	-60.2	166.5	4.8	0	0	121
1099	S	30.6	Very low	29.2	Very low	90 Å²	90	139 Å²	139	63%	0.629	79%	0.794	S	S	*	*			cis	-174.4	138.9	-26.5	56.7	0	0	0	0	111.6
1100	I	30.5	Very low	29	Very low	161 Å²	161	139.5 Å²	139.5	83%	0.826	80%	0.798	S	S	*	*			trans	52.4	144.3	133.6	-60.3	172.5	0	0	0	119.7
1101	P	34.4	Very low	29.6	Very low	117 Å²	117	137.3 Å²	137.3	76%	0.76	80%	0.799	S	S	*	*			cis	-131.6	-175.1	7.4	30.2	-6.5	0	0	0	116.8
1102	R	32.8	Very low	29.6	Very low	240 Å²	240	134.1 Å²	134.1	91%	0.906	79%	0.793	S	S	*	*			trans	-103.7	155.5	156.3	-68.1	-179.2	173.6	-173.4	-2.1	110.6
1103	P	36.2	Very low	29.8	Very low	134 Å²	134	135.7 Å²	135.7	87%	0.87	79%	0.792	S	S	*	*				-147.4	175.6	102	37.4	-21	0	0	0	113.5
1104	G	28.5	Very low	30.1	Very low	75 Å²	75	135.5 Å²	135.5	77%	0.773	79%	0.786	S	S	*	*			cis	170	159.2	-5.5	0	0	0	0	0	112.3
1105	G	28.5	Very low	30.3	Very low	78 Å²	78	137.6 Å²	137.6	80%	0.804	79%	0.791	S	S	*	*			trans	90.1	152.3	-178.4	0	0	0	0	0	114.5
1106	I	32.2	Very low	30.5	Very low	168 Å²	168	136.3 Å²	136.3	86%	0.862	79%	0.79	S	S	*	*			cis	-133.7	151.1	8.3	-65	177.1	0	0	0	112
1107	I	29.6	Very low	30.7	Very low	145 Å²	145	137.2 Å²	137.2	74%	0.744	80%	0.796	S	S	*	*			trans	-39.1	146.2	171.4	-61.1	155.5	0	0	0	117
1108	V	32.6	Very low	30.8	Very low	140 Å²	140	136.8 Å²	136.8	85%	0.848	80%	0.803	S	S	*	*				-170.5	151	116.2	153.6	0	0	0	0	111.3
1109	M	31.3	Very low	31.2	Very low	160 Å²	160	134 Å²	134	79%	0.788	80%	0.801	S	S	*	*			trans	-87.6	148.3	-174	-66.1	148	74	0	0	111.5
1110	S	24.4	Very low	31.7	Very low	110 Å²	110	135.4 Å²	135.4	77%	0.769	81%	0.808	S	S	*	*				60.5	147.8	62.4	-53	0	0	0	0	114.5
1111	P	36.8	Very low	32.2	Very low	130 Å²	130	133.8 Å²	133.8	84%	0.844	81%	0.808	S	S	*	*			cis	-137.7	-157.8	11.3	44.2	-24.7	0	0	0	115.5
1112	T	26.8	Very low	32	Very low	132 Å²	132	135.4 Å²	135.4	81%	0.81	82%	0.816	S	S	*	*			trans	-111.9	159.2	178.7	40.5	0	0	0	0	114.8
1113	N	31.1	Very low	32	Very low	145 Å²	145	127.4 Å²	127.4	78%	0.775	81%	0.808	S	S	*	*			trans	-152.8	132.6	153.9	-94.7	-27.7	0	0	0	107.1
1114	Q	30.5	Very low	31.7	Very low	168 Å²	168	126.2 Å²	126.2	79%	0.785	81%	0.81	S	S	*	*				74.9	95.8	61.6	-82.5	-170.3	115	0	0	115.9
1115	T	27.7	Very low	32	Very low	128 Å²	128	126.9 Å²	126.9	79%	0.785	81%	0.808	S	S	*	*			trans	40.2	122.9	135.8	54.7	0	0	0	0	121.2
1116	D	31	Very low	32.3	Very low	162 Å²	162	127.9 Å²	127.9	87%	0.866	81%	0.808	S	S	*	*				-148.4	174.3	123.6	-146.8	-22.2	0	0	0	110.7
1117	S	28.7	Very low	32.7	Very low	113 Å²	113	128.9 Å²	128.9	79%	0.79	81%	0.807	S	S	*	*			trans	-137.9	125.8	-173.5	-66.3	0	0	0	0	113.9
1118	A	31.8	Very low	34	Very low	96 Å²	96	127.7 Å²	127.7	79%	0.793	81%	0.808	S	S	*	*			trans	-152.8	131.2	168	0	0	0	0	0	111.9
1119	P	38.5	Very low	35.6	Very low	121 Å²	121	124.2 Å²	124.2	79%	0.786	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-84.6	149.2	170.3	34.1	-33	0	0	0	111.6
1120	P	42	Very low	38.1	Very low	121 Å²	121	120 Å²	120	79%	0.786	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-76.1	147.7	177.2	31.6	-34.8	0	0	0	112.2
1121	P	40.2	Very low	41	Very low	126 Å²	126	115.7 Å²	115.7	82%	0.818	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-75.2	149.8	178.3	31.2	-35.3	0	0	0	112.6	G1123	P1121-G1123 PolarHBondContact O-N 2.89Å; P1121-G1123 VanDerWaalsContact O-N 3.12Å
1122	T	30.5	Very low	43	Very low	151 Å²	151	115.5 Å²	115.5	93%	0.926	72%	0.721	S	S	*	*			trans	-68.4	102.7	177	47.5	0	0	0	0	112.3
1123	G	33.2	Very low	45.2	Very low	72 Å²	72	112.1 Å²	112.1	74%	0.742	70%	0.7	S	S	*	*			trans	-97.8	106.7	163.7	0	0	0	0	0	110.7	P1121 A1125	P1121-G1123 PolarHBondContact O-N 2.89Å; P1121-G1123 VanDerWaalsContact O-N 3.12Å; G1123-A1125 VanDerWaalsContact C-N 3.28Å; G1123-A1125 PolarHBondContact O-N 3.47Å
1124	A	29.5	Very low	46.8	Very low	110 Å²	110	106.7 Å²	106.7	91%	0.909	67%	0.672	S	S	*	*			trans	-75.2	77.9	177.7	0	0	0	0	0	111.4	A1126	A1124-A1126 PolarHBondContact O-N 3.45Å
1125	A	34.2	Very low	47.6	Very low	88 Å²	88	106.6 Å²	106.6	73%	0.727	67%	0.669	S	S	*	*			trans	-66.6	119.5	168	0	0	0	0	0	109.3	G1123 K1127	G1123-A1125 VanDerWaalsContact C-N 3.28Å; G1123-A1125 PolarHBondContact O-N 3.47Å; A1125-K1127 PolarHBondContact O-N 3.34Å
1126	A	35.4	Very low	48.1	Very low	99 Å²	99	104.5 Å²	104.5	82%	0.818	66%	0.659	S	S	*	*			trans	-61.9	111.6	172.9	0	0	0	0	0	109	A1124	A1124-A1126 PolarHBondContact O-N 3.45Å
1127	K	40.7	Very low	48.3	Very low	190 Å²	190	101.1 Å²	101.1	83%	0.826	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-58.2	130.4	174.2	-70.1	-175.2	178.1	-178.1	0	108.3	A1125	A1125-K1127 PolarHBondContact O-N 3.34Å
1128	P	57.5	Low	48.4	Very low	119 Å²	119	103.4 Å²	103.4	77%	0.773	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-60.7	143.4	173.6	27.1	-34.1	0	0	0	109.2	R1130	P1128-R1130 PolarHBondContact O-N 2.91Å; P1128-R1130 VanDerWaalsContact O-N 3.16Å
1129	S	66.4	Low	48.8	Very low	68 Å²	68	104.3 Å²	104.3	48%	0.476	66%	0.655	S	S	.	*	P	Polyproline II helix	trans	-61.2	124.6	-178.9	-179.8	0	0	0	0	110.5	Q664 F1131	Q664-S1129 PolarHBondContact OE1-OG 3.12Å; S1129-F1131 PolarHBondContact O-N 2.95Å; S1129-F1131 PolarHBondContact OG-N 2.89Å
1130	R	84.2	Confident	48.6	Very low	71 Å²	71	106.8 Å²	106.8	27%	0.268	66%	0.66	S	S	.	*			trans	-78.2	-5.4	179.7	-152.1	176.8	-168.7	-174	-4.3	112.6	E619 F645 A646 D652 P1128	E619-R1130 IonicContact OE1-CZ 3.34Å; E619-R1130 VanDerWaalsContact OE1-CZ 3.25Å; E619-R1130 IonicContact OE1-NE 3.5Å; E619-R1130 PolarHBondContact OE1-NE 3.04Å; E619-R1130 IonicContact OE1-NH2 3.44Å; E619-R1130 PolarHBondContact OE1-NH2 3.06Å; F645-R1130 WeakPolarHBondContact CA-O 3.26Å; A646-R1130 HydrophobicContact CB-CG 4Å; A646-R1130 VanDerWaalsContact O-CD 3.31Å; A646-R1130 WeakPolarHBondContact O-CD 3.43Å; A646-R1130 VanDerWaalsContact O-CZ 3.32Å; A646-R1130 PolarHBondContact O-NE 2.85Å; D652-R1130 IonicContact OD1-NH1 2.63Å; D652-R1130 PolarHBondContact OD1-NH1 3.03Å; D652-R1130 IonicContact OD2-CZ 3.08Å; D652-R1130 IonicContact OD2-NH1 2.67Å; D652-R1130 PolarHBondContact OD2-NH1 3.18Å; D652-R1130 IonicContact OD2-NH2 2.71Å; D652-R1130 PolarHBondContact OD2-NH2 3.43Å; P1128-R1130 PolarHBondContact O-N 2.91Å; P1128-R1130 VanDerWaalsContact O-N 3.16Å
1131	F	85	Confident	48.2	Very low	19 Å²	19	105.1 Å²	105.1	8%	0.083	66%	0.656	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.9	126.1	-173.2	-59.2	-84.7	0	0	0	110.5	L643 Q644 F645 V657 Q660 M661 Q664 S1129	L643-F1131 HydrophobicContact CD1-CB 4.23Å; L643-F1131 HydrophobicContact CD1-CD1 4.48Å; L643-F1131 HydrophobicContact CD2-CD1 4.41Å; Q644-F1131 WeakPolarHBondContact O-CA 3.49Å; F645-F1131 HydrophobicContact CB-CD1 3.58Å; F645-F1131 HydrophobicContact CB-CE1 3.68Å; F645-F1131 HydrophobicContact CB-CG 4.48Å; F645-F1131 HydrophobicContact CG-CD1 4.4Å; F645-F1131 HydrophobicContact CG-CE1 4.2Å; V657-F1131 HydrophobicContact CG1-CE1 4.45Å; V657-F1131 HydrophobicContact CG1-CZ 4.36Å; Q660-F1131 HydrophobicContact CB-CE2 3.88Å; Q660-F1131 HydrophobicContact CB-CZ 3.89Å; M661-F1131 HydrophobicContact CE-CD1 4.44Å; M661-F1131 HydrophobicContact CE-CE1 3.78Å; M661-F1131 HydrophobicContact CG-CD1 4.03Å; M661-F1131 HydrophobicContact CG-CE1 3.37Å; M661-F1131 HydrophobicContact CG-CZ 3.98Å; M661-F1131 HydrophobicContact SD-CE1 4.44Å; Q664-F1131 VanDerWaalsContact NE2-CD2 3.33Å; S1129-F1131 PolarHBondContact O-N 2.95Å; S1129-F1131 PolarHBondContact OG-N 2.89Å
1132	Q	79	Confident	47.8	Very low	126 Å²	126	105.4 Å²	105.4	59%	0.589	66%	0.656	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-131.8	126.9	-179.8	-62.7	-172.2	10	0	0	110.3	Q644 T1134	Q644-Q1132 WeakPolarHBondContact CA-O 3.22Å; Q644-Q1132 WeakPolarHBondContact CB-O 3.37Å; Q644-Q1132 PolarHBondContact N-O 3.38Å; Q644-Q1132 PolarHBondContact O-N 3.19Å; Q1132-T1134 PolarHBondContact O-N 3.43Å
1133	V	71.9	Confident	48	Very low	62 Å²	62	103.3 Å²	103.3	38%	0.376	65%	0.645	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.3	105.7	175.9	-179.5	0	0	0	0	108.6	F637 E641 L643	F637-V1133 HydrophobicContact CB-CG1 3.88Å; F637-V1133 HydrophobicContact CB-CG2 4.23Å; E641-V1133 HydrophobicContact CB-CG1 3.64Å; E641-V1133 HydrophobicContact CG-CG1 4.24Å; E641-V1133 VanDerWaalsContact OE2-CG1 3.29Å; E641-V1133 WeakPolarHBondContact OE2-CG1 3.47Å; L643-V1133 HydrophobicContact CD1-CG2 4.16Å
1134	T	64	Low	47.9	Very low	31 Å²	31	107.9 Å²	107.9	19%	0.19	65%	0.651	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.8	127.6	-176.2	67.7	0	0	0	0	112.4	K607 Q623 E641 G642 Q644 Q1132	K607-T1134 PolarHBondContact NZ-OG1 3.08Å; Q623-T1134 PolarHBondContact NE2-OG1 3.04Å; E641-T1134 WeakPolarHBondContact CA-O 3.35Å; G642-T1134 PolarHBondContact O-N 3.04Å; Q644-T1134 HydrophobicContact CB-CG2 3.99Å; Q644-T1134 VanDerWaalsContact OE1-CG2 3.3Å; Q1132-T1134 PolarHBondContact O-N 3.43Å
1135	K	48.3	Very low	47.9	Very low	166 Å²	166	107.5 Å²	107.5	72%	0.722	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-72.5	141	169.5	-73.5	168.4	-176.8	172.4	0	111.4	E641	E641-K1135 HydrophobicContact CG-CG 4.16Å; E641-K1135 WeakPolarHBondContact OE1-CE 3.43Å; E641-K1135 WeakPolarHBondContact OE1-CG 3.32Å
1136	S	39	Very low	47.8	Very low	83 Å²	83	108.2 Å²	108.2	58%	0.58	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-81.6	136.7	167.9	-61.2	0	0	0	0	109.4	N640	N640-S1136 PolarHBondContact O-OG 3.42Å; N640-S1136 VanDerWaalsContact O-OG 3.1Å
1137	A	34.5	Very low	47.6	Very low	92 Å²	92	108.4 Å²	108.4	76%	0.76	64%	0.637	S	S	*	*			trans	-150.2	132.8	-179.4	0	0	0	0	0	111
1138	D	30.9	Very low	47.1	Very low	160 Å²	160	106.4 Å²	106.4	86%	0.856	63%	0.634	S	S	*	*			trans	-156.7	150.3	-178	-98	-44.5	0	0	0	107.4
1139	P	40.2	Very low	45.7	Very low	116 Å²	116	105.3 Å²	105.3	75%	0.753	63%	0.629	S	S	*	*				-116.6	151.9	-77.7	37.8	-33.9	0	0	0	113
1140	I	35.1	Very low	44	Very low	172 Å²	172	108.2 Å²	108.2	88%	0.882	64%	0.644	S	S	*	*			trans	-129.7	136.4	167.5	-64.8	-177.8	0	0	0	109.7	T1142	I1140-T1142 PolarHBondContact O-N 2.92Å
1141	A	32.3	Very low	41.5	Very low	86 Å²	86	109.1 Å²	109.1	71%	0.711	67%	0.666	S	S	*	*			trans	-77.5	106.7	-174.3	0	0	0	0	0	113.3
1142	T	32.3	Very low	38.8	Very low	132 Å²	132	113.9 Å²	113.9	81%	0.81	70%	0.697	S	S	*	*			trans	64.2	154.1	147	46.4	0	0	0	0	120	I1140	I1140-T1142 PolarHBondContact O-N 2.92Å
1143	P	34.5	Very low	36.7	Very low	108 Å²	108	114.4 Å²	114.4	70%	0.701	71%	0.709	S	S	*	*			trans	-113.1	179.1	-160	43	-34.2	0	0	0	114
1144	I	31.3	Very low	34.8	Very low	168 Å²	168	118.3 Å²	118.3	86%	0.862	73%	0.726	S	S	*	*				-154.2	149.8	126.3	-97.5	145.9	0	0	0	108
1145	S	28.9	Very low	34	Very low	101 Å²	101	121.8 Å²	121.8	71%	0.706	75%	0.749	S	S	*	*			trans	-111.9	179.8	-174.5	-68.5	0	0	0	0	112.8
1146	S	32.3	Very low	33.3	Very low	104 Å²	104	121.3 Å²	121.3	73%	0.727	75%	0.752	S	S	*	*			trans	82.9	129.5	178.8	75.2	0	0	0	0	115.6
1147	S	30.6	Very low	33.4	Very low	103 Å²	103	123.8 Å²	123.8	72%	0.72	76%	0.764	S	S	*	*			cis	74.8	133.7	30.8	87.1	0	0	0	0	113.1
1148	I	30.3	Very low	33.5	Very low	148 Å²	148	123.7 Å²	123.7	76%	0.759	76%	0.763	S	S	*	*			cis	-144.1	160.6	34	-72.8	178.6	0	0	0	112.2
1149	S	29.4	Very low	33.9	Very low	96 Å²	96	120.6 Å²	120.6	67%	0.671	76%	0.76	S	S	*	*			trans	-11.9	161.2	158	-42.7	0	0	0	0	120.6
1150	T	29.9	Very low	33.4	Very low	129 Å²	129	121.5 Å²	121.5	79%	0.791	76%	0.763	S	S	*	*				-174.4	162.3	73	38.7	0	0	0	0	115.1
1151	A	31.7	Very low	33.8	Very low	89 Å²	89	118.9 Å²	118.9	74%	0.736	76%	0.757	S	S	*	*			trans	70.3	148.4	148.8	0	0	0	0	0	120
1152	T	29.2	Very low	34	Very low	119 Å²	119	120.6 Å²	120.6	73%	0.73	76%	0.759	S	S	*	*			cis	-168	147.9	-15.6	-94.7	0	0	0	0	109
1153	V	33.9	Very low	34.2	Very low	138 Å²	138	120.3 Å²	120.3	84%	0.836	75%	0.753	S	S	*	*			trans	-172	146.6	136.2	141.6	0	0	0	0	109.9
1154	I	32.7	Very low	34.2	Very low	144 Å²	144	121.9 Å²	121.9	74%	0.738	75%	0.754	S	S	*	*			trans	-132.8	147.2	-171.2	-66.4	158.1	0	0	0	107.1
1155	P	45.9	Very low	34.3	Very low	103 Å²	103	118.6 Å²	118.6	67%	0.669	74%	0.742	S	S	*	*				-154.5	140.1	113.5	35.6	-15.8	0	0	0	118.3
1156	I	34.6	Very low	34.3	Very low	156 Å²	156	118 Å²	118	80%	0.8	74%	0.738	S	S	*	*			trans	72.6	137.1	135.7	-66.8	170.4	0	0	0	116.4
1157	V	41.5	Very low	34.2	Very low	135 Å²	135	120.6 Å²	120.6	82%	0.818	74%	0.738	S	S	*	*			cis	-122	159.5	29.3	-174.4	0	0	0	0	114.3
1158	A	35.4	Very low	34.9	Very low	90 Å²	90	121.1 Å²	121.1	74%	0.744	74%	0.739	S	S	*	*			trans	-64.2	178.6	175.6	0	0	0	0	0	115
1159	A	40.3	Very low	35	Very low	96 Å²	96	120.4 Å²	120.4	79%	0.793	74%	0.741	S	S	*	*			cis	-153.4	153.9	18.6	0	0	0	0	0	116.8
1160	T	28.9	Very low	35.2	Very low	134 Å²	134	123.4 Å²	123.4	82%	0.822	75%	0.748	S	S	*	*			trans	-96.8	-169	157.2	51.1	0	0	0	0	108.9
1161	P	44.3	Very low	35.4	Very low	117 Å²	117	123.7 Å²	123.7	76%	0.76	75%	0.749	S	S	*	*			cis	-114.7	-164	-5.1	40	-21.4	0	0	0	111.7
1162	T	36.7	Very low	35.6	Very low	122 Å²	122	127.7 Å²	127.7	75%	0.748	75%	0.753	S	S	*	*			cis	-128.6	175.9	13.4	64.6	0	0	0	0	111.2
1163	N	35.1	Very low	36.9	Very low	126 Å²	126	128.2 Å²	128.2	67%	0.674	76%	0.759	S	S	*	*			cis	78.5	142	20.7	-129.4	17.5	0	0	0	113.7	T1165	N1163-T1165 PolarHBondContact OD1-OG1 2.94Å
1164	I	36.1	Very low	36.9	Very low	141 Å²	141	129.1 Å²	129.1	72%	0.723	76%	0.757	S	S	*	*			cis	-136.6	131.1	23.9	-82.4	171.8	0	0	0	110.1
1165	T	31.9	Very low	37.1	Very low	99 Å²	99	127.8 Å²	127.8	61%	0.607	76%	0.756	S	S	*	*				59.6	141.5	86.2	7.2	0	0	0	0	113.5	N1163	N1163-T1165 PolarHBondContact OD1-OG1 2.94Å
1166	S	29.8	Very low	36.7	Very low	89 Å²	89	127 Å²	127	62%	0.622	76%	0.758	S	S	*	*			cis	-180	-163.1	-6.2	41.7	0	0	0	0	111.8
1167	E	30.8	Very low	36.5	Very low	158 Å²	158	128.3 Å²	128.3	74%	0.738	76%	0.761	S	S	*	*			trans	88.9	131.8	156.9	-61.3	-56.1	94.5	0	0	121.2
1168	P	44.2	Very low	36.1	Very low	114 Å²	114	127.6 Å²	127.6	74%	0.74	76%	0.756	S	S	*	*			trans	-95.9	148.9	160.8	37.5	-30.7	0	0	0	112.1
1169	V	32	Very low	36	Very low	133 Å²	133	130 Å²	130	81%	0.806	76%	0.755	S	S	*	*			trans	-139.4	147.1	177	-178.9	0	0	0	0	111.6
1170	I	33.2	Very low	35.6	Very low	160 Å²	160	130 Å²	130	82%	0.821	75%	0.746	S	S	*	*			trans	-107.3	133.8	-179.7	-59.8	166.2	0	0	0	110.3
1171	V	35.6	Very low	35.9	Very low	134 Å²	134	131.4 Å²	131.4	81%	0.812	74%	0.743	S	S	*	*			trans	-145.7	138.4	159.1	-174.5	0	0	0	0	111.2
1172	Q	34.8	Very low	35.3	Very low	174 Å²	174	133.1 Å²	133.1	81%	0.813	74%	0.744	S	S	*	*			trans	-135.4	159.1	162.9	-70	-174.9	-0.5	0	0	109.5
1173	P	56.8	Low	35.2	Very low	130 Å²	130	131 Å²	131	84%	0.844	74%	0.739	S	S	*	*			trans	-97.3	165.6	179.4	36.9	-33.9	0	0	0	115.6
1174	I	34.9	Very low	35.2	Very low	157 Å²	157	131.2 Å²	131.2	81%	0.805	75%	0.745	S	S	*	*			trans	-100.5	176.5	-169.7	55.1	167.5	0	0	0	112.8
1175	T	37	Very low	35.3	Very low	116 Å²	116	130.1 Å²	130.1	71%	0.712	75%	0.747	S	S	*	*			cis	-158.3	165.5	21.1	-24.7	0	0	0	0	113.4
1176	A	35.9	Very low	35.4	Very low	87 Å²	87	130.6 Å²	130.6	72%	0.719	76%	0.755	S	S	*	*			trans	72.4	160.1	148.3	0	0	0	0	0	120.6
1177	Q	32	Very low	36.1	Very low	183 Å²	183	131.8 Å²	131.8	86%	0.855	76%	0.761	S	S	*	*			cis	-176.9	-177.2	-48.9	-116.7	-172.7	1.8	0	0	109.8
1178	V	32.4	Very low	36.1	Very low	119 Å²	119	130.1 Å²	130.1	72%	0.721	76%	0.761	S	S	*	*			trans	92.2	99.4	170.6	-176.2	0	0	0	0	114.4
1179	I	32.9	Very low	35.4	Very low	140 Å²	140	129.1 Å²	129.1	72%	0.718	76%	0.756	S	S	*	*				84.8	130.7	75.8	-77.7	165.3	0	0	0	111.6
1180	T	32	Very low	35.4	Very low	97 Å²	97	130.7 Å²	130.7	60%	0.595	76%	0.755	S	S	*	*			cis	-159.8	177.9	7.3	15.7	0	0	0	0	113.5
1181	H	34.7	Very low	35.3	Very low	164 Å²	164	127.8 Å²	127.8	76%	0.759	75%	0.748	S	S	*	*			trans	81.2	145.5	160.7	-48.4	-61.7	0	0	0	116.6
1182	L	32.2	Very low	35.1	Very low	152 Å²	152	128 Å²	128	80%	0.796	74%	0.744	S	S	*	*			cis	-155.7	163.9	-3.8	-150.5	68.9	0	0	0	111.2
1183	A	35.3	Very low	35	Very low	77 Å²	77	123 Å²	123	64%	0.636	73%	0.728	S	S	*	*			trans	59.5	116.2	160	0	0	0	0	0	119.4
1184	T	35.7	Very low	33.9	Very low	131 Å²	131	121.3 Å²	121.3	80%	0.804	72%	0.72	S	S	*	*				75.1	145.1	54.4	65.1	0	0	0	0	116.5
1185	P	37.9	Very low	33.9	Very low	118 Å²	118	121 Å²	121	77%	0.766	72%	0.72	S	S	*	*			cis	-144	178.1	-26	40.8	-22.6	0	0	0	115.7
1186	S	33.7	Very low	33.6	Very low	110 Å²	110	120.1 Å²	120.1	77%	0.769	72%	0.718	S	S	*	*			trans	-84	164.8	153.6	-37.2	0	0	0	0	109.7
1187	P	44.6	Very low	33.5	Very low	114 Å²	114	121.3 Å²	121.3	74%	0.74	72%	0.722	S	S	*	*				-158.1	-150.9	58.5	40.6	-15.1	0	0	0	116
1188	V	31.5	Very low	33.8	Very low	123 Å²	123	118.6 Å²	118.6	75%	0.745	72%	0.72	S	S	*	*			trans	76.1	97.4	157.9	-70.1	0	0	0	0	123.4
1189	S	29.3	Very low	33.7	Very low	92 Å²	92	118.4 Å²	118.4	64%	0.643	72%	0.724	S	S	*	*				101	147.7	112.3	-63.2	0	0	0	0	122.8
1190	H	30.7	Very low	33.6	Very low	167 Å²	167	116.2 Å²	116.2	77%	0.773	73%	0.726	S	S	*	*			trans	91.3	90.4	158.9	-58.5	-58.4	0	0	0	121.5
1191	S	30.9	Very low	33.6	Very low	98 Å²	98	117.3 Å²	117.3	69%	0.685	73%	0.733	S	S	*	*				89.3	124	115.5	-58.5	0	0	0	0	121.9
1192	L	31.6	Very low	33.5	Very low	139 Å²	139	114.8 Å²	114.8	73%	0.728	73%	0.73	S	S	*	*			trans	68.1	117.3	155.5	-55.8	173.1	0	0	0	116.4
1193	S	32.8	Very low	33.7	Very low	69 Å²	69	115.3 Å²	115.3	48%	0.483	73%	0.727	S	S	.	*			cis	85.6	140	46.8	77	0	0	0	0	113.8
1194	S	35.2	Very low	33.6	Very low	95 Å²	95	116 Å²	116	66%	0.664	73%	0.728	S	S	*	*			cis	-174.4	179.4	-14	60.5	0	0	0	0	107.6
1195	N	33	Very low	33.3	Very low	149 Å²	149	116.6 Å²	116.6	80%	0.797	73%	0.726	S	S	*	*			cis	-153.6	-174.7	6.6	-160.1	1.2	0	0	0	110.3
1196	S	31.4	Very low	32.8	Very low	98 Å²	98	118.2 Å²	118.2	69%	0.685	73%	0.725	S	S	*	*			trans	-99.6	174.3	169	59.3	0	0	0	0	113.5
1197	S	34.5	Very low	33.1	Very low	113 Å²	113	117.5 Å²	117.5	79%	0.79	72%	0.72	S	S	*	*			trans	-59.5	155.4	-177.2	-44.7	0	0	0	0	114.4
1198	P	38.7	Very low	32.2	Very low	126 Å²	126	116 Å²	116	82%	0.818	71%	0.712	S	S	*	*				-150.1	-166.4	94.9	40.8	-23.1	0	0	0	114.8
1199	S	29.9	Very low	32.3	Very low	115 Å²	115	117.9 Å²	117.9	80%	0.804	72%	0.717	S	S	*	*			trans	-101.6	152.9	-173.5	-53.6	0	0	0	0	115.4
1200	A	31.2	Very low	32.3	Very low	93 Å²	93	119.8 Å²	119.8	77%	0.769	72%	0.715	S	S	*	*			trans	52.6	136.7	147.2	0	0	0	0	0	121.3
1201	T	30.8	Very low	32.3	Very low	121 Å²	121	116.9 Å²	116.9	74%	0.742	71%	0.714	S	S	*	*				178	151.4	104.5	-73.2	0	0	0	0	112.1
1202	T	32.7	Very low	32.3	Very low	111 Å²	111	118 Å²	118	68%	0.681	72%	0.716	S	S	*	*			trans	72.5	141.1	162.8	34.4	0	0	0	0	122.6
1203	H	37	Very low	32.5	Very low	162 Å²	162	117.9 Å²	117.9	75%	0.75	72%	0.722	S	S	*	*			trans	53.8	89.3	155.8	-56.8	-49.7	0	0	0	118.5
1204	S	32.4	Very low	32.8	Very low	92 Å²	92	119.7 Å²	119.7	64%	0.643	73%	0.734	S	S	*	*				80.9	134.8	58.6	77.1	0	0	0	0	115.1
1205	N	28.7	Very low	32.7	Very low	144 Å²	144	121.6 Å²	121.6	77%	0.77	74%	0.742	S	S	*	*			trans	40	129.9	145.8	-64	0.6	0	0	0	119.4
1206	M	27.4	Very low	33	Very low	151 Å²	151	120.4 Å²	120.4	74%	0.744	74%	0.742	S	S	*	*			cis	-162.6	172.2	13	-128.5	174	84	0	0	112	S1208	M1206-S1208 PolarHBondContact O-N 2.87Å
1207	S	40.9	Very low	33	Very low	95 Å²	95	119 Å²	119	66%	0.664	74%	0.743	S	S	*	*			trans	-37	123.4	161.5	51.9	0	0	0	0	114.4
1208	S	25.5	Very low	32.9	Very low	83 Å²	83	124.3 Å²	124.3	58%	0.58	75%	0.746	S	S	*	*			trans	-156.7	142.2	161.1	-80.4	0	0	0	0	105.8	M1206 Q1210	M1206-S1208 PolarHBondContact O-N 2.87Å; S1208-Q1210 PolarHBondContact OG-NE2 2.94Å
1209	I	34.1	Very low	32.3	Very low	163 Å²	163	126.4 Å²	126.4	84%	0.836	74%	0.737	S	S	*	*	S	Bend	cis	-113.2	150.4	28.6	-66.1	168.6	0	0	0	110.5
1210	Q	28.5	Very low	32.3	Very low	131 Å²	131	128.6 Å²	128.6	61%	0.612	73%	0.733	S	S	*	*			cis	175.2	164.7	-32.7	-108.4	162.1	12.4	0	0	107.3	S1208	S1208-Q1210 PolarHBondContact OG-NE2 2.94Å
1211	S	31.1	Very low	32.1	Very low	106 Å²	106	129.9 Å²	129.9	74%	0.741	73%	0.731	S	S	*	*			trans	71.3	147.1	165.9	-54.2	0	0	0	0	116.5
1212	T	31.9	Very low	31.9	Very low	121 Å²	121	130.3 Å²	130.3	74%	0.742	73%	0.733	S	S	*	*			cis	-158.6	165	-7.7	9.3	0	0	0	0	110.9
1213	T	35.3	Very low	31.8	Very low	138 Å²	138	133.3 Å²	133.3	85%	0.847	74%	0.74	S	S	*	*			trans	71	140.8	177.8	77.4	0	0	0	0	115.2
1214	S	37.8	Very low	32.1	Very low	106 Å²	106	130.8 Å²	130.8	74%	0.741	74%	0.737	S	S	*	*			cis	-148.7	146.7	-13.2	43.5	0	0	0	0	108.2
1215	V	33.8	Very low	31.8	Very low	135 Å²	135	132.4 Å²	132.4	82%	0.818	74%	0.743	S	S	*	*			cis	93.4	127	36.7	171	0	0	0	0	111.4
1216	P	40.5	Very low	31.9	Very low	124 Å²	124	130 Å²	130	81%	0.805	74%	0.738	S	S	*	*				-147.8	-175.7	-100.3	45.2	-27.9	0	0	0	118.2
1217	G	30	Very low	32	Very low	68 Å²	68	132 Å²	132	70%	0.701	75%	0.745	S	S	*	*				115.4	161.5	121.8	0	0	0	0	0	122.4
1218	R	32.2	Very low	31.6	Very low	225 Å²	225	131.5 Å²	131.5	85%	0.849	75%	0.747	S	S	*	*			trans	70.8	152.5	160.9	-69.9	-178.7	171.2	-168	0	117.3
1219	R	27.5	Very low	32	Very low	170 Å²	170	136.2 Å²	136.2	64%	0.642	76%	0.76	S	S	*	*			cis	-162.5	159.7	-7.8	-132	172.2	168.6	-171.1	-4.5	112.4
1220	F	29.1	Very low	32	Very low	162 Å²	162	134 Å²	134	71%	0.711	76%	0.759	S	S	*	*			trans	75	150.3	143.9	-82.8	-43.2	0	0	0	124.6
1221	T	27.7	Very low	32.2	Very low	120 Å²	120	130.1 Å²	130.1	74%	0.736	75%	0.754	S	S	*	*			trans	-81.5	176.2	159.3	46.1	0	0	0	0	110.2
1222	V	26.5	Very low	32.5	Very low	130 Å²	130	133.5 Å²	133.5	79%	0.788	76%	0.762	S	S	*	*			cis	-156.4	174.9	39.9	-176.3	0	0	0	0	109.1
1223	Q	29.1	Very low	32.5	Very low	173 Å²	173	132.8 Å²	132.8	81%	0.808	76%	0.762	S	S	*	*			trans	-64.6	-177	164.8	-44.8	171.3	-36.6	0	0	112.6
1224	P	43.1	Very low	32.4	Very low	109 Å²	109	131.3 Å²	131.3	71%	0.708	76%	0.757	S	S	*	*			cis	-135.4	-167.7	-6.6	28.5	-3	0	0	0	115.1
1225	V	26.3	Very low	32.1	Very low	126 Å²	126	131.8 Å²	131.8	76%	0.764	76%	0.761	S	S	*	*			trans	87.4	124.3	158.1	-172.7	0	0	0	0	120.1
1226	S	31.1	Very low	32.1	Very low	95 Å²	95	133.1 Å²	133.1	66%	0.664	76%	0.762	S	S	*	*			trans	43.1	129.2	153.5	-58.1	0	0	0	0	125.1
1227	Q	29.3	Very low	31.5	Very low	192 Å²	192	132.6 Å²	132.6	90%	0.897	76%	0.761	S	S	*	*			trans	58.8	153.7	137.9	-68.7	-178.5	-35.8	0	0	120.7
1228	A	32.5	Very low	31.9	Very low	84 Å²	84	135.8 Å²	135.8	69%	0.694	77%	0.767	S	S	*	*			cis	-173.5	153.6	-24.5	0	0	0	0	0	108.8
1229	E	33.8	Very low	32.2	Very low	182 Å²	182	130.1 Å²	130.1	85%	0.85	76%	0.759	S	S	*	*			cis	-104.9	-102	-15.2	-65.2	-177.8	8.6	0	0	110.3
1230	S	35.1	Very low	32.1	Very low	116 Å²	116	130.1 Å²	130.1	81%	0.811	77%	0.766	S	S	*	*			cis	-157.1	130.7	-9.6	58.3	0	0	0	0	109.5
1231	G	32.5	Very low	32.8	Very low	51 Å²	51	127.3 Å²	127.3	53%	0.526	76%	0.764	S	S	.	*			cis	-160.4	-174.3	-6.9	0	0	0	0	0	111.6
1232	I	37.4	Very low	32.8	Very low	177 Å²	177	129.5 Å²	129.5	91%	0.908	77%	0.766	S	S	*	*			trans	60.8	141	-175.5	64.1	168.5	0	0	0	117.2
1233	S	31	Very low	33.5	Very low	106 Å²	106	128.1 Å²	128.1	74%	0.741	76%	0.76	S	S	*	*			trans	-149.3	152.8	-155	-41.9	0	0	0	0	115.2
1234	S	33.2	Very low	33.9	Very low	106 Å²	106	125.6 Å²	125.6	74%	0.741	76%	0.757	S	S	*	*			trans	30.6	164.1	132.2	67.7	0	0	0	0	123.1
1235	S	31.7	Very low	33.8	Very low	117 Å²	117	126 Å²	126	82%	0.818	76%	0.759	S	S	*	*			cis	-178.4	-170.8	-21.8	-83.6	0	0	0	0	107.8
1236	I	34.7	Very low	34.1	Very low	162 Å²	162	124.5 Å²	124.5	83%	0.831	76%	0.76	S	S	*	*			trans	-82.1	156.3	178.8	-78	170	0	0	0	113.9
1237	S	28.3	Very low	34.3	Very low	113 Å²	113	127.1 Å²	127.1	79%	0.79	77%	0.765	S	S	*	*			trans	97.5	157.1	167	-65.7	0	0	0	0	120.5
1238	T	37.1	Very low	34.6	Very low	135 Å²	135	124.1 Å²	124.1	83%	0.828	76%	0.76	S	S	*	*			trans	-152.7	-166.5	-168	59.4	0	0	0	0	109.7
1239	P	38.2	Very low	34.6	Very low	106 Å²	106	124.8 Å²	124.8	69%	0.688	76%	0.76	S	S	*	*			cis	-142.1	-160.5	-0.1	45.1	-24.3	0	0	0	116.7
1240	H	26.7	Very low	34.3	Very low	170 Å²	170	122 Å²	122	79%	0.787	76%	0.759	S	S	*	*			trans	71.4	168.3	162.7	-105.1	-107.8	0	0	0	118.5
1241	P	42.9	Very low	34.5	Very low	103 Å²	103	121.9 Å²	121.9	67%	0.669	76%	0.755	S	S	*	*			cis	-136.6	160.1	-6.1	40.2	-22.9	0	0	0	118.8
1242	E	27.5	Very low	35.4	Very low	166 Å²	166	125 Å²	125	78%	0.776	77%	0.767	S	S	*	*			trans	48.3	164.4	145.3	-81.2	-155.6	94.6	0	0	125.2
1243	P	42.5	Very low	35.5	Very low	101 Å²	101	122.8 Å²	122.8	66%	0.656	76%	0.763	S	S	*	*			cis	-129.1	163.6	-1.9	40.5	-24.9	0	0	0	117.7
1244	T	36.2	Very low	35.7	Very low	121 Å²	121	124 Å²	124	74%	0.742	77%	0.766	S	S	*	*			trans	20.2	158.9	149.8	58.5	0	0	0	0	124.8
1245	P	42	Very low	36.6	Very low	116 Å²	116	124.3 Å²	124.3	75%	0.753	77%	0.765	S	S	*	*			cis	-140.3	168	-16.8	36.6	-17	0	0	0	118
1246	A	33.1	Very low	36.8	Very low	95 Å²	95	124.7 Å²	124.7	79%	0.785	77%	0.768	S	S	*	*			trans	67.8	158.4	154.9	0	0	0	0	0	118.3
1247	I	35.1	Very low	37	Very low	150 Å²	150	123.6 Å²	123.6	77%	0.769	77%	0.769	S	S	*	*			cis	-142.3	132.3	13.5	-73	178.2	0	0	0	110.7
1248	T	35	Very low	37.7	Very low	129 Å²	129	123.7 Å²	123.7	79%	0.791	77%	0.767	S	S	*	*			trans	56.5	144.8	150.8	-57.3	0	0	0	0	121.4
1249	S	32.4	Very low	38.1	Very low	99 Å²	99	122.5 Å²	122.5	69%	0.692	76%	0.761	S	S	*	*			cis	177.5	170.1	-23.4	72.9	0	0	0	0	107.7
1250	C	28.4	Very low	37.7	Very low	123 Å²	123	123.6 Å²	123.6	83%	0.831	77%	0.766	S	S	*	*			cis	-165.3	158.7	-31	-96.8	0	0	0	0	108.8
1251	P	37.9	Very low	37.9	Very low	114 Å²	114	121.4 Å²	121.4	74%	0.74	76%	0.764	S	S	*	*			trans	-110.1	174.7	-173.7	41.3	-34.5	0	0	0	115.4
1252	P	52.9	Low	37.3	Very low	117 Å²	117	121.6 Å²	121.6	76%	0.76	77%	0.768	S	S	*	*			trans	-77.5	153.4	166.8	34.2	-36.8	0	0	0	112.3
1253	P	38.9	Very low	37.5	Very low	129 Å²	129	121.5 Å²	121.5	84%	0.838	77%	0.773	S	S	*	*				-152.9	-159	79.1	42.4	-21.1	0	0	0	116.3
1254	V	35.2	Very low	36.8	Very low	132 Å²	132	119.7 Å²	119.7	80%	0.8	77%	0.772	S	S	*	*			trans	-97.7	179.7	-175	-72.9	0	0	0	0	113.8
1255	P	52.2	Low	36.4	Very low	112 Å²	112	120.3 Å²	120.3	73%	0.727	78%	0.776	S	S	*	*			cis	-134.4	166.6	-35.2	32.9	-15.2	0	0	0	115.1
1256	S	36.2	Very low	35.9	Very low	126 Å²	126	121.8 Å²	121.8	88%	0.881	78%	0.777	S	S	*	*			trans	-173.4	159	147.6	-84.9	0	0	0	0	112.5
1257	V	38.5	Very low	35.6	Very low	138 Å²	138	124.2 Å²	124.2	84%	0.836	78%	0.777	S	S	*	*			trans	-151.1	136.4	-169.9	149.1	0	0	0	0	107.4
1258	P	42.9	Very low	35.4	Very low	116 Å²	116	124.4 Å²	124.4	75%	0.753	78%	0.778	S	S	*	*				-145.1	-150.6	64.3	43.9	-22.5	0	0	0	112.1
1259	P	45.3	Very low	35	Very low	110 Å²	110	126.1 Å²	126.1	71%	0.714	78%	0.778	S	S	*	*			cis	-136.9	161.8	-8.9	40.1	-21.1	0	0	0	119.2
1260	V	30.7	Very low	35.2	Very low	128 Å²	128	128 Å²	128	78%	0.776	79%	0.785	S	S	*	*			trans	72.6	104.3	140.2	170.4	0	0	0	0	122.5
1261	V	30.2	Very low	35.4	Very low	124 Å²	124	125.9 Å²	125.9	75%	0.752	78%	0.776	S	S	*	*			trans	46.8	113.9	130.2	-166.7	0	0	0	0	121.2
1262	S	30.8	Very low	35.6	Very low	108 Å²	108	125.6 Å²	125.6	76%	0.755	77%	0.774	S	S	*	*				-179.1	162.5	117.3	-81.2	0	0	0	0	114
1263	N	31.3	Very low	34.6	Very low	163 Å²	163	128.9 Å²	128.9	87%	0.872	78%	0.776	S	S	*	*			trans	-36.6	152.9	168.8	-44.2	-27.4	0	0	0	114.5
1264	G	28	Very low	34.2	Very low	63 Å²	63	131.1 Å²	131.1	65%	0.649	78%	0.775	S	S	*	*			cis	129.6	152.5	6.8	0	0	0	0	0	112.2
1265	T	27.9	Very low	34	Very low	135 Å²	135	130 Å²	130	83%	0.828	77%	0.769	S	S	*	*			trans	79.1	140.2	169.2	-2.8	0	0	0	0	120.3
1266	L	30.1	Very low	33.6	Very low	147 Å²	147	130.2 Å²	130.2	77%	0.77	77%	0.77	S	S	*	*			trans	66.2	122.9	165.4	-49.4	-178.5	0	0	0	117.4
1267	N	27.3	Very low	33.4	Very low	145 Å²	145	129.5 Å²	129.5	78%	0.775	77%	0.765	S	S	*	*				74.2	118.5	50.2	-79.5	11.4	0	0	0	115.7
1268	L	30.8	Very low	33.2	Very low	154 Å²	154	127.4 Å²	127.4	81%	0.806	76%	0.763	S	S	*	*				-152.5	113.3	126.3	-124.4	61.2	0	0	0	105.5
1269	E	27.5	Very low	32.6	Very low	166 Å²	166	127.8 Å²	127.8	78%	0.776	76%	0.763	S	S	*	*				84.9	131.4	87.3	-156	154	124.2	0	0	110.5
1270	V	36.5	Very low	31.9	Very low	139 Å²	139	128.9 Å²	128.9	84%	0.842	76%	0.763	S	S	*	*				-138.5	143.4	60.3	168.5	0	0	0	0	113.2
1271	A	31.4	Very low	32	Very low	78 Å²	78	132 Å²	132	65%	0.645	77%	0.769	S	S	*	*			trans	-103.8	-145.2	174.8	0	0	0	0	0	110.1
1272	P	42.9	Very low	32	Very low	107 Å²	107	132.8 Å²	132.8	70%	0.695	77%	0.769	S	S	*	*			cis	-135.4	151.3	10.9	41.6	-22.4	0	0	0	118.5
1273	K	31.8	Very low	32.1	Very low	187 Å²	187	133.6 Å²	133.6	81%	0.813	77%	0.769	S	S	*	*				54	155.4	123	-54.3	179.3	178.3	177.5	0	120.8
1274	Q	31.3	Very low	32.1	Very low	175 Å²	175	131.6 Å²	131.6	82%	0.818	76%	0.758	S	S	*	*			cis	-136.7	167.4	26.4	-68.8	179.4	100.1	0	0	110.8
1275	T	30.6	Very low	32.3	Very low	109 Å²	109	133.7 Å²	133.7	67%	0.669	76%	0.759	S	S	*	*			cis	71.6	143.1	29.7	64.5	0	0	0	0	115.3
1276	P	44.4	Very low	32.4	Very low	116 Å²	116	134.3 Å²	134.3	75%	0.753	75%	0.752	S	S	*	*			cis	-115.8	172.7	16	27.5	-5.2	0	0	0	114.9
1277	S	31.9	Very low	32.5	Very low	111 Å²	111	134.5 Å²	134.5	78%	0.776	75%	0.749	S	S	*	*			cis	75.2	146.8	47.7	-30.4	0	0	0	0	114.2
1278	A	33.7	Very low	32.7	Very low	94 Å²	94	132.4 Å²	132.4	78%	0.777	75%	0.746	S	S	*	*			cis	-153.2	-162.2	-3.9	0	0	0	0	0	108.8
1279	T	31.3	Very low	32.8	Very low	124 Å²	124	129.8 Å²	129.8	76%	0.761	74%	0.74	S	S	*	*			cis	-162.8	-175.6	10.8	-157.5	0	0	0	0	114.1
1280	N	29.1	Very low	33.1	Very low	133 Å²	133	126.4 Å²	126.4	71%	0.711	74%	0.735	S	S	*	*			trans	-48.3	153.4	-178.6	-53	-26.5	0	0	0	121.9
1281	Q	33.3	Very low	32.8	Very low	194 Å²	194	126.1 Å²	126.1	91%	0.907	73%	0.734	S	S	*	*				172.2	170.3	105.6	-93.9	-179.9	81.3	0	0	112.9
1282	N	30.3	Very low	32.8	Very low	140 Å²	140	126.7 Å²	126.7	75%	0.749	74%	0.738	S	S	*	*				-153.3	-176.6	-94	-174.5	34.3	0	0	0	109.2
1283	V	33.3	Very low	32.1	Very low	126 Å²	126	126.7 Å²	126.7	76%	0.764	74%	0.741	S	S	*	*			trans	78.3	118.4	174.1	-171.2	0	0	0	0	113.6
1284	D	30.2	Very low	32	Very low	120 Å²	120	124.4 Å²	124.4	64%	0.642	74%	0.743	S	S	*	*			cis	-154.1	-148.5	-18.5	-150.2	-119.7	0	0	0	106.2
1285	T	32.7	Very low	31.9	Very low	108 Å²	108	120.2 Å²	120.2	66%	0.663	74%	0.738	S	S	*	*			cis	-167.8	157.6	0.4	-136.8	0	0	0	0	106.2
1286	Q	30.6	Very low	31.8	Very low	147 Å²	147	121 Å²	121	69%	0.687	74%	0.743	S	S	*	*			cis	-160.6	173.4	-19.9	-120.2	-179	97.9	0	0	108.9
1287	H	31.8	Very low	31.1	Very low	151 Å²	151	122.7 Å²	122.7	70%	0.699	75%	0.745	S	S	*	*			trans	4.9	127.5	163.6	-68.1	-62	0	0	0	123.1
1288	S	32.5	Very low	31.1	Very low	102 Å²	102	123.4 Å²	123.4	71%	0.713	74%	0.744	S	S	*	*				82.9	146.7	68.7	-57.3	0	0	0	0	114.8
1289	S	32.7	Very low	30.8	Very low	99 Å²	99	124.1 Å²	124.1	69%	0.692	74%	0.743	S	S	*	*			cis	-171.7	163	-24.4	54.9	0	0	0	0	111.7
1290	S	32.2	Very low	30.7	Very low	94 Å²	94	127.2 Å²	127.2	66%	0.657	75%	0.749	S	S	*	*			trans	63.9	116.8	147.7	56.7	0	0	0	0	123.9
1291	T	31.1	Very low	30.7	Very low	133 Å²	133	126.8 Å²	126.8	82%	0.816	75%	0.752	S	S	*	*			trans	75.6	119.4	130.2	56.9	0	0	0	0	124.9
1292	A	30.3	Very low	30.9	Very low	90 Å²	90	123 Å²	123	74%	0.744	74%	0.744	S	S	*	*				95.3	127.6	124.1	0	0	0	0	0	123.6
1293	S	29.5	Very low	31	Very low	108 Å²	108	120.5 Å²	120.5	76%	0.755	74%	0.743	S	S	*	*			trans	79	115.5	140.2	-61.8	0	0	0	0	123.5
1294	T	30	Very low	31.2	Very low	139 Å²	139	120.7 Å²	120.7	85%	0.853	74%	0.744	S	S	*	*			trans	76.2	128.3	133.2	-48.9	0	0	0	0	121
1295	A	28.9	Very low	31.3	Very low	86 Å²	86	120.8 Å²	120.8	71%	0.711	75%	0.749	S	S	*	*			trans	-54.3	167.5	-179.4	0	0	0	0	0	118.3
1296	T	28.8	Very low	31.2	Very low	125 Å²	125	123.7 Å²	123.7	77%	0.767	75%	0.754	S	S	*	*			trans	170.3	135	134.3	-76.9	0	0	0	0	112.8
1297	L	29.8	Very low	31.4	Very low	152 Å²	152	122.9 Å²	122.9	80%	0.796	76%	0.76	S	S	*	*			trans	52.7	136	163.2	-63.3	166.3	0	0	0	118.8
1298	V	30.5	Very low	31.4	Very low	127 Å²	127	121.5 Å²	121.5	77%	0.77	76%	0.762	S	S	*	*			cis	101.5	100.3	36.8	170.2	0	0	0	0	114
1299	S	27.8	Very low	31.7	Very low	108 Å²	108	122 Å²	122	76%	0.755	76%	0.763	S	S	*	*			trans	45.3	125.8	137.1	-172.6	0	0	0	0	123
1300	E	30.4	Very low	31.6	Very low	190 Å²	190	124.8 Å²	124.8	89%	0.888	77%	0.768	S	S	*	*			trans	-156	174.3	139	-126.1	170.7	-162.5	0	0	113.5
1301	T	28.3	Very low	31.6	Very low	124 Å²	124	124.7 Å²	124.7	76%	0.761	77%	0.767	S	S	*	*			trans	-135.9	-164.1	-171.2	58.6	0	0	0	0	109.6
1302	P	38.4	Very low	31.6	Very low	114 Å²	114	124.5 Å²	124.5	74%	0.74	77%	0.766	S	S	*	*			cis	-143.6	-173.7	-1.8	44	-23.9	0	0	0	118.1
1303	A	32	Very low	31.9	Very low	88 Å²	88	125.5 Å²	125.5	73%	0.727	77%	0.765	S	S	*	*			trans	74.5	140	144.6	0	0	0	0	0	124
1304	T	36.3	Very low	31.8	Very low	130 Å²	130	124.5 Å²	124.5	80%	0.798	76%	0.763	S	S	*	*				142.6	102.3	129.2	-59.5	0	0	0	0	117.3
1305	V	33.6	Very low	32.1	Very low	121 Å²	121	123.6 Å²	123.6	73%	0.733	76%	0.76	S	S	*	*			trans	70	118.2	139.4	174.2	0	0	0	0	123.7
1306	H	30.8	Very low	32	Very low	169 Å²	169	125.7 Å²	125.7	78%	0.782	76%	0.763	S	S	*	*			trans	45	153.4	143.7	-75.5	-98.1	0	0	0	122.5
1307	V	33	Very low	31.7	Very low	131 Å²	131	126.8 Å²	126.8	79%	0.794	76%	0.76	S	S	*	*			cis	-132.7	157.6	16.3	-172.2	0	0	0	0	111.7
1308	T	33.2	Very low	31.4	Very low	122 Å²	122	127.3 Å²	127.3	75%	0.748	76%	0.758	S	S	*	*			trans	-91.1	-168.8	179.3	44.1	0	0	0	0	112.7
1309	P	38.3	Very low	31.5	Very low	113 Å²	113	126 Å²	126	73%	0.734	75%	0.752	S	S	*	*			cis	-127.6	-178.8	1	45.9	-29.2	0	0	0	114
1310	I	31.5	Very low	31.3	Very low	157 Å²	157	128.3 Å²	128.3	81%	0.805	76%	0.755	S	S	*	*			cis	-158.7	-170.3	13.3	-140.1	154.8	0	0	0	107.5
1311	S	30.5	Very low	30.9	Very low	91 Å²	91	124.5 Å²	124.5	64%	0.636	75%	0.745	S	S	*	*				-143.9	163.1	-80.6	-76.4	0	0	0	0	107.4
1312	V	31.7	Very low	30.7	Very low	130 Å²	130	125.1 Å²	125.1	79%	0.788	74%	0.742	S	S	*	*			cis	68.8	131.6	40.6	177.9	0	0	0	0	111.9
1313	P	36.6	Very low	29.9	Very low	111 Å²	111	125.8 Å²	125.8	72%	0.721	74%	0.739	S	S	*	*			cis	-123.1	-168.4	13.2	40.8	-20.8	0	0	0	112.7
1314	A	27.5	Very low	29.6	Very low	86 Å²	86	126.3 Å²	126.3	71%	0.711	73%	0.726	S	S	*	*			cis	71.5	165.4	18	0	0	0	0	0	115.8
1315	P	35.7	Very low	29	Very low	121 Å²	121	127.4 Å²	127.4	79%	0.786	72%	0.722	S	S	*	*			cis	-129.1	-170.6	-34	38.5	-21	0	0	0	114.1
1316	V	27	Very low	28.6	Very low	129 Å²	129	126 Å²	126	78%	0.782	72%	0.717	S	S	*	*			trans	-47	145.6	168.3	-172.2	0	0	0	0	115.1
1317	Q	23.3	Very low	28.3	Very low	149 Å²	149	124.5 Å²	124.5	70%	0.696	72%	0.715	S	S	*	*				158	117	109.8	-166.2	154.2	1.5	0	0	117.3
1318	E	23.5	Very low	28.1	Very low	163 Å²	163	124.5 Å²	124.5	76%	0.762	72%	0.715	S	S	*	*			trans	57.7	179.5	150.9	-76.9	-179.7	132.5	0	0	120.2
1319	P	32.8	Very low	27.7	Very low	99 Å²	99	125.9 Å²	125.9	64%	0.643	72%	0.717	S	S	*	*			cis	-132.1	174.3	-17.2	16.3	8.8	0	0	0	115.8
1320	L	22.2	Very low	27.2	Very low	156 Å²	156	126.4 Å²	126.4	82%	0.817	72%	0.719	S	S	*	*			trans	61.6	147.4	147.9	-68.9	160.5	0	0	0	120
1321	V	22.6	Very low	27	Very low	111 Å²	111	125.7 Å²	125.7	67%	0.673	71%	0.712	S	S	*	*			cis	-171.7	168.2	-16.9	72.7	0	0	0	0	111.1
1322	I	23.3	Very low	26.8	Very low	137 Å²	137	129.8 Å²	129.8	70%	0.703	73%	0.726	S	S	*	*			trans	77.9	124.5	162.4	-72.8	167.2	0	0	0	118.5
1323	D	22.4	Very low	26.5	Very low	128 Å²	128	131.3 Å²	131.3	68%	0.684	73%	0.73	S	S	*	*			trans	47.6	146.1	155.8	-82.9	-63	0	0	0	121.6
1324	H	25.1	Very low	26.1	Very low	98 Å²	98	128.2 Å²	128.2	45%	0.454	71%	0.711	S	S	.	*			cis	-153.6	-177.1	28.7	-115	-19.2	0	0	0	113.3	S1565	H1324-S1565 WeakPolarHBondContact CD2-CB 3.33Å; H1324-S1565 PolarHBondContact CD2-OG 3.27Å; H1324-S1565 WeakPolarHBondContact NE2-CB 3.36Å; H1324-S1565 PolarHBondContact NE2-OG 3.06Å
1325	H	24.4	Very low	26.4	Very low	153 Å²	153	133.3 Å²	133.3	71%	0.708	72%	0.72	S	S	*	*			trans	2.2	147.8	151.2	-72.5	-87.1	0	0	0	120.3
1326	S	24.4	Very low	26.3	Very low	91 Å²	91	133.3 Å²	133.3	64%	0.636	71%	0.712	S	S	*	*			cis	-169.8	163.1	3.9	41.9	0	0	0	0	112.1
1327	D	25.3	Very low	26.3	Very low	138 Å²	138	139.2 Å²	139.2	74%	0.738	72%	0.721	S	S	*	*			trans	35.9	107.1	150.9	-57	-42.7	0	0	0	120.9
1328	V	28.8	Very low	26.5	Very low	132 Å²	132	138.8 Å²	138.8	80%	0.8	72%	0.716	S	S	*	*				-135.4	77.1	123.6	-170	0	0	0	0	109.9	Q1331	V1328-Q1331 HydrophobicContact CG1-CB 4.02Å
1329	L	25.3	Very low	26.6	Very low	150 Å²	150	137.7 Å²	137.7	79%	0.785	73%	0.725	S	S	*	*	S	Bend	trans	-103.8	141.9	146	-136.2	169.2	0	0	0	105.4
1330	T	28.2	Very low	26.4	Very low	125 Å²	125	140.8 Å²	140.8	77%	0.767	73%	0.729	S	S	*	*			trans	76.2	55.2	-177	70.7	0	0	0	0	118.1
1331	Q	26.4	Very low	26.5	Very low	141 Å²	141	141.6 Å²	141.6	66%	0.659	73%	0.728	S	S	*	*			trans	-127.7	45.5	157.6	-160	76.9	40.5	0	0	112.8	V1328 S1334	V1328-Q1331 HydrophobicContact CG1-CB 4.02Å; Q1331-S1334 PolarHBondContact NE2-OG 3.32Å
1332	L	27	Very low	26.7	Very low	177 Å²	177	142.8 Å²	142.8	93%	0.927	74%	0.736	S	S	*	*	S	Bend	trans	-143.7	30.4	161.8	-149.3	84.8	0	0	0	113.3
1333	D	24.4	Very low	26.8	Very low	163 Å²	163	142.2 Å²	142.2	87%	0.872	74%	0.743	S	S	*	*	S	Bend	trans	-136.7	52.6	163.1	-167	20.2	0	0	0	109.8
1334	S	27.9	Very low	27.1	Very low	46 Å²	46	139 Å²	139	32%	0.322	74%	0.741	S	S	.	*			trans	-144.5	27.2	179.5	53.9	0	0	0	0	112.9	Q1331 L1336	Q1331-S1334 PolarHBondContact NE2-OG 3.32Å; S1334-L1336 WeakPolarHBondContact O-CG 3.43Å; S1334-L1336 PolarHBondContact O-N 2.94Å
1335	E	34.6	Very low	27.2	Very low	192 Å²	192	141 Å²	141	90%	0.897	76%	0.76	S	S	*	*	S	Bend	trans	-69	76.5	149.2	-101.3	-64.5	143.8	0	0	108.2	R1337	E1335-R1337 PolarHBondContact O-N 3.43Å
1336	L	33.3	Very low	27.3	Very low	121 Å²	121	138.2 Å²	138.2	63%	0.634	76%	0.757	S	S	*	*			trans	-47.5	123.8	-169.2	-88.1	145	0	0	0	114	S1334 K1338	S1334-L1336 WeakPolarHBondContact O-CG 3.43Å; S1334-L1336 PolarHBondContact O-N 2.94Å; L1336-K1338 HydrophobicContact CB-CB 4.38Å; L1336-K1338 HydrophobicContact CD2-CD 4.44Å; L1336-K1338 PolarHBondContact O-N 3.03Å
1337	R	26.5	Very low	27.5	Very low	254 Å²	254	142 Å²	142	96%	0.958	77%	0.765	S	S	*	*			trans	-60.8	78.8	155.3	-60.2	-179.1	-173.2	-169	3.3	110.3	E1335	E1335-R1337 PolarHBondContact O-N 3.43Å
1338	K	28.5	Very low	27.6	Very low	140 Å²	140	140.2 Å²	140.2	61%	0.609	76%	0.763	S	S	*	*			trans	-141.7	26.1	176.8	-112	-179.9	-173.1	176.7	0	115.8	L1336 F1340	L1336-K1338 HydrophobicContact CB-CB 4.38Å; L1336-K1338 HydrophobicContact CD2-CD 4.44Å; L1336-K1338 PolarHBondContact O-N 3.03Å; K1338-F1340 HydrophobicContact CD-CE2 4.22Å; K1338-F1340 HydrophobicContact CG-CD2 4.21Å; K1338-F1340 HydrophobicContact CG-CE2 3.97Å; K1338-F1340 PolarHBondContact O-N 3.5Å
1339	C	25.6	Very low	27.5	Very low	139 Å²	139	138.6 Å²	138.6	94%	0.939	76%	0.763	S	S	*	*			trans	-63.8	103.5	145.5	-72.6	0	0	0	0	107.7
1340	F	27.3	Very low	27.5	Very low	164 Å²	164	137 Å²	137	72%	0.719	77%	0.765	S	S	*	*			trans	-68.3	159.6	-177.7	-106.6	-93.4	0	0	0	112.4	K1338 V1342	K1338-F1340 HydrophobicContact CD-CE2 4.22Å; K1338-F1340 HydrophobicContact CG-CD2 4.21Å; K1338-F1340 HydrophobicContact CG-CE2 3.97Å; K1338-F1340 PolarHBondContact O-N 3.5Å; F1340-V1342 PolarHBondContact O-N 3.25Å
1341	Q	24.3	Very low	27.7	Very low	174 Å²	174	136 Å²	136	81%	0.813	76%	0.761	S	S	*	*			trans	-62.4	125.1	163.4	-68.1	169.4	-30.8	0	0	109.9
1342	V	27.5	Very low	27.8	Very low	136 Å²	136	134.5 Å²	134.5	82%	0.824	77%	0.765	S	S	*	*			trans	-127.2	103.8	149	179.2	0	0	0	0	107	F1340	F1340-V1342 PolarHBondContact O-N 3.25Å
1343	S	26.5	Very low	28	Very low	124 Å²	124	131.5 Å²	131.5	87%	0.867	76%	0.755	S	S	*	*			trans	-81.3	111.9	166.5	-62.7	0	0	0	0	108.2
1344	G	28.2	Very low	28.3	Very low	61 Å²	61	129.2 Å²	129.2	63%	0.629	75%	0.746	S	S	*	*			trans	179.7	135.9	176.6	0	0	0	0	0	115.3
1345	V	27.7	Very low	28.6	Very low	140 Å²	140	133.3 Å²	133.3	85%	0.848	77%	0.769	S	S	*	*			trans	70.2	98.1	163.8	-167.4	0	0	0	0	117.1
1346	S	25.4	Very low	28.4	Very low	94 Å²	94	130.8 Å²	130.8	66%	0.657	76%	0.757	S	S	*	*			trans	-75.5	158.9	154.3	-54.5	0	0	0	0	110.9
1347	H	28.9	Very low	28.1	Very low	172 Å²	172	129.1 Å²	129.1	80%	0.796	76%	0.756	S	S	*	*			trans	65.8	148	175.5	-42.8	-78.7	0	0	0	112.9
1348	S	26.4	Very low	28.3	Very low	100 Å²	100	124.5 Å²	124.5	70%	0.699	75%	0.749	S	S	*	*			cis	169.7	146.6	-12.2	50.8	0	0	0	0	104.1
1349	A	27.5	Very low	28.3	Very low	97 Å²	97	123.2 Å²	123.2	80%	0.802	75%	0.753	S	S	*	*			trans	53.7	103.9	164.8	0	0	0	0	0	118.2
1350	S	25.5	Very low	28.3	Very low	117 Å²	117	121.6 Å²	121.6	82%	0.818	74%	0.744	S	S	*	*				-58.3	152.4	129.6	-48.4	0	0	0	0	108.6
1351	P	32.3	Very low	28.2	Very low	105 Å²	105	121.5 Å²	121.5	68%	0.682	75%	0.747	S	S	*	*			cis	-140.6	-176.9	31.9	43.1	-25.6	0	0	0	116.2
1352	S	29.1	Very low	28.9	Very low	109 Å²	109	119.9 Å²	119.9	76%	0.762	75%	0.749	S	S	*	*			trans	-114.4	133.5	140.7	-44.6	0	0	0	0	105.8
1353	T	30.5	Very low	29	Very low	114 Å²	114	118.5 Å²	118.5	70%	0.699	74%	0.743	S	S	*	*			cis	55.3	143.8	42	74.1	0	0	0	0	113
1354	V	31.9	Very low	29	Very low	114 Å²	114	121.4 Å²	121.4	69%	0.691	74%	0.743	S	S	*	*			cis	-126.4	167.7	-2.1	-122.8	0	0	0	0	107.1	E1356	V1354-E1356 WeakPolarHBondContact CG1-OE2 3.43Å
1355	V	33.1	Very low	29	Very low	132 Å²	132	124.4 Å²	124.4	80%	0.8	75%	0.749	S	S	*	*	S	Bend	cis	-149.4	155.8	25.2	-107	0	0	0	0	107.6
1356	E	30.4	Very low	29.3	Very low	140 Å²	140	124.6 Å²	124.6	65%	0.654	74%	0.744	S	S	*	*			cis	-155.1	-176.5	-9	-164.6	33.3	-108.5	0	0	110.2	V1354	V1354-E1356 WeakPolarHBondContact CG1-OE2 3.43Å
1357	S	28.2	Very low	29.8	Very low	86 Å²	86	125.3 Å²	125.3	60%	0.601	75%	0.747	S	S	*	*			trans	-83.1	148.1	-169.5	-57	0	0	0	0	116.8
1358	L	29.7	Very low	29.7	Very low	156 Å²	156	124.3 Å²	124.3	82%	0.817	75%	0.746	S	S	*	*				-176.4	140.2	105.9	-96.7	167.9	0	0	0	114.8
1359	T	29.1	Very low	29.8	Very low	113 Å²	113	123.5 Å²	123.5	69%	0.693	75%	0.746	S	S	*	*			trans	26.4	117.7	155.1	52.2	0	0	0	0	123
1360	S	24.7	Very low	29.9	Very low	106 Å²	106	123.8 Å²	123.8	74%	0.741	74%	0.74	S	S	*	*			trans	76.5	161.4	132.8	79.7	0	0	0	0	120.9
1361	M	26.2	Very low	30.2	Very low	162 Å²	162	126.7 Å²	126.7	80%	0.798	74%	0.741	S	S	*	*			trans	59.5	105.5	170.5	-62.8	-65.1	98.3	0	0	117.7
1362	T	38.4	Very low	30	Very low	139 Å²	139	126.9 Å²	126.9	85%	0.853	74%	0.74	S	S	*	*			trans	-56.9	145	156.2	48.4	0	0	0	0	111.3
1363	P	29.7	Very low	30.1	Very low	107 Å²	107	127.8 Å²	127.8	70%	0.695	74%	0.741	S	S	*	*				-142.2	135.5	123.3	35.3	-22.1	0	0	0	114.5
1364	Q	26.6	Very low	30.2	Very low	186 Å²	186	127.8 Å²	127.8	87%	0.869	74%	0.743	S	S	*	*				-134.5	94.7	128	-82.2	-155.6	1.6	0	0	108.7
1365	T	28	Very low	30.2	Very low	124 Å²	124	127.2 Å²	127.2	76%	0.761	75%	0.751	S	S	*	*			trans	-85.3	103.5	159.1	-60.8	0	0	0	0	106.8
1366	I	33.4	Very low	30.1	Very low	144 Å²	144	126.1 Å²	126.1	74%	0.738	75%	0.748	S	S	*	*			trans	-57.9	136.3	164.3	-69.6	178.9	0	0	0	107.3
1367	P	35.5	Very low	30.1	Very low	109 Å²	109	128.1 Å²	128.1	71%	0.708	76%	0.762	S	S	*	*			trans	-63.4	164.7	-160.5	20.2	-33.8	0	0	0	116.1
1368	L	27.8	Very low	30.2	Very low	151 Å²	151	127.2 Å²	127.2	79%	0.791	77%	0.766	S	S	*	*			trans	-38.5	141.3	173.7	-71.1	64.8	0	0	0	112.1
1369	A	29.1	Very low	30.3	Very low	83 Å²	83	129.1 Å²	129.1	69%	0.686	77%	0.771	S	S	*	*				57.4	144.2	58.9	0	0	0	0	0	112.2
1370	C	28.6	Very low	30.5	Very low	102 Å²	102	128 Å²	128	69%	0.689	77%	0.774	S	S	*	*			cis	-160.1	168.6	-9.9	-122.5	0	0	0	0	108.1
1371	Q	31.2	Very low	31.4	Very low	179 Å²	179	129.2 Å²	129.2	84%	0.836	78%	0.779	S	S	*	*			trans	-149.7	123.5	142.1	-113.3	141.9	96.9	0	0	107.7
1372	T	28	Very low	31.7	Very low	108 Å²	108	126.5 Å²	126.5	66%	0.663	78%	0.782	S	S	*	*			cis	63.7	119.2	47.6	-41	0	0	0	0	108.6
1373	V	31.4	Very low	31.3	Very low	128 Å²	128	126.1 Å²	126.1	78%	0.776	78%	0.779	S	S	*	*				-169.1	173.7	85.4	-88.9	0	0	0	0	109.8
1374	P	33.9	Very low	31.4	Very low	114 Å²	114	128.4 Å²	128.4	74%	0.74	78%	0.784	S	S	*	*			cis	-127.3	160	-2	21.9	0.6	0	0	0	115.6
1375	A	30.9	Very low	31.6	Very low	103 Å²	103	123.7 Å²	123.7	85%	0.851	78%	0.777	S	S	*	*			trans	-115.9	134.7	142.3	0	0	0	0	0	107.4
1376	S	31	Very low	31.8	Very low	108 Å²	108	122.6 Å²	122.6	76%	0.755	78%	0.78	S	S	*	*			trans	-163.6	120.7	169.9	-158.1	0	0	0	0	113.3
1377	I	30.9	Very low	31.8	Very low	182 Å²	182	119.5 Å²	119.5	93%	0.933	78%	0.777	S	S	*	*			trans	-140.4	121	152.3	-61.9	-177.4	0	0	0	105.3
1378	G	29.9	Very low	31.7	Very low	68 Å²	68	123.2 Å²	123.2	70%	0.701	78%	0.784	S	S	*	*			trans	158.6	97.9	-179.3	0	0	0	0	0	113.8
1379	Q	32	Very low	32	Very low	195 Å²	195	120.3 Å²	120.3	91%	0.911	78%	0.782	S	S	*	*			trans	-60.3	134.7	175.9	-68.8	157.4	-13	0	0	110.8
1380	A	34.2	Very low	32.2	Very low	91 Å²	91	120.4 Å²	120.4	75%	0.752	78%	0.782	S	S	*	*				78.7	156.4	57.4	0	0	0	0	0	114
1381	P	43.6	Very low	32.3	Very low	131 Å²	131	119.9 Å²	119.9	85%	0.851	78%	0.78	S	S	*	*			cis	-130.5	162	-23.5	33.4	-15.8	0	0	0	115.5
1382	A	32.1	Very low	32.3	Very low	104 Å²	104	118.5 Å²	118.5	86%	0.86	78%	0.778	S	S	*	*			trans	-122.7	173.6	173.7	0	0	0	0	0	112.1
1383	V	30.5	Very low	32.5	Very low	132 Å²	132	119.8 Å²	119.8	80%	0.8	78%	0.779	S	S	*	*			trans	-154.8	159.4	-157.7	83.8	0	0	0	0	116.3
1384	I	30.8	Very low	33	Very low	154 Å²	154	118.4 Å²	118.4	79%	0.79	77%	0.773	S	S	*	*			trans	81	136.5	163.5	-78.2	165.4	0	0	0	120.5
1385	A	31.1	Very low	32.9	Very low	87 Å²	87	120.2 Å²	120.2	72%	0.719	78%	0.776	S	S	*	*			trans	62.1	126.4	166.8	0	0	0	0	0	118.1
1386	A	31.6	Very low	32.9	Very low	101 Å²	101	119.9 Å²	119.9	84%	0.835	77%	0.773	S	S	*	*			cis	78.2	146	42.4	0	0	0	0	0	113.2
1387	A	34.7	Very low	32.9	Very low	80 Å²	80	120.3 Å²	120.3	66%	0.661	78%	0.776	S	S	*	*			cis	-157.7	144.6	22.5	0	0	0	0	0	114.1
1388	H	32	Very low	33	Very low	187 Å²	187	118.4 Å²	118.4	87%	0.866	77%	0.773	S	S	*	*			trans	57.5	159.2	140.5	-74.2	-100	0	0	0	120.4
1389	A	34.2	Very low	33.4	Very low	90 Å²	90	120.6 Å²	120.6	74%	0.744	78%	0.775	S	S	*	*			cis	-162.9	169.4	-3.4	0	0	0	0	0	107.7
1390	A	33.4	Very low	33.3	Very low	84 Å²	84	120.8 Å²	120.8	69%	0.694	78%	0.775	S	S	*	*			cis	-153.6	153.2	-7.1	0	0	0	0	0	107.1
1391	S	31.4	Very low	32.9	Very low	92 Å²	92	121.5 Å²	121.5	64%	0.643	78%	0.775	S	S	*	*				52.4	133.6	77	-110.4	0	0	0	0	113.5
1392	L	31.2	Very low	32.7	Very low	150 Å²	150	120.7 Å²	120.7	79%	0.785	77%	0.77	S	S	*	*			cis	-140.3	152.5	28.3	-81.4	102.9	0	0	0	111.4
1393	I	31.9	Very low	32.5	Very low	135 Å²	135	121.4 Å²	121.4	69%	0.692	77%	0.768	S	S	*	*			cis	97.5	138.6	44.8	-77.7	167.1	0	0	0	112.2
1394	P	41.6	Very low	32.3	Very low	99 Å²	99	126.2 Å²	126.2	64%	0.643	77%	0.772	S	S	*	*				-141.1	-135.5	-110.1	43.8	-23.6	0	0	0	114.7
1395	N	31.6	Very low	32.1	Very low	152 Å²	152	126.4 Å²	126.4	81%	0.813	77%	0.774	S	S	*	*			trans	77.5	150.7	163	-71.8	-11.1	0	0	0	118.6
1396	A	31.5	Very low	31.9	Very low	95 Å²	95	129.3 Å²	129.3	79%	0.785	78%	0.778	S	S	*	*			cis	-157.8	172.1	-10.8	0	0	0	0	0	112.2
1397	S	29.6	Very low	31.8	Very low	118 Å²	118	129.2 Å²	129.2	83%	0.825	78%	0.776	S	S	*	*			trans	-85.7	154.9	-166.2	-34.8	0	0	0	0	117.1
1398	V	34	Very low	31.5	Very low	142 Å²	142	134.3 Å²	134.3	86%	0.861	79%	0.787	S	S	*	*			trans	-139.6	141.5	148.1	175.1	0	0	0	0	108.5
1399	P	37.5	Very low	31.4	Very low	114 Å²	114	132.7 Å²	132.7	74%	0.74	79%	0.79	S	S	*	*			trans	-115.2	173.7	-162.5	42.4	-34.2	0	0	0	115.6
1400	Q	29.6	Very low	31.3	Very low	198 Å²	198	131.6 Å²	131.6	93%	0.925	79%	0.788	S	S	*	*			trans	-153.4	158.6	154.1	-128.2	173.2	60.9	0	0	113.5
1401	S	26.6	Very low	31.2	Very low	107 Å²	107	135.8 Å²	135.8	75%	0.748	80%	0.798	S	S	*	*			trans	-162.1	171.4	-178.9	69.4	0	0	0	0	108.8
1402	P	38.9	Very low	31.2	Very low	114 Å²	114	135.9 Å²	135.9	74%	0.74	80%	0.804	S	S	*	*			cis	-129.3	-168.7	-23.8	37.9	-21.4	0	0	0	112.6
1403	S	28	Very low	31.4	Very low	118 Å²	118	130.4 Å²	130.4	83%	0.825	78%	0.784	S	S	*	*			trans	120.9	152.9	141.9	80.4	0	0	0	0	119.4
1404	R	26.7	Very low	31.8	Very low	233 Å²	233	130.4 Å²	130.4	88%	0.879	78%	0.784	S	S	*	*			trans	-35.4	148.1	-175	-71.7	170.5	157.7	171	-9.4	118.3
1405	L	27.4	Very low	31.9	Very low	158 Å²	158	131.7 Å²	131.7	83%	0.827	78%	0.782	S	S	*	*				-161.8	174.9	104.7	-101.5	169.9	0	0	0	111.6
1406	D	25.3	Very low	32.7	Very low	149 Å²	149	131.5 Å²	131.5	80%	0.797	78%	0.776	S	S	*	*			trans	-80.6	154.7	-171.8	-44	-94.1	0	0	0	114.3
1407	A	31.3	Very low	33.4	Very low	98 Å²	98	134.6 Å²	134.6	81%	0.81	77%	0.771	S	S	*	*			trans	-166.2	144	147.5	0	0	0	0	0	111.7
1408	E	27.5	Very low	34.4	Very low	188 Å²	188	134.7 Å²	134.7	88%	0.879	76%	0.762	S	S	*	*			trans	-81.1	138.8	162.9	-60.3	178.7	112.1	0	0	110.4
1409	T	29.7	Very low	35	Very low	153 Å²	153	133.1 Å²	133.1	94%	0.939	75%	0.745	S	S	*	*			trans	173.2	165	142.4	24.1	0	0	0	0	110.1
1410	G	31.7	Very low	35.6	Very low	67 Å²	67	130.6 Å²	130.6	69%	0.691	73%	0.734	S	S	*	*			trans	113.2	27.1	160.7	0	0	0	0	0	118.7	A1412	G1410-A1412 PolarHBondContact O-N 3.27Å
1411	L	31.6	Very low	36.4	Very low	172 Å²	172	127.2 Å²	127.2	90%	0.901	72%	0.722	S	S	*	*			trans	-76.1	61.3	163	-87.2	173.1	0	0	0	111.8
1412	A	31.3	Very low	37.3	Very low	93 Å²	93	128.7 Å²	128.7	77%	0.769	72%	0.715	S	S	*	*			trans	-134.1	139.1	170.6	0	0	0	0	0	108.8	G1410	G1410-A1412 PolarHBondContact O-N 3.27Å
1413	G	36	Very low	37.5	Very low	36 Å²	36	130.6 Å²	130.6	37%	0.371	72%	0.716	S	S	.	*	S	Bend	trans	109.2	0.9	-174	0	0	0	0	0	115.8
1414	L	41.1	Very low	38.3	Very low	135 Å²	135	129.3 Å²	129.3	71%	0.707	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-16.1	173.1	-116.4	171.2	0	0	0	113.8
1415	H	44.1	Very low	39.1	Very low	126 Å²	126	125.1 Å²	125.1	58%	0.583	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-50.5	173.3	-160.7	-82.8	0	0	0	111	K1417 L1418 E1419	H1415-K1417 VanDerWaalsContact C-N 3.31Å; H1415-K1417 PolarHBondContact O-N 3.02Å; H1415-L1418 WeakPolarHBondContact O-CA 3.35Å; H1415-L1418 VanDerWaalsContact O-CB 3.31Å; H1415-L1418 WeakPolarHBondContact O-CB 3.25Å; H1415-L1418 PolarHBondContact O-N 2.87Å; H1415-E1419 IonicContact CE1-OE1 2.67Å; H1415-E1419 PolarHBondContact CE1-OE1 2.81Å; H1415-E1419 IonicContact CE1-OE2 3.33Å; H1415-E1419 PolarHBondContact CE1-OE2 2.65Å; H1415-E1419 VanDerWaalsContact CE1-OE2 3.28Å; H1415-E1419 IonicContact CG-OE2 3.76Å; H1415-E1419 VanDerWaalsContact ND1-CD 3.26Å; H1415-E1419 IonicContact ND1-OE1 2.82Å; H1415-E1419 IonicContact ND1-OE2 3.98Å; H1415-E1419 PolarHBondContact ND1-OE2 3.12Å; H1415-E1419 PolarHBondContact O-N 3.34Å
1416	E	46.8	Very low	39.5	Very low	147 Å²	147	123.9 Å²	123.9	69%	0.687	68%	0.681	S	S	*	*	H	α-helix	trans	-58.1	-39.4	-179.4	-169.6	174.7	-163.8	0	0	112.6	L1418 A1420	E1416-L1418 VanDerWaalsContact C-N 3.31Å; E1416-L1418 PolarHBondContact O-N 3.32Å; E1416-A1420 VanDerWaalsContact O-CB 3.3Å; E1416-A1420 WeakPolarHBondContact O-CB 3.47Å; E1416-A1420 PolarHBondContact O-N 2.69Å
1417	K	47.7	Very low	40	Very low	160 Å²	160	126.2 Å²	126.2	70%	0.696	68%	0.679	S	S	*	*	H	α-helix	trans	-71.5	-19.3	172.3	-78.4	-173.6	173.6	-179.7	0	114.6	H1415 L1421	H1415-K1417 VanDerWaalsContact C-N 3.31Å; H1415-K1417 PolarHBondContact O-N 3.02Å; K1417-L1421 WeakPolarHBondContact O-CG 3.48Å; K1417-L1421 PolarHBondContact O-N 3.16Å
1418	L	50.5	Low	40.3	Very low	121 Å²	121	130.7 Å²	130.7	63%	0.634	68%	0.675	S	S	*	*	H	α-helix	trans	-84.8	-36.9	175.6	-164.6	68.7	0	0	0	111.2	H1415 E1416 L1421 K1422	H1415-L1418 WeakPolarHBondContact O-CA 3.35Å; H1415-L1418 VanDerWaalsContact O-CB 3.31Å; H1415-L1418 WeakPolarHBondContact O-CB 3.25Å; H1415-L1418 PolarHBondContact O-N 2.87Å; E1416-L1418 VanDerWaalsContact C-N 3.31Å; E1416-L1418 PolarHBondContact O-N 3.32Å; L1418-L1421 PolarHBondContact O-N 2.86Å; L1418-K1422 PolarHBondContact O-N 3.06Å; L1418-K1422 VanDerWaalsContact O-N 3.14Å
1419	E	45.8	Very low	40.4	Very low	108 Å²	108	130.9 Å²	130.9	51%	0.505	68%	0.676	S	S	.	*	H	α-helix	trans	-70.1	-40.9	172.4	-73.8	170.8	128.7	0	0	111.9	H1415 L1421 K1422 M1423	H1415-E1419 IonicContact CE1-OE1 2.67Å; H1415-E1419 PolarHBondContact CE1-OE1 2.81Å; H1415-E1419 IonicContact CE1-OE2 3.33Å; H1415-E1419 PolarHBondContact CE1-OE2 2.65Å; H1415-E1419 VanDerWaalsContact CE1-OE2 3.28Å; H1415-E1419 IonicContact CG-OE2 3.76Å; H1415-E1419 VanDerWaalsContact ND1-CD 3.26Å; H1415-E1419 IonicContact ND1-OE1 2.82Å; H1415-E1419 IonicContact ND1-OE2 3.98Å; H1415-E1419 PolarHBondContact ND1-OE2 3.12Å; H1415-E1419 PolarHBondContact O-N 3.34Å; E1419-L1421 VanDerWaalsContact C-N 3.29Å; E1419-L1421 PolarHBondContact O-N 3.04Å; E1419-K1422 PolarHBondContact O-N 3.45Å; E1419-M1423 PolarHBondContact O-N 3.12Å
1420	A	51.1	Low	40.3	Very low	62 Å²	62	130.9 Å²	130.9	51%	0.512	67%	0.67	S	S	.	*	H	α-helix	trans	-59.6	-38	173.1	0	0	0	0	0	112.7	E1416 K1422 E1424	E1416-A1420 VanDerWaalsContact O-CB 3.3Å; E1416-A1420 WeakPolarHBondContact O-CB 3.47Å; E1416-A1420 PolarHBondContact O-N 2.69Å; A1420-K1422 VanDerWaalsContact C-N 3.31Å; A1420-E1424 PolarHBondContact O-N 2.73Å
1421	L	44.6	Very low	40.4	Very low	127 Å²	127	136.4 Å²	136.4	67%	0.665	68%	0.68	S	S	*	*	H	α-helix	trans	-73.5	-19.9	174.2	-80.8	171.2	0	0	0	113.5	K1417 L1418 E1419	K1417-L1421 WeakPolarHBondContact O-CG 3.48Å; K1417-L1421 PolarHBondContact O-N 3.16Å; L1418-L1421 PolarHBondContact O-N 2.86Å; E1419-L1421 VanDerWaalsContact C-N 3.29Å; E1419-L1421 PolarHBondContact O-N 3.04Å
1422	K	46.7	Very low	40.6	Very low	138 Å²	138	131.6 Å²	131.6	60%	0.6	67%	0.672	S	S	*	*	H	α-helix	trans	-83.2	-39.3	174.1	-167.1	165.3	-177.1	178.4	0	112.3	L1418 E1419 A1420 E1424 Q1425 D1426	L1418-K1422 PolarHBondContact O-N 3.06Å; L1418-K1422 VanDerWaalsContact O-N 3.14Å; E1419-K1422 PolarHBondContact O-N 3.45Å; A1420-K1422 VanDerWaalsContact C-N 3.31Å; K1422-E1424 VanDerWaalsContact C-N 3.33Å; K1422-E1424 PolarHBondContact O-N 3.49Å; K1422-Q1425 WeakPolarHBondContact O-CB 3.41Å; K1422-Q1425 PolarHBondContact O-N 3.06Å; K1422-Q1425 VanDerWaalsContact O-N 3.09Å; K1422-D1426 PolarHBondContact O-N 3.39Å
1423	M	42.7	Very low	40.5	Very low	153 Å²	153	134.9 Å²	134.9	75%	0.754	68%	0.677	S	S	*	*	H	α-helix	trans	-67.2	-27.6	176.4	-74.2	-169.8	171.3	0	0	114.1	E1419 Q1425	E1419-M1423 PolarHBondContact O-N 3.12Å; M1423-Q1425 VanDerWaalsContact C-N 3.32Å
1424	E	44.6	Very low	40.3	Very low	91 Å²	91	140.8 Å²	140.8	43%	0.425	70%	0.7	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	-16.7	172	-179.3	57.4	-158.6	0	0	112.7	A1420 K1422 R1428	A1420-E1424 PolarHBondContact O-N 2.73Å; K1422-E1424 VanDerWaalsContact C-N 3.33Å; K1422-E1424 PolarHBondContact O-N 3.49Å; E1424-R1428 IonicContact OE1-CZ 3.18Å; E1424-R1428 IonicContact OE1-NE 3.06Å; E1424-R1428 PolarHBondContact OE1-NE 3.12Å; E1424-R1428 VanDerWaalsContact OE1-NE 3.08Å; E1424-R1428 IonicContact OE1-NH2 2.95Å; E1424-R1428 PolarHBondContact OE1-NH2 3.19Å
1425	Q	43.4	Very low	40	Very low	146 Å²	146	138 Å²	138	68%	0.682	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-42.4	174.9	-170.1	168.2	-4.3	0	0	111.7	K1422 M1423 R1427	K1422-Q1425 WeakPolarHBondContact O-CB 3.41Å; K1422-Q1425 PolarHBondContact O-N 3.06Å; K1422-Q1425 VanDerWaalsContact O-N 3.09Å; M1423-Q1425 VanDerWaalsContact C-N 3.32Å; Q1425-R1427 PolarHBondContact O-N 2.89Å
1426	D	36.4	Very low	39.4	Very low	132 Å²	132	140.3 Å²	140.3	71%	0.706	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.5	9.9	178.8	-67.4	-19	0	0	0	113.9	K1422	K1422-D1426 PolarHBondContact O-N 3.39Å
1427	R	36.5	Very low	38.7	Very low	197 Å²	197	136.1 Å²	136.1	74%	0.743	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	14.5	-177.2	-130.5	-167.5	82.4	78.6	3.1	115.4	Q1425	Q1425-R1427 PolarHBondContact O-N 2.89Å
1428	R	36.1	Very low	38	Very low	192 Å²	192	135.2 Å²	135.2	73%	0.725	72%	0.715	S	S	*	*	S	Bend	trans	-131.1	9.5	-174.6	-63.5	-168.6	-176	-154.6	1.4	116.3	E1424	E1424-R1428 IonicContact OE1-CZ 3.18Å; E1424-R1428 IonicContact OE1-NE 3.06Å; E1424-R1428 PolarHBondContact OE1-NE 3.12Å; E1424-R1428 VanDerWaalsContact OE1-NE 3.08Å; E1424-R1428 IonicContact OE1-NH2 2.95Å; E1424-R1428 PolarHBondContact OE1-NH2 3.19Å
1429	E	30.1	Very low	37.1	Very low	193 Å²	193	135.4 Å²	135.4	90%	0.902	72%	0.722	S	S	*	*			trans	-125.7	73.2	176.7	-67.8	-173.6	-177.2	0	0	111.5
1430	D	28.1	Very low	36.4	Very low	153 Å²	153	136 Å²	136	82%	0.818	73%	0.733	S	S	*	*			trans	-153.8	155.5	158.1	-158.8	-4.6	0	0	0	109.4
1431	M	34.5	Very low	35.7	Very low	183 Å²	183	139.2 Å²	139.2	90%	0.901	75%	0.746	S	S	*	*			trans	70.6	116.3	-166.6	-50.8	-78.9	-79	0	0	114.4
1432	G	34.4	Very low	35.1	Very low	71 Å²	71	141 Å²	141	73%	0.732	76%	0.757	S	S	*	*			trans	-133.8	-178.7	-178.5	0	0	0	0	0	115.2
1433	D	30.5	Very low	34.4	Very low	162 Å²	162	138 Å²	138	87%	0.866	77%	0.765	S	S	*	*			trans	35.1	127.3	159.1	-52.2	-23.8	0	0	0	120.9
1434	D	30.8	Very low	34	Very low	159 Å²	159	139.1 Å²	139.1	85%	0.85	77%	0.765	S	S	*	*				177.4	176.3	78.7	-143.6	-27.7	0	0	0	114
1435	A	34.2	Very low	33.4	Very low	78 Å²	78	140.1 Å²	140.1	65%	0.645	77%	0.774	S	S	*	*			trans	86.2	83.7	152.1	0	0	0	0	0	124.6
1436	I	32.1	Very low	32.8	Very low	174 Å²	174	141.8 Å²	141.8	89%	0.892	78%	0.781	S	S	*	*				63.2	128.3	116	-60.5	156.8	0	0	0	123.9
1437	G	32.3	Very low	32.7	Very low	58 Å²	58	143.3 Å²	143.3	60%	0.598	79%	0.788	S	S	*	*			trans	97.2	106	145.1	0	0	0	0	0	118.4
1438	T	31.8	Very low	32.9	Very low	141 Å²	141	139 Å²	139	87%	0.865	79%	0.785	S	S	*	*			cis	69.3	137.5	43.3	82.8	0	0	0	0	114.5
1439	T	31.9	Very low	32.7	Very low	125 Å²	125	136.8 Å²	136.8	77%	0.767	79%	0.786	S	S	*	*			cis	-135.1	-170.5	5.9	60.5	0	0	0	0	110.5
1440	T	32	Very low	32.9	Very low	122 Å²	122	135.7 Å²	135.7	75%	0.748	79%	0.787	S	S	*	*			cis	-131.1	-116.7	5.6	-37.5	0	0	0	0	112.1
1441	T	35.3	Very low	33.5	Very low	128 Å²	128	133.5 Å²	133.5	79%	0.785	78%	0.779	S	S	*	*			cis	-161	165.7	3.6	-36.7	0	0	0	0	110.7
1442	D	33.5	Very low	33.4	Very low	166 Å²	166	131.8 Å²	131.8	89%	0.888	77%	0.772	S	S	*	*			trans	-74.2	156.6	-173.8	-72.5	-67	0	0	0	117.6
1443	G	32	Very low	33.5	Very low	74 Å²	74	135.9 Å²	135.9	76%	0.763	77%	0.77	S	S	*	*			trans	-167.1	-6.9	-179	0	0	0	0	0	122.8
1444	K	33.6	Very low	34.1	Very low	176 Å²	176	130.3 Å²	130.3	77%	0.765	75%	0.751	S	S	*	*			trans	73.1	135.9	171.6	-77.8	-171.1	141.8	-68	0	122.2
1445	D	33	Very low	34.4	Very low	113 Å²	113	128.2 Å²	128.2	60%	0.604	74%	0.739	S	S	*	*			trans	61.5	90.7	136.3	-46.8	-1.9	0	0	0	121.9
1446	E	29.7	Very low	34.6	Very low	181 Å²	181	127.7 Å²	127.7	85%	0.846	74%	0.735	S	S	*	*				59.6	125	111.6	-68.2	-167.8	146.3	0	0	124
1447	I	33.7	Very low	35.1	Very low	164 Å²	164	124.9 Å²	124.9	84%	0.841	72%	0.718	S	S	*	*				-167.4	126.9	121.5	-93.2	150.6	0	0	0	108.1
1448	P	40.9	Very low	35.5	Very low	105 Å²	105	124.8 Å²	124.8	68%	0.682	71%	0.712	S	S	*	*			trans	-92.4	170.9	172.9	37.6	-35	0	0	0	112.1
1449	I	32.9	Very low	35.7	Very low	146 Å²	146	124 Å²	124	75%	0.749	70%	0.702	S	S	*	*			trans	179.4	125.7	133.4	-95	154.6	0	0	0	110.6	T1451	I1449-T1451 WeakPolarHBondContact CG2-OG1 3.49Å
1450	D	33.8	Very low	36.1	Very low	171 Å²	171	121 Å²	121	91%	0.914	70%	0.695	S	S	*	*			trans	-74.5	125.2	161.1	-84	-63.2	0	0	0	109.8
1451	T	40.3	Very low	36.4	Very low	106 Å²	106	123.3 Å²	123.3	65%	0.65	70%	0.695	S	S	*	*			trans	-147.7	148.4	164.5	-56.8	0	0	0	0	112	I1449 K1453 G1454	I1449-T1451 WeakPolarHBondContact CG2-OG1 3.49Å; T1451-K1453 PolarHBondContact O-N 3.2Å; T1451-G1454 PolarHBondContact O-N 3.18Å
1452	L	32.1	Very low	36.5	Very low	147 Å²	147	123.1 Å²	123.1	77%	0.77	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52	-6.1	-166.6	-148.7	68.7	0	0	0	117.7
1453	K	38.3	Very low	36.4	Very low	157 Å²	157	121.3 Å²	121.3	68%	0.683	68%	0.682	S	S	*	*	H	α-helix	trans	-70.4	-39.6	180	-166.6	177.8	178.7	-173.5	0	112.5	T1451 L1455 A1456	T1451-K1453 PolarHBondContact O-N 3.2Å; K1453-L1455 VanDerWaalsContact C-N 3.27Å; K1453-L1455 PolarHBondContact O-N 3.24Å; K1453-A1456 PolarHBondContact O-N 2.92Å
1454	G	42	Very low	36.5	Very low	45 Å²	45	126.5 Å²	126.5	46%	0.464	69%	0.686	S	S	.	*	H	α-helix	trans	-62.8	-30.2	-179.1	0	0	0	0	0	114	T1451 A1456 E1457 A1458	T1451-G1454 PolarHBondContact O-N 3.18Å; G1454-A1456 VanDerWaalsContact C-N 3.31Å; G1454-A1456 PolarHBondContact O-N 3.15Å; G1454-E1457 PolarHBondContact O-N 3.47Å; G1454-A1458 PolarHBondContact O-N 2.86Å
1455	L	36.3	Very low	36.6	Very low	115 Å²	115	122.1 Å²	122.1	60%	0.602	68%	0.683	S	S	*	*	H	α-helix	trans	-66.9	-32.2	178.1	-159.9	79	0	0	0	112.5	K1453 L1459	K1453-L1455 VanDerWaalsContact C-N 3.27Å; K1453-L1455 PolarHBondContact O-N 3.24Å; L1455-L1459 PolarHBondContact O-N 3.09Å
1456	A	39.3	Very low	36.6	Very low	68 Å²	68	124.7 Å²	124.7	56%	0.562	70%	0.696	S	S	*	*	H	α-helix	trans	-71.5	-39.7	176.7	0	0	0	0	0	111.7	K1453 G1454 A1458 L1459 G1460	K1453-A1456 PolarHBondContact O-N 2.92Å; G1454-A1456 VanDerWaalsContact C-N 3.31Å; G1454-A1456 PolarHBondContact O-N 3.15Å; A1456-A1458 VanDerWaalsContact C-N 3.33Å; A1456-L1459 PolarHBondContact O-N 2.67Å; A1456-G1460 PolarHBondContact O-N 3.09Å; A1456-G1460 VanDerWaalsContact O-N 3.13Å
1457	E	41.9	Very low	36.9	Very low	114 Å²	114	119.9 Å²	119.9	53%	0.533	70%	0.695	S	S	.	*	H	α-helix	trans	-74.4	-21.8	177.3	-67.5	-178.7	176	0	0	113.2	G1454 K1461	G1454-E1457 PolarHBondContact O-N 3.47Å; E1457-K1461 WeakPolarHBondContact O-CD 3.46Å; E1457-K1461 WeakPolarHBondContact O-CE 3Å; E1457-K1461 WeakPolarHBondContact O-CG 3.21Å
1458	A	41.2	Very low	36.6	Very low	57 Å²	57	124 Å²	124	47%	0.471	70%	0.701	S	S	.	*	H	α-helix	trans	-72.2	-45.7	169.4	0	0	0	0	0	112	G1454 A1456 G1460 K1461	G1454-A1458 PolarHBondContact O-N 2.86Å; A1456-A1458 VanDerWaalsContact C-N 3.33Å; A1458-G1460 VanDerWaalsContact C-N 3.32Å; A1458-G1460 PolarHBondContact O-N 3.09Å; A1458-K1461 PolarHBondContact O-N 3.27Å
1459	L	37	Very low	36.2	Very low	125 Å²	125	127.9 Å²	127.9	65%	0.654	71%	0.71	S	S	*	*	H	α-helix	trans	-71.4	-24	-179.8	-75.6	167.3	0	0	0	113.5	L1455 A1456 K1461	L1455-L1459 PolarHBondContact O-N 3.09Å; A1456-L1459 PolarHBondContact O-N 2.67Å; L1459-K1461 PolarHBondContact O-N 3.1Å
1460	G	39.8	Very low	36.1	Very low	60 Å²	60	127.4 Å²	127.4	62%	0.619	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-6.3	174.3	0	0	0	0	0	115.6	A1456 A1458	A1456-G1460 PolarHBondContact O-N 3.09Å; A1456-G1460 VanDerWaalsContact O-N 3.13Å; A1458-G1460 VanDerWaalsContact C-N 3.32Å; A1458-G1460 PolarHBondContact O-N 3.09Å
1461	K	39.1	Very low	36.2	Very low	171 Å²	171	125.7 Å²	125.7	74%	0.743	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.8	7.8	-171.7	-69.2	175.8	-176.1	173.1	0	115.1	E1457 A1458 L1459	E1457-K1461 WeakPolarHBondContact O-CD 3.46Å; E1457-K1461 WeakPolarHBondContact O-CE 3Å; E1457-K1461 WeakPolarHBondContact O-CG 3.21Å; A1458-K1461 PolarHBondContact O-N 3.27Å; L1459-K1461 PolarHBondContact O-N 3.1Å
1462	V	35.8	Very low	35.9	Very low	125 Å²	125	126.1 Å²	126.1	76%	0.758	71%	0.714	S	S	*	*	S	Bend	trans	-111.5	7.7	-177.3	-171.7	0	0	0	0	112.1
1463	I	32.1	Very low	35.7	Very low	128 Å²	128	127.2 Å²	127.2	66%	0.656	72%	0.717	S	S	*	*	S	Bend	trans	-133.2	127.9	175	-46.1	-178.7	0	0	0	108.3
1464	H	33.7	Very low	35.8	Very low	182 Å²	182	124.6 Å²	124.6	84%	0.843	72%	0.716	S	S	*	*			trans	71.9	104.3	-172.9	-53.1	-70.8	0	0	0	116.3
1465	A	34.9	Very low	35.8	Very low	84 Å²	84	127.2 Å²	127.2	69%	0.694	73%	0.725	S	S	*	*			trans	-99.4	157.8	143	0	0	0	0	0	108.5
1466	D	34.9	Very low	35.9	Very low	167 Å²	167	129.6 Å²	129.6	89%	0.893	74%	0.738	S	S	*	*			trans	60.6	125.6	175.5	-51.9	-31.1	0	0	0	117.1
1467	G	34.6	Very low	35.5	Very low	80 Å²	80	134.6 Å²	134.6	83%	0.825	75%	0.75	S	S	*	*			cis	-155.8	169.5	-1.7	0	0	0	0	0	112.5
1468	R	28.8	Very low	35.5	Very low	251 Å²	251	134.1 Å²	134.1	95%	0.947	76%	0.757	S	S	*	*			trans	-92.3	144.7	-176.8	-75.7	173.9	163.1	156.7	-7	112.4
1469	E	31.1	Very low	35	Very low	187 Å²	187	138.5 Å²	138.5	87%	0.874	77%	0.772	S	S	*	*			trans	-158.6	114.8	134.6	-149.8	168.2	-138	0	0	112.6
1470	T	31.9	Very low	34.7	Very low	136 Å²	136	139 Å²	139	83%	0.834	78%	0.775	S	S	*	*			trans	-157.3	137.8	163.1	47.1	0	0	0	0	111.2
1471	T	35	Very low	34.3	Very low	135 Å²	135	141.6 Å²	141.6	83%	0.828	78%	0.779	S	S	*	*			trans	-178.4	157.4	170.9	5.9	0	0	0	0	108.8
1472	P	34.4	Very low	33.9	Very low	114 Å²	114	140.5 Å²	140.5	74%	0.74	78%	0.781	S	S	*	*			cis	-131.9	159.6	-48.6	29.3	-9.8	0	0	0	115.9
1473	M	28	Very low	33.5	Very low	171 Å²	171	138.8 Å²	138.8	84%	0.842	78%	0.78	S	S	*	*			trans	-5.4	173.3	132.8	-92	179.9	81.4	0	0	121.4
1474	P	40.6	Very low	33.5	Very low	101 Å²	101	138.4 Å²	138.4	66%	0.656	79%	0.789	S	S	*	*			cis	-145.8	-130	-18.1	39.6	-15.7	0	0	0	112.6
1475	P	42	Very low	33.2	Very low	100 Å²	100	136.7 Å²	136.7	65%	0.649	79%	0.791	S	S	*	*				-124	178.5	-52.1	36.7	-21.3	0	0	0	114.4
1476	D	37.8	Very low	33	Very low	165 Å²	165	136.6 Å²	136.6	88%	0.882	80%	0.799	S	S	*	*				-162.6	169.9	125.8	-113.1	-27.7	0	0	0	112.6
1477	H	31.7	Very low	32.6	Very low	173 Å²	173	136 Å²	136	80%	0.801	79%	0.791	S	S	*	*			trans	-133.6	-169.4	-163.8	-103.5	-63.5	0	0	0	112.3
1478	P	41	Very low	32.4	Very low	105 Å²	105	141 Å²	141	68%	0.682	80%	0.795	S	S	*	*				-128.1	178.8	-52.3	40.1	-25.5	0	0	0	113.2
1479	D	30.4	Very low	32.5	Very low	148 Å²	148	134.9 Å²	134.9	79%	0.791	78%	0.78	S	S	*	*				-175.6	-177.7	115.8	-134.7	-7.8	0	0	0	115.4
1480	L	31.9	Very low	32.5	Very low	137 Å²	137	134.4 Å²	134.4	72%	0.717	78%	0.783	S	S	*	*			trans	-88.9	156.2	-150.2	-72.5	155.8	0	0	0	121.8
1481	T	29.9	Very low	32.6	Very low	114 Å²	114	136.6 Å²	136.6	70%	0.699	78%	0.784	S	S	*	*			trans	27.6	150.7	142.6	60.9	0	0	0	0	122.6
1482	D	30.7	Very low	32.5	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	78%	0.783	S	S	*	*			cis	-139.7	158.3	33.1	-95.1	-35.2	0	0	0	111.1
1483	A	29.1	Very low	32.9	Very low	89 Å²	89	136 Å²	136	74%	0.736	77%	0.774	S	S	*	*			cis	107.5	96.1	31.1	0	0	0	0	0	114.3
1484	S	31.1	Very low	34.2	Very low	121 Å²	121	132 Å²	132	85%	0.846	76%	0.756	S	S	*	*			trans	-159.6	121	150.8	71.4	0	0	0	0	111.1
1485	T	27.9	Very low	35.5	Very low	146 Å²	146	131.5 Å²	131.5	90%	0.896	75%	0.753	S	S	*	*			trans	-117.6	119.9	174.2	-57.9	0	0	0	0	109.5
1486	G	30.3	Very low	36.4	Very low	82 Å²	82	134.2 Å²	134.2	85%	0.845	76%	0.758	S	S	*	*			trans	-90.2	104.7	178.4	0	0	0	0	0	111.8
1487	Q	25.8	Very low	37.3	Very low	155 Å²	155	129 Å²	129	72%	0.724	73%	0.732	S	S	*	*			trans	-83.1	140.1	170.8	-179.5	173.8	-23	0	0	110.1	D1489	Q1487-D1489 PolarHBondContact NE2-OD1 3.11Å
1488	M	32	Very low	39	Very low	185 Å²	185	125.2 Å²	125.2	91%	0.911	72%	0.716	S	S	*	*			trans	-141.6	130.4	162.2	-76.3	-160.1	-63.7	0	0	108.9
1489	D	30	Very low	40.3	Very low	121 Å²	121	125.9 Å²	125.9	65%	0.647	71%	0.71	S	S	*	*			trans	-88.9	158.5	-164.8	-47.6	-73.5	0	0	0	113.2	Q1487	Q1487-D1489 PolarHBondContact NE2-OD1 3.11Å
1490	L	31.7	Very low	42.1	Very low	178 Å²	178	124.3 Å²	124.3	93%	0.932	70%	0.699	S	S	*	*			trans	-138.5	93.7	172.9	-83.4	174.1	0	0	0	109.7
1491	E	32.9	Very low	43.8	Very low	182 Å²	182	122 Å²	122	85%	0.85	69%	0.687	S	S	*	*			trans	-120.3	168.1	168.5	-65.9	-162.1	142.5	0	0	111
1492	S	32.8	Very low	45.9	Very low	115 Å²	115	120.8 Å²	120.8	80%	0.804	68%	0.679	S	S	*	*			trans	72	77.6	-176.3	71.2	0	0	0	0	117.4
1493	E	43.3	Very low	48.1	Very low	121 Å²	121	120.3 Å²	120.3	57%	0.565	67%	0.666	S	S	*	*			trans	-122.4	147.7	144.5	-71.6	-88	139.1	0	0	107.6	K406	K406-E1493 IonicContact NZ-OE1 3.09Å; K406-E1493 PolarHBondContact NZ-OE1 3.18Å
1494	D	56.5	Low	50.4	Low	86 Å²	86	120.9 Å²	120.9	46%	0.46	65%	0.653	S	S	.	*			trans	-75.4	133.3	-166.6	-171	-54.8	0	0	0	113.3	E1496 V1497 I1498	D1494-E1496 VanDerWaalsContact C-N 3.32Å; D1494-E1496 PolarHBondContact O-N 3.3Å; D1494-E1496 PolarHBondContact OD1-N 3.17Å; D1494-V1497 HydrophobicContact CB-CB 4.33Å; D1494-V1497 HydrophobicContact CB-CG2 3.98Å; D1494-V1497 WeakPolarHBondContact O-CB 3.14Å; D1494-V1497 PolarHBondContact O-N 2.85Å; D1494-V1497 VanDerWaalsContact O-N 3.12Å; D1494-I1498 PolarHBondContact O-N 3.01Å; D1494-I1498 VanDerWaalsContact O-N 3.12Å
1495	P	67.1	Low	52.4	Low	92 Å²	92	124 Å²	124	60%	0.597	65%	0.647	S	S	*	*	H	α-helix	trans	-60.9	-30.6	-179.3	24.9	-35	0	0	0	114.7	I1498 Q1499	P1495-I1498 PolarHBondContact O-N 2.83Å; P1495-Q1499 WeakPolarHBondContact O-CG 3.32Å; P1495-Q1499 PolarHBondContact O-N 3.08Å
1496	E	60.1	Low	54.7	Low	157 Å²	157	122.3 Å²	122.3	73%	0.734	63%	0.63	S	S	*	*	H	α-helix	trans	-68.5	-37.5	175	-71.6	-153.2	132.8	0	0	111.5	D1494 I1498 Q1499 M1500	D1494-E1496 VanDerWaalsContact C-N 3.32Å; D1494-E1496 PolarHBondContact O-N 3.3Å; D1494-E1496 PolarHBondContact OD1-N 3.17Å; E1496-I1498 VanDerWaalsContact C-N 3.35Å; E1496-Q1499 PolarHBondContact O-N 3.48Å; E1496-M1500 WeakPolarHBondContact O-CB 3.41Å; E1496-M1500 PolarHBondContact O-N 2.84Å
1497	V	57.6	Low	57.2	Low	56 Å²	56	123.6 Å²	123.6	34%	0.339	61%	0.614	S	S	.	*	H	α-helix	trans	-65.8	-40.3	176.9	178.2	0	0	0	0	110.4	D1494 M1500 I1501	D1494-V1497 HydrophobicContact CB-CB 4.33Å; D1494-V1497 HydrophobicContact CB-CG2 3.98Å; D1494-V1497 WeakPolarHBondContact O-CB 3.14Å; D1494-V1497 PolarHBondContact O-N 2.85Å; D1494-V1497 VanDerWaalsContact O-N 3.12Å; V1497-M1500 PolarHBondContact O-N 3.44Å; V1497-I1501 HydrophobicContact CG1-CD1 3.93Å; V1497-I1501 VanDerWaalsContact O-CG1 3.29Å; V1497-I1501 WeakPolarHBondContact O-CG1 3.34Å; V1497-I1501 PolarHBondContact O-N 3.12Å
1498	I	66.7	Low	59.3	Low	92 Å²	92	120.7 Å²	120.7	47%	0.472	60%	0.6	S	S	.	*	H	α-helix	trans	-61.9	-47.5	174	-63.3	172.4	0	0	0	110.5	D1494 P1495 E1496 M1500 I1501 V1502	D1494-I1498 PolarHBondContact O-N 3.01Å; D1494-I1498 VanDerWaalsContact O-N 3.12Å; P1495-I1498 PolarHBondContact O-N 2.83Å; E1496-I1498 VanDerWaalsContact C-N 3.35Å; I1498-M1500 VanDerWaalsContact C-N 3.34Å; I1498-M1500 PolarHBondContact O-N 3.46Å; I1498-I1501 PolarHBondContact O-N 3.17Å; I1498-V1502 WeakPolarHBondContact O-CG2 3.47Å; I1498-V1502 PolarHBondContact O-N 3.21Å
1499	Q	68	Low	61.4	Low	119 Å²	119	117.9 Å²	117.9	56%	0.556	59%	0.585	S	S	*	*	H	α-helix	trans	-61.6	-39.2	176.3	-72.9	-168.8	28.8	0	0	112.9	P1495 E1496 V1502 R1503	P1495-Q1499 WeakPolarHBondContact O-CG 3.32Å; P1495-Q1499 PolarHBondContact O-N 3.08Å; E1496-Q1499 PolarHBondContact O-N 3.48Å; Q1499-V1502 PolarHBondContact O-N 3.02Å; Q1499-R1503 WeakPolarHBondContact O-CB 3.37Å; Q1499-R1503 PolarHBondContact O-N 3.22Å
1500	M	69.4	Low	63.8	Low	115 Å²	115	119.5 Å²	119.5	57%	0.567	59%	0.586	S	S	*	*	H	α-helix	trans	-63.9	-42.5	176.1	-178.7	171.8	56.9	0	0	111.9	E1496 V1497 I1498 R1503 H1504	E1496-M1500 WeakPolarHBondContact O-CB 3.41Å; E1496-M1500 PolarHBondContact O-N 2.84Å; V1497-M1500 PolarHBondContact O-N 3.44Å; I1498-M1500 VanDerWaalsContact C-N 3.34Å; I1498-M1500 PolarHBondContact O-N 3.46Å; M1500-R1503 PolarHBondContact O-N 2.91Å; M1500-H1504 WeakPolarHBondContact O-CB 3.5Å; M1500-H1504 PolarHBondContact O-N 2.95Å
1501	I	67.4	Low	66.1	Low	89 Å²	89	115.7 Å²	115.7	46%	0.456	57%	0.566	S	S	.	*	H	α-helix	trans	-64.5	-41.1	176	-70	166.3	0	0	0	111.2	V1497 I1498 R1505	V1497-I1501 HydrophobicContact CG1-CD1 3.93Å; V1497-I1501 VanDerWaalsContact O-CG1 3.29Å; V1497-I1501 WeakPolarHBondContact O-CG1 3.34Å; V1497-I1501 PolarHBondContact O-N 3.12Å; I1498-I1501 PolarHBondContact O-N 3.17Å; I1501-R1505 WeakPolarHBondContact O-CB 3.31Å; I1501-R1505 PolarHBondContact O-N 2.77Å
1502	V	73.6	Confident	68.1	Low	88 Å²	88	112.1 Å²	112.1	53%	0.533	55%	0.552	S	S	.	*	H	α-helix	trans	-64.3	-46.9	175.6	170.6	0	0	0	0	111.2	I1498 Q1499 H1504 R1505 M1506	I1498-V1502 WeakPolarHBondContact O-CG2 3.47Å; I1498-V1502 PolarHBondContact O-N 3.21Å; Q1499-V1502 PolarHBondContact O-N 3.02Å; V1502-H1504 PolarHBondContact O-N 3.27Å; V1502-R1505 PolarHBondContact O-N 2.96Å; V1502-M1506 WeakPolarHBondContact O-CB 3.49Å; V1502-M1506 PolarHBondContact O-N 2.76Å
1503	R	77.8	Confident	70.4	Confident	137 Å²	137	110 Å²	110	52%	0.517	53%	0.529	S	S	.	.	H	α-helix	trans	-58.3	-47.4	176.5	-173.2	178.1	-69.5	126.2	0.3	111.2	Q1499 M1500 R1505 M1506 E1507	Q1499-R1503 WeakPolarHBondContact O-CB 3.37Å; Q1499-R1503 PolarHBondContact O-N 3.22Å; M1500-R1503 PolarHBondContact O-N 2.91Å; R1503-R1505 PolarHBondContact O-N 2.94Å; R1503-M1506 PolarHBondContact O-N 3.44Å; R1503-E1507 WeakPolarHBondContact O-CG 3.49Å; R1503-E1507 PolarHBondContact O-N 3.35Å
1504	H	76.8	Confident	72.3	Confident	101 Å²	101	111.8 Å²	111.8	47%	0.468	54%	0.536	S	S	.	.	H	α-helix	trans	-65.6	-39	179.1	-167.9	65	0	0	0	113	M1500 V1502 M1506 E1507 Q1508	M1500-H1504 WeakPolarHBondContact O-CB 3.5Å; M1500-H1504 PolarHBondContact O-N 2.95Å; V1502-H1504 PolarHBondContact O-N 3.27Å; H1504-M1506 VanDerWaalsContact C-N 3.34Å; H1504-M1506 PolarHBondContact O-N 2.79Å; H1504-E1507 PolarHBondContact O-N 3.28Å; H1504-Q1508 PolarHBondContact NE2-NE2 2.86Å; H1504-Q1508 VanDerWaalsContact NE2-NE2 3.11Å; H1504-Q1508 WeakPolarHBondContact O-CG 2.98Å; H1504-Q1508 PolarHBondContact O-N 2.96Å
1505	R	72.2	Confident	73.4	Confident	187 Å²	187	112.9 Å²	112.9	71%	0.706	54%	0.538	S	S	*	.	H	α-helix	trans	-61.4	-41.3	172.4	-84.4	-175.3	170.8	178.7	-0.9	112.3	I1501 V1502 R1503 Q1508 H1509	I1501-R1505 WeakPolarHBondContact O-CB 3.31Å; I1501-R1505 PolarHBondContact O-N 2.77Å; V1502-R1505 PolarHBondContact O-N 2.96Å; R1503-R1505 PolarHBondContact O-N 2.94Å; R1505-Q1508 PolarHBondContact O-N 2.97Å; R1505-H1509 PolarHBondContact O-N 3.36Å
1506	M	77	Confident	74.3	Confident	111 Å²	111	115.6 Å²	115.6	55%	0.547	54%	0.536	S	S	.	.	H	α-helix	trans	-67.4	-35.9	178.5	-176	171.3	53.5	0	0	112.2	V1502 R1503 H1504 K1510	V1502-M1506 WeakPolarHBondContact O-CB 3.49Å; V1502-M1506 PolarHBondContact O-N 2.76Å; R1503-M1506 PolarHBondContact O-N 3.44Å; H1504-M1506 VanDerWaalsContact C-N 3.34Å; H1504-M1506 PolarHBondContact O-N 2.79Å; M1506-K1510 PolarHBondContact O-N 3.34Å
1507	E	82.4	Confident	75.2	Confident	108 Å²	108	112.2 Å²	112.2	51%	0.505	53%	0.526	S	S	.	.	H	α-helix	trans	-67.1	-45.1	172.6	-73	169.8	177.1	0	0	112.4	R1503 H1504 H1509 K1510 L1511	R1503-E1507 WeakPolarHBondContact O-CG 3.49Å; R1503-E1507 PolarHBondContact O-N 3.35Å; H1504-E1507 PolarHBondContact O-N 3.28Å; E1507-H1509 VanDerWaalsContact C-N 3.32Å; E1507-H1509 PolarHBondContact O-N 2.67Å; E1507-K1510 PolarHBondContact O-N 2.88Å; E1507-L1511 PolarHBondContact O-N 3.5Å
1508	Q	69.3	Low	76.3	Confident	94 Å²	94	114.1 Å²	114.1	44%	0.439	53%	0.531	S	S	.	.	H	α-helix	trans	-56.4	-45.6	172.8	-70.2	-81.2	-12	0	0	111.2	H1504 R1505 L1511 L1512	H1504-Q1508 PolarHBondContact NE2-NE2 2.86Å; H1504-Q1508 VanDerWaalsContact NE2-NE2 3.11Å; H1504-Q1508 WeakPolarHBondContact O-CG 2.98Å; H1504-Q1508 PolarHBondContact O-N 2.96Å; R1505-Q1508 PolarHBondContact O-N 2.97Å; Q1508-L1511 PolarHBondContact O-N 2.87Å; Q1508-L1512 WeakPolarHBondContact O-CG 3.47Å; Q1508-L1512 PolarHBondContact O-N 3.34Å
1509	H	77.4	Confident	76.7	Confident	126 Å²	126	113.9 Å²	113.9	58%	0.583	53%	0.53	S	S	*	.	H	α-helix	trans	-67.1	-38.1	178.6	-158.6	-52.5	0	0	0	112.6	R1505 E1507 L1511 E1513	R1505-H1509 PolarHBondContact O-N 3.36Å; E1507-H1509 VanDerWaalsContact C-N 3.32Å; E1507-H1509 PolarHBondContact O-N 2.67Å; H1509-L1511 VanDerWaalsContact C-N 3.33Å; H1509-E1513 WeakPolarHBondContact O-CB 3.37Å; H1509-E1513 PolarHBondContact O-N 2.84Å
1510	K	79.9	Confident	77	Confident	155 Å²	155	113.1 Å²	113.1	67%	0.674	53%	0.527	S	S	*	.	H	α-helix	trans	-62.7	-38.6	171.6	-91.7	-177	173.8	175.5	0	112.2	M1506 E1507 K1514	M1506-K1510 PolarHBondContact O-N 3.34Å; E1507-K1510 PolarHBondContact O-N 2.88Å; K1510-K1514 VanDerWaalsContact O-CB 3.25Å; K1510-K1514 WeakPolarHBondContact O-CB 3.49Å; K1510-K1514 PolarHBondContact O-N 2.96Å
1511	L	79.6	Confident	77.3	Confident	99 Å²	99	114.5 Å²	114.5	52%	0.518	53%	0.525	S	S	.	.	H	α-helix	trans	-69.1	-43.1	178.8	-172.6	63.2	0	0	0	111.8	E1507 Q1508 H1509 K1514 Q1515	E1507-L1511 PolarHBondContact O-N 3.5Å; Q1508-L1511 PolarHBondContact O-N 2.87Å; H1509-L1511 VanDerWaalsContact C-N 3.33Å; L1511-K1514 PolarHBondContact O-N 3.38Å; L1511-Q1515 WeakPolarHBondContact O-CG 3.31Å; L1511-Q1515 PolarHBondContact O-N 2.88Å
1512	L	75.5	Confident	77.5	Confident	106 Å²	106	113.7 Å²	113.7	56%	0.555	52%	0.522	S	S	*	.	H	α-helix	trans	-63.5	-45.6	176	-74.3	168.6	0	0	0	112.2	Q1508 K1514 Q1515 R1516	Q1508-L1512 WeakPolarHBondContact O-CG 3.47Å; Q1508-L1512 PolarHBondContact O-N 3.34Å; L1512-K1514 VanDerWaalsContact C-N 3.3Å; L1512-K1514 PolarHBondContact O-N 2.94Å; L1512-Q1515 PolarHBondContact O-N 3.44Å; L1512-R1516 PolarHBondContact O-N 2.9Å
1513	E	81.2	Confident	77	Confident	70 Å²	70	116.9 Å²	116.9	33%	0.327	52%	0.524	S	S	.	.	H	α-helix	trans	-65.4	-36.2	177.5	-161.1	61.3	-146.8	0	0	111.3	H1509 Q1515 R1516 V1517	H1509-E1513 WeakPolarHBondContact O-CB 3.37Å; H1509-E1513 PolarHBondContact O-N 2.84Å; E1513-Q1515 PolarHBondContact O-N 3.06Å; E1513-R1516 PolarHBondContact O-N 3.07Å; E1513-R1516 WeakPolarHBondContact OE1-CD 3.42Å; E1513-R1516 IonicContact OE1-CZ 3.93Å; E1513-R1516 IonicContact OE1-NE 3.17Å; E1513-R1516 IonicContact OE1-NH1 2.7Å; E1513-R1516 PolarHBondContact OE1-NH1 3.26Å; E1513-R1516 IonicContact OE2-NH1 3.74Å; E1513-V1517 WeakPolarHBondContact O-CG2 3.48Å; E1513-V1517 PolarHBondContact O-N 3.04Å
1514	K	82.1	Confident	76.3	Confident	160 Å²	160	114.1 Å²	114.1	70%	0.696	53%	0.526	S	S	*	.	H	α-helix	trans	-66.1	-36.3	174.7	-162.2	172.8	-172	179.1	0	112.4	K1510 L1511 L1512 E1518	K1510-K1514 VanDerWaalsContact O-CB 3.25Å; K1510-K1514 WeakPolarHBondContact O-CB 3.49Å; K1510-K1514 PolarHBondContact O-N 2.96Å; L1511-K1514 PolarHBondContact O-N 3.38Å; L1512-K1514 VanDerWaalsContact C-N 3.3Å; L1512-K1514 PolarHBondContact O-N 2.94Å; K1514-E1518 WeakPolarHBondContact O-CB 3.3Å; K1514-E1518 PolarHBondContact O-N 3.22Å; K1514-E1518 VanDerWaalsContact O-N 3.13Å
1515	Q	80.9	Confident	75.7	Confident	108 Å²	108	116.4 Å²	116.4	51%	0.505	54%	0.535	S	S	.	.	H	α-helix	trans	-67.9	-42.1	170.9	-73.8	-176.8	2	0	0	112	L1511 L1512 E1513 E1518 I1519	L1511-Q1515 WeakPolarHBondContact O-CG 3.31Å; L1511-Q1515 PolarHBondContact O-N 2.88Å; L1512-Q1515 PolarHBondContact O-N 3.44Å; E1513-Q1515 PolarHBondContact O-N 3.06Å; Q1515-E1518 PolarHBondContact O-N 3.34Å; Q1515-I1519 WeakPolarHBondContact O-CB 3.38Å; Q1515-I1519 VanDerWaalsContact O-CG1 3.27Å; Q1515-I1519 WeakPolarHBondContact O-CG1 2.99Å; Q1515-I1519 PolarHBondContact O-N 2.85Å
1516	R	85.2	Confident	74.7	Confident	150 Å²	150	113.7 Å²	113.7	57%	0.566	53%	0.533	S	S	*	.	H	α-helix	trans	-59.4	-48.9	176.1	179.5	-178.9	172	-145.5	5.9	111.7	L1512 E1513 E1518 I1519 E1520	L1512-R1516 PolarHBondContact O-N 2.9Å; E1513-R1516 PolarHBondContact O-N 3.07Å; E1513-R1516 WeakPolarHBondContact OE1-CD 3.42Å; E1513-R1516 IonicContact OE1-CZ 3.93Å; E1513-R1516 IonicContact OE1-NE 3.17Å; E1513-R1516 IonicContact OE1-NH1 2.7Å; E1513-R1516 PolarHBondContact OE1-NH1 3.26Å; E1513-R1516 IonicContact OE2-NH1 3.74Å; R1516-E1518 VanDerWaalsContact C-N 3.34Å; R1516-E1518 PolarHBondContact O-N 3.18Å; R1516-I1519 PolarHBondContact O-N 3.42Å; R1516-E1520 PolarHBondContact O-N 2.56Å
1517	V	80	Confident	72.9	Confident	85 Å²	85	118.7 Å²	118.7	52%	0.515	55%	0.545	S	S	.	.	H	α-helix	trans	-62.6	-39.2	177.6	171.4	0	0	0	0	111.5	E1513 E1520 R1521	E1513-V1517 WeakPolarHBondContact O-CG2 3.48Å; E1513-V1517 PolarHBondContact O-N 3.04Å; V1517-E1520 PolarHBondContact O-N 2.94Å; V1517-R1521 WeakPolarHBondContact O-CB 3.39Å; V1517-R1521 PolarHBondContact O-N 3.43Å
1518	E	80.1	Confident	70.6	Confident	97 Å²	97	119.4 Å²	119.4	45%	0.453	56%	0.557	S	S	.	*	H	α-helix	trans	-69	-37.4	175.6	-167.4	61	-153.8	0	0	112.1	K1514 Q1515 R1516 R1521 L1522	K1514-E1518 WeakPolarHBondContact O-CB 3.3Å; K1514-E1518 PolarHBondContact O-N 3.22Å; K1514-E1518 VanDerWaalsContact O-N 3.13Å; Q1515-E1518 PolarHBondContact O-N 3.34Å; R1516-E1518 VanDerWaalsContact C-N 3.34Å; R1516-E1518 PolarHBondContact O-N 3.18Å; E1518-R1521 PolarHBondContact O-N 2.83Å; E1518-L1522 HydrophobicContact CG-CD1 4.32Å; E1518-L1522 WeakPolarHBondContact O-CB 3.29Å; E1518-L1522 VanDerWaalsContact O-CG 3.24Å; E1518-L1522 WeakPolarHBondContact O-CG 3.5Å; E1518-L1522 PolarHBondContact O-N 3.21Å
1519	I	74.7	Confident	69.1	Low	87 Å²	87	120 Å²	120	45%	0.446	57%	0.569	S	S	.	*	H	α-helix	trans	-63.6	-41.9	173	-71.2	164.5	0	0	0	110.8	Q1515 R1516 L1522 R1523	Q1515-I1519 WeakPolarHBondContact O-CB 3.38Å; Q1515-I1519 VanDerWaalsContact O-CG1 3.27Å; Q1515-I1519 WeakPolarHBondContact O-CG1 2.99Å; Q1515-I1519 PolarHBondContact O-N 2.85Å; R1516-I1519 PolarHBondContact O-N 3.42Å; I1519-L1522 PolarHBondContact O-N 3.26Å; I1519-R1523 HydrophobicContact CG2-CG 4.46Å; I1519-R1523 WeakPolarHBondContact O-CB 3.36Å; I1519-R1523 WeakPolarHBondContact O-CG 3.37Å; I1519-R1523 PolarHBondContact O-N 3.23Å
1520	E	73.9	Confident	66.7	Low	103 Å²	103	126 Å²	126	48%	0.481	59%	0.586	S	S	.	*	H	α-helix	trans	-68.3	-36.5	176.7	-148.1	63.6	-108.5	0	0	111.8	R1516 V1517 L1522 R1523 S1524	R1516-E1520 PolarHBondContact O-N 2.56Å; V1517-E1520 PolarHBondContact O-N 2.94Å; E1520-L1522 VanDerWaalsContact C-N 3.31Å; E1520-L1522 PolarHBondContact O-N 3.2Å; E1520-R1523 PolarHBondContact O-N 3.44Å; E1520-S1524 WeakPolarHBondContact O-CB 3.29Å; E1520-S1524 PolarHBondContact O-N 3.01Å; E1520-S1524 PolarHBondContact O-OG 2.95Å
1521	R	77.3	Confident	64.3	Low	144 Å²	144	122.6 Å²	122.6	54%	0.543	59%	0.587	S	S	.	*	H	α-helix	trans	-65.9	-29.9	172.1	-174.3	176.1	-178.8	78.1	-5.6	112.9	V1517 E1518 S1524 K1525	V1517-R1521 WeakPolarHBondContact O-CB 3.39Å; V1517-R1521 PolarHBondContact O-N 3.43Å; E1518-R1521 PolarHBondContact O-N 2.83Å; R1521-S1524 WeakPolarHBondContact CA-OG 3.35Å; R1521-S1524 PolarHBondContact O-OG 3.43Å; R1521-K1525 WeakPolarHBondContact O-CG 3.42Å; R1521-K1525 PolarHBondContact O-N 3.23Å
1522	L	71	Confident	61.8	Low	72 Å²	72	124.1 Å²	124.1	38%	0.377	60%	0.601	S	S	.	*	H	α-helix	trans	-80.4	-41.3	173	-71.9	166.5	0	0	0	111.7	E1518 I1519 E1520 K1525 I1526	E1518-L1522 HydrophobicContact CG-CD1 4.32Å; E1518-L1522 WeakPolarHBondContact O-CB 3.29Å; E1518-L1522 VanDerWaalsContact O-CG 3.24Å; E1518-L1522 WeakPolarHBondContact O-CG 3.5Å; E1518-L1522 PolarHBondContact O-N 3.21Å; I1519-L1522 PolarHBondContact O-N 3.26Å; E1520-L1522 VanDerWaalsContact C-N 3.31Å; E1520-L1522 PolarHBondContact O-N 3.2Å; L1522-K1525 PolarHBondContact O-N 3.02Å; L1522-I1526 VanDerWaalsContact O-CG1 3.32Å; L1522-I1526 WeakPolarHBondContact O-CG1 3.17Å; L1522-I1526 PolarHBondContact O-N 3.26Å
1523	R	64.1	Low	59.5	Low	154 Å²	154	124.2 Å²	124.2	58%	0.581	61%	0.611	S	S	*	*	H	α-helix	trans	-61.5	-44.7	175	-77.7	176.8	166.9	-164.1	-7	112.1	I1519 E1520 K1525 I1526 R1527	I1519-R1523 HydrophobicContact CG2-CG 4.46Å; I1519-R1523 WeakPolarHBondContact O-CB 3.36Å; I1519-R1523 WeakPolarHBondContact O-CG 3.37Å; I1519-R1523 PolarHBondContact O-N 3.23Å; E1520-R1523 PolarHBondContact O-N 3.44Å; R1523-K1525 VanDerWaalsContact C-N 3.34Å; R1523-K1525 PolarHBondContact O-N 3.46Å; R1523-I1526 PolarHBondContact O-N 2.9Å; R1523-R1527 PolarHBondContact O-N 3.17Å; R1523-R1527 VanDerWaalsContact O-N 3.1Å
1524	S	62.5	Low	57	Low	80 Å²	80	126.2 Å²	126.2	56%	0.559	63%	0.627	S	S	*	*	H	α-helix	trans	-63.9	-35.2	174.4	48.3	0	0	0	0	113	E1520 R1521 R1527	E1520-S1524 WeakPolarHBondContact O-CB 3.29Å; E1520-S1524 PolarHBondContact O-N 3.01Å; E1520-S1524 PolarHBondContact O-OG 2.95Å; R1521-S1524 WeakPolarHBondContact CA-OG 3.35Å; R1521-S1524 PolarHBondContact O-OG 3.43Å; S1524-R1527 PolarHBondContact O-N 3.14Å
1525	K	63.2	Low	54.4	Low	149 Å²	149	125.3 Å²	125.3	65%	0.648	63%	0.63	S	S	*	*	H	α-helix	trans	-70.4	-26.5	171.7	-81.3	-176.3	171.8	-167.2	0	114.8	R1521 L1522 R1523	R1521-K1525 WeakPolarHBondContact O-CG 3.42Å; R1521-K1525 PolarHBondContact O-N 3.23Å; L1522-K1525 PolarHBondContact O-N 3.02Å; R1523-K1525 VanDerWaalsContact C-N 3.34Å; R1523-K1525 PolarHBondContact O-N 3.46Å
1526	I	52.4	Low	52	Low	130 Å²	130	125.6 Å²	125.6	67%	0.667	64%	0.641	S	S	*	*	H	α-helix	trans	-82.9	-18.7	176.7	-69.9	165.4	0	0	0	111.2	L1522 R1523 V1528	L1522-I1526 VanDerWaalsContact O-CG1 3.32Å; L1522-I1526 WeakPolarHBondContact O-CG1 3.17Å; L1522-I1526 PolarHBondContact O-N 3.26Å; R1523-I1526 PolarHBondContact O-N 2.9Å; I1526-V1528 PolarHBondContact O-N 3.24Å
1527	R	37.7	Very low	49.3	Very low	215 Å²	215	125.8 Å²	125.8	81%	0.811	65%	0.649	S	S	*	*			trans	-80.7	55	-178.5	-155.2	176.3	-158.1	157.3	6.6	113.6	R1523 S1524 P1529	R1523-R1527 PolarHBondContact O-N 3.17Å; R1523-R1527 VanDerWaalsContact O-N 3.1Å; S1524-R1527 PolarHBondContact O-N 3.14Å; R1527-P1529 WeakPolarHBondContact O-CD 3.31Å
1528	V	35.2	Very low	46.8	Very low	124 Å²	124	130.2 Å²	130.2	75%	0.752	67%	0.666	S	S	*	*			trans	-73.9	117	162.1	-179.5	0	0	0	0	107.7	I1526 R1530	I1526-V1528 PolarHBondContact O-N 3.24Å; V1528-R1530 PolarHBondContact O-N 3.18Å
1529	P	38.1	Very low	44.6	Very low	105 Å²	105	132.9 Å²	132.9	68%	0.682	68%	0.681	S	S	*	*			trans	-76.7	114.7	-175.6	29.8	-33	0	0	0	110.8	R1527 A1531	R1527-P1529 WeakPolarHBondContact O-CD 3.31Å; P1529-A1531 PolarHBondContact O-N 3.27Å
1530	R	26.5	Very low	42.5	Very low	252 Å²	252	131 Å²	131	95%	0.951	68%	0.684	S	S	*	*			trans	-75	66.5	162.9	-170.6	178.9	179.1	163.9	0.4	109.4	V1528	V1528-R1530 PolarHBondContact O-N 3.18Å
1531	A	30.5	Very low	40.5	Very low	85 Å²	85	133.8 Å²	133.8	70%	0.702	70%	0.702	S	S	*	*			trans	-79.9	132	176.8	0	0	0	0	0	110.5	P1529	P1529-A1531 PolarHBondContact O-N 3.27Å
1532	T	26.5	Very low	38.4	Very low	131 Å²	131	134 Å²	134	80%	0.804	71%	0.714	S	S	*	*			trans	-86.1	117.9	174.6	45.7	0	0	0	0	111
1533	S	27.7	Very low	36.5	Very low	108 Å²	108	139.1 Å²	139.1	76%	0.755	74%	0.736	S	S	*	*			trans	-128.9	122.7	151.1	-138	0	0	0	0	104.4
1534	V	28	Very low	35.1	Very low	112 Å²	112	136.9 Å²	136.9	68%	0.679	75%	0.75	S	S	*	*			cis	59.1	89.8	40	-163.6	0	0	0	0	110.1
1535	N	27.3	Very low	33.5	Very low	140 Å²	140	140 Å²	140	75%	0.749	76%	0.761	S	S	*	*			trans	-68.2	150	158.3	-72.8	-6.4	0	0	0	108.6
1536	P	31.3	Very low	32.1	Very low	115 Å²	115	137.7 Å²	137.7	75%	0.747	76%	0.76	S	S	*	*				-105.7	132.3	95.4	30.8	-35.1	0	0	0	110.2
1537	E	27	Very low	31.2	Very low	154 Å²	154	137.3 Å²	137.3	72%	0.72	76%	0.763	S	S	*	*				54.9	82.6	68.5	-71	-160.3	123.7	0	0	113.2
1538	M	29	Very low	30.9	Very low	177 Å²	177	134.2 Å²	134.2	87%	0.872	76%	0.762	S	S	*	*				-129.3	119.3	129.3	-80.8	-62.9	-57.7	0	0	107.2
1539	I	32.4	Very low	30.8	Very low	153 Å²	153	134.4 Å²	134.4	79%	0.785	76%	0.764	S	S	*	*			trans	-118.4	145.7	172.7	-67.8	176.9	0	0	0	107.1
1540	G	32	Very low	30.5	Very low	49 Å²	49	132.9 Å²	132.9	51%	0.505	76%	0.76	S	S	.	*			trans	95.2	140	174.7	0	0	0	0	0	113.5
1541	D	31.3	Very low	30.7	Very low	161 Å²	161	128 Å²	128	86%	0.861	75%	0.752	S	S	*	*			cis	-143.2	174.3	-0.8	-58.5	-58.3	0	0	0	107.7
1542	D	32.9	Very low	30.8	Very low	147 Å²	147	131.5 Å²	131.5	79%	0.786	75%	0.754	S	S	*	*			cis	-154.7	-168.4	14.8	-153.9	-15.9	0	0	0	110.4
1543	E	31.8	Very low	31.1	Very low	180 Å²	180	130.2 Å²	130.2	84%	0.841	75%	0.75	S	S	*	*			trans	-59.2	153.6	174.3	-57.3	-174.9	121.6	0	0	116.3
1544	A	33.3	Very low	31.4	Very low	107 Å²	107	129.4 Å²	129.4	88%	0.884	75%	0.75	S	S	*	*				179.1	136.1	119	0	0	0	0	0	114.2
1545	D	30.7	Very low	31.6	Very low	147 Å²	147	132.3 Å²	132.3	79%	0.786	76%	0.76	S	S	*	*			trans	-88.5	165.7	-157.8	-160.5	-18.1	0	0	0	116.9
1546	T	33.3	Very low	31.8	Very low	100 Å²	100	128.7 Å²	128.7	61%	0.613	76%	0.756	S	S	*	*			trans	66.7	133.9	147.6	7.4	0	0	0	0	126.2
1547	T	33.4	Very low	32	Very low	121 Å²	121	131.1 Å²	131.1	74%	0.742	76%	0.763	S	S	*	*			trans	68.9	147.4	154	66.1	0	0	0	0	119.1
1548	L	31.4	Very low	32.3	Very low	150 Å²	150	128.3 Å²	128.3	79%	0.785	77%	0.766	S	S	*	*			cis	-156.5	-171.2	-15.5	-106.4	168.3	0	0	0	106.1
1549	T	32.1	Very low	32.4	Very low	129 Å²	129	125.3 Å²	125.3	79%	0.791	76%	0.763	S	S	*	*			cis	-152.8	179.6	19.6	-32	0	0	0	0	110.5
1550	A	32.8	Very low	32.5	Very low	72 Å²	72	126.1 Å²	126.1	60%	0.595	77%	0.768	S	S	*	*			trans	-83.2	178.4	176.7	0	0	0	0	0	113.2
1551	L	30.8	Very low	32.4	Very low	149 Å²	149	128.4 Å²	128.4	78%	0.78	78%	0.776	S	S	*	*				-150	140.3	54.2	-69.5	165.5	0	0	0	110.4
1552	Q	31.9	Very low	32.3	Very low	159 Å²	159	129.1 Å²	129.1	74%	0.743	78%	0.779	S	S	*	*			cis	79.8	131.2	48.8	-165.1	173.2	15.5	0	0	112.2
1553	S	32.5	Very low	32.6	Very low	105 Å²	105	127.8 Å²	127.8	73%	0.734	78%	0.778	S	S	*	*			cis	-178.7	161.3	-11.9	52.7	0	0	0	0	111.2
1554	A	33.7	Very low	32.6	Very low	90 Å²	90	123.6 Å²	123.6	74%	0.744	77%	0.774	S	S	*	*			trans	-170.5	124.2	147.5	0	0	0	0	0	116.2
1555	L	32.9	Very low	32.4	Very low	173 Å²	173	121.5 Å²	121.5	91%	0.906	75%	0.753	S	S	*	*			trans	38.5	136.9	137.6	-60.3	162.6	0	0	0	122.3
1556	G	32	Very low	32.9	Very low	64 Å²	64	120 Å²	120	66%	0.66	75%	0.752	S	S	*	*			cis	163.6	162.7	-8.2	0	0	0	0	0	116
1557	N	35.7	Very low	33.1	Very low	166 Å²	166	120.8 Å²	120.8	89%	0.888	76%	0.758	S	S	*	*			trans	66.8	148.6	164.6	-59.7	-6.4	0	0	0	118.7
1558	A	33.5	Very low	33.5	Very low	96 Å²	96	120.3 Å²	120.3	79%	0.793	76%	0.757	S	S	*	*			cis	-136.7	167.4	7.6	0	0	0	0	0	113.2
1559	S	30.8	Very low	33.6	Very low	113 Å²	113	120.7 Å²	120.7	79%	0.79	76%	0.76	S	S	*	*			trans	-150.3	157.3	-179.2	-50.5	0	0	0	0	111.9
1560	L	32.8	Very low	33.9	Very low	171 Å²	171	121.1 Å²	121.1	90%	0.895	76%	0.763	S	S	*	*			trans	-150.1	149.3	165.7	-72.8	178.6	0	0	0	109.6
1561	S	30.8	Very low	33.7	Very low	97 Å²	97	125.1 Å²	125.1	68%	0.678	77%	0.769	S	S	*	*				-170.3	134.3	-83.3	52.2	0	0	0	0	111.2
1562	L	28.4	Very low	33.9	Very low	176 Å²	176	124 Å²	124	92%	0.921	77%	0.768	S	S	*	*			trans	-129.2	136.4	162.1	-75	176.2	0	0	0	109.7
1563	P	40.9	Very low	34.1	Very low	119 Å²	119	122.6 Å²	122.6	77%	0.773	77%	0.771	S	S	*	*			trans	-108.8	176	166.3	39.6	-31.8	0	0	0	111.7
1564	A	30.4	Very low	34.1	Very low	92 Å²	92	125.6 Å²	125.6	76%	0.76	77%	0.771	S	S	*	*			cis	-176.5	158.4	-35.2	0	0	0	0	0	108.2
1565	S	30.1	Very low	34.1	Very low	63 Å²	63	128.3 Å²	128.3	44%	0.441	78%	0.778	S	S	.	*			trans	-72.4	-165.2	-176	-36.4	0	0	0	0	114.8	H1324	H1324-S1565 WeakPolarHBondContact CD2-CB 3.33Å; H1324-S1565 PolarHBondContact CD2-OG 3.27Å; H1324-S1565 WeakPolarHBondContact NE2-CB 3.36Å; H1324-S1565 PolarHBondContact NE2-OG 3.06Å
1566	P	40.1	Very low	34	Very low	116 Å²	116	126.8 Å²	126.8	75%	0.753	77%	0.771	S	S	*	*			cis	-134.5	-119.9	-5.6	28.8	-0	0	0	0	114.6
1567	P	37.3	Very low	33.8	Very low	115 Å²	115	128.9 Å²	128.9	75%	0.747	77%	0.771	S	S	*	*				-129.4	-179.4	-127.9	41.1	-19.3	0	0	0	116.8
1568	P	43.6	Very low	33.5	Very low	112 Å²	112	127.1 Å²	127.1	73%	0.727	77%	0.766	S	S	*	*			trans	-111.8	150.3	-179.7	38.4	-30.5	0	0	0	116.3
1569	N	32.7	Very low	33.3	Very low	158 Å²	158	128.9 Å²	128.9	85%	0.845	77%	0.767	S	S	*	*				-164.3	165.7	125.5	-113.5	-92.6	0	0	0	110
1570	T	37.4	Very low	33.3	Very low	137 Å²	137	130.4 Å²	130.4	84%	0.84	77%	0.765	S	S	*	*			trans	-149.4	161.7	-176	53.9	0	0	0	0	113.1
1571	E	30.4	Very low	33.9	Very low	156 Å²	156	127.9 Å²	127.9	73%	0.729	76%	0.758	S	S	*	*			trans	-139.4	173.6	160.2	-138.2	-148.2	159.6	0	0	111.8
1572	T	34	Very low	33.8	Very low	125 Å²	125	128.3 Å²	128.3	77%	0.767	76%	0.761	S	S	*	*			trans	81	126	-173	68.7	0	0	0	0	116.1
1573	T	36.2	Very low	33.7	Very low	130 Å²	130	126.8 Å²	126.8	80%	0.798	75%	0.754	S	S	*	*			cis	-148.1	157.2	-5.2	-79.9	0	0	0	0	112.6
1574	K	31.6	Very low	33.2	Very low	168 Å²	168	126.4 Å²	126.4	73%	0.73	75%	0.749	S	S	*	*			trans	-70.3	156.2	-168.3	-60	141.8	-177.7	166.7	0	116.8
1575	V	34.8	Very low	33.1	Very low	147 Å²	147	129.7 Å²	129.7	89%	0.891	75%	0.753	S	S	*	*				160.5	150.2	124.8	156.4	0	0	0	0	110.9
1576	N	29.6	Very low	33	Very low	141 Å²	141	130.2 Å²	130.2	75%	0.754	76%	0.762	S	S	*	*				-165.3	145.4	-54.3	-156.4	25.5	0	0	0	109.6
1577	T	29.7	Very low	32.6	Very low	108 Å²	108	130.4 Å²	130.4	66%	0.663	76%	0.761	S	S	*	*			trans	82.3	123.3	159	-21.5	0	0	0	0	121.6
1578	T	27.7	Very low	32.3	Very low	130 Å²	130	135 Å²	135	80%	0.798	76%	0.763	S	S	*	*			trans	65.2	152.7	165	24.6	0	0	0	0	117.1
1579	V	29.5	Very low	31.7	Very low	132 Å²	132	136.5 Å²	136.5	80%	0.8	76%	0.762	S	S	*	*			cis	-136.3	160.2	23.8	-175.6	0	0	0	0	113.1
1580	I	32	Very low	31.8	Very low	146 Å²	146	134.5 Å²	134.5	75%	0.749	76%	0.756	S	S	*	*			trans	-44.3	154.4	162.2	-70.8	161.3	0	0	0	114.5
1581	P	44.3	Very low	31.7	Very low	117 Å²	117	136.5 Å²	136.5	76%	0.76	76%	0.758	S	S	*	*			trans	-77	151.3	178.4	32	-38.8	0	0	0	114.7
1582	S	28.9	Very low	31.8	Very low	106 Å²	106	133 Å²	133	74%	0.741	75%	0.75	S	S	*	*			trans	-174.7	145.4	130.4	-128.8	0	0	0	0	114.2
1583	D	27.1	Very low	31.8	Very low	145 Å²	145	135.5 Å²	135.5	78%	0.775	75%	0.753	S	S	*	*			trans	77.3	148	139.7	-92.4	-52	0	0	0	126.9
1584	V	29.6	Very low	31.7	Very low	110 Å²	110	134.3 Å²	134.3	67%	0.667	75%	0.75	S	S	*	*			trans	84.6	103.8	144.5	160.5	0	0	0	0	121.9
1585	L	29.1	Very low	31.7	Very low	161 Å²	161	131.1 Å²	131.1	84%	0.843	75%	0.749	S	S	*	*			trans	58.3	155.8	146.7	-80.6	73.9	0	0	0	120.3
1586	A	27.8	Very low	31.6	Very low	75 Å²	75	130.7 Å²	130.7	62%	0.62	75%	0.747	S	S	*	*			cis	-173.6	172.1	-30.4	0	0	0	0	0	110.5
1587	T	31.3	Very low	31.6	Very low	119 Å²	119	133.9 Å²	133.9	73%	0.73	75%	0.754	S	S	*	*			trans	75.6	104.1	151.1	-53.1	0	0	0	0	119.1
1588	R	30.6	Very low	31.7	Very low	213 Å²	213	134 Å²	134	80%	0.804	76%	0.759	S	S	*	*			trans	55.7	152.8	140.2	-67.2	179.3	164.6	-173.2	-4	118.4
1589	M	31.6	Very low	32.1	Very low	142 Å²	142	133.5 Å²	133.5	70%	0.7	76%	0.761	S	S	*	*			cis	-161.4	156.8	-2	-113.5	162	168.6	0	0	104.1
1590	T	34.6	Very low	32.1	Very low	116 Å²	116	134.8 Å²	134.8	71%	0.712	76%	0.764	S	S	*	*				-173.2	152.5	57.7	45.1	0	0	0	0	109.7
1591	M	36	Very low	32.1	Very low	180 Å²	180	134.4 Å²	134.4	89%	0.887	77%	0.768	S	S	*	*			trans	52.7	148.9	139.6	-70.5	-176.2	167.6	0	0	121.7
1592	S	32.6	Very low	31.3	Very low	81 Å²	81	134.3 Å²	134.3	57%	0.566	77%	0.77	S	S	*	*			cis	-171.3	155.7	-10.6	55.6	0	0	0	0	110.4
1593	Q	33.1	Very low	31.3	Very low	179 Å²	179	135.9 Å²	135.9	84%	0.836	78%	0.775	S	S	*	*			trans	67.4	148	165	-61.1	166.9	92.2	0	0	116
1594	S	33.6	Very low	31.6	Very low	105 Å²	105	134.3 Å²	134.3	73%	0.734	78%	0.775	S	S	*	*			cis	-153.7	152.8	-17.7	41.2	0	0	0	0	112.3
1595	S	32.6	Very low	31.9	Very low	101 Å²	101	133.2 Å²	133.2	71%	0.706	77%	0.772	S	S	*	*			trans	-37.8	153.9	168.3	49.1	0	0	0	0	117.8
1596	T	32.9	Very low	32.2	Very low	137 Å²	137	136 Å²	136	84%	0.84	77%	0.772	S	S	*	*			cis	-170	160	-6.8	20.8	0	0	0	0	109.2
1597	K	29.4	Very low	32.6	Very low	209 Å²	209	139.5 Å²	139.5	91%	0.909	78%	0.775	S	S	*	*			trans	-120.8	166.8	156.7	-121.4	178.9	-177.2	179.3	0	110.6
1598	S	31.6	Very low	32.9	Very low	110 Å²	110	142.7 Å²	142.7	77%	0.769	77%	0.773	S	S	*	*			trans	-77.4	174.5	-156.6	-43.8	0	0	0	0	117.3
1599	S	34.9	Very low	33.2	Very low	120 Å²	120	137.6 Å²	137.6	84%	0.839	76%	0.762	S	S	*	*			trans	91.2	128.8	156.7	72.6	0	0	0	0	119
1600	N	30.1	Very low	33.5	Very low	159 Å²	159	137.1 Å²	137.1	85%	0.85	76%	0.763	S	S	*	*			trans	-84.7	149.1	167.7	-63.5	-41.1	0	0	0	109.8
1601	V	32.3	Very low	33.7	Very low	138 Å²	138	139.3 Å²	139.3	84%	0.836	76%	0.764	S	S	*	*				-173	144.5	105.2	148.7	0	0	0	0	108.8
1602	S	27.5	Very low	33.8	Very low	115 Å²	115	135 Å²	135	80%	0.804	75%	0.753	S	S	*	*			trans	-92	141.7	-170.7	-46.3	0	0	0	0	113.2
1603	V	29.7	Very low	34.2	Very low	138 Å²	138	135.6 Å²	135.6	84%	0.836	76%	0.762	S	S	*	*			trans	-139.1	142	157.4	-175	0	0	0	0	110.6
1604	S	33.1	Very low	34.7	Very low	112 Å²	112	132.4 Å²	132.4	78%	0.783	76%	0.757	S	S	*	*			trans	-153.3	145.3	166.3	-86.2	0	0	0	0	107.9
1605	S	36.2	Very low	35.3	Very low	87 Å²	87	132.5 Å²	132.5	61%	0.608	76%	0.755	S	S	*	*			cis	-171.5	148.7	-1.1	53.2	0	0	0	0	112.1
1606	R	34.8	Very low	35.4	Very low	220 Å²	220	138.2 Å²	138.2	83%	0.83	76%	0.761	S	S	*	*			trans	66	162.9	151.4	-65.7	165.7	179.9	-179.2	0.4	116.2
1607	H	36	Very low	35.5	Very low	148 Å²	148	139.3 Å²	139.3	69%	0.685	76%	0.756	S	S	*	*			cis	179.7	162.2	-22.4	-95.3	-15.8	0	0	0	105.5
1608	R	37.6	Very low	35.9	Very low	186 Å²	186	137.2 Å²	137.2	70%	0.702	75%	0.749	S	S	*	*			cis	-163.2	151.6	-6.4	-120.2	-175.9	140.6	149.9	-2.7	111.7
1609	D	36.8	Very low	36.1	Very low	107 Å²	107	139.7 Å²	139.7	57%	0.572	75%	0.748	S	S	*	*			trans	27.4	138.6	139	-44.3	-15.5	0	0	0	120.5
1610	N	38.5	Very low	36.1	Very low	132 Å²	132	142.4 Å²	142.4	71%	0.706	75%	0.748	S	S	*	*				-173.2	174.2	72.8	-83.2	-94	0	0	0	108.1
1611	Q	39.3	Very low	36.1	Very low	161 Å²	161	143.6 Å²	143.6	75%	0.752	75%	0.748	S	S	*	*			cis	-177.4	176	-18.5	-100.4	-162.3	67.9	0	0	105.7
1612	S	36.5	Very low	36.7	Very low	91 Å²	91	141.7 Å²	141.7	64%	0.636	74%	0.739	S	S	*	*			cis	-174.7	164	-14.8	-95.4	0	0	0	0	107.3
1613	A	41.2	Very low	37	Very low	93 Å²	93	145.1 Å²	145.1	77%	0.769	74%	0.741	S	S	*	*			cis	-173.1	-38.6	-17	0	0	0	0	0	116.1
1614	P	43.9	Very low	37.9	Very low	112 Å²	112	143.7 Å²	143.7	73%	0.727	74%	0.735	S	S	*	*			trans	-120.5	-179.5	-157.2	43.9	-35.1	0	0	0	116.2
1615	P	46	Very low	38.7	Very low	106 Å²	106	143.3 Å²	143.3	69%	0.688	73%	0.73	S	S	*	*			cis	-144.3	147.7	-37.3	37.1	-18.2	0	0	0	118.3
1616	R	35	Very low	39	Very low	221 Å²	221	148.2 Å²	148.2	83%	0.834	74%	0.743	S	S	*	*			trans	75.6	147	131.7	-74.3	-175.6	170.2	-157.1	-1.6	127.1
1617	H	36.4	Very low	39	Very low	161 Å²	161	145.9 Å²	145.9	75%	0.745	74%	0.741	S	S	*	*			trans	105.9	163	152.2	-74.4	-63.1	0	0	0	121.2
1618	H	36.4	Very low	39.3	Very low	164 Å²	164	144.3 Å²	144.3	76%	0.759	74%	0.744	S	S	*	*			trans	-137.3	153.8	-142.1	-95	-91.4	0	0	0	117.4
1619	H	35.3	Very low	38.9	Very low	162 Å²	162	144.1 Å²	144.1	75%	0.75	75%	0.751	S	S	*	*			trans	50.4	134.1	145.6	-82.3	-7	0	0	0	126.3
1620	H	35.8	Very low	38.8	Very low	178 Å²	178	146.6 Å²	146.6	82%	0.824	76%	0.763	S	S	*	*				173.3	114.7	117.9	-95.8	-31.3	0	0	0	117.4
1621	Q	30.7	Very low	38.5	Very low	184 Å²	184	148 Å²	148	86%	0.86	77%	0.765	S	S	*	*				49.2	173.1	127.1	-98.6	-162.8	-5.3	0	0	126.8
1622	P	44	Very low	38	Very low	98 Å²	98	147 Å²	147	64%	0.636	77%	0.765	S	S	*	*			trans	-138.5	-170.6	-131	47.4	-27.5	0	0	0	119.3
1623	H	33.9	Very low	37.7	Very low	187 Å²	187	149.2 Å²	149.2	87%	0.866	77%	0.765	S	S	*	*			trans	-180	174.6	144	-98.5	-55.9	0	0	0	114
1624	P	49	Very low	37.1	Very low	107 Å²	107	155.1 Å²	155.1	70%	0.695	77%	0.769	S	S	*	*			trans	-130.6	-148.8	-149.8	49.2	-33	0	0	0	114.6
1625	P	49.4	Very low	36.5	Very low	105 Å²	105	158.2 Å²	158.2	68%	0.682	77%	0.774	S	S	*	*			cis	-129.5	167.2	-30.3	35.7	-18.5	0	0	0	115.7
1626	H	42.2	Very low	36.5	Very low	190 Å²	190	157.8 Å²	157.8	88%	0.88	77%	0.771	S	S	*	*			trans	156	158.3	140.1	-97.1	-87.9	0	0	0	115.5
1627	H	35.1	Very low	36.5	Very low	170 Å²	170	152.5 Å²	152.5	79%	0.787	77%	0.765	S	S	*	*			trans	-78	174.7	175.9	-96.9	-100	0	0	0	114.4
1628	P	41.8	Very low	36.2	Very low	116 Å²	116	152.6 Å²	152.6	75%	0.753	77%	0.766	S	S	*	*			cis	-128.7	178.8	-2.4	34.1	-14.2	0	0	0	115.8
1629	H	31	Very low	35.9	Very low	182 Å²	182	149.8 Å²	149.8	84%	0.843	76%	0.756	S	S	*	*			trans	-67.5	138.4	179.3	-80.6	-92.9	0	0	0	115.7
1630	L	33	Very low	35.8	Very low	158 Å²	158	148.9 Å²	148.9	83%	0.827	75%	0.752	S	S	*	*			trans	-150.2	141.7	151.9	-99.7	172.1	0	0	0	111
1631	Q	33.7	Very low	35.4	Very low	162 Å²	162	146.1 Å²	146.1	76%	0.757	75%	0.748	S	S	*	*	S	Bend	trans	16.5	96.9	172	-98.5	71.4	3.9	0	0	120.6
1632	N	29	Very low	35.3	Very low	141 Å²	141	142.6 Å²	142.6	75%	0.754	74%	0.744	S	S	*	*			trans	173.2	158.4	149.7	-101.3	-38.7	0	0	0	108.7
1633	H	29.2	Very low	34.7	Very low	137 Å²	137	142.3 Å²	142.3	63%	0.634	75%	0.749	S	S	*	*			cis	-130	-177	-0.9	-72.1	-69.8	0	0	0	107.9
1634	Y	29.2	Very low	34.7	Very low	217 Å²	217	139.6 Å²	139.6	85%	0.851	75%	0.746	S	S	*	*			cis	-140.7	155.1	18	-94.1	-87	0	0	0	112.1
1635	H	30.2	Very low	34.1	Very low	177 Å²	177	138.9 Å²	138.9	82%	0.819	75%	0.749	S	S	*	*			trans	-109.3	173.6	164.7	-126	-13.6	0	0	0	109.6
1636	P	46.6	Very low	33.8	Very low	97 Å²	97	139.2 Å²	139.2	63%	0.63	75%	0.752	S	S	*	*				-110.1	-162.7	-128.7	37.8	-20.7	0	0	0	112.6
1637	P	35.5	Very low	33.4	Very low	110 Å²	110	136 Å²	136	71%	0.714	75%	0.749	S	S	*	*				-135.8	154.6	93.6	38.5	-25.1	0	0	0	112.7
1638	Q	29.7	Very low	33.8	Very low	162 Å²	162	133.4 Å²	133.4	76%	0.757	75%	0.747	S	S	*	*				51.1	142.5	92.3	-42.3	-176.5	-2.9	0	0	114.6
1639	N	30.6	Very low	33.4	Very low	106 Å²	106	133.3 Å²	133.3	57%	0.567	75%	0.749	S	S	*	*			cis	-163.5	177.7	4.3	-128.9	-20.7	0	0	0	112.3
1640	H	33.3	Very low	33.6	Very low	143 Å²	143	129 Å²	129	66%	0.662	75%	0.745	S	S	*	*			trans	44.4	105.7	148.8	-59.3	-37.4	0	0	0	119.8
1641	T	26.6	Very low	33.6	Very low	119 Å²	119	130.1 Å²	130.1	73%	0.73	75%	0.748	S	S	*	*				71.3	140.9	77.4	61.8	0	0	0	0	117.3
1642	S	28.5	Very low	33.5	Very low	111 Å²	111	127 Å²	127	78%	0.776	74%	0.741	S	S	*	*			trans	68.3	112.3	163.1	54.7	0	0	0	0	121.6
1643	A	31.4	Very low	33.6	Very low	91 Å²	91	129 Å²	129	75%	0.752	75%	0.745	S	S	*	*			trans	73.1	149.2	133.2	0	0	0	0	0	119.4
1644	T	33.3	Very low	33.6	Very low	130 Å²	130	129.5 Å²	129.5	80%	0.798	75%	0.752	S	S	*	*			cis	-157.9	141.4	4	-13.6	0	0	0	0	113.6
1645	A	36	Very low	33.6	Very low	92 Å²	92	127.1 Å²	127.1	76%	0.76	75%	0.749	S	S	*	*			trans	62	168.4	145.3	0	0	0	0	0	120.2
1646	P	45.1	Very low	33.5	Very low	113 Å²	113	122.5 Å²	122.5	73%	0.734	74%	0.741	S	S	*	*			cis	-128.1	152.1	-1.8	39.5	-23.7	0	0	0	117.7
1647	C	32.2	Very low	32.8	Very low	123 Å²	123	124 Å²	124	83%	0.831	75%	0.748	S	S	*	*			trans	28.6	163.8	135.3	-64.1	0	0	0	0	124.5
1648	P	43.9	Very low	32.5	Very low	115 Å²	115	124.4 Å²	124.4	75%	0.747	75%	0.753	S	S	*	*			cis	-136.8	167.4	-12.9	34.6	-15.6	0	0	0	117
1649	S	33.1	Very low	32.6	Very low	113 Å²	113	124.3 Å²	124.3	79%	0.79	76%	0.758	S	S	*	*			trans	139.3	142.8	130.5	-62.2	0	0	0	0	117.2
1650	A	36	Very low	32.8	Very low	92 Å²	92	126.1 Å²	126.1	76%	0.76	77%	0.768	S	S	*	*			trans	54.9	106.2	163.7	0	0	0	0	0	119
1651	M	32.2	Very low	32.6	Very low	181 Å²	181	124.9 Å²	124.9	89%	0.892	77%	0.766	S	S	*	*				76.8	133.3	66.2	-73.3	-161	127.3	0	0	115.3
1652	V	33	Very low	33	Very low	98 Å²	98	125.1 Å²	125.1	59%	0.594	77%	0.767	S	S	*	*			cis	-158.2	134	-17.9	153.9	0	0	0	0	107.5
1653	Q	30.4	Very low	33.1	Very low	182 Å²	182	126.1 Å²	126.1	85%	0.85	76%	0.764	S	S	*	*			trans	-167.6	94.9	131.6	-141	96.4	58	0	0	112.8
1654	L	29	Very low	33.9	Very low	148 Å²	148	125.7 Å²	125.7	78%	0.775	75%	0.753	S	S	*	*			trans	-142.1	156	162	-68.6	174.1	0	0	0	105
1655	Q	28.3	Very low	33.9	Very low	167 Å²	167	126 Å²	126	78%	0.78	75%	0.749	S	S	*	*			cis	-157.9	165.7	-5.2	-129.1	165.1	-41.6	0	0	108
1656	A	28.6	Very low	33.7	Very low	80 Å²	80	128.2 Å²	128.2	66%	0.661	74%	0.744	S	S	*	*			trans	-105.2	158.2	145	0	0	0	0	0	106.9
1657	V	31.5	Very low	33.1	Very low	128 Å²	128	130.8 Å²	130.8	78%	0.776	75%	0.746	S	S	*	*			cis	-146.1	145.5	20	176.5	0	0	0	0	108.5
1658	S	30.2	Very low	33.9	Very low	118 Å²	118	129.4 Å²	129.4	83%	0.825	74%	0.735	S	S	*	*			trans	-172.8	108.6	140	-88	0	0	0	0	113.1
1659	N	32.5	Very low	34.1	Very low	161 Å²	161	130 Å²	130	86%	0.861	74%	0.739	S	S	*	*				-148	140.1	129.7	-123.3	-14.7	0	0	0	108.5
1660	N	33	Very low	34.1	Very low	144 Å²	144	132.8 Å²	132.8	77%	0.77	74%	0.739	S	S	*	*			trans	-68.1	143.4	179.2	-76.2	-52	0	0	0	109.8
1661	N	31	Very low	34.6	Very low	117 Å²	117	133.8 Å²	133.8	63%	0.626	74%	0.738	S	S	*	*				56.6	120.6	65.7	-148.9	14.1	0	0	0	109.2
1662	V	33	Very low	34.6	Very low	124 Å²	124	131 Å²	131	75%	0.752	73%	0.731	S	S	*	*			cis	-140.1	138	42.1	172.7	0	0	0	0	110.2
1663	N	30.8	Very low	34.8	Very low	132 Å²	132	131.4 Å²	131.4	71%	0.706	74%	0.738	S	S	*	*				83.5	170.3	57.5	-112.2	4.6	0	0	0	113.2
1664	P	49.8	Very low	35.1	Very low	82 Å²	82	127.4 Å²	127.4	53%	0.532	73%	0.73	S	S	.	*				-149.8	-156.1	-78.5	44	-22.5	0	0	0	116.7
1665	L	31.9	Very low	35.4	Very low	136 Å²	136	128.5 Å²	128.5	71%	0.712	73%	0.731	S	S	*	*			trans	74.8	162.4	150.9	-94.5	47.1	0	0	0	118.3
1666	H	32.4	Very low	35.9	Very low	139 Å²	139	127.5 Å²	127.5	64%	0.644	73%	0.73	S	S	*	*			cis	-146.4	134.4	11	-114.5	-37	0	0	0	109.6
1667	Q	31.6	Very low	36.4	Very low	166 Å²	166	128.6 Å²	128.6	78%	0.776	73%	0.73	S	S	*	*				95.4	156	85.7	-96	-168.1	2.2	0	0	117.8
1668	P	49	Very low	37.3	Very low	95 Å²	95	128.3 Å²	128.3	62%	0.617	73%	0.731	S	S	*	*			trans	-106.5	-166.8	-165.9	43.4	-37.9	0	0	0	115
1669	P	48.4	Very low	37.6	Very low	127 Å²	127	132.1 Å²	132.1	83%	0.825	74%	0.736	S	S	*	*				-144.8	175.2	109	38.5	-23	0	0	0	117.7
1670	H	32.9	Very low	38.1	Very low	171 Å²	171	133.1 Å²	133.1	79%	0.792	77%	0.767	S	S	*	*			trans	-88.3	-170.6	177.9	-68.5	-89.4	0	0	0	112.4
1671	P	47	Very low	38.3	Very low	114 Å²	114	132.6 Å²	132.6	74%	0.74	77%	0.767	S	S	*	*			cis	-123.8	-149.8	2.3	24.8	3.4	0	0	0	113.2
1672	V	33.3	Very low	38.7	Very low	123 Å²	123	133.4 Å²	133.4	75%	0.745	77%	0.774	S	S	*	*			cis	-159	167.4	17.9	-137.4	0	0	0	0	112.7
1673	S	36.9	Very low	39	Very low	106 Å²	106	133.9 Å²	133.9	74%	0.741	78%	0.775	S	S	*	*			trans	67.9	153	154.4	-63.2	0	0	0	0	120.8
1674	S	35.9	Very low	39.5	Very low	97 Å²	97	134.1 Å²	134.1	68%	0.678	78%	0.779	S	S	*	*			cis	-176.8	139.5	-30	53.6	0	0	0	0	112.2
1675	Q	34.6	Very low	38.9	Very low	171 Å²	171	137.3 Å²	137.3	80%	0.799	80%	0.795	S	S	*	*			trans	68.1	129.1	153	-70.5	-169.4	1.5	0	0	119.2
1676	I	39.4	Very low	39.3	Very low	146 Å²	146	137.4 Å²	137.4	75%	0.749	80%	0.8	S	S	*	*				83.9	146.7	70.9	-97.4	169.2	0	0	0	113.2
1677	P	39.7	Very low	39.8	Very low	104 Å²	104	137.3 Å²	137.3	68%	0.675	81%	0.811	S	S	*	*			cis	-134.3	-164.4	-24.1	42	-23.3	0	0	0	112.9
1678	P	50.5	Low	40.5	Very low	121 Å²	121	135.1 Å²	135.1	79%	0.786	81%	0.814	S	S	*	*			trans	-94.8	166.4	160.7	36.4	-35.5	0	0	0	114.5
1679	Q	36.7	Very low	39.7	Very low	198 Å²	198	138.4 Å²	138.4	93%	0.925	83%	0.831	S	S	*	*			trans	-139.4	112.9	160.7	-90.9	-166.7	-17.4	0	0	110.4
1680	A	41.6	Very low	39	Very low	183 Å²	183	139.5 Å²	139.5	100%	1.512	83%	0.831	S	S	*	*			trans	-175.1	0	156.1	0	0	0	0	0	108.1

Retrieved 1,680 of 1,680 residues in 610.1 ms (Link to these results)

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