A0A077Z0R3_TRITR Loading...

Signal induced proliferation associated 1

AlphaFold DB , UniProt , Accession A0A077Z0R3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,356 aa.

						>A0A077Z0R3_TRITR|A0A077Z0R3
MAASPPTLPPPSPPPPPPLFRSSGDSLLLPGSDCRSFQEQQSKRLLRKELKKGALRKPSHESILRKLILASGKAFSEDSSLRIMNSVASMVSRMENSETSSGSMEEQRGRKQYFAHYDCHSICADYGPLLSQVIWKSSSGAGLPYGPGSGPIGPLGPFGSAPSRVCLPQRNTTNPCGGSLDVLSVSSPVESDDHGVTSSSGSSAMLDEGDGKYNGLILSCPFFRNEIGGEPTRHVSLGTERYLQRWIVQDVSSVPSGDPSASAASRSAKAKDSTETWHRIPSAAEACVLENLGNVYLGGRLCAYRQPQLVIEHVDHGAFYYRHCFLGKAHQNYFGIDENLGPVAVSIARDKLDAYQAKQAGLVSPYLYRMIVRLSDLSTFRGSILEESLPSYQMAREQMQAAGQPLSPTGAVATTGQTSSLKIPVKELLELVVSDLLSGCLRLAVPLPRTEEMLLKRADVLSHRNKKLLQIYTRYKVGVLLCKAGQCSEEQMYNNEHSSAPFEEFLDILGQRIRLKGFDKYRGGLDNKGDSTGTHSVYTSYQQYEIMFHVSTMLPFTPSNRQQLARKRHIGNDIVTIIFQEPGALPFCPQTMRSHFQHVFIVVQAVNPNTDKVKYSVSVSRYKDVPAFGPPIPENYGFPRSQEFREFLLTKGIAKKAVVISCFTNSHCLINAENAVHVSAKFAAMAARTRREFMRELAENHCISHSIESSSAKITCKIANMLPCAKILGNKRKDRPRAKVFLEAFNRGAIVWDVQVLTELENFSLCCTVDCFLAVSADYLVMIERSTETTLFCTATHSVIGWTLQGNSLKLYYDHADVIILRTVDDDDGLIIADIITRLKFVTKGCELIKRATIQTQEMMLRQSGCESLDFRIQYEGIVSDVDMYGHSWQAGLRQGSRIVEICKVSVASLTYPKMIEFLKSPNSRVLVIAPLEDGSPRRGCEDPHCPAVRGEVTPIVPSDWVSQPGSLPLHLPGRSPPSYDSLVTRPRIGTDLEGVPSSCKGALKVHGSGNDLCPSNCSSKSLDELRSRRAHCYSDTAAGLDSGFDSTRNSADYQSTTASSLSSEDRWYQSLMLQSTARAKNLSSSSSGGSSDLSSEAAVHQGKVDTTLLHPQVGVGNLVIGSRNLPLNISAIGSDKGAPAMVSSGGVGSTAKLNAFRAPPMPTKNYKHRSSDTSMVTLKEPVSSQQDMLNISDSDASKETISLADTNSARPLSPCSGAKYWSSRFADVPSTSTDLTKCSSLVDLATRAIEGVTQMAVSQQGSPELTSYNLVLQASRRKIVLLEERVKHLLTELSGERESKRHLEAEVSRLNDENKALSNELKAAKEELQHFTQWFHSTVENPMAYLQEPVLNDHQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.3	Very low	40.5	Very low	247 Å²	247	133.3 Å²	133.3	100%	1.217	84%	0.843	S	S	*	*				0	165.9	0	-78.9	171.7	159	0	0	108.5
2	A	34.8	Very low	40.4	Very low	102 Å²	102	131.3 Å²	131.3	84%	0.843	84%	0.837	S	S	*	*			trans	-36.9	157.5	-171	0	0	0	0	0	118.8
3	A	35.2	Very low	40.4	Very low	95 Å²	95	129.7 Å²	129.7	79%	0.785	83%	0.828	S	S	*	*			cis	-171.7	146.2	-20.4	0	0	0	0	0	110.7
4	S	34.1	Very low	40.7	Very low	116 Å²	116	129.1 Å²	129.1	81%	0.811	83%	0.825	S	S	*	*			trans	-100.9	173.9	158.3	-39.1	0	0	0	0	108.2
5	P	47.6	Very low	41.3	Very low	118 Å²	118	128.4 Å²	128.4	77%	0.766	82%	0.821	S	S	*	*			cis	-144	-146.5	34.3	45.6	-22.6	0	0	0	111.4
6	P	52	Low	41.1	Very low	119 Å²	119	127.6 Å²	127.6	77%	0.773	82%	0.817	S	S	*	*			cis	-130.5	-179.1	-13	37.9	-18	0	0	0	116.5
7	T	37.3	Very low	41.2	Very low	133 Å²	133	127.4 Å²	127.4	82%	0.816	82%	0.816	S	S	*	*			trans	-81.8	153.4	-175.4	49.2	0	0	0	0	116.3
8	L	41.4	Very low	41.4	Very low	171 Å²	171	126.9 Å²	126.9	90%	0.895	81%	0.814	S	S	*	*			trans	-136	142.3	153.3	-86.2	170.4	0	0	0	110.3
9	P	47.9	Very low	40.9	Very low	116 Å²	116	129.2 Å²	129.2	75%	0.753	82%	0.818	S	S	*	*			trans	-90.1	166.2	-177.5	35.7	-35.4	0	0	0	114.4
10	P	42	Very low	40.7	Very low	118 Å²	118	133.4 Å²	133.4	77%	0.766	82%	0.824	S	S	*	*			trans	-107.8	167.4	-161.2	40.8	-36.2	0	0	0	116.2
11	P	42.5	Very low	40.1	Very low	131 Å²	131	138.7 Å²	138.7	85%	0.851	83%	0.828	S	S	*	*			trans	-100.5	145	162.7	36.8	-30	0	0	0	113.2
12	S	40.1	Very low	40.3	Very low	110 Å²	110	132.6 Å²	132.6	77%	0.769	81%	0.81	S	S	*	*			trans	-157.3	178.7	173.1	67	0	0	0	0	110.5
13	P	40.2	Very low	40.2	Very low	110 Å²	110	133.7 Å²	133.7	71%	0.714	81%	0.811	S	S	*	*				-124.9	172.8	-84.5	38.3	-23.5	0	0	0	113.9
14	P	44.4	Very low	39.9	Very low	122 Å²	122	132.3 Å²	132.3	79%	0.792	81%	0.806	S	S	*	*			trans	-77	158.4	170.1	31.8	-34.2	0	0	0	113.3
15	P	49.6	Very low	39.8	Very low	118 Å²	118	134.3 Å²	134.3	77%	0.766	81%	0.808	S	S	*	*			trans	-104.8	166.6	-156.2	39.8	-37.2	0	0	0	116.6
16	P	38.2	Very low	38.9	Very low	115 Å²	115	132.9 Å²	132.9	75%	0.747	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-82.4	161.4	172.7	34.9	-36.5	0	0	0	113.8
17	P	43.1	Very low	37.8	Very low	125 Å²	125	134.8 Å²	134.8	81%	0.812	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-79	144.1	177.2	32.3	-34.9	0	0	0	112.9
18	P	44.7	Very low	37.6	Very low	118 Å²	118	135.7 Å²	135.7	77%	0.766	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-94.4	160.8	-173.8	36.8	-36.4	0	0	0	114.6
19	L	31.2	Very low	37.1	Very low	170 Å²	170	135.1 Å²	135.1	89%	0.89	80%	0.8	S	S	*	*			trans	-123.6	130.9	159.6	-78.5	173.9	0	0	0	109.8
20	F	36.9	Very low	36.6	Very low	214 Å²	214	135.9 Å²	135.9	94%	0.939	81%	0.805	S	S	*	*			trans	-139.6	146.1	164.6	-108.9	-85.1	0	0	0	109.9
21	R	28.8	Very low	36	Very low	245 Å²	245	133.2 Å²	133.2	93%	0.925	80%	0.799	S	S	*	*			trans	-102.9	135.1	173.2	-76.5	176.7	166.7	-180	-3.8	110
22	S	34.3	Very low	35.4	Very low	119 Å²	119	132.3 Å²	132.3	83%	0.832	80%	0.795	S	S	*	*			trans	-159.5	129.5	140.7	53.8	0	0	0	0	111.7
23	S	32.8	Very low	34.7	Very low	124 Å²	124	134.1 Å²	134.1	87%	0.867	80%	0.797	S	S	*	*			trans	-55.5	158.7	172.6	47.3	0	0	0	0	116.1
24	G	28.9	Very low	34.2	Very low	66 Å²	66	134.7 Å²	134.7	68%	0.68	80%	0.802	S	S	*	*			trans	157.3	91.3	148.8	0	0	0	0	0	116.8
25	D	30.9	Very low	33.5	Very low	158 Å²	158	140.9 Å²	140.9	85%	0.845	81%	0.809	S	S	*	*			trans	58.2	168.2	152.4	-72.6	-55.8	0	0	0	120.8
26	S	28.9	Very low	32.4	Very low	89 Å²	89	140 Å²	140	62%	0.622	81%	0.806	S	S	*	*			cis	-172.4	164.4	-44	-95.5	0	0	0	0	108
27	L	30.1	Very low	32	Very low	159 Å²	159	143.1 Å²	143.1	83%	0.832	81%	0.808	S	S	*	*			trans	70.7	140.9	173.8	-53.2	177.5	0	0	0	114.6
28	L	32.7	Very low	31.3	Very low	152 Å²	152	144 Å²	144	80%	0.796	80%	0.801	S	S	*	*			cis	-148.8	157.8	2.5	-104.7	145.1	0	0	0	110.3
29	L	31.3	Very low	30.4	Very low	158 Å²	158	145.2 Å²	145.2	83%	0.827	80%	0.797	S	S	*	*			trans	-111.2	147.7	164	-75.9	170.1	0	0	0	109.5
30	P	37.4	Very low	30.1	Very low	132 Å²	132	144.5 Å²	144.5	86%	0.857	79%	0.789	S	S	*	*				-144.4	-179.9	98.3	36.9	-20.4	0	0	0	112.7
31	G	29.1	Very low	29.7	Very low	62 Å²	62	143.3 Å²	143.3	64%	0.639	79%	0.786	S	S	*	*			cis	151	126.5	-8.1	0	0	0	0	0	113.2
32	S	29.5	Very low	29.7	Very low	112 Å²	112	137.3 Å²	137.3	78%	0.783	78%	0.782	S	S	*	*			trans	63.7	127.3	164.5	43.9	0	0	0	0	122
33	D	26.3	Very low	29.2	Very low	149 Å²	149	140.9 Å²	140.9	80%	0.797	78%	0.783	S	S	*	*			trans	57.2	115.2	137	-52.8	-23.3	0	0	0	123.4
34	C	29.3	Very low	29.1	Very low	122 Å²	122	143.9 Å²	143.9	82%	0.824	78%	0.775	S	S	*	*				170.6	116.8	105.5	-92.3	0	0	0	0	113.7
35	R	29.7	Very low	29.2	Very low	251 Å²	251	148.7 Å²	148.7	95%	0.947	78%	0.784	S	S	*	*				173.8	126.7	121.6	-97.4	173.8	-173.2	-153	0.5	113.2
36	S	27	Very low	29.2	Very low	99 Å²	99	148.2 Å²	148.2	69%	0.692	78%	0.78	S	S	*	*			trans	-76.1	142.7	157.8	46.7	0	0	0	0	110.8
37	F	29.6	Very low	29.1	Very low	181 Å²	181	153.2 Å²	153.2	79%	0.794	79%	0.786	S	S	*	*				-170	157.7	111.2	-120.5	-103.1	0	0	0	112.3
38	Q	28.8	Very low	29.2	Very low	144 Å²	144	154.3 Å²	154.3	67%	0.673	78%	0.784	S	S	*	*			trans	-20.7	143.6	-179.8	-67.8	178.1	-60.1	0	0	119.9
39	E	25.5	Very low	29.2	Very low	143 Å²	143	154.5 Å²	154.5	67%	0.668	78%	0.781	S	S	*	*			cis	90.6	125.6	38.1	-171.7	-175.5	-159.4	0	0	114.9
40	Q	25	Very low	29.1	Very low	156 Å²	156	153.2 Å²	153.2	73%	0.729	77%	0.774	S	S	*	*			trans	41.5	94.5	159.8	-63.9	-178	62.2	0	0	120.8
41	Q	27.1	Very low	28.7	Very low	189 Å²	189	156 Å²	156	88%	0.883	77%	0.773	S	S	*	*				-168.2	143.9	116.4	-103	160.4	80.8	0	0	108.8
42	S	29.7	Very low	28.8	Very low	119 Å²	119	163 Å²	163	83%	0.832	79%	0.785	S	S	*	*				-142	117.4	53.6	48.5	0	0	0	0	115.2
43	K	24.5	Very low	28.7	Very low	194 Å²	194	161 Å²	161	84%	0.843	78%	0.783	S	S	*	*			trans	-121.9	140.6	147.8	-92.5	-177.9	176	173.1	0	107.5
44	R	30.7	Very low	28.8	Very low	187 Å²	187	158.5 Å²	158.5	71%	0.706	78%	0.783	S	S	*	*			trans	81	94	175.8	-57.9	177.9	167.9	144.8	0.1	118
45	L	31	Very low	28.8	Very low	167 Å²	167	158.2 Å²	158.2	87%	0.874	77%	0.773	S	S	*	*	S	Bend		-88.6	144.8	105.5	-66.6	167.4	0	0	0	106.9
46	L	30.7	Very low	28.7	Very low	147 Å²	147	156.1 Å²	156.1	77%	0.77	77%	0.765	S	S	*	*			cis	-143.9	161.3	-0.5	-151.4	141.8	0	0	0	108.4
47	R	27	Very low	28.7	Very low	194 Å²	194	160.8 Å²	160.8	73%	0.732	77%	0.772	S	S	*	*			trans	-142.3	110.2	-177.3	-141.1	-175.2	-172.5	-172.5	-0.2	112.2
48	K	31.9	Very low	28.9	Very low	182 Å²	182	157.7 Å²	157.7	79%	0.791	77%	0.771	S	S	*	*			trans	-175	143.2	163.9	-97.1	173.2	-178.1	-175	0	104.7
49	E	31.3	Very low	28.9	Very low	156 Å²	156	155.8 Å²	155.8	73%	0.729	77%	0.773	S	S	*	*			cis	-123.2	-175.1	19	-94.9	-57.4	133.9	0	0	113.8
50	L	30.6	Very low	29.1	Very low	131 Å²	131	156.9 Å²	156.9	69%	0.686	78%	0.778	S	S	*	*			trans	-119	146	179.7	-90.4	95.8	0	0	0	114.6
51	K	28.5	Very low	29.2	Very low	191 Å²	191	156.8 Å²	156.8	83%	0.83	78%	0.778	S	S	*	*			trans	64.3	142.9	156.8	-64.8	167.6	176.7	178.2	0	115.4
52	K	30.9	Very low	29.6	Very low	208 Å²	208	151.7 Å²	151.7	90%	0.904	76%	0.762	S	S	*	*			cis	-141.7	170.6	12.6	-55.9	170.7	-179.8	175.4	0	109.6
53	G	28.6	Very low	29.9	Very low	72 Å²	72	153.1 Å²	153.1	74%	0.742	76%	0.759	S	S	*	*			trans	122	90.4	145.9	0	0	0	0	0	119.3
54	A	28.5	Very low	30.2	Very low	96 Å²	96	150.4 Å²	150.4	79%	0.793	75%	0.753	S	S	*	*			trans	40.8	124.9	139.5	0	0	0	0	0	123.9
55	L	27.5	Very low	30.3	Very low	115 Å²	115	150.9 Å²	150.9	60%	0.602	76%	0.755	S	S	*	*			trans	80.8	136.1	135.6	-121.3	72.8	0	0	0	123.3
56	R	28.7	Very low	30.6	Very low	208 Å²	208	152.2 Å²	152.2	79%	0.785	75%	0.754	S	S	*	*			trans	85.3	136.9	158.4	-63	-170.4	175.5	175.7	2.3	121.6
57	K	26.3	Very low	30.7	Very low	196 Å²	196	152.8 Å²	152.8	85%	0.852	76%	0.757	S	S	*	*			trans	-74.1	174.5	162.6	-66.1	-177.4	177.5	-177.7	0	109.9
58	P	34.9	Very low	30.9	Very low	117 Å²	117	150.6 Å²	150.6	76%	0.76	76%	0.758	S	S	*	*			cis	-142.9	-172.5	18.4	44.8	-24.7	0	0	0	118.1
59	S	27.4	Very low	30.7	Very low	103 Å²	103	149.9 Å²	149.9	72%	0.72	76%	0.762	S	S	*	*			trans	-28.7	150.1	167	53.2	0	0	0	0	120
60	H	29.7	Very low	30.8	Very low	167 Å²	167	146.6 Å²	146.6	77%	0.773	76%	0.762	S	S	*	*				-151.2	147.5	118.3	-137.7	-77.2	0	0	0	114.6
61	E	27.3	Very low	30.9	Very low	154 Å²	154	146.7 Å²	146.7	72%	0.72	77%	0.773	S	S	*	*			trans	-82	140	167.5	176.2	-170.6	-148.9	0	0	110.7
62	S	35.3	Very low	31	Very low	81 Å²	81	141.3 Å²	141.3	57%	0.566	77%	0.772	S	S	*	*			trans	-164.1	75.8	173.6	-179.9	0	0	0	0	114.8
63	I	35.9	Very low	31.1	Very low	150 Å²	150	141.4 Å²	141.4	77%	0.769	77%	0.772	S	S	*	*	S	Bend	trans	-109.8	-40.9	157.1	-69.1	-180	0	0	0	111.3	R65 K66	I63-R65 PolarHBondContact O-N 3.28Å; I63-R65 VanDerWaalsContact O-N 3.09Å; I63-K66 PolarHBondContact O-N 3.25Å
64	L	31.7	Very low	31	Very low	136 Å²	136	142.1 Å²	142.1	71%	0.712	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-57.6	-26.1	178.7	-94.3	80.9	0	0	0	114.7	K66 L67	L64-K66 PolarHBondContact O-N 3.25Å; L64-K66 VanDerWaalsContact O-N 3.1Å; L64-L67 PolarHBondContact O-N 3.33Å
65	R	33.8	Very low	31.2	Very low	198 Å²	198	147.7 Å²	147.7	75%	0.747	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-69.1	-3.4	-177.3	-76.6	-168.2	173.9	-148.3	-1.1	115.5	I63	I63-R65 PolarHBondContact O-N 3.28Å; I63-R65 VanDerWaalsContact O-N 3.09Å
66	K	36.6	Very low	31.5	Very low	194 Å²	194	146.5 Å²	146.5	84%	0.843	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-96.8	-4.4	177.3	-78.6	-168.6	173.3	-174.8	0	115.7	I63 L64	I63-K66 PolarHBondContact O-N 3.25Å; L64-K66 PolarHBondContact O-N 3.25Å; L64-K66 VanDerWaalsContact O-N 3.1Å
67	L	31.8	Very low	31.5	Very low	160 Å²	160	144.9 Å²	144.9	84%	0.838	78%	0.78	S	S	*	*	S	Bend	trans	-107.6	2.4	-174.6	-89.7	162.6	0	0	0	115.5	L64	L64-L67 PolarHBondContact O-N 3.33Å
68	I	32.3	Very low	31.9	Very low	147 Å²	147	140.3 Å²	140.3	75%	0.754	77%	0.766	S	S	*	*	S	Bend	trans	-118.9	32.4	-176	-41.6	-176.9	0	0	0	111.1
69	L	28.4	Very low	31.8	Very low	167 Å²	167	138.2 Å²	138.2	87%	0.874	75%	0.754	S	S	*	*			trans	-135.8	54.4	176.6	-78	176.3	0	0	0	112.1
70	A	33	Very low	31.9	Very low	87 Å²	87	136.5 Å²	136.5	72%	0.719	74%	0.741	S	S	*	*	S	Bend	trans	-144.3	132	161.8	0	0	0	0	0	109
71	S	32.4	Very low	32.2	Very low	134 Å²	134	133.4 Å²	133.4	94%	0.937	73%	0.73	S	S	*	*	S	Bend	trans	55.2	105.5	174.5	-59.2	0	0	0	0	117
72	G	29.8	Very low	32.6	Very low	77 Å²	77	134.4 Å²	134.4	79%	0.794	73%	0.727	S	S	*	*			trans	-152.2	167.3	170.4	0	0	0	0	0	113.5
73	K	32.7	Very low	32.8	Very low	211 Å²	211	135.7 Å²	135.7	92%	0.917	73%	0.727	S	S	*	*			trans	-159.5	118.9	160.3	-115	171.6	-176.1	178.8	0	112.2
74	A	28.3	Very low	32.7	Very low	87 Å²	87	134 Å²	134	72%	0.719	72%	0.717	S	S	*	*			trans	39.2	108.4	154.5	0	0	0	0	0	120.8
75	F	30.6	Very low	33.1	Very low	212 Å²	212	133 Å²	133	93%	0.93	71%	0.712	S	S	*	*				-147.7	168.4	120.9	-99.5	-70.9	0	0	0	109.1
76	S	34.7	Very low	33.3	Very low	91 Å²	91	126.4 Å²	126.4	64%	0.636	70%	0.697	S	S	*	*			trans	-80.7	155.4	-153.5	50.6	0	0	0	0	117.5	D78	S76-D78 PolarHBondContact O-N 3.27Å
77	E	28.2	Very low	33.3	Very low	173 Å²	173	120.8 Å²	120.8	81%	0.808	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-71.1	-24.2	-161.9	-61.2	176.8	110.2	0	0	116.1	S79 S80	E77-S79 PolarHBondContact O-N 2.74Å; E77-S80 PolarHBondContact O-N 2.97Å
78	D	35.1	Very low	33.5	Very low	101 Å²	101	115.5 Å²	115.5	54%	0.54	66%	0.658	S	S	.	*	G	3₁₀ helix	trans	-71.4	-12.6	-169.7	-162.7	50.6	0	0	0	114.6	S76 R82	S76-D78 PolarHBondContact O-N 3.27Å; D78-R82 IonicContact OD2-CZ 2.68Å; D78-R82 IonicContact OD2-NE 3.13Å; D78-R82 IonicContact OD2-NH2 2.8Å; D78-R82 PolarHBondContact OD2-NH2 2.83Å
79	S	32.3	Very low	33.7	Very low	73 Å²	73	111.4 Å²	111.4	51%	0.51	64%	0.642	S	S	.	*	G	3₁₀ helix	trans	-80	-35.8	173.9	-64.8	0	0	0	0	112.6	E77 L81 R82 I83	E77-S79 PolarHBondContact O-N 2.74Å; S79-L81 VanDerWaalsContact C-N 3.34Å; S79-L81 PolarHBondContact O-N 2.66Å; S79-R82 PolarHBondContact O-N 2.8Å; S79-I83 PolarHBondContact O-N 3.39Å
80	S	30.7	Very low	34	Very low	66 Å²	66	108.8 Å²	108.8	46%	0.462	63%	0.627	S	S	.	*	H	α-helix	trans	-65.1	-35.6	-172.4	-60.3	0	0	0	0	112.7	E77 I83 M84	E77-S80 PolarHBondContact O-N 2.97Å; S80-I83 PolarHBondContact O-N 2.96Å; S80-M84 WeakPolarHBondContact O-CB 3.28Å; S80-M84 WeakPolarHBondContact O-CG 3.31Å; S80-M84 PolarHBondContact O-N 3.15Å
81	L	34.6	Very low	34.2	Very low	103 Å²	103	107.7 Å²	107.7	54%	0.539	61%	0.611	S	S	.	*	H	α-helix	trans	-67	-34.2	176.8	-85.1	159.9	0	0	0	112.9	S79 M84 N85	S79-L81 VanDerWaalsContact C-N 3.34Å; S79-L81 PolarHBondContact O-N 2.66Å; L81-M84 HydrophobicContact CD2-CE 4.41Å; L81-N85 WeakPolarHBondContact O-CB 3.47Å; L81-N85 PolarHBondContact O-N 2.83Å; L81-N85 PolarHBondContact O-ND2 3.07Å
82	R	36.4	Very low	34.2	Very low	175 Å²	175	104.6 Å²	104.6	66%	0.66	59%	0.59	S	S	*	*	H	α-helix	trans	-72.7	-40.7	177.6	-55.7	-175.8	-159.9	-153.1	4	111.2	D78 S79 N85 S86	D78-R82 IonicContact OD2-CZ 2.68Å; D78-R82 IonicContact OD2-NE 3.13Å; D78-R82 IonicContact OD2-NH2 2.8Å; D78-R82 PolarHBondContact OD2-NH2 2.83Å; S79-R82 PolarHBondContact O-N 2.8Å; R82-N85 PolarHBondContact O-N 2.76Å; R82-S86 WeakPolarHBondContact O-CB 3.3Å; R82-S86 PolarHBondContact O-N 3.45Å
83	I	39.1	Very low	34.4	Very low	107 Å²	107	110.1 Å²	110.1	55%	0.549	59%	0.587	S	S	.	*	H	α-helix	trans	-65.7	-46.5	176.1	-63.4	171.1	0	0	0	110.4	S79 S80 N85 S86 V87	S79-I83 PolarHBondContact O-N 3.39Å; S80-I83 PolarHBondContact O-N 2.96Å; I83-N85 PolarHBondContact O-N 3.38Å; I83-S86 WeakPolarHBondContact O-CB 3.49Å; I83-S86 PolarHBondContact O-N 3.02Å; I83-S86 VanDerWaalsContact O-N 3.14Å; I83-V87 HydrophobicContact CG2-CG2 4.34Å; I83-V87 WeakPolarHBondContact O-CG2 3.48Å; I83-V87 PolarHBondContact O-N 2.84Å
84	M	34.7	Very low	34.4	Very low	114 Å²	114	106.7 Å²	106.7	56%	0.562	58%	0.575	S	S	*	*	H	α-helix	trans	-61.2	-40.7	176.4	-75.6	-171.5	-68.9	0	0	112.9	S80 L81 S86 V87 A88	S80-M84 WeakPolarHBondContact O-CB 3.28Å; S80-M84 WeakPolarHBondContact O-CG 3.31Å; S80-M84 PolarHBondContact O-N 3.15Å; L81-M84 HydrophobicContact CD2-CE 4.41Å; M84-S86 VanDerWaalsContact C-N 3.33Å; M84-S86 PolarHBondContact O-N 3.44Å; M84-V87 PolarHBondContact O-N 3.13Å; M84-A88 VanDerWaalsContact O-CB 3.25Å; M84-A88 WeakPolarHBondContact O-CB 3.04Å; M84-A88 PolarHBondContact O-N 2.61Å
85	N	38.9	Very low	34.6	Very low	115 Å²	115	109.9 Å²	109.9	62%	0.615	58%	0.576	S	S	*	*	H	α-helix	trans	-66.8	-32.9	174.8	-76.6	-28.8	0	0	0	112.8	L81 R82 I83 S89	L81-N85 WeakPolarHBondContact O-CB 3.47Å; L81-N85 PolarHBondContact O-N 2.83Å; L81-N85 PolarHBondContact O-ND2 3.07Å; R82-N85 PolarHBondContact O-N 2.76Å; I83-N85 PolarHBondContact O-N 3.38Å; N85-S89 WeakPolarHBondContact O-CB 3.46Å; N85-S89 PolarHBondContact O-N 3.19Å; N85-S89 VanDerWaalsContact O-N 3.13Å
86	S	38.2	Very low	34.6	Very low	61 Å²	61	105.2 Å²	105.2	43%	0.427	56%	0.56	S	S	.	*	H	α-helix	trans	-69.3	-45.9	174.3	-163.8	0	0	0	0	111.7	R82 I83 M84 S89 M90	R82-S86 WeakPolarHBondContact O-CB 3.3Å; R82-S86 PolarHBondContact O-N 3.45Å; I83-S86 WeakPolarHBondContact O-CB 3.49Å; I83-S86 PolarHBondContact O-N 3.02Å; I83-S86 VanDerWaalsContact O-N 3.14Å; M84-S86 VanDerWaalsContact C-N 3.33Å; M84-S86 PolarHBondContact O-N 3.44Å; S86-S89 WeakPolarHBondContact O-CB 3.47Å; S86-S89 PolarHBondContact O-N 3.14Å; S86-M90 WeakPolarHBondContact O-CG 3.48Å; S86-M90 PolarHBondContact O-N 2.82Å
87	V	37.3	Very low	34.4	Very low	76 Å²	76	104.7 Å²	104.7	46%	0.461	56%	0.556	S	S	.	*	H	α-helix	trans	-66.2	-41.8	177.4	174	0	0	0	0	111.5	I83 M84 S89 M90 V91	I83-V87 HydrophobicContact CG2-CG2 4.34Å; I83-V87 WeakPolarHBondContact O-CG2 3.48Å; I83-V87 PolarHBondContact O-N 2.84Å; M84-V87 PolarHBondContact O-N 3.13Å; V87-S89 VanDerWaalsContact C-N 3.28Å; V87-S89 PolarHBondContact O-N 2.82Å; V87-M90 WeakPolarHBondContact O-CB 3.35Å; V87-M90 PolarHBondContact O-N 2.91Å; V87-V91 HydrophobicContact CG1-CG2 4.36Å; V87-V91 WeakPolarHBondContact O-CG2 3.44Å; V87-V91 PolarHBondContact O-N 2.93Å
88	A	36.6	Very low	34.4	Very low	49 Å²	49	105.4 Å²	105.4	41%	0.405	56%	0.56	S	S	.	*	H	α-helix	trans	-60.6	-37.6	173.9	0	0	0	0	0	112	M84 M90 V91 S92	M84-A88 VanDerWaalsContact O-CB 3.25Å; M84-A88 WeakPolarHBondContact O-CB 3.04Å; M84-A88 PolarHBondContact O-N 2.61Å; A88-M90 VanDerWaalsContact C-N 3.33Å; A88-M90 PolarHBondContact O-N 3.41Å; A88-V91 PolarHBondContact O-N 3.25Å; A88-S92 WeakPolarHBondContact O-CB 3.27Å; A88-S92 PolarHBondContact O-N 3.36Å; A88-S92 PolarHBondContact O-OG 2.88Å
89	S	35.9	Very low	34.1	Very low	61 Å²	61	106.2 Å²	106.2	43%	0.427	57%	0.568	S	S	.	*	H	α-helix	trans	-65.9	-32.3	173.2	-171.4	0	0	0	0	112.9	N85 S86 V87 R93	N85-S89 WeakPolarHBondContact O-CB 3.46Å; N85-S89 PolarHBondContact O-N 3.19Å; N85-S89 VanDerWaalsContact O-N 3.13Å; S86-S89 WeakPolarHBondContact O-CB 3.47Å; S86-S89 PolarHBondContact O-N 3.14Å; V87-S89 VanDerWaalsContact C-N 3.28Å; V87-S89 PolarHBondContact O-N 2.82Å; S89-R93 WeakPolarHBondContact O-CD 3.31Å; S89-R93 VanDerWaalsContact O-CG 3.25Å; S89-R93 WeakPolarHBondContact O-CG 3.31Å; S89-R93 PolarHBondContact O-N 3.1Å
90	M	34.8	Very low	34.1	Very low	111 Å²	111	106.8 Å²	106.8	55%	0.547	57%	0.573	S	S	.	*	H	α-helix	trans	-73.1	-45.1	172.6	-64.9	178.6	-165.4	0	0	112.1	S86 V87 A88 R93 M94	S86-M90 WeakPolarHBondContact O-CG 3.48Å; S86-M90 PolarHBondContact O-N 2.82Å; V87-M90 WeakPolarHBondContact O-CB 3.35Å; V87-M90 PolarHBondContact O-N 2.91Å; A88-M90 VanDerWaalsContact C-N 3.33Å; A88-M90 PolarHBondContact O-N 3.41Å; M90-R93 WeakPolarHBondContact O-CA 3.25Å; M90-R93 WeakPolarHBondContact O-CB 3.49Å; M90-R93 PolarHBondContact O-N 3.12Å; M90-M94 PolarHBondContact O-N 3.29Å; M90-M94 VanDerWaalsContact O-N 3.08Å
91	V	36.4	Very low	34	Very low	64 Å²	64	107.9 Å²	107.9	39%	0.388	58%	0.58	S	S	.	*	H	α-helix	trans	-63.9	-44.4	178.8	175.6	0	0	0	0	111	V87 A88 R93 M94 E95	V87-V91 HydrophobicContact CG1-CG2 4.36Å; V87-V91 WeakPolarHBondContact O-CG2 3.44Å; V87-V91 PolarHBondContact O-N 2.93Å; A88-V91 PolarHBondContact O-N 3.25Å; V91-R93 PolarHBondContact O-N 2.87Å; V91-R93 VanDerWaalsContact O-N 3.13Å; V91-M94 PolarHBondContact O-N 3.28Å; V91-E95 HydrophobicContact CG1-CG 4.44Å; V91-E95 PolarHBondContact O-N 3.48Å
92	S	33.5	Very low	33.8	Very low	70 Å²	70	105.2 Å²	105.2	49%	0.49	58%	0.577	S	S	.	*	H	α-helix	trans	-65	-13.5	172.9	-63.9	0	0	0	0	114.4	A88 N96	A88-S92 WeakPolarHBondContact O-CB 3.27Å; A88-S92 PolarHBondContact O-N 3.36Å; A88-S92 PolarHBondContact O-OG 2.88Å; S92-N96 PolarHBondContact O-ND2 3.29Å
93	R	32.5	Very low	33.9	Very low	193 Å²	193	100.5 Å²	100.5	73%	0.728	57%	0.571	S	S	*	*	H	α-helix	trans	-87.1	-27.8	168.7	-76.3	170.9	176.4	-161	-2.1	112.8	S89 M90 V91	S89-R93 WeakPolarHBondContact O-CD 3.31Å; S89-R93 VanDerWaalsContact O-CG 3.25Å; S89-R93 WeakPolarHBondContact O-CG 3.31Å; S89-R93 PolarHBondContact O-N 3.1Å; M90-R93 WeakPolarHBondContact O-CA 3.25Å; M90-R93 WeakPolarHBondContact O-CB 3.49Å; M90-R93 PolarHBondContact O-N 3.12Å; V91-R93 PolarHBondContact O-N 2.87Å; V91-R93 VanDerWaalsContact O-N 3.13Å
94	M	33.8	Very low	33.7	Very low	138 Å²	138	99.9 Å²	99.9	68%	0.68	57%	0.567	S	S	*	*	H	α-helix	trans	-76.4	-43.5	174.7	-66.6	177.1	69.2	0	0	111.3	M90 V91 N96 S97	M90-M94 PolarHBondContact O-N 3.29Å; M90-M94 VanDerWaalsContact O-N 3.08Å; V91-M94 PolarHBondContact O-N 3.28Å; M94-N96 PolarHBondContact O-N 3.34Å; M94-S97 WeakPolarHBondContact O-CB 3.4Å; M94-S97 PolarHBondContact O-N 2.87Å; M94-S97 VanDerWaalsContact O-N 3.17Å; M94-S97 PolarHBondContact O-OG 2.93Å
95	E	32	Very low	33.8	Very low	155 Å²	155	99.4 Å²	99.4	72%	0.724	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.5	-5.4	-179.5	-64.5	-174	136.1	0	0	114.5	V91	V91-E95 HydrophobicContact CG1-CG 4.44Å; V91-E95 PolarHBondContact O-N 3.48Å
96	N	29.9	Very low	33.8	Very low	114 Å²	114	98 Å²	98	61%	0.61	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	13.7	171.1	-77	-78.8	0	0	0	113	S92 M94 E98 T99	S92-N96 PolarHBondContact O-ND2 3.29Å; M94-N96 PolarHBondContact O-N 3.34Å; N96-E98 VanDerWaalsContact C-N 3.26Å; N96-E98 PolarHBondContact O-N 3.27Å; N96-T99 PolarHBondContact O-OG1 2.64Å
97	S	30.8	Very low	34.1	Very low	79 Å²	79	100 Å²	100	55%	0.552	56%	0.556	S	S	*	*			trans	-73.1	-11.2	-178.8	64.7	0	0	0	0	114.7	M94 T99	M94-S97 WeakPolarHBondContact O-CB 3.4Å; M94-S97 PolarHBondContact O-N 2.87Å; M94-S97 VanDerWaalsContact O-N 3.17Å; M94-S97 PolarHBondContact O-OG 2.93Å; S97-T99 PolarHBondContact O-N 2.86Å
98	E	28	Very low	34.5	Very low	189 Å²	189	100 Å²	100	88%	0.883	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	32.7	173.7	-63.7	-165.9	146	0	0	114	N96	N96-E98 VanDerWaalsContact C-N 3.26Å; N96-E98 PolarHBondContact O-N 3.27Å
99	T	29.4	Very low	34.9	Very low	117 Å²	117	98.9 Å²	98.9	72%	0.718	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.2	46.2	168	42.5	0	0	0	0	112.9	N96 S97 S101	N96-T99 PolarHBondContact O-OG1 2.64Å; S97-T99 PolarHBondContact O-N 2.86Å; T99-S101 PolarHBondContact O-N 3.16Å
100	S	32.6	Very low	35.5	Very low	86 Å²	86	99.8 Å²	99.8	60%	0.601	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	0.6	-175	57.3	0	0	0	0	116.6	G102 S103	S100-G102 PolarHBondContact O-N 3.47Å; S100-G102 VanDerWaalsContact O-N 3.11Å; S100-S103 PolarHBondContact O-N 2.71Å; S100-S103 PolarHBondContact O-OG 2.88Å; S100-S103 VanDerWaalsContact O-OG 3.13Å
101	S	29.5	Very low	36.4	Very low	89 Å²	89	96.3 Å²	96.3	62%	0.622	52%	0.516	S	S	*	.	H	α-helix	trans	-55.8	-32.7	-176.3	52.8	0	0	0	0	114.5	T99 S103 M104 E105	T99-S101 PolarHBondContact O-N 3.16Å; S101-S103 PolarHBondContact O-N 3.26Å; S101-M104 PolarHBondContact O-N 3.3Å; S101-E105 PolarHBondContact O-N 3.39Å; S101-E105 VanDerWaalsContact O-N 3.12Å
102	G	29.8	Very low	37.5	Very low	46 Å²	46	95.5 Å²	95.5	47%	0.474	51%	0.508	S	S	.	.	H	α-helix	trans	-65.5	-27.9	-175.4	0	0	0	0	0	115.7	S100 E106	S100-G102 PolarHBondContact O-N 3.47Å; S100-G102 VanDerWaalsContact O-N 3.11Å; G102-E106 PolarHBondContact O-N 3.43Å
103	S	38.6	Very low	39.1	Very low	76 Å²	76	93.9 Å²	93.9	53%	0.531	49%	0.492	S	S	.	.	H	α-helix	trans	-77.6	-37.7	177	54.6	0	0	0	0	112	S100 S101 E106 Q107	S100-S103 PolarHBondContact O-N 2.71Å; S100-S103 PolarHBondContact O-OG 2.88Å; S100-S103 VanDerWaalsContact O-OG 3.13Å; S101-S103 PolarHBondContact O-N 3.26Å; S103-E106 PolarHBondContact O-N 2.81Å; S103-Q107 PolarHBondContact O-N 2.85Å
104	M	34.7	Very low	41.5	Very low	94 Å²	94	85 Å²	85	46%	0.463	46%	0.458	S	S	.	.	H	α-helix	trans	-70.9	-37	179.4	-140.9	172.6	85.8	0	0	111.5	S101 R108	S101-M104 PolarHBondContact O-N 3.3Å; M104-R108 WeakPolarHBondContact O-CB 3.14Å; M104-R108 PolarHBondContact O-N 2.83Å
105	E	36.6	Very low	44	Very low	104 Å²	104	78.6 Å²	78.6	49%	0.486	43%	0.427	S	S	.	.	H	α-helix	trans	-63.3	-43.7	168.9	-90.8	-153.2	96.2	0	0	112.9	S101 Q107 R108 G109 R737	S101-E105 PolarHBondContact O-N 3.39Å; S101-E105 VanDerWaalsContact O-N 3.12Å; E105-Q107 VanDerWaalsContact C-N 3.35Å; E105-Q107 PolarHBondContact O-N 3.29Å; E105-R108 PolarHBondContact O-N 3.48Å; E105-G109 PolarHBondContact O-N 2.8Å; E105-R737 IonicContact OE1-CZ 3.79Å; E105-R737 IonicContact OE1-NH2 2.69Å; E105-R737 PolarHBondContact OE1-NH2 3.24Å
106	E	38.5	Very low	46.7	Very low	87 Å²	87	71.3 Å²	71.3	41%	0.407	39%	0.393	S	S	.	.	H	α-helix	trans	-68.1	-34.9	-179.5	-162.5	176.4	172.6	0	0	111.9	G102 S103 G109 R110 R735	G102-E106 PolarHBondContact O-N 3.43Å; S103-E106 PolarHBondContact O-N 2.81Å; E106-G109 PolarHBondContact O-N 2.79Å; E106-R110 WeakPolarHBondContact O-CG 3.15Å; E106-R110 PolarHBondContact O-N 2.81Å; E106-R110 VanDerWaalsContact O-N 3.08Å; E106-R110 IonicContact OE1-CZ 3.83Å; E106-R110 IonicContact OE1-NE 2.69Å; E106-R110 IonicContact OE1-NH2 2.97Å; E106-R110 PolarHBondContact OE1-NH2 3.01Å; E106-R110 IonicContact OE2-NH2 2.81Å; E106-R735 IonicContact OE1-NH1 2.72Å
107	Q	44.5	Very low	49.2	Very low	101 Å²	101	65.9 Å²	65.9	47%	0.472	36%	0.364	S	S	.	.	H	α-helix	trans	-68.6	-43.2	171.2	-77	-175.7	-54.5	0	0	112.8	S103 E105 G109 R110 K111	S103-Q107 PolarHBondContact O-N 2.85Å; E105-Q107 VanDerWaalsContact C-N 3.35Å; E105-Q107 PolarHBondContact O-N 3.29Å; Q107-G109 VanDerWaalsContact C-N 3.29Å; Q107-G109 PolarHBondContact O-N 2.84Å; Q107-R110 PolarHBondContact O-N 2.81Å; Q107-K111 WeakPolarHBondContact O-CG 3.21Å; Q107-K111 PolarHBondContact O-N 3.11Å; Q107-K111 VanDerWaalsContact O-N 3.09Å
108	R	46.2	Very low	51.4	Low	78 Å²	78	62.1 Å²	62.1	29%	0.294	34%	0.338	S	S	.	.	H	α-helix	trans	-54.6	-47.2	171.1	-94.1	-174.6	178	165.1	2	110.9	M104 E105 R110 K111 Q112 V824 D825	M104-R108 WeakPolarHBondContact O-CB 3.14Å; M104-R108 PolarHBondContact O-N 2.83Å; E105-R108 PolarHBondContact O-N 3.48Å; R108-R110 PolarHBondContact O-N 3.38Å; R108-K111 PolarHBondContact O-N 2.89Å; R108-Q112 PolarHBondContact O-N 2.97Å; R108-V824 PolarHBondContact NH2-O 3.45Å; R108-D825 PolarHBondContact NH1-O 2.87Å
109	G	44.9	Very low	53.8	Low	24 Å²	24	53.4 Å²	53.4	25%	0.247	30%	0.298	C	S	.	.	H	α-helix	trans	-62.8	-35.2	-179.5	0	0	0	0	0	114	E105 E106 Q107 Y113	E105-G109 PolarHBondContact O-N 2.8Å; E106-G109 PolarHBondContact O-N 2.79Å; Q107-G109 VanDerWaalsContact C-N 3.29Å; Q107-G109 PolarHBondContact O-N 2.84Å; G109-Y113 WeakPolarHBondContact O-CD2 3.4Å; G109-Y113 WeakPolarHBondContact O-CE2 3.33Å
110	R	47.6	Very low	56	Low	80 Å²	80	52 Å²	52	30%	0.302	28%	0.283	S	S	.	.	H	α-helix	trans	-72.4	-40.1	175.2	-69.6	175.9	-161.6	174.9	4.4	112.4	E106 Q107 R108 Q112 Y113 S434	E106-R110 WeakPolarHBondContact O-CG 3.15Å; E106-R110 PolarHBondContact O-N 2.81Å; E106-R110 VanDerWaalsContact O-N 3.08Å; E106-R110 IonicContact OE1-CZ 3.83Å; E106-R110 IonicContact OE1-NE 2.69Å; E106-R110 IonicContact OE1-NH2 2.97Å; E106-R110 PolarHBondContact OE1-NH2 3.01Å; E106-R110 IonicContact OE2-NH2 2.81Å; Q107-R110 PolarHBondContact O-N 2.81Å; R108-R110 PolarHBondContact O-N 3.38Å; R110-Q112 PolarHBondContact O-N 3.31Å; R110-Y113 WeakPolarHBondContact O-CD2 3.43Å; R110-Y113 PolarHBondContact O-N 2.93Å; R110-S434 VanDerWaalsContact NH1-CB 3.33Å; R110-S434 PolarHBondContact NH1-OG 2.88Å
111	K	55.3	Low	58.2	Low	38 Å²	38	47.9 Å²	47.9	17%	0.165	25%	0.254	C	S	.	.	H	α-helix	trans	-66.4	-17.9	-176.2	-75.9	168.2	168.3	-74.3	0	114.5	Q107 R108 D125 Y126	Q107-K111 WeakPolarHBondContact O-CG 3.21Å; Q107-K111 PolarHBondContact O-N 3.11Å; Q107-K111 VanDerWaalsContact O-N 3.09Å; R108-K111 PolarHBondContact O-N 2.89Å; K111-D125 PolarHBondContact NZ-O 3.5Å; K111-D125 IonicContact NZ-OD1 2.72Å; K111-D125 PolarHBondContact NZ-OD1 2.96Å; K111-D125 IonicContact NZ-OD2 3.51Å; K111-D125 PolarHBondContact NZ-OD2 2.92Å; K111-Y126 HydrophobicContact CD-CE1 4Å; K111-Y126 HydrophobicContact CD-CE2 4.33Å; K111-Y126 VanDerWaalsContact NZ-CE2 3.33Å
112	Q	58.5	Low	60.6	Low	47 Å²	47	43.6 Å²	43.6	22%	0.22	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-38.1	176	-71.4	-175.6	-47.1	0	0	112.8	R108 R110 F114 E743 D834	R108-Q112 PolarHBondContact O-N 2.97Å; R110-Q112 PolarHBondContact O-N 3.31Å; Q112-F114 VanDerWaalsContact C-N 3.31Å; Q112-F114 PolarHBondContact O-N 3.2Å; Q112-E743 VanDerWaalsContact O-CG 3.31Å; Q112-E743 WeakPolarHBondContact O-CG 3.22Å; Q112-D834 PolarHBondContact NE2-OD2 3.14Å
113	Y	68	Low	62.8	Low	37 Å²	37	41.6 Å²	41.6	15%	0.145	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-16	-170.1	-57.1	-66.8	0	0	0	115.8	G109 R110 L431 A738 E743	G109-Y113 WeakPolarHBondContact O-CD2 3.4Å; G109-Y113 WeakPolarHBondContact O-CE2 3.33Å; R110-Y113 WeakPolarHBondContact O-CD2 3.43Å; R110-Y113 PolarHBondContact O-N 2.93Å; Y113-L431 HydrophobicContact CD2-CD2 3.6Å; Y113-L431 HydrophobicContact CE2-CD2 4.19Å; Y113-L431 HydrophobicContact CG-CD2 4.23Å; Y113-A738 HydrophobicContact CE1-CB 3.65Å; Y113-A738 VanDerWaalsContact OH-CB 3.28Å; Y113-A738 WeakPolarHBondContact OH-CB 3.43Å; Y113-E743 WeakPolarHBondContact CD1-OE1 3.46Å
114	F	81.7	Confident	64.4	Low	7 Å²	7	38.2 Å²	38.2	3%	0.031	18%	0.18	C	C	.	.			trans	-109.8	116.2	-174.6	-177.5	-105.2	0	0	0	111.5	Q112 H116 G382 I384 V432	Q112-F114 VanDerWaalsContact C-N 3.31Å; Q112-F114 PolarHBondContact O-N 3.2Å; F114-H116 AromaticContact CD1-CD2 3.84Å; F114-H116 AromaticContact CE1-CD2 3.74Å; F114-H116 PolarHBondContact O-CE1 3.17Å; F114-H116 PolarHBondContact O-ND1 3.34Å; F114-H116 PolarHBondContact O-NE2 3.17Å; F114-G382 VanDerWaalsContact CZ-CA 3.47Å; F114-I384 HydrophobicContact CB-CG1 4.43Å; F114-I384 HydrophobicContact CD2-CD1 4.22Å; F114-I384 HydrophobicContact CD2-CG1 3.85Å; F114-V432 HydrophobicContact CB-CG2 4.38Å; F114-V432 HydrophobicContact CD1-CG1 4.44Å; F114-V432 HydrophobicContact CD2-CB 4.43Å; F114-V432 HydrophobicContact CD2-CG1 4.09Å; F114-V432 HydrophobicContact CD2-CG2 3.42Å; F114-V432 VanDerWaalsContact CD2-CG2 3.42Å; F114-V432 HydrophobicContact CE1-CG1 4.24Å; F114-V432 HydrophobicContact CE2-CG1 3.86Å; F114-V432 HydrophobicContact CE2-CG2 3.77Å; F114-V432 HydrophobicContact CG-CG1 4.36Å; F114-V432 HydrophobicContact CG-CG2 4.01Å; F114-V432 HydrophobicContact CZ-CG1 3.92Å
115	A	87	Confident	66.1	Low	3 Å²	3	35 Å²	35	3%	0.025	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	116.2	175.3	0	0	0	0	0	110.2	G382 S383 N746 A749	A115-G382 CarbonylContact O-C 3.5Å; A115-G382 WeakPolarHBondContact O-CA 3.23Å; A115-S383 PolarHBondContact N-O 3.18Å; A115-S383 PolarHBondContact O-N 3.37Å; A115-N746 HydrophobicContact CB-CB 3.94Å; A115-N746 WeakPolarHBondContact CB-ND2 3.14Å; A115-A749 CarbonylContact C-O 3.49Å; A115-A749 WeakPolarHBondContact CA-O 3.34Å
116	H	87.8	Confident	67.4	Low	1 Å²	1	31.7 Å²	31.7	1%	0.005	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	139.3	-173.9	-58.6	76.3	0	0	0	111.4	F114 I122 D125 G748 A749 V751	F114-H116 AromaticContact CD1-CD2 3.84Å; F114-H116 AromaticContact CE1-CD2 3.74Å; F114-H116 PolarHBondContact O-CE1 3.17Å; F114-H116 PolarHBondContact O-ND1 3.34Å; F114-H116 PolarHBondContact O-NE2 3.17Å; H116-I122 HydrophobicContact CB-CD1 4.23Å; H116-I122 HydrophobicContact CB-CG1 3.57Å; H116-D125 IonicContact NE2-OD2 2.78Å; H116-D125 PolarHBondContact NE2-OD2 3.31Å; H116-G748 CarbonylContact O-C 3.22Å; H116-G748 WeakPolarHBondContact O-CA 3.44Å; H116-A749 PolarHBondContact CE1-O 3.01Å; H116-A749 PolarHBondContact N-O 3.27Å; H116-A749 PolarHBondContact ND1-O 3.29Å; H116-A749 PolarHBondContact O-N 3Å; H116-V751 WeakPolarHBondContact CE1-CG2 3.37Å
117	Y	82.8	Confident	68.4	Low	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	-80.9	-29.5	179.7	174.2	-98.4	0	0	0	113.2	V288 L289 E290 L292 Y320 R381	Y117-V288 HydrophobicContact CE1-CG1 4.03Å; Y117-V288 HydrophobicContact CE1-CG2 4.32Å; Y117-V288 HydrophobicContact CE2-CG1 4.05Å; Y117-V288 WeakPolarHBondContact OH-CG1 3.33Å; Y117-L289 WeakPolarHBondContact O-CB 3.26Å; Y117-L289 PolarHBondContact O-N 3.45Å; Y117-E290 HydrophobicContact CD2-CB 3.96Å; Y117-E290 HydrophobicContact CD2-CG 4.09Å; Y117-E290 HydrophobicContact CE2-CB 3.97Å; Y117-L292 HydrophobicContact CE2-CD1 3.85Å; Y117-L292 HydrophobicContact CE2-CG 4.18Å; Y117-L292 VanDerWaalsContact OH-CD1 3.27Å; Y117-L292 WeakPolarHBondContact OH-CD1 3.48Å; Y117-Y320 AromaticContact CD1-CD2 3.68Å; Y117-Y320 HydrophobicContact CD1-CD2 3.68Å; Y117-Y320 HydrophobicContact CD1-CE2 4.18Å; Y117-Y320 HydrophobicContact CD1-CG 4.17Å; Y117-Y320 AromaticContact CD2-CD2 3.43Å; Y117-Y320 HydrophobicContact CD2-CD2 3.43Å; Y117-Y320 VanDerWaalsContact CD2-CD2 3.43Å; Y117-Y320 AromaticContact CD2-CE2 3.28Å; Y117-Y320 HydrophobicContact CD2-CE2 3.28Å; Y117-Y320 AromaticContact CE1-CD2 3.72Å; Y117-Y320 HydrophobicContact CE1-CD2 3.72Å; Y117-Y320 HydrophobicContact CE1-CG 4.25Å; Y117-Y320 AromaticContact CE2-CD2 3.45Å; Y117-Y320 HydrophobicContact CE2-CD2 3.45Å; Y117-Y320 VanDerWaalsContact CE2-CD2 3.45Å; Y117-Y320 AromaticContact CE2-CE2 3.7Å; Y117-Y320 HydrophobicContact CE2-CE2 3.7Å; Y117-Y320 AromaticContact CG-CD2 3.53Å; Y117-Y320 HydrophobicContact CG-CD2 3.53Å; Y117-Y320 AromaticContact CG-CE2 3.55Å; Y117-Y320 HydrophobicContact CG-CE2 3.55Å; Y117-Y320 HydrophobicContact CG-CG 4.34Å; Y117-Y320 AromaticContact CZ-CD2 3.6Å; Y117-R381 WeakPolarHBondContact CB-O 3.24Å; Y117-R381 HydrophobicContact CD1-CB 4.37Å; Y117-R381 HydrophobicContact CG-CB 4.48Å; Y117-R381 PolarHBondContact N-O 3.46Å
118	D	77.9	Confident	68.6	Low	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.137	C	C	.	.	S	Bend	trans	-154.3	168.1	179.8	68.3	-8.1	0	0	0	114.4	H120 S121 I122 C287 H316 R381	D118-H120 VanDerWaalsContact C-N 3.31Å; D118-H120 PolarHBondContact O-N 3.46Å; D118-S121 WeakPolarHBondContact O-CB 3.39Å; D118-S121 PolarHBondContact O-N 3.29Å; D118-S121 VanDerWaalsContact O-N 3.09Å; D118-S121 VanDerWaalsContact OD1-CB 3.24Å; D118-S121 WeakPolarHBondContact OD1-CB 3.43Å; D118-S121 PolarHBondContact OD1-N 3.37Å; D118-S121 PolarHBondContact OD1-OG 2.89Å; D118-I122 PolarHBondContact O-N 2.87Å; D118-C287 WeakPolarHBondContact CB-O 3.44Å; D118-H316 WeakPolarHBondContact OD2-CB 3.37Å; D118-H316 IonicContact OD2-CD2 2.77Å; D118-H316 IonicContact OD2-CG 2.66Å; D118-H316 IonicContact OD2-ND1 3.64Å; D118-R381 VanDerWaalsContact CG-NH1 3.26Å; D118-R381 IonicContact OD1-CZ 3.22Å; D118-R381 IonicContact OD1-NH1 2.73Å; D118-R381 PolarHBondContact OD1-NH1 3.36Å; D118-R381 IonicContact OD1-NH2 2.71Å; D118-R381 PolarHBondContact OD1-NH2 3.28Å; D118-R381 IonicContact OD2-CZ 2.64Å; D118-R381 IonicContact OD2-NH1 3.18Å; D118-R381 PolarHBondContact OD2-NH1 2.94Å; D118-R381 IonicContact OD2-NH2 3.24Å; D118-R381 PolarHBondContact OD2-NH2 3.39Å
119	C	77.8	Confident	68.7	Low	6 Å²	6	28 Å²	28	4%	0.041	15%	0.147	C	C	.	.	H	α-helix	trans	-53.1	-43.2	175.7	-61	0	0	0	0	112.9	S121 I122 C123 A286 I783	C119-S121 VanDerWaalsContact C-N 3.27Å; C119-S121 PolarHBondContact O-N 2.9Å; C119-I122 WeakPolarHBondContact O-CB 3.42Å; C119-I122 PolarHBondContact O-N 3.17Å; C119-C123 PolarHBondContact O-N 3.34Å; C119-C123 PolarHBondContact O-SG 3.1Å; C119-C123 VanDerWaalsContact O-SG 3.37Å; C119-A286 PolarHBondContact SG-O 3.12Å; C119-A286 VanDerWaalsContact SG-O 3.37Å; C119-I783 HydrophobicContact CB-CD1 3.73Å
120	H	74.8	Confident	68.9	Low	87 Å²	87	27.8 Å²	27.8	40%	0.403	14%	0.14	S	C	.	.	H	α-helix	trans	-62.4	-31.7	178.3	-76.2	-54.7	0	0	0	113.7	D118 A124 C287 H316	D118-H120 VanDerWaalsContact C-N 3.31Å; D118-H120 PolarHBondContact O-N 3.46Å; H120-A124 WeakPolarHBondContact O-CB 3.38Å; H120-A124 PolarHBondContact O-N 3.07Å; H120-A124 VanDerWaalsContact O-N 3.09Å; H120-C287 VanDerWaalsContact CD2-SG 3.55Å; H120-H316 AromaticContact CD2-CD2 3.7Å; H120-H316 AromaticContact CD2-NE2 3.81Å
121	S	79.9	Confident	68.6	Low	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-72.8	-30.3	173.8	-57.1	0	0	0	0	112.3	D118 C119 A124 D125 T379 R381	D118-S121 WeakPolarHBondContact O-CB 3.39Å; D118-S121 PolarHBondContact O-N 3.29Å; D118-S121 VanDerWaalsContact O-N 3.09Å; D118-S121 VanDerWaalsContact OD1-CB 3.24Å; D118-S121 WeakPolarHBondContact OD1-CB 3.43Å; D118-S121 PolarHBondContact OD1-N 3.37Å; D118-S121 PolarHBondContact OD1-OG 2.89Å; C119-S121 VanDerWaalsContact C-N 3.27Å; C119-S121 PolarHBondContact O-N 2.9Å; S121-A124 WeakPolarHBondContact O-CB 3.49Å; S121-D125 PolarHBondContact O-N 2.9Å; S121-T379 PolarHBondContact OG-O 2.6Å; S121-R381 WeakPolarHBondContact CB-O 3.49Å; S121-R381 PolarHBondContact OG-N 2.84Å; S121-R381 PolarHBondContact OG-NH2 2.86Å; S121-R381 PolarHBondContact OG-O 3.26Å
122	I	80.2	Confident	67.6	Low	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-69.3	-48.8	174.8	-60.4	173	0	0	0	110.1	H116 D118 C119 A124 D125 Y126 L289 A749 V751 F772 A774 I783	H116-I122 HydrophobicContact CB-CD1 4.23Å; H116-I122 HydrophobicContact CB-CG1 3.57Å; D118-I122 PolarHBondContact O-N 2.87Å; C119-I122 WeakPolarHBondContact O-CB 3.42Å; C119-I122 PolarHBondContact O-N 3.17Å; I122-A124 VanDerWaalsContact C-N 3.25Å; I122-A124 PolarHBondContact O-N 2.85Å; I122-D125 PolarHBondContact O-N 2.89Å; I122-D125 VanDerWaalsContact O-N 3.17Å; I122-Y126 WeakPolarHBondContact O-CD2 3.45Å; I122-Y126 PolarHBondContact O-N 2.94Å; I122-L289 HydrophobicContact CD1-CD1 3.61Å; I122-A749 HydrophobicContact CD1-CB 4.37Å; I122-V751 HydrophobicContact CB-CG2 4.43Å; I122-V751 HydrophobicContact CD1-CG2 3.76Å; I122-V751 HydrophobicContact CG1-CG2 3.77Å; I122-V751 HydrophobicContact CG2-CG1 3.86Å; I122-V751 HydrophobicContact CG2-CG2 3.89Å; I122-F772 HydrophobicContact CG2-CB 4.16Å; I122-F772 HydrophobicContact CG2-CD2 4.39Å; I122-F772 HydrophobicContact CG2-CG 4.35Å; I122-A774 HydrophobicContact CD1-CB 3.49Å; I122-A774 VanDerWaalsContact CD1-CB 3.49Å; I122-I783 HydrophobicContact CB-CD1 4.27Å; I122-I783 HydrophobicContact CD1-CD1 4.33Å; I122-I783 HydrophobicContact CG2-CD1 4.26Å
123	C	76.3	Confident	66.7	Low	4 Å²	4	30.1 Å²	30.1	3%	0.027	17%	0.165	C	C	.	.	H	α-helix	trans	-58.4	-38.6	174.9	-61.6	0	0	0	0	111.8	C119 D125 Y126 G127 E788	C119-C123 PolarHBondContact O-N 3.34Å; C119-C123 PolarHBondContact O-SG 3.1Å; C119-C123 VanDerWaalsContact O-SG 3.37Å; C123-D125 PolarHBondContact O-N 2.75Å; C123-Y126 PolarHBondContact O-N 2.89Å; C123-G127 WeakPolarHBondContact O-CA 3.42Å; C123-G127 PolarHBondContact O-N 2.85Å; C123-E788 HydrophobicContact CB-CB 4.43Å; C123-E788 HydrophobicContact CB-CG 4.19Å; C123-E788 WeakPolarHBondContact CB-OE2 3.35Å
124	A	72.1	Confident	65.2	Low	5 Å²	5	33.4 Å²	33.4	4%	0.041	18%	0.184	C	C	.	.	H	α-helix	trans	-58.4	-44.3	175.4	0	0	0	0	0	113.1	H120 S121 I122 Y126 L130 S378 F380	H120-A124 WeakPolarHBondContact O-CB 3.38Å; H120-A124 PolarHBondContact O-N 3.07Å; H120-A124 VanDerWaalsContact O-N 3.09Å; S121-A124 WeakPolarHBondContact O-CB 3.49Å; I122-A124 VanDerWaalsContact C-N 3.25Å; I122-A124 PolarHBondContact O-N 2.85Å; A124-Y126 PolarHBondContact O-N 2.92Å; A124-L130 WeakPolarHBondContact O-CD1 3.32Å; A124-S378 VanDerWaalsContact CA-OG 3.28Å; A124-S378 WeakPolarHBondContact CA-OG 3.27Å; A124-S378 WeakPolarHBondContact CB-OG 3.38Å; A124-F380 HydrophobicContact CB-CD1 4.34Å; A124-F380 HydrophobicContact CB-CD2 3.77Å; A124-F380 HydrophobicContact CB-CE1 4.24Å; A124-F380 HydrophobicContact CB-CE2 3.62Å; A124-F380 HydrophobicContact CB-CG 4.12Å; A124-F380 HydrophobicContact CB-CZ 3.88Å; A124-F380 WeakPolarHBondContact O-CZ 3.35Å
125	D	69.5	Low	62.7	Low	27 Å²	27	42.7 Å²	42.7	14%	0.144	22%	0.219	C	C	.	.	H	α-helix	trans	-73.9	-22.3	-175	-179.7	36.3	0	0	0	113.6	K111 H116 S121 I122 C123 F380	K111-D125 PolarHBondContact NZ-O 3.5Å; K111-D125 IonicContact NZ-OD1 2.72Å; K111-D125 PolarHBondContact NZ-OD1 2.96Å; K111-D125 IonicContact NZ-OD2 3.51Å; K111-D125 PolarHBondContact NZ-OD2 2.92Å; H116-D125 IonicContact NE2-OD2 2.78Å; H116-D125 PolarHBondContact NE2-OD2 3.31Å; S121-D125 PolarHBondContact O-N 2.9Å; I122-D125 PolarHBondContact O-N 2.89Å; I122-D125 VanDerWaalsContact O-N 3.17Å; C123-D125 PolarHBondContact O-N 2.75Å; D125-F380 VanDerWaalsContact CA-CE1 3.48Å; D125-F380 HydrophobicContact CB-CD1 4.31Å; D125-F380 HydrophobicContact CB-CE1 3.64Å; D125-F380 HydrophobicContact CB-CZ 4.41Å
126	Y	64.6	Low	60.1	Low	34 Å²	34	50.7 Å²	50.7	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-114.9	1.2	-179.1	-67.3	-108.3	0	0	0	113.8	K111 I122 C123 A124 V751 F772	K111-Y126 HydrophobicContact CD-CE1 4Å; K111-Y126 HydrophobicContact CD-CE2 4.33Å; K111-Y126 VanDerWaalsContact NZ-CE2 3.33Å; I122-Y126 WeakPolarHBondContact O-CD2 3.45Å; I122-Y126 PolarHBondContact O-N 2.94Å; C123-Y126 PolarHBondContact O-N 2.89Å; A124-Y126 PolarHBondContact O-N 2.92Å; Y126-V751 HydrophobicContact CE2-CB 4.21Å; Y126-V751 HydrophobicContact CE2-CG1 3.82Å; Y126-F772 AromaticContact CD1-CD1 3.95Å; Y126-F772 HydrophobicContact CD1-CD1 3.95Å; Y126-F772 AromaticContact CD1-CE1 3.4Å; Y126-F772 HydrophobicContact CD1-CE1 3.4Å; Y126-F772 VanDerWaalsContact CD1-CE1 3.4Å; Y126-F772 HydrophobicContact CD1-CZ 4.08Å; Y126-F772 HydrophobicContact CD2-CE1 4.49Å; Y126-F772 HydrophobicContact CE1-CD1 4.28Å; Y126-F772 HydrophobicContact CE1-CE1 4.13Å; Y126-F772 HydrophobicContact CG-CD1 4.12Å; Y126-F772 AromaticContact CG-CE1 3.6Å; Y126-F772 HydrophobicContact CG-CE1 3.6Å; Y126-F772 AromaticContact CG-CZ 3.87Å; Y126-F772 HydrophobicContact CG-CZ 3.87Å
127	G	58.9	Low	57.4	Low	15 Å²	15	54.9 Å²	54.9	16%	0.155	28%	0.283	C	S	.	.			trans	-67	142.1	-179.2	0	0	0	0	0	113.4	C123 L129	C123-G127 WeakPolarHBondContact O-CA 3.42Å; C123-G127 PolarHBondContact O-N 2.85Å; G127-L129 PolarHBondContact O-N 3.44Å; G127-L129 VanDerWaalsContact O-N 3.11Å
128	P	49.7	Very low	54.8	Low	77 Å²	77	59.1 Å²	59.1	50%	0.5	31%	0.313	S	S	.	.	H	α-helix	trans	-67.8	-16.3	-168.6	26.3	-35.7	0	0	0	115	L130 S131 Q132	P128-L130 VanDerWaalsContact C-N 3.34Å; P128-L130 PolarHBondContact O-N 2.73Å; P128-S131 PolarHBondContact O-N 2.66Å; P128-S131 PolarHBondContact O-OG 3.07Å; P128-S131 VanDerWaalsContact O-OG 3.08Å; P128-Q132 WeakPolarHBondContact O-CB 3.26Å; P128-Q132 VanDerWaalsContact O-CG 3.27Å; P128-Q132 WeakPolarHBondContact O-CG 3.22Å; P128-Q132 PolarHBondContact O-N 3.43Å
129	L	48.2	Very low	52.4	Low	95 Å²	95	64 Å²	64	50%	0.497	35%	0.347	S	S	.	.	H	α-helix	trans	-68.9	-28.9	-176.5	-77.3	171.2	0	0	0	113.7	G127 Q132 V133 L377	G127-L129 PolarHBondContact O-N 3.44Å; G127-L129 VanDerWaalsContact O-N 3.11Å; L129-Q132 PolarHBondContact O-N 2.89Å; L129-V133 PolarHBondContact O-N 3.18Å; L129-L377 HydrophobicContact CB-CD2 3.69Å; L129-L377 HydrophobicContact CD1-CD2 3.75Å; L129-L377 HydrophobicContact CG-CD2 4.39Å
130	L	49.2	Very low	50.1	Low	21 Å²	21	66.8 Å²	66.8	11%	0.11	38%	0.376	C	S	.	.	H	α-helix	trans	-66.9	-43.5	177.2	-72.4	157.5	0	0	0	111.2	A124 P128 L340 L377 F380	A124-L130 WeakPolarHBondContact O-CD1 3.32Å; P128-L130 VanDerWaalsContact C-N 3.34Å; P128-L130 PolarHBondContact O-N 2.73Å; L130-L340 HydrophobicContact CD2-CD2 4.44Å; L130-L377 HydrophobicContact CD2-CD1 3.69Å; L130-L377 HydrophobicContact CG-CD1 3.94Å; L130-F380 HydrophobicContact CD1-CE2 4.43Å; L130-F380 HydrophobicContact CD1-CZ 3.79Å
131	S	39.6	Very low	48	Very low	65 Å²	65	68 Å²	68	46%	0.455	40%	0.401	S	S	.	.	H	α-helix	trans	-74.4	-25.4	175.5	60.3	0	0	0	0	113.5	P128 I134	P128-S131 PolarHBondContact O-N 2.66Å; P128-S131 PolarHBondContact O-OG 3.07Å; P128-S131 VanDerWaalsContact O-OG 3.08Å; S131-I134 WeakPolarHBondContact O-CB 3.01Å
132	Q	35.7	Very low	45.7	Very low	103 Å²	103	71.3 Å²	71.3	48%	0.481	44%	0.435	S	S	.	.	H	α-helix	trans	-73.5	-21.9	179	-78.6	179.8	13.3	0	0	114.9	P128 L129 I134 W135	P128-Q132 WeakPolarHBondContact O-CB 3.26Å; P128-Q132 VanDerWaalsContact O-CG 3.27Å; P128-Q132 WeakPolarHBondContact O-CG 3.22Å; P128-Q132 PolarHBondContact O-N 3.43Å; L129-Q132 PolarHBondContact O-N 2.89Å; Q132-I134 PolarHBondContact O-N 2.81Å; Q132-W135 PolarHBondContact O-N 2.87Å; Q132-W135 VanDerWaalsContact O-N 3.12Å
133	V	39.7	Very low	43.2	Very low	46 Å²	46	79.6 Å²	79.6	28%	0.279	48%	0.479	S	S	.	.	H	α-helix	trans	-54.9	-39.6	173.6	171.6	0	0	0	0	110.9	L129 W135 K136 S137 N339	L129-V133 PolarHBondContact O-N 3.18Å; V133-W135 PolarHBondContact O-N 3.49Å; V133-K136 PolarHBondContact O-N 2.94Å; V133-K136 VanDerWaalsContact O-N 3.14Å; V133-S137 PolarHBondContact O-N 2.84Å; V133-S137 PolarHBondContact O-OG 2.83Å; V133-N339 HydrophobicContact CG1-CB 3.84Å
134	I	36.5	Very low	41.3	Very low	106 Å²	106	85.1 Å²	85.1	54%	0.544	52%	0.515	S	S	.	.	H	α-helix	trans	-58.4	-30.2	-179.1	-55.1	174.7	0	0	0	112.3	S131 Q132 S137	S131-I134 WeakPolarHBondContact O-CB 3.01Å; Q132-I134 PolarHBondContact O-N 2.81Å; I134-S137 PolarHBondContact O-OG 2.97Å
135	W	29.3	Very low	39.3	Very low	201 Å²	201	96.2 Å²	96.2	76%	0.761	56%	0.557	S	S	*	*	H	α-helix	trans	-85.6	-23.5	-178.4	-69.3	85.3	0	0	0	113.4	Q132 V133 S138	Q132-W135 PolarHBondContact O-N 2.87Å; Q132-W135 VanDerWaalsContact O-N 3.12Å; V133-W135 PolarHBondContact O-N 3.49Å; W135-S138 PolarHBondContact O-OG 2.78Å
136	K	30.7	Very low	37.4	Very low	172 Å²	172	98.3 Å²	98.3	75%	0.748	59%	0.585	S	S	*	*	H	α-helix	trans	-78	-27.9	173.5	-73.7	-176.4	176.6	175.7	0	112.4	V133 S138 S139	V133-K136 PolarHBondContact O-N 2.94Å; V133-K136 VanDerWaalsContact O-N 3.14Å; K136-S138 PolarHBondContact O-N 3.35Å; K136-S139 PolarHBondContact O-N 2.69Å; K136-S139 PolarHBondContact O-OG 3.5Å
137	S	31.9	Very low	36	Very low	88 Å²	88	103.2 Å²	103.2	62%	0.615	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-10.2	173.5	48.4	0	0	0	0	114.1	V133 I134	V133-S137 PolarHBondContact O-N 2.84Å; V133-S137 PolarHBondContact O-OG 2.83Å; I134-S137 PolarHBondContact O-OG 2.97Å
138	S	29.1	Very low	34.6	Very low	90 Å²	90	105.9 Å²	105.9	63%	0.629	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-2.6	171.8	37.1	0	0	0	0	115.8	W135 K136	W135-S138 PolarHBondContact O-OG 2.78Å; K136-S138 PolarHBondContact O-N 3.35Å
139	S	27.7	Very low	33.8	Very low	103 Å²	103	108.3 Å²	108.3	72%	0.72	67%	0.667	S	S	*	*	S	Bend	trans	-124.6	51.3	-179.9	62.7	0	0	0	0	112.8	K136	K136-S139 PolarHBondContact O-N 2.69Å; K136-S139 PolarHBondContact O-OG 3.5Å
140	G	29.5	Very low	32.8	Very low	64 Å²	64	107.4 Å²	107.4	66%	0.66	68%	0.681	S	S	*	*			trans	-156.9	74.1	-178.5	0	0	0	0	0	112.9	G142	G140-G142 PolarHBondContact O-N 3.4Å
141	A	30.3	Very low	32.3	Very low	111 Å²	111	111.7 Å²	111.7	92%	0.917	71%	0.71	S	S	*	*			trans	-71.5	112.1	178.3	0	0	0	0	0	111.3
142	G	30.1	Very low	31.9	Very low	70 Å²	70	116.9 Å²	116.9	72%	0.722	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-75.4	145.4	175.8	0	0	0	0	0	113.3	G140	G140-G142 PolarHBondContact O-N 3.4Å
143	L	29.1	Very low	31.5	Very low	174 Å²	174	115.1 Å²	115.1	91%	0.911	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-78	126.2	164.9	-73.6	166.8	0	0	0	109.3
144	P	36.4	Very low	31.6	Very low	121 Å²	121	118.8 Å²	118.8	79%	0.786	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-86.1	140.3	-173.1	32.6	-34.7	0	0	0	113.2
145	Y	30.6	Very low	31.3	Very low	238 Å²	238	122.4 Å²	122.4	93%	0.933	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-80	142	163.3	-96.9	-92.5	0	0	0	111.3
146	G	29.4	Very low	31.4	Very low	71 Å²	71	116.3 Å²	116.3	73%	0.732	78%	0.784	S	S	*	*			trans	-120.3	128.7	169.6	0	0	0	0	0	110.7
147	P	35.5	Very low	31.7	Very low	137 Å²	137	113.7 Å²	113.7	89%	0.89	79%	0.785	S	S	*	*			trans	-113.3	162	-166.6	40.4	-34.8	0	0	0	116.2
148	G	29	Very low	31.6	Very low	70 Å²	70	120 Å²	120	72%	0.722	80%	0.801	S	S	*	*			trans	157	142.1	159.3	0	0	0	0	0	111.5
149	S	31.6	Very low	31.5	Very low	128 Å²	128	118.8 Å²	118.8	90%	0.895	80%	0.803	S	S	*	*			cis	157.6	104.6	-16.9	44.4	0	0	0	0	105.5
150	G	27.9	Very low	31.5	Very low	76 Å²	76	119.9 Å²	119.9	78%	0.784	81%	0.811	S	S	*	*			trans	-178.4	124	-176.7	0	0	0	0	0	112.3
151	P	39.5	Very low	31.5	Very low	112 Å²	112	121.3 Å²	121.3	73%	0.727	82%	0.816	S	S	*	*			trans	-125.8	179.5	-167.7	42.9	-31.5	0	0	0	116.5
152	I	29.8	Very low	31.8	Very low	173 Å²	173	121.5 Å²	121.5	89%	0.887	81%	0.808	S	S	*	*			trans	78	141.8	170.4	-50	160.4	0	0	0	113.3
153	G	29.1	Very low	31.7	Very low	66 Å²	66	123.3 Å²	123.3	68%	0.68	81%	0.81	S	S	*	*			cis	-163.3	-175.8	2.3	0	0	0	0	0	113
154	P	40.9	Very low	31.6	Very low	123 Å²	123	126.1 Å²	126.1	80%	0.799	81%	0.808	S	S	*	*			trans	-118.1	170.2	-154.6	41.9	-34.3	0	0	0	117
155	L	31.1	Very low	31.3	Very low	182 Å²	182	127.1 Å²	127.1	95%	0.953	81%	0.812	S	S	*	*			trans	177	148.1	135.5	-100	167.9	0	0	0	114.4
156	G	29.4	Very low	31.2	Very low	73 Å²	73	121.3 Å²	121.3	75%	0.753	81%	0.805	S	S	*	*			trans	95.6	123.7	149.9	0	0	0	0	0	119.9
157	P	38.5	Very low	31	Very low	118 Å²	118	125.7 Å²	125.7	77%	0.766	81%	0.811	S	S	*	*			trans	-125.8	161	179.1	41.4	-29.8	0	0	0	116.4
158	F	30.3	Very low	30.9	Very low	220 Å²	220	125.4 Å²	125.4	97%	0.965	81%	0.809	S	S	*	*			trans	-155.3	173.2	156.4	-102	-72.3	0	0	0	111.4
159	G	25	Very low	30.7	Very low	65 Å²	65	130.5 Å²	130.5	67%	0.67	81%	0.814	S	S	*	*			trans	-74.5	-171.4	179.7	0	0	0	0	0	114.6
160	S	29.4	Very low	30.5	Very low	126 Å²	126	134.6 Å²	134.6	88%	0.881	81%	0.81	S	S	*	*			cis	-160.8	175.2	16.7	-44.2	0	0	0	0	111.3
161	A	29.6	Very low	30.4	Very low	93 Å²	93	136.8 Å²	136.8	77%	0.769	80%	0.804	S	S	*	*			trans	-110.8	155.7	158.4	0	0	0	0	0	109.5
162	P	34.8	Very low	29.8	Very low	115 Å²	115	137.1 Å²	137.1	75%	0.747	80%	0.804	S	S	*	*				-158.9	166.8	102.7	41.4	-23.5	0	0	0	117.9
163	S	28.6	Very low	29.8	Very low	109 Å²	109	135.9 Å²	135.9	76%	0.762	80%	0.804	S	S	*	*			trans	62.9	163.9	138.5	-76.3	0	0	0	0	122.3
164	R	27	Very low	29.7	Very low	232 Å²	232	140.1 Å²	140.1	88%	0.875	81%	0.811	S	S	*	*			cis	-170.2	126.8	-39.6	-134.7	-171.7	-171.1	-157.9	6.4	110
165	V	29.9	Very low	29.6	Very low	143 Å²	143	139.2 Å²	139.2	87%	0.867	81%	0.805	S	S	*	*			trans	-154.6	160	169.1	-169.3	0	0	0	0	107.7
166	C	28.9	Very low	29.2	Very low	115 Å²	115	136.5 Å²	136.5	78%	0.777	80%	0.8	S	S	*	*				-149.4	-174.4	-66.7	-101.2	0	0	0	0	109.2
167	L	26.2	Very low	29.2	Very low	163 Å²	163	137.1 Å²	137.1	85%	0.853	81%	0.806	S	S	*	*			trans	-130.1	164.7	172.3	-76.2	163.9	0	0	0	109.2
168	P	32.8	Very low	28.5	Very low	131 Å²	131	135.4 Å²	135.4	85%	0.851	81%	0.81	S	S	*	*				-146.7	179.3	97.3	38.8	-22.2	0	0	0	115.2
169	Q	24.7	Very low	28.4	Very low	177 Å²	177	130 Å²	130	83%	0.827	80%	0.8	S	S	*	*			trans	-149	132	-178.6	173.7	-164.2	55.5	0	0	109.2
170	R	27.4	Very low	28.4	Very low	214 Å²	214	134.2 Å²	134.2	81%	0.808	81%	0.806	S	S	*	*			trans	172.2	139.7	136.4	-100.5	-175.7	166.9	167.3	-2.6	117
171	N	26.1	Very low	28.3	Very low	123 Å²	123	135.8 Å²	135.8	66%	0.658	81%	0.805	S	S	*	*			trans	80.3	117.5	135.4	-72.5	14.8	0	0	0	124.9
172	T	26.3	Very low	28.2	Very low	119 Å²	119	136.6 Å²	136.6	73%	0.73	80%	0.8	S	S	*	*			trans	68.9	106.8	130.4	58.8	0	0	0	0	122.2
173	T	29.8	Very low	27.9	Very low	146 Å²	146	139.7 Å²	139.7	90%	0.896	81%	0.809	S	S	*	*				-162.1	175.2	106.4	27.3	0	0	0	0	110.9
174	N	27.8	Very low	27.7	Very low	156 Å²	156	139.1 Å²	139.1	83%	0.834	81%	0.805	S	S	*	*			trans	-129.7	170.9	-176.6	-120.5	6.5	0	0	0	108.3
175	P	37.3	Very low	27.7	Very low	103 Å²	103	133.6 Å²	133.6	67%	0.669	80%	0.797	S	S	*	*			cis	-137.6	-159.7	-6.5	35.2	-12	0	0	0	114
176	C	24.5	Very low	27.6	Very low	125 Å²	125	132.2 Å²	132.2	85%	0.845	79%	0.794	S	S	*	*			trans	96	132	159.4	-62.3	0	0	0	0	119.8
177	G	27.7	Very low	27.3	Very low	86 Å²	86	131.7 Å²	131.7	89%	0.887	79%	0.792	S	S	*	*			trans	90.6	127.5	170.5	0	0	0	0	0	115.6
178	G	24.3	Very low	27.7	Very low	82 Å²	82	129.7 Å²	129.7	85%	0.845	79%	0.788	S	S	*	*			cis	142	69.9	-17	0	0	0	0	0	116.5
179	S	28.6	Very low	27.6	Very low	108 Å²	108	129.8 Å²	129.8	76%	0.755	79%	0.786	S	S	*	*			trans	-157.8	151	148.8	-164	0	0	0	0	111.6
180	L	25	Very low	27.8	Very low	152 Å²	152	129.8 Å²	129.8	80%	0.796	79%	0.786	S	S	*	*			trans	-157.3	107.3	179	-119	172	0	0	0	107.6	V182	L180-V182 PolarHBondContact O-N 2.83Å
181	D	27.9	Very low	27.8	Very low	159 Å²	159	124 Å²	124	85%	0.85	78%	0.779	S	S	*	*			trans	-74.4	119.3	-179.1	-78.2	-53.7	0	0	0	111.6
182	V	27.4	Very low	28	Very low	110 Å²	110	125.1 Å²	125.1	67%	0.667	79%	0.785	S	S	*	*			trans	-122.9	105.3	-179.3	176.6	0	0	0	0	109.2	L180 S184	L180-V182 PolarHBondContact O-N 2.83Å; V182-S184 PolarHBondContact O-N 3.37Å; V182-S184 VanDerWaalsContact O-N 3.09Å
183	L	26.9	Very low	28	Very low	180 Å²	180	126.1 Å²	126.1	94%	0.942	79%	0.786	S	S	*	*			trans	-67.9	107.3	170.9	-69.8	176.1	0	0	0	110
184	S	26.1	Very low	27.9	Very low	97 Å²	97	127.3 Å²	127.3	68%	0.678	78%	0.781	S	S	*	*			trans	-102.7	127.8	177.3	-62.2	0	0	0	0	110.5	V182	V182-S184 PolarHBondContact O-N 3.37Å; V182-S184 VanDerWaalsContact O-N 3.09Å
185	V	26.4	Very low	27.9	Very low	116 Å²	116	123.4 Å²	123.4	70%	0.703	78%	0.777	S	S	*	*			trans	-117.9	109.6	171.3	177.8	0	0	0	0	109.1
186	S	27.1	Very low	27.4	Very low	114 Å²	114	125.5 Å²	125.5	80%	0.797	79%	0.787	S	S	*	*			trans	-111.7	149.5	176.4	-63.9	0	0	0	0	110.5
187	S	24.2	Very low	27.7	Very low	105 Å²	105	126 Å²	126	73%	0.734	79%	0.787	S	S	*	*			trans	-87.6	162.8	-174.2	-66.4	0	0	0	0	113.4
188	P	34.3	Very low	27.5	Very low	121 Å²	121	127.6 Å²	127.6	79%	0.786	79%	0.785	S	S	*	*			trans	-104.4	176.2	-153.2	40.8	-37.6	0	0	0	115.6
189	V	30.6	Very low	27.8	Very low	133 Å²	133	129.1 Å²	129.1	81%	0.806	78%	0.782	S	S	*	*			trans	-136.8	152.6	161.7	174.9	0	0	0	0	109.2
190	E	27.5	Very low	27.6	Very low	177 Å²	177	130.1 Å²	130.1	83%	0.827	79%	0.789	S	S	*	*			trans	-38.1	156.4	170.9	-67.1	148	171.5	0	0	116.6
191	S	27.5	Very low	27.7	Very low	92 Å²	92	126 Å²	126	64%	0.643	78%	0.783	S	S	*	*			cis	-161.5	176.8	-5.6	54	0	0	0	0	112.5
192	D	30.2	Very low	27.7	Very low	147 Å²	147	123 Å²	123	79%	0.786	78%	0.775	S	S	*	*			trans	76.4	87.1	154.1	-51.6	-38.9	0	0	0	123
193	D	27.4	Very low	27.8	Very low	140 Å²	140	122.9 Å²	122.9	75%	0.749	78%	0.779	S	S	*	*				82.2	151.2	119.2	-146.5	5.2	0	0	0	123.4
194	H	28.2	Very low	28.2	Very low	171 Å²	171	118.1 Å²	118.1	79%	0.792	77%	0.766	S	S	*	*			trans	72.3	107.4	168.8	-71.4	12.7	0	0	0	119.4
195	G	27.6	Very low	29	Very low	74 Å²	74	122.1 Å²	122.1	76%	0.763	78%	0.776	S	S	*	*			trans	172.7	60	169.8	0	0	0	0	0	116.1	T197	G195-T197 PolarHBondContact O-N 2.91Å
196	V	26.9	Very low	30.4	Very low	146 Å²	146	123.8 Å²	123.8	89%	0.885	78%	0.78	S	S	*	*			trans	-78.4	111.6	179.5	179.3	0	0	0	0	111.9
197	T	30.3	Very low	32.4	Very low	135 Å²	135	120.7 Å²	120.7	83%	0.828	76%	0.755	S	S	*	*			trans	-131.9	119.1	154.1	49.2	0	0	0	0	110.3	G195 S199	G195-T197 PolarHBondContact O-N 2.91Å; T197-S199 PolarHBondContact O-N 3.3Å
198	S	24.4	Very low	34.6	Very low	121 Å²	121	123.9 Å²	123.9	85%	0.846	76%	0.758	S	S	*	*			trans	-80.2	116.6	-179.5	53.8	0	0	0	0	111.7
199	S	28.9	Very low	36.6	Very low	114 Å²	114	118.5 Å²	118.5	80%	0.797	72%	0.724	S	S	*	*			trans	-109.7	115.7	156.1	53.5	0	0	0	0	109	T197 G201	T197-S199 PolarHBondContact O-N 3.3Å; S199-G201 PolarHBondContact O-N 2.98Å
200	S	25.6	Very low	39	Very low	128 Å²	128	112.6 Å²	112.6	90%	0.895	69%	0.688	S	S	*	*			trans	-77.3	73.8	-179.7	55.4	0	0	0	0	110.7
201	G	27.5	Very low	41.7	Very low	65 Å²	65	106.2 Å²	106.2	67%	0.67	67%	0.67	S	S	*	*			trans	-60.3	141.9	166.2	0	0	0	0	0	110.5	S199 S203	S199-G201 PolarHBondContact O-N 2.98Å; G201-S203 PolarHBondContact O-N 3.07Å
202	S	27.3	Very low	44.6	Very low	98 Å²	98	104 Å²	104	69%	0.685	65%	0.649	S	S	*	*			trans	-61.2	119.1	-175.9	38.7	0	0	0	0	111.5	A204	S202-A204 PolarHBondContact O-N 2.88Å
203	S	29.5	Very low	47.4	Very low	107 Å²	107	104.7 Å²	104.7	75%	0.748	64%	0.641	S	S	*	*			trans	-73.4	76	172.5	-170.5	0	0	0	0	110.1	G201 M205	G201-S203 PolarHBondContact O-N 3.07Å; S203-M205 PolarHBondContact O-N 3.04Å; S203-M205 VanDerWaalsContact O-N 3.16Å
204	A	35.8	Very low	50.3	Low	80 Å²	80	100.1 Å²	100.1	66%	0.661	62%	0.617	S	S	*	*			trans	-58.8	113.1	153.1	0	0	0	0	0	106.4	S202 L206	S202-A204 PolarHBondContact O-N 2.88Å; A204-L206 PolarHBondContact O-N 2.74Å
205	M	42	Very low	53.2	Low	180 Å²	180	94.6 Å²	94.6	89%	0.887	61%	0.606	S	S	*	*			trans	-39.3	108.9	-175.2	-79.4	-76.7	-174	0	0	110.8	S203 D207	S203-M205 PolarHBondContact O-N 3.04Å; S203-M205 VanDerWaalsContact O-N 3.16Å; M205-D207 PolarHBondContact O-N 3.02Å; M205-D207 VanDerWaalsContact O-N 3.1Å
206	L	56.4	Low	56.2	Low	152 Å²	152	91.5 Å²	91.5	80%	0.796	57%	0.572	S	S	*	*			trans	-67.2	114.4	-179.2	-73.9	173.5	0	0	0	107.9	A204 E208	A204-L206 PolarHBondContact O-N 2.74Å; L206-E208 PolarHBondContact O-N 3.38Å
207	D	67.8	Low	59.2	Low	49 Å²	49	84.6 Å²	84.6	26%	0.262	53%	0.53	S	S	.	.			trans	-65.2	93.8	179.1	-178.8	-6.2	0	0	0	109.6	M205 G209 P221 R224 K623	M205-D207 PolarHBondContact O-N 3.02Å; M205-D207 VanDerWaalsContact O-N 3.1Å; D207-G209 PolarHBondContact O-N 2.87Å; D207-G209 VanDerWaalsContact O-N 3.08Å; D207-G209 PolarHBondContact OD1-N 3.44Å; D207-P221 VanDerWaalsContact O-CA 3.3Å; D207-P221 WeakPolarHBondContact O-CA 3.35Å; D207-P221 WeakPolarHBondContact O-CB 3.29Å; D207-R224 IonicContact OD1-CZ 3.94Å; D207-R224 IonicContact OD1-NH1 3.34Å; D207-R224 PolarHBondContact OD1-NH1 3.05Å; D207-R224 IonicContact OD1-NH2 2.84Å; D207-R224 PolarHBondContact OD1-NH2 3.37Å; D207-R224 IonicContact OD2-NH1 3.41Å; D207-R224 IonicContact OD2-NH2 2.81Å; D207-R224 PolarHBondContact OD2-NH2 3.19Å; D207-K623 WeakPolarHBondContact OD2-CD 3.18Å; D207-K623 WeakPolarHBondContact OD2-CE 3.13Å; D207-K623 IonicContact OD2-NZ 3.41Å; D207-K623 PolarHBondContact OD2-NZ 3.49Å
208	E	71.3	Confident	62.1	Low	172 Å²	172	81.6 Å²	81.6	80%	0.804	51%	0.508	S	S	*	.			trans	-68	-3.4	-177.7	-58.8	-166.4	146.2	0	0	113.5	L206	L206-E208 PolarHBondContact O-N 3.38Å
209	G	75.5	Confident	65.2	Low	7 Å²	7	77.5 Å²	77.5	7%	0.072	48%	0.48	C	S	.	.			trans	99.8	-153.4	-172.1	0	0	0	0	0	112	D207	D207-G209 PolarHBondContact O-N 2.87Å; D207-G209 VanDerWaalsContact O-N 3.08Å; D207-G209 PolarHBondContact OD1-N 3.44Å
210	D	82.4	Confident	68	Low	10 Å²	10	72.1 Å²	72.1	5%	0.053	44%	0.443	C	S	.	.			trans	-98.1	-8.6	164.7	50.3	19	0	0	0	112.8	K212 R224 N225	D210-K212 HydrophobicContact CB-CD 4.38Å; D210-K212 HydrophobicContact CB-CG 4.16Å; D210-K212 PolarHBondContact O-N 2.91Å; D210-K212 WeakPolarHBondContact OD1-CB 3.35Å; D210-K212 PolarHBondContact OD1-N 3.3Å; D210-R224 WeakPolarHBondContact OD2-CA 3.47Å; D210-N225 PolarHBondContact OD2-N 3.34Å
211	G	83.9	Confident	70.9	Confident	43 Å²	43	68.3 Å²	68.3	44%	0.443	41%	0.414	S	S	.	.			trans	69.9	13.3	-173.1	0	0	0	0	0	113.9	Y213 S219	G211-Y213 WeakPolarHBondContact O-CD1 3.29Å; G211-S219 WeakPolarHBondContact CA-OG 3.05Å; G211-S219 PolarHBondContact N-OG 2.89Å
212	K	87.1	Confident	73.7	Confident	45 Å²	45	70.3 Å²	70.3	20%	0.196	41%	0.405	C	S	.	.			trans	-86	127.7	-177.9	-71.7	-178.5	168.5	-173.9	0	111.4	D210 S219 N225 I227 T276	D210-K212 HydrophobicContact CB-CD 4.38Å; D210-K212 HydrophobicContact CB-CG 4.16Å; D210-K212 PolarHBondContact O-N 2.91Å; D210-K212 WeakPolarHBondContact OD1-CB 3.35Å; D210-K212 PolarHBondContact OD1-N 3.3Å; K212-S219 WeakPolarHBondContact O-CA 3.46Å; K212-S219 PolarHBondContact O-N 3.14Å; K212-N225 HydrophobicContact CB-CB 4.02Å; K212-N225 WeakPolarHBondContact CD-O 3.33Å; K212-N225 PolarHBondContact O-ND2 3.47Å; K212-I227 HydrophobicContact CB-CD1 4.22Å; K212-T276 PolarHBondContact NZ-OG1 3.47Å
213	Y	89.7	Confident	76.7	Confident	162 Å²	162	66.6 Å²	66.6	64%	0.635	38%	0.377	S	S	*	.			trans	-150.1	160.8	176.3	66	-85.8	0	0	0	110.7	G211 I217	G211-Y213 WeakPolarHBondContact O-CD1 3.29Å; Y213-I217 CarbonylContact C-O 3.46Å; Y213-I217 VanDerWaalsContact CA-O 3.25Å; Y213-I217 WeakPolarHBondContact CA-O 3.26Å; Y213-I217 WeakPolarHBondContact CB-O 3.45Å
214	N	89.3	Confident	79.4	Confident	44 Å²	44	62.8 Å²	62.8	24%	0.235	35%	0.346	C	S	.	.			trans	-151.1	-167.1	170.4	68.5	12	0	0	0	109.9	L216 I217 S618	N214-L216 PolarHBondContact O-N 3.14Å; N214-L216 WeakPolarHBondContact OD1-CA 3.42Å; N214-L216 WeakPolarHBondContact OD1-CB 3.49Å; N214-L216 PolarHBondContact OD1-N 3.1Å; N214-I217 PolarHBondContact N-O 3.12Å; N214-I217 PolarHBondContact OD1-N 3.43Å; N214-S618 PolarHBondContact ND2-OG 3.19Å
215	G	88.5	Confident	82	Confident	55 Å²	55	59 Å²	59	57%	0.567	31%	0.314	S	S	*	.	S	Bend	trans	-66.4	-12	177.8	0	0	0	0	0	115.5
216	L	89.4	Confident	84.1	Confident	9 Å²	9	50.4 Å²	50.4	5%	0.047	27%	0.272	C	S	.	.	S	Bend	trans	-98.6	-37	179.2	-49.7	-170.2	0	0	0	112.1	N214 Q580 P586 F587 V602 Q604	N214-L216 PolarHBondContact O-N 3.14Å; N214-L216 WeakPolarHBondContact OD1-CA 3.42Å; N214-L216 WeakPolarHBondContact OD1-CB 3.49Å; N214-L216 PolarHBondContact OD1-N 3.1Å; L216-Q580 PolarHBondContact O-NE2 3.47Å; L216-P586 WeakPolarHBondContact O-CA 3.39Å; L216-F587 PolarHBondContact O-N 3.24Å; L216-V602 HydrophobicContact CB-CG1 4.05Å; L216-Q604 HydrophobicContact CD1-CB 4.49Å; L216-Q604 HydrophobicContact CD2-CB 3.53Å; L216-Q604 HydrophobicContact CD2-CG 4.17Å
217	I	90.9	Very high	85.4	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-142.7	142.9	-169.7	-168.7	164.5	0	0	0	114	Y213 N214 N225 I227 F587 P589 V602 S620	Y213-I217 CarbonylContact C-O 3.46Å; Y213-I217 VanDerWaalsContact CA-O 3.25Å; Y213-I217 WeakPolarHBondContact CA-O 3.26Å; Y213-I217 WeakPolarHBondContact CB-O 3.45Å; N214-I217 PolarHBondContact N-O 3.12Å; N214-I217 PolarHBondContact OD1-N 3.43Å; I217-N225 WeakPolarHBondContact CD1-OD1 3.41Å; I217-I227 HydrophobicContact CG2-CG2 3.91Å; I217-F587 CarbonylContact C-O 3.55Å; I217-F587 WeakPolarHBondContact CA-O 3.44Å; I217-F587 HydrophobicContact CD1-CD1 4.06Å; I217-F587 HydrophobicContact CG1-CD1 4.25Å; I217-F587 WeakPolarHBondContact CG1-O 3.38Å; I217-P589 HydrophobicContact CD1-CG 4.1Å; I217-V602 HydrophobicContact CD1-CG2 4.18Å; I217-S620 VanDerWaalsContact CD1-CB 3.43Å
218	L	91.9	Very high	85.9	Confident	72 Å²	72	43.6 Å²	43.6	38%	0.377	24%	0.239	S	C	.	.			trans	-94.8	152.6	174.3	-56.6	-176.9	0	0	0	112.5	N225 P586 F587 C588	L218-N225 PolarHBondContact O-ND2 3.35Å; L218-P586 HydrophobicContact CD1-CB 4.48Å; L218-P586 HydrophobicContact CD2-CB 3.69Å; L218-P586 HydrophobicContact CD2-CG 4.39Å; L218-P586 HydrophobicContact CG-CB 3.82Å; L218-F587 PolarHBondContact N-O 2.92Å; L218-C588 HydrophobicContact CB-CB 4.36Å; L218-C588 HydrophobicContact CD1-CB 4.29Å
219	S	89.1	Confident	85.7	Confident	36 Å²	36	37.4 Å²	37.4	25%	0.252	22%	0.222	S	C	.	.			trans	-64.3	151.4	171.2	-175.6	0	0	0	0	111.4	G211 K212	G211-S219 WeakPolarHBondContact CA-OG 3.05Å; G211-S219 PolarHBondContact N-OG 2.89Å; K212-S219 WeakPolarHBondContact O-CA 3.46Å; K212-S219 PolarHBondContact O-N 3.14Å
220	C	86.7	Confident	85.5	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.007	22%	0.22	C	C	.	.			trans	-153.2	129.3	179.6	171.9	0	0	0	0	111	F222 F223 P589	C220-F222 VanDerWaalsContact C-N 3.25Å; C220-F222 PolarHBondContact O-N 3.09Å; C220-F222 VanDerWaalsContact O-N 3.08Å; C220-F223 HydrophobicContact CB-CB 4.26Å; C220-F223 PolarHBondContact O-N 2.97Å; C220-P589 HydrophobicContact CB-CG 4.46Å
221	P	87.1	Confident	84.7	Confident	47 Å²	47	38.9 Å²	38.9	31%	0.305	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-40.2	-45.6	175.6	-39.8	41.4	0	0	0	116.4	D207 F223 R224	D207-P221 VanDerWaalsContact O-CA 3.3Å; D207-P221 WeakPolarHBondContact O-CA 3.35Å; D207-P221 WeakPolarHBondContact O-CB 3.29Å; P221-F223 VanDerWaalsContact C-N 3.34Å; P221-F223 PolarHBondContact O-N 3.08Å; P221-R224 PolarHBondContact O-NH1 2.95Å
222	F	86.8	Confident	83.6	Confident	108 Å²	108	38 Å²	38	47%	0.474	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-6.6	-172.2	-50	-74.4	0	0	0	114	C220 Y622 K623	C220-F222 VanDerWaalsContact C-N 3.25Å; C220-F222 PolarHBondContact O-N 3.09Å; C220-F222 VanDerWaalsContact O-N 3.08Å; F222-Y622 HydrophobicContact CB-CE2 4.31Å; F222-Y622 VanDerWaalsContact O-CD2 3.24Å; F222-Y622 WeakPolarHBondContact O-CD2 3.4Å; F222-K623 PolarHBondContact O-N 2.68Å
223	F	89	Confident	82.5	Confident	20 Å²	20	39.6 Å²	39.6	9%	0.088	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	168	-173.6	-76.3	-101.6	0	0	0	111	C220 P221 P589 F600 S620 R621 Y622	C220-F223 HydrophobicContact CB-CB 4.26Å; C220-F223 PolarHBondContact O-N 2.97Å; P221-F223 VanDerWaalsContact C-N 3.34Å; P221-F223 PolarHBondContact O-N 3.08Å; F223-P589 HydrophobicContact CB-CB 4.35Å; F223-P589 HydrophobicContact CB-CG 4.32Å; F223-P589 HydrophobicContact CD1-CB 3.88Å; F223-P589 HydrophobicContact CD1-CG 4.29Å; F223-P589 HydrophobicContact CD2-CB 3.59Å; F223-P589 HydrophobicContact CD2-CG 4.45Å; F223-P589 HydrophobicContact CE1-CB 4.11Å; F223-P589 HydrophobicContact CE2-CB 3.81Å; F223-P589 HydrophobicContact CG-CB 3.66Å; F223-P589 HydrophobicContact CG-CG 4.1Å; F223-P589 HydrophobicContact CZ-CB 4.08Å; F223-F600 HydrophobicContact CD1-CD2 4.46Å; F223-F600 AromaticContact CE1-CD2 3.8Å; F223-F600 HydrophobicContact CE1-CD2 3.8Å; F223-F600 AromaticContact CE1-CE2 3.67Å; F223-F600 HydrophobicContact CE1-CE2 3.67Å; F223-F600 HydrophobicContact CZ-CD2 4.34Å; F223-F600 AromaticContact CZ-CE2 3.75Å; F223-F600 HydrophobicContact CZ-CE2 3.75Å; F223-S620 WeakPolarHBondContact CD1-OG 3.42Å; F223-R621 CarbonylContact C-O 3.58Å; F223-R621 VanDerWaalsContact CA-O 3.25Å; F223-R621 WeakPolarHBondContact CA-O 3.47Å; F223-R621 WeakPolarHBondContact CD1-O 3.43Å; F223-Y622 HydrophobicContact CE2-CD2 4.41Å; F223-Y622 HydrophobicContact CZ-CD2 4.46Å
224	R	87.3	Confident	81.2	Confident	27 Å²	27	34.6 Å²	34.6	10%	0.102	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.6	170.6	-61	-64.8	-178.1	-91	7.6	108	D207 D210 P221 R621 K623	D207-R224 IonicContact OD1-CZ 3.94Å; D207-R224 IonicContact OD1-NH1 3.34Å; D207-R224 PolarHBondContact OD1-NH1 3.05Å; D207-R224 IonicContact OD1-NH2 2.84Å; D207-R224 PolarHBondContact OD1-NH2 3.37Å; D207-R224 IonicContact OD2-NH1 3.41Å; D207-R224 IonicContact OD2-NH2 2.81Å; D207-R224 PolarHBondContact OD2-NH2 3.19Å; D210-R224 WeakPolarHBondContact OD2-CA 3.47Å; P221-R224 PolarHBondContact O-NH1 2.95Å; R224-R621 HydrophobicContact CB-CG 4.34Å; R224-R621 PolarHBondContact N-O 3.43Å; R224-R621 WeakPolarHBondContact O-CG 3.47Å; R224-R621 PolarHBondContact O-N 2.84Å; R224-K623 HydrophobicContact CG-CB 4.19Å
225	N	89.2	Confident	80.1	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130.9	-171.2	-68.6	-24	0	0	0	111.2	D210 K212 I217 L218 I227 V619 S620	D210-N225 PolarHBondContact OD2-N 3.34Å; K212-N225 HydrophobicContact CB-CB 4.02Å; K212-N225 WeakPolarHBondContact CD-O 3.33Å; K212-N225 PolarHBondContact O-ND2 3.47Å; I217-N225 WeakPolarHBondContact CD1-OD1 3.41Å; L218-N225 PolarHBondContact O-ND2 3.35Å; N225-I227 HydrophobicContact CB-CG2 4.09Å; N225-V619 CarbonylContact C-O 3.32Å; N225-V619 WeakPolarHBondContact CA-O 3.37Å; N225-S620 WeakPolarHBondContact OD1-CB 3.32Å; N225-S620 PolarHBondContact OD1-OG 3.4Å
226	E	86.4	Confident	78.9	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	115.2	163.6	-55.9	169	-163.1	0	0	106.4	E230 H278 S618 V619 R621 I632 K651	E226-E230 VanDerWaalsContact CA-OE1 3.22Å; E226-E230 WeakPolarHBondContact CA-OE1 3.47Å; E226-E230 HydrophobicContact CB-CG 4.29Å; E226-E230 HydrophobicContact CG-CG 4.32Å; E226-H278 IonicContact OE1-CE1 3.64Å; E226-H278 IonicContact OE1-NE2 2.91Å; E226-H278 IonicContact OE2-CE1 2.74Å; E226-H278 PolarHBondContact OE2-CE1 3.45Å; E226-H278 IonicContact OE2-NE2 2.6Å; E226-S618 CarbonylContact O-C 3.41Å; E226-S618 WeakPolarHBondContact O-CA 3.32Å; E226-S618 WeakPolarHBondContact O-CB 3.38Å; E226-V619 HydrophobicContact CB-CB 4.19Å; E226-V619 PolarHBondContact N-O 2.9Å; E226-V619 PolarHBondContact O-N 2.72Å; E226-R621 IonicContact OE1-NE 2.76Å; E226-I632 HydrophobicContact CB-CD1 3.96Å; E226-I632 HydrophobicContact CB-CG1 4.45Å; E226-I632 WeakPolarHBondContact O-CD1 3.48Å; E226-K651 IonicContact OE2-NZ 3.88Å; E226-K651 PolarHBondContact OE2-NZ 3.2Å
227	I	85.2	Confident	77.4	Confident	44 Å²	44	31.9 Å²	31.9	23%	0.226	18%	0.177	C	C	.	.			trans	-120.9	-7.4	-172.7	57.7	171.3	0	0	0	113.1	K212 I217 N225 E230	K212-I227 HydrophobicContact CB-CD1 4.22Å; I217-I227 HydrophobicContact CG2-CG2 3.91Å; N225-I227 HydrophobicContact CB-CG2 4.09Å; I227-E230 PolarHBondContact N-OE1 3.47Å
228	G	76.6	Confident	75.7	Confident	13 Å²	13	32 Å²	32	13%	0.134	18%	0.177	C	C	.	.	S	Bend	trans	119.4	139.2	-172.8	0	0	0	0	0	111.5	E230 I632	G228-E230 PolarHBondContact N-OE1 3.23Å; G228-E230 PolarHBondContact N-OE2 3.4Å; G228-I632 WeakPolarHBondContact CA-O 3.39Å
229	G	68.6	Low	73.8	Confident	43 Å²	43	29.8 Å²	29.8	44%	0.443	17%	0.167	S	C	.	.			trans	80.6	18.9	176	0	0	0	0	0	114.5	I632	G229-I632 PolarHBondContact N-O 2.74Å
230	E	71.1	Confident	71.8	Confident	8 Å²	8	30.9 Å²	30.9	4%	0.037	17%	0.168	C	C	.	.			trans	-61.5	131.3	177.7	-67.2	69.1	-143.4	0	0	112.1	E226 I227 G228 H278 P631 I632	E226-E230 VanDerWaalsContact CA-OE1 3.22Å; E226-E230 WeakPolarHBondContact CA-OE1 3.47Å; E226-E230 HydrophobicContact CB-CG 4.29Å; E226-E230 HydrophobicContact CG-CG 4.32Å; I227-E230 PolarHBondContact N-OE1 3.47Å; G228-E230 PolarHBondContact N-OE1 3.23Å; G228-E230 PolarHBondContact N-OE2 3.4Å; E230-H278 VanDerWaalsContact CB-CD2 3.46Å; E230-H278 WeakPolarHBondContact CB-CD2 3.47Å; E230-P631 HydrophobicContact CB-CB 4.33Å; E230-I632 PolarHBondContact OE2-N 2.75Å
231	P	64.7	Low	70	Confident	39 Å²	39	32.3 Å²	32.3	25%	0.253	17%	0.173	S	C	.	.			trans	-71.9	142.9	-175.3	31.4	-36.3	0	0	0	111.2	E275 W277 H278	P231-E275 HydrophobicContact CG-CG 4.01Å; P231-W277 HydrophobicContact CB-CD2 4.5Å; P231-W277 HydrophobicContact CB-CE3 3.86Å; P231-W277 HydrophobicContact CB-CH2 4Å; P231-W277 HydrophobicContact CB-CZ3 3.61Å; P231-W277 HydrophobicContact CG-CD2 4.12Å; P231-W277 HydrophobicContact CG-CE3 3.97Å; P231-W277 HydrophobicContact CG-CH2 4.26Å; P231-W277 HydrophobicContact CG-CZ2 4.36Å; P231-W277 HydrophobicContact CG-CZ3 4.08Å; P231-W277 WeakPolarHBondContact O-CA 3.49Å; P231-H278 PolarHBondContact O-N 2.99Å
232	T	61.9	Low	67.9	Low	25 Å²	25	32.1 Å²	32.1	15%	0.153	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-106.7	130.8	174.9	-57.8	0	0	0	0	108.7	H234 I280	T232-H234 PolarHBondContact O-CD2 3.22Å; T232-H234 PolarHBondContact O-N 3.27Å; T232-I280 HydrophobicContact CG2-CB 4.3Å; T232-I280 HydrophobicContact CG2-CG2 3.64Å
233	R	63.1	Low	65.9	Low	78 Å²	78	31.6 Å²	31.6	29%	0.294	17%	0.169	S	C	.	.			trans	-83.3	112	-169.5	-156.2	166.2	170.6	-146.4	-3.2	110.8	W277 H278 E784	R233-W277 HydrophobicContact CB-CD2 4.2Å; R233-W277 HydrophobicContact CB-CE3 3.53Å; R233-W277 HydrophobicContact CB-CZ3 4.04Å; R233-W277 HydrophobicContact CG-CD2 4.34Å; R233-W277 HydrophobicContact CG-CE3 3.89Å; R233-W277 HydrophobicContact CG-CZ3 4.12Å; R233-H278 PolarHBondContact N-O 3.48Å; R233-E784 IonicContact CZ-OE1 3.33Å; R233-E784 VanDerWaalsContact CZ-OE1 3.26Å; R233-E784 IonicContact CZ-OE2 2.79Å; R233-E784 IonicContact NH1-OE1 2.81Å; R233-E784 PolarHBondContact NH1-OE1 3.13Å; R233-E784 IonicContact NH1-OE2 3.22Å; R233-E784 PolarHBondContact NH1-OE2 3.13Å; R233-E784 IonicContact NH2-OE1 2.93Å; R233-E784 PolarHBondContact NH2-OE1 3.25Å
234	H	61.8	Low	63.6	Low	57 Å²	57	37.9 Å²	37.9	26%	0.264	20%	0.198	S	C	.	.			trans	-107.5	145.5	-175.4	-72.1	-72.9	0	0	0	113.2	T232 Y242 I280	T232-H234 PolarHBondContact O-CD2 3.22Å; T232-H234 PolarHBondContact O-N 3.27Å; H234-Y242 AromaticContact CE1-CD1 3.9Å; H234-Y242 AromaticContact CE1-CE1 3.14Å; H234-Y242 WeakPolarHBondContact CE1-CE1 3.21Å; H234-Y242 AromaticContact CE1-CZ 3.48Å; H234-Y242 VanDerWaalsContact CE1-CZ 3.48Å; H234-Y242 AromaticContact ND1-CE1 3.76Å; H234-Y242 AromaticContact ND1-CZ 3.82Å; H234-Y242 AromaticContact NE2-CD1 3.98Å; H234-Y242 AromaticContact NE2-CE1 3.54Å; H234-I280 VanDerWaalsContact CE1-CG2 3.47Å; H234-I280 WeakPolarHBondContact CE1-CG2 3.31Å
235	V	66.4	Low	61.3	Low	6 Å²	6	38 Å²	38	4%	0.036	20%	0.199	C	C	.	.			trans	-116.7	7.4	-169.8	-148.9	0	0	0	0	113.1	V756 T758 M782 L791 F792	V235-V756 HydrophobicContact CG1-CB 4.16Å; V235-V756 HydrophobicContact CG1-CG1 3.41Å; V235-V756 VanDerWaalsContact CG1-CG1 3.41Å; V235-V756 HydrophobicContact CG1-CG2 3.62Å; V235-T758 HydrophobicContact CG1-CG2 3.79Å; V235-M782 HydrophobicContact CB-CE 4.16Å; V235-M782 HydrophobicContact CG1-CE 3.76Å; V235-L791 HydrophobicContact CG2-CB 3.74Å; V235-L791 WeakPolarHBondContact CG2-O 3.26Å; V235-F792 HydrophobicContact CG2-CB 4.07Å
236	S	64.5	Low	58.6	Low	14 Å²	14	42.1 Å²	42.1	10%	0.098	21%	0.214	C	C	.	.			trans	-125.1	138.7	-168.6	-177.3	0	0	0	0	111.3	G238 Y813 V818	S236-G238 PolarHBondContact O-N 3.05Å; S236-G238 VanDerWaalsContact O-N 3.13Å; S236-Y813 WeakPolarHBondContact CB-OH 3.3Å; S236-Y813 PolarHBondContact OG-OH 3.05Å; S236-V818 WeakPolarHBondContact CA-O 3.45Å; S236-V818 PolarHBondContact OG-N 3.39Å; S236-V818 PolarHBondContact OG-O 3.39Å
237	L	57.4	Low	56.1	Low	32 Å²	32	47.1 Å²	47.1	17%	0.168	24%	0.24	C	C	.	.	S	Bend	trans	-81	14.9	-172.8	-44.8	178.2	0	0	0	113.4	T239 E759 V818 I820 S909	L237-T239 PolarHBondContact O-N 2.89Å; L237-E759 HydrophobicContact CD2-CG 3.68Å; L237-V818 HydrophobicContact CB-CG1 3.91Å; L237-V818 HydrophobicContact CD1-CG1 4.22Å; L237-V818 HydrophobicContact CG-CG1 4.26Å; L237-V818 PolarHBondContact N-O 2.65Å; L237-I820 HydrophobicContact CD1-CD1 3.61Å; L237-I820 HydrophobicContact CD1-CG1 3.9Å; L237-S909 WeakPolarHBondContact O-CB 3.35Å
238	G	55.2	Low	53.4	Low	1 Å²	1	47.9 Å²	47.9	1%	0.01	25%	0.246	C	C	.	.			trans	-81.8	22.1	177.6	0	0	0	0	0	114.2	S236 E240 R241	S236-G238 PolarHBondContact O-N 3.05Å; S236-G238 VanDerWaalsContact O-N 3.13Å; G238-E240 PolarHBondContact O-N 3.38Å; G238-R241 PolarHBondContact O-N 3.19Å
239	T	52.7	Low	51.1	Low	26 Å²	26	52.3 Å²	52.3	16%	0.16	26%	0.264	C	S	.	.	H	α-helix	trans	-56.5	-38.3	-157.9	37.5	0	0	0	0	115.2	L237 R241 Y242 L243 E759 F763	L237-T239 PolarHBondContact O-N 2.89Å; T239-R241 PolarHBondContact O-N 3.21Å; T239-Y242 PolarHBondContact O-N 3.04Å; T239-L243 WeakPolarHBondContact O-CB 3.39Å; T239-L243 WeakPolarHBondContact O-CG 3.3Å; T239-L243 PolarHBondContact O-N 2.82Å; T239-E759 WeakPolarHBondContact CG2-OE2 3.39Å; T239-E759 PolarHBondContact OG1-OE2 2.82Å; T239-F763 VanDerWaalsContact OG1-CE1 3.29Å; T239-F763 WeakPolarHBondContact OG1-CE1 3.1Å; T239-F763 WeakPolarHBondContact OG1-CZ 3.37Å
240	E	46.4	Very low	49.1	Very low	59 Å²	59	58 Å²	58	28%	0.276	28%	0.284	S	S	.	.	H	α-helix	trans	-62.3	-36.1	-176.9	-163.6	172.5	-111.7	0	0	113.5	G238 K914	G238-E240 PolarHBondContact O-N 3.38Å; E240-K914 IonicContact OE1-NZ 2.85Å; E240-K914 PolarHBondContact OE1-NZ 3.48Å; E240-K914 IonicContact OE2-NZ 3.72Å; E240-K914 PolarHBondContact OE2-NZ 3.27Å
241	R	48.5	Very low	46.9	Very low	31 Å²	31	63 Å²	63	12%	0.117	32%	0.315	C	S	.	.	H	α-helix	trans	-81.6	-15.1	174.5	-67	-173.6	-161.3	-162.7	12.3	113.8	G238 T239 R245 Y875 V907 A908 L910 V949	G238-R241 PolarHBondContact O-N 3.19Å; T239-R241 PolarHBondContact O-N 3.21Å; R241-R245 WeakPolarHBondContact O-CD 3.21Å; R241-Y875 PolarHBondContact NH1-O 2.83Å; R241-Y875 PolarHBondContact NH2-O 3.45Å; R241-V907 PolarHBondContact NH2-O 3.49Å; R241-A908 VanDerWaalsContact CD-O 3.22Å; R241-A908 WeakPolarHBondContact CD-O 3.37Å; R241-A908 VanDerWaalsContact CG-O 3.29Å; R241-A908 WeakPolarHBondContact CG-O 3.43Å; R241-A908 PolarHBondContact NE-O 2.87Å; R241-L910 PolarHBondContact NE-O 3.42Å; R241-L910 PolarHBondContact NH2-O 2.67Å; R241-V949 PolarHBondContact NH1-O 3.5Å
242	Y	44.4	Very low	45	Very low	43 Å²	43	65.4 Å²	65.4	17%	0.169	33%	0.332	C	S	.	.	H	α-helix	trans	-91.1	-42.9	-177.2	-138.3	-69.4	0	0	0	111	H234 T239 Q244 R245 W246 Y304	H234-Y242 AromaticContact CE1-CD1 3.9Å; H234-Y242 AromaticContact CE1-CE1 3.14Å; H234-Y242 WeakPolarHBondContact CE1-CE1 3.21Å; H234-Y242 AromaticContact CE1-CZ 3.48Å; H234-Y242 VanDerWaalsContact CE1-CZ 3.48Å; H234-Y242 AromaticContact ND1-CE1 3.76Å; H234-Y242 AromaticContact ND1-CZ 3.82Å; H234-Y242 AromaticContact NE2-CD1 3.98Å; H234-Y242 AromaticContact NE2-CE1 3.54Å; T239-Y242 PolarHBondContact O-N 3.04Å; Y242-Q244 PolarHBondContact O-N 3.23Å; Y242-R245 PolarHBondContact O-N 3.36Å; Y242-R245 VanDerWaalsContact O-N 3.09Å; Y242-W246 AromaticContact CD1-CD1 3.37Å; Y242-W246 HydrophobicContact CD1-CG 4.27Å; Y242-W246 AromaticContact CD1-NE1 3.84Å; Y242-W246 AromaticContact CE1-CD1 3.21Å; Y242-W246 HydrophobicContact CE1-CG 4.07Å; Y242-W246 AromaticContact CE1-NE1 3.22Å; Y242-W246 AromaticContact CZ-NE1 3.88Å; Y242-W246 PolarHBondContact O-N 3Å; Y242-Y304 HydrophobicContact CD2-CE1 4.16Å; Y242-Y304 WeakPolarHBondContact CD2-OH 3.14Å; Y242-Y304 AromaticContact CE2-CE1 3.52Å; Y242-Y304 HydrophobicContact CE2-CE1 3.52Å; Y242-Y304 AromaticContact CE2-CZ 3.68Å; Y242-Y304 WeakPolarHBondContact CE2-OH 3.19Å; Y242-Y304 AromaticContact CZ-CE1 3.81Å
243	L	43.9	Very low	43.2	Very low	98 Å²	98	69.7 Å²	69.7	51%	0.513	36%	0.363	S	S	.	.	H	α-helix	trans	-57.2	-48.4	175.4	-76.1	162.2	0	0	0	111.6	T239 R245 I247	T239-L243 WeakPolarHBondContact O-CB 3.39Å; T239-L243 WeakPolarHBondContact O-CG 3.3Å; T239-L243 PolarHBondContact O-N 2.82Å; L243-R245 PolarHBondContact O-N 2.99Å; L243-I247 HydrophobicContact CD2-CD1 4.3Å; L243-I247 WeakPolarHBondContact O-CB 3.21Å; L243-I247 WeakPolarHBondContact O-CG1 3.41Å; L243-I247 PolarHBondContact O-N 2.89Å
244	Q	41.3	Very low	41.4	Very low	152 Å²	152	72.8 Å²	72.8	71%	0.71	39%	0.391	S	S	*	.	H	α-helix	trans	-65.9	-1	177.1	-71.6	-164.4	-30.8	0	0	115.4	Y242	Y242-Q244 PolarHBondContact O-N 3.23Å
245	R	38.9	Very low	39.7	Very low	30 Å²	30	75.3 Å²	75.3	11%	0.113	41%	0.412	C	S	.	.	H	α-helix	trans	-116.2	-29	-177.6	-82.4	-176.1	172.5	149.1	-8.3	115.5	R241 Y242 L243 P947 A948 G951 V953	R241-R245 WeakPolarHBondContact O-CD 3.21Å; Y242-R245 PolarHBondContact O-N 3.36Å; Y242-R245 VanDerWaalsContact O-N 3.09Å; L243-R245 PolarHBondContact O-N 2.99Å; R245-P947 PolarHBondContact NH2-O 3.17Å; R245-A948 VanDerWaalsContact CZ-O 3.23Å; R245-A948 PolarHBondContact NH1-O 3.34Å; R245-A948 PolarHBondContact NH2-O 3.33Å; R245-G951 PolarHBondContact NE-O 3.28Å; R245-G951 VanDerWaalsContact NE-O 3.12Å; R245-V953 HydrophobicContact CG-CB 4.44Å
246	W	32.7	Very low	37.7	Very low	85 Å²	85	81.3 Å²	81.3	32%	0.322	46%	0.455	S	S	.	.	H	α-helix	trans	-105.6	-20	-178.7	-71.4	85.8	0	0	0	112.7	Y242 V248 P281 T664	Y242-W246 AromaticContact CD1-CD1 3.37Å; Y242-W246 HydrophobicContact CD1-CG 4.27Å; Y242-W246 AromaticContact CD1-NE1 3.84Å; Y242-W246 AromaticContact CE1-CD1 3.21Å; Y242-W246 HydrophobicContact CE1-CG 4.07Å; Y242-W246 AromaticContact CE1-NE1 3.22Å; Y242-W246 AromaticContact CZ-NE1 3.88Å; Y242-W246 PolarHBondContact O-N 3Å; W246-V248 PolarHBondContact O-N 2.92Å; W246-P281 HydrophobicContact CH2-CG 3.97Å; W246-P281 HydrophobicContact CZ3-CG 4.41Å; W246-T664 HydrophobicContact CH2-CG2 4.09Å; W246-T664 HydrophobicContact CZ3-CG2 4.12Å
247	I	32.3	Very low	35.9	Very low	105 Å²	105	84 Å²	84	54%	0.538	48%	0.484	S	S	.	.	S	Bend	trans	-70.9	105.7	152.6	-57.9	173.3	0	0	0	106.1	L243 Q249	L243-I247 HydrophobicContact CD2-CD1 4.3Å; L243-I247 WeakPolarHBondContact O-CB 3.21Å; L243-I247 WeakPolarHBondContact O-CG1 3.41Å; L243-I247 PolarHBondContact O-N 2.89Å; I247-Q249 PolarHBondContact O-N 3.28Å
248	V	29.7	Very low	34.3	Very low	60 Å²	60	88.8 Å²	88.8	36%	0.364	51%	0.51	S	S	.	.			trans	-56.8	131.9	167.1	171.8	0	0	0	0	107.3	W246 D250 P633	W246-V248 PolarHBondContact O-N 2.92Å; V248-D250 PolarHBondContact O-N 3.39Å; V248-P633 HydrophobicContact CG2-CB 4.21Å
249	Q	28.1	Very low	33	Very low	107 Å²	107	94.3 Å²	94.3	50%	0.5	55%	0.545	S	S	.	.			trans	-31.9	122.2	-168.4	-66.1	171.3	-70.1	0	0	113.9	I247 V251	I247-Q249 PolarHBondContact O-N 3.28Å; Q249-V251 VanDerWaalsContact C-N 3.29Å; Q249-V251 HydrophobicContact CB-CG2 4.18Å; Q249-V251 VanDerWaalsContact O-CG2 3.31Å; Q249-V251 WeakPolarHBondContact O-CG2 3.16Å; Q249-V251 PolarHBondContact O-N 2.85Å
250	D	26.2	Very low	31.9	Very low	161 Å²	161	97.6 Å²	97.6	86%	0.861	57%	0.569	S	S	*	*			trans	-64.1	92.5	162.9	-159.7	-3.5	0	0	0	107.5	V248 S252	V248-D250 PolarHBondContact O-N 3.39Å; D250-S252 VanDerWaalsContact C-N 3.25Å; D250-S252 PolarHBondContact O-N 2.88Å
251	V	25.1	Very low	31	Very low	115 Å²	115	98.8 Å²	98.8	70%	0.697	59%	0.59	S	S	*	*			trans	-76.2	80.5	-171.6	-175.3	0	0	0	0	109.8	Q249	Q249-V251 VanDerWaalsContact C-N 3.29Å; Q249-V251 HydrophobicContact CB-CG2 4.18Å; Q249-V251 VanDerWaalsContact O-CG2 3.31Å; Q249-V251 WeakPolarHBondContact O-CG2 3.16Å; Q249-V251 PolarHBondContact O-N 2.85Å
252	S	24.9	Very low	29.9	Very low	88 Å²	88	101.3 Å²	101.3	62%	0.615	61%	0.612	S	S	*	*	S	Bend	trans	42.1	121	149.9	61.8	0	0	0	0	118.4	D250	D250-S252 VanDerWaalsContact C-N 3.25Å; D250-S252 PolarHBondContact O-N 2.88Å
253	S	24.8	Very low	29.2	Very low	115 Å²	115	102.6 Å²	102.6	80%	0.804	63%	0.631	S	S	*	*			trans	74.6	77	163.2	69.2	0	0	0	0	117.7
254	V	23.7	Very low	28.4	Very low	144 Å²	144	102.2 Å²	102.2	87%	0.873	64%	0.642	S	S	*	*			trans	-91.4	116.8	134.6	-177.2	0	0	0	0	107.2
255	P	26.5	Very low	27.8	Very low	110 Å²	110	99.9 Å²	99.9	71%	0.714	64%	0.643	S	S	*	*			trans	-70.3	151.5	175	29.9	-33.9	0	0	0	110.7	G257	P255-G257 PolarHBondContact O-N 3.1Å; P255-G257 VanDerWaalsContact O-N 3.15Å
256	S	25.5	Very low	27.3	Very low	132 Å²	132	107.8 Å²	107.8	92%	0.923	67%	0.673	S	S	*	*			trans	-54.2	114.7	-176.3	53	0	0	0	0	113.4
257	G	25.2	Very low	27.1	Very low	69 Å²	69	108.9 Å²	108.9	71%	0.711	69%	0.693	S	S	*	*			trans	-142.5	134.2	174.4	0	0	0	0	0	111.9	P255	P255-G257 PolarHBondContact O-N 3.1Å; P255-G257 VanDerWaalsContact O-N 3.15Å
258	D	24.8	Very low	27.1	Very low	134 Å²	134	106.6 Å²	106.6	72%	0.717	69%	0.69	S	S	*	*			trans	42.4	105	171.1	-76.4	-9.4	0	0	0	120.4	S260	D258-S260 PolarHBondContact O-N 2.72Å
259	P	28.2	Very low	27.2	Very low	116 Å²	116	111.1 Å²	111.1	75%	0.753	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-64.8	-5	169	-22.2	34.4	0	0	0	116.1	A261 S262	P259-A261 PolarHBondContact O-N 3.38Å; P259-S262 PolarHBondContact O-OG 2.79Å
260	S	28.4	Very low	27.3	Very low	95 Å²	95	110 Å²	110	66%	0.664	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-73.6	-23.2	-163.9	58.3	0	0	0	0	115.1	D258 S262	D258-S260 PolarHBondContact O-N 2.72Å; S260-S262 VanDerWaalsContact C-N 3.32Å; S260-S262 PolarHBondContact O-N 2.94Å
261	A	28.1	Very low	27.7	Very low	85 Å²	85	108 Å²	108	70%	0.702	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-74.5	-16.1	-176.6	0	0	0	0	0	114.7	P259 A263	P259-A261 PolarHBondContact O-N 3.38Å; A261-A263 PolarHBondContact O-N 3.33Å
262	S	26.4	Very low	28.6	Very low	83 Å²	83	108.6 Å²	108.6	58%	0.58	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-73.6	8.9	-168.3	64.3	0	0	0	0	116.4	P259 S260 R266	P259-S262 PolarHBondContact O-OG 2.79Å; S260-S262 VanDerWaalsContact C-N 3.32Å; S260-S262 PolarHBondContact O-N 2.94Å; S262-R266 PolarHBondContact O-NH2 3.29Å
263	A	28	Very low	29.4	Very low	70 Å²	70	109.9 Å²	109.9	58%	0.579	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-89.3	-39.8	179.8	0	0	0	0	0	113.7	A261 S265	A261-A263 PolarHBondContact O-N 3.33Å; A263-S265 PolarHBondContact O-N 2.97Å
264	A	28.9	Very low	30.7	Very low	90 Å²	90	106.2 Å²	106.2	74%	0.744	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-72	-26	-166.1	0	0	0	0	0	114.8	R266	A264-R266 PolarHBondContact O-N 2.92Å; A264-R266 VanDerWaalsContact O-N 3.16Å
265	S	28.5	Very low	32.3	Very low	103 Å²	103	103.8 Å²	103.8	72%	0.72	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-74.1	-3.2	-172.6	-165.5	0	0	0	0	115.4	A263 S267	A263-S265 PolarHBondContact O-N 2.97Å; S265-S267 VanDerWaalsContact C-N 3.33Å; S265-S267 PolarHBondContact O-N 3.48Å
266	R	27.7	Very low	34.1	Very low	197 Å²	197	98.6 Å²	98.6	74%	0.743	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-85.8	9.9	-168.3	-90.3	176.9	-89.3	-178.7	-8.7	116.1	S262 A264	S262-R266 PolarHBondContact O-NH2 3.29Å; A264-R266 PolarHBondContact O-N 2.92Å; A264-R266 VanDerWaalsContact O-N 3.16Å
267	S	28.9	Very low	36.2	Very low	108 Å²	108	97 Å²	97	76%	0.755	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-91.5	14	175.9	-162.8	0	0	0	0	114.6	S265 K269	S265-S267 VanDerWaalsContact C-N 3.33Å; S265-S267 PolarHBondContact O-N 3.48Å; S267-K269 PolarHBondContact O-N 2.82Å
268	A	31.1	Very low	38.2	Very low	56 Å²	56	93.9 Å²	93.9	46%	0.463	56%	0.564	S	S	.	*			trans	-73.6	-10	-166.7	0	0	0	0	0	116.8	A270 K271	A268-A270 PolarHBondContact O-N 2.86Å; A268-K271 PolarHBondContact O-N 2.98Å; A268-K271 VanDerWaalsContact O-N 3.11Å
269	K	31.5	Very low	40	Very low	155 Å²	155	92 Å²	92	67%	0.674	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	13.7	-174.8	-79.8	-171.9	175.1	179.1	0	115.8	S267 E1285	S267-K269 PolarHBondContact O-N 2.82Å; K269-E1285 IonicContact NZ-OE2 2.64Å; K269-E1285 PolarHBondContact NZ-OE2 2.85Å
270	A	30.1	Very low	41.5	Very low	83 Å²	83	87 Å²	87	69%	0.686	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.5	4.9	175.8	0	0	0	0	0	114	A268	A268-A270 PolarHBondContact O-N 2.86Å
271	K	36.2	Very low	42.8	Very low	120 Å²	120	83.3 Å²	83.3	52%	0.522	49%	0.488	S	S	.	.			trans	-88.3	-22.4	-173	-88.3	-160.2	167.8	-158.6	0	115.8	A268 S273 T274 E275	A268-K271 PolarHBondContact O-N 2.98Å; A268-K271 VanDerWaalsContact O-N 3.11Å; K271-S273 PolarHBondContact O-N 3.16Å; K271-T274 PolarHBondContact O-N 3.41Å; K271-T274 PolarHBondContact O-OG1 2.92Å; K271-E275 PolarHBondContact O-N 2.64Å
272	D	43.4	Very low	44.1	Very low	128 Å²	128	79.9 Å²	79.9	68%	0.684	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-49	-34.4	-171.6	-59.7	23.1	0	0	0	114.2	T274	D272-T274 VanDerWaalsContact C-N 3.3Å; D272-T274 PolarHBondContact O-N 3.36Å
273	S	42.3	Very low	45.7	Very low	114 Å²	114	76.1 Å²	76.1	80%	0.797	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-73.1	-14.6	179.3	60.2	0	0	0	0	115.2	K271	K271-S273 PolarHBondContact O-N 3.16Å
274	T	50.6	Low	47	Very low	38 Å²	38	73.6 Å²	73.6	23%	0.233	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-107	-8.4	179.1	61.1	0	0	0	0	113.1	K271 D272	K271-T274 PolarHBondContact O-N 3.41Å; K271-T274 PolarHBondContact O-OG1 2.92Å; D272-T274 VanDerWaalsContact C-N 3.3Å; D272-T274 PolarHBondContact O-N 3.36Å
275	E	58.8	Low	48.2	Very low	93 Å²	93	69.9 Å²	69.9	44%	0.435	38%	0.379	S	S	.	.			trans	-73.3	137.6	-170	-169.9	156.3	-123.1	0	0	113.3	P231 K271 W277	P231-E275 HydrophobicContact CG-CG 4.01Å; K271-E275 PolarHBondContact O-N 2.64Å; E275-W277 HydrophobicContact CG-CZ2 4.43Å; E275-W277 PolarHBondContact O-N 3.37Å; E275-W277 VanDerWaalsContact OE2-CZ2 3.25Å; E275-W277 WeakPolarHBondContact OE2-CZ2 3.49Å; E275-W277 PolarHBondContact OE2-NE1 2.95Å
276	T	62.9	Low	49.7	Very low	2 Å²	2	65 Å²	65	1%	0.012	35%	0.345	C	S	.	.			trans	-98.4	70.6	-162.2	-25.9	0	0	0	0	111.1	K212 H278 A627	K212-T276 PolarHBondContact NZ-OG1 3.47Å; T276-H278 PolarHBondContact O-N 2.96Å; T276-A627 HydrophobicContact CG2-CB 4.49Å
277	W	70	Confident	51.4	Low	97 Å²	97	56.3 Å²	56.3	37%	0.367	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-71.1	122	-176.7	-65.3	90	0	0	0	112.5	P231 R233 E275	P231-W277 HydrophobicContact CB-CD2 4.5Å; P231-W277 HydrophobicContact CB-CE3 3.86Å; P231-W277 HydrophobicContact CB-CH2 4Å; P231-W277 HydrophobicContact CB-CZ3 3.61Å; P231-W277 HydrophobicContact CG-CD2 4.12Å; P231-W277 HydrophobicContact CG-CE3 3.97Å; P231-W277 HydrophobicContact CG-CH2 4.26Å; P231-W277 HydrophobicContact CG-CZ2 4.36Å; P231-W277 HydrophobicContact CG-CZ3 4.08Å; P231-W277 WeakPolarHBondContact O-CA 3.49Å; R233-W277 HydrophobicContact CB-CD2 4.2Å; R233-W277 HydrophobicContact CB-CE3 3.53Å; R233-W277 HydrophobicContact CB-CZ3 4.04Å; R233-W277 HydrophobicContact CG-CD2 4.34Å; R233-W277 HydrophobicContact CG-CE3 3.89Å; R233-W277 HydrophobicContact CG-CZ3 4.12Å; E275-W277 HydrophobicContact CG-CZ2 4.43Å; E275-W277 PolarHBondContact O-N 3.37Å; E275-W277 VanDerWaalsContact OE2-CZ2 3.25Å; E275-W277 WeakPolarHBondContact OE2-CZ2 3.49Å; E275-W277 PolarHBondContact OE2-NE1 2.95Å
278	H	67.9	Low	53.3	Low	4 Å²	4	52.4 Å²	52.4	2%	0.019	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-80.2	149.2	165.6	-78.1	-102	0	0	0	110.8	E226 E230 P231 R233 T276 G629	E226-H278 IonicContact OE1-CE1 3.64Å; E226-H278 IonicContact OE1-NE2 2.91Å; E226-H278 IonicContact OE2-CE1 2.74Å; E226-H278 PolarHBondContact OE2-CE1 3.45Å; E226-H278 IonicContact OE2-NE2 2.6Å; E230-H278 VanDerWaalsContact CB-CD2 3.46Å; E230-H278 WeakPolarHBondContact CB-CD2 3.47Å; P231-H278 PolarHBondContact O-N 2.99Å; R233-H278 PolarHBondContact N-O 3.48Å; T276-H278 PolarHBondContact O-N 2.96Å; H278-G629 PolarHBondContact ND1-O 2.92Å
279	R	62.8	Low	55.3	Low	94 Å²	94	49.8 Å²	49.8	36%	0.355	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-67.9	145.7	169.5	-66.2	171.2	175.1	154.6	-6	109.5	E312	R279-E312 IonicContact CZ-OE2 2.84Å; R279-E312 IonicContact NH1-OE2 3.89Å; R279-E312 PolarHBondContact NH1-OE2 3.35Å
280	I	59.3	Low	57.1	Low	11 Å²	11	42.5 Å²	42.5	6%	0.056	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-60.1	140.9	166.6	63.8	168.8	0	0	0	109.1	T232 H234 S282 A283 L791 F792	T232-I280 HydrophobicContact CG2-CB 4.3Å; T232-I280 HydrophobicContact CG2-CG2 3.64Å; H234-I280 VanDerWaalsContact CE1-CG2 3.47Å; H234-I280 WeakPolarHBondContact CE1-CG2 3.31Å; I280-S282 VanDerWaalsContact C-N 3.33Å; I280-S282 WeakPolarHBondContact CD1-OG 3.3Å; I280-S282 PolarHBondContact O-N 3.43Å; I280-A283 HydrophobicContact CD1-CB 4.34Å; I280-A283 HydrophobicContact CG1-CB 3.48Å; I280-A283 VanDerWaalsContact CG1-CB 3.48Å; I280-A283 VanDerWaalsContact O-CB 3.28Å; I280-A283 WeakPolarHBondContact O-CB 3.39Å; I280-A283 PolarHBondContact O-N 3.22Å; I280-L791 WeakPolarHBondContact CD1-O 3.33Å; I280-F792 HydrophobicContact CD1-CD2 4.25Å
281	P	54.7	Low	58.6	Low	18 Å²	18	41.2 Å²	41.2	12%	0.117	21%	0.214	C	C	.	.	H	α-helix	trans	-53.6	-40.6	-176.8	-35.1	41	0	0	0	115.2	W246 A283 A284 Q308 T664	W246-P281 HydrophobicContact CH2-CG 3.97Å; W246-P281 HydrophobicContact CZ3-CG 4.41Å; P281-A283 PolarHBondContact O-N 2.7Å; P281-A284 PolarHBondContact O-N 2.81Å; P281-A284 VanDerWaalsContact O-N 3.15Å; P281-Q308 HydrophobicContact CB-CB 4.28Å; P281-Q308 HydrophobicContact CB-CG 4.05Å; P281-T664 HydrophobicContact CG-CG2 4.24Å
282	S	57.2	Low	59.3	Low	13 Å²	13	37.8 Å²	37.8	9%	0.091	20%	0.201	C	C	.	.	H	α-helix	trans	-67	-18.6	176.2	67	0	0	0	0	114.5	I280 A284 E285 A286 C793	I280-S282 VanDerWaalsContact C-N 3.33Å; I280-S282 WeakPolarHBondContact CD1-OG 3.3Å; I280-S282 PolarHBondContact O-N 3.43Å; S282-A284 VanDerWaalsContact C-N 3.3Å; S282-E285 PolarHBondContact O-N 2.89Å; S282-A286 PolarHBondContact O-N 2.99Å; S282-C793 VanDerWaalsContact O-CB 3.28Å; S282-C793 WeakPolarHBondContact O-CB 3.48Å; S282-C793 PolarHBondContact OG-O 3.45Å
283	A	59.3	Low	59.3	Low	5 Å²	5	33.6 Å²	33.6	4%	0.041	19%	0.188	C	C	.	.	H	α-helix	trans	-75.1	-19.8	175.8	0	0	0	0	0	112.8	I280 P281 A286 T790	I280-A283 HydrophobicContact CD1-CB 4.34Å; I280-A283 HydrophobicContact CG1-CB 3.48Å; I280-A283 VanDerWaalsContact CG1-CB 3.48Å; I280-A283 VanDerWaalsContact O-CB 3.28Å; I280-A283 WeakPolarHBondContact O-CB 3.39Å; I280-A283 PolarHBondContact O-N 3.22Å; P281-A283 PolarHBondContact O-N 2.7Å; A283-A286 WeakPolarHBondContact O-CB 3.4Å; A283-T790 HydrophobicContact CB-CG2 3.58Å; A283-T790 WeakPolarHBondContact CB-O 3.18Å
284	A	54	Low	59.3	Low	17 Å²	17	35.2 Å²	35.2	14%	0.14	19%	0.188	C	C	.	.	H	α-helix	trans	-74.8	-36.1	170.9	0	0	0	0	0	111.4	P281 S282 A286 V310 E312	P281-A284 PolarHBondContact O-N 2.81Å; P281-A284 VanDerWaalsContact O-N 3.15Å; S282-A284 VanDerWaalsContact C-N 3.3Å; A284-A286 VanDerWaalsContact C-N 3.29Å; A284-A286 PolarHBondContact O-N 3.29Å; A284-V310 HydrophobicContact CB-CB 3.92Å; A284-V310 HydrophobicContact CB-CG1 3.82Å; A284-V310 HydrophobicContact CB-CG2 3.91Å; A284-E312 HydrophobicContact CB-CG 4.23Å
285	E	54.3	Low	58.9	Low	11 Å²	11	38.5 Å²	38.5	5%	0.051	21%	0.208	C	C	.	.	H	α-helix	trans	-68	-27.8	175.8	-61.3	-179.9	-169.9	0	0	112.8	S282 C287 L297 V310	S282-E285 PolarHBondContact O-N 2.89Å; E285-C287 PolarHBondContact O-N 2.74Å; E285-L297 VanDerWaalsContact OE2-CD2 3.27Å; E285-L297 WeakPolarHBondContact OE2-CD2 3.48Å; E285-V310 HydrophobicContact CG-CG2 3.44Å; E285-V310 VanDerWaalsContact CG-CG2 3.44Å
286	A	60.1	Low	58.3	Low	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-14.2	-172.5	0	0	0	0	0	116	C119 S282 A283 A284 V288 L289 V781 T790 C793	C119-A286 PolarHBondContact SG-O 3.12Å; C119-A286 VanDerWaalsContact SG-O 3.37Å; S282-A286 PolarHBondContact O-N 2.99Å; A283-A286 WeakPolarHBondContact O-CB 3.4Å; A284-A286 VanDerWaalsContact C-N 3.29Å; A284-A286 PolarHBondContact O-N 3.29Å; A286-V288 PolarHBondContact O-N 2.98Å; A286-L289 WeakPolarHBondContact O-CD2 3.46Å; A286-V781 HydrophobicContact CB-CG1 4.08Å; A286-V781 HydrophobicContact CB-CG2 4.14Å; A286-T790 HydrophobicContact CB-CG2 4.02Å; A286-C793 HydrophobicContact CB-CB 3.66Å; A286-C793 VanDerWaalsContact CB-SG 3.53Å
287	C	63.6	Low	57.4	Low	16 Å²	16	40.7 Å²	40.7	11%	0.108	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	10.3	-165.8	-148.1	0	0	0	0	114.3	D118 H120 E285 H316	D118-C287 WeakPolarHBondContact CB-O 3.44Å; H120-C287 VanDerWaalsContact CD2-SG 3.55Å; E285-C287 PolarHBondContact O-N 2.74Å; C287-H316 PolarHBondContact O-CE1 3.12Å; C287-H316 PolarHBondContact O-ND1 3.1Å; C287-H316 VanDerWaalsContact O-ND1 3.11Å; C287-H316 VanDerWaalsContact SG-CE1 3.5Å; C287-H316 PolarHBondContact SG-NE2 3.36Å
288	V	69.4	Low	56.4	Low	26 Å²	26	37.8 Å²	37.8	16%	0.158	22%	0.216	C	C	.	.			trans	-135.2	122.3	159.8	175	0	0	0	0	109.1	Y117 A286 E290 H316 Y779	Y117-V288 HydrophobicContact CE1-CG1 4.03Å; Y117-V288 HydrophobicContact CE1-CG2 4.32Å; Y117-V288 HydrophobicContact CE2-CG1 4.05Å; Y117-V288 WeakPolarHBondContact OH-CG1 3.33Å; A286-V288 PolarHBondContact O-N 2.98Å; V288-E290 VanDerWaalsContact CG1-O 3.31Å; V288-E290 WeakPolarHBondContact CG1-O 3.46Å; V288-H316 WeakPolarHBondContact CG2-ND1 3.47Å; V288-Y779 WeakPolarHBondContact O-CE2 3.48Å
289	L	73.1	Confident	55.7	Low	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.239	C	C	.	.			trans	-98.2	-18.8	-170	-60.2	168.4	0	0	0	113.6	Y117 I122 A286 A749 S776 V781	Y117-L289 WeakPolarHBondContact O-CB 3.26Å; Y117-L289 PolarHBondContact O-N 3.45Å; I122-L289 HydrophobicContact CD1-CD1 3.61Å; A286-L289 WeakPolarHBondContact O-CD2 3.46Å; L289-A749 HydrophobicContact CB-CB 4.39Å; L289-A749 HydrophobicContact CD1-CB 3.66Å; L289-S776 WeakPolarHBondContact O-CB 3.23Å; L289-S776 PolarHBondContact O-OG 2.86Å; L289-V781 HydrophobicContact CD2-CB 4.3Å; L289-V781 HydrophobicContact CD2-CG2 3.54Å
290	E	68.5	Low	56.1	Low	2 Å²	2	42.2 Å²	42.2	1%	0.009	25%	0.247	C	C	.	.	S	Bend	trans	-99.3	119.3	167	-68.3	-173	-157.6	0	0	110.4	Y117 V288 L292 R369 R747	Y117-E290 HydrophobicContact CD2-CB 3.96Å; Y117-E290 HydrophobicContact CD2-CG 4.09Å; Y117-E290 HydrophobicContact CE2-CB 3.97Å; V288-E290 VanDerWaalsContact CG1-O 3.31Å; V288-E290 WeakPolarHBondContact CG1-O 3.46Å; E290-L292 PolarHBondContact O-N 3.04Å; E290-R369 IonicContact OE1-NH1 3.34Å; E290-R369 PolarHBondContact OE1-NH1 2.81Å; E290-R369 IonicContact OE2-CZ 3.84Å; E290-R369 IonicContact OE2-NH1 3.36Å; E290-R369 PolarHBondContact OE2-NH1 3.3Å; E290-R369 IonicContact OE2-NH2 3.84Å; E290-R369 PolarHBondContact OE2-NH2 2.71Å; E290-R747 HydrophobicContact CG-CB 4.08Å
291	N	61.3	Low	56.9	Low	57 Å²	57	43.3 Å²	43.3	31%	0.305	25%	0.253	S	S	.	.			trans	-71.3	99	176.1	-174.3	-5.2	0	0	0	111.5	G293 N294 D778	N291-G293 PolarHBondContact O-N 3.45Å; N291-G293 WeakPolarHBondContact OD1-CA 3.22Å; N291-G293 PolarHBondContact OD1-N 2.72Å; N291-N294 PolarHBondContact OD1-N 2.79Å; N291-D778 HydrophobicContact CB-CB 4.33Å; N291-D778 VanDerWaalsContact CB-OD2 3.23Å; N291-D778 WeakPolarHBondContact CB-OD2 3.38Å; N291-D778 PolarHBondContact N-OD2 3.39Å
292	L	51.7	Low	57.8	Low	48 Å²	48	42.5 Å²	42.5	25%	0.251	25%	0.248	S	C	.	.			trans	-80.5	9.8	174.5	-61.6	-174.6	0	0	0	114	Y117 E290 F319 H323	Y117-L292 HydrophobicContact CE2-CD1 3.85Å; Y117-L292 HydrophobicContact CE2-CG 4.18Å; Y117-L292 VanDerWaalsContact OH-CD1 3.27Å; Y117-L292 WeakPolarHBondContact OH-CD1 3.48Å; E290-L292 PolarHBondContact O-N 3.04Å; L292-F319 HydrophobicContact CB-CE1 4.43Å; L292-F319 HydrophobicContact CD1-CD1 4.4Å; L292-F319 HydrophobicContact CD1-CE1 3.92Å; L292-H323 HydrophobicContact CD1-CB 4.1Å
293	G	42.6	Very low	58.3	Low	39 Å²	39	42.7 Å²	42.7	40%	0.402	25%	0.251	S	S	.	.	S	Bend	trans	123.9	103.4	166.8	0	0	0	0	0	114.3	N291 V295	N291-G293 PolarHBondContact O-N 3.45Å; N291-G293 WeakPolarHBondContact OD1-CA 3.22Å; N291-G293 PolarHBondContact OD1-N 2.72Å; G293-V295 WeakPolarHBondContact O-CG2 3.49Å; G293-V295 PolarHBondContact O-N 2.73Å
294	N	43.5	Very low	58.6	Low	149 Å²	149	43.8 Å²	43.8	80%	0.797	25%	0.254	S	S	*	.	S	Bend	trans	52.6	3.8	153.3	-62.2	-1.5	0	0	0	120.6	N291 Y296	N291-N294 PolarHBondContact OD1-N 2.79Å; N294-Y296 PolarHBondContact O-N 2.91Å
295	V	42.4	Very low	59.3	Low	107 Å²	107	45.1 Å²	45.1	65%	0.648	26%	0.255	S	S	*	.	S	Bend	trans	-73.2	-27.3	-169.4	168.3	0	0	0	0	114.7	G293	G293-V295 WeakPolarHBondContact O-CG2 3.49Å; G293-V295 PolarHBondContact O-N 2.73Å
296	Y	44.9	Very low	59.5	Low	97 Å²	97	45.1 Å²	45.1	38%	0.38	26%	0.255	S	S	.	.	S	Bend	trans	-122.7	-24.6	-172.8	-64.6	-63	0	0	0	117.1	N294	N294-Y296 PolarHBondContact O-N 2.91Å
297	L	45.3	Very low	59	Low	43 Å²	43	48 Å²	48	23%	0.225	27%	0.274	C	S	.	.			trans	-103.1	126.6	-174.9	-68.6	-170.4	0	0	0	115	E285 G299 Q306 Y779	E285-L297 VanDerWaalsContact OE2-CD2 3.27Å; E285-L297 WeakPolarHBondContact OE2-CD2 3.48Å; L297-G299 VanDerWaalsContact C-N 3.27Å; L297-G299 PolarHBondContact O-N 3.42Å; L297-Q306 HydrophobicContact CD2-CB 4.16Å; L297-Q306 HydrophobicContact CD2-CG 3.96Å; L297-Y779 HydrophobicContact CD1-CE1 3.83Å; L297-Y779 WeakPolarHBondContact CD1-OH 3.18Å
298	G	47.9	Very low	58.4	Low	37 Å²	37	48.5 Å²	48.5	38%	0.381	28%	0.275	S	S	.	.			trans	-77.9	53.4	176.9	0	0	0	0	0	115.2	L301	G298-L301 WeakPolarHBondContact O-CD1 3.37Å; G298-L301 WeakPolarHBondContact O-CG 3.49Å
299	G	53.6	Low	57.5	Low	48 Å²	48	49.1 Å²	49.1	50%	0.495	28%	0.277	S	S	.	.	S	Bend	trans	78.4	-167.8	-179.1	0	0	0	0	0	114	L297 L301	L297-G299 VanDerWaalsContact C-N 3.27Å; L297-G299 PolarHBondContact O-N 3.42Å; G299-L301 PolarHBondContact O-N 2.82Å
300	R	71.6	Confident	56.6	Low	142 Å²	142	49.4 Å²	49.4	54%	0.536	28%	0.278	S	S	.	.	S	Bend	trans	-80.4	41.2	-176.6	-47.8	-175.8	-137.7	-94.9	-2.1	113.5	E942	R300-E942 HydrophobicContact CB-CB 3.86Å; R300-E942 HydrophobicContact CB-CG 4.42Å; R300-E942 WeakPolarHBondContact CB-OE2 3.49Å; R300-E942 VanDerWaalsContact CD-OE1 3.26Å; R300-E942 WeakPolarHBondContact CD-OE1 3.3Å; R300-E942 IonicContact CZ-OE1 3.66Å; R300-E942 IonicContact NE-OE1 2.82Å; R300-E942 PolarHBondContact NE-OE1 2.78Å; R300-E942 IonicContact NE-OE2 2.74Å; R300-E942 VanDerWaalsContact O-CB 3.3Å; R300-E942 WeakPolarHBondContact O-CB 3.1Å; R300-E942 PolarHBondContact O-N 3.37Å
301	L	75.9	Confident	56	Low	35 Å²	35	50 Å²	50	18%	0.183	28%	0.282	C	S	.	.			trans	-81	158.7	175.6	-57.3	-179.2	0	0	0	110.1	G298 G299 R305 Q306 H797 D943	G298-L301 WeakPolarHBondContact O-CD1 3.37Å; G298-L301 WeakPolarHBondContact O-CG 3.49Å; G299-L301 PolarHBondContact O-N 2.82Å; L301-R305 HydrophobicContact CB-CB 3.82Å; L301-R305 HydrophobicContact CD1-CB 4.11Å; L301-Q306 PolarHBondContact O-NE2 2.94Å; L301-H797 PolarHBondContact O-NE2 2.94Å; L301-H797 VanDerWaalsContact O-NE2 3.16Å; L301-D943 HydrophobicContact CD2-CB 4Å
302	C	74.6	Confident	55.7	Low	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.272	C	S	.	.			trans	-67.2	162.5	170.8	55.4	0	0	0	0	111.9	Y304 R305 Q306 D814 H815 C941	C302-Y304 VanDerWaalsContact C-N 3.27Å; C302-Y304 HydrophobicContact CB-CD2 4.33Å; C302-Y304 PolarHBondContact O-N 3.34Å; C302-R305 PolarHBondContact O-N 3.35Å; C302-Q306 PolarHBondContact O-N 2.93Å; C302-D814 WeakPolarHBondContact CA-OD1 3.31Å; C302-D814 HydrophobicContact CB-CB 3.96Å; C302-D814 WeakPolarHBondContact CB-OD1 3.43Å; C302-D814 WeakPolarHBondContact CB-OD2 3.33Å; C302-H815 PolarHBondContact SG-NE2 2.73Å; C302-C941 HydrophobicContact CB-CB 3.78Å; C302-C941 PolarHBondContact N-SG 2.84Å; C302-C941 VanDerWaalsContact N-SG 3.4Å
303	A	67.4	Low	55.8	Low	18 Å²	18	49.1 Å²	49.1	15%	0.149	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-52	-43.9	-176.9	0	0	0	0	0	112.9	R305 Q306 Q308 D814	A303-R305 PolarHBondContact O-N 2.86Å; A303-Q306 PolarHBondContact O-N 2.69Å; A303-Q306 VanDerWaalsContact O-N 3.12Å; A303-Q308 PolarHBondContact O-NE2 2.97Å; A303-D814 PolarHBondContact N-OD2 3.23Å
304	Y	64.2	Low	56.4	Low	27 Å²	27	48.4 Å²	48.4	11%	0.106	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-56.4	-18	177.2	-51.2	-85.9	0	0	0	115.6	Y242 C302 S661 D817 A948	Y242-Y304 HydrophobicContact CD2-CE1 4.16Å; Y242-Y304 WeakPolarHBondContact CD2-OH 3.14Å; Y242-Y304 AromaticContact CE2-CE1 3.52Å; Y242-Y304 HydrophobicContact CE2-CE1 3.52Å; Y242-Y304 AromaticContact CE2-CZ 3.68Å; Y242-Y304 WeakPolarHBondContact CE2-OH 3.19Å; Y242-Y304 AromaticContact CZ-CE1 3.81Å; C302-Y304 VanDerWaalsContact C-N 3.27Å; C302-Y304 HydrophobicContact CB-CD2 4.33Å; C302-Y304 PolarHBondContact O-N 3.34Å; Y304-S661 PolarHBondContact O-OG 3.29Å; Y304-D817 PolarHBondContact OH-OD2 2.91Å; Y304-A948 HydrophobicContact CD2-CB 3.77Å; Y304-A948 HydrophobicContact CG-CB 3.79Å
305	R	68.8	Low	56.9	Low	46 Å²	46	43.8 Å²	43.8	17%	0.174	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-116.4	-5.3	-175.9	-75.2	-74	-67	-74.7	2.2	113.2	L301 C302 A303 S661 D943 C946 P947	L301-R305 HydrophobicContact CB-CB 3.82Å; L301-R305 HydrophobicContact CD1-CB 4.11Å; C302-R305 PolarHBondContact O-N 3.35Å; A303-R305 PolarHBondContact O-N 2.86Å; R305-S661 VanDerWaalsContact CD-OG 3.28Å; R305-S661 WeakPolarHBondContact CD-OG 3.42Å; R305-D943 IonicContact CZ-OD2 3.26Å; R305-D943 IonicContact NH1-OD2 3.85Å; R305-D943 PolarHBondContact NH1-OD2 3.16Å; R305-D943 IonicContact NH2-OD2 3.76Å; R305-D943 PolarHBondContact NH2-OD2 3.35Å; R305-C946 VanDerWaalsContact CG-SG 3.58Å; R305-C946 PolarHBondContact NH1-SG 3.01Å; R305-P947 VanDerWaalsContact NH1-CD 3.32Å
306	Q	58.1	Low	58	Low	10 Å²	10	39.1 Å²	39.1	5%	0.047	21%	0.208	C	C	.	.	S	Bend	trans	-73.7	140.9	170.4	-68.9	165.8	-3.2	0	0	108.8	L297 L301 C302 A303 Q308	L297-Q306 HydrophobicContact CD2-CB 4.16Å; L297-Q306 HydrophobicContact CD2-CG 3.96Å; L301-Q306 PolarHBondContact O-NE2 2.94Å; C302-Q306 PolarHBondContact O-N 2.93Å; A303-Q306 PolarHBondContact O-N 2.69Å; A303-Q306 VanDerWaalsContact O-N 3.12Å; Q306-Q308 PolarHBondContact O-N 3.45Å; Q306-Q308 VanDerWaalsContact O-N 3.15Å; Q306-Q308 PolarHBondContact O-NE2 3.44Å
307	P	49.6	Very low	59.1	Low	62 Å²	62	34.6 Å²	34.6	40%	0.403	19%	0.192	S	C	.	.			trans	-76.5	105.6	-174.3	30.4	-32.5	0	0	0	110.1	L309	P307-L309 PolarHBondContact O-N 3.49Å
308	Q	51.9	Low	60.2	Low	25 Å²	25	32.6 Å²	32.6	12%	0.117	18%	0.181	C	C	.	.			trans	-67.9	36.8	-173	-54.5	-57.7	-51.6	0	0	115	P281 A303 Q306 V310 N665 S666	P281-Q308 HydrophobicContact CB-CB 4.28Å; P281-Q308 HydrophobicContact CB-CG 4.05Å; A303-Q308 PolarHBondContact O-NE2 2.97Å; Q306-Q308 PolarHBondContact O-N 3.45Å; Q306-Q308 VanDerWaalsContact O-N 3.15Å; Q306-Q308 PolarHBondContact O-NE2 3.44Å; Q308-V310 PolarHBondContact O-N 2.72Å; Q308-N665 CarbonylContact O-C 3.56Å; Q308-N665 PolarHBondContact O-N 2.71Å; Q308-S666 PolarHBondContact O-OG 2.66Å
309	L	50.9	Low	61.3	Low	40 Å²	40	35.8 Å²	35.8	21%	0.209	19%	0.185	C	C	.	.			trans	-90.9	81.5	-176.6	-171.2	124.2	0	0	0	110.3	P307 Q542 N665 H667	P307-L309 PolarHBondContact O-N 3.49Å; L309-Q542 VanDerWaalsContact CD1-NE2 3.31Å; L309-N665 VanDerWaalsContact CA-O 3.27Å; L309-N665 WeakPolarHBondContact CA-O 2.99Å; L309-N665 HydrophobicContact CB-CB 3.9Å; L309-N665 HydrophobicContact CD1-CB 4.27Å; L309-N665 WeakPolarHBondContact CD1-O 3.42Å; L309-N665 WeakPolarHBondContact CD1-OD1 3.44Å; L309-N665 VanDerWaalsContact CG-O 3.26Å; L309-N665 WeakPolarHBondContact CG-O 3.4Å; L309-H667 WeakPolarHBondContact CD1-NE2 3.35Å; L309-H667 WeakPolarHBondContact CD2-NE2 3.44Å; L309-H667 WeakPolarHBondContact CG-NE2 3.3Å
310	V	53.4	Low	62.3	Low	5 Å²	5	33.5 Å²	33.5	3%	0.03	16%	0.161	C	C	.	.			trans	-111.6	124.1	-179.5	-152	0	0	0	0	110.9	A284 E285 Q308 H667 N671	A284-V310 HydrophobicContact CB-CB 3.92Å; A284-V310 HydrophobicContact CB-CG1 3.82Å; A284-V310 HydrophobicContact CB-CG2 3.91Å; E285-V310 HydrophobicContact CG-CG2 3.44Å; E285-V310 VanDerWaalsContact CG-CG2 3.44Å; Q308-V310 PolarHBondContact O-N 2.72Å; V310-H667 PolarHBondContact O-N 2.82Å; V310-N671 PolarHBondContact O-ND2 3.4Å
311	I	55.6	Low	62.8	Low	16 Å²	16	26.8 Å²	26.8	8%	0.082	14%	0.136	C	C	.	.			trans	-82.6	112.7	156.1	-67.2	149.6	0	0	0	105.5	H313 Y544 H667 I670	I311-H313 PolarHBondContact O-N 3.29Å; I311-Y544 HydrophobicContact CD1-CD2 4.45Å; I311-Y544 HydrophobicContact CD1-CE2 3.48Å; I311-Y544 VanDerWaalsContact CD1-CE2 3.48Å; I311-H667 HydrophobicContact CG1-CB 3.89Å; I311-H667 WeakPolarHBondContact CG1-ND1 3.48Å; I311-I670 HydrophobicContact CG2-CG2 3.86Å
312	E	55.4	Low	62.8	Low	22 Å²	22	29.7 Å²	29.7	10%	0.103	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-64.5	137.1	178.8	-80.9	176.4	-87.9	0	0	110.1	R279 A284 G629 N671 N674	R279-E312 IonicContact CZ-OE2 2.84Å; R279-E312 IonicContact NH1-OE2 3.89Å; R279-E312 PolarHBondContact NH1-OE2 3.35Å; A284-E312 HydrophobicContact CB-CG 4.23Å; E312-G629 PolarHBondContact OE1-N 2.79Å; E312-N671 HydrophobicContact CB-CB 4.36Å; E312-N671 WeakPolarHBondContact CG-ND2 3.29Å; E312-N671 PolarHBondContact N-OD1 2.81Å; E312-N671 PolarHBondContact OE1-ND2 3.16Å; E312-N674 PolarHBondContact O-ND2 3.02Å
313	H	54.8	Low	62.9	Low	64 Å²	64	33.5 Å²	33.5	30%	0.296	16%	0.162	S	C	.	.	P	Polyproline II helix		-81.3	143.2	-127.2	-133.2	-73.7	0	0	0	114.7	I311 H316	I311-H313 PolarHBondContact O-N 3.29Å; H313-H316 WeakPolarHBondContact CB-NE2 3.37Å; H313-H316 AromaticContact CD2-CE1 3.43Å; H313-H316 PolarHBondContact CD2-CE1 3.04Å; H313-H316 VanDerWaalsContact CD2-CE1 3.43Å; H313-H316 AromaticContact CD2-NE2 3.86Å; H313-H316 AromaticContact CE1-CE1 3.23Å; H313-H316 PolarHBondContact CE1-CE1 3.46Å; H313-H316 AromaticContact CE1-ND1 3.54Å; H313-H316 AromaticContact CE1-NE2 3.91Å; H313-H316 AromaticContact CG-CE1 3.15Å; H313-H316 AromaticContact CG-NE2 3.18Å; H313-H316 AromaticContact ND1-CD2 3.86Å; H313-H316 AromaticContact ND1-CE1 3.04Å; H313-H316 PolarHBondContact ND1-CE1 3.29Å; H313-H316 AromaticContact ND1-ND1 3.55Å; H313-H316 AromaticContact ND1-NE2 3.25Å; H313-H316 PolarHBondContact ND1-NE2 3.07Å; H313-H316 AromaticContact NE2-CE1 3.46Å; H313-H316 PolarHBondContact NE2-CE1 3.44Å
314	V	54.4	Low	63.6	Low	24 Å²	24	32.7 Å²	32.7	15%	0.145	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-89.6	152.6	173.6	-180	0	0	0	0	110.1	H316 Y472	V314-H316 PolarHBondContact O-N 3.08Å; V314-Y472 HydrophobicContact CG1-CD1 4Å; V314-Y472 HydrophobicContact CG1-CD2 3.74Å; V314-Y472 HydrophobicContact CG1-CE2 4.37Å; V314-Y472 HydrophobicContact CG1-CG 3.53Å
315	D	54.5	Low	64.7	Low	52 Å²	52	31.4 Å²	31.4	28%	0.278	15%	0.15	S	C	.	.			trans	-37.2	101.9	-167.7	-169.2	-39.5	0	0	0	114.4	G317 A318	D315-G317 PolarHBondContact O-N 2.92Å; D315-G317 VanDerWaalsContact OD1-CA 3.25Å; D315-G317 WeakPolarHBondContact OD1-CA 3.42Å; D315-G317 PolarHBondContact OD1-N 2.91Å; D315-A318 WeakPolarHBondContact O-CB 3.46Å; D315-A318 PolarHBondContact O-N 2.75Å; D315-A318 VanDerWaalsContact O-N 3.07Å; D315-A318 PolarHBondContact OD1-N 3.29Å
316	H	65.2	Low	65.3	Low	8 Å²	8	30.9 Å²	30.9	4%	0.037	15%	0.151	C	C	.	.	H	α-helix	trans	-67.6	-17.7	-179.4	-59.2	-109.1	0	0	0	114.1	D118 H120 C287 V288 H313 V314 A318 F319 Y320 R381	D118-H316 WeakPolarHBondContact OD2-CB 3.37Å; D118-H316 IonicContact OD2-CD2 2.77Å; D118-H316 IonicContact OD2-CG 2.66Å; D118-H316 IonicContact OD2-ND1 3.64Å; H120-H316 AromaticContact CD2-CD2 3.7Å; H120-H316 AromaticContact CD2-NE2 3.81Å; C287-H316 PolarHBondContact O-CE1 3.12Å; C287-H316 PolarHBondContact O-ND1 3.1Å; C287-H316 VanDerWaalsContact O-ND1 3.11Å; C287-H316 VanDerWaalsContact SG-CE1 3.5Å; C287-H316 PolarHBondContact SG-NE2 3.36Å; V288-H316 WeakPolarHBondContact CG2-ND1 3.47Å; H313-H316 WeakPolarHBondContact CB-NE2 3.37Å; H313-H316 AromaticContact CD2-CE1 3.43Å; H313-H316 PolarHBondContact CD2-CE1 3.04Å; H313-H316 VanDerWaalsContact CD2-CE1 3.43Å; H313-H316 AromaticContact CD2-NE2 3.86Å; H313-H316 AromaticContact CE1-CE1 3.23Å; H313-H316 PolarHBondContact CE1-CE1 3.46Å; H313-H316 AromaticContact CE1-ND1 3.54Å; H313-H316 AromaticContact CE1-NE2 3.91Å; H313-H316 AromaticContact CG-CE1 3.15Å; H313-H316 AromaticContact CG-NE2 3.18Å; H313-H316 AromaticContact ND1-CD2 3.86Å; H313-H316 AromaticContact ND1-CE1 3.04Å; H313-H316 PolarHBondContact ND1-CE1 3.29Å; H313-H316 AromaticContact ND1-ND1 3.55Å; H313-H316 AromaticContact ND1-NE2 3.25Å; H313-H316 PolarHBondContact ND1-NE2 3.07Å; H313-H316 AromaticContact NE2-CE1 3.46Å; H313-H316 PolarHBondContact NE2-CE1 3.44Å; V314-H316 PolarHBondContact O-N 3.08Å; H316-A318 PolarHBondContact O-N 2.67Å; H316-F319 PolarHBondContact O-N 3.19Å; H316-Y320 WeakPolarHBondContact O-CB 3.22Å; H316-Y320 PolarHBondContact O-N 3.14Å; H316-Y320 VanDerWaalsContact O-N 3.11Å; H316-R381 PolarHBondContact O-NH1 2.83Å
317	G	68.7	Low	66.4	Low	3 Å²	3	34.2 Å²	34.2	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-62.5	-30.9	172.3	0	0	0	0	0	111.6	D315 Y321	D315-G317 PolarHBondContact O-N 2.92Å; D315-G317 VanDerWaalsContact OD1-CA 3.25Å; D315-G317 WeakPolarHBondContact OD1-CA 3.42Å; D315-G317 PolarHBondContact OD1-N 2.91Å; G317-Y321 VanDerWaalsContact O-CB 3.29Å; G317-Y321 WeakPolarHBondContact O-CB 3.33Å; G317-Y321 PolarHBondContact O-N 3.32Å; G317-Y321 VanDerWaalsContact O-N 3.16Å
318	A	67.9	Low	68.1	Low	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-56.6	-66.3	168.2	0	0	0	0	0	113	D315 H316 Y320 Y321 R322 A458 D459	D315-A318 WeakPolarHBondContact O-CB 3.46Å; D315-A318 PolarHBondContact O-N 2.75Å; D315-A318 VanDerWaalsContact O-N 3.07Å; D315-A318 PolarHBondContact OD1-N 3.29Å; H316-A318 PolarHBondContact O-N 2.67Å; A318-Y320 VanDerWaalsContact C-N 3.28Å; A318-Y320 PolarHBondContact O-N 2.6Å; A318-Y321 PolarHBondContact O-N 3.33Å; A318-Y321 VanDerWaalsContact O-N 3.14Å; A318-R322 WeakPolarHBondContact O-CB 3.12Å; A318-R322 PolarHBondContact O-N 3.19Å; A318-A458 VanDerWaalsContact CA-C 3.41Å; A318-A458 VanDerWaalsContact CA-CA 3.48Å; A318-A458 VanDerWaalsContact CA-CB 3.43Å; A318-A458 WeakPolarHBondContact CA-O 3.2Å; A318-A458 HydrophobicContact CB-CB 3.96Å; A318-A458 WeakPolarHBondContact CB-O 3.27Å; A318-D459 HydrophobicContact CB-CB 3.66Å
319	F	70	Confident	69.8	Low	105 Å²	105	38.9 Å²	38.9	46%	0.461	22%	0.219	S	C	.	.	H	α-helix	trans	-62.6	-40.8	-168.2	-173.3	-104.5	0	0	0	110.6	L292 H316 H323	L292-F319 HydrophobicContact CB-CE1 4.43Å; L292-F319 HydrophobicContact CD1-CD1 4.4Å; L292-F319 HydrophobicContact CD1-CE1 3.92Å; H316-F319 PolarHBondContact O-N 3.19Å; F319-H323 VanDerWaalsContact O-CB 3.24Å; F319-H323 WeakPolarHBondContact O-CB 3.24Å; F319-H323 PolarHBondContact O-N 3.37Å
320	Y	76.3	Confident	71.6	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.2	-46.7	175.1	-166.8	-109	0	0	0	112.8	Y117 H316 A318 R322 H323 C324 F325 R369 M370 I371 R381 G382	Y117-Y320 AromaticContact CD1-CD2 3.68Å; Y117-Y320 HydrophobicContact CD1-CD2 3.68Å; Y117-Y320 HydrophobicContact CD1-CE2 4.18Å; Y117-Y320 HydrophobicContact CD1-CG 4.17Å; Y117-Y320 AromaticContact CD2-CD2 3.43Å; Y117-Y320 HydrophobicContact CD2-CD2 3.43Å; Y117-Y320 VanDerWaalsContact CD2-CD2 3.43Å; Y117-Y320 AromaticContact CD2-CE2 3.28Å; Y117-Y320 HydrophobicContact CD2-CE2 3.28Å; Y117-Y320 AromaticContact CE1-CD2 3.72Å; Y117-Y320 HydrophobicContact CE1-CD2 3.72Å; Y117-Y320 HydrophobicContact CE1-CG 4.25Å; Y117-Y320 AromaticContact CE2-CD2 3.45Å; Y117-Y320 HydrophobicContact CE2-CD2 3.45Å; Y117-Y320 VanDerWaalsContact CE2-CD2 3.45Å; Y117-Y320 AromaticContact CE2-CE2 3.7Å; Y117-Y320 HydrophobicContact CE2-CE2 3.7Å; Y117-Y320 AromaticContact CG-CD2 3.53Å; Y117-Y320 HydrophobicContact CG-CD2 3.53Å; Y117-Y320 AromaticContact CG-CE2 3.55Å; Y117-Y320 HydrophobicContact CG-CE2 3.55Å; Y117-Y320 HydrophobicContact CG-CG 4.34Å; Y117-Y320 AromaticContact CZ-CD2 3.6Å; H316-Y320 WeakPolarHBondContact O-CB 3.22Å; H316-Y320 PolarHBondContact O-N 3.14Å; H316-Y320 VanDerWaalsContact O-N 3.11Å; A318-Y320 VanDerWaalsContact C-N 3.28Å; A318-Y320 PolarHBondContact O-N 2.6Å; Y320-R322 PolarHBondContact O-N 2.9Å; Y320-H323 PolarHBondContact O-N 3.12Å; Y320-C324 HydrophobicContact CE2-CB 4.36Å; Y320-C324 VanDerWaalsContact CE2-SG 3.58Å; Y320-C324 VanDerWaalsContact O-CB 3.25Å; Y320-C324 WeakPolarHBondContact O-CB 3.47Å; Y320-C324 PolarHBondContact O-N 2.83Å; Y320-F325 AromaticContact CD1-CE2 3.75Å; Y320-F325 HydrophobicContact CD1-CE2 3.75Å; Y320-F325 AromaticContact CE1-CE2 3.55Å; Y320-F325 HydrophobicContact CE1-CE2 3.55Å; Y320-F325 HydrophobicContact CE1-CZ 4.05Å; Y320-R369 PolarHBondContact OH-NH1 2.82Å; Y320-M370 WeakPolarHBondContact CE1-O 3.32Å; Y320-I371 HydrophobicContact CD1-CB 4.21Å; Y320-I371 HydrophobicContact CE1-CB 4.4Å; Y320-R381 HydrophobicContact CD1-CB 3.84Å; Y320-R381 HydrophobicContact CD1-CG 3.51Å; Y320-R381 HydrophobicContact CE1-CB 3.92Å; Y320-R381 HydrophobicContact CE1-CG 3.96Å; Y320-R381 HydrophobicContact CG-CB 4.27Å; Y320-R381 HydrophobicContact CG-CG 4.13Å; Y320-G382 PolarHBondContact OH-O 3.34Å
321	Y	81.7	Confident	73.3	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.6	-43.3	178.5	-170.9	-115.2	0	0	0	111.7	G317 A318 H323 F325 L326 H330 S346 I371 L454 L455	G317-Y321 VanDerWaalsContact O-CB 3.29Å; G317-Y321 WeakPolarHBondContact O-CB 3.33Å; G317-Y321 PolarHBondContact O-N 3.32Å; G317-Y321 VanDerWaalsContact O-N 3.16Å; A318-Y321 PolarHBondContact O-N 3.33Å; A318-Y321 VanDerWaalsContact O-N 3.14Å; Y321-H323 PolarHBondContact O-N 3.24Å; Y321-F325 HydrophobicContact CD2-CB 3.53Å; Y321-F325 HydrophobicContact CD2-CD1 4.32Å; Y321-F325 AromaticContact CD2-CD2 3.76Å; Y321-F325 HydrophobicContact CD2-CD2 3.76Å; Y321-F325 AromaticContact CD2-CG 3.61Å; Y321-F325 HydrophobicContact CD2-CG 3.61Å; Y321-F325 HydrophobicContact CE2-CB 3.41Å; Y321-F325 VanDerWaalsContact CE2-CB 3.41Å; Y321-F325 HydrophobicContact CE2-CD1 4.21Å; Y321-F325 HydrophobicContact CE2-CD2 4.38Å; Y321-F325 AromaticContact CE2-CG 3.76Å; Y321-F325 HydrophobicContact CE2-CG 3.76Å; Y321-F325 HydrophobicContact CG-CB 4.36Å; Y321-F325 WeakPolarHBondContact O-CA 3.46Å; Y321-F325 WeakPolarHBondContact O-CB 3.24Å; Y321-F325 PolarHBondContact O-N 3.01Å; Y321-L326 PolarHBondContact O-N 2.97Å; Y321-H330 AromaticContact CE2-NE2 3.79Å; Y321-H330 AromaticContact CZ-NE2 3.69Å; Y321-H330 PolarHBondContact OH-NE2 2.8Å; Y321-S346 WeakPolarHBondContact CE2-OG 3.12Å; Y321-I371 HydrophobicContact CD2-CG2 4.13Å; Y321-L454 HydrophobicContact CD1-CB 4.07Å; Y321-L454 HydrophobicContact CE1-CB 3.47Å; Y321-L454 VanDerWaalsContact CE1-CB 3.47Å; Y321-L454 HydrophobicContact CE1-CD1 4.19Å; Y321-L454 HydrophobicContact CE2-CD1 4.31Å; Y321-L454 WeakPolarHBondContact OH-CD1 3.42Å; Y321-L455 HydrophobicContact CD1-CD1 3.64Å; Y321-L455 HydrophobicContact CD1-CG 4.2Å; Y321-L455 HydrophobicContact CE1-CD1 3.65Å
322	R	75.9	Confident	75	Confident	97 Å²	97	41.6 Å²	41.6	37%	0.366	23%	0.231	S	C	.	.	H	α-helix	trans	-66.9	-34	178.5	-179.8	170	159.7	-160.2	-12.1	113.8	A318 Y320 L326 L455 D459 V460	A318-R322 WeakPolarHBondContact O-CB 3.12Å; A318-R322 PolarHBondContact O-N 3.19Å; Y320-R322 PolarHBondContact O-N 2.9Å; R322-L326 HydrophobicContact CG-CD2 4.16Å; R322-L455 HydrophobicContact CB-CD2 4.13Å; R322-L455 HydrophobicContact CG-CD2 4.22Å; R322-D459 WeakPolarHBondContact CD-O 3.07Å; R322-D459 PolarHBondContact NH1-O 3.4Å; R322-V460 WeakPolarHBondContact CD-O 3.28Å; R322-V460 VanDerWaalsContact CZ-O 3.26Å; R322-V460 PolarHBondContact NE-O 3.17Å; R322-V460 PolarHBondContact NH1-O 3.06Å
323	H	76.6	Confident	76.7	Confident	79 Å²	79	41.6 Å²	41.6	37%	0.366	23%	0.23	S	C	.	.	H	α-helix	trans	-86.7	-37.2	179.7	-168.6	111.6	0	0	0	112.8	L292 F319 Y320 Y321 K328	L292-H323 HydrophobicContact CD1-CB 4.1Å; F319-H323 VanDerWaalsContact O-CB 3.24Å; F319-H323 WeakPolarHBondContact O-CB 3.24Å; F319-H323 PolarHBondContact O-N 3.37Å; Y320-H323 PolarHBondContact O-N 3.12Å; Y321-H323 PolarHBondContact O-N 3.24Å; H323-K328 WeakPolarHBondContact O-CE 3.35Å; H323-K328 PolarHBondContact O-NZ 2.9Å
324	C	82.3	Confident	78.4	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.007	22%	0.216	C	C	.	.	H	α-helix	trans	-99.3	-17.3	-171.2	-64.4	0	0	0	0	114.6	Y320 K328	Y320-C324 HydrophobicContact CE2-CB 4.36Å; Y320-C324 VanDerWaalsContact CE2-SG 3.58Å; Y320-C324 VanDerWaalsContact O-CB 3.25Å; Y320-C324 WeakPolarHBondContact O-CB 3.47Å; Y320-C324 PolarHBondContact O-N 2.83Å; C324-K328 VanDerWaalsContact O-CD 3.3Å; C324-K328 WeakPolarHBondContact O-CD 3.46Å
325	F	86.8	Confident	80.1	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-128.9	-43.5	-172.3	-57.2	-104.1	0	0	0	113.4	Y320 Y321 G327 K328 H330 S346 A348 R369 I371	Y320-F325 AromaticContact CD1-CE2 3.75Å; Y320-F325 HydrophobicContact CD1-CE2 3.75Å; Y320-F325 AromaticContact CE1-CE2 3.55Å; Y320-F325 HydrophobicContact CE1-CE2 3.55Å; Y320-F325 HydrophobicContact CE1-CZ 4.05Å; Y321-F325 HydrophobicContact CD2-CB 3.53Å; Y321-F325 HydrophobicContact CD2-CD1 4.32Å; Y321-F325 AromaticContact CD2-CD2 3.76Å; Y321-F325 HydrophobicContact CD2-CD2 3.76Å; Y321-F325 AromaticContact CD2-CG 3.61Å; Y321-F325 HydrophobicContact CD2-CG 3.61Å; Y321-F325 HydrophobicContact CE2-CB 3.41Å; Y321-F325 VanDerWaalsContact CE2-CB 3.41Å; Y321-F325 HydrophobicContact CE2-CD1 4.21Å; Y321-F325 HydrophobicContact CE2-CD2 4.38Å; Y321-F325 AromaticContact CE2-CG 3.76Å; Y321-F325 HydrophobicContact CE2-CG 3.76Å; Y321-F325 HydrophobicContact CG-CB 4.36Å; Y321-F325 WeakPolarHBondContact O-CA 3.46Å; Y321-F325 WeakPolarHBondContact O-CB 3.24Å; Y321-F325 PolarHBondContact O-N 3.01Å; F325-G327 PolarHBondContact O-N 2.8Å; F325-K328 PolarHBondContact O-N 2.86Å; F325-K328 VanDerWaalsContact O-O 3.12Å; F325-H330 HydrophobicContact CB-CB 4.46Å; F325-H330 HydrophobicContact CD1-CB 3.83Å; F325-H330 AromaticContact CD1-CD2 3.88Å; F325-H330 AromaticContact CD1-CG 3.95Å; F325-H330 PolarHBondContact O-CE1 2.87Å; F325-H330 PolarHBondContact O-ND1 2.87Å; F325-S346 WeakPolarHBondContact CE1-O 3.42Å; F325-A348 HydrophobicContact CD1-CB 3.98Å; F325-A348 HydrophobicContact CE1-CB 3.92Å; F325-R369 HydrophobicContact CZ-CB 4.08Å; F325-I371 HydrophobicContact CD2-CG2 4.41Å; F325-I371 HydrophobicContact CE1-CG2 4.14Å; F325-I371 HydrophobicContact CE2-CB 4.5Å; F325-I371 HydrophobicContact CE2-CG2 3.85Å; F325-I371 HydrophobicContact CZ-CB 4.41Å; F325-I371 HydrophobicContact CZ-CG2 3.7Å
326	L	81.7	Confident	81.8	Confident	36 Å²	36	38.5 Å²	38.5	19%	0.188	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	126.5	-178.7	-176.7	66.7	0	0	0	111.5	Y321 R322 K328 E451 L455 L461	Y321-L326 PolarHBondContact O-N 2.97Å; R322-L326 HydrophobicContact CG-CD2 4.16Å; L326-K328 PolarHBondContact O-N 3.15Å; L326-E451 HydrophobicContact CD1-CB 4.33Å; L326-L455 HydrophobicContact CB-CD1 4.39Å; L326-L455 HydrophobicContact CD1-CD1 3.93Å; L326-L455 HydrophobicContact CD2-CD1 4.05Å; L326-L455 HydrophobicContact CD2-CD2 3.98Å; L326-L455 HydrophobicContact CG-CD1 4.35Å; L326-L461 HydrophobicContact CD1-CD1 4.49Å; L326-L461 HydrophobicContact CD2-CD1 4.43Å; L326-L461 HydrophobicContact CD2-CD2 4.15Å; L326-L461 HydrophobicContact CD2-CG 3.98Å
327	G	80.9	Confident	82.8	Confident	79 Å²	79	38.3 Å²	38.3	81%	0.814	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.9	3.8	-176.3	0	0	0	0	0	115.1	F325	F325-G327 PolarHBondContact O-N 2.8Å
328	K	85.2	Confident	83.6	Confident	86 Å²	86	47 Å²	47	37%	0.374	25%	0.254	S	S	.	.	S	Bend	trans	-111.4	153.6	175.7	-69.7	171.8	171.4	176.2	0	110.4	H323 C324 F325 L326 H330	H323-K328 WeakPolarHBondContact O-CE 3.35Å; H323-K328 PolarHBondContact O-NZ 2.9Å; C324-K328 VanDerWaalsContact O-CD 3.3Å; C324-K328 WeakPolarHBondContact O-CD 3.46Å; F325-K328 PolarHBondContact O-N 2.86Å; F325-K328 VanDerWaalsContact O-O 3.12Å; L326-K328 PolarHBondContact O-N 3.15Å; K328-H330 PolarHBondContact O-N 3.19Å; K328-H330 VanDerWaalsContact O-N 3.09Å; K328-H330 PolarHBondContact O-ND1 3.48Å
329	A	86.8	Confident	84.3	Confident	99 Å²	99	51.5 Å²	51.5	82%	0.818	28%	0.279	S	S	*	.			trans	-70.1	105.8	179.7	0	0	0	0	0	111.1
330	H	90.2	Very high	84.8	Confident	30 Å²	30	47.2 Å²	47.2	14%	0.139	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	168.6	-178.1	73.6	-80.9	0	0	0	111.7	Y321 F325 K328 N332 I347 A348 E451	Y321-H330 AromaticContact CE2-NE2 3.79Å; Y321-H330 AromaticContact CZ-NE2 3.69Å; Y321-H330 PolarHBondContact OH-NE2 2.8Å; F325-H330 HydrophobicContact CB-CB 4.46Å; F325-H330 HydrophobicContact CD1-CB 3.83Å; F325-H330 AromaticContact CD1-CD2 3.88Å; F325-H330 AromaticContact CD1-CG 3.95Å; F325-H330 PolarHBondContact O-CE1 2.87Å; F325-H330 PolarHBondContact O-ND1 2.87Å; K328-H330 PolarHBondContact O-N 3.19Å; K328-H330 VanDerWaalsContact O-N 3.09Å; K328-H330 PolarHBondContact O-ND1 3.48Å; H330-N332 PolarHBondContact CD2-ND2 2.85Å; H330-N332 VanDerWaalsContact CD2-ND2 3.34Å; H330-N332 PolarHBondContact CD2-OD1 2.91Å; H330-N332 PolarHBondContact NE2-ND2 2.94Å; H330-N332 PolarHBondContact NE2-OD1 3.03Å; H330-I347 CarbonylContact C-O 3.4Å; H330-I347 WeakPolarHBondContact CA-O 3.5Å; H330-I347 WeakPolarHBondContact CB-O 3.47Å; H330-A348 HydrophobicContact CB-CB 3.84Å; H330-E451 IonicContact CE1-OE1 3.21Å; H330-E451 PolarHBondContact CE1-OE1 3.46Å; H330-E451 VanDerWaalsContact CE1-OE1 3.28Å
331	Q	89.1	Confident	85.2	Confident	72 Å²	72	48 Å²	48	34%	0.336	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	136.6	178	-65.3	176.9	-2.3	0	0	109.3	Y333 S346 I347 I423 L443	Q331-Y333 HydrophobicContact CB-CE2 3.84Å; Q331-Y333 PolarHBondContact OE1-OH 2.66Å; Q331-S346 CarbonylContact O-C 3.55Å; Q331-S346 WeakPolarHBondContact O-CA 3.27Å; Q331-I347 PolarHBondContact N-O 3.34Å; Q331-I347 PolarHBondContact O-N 2.92Å; Q331-I423 HydrophobicContact CG-CD1 4.25Å; Q331-L443 HydrophobicContact CB-CD1 4.4Å
332	N	90.9	Very high	85.6	Confident	16 Å²	16	48.1 Å²	48.1	9%	0.086	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	138.7	176.1	-61.8	-65.8	0	0	0	109.4	H330 F334 V345 S346 A444 L454	H330-N332 PolarHBondContact CD2-ND2 2.85Å; H330-N332 VanDerWaalsContact CD2-ND2 3.34Å; H330-N332 PolarHBondContact CD2-OD1 2.91Å; H330-N332 PolarHBondContact NE2-ND2 2.94Å; H330-N332 PolarHBondContact NE2-OD1 3.03Å; N332-F334 HydrophobicContact CB-CE1 4.07Å; N332-F334 HydrophobicContact CB-CZ 4.13Å; N332-V345 CarbonylContact C-O 3.42Å; N332-V345 WeakPolarHBondContact CA-O 3.1Å; N332-S346 WeakPolarHBondContact OD1-CB 3.36Å; N332-S346 PolarHBondContact OD1-OG 3.2Å; N332-A444 HydrophobicContact CB-CB 3.75Å; N332-A444 WeakPolarHBondContact O-CB 3.4Å; N332-A444 PolarHBondContact O-N 2.89Å; N332-L454 HydrophobicContact CB-CD1 4.43Å
333	Y	90.9	Very high	86.2	Confident	23 Å²	23	43.5 Å²	43.5	9%	0.09	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	129.5	177.9	-66.5	-90.6	0	0	0	109.6	Q331 V345 V425 R442 L443 I707	Q331-Y333 HydrophobicContact CB-CE2 3.84Å; Q331-Y333 PolarHBondContact OE1-OH 2.66Å; Y333-V345 PolarHBondContact N-O 3.15Å; Y333-V345 PolarHBondContact O-N 3.43Å; Y333-V425 HydrophobicContact CD2-CG1 4.37Å; Y333-V425 HydrophobicContact CE2-CG1 4.14Å; Y333-V425 HydrophobicContact CE2-CG2 3.8Å; Y333-R442 CarbonylContact C-O 3.01Å; Y333-R442 VanDerWaalsContact CA-O 3.24Å; Y333-R442 WeakPolarHBondContact CA-O 3.46Å; Y333-L443 HydrophobicContact CD1-CB 4.3Å; Y333-L443 HydrophobicContact CD1-CD1 4.22Å; Y333-L443 HydrophobicContact CE1-CB 4.03Å; Y333-L443 HydrophobicContact CE1-CD1 3.67Å; Y333-L443 HydrophobicContact CE1-CG 4.47Å; Y333-L443 HydrophobicContact CE2-CD1 4.16Å; Y333-I707 HydrophobicContact CD1-CD1 3.94Å; Y333-I707 HydrophobicContact CD1-CG1 3.81Å; Y333-I707 HydrophobicContact CE1-CD1 4.16Å; Y333-I707 HydrophobicContact CE1-CG1 3.74Å; Y333-I707 HydrophobicContact CG-CD1 4.42Å
334	F	90.9	Very high	86.8	Confident	1 Å²	1	39.8 Å²	39.8	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	155.5	175.4	-40.9	-45.6	0	0	0	110.3	N332 V343 A344 R442 A444 T450 L454 L697 A698 H701	N332-F334 HydrophobicContact CB-CE1 4.07Å; N332-F334 HydrophobicContact CB-CZ 4.13Å; F334-V343 WeakPolarHBondContact CA-O 3.31Å; F334-A344 HydrophobicContact CD1-CB 3.56Å; F334-A344 HydrophobicContact CE1-CB 3.97Å; F334-R442 PolarHBondContact N-O 3.05Å; F334-R442 PolarHBondContact O-N 2.96Å; F334-A444 HydrophobicContact CD2-CB 3.83Å; F334-A444 HydrophobicContact CE1-CB 4.39Å; F334-A444 HydrophobicContact CE2-CB 3.37Å; F334-A444 HydrophobicContact CZ-CB 3.69Å; F334-T450 HydrophobicContact CE2-CG2 3.64Å; F334-T450 HydrophobicContact CZ-CG2 3.56Å; F334-L454 HydrophobicContact CE1-CD1 4Å; F334-L454 HydrophobicContact CE1-CD2 3.97Å; F334-L454 HydrophobicContact CE1-CG 4.39Å; F334-L454 HydrophobicContact CZ-CD1 3.97Å; F334-L454 HydrophobicContact CZ-CD2 4.27Å; F334-L454 HydrophobicContact CZ-CG 4.28Å; F334-L697 HydrophobicContact CD2-CB 4.04Å; F334-L697 HydrophobicContact CE2-CB 4.22Å; F334-L697 HydrophobicContact CE2-CD2 4.1Å; F334-L697 HydrophobicContact CG-CB 4.34Å; F334-L697 HydrophobicContact CZ-CD2 4.37Å; F334-A698 HydrophobicContact CB-CB 4.2Å; F334-H701 HydrophobicContact CD2-CB 4.41Å; F334-H701 HydrophobicContact CE2-CB 4.11Å
335	G	89.8	Confident	87.2	Confident	5 Å²	5	39.7 Å²	39.7	5%	0.052	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169.7	179.7	177.6	0	0	0	0	0	111.6	P342 V343 C440 A698	G335-P342 WeakPolarHBondContact O-CA 3.45Å; G335-V343 PolarHBondContact N-O 2.94Å; G335-V343 PolarHBondContact O-N 2.92Å; G335-C440 WeakPolarHBondContact CA-O 3.25Å; G335-A698 WeakPolarHBondContact O-CB 3.49Å
336	I	89.1	Confident	87.5	Confident	69 Å²	69	39.7 Å²	39.7	35%	0.354	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	113.9	169	-57.1	178.1	0	0	0	106.1	P342 C440 R695 A698 E699	I336-P342 HydrophobicContact CG1-CG 4.45Å; I336-C440 WeakPolarHBondContact O-CB 3.44Å; I336-R695 HydrophobicContact CD1-CG 4.39Å; I336-A698 HydrophobicContact CD1-CB 4.48Å; I336-A698 HydrophobicContact CG1-CB 3.89Å; I336-E699 HydrophobicContact CD1-CG 4.16Å
337	D	87.6	Confident	88	Confident	3 Å²	3	38 Å²	38	2%	0.016	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	144.7	170.4	-174.3	-82.7	0	0	0	109	N339 L340 G341 V343 L436 L437	D337-N339 VanDerWaalsContact C-N 3.3Å; D337-N339 PolarHBondContact O-N 3.26Å; D337-N339 WeakPolarHBondContact OD1-CA 3.24Å; D337-N339 PolarHBondContact OD1-N 2.92Å; D337-L340 HydrophobicContact CB-CB 4.07Å; D337-L340 PolarHBondContact OD1-N 3.39Å; D337-G341 PolarHBondContact N-O 3.45Å; D337-G341 VanDerWaalsContact O-CA 3.27Å; D337-G341 WeakPolarHBondContact O-CA 3.39Å; D337-G341 PolarHBondContact O-N 2.91Å; D337-V343 HydrophobicContact CB-CG2 4.34Å; D337-L436 HydrophobicContact CB-CD1 3.94Å; D337-L437 PolarHBondContact OD2-N 2.93Å; D337-L437 VanDerWaalsContact OD2-N 3.1Å
338	E	84.1	Confident	88.5	Confident	185 Å²	185	34.2 Å²	34.2	86%	0.864	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-26.5	-176	-62.2	-174.4	160.8	0	0	112.7
339	N	83.4	Confident	88.8	Confident	96 Å²	96	33.3 Å²	33.3	51%	0.513	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-41.3	-179.9	-56	-70.6	0	0	0	112.1	V133 D337	V133-N339 HydrophobicContact CG1-CB 3.84Å; D337-N339 VanDerWaalsContact C-N 3.3Å; D337-N339 PolarHBondContact O-N 3.26Å; D337-N339 WeakPolarHBondContact OD1-CA 3.24Å; D337-N339 PolarHBondContact OD1-N 2.92Å
340	L	80.3	Confident	88.9	Confident	15 Å²	15	30.3 Å²	30.3	8%	0.079	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-2.1	-174.5	-56	177.5	0	0	0	113.8	L130 D337 V343 L374 S375 L377 V433 L436	L130-L340 HydrophobicContact CD2-CD2 4.44Å; D337-L340 HydrophobicContact CB-CB 4.07Å; D337-L340 PolarHBondContact OD1-N 3.39Å; L340-V343 HydrophobicContact CB-CG2 4.36Å; L340-L374 HydrophobicContact CD1-CD2 4.47Å; L340-S375 PolarHBondContact O-OG 3.11Å; L340-L377 HydrophobicContact CD2-CD1 4.27Å; L340-V433 HydrophobicContact CD1-CG1 4.38Å; L340-L436 HydrophobicContact CD1-CB 4.17Å; L340-L436 HydrophobicContact CD1-CD1 4.31Å
341	G	86	Confident	88.6	Confident	16 Å²	16	35.6 Å²	35.6	17%	0.165	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	70.5	-154.5	178.8	0	0	0	0	0	113.4	D337 V343	D337-G341 PolarHBondContact N-O 3.45Å; D337-G341 VanDerWaalsContact O-CA 3.27Å; D337-G341 WeakPolarHBondContact O-CA 3.39Å; D337-G341 PolarHBondContact O-N 2.91Å; G341-V343 WeakPolarHBondContact O-CG2 3.16Å; G341-V343 PolarHBondContact O-N 3.24Å
342	P	88.1	Confident	88.1	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.013	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	128.9	174.2	-24.8	34.8	0	0	0	112.9	G335 I336 S375 R691 M694 R695	G335-P342 WeakPolarHBondContact O-CA 3.45Å; I336-P342 HydrophobicContact CG1-CG 4.45Å; P342-S375 PolarHBondContact O-N 3.01Å; P342-R691 HydrophobicContact CG-CG 4.15Å; P342-M694 HydrophobicContact CB-CB 3.82Å; P342-M694 WeakPolarHBondContact O-CE 3.33Å; P342-R695 HydrophobicContact CB-CB 4.45Å; P342-R695 HydrophobicContact CG-CB 3.93Å
343	V	88.6	Confident	87.5	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	140.4	-176.6	176	0	0	0	0	110.9	F334 G335 D337 L340 G341 V345 V372 R373 L374 L436 L441	F334-V343 WeakPolarHBondContact CA-O 3.31Å; G335-V343 PolarHBondContact N-O 2.94Å; G335-V343 PolarHBondContact O-N 2.92Å; D337-V343 HydrophobicContact CB-CG2 4.34Å; L340-V343 HydrophobicContact CB-CG2 4.36Å; G341-V343 WeakPolarHBondContact O-CG2 3.16Å; G341-V343 PolarHBondContact O-N 3.24Å; V343-V345 HydrophobicContact CG1-CG2 4.05Å; V343-V372 HydrophobicContact CG1-CG1 4.43Å; V343-R373 WeakPolarHBondContact CA-O 3.09Å; V343-L374 HydrophobicContact CB-CD2 4.26Å; V343-L374 HydrophobicContact CG1-CD2 3.82Å; V343-L374 HydrophobicContact CG2-CD2 3.58Å; V343-L436 HydrophobicContact CB-CD1 4.42Å; V343-L436 HydrophobicContact CG1-CD1 4.23Å; V343-L436 HydrophobicContact CG1-CD2 3.93Å; V343-L436 HydrophobicContact CG2-CD1 3.95Å; V343-L441 HydrophobicContact CB-CD2 4.43Å; V343-L441 HydrophobicContact CG1-CD2 4.17Å
344	A	89.8	Confident	86.6	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.008	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	114.1	172.4	0	0	0	0	0	112.4	F334 R373 L454 M694	F334-A344 HydrophobicContact CD1-CB 3.56Å; F334-A344 HydrophobicContact CE1-CB 3.97Å; A344-R373 HydrophobicContact CB-CB 4.31Å; A344-R373 PolarHBondContact N-O 3.25Å; A344-R373 WeakPolarHBondContact O-CB 3.37Å; A344-R373 PolarHBondContact O-N 2.87Å; A344-L454 HydrophobicContact CB-CD2 4.48Å; A344-M694 HydrophobicContact CB-SD 4.12Å
345	V	91.2	Very high	85.7	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	135.8	179	-177.2	0	0	0	0	109.9	N332 Y333 V343 I347 I371 V372 L429 L436 L441	N332-V345 CarbonylContact C-O 3.42Å; N332-V345 WeakPolarHBondContact CA-O 3.1Å; Y333-V345 PolarHBondContact N-O 3.15Å; Y333-V345 PolarHBondContact O-N 3.43Å; V343-V345 HydrophobicContact CG1-CG2 4.05Å; V345-I347 HydrophobicContact CG1-CD1 4.05Å; V345-I347 HydrophobicContact CG1-CG1 3.74Å; V345-I371 CarbonylContact C-O 3.59Å; V345-I371 WeakPolarHBondContact CA-O 3.41Å; V345-V372 HydrophobicContact CG1-CG2 4.19Å; V345-V372 HydrophobicContact CG2-CG1 4.16Å; V345-V372 HydrophobicContact CG2-CG2 4.21Å; V345-L429 HydrophobicContact CG1-CD2 4.26Å; V345-L429 HydrophobicContact CG2-CD2 4.21Å; V345-L436 HydrophobicContact CG2-CD2 4.43Å; V345-L441 HydrophobicContact CG2-CD1 4.07Å; V345-L441 HydrophobicContact CG2-CD2 4.46Å
346	S	92	Very high	84.7	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.9	164.4	-43	0	0	0	0	110	Y321 F325 Q331 N332 M370 I371 R373	Y321-S346 WeakPolarHBondContact CE2-OG 3.12Å; F325-S346 WeakPolarHBondContact CE1-O 3.42Å; Q331-S346 CarbonylContact O-C 3.55Å; Q331-S346 WeakPolarHBondContact O-CA 3.27Å; N332-S346 WeakPolarHBondContact OD1-CB 3.36Å; N332-S346 PolarHBondContact OD1-OG 3.2Å; S346-M370 WeakPolarHBondContact O-CA 3.41Å; S346-I371 VanDerWaalsContact CB-CG2 3.48Å; S346-I371 PolarHBondContact N-O 3.15Å; S346-I371 PolarHBondContact O-N 2.77Å; S346-R373 PolarHBondContact OG-NH1 3.49Å
347	I	93.2	Very high	83.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	129.6	179.3	-47.3	-173.6	0	0	0	110.7	H330 Q331 V345 Y368 R369 M370 I423 V425 L428	H330-I347 CarbonylContact C-O 3.4Å; H330-I347 WeakPolarHBondContact CA-O 3.5Å; H330-I347 WeakPolarHBondContact CB-O 3.47Å; Q331-I347 PolarHBondContact N-O 3.34Å; Q331-I347 PolarHBondContact O-N 2.92Å; V345-I347 HydrophobicContact CG1-CD1 4.05Å; V345-I347 HydrophobicContact CG1-CG1 3.74Å; I347-Y368 HydrophobicContact CG2-CD1 4.34Å; I347-R369 WeakPolarHBondContact CA-O 3.15Å; I347-M370 HydrophobicContact CD1-CE 3.97Å; I347-M370 HydrophobicContact CD1-CG 4.41Å; I347-M370 HydrophobicContact CG1-CE 4.44Å; I347-M370 HydrophobicContact CG1-CG 4.11Å; I347-M370 HydrophobicContact CG2-CG 4.01Å; I347-I423 HydrophobicContact CG2-CD1 4.34Å; I347-I423 HydrophobicContact CG2-CG2 3.81Å; I347-V425 HydrophobicContact CD1-CB 4.39Å; I347-V425 HydrophobicContact CD1-CG1 3.83Å; I347-V425 HydrophobicContact CD1-CG2 4.21Å; I347-L428 HydrophobicContact CD1-CD1 4.41Å; I347-L428 HydrophobicContact CG2-CD1 4.26Å
348	A	91.5	Very high	83.1	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	146.9	172.1	0	0	0	0	0	110	F325 H330 Y368 R369	F325-A348 HydrophobicContact CD1-CB 3.98Å; F325-A348 HydrophobicContact CE1-CB 3.92Å; H330-A348 HydrophobicContact CB-CB 3.84Å; A348-Y368 CarbonylContact O-C 3.56Å; A348-Y368 VanDerWaalsContact O-CA 3.31Å; A348-Y368 WeakPolarHBondContact O-CA 3.49Å; A348-R369 PolarHBondContact N-O 3.32Å; A348-R369 PolarHBondContact O-N 3.08Å
349	R	91.9	Very high	82.4	Confident	67 Å²	67	53.8 Å²	53.8	25%	0.253	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	86.5	173.8	-173.4	-179.4	177.8	-85.4	0.8	108.9	Y366 L367 Y368 E386	R349-Y366 VanDerWaalsContact NH2-CG 3.32Å; R349-L367 CarbonylContact C-O 3.13Å; R349-L367 WeakPolarHBondContact CA-O 3.5Å; R349-Y368 HydrophobicContact CB-CD1 4Å; R349-Y368 HydrophobicContact CB-CE1 3.8Å; R349-Y368 WeakPolarHBondContact CD-OH 3.45Å; R349-Y368 HydrophobicContact CG-CD1 4.07Å; R349-Y368 HydrophobicContact CG-CE1 3.59Å; R349-Y368 PolarHBondContact NE-OH 2.98Å; R349-Y368 VanDerWaalsContact NE-OH 3.15Å; R349-E386 IonicContact CZ-OE1 2.75Å; R349-E386 IonicContact CZ-OE2 2.89Å; R349-E386 IonicContact NE-OE1 3.51Å; R349-E386 PolarHBondContact NE-OE1 3.47Å; R349-E386 IonicContact NH2-OE1 3.08Å; R349-E386 PolarHBondContact NH2-OE1 2.94Å; R349-E386 IonicContact NH2-OE2 3.9Å; R349-E386 PolarHBondContact NH2-OE2 2.92Å
350	D	87.3	Confident	81.6	Confident	36 Å²	36	49.6 Å²	49.6	19%	0.193	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	149.8	-179	-86.8	-6.7	0	0	0	111	Y366 L367 R369	D350-Y366 WeakPolarHBondContact O-CA 3.34Å; D350-L367 HydrophobicContact CB-CD1 3.84Å; D350-L367 HydrophobicContact CB-CG 4.36Å; D350-L367 PolarHBondContact N-O 2.89Å; D350-L367 PolarHBondContact O-N 2.81Å; D350-R369 WeakPolarHBondContact OD2-CD 3.4Å; D350-R369 IonicContact OD2-NE 3.44Å; D350-R369 PolarHBondContact OD2-NE 2.93Å
351	K	85.5	Confident	81.2	Confident	141 Å²	141	51.9 Å²	51.9	61%	0.613	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.3	129.9	169.2	-166	-176.6	177.2	-175.7	0	109.4	P365 Y366	K351-P365 CarbonylContact C-O 3.59Å; K351-P365 WeakPolarHBondContact CA-O 3.27Å; K351-P365 VanDerWaalsContact CG-O 3.27Å; K351-P365 WeakPolarHBondContact CG-O 3.42Å; K351-Y366 HydrophobicContact CB-CD1 3.83Å; K351-Y366 HydrophobicContact CB-CE1 3.62Å; K351-Y366 HydrophobicContact CD-CE1 3.97Å; K351-Y366 HydrophobicContact CG-CD1 3.92Å; K351-Y366 HydrophobicContact CG-CE1 3.56Å
352	L	77.4	Confident	80.7	Confident	29 Å²	29	52.2 Å²	52.2	15%	0.152	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-72.9	149.6	171	-73.8	170.1	0	0	0	111	A357 L362 P365 L367 L385	L352-A357 HydrophobicContact CB-CB 4.29Å; L352-L362 HydrophobicContact CD1-CD1 3.78Å; L352-P365 PolarHBondContact N-O 2.79Å; L352-L367 HydrophobicContact CD1-CD2 4.31Å; L352-L367 HydrophobicContact CD2-CD2 3.74Å; L352-L367 HydrophobicContact CG-CD2 3.99Å; L352-L385 HydrophobicContact CD1-CD2 4.2Å
353	D	78.4	Confident	80.1	Confident	102 Å²	102	55.7 Å²	55.7	55%	0.545	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-59.3	145.6	170.6	-60.2	-49.9	0	0	0	110.8	Y355 Q356 A357	D353-Y355 PolarHBondContact O-N 3.45Å; D353-Y355 VanDerWaalsContact O-N 3.14Å; D353-Q356 HydrophobicContact CB-CB 4.34Å; D353-Q356 HydrophobicContact CB-CG 4.12Å; D353-Q356 PolarHBondContact O-N 2.79Å; D353-Q356 PolarHBondContact OD2-NE2 3.15Å; D353-A357 PolarHBondContact O-N 3.4Å
354	A	72.4	Confident	79.8	Confident	85 Å²	85	56.1 Å²	56.1	70%	0.702	29%	0.294	S	S	*	.	H	α-helix	trans	-58.1	-31.3	179.5	0	0	0	0	0	112.9	K358	A354-K358 WeakPolarHBondContact O-CB 3.45Å; A354-K358 PolarHBondContact O-N 3.03Å; A354-K358 VanDerWaalsContact O-N 3.09Å
355	Y	72	Confident	79.5	Confident	173 Å²	173	57.6 Å²	57.6	68%	0.678	30%	0.303	S	S	*	.	H	α-helix	trans	-67.1	-50	172.7	-177.4	-90.6	0	0	0	111.7	D353 K358 Q359	D353-Y355 PolarHBondContact O-N 3.45Å; D353-Y355 VanDerWaalsContact O-N 3.14Å; Y355-K358 PolarHBondContact O-N 2.91Å; Y355-Q359 VanDerWaalsContact CE1-OE1 3.26Å; Y355-Q359 WeakPolarHBondContact O-CB 3.38Å; Y355-Q359 PolarHBondContact O-N 2.92Å
356	Q	68.3	Low	79.3	Confident	47 Å²	47	60.8 Å²	60.8	22%	0.22	32%	0.316	C	S	.	.	H	α-helix	trans	-62.7	-46.8	-179.2	-64	-166.6	72.7	0	0	111.3	D353 K358 Q359 A360 R747	D353-Q356 HydrophobicContact CB-CB 4.34Å; D353-Q356 HydrophobicContact CB-CG 4.12Å; D353-Q356 PolarHBondContact O-N 2.79Å; D353-Q356 PolarHBondContact OD2-NE2 3.15Å; Q356-K358 PolarHBondContact O-N 3.15Å; Q356-Q359 PolarHBondContact O-N 2.85Å; Q356-A360 WeakPolarHBondContact O-CB 3.38Å; Q356-A360 PolarHBondContact O-N 2.86Å; Q356-R747 VanDerWaalsContact OE1-NH2 3.11Å
357	A	71.5	Confident	79.1	Confident	5 Å²	5	61 Å²	61	4%	0.041	32%	0.317	C	S	.	.	H	α-helix	trans	-62.7	-38.8	176.8	0	0	0	0	0	112.8	L352 D353 A360 G361 L362 P365	L352-A357 HydrophobicContact CB-CB 4.29Å; D353-A357 PolarHBondContact O-N 3.4Å; A357-A360 CarbonylContact O-C 3.58Å; A357-A360 PolarHBondContact O-N 2.88Å; A357-G361 PolarHBondContact O-N 3.45Å; A357-G361 VanDerWaalsContact O-N 3.14Å; A357-L362 PolarHBondContact O-N 3.48Å; A357-P365 HydrophobicContact CB-CB 3.6Å
358	K	72.8	Confident	79	Confident	179 Å²	179	61.2 Å²	61.2	78%	0.778	32%	0.318	S	S	*	.	H	α-helix	trans	-70.1	-41.1	176.8	-175.8	-179.7	178.5	-175.4	0	112.4	A354 Y355 Q356 A360 G361	A354-K358 WeakPolarHBondContact O-CB 3.45Å; A354-K358 PolarHBondContact O-N 3.03Å; A354-K358 VanDerWaalsContact O-N 3.09Å; Y355-K358 PolarHBondContact O-N 2.91Å; Q356-K358 PolarHBondContact O-N 3.15Å; K358-A360 PolarHBondContact O-N 2.81Å; K358-G361 PolarHBondContact O-N 2.86Å; K358-G361 VanDerWaalsContact O-N 3.12Å
359	Q	68.1	Low	79	Confident	136 Å²	136	62.5 Å²	62.5	64%	0.636	32%	0.323	S	S	*	.	H	α-helix	trans	-63.2	-33.6	173.2	-172.6	178.1	6	0	0	111.1	Y355 Q356 G361	Y355-Q359 VanDerWaalsContact CE1-OE1 3.26Å; Y355-Q359 WeakPolarHBondContact O-CB 3.38Å; Y355-Q359 PolarHBondContact O-N 2.92Å; Q356-Q359 PolarHBondContact O-N 2.85Å; Q359-G361 VanDerWaalsContact C-N 3.29Å; Q359-G361 PolarHBondContact O-N 3.07Å
360	A	66.5	Low	79	Confident	8 Å²	8	59.4 Å²	59.4	7%	0.066	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-2.3	174.2	0	0	0	0	0	115	Q356 A357 K358 L362 F745	Q356-A360 WeakPolarHBondContact O-CB 3.38Å; Q356-A360 PolarHBondContact O-N 2.86Å; A357-A360 CarbonylContact O-C 3.58Å; A357-A360 PolarHBondContact O-N 2.88Å; K358-A360 PolarHBondContact O-N 2.81Å; A360-L362 HydrophobicContact CB-CD1 3.72Å; A360-L362 HydrophobicContact CB-CG 3.71Å; A360-L362 PolarHBondContact O-N 2.93Å; A360-L362 VanDerWaalsContact O-N 3.1Å; A360-F745 VanDerWaalsContact CA-CD1 3.43Å; A360-F745 HydrophobicContact CB-CB 3.59Å; A360-F745 HydrophobicContact CB-CD1 3.96Å; A360-F745 HydrophobicContact CB-CD2 4.39Å; A360-F745 HydrophobicContact CB-CG 3.74Å; A360-F745 WeakPolarHBondContact O-CD2 3.49Å; A360-F745 WeakPolarHBondContact O-CE2 3.23Å; A360-F745 WeakPolarHBondContact O-CZ 3.5Å
361	G	73.9	Confident	79.1	Confident	63 Å²	63	57.7 Å²	57.7	65%	0.649	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	18.2	-176.3	0	0	0	0	0	114.9	A357 K358 Q359	A357-G361 PolarHBondContact O-N 3.45Å; A357-G361 VanDerWaalsContact O-N 3.14Å; K358-G361 PolarHBondContact O-N 2.86Å; K358-G361 VanDerWaalsContact O-N 3.12Å; Q359-G361 VanDerWaalsContact C-N 3.29Å; Q359-G361 PolarHBondContact O-N 3.07Å
362	L	73.4	Confident	79.2	Confident	22 Å²	22	51 Å²	51	12%	0.115	27%	0.273	C	S	.	.			trans	-77.3	136.1	-173.7	-67.4	170.4	0	0	0	111.9	L352 A357 A360 L385 E387 L742	L352-L362 HydrophobicContact CD1-CD1 3.78Å; A357-L362 PolarHBondContact O-N 3.48Å; A360-L362 HydrophobicContact CB-CD1 3.72Å; A360-L362 HydrophobicContact CB-CG 3.71Å; A360-L362 PolarHBondContact O-N 2.93Å; A360-L362 VanDerWaalsContact O-N 3.1Å; L362-L385 HydrophobicContact CD1-CD2 4.04Å; L362-E387 WeakPolarHBondContact CA-OE1 3.29Å; L362-E387 HydrophobicContact CD2-CG 4.5Å; L362-L742 HydrophobicContact CD2-CD2 3.94Å
363	V	76.6	Confident	79.5	Confident	75 Å²	75	50.6 Å²	50.6	46%	0.455	27%	0.269	S	S	.	.	S	Bend	trans	-80.2	-36.9	168.9	-171.8	0	0	0	0	110.3	E387	V363-E387 WeakPolarHBondContact CA-OE1 3.38Å; V363-E387 WeakPolarHBondContact CB-OE1 3.28Å; V363-E387 PolarHBondContact N-OE1 3Å
364	S	81.2	Confident	79.5	Confident	10 Å²	10	45.8 Å²	45.8	7%	0.07	24%	0.244	C	C	.	.	S	Bend	trans	-105.5	112.4	172.5	-158.8	0	0	0	0	111.4	Y366 E386 E387	S364-Y366 PolarHBondContact O-N 3.02Å; S364-Y366 WeakPolarHBondContact OG-CD2 3.12Å; S364-E386 PolarHBondContact OG-OE2 2.91Å; S364-E387 PolarHBondContact N-OE1 3.21Å
365	P	83.4	Confident	79.6	Confident	31 Å²	31	41.9 Å²	41.9	20%	0.201	21%	0.211	C	C	.	.			trans	-81.4	44.4	179.3	36.6	-38.3	0	0	0	111.6	K351 L352 A357	K351-P365 CarbonylContact C-O 3.59Å; K351-P365 WeakPolarHBondContact CA-O 3.27Å; K351-P365 VanDerWaalsContact CG-O 3.27Å; K351-P365 WeakPolarHBondContact CG-O 3.42Å; L352-P365 PolarHBondContact N-O 2.79Å; A357-P365 HydrophobicContact CB-CB 3.6Å
366	Y	87	Confident	79.3	Confident	67 Å²	67	37.5 Å²	37.5	26%	0.263	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	145.7	-175.1	-66.8	-79.2	0	0	0	112.5	R349 D350 K351 S364 E386	R349-Y366 VanDerWaalsContact NH2-CG 3.32Å; D350-Y366 WeakPolarHBondContact O-CA 3.34Å; K351-Y366 HydrophobicContact CB-CD1 3.83Å; K351-Y366 HydrophobicContact CB-CE1 3.62Å; K351-Y366 HydrophobicContact CD-CE1 3.97Å; K351-Y366 HydrophobicContact CG-CD1 3.92Å; K351-Y366 HydrophobicContact CG-CE1 3.56Å; S364-Y366 PolarHBondContact O-N 3.02Å; S364-Y366 WeakPolarHBondContact OG-CD2 3.12Å; Y366-E386 WeakPolarHBondContact O-CB 3.39Å; Y366-E386 PolarHBondContact O-N 3.45Å
367	L	89.4	Confident	79.2	Confident	5 Å²	5	36.7 Å²	36.7	3%	0.026	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	158.2	173	62.7	79.1	0	0	0	111.1	R349 D350 L352 R369 I384 L385	R349-L367 CarbonylContact C-O 3.13Å; R349-L367 WeakPolarHBondContact CA-O 3.5Å; D350-L367 HydrophobicContact CB-CD1 3.84Å; D350-L367 HydrophobicContact CB-CG 4.36Å; D350-L367 PolarHBondContact N-O 2.89Å; D350-L367 PolarHBondContact O-N 2.81Å; L352-L367 HydrophobicContact CD1-CD2 4.31Å; L352-L367 HydrophobicContact CD2-CD2 3.74Å; L352-L367 HydrophobicContact CG-CD2 3.99Å; L367-R369 HydrophobicContact CD1-CG 3.44Å; L367-R369 VanDerWaalsContact CD1-CG 3.44Å; L367-I384 CarbonylContact C-O 3.46Å; L367-I384 WeakPolarHBondContact CA-O 3.48Å; L367-I384 WeakPolarHBondContact CB-O 3.49Å; L367-L385 HydrophobicContact CB-CD2 4.22Å
368	Y	90.9	Very high	79.1	Confident	5 Å²	5	38.7 Å²	38.7	2%	0.02	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	115	173.8	-64.9	-84.8	0	0	0	108.8	I347 A348 R349 S383 I384 E386 L389 I423 L428	I347-Y368 HydrophobicContact CG2-CD1 4.34Å; A348-Y368 CarbonylContact O-C 3.56Å; A348-Y368 VanDerWaalsContact O-CA 3.31Å; A348-Y368 WeakPolarHBondContact O-CA 3.49Å; R349-Y368 HydrophobicContact CB-CD1 4Å; R349-Y368 HydrophobicContact CB-CE1 3.8Å; R349-Y368 WeakPolarHBondContact CD-OH 3.45Å; R349-Y368 HydrophobicContact CG-CD1 4.07Å; R349-Y368 HydrophobicContact CG-CE1 3.59Å; R349-Y368 PolarHBondContact NE-OH 2.98Å; R349-Y368 VanDerWaalsContact NE-OH 3.15Å; Y368-S383 CarbonylContact O-C 3.56Å; Y368-S383 WeakPolarHBondContact O-CA 3.25Å; Y368-I384 PolarHBondContact N-O 3.39Å; Y368-I384 PolarHBondContact O-N 2.94Å; Y368-E386 HydrophobicContact CE2-CB 3.91Å; Y368-E386 HydrophobicContact CE2-CG 3.94Å; Y368-E386 PolarHBondContact OH-OE1 3.38Å; Y368-L389 HydrophobicContact CD2-CD1 4.08Å; Y368-L389 HydrophobicContact CE2-CD1 3.7Å; Y368-I423 HydrophobicContact CD1-CG2 3.94Å; Y368-I423 HydrophobicContact CE1-CB 4.29Å; Y368-I423 HydrophobicContact CE1-CG1 4.17Å; Y368-I423 HydrophobicContact CE1-CG2 3.87Å; Y368-L428 HydrophobicContact CD1-CD1 3.76Å; Y368-L428 HydrophobicContact CD2-CD1 4.47Å; Y368-L428 HydrophobicContact CD2-CD2 4.11Å; Y368-L428 HydrophobicContact CE1-CD1 4.31Å; Y368-L428 HydrophobicContact CG-CD1 3.85Å; Y368-L428 HydrophobicContact CG-CD2 3.98Å
369	R	91.5	Very high	79.2	Confident	26 Å²	26	31.2 Å²	31.2	10%	0.098	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	134.6	169.3	-67.5	-163.4	177.1	-87.2	4.4	109.5	E290 Y320 F325 I347 A348 D350 L367	E290-R369 IonicContact OE1-NH1 3.34Å; E290-R369 PolarHBondContact OE1-NH1 2.81Å; E290-R369 IonicContact OE2-CZ 3.84Å; E290-R369 IonicContact OE2-NH1 3.36Å; E290-R369 PolarHBondContact OE2-NH1 3.3Å; E290-R369 IonicContact OE2-NH2 3.84Å; E290-R369 PolarHBondContact OE2-NH2 2.71Å; Y320-R369 PolarHBondContact OH-NH1 2.82Å; F325-R369 HydrophobicContact CZ-CB 4.08Å; I347-R369 WeakPolarHBondContact CA-O 3.15Å; A348-R369 PolarHBondContact N-O 3.32Å; A348-R369 PolarHBondContact O-N 3.08Å; D350-R369 WeakPolarHBondContact OD2-CD 3.4Å; D350-R369 IonicContact OD2-NE 3.44Å; D350-R369 PolarHBondContact OD2-NE 2.93Å; L367-R369 HydrophobicContact CD1-CG 3.44Å; L367-R369 VanDerWaalsContact CD1-CG 3.44Å
370	M	91.3	Very high	79.8	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.01	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	142.1	-175.8	-65.7	177.8	65.6	0	0	111.4	Y320 S346 I347 R381 G382 I384 L428 L429 V432	Y320-M370 WeakPolarHBondContact CE1-O 3.32Å; S346-M370 WeakPolarHBondContact O-CA 3.41Å; I347-M370 HydrophobicContact CD1-CE 3.97Å; I347-M370 HydrophobicContact CD1-CG 4.41Å; I347-M370 HydrophobicContact CG1-CE 4.44Å; I347-M370 HydrophobicContact CG1-CG 4.11Å; I347-M370 HydrophobicContact CG2-CG 4.01Å; M370-R381 WeakPolarHBondContact O-CA 3.34Å; M370-G382 PolarHBondContact N-O 3.45Å; M370-G382 PolarHBondContact O-N 3.3Å; M370-I384 HydrophobicContact SD-CD1 4.38Å; M370-L428 HydrophobicContact CE-CB 4.05Å; M370-L428 HydrophobicContact SD-CB 3.85Å; M370-L428 HydrophobicContact SD-CD2 4.13Å; M370-L428 HydrophobicContact SD-CG 4.41Å; M370-L429 HydrophobicContact CE-CD2 4Å; M370-V432 HydrophobicContact CE-CG2 4.16Å; M370-V432 HydrophobicContact SD-CG2 4.14Å
371	I	88.6	Confident	80.8	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	119.8	165.5	176.2	169.5	0	0	0	108.7	Y320 Y321 F325 V345 S346 R373 T379 F380 R381	Y320-I371 HydrophobicContact CD1-CB 4.21Å; Y320-I371 HydrophobicContact CE1-CB 4.4Å; Y321-I371 HydrophobicContact CD2-CG2 4.13Å; F325-I371 HydrophobicContact CD2-CG2 4.41Å; F325-I371 HydrophobicContact CE1-CG2 4.14Å; F325-I371 HydrophobicContact CE2-CB 4.5Å; F325-I371 HydrophobicContact CE2-CG2 3.85Å; F325-I371 HydrophobicContact CZ-CB 4.41Å; F325-I371 HydrophobicContact CZ-CG2 3.7Å; V345-I371 CarbonylContact C-O 3.59Å; V345-I371 WeakPolarHBondContact CA-O 3.41Å; S346-I371 VanDerWaalsContact CB-CG2 3.48Å; S346-I371 PolarHBondContact N-O 3.15Å; S346-I371 PolarHBondContact O-N 2.77Å; I371-R373 HydrophobicContact CD1-CG 4.48Å; I371-R373 HydrophobicContact CG1-CG 4.23Å; I371-T379 HydrophobicContact CD1-CG2 3.87Å; I371-T379 HydrophobicContact CG1-CG2 3.62Å; I371-F380 CarbonylContact C-O 3.56Å; I371-F380 WeakPolarHBondContact CA-O 3.48Å; I371-R381 HydrophobicContact CB-CG 3.76Å; I371-R381 HydrophobicContact CD1-CG 3.84Å; I371-R381 HydrophobicContact CG1-CG 3.56Å
372	V	87.6	Confident	81.5	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.006	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	113.4	177.2	-177.8	0	0	0	0	108.5	V343 V345 L374 T379 F380 L429 V433	V343-V372 HydrophobicContact CG1-CG1 4.43Å; V345-V372 HydrophobicContact CG1-CG2 4.19Å; V345-V372 HydrophobicContact CG2-CG1 4.16Å; V345-V372 HydrophobicContact CG2-CG2 4.21Å; V372-L374 HydrophobicContact CG1-CD2 3.82Å; V372-L374 HydrophobicContact CG1-CG 4.11Å; V372-T379 WeakPolarHBondContact O-CA 3.36Å; V372-F380 HydrophobicContact CB-CB 4.21Å; V372-F380 PolarHBondContact N-O 3.44Å; V372-F380 PolarHBondContact O-N 3.38Å; V372-F380 VanDerWaalsContact O-N 3.12Å; V372-L429 HydrophobicContact CG2-CD2 4.44Å; V372-V433 HydrophobicContact CG1-CG2 4.34Å
373	R	84.9	Confident	82.2	Confident	21 Å²	21	20.8 Å²	20.8	8%	0.079	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	123.5	176.3	-55.3	171.8	-179.5	91.1	-15	108.4	V343 A344 S346 I371 T379 M694	V343-R373 WeakPolarHBondContact CA-O 3.09Å; A344-R373 HydrophobicContact CB-CB 4.31Å; A344-R373 PolarHBondContact N-O 3.25Å; A344-R373 WeakPolarHBondContact O-CB 3.37Å; A344-R373 PolarHBondContact O-N 2.87Å; S346-R373 PolarHBondContact OG-NH1 3.49Å; I371-R373 HydrophobicContact CD1-CG 4.48Å; I371-R373 HydrophobicContact CG1-CG 4.23Å; R373-T379 HydrophobicContact CB-CG2 4.47Å; R373-T379 HydrophobicContact CG-CG2 3.76Å; R373-M694 HydrophobicContact CB-CE 4.5Å; R373-M694 HydrophobicContact CB-SD 3.64Å
374	L	78.8	Confident	82.8	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.005	9%	0.09	C	C	.	.			trans	-115.5	158.6	-179.7	-58.9	177.7	0	0	0	109.9	L340 V343 V372 L377 F380 M694	L340-L374 HydrophobicContact CD1-CD2 4.47Å; V343-L374 HydrophobicContact CB-CD2 4.26Å; V343-L374 HydrophobicContact CG1-CD2 3.82Å; V343-L374 HydrophobicContact CG2-CD2 3.58Å; V372-L374 HydrophobicContact CG1-CD2 3.82Å; V372-L374 HydrophobicContact CG1-CG 4.11Å; L374-L377 HydrophobicContact CB-CB 4.01Å; L374-L377 HydrophobicContact CD1-CB 4.07Å; L374-L377 HydrophobicContact CD1-CD1 3.9Å; L374-F380 HydrophobicContact CD1-CD2 4.28Å; L374-F380 HydrophobicContact CD1-CE2 3.98Å; L374-M694 VanDerWaalsContact O-CE 3.26Å; L374-M694 WeakPolarHBondContact O-CE 3.1Å
375	S	73.3	Confident	83	Confident	2 Å²	2	16.9 Å²	16.9	1%	0.014	9%	0.087	C	C	.	.	S	Bend	trans	-68	-46.6	-169	63.8	0	0	0	0	113.8	L340 P342	L340-S375 PolarHBondContact O-OG 3.11Å; P342-S375 PolarHBondContact O-N 3.01Å
376	D	66.1	Low	83.1	Confident	81 Å²	81	15.7 Å²	15.7	43%	0.433	8%	0.079	S	C	.	.	S	Bend	trans	-113.5	-10.5	-175.7	-60.4	-77.9	0	0	0	113.7	R691	D376-R691 IonicContact OD1-CZ 2.68Å; D376-R691 IonicContact OD1-NH1 3.28Å; D376-R691 PolarHBondContact OD1-NH1 3.18Å; D376-R691 IonicContact OD1-NH2 3.19Å; D376-R691 PolarHBondContact OD1-NH2 3.37Å; D376-R691 IonicContact OD2-CZ 3.4Å; D376-R691 VanDerWaalsContact OD2-CZ 3.22Å; D376-R691 IonicContact OD2-NH1 2.68Å; D376-R691 IonicContact OD2-NH2 3.58Å; D376-R691 PolarHBondContact OD2-NH2 3.06Å
377	L	66.3	Low	82.8	Confident	30 Å²	30	12.7 Å²	12.7	16%	0.157	7%	0.068	C	C	.	.	S	Bend	trans	-101.2	161.3	-177.7	-57.1	178.2	0	0	0	112.1	L129 L130 L340 L374	L129-L377 HydrophobicContact CB-CD2 3.69Å; L129-L377 HydrophobicContact CD1-CD2 3.75Å; L129-L377 HydrophobicContact CG-CD2 4.39Å; L130-L377 HydrophobicContact CD2-CD1 3.69Å; L130-L377 HydrophobicContact CG-CD1 3.94Å; L340-L377 HydrophobicContact CD2-CD1 4.27Å; L374-L377 HydrophobicContact CB-CB 4.01Å; L374-L377 HydrophobicContact CD1-CB 4.07Å; L374-L377 HydrophobicContact CD1-CD1 3.9Å
378	S	69.1	Low	82.4	Confident	48 Å²	48	12.5 Å²	12.5	34%	0.336	7%	0.067	S	C	.	.			trans	-62.1	151	174.4	23.6	0	0	0	0	111.7	A124 F380	A124-S378 VanDerWaalsContact CA-OG 3.28Å; A124-S378 WeakPolarHBondContact CA-OG 3.27Å; A124-S378 WeakPolarHBondContact CB-OG 3.38Å; S378-F380 PolarHBondContact O-N 3.23Å
379	T	75.9	Confident	82	Confident	22 Å²	22	12.4 Å²	12.4	14%	0.135	7%	0.066	C	C	.	.			trans	-87.1	106	-173.2	-67.4	0	0	0	0	111	S121 I371 V372 R373 R381	S121-T379 PolarHBondContact OG-O 2.6Å; I371-T379 HydrophobicContact CD1-CG2 3.87Å; I371-T379 HydrophobicContact CG1-CG2 3.62Å; V372-T379 WeakPolarHBondContact O-CA 3.36Å; R373-T379 HydrophobicContact CB-CG2 4.47Å; R373-T379 HydrophobicContact CG-CG2 3.76Å; T379-R381 HydrophobicContact CG2-CG 4.37Å; T379-R381 PolarHBondContact O-NE 3.07Å; T379-R381 PolarHBondContact O-NH2 3.36Å
380	F	80.5	Confident	81.3	Confident	3 Å²	3	13.4 Å²	13.4	1%	0.013	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	125.8	176.9	-72	-111	0	0	0	111.4	A124 D125 L130 I371 V372 L374 S378 V432	A124-F380 HydrophobicContact CB-CD1 4.34Å; A124-F380 HydrophobicContact CB-CD2 3.77Å; A124-F380 HydrophobicContact CB-CE1 4.24Å; A124-F380 HydrophobicContact CB-CE2 3.62Å; A124-F380 HydrophobicContact CB-CG 4.12Å; A124-F380 HydrophobicContact CB-CZ 3.88Å; A124-F380 WeakPolarHBondContact O-CZ 3.35Å; D125-F380 VanDerWaalsContact CA-CE1 3.48Å; D125-F380 HydrophobicContact CB-CD1 4.31Å; D125-F380 HydrophobicContact CB-CE1 3.64Å; D125-F380 HydrophobicContact CB-CZ 4.41Å; L130-F380 HydrophobicContact CD1-CE2 4.43Å; L130-F380 HydrophobicContact CD1-CZ 3.79Å; I371-F380 CarbonylContact C-O 3.56Å; I371-F380 WeakPolarHBondContact CA-O 3.48Å; V372-F380 HydrophobicContact CB-CB 4.21Å; V372-F380 PolarHBondContact N-O 3.44Å; V372-F380 PolarHBondContact O-N 3.38Å; V372-F380 VanDerWaalsContact O-N 3.12Å; L374-F380 HydrophobicContact CD1-CD2 4.28Å; L374-F380 HydrophobicContact CD1-CE2 3.98Å; S378-F380 PolarHBondContact O-N 3.23Å; F380-V432 HydrophobicContact CD1-CG1 4.19Å
381	R	86.5	Confident	80.7	Confident	6 Å²	6	16 Å²	16	2%	0.023	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	141.1	174.8	-73.9	152.7	-68.2	115.2	12.7	110.9	Y117 D118 S121 H316 Y320 M370 I371 T379	Y117-R381 WeakPolarHBondContact CB-O 3.24Å; Y117-R381 HydrophobicContact CD1-CB 4.37Å; Y117-R381 HydrophobicContact CG-CB 4.48Å; Y117-R381 PolarHBondContact N-O 3.46Å; D118-R381 VanDerWaalsContact CG-NH1 3.26Å; D118-R381 IonicContact OD1-CZ 3.22Å; D118-R381 IonicContact OD1-NH1 2.73Å; D118-R381 PolarHBondContact OD1-NH1 3.36Å; D118-R381 IonicContact OD1-NH2 2.71Å; D118-R381 PolarHBondContact OD1-NH2 3.28Å; D118-R381 IonicContact OD2-CZ 2.64Å; D118-R381 IonicContact OD2-NH1 3.18Å; D118-R381 PolarHBondContact OD2-NH1 2.94Å; D118-R381 IonicContact OD2-NH2 3.24Å; D118-R381 PolarHBondContact OD2-NH2 3.39Å; S121-R381 WeakPolarHBondContact CB-O 3.49Å; S121-R381 PolarHBondContact OG-N 2.84Å; S121-R381 PolarHBondContact OG-NH2 2.86Å; S121-R381 PolarHBondContact OG-O 3.26Å; H316-R381 PolarHBondContact O-NH1 2.83Å; Y320-R381 HydrophobicContact CD1-CB 3.84Å; Y320-R381 HydrophobicContact CD1-CG 3.51Å; Y320-R381 HydrophobicContact CE1-CB 3.92Å; Y320-R381 HydrophobicContact CE1-CG 3.96Å; Y320-R381 HydrophobicContact CG-CB 4.27Å; Y320-R381 HydrophobicContact CG-CG 4.13Å; M370-R381 WeakPolarHBondContact O-CA 3.34Å; I371-R381 HydrophobicContact CB-CG 3.76Å; I371-R381 HydrophobicContact CD1-CG 3.84Å; I371-R381 HydrophobicContact CG1-CG 3.56Å; T379-R381 HydrophobicContact CG2-CG 4.37Å; T379-R381 PolarHBondContact O-NE 3.07Å; T379-R381 PolarHBondContact O-NH2 3.36Å
382	G	88.7	Confident	80.4	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.4	-167.5	-176.1	0	0	0	0	0	113	F114 A115 Y320 M370	F114-G382 VanDerWaalsContact CZ-CA 3.47Å; A115-G382 CarbonylContact O-C 3.5Å; A115-G382 WeakPolarHBondContact O-CA 3.23Å; Y320-G382 PolarHBondContact OH-O 3.34Å; M370-G382 PolarHBondContact N-O 3.45Å; M370-G382 PolarHBondContact O-N 3.3Å
383	S	89.5	Confident	79.8	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	151.9	-179.1	64.5	0	0	0	0	114.1	A115 Y368 N746	A115-S383 PolarHBondContact N-O 3.18Å; A115-S383 PolarHBondContact O-N 3.37Å; Y368-S383 CarbonylContact O-C 3.56Å; Y368-S383 WeakPolarHBondContact O-CA 3.25Å; S383-N746 PolarHBondContact O-ND2 2.97Å; S383-N746 PolarHBondContact OG-ND2 3.48Å; S383-N746 PolarHBondContact OG-OD1 2.94Å
384	I	88.2	Confident	79.3	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	130.9	172.7	-57	-175.9	0	0	0	108	F114 L367 Y368 M370 S388 L389 L428 L431 V432	F114-I384 HydrophobicContact CB-CG1 4.43Å; F114-I384 HydrophobicContact CD2-CD1 4.22Å; F114-I384 HydrophobicContact CD2-CG1 3.85Å; L367-I384 CarbonylContact C-O 3.46Å; L367-I384 WeakPolarHBondContact CA-O 3.48Å; L367-I384 WeakPolarHBondContact CB-O 3.49Å; Y368-I384 PolarHBondContact N-O 3.39Å; Y368-I384 PolarHBondContact O-N 2.94Å; M370-I384 HydrophobicContact SD-CD1 4.38Å; I384-S388 WeakPolarHBondContact CG2-OG 3.45Å; I384-L389 HydrophobicContact CG2-CD2 3.79Å; I384-L389 HydrophobicContact CG2-CG 4.44Å; I384-L428 HydrophobicContact CB-CD2 4.19Å; I384-L428 HydrophobicContact CD1-CD2 3.89Å; I384-L428 HydrophobicContact CG1-CD2 4.48Å; I384-L428 HydrophobicContact CG2-CD2 4.41Å; I384-L431 HydrophobicContact CD1-CB 4.11Å; I384-L431 HydrophobicContact CD1-CD1 4.16Å; I384-V432 HydrophobicContact CD1-CG2 3.69Å
385	L	85.4	Confident	79.2	Confident	3 Å²	3	26.9 Å²	26.9	2%	0.016	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	140	174.9	-70.5	166.9	0	0	0	109.9	L352 L362 L367 E387 S388 L742 N746	L352-L385 HydrophobicContact CD1-CD2 4.2Å; L362-L385 HydrophobicContact CD1-CD2 4.04Å; L367-L385 HydrophobicContact CB-CD2 4.22Å; L385-E387 PolarHBondContact O-N 2.86Å; L385-S388 PolarHBondContact O-N 3.13Å; L385-S388 PolarHBondContact O-OG 3.08Å; L385-L742 WeakPolarHBondContact CD1-O 3.35Å; L385-N746 HydrophobicContact CD1-CB 4.03Å; L385-N746 HydrophobicContact CG-CB 4.32Å
386	E	85.9	Confident	79.1	Confident	7 Å²	7	30 Å²	30	3%	0.033	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-61.6	-31	-178.5	-178.6	166.2	-100.2	0	0	112.7	R349 S364 Y366 Y368 S388 L389 Y392	R349-E386 IonicContact CZ-OE1 2.75Å; R349-E386 IonicContact CZ-OE2 2.89Å; R349-E386 IonicContact NE-OE1 3.51Å; R349-E386 PolarHBondContact NE-OE1 3.47Å; R349-E386 IonicContact NH2-OE1 3.08Å; R349-E386 PolarHBondContact NH2-OE1 2.94Å; R349-E386 IonicContact NH2-OE2 3.9Å; R349-E386 PolarHBondContact NH2-OE2 2.92Å; S364-E386 PolarHBondContact OG-OE2 2.91Å; Y366-E386 WeakPolarHBondContact O-CB 3.39Å; Y366-E386 PolarHBondContact O-N 3.45Å; Y368-E386 HydrophobicContact CE2-CB 3.91Å; Y368-E386 HydrophobicContact CE2-CG 3.94Å; Y368-E386 PolarHBondContact OH-OE1 3.38Å; E386-S388 VanDerWaalsContact C-N 3.34Å; E386-S388 PolarHBondContact O-N 3.44Å; E386-L389 PolarHBondContact O-N 3.27Å; E386-Y392 HydrophobicContact CG-CD2 3.82Å; E386-Y392 HydrophobicContact CG-CE2 4.3Å; E386-Y392 HydrophobicContact CG-CG 4.36Å; E386-Y392 VanDerWaalsContact O-CB 3.24Å; E386-Y392 WeakPolarHBondContact O-CB 3.31Å
387	E	81.3	Confident	79.5	Confident	4 Å²	4	32.1 Å²	32.1	2%	0.019	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-75.1	-16.7	177.4	-61.9	-153.5	-115.8	0	0	114.8	L362 V363 S364 L385 L389 Y392 Q393 R396 L742	L362-E387 WeakPolarHBondContact CA-OE1 3.29Å; L362-E387 HydrophobicContact CD2-CG 4.5Å; V363-E387 WeakPolarHBondContact CA-OE1 3.38Å; V363-E387 WeakPolarHBondContact CB-OE1 3.28Å; V363-E387 PolarHBondContact N-OE1 3Å; S364-E387 PolarHBondContact N-OE1 3.21Å; L385-E387 PolarHBondContact O-N 2.86Å; E387-L389 VanDerWaalsContact C-N 3.3Å; E387-Y392 HydrophobicContact CB-CD1 4.21Å; E387-Y392 HydrophobicContact CB-CE1 4.16Å; E387-Y392 HydrophobicContact CG-CD1 4.08Å; E387-Y392 HydrophobicContact CG-CE1 3.57Å; E387-Q393 VanDerWaalsContact O-CG 3.28Å; E387-Q393 WeakPolarHBondContact O-CG 3.19Å; E387-Q393 PolarHBondContact O-NE2 3.26Å; E387-R396 IonicContact OE2-CZ 2.66Å; E387-R396 IonicContact OE2-NH1 3.17Å; E387-R396 PolarHBondContact OE2-NH1 3.15Å; E387-L742 HydrophobicContact CB-CD1 3.97Å; E387-L742 HydrophobicContact CB-CD2 4.16Å; E387-L742 WeakPolarHBondContact O-CD1 3.46Å
388	S	79.9	Confident	79.8	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.007	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-81.3	-12.3	175.8	70.4	0	0	0	0	112.6	I384 L385 E386 Q393	I384-S388 WeakPolarHBondContact CG2-OG 3.45Å; L385-S388 PolarHBondContact O-N 3.13Å; L385-S388 PolarHBondContact O-OG 3.08Å; E386-S388 VanDerWaalsContact C-N 3.34Å; E386-S388 PolarHBondContact O-N 3.44Å; S388-Q393 PolarHBondContact O-NE2 2.6Å
389	L	82.7	Confident	79.6	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	20%	0.196	C	C	.	.	S	Bend	trans	-68.2	127.2	175.9	-61.3	-179.3	0	0	0	112.1	Y368 I384 E386 E387 S391 Y392 Q393 P424 L428 L431	Y368-L389 HydrophobicContact CD2-CD1 4.08Å; Y368-L389 HydrophobicContact CE2-CD1 3.7Å; I384-L389 HydrophobicContact CG2-CD2 3.79Å; I384-L389 HydrophobicContact CG2-CG 4.44Å; E386-L389 PolarHBondContact O-N 3.27Å; E387-L389 VanDerWaalsContact C-N 3.3Å; L389-S391 VanDerWaalsContact C-N 3.27Å; L389-S391 PolarHBondContact O-N 3.08Å; L389-Y392 PolarHBondContact O-N 3.36Å; L389-Y392 VanDerWaalsContact O-N 3.09Å; L389-Q393 PolarHBondContact O-N 3.03Å; L389-Q393 VanDerWaalsContact O-N 3.08Å; L389-P424 HydrophobicContact CD1-CG 3.73Å; L389-L428 HydrophobicContact CD1-CD2 4.44Å; L389-L428 HydrophobicContact CD2-CD2 3.86Å; L389-L431 HydrophobicContact CD2-CD1 3.72Å
390	P	77.3	Confident	79.4	Confident	47 Å²	47	42.4 Å²	42.4	31%	0.305	21%	0.213	S	C	.	.	H	α-helix	trans	-53	-39.9	175.4	-29.4	35.9	0	0	0	114.1	Y392 Q393 M394 E427	P390-Y392 PolarHBondContact O-N 3.49Å; P390-Q393 PolarHBondContact O-N 2.81Å; P390-M394 WeakPolarHBondContact O-CG 3.42Å; P390-M394 PolarHBondContact O-N 3.24Å; P390-E427 WeakPolarHBondContact CD-OE1 3.36Å
391	S	78	Confident	78.9	Confident	56 Å²	56	46.6 Å²	46.6	39%	0.392	25%	0.249	S	C	.	.	H	α-helix	trans	-63	-39	177.6	65.8	0	0	0	0	113.2	L389 A395 E427	L389-S391 VanDerWaalsContact C-N 3.27Å; L389-S391 PolarHBondContact O-N 3.08Å; S391-A395 WeakPolarHBondContact O-CB 3.45Å; S391-A395 PolarHBondContact O-N 3.49Å; S391-A395 VanDerWaalsContact O-N 3.07Å; S391-E427 VanDerWaalsContact CB-OE1 3.32Å; S391-E427 WeakPolarHBondContact CB-OE1 3.28Å; S391-E427 WeakPolarHBondContact CB-OE2 3.23Å; S391-E427 PolarHBondContact N-OE1 3.12Å; S391-E427 VanDerWaalsContact OG-CD 3.3Å; S391-E427 PolarHBondContact OG-OE1 2.92Å; S391-E427 PolarHBondContact OG-OE2 3Å
392	Y	81.9	Confident	78.1	Confident	50 Å²	50	49.7 Å²	49.7	20%	0.196	28%	0.275	C	S	.	.	H	α-helix	trans	-67.2	-44.6	174.9	-177.1	-85.4	0	0	0	111.1	E386 E387 L389 P390 M394 A395 R396	E386-Y392 HydrophobicContact CG-CD2 3.82Å; E386-Y392 HydrophobicContact CG-CE2 4.3Å; E386-Y392 HydrophobicContact CG-CG 4.36Å; E386-Y392 VanDerWaalsContact O-CB 3.24Å; E386-Y392 WeakPolarHBondContact O-CB 3.31Å; E387-Y392 HydrophobicContact CB-CD1 4.21Å; E387-Y392 HydrophobicContact CB-CE1 4.16Å; E387-Y392 HydrophobicContact CG-CD1 4.08Å; E387-Y392 HydrophobicContact CG-CE1 3.57Å; L389-Y392 PolarHBondContact O-N 3.36Å; L389-Y392 VanDerWaalsContact O-N 3.09Å; P390-Y392 PolarHBondContact O-N 3.49Å; Y392-M394 PolarHBondContact O-N 3.09Å; Y392-A395 PolarHBondContact O-N 3.21Å; Y392-R396 HydrophobicContact CE1-CB 4.34Å; Y392-R396 WeakPolarHBondContact O-CB 3.39Å; Y392-R396 PolarHBondContact O-N 2.9Å
393	Q	76.2	Confident	76.6	Confident	45 Å²	45	52.8 Å²	52.8	21%	0.21	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-47	179.3	-67.1	178.1	15.9	0	0	111.4	E387 S388 L389 P390 A395 R396 E397	E387-Q393 VanDerWaalsContact O-CG 3.28Å; E387-Q393 WeakPolarHBondContact O-CG 3.19Å; E387-Q393 PolarHBondContact O-NE2 3.26Å; S388-Q393 PolarHBondContact O-NE2 2.6Å; L389-Q393 PolarHBondContact O-N 3.03Å; L389-Q393 VanDerWaalsContact O-N 3.08Å; P390-Q393 PolarHBondContact O-N 2.81Å; Q393-A395 PolarHBondContact O-N 3.3Å; Q393-R396 PolarHBondContact O-N 3.13Å; Q393-E397 WeakPolarHBondContact O-CG 3.1Å; Q393-E397 PolarHBondContact O-N 3.42Å
394	M	74	Confident	74.9	Confident	118 Å²	118	59 Å²	59	58%	0.581	34%	0.336	S	S	*	.	H	α-helix	trans	-62	-39.8	175.7	-68.8	-176.7	-167.9	0	0	112.6	P390 Y392 Q398	P390-M394 WeakPolarHBondContact O-CG 3.42Å; P390-M394 PolarHBondContact O-N 3.24Å; Y392-M394 PolarHBondContact O-N 3.09Å; M394-Q398 WeakPolarHBondContact O-CB 3.5Å; M394-Q398 VanDerWaalsContact O-CG 3.28Å; M394-Q398 WeakPolarHBondContact O-CG 3.14Å; M394-Q398 PolarHBondContact O-N 2.79Å
395	A	76.2	Confident	72.9	Confident	40 Å²	40	65 Å²	65	33%	0.331	38%	0.375	S	S	.	.	H	α-helix	trans	-65	-41	175.6	0	0	0	0	0	111.9	S391 Y392 Q393 Q398 M399	S391-A395 WeakPolarHBondContact O-CB 3.45Å; S391-A395 PolarHBondContact O-N 3.49Å; S391-A395 VanDerWaalsContact O-N 3.07Å; Y392-A395 PolarHBondContact O-N 3.21Å; Q393-A395 PolarHBondContact O-N 3.3Å; A395-Q398 PolarHBondContact O-N 3.42Å; A395-M399 WeakPolarHBondContact O-CG 3.36Å; A395-M399 PolarHBondContact O-N 2.81Å
396	R	71.6	Confident	71.1	Confident	67 Å²	67	69.5 Å²	69.5	25%	0.253	40%	0.399	S	S	.	.	H	α-helix	trans	-66.5	-41.7	177.7	-160.6	-177.3	75.4	177.9	4.5	111.8	E387 Y392 Q393 M399 Q400	E387-R396 IonicContact OE2-CZ 2.66Å; E387-R396 IonicContact OE2-NH1 3.17Å; E387-R396 PolarHBondContact OE2-NH1 3.15Å; Y392-R396 HydrophobicContact CE1-CB 4.34Å; Y392-R396 WeakPolarHBondContact O-CB 3.39Å; Y392-R396 PolarHBondContact O-N 2.9Å; Q393-R396 PolarHBondContact O-N 3.13Å; R396-M399 PolarHBondContact O-N 2.93Å; R396-Q400 WeakPolarHBondContact O-CB 3.24Å; R396-Q400 VanDerWaalsContact O-CG 3.3Å; R396-Q400 WeakPolarHBondContact O-CG 3.28Å; R396-Q400 PolarHBondContact O-N 3.48Å
397	E	74.6	Confident	69	Low	125 Å²	125	72 Å²	72	58%	0.584	42%	0.416	S	S	*	.	H	α-helix	trans	-63.8	-40.2	174.5	-73.6	-175.5	168.5	0	0	112	Q393 Q400 A401	Q393-E397 WeakPolarHBondContact O-CG 3.1Å; Q393-E397 PolarHBondContact O-N 3.42Å; E397-Q400 PolarHBondContact O-N 2.99Å; E397-A401 WeakPolarHBondContact O-CB 3.38Å; E397-A401 PolarHBondContact O-N 3.05Å
398	Q	72	Confident	67.1	Low	119 Å²	119	78.1 Å²	78.1	56%	0.556	46%	0.457	S	S	*	.	H	α-helix	trans	-63.6	-40.9	174.3	-73.8	173	27.6	0	0	112.4	M394 A395 A401 A402	M394-Q398 WeakPolarHBondContact O-CB 3.5Å; M394-Q398 VanDerWaalsContact O-CG 3.28Å; M394-Q398 WeakPolarHBondContact O-CG 3.14Å; M394-Q398 PolarHBondContact O-N 2.79Å; A395-Q398 PolarHBondContact O-N 3.42Å; Q398-A401 PolarHBondContact O-N 2.75Å; Q398-A402 VanDerWaalsContact O-CB 3.27Å; Q398-A402 WeakPolarHBondContact O-CB 3.4Å; Q398-A402 PolarHBondContact O-N 3.01Å
399	M	66.3	Low	65.2	Low	94 Å²	94	83.4 Å²	83.4	46%	0.463	49%	0.489	S	S	.	.	H	α-helix	trans	-65.5	-39.7	175	-70.3	-179.8	-173.7	0	0	112.4	A395 R396 A402 G403	A395-M399 WeakPolarHBondContact O-CG 3.36Å; A395-M399 PolarHBondContact O-N 2.81Å; R396-M399 PolarHBondContact O-N 2.93Å; M399-A402 PolarHBondContact O-N 2.86Å; M399-G403 PolarHBondContact O-N 3.21Å
400	Q	70.5	Confident	63.1	Low	103 Å²	103	86.7 Å²	86.7	48%	0.481	52%	0.524	S	S	.	.	H	α-helix	trans	-66.1	-42.1	175.8	-72.7	174.7	-4.4	0	0	111.8	R396 E397 A402 G403	R396-Q400 WeakPolarHBondContact O-CB 3.24Å; R396-Q400 VanDerWaalsContact O-CG 3.3Å; R396-Q400 WeakPolarHBondContact O-CG 3.28Å; R396-Q400 PolarHBondContact O-N 3.48Å; E397-Q400 PolarHBondContact O-N 2.99Å; Q400-A402 VanDerWaalsContact C-N 3.31Å; Q400-A402 PolarHBondContact O-N 2.77Å; Q400-G403 PolarHBondContact O-N 2.71Å
401	A	69.3	Low	61.1	Low	92 Å²	92	87.6 Å²	87.6	76%	0.76	54%	0.535	S	S	*	.	H	α-helix	trans	-67.5	-29	174.6	0	0	0	0	0	113.2	E397 Q398 G403	E397-A401 WeakPolarHBondContact O-CB 3.38Å; E397-A401 PolarHBondContact O-N 3.05Å; Q398-A401 PolarHBondContact O-N 2.75Å; A401-G403 PolarHBondContact O-N 2.73Å
402	A	71.6	Confident	59.2	Low	70 Å²	70	89 Å²	89	58%	0.579	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-1.1	174.8	0	0	0	0	0	114	Q398 M399 Q400 Q404	Q398-A402 VanDerWaalsContact O-CB 3.27Å; Q398-A402 WeakPolarHBondContact O-CB 3.4Å; Q398-A402 PolarHBondContact O-N 3.01Å; M399-A402 PolarHBondContact O-N 2.86Å; Q400-A402 VanDerWaalsContact C-N 3.31Å; Q400-A402 PolarHBondContact O-N 2.77Å; A402-Q404 PolarHBondContact O-N 3.26Å
403	G	55.5	Low	56.8	Low	65 Å²	65	91.8 Å²	91.8	67%	0.67	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	68.6	12.9	172.9	0	0	0	0	0	115.8	M399 Q400 A401	M399-G403 PolarHBondContact O-N 3.21Å; Q400-G403 PolarHBondContact O-N 2.71Å; A401-G403 PolarHBondContact O-N 2.73Å
404	Q	54.9	Low	54.7	Low	131 Å²	131	94.7 Å²	94.7	61%	0.612	60%	0.595	S	S	*	*			trans	-82.2	135.1	177.1	-66.1	-167.4	0.4	0	0	110.9	A402 L406	A402-Q404 PolarHBondContact O-N 3.26Å; Q404-L406 PolarHBondContact O-N 3.4Å
405	P	46.7	Very low	52.6	Low	125 Å²	125	96.4 Å²	96.4	81%	0.812	61%	0.613	S	S	*	*			trans	-69.9	133	-177.5	27.9	-34.2	0	0	0	111.6	S407	P405-S407 PolarHBondContact O-N 3.32Å; P405-S407 VanDerWaalsContact O-N 3.11Å
406	L	46.2	Very low	50.2	Low	99 Å²	99	97.7 Å²	97.7	52%	0.518	63%	0.63	S	S	.	*			trans	-67.1	106.4	174.4	-77.4	162.4	0	0	0	110.6	Q404	Q404-L406 PolarHBondContact O-N 3.4Å
407	S	41.7	Very low	48.1	Very low	58 Å²	58	102.7 Å²	102.7	41%	0.406	66%	0.656	S	S	.	*			trans	-65.3	132.5	163.6	176.9	0	0	0	0	109.7	P405 T409 G410	P405-S407 PolarHBondContact O-N 3.32Å; P405-S407 VanDerWaalsContact O-N 3.11Å; S407-T409 PolarHBondContact O-N 2.97Å; S407-T409 PolarHBondContact OG-OG1 3.21Å; S407-G410 PolarHBondContact O-N 2.81Å
408	P	41.2	Very low	46	Very low	133 Å²	133	104 Å²	104	86%	0.864	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	2.9	-179.7	29.5	-36.4	0	0	0	114.2
409	T	40.6	Very low	44.1	Very low	112 Å²	112	102.4 Å²	102.4	69%	0.687	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	-2.5	172.5	55.2	0	0	0	0	114.1	S407 A411	S407-T409 PolarHBondContact O-N 2.97Å; S407-T409 PolarHBondContact OG-OG1 3.21Å; T409-A411 PolarHBondContact O-N 3.01Å; T409-A411 VanDerWaalsContact O-N 3.08Å
410	G	37.8	Very low	43	Very low	72 Å²	72	102.8 Å²	102.8	74%	0.742	69%	0.687	S	S	*	*			trans	65.8	7.5	177.4	0	0	0	0	0	115.6	S407	S407-G410 PolarHBondContact O-N 2.81Å
411	A	35.7	Very low	42.2	Very low	65 Å²	65	103.8 Å²	103.8	54%	0.537	70%	0.695	S	S	.	*			trans	-99.5	127.1	-179.4	0	0	0	0	0	111.2	T409 A413	T409-A411 PolarHBondContact O-N 3.01Å; T409-A411 VanDerWaalsContact O-N 3.08Å; A411-A413 PolarHBondContact O-N 2.9Å
412	V	39.6	Very low	42.1	Very low	86 Å²	86	106.2 Å²	106.2	52%	0.521	69%	0.688	S	S	.	*			trans	-73.7	117.8	174	-178.2	0	0	0	0	109.2	T414	V412-T414 HydrophobicContact CG1-CG2 3.92Å; V412-T414 WeakPolarHBondContact CG1-OG1 3.35Å; V412-T414 PolarHBondContact O-N 2.87Å
413	A	30.2	Very low	42.4	Very low	108 Å²	108	104.1 Å²	104.1	89%	0.893	67%	0.667	S	S	*	*			trans	-81.2	59.8	175.2	0	0	0	0	0	111.7	A411	A411-A413 PolarHBondContact O-N 2.9Å
414	T	33.5	Very low	43.8	Very low	106 Å²	106	102.6 Å²	102.6	65%	0.65	65%	0.645	S	S	*	*	S	Bend	trans	-117.6	149.9	166.8	57.3	0	0	0	0	110.7	V412 G416	V412-T414 HydrophobicContact CG1-CG2 3.92Å; V412-T414 WeakPolarHBondContact CG1-OG1 3.35Å; V412-T414 PolarHBondContact O-N 2.87Å; T414-G416 PolarHBondContact O-N 3.42Å; T414-G416 VanDerWaalsContact O-N 3.13Å
415	T	28.7	Very low	45.2	Very low	155 Å²	155	96.7 Å²	96.7	95%	0.951	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	110.3	-158.1	-41.7	0	0	0	0	113.7
416	G	26.1	Very low	47	Very low	67 Å²	67	94.7 Å²	94.7	69%	0.691	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	85.8	40.1	150.3	0	0	0	0	0	118.2	T414	T414-G416 PolarHBondContact O-N 3.42Å; T414-G416 VanDerWaalsContact O-N 3.13Å
417	Q	28.1	Very low	48.8	Very low	172 Å²	172	91.7 Å²	91.7	80%	0.804	58%	0.58	S	S	*	*			trans	-153.6	83.1	159.3	-129.6	162.4	89.8	0	0	114.7	S419	Q417-S419 PolarHBondContact O-N 3.07Å
418	T	29.1	Very low	51	Low	153 Å²	153	89 Å²	89	94%	0.939	56%	0.561	S	S	*	*			trans	-76.9	54.9	165	56	0	0	0	0	110.9
419	S	32.5	Very low	53	Low	85 Å²	85	82.7 Å²	82.7	59%	0.594	52%	0.52	S	S	*	.			trans	-71	132.9	171.5	54.9	0	0	0	0	109	Q417 L421	Q417-S419 PolarHBondContact O-N 3.07Å; S419-L421 PolarHBondContact O-N 3.32Å
420	S	43.6	Very low	55	Low	101 Å²	101	82 Å²	82	71%	0.706	51%	0.509	S	S	*	.			trans	-59.1	133.4	179.4	48.7	0	0	0	0	110.6	K422	S420-K422 PolarHBondContact O-N 3.21Å
421	L	53.5	Low	56.8	Low	125 Å²	125	79.8 Å²	79.8	65%	0.654	48%	0.48	S	S	*	.			trans	-56.2	107.2	161.4	-74.5	170.3	0	0	0	106.9	S419 I423	S419-L421 PolarHBondContact O-N 3.32Å; L421-I423 PolarHBondContact O-N 2.84Å
422	K	68.1	Low	58.9	Low	142 Å²	142	77.3 Å²	77.3	62%	0.617	46%	0.458	S	S	*	.			trans	-63.5	132.2	178.7	-71.2	-172.7	174.9	-170.8	0	108	S420	S420-K422 PolarHBondContact O-N 3.21Å
423	I	76.8	Confident	60.7	Low	26 Å²	26	73.5 Å²	73.5	13%	0.133	44%	0.435	C	S	.	.			trans	-49.3	124.2	176.6	-57.5	-172.8	0	0	0	108.3	Q331 I347 Y368 L421 V425 L428	Q331-I423 HydrophobicContact CG-CD1 4.25Å; I347-I423 HydrophobicContact CG2-CD1 4.34Å; I347-I423 HydrophobicContact CG2-CG2 3.81Å; Y368-I423 HydrophobicContact CD1-CG2 3.94Å; Y368-I423 HydrophobicContact CE1-CB 4.29Å; Y368-I423 HydrophobicContact CE1-CG1 4.17Å; Y368-I423 HydrophobicContact CE1-CG2 3.87Å; L421-I423 PolarHBondContact O-N 2.84Å; I423-V425 HydrophobicContact CB-CG2 4.06Å; I423-V425 HydrophobicContact CG2-CG2 3.72Å; I423-V425 PolarHBondContact O-N 3.46Å; I423-L428 HydrophobicContact CG2-CD1 3.58Å
424	P	84.4	Confident	62.7	Low	33 Å²	33	70.8 Å²	70.8	21%	0.214	41%	0.41	C	S	.	.			trans	-80.2	61.1	-177.1	32	-33.8	0	0	0	110.3	L389 K426 E427 L428	L389-P424 HydrophobicContact CD1-CG 3.73Å; P424-K426 PolarHBondContact O-N 2.95Å; P424-K426 VanDerWaalsContact O-N 3.08Å; P424-E427 HydrophobicContact CB-CB 4.26Å; P424-E427 PolarHBondContact O-N 2.89Å; P424-L428 HydrophobicContact CG-CD1 4.19Å; P424-L428 HydrophobicContact CG-CG 4.25Å; P424-L428 PolarHBondContact O-N 3.4Å
425	V	84.8	Confident	64.7	Low	7 Å²	7	69.1 Å²	69.1	4%	0.042	40%	0.397	C	S	.	.	H	α-helix	trans	-52.9	-38.2	-168.1	-178.1	0	0	0	0	113	Y333 I347 I423 L429 I707	Y333-V425 HydrophobicContact CD2-CG1 4.37Å; Y333-V425 HydrophobicContact CE2-CG1 4.14Å; Y333-V425 HydrophobicContact CE2-CG2 3.8Å; I347-V425 HydrophobicContact CD1-CB 4.39Å; I347-V425 HydrophobicContact CD1-CG1 3.83Å; I347-V425 HydrophobicContact CD1-CG2 4.21Å; I423-V425 HydrophobicContact CB-CG2 4.06Å; I423-V425 HydrophobicContact CG2-CG2 3.72Å; I423-V425 PolarHBondContact O-N 3.46Å; V425-L429 HydrophobicContact CG1-CD1 3.88Å; V425-L429 HydrophobicContact CG1-CG 4.33Å; V425-L429 WeakPolarHBondContact O-CB 3.45Å; V425-L429 VanDerWaalsContact O-CG 3.25Å; V425-L429 WeakPolarHBondContact O-CG 3.31Å; V425-L429 PolarHBondContact O-N 2.87Å; V425-I707 HydrophobicContact CG1-CD1 3.73Å
426	K	83.9	Confident	67.1	Low	83 Å²	83	62.2 Å²	62.2	36%	0.361	35%	0.354	S	S	.	.	H	α-helix	trans	-66.2	-47.4	178.1	179	166.1	175.8	166.2	0	112.4	P424 L429 E430	P424-K426 PolarHBondContact O-N 2.95Å; P424-K426 VanDerWaalsContact O-N 3.08Å; K426-L429 PolarHBondContact O-N 3.25Å; K426-E430 WeakPolarHBondContact CE-OE1 3.39Å; K426-E430 HydrophobicContact CG-CG 4.4Å; K426-E430 IonicContact NZ-OE1 3.13Å; K426-E430 WeakPolarHBondContact O-CB 3.39Å; K426-E430 WeakPolarHBondContact O-CG 3.49Å; K426-E430 PolarHBondContact O-N 2.87Å
427	E	85.2	Confident	69.6	Low	37 Å²	37	63.8 Å²	63.8	17%	0.173	35%	0.346	C	S	.	.	H	α-helix	trans	-63.6	-42.3	177.7	-175.6	177.3	-157.8	0	0	110.8	P390 S391 P424 L429 E430 L431	P390-E427 WeakPolarHBondContact CD-OE1 3.36Å; S391-E427 VanDerWaalsContact CB-OE1 3.32Å; S391-E427 WeakPolarHBondContact CB-OE1 3.28Å; S391-E427 WeakPolarHBondContact CB-OE2 3.23Å; S391-E427 PolarHBondContact N-OE1 3.12Å; S391-E427 VanDerWaalsContact OG-CD 3.3Å; S391-E427 PolarHBondContact OG-OE1 2.92Å; S391-E427 PolarHBondContact OG-OE2 3Å; P424-E427 HydrophobicContact CB-CB 4.26Å; P424-E427 PolarHBondContact O-N 2.89Å; E427-L429 PolarHBondContact O-N 3.23Å; E427-E430 PolarHBondContact O-N 2.67Å; E427-L431 VanDerWaalsContact O-CG 3.31Å; E427-L431 WeakPolarHBondContact O-CG 3.38Å; E427-L431 PolarHBondContact O-N 2.91Å; E427-L431 VanDerWaalsContact O-N 3.16Å
428	L	87.2	Confident	71.9	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61	-40.6	174.4	-72.2	167.6	0	0	0	112.7	I347 Y368 M370 I384 L389 I423 P424 V432	I347-L428 HydrophobicContact CD1-CD1 4.41Å; I347-L428 HydrophobicContact CG2-CD1 4.26Å; Y368-L428 HydrophobicContact CD1-CD1 3.76Å; Y368-L428 HydrophobicContact CD2-CD1 4.47Å; Y368-L428 HydrophobicContact CD2-CD2 4.11Å; Y368-L428 HydrophobicContact CE1-CD1 4.31Å; Y368-L428 HydrophobicContact CG-CD1 3.85Å; Y368-L428 HydrophobicContact CG-CD2 3.98Å; M370-L428 HydrophobicContact CE-CB 4.05Å; M370-L428 HydrophobicContact SD-CB 3.85Å; M370-L428 HydrophobicContact SD-CD2 4.13Å; M370-L428 HydrophobicContact SD-CG 4.41Å; I384-L428 HydrophobicContact CB-CD2 4.19Å; I384-L428 HydrophobicContact CD1-CD2 3.89Å; I384-L428 HydrophobicContact CG1-CD2 4.48Å; I384-L428 HydrophobicContact CG2-CD2 4.41Å; L389-L428 HydrophobicContact CD1-CD2 4.44Å; L389-L428 HydrophobicContact CD2-CD2 3.86Å; I423-L428 HydrophobicContact CG2-CD1 3.58Å; P424-L428 HydrophobicContact CG-CD1 4.19Å; P424-L428 HydrophobicContact CG-CG 4.25Å; P424-L428 PolarHBondContact O-N 3.4Å; L428-V432 WeakPolarHBondContact O-CG2 3.49Å; L428-V432 PolarHBondContact O-N 3.01Å
429	L	84.4	Confident	74.3	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-72.7	-38.6	176.8	-72.2	173.3	0	0	0	112.4	V345 M370 V372 V425 K426 E427 L431 V432 V433 L436 L441 I707	V345-L429 HydrophobicContact CG1-CD2 4.26Å; V345-L429 HydrophobicContact CG2-CD2 4.21Å; M370-L429 HydrophobicContact CE-CD2 4Å; V372-L429 HydrophobicContact CG2-CD2 4.44Å; V425-L429 HydrophobicContact CG1-CD1 3.88Å; V425-L429 HydrophobicContact CG1-CG 4.33Å; V425-L429 WeakPolarHBondContact O-CB 3.45Å; V425-L429 VanDerWaalsContact O-CG 3.25Å; V425-L429 WeakPolarHBondContact O-CG 3.31Å; V425-L429 PolarHBondContact O-N 2.87Å; K426-L429 PolarHBondContact O-N 3.25Å; E427-L429 PolarHBondContact O-N 3.23Å; L429-L431 PolarHBondContact O-N 3.17Å; L429-V432 PolarHBondContact O-N 2.93Å; L429-V433 CarbonylContact O-C 3.53Å; L429-V433 PolarHBondContact O-N 2.91Å; L429-L436 HydrophobicContact CD2-CD2 4.3Å; L429-L441 HydrophobicContact CD1-CD1 3.47Å; L429-L441 VanDerWaalsContact CD1-CD1 3.47Å; L429-I707 HydrophobicContact CD1-CD1 4.44Å
430	E	81.2	Confident	76.8	Confident	97 Å²	97	48.2 Å²	48.2	45%	0.453	27%	0.267	S	S	.	.	H	α-helix	trans	-62.3	-23.5	175.5	-75.4	172.9	167.3	0	0	113	K426 E427	K426-E430 WeakPolarHBondContact CE-OE1 3.39Å; K426-E430 HydrophobicContact CG-CG 4.4Å; K426-E430 IonicContact NZ-OE1 3.13Å; K426-E430 WeakPolarHBondContact O-CB 3.39Å; K426-E430 WeakPolarHBondContact O-CG 3.49Å; K426-E430 PolarHBondContact O-N 2.87Å; E427-E430 PolarHBondContact O-N 2.67Å
431	L	76.5	Confident	78.9	Confident	26 Å²	26	43.4 Å²	43.4	14%	0.136	23%	0.234	C	C	.	.	H	α-helix	trans	-83	-35	173.7	-68.4	172.6	0	0	0	114.1	Y113 I384 L389 E427 L429	Y113-L431 HydrophobicContact CD2-CD2 3.6Å; Y113-L431 HydrophobicContact CE2-CD2 4.19Å; Y113-L431 HydrophobicContact CG-CD2 4.23Å; I384-L431 HydrophobicContact CD1-CB 4.11Å; I384-L431 HydrophobicContact CD1-CD1 4.16Å; L389-L431 HydrophobicContact CD2-CD1 3.72Å; E427-L431 VanDerWaalsContact O-CG 3.31Å; E427-L431 WeakPolarHBondContact O-CG 3.38Å; E427-L431 PolarHBondContact O-N 2.91Å; E427-L431 VanDerWaalsContact O-N 3.16Å; L429-L431 PolarHBondContact O-N 3.17Å
432	V	78.4	Confident	80.5	Confident	12 Å²	12	43.4 Å²	43.4	7%	0.073	23%	0.225	C	C	.	.	H	α-helix	trans	-100.5	-39.3	-173	-173.4	0	0	0	0	113.4	F114 M370 F380 I384 L428 L429	F114-V432 HydrophobicContact CB-CG2 4.38Å; F114-V432 HydrophobicContact CD1-CG1 4.44Å; F114-V432 HydrophobicContact CD2-CB 4.43Å; F114-V432 HydrophobicContact CD2-CG1 4.09Å; F114-V432 HydrophobicContact CD2-CG2 3.42Å; F114-V432 VanDerWaalsContact CD2-CG2 3.42Å; F114-V432 HydrophobicContact CE1-CG1 4.24Å; F114-V432 HydrophobicContact CE2-CG1 3.86Å; F114-V432 HydrophobicContact CE2-CG2 3.77Å; F114-V432 HydrophobicContact CG-CG1 4.36Å; F114-V432 HydrophobicContact CG-CG2 4.01Å; F114-V432 HydrophobicContact CZ-CG1 3.92Å; M370-V432 HydrophobicContact CE-CG2 4.16Å; M370-V432 HydrophobicContact SD-CG2 4.14Å; F380-V432 HydrophobicContact CD1-CG1 4.19Å; I384-V432 HydrophobicContact CD1-CG2 3.69Å; L428-V432 WeakPolarHBondContact O-CG2 3.49Å; L428-V432 PolarHBondContact O-N 3.01Å; L429-V432 PolarHBondContact O-N 2.93Å
433	V	78	Confident	81.5	Confident	6 Å²	6	39.4 Å²	39.4	4%	0.036	21%	0.21	C	C	.	.			trans	-142.2	76.8	-178.7	-168.6	0	0	0	0	108.3	L340 V372 L429 D435 L436	L340-V433 HydrophobicContact CD1-CG1 4.38Å; V372-V433 HydrophobicContact CG1-CG2 4.34Å; L429-V433 CarbonylContact O-C 3.53Å; L429-V433 PolarHBondContact O-N 2.91Å; V433-D435 PolarHBondContact O-N 3.32Å; V433-L436 HydrophobicContact CB-CB 4.21Å; V433-L436 HydrophobicContact CG1-CB 3.78Å; V433-L436 PolarHBondContact O-N 3.37Å
434	S	72.8	Confident	81.9	Confident	52 Å²	52	38.4 Å²	38.4	36%	0.364	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-19.2	-175.8	55.4	0	0	0	0	114.7	R110	R110-S434 VanDerWaalsContact NH1-CB 3.33Å; R110-S434 PolarHBondContact NH1-OG 2.88Å
435	D	74.7	Confident	81.8	Confident	71 Å²	71	39 Å²	39	38%	0.38	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-8.9	-172.4	-45.1	-26.7	0	0	0	111.8	V433	V433-D435 PolarHBondContact O-N 3.32Å
436	L	80.5	Confident	81.4	Confident	9 Å²	9	44.2 Å²	44.2	5%	0.047	24%	0.243	C	C	.	.	S	Bend	trans	-82.5	117.2	177.5	175.5	59.2	0	0	0	111	D337 L340 V343 V345 L429 V433 S438 L441	D337-L436 HydrophobicContact CB-CD1 3.94Å; L340-L436 HydrophobicContact CD1-CB 4.17Å; L340-L436 HydrophobicContact CD1-CD1 4.31Å; V343-L436 HydrophobicContact CB-CD1 4.42Å; V343-L436 HydrophobicContact CG1-CD1 4.23Å; V343-L436 HydrophobicContact CG1-CD2 3.93Å; V343-L436 HydrophobicContact CG2-CD1 3.95Å; V345-L436 HydrophobicContact CG2-CD2 4.43Å; L429-L436 HydrophobicContact CD2-CD2 4.3Å; V433-L436 HydrophobicContact CB-CB 4.21Å; V433-L436 HydrophobicContact CG1-CB 3.78Å; V433-L436 PolarHBondContact O-N 3.37Å; L436-S438 PolarHBondContact O-N 2.87Å; L436-L441 HydrophobicContact CD2-CD1 4.2Å
437	L	77.4	Confident	80.9	Confident	101 Å²	101	44.7 Å²	44.7	53%	0.529	25%	0.249	S	C	.	.			trans	-71.9	96.4	-178.9	-64.8	178.1	0	0	0	111.2	D337 G439 C440	D337-L437 PolarHBondContact OD2-N 2.93Å; D337-L437 VanDerWaalsContact OD2-N 3.1Å; L437-G439 PolarHBondContact O-N 2.46Å; L437-C440 PolarHBondContact O-N 2.84Å; L437-C440 PolarHBondContact O-SG 3.05Å
438	S	76.7	Confident	80.3	Confident	16 Å²	16	47.7 Å²	47.7	11%	0.112	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-17.2	-178.1	58.5	0	0	0	0	116.2	L436	L436-S438 PolarHBondContact O-N 2.87Å
439	G	80	Confident	79.5	Confident	36 Å²	36	54.7 Å²	54.7	37%	0.371	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-23.7	171.7	0	0	0	0	0	115	L437 L441	L437-G439 PolarHBondContact O-N 2.46Å; G439-L441 VanDerWaalsContact C-N 3.28Å; G439-L441 PolarHBondContact O-N 3.5Å
440	C	84.5	Confident	79.1	Confident	30 Å²	30	54.7 Å²	54.7	20%	0.203	30%	0.298	C	S	.	.	S	Bend	trans	-72.5	-23.2	176.9	76.3	0	0	0	0	112.8	G335 I336 L437	G335-C440 WeakPolarHBondContact CA-O 3.25Å; I336-C440 WeakPolarHBondContact O-CB 3.44Å; L437-C440 PolarHBondContact O-N 2.84Å; L437-C440 PolarHBondContact O-SG 3.05Å
441	L	87.6	Confident	78.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.289	C	S	.	.			trans	-81.8	135.2	-174.3	-66.6	178.5	0	0	0	112.5	V343 V345 L429 L436 G439 I707	V343-L441 HydrophobicContact CB-CD2 4.43Å; V343-L441 HydrophobicContact CG1-CD2 4.17Å; V345-L441 HydrophobicContact CG2-CD1 4.07Å; V345-L441 HydrophobicContact CG2-CD2 4.46Å; L429-L441 HydrophobicContact CD1-CD1 3.47Å; L429-L441 VanDerWaalsContact CD1-CD1 3.47Å; L436-L441 HydrophobicContact CD2-CD1 4.2Å; G439-L441 VanDerWaalsContact C-N 3.28Å; G439-L441 PolarHBondContact O-N 3.5Å; L441-I707 HydrophobicContact CB-CD1 3.59Å; L441-I707 HydrophobicContact CB-CG1 4.18Å; L441-I707 HydrophobicContact CD1-CD1 3.9Å; L441-I707 HydrophobicContact CG-CD1 4.41Å; L441-I707 PolarHBondContact O-N 3.3Å
442	R	88.2	Confident	78.4	Confident	125 Å²	125	54.4 Å²	54.4	47%	0.472	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	145.7	178.9	-60	-177.6	-174.4	-161.9	0.2	110	Y333 F334 A444 C702	Y333-R442 CarbonylContact C-O 3.01Å; Y333-R442 VanDerWaalsContact CA-O 3.24Å; Y333-R442 WeakPolarHBondContact CA-O 3.46Å; F334-R442 PolarHBondContact N-O 3.05Å; F334-R442 PolarHBondContact O-N 2.96Å; R442-A444 PolarHBondContact O-N 3.31Å; R442-C702 HydrophobicContact CB-CB 3.99Å
443	L	87.9	Confident	78	Confident	58 Å²	58	54.2 Å²	54.2	30%	0.304	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	128.6	178	-173.4	72.3	0	0	0	109.9	Q331 Y333 I703 H705	Q331-L443 HydrophobicContact CB-CD1 4.4Å; Y333-L443 HydrophobicContact CD1-CB 4.3Å; Y333-L443 HydrophobicContact CD1-CD1 4.22Å; Y333-L443 HydrophobicContact CE1-CB 4.03Å; Y333-L443 HydrophobicContact CE1-CD1 3.67Å; Y333-L443 HydrophobicContact CE1-CG 4.47Å; Y333-L443 HydrophobicContact CE2-CD1 4.16Å; L443-I703 WeakPolarHBondContact O-CB 3.37Å; L443-I703 PolarHBondContact O-N 2.92Å; L443-H705 PolarHBondContact N-O 3.42Å
444	A	85.8	Confident	77.7	Confident	6 Å²	6	54.2 Å²	54.2	5%	0.05	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	155.5	178.1	0	0	0	0	0	112.2	N332 F334 R442 P446 T450 H701	N332-A444 HydrophobicContact CB-CB 3.75Å; N332-A444 WeakPolarHBondContact O-CB 3.4Å; N332-A444 PolarHBondContact O-N 2.89Å; F334-A444 HydrophobicContact CD2-CB 3.83Å; F334-A444 HydrophobicContact CE1-CB 4.39Å; F334-A444 HydrophobicContact CE2-CB 3.37Å; F334-A444 HydrophobicContact CZ-CB 3.69Å; R442-A444 PolarHBondContact O-N 3.31Å; A444-P446 WeakPolarHBondContact O-CD 3.49Å; A444-T450 HydrophobicContact CB-CG2 4.27Å; A444-H701 WeakPolarHBondContact CA-O 3.5Å
445	V	82.9	Confident	77.4	Confident	45 Å²	45	52.1 Å²	52.1	27%	0.273	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-71.6	123.9	170.3	-164.9	0	0	0	0	109	L447 T450 H701 I703	V445-L447 HydrophobicContact CB-CD1 4.35Å; V445-L447 HydrophobicContact CG1-CD1 3.79Å; V445-L447 HydrophobicContact CG1-CG 3.85Å; V445-L447 PolarHBondContact O-N 2.92Å; V445-T450 PolarHBondContact O-OG1 2.86Å; V445-H701 PolarHBondContact N-O 3.49Å; V445-I703 HydrophobicContact CB-CG1 4.41Å; V445-I703 HydrophobicContact CG2-CG1 3.86Å
446	P	75.7	Confident	76.4	Confident	116 Å²	116	52.6 Å²	52.6	75%	0.753	28%	0.278	S	S	*	.			trans	-78.2	71.4	-177.3	33	-36.4	0	0	0	111.3	A444	A444-P446 WeakPolarHBondContact O-CD 3.49Å
447	L	73.2	Confident	74.9	Confident	93 Å²	93	55.7 Å²	55.7	49%	0.487	29%	0.289	S	S	.	.			trans	-112.2	144.5	176.3	-70.5	168.9	0	0	0	110.2	V445 R449 T450 E451	V445-L447 HydrophobicContact CB-CD1 4.35Å; V445-L447 HydrophobicContact CG1-CD1 3.79Å; V445-L447 HydrophobicContact CG1-CG 3.85Å; V445-L447 PolarHBondContact O-N 2.92Å; L447-R449 PolarHBondContact O-N 3.5Å; L447-R449 VanDerWaalsContact O-N 3.09Å; L447-T450 WeakPolarHBondContact O-CA 3.29Å; L447-T450 VanDerWaalsContact O-CB 3.24Å; L447-T450 WeakPolarHBondContact O-CB 3.22Å; L447-T450 PolarHBondContact O-N 3.41Å; L447-T450 PolarHBondContact O-OG1 2.89Å; L447-E451 PolarHBondContact O-N 3.35Å
448	P	72.8	Confident	73.2	Confident	100 Å²	100	51.2 Å²	51.2	65%	0.649	27%	0.266	S	S	*	.	H	α-helix	trans	-56.7	-27	173.7	-27.3	35.6	0	0	0	113.7	T450 E451 E452	P448-T450 VanDerWaalsContact C-N 3.33Å; P448-E451 PolarHBondContact O-N 3.24Å; P448-E452 VanDerWaalsContact O-CB 3.23Å; P448-E452 WeakPolarHBondContact O-CB 3.42Å; P448-E452 PolarHBondContact O-N 3Å
449	R	71.4	Confident	71.5	Confident	148 Å²	148	52.8 Å²	52.8	56%	0.558	27%	0.273	S	S	*	.	H	α-helix	trans	-64.1	-35.1	172	178.3	174.7	169.9	159.9	-1.3	112.5	L447 M453	L447-R449 PolarHBondContact O-N 3.5Å; L447-R449 VanDerWaalsContact O-N 3.09Å; R449-M453 HydrophobicContact CG-CG 4.46Å; R449-M453 HydrophobicContact CG-SD 4.06Å; R449-M453 VanDerWaalsContact O-CB 3.29Å; R449-M453 WeakPolarHBondContact O-CB 3.02Å; R449-M453 VanDerWaalsContact O-CG 3.26Å; R449-M453 WeakPolarHBondContact O-CG 3.47Å; R449-M453 PolarHBondContact O-N 3.18Å
450	T	75.6	Confident	69.2	Low	2 Å²	2	52.2 Å²	52.2	1%	0.012	26%	0.263	C	S	.	.	H	α-helix	trans	-66.4	-46.1	176.5	-49.9	0	0	0	0	110.4	F334 A444 V445 L447 P448 M453 L454	F334-T450 HydrophobicContact CE2-CG2 3.64Å; F334-T450 HydrophobicContact CZ-CG2 3.56Å; A444-T450 HydrophobicContact CB-CG2 4.27Å; V445-T450 PolarHBondContact O-OG1 2.86Å; L447-T450 WeakPolarHBondContact O-CA 3.29Å; L447-T450 VanDerWaalsContact O-CB 3.24Å; L447-T450 WeakPolarHBondContact O-CB 3.22Å; L447-T450 PolarHBondContact O-N 3.41Å; L447-T450 PolarHBondContact O-OG1 2.89Å; P448-T450 VanDerWaalsContact C-N 3.33Å; T450-M453 PolarHBondContact O-N 2.99Å; T450-L454 WeakPolarHBondContact O-CG 3.14Å; T450-L454 PolarHBondContact O-N 2.88Å
451	E	76.7	Confident	66.7	Low	54 Å²	54	55.2 Å²	55.2	25%	0.252	28%	0.276	S	S	.	.	H	α-helix	trans	-64.2	-45.8	174.6	-59.7	-174.3	156.4	0	0	111.4	L326 H330 L447 P448 M453 L454 L455	L326-E451 HydrophobicContact CD1-CB 4.33Å; H330-E451 IonicContact CE1-OE1 3.21Å; H330-E451 PolarHBondContact CE1-OE1 3.46Å; H330-E451 VanDerWaalsContact CE1-OE1 3.28Å; L447-E451 PolarHBondContact O-N 3.35Å; P448-E451 PolarHBondContact O-N 3.24Å; E451-M453 VanDerWaalsContact C-N 3.26Å; E451-M453 PolarHBondContact O-N 2.8Å; E451-L454 CarbonylContact O-C 3.54Å; E451-L454 WeakPolarHBondContact O-CA 3.43Å; E451-L454 PolarHBondContact O-N 2.98Å; E451-L454 VanDerWaalsContact O-N 3.1Å; E451-L455 WeakPolarHBondContact O-CD1 3.49Å; E451-L455 PolarHBondContact O-N 3.25Å
452	E	66.8	Low	63.8	Low	62 Å²	62	58 Å²	58	29%	0.29	30%	0.295	S	S	.	.	H	α-helix	trans	-60.9	-34.7	176	-165.7	-149.6	-176.5	0	0	111.6	P448 L455 K456	P448-E452 VanDerWaalsContact O-CB 3.23Å; P448-E452 WeakPolarHBondContact O-CB 3.42Å; P448-E452 PolarHBondContact O-N 3Å; E452-L455 CarbonylContact O-C 3.55Å; E452-L455 PolarHBondContact O-N 2.95Å; E452-K456 HydrophobicContact CG-CD 4.3Å; E452-K456 WeakPolarHBondContact O-CA 3.39Å; E452-K456 VanDerWaalsContact O-CB 3.27Å; E452-K456 WeakPolarHBondContact O-CB 3.29Å; E452-K456 WeakPolarHBondContact O-CG 3.16Å; E452-K456 PolarHBondContact O-N 3Å; E452-K456 WeakPolarHBondContact OE1-CE 3.48Å; E452-K456 IonicContact OE1-NZ 3.22Å; E452-K456 PolarHBondContact OE1-NZ 3.18Å; E452-K456 IonicContact OE2-NZ 3.81Å; E452-K456 PolarHBondContact OE2-NZ 3.24Å
453	M	69.5	Low	61.2	Low	8 Å²	8	60.8 Å²	60.8	4%	0.039	31%	0.314	C	S	.	.	H	α-helix	trans	-69	-43.6	172	-79.2	177.2	72.4	0	0	111.5	R449 T450 E451 L455 K456 F693 E696 L697 H701	R449-M453 HydrophobicContact CG-CG 4.46Å; R449-M453 HydrophobicContact CG-SD 4.06Å; R449-M453 VanDerWaalsContact O-CB 3.29Å; R449-M453 WeakPolarHBondContact O-CB 3.02Å; R449-M453 VanDerWaalsContact O-CG 3.26Å; R449-M453 WeakPolarHBondContact O-CG 3.47Å; R449-M453 PolarHBondContact O-N 3.18Å; T450-M453 PolarHBondContact O-N 2.99Å; E451-M453 VanDerWaalsContact C-N 3.26Å; E451-M453 PolarHBondContact O-N 2.8Å; M453-L455 PolarHBondContact O-N 3.27Å; M453-K456 HydrophobicContact CG-CD 4.37Å; M453-K456 PolarHBondContact O-N 3.09Å; M453-F693 HydrophobicContact CB-CE2 4.46Å; M453-F693 HydrophobicContact CB-CZ 3.78Å; M453-F693 HydrophobicContact CE-CE2 3.7Å; M453-F693 HydrophobicContact CE-CZ 4.09Å; M453-F693 HydrophobicContact CG-CE2 4.46Å; M453-F693 HydrophobicContact CG-CZ 4.24Å; M453-F693 WeakPolarHBondContact O-CE1 3.44Å; M453-F693 WeakPolarHBondContact O-CZ 3.31Å; M453-E696 WeakPolarHBondContact CE-OE1 3.47Å; M453-L697 HydrophobicContact CB-CD2 4Å; M453-L697 HydrophobicContact CE-CD2 3.86Å; M453-L697 HydrophobicContact CE-CG 4.3Å; M453-L697 HydrophobicContact SD-CD2 4.38Å; M453-H701 PolarHBondContact SD-NE2 3.04Å
454	L	72.1	Confident	58.5	Low	7 Å²	7	69.5 Å²	69.5	4%	0.037	34%	0.342	C	S	.	.	H	α-helix	trans	-64.4	-19.9	172.2	-68.9	175.8	0	0	0	113.8	Y321 N332 F334 A344 T450 E451 A458 L697	Y321-L454 HydrophobicContact CD1-CB 4.07Å; Y321-L454 HydrophobicContact CE1-CB 3.47Å; Y321-L454 VanDerWaalsContact CE1-CB 3.47Å; Y321-L454 HydrophobicContact CE1-CD1 4.19Å; Y321-L454 HydrophobicContact CE2-CD1 4.31Å; Y321-L454 WeakPolarHBondContact OH-CD1 3.42Å; N332-L454 HydrophobicContact CB-CD1 4.43Å; F334-L454 HydrophobicContact CE1-CD1 4Å; F334-L454 HydrophobicContact CE1-CD2 3.97Å; F334-L454 HydrophobicContact CE1-CG 4.39Å; F334-L454 HydrophobicContact CZ-CD1 3.97Å; F334-L454 HydrophobicContact CZ-CD2 4.27Å; F334-L454 HydrophobicContact CZ-CG 4.28Å; A344-L454 HydrophobicContact CB-CD2 4.48Å; T450-L454 WeakPolarHBondContact O-CG 3.14Å; T450-L454 PolarHBondContact O-N 2.88Å; E451-L454 CarbonylContact O-C 3.54Å; E451-L454 WeakPolarHBondContact O-CA 3.43Å; E451-L454 PolarHBondContact O-N 2.98Å; E451-L454 VanDerWaalsContact O-N 3.1Å; L454-A458 WeakPolarHBondContact O-CB 3.42Å; L454-L697 HydrophobicContact CD2-CD1 3.85Å
455	L	65.7	Low	55.9	Low	7 Å²	7	75.5 Å²	75.5	4%	0.037	37%	0.373	C	S	.	.	H	α-helix	trans	-94.3	-14.4	168.4	-90.3	103.7	0	0	0	114.9	Y321 R322 L326 E451 E452 M453 R457 A458 D459 L461	Y321-L455 HydrophobicContact CD1-CD1 3.64Å; Y321-L455 HydrophobicContact CD1-CG 4.2Å; Y321-L455 HydrophobicContact CE1-CD1 3.65Å; R322-L455 HydrophobicContact CB-CD2 4.13Å; R322-L455 HydrophobicContact CG-CD2 4.22Å; L326-L455 HydrophobicContact CB-CD1 4.39Å; L326-L455 HydrophobicContact CD1-CD1 3.93Å; L326-L455 HydrophobicContact CD2-CD1 4.05Å; L326-L455 HydrophobicContact CD2-CD2 3.98Å; L326-L455 HydrophobicContact CG-CD1 4.35Å; E451-L455 WeakPolarHBondContact O-CD1 3.49Å; E451-L455 PolarHBondContact O-N 3.25Å; E452-L455 CarbonylContact O-C 3.55Å; E452-L455 PolarHBondContact O-N 2.95Å; M453-L455 PolarHBondContact O-N 3.27Å; L455-R457 PolarHBondContact O-N 3.34Å; L455-A458 WeakPolarHBondContact CA-O 3.26Å; L455-A458 CarbonylContact O-C 3.54Å; L455-A458 WeakPolarHBondContact O-CA 3.41Å; L455-A458 PolarHBondContact O-N 3.47Å; L455-D459 PolarHBondContact O-N 3.09Å; L455-L461 HydrophobicContact CD2-CG 4.4Å
456	K	54.6	Low	53.6	Low	82 Å²	82	82 Å²	82	36%	0.357	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-12.7	-174	-100.2	162.4	174	164	0	114.5	E452 M453 L468	E452-K456 HydrophobicContact CG-CD 4.3Å; E452-K456 WeakPolarHBondContact O-CA 3.39Å; E452-K456 VanDerWaalsContact O-CB 3.27Å; E452-K456 WeakPolarHBondContact O-CB 3.29Å; E452-K456 WeakPolarHBondContact O-CG 3.16Å; E452-K456 PolarHBondContact O-N 3Å; E452-K456 WeakPolarHBondContact OE1-CE 3.48Å; E452-K456 IonicContact OE1-NZ 3.22Å; E452-K456 PolarHBondContact OE1-NZ 3.18Å; E452-K456 IonicContact OE2-NZ 3.81Å; E452-K456 PolarHBondContact OE2-NZ 3.24Å; M453-K456 HydrophobicContact CG-CD 4.37Å; M453-K456 PolarHBondContact O-N 3.09Å; K456-L468 HydrophobicContact CG-CD2 4.41Å
457	R	49	Very low	51.6	Low	74 Å²	74	82.1 Å²	82.1	28%	0.279	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.1	5.3	162	-118.9	-171.3	179.7	97.9	10.5	113.2	L455 T689	L455-R457 PolarHBondContact O-N 3.34Å; R457-T689 PolarHBondContact NH1-O 2.97Å
458	A	41	Very low	49.8	Very low	6 Å²	6	82.2 Å²	82.2	5%	0.05	39%	0.387	C	S	.	.	S	Bend	trans	-135.4	63.3	-166.9	0	0	0	0	0	109.2	A318 L454 L455	A318-A458 VanDerWaalsContact CA-C 3.41Å; A318-A458 VanDerWaalsContact CA-CA 3.48Å; A318-A458 VanDerWaalsContact CA-CB 3.43Å; A318-A458 WeakPolarHBondContact CA-O 3.2Å; A318-A458 HydrophobicContact CB-CB 3.96Å; A318-A458 WeakPolarHBondContact CB-O 3.27Å; L454-A458 WeakPolarHBondContact O-CB 3.42Å; L455-A458 WeakPolarHBondContact CA-O 3.26Å; L455-A458 CarbonylContact O-C 3.54Å; L455-A458 WeakPolarHBondContact O-CA 3.41Å; L455-A458 PolarHBondContact O-N 3.47Å
459	D	40.6	Very low	48	Very low	49 Å²	49	81 Å²	81	26%	0.262	38%	0.375	S	S	.	.			trans	24.3	105.4	-178.8	-66.3	-29	0	0	0	120.4	A318 R322 L455 Y472	A318-D459 HydrophobicContact CB-CB 3.66Å; R322-D459 WeakPolarHBondContact CD-O 3.07Å; R322-D459 PolarHBondContact NH1-O 3.4Å; L455-D459 PolarHBondContact O-N 3.09Å; D459-Y472 WeakPolarHBondContact OD1-CD2 3.45Å
460	V	32	Very low	46.4	Very low	25 Å²	25	76.8 Å²	76.8	15%	0.152	36%	0.362	C	S	.	.			trans	70.6	102.2	130.4	177.2	0	0	0	0	114.9	R322 L469	R322-V460 WeakPolarHBondContact CD-O 3.28Å; R322-V460 VanDerWaalsContact CZ-O 3.26Å; R322-V460 PolarHBondContact NE-O 3.17Å; R322-V460 PolarHBondContact NH1-O 3.06Å; V460-L469 HydrophobicContact CB-CG 4.3Å; V460-L469 HydrophobicContact CG1-CD1 3.62Å; V460-L469 HydrophobicContact CG1-CD2 4.19Å; V460-L469 HydrophobicContact CG1-CG 3.51Å; V460-L469 HydrophobicContact CG2-CD2 4.15Å; V460-L469 HydrophobicContact CG2-CG 3.79Å
461	L	31.5	Very low	45	Very low	92 Å²	92	82.2 Å²	82.2	48%	0.482	39%	0.389	S	S	.	.			trans	-87.2	116.6	166.1	-128.9	168.5	0	0	0	111	L326 L455	L326-L461 HydrophobicContact CD1-CD1 4.49Å; L326-L461 HydrophobicContact CD2-CD1 4.43Å; L326-L461 HydrophobicContact CD2-CD2 4.15Å; L326-L461 HydrophobicContact CD2-CG 3.98Å; L455-L461 HydrophobicContact CD2-CG 4.4Å
462	S	28	Very low	44	Very low	58 Å²	58	82.3 Å²	82.3	41%	0.406	39%	0.388	S	S	.	.			trans	-66.9	154.2	-176.3	-160.2	0	0	0	0	113.2	R464	S462-R464 PolarHBondContact O-N 2.59Å
463	H	31.8	Very low	44	Very low	185 Å²	185	80.7 Å²	80.7	86%	0.856	38%	0.382	S	S	*	.	S	Bend	trans	69.6	0.7	159.7	-80.3	66.2	0	0	0	122.1
464	R	32.2	Very low	44.4	Very low	241 Å²	241	82 Å²	82	91%	0.909	39%	0.386	S	S	*	.	S	Bend	trans	-134.3	-11.4	170.3	-110.5	177.3	-176.7	140.7	2.2	119.6	S462	S462-R464 PolarHBondContact O-N 2.59Å
465	N	30.7	Very low	45	Very low	131 Å²	131	81.9 Å²	81.9	70%	0.701	39%	0.386	S	S	*	.			trans	-142.9	104.7	174.4	-95	-46.7	0	0	0	112.7	K467	N465-K467 PolarHBondContact O-N 2.91Å
466	K	34.5	Very low	46.2	Very low	181 Å²	181	83.3 Å²	83.3	79%	0.787	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-5.1	-178.3	-165.4	-179.4	175.2	-169.6	0	114.5	Q470	K466-Q470 PolarHBondContact O-NE2 3.31Å
467	K	35	Very low	48	Very low	120 Å²	120	79.4 Å²	79.4	52%	0.522	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-18.8	-166.3	-160.6	165.3	-175.4	171.9	0	116.1	N465 Q470 E1065	N465-K467 PolarHBondContact O-N 2.91Å; K467-Q470 WeakPolarHBondContact O-CG 3.49Å; K467-Q470 PolarHBondContact O-NE2 3.08Å; K467-Q470 PolarHBondContact O-OE1 2.89Å; K467-E1065 WeakPolarHBondContact CE-OE1 3.4Å; K467-E1065 IonicContact NZ-OE1 3.37Å; K467-E1065 PolarHBondContact NZ-OE1 2.82Å
468	L	35.3	Very low	50.1	Low	95 Å²	95	75.9 Å²	75.9	50%	0.497	36%	0.361	S	S	.	.	S	Bend	trans	-104.9	4.4	-172.7	-107.5	156.8	0	0	0	115.1	K456 Q470	K456-L468 HydrophobicContact CG-CD2 4.41Å; L468-Q470 PolarHBondContact O-N 2.88Å; L468-Q470 VanDerWaalsContact O-N 3.16Å
469	L	35	Very low	52.7	Low	74 Å²	74	75.6 Å²	75.6	39%	0.387	36%	0.359	S	S	.	.	S	Bend	trans	-74.4	2.4	-179.8	-135	140.6	0	0	0	114.5	V460 T473	V460-L469 HydrophobicContact CB-CG 4.3Å; V460-L469 HydrophobicContact CG1-CD1 3.62Å; V460-L469 HydrophobicContact CG1-CD2 4.19Å; V460-L469 HydrophobicContact CG1-CG 3.51Å; V460-L469 HydrophobicContact CG2-CD2 4.15Å; V460-L469 HydrophobicContact CG2-CG 3.79Å; L469-T473 HydrophobicContact CD2-CG2 3.79Å; L469-T473 PolarHBondContact O-OG1 2.94Å
470	Q	37.4	Very low	55.3	Low	60 Å²	60	73.3 Å²	73.3	28%	0.28	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.7	8.8	-137.3	-62	-169.1	1	0	0	115.5	K466 K467 L468 R474	K466-Q470 PolarHBondContact O-NE2 3.31Å; K467-Q470 WeakPolarHBondContact O-CG 3.49Å; K467-Q470 PolarHBondContact O-NE2 3.08Å; K467-Q470 PolarHBondContact O-OE1 2.89Å; L468-Q470 PolarHBondContact O-N 2.88Å; L468-Q470 VanDerWaalsContact O-N 3.16Å; Q470-R474 WeakPolarHBondContact O-CD 3.13Å
471	I	46	Very low	58.4	Low	116 Å²	116	72.1 Å²	72.1	60%	0.595	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-55.7	-172.4	-59.8	179.2	0	0	0	111.6
472	Y	54.8	Low	61.5	Low	56 Å²	56	67.9 Å²	67.9	22%	0.22	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-12.8	-178.9	-58.2	-68.8	0	0	0	114.4	V314 D459 R474 Y475 Y544	V314-Y472 HydrophobicContact CG1-CD1 4Å; V314-Y472 HydrophobicContact CG1-CD2 3.74Å; V314-Y472 HydrophobicContact CG1-CE2 4.37Å; V314-Y472 HydrophobicContact CG1-CG 3.53Å; D459-Y472 WeakPolarHBondContact OD1-CD2 3.45Å; Y472-R474 VanDerWaalsContact C-N 3.27Å; Y472-R474 PolarHBondContact O-N 3.22Å; Y472-Y475 WeakPolarHBondContact O-CE2 3.45Å; Y472-Y475 PolarHBondContact O-OH 3.28Å; Y472-Y544 VanDerWaalsContact O-CE1 3.27Å; Y472-Y544 WeakPolarHBondContact O-CE1 3.48Å
473	T	68.2	Low	64.6	Low	27 Å²	27	67.5 Å²	67.5	17%	0.166	31%	0.308	C	S	.	.	S	Bend	trans	-86.7	7.5	177.2	59.9	0	0	0	0	113.3	L469 Y544 E545	L469-T473 HydrophobicContact CD2-CG2 3.79Å; L469-T473 PolarHBondContact O-OG1 2.94Å; T473-Y544 CarbonylContact O-C 3.55Å; T473-Y544 WeakPolarHBondContact O-CA 3.34Å; T473-E545 PolarHBondContact O-N 3.39Å
474	R	78	Confident	67.6	Low	35 Å²	35	61.6 Å²	61.6	13%	0.132	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	117.6	-164.2	-66.3	-174.9	161	-163.8	-9.1	112.6	Q470 Y472 Y521 E545	Q470-R474 WeakPolarHBondContact O-CD 3.13Å; Y472-R474 VanDerWaalsContact C-N 3.27Å; Y472-R474 PolarHBondContact O-N 3.22Å; R474-Y521 HydrophobicContact CB-CD1 4.03Å; R474-Y521 HydrophobicContact CB-CD2 4.2Å; R474-Y521 HydrophobicContact CB-CE1 4.05Å; R474-Y521 HydrophobicContact CB-CE2 4.18Å; R474-Y521 HydrophobicContact CB-CG 4.09Å; R474-Y521 HydrophobicContact CG-CD1 4.43Å; R474-Y521 HydrophobicContact CG-CD2 4.32Å; R474-Y521 HydrophobicContact CG-CG 4.11Å; R474-E545 VanDerWaalsContact CA-O 3.31Å; R474-E545 WeakPolarHBondContact CA-O 3.13Å; R474-E545 HydrophobicContact CG-CB 4.24Å; R474-E545 IonicContact CZ-OE2 2.69Å; R474-E545 IonicContact NE-OE2 3.93Å; R474-E545 PolarHBondContact NE-OE2 2.98Å; R474-E545 IonicContact NH2-OE1 3.43Å; R474-E545 IonicContact NH2-OE2 3.27Å; R474-E545 PolarHBondContact NH2-OE2 3.48Å
475	Y	84.4	Confident	70.4	Confident	6 Å²	6	52.2 Å²	52.2	2%	0.024	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	143.7	-173.7	-66.6	-80.6	0	0	0	111.5	Y472 Y521 Y544 E545 I546 M547 I670 E673 N674	Y472-Y475 WeakPolarHBondContact O-CE2 3.45Å; Y472-Y475 PolarHBondContact O-OH 3.28Å; Y475-Y521 WeakPolarHBondContact O-CE1 3.3Å; Y475-Y544 HydrophobicContact CD2-CD1 4.18Å; Y475-Y544 AromaticContact CE2-CD1 3.59Å; Y475-Y544 HydrophobicContact CE2-CD1 3.59Å; Y475-Y544 HydrophobicContact CE2-CE1 4.03Å; Y475-E545 PolarHBondContact N-O 3.34Å; Y475-I546 WeakPolarHBondContact O-CA 3.42Å; Y475-M547 PolarHBondContact O-N 3.41Å; Y475-I670 HydrophobicContact CD2-CD1 4.31Å; Y475-I670 HydrophobicContact CD2-CG1 3.75Å; Y475-I670 HydrophobicContact CE2-CB 4.16Å; Y475-I670 HydrophobicContact CE2-CD1 4.2Å; Y475-I670 HydrophobicContact CE2-CG1 3.7Å; Y475-I670 HydrophobicContact CE2-CG2 3.79Å; Y475-I670 HydrophobicContact CG-CG1 4.38Å; Y475-E673 HydrophobicContact CD1-CB 3.95Å; Y475-E673 HydrophobicContact CD1-CG 4.06Å; Y475-E673 HydrophobicContact CE1-CB 3.79Å; Y475-E673 HydrophobicContact CE1-CG 3.96Å; Y475-N674 PolarHBondContact OH-OD1 2.73Å
476	K	89.5	Confident	73.4	Confident	36 Å²	36	47.4 Å²	47.4	16%	0.157	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	117.3	177.9	61.9	-174.6	-163.4	78.2	0	109.2	Y521 M547 N572 D573	K476-Y521 HydrophobicContact CB-CE1 4.46Å; K476-M547 WeakPolarHBondContact CA-O 3.48Å; K476-N572 PolarHBondContact NZ-O 3.31Å; K476-D573 WeakPolarHBondContact CG-OD1 3.22Å; K476-D573 IonicContact NZ-OD1 2.72Å; K476-D573 PolarHBondContact NZ-OD1 2.88Å
477	V	92.6	Very high	75.9	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	121.7	-166.4	177.5	0	0	0	0	109.9	I546 M547 F548 H549 I577 L669	V477-I546 HydrophobicContact CG2-CG2 4.09Å; V477-M547 PolarHBondContact N-O 2.68Å; V477-F548 HydrophobicContact CB-CD1 3.76Å; V477-F548 HydrophobicContact CB-CE1 3.92Å; V477-F548 HydrophobicContact CG1-CD1 3.91Å; V477-F548 HydrophobicContact CG1-CE1 3.91Å; V477-F548 HydrophobicContact CG2-CE1 4.49Å; V477-F548 CarbonylContact O-C 3.56Å; V477-F548 VanDerWaalsContact O-CA 3.31Å; V477-F548 WeakPolarHBondContact O-CA 3.42Å; V477-H549 PolarHBondContact O-N 3.11Å; V477-I577 HydrophobicContact CG1-CD1 4.15Å; V477-I577 HydrophobicContact CG1-CG1 4.01Å; V477-L669 HydrophobicContact CG1-CD1 4.34Å; V477-L669 HydrophobicContact CG1-CD2 3.62Å; V477-L669 HydrophobicContact CG2-CD1 4.41Å; V477-L669 HydrophobicContact CG2-CD2 4.03Å
478	G	94.1	Very high	78.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	142.4	175.2	0	0	0	0	0	111.3	D573 V575 T576 I577	G478-D573 WeakPolarHBondContact CA-OD2 3.2Å; G478-D573 PolarHBondContact N-OD2 2.95Å; G478-V575 PolarHBondContact N-O 3.38Å; G478-V575 VanDerWaalsContact N-O 3.1Å; G478-T576 CarbonylContact O-C 3.58Å; G478-T576 WeakPolarHBondContact O-CA 2.79Å; G478-I577 PolarHBondContact O-N 3.28Å
479	V	95.9	Very high	81	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	114.6	171.6	-170.5	0	0	0	0	109.4	F502 L509 F548 H549 V550 S551 I577	V479-F502 HydrophobicContact CG1-CE2 3.83Å; V479-F502 HydrophobicContact CG1-CZ 3.86Å; V479-L509 HydrophobicContact CG2-CD1 4.36Å; V479-F548 HydrophobicContact CG2-CB 4.03Å; V479-F548 HydrophobicContact CG2-CD1 3.62Å; V479-F548 HydrophobicContact CG2-CG 4.19Å; V479-H549 PolarHBondContact N-O 2.87Å; V479-V550 HydrophobicContact CB-CG2 4.31Å; V479-V550 HydrophobicContact CG2-CG2 4.41Å; V479-S551 PolarHBondContact O-N 2.9Å; V479-I577 WeakPolarHBondContact CA-O 3.35Å; V479-I577 HydrophobicContact CG1-CB 4.34Å; V479-I577 HydrophobicContact CG2-CB 4.39Å; V479-I577 HydrophobicContact CG2-CD1 4.33Å
480	L	95.2	Very high	83.7	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	135.1	176.9	-77.7	161.1	0	0	0	110.5	M492 Y493 I570 T576 I577 I578 F579 M592	L480-M492 HydrophobicContact CD2-CB 4.22Å; L480-Y493 HydrophobicContact CD2-CD1 3.84Å; L480-Y493 HydrophobicContact CD2-CD2 4.46Å; L480-Y493 HydrophobicContact CD2-CE1 3.89Å; L480-Y493 HydrophobicContact CD2-CE2 4.49Å; L480-Y493 HydrophobicContact CD2-CG 4.14Å; L480-I570 HydrophobicContact CD1-CG2 4.02Å; L480-I570 HydrophobicContact CD2-CD1 4.2Å; L480-I570 HydrophobicContact CG-CD1 4.34Å; L480-I570 HydrophobicContact CG-CG2 4.11Å; L480-T576 HydrophobicContact CD1-CG2 4.04Å; L480-I577 PolarHBondContact N-O 3.5Å; L480-I578 HydrophobicContact CB-CD1 3.97Å; L480-I578 HydrophobicContact CD1-CD1 3.88Å; L480-F579 PolarHBondContact O-N 2.97Å; L480-M592 HydrophobicContact CD1-SD 4.25Å
481	L	96.4	Very high	86.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.4	167.6	177.6	55.6	0	0	0	109.8	K483 N495 F502 T552 F579 E581	L481-K483 HydrophobicContact CD1-CG 4.49Å; L481-K483 VanDerWaalsContact CD2-CE 3.41Å; L481-K483 HydrophobicContact CD2-CG 4.28Å; L481-K483 HydrophobicContact CG-CG 4.03Å; L481-N495 PolarHBondContact O-ND2 3.01Å; L481-F502 HydrophobicContact CB-CD1 4.23Å; L481-F502 HydrophobicContact CB-CE1 4Å; L481-F502 HydrophobicContact CB-CE2 4.36Å; L481-F502 HydrophobicContact CB-CG 4.48Å; L481-F502 HydrophobicContact CB-CZ 4.07Å; L481-F502 HydrophobicContact CD1-CB 3.97Å; L481-F502 HydrophobicContact CD1-CD1 4.32Å; L481-F502 HydrophobicContact CD1-CD2 4.04Å; L481-F502 HydrophobicContact CD1-CG 3.87Å; L481-F502 HydrophobicContact CD2-CB 4.36Å; L481-F502 HydrophobicContact CD2-CD1 3.83Å; L481-F502 HydrophobicContact CD2-CE1 4.32Å; L481-F502 HydrophobicContact CD2-CG 4.17Å; L481-F502 HydrophobicContact CG-CD1 4.36Å; L481-F502 HydrophobicContact CG-CG 4.41Å; L481-T552 HydrophobicContact CB-CG2 4.48Å; L481-T552 HydrophobicContact CD2-CG2 4.08Å; L481-F579 HydrophobicContact CD1-CD1 3.72Å; L481-F579 HydrophobicContact CD1-CE1 4.39Å; L481-E581 HydrophobicContact CD1-CG 4.03Å
482	C	95.7	Very high	88.6	Confident	3 Å²	3	29.6 Å²	29.6	2%	0.02	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	111.7	170.8	-169.4	0	0	0	0	109.1	Q486 M492 I578 F579 Q580 E581	C482-Q486 PolarHBondContact SG-O 3.46Å; C482-Q486 VanDerWaalsContact SG-O 3.39Å; C482-M492 HydrophobicContact CB-CG 3.92Å; C482-M492 HydrophobicContact CB-SD 3.75Å; C482-I578 HydrophobicContact CB-CG2 4.12Å; C482-F579 PolarHBondContact N-O 3.35Å; C482-Q580 HydrophobicContact CB-CG 4.21Å; C482-E581 PolarHBondContact O-N 3.49Å
483	K	95	Very high	90.5	Very high	50 Å²	50	27 Å²	27	22%	0.217	16%	0.157	C	C	.	.			trans	-87.4	170.9	-176.2	-57.9	-165.3	173.3	179.5	0	112.5	L481 G485 Q486 N495 H497 E581 A584	L481-K483 HydrophobicContact CD1-CG 4.49Å; L481-K483 VanDerWaalsContact CD2-CE 3.41Å; L481-K483 HydrophobicContact CD2-CG 4.28Å; L481-K483 HydrophobicContact CG-CG 4.03Å; K483-G485 PolarHBondContact O-N 2.98Å; K483-Q486 HydrophobicContact CB-CG 4.17Å; K483-Q486 WeakPolarHBondContact O-CB 2.81Å; K483-Q486 PolarHBondContact O-N 3.17Å; K483-N495 WeakPolarHBondContact CD-OD1 3.33Å; K483-N495 WeakPolarHBondContact CE-OD1 3.44Å; K483-H497 PolarHBondContact NZ-O 3.47Å; K483-E581 VanDerWaalsContact CA-OE2 3.28Å; K483-E581 WeakPolarHBondContact CA-OE2 3.46Å; K483-E581 VanDerWaalsContact CB-OE2 3.25Å; K483-E581 WeakPolarHBondContact CB-OE2 3.36Å; K483-E581 WeakPolarHBondContact CG-OE2 3.32Å; K483-A584 WeakPolarHBondContact O-CB 3.44Å
484	A	93.2	Very high	91.8	Very high	62 Å²	62	27.6 Å²	27.6	51%	0.512	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.9	131.2	172.9	0	0	0	0	0	112.3	Q486 G583	A484-Q486 PolarHBondContact O-N 2.98Å; A484-G583 WeakPolarHBondContact CA-O 3.14Å
485	G	92.4	Very high	92.6	Very high	44 Å²	44	26.5 Å²	26.5	45%	0.454	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	0.2	-177.9	0	0	0	0	0	116.8	K483 G583	K483-G485 PolarHBondContact O-N 2.98Å; G485-G583 PolarHBondContact N-O 3.46Å
486	Q	93.2	Very high	93	Very high	30 Å²	30	31 Å²	31	14%	0.14	18%	0.177	C	C	.	.			trans	-88	147.3	176.2	-61.5	-176.8	-18.4	0	0	111.8	C482 K483 A484 Q491 N495 L585	C482-Q486 PolarHBondContact SG-O 3.46Å; C482-Q486 VanDerWaalsContact SG-O 3.39Å; K483-Q486 HydrophobicContact CB-CG 4.17Å; K483-Q486 WeakPolarHBondContact O-CB 2.81Å; K483-Q486 PolarHBondContact O-N 3.17Å; A484-Q486 PolarHBondContact O-N 2.98Å; Q486-Q491 HydrophobicContact CB-CB 4.08Å; Q486-Q491 HydrophobicContact CG-CB 3.97Å; Q486-N495 PolarHBondContact NE2-OD1 3.35Å; Q486-N495 PolarHBondContact OE1-ND2 3.36Å; Q486-L585 WeakPolarHBondContact O-CB 3.33Å; Q486-L585 PolarHBondContact O-N 3.3Å
487	C	86	Confident	93.2	Very high	50 Å²	50	35.5 Å²	35.5	34%	0.338	20%	0.199	S	C	.	.			trans	-145.1	-19.8	171.6	63.7	0	0	0	0	114.4	L585	C487-L585 HydrophobicContact CB-CB 3.96Å; C487-L585 HydrophobicContact CB-CD1 4.02Å
488	S	88.2	Confident	93.2	Very high	39 Å²	39	37.2 Å²	37.2	27%	0.273	21%	0.21	S	C	.	.	S	Bend	trans	-96.2	156.6	-169.8	83.5	0	0	0	0	113.9	E490 Q491 M492	S488-E490 VanDerWaalsContact C-N 3.3Å; S488-E490 PolarHBondContact O-N 3.32Å; S488-Q491 PolarHBondContact O-N 3.4Å; S488-Q491 WeakPolarHBondContact OG-CG 3.31Å; S488-Q491 PolarHBondContact OG-N 3.37Å; S488-Q491 PolarHBondContact OG-OE1 3.48Å; S488-M492 WeakPolarHBondContact O-CE 3.32Å; S488-M492 PolarHBondContact O-N 3.1Å; S488-M492 VanDerWaalsContact O-N 3.17Å
489	E	90.7	Very high	93.2	Very high	31 Å²	31	38.5 Å²	38.5	15%	0.145	22%	0.219	C	C	.	.	H	α-helix	trans	-53	-47.7	175	-176	169.4	-131.4	0	0	112.1	Q491 M492 Y493 K567 M592	E489-Q491 PolarHBondContact O-N 2.7Å; E489-M492 PolarHBondContact O-N 2.92Å; E489-Y493 HydrophobicContact CG-CD2 3.59Å; E489-Y493 HydrophobicContact CG-CE2 3.62Å; E489-Y493 VanDerWaalsContact O-CD2 3.31Å; E489-Y493 WeakPolarHBondContact O-CD2 3.48Å; E489-Y493 PolarHBondContact O-N 3.42Å; E489-Y493 VanDerWaalsContact O-N 3.11Å; E489-K567 WeakPolarHBondContact OE1-CE 3.47Å; E489-K567 IonicContact OE1-NZ 2.7Å; E489-K567 PolarHBondContact OE1-NZ 3.43Å; E489-K567 IonicContact OE2-NZ 3.45Å; E489-K567 PolarHBondContact OE2-NZ 2.93Å; E489-M592 HydrophobicContact CB-CE 3.58Å; E489-M592 HydrophobicContact CG-CE 3.79Å
490	E	90.5	Very high	93.2	Very high	74 Å²	74	41.4 Å²	41.4	35%	0.346	24%	0.243	S	C	.	.	H	α-helix	trans	-61.9	-43.9	-178.9	-166	179.7	138.4	0	0	111.6	S488 N494 R561	S488-E490 VanDerWaalsContact C-N 3.3Å; S488-E490 PolarHBondContact O-N 3.32Å; E490-N494 WeakPolarHBondContact CG-ND2 3.46Å; E490-N494 WeakPolarHBondContact O-CB 3.39Å; E490-N494 PolarHBondContact O-N 3.04Å; E490-N494 VanDerWaalsContact O-N 3.12Å; E490-N494 PolarHBondContact O-ND2 2.77Å; E490-R561 WeakPolarHBondContact CG-O 3.23Å; E490-R561 IonicContact OE1-CZ 2.74Å; E490-R561 IonicContact OE1-NE 3.27Å; E490-R561 PolarHBondContact OE1-NE 2.97Å; E490-R561 IonicContact OE1-NH2 3.27Å; E490-R561 PolarHBondContact OE1-NH2 3.01Å; E490-R561 IonicContact OE2-NH2 3.18Å
491	Q	93.2	Very high	93.1	Very high	77 Å²	77	42.4 Å²	42.4	36%	0.36	25%	0.25	S	C	.	.	H	α-helix	trans	-60.9	-48.1	179	-72.8	167.4	-24.5	0	0	112	Q486 S488 E489 N494	Q486-Q491 HydrophobicContact CB-CB 4.08Å; Q486-Q491 HydrophobicContact CG-CB 3.97Å; S488-Q491 PolarHBondContact O-N 3.4Å; S488-Q491 WeakPolarHBondContact OG-CG 3.31Å; S488-Q491 PolarHBondContact OG-N 3.37Å; S488-Q491 PolarHBondContact OG-OE1 3.48Å; E489-Q491 PolarHBondContact O-N 2.7Å; Q491-N494 PolarHBondContact O-N 2.87Å
492	M	94.2	Very high	93.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-65.8	-39.9	-177.8	-70.8	-177.4	-83.9	0	0	112.8	L480 C482 S488 E489 N495 I578 F587 M592	L480-M492 HydrophobicContact CD2-CB 4.22Å; C482-M492 HydrophobicContact CB-CG 3.92Å; C482-M492 HydrophobicContact CB-SD 3.75Å; S488-M492 WeakPolarHBondContact O-CE 3.32Å; S488-M492 PolarHBondContact O-N 3.1Å; S488-M492 VanDerWaalsContact O-N 3.17Å; E489-M492 PolarHBondContact O-N 2.92Å; M492-N495 PolarHBondContact O-ND2 3.11Å; M492-I578 HydrophobicContact SD-CG2 4.07Å; M492-F587 HydrophobicContact CE-CD2 4.21Å; M492-F587 HydrophobicContact CE-CE2 4.19Å; M492-M592 HydrophobicContact CE-CE 3.59Å
493	Y	94.8	Very high	93.1	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-71.1	-30.1	178.1	-86.1	-67.2	0	0	0	113.6	L480 E489 N495 R566 K567 I570 G571	L480-Y493 HydrophobicContact CD2-CD1 3.84Å; L480-Y493 HydrophobicContact CD2-CD2 4.46Å; L480-Y493 HydrophobicContact CD2-CE1 3.89Å; L480-Y493 HydrophobicContact CD2-CE2 4.49Å; L480-Y493 HydrophobicContact CD2-CG 4.14Å; E489-Y493 HydrophobicContact CG-CD2 3.59Å; E489-Y493 HydrophobicContact CG-CE2 3.62Å; E489-Y493 VanDerWaalsContact O-CD2 3.31Å; E489-Y493 WeakPolarHBondContact O-CD2 3.48Å; E489-Y493 PolarHBondContact O-N 3.42Å; E489-Y493 VanDerWaalsContact O-N 3.11Å; Y493-N495 VanDerWaalsContact C-N 3.28Å; Y493-N495 PolarHBondContact O-N 3.01Å; Y493-R566 HydrophobicContact CD1-CB 3.69Å; Y493-R566 HydrophobicContact CE1-CB 4.03Å; Y493-R566 WeakPolarHBondContact O-CD 3.33Å; Y493-R566 PolarHBondContact O-NH1 2.84Å; Y493-K567 HydrophobicContact CE1-CB 4Å; Y493-K567 HydrophobicContact CE2-CB 4.22Å; Y493-K567 HydrophobicContact CE2-CD 4.14Å; Y493-K567 HydrophobicContact CE2-CG 4.27Å; Y493-I570 HydrophobicContact CE1-CB 4.03Å; Y493-I570 HydrophobicContact CE1-CD1 4.09Å; Y493-I570 HydrophobicContact CE1-CG2 4.28Å; Y493-I570 WeakPolarHBondContact OH-CG2 3.45Å; Y493-G571 PolarHBondContact OH-N 3.14Å
494	N	95	Very high	93	Very high	40 Å²	40	43.2 Å²	43.2	21%	0.214	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	3.3	179.1	-75.4	-78.3	0	0	0	114.4	E490 Q491 E496 F556 R561 Q563	E490-N494 WeakPolarHBondContact CG-ND2 3.46Å; E490-N494 WeakPolarHBondContact O-CB 3.39Å; E490-N494 PolarHBondContact O-N 3.04Å; E490-N494 VanDerWaalsContact O-N 3.12Å; E490-N494 PolarHBondContact O-ND2 2.77Å; Q491-N494 PolarHBondContact O-N 2.87Å; N494-E496 PolarHBondContact O-N 3.42Å; N494-F556 HydrophobicContact CB-CE2 4.23Å; N494-R561 PolarHBondContact ND2-O 3.2Å; N494-Q563 WeakPolarHBondContact OD1-CG 3.4Å; N494-Q563 PolarHBondContact OD1-NE2 2.92Å
495	N	95.2	Very high	93	Very high	11 Å²	11	40.3 Å²	40.3	6%	0.059	23%	0.23	C	C	.	.			trans	-65.3	102.5	174	-78.1	-43.5	0	0	0	111.4	L481 K483 Q486 M492 Y493 R566	L481-N495 PolarHBondContact O-ND2 3.01Å; K483-N495 WeakPolarHBondContact CD-OD1 3.33Å; K483-N495 WeakPolarHBondContact CE-OD1 3.44Å; Q486-N495 PolarHBondContact NE2-OD1 3.35Å; Q486-N495 PolarHBondContact OE1-ND2 3.36Å; M492-N495 PolarHBondContact O-ND2 3.11Å; Y493-N495 VanDerWaalsContact C-N 3.28Å; Y493-N495 PolarHBondContact O-N 3.01Å; N495-R566 PolarHBondContact O-NH1 3.21Å
496	E	92.4	Very high	93	Very high	100 Å²	100	38.2 Å²	38.2	47%	0.467	21%	0.208	S	C	.	.			trans	-70.9	-37.5	-179.1	-65.1	-165.4	-122.5	0	0	113.6	N494 F556	N494-E496 PolarHBondContact O-N 3.42Å; E496-F556 HydrophobicContact CG-CD1 3.6Å; E496-F556 HydrophobicContact CG-CD2 3.83Å; E496-F556 HydrophobicContact CG-CE1 3.5Å; E496-F556 VanDerWaalsContact CG-CE1 3.5Å; E496-F556 HydrophobicContact CG-CE2 3.72Å; E496-F556 HydrophobicContact CG-CG 3.77Å; E496-F556 HydrophobicContact CG-CZ 3.56Å; E496-F556 VanDerWaalsContact OE1-CE1 3.25Å; E496-F556 WeakPolarHBondContact OE1-CE1 3.31Å; E496-F556 VanDerWaalsContact OE2-CD1 3.28Å; E496-F556 WeakPolarHBondContact OE2-CD1 3.34Å; E496-F556 WeakPolarHBondContact OE2-CE1 3.35Å
497	H	92.5	Very high	93	Very high	132 Å²	132	41.7 Å²	41.7	61%	0.611	23%	0.228	S	C	*	.	S	Bend	trans	-123.2	136.1	-171.2	-54	-22.5	0	0	0	111.2	K483	K483-H497 PolarHBondContact NZ-O 3.47Å
498	S	93.3	Very high	93.2	Very high	36 Å²	36	40 Å²	40	25%	0.252	22%	0.215	S	C	.	.			trans	-61.2	162	165.5	-54.2	0	0	0	0	111.7	E503 T552	S498-E503 WeakPolarHBondContact CB-OE1 3.31Å; S498-E503 PolarHBondContact OG-OE1 2.9Å; S498-T552 PolarHBondContact OG-OG1 3.34Å
499	S	94.8	Very high	93.3	Very high	27 Å²	27	38.1 Å²	38.1	19%	0.189	20%	0.202	C	C	.	.			trans	-114.1	164.3	169.8	61.4	0	0	0	0	110.7	F502 E503 E581	S499-F502 PolarHBondContact O-N 3.05Å; S499-F502 VanDerWaalsContact O-N 3.08Å; S499-E503 PolarHBondContact O-N 3.32Å; S499-E581 WeakPolarHBondContact CB-OE1 3.36Å; S499-E581 PolarHBondContact OG-OE1 3.19Å
500	A	94.6	Very high	93.3	Very high	61 Å²	61	37 Å²	37	50%	0.504	20%	0.199	S	C	.	.	H	α-helix	trans	-60.5	-36.6	177.8	0	0	0	0	0	114.1	F502 E504 N609	A500-F502 VanDerWaalsContact C-N 3.32Å; A500-F502 PolarHBondContact O-N 3.03Å; A500-E504 WeakPolarHBondContact O-CB 3.18Å; A500-E504 PolarHBondContact O-N 2.72Å; A500-E504 VanDerWaalsContact O-N 3.12Å; A500-N609 VanDerWaalsContact C-ND2 3.35Å; A500-N609 VanDerWaalsContact CB-OD1 3.25Å; A500-N609 WeakPolarHBondContact CB-OD1 3.32Å; A500-N609 PolarHBondContact O-ND2 3.03Å
501	P	94.4	Very high	93.4	Very high	21 Å²	21	39.9 Å²	39.9	14%	0.136	21%	0.212	C	C	.	.	H	α-helix	trans	-61.5	-37.2	169.8	-27.1	36.7	0	0	0	113.5	F505 F579 P608 N609	P501-F505 WeakPolarHBondContact O-CB 3.27Å; P501-F505 PolarHBondContact O-N 2.89Å; P501-F579 HydrophobicContact CB-CE1 4.17Å; P501-F579 HydrophobicContact CB-CZ 4.1Å; P501-F579 WeakPolarHBondContact O-CZ 3.37Å; P501-P608 HydrophobicContact CB-CB 3.64Å; P501-P608 HydrophobicContact CB-CG 4.11Å; P501-P608 HydrophobicContact CG-CB 3.76Å; P501-P608 HydrophobicContact CG-CG 3.85Å; P501-N609 WeakPolarHBondContact CD-OD1 3.34Å
502	F	95.8	Very high	93.6	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-76.5	-38.6	-178.5	-173	-128.8	0	0	0	112.4	V479 L481 S499 A500 F505 L506 V550 T552 F579	V479-F502 HydrophobicContact CG1-CE2 3.83Å; V479-F502 HydrophobicContact CG1-CZ 3.86Å; L481-F502 HydrophobicContact CB-CD1 4.23Å; L481-F502 HydrophobicContact CB-CE1 4Å; L481-F502 HydrophobicContact CB-CE2 4.36Å; L481-F502 HydrophobicContact CB-CG 4.48Å; L481-F502 HydrophobicContact CB-CZ 4.07Å; L481-F502 HydrophobicContact CD1-CB 3.97Å; L481-F502 HydrophobicContact CD1-CD1 4.32Å; L481-F502 HydrophobicContact CD1-CD2 4.04Å; L481-F502 HydrophobicContact CD1-CG 3.87Å; L481-F502 HydrophobicContact CD2-CB 4.36Å; L481-F502 HydrophobicContact CD2-CD1 3.83Å; L481-F502 HydrophobicContact CD2-CE1 4.32Å; L481-F502 HydrophobicContact CD2-CG 4.17Å; L481-F502 HydrophobicContact CG-CD1 4.36Å; L481-F502 HydrophobicContact CG-CG 4.41Å; S499-F502 PolarHBondContact O-N 3.05Å; S499-F502 VanDerWaalsContact O-N 3.08Å; A500-F502 VanDerWaalsContact C-N 3.32Å; A500-F502 PolarHBondContact O-N 3.03Å; F502-F505 HydrophobicContact CD2-CD1 4.24Å; F502-F505 HydrophobicContact CE2-CD1 4.3Å; F502-F505 WeakPolarHBondContact O-CB 3.39Å; F502-F505 PolarHBondContact O-N 2.59Å; F502-L506 HydrophobicContact CD1-CD1 3.81Å; F502-L506 HydrophobicContact CD1-CG 4.49Å; F502-L506 HydrophobicContact CD2-CG 4.48Å; F502-L506 HydrophobicContact CE1-CD1 3.72Å; F502-L506 HydrophobicContact CE1-CG 4.36Å; F502-L506 HydrophobicContact CE2-CD2 4.33Å; F502-L506 HydrophobicContact CE2-CG 4.34Å; F502-L506 HydrophobicContact CG-CD1 4.3Å; F502-L506 HydrophobicContact CZ-CD1 4.12Å; F502-L506 HydrophobicContact CZ-CD2 4.13Å; F502-L506 HydrophobicContact CZ-CG 4.29Å; F502-L506 VanDerWaalsContact O-CG 3.25Å; F502-L506 WeakPolarHBondContact O-CG 3.24Å; F502-L506 PolarHBondContact O-N 3.46Å; F502-V550 HydrophobicContact CE1-CG1 3.91Å; F502-V550 HydrophobicContact CZ-CG1 3.88Å; F502-T552 HydrophobicContact CD1-CG2 4.44Å; F502-T552 HydrophobicContact CE1-CG2 4.02Å; F502-F579 HydrophobicContact CB-CD1 4.14Å; F502-F579 HydrophobicContact CB-CE1 4.02Å; F502-F579 HydrophobicContact CD2-CB 3.79Å; F502-F579 AromaticContact CD2-CD1 3.53Å; F502-F579 HydrophobicContact CD2-CD1 3.53Å; F502-F579 HydrophobicContact CD2-CD2 4.36Å; F502-F579 HydrophobicContact CD2-CE1 4.15Å; F502-F579 AromaticContact CD2-CG 3.63Å; F502-F579 HydrophobicContact CD2-CG 3.63Å; F502-F579 HydrophobicContact CE2-CB 3.75Å; F502-F579 HydrophobicContact CE2-CD1 4.35Å; F502-F579 HydrophobicContact CE2-CG 4.12Å; F502-F579 HydrophobicContact CG-CD1 4.24Å
503	E	95.4	Very high	93.7	Very high	52 Å²	52	41.9 Å²	41.9	24%	0.243	22%	0.218	C	C	.	.	H	α-helix	trans	-66.2	-40.8	174.2	-68.3	-63.8	169.6	0	0	111.8	S498 S499 F505 L506 D507 R512	S498-E503 WeakPolarHBondContact CB-OE1 3.31Å; S498-E503 PolarHBondContact OG-OE1 2.9Å; S499-E503 PolarHBondContact O-N 3.32Å; E503-F505 PolarHBondContact O-N 2.89Å; E503-L506 PolarHBondContact O-N 2.66Å; E503-L506 VanDerWaalsContact O-N 3.16Å; E503-D507 PolarHBondContact O-N 3.09Å; E503-R512 IonicContact OE1-NH2 2.66Å; E503-R512 PolarHBondContact OE1-NH2 2.92Å; E503-R512 IonicContact OE2-CZ 2.73Å; E503-R512 IonicContact OE2-NH2 2.72Å; E503-R512 PolarHBondContact OE2-NH2 2.87Å
504	E	93	Very high	93.8	Very high	19 Å²	19	47 Å²	47	9%	0.089	24%	0.237	C	C	.	.	H	α-helix	trans	-56.1	-38.1	170.9	176	172.1	-154.6	0	0	112	A500 I508 N609 R640	A500-E504 WeakPolarHBondContact O-CB 3.18Å; A500-E504 PolarHBondContact O-N 2.72Å; A500-E504 VanDerWaalsContact O-N 3.12Å; E504-I508 WeakPolarHBondContact O-CG1 3.03Å; E504-I508 PolarHBondContact O-N 3.06Å; E504-N609 VanDerWaalsContact OE2-CA 3.26Å; E504-N609 WeakPolarHBondContact OE2-CA 3.35Å; E504-N609 PolarHBondContact OE2-N 3.09Å; E504-N609 PolarHBondContact OE2-ND2 3.06Å; E504-R640 WeakPolarHBondContact OE1-CD 3.16Å; E504-R640 IonicContact OE1-CZ 3.32Å; E504-R640 IonicContact OE1-NE 2.88Å; E504-R640 IonicContact OE1-NH1 2.79Å; E504-R640 PolarHBondContact OE1-NH1 2.81Å
505	F	92.7	Very high	93.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-72.5	-37.8	176.5	177.5	-103.2	0	0	0	113.7	P501 F502 E503 I508 L509 I577 F579 V603 Y615 F644 L648	P501-F505 WeakPolarHBondContact O-CB 3.27Å; P501-F505 PolarHBondContact O-N 2.89Å; F502-F505 HydrophobicContact CD2-CD1 4.24Å; F502-F505 HydrophobicContact CE2-CD1 4.3Å; F502-F505 WeakPolarHBondContact O-CB 3.39Å; F502-F505 PolarHBondContact O-N 2.59Å; E503-F505 PolarHBondContact O-N 2.89Å; F505-I508 WeakPolarHBondContact O-CB 3.31Å; F505-I508 PolarHBondContact O-N 3.38Å; F505-I508 VanDerWaalsContact O-N 3.17Å; F505-L509 HydrophobicContact CD1-CD1 4.27Å; F505-L509 HydrophobicContact CE1-CD1 3.71Å; F505-L509 HydrophobicContact CE1-CG 4.14Å; F505-L509 HydrophobicContact CZ-CD1 4.22Å; F505-L509 HydrophobicContact CZ-CD2 4.28Å; F505-L509 HydrophobicContact CZ-CG 4.29Å; F505-L509 PolarHBondContact O-N 3.15Å; F505-L509 VanDerWaalsContact O-N 3.13Å; F505-I577 HydrophobicContact CE1-CG2 4.07Å; F505-I577 HydrophobicContact CZ-CG2 3.94Å; F505-F579 HydrophobicContact CB-CD2 3.89Å; F505-F579 HydrophobicContact CB-CE2 3.46Å; F505-F579 VanDerWaalsContact CB-CE2 3.46Å; F505-F579 HydrophobicContact CB-CZ 4.05Å; F505-F579 HydrophobicContact CD1-CB 4.37Å; F505-F579 AromaticContact CD1-CD2 3.46Å; F505-F579 HydrophobicContact CD1-CD2 3.46Å; F505-F579 VanDerWaalsContact CD1-CD2 3.46Å; F505-F579 AromaticContact CD1-CE2 3.99Å; F505-F579 HydrophobicContact CD1-CE2 3.99Å; F505-F579 HydrophobicContact CD1-CG 4.11Å; F505-F579 AromaticContact CD2-CD2 3.72Å; F505-F579 HydrophobicContact CD2-CD2 3.72Å; F505-F579 AromaticContact CD2-CE2 3.68Å; F505-F579 HydrophobicContact CD2-CE2 3.68Å; F505-F579 HydrophobicContact CE1-CB 4.32Å; F505-F579 AromaticContact CE1-CD2 3.83Å; F505-F579 HydrophobicContact CE1-CD2 3.83Å; F505-F579 HydrophobicContact CE1-CG 4.44Å; F505-F579 HydrophobicContact CE2-CD2 4.05Å; F505-F579 HydrophobicContact CE2-CE2 4.38Å; F505-F579 AromaticContact CG-CD2 3.4Å; F505-F579 HydrophobicContact CG-CD2 3.4Å; F505-F579 VanDerWaalsContact CG-CD2 3.4Å; F505-F579 AromaticContact CG-CE2 3.44Å; F505-F579 HydrophobicContact CG-CE2 3.44Å; F505-F579 VanDerWaalsContact CG-CE2 3.44Å; F505-F579 HydrophobicContact CG-CG 4.39Å; F505-F579 HydrophobicContact CG-CZ 4.44Å; F505-F579 HydrophobicContact CZ-CD2 4.11Å; F505-V603 HydrophobicContact CE2-CB 4.3Å; F505-V603 HydrophobicContact CE2-CG1 3.8Å; F505-V603 HydrophobicContact CZ-CB 4.34Å; F505-V603 HydrophobicContact CZ-CG1 4.33Å; F505-V603 HydrophobicContact CZ-CG2 4.34Å; F505-Y615 HydrophobicContact CD2-CD1 4.38Å; F505-Y615 HydrophobicContact CD2-CE1 4.04Å; F505-F644 HydrophobicContact CE2-CE1 4.37Å; F505-L648 HydrophobicContact CE2-CD1 3.42Å; F505-L648 VanDerWaalsContact CE2-CD1 3.42Å; F505-L648 HydrophobicContact CZ-CD1 3.72Å
506	L	93.9	Very high	93.8	Very high	1 Å²	1	50 Å²	50	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-38.2	177.9	-71.7	167.6	0	0	0	112	F502 E503 I508 L509 G510 V537 V550 M553	F502-L506 HydrophobicContact CD1-CD1 3.81Å; F502-L506 HydrophobicContact CD1-CG 4.49Å; F502-L506 HydrophobicContact CD2-CG 4.48Å; F502-L506 HydrophobicContact CE1-CD1 3.72Å; F502-L506 HydrophobicContact CE1-CG 4.36Å; F502-L506 HydrophobicContact CE2-CD2 4.33Å; F502-L506 HydrophobicContact CE2-CG 4.34Å; F502-L506 HydrophobicContact CG-CD1 4.3Å; F502-L506 HydrophobicContact CZ-CD1 4.12Å; F502-L506 HydrophobicContact CZ-CD2 4.13Å; F502-L506 HydrophobicContact CZ-CG 4.29Å; F502-L506 VanDerWaalsContact O-CG 3.25Å; F502-L506 WeakPolarHBondContact O-CG 3.24Å; F502-L506 PolarHBondContact O-N 3.46Å; E503-L506 PolarHBondContact O-N 2.66Å; E503-L506 VanDerWaalsContact O-N 3.16Å; L506-I508 VanDerWaalsContact C-N 3.26Å; L506-I508 PolarHBondContact O-N 3.36Å; L506-L509 HydrophobicContact CD2-CD1 4.49Å; L506-L509 PolarHBondContact O-N 2.93Å; L506-G510 PolarHBondContact O-N 3.44Å; L506-V537 HydrophobicContact CB-CG2 4.19Å; L506-V537 HydrophobicContact CD2-CG2 4.03Å; L506-V550 HydrophobicContact CD1-CG1 4.08Å; L506-V550 HydrophobicContact CD2-CB 4.5Å; L506-V550 HydrophobicContact CD2-CG1 3.82Å; L506-V550 HydrophobicContact CD2-CG2 3.8Å; L506-M553 HydrophobicContact CD1-CE 3.76Å
507	D	92.5	Very high	93.8	Very high	103 Å²	103	48.4 Å²	48.4	55%	0.551	26%	0.258	S	S	*	.	H	α-helix	trans	-64.8	-27.4	172.6	-79.5	-15	0	0	0	112.8	E503	E503-D507 PolarHBondContact O-N 3.09Å
508	I	90.4	Very high	93.8	Very high	13 Å²	13	43.2 Å²	43.2	7%	0.067	23%	0.234	C	C	.	.	H	α-helix	trans	-71.3	-45.3	171.5	-66.6	167.3	0	0	0	110	E504 F505 L506 G510 Y615 R640 F644 R645	E504-I508 WeakPolarHBondContact O-CG1 3.03Å; E504-I508 PolarHBondContact O-N 3.06Å; F505-I508 WeakPolarHBondContact O-CB 3.31Å; F505-I508 PolarHBondContact O-N 3.38Å; F505-I508 VanDerWaalsContact O-N 3.17Å; L506-I508 VanDerWaalsContact C-N 3.26Å; L506-I508 PolarHBondContact O-N 3.36Å; I508-G510 PolarHBondContact O-N 3.2Å; I508-Y615 HydrophobicContact CD1-CE2 3.74Å; I508-Y615 VanDerWaalsContact CD1-OH 3.28Å; I508-Y615 WeakPolarHBondContact CD1-OH 3.36Å; I508-R640 HydrophobicContact CD1-CB 4.48Å; I508-R640 HydrophobicContact CD1-CG 3.8Å; I508-R640 HydrophobicContact CG1-CG 4.42Å; I508-F644 HydrophobicContact CG2-CD1 4.18Å; I508-R645 HydrophobicContact CG2-CB 3.79Å; I508-R645 HydrophobicContact CG2-CG 4.4Å; I508-R645 WeakPolarHBondContact O-CD 3.2Å; I508-R645 WeakPolarHBondContact O-CG 3.41Å; I508-R645 PolarHBondContact O-NE 2.85Å
509	L	89.9	Confident	93.7	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-60.8	-49	-178.7	-70.2	178.7	0	0	0	112.6	V479 F505 L506 V537 F548 I577 R645 L648	V479-L509 HydrophobicContact CG2-CD1 4.36Å; F505-L509 HydrophobicContact CD1-CD1 4.27Å; F505-L509 HydrophobicContact CE1-CD1 3.71Å; F505-L509 HydrophobicContact CE1-CG 4.14Å; F505-L509 HydrophobicContact CZ-CD1 4.22Å; F505-L509 HydrophobicContact CZ-CD2 4.28Å; F505-L509 HydrophobicContact CZ-CG 4.29Å; F505-L509 PolarHBondContact O-N 3.15Å; F505-L509 VanDerWaalsContact O-N 3.13Å; L506-L509 HydrophobicContact CD2-CD1 4.49Å; L506-L509 PolarHBondContact O-N 2.93Å; L509-V537 HydrophobicContact CB-CG1 4.41Å; L509-F548 HydrophobicContact CB-CE2 4.02Å; L509-F548 HydrophobicContact CB-CZ 4.06Å; L509-F548 HydrophobicContact CD1-CD1 4.28Å; L509-F548 HydrophobicContact CD1-CE1 4.1Å; L509-F548 HydrophobicContact CD1-CZ 4.31Å; L509-F548 HydrophobicContact CD2-CE1 4.4Å; L509-F548 HydrophobicContact CD2-CZ 4.22Å; L509-F548 HydrophobicContact CG-CZ 4.44Å; L509-I577 HydrophobicContact CD1-CD1 4.06Å; L509-I577 HydrophobicContact CD2-CD1 4.06Å; L509-R645 PolarHBondContact O-NH2 3.46Å; L509-L648 HydrophobicContact CD2-CB 4.15Å; L509-L648 HydrophobicContact CD2-CD1 3.9Å
510	G	90.3	Very high	93.5	Very high	7 Å²	7	50.7 Å²	50.7	7%	0.072	26%	0.264	C	S	.	.			trans	-173.1	-170.2	-173	0	0	0	0	0	115.3	L506 I508	L506-G510 PolarHBondContact O-N 3.44Å; I508-G510 PolarHBondContact O-N 3.2Å
511	Q	93.6	Very high	93.3	Very high	134 Å²	134	49.9 Å²	49.9	63%	0.626	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	126.7	177.9	-175.2	177.5	9.8	0	0	110	I513 Y538	Q511-I513 HydrophobicContact CG-CG2 4.26Å; Q511-I513 PolarHBondContact O-N 3.28Å; Q511-Y538 PolarHBondContact N-O 3.21Å; Q511-Y538 PolarHBondContact O-N 2.88Å
512	R	96.6	Very high	93.1	Very high	102 Å²	102	52.5 Å²	52.5	39%	0.385	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	125	164.7	-174.9	-176.3	-79.5	-111.5	5.8	109.7	E503 H535 S536 M553	E503-R512 IonicContact OE1-NH2 2.66Å; E503-R512 PolarHBondContact OE1-NH2 2.92Å; E503-R512 IonicContact OE2-CZ 2.73Å; E503-R512 IonicContact OE2-NH2 2.72Å; E503-R512 PolarHBondContact OE2-NH2 2.87Å; R512-H535 HydrophobicContact CG-CB 4.4Å; R512-S536 CarbonylContact C-O 3.55Å; R512-S536 WeakPolarHBondContact CA-O 3.3Å; R512-M553 VanDerWaalsContact CZ-CE 3.46Å; R512-M553 VanDerWaalsContact NH2-CE 3.3Å
513	I	96.6	Very high	92.8	Very high	17 Å²	17	52.9 Å²	52.9	9%	0.087	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	152	-175.7	52.8	158.2	0	0	0	111.3	Q511 F518 H535 S536 Y538 M547	Q511-I513 HydrophobicContact CG-CG2 4.26Å; Q511-I513 PolarHBondContact O-N 3.28Å; I513-F518 HydrophobicContact CB-CE2 4.32Å; I513-F518 HydrophobicContact CD1-CD1 3.97Å; I513-F518 HydrophobicContact CD1-CD2 3.88Å; I513-F518 HydrophobicContact CD1-CE1 3.62Å; I513-F518 HydrophobicContact CD1-CE2 3.55Å; I513-F518 HydrophobicContact CD1-CG 4.08Å; I513-F518 HydrophobicContact CD1-CZ 3.4Å; I513-F518 VanDerWaalsContact CD1-CZ 3.4Å; I513-F518 HydrophobicContact CG2-CE2 4.16Å; I513-H535 CarbonylContact O-C 2.8Å; I513-H535 WeakPolarHBondContact O-CA 3.25Å; I513-H535 WeakPolarHBondContact O-CB 3.5Å; I513-H535 PolarHBondContact O-CD2 3.37Å; I513-S536 VanDerWaalsContact CG1-O 3.25Å; I513-S536 WeakPolarHBondContact CG1-O 3.34Å; I513-S536 PolarHBondContact N-O 3.25Å; I513-S536 PolarHBondContact O-N 2.85Å; I513-S536 VanDerWaalsContact O-N 3.1Å; I513-Y538 VanDerWaalsContact CD1-CB 3.48Å; I513-Y538 HydrophobicContact CD1-CG 4.2Å; I513-M547 HydrophobicContact CD1-CE 3.98Å
514	R	96.6	Very high	92.7	Very high	110 Å²	110	52.8 Å²	52.8	42%	0.415	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	134.9	165.7	-173.8	74.1	-164.6	-143.5	-0.3	109.1	K516 D530 T534 H535	R514-K516 HydrophobicContact CG-CB 4.22Å; R514-D530 IonicContact CZ-OD1 2.77Å; R514-D530 IonicContact NE-OD1 3.54Å; R514-D530 PolarHBondContact NE-OD1 3.33Å; R514-D530 IonicContact NH2-OD1 3.64Å; R514-D530 PolarHBondContact NH2-OD1 3.46Å; R514-D530 IonicContact NH2-OD2 2.93Å; R514-D530 PolarHBondContact NH2-OD2 3.23Å; R514-T534 WeakPolarHBondContact CD-O 3.36Å; R514-T534 PolarHBondContact NE-O 3.25Å; R514-T534 VanDerWaalsContact NE-O 3.17Å; R514-H535 WeakPolarHBondContact CD-NE2 3.21Å
515	L	95.7	Very high	92.8	Very high	2 Å²	2	52 Å²	52	1%	0.01	27%	0.269	C	S	.	.	S	Bend	trans	-77.3	-42.8	178.1	-64.9	173.5	0	0	0	111.9	G517 F518 L525 N527 T534 M547	L515-G517 PolarHBondContact O-N 2.79Å; L515-F518 VanDerWaalsContact O-CB 3.22Å; L515-F518 WeakPolarHBondContact O-CB 3.31Å; L515-F518 PolarHBondContact O-N 2.76Å; L515-L525 HydrophobicContact CD1-CB 4.24Å; L515-L525 HydrophobicContact CD1-CD1 3.96Å; L515-L525 HydrophobicContact CD2-CB 4.23Å; L515-L525 HydrophobicContact CD2-CD1 3.68Å; L515-N527 VanDerWaalsContact O-CA 3.26Å; L515-N527 WeakPolarHBondContact O-CA 3.2Å; L515-N527 VanDerWaalsContact O-CB 3.23Å; L515-N527 WeakPolarHBondContact O-CB 3.43Å; L515-T534 PolarHBondContact N-O 3.11Å; L515-M547 HydrophobicContact CD2-CE 4.22Å
516	K	94.3	Very high	92.9	Very high	112 Å²	112	53.6 Å²	53.6	49%	0.487	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	118.5	176.1	-166.1	-178.1	-143.1	124.3	0	111.7	R514 N527 K528 D530	R514-K516 HydrophobicContact CG-CB 4.22Å; K516-N527 WeakPolarHBondContact CA-O 3.28Å; K516-K528 WeakPolarHBondContact CE-O 3.28Å; K516-D530 WeakPolarHBondContact CD-OD2 3.44Å; K516-D530 IonicContact NZ-OD2 4Å; K516-D530 PolarHBondContact NZ-OD2 3.25Å
517	G	92	Very high	92.8	Very high	66 Å²	66	55.5 Å²	55.5	68%	0.68	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.3	3.4	-178.6	0	0	0	0	0	115.4	L515 N527	L515-G517 PolarHBondContact O-N 2.79Å; G517-N527 PolarHBondContact N-O 2.94Å
518	F	93.4	Very high	92.8	Very high	23 Å²	23	58.1 Å²	58.1	10%	0.101	29%	0.294	C	S	.	.			trans	-69.6	129.2	178.4	-166.5	-115.6	0	0	0	111.9	I513 L515 K520 Y521 N527 Y538 M547	I513-F518 HydrophobicContact CB-CE2 4.32Å; I513-F518 HydrophobicContact CD1-CD1 3.97Å; I513-F518 HydrophobicContact CD1-CD2 3.88Å; I513-F518 HydrophobicContact CD1-CE1 3.62Å; I513-F518 HydrophobicContact CD1-CE2 3.55Å; I513-F518 HydrophobicContact CD1-CG 4.08Å; I513-F518 HydrophobicContact CD1-CZ 3.4Å; I513-F518 VanDerWaalsContact CD1-CZ 3.4Å; I513-F518 HydrophobicContact CG2-CE2 4.16Å; L515-F518 VanDerWaalsContact O-CB 3.22Å; L515-F518 WeakPolarHBondContact O-CB 3.31Å; L515-F518 PolarHBondContact O-N 2.76Å; F518-K520 HydrophobicContact CD1-CB 4.39Å; F518-K520 HydrophobicContact CE1-CB 3.66Å; F518-K520 HydrophobicContact CE1-CG 4.42Å; F518-K520 HydrophobicContact CE2-CB 4.35Å; F518-K520 HydrophobicContact CE2-CD 4.3Å; F518-K520 HydrophobicContact CE2-CG 4.23Å; F518-K520 HydrophobicContact CZ-CB 3.63Å; F518-K520 HydrophobicContact CZ-CD 4.01Å; F518-K520 HydrophobicContact CZ-CG 3.96Å; F518-Y521 WeakPolarHBondContact CE1-O 3.35Å; F518-N527 PolarHBondContact O-ND2 3.01Å; F518-Y538 AromaticContact CE1-CD2 3.92Å; F518-Y538 HydrophobicContact CE1-CD2 3.92Å; F518-Y538 HydrophobicContact CE1-CE2 4.14Å; F518-Y538 HydrophobicContact CE1-CG 4.45Å; F518-Y538 HydrophobicContact CZ-CD1 4.19Å; F518-Y538 AromaticContact CZ-CD2 3.7Å; F518-Y538 HydrophobicContact CZ-CD2 3.7Å; F518-Y538 HydrophobicContact CZ-CE1 4.43Å; F518-Y538 AromaticContact CZ-CE2 3.91Å; F518-Y538 HydrophobicContact CZ-CE2 3.91Å; F518-Y538 AromaticContact CZ-CG 3.85Å; F518-Y538 HydrophobicContact CZ-CG 3.85Å; F518-M547 HydrophobicContact CD1-CE 4.45Å; F518-M547 HydrophobicContact CE1-CE 4.11Å
519	D	91.7	Very high	92.8	Very high	125 Å²	125	60 Å²	60	67%	0.668	32%	0.317	S	S	*	.			trans	-104.6	-9.6	-170.8	78.9	-48	0	0	0	114.9
520	K	90.5	Very high	92.9	Very high	96 Å²	96	61.4 Å²	61.4	42%	0.417	32%	0.324	S	S	.	.	S	Bend	trans	-89.9	-167.3	-179.7	-47.2	-172.3	-175.4	174	0	111.9	F518 R522 Y538 E545	F518-K520 HydrophobicContact CD1-CB 4.39Å; F518-K520 HydrophobicContact CE1-CB 3.66Å; F518-K520 HydrophobicContact CE1-CG 4.42Å; F518-K520 HydrophobicContact CE2-CB 4.35Å; F518-K520 HydrophobicContact CE2-CD 4.3Å; F518-K520 HydrophobicContact CE2-CG 4.23Å; F518-K520 HydrophobicContact CZ-CB 3.63Å; F518-K520 HydrophobicContact CZ-CD 4.01Å; F518-K520 HydrophobicContact CZ-CG 3.96Å; K520-R522 PolarHBondContact O-N 2.83Å; K520-Y538 HydrophobicContact CB-CE2 4.2Å; K520-Y538 HydrophobicContact CD-CE1 4.05Å; K520-Y538 HydrophobicContact CD-CE2 4.49Å; K520-Y538 WeakPolarHBondContact CD-OH 3.22Å; K520-E545 WeakPolarHBondContact CB-OE1 3.36Å
521	Y	90.1	Very high	93	Very high	43 Å²	43	65.1 Å²	65.1	17%	0.169	35%	0.349	C	S	.	.			trans	-61.1	121.9	177	-178.4	-122.6	0	0	0	112.3	R474 Y475 K476 F518 E545 M547	R474-Y521 HydrophobicContact CB-CD1 4.03Å; R474-Y521 HydrophobicContact CB-CD2 4.2Å; R474-Y521 HydrophobicContact CB-CE1 4.05Å; R474-Y521 HydrophobicContact CB-CE2 4.18Å; R474-Y521 HydrophobicContact CB-CG 4.09Å; R474-Y521 HydrophobicContact CG-CD1 4.43Å; R474-Y521 HydrophobicContact CG-CD2 4.32Å; R474-Y521 HydrophobicContact CG-CG 4.11Å; Y475-Y521 WeakPolarHBondContact O-CE1 3.3Å; K476-Y521 HydrophobicContact CB-CE1 4.46Å; F518-Y521 WeakPolarHBondContact CE1-O 3.35Å; Y521-E545 VanDerWaalsContact CB-OE1 3.3Å; Y521-E545 WeakPolarHBondContact CB-OE1 3.17Å; Y521-E545 PolarHBondContact N-OE1 3.48Å; Y521-M547 HydrophobicContact CD1-CB 4.09Å; Y521-M547 HydrophobicContact CE1-CB 4.15Å; Y521-M547 WeakPolarHBondContact O-CE 3.12Å
522	R	91	Very high	93	Very high	77 Å²	77	59.6 Å²	59.6	29%	0.291	32%	0.324	S	S	.	.			trans	-102.6	5	-172.8	72.2	-172.3	-172.5	-85.1	-8.1	115.7	K520 G524 L525 E1065	K520-R522 PolarHBondContact O-N 2.83Å; R522-G524 PolarHBondContact O-N 3.17Å; R522-L525 WeakPolarHBondContact CD-O 3.49Å; R522-L525 VanDerWaalsContact O-CB 3.28Å; R522-L525 WeakPolarHBondContact O-CB 3.41Å; R522-L525 WeakPolarHBondContact O-CG 3.48Å; R522-L525 PolarHBondContact O-N 2.91Å; R522-E1065 IonicContact CZ-OE2 3.5Å; R522-E1065 IonicContact NH1-OE2 2.76Å; R522-E1065 PolarHBondContact NH1-OE2 3.48Å; R522-E1065 IonicContact NH2-OE2 3.61Å; R522-E1065 PolarHBondContact NH2-OE2 3.36Å
523	G	89.7	Confident	92.8	Very high	8 Å²	8	55.2 Å²	55.2	8%	0.082	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	-11.6	179.1	0	0	0	0	0	117.7	H549	G523-H549 PolarHBondContact O-CE1 3.11Å; G523-H549 PolarHBondContact O-NE2 3.41Å
524	G	91.7	Very high	92.8	Very high	50 Å²	50	57.3 Å²	57.3	52%	0.515	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	108.2	1.7	-165.7	0	0	0	0	0	113.5	R522	R522-G524 PolarHBondContact O-N 3.17Å
525	L	95.4	Very high	92.8	Very high	3 Å²	3	55 Å²	55	2%	0.016	32%	0.318	C	S	.	.			trans	-73.3	156.2	171	-57	177.1	0	0	0	111.9	L515 R522 T532 M547 L554	L515-L525 HydrophobicContact CD1-CB 4.24Å; L515-L525 HydrophobicContact CD1-CD1 3.96Å; L515-L525 HydrophobicContact CD2-CB 4.23Å; L515-L525 HydrophobicContact CD2-CD1 3.68Å; R522-L525 WeakPolarHBondContact CD-O 3.49Å; R522-L525 VanDerWaalsContact O-CB 3.28Å; R522-L525 WeakPolarHBondContact O-CB 3.41Å; R522-L525 WeakPolarHBondContact O-CG 3.48Å; R522-L525 PolarHBondContact O-N 2.91Å; L525-T532 WeakPolarHBondContact CA-OG1 3.48Å; L525-T532 WeakPolarHBondContact CB-OG1 3.31Å; L525-M547 HydrophobicContact CD1-CE 4.28Å; L525-M547 HydrophobicContact CD1-CG 4.13Å; L525-M547 HydrophobicContact CD1-SD 3.87Å; L525-L554 HydrophobicContact CD2-CD2 3.78Å
526	D	94.1	Very high	92.8	Very high	33 Å²	33	55 Å²	55	18%	0.176	32%	0.318	C	S	.	.			trans	-81.4	121.5	176.9	171.6	23.7	0	0	0	111.6	K528 G529 D530 S531 T532	D526-K528 WeakPolarHBondContact OD1-CA 3.35Å; D526-K528 PolarHBondContact OD1-N 2.84Å; D526-G529 VanDerWaalsContact CG-N 3.33Å; D526-G529 PolarHBondContact OD1-N 2.88Å; D526-G529 VanDerWaalsContact OD2-C 3.23Å; D526-G529 WeakPolarHBondContact OD2-CA 3.5Å; D526-G529 PolarHBondContact OD2-N 3.48Å; D526-D530 PolarHBondContact OD2-N 2.84Å; D526-D530 VanDerWaalsContact OD2-N 3.14Å; D526-S531 WeakPolarHBondContact CB-OG 3.32Å; D526-S531 VanDerWaalsContact CG-OG 3.29Å; D526-S531 WeakPolarHBondContact OD2-CB 3.39Å; D526-S531 PolarHBondContact OD2-N 3.04Å; D526-S531 PolarHBondContact OD2-OG 3.43Å; D526-T532 HydrophobicContact CB-CG2 3.99Å; D526-T532 PolarHBondContact N-OG1 3.45Å
527	N	93.1	Very high	92.9	Very high	41 Å²	41	49.7 Å²	49.7	22%	0.219	30%	0.295	C	S	.	.	S	Bend	trans	-102.1	14.5	177.6	71.8	-19.9	0	0	0	114.3	L515 K516 G517 F518	L515-N527 VanDerWaalsContact O-CA 3.26Å; L515-N527 WeakPolarHBondContact O-CA 3.2Å; L515-N527 VanDerWaalsContact O-CB 3.23Å; L515-N527 WeakPolarHBondContact O-CB 3.43Å; K516-N527 WeakPolarHBondContact CA-O 3.28Å; G517-N527 PolarHBondContact N-O 2.94Å; F518-N527 PolarHBondContact O-ND2 3.01Å
528	K	92.1	Very high	93.1	Very high	158 Å²	158	47 Å²	47	69%	0.687	27%	0.265	S	S	*	.	S	Bend	trans	-124.3	-52.5	-177.8	-60.6	177.6	-176.1	175.1	0	113.4	K516 D526	K516-K528 WeakPolarHBondContact CE-O 3.28Å; D526-K528 WeakPolarHBondContact OD1-CA 3.35Å; D526-K528 PolarHBondContact OD1-N 2.84Å
529	G	90.7	Very high	93	Very high	52 Å²	52	46.2 Å²	46.2	54%	0.536	26%	0.262	S	S	.	.	S	Bend	trans	-99.5	-4	-168.9	0	0	0	0	0	115.4	D526 S531	D526-G529 VanDerWaalsContact CG-N 3.33Å; D526-G529 PolarHBondContact OD1-N 2.88Å; D526-G529 VanDerWaalsContact OD2-C 3.23Å; D526-G529 WeakPolarHBondContact OD2-CA 3.5Å; D526-G529 PolarHBondContact OD2-N 3.48Å; G529-S531 PolarHBondContact O-N 2.92Å
530	D	91.8	Very high	92.7	Very high	30 Å²	30	43.9 Å²	43.9	16%	0.16	26%	0.256	C	S	.	.			trans	57.1	19.4	-169.3	-57.5	-80.4	0	0	0	113.4	R514 K516 D526 T532 G533 T534	R514-D530 IonicContact CZ-OD1 2.77Å; R514-D530 IonicContact NE-OD1 3.54Å; R514-D530 PolarHBondContact NE-OD1 3.33Å; R514-D530 IonicContact NH2-OD1 3.64Å; R514-D530 PolarHBondContact NH2-OD1 3.46Å; R514-D530 IonicContact NH2-OD2 2.93Å; R514-D530 PolarHBondContact NH2-OD2 3.23Å; K516-D530 WeakPolarHBondContact CD-OD2 3.44Å; K516-D530 IonicContact NZ-OD2 4Å; K516-D530 PolarHBondContact NZ-OD2 3.25Å; D526-D530 PolarHBondContact OD2-N 2.84Å; D526-D530 VanDerWaalsContact OD2-N 3.14Å; D530-T532 VanDerWaalsContact C-N 3.29Å; D530-T532 PolarHBondContact O-N 2.84Å; D530-G533 CarbonylContact C-O 3.43Å; D530-G533 WeakPolarHBondContact CA-O 3.3Å; D530-G533 CarbonylContact O-C 3.56Å; D530-G533 PolarHBondContact O-N 3.06Å; D530-T534 HydrophobicContact CB-CG2 4.19Å
531	S	92.2	Very high	91.9	Very high	85 Å²	85	40.5 Å²	40.5	59%	0.594	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-18.1	-172.3	62.3	0	0	0	0	114.4	D526 G529 P555	D526-S531 WeakPolarHBondContact CB-OG 3.32Å; D526-S531 VanDerWaalsContact CG-OG 3.29Å; D526-S531 WeakPolarHBondContact OD2-CB 3.39Å; D526-S531 PolarHBondContact OD2-N 3.04Å; D526-S531 PolarHBondContact OD2-OG 3.43Å; G529-S531 PolarHBondContact O-N 2.92Å; S531-P555 WeakPolarHBondContact O-CG 3.31Å
532	T	94	Very high	90.8	Very high	18 Å²	18	41.2 Å²	41.2	11%	0.11	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	30	170.5	65.8	0	0	0	0	111.5	L525 D526 D530	L525-T532 WeakPolarHBondContact CA-OG1 3.48Å; L525-T532 WeakPolarHBondContact CB-OG1 3.31Å; D526-T532 HydrophobicContact CB-CG2 3.99Å; D526-T532 PolarHBondContact N-OG1 3.45Å; D530-T532 VanDerWaalsContact C-N 3.29Å; D530-T532 PolarHBondContact O-N 2.84Å
533	G	93	Very high	89.8	Confident	10 Å²	10	46.1 Å²	46.1	10%	0.103	27%	0.272	C	S	.	.			trans	94.3	173	-173.2	0	0	0	0	0	112.5	D530	D530-G533 CarbonylContact C-O 3.43Å; D530-G533 WeakPolarHBondContact CA-O 3.3Å; D530-G533 CarbonylContact O-C 3.56Å; D530-G533 PolarHBondContact O-N 3.06Å
534	T	95.4	Very high	89.1	Confident	62 Å²	62	47.5 Å²	47.5	38%	0.38	28%	0.275	S	S	.	.	S	Bend	trans	-94.8	-30.8	-173.9	54.4	0	0	0	0	113.4	R514 L515 D530	R514-T534 WeakPolarHBondContact CD-O 3.36Å; R514-T534 PolarHBondContact NE-O 3.25Å; R514-T534 VanDerWaalsContact NE-O 3.17Å; L515-T534 PolarHBondContact N-O 3.11Å; D530-T534 HydrophobicContact CB-CG2 4.19Å
535	H	96.7	Very high	88.8	Confident	60 Å²	60	46.8 Å²	46.8	28%	0.278	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	160.8	-174.1	-60.6	86.2	0	0	0	110.3	R512 I513 R514 M553	R512-H535 HydrophobicContact CG-CB 4.4Å; I513-H535 CarbonylContact O-C 2.8Å; I513-H535 WeakPolarHBondContact O-CA 3.25Å; I513-H535 WeakPolarHBondContact O-CB 3.5Å; I513-H535 PolarHBondContact O-CD2 3.37Å; R514-H535 WeakPolarHBondContact CD-NE2 3.21Å; H535-M553 HydrophobicContact CB-SD 4.43Å
536	S	97.2	Very high	88.5	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.014	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	-177.1	161.1	-158.3	0	0	0	0	110.3	R512 I513 F548	R512-S536 CarbonylContact C-O 3.55Å; R512-S536 WeakPolarHBondContact CA-O 3.3Å; I513-S536 VanDerWaalsContact CG1-O 3.25Å; I513-S536 WeakPolarHBondContact CG1-O 3.34Å; I513-S536 PolarHBondContact N-O 3.25Å; I513-S536 PolarHBondContact O-N 2.85Å; I513-S536 VanDerWaalsContact O-N 3.1Å; S536-F548 PolarHBondContact OG-O 2.92Å
537	V	96.3	Very high	88.5	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	136.2	170.4	-176.3	0	0	0	0	109.8	L506 L509 F548 V550 M553	L506-V537 HydrophobicContact CB-CG2 4.19Å; L506-V537 HydrophobicContact CD2-CG2 4.03Å; L509-V537 HydrophobicContact CB-CG1 4.41Å; V537-F548 HydrophobicContact CB-CB 4.26Å; V537-F548 HydrophobicContact CB-CD2 4.01Å; V537-F548 HydrophobicContact CG1-CD2 3.81Å; V537-F548 HydrophobicContact CG1-CE2 4.32Å; V537-F548 PolarHBondContact O-N 3.49Å; V537-V550 HydrophobicContact CB-CG2 4.42Å; V537-V550 HydrophobicContact CG2-CG2 4.2Å; V537-M553 HydrophobicContact CG2-CE 3.69Å
538	Y	95	Very high	88.7	Confident	9 Å²	9	43.1 Å²	43.1	4%	0.035	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145	177.3	168.7	-80.7	0	0	0	110	Q511 I513 F518 K520 E545 I546 M547	Q511-Y538 PolarHBondContact N-O 3.21Å; Q511-Y538 PolarHBondContact O-N 2.88Å; I513-Y538 VanDerWaalsContact CD1-CB 3.48Å; I513-Y538 HydrophobicContact CD1-CG 4.2Å; F518-Y538 AromaticContact CE1-CD2 3.92Å; F518-Y538 HydrophobicContact CE1-CD2 3.92Å; F518-Y538 HydrophobicContact CE1-CE2 4.14Å; F518-Y538 HydrophobicContact CE1-CG 4.45Å; F518-Y538 HydrophobicContact CZ-CD1 4.19Å; F518-Y538 AromaticContact CZ-CD2 3.7Å; F518-Y538 HydrophobicContact CZ-CD2 3.7Å; F518-Y538 HydrophobicContact CZ-CE1 4.43Å; F518-Y538 AromaticContact CZ-CE2 3.91Å; F518-Y538 HydrophobicContact CZ-CE2 3.91Å; F518-Y538 AromaticContact CZ-CG 3.85Å; F518-Y538 HydrophobicContact CZ-CG 3.85Å; K520-Y538 HydrophobicContact CB-CE2 4.2Å; K520-Y538 HydrophobicContact CD-CE1 4.05Å; K520-Y538 HydrophobicContact CD-CE2 4.49Å; K520-Y538 WeakPolarHBondContact CD-OH 3.22Å; Y538-E545 HydrophobicContact CE2-CB 4.03Å; Y538-E545 WeakPolarHBondContact OH-CG 3.49Å; Y538-E545 PolarHBondContact OH-OE1 2.67Å; Y538-I546 WeakPolarHBondContact CA-O 3.45Å; Y538-M547 HydrophobicContact CD2-CE 4.4Å
539	T	91.1	Very high	88.9	Confident	8 Å²	8	35.7 Å²	35.7	5%	0.049	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	153.5	168.5	-171.5	0	0	0	0	111.1	I546 F548 R645 L649	T539-I546 HydrophobicContact CG2-CB 3.84Å; T539-I546 HydrophobicContact CG2-CD1 4.12Å; T539-I546 HydrophobicContact CG2-CG1 4.32Å; T539-I546 PolarHBondContact N-O 3.3Å; T539-I546 PolarHBondContact O-N 3.49Å; T539-F548 HydrophobicContact CG2-CE2 4.03Å; T539-R645 PolarHBondContact OG1-NH2 3.36Å; T539-R645 VanDerWaalsContact OG1-NH2 3.09Å; T539-L649 HydrophobicContact CG2-CD1 4.04Å; T539-L649 HydrophobicContact CG2-CD2 3.91Å
540	S	85.7	Confident	89.2	Confident	76 Å²	76	33.2 Å²	33.2	53%	0.531	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	114.7	169.7	58.2	0	0	0	0	109.4	Y544	S540-Y544 CarbonylContact C-O 3.57Å; S540-Y544 VanDerWaalsContact CA-O 3.22Å; S540-Y544 WeakPolarHBondContact CA-O 3.33Å
541	Y	73.3	Confident	89.4	Confident	24 Å²	24	31.8 Å²	31.8	9%	0.094	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	122.3	-174.3	-174.1	-109.7	0	0	0	109.5	Q543 Y544 E646 T650 H667	Y541-Q543 VanDerWaalsContact C-N 3.3Å; Y541-Q543 PolarHBondContact O-N 2.81Å; Y541-Q543 VanDerWaalsContact O-N 3.17Å; Y541-Y544 PolarHBondContact N-O 3.44Å; Y541-Y544 WeakPolarHBondContact O-CA 3.47Å; Y541-Y544 VanDerWaalsContact O-CB 3.25Å; Y541-Y544 WeakPolarHBondContact O-CB 2.95Å; Y541-Y544 WeakPolarHBondContact O-CD2 3.09Å; Y541-Y544 PolarHBondContact O-N 2.84Å; Y541-E646 HydrophobicContact CE2-CG 4.29Å; Y541-T650 HydrophobicContact CE1-CG2 4.02Å; Y541-T650 WeakPolarHBondContact CE1-OG1 3.43Å; Y541-H667 AromaticContact CD1-CE1 3.54Å; Y541-H667 AromaticContact CE1-CE1 3.19Å; Y541-H667 WeakPolarHBondContact CE1-CE1 3.46Å; Y541-H667 AromaticContact CE1-ND1 3.78Å
542	Q	67.9	Low	89.6	Confident	59 Å²	59	28.7 Å²	28.7	28%	0.276	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.6	42.8	179.6	-51.9	-158.8	23.8	0	0	115.7	L309 Y544 H667	L309-Q542 VanDerWaalsContact CD1-NE2 3.31Å; Q542-Y544 HydrophobicContact CB-CD2 4.3Å; Q542-Y544 WeakPolarHBondContact O-CD2 3.4Å; Q542-Y544 PolarHBondContact O-N 2.88Å; Q542-H667 WeakPolarHBondContact CB-CE1 3.07Å; Q542-H667 VanDerWaalsContact CD-NE2 3.28Å; Q542-H667 WeakPolarHBondContact CG-CE1 3.38Å; Q542-H667 PolarHBondContact NE2-CE1 2.58Å; Q542-H667 PolarHBondContact NE2-NE2 2.91Å; Q542-H667 PolarHBondContact OE1-CE1 3.09Å; Q542-H667 PolarHBondContact OE1-NE2 3.26Å
543	Q	69.2	Low	89.7	Confident	180 Å²	180	28.9 Å²	28.9	84%	0.841	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.4	-10.6	-173.4	-45.7	-178.9	20.6	0	0	115.8	Y541	Y541-Q543 VanDerWaalsContact C-N 3.3Å; Y541-Q543 PolarHBondContact O-N 2.81Å; Y541-Q543 VanDerWaalsContact O-N 3.17Å
544	Y	75.9	Confident	89.8	Confident	37 Å²	37	28.7 Å²	28.7	15%	0.145	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	141	169.6	-60.3	-94.1	0	0	0	111	I311 Y472 T473 Y475 S540 Y541 Q542 I670	I311-Y544 HydrophobicContact CD1-CD2 4.45Å; I311-Y544 HydrophobicContact CD1-CE2 3.48Å; I311-Y544 VanDerWaalsContact CD1-CE2 3.48Å; Y472-Y544 VanDerWaalsContact O-CE1 3.27Å; Y472-Y544 WeakPolarHBondContact O-CE1 3.48Å; T473-Y544 CarbonylContact O-C 3.55Å; T473-Y544 WeakPolarHBondContact O-CA 3.34Å; Y475-Y544 HydrophobicContact CD2-CD1 4.18Å; Y475-Y544 AromaticContact CE2-CD1 3.59Å; Y475-Y544 HydrophobicContact CE2-CD1 3.59Å; Y475-Y544 HydrophobicContact CE2-CE1 4.03Å; S540-Y544 CarbonylContact C-O 3.57Å; S540-Y544 VanDerWaalsContact CA-O 3.22Å; S540-Y544 WeakPolarHBondContact CA-O 3.33Å; Y541-Y544 PolarHBondContact N-O 3.44Å; Y541-Y544 WeakPolarHBondContact O-CA 3.47Å; Y541-Y544 VanDerWaalsContact O-CB 3.25Å; Y541-Y544 WeakPolarHBondContact O-CB 2.95Å; Y541-Y544 WeakPolarHBondContact O-CD2 3.09Å; Y541-Y544 PolarHBondContact O-N 2.84Å; Q542-Y544 HydrophobicContact CB-CD2 4.3Å; Q542-Y544 WeakPolarHBondContact O-CD2 3.4Å; Q542-Y544 PolarHBondContact O-N 2.88Å; Y544-I670 HydrophobicContact CD1-CD1 4.27Å; Y544-I670 HydrophobicContact CD2-CD1 4.32Å; Y544-I670 HydrophobicContact CG-CD1 3.99Å
545	E	85.5	Confident	89.7	Confident	34 Å²	34	27.8 Å²	27.8	16%	0.159	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	121.2	173.3	-53.5	180	64.1	0	0	109.4	T473 R474 Y475 K520 Y521 Y538	T473-E545 PolarHBondContact O-N 3.39Å; R474-E545 VanDerWaalsContact CA-O 3.31Å; R474-E545 WeakPolarHBondContact CA-O 3.13Å; R474-E545 HydrophobicContact CG-CB 4.24Å; R474-E545 IonicContact CZ-OE2 2.69Å; R474-E545 IonicContact NE-OE2 3.93Å; R474-E545 PolarHBondContact NE-OE2 2.98Å; R474-E545 IonicContact NH2-OE1 3.43Å; R474-E545 IonicContact NH2-OE2 3.27Å; R474-E545 PolarHBondContact NH2-OE2 3.48Å; Y475-E545 PolarHBondContact N-O 3.34Å; K520-E545 WeakPolarHBondContact CB-OE1 3.36Å; Y521-E545 VanDerWaalsContact CB-OE1 3.3Å; Y521-E545 WeakPolarHBondContact CB-OE1 3.17Å; Y521-E545 PolarHBondContact N-OE1 3.48Å; Y538-E545 HydrophobicContact CE2-CB 4.03Å; Y538-E545 WeakPolarHBondContact OH-CG 3.49Å; Y538-E545 PolarHBondContact OH-OE1 2.67Å
546	I	89.5	Confident	89.6	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.005	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	120	-178.8	-51.7	175.3	0	0	0	108.5	Y475 V477 Y538 T539 F548 L649 I670	Y475-I546 WeakPolarHBondContact O-CA 3.42Å; V477-I546 HydrophobicContact CG2-CG2 4.09Å; Y538-I546 WeakPolarHBondContact CA-O 3.45Å; T539-I546 HydrophobicContact CG2-CB 3.84Å; T539-I546 HydrophobicContact CG2-CD1 4.12Å; T539-I546 HydrophobicContact CG2-CG1 4.32Å; T539-I546 PolarHBondContact N-O 3.3Å; T539-I546 PolarHBondContact O-N 3.49Å; I546-F548 HydrophobicContact CG2-CE1 4.21Å; I546-F548 HydrophobicContact CG2-CE2 4.05Å; I546-F548 HydrophobicContact CG2-CZ 3.85Å; I546-L649 HydrophobicContact CD1-CD2 4.09Å; I546-I670 HydrophobicContact CD1-CD1 4.4Å
547	M	93.6	Very high	89.3	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	131.3	169.7	178.2	61.2	79.8	0	0	109.1	Y475 K476 V477 I513 L515 F518 Y521 L525 Y538	Y475-M547 PolarHBondContact O-N 3.41Å; K476-M547 WeakPolarHBondContact CA-O 3.48Å; V477-M547 PolarHBondContact N-O 2.68Å; I513-M547 HydrophobicContact CD1-CE 3.98Å; L515-M547 HydrophobicContact CD2-CE 4.22Å; F518-M547 HydrophobicContact CD1-CE 4.45Å; F518-M547 HydrophobicContact CE1-CE 4.11Å; Y521-M547 HydrophobicContact CD1-CB 4.09Å; Y521-M547 HydrophobicContact CE1-CB 4.15Å; Y521-M547 WeakPolarHBondContact O-CE 3.12Å; L525-M547 HydrophobicContact CD1-CE 4.28Å; L525-M547 HydrophobicContact CD1-CG 4.13Å; L525-M547 HydrophobicContact CD1-SD 3.87Å; Y538-M547 HydrophobicContact CD2-CE 4.4Å
548	F	95.9	Very high	88.9	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	142.4	171.1	-63.7	-80.9	0	0	0	110.8	V477 V479 L509 S536 V537 T539 I546 V550 I577 L649 L669	V477-F548 HydrophobicContact CB-CD1 3.76Å; V477-F548 HydrophobicContact CB-CE1 3.92Å; V477-F548 HydrophobicContact CG1-CD1 3.91Å; V477-F548 HydrophobicContact CG1-CE1 3.91Å; V477-F548 HydrophobicContact CG2-CE1 4.49Å; V477-F548 CarbonylContact O-C 3.56Å; V477-F548 VanDerWaalsContact O-CA 3.31Å; V477-F548 WeakPolarHBondContact O-CA 3.42Å; V479-F548 HydrophobicContact CG2-CB 4.03Å; V479-F548 HydrophobicContact CG2-CD1 3.62Å; V479-F548 HydrophobicContact CG2-CG 4.19Å; L509-F548 HydrophobicContact CB-CE2 4.02Å; L509-F548 HydrophobicContact CB-CZ 4.06Å; L509-F548 HydrophobicContact CD1-CD1 4.28Å; L509-F548 HydrophobicContact CD1-CE1 4.1Å; L509-F548 HydrophobicContact CD1-CZ 4.31Å; L509-F548 HydrophobicContact CD2-CE1 4.4Å; L509-F548 HydrophobicContact CD2-CZ 4.22Å; L509-F548 HydrophobicContact CG-CZ 4.44Å; S536-F548 PolarHBondContact OG-O 2.92Å; V537-F548 HydrophobicContact CB-CB 4.26Å; V537-F548 HydrophobicContact CB-CD2 4.01Å; V537-F548 HydrophobicContact CG1-CD2 3.81Å; V537-F548 HydrophobicContact CG1-CE2 4.32Å; V537-F548 PolarHBondContact O-N 3.49Å; T539-F548 HydrophobicContact CG2-CE2 4.03Å; I546-F548 HydrophobicContact CG2-CE1 4.21Å; I546-F548 HydrophobicContact CG2-CE2 4.05Å; I546-F548 HydrophobicContact CG2-CZ 3.85Å; F548-V550 HydrophobicContact CB-CG2 3.93Å; F548-I577 HydrophobicContact CE1-CD1 4.14Å; F548-L649 HydrophobicContact CZ-CD2 3.92Å; F548-L669 HydrophobicContact CE1-CD1 4.05Å; F548-L669 HydrophobicContact CZ-CD1 4.32Å
549	H	97	Very high	88.7	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.009	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	86.2	169.3	-65.7	148.8	0	0	0	108.3	V477 V479 G523 L554 H569 I570 D573	V477-H549 PolarHBondContact O-N 3.11Å; V479-H549 PolarHBondContact N-O 2.87Å; G523-H549 PolarHBondContact O-CE1 3.11Å; G523-H549 PolarHBondContact O-NE2 3.41Å; H549-L554 HydrophobicContact CB-CD1 4.46Å; H549-H569 HydrophobicContact CB-CB 4.34Å; H549-I570 HydrophobicContact CB-CG1 3.87Å; H549-I570 VanDerWaalsContact O-CD1 3.29Å; H549-I570 WeakPolarHBondContact O-CD1 3.34Å; H549-I570 VanDerWaalsContact O-CG1 3.31Å; H549-I570 WeakPolarHBondContact O-CG1 3.4Å; H549-D573 IonicContact CE1-OD1 3.3Å; H549-D573 PolarHBondContact CE1-OD1 2.91Å; H549-D573 IonicContact CE1-OD2 3.79Å; H549-D573 IonicContact CG-OD2 3.8Å; H549-D573 VanDerWaalsContact ND1-CG 3.3Å; H549-D573 IonicContact ND1-OD1 3.44Å; H549-D573 PolarHBondContact ND1-OD1 3.36Å; H549-D573 VanDerWaalsContact ND1-OD1 3.08Å; H549-D573 IonicContact ND1-OD2 2.67Å; H549-D573 PolarHBondContact ND1-OD2 3.32Å
550	V	97.1	Very high	88.6	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.5	-173	-174.8	0	0	0	0	110.7	V479 F502 L506 V537 F548 T552 M553 L554	V479-V550 HydrophobicContact CB-CG2 4.31Å; V479-V550 HydrophobicContact CG2-CG2 4.41Å; F502-V550 HydrophobicContact CE1-CG1 3.91Å; F502-V550 HydrophobicContact CZ-CG1 3.88Å; L506-V550 HydrophobicContact CD1-CG1 4.08Å; L506-V550 HydrophobicContact CD2-CB 4.5Å; L506-V550 HydrophobicContact CD2-CG1 3.82Å; L506-V550 HydrophobicContact CD2-CG2 3.8Å; V537-V550 HydrophobicContact CB-CG2 4.42Å; V537-V550 HydrophobicContact CG2-CG2 4.2Å; F548-V550 HydrophobicContact CB-CG2 3.93Å; V550-T552 VanDerWaalsContact C-N 3.31Å; V550-T552 PolarHBondContact O-N 3.4Å; V550-M553 HydrophobicContact CB-CB 4.27Å; V550-M553 HydrophobicContact CB-CE 4.33Å; V550-M553 HydrophobicContact CB-CG 4.03Å; V550-M553 HydrophobicContact CG1-CE 4.12Å; V550-M553 HydrophobicContact CG1-CG 4.04Å; V550-M553 HydrophobicContact CG2-CE 4.33Å; V550-M553 PolarHBondContact O-N 3.25Å; V550-L554 PolarHBondContact O-N 2.88Å; V550-L554 VanDerWaalsContact O-N 3.14Å
551	S	96.1	Very high	88.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-38.9	-170.9	70.8	0	0	0	0	113.8	V479 M553 R566	V479-S551 PolarHBondContact O-N 2.9Å; S551-M553 VanDerWaalsContact C-N 3.34Å; S551-M553 PolarHBondContact O-N 3.23Å; S551-R566 PolarHBondContact O-NE 3.14Å; S551-R566 VanDerWaalsContact O-NE 3.17Å; S551-R566 PolarHBondContact O-NH1 2.86Å; S551-R566 PolarHBondContact O-NH2 2.98Å; S551-R566 VanDerWaalsContact O-NH2 3.07Å
552	T	95.9	Very high	89.4	Confident	19 Å²	19	50.5 Å²	50.5	12%	0.117	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-18.1	179	61.4	0	0	0	0	114	L481 S498 F502 V550	L481-T552 HydrophobicContact CB-CG2 4.48Å; L481-T552 HydrophobicContact CD2-CG2 4.08Å; S498-T552 PolarHBondContact OG-OG1 3.34Å; F502-T552 HydrophobicContact CD1-CG2 4.44Å; F502-T552 HydrophobicContact CE1-CG2 4.02Å; V550-T552 VanDerWaalsContact C-N 3.31Å; V550-T552 PolarHBondContact O-N 3.4Å
553	M	95.8	Very high	90.6	Very high	22 Å²	22	47.8 Å²	47.8	11%	0.108	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-20.7	176.6	-54.6	-160.7	-153.9	0	0	113.1	L506 R512 H535 V537 V550 S551	L506-M553 HydrophobicContact CD1-CE 3.76Å; R512-M553 VanDerWaalsContact CZ-CE 3.46Å; R512-M553 VanDerWaalsContact NH2-CE 3.3Å; H535-M553 HydrophobicContact CB-SD 4.43Å; V537-M553 HydrophobicContact CG2-CE 3.69Å; V550-M553 HydrophobicContact CB-CB 4.27Å; V550-M553 HydrophobicContact CB-CE 4.33Å; V550-M553 HydrophobicContact CB-CG 4.03Å; V550-M553 HydrophobicContact CG1-CE 4.12Å; V550-M553 HydrophobicContact CG1-CG 4.04Å; V550-M553 HydrophobicContact CG2-CE 4.33Å; V550-M553 PolarHBondContact O-N 3.25Å; S551-M553 VanDerWaalsContact C-N 3.34Å; S551-M553 PolarHBondContact O-N 3.23Å
554	L	96.1	Very high	91.6	Very high	6 Å²	6	43.5 Å²	43.5	3%	0.031	23%	0.228	C	C	.	.	S	Bend	trans	-73.1	150.5	171.5	-67.4	174.2	0	0	0	111	L525 H549 V550 F556 R566 H569 I570	L525-L554 HydrophobicContact CD2-CD2 3.78Å; H549-L554 HydrophobicContact CB-CD1 4.46Å; V550-L554 PolarHBondContact O-N 2.88Å; V550-L554 VanDerWaalsContact O-N 3.14Å; L554-F556 PolarHBondContact O-N 3.09Å; L554-R566 HydrophobicContact CB-CG 3.94Å; L554-R566 HydrophobicContact CD1-CB 4.42Å; L554-R566 PolarHBondContact O-NE 3.27Å; L554-R566 PolarHBondContact O-NH2 3.08Å; L554-H569 HydrophobicContact CD1-CB 4.07Å; L554-I570 HydrophobicContact CD1-CD1 4.02Å; L554-I570 HydrophobicContact CD1-CG1 4.07Å
555	P	93.2	Very high	92.3	Very high	43 Å²	43	43.7 Å²	43.7	28%	0.279	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-55.4	138.2	-177.5	-24.2	33.5	0	0	0	112.4	S531 R566	S531-P555 WeakPolarHBondContact O-CG 3.31Å; P555-R566 VanDerWaalsContact O-CG 3.26Å; P555-R566 WeakPolarHBondContact O-CG 3.28Å; P555-R566 PolarHBondContact O-NE 2.95Å
556	F	93.4	Very high	92.7	Very high	51 Å²	51	42.2 Å²	42.2	22%	0.224	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-92.6	146.8	168.3	-176.8	-116	0	0	0	109.6	N494 E496 L554 P558 Q563	N494-F556 HydrophobicContact CB-CE2 4.23Å; E496-F556 HydrophobicContact CG-CD1 3.6Å; E496-F556 HydrophobicContact CG-CD2 3.83Å; E496-F556 HydrophobicContact CG-CE1 3.5Å; E496-F556 VanDerWaalsContact CG-CE1 3.5Å; E496-F556 HydrophobicContact CG-CE2 3.72Å; E496-F556 HydrophobicContact CG-CG 3.77Å; E496-F556 HydrophobicContact CG-CZ 3.56Å; E496-F556 VanDerWaalsContact OE1-CE1 3.25Å; E496-F556 WeakPolarHBondContact OE1-CE1 3.31Å; E496-F556 VanDerWaalsContact OE2-CD1 3.28Å; E496-F556 WeakPolarHBondContact OE2-CD1 3.34Å; E496-F556 WeakPolarHBondContact OE2-CE1 3.35Å; L554-F556 PolarHBondContact O-N 3.09Å; F556-P558 HydrophobicContact CD1-CG 3.79Å; F556-P558 HydrophobicContact CE1-CB 3.89Å; F556-P558 HydrophobicContact CE1-CG 3.6Å; F556-Q563 HydrophobicContact CD2-CG 4.47Å; F556-Q563 HydrophobicContact CE2-CG 4.44Å
557	T	91.7	Very high	92.9	Very high	48 Å²	48	44.3 Å²	44.3	29%	0.294	24%	0.239	S	C	.	.			trans	-132.4	98.2	174.6	-60.9	0	0	0	0	108.6	S559 N560 Q563	T557-S559 PolarHBondContact O-N 3.49Å; T557-S559 VanDerWaalsContact O-N 3.13Å; T557-N560 HydrophobicContact CG2-CB 3.74Å; T557-N560 PolarHBondContact O-N 2.86Å; T557-Q563 PolarHBondContact O-NE2 2.87Å
558	P	88.7	Confident	92.8	Very high	102 Å²	102	53.1 Å²	53.1	66%	0.662	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-32	-172.5	-23.4	28.9	0	0	0	114.2	F556 N560	F556-P558 HydrophobicContact CD1-CG 3.79Å; F556-P558 HydrophobicContact CE1-CB 3.89Å; F556-P558 HydrophobicContact CE1-CG 3.6Å; P558-N560 VanDerWaalsContact C-N 3.28Å; P558-N560 PolarHBondContact O-N 3.4Å
559	S	89.1	Confident	92.8	Very high	115 Å²	115	54.6 Å²	54.6	80%	0.804	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-8.4	178.4	53	0	0	0	0	114.6	T557	T557-S559 PolarHBondContact O-N 3.49Å; T557-S559 VanDerWaalsContact O-N 3.13Å
560	N	89.9	Confident	92.6	Very high	42 Å²	42	54.5 Å²	54.5	23%	0.225	28%	0.279	C	S	.	.			trans	-119.1	87.3	-176.4	-175.7	-10.5	0	0	0	110.5	T557 P558 Q562 Q563 L564	T557-N560 HydrophobicContact CG2-CB 3.74Å; T557-N560 PolarHBondContact O-N 2.86Å; P558-N560 VanDerWaalsContact C-N 3.28Å; P558-N560 PolarHBondContact O-N 3.4Å; N560-Q562 PolarHBondContact O-N 3.25Å; N560-Q562 VanDerWaalsContact O-N 3.09Å; N560-Q562 PolarHBondContact OD1-N 2.99Å; N560-Q563 WeakPolarHBondContact O-CA 3.14Å; N560-Q563 VanDerWaalsContact O-CD 3.24Å; N560-Q563 PolarHBondContact O-N 3.46Å; N560-Q563 PolarHBondContact O-NE2 2.93Å; N560-Q563 PolarHBondContact OD1-N 3.42Å; N560-L564 PolarHBondContact ND2-N 3.42Å
561	R	88.5	Confident	92.3	Very high	171 Å²	171	54.7 Å²	54.7	65%	0.645	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-30.1	179.2	-69.5	-178.7	62.7	160.4	-2.1	113.9	E490 N494 Q563	E490-R561 WeakPolarHBondContact CG-O 3.23Å; E490-R561 IonicContact OE1-CZ 2.74Å; E490-R561 IonicContact OE1-NE 3.27Å; E490-R561 PolarHBondContact OE1-NE 2.97Å; E490-R561 IonicContact OE1-NH2 3.27Å; E490-R561 PolarHBondContact OE1-NH2 3.01Å; E490-R561 IonicContact OE2-NH2 3.18Å; N494-R561 PolarHBondContact ND2-O 3.2Å; R561-Q563 VanDerWaalsContact C-N 3.27Å; R561-Q563 PolarHBondContact O-N 3.06Å
562	Q	88	Confident	92.1	Very high	129 Å²	129	57.9 Å²	57.9	60%	0.603	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-6.1	176.6	-65.1	-177.2	-5.9	0	0	113.9	N560 L564	N560-Q562 PolarHBondContact O-N 3.25Å; N560-Q562 VanDerWaalsContact O-N 3.09Å; N560-Q562 PolarHBondContact OD1-N 2.99Å; Q562-L564 VanDerWaalsContact C-N 3.27Å; Q562-L564 HydrophobicContact CB-CD2 3.97Å; Q562-L564 HydrophobicContact CB-CG 4.19Å; Q562-L564 PolarHBondContact O-N 3.34Å
563	Q	93.2	Very high	91.9	Very high	1 Å²	1	57 Å²	57	1%	0.005	29%	0.292	C	S	.	.			trans	43.4	50.3	-178.5	-61.8	-59.7	-27.6	0	0	113.1	N494 F556 T557 N560 R561 A565 R566 K567	N494-Q563 WeakPolarHBondContact OD1-CG 3.4Å; N494-Q563 PolarHBondContact OD1-NE2 2.92Å; F556-Q563 HydrophobicContact CD2-CG 4.47Å; F556-Q563 HydrophobicContact CE2-CG 4.44Å; T557-Q563 PolarHBondContact O-NE2 2.87Å; N560-Q563 WeakPolarHBondContact O-CA 3.14Å; N560-Q563 VanDerWaalsContact O-CD 3.24Å; N560-Q563 PolarHBondContact O-N 3.46Å; N560-Q563 PolarHBondContact O-NE2 2.93Å; N560-Q563 PolarHBondContact OD1-N 3.42Å; R561-Q563 VanDerWaalsContact C-N 3.27Å; R561-Q563 PolarHBondContact O-N 3.06Å; Q563-A565 PolarHBondContact O-N 3.28Å; Q563-R566 HydrophobicContact CB-CB 4.2Å; Q563-R566 HydrophobicContact CB-CG 4.23Å; Q563-R566 WeakPolarHBondContact O-CA 3.4Å; Q563-R566 WeakPolarHBondContact O-CB 3.36Å; Q563-R566 PolarHBondContact O-N 3.43Å; Q563-K567 PolarHBondContact O-N 3.36Å
564	L	90	Very high	91.5	Very high	91 Å²	91	56.5 Å²	56.5	48%	0.476	29%	0.29	S	S	.	.	H	α-helix	trans	-54.8	-28.5	-172.4	-63.7	175.9	0	0	0	113.6	N560 Q562 R568	N560-L564 PolarHBondContact ND2-N 3.42Å; Q562-L564 VanDerWaalsContact C-N 3.27Å; Q562-L564 HydrophobicContact CB-CD2 3.97Å; Q562-L564 HydrophobicContact CB-CG 4.19Å; Q562-L564 PolarHBondContact O-N 3.34Å; L564-R568 WeakPolarHBondContact O-CB 3.34Å; L564-R568 PolarHBondContact O-N 3.23Å
565	A	89.3	Confident	91.3	Very high	40 Å²	40	56.2 Å²	56.2	33%	0.331	29%	0.288	S	S	.	.	H	α-helix	trans	-62	-44.8	172.1	0	0	0	0	0	112.2	Q563 H569	Q563-A565 PolarHBondContact O-N 3.28Å; A565-H569 PolarHBondContact O-CD2 3.02Å
566	R	95	Very high	91.3	Very high	3 Å²	3	54.1 Å²	54.1	1%	0.011	28%	0.275	C	S	.	.	H	α-helix	trans	-70.4	-48	176.8	-58.3	-176.8	163.5	-164.7	-17.7	111.1	Y493 N495 S551 L554 P555 Q563 R568 H569 I570	Y493-R566 HydrophobicContact CD1-CB 3.69Å; Y493-R566 HydrophobicContact CE1-CB 4.03Å; Y493-R566 WeakPolarHBondContact O-CD 3.33Å; Y493-R566 PolarHBondContact O-NH1 2.84Å; N495-R566 PolarHBondContact O-NH1 3.21Å; S551-R566 PolarHBondContact O-NE 3.14Å; S551-R566 VanDerWaalsContact O-NE 3.17Å; S551-R566 PolarHBondContact O-NH1 2.86Å; S551-R566 PolarHBondContact O-NH2 2.98Å; S551-R566 VanDerWaalsContact O-NH2 3.07Å; L554-R566 HydrophobicContact CB-CG 3.94Å; L554-R566 HydrophobicContact CD1-CB 4.42Å; L554-R566 PolarHBondContact O-NE 3.27Å; L554-R566 PolarHBondContact O-NH2 3.08Å; P555-R566 VanDerWaalsContact O-CG 3.26Å; P555-R566 WeakPolarHBondContact O-CG 3.28Å; P555-R566 PolarHBondContact O-NE 2.95Å; Q563-R566 HydrophobicContact CB-CB 4.2Å; Q563-R566 HydrophobicContact CB-CG 4.23Å; Q563-R566 WeakPolarHBondContact O-CA 3.4Å; Q563-R566 WeakPolarHBondContact O-CB 3.36Å; Q563-R566 PolarHBondContact O-N 3.43Å; R566-R568 VanDerWaalsContact C-N 3.27Å; R566-R568 PolarHBondContact O-N 2.85Å; R566-H569 PolarHBondContact O-N 3.19Å; R566-H569 VanDerWaalsContact O-N 3.1Å; R566-I570 PolarHBondContact O-N 3.08Å; R566-I570 VanDerWaalsContact O-N 3.13Å
567	K	92.5	Very high	91.3	Very high	45 Å²	45	51.7 Å²	51.7	20%	0.196	26%	0.264	C	S	.	.	H	α-helix	trans	-64.9	-26.4	179.5	-176.6	160.2	174.3	160	0	113.2	E489 Y493 Q563 H569 G571 R593	E489-K567 WeakPolarHBondContact OE1-CE 3.47Å; E489-K567 IonicContact OE1-NZ 2.7Å; E489-K567 PolarHBondContact OE1-NZ 3.43Å; E489-K567 IonicContact OE2-NZ 3.45Å; E489-K567 PolarHBondContact OE2-NZ 2.93Å; Y493-K567 HydrophobicContact CE1-CB 4Å; Y493-K567 HydrophobicContact CE2-CB 4.22Å; Y493-K567 HydrophobicContact CE2-CD 4.14Å; Y493-K567 HydrophobicContact CE2-CG 4.27Å; Q563-K567 PolarHBondContact O-N 3.36Å; K567-H569 VanDerWaalsContact C-N 3.28Å; K567-H569 PolarHBondContact O-N 2.84Å; K567-G571 WeakPolarHBondContact O-CA 3.35Å; K567-G571 PolarHBondContact O-N 3.44Å; K567-R593 WeakPolarHBondContact CE-O 3.48Å; K567-R593 PolarHBondContact NZ-O 3.46Å
568	R	93.3	Very high	91.5	Very high	186 Å²	186	49.4 Å²	49.4	70%	0.702	25%	0.25	S	S	*	.	H	α-helix	trans	-64.1	-27.1	172	175.1	174.8	175.3	171.4	-1.5	113.8	L564 R566 N572	L564-R568 WeakPolarHBondContact O-CB 3.34Å; L564-R568 PolarHBondContact O-N 3.23Å; R566-R568 VanDerWaalsContact C-N 3.27Å; R566-R568 PolarHBondContact O-N 2.85Å; R568-N572 PolarHBondContact O-ND2 3.01Å
569	H	94.1	Very high	91.8	Very high	30 Å²	30	44.6 Å²	44.6	14%	0.139	22%	0.219	C	C	.	.	H	α-helix	trans	-90.7	-67.3	173.7	-68.9	-82.3	0	0	0	110	H549 L554 A565 R566 K567 G571 N572 D573	H549-H569 HydrophobicContact CB-CB 4.34Å; L554-H569 HydrophobicContact CD1-CB 4.07Å; A565-H569 PolarHBondContact O-CD2 3.02Å; R566-H569 PolarHBondContact O-N 3.19Å; R566-H569 VanDerWaalsContact O-N 3.1Å; K567-H569 VanDerWaalsContact C-N 3.28Å; K567-H569 PolarHBondContact O-N 2.84Å; H569-G571 PolarHBondContact O-N 3.28Å; H569-N572 PolarHBondContact O-N 3.28Å; H569-D573 PolarHBondContact O-N 3.21Å
570	I	94.3	Very high	92.1	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.8	-43.9	-173.2	-63.5	174.8	0	0	0	112.2	L480 Y493 H549 L554 R566 N572 D573 T576	L480-I570 HydrophobicContact CD1-CG2 4.02Å; L480-I570 HydrophobicContact CD2-CD1 4.2Å; L480-I570 HydrophobicContact CG-CD1 4.34Å; L480-I570 HydrophobicContact CG-CG2 4.11Å; Y493-I570 HydrophobicContact CE1-CB 4.03Å; Y493-I570 HydrophobicContact CE1-CD1 4.09Å; Y493-I570 HydrophobicContact CE1-CG2 4.28Å; Y493-I570 WeakPolarHBondContact OH-CG2 3.45Å; H549-I570 HydrophobicContact CB-CG1 3.87Å; H549-I570 VanDerWaalsContact O-CD1 3.29Å; H549-I570 WeakPolarHBondContact O-CD1 3.34Å; H549-I570 VanDerWaalsContact O-CG1 3.31Å; H549-I570 WeakPolarHBondContact O-CG1 3.4Å; L554-I570 HydrophobicContact CD1-CD1 4.02Å; L554-I570 HydrophobicContact CD1-CG1 4.07Å; R566-I570 PolarHBondContact O-N 3.08Å; R566-I570 VanDerWaalsContact O-N 3.13Å; I570-N572 PolarHBondContact O-N 3.18Å; I570-N572 VanDerWaalsContact O-N 3.13Å; I570-D573 WeakPolarHBondContact CA-OD2 3.42Å; I570-D573 WeakPolarHBondContact O-CB 3.44Å; I570-D573 PolarHBondContact O-N 3.29Å; I570-T576 HydrophobicContact CG2-CG2 4.1Å
571	G	91	Very high	92.3	Very high	4 Å²	4	38.3 Å²	38.3	4%	0.041	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-8.5	179.2	0	0	0	0	0	114.6	Y493 K567 H569 S594	Y493-G571 PolarHBondContact OH-N 3.14Å; K567-G571 WeakPolarHBondContact O-CA 3.35Å; K567-G571 PolarHBondContact O-N 3.44Å; H569-G571 PolarHBondContact O-N 3.28Å; G571-S594 PolarHBondContact O-OG 2.74Å
572	N	92	Very high	92.4	Very high	67 Å²	67	33.4 Å²	33.4	36%	0.358	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	4.9	174.1	-73.4	-40.6	0	0	0	112.7	K476 R568 H569 I570 F596	K476-N572 PolarHBondContact NZ-O 3.31Å; R568-N572 PolarHBondContact O-ND2 3.01Å; H569-N572 PolarHBondContact O-N 3.28Å; I570-N572 PolarHBondContact O-N 3.18Å; I570-N572 VanDerWaalsContact O-N 3.13Å; N572-F596 WeakPolarHBondContact OD1-CD2 3.36Å; N572-F596 VanDerWaalsContact OD1-CE2 3.29Å; N572-F596 WeakPolarHBondContact OD1-CE2 3.4Å
573	D	90.9	Very high	92.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.164	C	C	.	.			trans	-85	149.6	171.1	-61.1	-33.2	0	0	0	110.3	K476 G478 H549 H569 I570 F596 Q597	K476-D573 WeakPolarHBondContact CG-OD1 3.22Å; K476-D573 IonicContact NZ-OD1 2.72Å; K476-D573 PolarHBondContact NZ-OD1 2.88Å; G478-D573 WeakPolarHBondContact CA-OD2 3.2Å; G478-D573 PolarHBondContact N-OD2 2.95Å; H549-D573 IonicContact CE1-OD1 3.3Å; H549-D573 PolarHBondContact CE1-OD1 2.91Å; H549-D573 IonicContact CE1-OD2 3.79Å; H549-D573 IonicContact CG-OD2 3.8Å; H549-D573 VanDerWaalsContact ND1-CG 3.3Å; H549-D573 IonicContact ND1-OD1 3.44Å; H549-D573 PolarHBondContact ND1-OD1 3.36Å; H549-D573 VanDerWaalsContact ND1-OD1 3.08Å; H549-D573 IonicContact ND1-OD2 2.67Å; H549-D573 PolarHBondContact ND1-OD2 3.32Å; H569-D573 PolarHBondContact O-N 3.21Å; I570-D573 WeakPolarHBondContact CA-OD2 3.42Å; I570-D573 WeakPolarHBondContact O-CB 3.44Å; I570-D573 PolarHBondContact O-N 3.29Å; D573-F596 CarbonylContact O-C 3.6Å; D573-Q597 WeakPolarHBondContact O-CA 3.42Å; D573-Q597 VanDerWaalsContact O-CG 3.26Å; D573-Q597 WeakPolarHBondContact O-CG 3.43Å; D573-Q597 PolarHBondContact O-N 2.89Å
574	I	88.4	Confident	92.5	Very high	12 Å²	12	30.3 Å²	30.3	6%	0.062	17%	0.168	C	C	.	.	S	Bend	trans	-79.7	-39.9	-177.8	-69.9	173.2	0	0	0	110.9	F596 H598 V599 E673 V676 F682	I574-F596 WeakPolarHBondContact CA-O 3.25Å; I574-H598 PolarHBondContact O-N 3.15Å; I574-V599 PolarHBondContact O-N 2.78Å; I574-E673 HydrophobicContact CB-CG 4.07Å; I574-E673 HydrophobicContact CD1-CG 3.86Å; I574-E673 HydrophobicContact CG2-CB 4.43Å; I574-E673 HydrophobicContact CG2-CG 4Å; I574-V676 HydrophobicContact CG2-CB 3.7Å; I574-V676 HydrophobicContact CG2-CG1 3.63Å; I574-V676 HydrophobicContact CG2-CG2 3.72Å; I574-F682 HydrophobicContact CD1-CE1 4.15Å; I574-F682 HydrophobicContact CD1-CZ 4.48Å
575	V	91.2	Very high	92.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135.6	179.7	-166.7	0	0	0	0	109.4	G478 V599 I601 L669 A672 E673	G478-V575 PolarHBondContact N-O 3.38Å; G478-V575 VanDerWaalsContact N-O 3.1Å; V575-V599 WeakPolarHBondContact CA-O 3.41Å; V575-V599 HydrophobicContact CG1-CB 4.1Å; V575-V599 HydrophobicContact CG1-CG1 3.98Å; V575-V599 HydrophobicContact CG2-CB 4.36Å; V575-I601 HydrophobicContact CG1-CD1 4.13Å; V575-I601 HydrophobicContact CG1-CG1 4.28Å; V575-L669 HydrophobicContact CB-CD2 4.31Å; V575-L669 HydrophobicContact CG1-CD2 3.59Å; V575-A672 HydrophobicContact CG1-CB 4.08Å; V575-A672 HydrophobicContact CG2-CB 3.69Å; V575-E673 HydrophobicContact CG2-CB 3.95Å
576	T	93.1	Very high	92.7	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	128.2	179.3	-62	0	0	0	0	110.9	G478 L480 I570 I578 Q597 V599 F600 I601	G478-T576 CarbonylContact O-C 3.58Å; G478-T576 WeakPolarHBondContact O-CA 2.79Å; L480-T576 HydrophobicContact CD1-CG2 4.04Å; I570-T576 HydrophobicContact CG2-CG2 4.1Å; T576-I578 HydrophobicContact CG2-CD1 3.91Å; T576-Q597 PolarHBondContact OG1-NE2 2.87Å; T576-V599 PolarHBondContact N-O 3.02Å; T576-F600 HydrophobicContact CG2-CD1 4.35Å; T576-F600 HydrophobicContact CG2-CE1 4.48Å; T576-F600 CarbonylContact O-C 3.46Å; T576-F600 VanDerWaalsContact O-CA 3.28Å; T576-F600 WeakPolarHBondContact O-CA 3.44Å; T576-I601 PolarHBondContact O-N 3.22Å
577	I	94.2	Very high	92.6	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	129.9	171.2	-55.2	176.8	0	0	0	108.8	V477 G478 V479 L480 F505 L509 F548 I601 V603 L669	V477-I577 HydrophobicContact CG1-CD1 4.15Å; V477-I577 HydrophobicContact CG1-CG1 4.01Å; G478-I577 PolarHBondContact O-N 3.28Å; V479-I577 WeakPolarHBondContact CA-O 3.35Å; V479-I577 HydrophobicContact CG1-CB 4.34Å; V479-I577 HydrophobicContact CG2-CB 4.39Å; V479-I577 HydrophobicContact CG2-CD1 4.33Å; L480-I577 PolarHBondContact N-O 3.5Å; F505-I577 HydrophobicContact CE1-CG2 4.07Å; F505-I577 HydrophobicContact CZ-CG2 3.94Å; L509-I577 HydrophobicContact CD1-CD1 4.06Å; L509-I577 HydrophobicContact CD2-CD1 4.06Å; F548-I577 HydrophobicContact CE1-CD1 4.14Å; I577-I601 CarbonylContact C-O 3.56Å; I577-I601 WeakPolarHBondContact CA-O 3.45Å; I577-V603 HydrophobicContact CG2-CG2 4.21Å; I577-L669 HydrophobicContact CD1-CD1 4.26Å; I577-L669 HydrophobicContact CD1-CD2 4.47Å; I577-L669 HydrophobicContact CG1-CD2 4.34Å
578	I	94.3	Very high	92.5	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	105.7	170.4	-50.1	-59.8	0	0	0	107.5	L480 C482 M492 T576 F587 F600 I601 V602 V603	L480-I578 HydrophobicContact CB-CD1 3.97Å; L480-I578 HydrophobicContact CD1-CD1 3.88Å; C482-I578 HydrophobicContact CB-CG2 4.12Å; M492-I578 HydrophobicContact SD-CG2 4.07Å; T576-I578 HydrophobicContact CG2-CD1 3.91Å; I578-F587 HydrophobicContact CD1-CE2 4.08Å; I578-F587 HydrophobicContact CD1-CZ 4.32Å; I578-F587 HydrophobicContact CG1-CD2 4.23Å; I578-F587 HydrophobicContact CG1-CE1 4.37Å; I578-F587 HydrophobicContact CG1-CE2 3.99Å; I578-F587 HydrophobicContact CG1-CZ 4.05Å; I578-F587 HydrophobicContact CG2-CD2 4.23Å; I578-F600 HydrophobicContact CD1-CD1 4.28Å; I578-F600 HydrophobicContact CG1-CD1 4.36Å; I578-I601 PolarHBondContact N-O 2.91Å; I578-V602 HydrophobicContact CB-CG2 4.36Å; I578-V602 WeakPolarHBondContact O-CA 3.19Å; I578-V603 PolarHBondContact O-N 3.22Å
579	F	95.5	Very high	92.1	Very high	0 Å²	0	20 Å²	20	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	116.8	174.9	-177.1	-91.8	0	0	0	110.1	L480 L481 C482 P501 F502 F505 E581 V603 A605 Y615	L480-F579 PolarHBondContact O-N 2.97Å; L481-F579 HydrophobicContact CD1-CD1 3.72Å; L481-F579 HydrophobicContact CD1-CE1 4.39Å; C482-F579 PolarHBondContact N-O 3.35Å; P501-F579 HydrophobicContact CB-CE1 4.17Å; P501-F579 HydrophobicContact CB-CZ 4.1Å; P501-F579 WeakPolarHBondContact O-CZ 3.37Å; F502-F579 HydrophobicContact CB-CD1 4.14Å; F502-F579 HydrophobicContact CB-CE1 4.02Å; F502-F579 HydrophobicContact CD2-CB 3.79Å; F502-F579 AromaticContact CD2-CD1 3.53Å; F502-F579 HydrophobicContact CD2-CD1 3.53Å; F502-F579 HydrophobicContact CD2-CD2 4.36Å; F502-F579 HydrophobicContact CD2-CE1 4.15Å; F502-F579 AromaticContact CD2-CG 3.63Å; F502-F579 HydrophobicContact CD2-CG 3.63Å; F502-F579 HydrophobicContact CE2-CB 3.75Å; F502-F579 HydrophobicContact CE2-CD1 4.35Å; F502-F579 HydrophobicContact CE2-CG 4.12Å; F502-F579 HydrophobicContact CG-CD1 4.24Å; F505-F579 HydrophobicContact CB-CD2 3.89Å; F505-F579 HydrophobicContact CB-CE2 3.46Å; F505-F579 VanDerWaalsContact CB-CE2 3.46Å; F505-F579 HydrophobicContact CB-CZ 4.05Å; F505-F579 HydrophobicContact CD1-CB 4.37Å; F505-F579 AromaticContact CD1-CD2 3.46Å; F505-F579 HydrophobicContact CD1-CD2 3.46Å; F505-F579 VanDerWaalsContact CD1-CD2 3.46Å; F505-F579 AromaticContact CD1-CE2 3.99Å; F505-F579 HydrophobicContact CD1-CE2 3.99Å; F505-F579 HydrophobicContact CD1-CG 4.11Å; F505-F579 AromaticContact CD2-CD2 3.72Å; F505-F579 HydrophobicContact CD2-CD2 3.72Å; F505-F579 AromaticContact CD2-CE2 3.68Å; F505-F579 HydrophobicContact CD2-CE2 3.68Å; F505-F579 HydrophobicContact CE1-CB 4.32Å; F505-F579 AromaticContact CE1-CD2 3.83Å; F505-F579 HydrophobicContact CE1-CD2 3.83Å; F505-F579 HydrophobicContact CE1-CG 4.44Å; F505-F579 HydrophobicContact CE2-CD2 4.05Å; F505-F579 HydrophobicContact CE2-CE2 4.38Å; F505-F579 AromaticContact CG-CD2 3.4Å; F505-F579 HydrophobicContact CG-CD2 3.4Å; F505-F579 VanDerWaalsContact CG-CD2 3.4Å; F505-F579 AromaticContact CG-CE2 3.44Å; F505-F579 HydrophobicContact CG-CE2 3.44Å; F505-F579 VanDerWaalsContact CG-CE2 3.44Å; F505-F579 HydrophobicContact CG-CG 4.39Å; F505-F579 HydrophobicContact CG-CZ 4.44Å; F505-F579 HydrophobicContact CZ-CD2 4.11Å; F579-E581 HydrophobicContact CE1-CG 4.31Å; F579-V603 CarbonylContact C-O 3.11Å; F579-V603 WeakPolarHBondContact CA-O 3.38Å; F579-A605 HydrophobicContact CE2-CB 4.1Å; F579-A605 HydrophobicContact CZ-CB 3.75Å; F579-Y615 HydrophobicContact CE2-CE1 4.16Å
580	Q	95.5	Very high	91.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.3	177.1	-82	171.5	-28.8	0	0	111	L216 C482 A584 L585 V602 V603 Q604 A605	L216-Q580 PolarHBondContact O-NE2 3.47Å; C482-Q580 HydrophobicContact CB-CG 4.21Å; Q580-A584 HydrophobicContact CB-CB 3.91Å; Q580-A584 HydrophobicContact CG-CB 3.86Å; Q580-L585 PolarHBondContact NE2-O 3.03Å; Q580-V602 VanDerWaalsContact CD-CG1 3.47Å; Q580-V602 HydrophobicContact CG-CG1 4.18Å; Q580-V603 PolarHBondContact N-O 3.27Å; Q580-Q604 HydrophobicContact CB-CB 3.9Å; Q580-Q604 HydrophobicContact CB-CG 4.06Å; Q580-Q604 WeakPolarHBondContact O-CA 2.94Å; Q580-A605 PolarHBondContact O-N 3.12Å
581	E	94	Very high	91.1	Very high	26 Å²	26	26.5 Å²	26.5	12%	0.121	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-72.5	159.6	165.4	-67.3	178.7	170.4	0	0	111.4	L481 C482 K483 S499 F579 G583 A584	L481-E581 HydrophobicContact CD1-CG 4.03Å; C482-E581 PolarHBondContact O-N 3.49Å; K483-E581 VanDerWaalsContact CA-OE2 3.28Å; K483-E581 WeakPolarHBondContact CA-OE2 3.46Å; K483-E581 VanDerWaalsContact CB-OE2 3.25Å; K483-E581 WeakPolarHBondContact CB-OE2 3.36Å; K483-E581 WeakPolarHBondContact CG-OE2 3.32Å; S499-E581 WeakPolarHBondContact CB-OE1 3.36Å; S499-E581 PolarHBondContact OG-OE1 3.19Å; F579-E581 HydrophobicContact CE1-CG 4.31Å; E581-G583 PolarHBondContact O-N 3.1Å; E581-A584 VanDerWaalsContact O-CB 3.25Å; E581-A584 WeakPolarHBondContact O-CB 3.23Å; E581-A584 PolarHBondContact O-N 3.5Å
582	P	90.5	Very high	90.6	Very high	68 Å²	68	27 Å²	27	44%	0.442	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	125.8	167.5	-25.6	33.6	0	0	0	111.6	P608	P582-P608 HydrophobicContact CG-CG 3.81Å
583	G	90.7	Very high	89.5	Confident	55 Å²	55	31.9 Å²	31.9	57%	0.567	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.8	6.7	-177.1	0	0	0	0	0	115.4	A484 G485 E581	A484-G583 WeakPolarHBondContact CA-O 3.14Å; G485-G583 PolarHBondContact N-O 3.46Å; E581-G583 PolarHBondContact O-N 3.1Å
584	A	92.6	Very high	89.1	Confident	9 Å²	9	33.6 Å²	33.6	7%	0.074	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-63	149.8	162.9	0	0	0	0	0	110.2	K483 Q580 E581	K483-A584 WeakPolarHBondContact O-CB 3.44Å; Q580-A584 HydrophobicContact CB-CB 3.91Å; Q580-A584 HydrophobicContact CG-CB 3.86Å; E581-A584 VanDerWaalsContact O-CB 3.25Å; E581-A584 WeakPolarHBondContact O-CB 3.23Å; E581-A584 PolarHBondContact O-N 3.5Å
585	L	92.6	Very high	88.5	Confident	80 Å²	80	40.5 Å²	40.5	42%	0.419	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-81	157.4	178.8	-64.8	171.2	0	0	0	110.9	Q486 C487 Q580 F587	Q486-L585 WeakPolarHBondContact O-CB 3.33Å; Q486-L585 PolarHBondContact O-N 3.3Å; C487-L585 HydrophobicContact CB-CB 3.96Å; C487-L585 HydrophobicContact CB-CD1 4.02Å; Q580-L585 PolarHBondContact NE2-O 3.03Å; L585-F587 PolarHBondContact O-N 3.46Å
586	P	91.8	Very high	88	Confident	45 Å²	45	43.8 Å²	43.8	29%	0.292	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-53.4	128	173.3	-27.1	35.4	0	0	0	111.8	L216 L218	L216-P586 WeakPolarHBondContact O-CA 3.39Å; L218-P586 HydrophobicContact CD1-CB 4.48Å; L218-P586 HydrophobicContact CD2-CB 3.69Å; L218-P586 HydrophobicContact CD2-CG 4.39Å; L218-P586 HydrophobicContact CG-CB 3.82Å
587	F	92.3	Very high	87.7	Confident	3 Å²	3	44.1 Å²	44.1	1%	0.013	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-70.8	142	178.5	172.4	-104.9	0	0	0	110.3	L216 I217 L218 M492 I578 L585 P589 M592 F600 V602	L216-F587 PolarHBondContact O-N 3.24Å; I217-F587 CarbonylContact C-O 3.55Å; I217-F587 WeakPolarHBondContact CA-O 3.44Å; I217-F587 HydrophobicContact CD1-CD1 4.06Å; I217-F587 HydrophobicContact CG1-CD1 4.25Å; I217-F587 WeakPolarHBondContact CG1-O 3.38Å; L218-F587 PolarHBondContact N-O 2.92Å; M492-F587 HydrophobicContact CE-CD2 4.21Å; M492-F587 HydrophobicContact CE-CE2 4.19Å; I578-F587 HydrophobicContact CD1-CE2 4.08Å; I578-F587 HydrophobicContact CD1-CZ 4.32Å; I578-F587 HydrophobicContact CG1-CD2 4.23Å; I578-F587 HydrophobicContact CG1-CE1 4.37Å; I578-F587 HydrophobicContact CG1-CE2 3.99Å; I578-F587 HydrophobicContact CG1-CZ 4.05Å; I578-F587 HydrophobicContact CG2-CD2 4.23Å; L585-F587 PolarHBondContact O-N 3.46Å; F587-P589 HydrophobicContact CD1-CG 4.42Å; F587-P589 HydrophobicContact CE1-CB 4.31Å; F587-P589 HydrophobicContact CE1-CG 3.96Å; F587-M592 HydrophobicContact CE2-CE 4.23Å; F587-M592 HydrophobicContact CE2-CG 3.88Å; F587-M592 HydrophobicContact CE2-SD 4.24Å; F587-M592 HydrophobicContact CZ-CG 3.67Å; F587-M592 HydrophobicContact CZ-SD 4.45Å; F587-F600 HydrophobicContact CE1-CB 3.81Å; F587-F600 HydrophobicContact CE1-CD1 4.29Å; F587-F600 AromaticContact CE1-CD2 4Å; F587-F600 HydrophobicContact CE1-CD2 4Å; F587-F600 AromaticContact CE1-CG 3.75Å; F587-F600 HydrophobicContact CE1-CG 3.75Å; F587-F600 HydrophobicContact CZ-CB 4.27Å; F587-F600 AromaticContact CZ-CD1 3.89Å; F587-F600 HydrophobicContact CZ-CD1 3.89Å; F587-F600 HydrophobicContact CZ-CD2 4.1Å; F587-F600 HydrophobicContact CZ-CE1 4.3Å; F587-F600 HydrophobicContact CZ-CE2 4.48Å; F587-F600 AromaticContact CZ-CG 3.8Å; F587-F600 HydrophobicContact CZ-CG 3.8Å; F587-V602 HydrophobicContact CB-CG2 4.24Å; F587-V602 HydrophobicContact CD1-CG2 3.72Å; F587-V602 HydrophobicContact CE1-CG2 4.42Å; F587-V602 HydrophobicContact CG-CG2 4.22Å
588	C	90.1	Very high	87.4	Confident	21 Å²	21	44.4 Å²	44.4	14%	0.142	24%	0.237	C	C	.	.			trans	-121.6	118.3	170.7	-179.6	0	0	0	0	109.8	L218 Q590 T591	L218-C588 HydrophobicContact CB-CB 4.36Å; L218-C588 HydrophobicContact CD1-CB 4.29Å; C588-Q590 PolarHBondContact O-N 3.38Å; C588-Q590 VanDerWaalsContact O-N 3.1Å; C588-T591 HydrophobicContact CB-CG2 4.16Å; C588-T591 WeakPolarHBondContact O-CB 3.47Å; C588-T591 WeakPolarHBondContact O-CG2 3.48Å; C588-T591 PolarHBondContact O-N 3.03Å; C588-T591 PolarHBondContact O-OG1 3.03Å
589	P	85.3	Confident	87.2	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-54.2	-31.2	178.9	-26.7	33.2	0	0	0	113.9	I217 C220 F223 F587 T591 M592 F600 S620	I217-P589 HydrophobicContact CD1-CG 4.1Å; C220-P589 HydrophobicContact CB-CG 4.46Å; F223-P589 HydrophobicContact CB-CB 4.35Å; F223-P589 HydrophobicContact CB-CG 4.32Å; F223-P589 HydrophobicContact CD1-CB 3.88Å; F223-P589 HydrophobicContact CD1-CG 4.29Å; F223-P589 HydrophobicContact CD2-CB 3.59Å; F223-P589 HydrophobicContact CD2-CG 4.45Å; F223-P589 HydrophobicContact CE1-CB 4.11Å; F223-P589 HydrophobicContact CE2-CB 3.81Å; F223-P589 HydrophobicContact CG-CB 3.66Å; F223-P589 HydrophobicContact CG-CG 4.1Å; F223-P589 HydrophobicContact CZ-CB 4.08Å; F587-P589 HydrophobicContact CD1-CG 4.42Å; F587-P589 HydrophobicContact CE1-CB 4.31Å; F587-P589 HydrophobicContact CE1-CG 3.96Å; P589-T591 PolarHBondContact O-N 3.36Å; P589-T591 VanDerWaalsContact O-N 3.13Å; P589-M592 WeakPolarHBondContact O-CB 3.34Å; P589-M592 PolarHBondContact O-N 3.43Å; P589-F600 HydrophobicContact CB-CD2 4.19Å; P589-F600 HydrophobicContact CB-CE2 4.27Å; P589-S620 WeakPolarHBondContact CG-OG 3.24Å
590	Q	85.1	Confident	87	Confident	122 Å²	122	44.5 Å²	44.5	57%	0.57	24%	0.237	S	C	*	.	G	3₁₀ helix	trans	-61.6	-19	178.3	-162.5	179.7	2.7	0	0	113.6	C588 M592	C588-Q590 PolarHBondContact O-N 3.38Å; C588-Q590 VanDerWaalsContact O-N 3.1Å; Q590-M592 VanDerWaalsContact C-N 3.31Å
591	T	81.7	Confident	86.9	Confident	43 Å²	43	44.5 Å²	44.5	26%	0.264	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-71.9	-23.6	174.3	64.2	0	0	0	0	113	C588 P589 R593	C588-T591 HydrophobicContact CB-CG2 4.16Å; C588-T591 WeakPolarHBondContact O-CB 3.47Å; C588-T591 WeakPolarHBondContact O-CG2 3.48Å; C588-T591 PolarHBondContact O-N 3.03Å; C588-T591 PolarHBondContact O-OG1 3.03Å; P589-T591 PolarHBondContact O-N 3.36Å; P589-T591 VanDerWaalsContact O-N 3.13Å; T591-R593 PolarHBondContact O-N 3.07Å
592	M	80.8	Confident	86.8	Confident	16 Å²	16	43.3 Å²	43.3	8%	0.079	23%	0.231	C	C	.	.			trans	-85.2	101.1	-177.6	-61.6	-75.3	100	0	0	110.8	L480 E489 M492 F587 P589 Q590 S594 F600	L480-M592 HydrophobicContact CD1-SD 4.25Å; E489-M592 HydrophobicContact CB-CE 3.58Å; E489-M592 HydrophobicContact CG-CE 3.79Å; M492-M592 HydrophobicContact CE-CE 3.59Å; F587-M592 HydrophobicContact CE2-CE 4.23Å; F587-M592 HydrophobicContact CE2-CG 3.88Å; F587-M592 HydrophobicContact CE2-SD 4.24Å; F587-M592 HydrophobicContact CZ-CG 3.67Å; F587-M592 HydrophobicContact CZ-SD 4.45Å; P589-M592 WeakPolarHBondContact O-CB 3.34Å; P589-M592 PolarHBondContact O-N 3.43Å; Q590-M592 VanDerWaalsContact C-N 3.31Å; M592-S594 PolarHBondContact O-N 2.63Å; M592-S594 VanDerWaalsContact O-N 3.17Å; M592-F600 HydrophobicContact CB-CE1 4.11Å; M592-F600 HydrophobicContact CB-CE2 4.25Å; M592-F600 HydrophobicContact CB-CZ 3.53Å; M592-F600 HydrophobicContact CG-CD1 4.43Å; M592-F600 HydrophobicContact CG-CE1 3.6Å; M592-F600 HydrophobicContact CG-CE2 4.2Å; M592-F600 HydrophobicContact CG-CZ 3.47Å; M592-F600 VanDerWaalsContact CG-CZ 3.47Å; M592-F600 HydrophobicContact SD-CE1 4.09Å; M592-F600 HydrophobicContact SD-CZ 4.48Å
593	R	69.6	Low	86.9	Confident	168 Å²	168	40 Å²	40	63%	0.634	21%	0.21	S	C	*	.			trans	-85.6	85.3	176.7	-67.3	-172.7	-179.2	-175.3	2.7	111	K567 T591	K567-R593 WeakPolarHBondContact CE-O 3.48Å; K567-R593 PolarHBondContact NZ-O 3.46Å; T591-R593 PolarHBondContact O-N 3.07Å
594	S	81.7	Confident	87	Confident	37 Å²	37	39.3 Å²	39.3	26%	0.259	19%	0.192	S	C	.	.			trans	-139.2	152.2	172.2	177	0	0	0	0	112.6	G571 M592 F596 Q597	G571-S594 PolarHBondContact O-OG 2.74Å; M592-S594 PolarHBondContact O-N 2.63Å; M592-S594 VanDerWaalsContact O-N 3.17Å; S594-F596 PolarHBondContact OG-N 3.06Å; S594-Q597 PolarHBondContact OG-N 2.68Å
595	H	76.1	Confident	87	Confident	157 Å²	157	39 Å²	39	73%	0.727	19%	0.189	S	C	*	.	S	Bend	trans	-94.6	-6.5	169.1	-65.3	-54.1	0	0	0	114	H598 K681	H595-H598 PolarHBondContact O-CE1 3.32Å; H595-K681 PolarHBondContact O-NZ 3.16Å
596	F	79.8	Confident	86.9	Confident	68 Å²	68	37.6 Å²	37.6	30%	0.298	18%	0.184	S	C	.	.	S	Bend	trans	-111.1	-34.4	-172.9	-65.5	-76.7	0	0	0	113.6	N572 D573 I574 S594 H598 M1073	N572-F596 WeakPolarHBondContact OD1-CD2 3.36Å; N572-F596 VanDerWaalsContact OD1-CE2 3.29Å; N572-F596 WeakPolarHBondContact OD1-CE2 3.4Å; D573-F596 CarbonylContact O-C 3.6Å; I574-F596 WeakPolarHBondContact CA-O 3.25Å; S594-F596 PolarHBondContact OG-N 3.06Å; F596-H598 PolarHBondContact O-CE1 3.47Å; F596-H598 PolarHBondContact O-N 3.47Å; F596-H598 PolarHBondContact O-ND1 3.23Å; F596-M1073 HydrophobicContact CZ-CE 4.44Å
597	Q	88.2	Confident	86.8	Confident	8 Å²	8	40 Å²	40	4%	0.037	20%	0.195	C	C	.	.			trans	-71.7	116.9	174.6	-64.6	171.6	-71.2	0	0	109.1	D573 T576 S594 F600	D573-Q597 WeakPolarHBondContact O-CA 3.42Å; D573-Q597 VanDerWaalsContact O-CG 3.26Å; D573-Q597 WeakPolarHBondContact O-CG 3.43Å; D573-Q597 PolarHBondContact O-N 2.89Å; T576-Q597 PolarHBondContact OG1-NE2 2.87Å; S594-Q597 PolarHBondContact OG-N 2.68Å; Q597-F600 HydrophobicContact CB-CE1 4.08Å; Q597-F600 HydrophobicContact CB-CZ 3.76Å
598	H	87.6	Confident	86.6	Confident	5 Å²	5	41.2 Å²	41.2	2%	0.023	20%	0.203	C	C	.	.			trans	-121.8	-11.9	178.6	-65.1	76.5	0	0	0	112.9	I574 H595 F596 R621 Y622 V625 V676 K681 F682	I574-H598 PolarHBondContact O-N 3.15Å; H595-H598 PolarHBondContact O-CE1 3.32Å; F596-H598 PolarHBondContact O-CE1 3.47Å; F596-H598 PolarHBondContact O-N 3.47Å; F596-H598 PolarHBondContact O-ND1 3.23Å; H598-R621 CarbonylContact O-C 3.58Å; H598-R621 WeakPolarHBondContact O-CA 3.48Å; H598-Y622 AromaticContact CD2-CD1 3.9Å; H598-Y622 AromaticContact CD2-CG 3.95Å; H598-Y622 PolarHBondContact O-N 2.99Å; H598-V625 HydrophobicContact CB-CG2 4.23Å; H598-V676 HydrophobicContact CB-CG1 3.97Å; H598-V676 HydrophobicContact CB-CG2 3.69Å; H598-K681 PolarHBondContact CE1-NZ 2.88Å; H598-K681 VanDerWaalsContact CE1-NZ 3.32Å; H598-K681 PolarHBondContact NE2-NZ 3.41Å; H598-F682 AromaticContact CE1-CE2 3.39Å; H598-F682 WeakPolarHBondContact CE1-CE2 3.37Å; H598-F682 AromaticContact CE1-CZ 3.61Å; H598-F682 AromaticContact ND1-CE2 3.7Å; H598-F682 AromaticContact ND1-CZ 3.83Å; H598-F682 AromaticContact NE2-CE2 3.63Å
599	V	90.1	Very high	86.4	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	131.4	174.9	178.1	0	0	0	0	110.8	I574 V575 T576 I601 V619 S620 R621 F628 A672 V676	I574-V599 PolarHBondContact O-N 2.78Å; V575-V599 WeakPolarHBondContact CA-O 3.41Å; V575-V599 HydrophobicContact CG1-CB 4.1Å; V575-V599 HydrophobicContact CG1-CG1 3.98Å; V575-V599 HydrophobicContact CG2-CB 4.36Å; T576-V599 PolarHBondContact N-O 3.02Å; V599-I601 HydrophobicContact CG1-CG1 4.25Å; V599-V619 HydrophobicContact CG1-CG1 4.04Å; V599-S620 CarbonylContact C-O 3.16Å; V599-S620 VanDerWaalsContact CA-O 3.31Å; V599-S620 WeakPolarHBondContact CA-O 3.38Å; V599-R621 HydrophobicContact CG2-CB 4.24Å; V599-F628 HydrophobicContact CG1-CE1 4.15Å; V599-F628 HydrophobicContact CG1-CZ 3.69Å; V599-F628 HydrophobicContact CG2-CE1 3.95Å; V599-F628 HydrophobicContact CG2-CZ 4.28Å; V599-A672 HydrophobicContact CB-CB 4.38Å; V599-A672 HydrophobicContact CG1-CB 4.05Å; V599-A672 HydrophobicContact CG2-CB 4.28Å; V599-V676 HydrophobicContact CG2-CG2 3.73Å
600	F	91.8	Very high	86.6	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.009	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.2	169.7	-59.7	-72.8	0	0	0	109.9	F223 T576 I578 F587 P589 M592 Q597 V619 S620	F223-F600 HydrophobicContact CD1-CD2 4.46Å; F223-F600 AromaticContact CE1-CD2 3.8Å; F223-F600 HydrophobicContact CE1-CD2 3.8Å; F223-F600 AromaticContact CE1-CE2 3.67Å; F223-F600 HydrophobicContact CE1-CE2 3.67Å; F223-F600 HydrophobicContact CZ-CD2 4.34Å; F223-F600 AromaticContact CZ-CE2 3.75Å; F223-F600 HydrophobicContact CZ-CE2 3.75Å; T576-F600 HydrophobicContact CG2-CD1 4.35Å; T576-F600 HydrophobicContact CG2-CE1 4.48Å; T576-F600 CarbonylContact O-C 3.46Å; T576-F600 VanDerWaalsContact O-CA 3.28Å; T576-F600 WeakPolarHBondContact O-CA 3.44Å; I578-F600 HydrophobicContact CD1-CD1 4.28Å; I578-F600 HydrophobicContact CG1-CD1 4.36Å; F587-F600 HydrophobicContact CE1-CB 3.81Å; F587-F600 HydrophobicContact CE1-CD1 4.29Å; F587-F600 AromaticContact CE1-CD2 4Å; F587-F600 HydrophobicContact CE1-CD2 4Å; F587-F600 AromaticContact CE1-CG 3.75Å; F587-F600 HydrophobicContact CE1-CG 3.75Å; F587-F600 HydrophobicContact CZ-CB 4.27Å; F587-F600 AromaticContact CZ-CD1 3.89Å; F587-F600 HydrophobicContact CZ-CD1 3.89Å; F587-F600 HydrophobicContact CZ-CD2 4.1Å; F587-F600 HydrophobicContact CZ-CE1 4.3Å; F587-F600 HydrophobicContact CZ-CE2 4.48Å; F587-F600 AromaticContact CZ-CG 3.8Å; F587-F600 HydrophobicContact CZ-CG 3.8Å; P589-F600 HydrophobicContact CB-CD2 4.19Å; P589-F600 HydrophobicContact CB-CE2 4.27Å; M592-F600 HydrophobicContact CB-CE1 4.11Å; M592-F600 HydrophobicContact CB-CE2 4.25Å; M592-F600 HydrophobicContact CB-CZ 3.53Å; M592-F600 HydrophobicContact CG-CD1 4.43Å; M592-F600 HydrophobicContact CG-CE1 3.6Å; M592-F600 HydrophobicContact CG-CE2 4.2Å; M592-F600 HydrophobicContact CG-CZ 3.47Å; M592-F600 VanDerWaalsContact CG-CZ 3.47Å; M592-F600 HydrophobicContact SD-CE1 4.09Å; M592-F600 HydrophobicContact SD-CZ 4.48Å; Q597-F600 HydrophobicContact CB-CE1 4.08Å; Q597-F600 HydrophobicContact CB-CZ 3.76Å; F600-V619 CarbonylContact O-C 3.6Å; F600-V619 WeakPolarHBondContact O-CA 3.45Å; F600-S620 PolarHBondContact N-O 3.5Å; F600-S620 PolarHBondContact O-N 3.41Å
601	I	91.8	Very high	86.6	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	103.8	172.2	-53.7	-176.8	0	0	0	107.1	V575 T576 I577 I578 V599 V603 V617 V619 L648 L669	V575-I601 HydrophobicContact CG1-CD1 4.13Å; V575-I601 HydrophobicContact CG1-CG1 4.28Å; T576-I601 PolarHBondContact O-N 3.22Å; I577-I601 CarbonylContact C-O 3.56Å; I577-I601 WeakPolarHBondContact CA-O 3.45Å; I578-I601 PolarHBondContact N-O 2.91Å; V599-I601 HydrophobicContact CG1-CG1 4.25Å; I601-V603 HydrophobicContact CG2-CG2 4.07Å; I601-V617 HydrophobicContact CG2-CG1 3.92Å; I601-V619 HydrophobicContact CG1-CG2 4.31Å; I601-V619 HydrophobicContact CG2-CG2 4.35Å; I601-L648 HydrophobicContact CG2-CD2 4.34Å; I601-L669 HydrophobicContact CD1-CD2 3.72Å; I601-L669 HydrophobicContact CD1-CG 4.18Å
602	V	92.3	Very high	86.8	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	125.6	179	-170.5	0	0	0	0	108.6	L216 I217 I578 Q580 F587 V617 S618	L216-V602 HydrophobicContact CB-CG1 4.05Å; I217-V602 HydrophobicContact CD1-CG2 4.18Å; I578-V602 HydrophobicContact CB-CG2 4.36Å; I578-V602 WeakPolarHBondContact O-CA 3.19Å; Q580-V602 VanDerWaalsContact CD-CG1 3.47Å; Q580-V602 HydrophobicContact CG-CG1 4.18Å; F587-V602 HydrophobicContact CB-CG2 4.24Å; F587-V602 HydrophobicContact CD1-CG2 3.72Å; F587-V602 HydrophobicContact CE1-CG2 4.42Å; F587-V602 HydrophobicContact CG-CG2 4.22Å; V602-V617 WeakPolarHBondContact O-CA 3.4Å; V602-S618 PolarHBondContact N-O 3.47Å; V602-S618 PolarHBondContact O-N 3.17Å
603	V	92.9	Very high	87.2	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	116.4	-179	-175.1	0	0	0	0	109.1	F505 I577 I578 F579 Q580 I601 Y615 S616 V617 F644 L648	F505-V603 HydrophobicContact CE2-CB 4.3Å; F505-V603 HydrophobicContact CE2-CG1 3.8Å; F505-V603 HydrophobicContact CZ-CB 4.34Å; F505-V603 HydrophobicContact CZ-CG1 4.33Å; F505-V603 HydrophobicContact CZ-CG2 4.34Å; I577-V603 HydrophobicContact CG2-CG2 4.21Å; I578-V603 PolarHBondContact O-N 3.22Å; F579-V603 CarbonylContact C-O 3.11Å; F579-V603 WeakPolarHBondContact CA-O 3.38Å; Q580-V603 PolarHBondContact N-O 3.27Å; I601-V603 HydrophobicContact CG2-CG2 4.07Å; V603-Y615 HydrophobicContact CG1-CD1 4.05Å; V603-Y615 HydrophobicContact CG1-CG 4.42Å; V603-S616 WeakPolarHBondContact CA-O 3.37Å; V603-V617 HydrophobicContact CG1-CG2 4.39Å; V603-V617 HydrophobicContact CG2-CG1 4.39Å; V603-V617 HydrophobicContact CG2-CG2 4.32Å; V603-F644 HydrophobicContact CG1-CZ 4.05Å; V603-L648 HydrophobicContact CG2-CD2 3.77Å
604	Q	93.6	Very high	88.2	Confident	39 Å²	39	52.3 Å²	52.3	18%	0.182	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	133.2	175.4	-177.1	178.1	81.8	0	0	111	L216 Q580 Y615 S616	L216-Q604 HydrophobicContact CD1-CB 4.49Å; L216-Q604 HydrophobicContact CD2-CB 3.53Å; L216-Q604 HydrophobicContact CD2-CG 4.17Å; Q580-Q604 HydrophobicContact CB-CB 3.9Å; Q580-Q604 HydrophobicContact CB-CG 4.06Å; Q580-Q604 WeakPolarHBondContact O-CA 2.94Å; Q604-Y615 WeakPolarHBondContact O-CA 3.42Å; Q604-S616 PolarHBondContact N-O 3.43Å; Q604-S616 PolarHBondContact O-N 2.85Å
605	A	92.3	Very high	88.6	Confident	2 Å²	2	50.6 Å²	50.6	2%	0.017	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	125.2	174	0	0	0	0	0	111.6	F579 Q580 P608 Y615	F579-A605 HydrophobicContact CE2-CB 4.1Å; F579-A605 HydrophobicContact CZ-CB 3.75Å; Q580-A605 PolarHBondContact O-N 3.12Å; A605-P608 HydrophobicContact CB-CB 3.99Å; A605-P608 HydrophobicContact CB-CG 4.48Å; A605-Y615 HydrophobicContact CB-CD1 3.98Å; A605-Y615 HydrophobicContact CB-CE1 3.79Å
606	V	90.7	Very high	89.2	Confident	51 Å²	51	44.8 Å²	44.8	31%	0.309	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	127.4	176.8	-177.2	0	0	0	0	108.1	V613 K614	V606-V613 WeakPolarHBondContact O-CA 3.45Å; V606-K614 HydrophobicContact CB-CB 4.38Å; V606-K614 PolarHBondContact N-O 3.31Å; V606-K614 PolarHBondContact O-N 3.03Å
607	N	89.6	Confident	89.7	Confident	97 Å²	97	42 Å²	42	52%	0.519	22%	0.219	S	C	.	.	S	Bend	trans	51	48.5	-170.9	-51.6	-39.2	0	0	0	114.1	T610 V613	N607-T610 PolarHBondContact O-OG1 3.16Å; N607-V613 WeakPolarHBondContact O-CA 3.41Å; N607-V613 WeakPolarHBondContact O-CB 3.36Å
608	P	87.6	Confident	89.7	Confident	27 Å²	27	41.6 Å²	41.6	18%	0.175	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	156.9	-177.5	28.6	-36.6	0	0	0	112.9	P501 P582 A605 T610	P501-P608 HydrophobicContact CB-CB 3.64Å; P501-P608 HydrophobicContact CB-CG 4.11Å; P501-P608 HydrophobicContact CG-CB 3.76Å; P501-P608 HydrophobicContact CG-CG 3.85Å; P582-P608 HydrophobicContact CG-CG 3.81Å; A605-P608 HydrophobicContact CB-CB 3.99Å; A605-P608 HydrophobicContact CB-CG 4.48Å; P608-T610 PolarHBondContact O-N 3.22Å
609	N	86.4	Confident	89.8	Confident	81 Å²	81	41.4 Å²	41.4	43%	0.433	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	30.5	-178.2	-48.9	141.9	0	0	0	113.8	A500 P501 E504	A500-N609 VanDerWaalsContact C-ND2 3.35Å; A500-N609 VanDerWaalsContact CB-OD1 3.25Å; A500-N609 WeakPolarHBondContact CB-OD1 3.32Å; A500-N609 PolarHBondContact O-ND2 3.03Å; P501-N609 WeakPolarHBondContact CD-OD1 3.34Å; E504-N609 VanDerWaalsContact OE2-CA 3.26Å; E504-N609 WeakPolarHBondContact OE2-CA 3.35Å; E504-N609 PolarHBondContact OE2-N 3.09Å; E504-N609 PolarHBondContact OE2-ND2 3.06Å
610	T	89.7	Confident	89.8	Confident	67 Å²	67	41.4 Å²	41.4	41%	0.411	22%	0.216	S	C	.	.	S	Bend	trans	-133.8	157.7	171.9	75.9	0	0	0	0	110.7	N607 P608 K612 V613	N607-T610 PolarHBondContact O-OG1 3.16Å; P608-T610 PolarHBondContact O-N 3.22Å; T610-K612 PolarHBondContact O-N 3.22Å; T610-K612 PolarHBondContact OG1-N 3.13Å; T610-V613 WeakPolarHBondContact O-CB 3.36Å; T610-V613 VanDerWaalsContact O-CG1 3.28Å; T610-V613 WeakPolarHBondContact O-CG1 3.48Å; T610-V613 PolarHBondContact O-N 3.41Å
611	D	83.9	Confident	89.7	Confident	175 Å²	175	42.3 Å²	42.3	94%	0.936	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-10.9	175.8	-50.7	-47.4	0	0	0	113.8
612	K	86.9	Confident	89.6	Confident	168 Å²	168	45.2 Å²	45.2	73%	0.73	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.4	16.6	177.6	-61.7	-176.1	-178.7	178.8	0	112.8	T610 K614	T610-K612 PolarHBondContact O-N 3.22Å; T610-K612 PolarHBondContact OG1-N 3.13Å; K612-K614 PolarHBondContact O-N 3.49Å
613	V	89.7	Confident	89.3	Confident	7 Å²	7	48.6 Å²	48.6	4%	0.042	25%	0.246	C	C	.	.			trans	-58.2	133.7	175.3	62.4	0	0	0	0	110.9	V606 N607 T610 Y615 R640	V606-V613 WeakPolarHBondContact O-CA 3.45Å; N607-V613 WeakPolarHBondContact O-CA 3.41Å; N607-V613 WeakPolarHBondContact O-CB 3.36Å; T610-V613 WeakPolarHBondContact O-CB 3.36Å; T610-V613 VanDerWaalsContact O-CG1 3.28Å; T610-V613 WeakPolarHBondContact O-CG1 3.48Å; T610-V613 PolarHBondContact O-N 3.41Å; V613-Y615 HydrophobicContact CG2-CE1 4.37Å; V613-Y615 HydrophobicContact CG2-CE2 4.13Å; V613-R640 HydrophobicContact CG1-CB 3.48Å; V613-R640 VanDerWaalsContact CG1-CB 3.48Å; V613-R640 HydrophobicContact CG1-CG 4.43Å
614	K	89.6	Confident	88.8	Confident	107 Å²	107	52.3 Å²	52.3	47%	0.465	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	155.1	171.6	-68.5	-177.1	174.8	-168.4	0	109.9	V606 K612 G637 F638	V606-K614 HydrophobicContact CB-CB 4.38Å; V606-K614 PolarHBondContact N-O 3.31Å; V606-K614 PolarHBondContact O-N 3.03Å; K612-K614 PolarHBondContact O-N 3.49Å; K614-G637 WeakPolarHBondContact CD-O 3.31Å; K614-F638 CarbonylContact C-O 3.48Å; K614-F638 WeakPolarHBondContact CA-O 3.44Å
615	Y	89.7	Confident	88.3	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	121.4	174.8	-60.2	-80.5	0	0	0	109.6	F505 I508 F579 V603 Q604 A605 V613 F638 R640 F644	F505-Y615 HydrophobicContact CD2-CD1 4.38Å; F505-Y615 HydrophobicContact CD2-CE1 4.04Å; I508-Y615 HydrophobicContact CD1-CE2 3.74Å; I508-Y615 VanDerWaalsContact CD1-OH 3.28Å; I508-Y615 WeakPolarHBondContact CD1-OH 3.36Å; F579-Y615 HydrophobicContact CE2-CE1 4.16Å; V603-Y615 HydrophobicContact CG1-CD1 4.05Å; V603-Y615 HydrophobicContact CG1-CG 4.42Å; Q604-Y615 WeakPolarHBondContact O-CA 3.42Å; A605-Y615 HydrophobicContact CB-CD1 3.98Å; A605-Y615 HydrophobicContact CB-CE1 3.79Å; V613-Y615 HydrophobicContact CG2-CE1 4.37Å; V613-Y615 HydrophobicContact CG2-CE2 4.13Å; Y615-F638 PolarHBondContact N-O 2.82Å; Y615-F638 WeakPolarHBondContact O-CD2 3.4Å; Y615-F638 PolarHBondContact O-N 3.44Å; Y615-R640 HydrophobicContact CE2-CB 4.08Å; Y615-F644 HydrophobicContact CD1-CE1 4.1Å; Y615-F644 HydrophobicContact CD1-CZ 4.27Å; Y615-F644 AromaticContact CD2-CD1 3.47Å; Y615-F644 HydrophobicContact CD2-CD1 3.47Å; Y615-F644 VanDerWaalsContact CD2-CD1 3.47Å; Y615-F644 AromaticContact CD2-CE1 3.18Å; Y615-F644 HydrophobicContact CD2-CE1 3.18Å; Y615-F644 HydrophobicContact CD2-CG 4.26Å; Y615-F644 AromaticContact CD2-CZ 3.76Å; Y615-F644 HydrophobicContact CD2-CZ 3.76Å; Y615-F644 AromaticContact CE2-CD1 3.94Å; Y615-F644 HydrophobicContact CE2-CD1 3.94Å; Y615-F644 AromaticContact CE2-CE1 3.75Å; Y615-F644 HydrophobicContact CE2-CE1 3.75Å; Y615-F644 HydrophobicContact CG-CD1 4.13Å; Y615-F644 AromaticContact CG-CE1 3.37Å; Y615-F644 HydrophobicContact CG-CE1 3.37Å; Y615-F644 HydrophobicContact CG-CE2 4.36Å; Y615-F644 AromaticContact CG-CZ 3.51Å; Y615-F644 HydrophobicContact CG-CZ 3.51Å
616	S	89.7	Confident	87.5	Confident	35 Å²	35	52.4 Å²	52.4	25%	0.245	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	137.4	170.4	-59.4	0	0	0	0	108.5	V603 Q604	V603-S616 WeakPolarHBondContact CA-O 3.37Å; Q604-S616 PolarHBondContact N-O 3.43Å; Q604-S616 PolarHBondContact O-N 2.85Å
617	V	88.8	Confident	87	Confident	9 Å²	9	50.6 Å²	50.6	6%	0.055	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	142.1	-174.6	-173	0	0	0	0	110.9	I601 V602 V603 F638 F644 F647	I601-V617 HydrophobicContact CG2-CG1 3.92Å; V602-V617 WeakPolarHBondContact O-CA 3.4Å; V603-V617 HydrophobicContact CG1-CG2 4.39Å; V603-V617 HydrophobicContact CG2-CG1 4.39Å; V603-V617 HydrophobicContact CG2-CG2 4.32Å; V617-F638 HydrophobicContact CG2-CD2 4.15Å; V617-F638 HydrophobicContact CG2-CE2 4.35Å; V617-F644 HydrophobicContact CG2-CE2 3.94Å; V617-F644 HydrophobicContact CG2-CZ 4.47Å; V617-F647 HydrophobicContact CB-CE1 4.24Å; V617-F647 HydrophobicContact CG1-CE1 4.16Å; V617-F647 HydrophobicContact CG2-CE1 4.09Å
618	S	89.6	Confident	86.4	Confident	1 Å²	1	46 Å²	46	1%	0.007	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	147.6	164.9	-59.7	0	0	0	0	109.7	N214 E226 V602	N214-S618 PolarHBondContact ND2-OG 3.19Å; E226-S618 CarbonylContact O-C 3.41Å; E226-S618 WeakPolarHBondContact O-CA 3.32Å; E226-S618 WeakPolarHBondContact O-CB 3.38Å; V602-S618 PolarHBondContact N-O 3.47Å; V602-S618 PolarHBondContact O-N 3.17Å
619	V	89.7	Confident	85.4	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	140.2	-178.3	175.9	0	0	0	0	109.1	N225 E226 V599 F600 I601 F628 I632	N225-V619 CarbonylContact C-O 3.32Å; N225-V619 WeakPolarHBondContact CA-O 3.37Å; E226-V619 HydrophobicContact CB-CB 4.19Å; E226-V619 PolarHBondContact N-O 2.9Å; E226-V619 PolarHBondContact O-N 2.72Å; V599-V619 HydrophobicContact CG1-CG1 4.04Å; F600-V619 CarbonylContact O-C 3.6Å; F600-V619 WeakPolarHBondContact O-CA 3.45Å; I601-V619 HydrophobicContact CG1-CG2 4.31Å; I601-V619 HydrophobicContact CG2-CG2 4.35Å; V619-F628 HydrophobicContact CG1-CE1 4.28Å; V619-F628 HydrophobicContact CG1-CZ 3.67Å; V619-I632 HydrophobicContact CG2-CD1 4.21Å
620	S	90.3	Very high	84.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129.6	167.4	-154.5	0	0	0	0	109	I217 F223 N225 P589 V599 F600	I217-S620 VanDerWaalsContact CD1-CB 3.43Å; F223-S620 WeakPolarHBondContact CD1-OG 3.42Å; N225-S620 WeakPolarHBondContact OD1-CB 3.32Å; N225-S620 PolarHBondContact OD1-OG 3.4Å; P589-S620 WeakPolarHBondContact CG-OG 3.24Å; V599-S620 CarbonylContact C-O 3.16Å; V599-S620 VanDerWaalsContact CA-O 3.31Å; V599-S620 WeakPolarHBondContact CA-O 3.38Å; F600-S620 PolarHBondContact N-O 3.5Å; F600-S620 PolarHBondContact O-N 3.41Å
621	R	89.6	Confident	83.4	Confident	21 Å²	21	39.6 Å²	39.6	8%	0.079	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	140.1	176.3	58	174.5	-176.8	73.6	-11.1	110.1	F223 R224 E226 H598 V599 V625 P626 F628	F223-R621 CarbonylContact C-O 3.58Å; F223-R621 VanDerWaalsContact CA-O 3.25Å; F223-R621 WeakPolarHBondContact CA-O 3.47Å; F223-R621 WeakPolarHBondContact CD1-O 3.43Å; R224-R621 HydrophobicContact CB-CG 4.34Å; R224-R621 PolarHBondContact N-O 3.43Å; R224-R621 WeakPolarHBondContact O-CG 3.47Å; R224-R621 PolarHBondContact O-N 2.84Å; E226-R621 IonicContact OE1-NE 2.76Å; H598-R621 CarbonylContact O-C 3.58Å; H598-R621 WeakPolarHBondContact O-CA 3.48Å; V599-R621 HydrophobicContact CG2-CB 4.24Å; R621-V625 HydrophobicContact CB-CB 4.31Å; R621-V625 HydrophobicContact CB-CG1 4.42Å; R621-V625 WeakPolarHBondContact CD-O 3.46Å; R621-V625 PolarHBondContact NH1-O 3.16Å; R621-P626 WeakPolarHBondContact CD-O 3.45Å; R621-F628 HydrophobicContact CB-CE1 4.29Å
622	Y	89.2	Confident	83	Confident	61 Å²	61	31.5 Å²	31.5	24%	0.239	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	140.2	172.5	177.7	-99.2	0	0	0	109.2	F222 F223 H598 D624 V625	F222-Y622 HydrophobicContact CB-CE2 4.31Å; F222-Y622 VanDerWaalsContact O-CD2 3.24Å; F222-Y622 WeakPolarHBondContact O-CD2 3.4Å; F223-Y622 HydrophobicContact CE2-CD2 4.41Å; F223-Y622 HydrophobicContact CZ-CD2 4.46Å; H598-Y622 AromaticContact CD2-CD1 3.9Å; H598-Y622 AromaticContact CD2-CG 3.95Å; H598-Y622 PolarHBondContact O-N 2.99Å; Y622-D624 VanDerWaalsContact C-N 3.27Å; Y622-D624 HydrophobicContact CD1-CB 4.11Å; Y622-D624 HydrophobicContact CE1-CB 3.85Å; Y622-D624 VanDerWaalsContact CE1-OD2 3.26Å; Y622-D624 WeakPolarHBondContact CE1-OD2 3.26Å; Y622-D624 PolarHBondContact O-N 3.33Å; Y622-V625 HydrophobicContact CD1-CG2 4.48Å; Y622-V625 VanDerWaalsContact O-CB 3.25Å; Y622-V625 WeakPolarHBondContact O-CB 3.33Å; Y622-V625 WeakPolarHBondContact O-CG2 3.47Å; Y622-V625 PolarHBondContact O-N 2.87Å
623	K	86.4	Confident	82.2	Confident	72 Å²	72	24.8 Å²	24.8	31%	0.313	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-32.8	-161.4	63.1	174.4	-174.4	169.7	0	115.7	D207 F222 R224 V625	D207-K623 WeakPolarHBondContact OD2-CD 3.18Å; D207-K623 WeakPolarHBondContact OD2-CE 3.13Å; D207-K623 IonicContact OD2-NZ 3.41Å; D207-K623 PolarHBondContact OD2-NZ 3.49Å; F222-K623 PolarHBondContact O-N 2.68Å; R224-K623 HydrophobicContact CG-CB 4.19Å; K623-V625 VanDerWaalsContact C-N 3.26Å; K623-V625 PolarHBondContact O-N 3.45Å
624	D	82.8	Confident	81.3	Confident	78 Å²	78	30.4 Å²	30.4	42%	0.417	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-3	179.7	-54.7	-21.4	0	0	0	113.8	Y622 S679	Y622-D624 VanDerWaalsContact C-N 3.27Å; Y622-D624 HydrophobicContact CD1-CB 4.11Å; Y622-D624 HydrophobicContact CE1-CB 3.85Å; Y622-D624 VanDerWaalsContact CE1-OD2 3.26Å; Y622-D624 WeakPolarHBondContact CE1-OD2 3.26Å; Y622-D624 PolarHBondContact O-N 3.33Å; D624-S679 WeakPolarHBondContact O-CB 3.42Å
625	V	82.2	Confident	80.5	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.006	17%	0.173	C	C	.	.	S	Bend	trans	-89	127.9	175.5	-177.3	0	0	0	0	108.2	H598 R621 Y622 K623 A675 V676	H598-V625 HydrophobicContact CB-CG2 4.23Å; R621-V625 HydrophobicContact CB-CB 4.31Å; R621-V625 HydrophobicContact CB-CG1 4.42Å; R621-V625 WeakPolarHBondContact CD-O 3.46Å; R621-V625 PolarHBondContact NH1-O 3.16Å; Y622-V625 HydrophobicContact CD1-CG2 4.48Å; Y622-V625 VanDerWaalsContact O-CB 3.25Å; Y622-V625 WeakPolarHBondContact O-CB 3.33Å; Y622-V625 WeakPolarHBondContact O-CG2 3.47Å; Y622-V625 PolarHBondContact O-N 2.87Å; K623-V625 VanDerWaalsContact C-N 3.26Å; K623-V625 PolarHBondContact O-N 3.45Å; V625-A675 HydrophobicContact CG1-CB 3.92Å; V625-V676 HydrophobicContact CG1-CG2 3.85Å; V625-V676 HydrophobicContact CG2-CG2 3.85Å
626	P	76.7	Confident	79.6	Confident	41 Å²	41	36.4 Å²	36.4	27%	0.266	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-66	162.1	177.8	27.8	-34.1	0	0	0	112.3	R621 A675 V678	R621-P626 WeakPolarHBondContact CD-O 3.45Å; P626-A675 WeakPolarHBondContact CD-O 3.38Å; P626-A675 HydrophobicContact CG-CB 4.09Å; P626-V678 HydrophobicContact CG-CG1 4.42Å
627	A	79.5	Confident	79	Confident	14 Å²	14	35.4 Å²	35.4	12%	0.116	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-63.1	144.2	167.5	0	0	0	0	0	110.2	T276	T276-A627 HydrophobicContact CG2-CB 4.49Å
628	F	75.9	Confident	78.7	Confident	1 Å²	1	35.8 Å²	35.8	0%	0.004	19%	0.185	C	C	.	.			trans	-143.5	150	-170.1	63.2	-98.4	0	0	0	113.5	V599 V619 R621 N671 A672 A675	V599-F628 HydrophobicContact CG1-CE1 4.15Å; V599-F628 HydrophobicContact CG1-CZ 3.69Å; V599-F628 HydrophobicContact CG2-CE1 3.95Å; V599-F628 HydrophobicContact CG2-CZ 4.28Å; V619-F628 HydrophobicContact CG1-CE1 4.28Å; V619-F628 HydrophobicContact CG1-CZ 3.67Å; R621-F628 HydrophobicContact CB-CE1 4.29Å; F628-N671 HydrophobicContact CB-CB 4.33Å; F628-N671 HydrophobicContact CD2-CB 4.21Å; F628-A672 HydrophobicContact CD2-CB 4.04Å; F628-A672 HydrophobicContact CE1-CB 4.13Å; F628-A672 HydrophobicContact CE2-CB 3.46Å; F628-A672 VanDerWaalsContact CE2-CB 3.46Å; F628-A672 HydrophobicContact CZ-CB 3.51Å; F628-A675 HydrophobicContact CB-CB 3.76Å; F628-A675 HydrophobicContact CD1-CB 3.87Å; F628-A675 HydrophobicContact CG-CB 4.06Å
629	G	67.2	Low	78.4	Confident	11 Å²	11	38.5 Å²	38.5	11%	0.113	20%	0.203	C	C	.	.	S	Bend	trans	64.1	-176.5	-167.1	0	0	0	0	0	112.8	H278 E312	H278-G629 PolarHBondContact ND1-O 2.92Å; E312-G629 PolarHBondContact OE1-N 2.79Å
630	P	65.4	Low	78.1	Confident	4 Å²	4	44.6 Å²	44.6	3%	0.026	23%	0.225	C	C	.	.	S	Bend	trans	-64.1	164.4	170	30.2	-38.9	0	0	0	111.2	K651 T664	P630-K651 HydrophobicContact CG-CB 3.59Å; P630-K651 HydrophobicContact CG-CD 3.92Å; P630-K651 HydrophobicContact CG-CG 3.88Å; P630-K651 VanDerWaalsContact O-CD 3.27Å; P630-K651 WeakPolarHBondContact O-CD 3.31Å; P630-K651 WeakPolarHBondContact O-CE 3.22Å; P630-K651 PolarHBondContact O-NZ 3.22Å; P630-T664 HydrophobicContact CB-CG2 3.7Å; P630-T664 HydrophobicContact CG-CG2 4.29Å; P630-T664 WeakPolarHBondContact CG-OG1 3.3Å
631	P	69.4	Low	77.6	Confident	24 Å²	24	46.3 Å²	46.3	16%	0.156	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-62.5	166.1	176	26.7	-35.8	0	0	0	112.6	E230	E230-P631 HydrophobicContact CB-CB 4.33Å
632	I	74.7	Confident	76.9	Confident	6 Å²	6	49.3 Å²	49.3	3%	0.031	25%	0.252	C	S	.	.	P	Polyproline II helix	trans	-85.1	130.9	167.4	-57.3	-179.2	0	0	0	107.7	E226 G228 G229 E230 V619 E634	E226-I632 HydrophobicContact CB-CD1 3.96Å; E226-I632 HydrophobicContact CB-CG1 4.45Å; E226-I632 WeakPolarHBondContact O-CD1 3.48Å; G228-I632 WeakPolarHBondContact CA-O 3.39Å; G229-I632 PolarHBondContact N-O 2.74Å; E230-I632 PolarHBondContact OE2-N 2.75Å; V619-I632 HydrophobicContact CG2-CD1 4.21Å; I632-E634 PolarHBondContact O-N 2.78Å
633	P	70.8	Confident	76	Confident	26 Å²	26	49.9 Å²	49.9	17%	0.169	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-68.1	133.3	174.9	-12.8	27.4	0	0	0	110.2	V248 N635 Y636 F638	V248-P633 HydrophobicContact CG2-CB 4.21Å; P633-N635 PolarHBondContact O-N 2.83Å; P633-Y636 HydrophobicContact CB-CG 4.21Å; P633-Y636 WeakPolarHBondContact O-CB 3.49Å; P633-Y636 PolarHBondContact O-N 3.3Å; P633-F638 HydrophobicContact CG-CZ 4.38Å
634	E	69.7	Low	75.6	Confident	126 Å²	126	46.5 Å²	46.5	59%	0.589	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	136	-173.4	-151.5	-165.4	136.2	0	0	112.1	I632 Y636	I632-E634 PolarHBondContact O-N 2.78Å; E634-Y636 PolarHBondContact O-N 2.91Å
635	N	73.1	Confident	75.6	Confident	149 Å²	149	45.9 Å²	45.9	80%	0.797	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.6	18.3	179	-58.3	-60	0	0	0	115.6	P633	P633-N635 PolarHBondContact O-N 2.83Å
636	Y	71	Confident	74.9	Confident	83 Å²	83	46.3 Å²	46.3	33%	0.325	24%	0.236	S	C	.	.			trans	-88.7	120.2	-171	-169.1	-93	0	0	0	113.7	P633 E634 F638	P633-Y636 HydrophobicContact CB-CG 4.21Å; P633-Y636 WeakPolarHBondContact O-CB 3.49Å; P633-Y636 PolarHBondContact O-N 3.3Å; E634-Y636 PolarHBondContact O-N 2.91Å; Y636-F638 AromaticContact CD1-CD1 3.86Å; Y636-F638 HydrophobicContact CD1-CD1 3.86Å; Y636-F638 AromaticContact CD1-CD2 3.9Å; Y636-F638 HydrophobicContact CD1-CD2 3.9Å; Y636-F638 AromaticContact CD1-CE1 3.73Å; Y636-F638 HydrophobicContact CD1-CE1 3.73Å; Y636-F638 AromaticContact CD1-CE2 3.79Å; Y636-F638 HydrophobicContact CD1-CE2 3.79Å; Y636-F638 AromaticContact CD1-CG 3.91Å; Y636-F638 HydrophobicContact CD1-CG 3.91Å; Y636-F638 AromaticContact CD1-CZ 3.67Å; Y636-F638 HydrophobicContact CD1-CZ 3.67Å; Y636-F638 HydrophobicContact CE1-CB 4.39Å; Y636-F638 AromaticContact CE1-CD1 3.53Å; Y636-F638 HydrophobicContact CE1-CD1 3.53Å; Y636-F638 HydrophobicContact CE1-CD2 4.32Å; Y636-F638 AromaticContact CE1-CE1 3.68Å; Y636-F638 HydrophobicContact CE1-CE1 3.68Å; Y636-F638 HydrophobicContact CE1-CE2 4.45Å; Y636-F638 AromaticContact CE1-CG 3.85Å; Y636-F638 HydrophobicContact CE1-CG 3.85Å; Y636-F638 HydrophobicContact CE1-CZ 4.13Å
637	G	78	Confident	74.7	Confident	14 Å²	14	44.8 Å²	44.8	14%	0.144	23%	0.225	C	C	.	.			trans	-96.9	111.2	170.9	0	0	0	0	0	111.8	K614	K614-G637 WeakPolarHBondContact CD-O 3.31Å
638	F	81.8	Confident	74.5	Confident	17 Å²	17	44.1 Å²	44.1	8%	0.075	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	126.7	-177.6	-65.5	-92.5	0	0	0	111.6	K614 Y615 V617 P633 Y636 F644 F647	K614-F638 CarbonylContact C-O 3.48Å; K614-F638 WeakPolarHBondContact CA-O 3.44Å; Y615-F638 PolarHBondContact N-O 2.82Å; Y615-F638 WeakPolarHBondContact O-CD2 3.4Å; Y615-F638 PolarHBondContact O-N 3.44Å; V617-F638 HydrophobicContact CG2-CD2 4.15Å; V617-F638 HydrophobicContact CG2-CE2 4.35Å; P633-F638 HydrophobicContact CG-CZ 4.38Å; Y636-F638 AromaticContact CD1-CD1 3.86Å; Y636-F638 HydrophobicContact CD1-CD1 3.86Å; Y636-F638 AromaticContact CD1-CD2 3.9Å; Y636-F638 HydrophobicContact CD1-CD2 3.9Å; Y636-F638 AromaticContact CD1-CE1 3.73Å; Y636-F638 HydrophobicContact CD1-CE1 3.73Å; Y636-F638 AromaticContact CD1-CE2 3.79Å; Y636-F638 HydrophobicContact CD1-CE2 3.79Å; Y636-F638 AromaticContact CD1-CG 3.91Å; Y636-F638 HydrophobicContact CD1-CG 3.91Å; Y636-F638 AromaticContact CD1-CZ 3.67Å; Y636-F638 HydrophobicContact CD1-CZ 3.67Å; Y636-F638 HydrophobicContact CE1-CB 4.39Å; Y636-F638 AromaticContact CE1-CD1 3.53Å; Y636-F638 HydrophobicContact CE1-CD1 3.53Å; Y636-F638 HydrophobicContact CE1-CD2 4.32Å; Y636-F638 AromaticContact CE1-CE1 3.68Å; Y636-F638 HydrophobicContact CE1-CE1 3.68Å; Y636-F638 HydrophobicContact CE1-CE2 4.45Å; Y636-F638 AromaticContact CE1-CG 3.85Å; Y636-F638 HydrophobicContact CE1-CG 3.85Å; Y636-F638 HydrophobicContact CE1-CZ 4.13Å; F638-F644 HydrophobicContact CB-CB 4.17Å; F638-F644 HydrophobicContact CB-CD2 3.29Å; F638-F644 HydrophobicContact CB-CE2 3.86Å; F638-F644 HydrophobicContact CB-CG 3.89Å; F638-F644 HydrophobicContact CD1-CD2 4.12Å; F638-F644 HydrophobicContact CD2-CD2 4.27Å; F638-F644 HydrophobicContact CD2-CE2 4.3Å; F638-F644 AromaticContact CG-CD2 3.64Å; F638-F644 HydrophobicContact CG-CD2 3.64Å; F638-F644 HydrophobicContact CG-CE2 4.11Å; F638-F647 HydrophobicContact CD1-CD2 4.11Å; F638-F647 HydrophobicContact CD1-CG 4.19Å; F638-F647 HydrophobicContact CE1-CD1 4.37Å; F638-F647 AromaticContact CE1-CD2 3.33Å; F638-F647 HydrophobicContact CE1-CD2 3.33Å; F638-F647 HydrophobicContact CE1-CE1 4.47Å; F638-F647 AromaticContact CE1-CE2 3.45Å; F638-F647 HydrophobicContact CE1-CE2 3.45Å; F638-F647 VanDerWaalsContact CE1-CE2 3.45Å; F638-F647 AromaticContact CE1-CG 3.84Å; F638-F647 HydrophobicContact CE1-CG 3.84Å; F638-F647 HydrophobicContact CE1-CZ 4.04Å; F638-F647 HydrophobicContact CE2-CD1 4.39Å; F638-F647 HydrophobicContact CE2-CD2 4.45Å; F638-F647 AromaticContact CE2-CE1 3.94Å; F638-F647 HydrophobicContact CE2-CE1 3.94Å; F638-F647 AromaticContact CE2-CE2 4Å; F638-F647 HydrophobicContact CE2-CE2 4Å; F638-F647 AromaticContact CE2-CZ 3.72Å; F638-F647 HydrophobicContact CE2-CZ 3.72Å; F638-F647 HydrophobicContact CZ-CD1 4.26Å; F638-F647 AromaticContact CZ-CD2 3.56Å; F638-F647 HydrophobicContact CZ-CD2 3.56Å; F638-F647 AromaticContact CZ-CE1 3.91Å; F638-F647 HydrophobicContact CZ-CE1 3.91Å; F638-F647 AromaticContact CZ-CE2 3.13Å; F638-F647 HydrophobicContact CZ-CE2 3.13Å; F638-F647 HydrophobicContact CZ-CG 4.11Å; F638-F647 AromaticContact CZ-CZ 3.34Å; F638-F647 HydrophobicContact CZ-CZ 3.34Å
639	P	84.3	Confident	74.4	Confident	59 Å²	59	44.1 Å²	44.1	38%	0.383	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	157.9	174.3	30	-35.2	0	0	0	111.5	S641 F644	P639-S641 PolarHBondContact O-N 2.84Å; P639-F644 WeakPolarHBondContact O-CB 3.4Å
640	R	82.9	Confident	74	Confident	128 Å²	128	43.6 Å²	43.6	48%	0.483	22%	0.215	S	C	.	.	S	Bend	trans	-65.2	103.3	168.8	173.3	170.5	-177.1	-157.7	-1.9	110.2	E504 I508 V613 Y615	E504-R640 WeakPolarHBondContact OE1-CD 3.16Å; E504-R640 IonicContact OE1-CZ 3.32Å; E504-R640 IonicContact OE1-NE 2.88Å; E504-R640 IonicContact OE1-NH1 2.79Å; E504-R640 PolarHBondContact OE1-NH1 2.81Å; I508-R640 HydrophobicContact CD1-CB 4.48Å; I508-R640 HydrophobicContact CD1-CG 3.8Å; I508-R640 HydrophobicContact CG1-CG 4.42Å; V613-R640 HydrophobicContact CG1-CB 3.48Å; V613-R640 VanDerWaalsContact CG1-CB 3.48Å; V613-R640 HydrophobicContact CG1-CG 4.43Å; Y615-R640 HydrophobicContact CE2-CB 4.08Å
641	S	79.2	Confident	73	Confident	37 Å²	37	43.4 Å²	43.4	26%	0.259	21%	0.214	S	C	.	.	S	Bend	trans	-156.1	173.4	178.5	80.3	0	0	0	0	112.6	P639 E643 F644 R645	P639-S641 PolarHBondContact O-N 2.84Å; S641-E643 WeakPolarHBondContact CB-OE2 3.4Å; S641-E643 PolarHBondContact O-N 3.41Å; S641-E643 WeakPolarHBondContact OG-CB 3.35Å; S641-E643 PolarHBondContact OG-N 2.98Å; S641-E643 PolarHBondContact OG-OE2 2.82Å; S641-F644 PolarHBondContact O-N 2.81Å; S641-F644 PolarHBondContact OG-N 2.87Å; S641-R645 PolarHBondContact O-N 2.93Å
642	Q	75.7	Confident	71	Confident	83 Å²	83	42.4 Å²	42.4	39%	0.388	21%	0.208	S	C	.	.	H	α-helix	trans	-64.8	-28.2	176.1	175.4	60.7	28.2	0	0	111.3	R645 E646	Q642-R645 WeakPolarHBondContact O-CB 3.43Å; Q642-R645 PolarHBondContact O-N 2.96Å; Q642-E646 PolarHBondContact NE2-OE1 3.37Å; Q642-E646 VanDerWaalsContact O-CB 3.29Å; Q642-E646 WeakPolarHBondContact O-CB 3.28Å; Q642-E646 WeakPolarHBondContact O-CG 3.4Å; Q642-E646 PolarHBondContact O-N 2.82Å
643	E	68.4	Low	68.8	Low	73 Å²	73	44.5 Å²	44.5	34%	0.341	22%	0.218	S	C	.	.	H	α-helix	trans	-68.3	-32.7	175.8	-61.3	68.5	-147.1	0	0	112	S641 F647 I653	S641-E643 WeakPolarHBondContact CB-OE2 3.4Å; S641-E643 PolarHBondContact O-N 3.41Å; S641-E643 WeakPolarHBondContact OG-CB 3.35Å; S641-E643 PolarHBondContact OG-N 2.98Å; S641-E643 PolarHBondContact OG-OE2 2.82Å; E643-F647 WeakPolarHBondContact O-CB 3.46Å; E643-F647 PolarHBondContact O-N 2.97Å; E643-I653 HydrophobicContact CB-CD1 3.66Å; E643-I653 HydrophobicContact CB-CG1 3.9Å; E643-I653 HydrophobicContact CG-CD1 3.8Å; E643-I653 HydrophobicContact CG-CG1 4.14Å; E643-I653 HydrophobicContact CG-CG2 4.09Å
644	F	78.7	Confident	66.8	Low	1 Å²	1	45.7 Å²	45.7	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-80.5	-36.8	171.9	177.2	-112.7	0	0	0	112.9	F505 I508 V603 Y615 V617 F638 P639 S641 E646 F647 L648	F505-F644 HydrophobicContact CE2-CE1 4.37Å; I508-F644 HydrophobicContact CG2-CD1 4.18Å; V603-F644 HydrophobicContact CG1-CZ 4.05Å; Y615-F644 HydrophobicContact CD1-CE1 4.1Å; Y615-F644 HydrophobicContact CD1-CZ 4.27Å; Y615-F644 AromaticContact CD2-CD1 3.47Å; Y615-F644 HydrophobicContact CD2-CD1 3.47Å; Y615-F644 VanDerWaalsContact CD2-CD1 3.47Å; Y615-F644 AromaticContact CD2-CE1 3.18Å; Y615-F644 HydrophobicContact CD2-CE1 3.18Å; Y615-F644 HydrophobicContact CD2-CG 4.26Å; Y615-F644 AromaticContact CD2-CZ 3.76Å; Y615-F644 HydrophobicContact CD2-CZ 3.76Å; Y615-F644 AromaticContact CE2-CD1 3.94Å; Y615-F644 HydrophobicContact CE2-CD1 3.94Å; Y615-F644 AromaticContact CE2-CE1 3.75Å; Y615-F644 HydrophobicContact CE2-CE1 3.75Å; Y615-F644 HydrophobicContact CG-CD1 4.13Å; Y615-F644 AromaticContact CG-CE1 3.37Å; Y615-F644 HydrophobicContact CG-CE1 3.37Å; Y615-F644 HydrophobicContact CG-CE2 4.36Å; Y615-F644 AromaticContact CG-CZ 3.51Å; Y615-F644 HydrophobicContact CG-CZ 3.51Å; V617-F644 HydrophobicContact CG2-CE2 3.94Å; V617-F644 HydrophobicContact CG2-CZ 4.47Å; F638-F644 HydrophobicContact CB-CB 4.17Å; F638-F644 HydrophobicContact CB-CD2 3.29Å; F638-F644 HydrophobicContact CB-CE2 3.86Å; F638-F644 HydrophobicContact CB-CG 3.89Å; F638-F644 HydrophobicContact CD1-CD2 4.12Å; F638-F644 HydrophobicContact CD2-CD2 4.27Å; F638-F644 HydrophobicContact CD2-CE2 4.3Å; F638-F644 AromaticContact CG-CD2 3.64Å; F638-F644 HydrophobicContact CG-CD2 3.64Å; F638-F644 HydrophobicContact CG-CE2 4.11Å; P639-F644 WeakPolarHBondContact O-CB 3.4Å; S641-F644 PolarHBondContact O-N 2.81Å; S641-F644 PolarHBondContact OG-N 2.87Å; F644-E646 VanDerWaalsContact C-N 3.28Å; F644-E646 PolarHBondContact O-N 2.73Å; F644-F647 HydrophobicContact CD2-CB 4.06Å; F644-F647 HydrophobicContact CD2-CD1 4.3Å; F644-F647 HydrophobicContact CD2-CG 4.46Å; F644-F647 HydrophobicContact CE2-CD1 4.25Å; F644-F647 WeakPolarHBondContact O-CA 3.09Å; F644-F647 WeakPolarHBondContact O-CB 3.27Å; F644-F647 PolarHBondContact O-N 3.2Å; F644-L648 HydrophobicContact CE1-CD1 3.68Å; F644-L648 HydrophobicContact CE1-CG 4.31Å; F644-L648 HydrophobicContact CE2-CD1 4.15Å; F644-L648 HydrophobicContact CE2-CD2 4.18Å; F644-L648 HydrophobicContact CE2-CG 3.94Å; F644-L648 HydrophobicContact CZ-CD1 3.48Å; F644-L648 VanDerWaalsContact CZ-CD1 3.48Å; F644-L648 HydrophobicContact CZ-CD2 4.14Å; F644-L648 HydrophobicContact CZ-CG 3.79Å; F644-L648 PolarHBondContact O-N 3Å
645	R	82.3	Confident	64.6	Low	66 Å²	66	47.3 Å²	47.3	25%	0.249	24%	0.235	C	C	.	.	H	α-helix	trans	-56.3	-48.4	168.8	172.6	170.2	-165.5	-133.1	-4.3	110.7	I508 L509 T539 S641 Q642 L649	I508-R645 HydrophobicContact CG2-CB 3.79Å; I508-R645 HydrophobicContact CG2-CG 4.4Å; I508-R645 WeakPolarHBondContact O-CD 3.2Å; I508-R645 WeakPolarHBondContact O-CG 3.41Å; I508-R645 PolarHBondContact O-NE 2.85Å; L509-R645 PolarHBondContact O-NH2 3.46Å; T539-R645 PolarHBondContact OG1-NH2 3.36Å; T539-R645 VanDerWaalsContact OG1-NH2 3.09Å; S641-R645 PolarHBondContact O-N 2.93Å; Q642-R645 WeakPolarHBondContact O-CB 3.43Å; Q642-R645 PolarHBondContact O-N 2.96Å; R645-L649 HydrophobicContact CG-CD1 4.37Å; R645-L649 WeakPolarHBondContact O-CG 3.19Å; R645-L649 PolarHBondContact O-N 2.85Å
646	E	68.2	Low	62.4	Low	9 Å²	9	49.6 Å²	49.6	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-54.9	-60.2	167.9	-78.2	163	-173.5	0	0	106.6	Y541 Q642 F644 L648 L649 T650 A654	Y541-E646 HydrophobicContact CE2-CG 4.29Å; Q642-E646 PolarHBondContact NE2-OE1 3.37Å; Q642-E646 VanDerWaalsContact O-CB 3.29Å; Q642-E646 WeakPolarHBondContact O-CB 3.28Å; Q642-E646 WeakPolarHBondContact O-CG 3.4Å; Q642-E646 PolarHBondContact O-N 2.82Å; F644-E646 VanDerWaalsContact C-N 3.28Å; F644-E646 PolarHBondContact O-N 2.73Å; E646-L648 VanDerWaalsContact C-N 3.26Å; E646-L648 CarbonylContact O-C 3.58Å; E646-L648 PolarHBondContact O-N 3.34Å; E646-L649 CarbonylContact O-C 3.47Å; E646-L649 WeakPolarHBondContact O-CA 3.47Å; E646-L649 PolarHBondContact O-N 3.3Å; E646-T650 VanDerWaalsContact C-C 3.47Å; E646-T650 CarbonylContact C-O 3.58Å; E646-T650 CarbonylContact O-C 3.54Å; E646-T650 WeakPolarHBondContact O-CA 3.41Å; E646-T650 WeakPolarHBondContact O-CB 3.44Å; E646-T650 PolarHBondContact O-N 3.03Å; E646-A654 WeakPolarHBondContact OE2-CA 3.39Å; E646-A654 PolarHBondContact OE2-N 3.44Å
647	F	72	Confident	60.2	Low	9 Å²	9	49.9 Å²	49.9	4%	0.039	26%	0.257	C	S	.	.	H	α-helix	trans	-40.3	-42.7	-177.7	-170.7	-85.9	0	0	0	117.1	V617 F638 E643 F644 T650 K651 C668	V617-F647 HydrophobicContact CB-CE1 4.24Å; V617-F647 HydrophobicContact CG1-CE1 4.16Å; V617-F647 HydrophobicContact CG2-CE1 4.09Å; F638-F647 HydrophobicContact CD1-CD2 4.11Å; F638-F647 HydrophobicContact CD1-CG 4.19Å; F638-F647 HydrophobicContact CE1-CD1 4.37Å; F638-F647 AromaticContact CE1-CD2 3.33Å; F638-F647 HydrophobicContact CE1-CD2 3.33Å; F638-F647 HydrophobicContact CE1-CE1 4.47Å; F638-F647 AromaticContact CE1-CE2 3.45Å; F638-F647 HydrophobicContact CE1-CE2 3.45Å; F638-F647 VanDerWaalsContact CE1-CE2 3.45Å; F638-F647 AromaticContact CE1-CG 3.84Å; F638-F647 HydrophobicContact CE1-CG 3.84Å; F638-F647 HydrophobicContact CE1-CZ 4.04Å; F638-F647 HydrophobicContact CE2-CD1 4.39Å; F638-F647 HydrophobicContact CE2-CD2 4.45Å; F638-F647 AromaticContact CE2-CE1 3.94Å; F638-F647 HydrophobicContact CE2-CE1 3.94Å; F638-F647 AromaticContact CE2-CE2 4Å; F638-F647 HydrophobicContact CE2-CE2 4Å; F638-F647 AromaticContact CE2-CZ 3.72Å; F638-F647 HydrophobicContact CE2-CZ 3.72Å; F638-F647 HydrophobicContact CZ-CD1 4.26Å; F638-F647 AromaticContact CZ-CD2 3.56Å; F638-F647 HydrophobicContact CZ-CD2 3.56Å; F638-F647 AromaticContact CZ-CE1 3.91Å; F638-F647 HydrophobicContact CZ-CE1 3.91Å; F638-F647 AromaticContact CZ-CE2 3.13Å; F638-F647 HydrophobicContact CZ-CE2 3.13Å; F638-F647 HydrophobicContact CZ-CG 4.11Å; F638-F647 AromaticContact CZ-CZ 3.34Å; F638-F647 HydrophobicContact CZ-CZ 3.34Å; E643-F647 WeakPolarHBondContact O-CB 3.46Å; E643-F647 PolarHBondContact O-N 2.97Å; F644-F647 HydrophobicContact CD2-CB 4.06Å; F644-F647 HydrophobicContact CD2-CD1 4.3Å; F644-F647 HydrophobicContact CD2-CG 4.46Å; F644-F647 HydrophobicContact CE2-CD1 4.25Å; F644-F647 WeakPolarHBondContact O-CA 3.09Å; F644-F647 WeakPolarHBondContact O-CB 3.27Å; F644-F647 PolarHBondContact O-N 3.2Å; F647-T650 VanDerWaalsContact CA-C 3.49Å; F647-T650 WeakPolarHBondContact CA-O 3.07Å; F647-T650 PolarHBondContact N-O 2.8Å; F647-T650 CarbonylContact O-C 3.59Å; F647-T650 PolarHBondContact O-N 3.18Å; F647-K651 HydrophobicContact CD2-CB 4.21Å; F647-K651 HydrophobicContact CD2-CG 3.74Å; F647-K651 HydrophobicContact CE1-CG 4.15Å; F647-K651 HydrophobicContact CE2-CB 4.19Å; F647-K651 HydrophobicContact CE2-CD 4.39Å; F647-K651 HydrophobicContact CE2-CG 3.25Å; F647-K651 HydrophobicContact CG-CG 4.36Å; F647-K651 HydrophobicContact CZ-CD 4.29Å; F647-K651 HydrophobicContact CZ-CG 3.5Å; F647-K651 VanDerWaalsContact CZ-CG 3.5Å; F647-K651 VanDerWaalsContact O-CA 3.31Å; F647-K651 WeakPolarHBondContact O-CA 3.16Å; F647-K651 PolarHBondContact O-N 2.72Å; F647-C668 WeakPolarHBondContact O-CB 3.41Å
648	L	76.7	Confident	57.6	Low	0 Å²	0	55.2 Å²	55.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-75.4	-46.3	177.2	-66.3	174.2	0	0	0	113.3	F505 L509 I601 V603 F644 E646 T650 L669	F505-L648 HydrophobicContact CE2-CD1 3.42Å; F505-L648 VanDerWaalsContact CE2-CD1 3.42Å; F505-L648 HydrophobicContact CZ-CD1 3.72Å; L509-L648 HydrophobicContact CD2-CB 4.15Å; L509-L648 HydrophobicContact CD2-CD1 3.9Å; I601-L648 HydrophobicContact CG2-CD2 4.34Å; V603-L648 HydrophobicContact CG2-CD2 3.77Å; F644-L648 HydrophobicContact CE1-CD1 3.68Å; F644-L648 HydrophobicContact CE1-CG 4.31Å; F644-L648 HydrophobicContact CE2-CD1 4.15Å; F644-L648 HydrophobicContact CE2-CD2 4.18Å; F644-L648 HydrophobicContact CE2-CG 3.94Å; F644-L648 HydrophobicContact CZ-CD1 3.48Å; F644-L648 VanDerWaalsContact CZ-CD1 3.48Å; F644-L648 HydrophobicContact CZ-CD2 4.14Å; F644-L648 HydrophobicContact CZ-CG 3.79Å; F644-L648 PolarHBondContact O-N 3Å; E646-L648 VanDerWaalsContact C-N 3.26Å; E646-L648 CarbonylContact O-C 3.58Å; E646-L648 PolarHBondContact O-N 3.34Å; L648-T650 PolarHBondContact O-N 2.68Å; L648-L669 WeakPolarHBondContact O-CD1 3.34Å; L648-L669 WeakPolarHBondContact O-CG 3.48Å; L648-L669 PolarHBondContact O-N 3.18Å
649	L	72.6	Confident	54.9	Low	1 Å²	1	59.5 Å²	59.5	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-64.6	-27.8	170.6	-54.4	-179.1	0	0	0	111.2	T539 I546 F548 R645 E646 H667 L669	T539-L649 HydrophobicContact CG2-CD1 4.04Å; T539-L649 HydrophobicContact CG2-CD2 3.91Å; I546-L649 HydrophobicContact CD1-CD2 4.09Å; F548-L649 HydrophobicContact CZ-CD2 3.92Å; R645-L649 HydrophobicContact CG-CD1 4.37Å; R645-L649 WeakPolarHBondContact O-CG 3.19Å; R645-L649 PolarHBondContact O-N 2.85Å; E646-L649 CarbonylContact O-C 3.47Å; E646-L649 WeakPolarHBondContact O-CA 3.47Å; E646-L649 PolarHBondContact O-N 3.3Å; L649-H667 CarbonylContact O-C 3.54Å; L649-L669 HydrophobicContact CD2-CD1 4.14Å
650	T	59.1	Low	52.1	Low	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.327	C	S	.	.	S	Bend	trans	-178.9	85.5	-150.9	-65.3	0	0	0	0	112	Y541 E646 F647 L648 G652 S666 H667	Y541-T650 HydrophobicContact CE1-CG2 4.02Å; Y541-T650 WeakPolarHBondContact CE1-OG1 3.43Å; E646-T650 VanDerWaalsContact C-C 3.47Å; E646-T650 CarbonylContact C-O 3.58Å; E646-T650 CarbonylContact O-C 3.54Å; E646-T650 WeakPolarHBondContact O-CA 3.41Å; E646-T650 WeakPolarHBondContact O-CB 3.44Å; E646-T650 PolarHBondContact O-N 3.03Å; F647-T650 VanDerWaalsContact CA-C 3.49Å; F647-T650 WeakPolarHBondContact CA-O 3.07Å; F647-T650 PolarHBondContact N-O 2.8Å; F647-T650 CarbonylContact O-C 3.59Å; F647-T650 PolarHBondContact O-N 3.18Å; L648-T650 PolarHBondContact O-N 2.68Å; T650-G652 VanDerWaalsContact C-N 3.28Å; T650-G652 WeakPolarHBondContact CG2-O 3.39Å; T650-G652 CarbonylContact O-C 3.58Å; T650-G652 WeakPolarHBondContact O-CA 3.27Å; T650-G652 PolarHBondContact O-N 2.98Å; T650-S666 CarbonylContact C-O 3.58Å; T650-S666 WeakPolarHBondContact CA-O 3.18Å; T650-H667 HydrophobicContact CG2-CB 4.42Å; T650-H667 VanDerWaalsContact CG2-CD2 3.4Å; T650-H667 WeakPolarHBondContact CG2-CD2 3.41Å; T650-H667 VanDerWaalsContact OG1-CG 3.26Å; T650-H667 PolarHBondContact OG1-ND1 2.84Å
651	K	43.8	Very low	49.4	Very low	1 Å²	1	57.6 Å²	57.6	0%	0.004	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-28.3	70.1	173	-124.3	163.6	174.3	-174.7	0	115.5	E226 P630 F647 T664 S666 C668	E226-K651 IonicContact OE2-NZ 3.88Å; E226-K651 PolarHBondContact OE2-NZ 3.2Å; P630-K651 HydrophobicContact CG-CB 3.59Å; P630-K651 HydrophobicContact CG-CD 3.92Å; P630-K651 HydrophobicContact CG-CG 3.88Å; P630-K651 VanDerWaalsContact O-CD 3.27Å; P630-K651 WeakPolarHBondContact O-CD 3.31Å; P630-K651 WeakPolarHBondContact O-CE 3.22Å; P630-K651 PolarHBondContact O-NZ 3.22Å; F647-K651 HydrophobicContact CD2-CB 4.21Å; F647-K651 HydrophobicContact CD2-CG 3.74Å; F647-K651 HydrophobicContact CE1-CG 4.15Å; F647-K651 HydrophobicContact CE2-CB 4.19Å; F647-K651 HydrophobicContact CE2-CD 4.39Å; F647-K651 HydrophobicContact CE2-CG 3.25Å; F647-K651 HydrophobicContact CG-CG 4.36Å; F647-K651 HydrophobicContact CZ-CD 4.29Å; F647-K651 HydrophobicContact CZ-CG 3.5Å; F647-K651 VanDerWaalsContact CZ-CG 3.5Å; F647-K651 VanDerWaalsContact O-CA 3.31Å; F647-K651 WeakPolarHBondContact O-CA 3.16Å; F647-K651 PolarHBondContact O-N 2.72Å; K651-T664 CarbonylContact O-C 3.48Å; K651-S666 WeakPolarHBondContact CA-O 3.43Å; K651-S666 WeakPolarHBondContact CB-O 3.39Å; K651-S666 PolarHBondContact N-O 3.03Å; K651-S666 PolarHBondContact O-N 3.07Å; K651-C668 HydrophobicContact CB-CB 3.95Å; K651-C668 HydrophobicContact CD-CB 4.31Å; K651-C668 HydrophobicContact CG-CB 4.22Å
652	G	26.9	Very low	47	Very low	3 Å²	3	58 Å²	58	3%	0.031	31%	0.313	C	S	.	.	S	Bend	trans	80.2	178.1	-173.7	0	0	0	0	0	114.5	T650 T664 N665 S666	T650-G652 VanDerWaalsContact C-N 3.28Å; T650-G652 WeakPolarHBondContact CG2-O 3.39Å; T650-G652 CarbonylContact O-C 3.58Å; T650-G652 WeakPolarHBondContact O-CA 3.27Å; T650-G652 PolarHBondContact O-N 2.98Å; G652-T664 CarbonylContact C-O 3.46Å; G652-T664 WeakPolarHBondContact CA-O 3.44Å; G652-N665 VanDerWaalsContact C-CA 3.5Å; G652-N665 CarbonylContact O-C 3.54Å; G652-N665 WeakPolarHBondContact O-CA 3.23Å; G652-N665 PolarHBondContact O-OD1 2.88Å; G652-S666 PolarHBondContact O-N 3.48Å
653	I	29.4	Very low	44.7	Very low	50 Å²	50	57.8 Å²	57.8	26%	0.256	31%	0.311	S	S	.	.			cis	-160.6	116.5	-34.5	-78.2	-143.4	0	0	0	108.1	E643 F663 T664 N665	E643-I653 HydrophobicContact CB-CD1 3.66Å; E643-I653 HydrophobicContact CB-CG1 3.9Å; E643-I653 HydrophobicContact CG-CD1 3.8Å; E643-I653 HydrophobicContact CG-CG1 4.14Å; E643-I653 HydrophobicContact CG-CG2 4.09Å; I653-F663 HydrophobicContact CB-CB 4.06Å; I653-F663 HydrophobicContact CD1-CB 3.57Å; I653-F663 HydrophobicContact CD1-CD1 4.5Å; I653-F663 HydrophobicContact CD1-CD2 4.32Å; I653-F663 HydrophobicContact CD1-CG 3.89Å; I653-F663 HydrophobicContact CG1-CB 3.81Å; I653-F663 HydrophobicContact CG2-CB 4.34Å; I653-T664 PolarHBondContact N-O 3.24Å; I653-N665 VanDerWaalsContact C-OD1 3.28Å; I653-N665 PolarHBondContact N-OD1 3.09Å; I653-N665 PolarHBondContact O-ND2 3.17Å; I653-N665 PolarHBondContact O-OD1 3.25Å
654	A	29.6	Very low	43	Very low	50 Å²	50	55.3 Å²	55.3	41%	0.413	30%	0.301	S	S	.	.			trans	86	128.1	155.2	0	0	0	0	0	122.1	E646	E646-A654 WeakPolarHBondContact OE2-CA 3.39Å; E646-A654 PolarHBondContact OE2-N 3.44Å
655	K	23.3	Very low	40.7	Very low	160 Å²	160	56.3 Å²	56.3	70%	0.696	31%	0.306	S	S	*	.	S	Bend	trans	-112	82.7	150	-83.3	-173.1	174.3	178.5	0	112.3
656	K	25.7	Very low	38.8	Very low	197 Å²	197	53.5 Å²	53.5	86%	0.857	30%	0.297	S	S	*	.	S	Bend	trans	170.1	135.3	134.7	-96.6	163.5	-177.6	-179.5	0	113.7
657	A	24.7	Very low	38.2	Very low	89 Å²	89	53.1 Å²	53.1	74%	0.736	30%	0.295	S	S	*	.			trans	61	115.5	143.9	0	0	0	0	0	120.9
658	V	23.9	Very low	37.7	Very low	127 Å²	127	52.8 Å²	52.8	77%	0.77	29%	0.294	S	S	*	.	S	Bend	trans	72.2	102.8	144.9	-174.5	0	0	0	0	118	I660	V658-I660 PolarHBondContact O-N 3.32Å
659	V	25.5	Very low	37.7	Very low	107 Å²	107	52.9 Å²	52.9	65%	0.648	30%	0.295	S	S	*	.			trans	52.9	54.9	146.5	-162.9	0	0	0	0	116.3
660	I	26.3	Very low	37.9	Very low	127 Å²	127	52.9 Å²	52.9	65%	0.651	29%	0.294	S	S	*	.			trans	-126.5	130	152.4	-57.5	177.1	0	0	0	107.1	V658 I956	V658-I660 PolarHBondContact O-N 3.32Å; I660-I956 HydrophobicContact CD1-CD1 4.04Å; I660-I956 HydrophobicContact CG1-CD1 4.02Å; I660-I956 HydrophobicContact CG2-CD1 3.96Å; I660-I956 HydrophobicContact CG2-CG1 4.34Å
661	S	26	Very low	38.7	Very low	19 Å²	19	52.9 Å²	52.9	13%	0.133	30%	0.295	C	S	.	.			trans	-107.9	145	-173.7	-156.1	0	0	0	0	110.2	Y304 R305	Y304-S661 PolarHBondContact O-OG 3.29Å; R305-S661 VanDerWaalsContact CD-OG 3.28Å; R305-S661 WeakPolarHBondContact CD-OG 3.42Å
662	C	27.3	Very low	40.5	Very low	46 Å²	46	52.9 Å²	52.9	31%	0.311	29%	0.294	S	S	.	.			trans	55.4	88.7	-176.2	-67.4	0	0	0	0	115	V953	C662-V953 HydrophobicContact CB-CG1 3.47Å; C662-V953 VanDerWaalsContact CB-CG1 3.47Å; C662-V953 VanDerWaalsContact SG-CG1 3.59Å
663	F	27.9	Very low	43.1	Very low	78 Å²	78	53.6 Å²	53.6	34%	0.342	30%	0.297	S	S	.	.				-127.3	157.6	103.9	-96.3	-84.9	0	0	0	109.1	I653 P955	I653-F663 HydrophobicContact CB-CB 4.06Å; I653-F663 HydrophobicContact CD1-CB 3.57Å; I653-F663 HydrophobicContact CD1-CD1 4.5Å; I653-F663 HydrophobicContact CD1-CD2 4.32Å; I653-F663 HydrophobicContact CD1-CG 3.89Å; I653-F663 HydrophobicContact CG1-CB 3.81Å; I653-F663 HydrophobicContact CG2-CB 4.34Å; F663-P955 HydrophobicContact CE2-CB 3.97Å; F663-P955 HydrophobicContact CE2-CG 4.33Å; F663-P955 HydrophobicContact CZ-CB 4.35Å; F663-P955 HydrophobicContact CZ-CG 4.38Å
664	T	32.4	Very low	45.3	Very low	21 Å²	21	51.8 Å²	51.8	13%	0.129	29%	0.288	C	S	.	.			trans	-69.1	163.2	178.3	44.6	0	0	0	0	111.3	W246 P281 P630 K651 G652 I653	W246-T664 HydrophobicContact CH2-CG2 4.09Å; W246-T664 HydrophobicContact CZ3-CG2 4.12Å; P281-T664 HydrophobicContact CG-CG2 4.24Å; P630-T664 HydrophobicContact CB-CG2 3.7Å; P630-T664 HydrophobicContact CG-CG2 4.29Å; P630-T664 WeakPolarHBondContact CG-OG1 3.3Å; K651-T664 CarbonylContact O-C 3.48Å; G652-T664 CarbonylContact C-O 3.46Å; G652-T664 WeakPolarHBondContact CA-O 3.44Å; I653-T664 PolarHBondContact N-O 3.24Å
665	N	30.2	Very low	47.6	Very low	22 Å²	22	49.8 Å²	49.8	12%	0.118	27%	0.271	C	S	.	.			trans	-135.7	26	-160.2	-138.3	-24	0	0	0	114.6	Q308 L309 G652 I653	Q308-N665 CarbonylContact O-C 3.56Å; Q308-N665 PolarHBondContact O-N 2.71Å; L309-N665 VanDerWaalsContact CA-O 3.27Å; L309-N665 WeakPolarHBondContact CA-O 2.99Å; L309-N665 HydrophobicContact CB-CB 3.9Å; L309-N665 HydrophobicContact CD1-CB 4.27Å; L309-N665 WeakPolarHBondContact CD1-O 3.42Å; L309-N665 WeakPolarHBondContact CD1-OD1 3.44Å; L309-N665 VanDerWaalsContact CG-O 3.26Å; L309-N665 WeakPolarHBondContact CG-O 3.4Å; G652-N665 VanDerWaalsContact C-CA 3.5Å; G652-N665 CarbonylContact O-C 3.54Å; G652-N665 WeakPolarHBondContact O-CA 3.23Å; G652-N665 PolarHBondContact O-OD1 2.88Å; I653-N665 VanDerWaalsContact C-OD1 3.28Å; I653-N665 PolarHBondContact N-OD1 3.09Å; I653-N665 PolarHBondContact O-ND2 3.17Å; I653-N665 PolarHBondContact O-OD1 3.25Å
666	S	43.9	Very low	50.3	Low	8 Å²	8	42.1 Å²	42.1	6%	0.056	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	-125.6	145.3	-144.6	-18.1	0	0	0	0	115.4	Q308 T650 K651 G652 C668	Q308-S666 PolarHBondContact O-OG 2.66Å; T650-S666 CarbonylContact C-O 3.58Å; T650-S666 WeakPolarHBondContact CA-O 3.18Å; K651-S666 WeakPolarHBondContact CA-O 3.43Å; K651-S666 WeakPolarHBondContact CB-O 3.39Å; K651-S666 PolarHBondContact N-O 3.03Å; K651-S666 PolarHBondContact O-N 3.07Å; G652-S666 PolarHBondContact O-N 3.48Å; S666-C668 PolarHBondContact O-N 2.76Å
667	H	55.3	Low	52.6	Low	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.213	C	C	.	.			trans	-78.3	53.4	-144.5	-75.7	-134	0	0	0	119.3	L309 V310 I311 Y541 Q542 L649 T650 L669 I670 N671	L309-H667 WeakPolarHBondContact CD1-NE2 3.35Å; L309-H667 WeakPolarHBondContact CD2-NE2 3.44Å; L309-H667 WeakPolarHBondContact CG-NE2 3.3Å; V310-H667 PolarHBondContact O-N 2.82Å; I311-H667 HydrophobicContact CG1-CB 3.89Å; I311-H667 WeakPolarHBondContact CG1-ND1 3.48Å; Y541-H667 AromaticContact CD1-CE1 3.54Å; Y541-H667 AromaticContact CE1-CE1 3.19Å; Y541-H667 WeakPolarHBondContact CE1-CE1 3.46Å; Y541-H667 AromaticContact CE1-ND1 3.78Å; Q542-H667 WeakPolarHBondContact CB-CE1 3.07Å; Q542-H667 VanDerWaalsContact CD-NE2 3.28Å; Q542-H667 WeakPolarHBondContact CG-CE1 3.38Å; Q542-H667 PolarHBondContact NE2-CE1 2.58Å; Q542-H667 PolarHBondContact NE2-NE2 2.91Å; Q542-H667 PolarHBondContact OE1-CE1 3.09Å; Q542-H667 PolarHBondContact OE1-NE2 3.26Å; L649-H667 CarbonylContact O-C 3.54Å; T650-H667 HydrophobicContact CG2-CB 4.42Å; T650-H667 VanDerWaalsContact CG2-CD2 3.4Å; T650-H667 WeakPolarHBondContact CG2-CD2 3.41Å; T650-H667 VanDerWaalsContact OG1-CG 3.26Å; T650-H667 PolarHBondContact OG1-ND1 2.84Å; H667-L669 PolarHBondContact O-N 3.39Å; H667-L669 VanDerWaalsContact O-N 3.16Å; H667-I670 HydrophobicContact CB-CB 4.06Å; H667-I670 HydrophobicContact CB-CG2 4.35Å; H667-I670 CarbonylContact O-C 3.55Å; H667-I670 WeakPolarHBondContact O-CA 3.38Å; H667-I670 WeakPolarHBondContact O-CB 3.5Å; H667-I670 PolarHBondContact O-N 2.94Å; H667-N671 WeakPolarHBondContact CB-OD1 3.48Å; H667-N671 PolarHBondContact O-N 3.34Å; H667-N671 PolarHBondContact O-OD1 3.12Å
668	C	61.7	Low	54.7	Low	2 Å²	2	36.4 Å²	36.4	1%	0.014	21%	0.205	C	C	.	.	H	α-helix	trans	-16.5	-74.7	-178.5	-164	0	0	0	0	118.8	F647 K651 S666 I670 N671 A672	F647-C668 WeakPolarHBondContact O-CB 3.41Å; K651-C668 HydrophobicContact CB-CB 3.95Å; K651-C668 HydrophobicContact CD-CB 4.31Å; K651-C668 HydrophobicContact CG-CB 4.22Å; S666-C668 PolarHBondContact O-N 2.76Å; C668-I670 VanDerWaalsContact C-N 3.3Å; C668-I670 PolarHBondContact O-N 3.35Å; C668-N671 PolarHBondContact O-N 3.35Å; C668-A672 WeakPolarHBondContact O-CB 3.25Å; C668-A672 PolarHBondContact O-N 2.89Å
669	L	77.2	Confident	57.1	Low	3 Å²	3	30.5 Å²	30.5	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-60.8	-35.6	-177.7	-88.4	171.2	0	0	0	113.8	V477 F548 V575 I577 I601 L648 L649 H667 E673	V477-L669 HydrophobicContact CG1-CD1 4.34Å; V477-L669 HydrophobicContact CG1-CD2 3.62Å; V477-L669 HydrophobicContact CG2-CD1 4.41Å; V477-L669 HydrophobicContact CG2-CD2 4.03Å; F548-L669 HydrophobicContact CE1-CD1 4.05Å; F548-L669 HydrophobicContact CZ-CD1 4.32Å; V575-L669 HydrophobicContact CB-CD2 4.31Å; V575-L669 HydrophobicContact CG1-CD2 3.59Å; I577-L669 HydrophobicContact CD1-CD1 4.26Å; I577-L669 HydrophobicContact CD1-CD2 4.47Å; I577-L669 HydrophobicContact CG1-CD2 4.34Å; I601-L669 HydrophobicContact CD1-CD2 3.72Å; I601-L669 HydrophobicContact CD1-CG 4.18Å; L648-L669 WeakPolarHBondContact O-CD1 3.34Å; L648-L669 WeakPolarHBondContact O-CG 3.48Å; L648-L669 PolarHBondContact O-N 3.18Å; L649-L669 HydrophobicContact CD2-CD1 4.14Å; H667-L669 PolarHBondContact O-N 3.39Å; H667-L669 VanDerWaalsContact O-N 3.16Å; L669-E673 PolarHBondContact O-N 3.16Å
670	I	75.9	Confident	59.4	Low	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-76.7	-45	179.8	-68.6	173.9	0	0	0	109.7	I311 Y475 Y544 I546 H667 C668 A672 E673 N674	I311-I670 HydrophobicContact CG2-CG2 3.86Å; Y475-I670 HydrophobicContact CD2-CD1 4.31Å; Y475-I670 HydrophobicContact CD2-CG1 3.75Å; Y475-I670 HydrophobicContact CE2-CB 4.16Å; Y475-I670 HydrophobicContact CE2-CD1 4.2Å; Y475-I670 HydrophobicContact CE2-CG1 3.7Å; Y475-I670 HydrophobicContact CE2-CG2 3.79Å; Y475-I670 HydrophobicContact CG-CG1 4.38Å; Y544-I670 HydrophobicContact CD1-CD1 4.27Å; Y544-I670 HydrophobicContact CD2-CD1 4.32Å; Y544-I670 HydrophobicContact CG-CD1 3.99Å; I546-I670 HydrophobicContact CD1-CD1 4.4Å; H667-I670 HydrophobicContact CB-CB 4.06Å; H667-I670 HydrophobicContact CB-CG2 4.35Å; H667-I670 CarbonylContact O-C 3.55Å; H667-I670 WeakPolarHBondContact O-CA 3.38Å; H667-I670 WeakPolarHBondContact O-CB 3.5Å; H667-I670 PolarHBondContact O-N 2.94Å; C668-I670 VanDerWaalsContact C-N 3.3Å; C668-I670 PolarHBondContact O-N 3.35Å; I670-A672 VanDerWaalsContact C-N 3.26Å; I670-A672 PolarHBondContact O-N 2.89Å; I670-E673 PolarHBondContact O-N 3.47Å; I670-N674 WeakPolarHBondContact O-CB 3.38Å; I670-N674 PolarHBondContact O-N 3.23Å; I670-N674 PolarHBondContact O-OD1 3.46Å
671	N	76.6	Confident	61.7	Low	1 Å²	1	26.7 Å²	26.7	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-63.7	-32.4	175.7	-71.3	18.6	0	0	0	111.4	V310 E312 F628 H667 C668 A675	V310-N671 PolarHBondContact O-ND2 3.4Å; E312-N671 HydrophobicContact CB-CB 4.36Å; E312-N671 WeakPolarHBondContact CG-ND2 3.29Å; E312-N671 PolarHBondContact N-OD1 2.81Å; E312-N671 PolarHBondContact OE1-ND2 3.16Å; F628-N671 HydrophobicContact CB-CB 4.33Å; F628-N671 HydrophobicContact CD2-CB 4.21Å; H667-N671 WeakPolarHBondContact CB-OD1 3.48Å; H667-N671 PolarHBondContact O-N 3.34Å; H667-N671 PolarHBondContact O-OD1 3.12Å; C668-N671 PolarHBondContact O-N 3.35Å; N671-A675 WeakPolarHBondContact O-CB 3.47Å; N671-A675 PolarHBondContact O-N 2.85Å
672	A	82	Confident	63.9	Low	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.8	-51.8	172.9	0	0	0	0	0	111.8	V575 V599 F628 C668 I670 A675 V676	V575-A672 HydrophobicContact CG1-CB 4.08Å; V575-A672 HydrophobicContact CG2-CB 3.69Å; V599-A672 HydrophobicContact CB-CB 4.38Å; V599-A672 HydrophobicContact CG1-CB 4.05Å; V599-A672 HydrophobicContact CG2-CB 4.28Å; F628-A672 HydrophobicContact CD2-CB 4.04Å; F628-A672 HydrophobicContact CE1-CB 4.13Å; F628-A672 HydrophobicContact CE2-CB 3.46Å; F628-A672 VanDerWaalsContact CE2-CB 3.46Å; F628-A672 HydrophobicContact CZ-CB 3.51Å; C668-A672 WeakPolarHBondContact O-CB 3.25Å; C668-A672 PolarHBondContact O-N 2.89Å; I670-A672 VanDerWaalsContact C-N 3.26Å; I670-A672 PolarHBondContact O-N 2.89Å; A672-A675 PolarHBondContact O-N 3.38Å; A672-V676 VanDerWaalsContact O-CG2 3.31Å; A672-V676 WeakPolarHBondContact O-CG2 3.34Å; A672-V676 PolarHBondContact O-N 3.12Å
673	E	80.4	Confident	65.9	Low	19 Å²	19	27 Å²	27	9%	0.089	15%	0.154	C	C	.	.	H	α-helix	trans	-69.2	-37.6	179.7	-168.9	157.1	142.3	0	0	111.6	Y475 I574 V575 L669 I670 V676 H677	Y475-E673 HydrophobicContact CD1-CB 3.95Å; Y475-E673 HydrophobicContact CD1-CG 4.06Å; Y475-E673 HydrophobicContact CE1-CB 3.79Å; Y475-E673 HydrophobicContact CE1-CG 3.96Å; I574-E673 HydrophobicContact CB-CG 4.07Å; I574-E673 HydrophobicContact CD1-CG 3.86Å; I574-E673 HydrophobicContact CG2-CB 4.43Å; I574-E673 HydrophobicContact CG2-CG 4Å; V575-E673 HydrophobicContact CG2-CB 3.95Å; L669-E673 PolarHBondContact O-N 3.16Å; I670-E673 PolarHBondContact O-N 3.47Å; E673-V676 PolarHBondContact O-N 3.01Å; E673-H677 PolarHBondContact O-N 3.34Å
674	N	76	Confident	68	Low	12 Å²	12	26.1 Å²	26.1	6%	0.064	16%	0.161	C	C	.	.	H	α-helix	trans	-64.4	-40.8	174.1	-66.2	-2.9	0	0	0	111.9	E312 Y475 I670 H677 V678	E312-N674 PolarHBondContact O-ND2 3.02Å; Y475-N674 PolarHBondContact OH-OD1 2.73Å; I670-N674 WeakPolarHBondContact O-CB 3.38Å; I670-N674 PolarHBondContact O-N 3.23Å; I670-N674 PolarHBondContact O-OD1 3.46Å; N674-H677 WeakPolarHBondContact O-CB 3.38Å; N674-H677 PolarHBondContact O-N 2.96Å; N674-V678 PolarHBondContact O-N 3.18Å; N674-V678 VanDerWaalsContact O-N 3.17Å
675	A	78.2	Confident	69.8	Low	7 Å²	7	29.5 Å²	29.5	6%	0.058	18%	0.176	C	C	.	.	H	α-helix	trans	-64.2	-39.2	174	0	0	0	0	0	111.9	V625 P626 F628 N671 A672 H677 V678 S679	V625-A675 HydrophobicContact CG1-CB 3.92Å; P626-A675 WeakPolarHBondContact CD-O 3.38Å; P626-A675 HydrophobicContact CG-CB 4.09Å; F628-A675 HydrophobicContact CB-CB 3.76Å; F628-A675 HydrophobicContact CD1-CB 3.87Å; F628-A675 HydrophobicContact CG-CB 4.06Å; N671-A675 WeakPolarHBondContact O-CB 3.47Å; N671-A675 PolarHBondContact O-N 2.85Å; A672-A675 PolarHBondContact O-N 3.38Å; A675-H677 VanDerWaalsContact C-N 3.29Å; A675-H677 PolarHBondContact O-N 2.84Å; A675-V678 WeakPolarHBondContact O-CB 3.49Å; A675-V678 PolarHBondContact O-N 3.25Å; A675-V678 VanDerWaalsContact O-N 3.1Å; A675-S679 PolarHBondContact O-N 3.36Å
676	V	79.5	Confident	71.6	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-61.7	-38	172.8	173.8	0	0	0	0	111.1	I574 H598 V599 V625 A672 E673 V678 S679 F682	I574-V676 HydrophobicContact CG2-CB 3.7Å; I574-V676 HydrophobicContact CG2-CG1 3.63Å; I574-V676 HydrophobicContact CG2-CG2 3.72Å; H598-V676 HydrophobicContact CB-CG1 3.97Å; H598-V676 HydrophobicContact CB-CG2 3.69Å; V599-V676 HydrophobicContact CG2-CG2 3.73Å; V625-V676 HydrophobicContact CG1-CG2 3.85Å; V625-V676 HydrophobicContact CG2-CG2 3.85Å; A672-V676 VanDerWaalsContact O-CG2 3.31Å; A672-V676 WeakPolarHBondContact O-CG2 3.34Å; A672-V676 PolarHBondContact O-N 3.12Å; E673-V676 PolarHBondContact O-N 3.01Å; V676-V678 VanDerWaalsContact C-N 3.28Å; V676-V678 PolarHBondContact O-N 2.85Å; V676-S679 WeakPolarHBondContact O-CB 3.43Å; V676-S679 PolarHBondContact O-N 3.2Å; V676-S679 VanDerWaalsContact O-N 3.15Å; V676-S679 PolarHBondContact O-OG 2.88Å; V676-F682 HydrophobicContact CG1-CD2 3.57Å; V676-F682 HydrophobicContact CG1-CE1 4.33Å; V676-F682 HydrophobicContact CG1-CE2 3.26Å; V676-F682 HydrophobicContact CG1-CG 4.21Å; V676-F682 HydrophobicContact CG1-CZ 3.69Å; V676-F682 WeakPolarHBondContact O-CB 3.06Å; V676-F682 WeakPolarHBondContact O-CD2 3.23Å
677	H	73.7	Confident	72.8	Confident	71 Å²	71	30.5 Å²	30.5	33%	0.329	19%	0.188	S	C	.	.	H	α-helix	trans	-65.4	-25.6	173.9	-69.4	-28.3	0	0	0	114.4	E673 N674 A675 F682	E673-H677 PolarHBondContact O-N 3.34Å; N674-H677 WeakPolarHBondContact O-CB 3.38Å; N674-H677 PolarHBondContact O-N 2.96Å; A675-H677 VanDerWaalsContact C-N 3.29Å; A675-H677 PolarHBondContact O-N 2.84Å; H677-F682 AromaticContact ND1-CD1 3.85Å
678	V	69.9	Low	73.6	Confident	94 Å²	94	38.6 Å²	38.6	57%	0.57	22%	0.219	S	C	*	.	H	α-helix	trans	-76.4	-26.7	172.5	175.6	0	0	0	0	112.1	P626 N674 A675 V676	P626-V678 HydrophobicContact CG-CG1 4.42Å; N674-V678 PolarHBondContact O-N 3.18Å; N674-V678 VanDerWaalsContact O-N 3.17Å; A675-V678 WeakPolarHBondContact O-CB 3.49Å; A675-V678 PolarHBondContact O-N 3.25Å; A675-V678 VanDerWaalsContact O-N 3.1Å; V676-V678 VanDerWaalsContact C-N 3.28Å; V676-V678 PolarHBondContact O-N 2.85Å
679	S	73.3	Confident	74.2	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.021	23%	0.227	C	C	.	.	S	Bend	trans	-57.7	144	179.3	75.7	0	0	0	0	112.9	D624 A675 V676 K681 F682 A683	D624-S679 WeakPolarHBondContact O-CB 3.42Å; A675-S679 PolarHBondContact O-N 3.36Å; V676-S679 WeakPolarHBondContact O-CB 3.43Å; V676-S679 PolarHBondContact O-N 3.2Å; V676-S679 VanDerWaalsContact O-N 3.15Å; V676-S679 PolarHBondContact O-OG 2.88Å; S679-K681 PolarHBondContact O-N 3.34Å; S679-F682 PolarHBondContact O-N 2.79Å; S679-A683 PolarHBondContact O-N 2.83Å
680	A	73.1	Confident	73.9	Confident	70 Å²	70	42.8 Å²	42.8	58%	0.579	24%	0.237	S	C	*	.	H	α-helix	trans	-52.2	-38.5	-169.7	0	0	0	0	0	114	A684	A680-A684 VanDerWaalsContact O-CB 3.29Å; A680-A684 WeakPolarHBondContact O-CB 3.12Å; A680-A684 PolarHBondContact O-N 3.2Å
681	K	75.6	Confident	74	Confident	85 Å²	85	46 Å²	46	37%	0.37	25%	0.25	S	C	.	.	H	α-helix	trans	-59.6	-46.6	176.7	177.7	-179.7	167.2	-169.4	0	112.4	H595 H598 S679 M685	H595-K681 PolarHBondContact O-NZ 3.16Å; H598-K681 PolarHBondContact CE1-NZ 2.88Å; H598-K681 VanDerWaalsContact CE1-NZ 3.32Å; H598-K681 PolarHBondContact NE2-NZ 3.41Å; S679-K681 PolarHBondContact O-N 3.34Å; K681-M685 HydrophobicContact CG-CE 4.33Å; K681-M685 WeakPolarHBondContact O-CG 3.38Å; K681-M685 PolarHBondContact O-N 3.22Å
682	F	73	Confident	74.2	Confident	28 Å²	28	50.3 Å²	50.3	12%	0.123	27%	0.27	C	S	.	.	H	α-helix	trans	-79.2	-38	178.9	-74.5	-97.5	0	0	0	112.1	I574 H598 V676 H677 S679 A684 M685 A686	I574-F682 HydrophobicContact CD1-CE1 4.15Å; I574-F682 HydrophobicContact CD1-CZ 4.48Å; H598-F682 AromaticContact CE1-CE2 3.39Å; H598-F682 WeakPolarHBondContact CE1-CE2 3.37Å; H598-F682 AromaticContact CE1-CZ 3.61Å; H598-F682 AromaticContact ND1-CE2 3.7Å; H598-F682 AromaticContact ND1-CZ 3.83Å; H598-F682 AromaticContact NE2-CE2 3.63Å; V676-F682 HydrophobicContact CG1-CD2 3.57Å; V676-F682 HydrophobicContact CG1-CE1 4.33Å; V676-F682 HydrophobicContact CG1-CE2 3.26Å; V676-F682 HydrophobicContact CG1-CG 4.21Å; V676-F682 HydrophobicContact CG1-CZ 3.69Å; V676-F682 WeakPolarHBondContact O-CB 3.06Å; V676-F682 WeakPolarHBondContact O-CD2 3.23Å; H677-F682 AromaticContact ND1-CD1 3.85Å; S679-F682 PolarHBondContact O-N 2.79Å; F682-A684 VanDerWaalsContact C-N 3.28Å; F682-A684 PolarHBondContact O-N 2.86Å; F682-M685 HydrophobicContact CB-CE 4.44Å; F682-M685 HydrophobicContact CD1-CE 3.71Å; F682-M685 HydrophobicContact CD2-CE 4.4Å; F682-M685 HydrophobicContact CE1-CE 4.02Å; F682-M685 HydrophobicContact CG-CE 3.93Å; F682-M685 HydrophobicContact CZ-CE 4.5Å; F682-M685 PolarHBondContact O-N 3.1Å; F682-M685 VanDerWaalsContact O-N 3.16Å; F682-A686 WeakPolarHBondContact O-CB 3.4Å; F682-A686 PolarHBondContact O-N 2.67Å
683	A	68.6	Low	74	Confident	42 Å²	42	52.3 Å²	52.3	35%	0.347	28%	0.279	S	S	.	.	H	α-helix	trans	-55.5	-43.5	173.6	0	0	0	0	0	111.6	S679 A686 A687	S679-A683 PolarHBondContact O-N 2.83Å; A683-A686 PolarHBondContact O-N 2.81Å; A683-A687 VanDerWaalsContact O-CB 3.3Å; A683-A687 WeakPolarHBondContact O-CB 3.46Å; A683-A687 PolarHBondContact O-N 3.27Å
684	A	72.5	Confident	74	Confident	60 Å²	60	51.6 Å²	51.6	50%	0.496	28%	0.275	S	S	.	.	H	α-helix	trans	-65.4	-40.3	176.1	0	0	0	0	0	113.5	A680 F682 A687 R688	A680-A684 VanDerWaalsContact O-CB 3.29Å; A680-A684 WeakPolarHBondContact O-CB 3.12Å; A680-A684 PolarHBondContact O-N 3.2Å; F682-A684 VanDerWaalsContact C-N 3.28Å; F682-A684 PolarHBondContact O-N 2.86Å; A684-A687 PolarHBondContact O-N 2.95Å; A684-R688 WeakPolarHBondContact O-CB 3.25Å; A684-R688 PolarHBondContact O-N 3.33Å
685	M	69.5	Low	74.5	Confident	92 Å²	92	54.7 Å²	54.7	45%	0.453	29%	0.286	S	S	.	.	H	α-helix	trans	-66.3	-40.9	174.5	-69	-173	-66.7	0	0	111.6	K681 F682 T689	K681-M685 HydrophobicContact CG-CE 4.33Å; K681-M685 WeakPolarHBondContact O-CG 3.38Å; K681-M685 PolarHBondContact O-N 3.22Å; F682-M685 HydrophobicContact CB-CE 4.44Å; F682-M685 HydrophobicContact CD1-CE 3.71Å; F682-M685 HydrophobicContact CD2-CE 4.4Å; F682-M685 HydrophobicContact CE1-CE 4.02Å; F682-M685 HydrophobicContact CG-CE 3.93Å; F682-M685 HydrophobicContact CZ-CE 4.5Å; F682-M685 PolarHBondContact O-N 3.1Å; F682-M685 VanDerWaalsContact O-N 3.16Å; M685-T689 PolarHBondContact O-N 2.93Å; M685-T689 VanDerWaalsContact O-N 3.09Å; M685-T689 PolarHBondContact O-OG1 3.32Å
686	A	68.5	Low	74.8	Confident	39 Å²	39	58.1 Å²	58.1	32%	0.322	30%	0.301	S	S	.	.	H	α-helix	trans	-63.5	-45.4	175	0	0	0	0	0	111.5	F682 A683 T689 R690	F682-A686 WeakPolarHBondContact O-CB 3.4Å; F682-A686 PolarHBondContact O-N 2.67Å; A683-A686 PolarHBondContact O-N 2.81Å; A686-T689 PolarHBondContact O-N 2.89Å; A686-R690 WeakPolarHBondContact O-CB 3.33Å; A686-R690 PolarHBondContact O-N 3.43Å
687	A	68.8	Low	75	Confident	12 Å²	12	58.1 Å²	58.1	10%	0.099	30%	0.301	C	S	.	.	H	α-helix	trans	-62.4	-43.6	176.5	0	0	0	0	0	112.5	A683 A684 T689 R690 R691	A683-A687 VanDerWaalsContact O-CB 3.3Å; A683-A687 WeakPolarHBondContact O-CB 3.46Å; A683-A687 PolarHBondContact O-N 3.27Å; A684-A687 PolarHBondContact O-N 2.95Å; A687-T689 VanDerWaalsContact C-N 3.33Å; A687-T689 PolarHBondContact O-N 3.44Å; A687-R690 PolarHBondContact O-N 3.39Å; A687-R691 WeakPolarHBondContact O-CB 2.75Å; A687-R691 PolarHBondContact O-N 3.16Å
688	R	72.5	Confident	75.7	Confident	170 Å²	170	55.4 Å²	55.4	64%	0.642	29%	0.291	S	S	*	.	H	α-helix	trans	-57.2	-46.8	173.1	-171.5	-175	-62.7	-173.9	1.2	111.4	A684 R690 R691 E692	A684-R688 WeakPolarHBondContact O-CB 3.25Å; A684-R688 PolarHBondContact O-N 3.33Å; R688-R690 VanDerWaalsContact C-N 3.31Å; R688-R690 PolarHBondContact O-N 2.86Å; R688-R691 PolarHBondContact O-N 2.85Å; R688-E692 PolarHBondContact O-N 3.09Å
689	T	74.5	Confident	76.4	Confident	30 Å²	30	56.3 Å²	56.3	18%	0.184	29%	0.289	C	S	.	.	H	α-helix	trans	-72.8	-24.2	-179.8	-35.3	0	0	0	0	112.7	R457 M685 A686 A687 F693 L1072	R457-T689 PolarHBondContact NH1-O 2.97Å; M685-T689 PolarHBondContact O-N 2.93Å; M685-T689 VanDerWaalsContact O-N 3.09Å; M685-T689 PolarHBondContact O-OG1 3.32Å; A686-T689 PolarHBondContact O-N 2.89Å; A687-T689 VanDerWaalsContact C-N 3.33Å; A687-T689 PolarHBondContact O-N 3.44Å; T689-F693 WeakPolarHBondContact O-CB 3.45Å; T689-F693 PolarHBondContact O-N 2.86Å; T689-L1072 HydrophobicContact CG2-CD2 4.49Å
690	R	70.6	Confident	76.9	Confident	63 Å²	63	61.3 Å²	61.3	24%	0.238	32%	0.315	C	S	.	.	H	α-helix	trans	-72.7	-45	171.6	-170.4	-168.7	-66.6	124.5	-2.1	111.3	A686 A687 R688 F693 M694	A686-R690 WeakPolarHBondContact O-CB 3.33Å; A686-R690 PolarHBondContact O-N 3.43Å; A687-R690 PolarHBondContact O-N 3.39Å; R688-R690 VanDerWaalsContact C-N 3.31Å; R688-R690 PolarHBondContact O-N 2.86Å; R690-F693 PolarHBondContact O-N 2.86Å; R690-M694 HydrophobicContact CG-CE 4.1Å; R690-M694 HydrophobicContact CG-SD 4.39Å; R690-M694 WeakPolarHBondContact O-CG 3.25Å; R690-M694 PolarHBondContact O-N 3.07Å
691	R	77.8	Confident	77.4	Confident	67 Å²	67	58.9 Å²	58.9	25%	0.253	29%	0.292	S	S	.	.	H	α-helix	trans	-54.7	-55.6	177.4	177.6	-161.1	-91.8	86	-14	111.8	P342 D376 A687 R688 F693 M694 R695	P342-R691 HydrophobicContact CG-CG 4.15Å; D376-R691 IonicContact OD1-CZ 2.68Å; D376-R691 IonicContact OD1-NH1 3.28Å; D376-R691 PolarHBondContact OD1-NH1 3.18Å; D376-R691 IonicContact OD1-NH2 3.19Å; D376-R691 PolarHBondContact OD1-NH2 3.37Å; D376-R691 IonicContact OD2-CZ 3.4Å; D376-R691 VanDerWaalsContact OD2-CZ 3.22Å; D376-R691 IonicContact OD2-NH1 2.68Å; D376-R691 IonicContact OD2-NH2 3.58Å; D376-R691 PolarHBondContact OD2-NH2 3.06Å; A687-R691 WeakPolarHBondContact O-CB 2.75Å; A687-R691 PolarHBondContact O-N 3.16Å; R688-R691 PolarHBondContact O-N 2.85Å; R691-F693 VanDerWaalsContact C-N 3.29Å; R691-F693 PolarHBondContact O-N 3.44Å; R691-M694 PolarHBondContact O-N 2.95Å; R691-R695 WeakPolarHBondContact O-CB 3.24Å; R691-R695 PolarHBondContact O-N 3Å
692	E	80.5	Confident	77.7	Confident	92 Å²	92	56.2 Å²	56.2	43%	0.43	28%	0.284	S	S	.	.	H	α-helix	trans	-68.6	-28.9	-176.5	-61	-48.3	116.4	0	0	112.7	R688 R695 E696	R688-E692 PolarHBondContact O-N 3.09Å; E692-R695 WeakPolarHBondContact O-CB 3.47Å; E692-R695 PolarHBondContact O-N 3.45Å; E692-R695 IonicContact OE1-NE 2.67Å; E692-R695 IonicContact OE1-NH2 3.46Å; E692-R695 WeakPolarHBondContact OE2-CD 3.36Å; E692-R695 IonicContact OE2-CZ 3.92Å; E692-R695 IonicContact OE2-NE 2.75Å; E692-R695 PolarHBondContact OE2-NE 3.46Å; E692-E696 PolarHBondContact O-N 3.35Å
693	F	76.6	Confident	77.8	Confident	42 Å²	42	57.6 Å²	57.6	18%	0.184	29%	0.292	C	S	.	.	H	α-helix	trans	-69	-41.7	171.8	-179	-107.1	0	0	0	113	M453 T689 R690 R691 R695 E696 L697	M453-F693 HydrophobicContact CB-CE2 4.46Å; M453-F693 HydrophobicContact CB-CZ 3.78Å; M453-F693 HydrophobicContact CE-CE2 3.7Å; M453-F693 HydrophobicContact CE-CZ 4.09Å; M453-F693 HydrophobicContact CG-CE2 4.46Å; M453-F693 HydrophobicContact CG-CZ 4.24Å; M453-F693 WeakPolarHBondContact O-CE1 3.44Å; M453-F693 WeakPolarHBondContact O-CZ 3.31Å; T689-F693 WeakPolarHBondContact O-CB 3.45Å; T689-F693 PolarHBondContact O-N 2.86Å; R690-F693 PolarHBondContact O-N 2.86Å; R691-F693 VanDerWaalsContact C-N 3.29Å; R691-F693 PolarHBondContact O-N 3.44Å; F693-R695 VanDerWaalsContact C-N 3.32Å; F693-E696 WeakPolarHBondContact O-CB 3.48Å; F693-E696 PolarHBondContact O-N 3.03Å; F693-L697 HydrophobicContact CD1-CD1 4.26Å; F693-L697 HydrophobicContact CE1-CD1 3.85Å; F693-L697 HydrophobicContact CZ-CD1 4.37Å; F693-L697 PolarHBondContact O-N 3.11Å; F693-L697 VanDerWaalsContact O-N 3.12Å
694	M	81.3	Confident	77.8	Confident	5 Å²	5	60.6 Å²	60.6	3%	0.025	31%	0.31	C	S	.	.	H	α-helix	trans	-73.1	-26.2	175.7	-65.8	-163.4	-54.2	0	0	112.4	P342 A344 R373 L374 R690 R691 L697 A698	P342-M694 HydrophobicContact CB-CB 3.82Å; P342-M694 WeakPolarHBondContact O-CE 3.33Å; A344-M694 HydrophobicContact CB-SD 4.12Å; R373-M694 HydrophobicContact CB-CE 4.5Å; R373-M694 HydrophobicContact CB-SD 3.64Å; L374-M694 VanDerWaalsContact O-CE 3.26Å; L374-M694 WeakPolarHBondContact O-CE 3.1Å; R690-M694 HydrophobicContact CG-CE 4.1Å; R690-M694 HydrophobicContact CG-SD 4.39Å; R690-M694 WeakPolarHBondContact O-CG 3.25Å; R690-M694 PolarHBondContact O-N 3.07Å; R691-M694 PolarHBondContact O-N 2.95Å; M694-L697 PolarHBondContact O-N 2.74Å; M694-A698 WeakPolarHBondContact O-CB 3.42Å; M694-A698 PolarHBondContact O-N 2.77Å
695	R	86.3	Confident	77.3	Confident	77 Å²	77	63.5 Å²	63.5	29%	0.291	31%	0.313	S	S	.	.	H	α-helix	trans	-60.1	-49.9	165.5	-176.7	-172.4	-59.3	-70.9	-1.4	110.8	I336 P342 R691 E692 F693 L697 A698 E699	I336-R695 HydrophobicContact CD1-CG 4.39Å; P342-R695 HydrophobicContact CB-CB 4.45Å; P342-R695 HydrophobicContact CG-CB 3.93Å; R691-R695 WeakPolarHBondContact O-CB 3.24Å; R691-R695 PolarHBondContact O-N 3Å; E692-R695 WeakPolarHBondContact O-CB 3.47Å; E692-R695 PolarHBondContact O-N 3.45Å; E692-R695 IonicContact OE1-NE 2.67Å; E692-R695 IonicContact OE1-NH2 3.46Å; E692-R695 WeakPolarHBondContact OE2-CD 3.36Å; E692-R695 IonicContact OE2-CZ 3.92Å; E692-R695 IonicContact OE2-NE 2.75Å; E692-R695 PolarHBondContact OE2-NE 3.46Å; F693-R695 VanDerWaalsContact C-N 3.32Å; R695-L697 VanDerWaalsContact C-N 3.26Å; R695-L697 PolarHBondContact O-N 3.38Å; R695-A698 PolarHBondContact O-N 3.37Å; R695-A698 VanDerWaalsContact O-N 3.16Å; R695-E699 WeakPolarHBondContact CD-OE1 3.36Å; R695-E699 HydrophobicContact CG-CG 4.21Å; R695-E699 WeakPolarHBondContact CG-OE1 3.46Å; R695-E699 IonicContact NH1-OE1 3.71Å; R695-E699 WeakPolarHBondContact O-CB 3.42Å; R695-E699 WeakPolarHBondContact O-CG 3.42Å; R695-E699 PolarHBondContact O-N 3Å
696	E	84.9	Confident	77.1	Confident	78 Å²	78	60.6 Å²	60.6	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-57.2	-39	176.8	-166	-160.3	144.4	0	0	112.1	M453 E692 F693 N700 H701	M453-E696 WeakPolarHBondContact CE-OE1 3.47Å; E692-E696 PolarHBondContact O-N 3.35Å; F693-E696 WeakPolarHBondContact O-CB 3.48Å; F693-E696 PolarHBondContact O-N 3.03Å; E696-N700 VanDerWaalsContact O-CB 3.31Å; E696-N700 WeakPolarHBondContact O-CB 3.25Å; E696-N700 PolarHBondContact O-N 3.46Å; E696-N700 PolarHBondContact O-ND2 2.93Å; E696-H701 PolarHBondContact O-ND1 2.94Å; E696-H701 IonicContact OE1-CE1 3.16Å
697	L	84	Confident	76.8	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-65.5	-50.2	173.7	-75	172.3	0	0	0	112.4	F334 M453 L454 F693 M694 R695 E699 H701	F334-L697 HydrophobicContact CD2-CB 4.04Å; F334-L697 HydrophobicContact CE2-CB 4.22Å; F334-L697 HydrophobicContact CE2-CD2 4.1Å; F334-L697 HydrophobicContact CG-CB 4.34Å; F334-L697 HydrophobicContact CZ-CD2 4.37Å; M453-L697 HydrophobicContact CB-CD2 4Å; M453-L697 HydrophobicContact CE-CD2 3.86Å; M453-L697 HydrophobicContact CE-CG 4.3Å; M453-L697 HydrophobicContact SD-CD2 4.38Å; L454-L697 HydrophobicContact CD2-CD1 3.85Å; F693-L697 HydrophobicContact CD1-CD1 4.26Å; F693-L697 HydrophobicContact CE1-CD1 3.85Å; F693-L697 HydrophobicContact CZ-CD1 4.37Å; F693-L697 PolarHBondContact O-N 3.11Å; F693-L697 VanDerWaalsContact O-N 3.12Å; M694-L697 PolarHBondContact O-N 2.74Å; R695-L697 VanDerWaalsContact C-N 3.26Å; R695-L697 PolarHBondContact O-N 3.38Å; L697-E699 VanDerWaalsContact C-N 3.35Å; L697-E699 PolarHBondContact O-N 2.75Å; L697-H701 HydrophobicContact CD2-CB 4.14Å; L697-H701 WeakPolarHBondContact O-CA 3.4Å; L697-H701 WeakPolarHBondContact O-CB 3.38Å; L697-H701 PolarHBondContact O-N 3.26Å
698	A	86.9	Confident	76.1	Confident	13 Å²	13	64.1 Å²	64.1	11%	0.107	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-38	-179	0	0	0	0	0	113	F334 G335 I336 M694 R695 C702	F334-A698 HydrophobicContact CB-CB 4.2Å; G335-A698 WeakPolarHBondContact O-CB 3.49Å; I336-A698 HydrophobicContact CD1-CB 4.48Å; I336-A698 HydrophobicContact CG1-CB 3.89Å; M694-A698 WeakPolarHBondContact O-CB 3.42Å; M694-A698 PolarHBondContact O-N 2.77Å; R695-A698 PolarHBondContact O-N 3.37Å; R695-A698 VanDerWaalsContact O-N 3.16Å; A698-C702 PolarHBondContact O-SG 3.3Å
699	E	86.3	Confident	74.9	Confident	113 Å²	113	59.8 Å²	59.8	53%	0.528	31%	0.306	S	S	.	.	H	α-helix	trans	-81.7	-37.5	-177.5	-68.7	172.9	-173.7	0	0	112.8	I336 R695 L697	I336-E699 HydrophobicContact CD1-CG 4.16Å; R695-E699 WeakPolarHBondContact CD-OE1 3.36Å; R695-E699 HydrophobicContact CG-CG 4.21Å; R695-E699 WeakPolarHBondContact CG-OE1 3.46Å; R695-E699 IonicContact NH1-OE1 3.71Å; R695-E699 WeakPolarHBondContact O-CB 3.42Å; R695-E699 WeakPolarHBondContact O-CG 3.42Å; R695-E699 PolarHBondContact O-N 3Å; L697-E699 VanDerWaalsContact C-N 3.35Å; L697-E699 PolarHBondContact O-N 2.75Å
700	N	83.8	Confident	73.3	Confident	109 Å²	109	61.7 Å²	61.7	58%	0.583	32%	0.32	S	S	*	.	H	α-helix	trans	-113.1	-13.6	-169.4	-54	-84.8	0	0	0	115.4	E696	E696-N700 VanDerWaalsContact O-CB 3.31Å; E696-N700 WeakPolarHBondContact O-CB 3.25Å; E696-N700 PolarHBondContact O-N 3.46Å; E696-N700 PolarHBondContact O-ND2 2.93Å
701	H	82	Confident	72	Confident	19 Å²	19	60.7 Å²	60.7	9%	0.088	32%	0.323	C	S	.	.	S	Bend	trans	-119.2	20.7	-171.6	-60.1	82.8	0	0	0	113.7	F334 A444 V445 M453 E696 L697	F334-H701 HydrophobicContact CD2-CB 4.41Å; F334-H701 HydrophobicContact CE2-CB 4.11Å; A444-H701 WeakPolarHBondContact CA-O 3.5Å; V445-H701 PolarHBondContact N-O 3.49Å; M453-H701 PolarHBondContact SD-NE2 3.04Å; E696-H701 PolarHBondContact O-ND1 2.94Å; E696-H701 IonicContact OE1-CE1 3.16Å; L697-H701 HydrophobicContact CD2-CB 4.14Å; L697-H701 WeakPolarHBondContact O-CA 3.4Å; L697-H701 WeakPolarHBondContact O-CB 3.38Å; L697-H701 PolarHBondContact O-N 3.26Å
702	C	81.8	Confident	70	Confident	29 Å²	29	60.5 Å²	60.5	20%	0.196	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	148	177.6	-69.3	0	0	0	0	113.7	R442 A698	R442-C702 HydrophobicContact CB-CB 3.99Å; A698-C702 PolarHBondContact O-SG 3.3Å
703	I	76.5	Confident	68	Low	57 Å²	57	64.8 Å²	64.8	29%	0.292	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	145.4	161.6	-54.5	169.8	0	0	0	108	L443 V445 H705	L443-I703 WeakPolarHBondContact O-CB 3.37Å; L443-I703 PolarHBondContact O-N 2.92Å; V445-I703 HydrophobicContact CB-CG1 4.41Å; V445-I703 HydrophobicContact CG2-CG1 3.86Å; I703-H705 PolarHBondContact O-N 2.87Å
704	S	67.5	Low	66.3	Low	105 Å²	105	68.4 Å²	68.4	73%	0.734	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	4.8	-177.1	-51.5	0	0	0	0	116.5
705	H	63	Low	64.1	Low	121 Å²	121	73 Å²	73	56%	0.56	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	110.2	178.2	-64.6	-52.6	0	0	0	111.4	L443 I703	L443-H705 PolarHBondContact N-O 3.42Å; I703-H705 PolarHBondContact O-N 2.87Å
706	S	64.3	Low	61.7	Low	31 Å²	31	73.1 Å²	73.1	22%	0.217	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	157.7	168.1	62.5	0	0	0	0	111.9	E708 S709	S706-E708 PolarHBondContact O-N 2.93Å; S706-S709 VanDerWaalsContact O-CB 3.3Å; S706-S709 WeakPolarHBondContact O-CB 3.37Å; S706-S709 PolarHBondContact O-N 2.96Å; S706-S709 VanDerWaalsContact O-N 3.16Å; S706-S709 PolarHBondContact O-OG 2.97Å; S706-S709 PolarHBondContact OG-OG 3.07Å
707	I	62.4	Low	59.2	Low	13 Å²	13	77.4 Å²	77.4	7%	0.067	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-38.6	178.3	-65.7	-179.4	0	0	0	112	Y333 V425 L429 L441 S709 S710	Y333-I707 HydrophobicContact CD1-CD1 3.94Å; Y333-I707 HydrophobicContact CD1-CG1 3.81Å; Y333-I707 HydrophobicContact CE1-CD1 4.16Å; Y333-I707 HydrophobicContact CE1-CG1 3.74Å; Y333-I707 HydrophobicContact CG-CD1 4.42Å; V425-I707 HydrophobicContact CG1-CD1 3.73Å; L429-I707 HydrophobicContact CD1-CD1 4.44Å; L441-I707 HydrophobicContact CB-CD1 3.59Å; L441-I707 HydrophobicContact CB-CG1 4.18Å; L441-I707 HydrophobicContact CD1-CD1 3.9Å; L441-I707 HydrophobicContact CG-CD1 4.41Å; L441-I707 PolarHBondContact O-N 3.3Å; I707-S709 PolarHBondContact O-N 3.33Å; I707-S710 PolarHBondContact O-N 3.43Å
708	E	54.4	Low	57.2	Low	111 Å²	111	82.2 Å²	82.2	52%	0.519	46%	0.455	S	S	.	.	H	α-helix	trans	-59.4	-29.3	-179.4	-61.9	-168.8	124.8	0	0	113.8	S706 S710 S711 A712	S706-E708 PolarHBondContact O-N 2.93Å; E708-S710 PolarHBondContact O-N 3.15Å; E708-S711 PolarHBondContact O-N 3.32Å; E708-A712 PolarHBondContact O-N 3.26Å
709	S	46.5	Very low	54.9	Low	80 Å²	80	85 Å²	85	56%	0.559	48%	0.478	S	S	*	.	H	α-helix	trans	-60.2	-18.7	175.9	-59.9	0	0	0	0	113.1	S706 I707	S706-S709 VanDerWaalsContact O-CB 3.3Å; S706-S709 WeakPolarHBondContact O-CB 3.37Å; S706-S709 PolarHBondContact O-N 2.96Å; S706-S709 VanDerWaalsContact O-N 3.16Å; S706-S709 PolarHBondContact O-OG 2.97Å; S706-S709 PolarHBondContact OG-OG 3.07Å; I707-S709 PolarHBondContact O-N 3.33Å
710	S	42.5	Very low	52.4	Low	69 Å²	69	86 Å²	86	48%	0.483	49%	0.487	S	S	.	.	H	α-helix	trans	-103.5	-26.9	-178.7	-72.1	0	0	0	0	115.1	I707 E708	I707-S710 PolarHBondContact O-N 3.43Å; E708-S710 PolarHBondContact O-N 3.15Å
711	S	42.2	Very low	50.1	Low	42 Å²	42	88.4 Å²	88.4	29%	0.294	50%	0.497	S	S	.	.	H	α-helix	trans	-91.8	-29.7	-172.5	54.5	0	0	0	0	114.1	E708 K713 I714	E708-S711 PolarHBondContact O-N 3.32Å; S711-K713 PolarHBondContact O-N 2.91Å; S711-I714 PolarHBondContact O-N 2.9Å
712	A	37.4	Very low	47.9	Very low	63 Å²	63	92.8 Å²	92.8	52%	0.521	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-7.6	-172.2	0	0	0	0	0	116.5	E708	E708-A712 PolarHBondContact O-N 3.26Å
713	K	38.1	Very low	45.5	Very low	183 Å²	183	97.6 Å²	97.6	80%	0.796	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-7.1	-179.1	-70	-175.9	177.9	177.5	0	115.3	S711	S711-K713 PolarHBondContact O-N 2.91Å
714	I	39.2	Very low	43.3	Very low	117 Å²	117	100.3 Å²	100.3	60%	0.6	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.1	-53.4	-179	-63.7	177.5	0	0	0	110.7	S711 C716 K717	S711-I714 PolarHBondContact O-N 2.9Å; I714-C716 VanDerWaalsContact C-N 3.31Å; I714-C716 PolarHBondContact O-N 3.47Å; I714-K717 PolarHBondContact O-N 3.08Å
715	T	36.3	Very low	41.7	Very low	102 Å²	102	99.6 Å²	99.6	63%	0.626	57%	0.574	S	S	*	*	H	α-helix	trans	-61.6	-36.3	-176.5	-38.5	0	0	0	0	113.1	K717 I718	T715-K717 VanDerWaalsContact C-N 3.25Å; T715-K717 PolarHBondContact O-N 2.82Å; T715-I718 PolarHBondContact O-N 2.96Å
716	C	35.8	Very low	40.1	Very low	80 Å²	80	103.5 Å²	103.5	54%	0.541	59%	0.59	S	S	.	*	H	α-helix	trans	-72.2	-7.9	-176.8	-61.9	0	0	0	0	115.3	I714	I714-C716 VanDerWaalsContact C-N 3.31Å; I714-C716 PolarHBondContact O-N 3.47Å
717	K	32.9	Very low	38.6	Very low	167 Å²	167	109.4 Å²	109.4	73%	0.726	62%	0.617	S	S	*	*	H	α-helix	trans	-92	-24.7	173	-80.7	-168.5	171.5	-172.1	0	113.8	I714 T715	I714-K717 PolarHBondContact O-N 3.08Å; T715-K717 VanDerWaalsContact C-N 3.25Å; T715-K717 PolarHBondContact O-N 2.82Å
718	I	42.1	Very low	37.2	Very low	102 Å²	102	117.2 Å²	117.2	52%	0.523	66%	0.658	S	S	.	*	H	α-helix	trans	-80.5	-39.9	-179.3	-59.2	176.5	0	0	0	110.4	T715 N720	T715-I718 PolarHBondContact O-N 2.96Å; I718-N720 VanDerWaalsContact C-N 3.28Å; I718-N720 PolarHBondContact O-N 2.83Å
719	A	37.9	Very low	36	Very low	71 Å²	71	115 Å²	115	59%	0.587	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-62.9	-29.3	179.9	0	0	0	0	0	114.4
720	N	34.6	Very low	35.2	Very low	136 Å²	136	119.4 Å²	119.4	73%	0.727	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-97	6.2	-172.2	-73.7	-8.4	0	0	0	114.8	I718	I718-N720 VanDerWaalsContact C-N 3.28Å; I718-N720 PolarHBondContact O-N 2.83Å
721	M	34.2	Very low	34.5	Very low	158 Å²	158	125.4 Å²	125.4	78%	0.778	70%	0.7	S	S	*	*	G	3₁₀ helix	trans	-115.6	19.3	-179	-66.8	-68.5	-73.9	0	0	113.3	P723	M721-P723 VanDerWaalsContact O-CD 3.3Å; M721-P723 WeakPolarHBondContact O-CD 3.34Å
722	L	36.7	Very low	34	Very low	112 Å²	112	135.2 Å²	135.2	59%	0.586	73%	0.73	S	S	*	*			trans	-115.1	87.4	-176.3	-92.5	159.3	0	0	0	112.7	C724	L722-C724 PolarHBondContact O-N 2.73Å
723	P	30.8	Very low	33.6	Very low	129 Å²	129	141.6 Å²	141.6	84%	0.838	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	43.3	177.1	34	-37.2	0	0	0	113.5	M721	M721-P723 VanDerWaalsContact O-CD 3.3Å; M721-P723 WeakPolarHBondContact O-CD 3.34Å
724	C	31.3	Very low	33.4	Very low	115 Å²	115	139.5 Å²	139.5	78%	0.777	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.2	5.2	-179.8	-92.6	0	0	0	0	115.6	L722 K726	L722-C724 PolarHBondContact O-N 2.73Å; C724-K726 PolarHBondContact O-N 3.41Å
725	A	33.1	Very low	33.5	Very low	89 Å²	89	143.5 Å²	143.5	74%	0.736	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	22.2	-169.7	0	0	0	0	0	116.2
726	K	29.6	Very low	33.6	Very low	204 Å²	204	144.5 Å²	144.5	89%	0.887	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.6	0.5	-177.2	-88.5	-171.6	174.3	-178.1	0	116.9	C724	C724-K726 PolarHBondContact O-N 3.41Å
727	I	32.7	Very low	33.8	Very low	155 Å²	155	148.6 Å²	148.6	80%	0.795	76%	0.764	S	S	*	*	S	Bend	trans	-139.5	81.1	179.7	-47.1	178.3	0	0	0	111.2
728	L	33.9	Very low	34.3	Very low	177 Å²	177	141.5 Å²	141.5	93%	0.927	74%	0.736	S	S	*	*			trans	-173.4	141.3	138.6	-125.2	69.4	0	0	0	109.6
729	G	28.9	Very low	34.6	Very low	65 Å²	65	144.5 Å²	144.5	67%	0.67	75%	0.746	S	S	*	*			trans	-97.3	159.4	-175.7	0	0	0	0	0	114.9	K731	G729-K731 PolarHBondContact O-N 3.5Å; G729-K731 VanDerWaalsContact O-N 3.16Å
730	N	29.3	Very low	35.2	Very low	171 Å²	171	143 Å²	143	91%	0.914	73%	0.729	S	S	*	*	S	Bend	trans	36.2	59.2	154.7	-67.4	13.9	0	0	0	118.6
731	K	28.4	Very low	36.2	Very low	195 Å²	195	142 Å²	142	85%	0.848	72%	0.718	S	S	*	*			trans	-132.1	119.8	138.3	-69	-165	177.4	-172.5	0	109.2	G729 K733	G729-K731 PolarHBondContact O-N 3.5Å; G729-K731 VanDerWaalsContact O-N 3.16Å; K731-K733 PolarHBondContact O-N 2.61Å
732	R	31.2	Very low	37.4	Very low	248 Å²	248	135.9 Å²	135.9	94%	0.936	69%	0.688	S	S	*	*			trans	-64.9	103	161.8	-74.6	-178.9	177.8	166.8	-1.5	105.7
733	K	29.7	Very low	38.6	Very low	198 Å²	198	130.9 Å²	130.9	86%	0.861	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-79.5	122	171	-177	-178.2	179.1	-174.9	0	106.5	K731 R735	K731-K733 PolarHBondContact O-N 2.61Å; K733-R735 PolarHBondContact O-N 2.81Å
734	D	33.3	Very low	40.2	Very low	139 Å²	139	124.9 Å²	124.9	74%	0.743	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-54.9	136.2	-177.7	-52.1	-73.1	0	0	0	110.5
735	R	40.7	Very low	42	Very low	200 Å²	200	121.4 Å²	121.4	76%	0.755	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-58.2	130	163	-78.2	177.2	170.7	156.5	-5.9	106	E106 K733 R737	E106-R735 IonicContact OE1-NH1 2.72Å; K733-R735 PolarHBondContact O-N 2.81Å; R735-R737 PolarHBondContact O-N 2.65Å
736	P	37.8	Very low	44.1	Very low	123 Å²	123	117.5 Å²	117.5	80%	0.799	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-57.8	119.7	170.2	25.4	-32.1	0	0	0	107.4	A738	P736-A738 PolarHBondContact O-N 2.74Å
737	R	40.5	Very low	46.4	Very low	167 Å²	167	112 Å²	112	63%	0.63	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-53.7	126.9	169.4	-79.9	-173.8	179.3	153.4	-2	106.5	E105 R735 L830	E105-R737 IonicContact OE1-CZ 3.79Å; E105-R737 IonicContact OE1-NH2 2.69Å; E105-R737 PolarHBondContact OE1-NH2 3.24Å; R735-R737 PolarHBondContact O-N 2.65Å; R737-L830 VanDerWaalsContact NH1-CD1 3.33Å
738	A	44.2	Very low	48.8	Very low	17 Å²	17	104.7 Å²	104.7	14%	0.14	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-57.6	152.1	178.7	0	0	0	0	0	109.4	Y113 P736 V740	Y113-A738 HydrophobicContact CE1-CB 3.65Å; Y113-A738 VanDerWaalsContact OH-CB 3.28Å; Y113-A738 WeakPolarHBondContact OH-CB 3.43Å; P736-A738 PolarHBondContact O-N 2.74Å; A738-V740 PolarHBondContact O-N 2.76Å
739	K	48.1	Very low	51.4	Low	166 Å²	166	96.2 Å²	96.2	72%	0.722	45%	0.454	S	S	*	.			trans	-73.7	93.2	-178.7	-68.8	-178.5	179.5	177.7	0	109.4	F741 L742	K739-F741 PolarHBondContact O-N 2.89Å; K739-L742 PolarHBondContact O-N 2.84Å
740	V	50.7	Low	54.2	Low	38 Å²	38	93.7 Å²	93.7	23%	0.23	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-39.8	-29.7	174.4	-175.6	0	0	0	0	113.3	A738 L742 E743 A744	A738-V740 PolarHBondContact O-N 2.76Å; V740-L742 PolarHBondContact O-N 3.38Å; V740-E743 PolarHBondContact O-N 3.37Å; V740-E743 VanDerWaalsContact O-N 3.15Å; V740-A744 PolarHBondContact O-N 3.34Å
741	F	55.8	Low	57	Low	117 Å²	117	86 Å²	86	51%	0.513	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-43.3	-32.8	169.1	-163.7	-102.8	0	0	0	115.2	K739 F745 F841	K739-F741 PolarHBondContact O-N 2.89Å; F741-F745 AromaticContact CD1-CE2 3.67Å; F741-F745 HydrophobicContact CD1-CE2 3.67Å; F741-F745 HydrophobicContact CD1-CZ 4.16Å; F741-F745 AromaticContact CE1-CE2 3.52Å; F741-F745 HydrophobicContact CE1-CE2 3.52Å; F741-F745 AromaticContact CE1-CZ 3.56Å; F741-F745 HydrophobicContact CE1-CZ 3.56Å; F741-F745 HydrophobicContact CE2-CZ 4.48Å; F741-F745 HydrophobicContact CG-CE2 4.39Å; F741-F745 HydrophobicContact CZ-CE2 4.14Å; F741-F745 AromaticContact CZ-CZ 3.75Å; F741-F745 HydrophobicContact CZ-CZ 3.75Å; F741-F745 WeakPolarHBondContact O-CD2 3.25Å; F741-F745 WeakPolarHBondContact O-CE2 3.33Å; F741-F841 HydrophobicContact CD2-CE2 4.15Å; F741-F841 HydrophobicContact CD2-CZ 4.35Å; F741-F841 AromaticContact CE2-CE2 3.75Å; F741-F841 HydrophobicContact CE2-CE2 3.75Å; F741-F841 AromaticContact CE2-CZ 3.54Å; F741-F841 HydrophobicContact CE2-CZ 3.54Å; F741-F841 HydrophobicContact CZ-CE2 4.41Å; F741-F841 AromaticContact CZ-CZ 3.81Å; F741-F841 HydrophobicContact CZ-CZ 3.81Å
742	L	58.2	Low	59.9	Low	28 Å²	28	77.6 Å²	77.6	15%	0.147	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-70.1	-43.9	179.7	-71.9	172.2	0	0	0	112.9	L362 L385 E387 K739 V740 A744 F745	L362-L742 HydrophobicContact CD2-CD2 3.94Å; L385-L742 WeakPolarHBondContact CD1-O 3.35Å; E387-L742 HydrophobicContact CB-CD1 3.97Å; E387-L742 HydrophobicContact CB-CD2 4.16Å; E387-L742 WeakPolarHBondContact O-CD1 3.46Å; K739-L742 PolarHBondContact O-N 2.84Å; V740-L742 PolarHBondContact O-N 3.38Å; L742-A744 VanDerWaalsContact C-N 3.27Å; L742-A744 PolarHBondContact O-N 2.61Å; L742-F745 PolarHBondContact O-N 3.38Å
743	E	62.8	Low	62.7	Low	7 Å²	7	67.3 Å²	67.3	3%	0.033	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-69.9	-26.5	179.9	-67.3	116	-146	0	0	112.6	Q112 Y113 V740 F745 N746 I750	Q112-E743 VanDerWaalsContact O-CG 3.31Å; Q112-E743 WeakPolarHBondContact O-CG 3.22Å; Y113-E743 WeakPolarHBondContact CD1-OE1 3.46Å; V740-E743 PolarHBondContact O-N 3.37Å; V740-E743 VanDerWaalsContact O-N 3.15Å; E743-F745 PolarHBondContact O-N 3.1Å; E743-N746 PolarHBondContact O-N 3Å; E743-I750 HydrophobicContact CB-CD1 3.86Å
744	A	63.5	Low	65.6	Low	4 Å²	4	58 Å²	58	3%	0.033	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-55.9	-16.5	177.7	0	0	0	0	0	113.8	V740 L742 R838 F841	V740-A744 PolarHBondContact O-N 3.34Å; L742-A744 VanDerWaalsContact C-N 3.27Å; L742-A744 PolarHBondContact O-N 2.61Å; A744-R838 VanDerWaalsContact C-NH1 3.34Å; A744-R838 PolarHBondContact O-NH1 3.34Å; A744-F841 HydrophobicContact CB-CD2 3.7Å; A744-F841 HydrophobicContact CB-CE2 4.2Å; A744-F841 HydrophobicContact CB-CG 4.4Å
745	F	69.8	Low	68.3	Low	42 Å²	42	53.3 Å²	53.3	18%	0.184	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-97.1	-9.9	174.6	-56.9	-67.7	0	0	0	115.9	A360 F741 L742 E743 F841	A360-F745 VanDerWaalsContact CA-CD1 3.43Å; A360-F745 HydrophobicContact CB-CB 3.59Å; A360-F745 HydrophobicContact CB-CD1 3.96Å; A360-F745 HydrophobicContact CB-CD2 4.39Å; A360-F745 HydrophobicContact CB-CG 3.74Å; A360-F745 WeakPolarHBondContact O-CD2 3.49Å; A360-F745 WeakPolarHBondContact O-CE2 3.23Å; A360-F745 WeakPolarHBondContact O-CZ 3.5Å; F741-F745 AromaticContact CD1-CE2 3.67Å; F741-F745 HydrophobicContact CD1-CE2 3.67Å; F741-F745 HydrophobicContact CD1-CZ 4.16Å; F741-F745 AromaticContact CE1-CE2 3.52Å; F741-F745 HydrophobicContact CE1-CE2 3.52Å; F741-F745 AromaticContact CE1-CZ 3.56Å; F741-F745 HydrophobicContact CE1-CZ 3.56Å; F741-F745 HydrophobicContact CE2-CZ 4.48Å; F741-F745 HydrophobicContact CG-CE2 4.39Å; F741-F745 HydrophobicContact CZ-CE2 4.14Å; F741-F745 AromaticContact CZ-CZ 3.75Å; F741-F745 HydrophobicContact CZ-CZ 3.75Å; F741-F745 WeakPolarHBondContact O-CD2 3.25Å; F741-F745 WeakPolarHBondContact O-CE2 3.33Å; L742-F745 PolarHBondContact O-N 3.38Å; E743-F745 PolarHBondContact O-N 3.1Å; F745-F841 HydrophobicContact CD1-CD1 4.1Å; F745-F841 HydrophobicContact CD1-CE1 4.18Å; F745-F841 AromaticContact CE1-CD1 3.62Å; F745-F841 HydrophobicContact CE1-CD1 3.62Å; F745-F841 AromaticContact CE1-CE1 3.26Å; F745-F841 HydrophobicContact CE1-CE1 3.26Å; F745-F841 HydrophobicContact CE1-CE2 4.5Å; F745-F841 HydrophobicContact CE1-CG 4.4Å; F745-F841 AromaticContact CE1-CZ 3.75Å; F745-F841 HydrophobicContact CE1-CZ 3.75Å; F745-F841 HydrophobicContact CZ-CD1 4.41Å; F745-F841 AromaticContact CZ-CE1 3.72Å; F745-F841 HydrophobicContact CZ-CE1 3.72Å; F745-F841 HydrophobicContact CZ-CE2 4.43Å; F745-F841 AromaticContact CZ-CZ 3.71Å; F745-F841 HydrophobicContact CZ-CZ 3.71Å
746	N	77	Confident	70.5	Confident	6 Å²	6	43.8 Å²	43.8	3%	0.032	21%	0.208	C	C	.	.			trans	-71	145.2	-177.5	-159.3	-12.8	0	0	0	111	A115 S383 L385 E743 R838	A115-N746 HydrophobicContact CB-CB 3.94Å; A115-N746 WeakPolarHBondContact CB-ND2 3.14Å; S383-N746 PolarHBondContact O-ND2 2.97Å; S383-N746 PolarHBondContact OG-ND2 3.48Å; S383-N746 PolarHBondContact OG-OD1 2.94Å; L385-N746 HydrophobicContact CD1-CB 4.03Å; L385-N746 HydrophobicContact CG-CB 4.32Å; E743-N746 PolarHBondContact O-N 3Å; N746-R838 VanDerWaalsContact O-CZ 3.3Å; N746-R838 PolarHBondContact O-NH1 3Å; N746-R838 PolarHBondContact O-NH2 3.17Å
747	R	78.5	Confident	72.5	Confident	90 Å²	90	39.8 Å²	39.8	34%	0.34	18%	0.179	S	C	.	.	S	Bend	trans	-72	-41.5	-178	-85.9	-172.1	171	-119.3	1.9	113.2	E290 Q356 S776 A777	E290-R747 HydrophobicContact CG-CB 4.08Å; Q356-R747 VanDerWaalsContact OE1-NH2 3.11Å; R747-S776 VanDerWaalsContact O-CB 3.31Å; R747-S776 WeakPolarHBondContact O-CB 3.26Å; R747-A777 HydrophobicContact CB-CB 4.48Å; R747-A777 HydrophobicContact CG-CB 4.26Å; R747-A777 PolarHBondContact O-N 3.18Å
748	G	82.8	Confident	73.8	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.153	C	C	.	.	S	Bend	trans	-62.8	170.9	176.9	0	0	0	0	0	112.7	H116 R838	H116-G748 CarbonylContact O-C 3.22Å; H116-G748 WeakPolarHBondContact O-CA 3.44Å; G748-R838 PolarHBondContact O-NH2 2.66Å
749	A	87.9	Confident	74.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.161	C	C	.	.	B	Isolated β-bridge	trans	-80.2	132.3	-177.4	0	0	0	0	0	113.5	A115 H116 I122 L289 A774 V775	A115-A749 CarbonylContact C-O 3.49Å; A115-A749 WeakPolarHBondContact CA-O 3.34Å; H116-A749 PolarHBondContact CE1-O 3.01Å; H116-A749 PolarHBondContact N-O 3.27Å; H116-A749 PolarHBondContact ND1-O 3.29Å; H116-A749 PolarHBondContact O-N 3Å; I122-A749 HydrophobicContact CD1-CB 4.37Å; L289-A749 HydrophobicContact CB-CB 4.39Å; L289-A749 HydrophobicContact CD1-CB 3.66Å; A749-A774 HydrophobicContact CB-CB 4.1Å; A749-V775 WeakPolarHBondContact CA-O 3.44Å
750	I	87.7	Confident	74.2	Confident	11 Å²	11	30.4 Å²	30.4	6%	0.056	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	145	159.6	-48.7	175.1	0	0	0	107.3	E743 W752 A774 V775 R838	E743-I750 HydrophobicContact CB-CD1 3.86Å; I750-W752 HydrophobicContact CB-CH2 3.6Å; I750-W752 HydrophobicContact CB-CZ2 4.13Å; I750-W752 HydrophobicContact CB-CZ3 3.91Å; I750-W752 HydrophobicContact CD1-CH2 4.33Å; I750-W752 HydrophobicContact CG2-CH2 3.58Å; I750-W752 HydrophobicContact CG2-CZ2 3.56Å; I750-W752 HydrophobicContact CG2-CZ3 4.07Å; I750-W752 WeakPolarHBondContact O-CZ3 3.14Å; I750-A774 WeakPolarHBondContact O-CA 3.22Å; I750-V775 PolarHBondContact N-O 2.79Å; I750-V775 PolarHBondContact O-N 3.49Å; I750-R838 HydrophobicContact CD1-CG 4.44Å
751	V	89	Confident	73.7	Confident	10 Å²	10	36.4 Å²	36.4	6%	0.061	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	139.8	-171.5	-175.7	0	0	0	0	111.7	H116 I122 Y126 F772 L773 A774	H116-V751 WeakPolarHBondContact CE1-CG2 3.37Å; I122-V751 HydrophobicContact CB-CG2 4.43Å; I122-V751 HydrophobicContact CD1-CG2 3.76Å; I122-V751 HydrophobicContact CG1-CG2 3.77Å; I122-V751 HydrophobicContact CG2-CG1 3.86Å; I122-V751 HydrophobicContact CG2-CG2 3.89Å; Y126-V751 HydrophobicContact CE2-CB 4.21Å; Y126-V751 HydrophobicContact CE2-CG1 3.82Å; V751-F772 HydrophobicContact CG1-CB 3.95Å; V751-L773 CarbonylContact C-O 3.59Å; V751-L773 WeakPolarHBondContact CA-O 3.35Å; V751-A774 HydrophobicContact CG2-CB 4.37Å
752	W	89.4	Confident	72.8	Confident	19 Å²	19	37.2 Å²	37.2	7%	0.072	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	140	174.1	-60.3	-87.4	0	0	0	111.7	I750 V754 L773 V775 I831 D834 I835 R838	I750-W752 HydrophobicContact CB-CH2 3.6Å; I750-W752 HydrophobicContact CB-CZ2 4.13Å; I750-W752 HydrophobicContact CB-CZ3 3.91Å; I750-W752 HydrophobicContact CD1-CH2 4.33Å; I750-W752 HydrophobicContact CG2-CH2 3.58Å; I750-W752 HydrophobicContact CG2-CZ2 3.56Å; I750-W752 HydrophobicContact CG2-CZ3 4.07Å; I750-W752 WeakPolarHBondContact O-CZ3 3.14Å; W752-V754 HydrophobicContact CB-CG1 4.42Å; W752-V754 PolarHBondContact O-N 2.8Å; W752-L773 PolarHBondContact N-O 3.48Å; W752-L773 PolarHBondContact O-N 3.36Å; W752-V775 HydrophobicContact CZ3-CB 3.99Å; W752-V775 HydrophobicContact CZ3-CG2 3.87Å; W752-I831 HydrophobicContact CB-CG2 4.33Å; W752-I831 HydrophobicContact CG-CG2 4.15Å; W752-D834 HydrophobicContact CZ2-CB 4.42Å; W752-I835 HydrophobicContact CB-CD1 4.12Å; W752-I835 HydrophobicContact CB-CG1 4.33Å; W752-I835 HydrophobicContact CD2-CD1 4.25Å; W752-I835 HydrophobicContact CD2-CG1 3.47Å; W752-I835 VanDerWaalsContact CD2-CG1 3.47Å; W752-I835 HydrophobicContact CE3-CG1 3.89Å; W752-I835 HydrophobicContact CG-CD1 3.99Å; W752-I835 HydrophobicContact CG-CG1 3.7Å; W752-I835 HydrophobicContact CZ2-CG1 4.2Å; W752-I835 HydrophobicContact CZ3-CG1 4.41Å; W752-R838 HydrophobicContact CH2-CB 3.71Å; W752-R838 HydrophobicContact CH2-CG 3.88Å; W752-R838 HydrophobicContact CZ2-CB 4.39Å
753	D	88.8	Confident	72	Confident	31 Å²	31	42.3 Å²	42.3	17%	0.166	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	122.8	166.1	-57.3	-103.7	0	0	0	110.2	R785	D753-R785 IonicContact OD1-CZ 3.79Å; D753-R785 VanDerWaalsContact OD1-CZ 3.27Å; D753-R785 IonicContact OD1-NH1 2.82Å; D753-R785 PolarHBondContact OD1-NH1 2.87Å; D753-R785 IonicContact OD1-NH2 3.47Å; D753-R785 PolarHBondContact OD1-NH2 3.41Å
754	V	91	Very high	70.8	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.018	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	160.3	178.1	-60.1	0	0	0	0	111.4	W752 C771 L773 L821 R822 T823 I835	W752-V754 HydrophobicContact CB-CG1 4.42Å; W752-V754 PolarHBondContact O-N 2.8Å; V754-C771 HydrophobicContact CG2-CB 4.12Å; V754-C771 PolarHBondContact N-O 3.38Å; V754-C771 PolarHBondContact O-N 3.13Å; V754-L773 HydrophobicContact CG1-CB 3.96Å; V754-L773 HydrophobicContact CG1-CD2 4.25Å; V754-L773 HydrophobicContact CG2-CB 3.71Å; V754-L821 HydrophobicContact CG2-CD2 4.02Å; V754-R822 CarbonylContact C-O 3.46Å; V754-R822 WeakPolarHBondContact CA-O 3.18Å; V754-T823 HydrophobicContact CG1-CG2 4.42Å; V754-I835 HydrophobicContact CG1-CD1 4.32Å
755	Q	90.1	Very high	69.9	Low	40 Å²	40	49.5 Å²	49.5	19%	0.187	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	132.1	161.3	-81	173.2	-8.1	0	0	109.4	D770 L821 R822 V824	Q755-D770 WeakPolarHBondContact CG-OD1 3.44Å; Q755-D770 PolarHBondContact NE2-OD1 3.45Å; Q755-L821 CarbonylContact O-C 3.57Å; Q755-R822 HydrophobicContact CB-CB 4.25Å; Q755-R822 PolarHBondContact N-O 2.83Å; Q755-R822 PolarHBondContact O-N 2.8Å; Q755-V824 HydrophobicContact CB-CG2 4.49Å; Q755-V824 HydrophobicContact CG-CG2 3.83Å
756	V	88	Confident	69.3	Low	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	140.6	172.5	94.2	0	0	0	0	109.1	V235 T758 T768 V769 M782 I819 L821	V235-V756 HydrophobicContact CG1-CB 4.16Å; V235-V756 HydrophobicContact CG1-CG1 3.41Å; V235-V756 VanDerWaalsContact CG1-CG1 3.41Å; V235-V756 HydrophobicContact CG1-CG2 3.62Å; V756-T758 HydrophobicContact CG1-CG2 3.88Å; V756-T768 CarbonylContact O-C 3.45Å; V756-T768 VanDerWaalsContact O-CA 3.23Å; V756-T768 WeakPolarHBondContact O-CA 3.2Å; V756-V769 HydrophobicContact CG1-CB 4.1Å; V756-V769 PolarHBondContact N-O 3.18Å; V756-V769 PolarHBondContact O-N 3.17Å; V756-M782 HydrophobicContact CG2-CE 3.83Å; V756-M782 HydrophobicContact CG2-SD 3.77Å; V756-I819 HydrophobicContact CG2-CG2 3.79Å; V756-L821 HydrophobicContact CG2-CD2 4.21Å
757	L	79.2	Confident	68.9	Low	39 Å²	39	52.8 Å²	52.8	20%	0.204	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	132.3	169.3	-80.9	65.8	0	0	0	109.1	T768 I820	L757-T768 HydrophobicContact CD1-CG2 4.15Å; L757-T768 HydrophobicContact CG-CG2 4.36Å; L757-I820 HydrophobicContact CB-CB 4.28Å; L757-I820 HydrophobicContact CD1-CG2 4.24Å; L757-I820 HydrophobicContact CD2-CB 4.31Å; L757-I820 HydrophobicContact CD2-CG2 4.16Å; L757-I820 PolarHBondContact N-O 2.86Å
758	T	68.1	Low	68.9	Low	13 Å²	13	51.9 Å²	51.9	8%	0.08	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	142.1	173.2	53.3	0	0	0	0	111.5	V235 V756 L760 C767 V769	V235-T758 HydrophobicContact CG1-CG2 3.79Å; V756-T758 HydrophobicContact CG1-CG2 3.88Å; T758-L760 PolarHBondContact O-N 3.02Å; T758-C767 PolarHBondContact N-O 2.86Å; T758-C767 PolarHBondContact O-N 3.09Å; T758-C767 PolarHBondContact OG1-SG 3.24Å; T758-V769 HydrophobicContact CG2-CG2 4.17Å
759	E	58.2	Low	68.9	Low	63 Å²	63	52.5 Å²	52.5	29%	0.294	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	110.3	166	-82	172.6	178.6	0	0	109.4	L237 T239 F763	L237-E759 HydrophobicContact CD2-CG 3.68Å; T239-E759 WeakPolarHBondContact CG2-OE2 3.39Å; T239-E759 PolarHBondContact OG1-OE2 2.82Å; E759-F763 HydrophobicContact CG-CD1 4.47Å; E759-F763 WeakPolarHBondContact OE1-CD1 3.1Å; E759-F763 WeakPolarHBondContact OE2-CE1 3.25Å
760	L	42.3	Very low	69	Low	78 Å²	78	56.1 Å²	56.1	41%	0.408	30%	0.3	S	S	.	.			trans	-76.4	161.8	153.5	-78.8	164.6	0	0	0	109.4	T758 L765 C767	T758-L760 PolarHBondContact O-N 3.02Å; L760-L765 HydrophobicContact CB-CB 4.22Å; L760-L765 WeakPolarHBondContact CB-O 3.43Å; L760-L765 PolarHBondContact N-O 3.18Å; L760-C767 HydrophobicContact CD1-CB 4.27Å; L760-C767 VanDerWaalsContact CD1-SG 3.53Å
761	E	39.3	Very low	69.1	Low	164 Å²	164	55.7 Å²	55.7	77%	0.766	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-48.2	147.2	-169.5	-55.4	-172.4	131.5	0	0	114.3	F763	E761-F763 VanDerWaalsContact C-N 3.32Å; E761-F763 PolarHBondContact O-N 3.01Å
762	N	37.4	Very low	69.1	Low	134 Å²	134	55.4 Å²	55.4	72%	0.717	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	66.4	22.3	175.9	-50.5	-75.7	0	0	0	115.7	S764	N762-S764 PolarHBondContact O-N 3.41Å; N762-S764 PolarHBondContact O-OG 2.67Å
763	F	41.4	Very low	69.3	Low	134 Å²	134	54.6 Å²	54.6	59%	0.588	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	59.7	5.9	174.2	-58.8	-82.5	0	0	0	115.8	T239 E759 E761	T239-F763 VanDerWaalsContact OG1-CE1 3.29Å; T239-F763 WeakPolarHBondContact OG1-CE1 3.1Å; T239-F763 WeakPolarHBondContact OG1-CZ 3.37Å; E759-F763 HydrophobicContact CG-CD1 4.47Å; E759-F763 WeakPolarHBondContact OE1-CD1 3.1Å; E759-F763 WeakPolarHBondContact OE2-CE1 3.25Å; E761-F763 VanDerWaalsContact C-N 3.32Å; E761-F763 PolarHBondContact O-N 3.01Å
764	S	38.4	Very low	69.4	Low	66 Å²	66	53.1 Å²	53.1	46%	0.462	29%	0.285	S	S	.	.			trans	-99.8	-14.7	-168.9	42	0	0	0	0	115.4	N762	N762-S764 PolarHBondContact O-N 3.41Å; N762-S764 PolarHBondContact O-OG 2.67Å
765	L	43	Very low	69.4	Low	96 Å²	96	53 Å²	53	50%	0.503	28%	0.284	S	S	.	.			trans	-127.4	94.8	177.6	-81	160.4	0	0	0	110.1	L760 C767	L760-L765 HydrophobicContact CB-CB 4.22Å; L760-L765 WeakPolarHBondContact CB-O 3.43Å; L760-L765 PolarHBondContact N-O 3.18Å; L765-C767 PolarHBondContact O-N 2.91Å
766	C	57.3	Low	69.2	Low	72 Å²	72	51.1 Å²	51.1	49%	0.486	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	97.4	167.3	-178.2	0	0	0	0	108.2
767	C	68.9	Low	69	Low	45 Å²	45	52.5 Å²	52.5	30%	0.304	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	160.9	168.9	60.1	0	0	0	0	110.5	T758 L760 L765	T758-C767 PolarHBondContact N-O 2.86Å; T758-C767 PolarHBondContact O-N 3.09Å; T758-C767 PolarHBondContact OG1-SG 3.24Å; L760-C767 HydrophobicContact CD1-CB 4.27Å; L760-C767 VanDerWaalsContact CD1-SG 3.53Å; L765-C767 PolarHBondContact O-N 2.91Å
768	T	79.8	Confident	69.1	Low	72 Å²	72	52.6 Å²	52.6	44%	0.442	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.4	173.4	46.9	0	0	0	0	109.7	V756 L757	V756-T768 CarbonylContact O-C 3.45Å; V756-T768 VanDerWaalsContact O-CA 3.23Å; V756-T768 WeakPolarHBondContact O-CA 3.2Å; L757-T768 HydrophobicContact CD1-CG2 4.15Å; L757-T768 HydrophobicContact CG-CG2 4.36Å
769	V	82.9	Confident	69.9	Low	13 Å²	13	52.9 Å²	52.9	8%	0.079	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125.9	175.9	-173.5	0	0	0	0	109.2	V756 T758 C771 E784 L791	V756-V769 HydrophobicContact CG1-CB 4.1Å; V756-V769 PolarHBondContact N-O 3.18Å; V756-V769 PolarHBondContact O-N 3.17Å; T758-V769 HydrophobicContact CG2-CG2 4.17Å; V769-C771 PolarHBondContact O-N 3.49Å; V769-C771 PolarHBondContact O-SG 3.11Å; V769-E784 HydrophobicContact CG1-CB 4.49Å; V769-E784 HydrophobicContact CG1-CG 3.75Å; V769-E784 WeakPolarHBondContact CG1-OE1 3.31Å; V769-L791 HydrophobicContact CG1-CD1 3.99Å
770	D	89.1	Confident	71.3	Confident	76 Å²	76	50.1 Å²	50.1	41%	0.406	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	122.7	175.3	-62.9	-57	0	0	0	110	Q755 R785	Q755-D770 WeakPolarHBondContact CG-OD1 3.44Å; Q755-D770 PolarHBondContact NE2-OD1 3.45Å; D770-R785 HydrophobicContact CB-CB 4.19Å; D770-R785 WeakPolarHBondContact O-CB 3.14Å; D770-R785 PolarHBondContact O-N 2.95Å
771	C	89.2	Confident	73.4	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.014	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	152.9	-172.1	-59.8	0	0	0	0	112.2	V754 V769 I783	V754-C771 HydrophobicContact CG2-CB 4.12Å; V754-C771 PolarHBondContact N-O 3.38Å; V754-C771 PolarHBondContact O-N 3.13Å; V769-C771 PolarHBondContact O-N 3.49Å; V769-C771 PolarHBondContact O-SG 3.11Å; C771-I783 CarbonylContact C-O 3.45Å; C771-I783 WeakPolarHBondContact CA-O 3.4Å; C771-I783 WeakPolarHBondContact CB-O 3.48Å
772	F	90.4	Very high	75.7	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.018	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	117.4	158.6	-53.1	-56.4	0	0	0	108.7	I122 Y126 V751 M782 I783 R785	I122-F772 HydrophobicContact CG2-CB 4.16Å; I122-F772 HydrophobicContact CG2-CD2 4.39Å; I122-F772 HydrophobicContact CG2-CG 4.35Å; Y126-F772 AromaticContact CD1-CD1 3.95Å; Y126-F772 HydrophobicContact CD1-CD1 3.95Å; Y126-F772 AromaticContact CD1-CE1 3.4Å; Y126-F772 HydrophobicContact CD1-CE1 3.4Å; Y126-F772 VanDerWaalsContact CD1-CE1 3.4Å; Y126-F772 HydrophobicContact CD1-CZ 4.08Å; Y126-F772 HydrophobicContact CD2-CE1 4.49Å; Y126-F772 HydrophobicContact CE1-CD1 4.28Å; Y126-F772 HydrophobicContact CE1-CE1 4.13Å; Y126-F772 HydrophobicContact CG-CD1 4.12Å; Y126-F772 AromaticContact CG-CE1 3.6Å; Y126-F772 HydrophobicContact CG-CE1 3.6Å; Y126-F772 AromaticContact CG-CZ 3.87Å; Y126-F772 HydrophobicContact CG-CZ 3.87Å; V751-F772 HydrophobicContact CG1-CB 3.95Å; F772-M782 WeakPolarHBondContact O-CA 3.48Å; F772-I783 HydrophobicContact CB-CB 4.47Å; F772-I783 HydrophobicContact CD2-CB 4.41Å; F772-I783 PolarHBondContact N-O 3.05Å; F772-I783 PolarHBondContact O-N 2.82Å; F772-R785 HydrophobicContact CE1-CG 4.34Å; F772-R785 HydrophobicContact CE2-CB 4.36Å; F772-R785 HydrophobicContact CE2-CG 4.26Å; F772-R785 HydrophobicContact CZ-CB 4.24Å; F772-R785 HydrophobicContact CZ-CG 3.75Å
773	L	92.3	Very high	77.9	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	120.1	167.2	172.9	64.4	0	0	0	108.6	V751 W752 V754 V775 L780 M782 L821 I835	V751-L773 CarbonylContact C-O 3.59Å; V751-L773 WeakPolarHBondContact CA-O 3.35Å; W752-L773 PolarHBondContact N-O 3.48Å; W752-L773 PolarHBondContact O-N 3.36Å; V754-L773 HydrophobicContact CG1-CB 3.96Å; V754-L773 HydrophobicContact CG1-CD2 4.25Å; V754-L773 HydrophobicContact CG2-CB 3.71Å; L773-V775 HydrophobicContact CD1-CG2 4.21Å; L773-V775 HydrophobicContact CG-CG2 4.16Å; L773-L780 HydrophobicContact CD1-CD1 4.25Å; L773-L780 HydrophobicContact CD1-CD2 3.9Å; L773-L780 HydrophobicContact CD1-CG 3.94Å; L773-M782 HydrophobicContact CD1-CG 3.98Å; L773-L821 HydrophobicContact CD2-CD1 4.01Å; L773-L821 HydrophobicContact CD2-CD2 4.38Å; L773-I835 HydrophobicContact CD2-CD1 4.13Å; L773-I835 HydrophobicContact CD2-CG1 4.37Å; L773-I835 HydrophobicContact CD2-CG2 4.03Å
774	A	90.8	Very high	80	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.8	-179.4	0	0	0	0	0	110.3	I122 A749 I750 V751 L780 V781	I122-A774 HydrophobicContact CD1-CB 3.49Å; I122-A774 VanDerWaalsContact CD1-CB 3.49Å; A749-A774 HydrophobicContact CB-CB 4.1Å; I750-A774 WeakPolarHBondContact O-CA 3.22Å; V751-A774 HydrophobicContact CG2-CB 4.37Å; A774-L780 WeakPolarHBondContact O-CA 3.45Å; A774-V781 HydrophobicContact CB-CB 4.39Å; A774-V781 PolarHBondContact N-O 2.84Å; A774-V781 PolarHBondContact O-N 3.5Å
775	V	90.9	Very high	82.1	Confident	1 Å²	1	29 Å²	29	1%	0.006	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	103.5	-178.7	-171.4	0	0	0	0	110.8	A749 I750 W752 L773 L780 R838 V842	A749-V775 WeakPolarHBondContact CA-O 3.44Å; I750-V775 PolarHBondContact N-O 2.79Å; I750-V775 PolarHBondContact O-N 3.49Å; W752-V775 HydrophobicContact CZ3-CB 3.99Å; W752-V775 HydrophobicContact CZ3-CG2 3.87Å; L773-V775 HydrophobicContact CD1-CG2 4.21Å; L773-V775 HydrophobicContact CG-CG2 4.16Å; V775-L780 HydrophobicContact CG2-CD1 4.04Å; V775-L780 HydrophobicContact CG2-CG 4.12Å; V775-R838 HydrophobicContact CB-CG 3.97Å; V775-R838 HydrophobicContact CG1-CG 3.71Å; V775-R838 PolarHBondContact O-NE 3.06Å; V775-R838 PolarHBondContact O-NH2 2.93Å; V775-V842 HydrophobicContact CG1-CG2 3.73Å
776	S	87.6	Confident	83.8	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.168	C	C	.	.			trans	-87.3	-176.1	171.6	92.3	0	0	0	0	110.9	L289 R747 D778 Y779	L289-S776 WeakPolarHBondContact O-CB 3.23Å; L289-S776 PolarHBondContact O-OG 2.86Å; R747-S776 VanDerWaalsContact O-CB 3.31Å; R747-S776 WeakPolarHBondContact O-CB 3.26Å; S776-D778 VanDerWaalsContact C-N 3.3Å; S776-D778 PolarHBondContact OG-N 3.03Å; S776-Y779 PolarHBondContact N-O 2.66Å; S776-Y779 PolarHBondContact OG-N 3.32Å
777	A	83.8	Confident	84.6	Confident	29 Å²	29	29.1 Å²	29.1	24%	0.24	17%	0.166	C	C	.	.	S	Bend	trans	-69.3	-29.2	169.7	0	0	0	0	0	112.8	R747 T796	R747-A777 HydrophobicContact CB-CB 4.48Å; R747-A777 HydrophobicContact CG-CB 4.26Å; R747-A777 PolarHBondContact O-N 3.18Å; A777-T796 WeakPolarHBondContact O-CG2 3.39Å; A777-T796 PolarHBondContact O-OG1 2.99Å
778	D	80.9	Confident	84.9	Confident	42 Å²	42	31.6 Å²	31.6	23%	0.225	17%	0.172	C	C	.	.	S	Bend	trans	-105.4	-29.7	-171.4	-60.5	-59.2	0	0	0	113	N291 S776 A795 T796	N291-D778 HydrophobicContact CB-CB 4.33Å; N291-D778 VanDerWaalsContact CB-OD2 3.23Å; N291-D778 WeakPolarHBondContact CB-OD2 3.38Å; N291-D778 PolarHBondContact N-OD2 3.39Å; S776-D778 VanDerWaalsContact C-N 3.3Å; S776-D778 PolarHBondContact OG-N 3.03Å; D778-A795 CarbonylContact O-C 3.5Å; D778-A795 WeakPolarHBondContact O-CA 3.38Å; D778-T796 PolarHBondContact O-N 3.39Å; D778-T796 PolarHBondContact O-OG1 2.87Å
779	Y	83.4	Confident	84.6	Confident	19 Å²	19	30 Å²	30	8%	0.075	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	150.2	-173.1	-62.2	-85.3	0	0	0	114.4	V288 L297 S776 T794	V288-Y779 WeakPolarHBondContact O-CE2 3.48Å; L297-Y779 HydrophobicContact CD1-CE1 3.83Å; L297-Y779 WeakPolarHBondContact CD1-OH 3.18Å; S776-Y779 PolarHBondContact N-O 2.66Å; S776-Y779 PolarHBondContact OG-N 3.32Å; Y779-T794 WeakPolarHBondContact CA-O 3.19Å
780	L	88.8	Confident	84.3	Confident	4 Å²	4	30.2 Å²	30.2	2%	0.021	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.2	161.9	-177.3	152.5	0	0	0	108.7	L773 A774 V775 F792 C793 T794 L811 L839	L773-L780 HydrophobicContact CD1-CD1 4.25Å; L773-L780 HydrophobicContact CD1-CD2 3.9Å; L773-L780 HydrophobicContact CD1-CG 3.94Å; A774-L780 WeakPolarHBondContact O-CA 3.45Å; V775-L780 HydrophobicContact CG2-CD1 4.04Å; V775-L780 HydrophobicContact CG2-CG 4.12Å; L780-F792 HydrophobicContact CD2-CD1 4.05Å; L780-F792 HydrophobicContact CD2-CE1 3.93Å; L780-C793 WeakPolarHBondContact O-CA 3.49Å; L780-T794 HydrophobicContact CB-CG2 4.23Å; L780-T794 PolarHBondContact N-O 3.27Å; L780-T794 PolarHBondContact O-N 3.16Å; L780-L811 HydrophobicContact CD1-CD1 3.8Å; L780-L839 HydrophobicContact CD1-CD2 3.91Å
781	V	86.2	Confident	83.7	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	144.2	-171.8	-175.2	0	0	0	0	110	A286 L289 A774 I783 T790 F792 C793	A286-V781 HydrophobicContact CB-CG1 4.08Å; A286-V781 HydrophobicContact CB-CG2 4.14Å; L289-V781 HydrophobicContact CD2-CB 4.3Å; L289-V781 HydrophobicContact CD2-CG2 3.54Å; A774-V781 HydrophobicContact CB-CB 4.39Å; A774-V781 PolarHBondContact N-O 2.84Å; A774-V781 PolarHBondContact O-N 3.5Å; V781-I783 HydrophobicContact CG1-CG1 4.22Å; V781-T790 HydrophobicContact CG1-CG2 3.5Å; V781-F792 CarbonylContact C-O 3.08Å; V781-F792 WeakPolarHBondContact CA-O 3.45Å; V781-F792 WeakPolarHBondContact CG1-O 3.21Å; V781-C793 HydrophobicContact CG2-CB 4.33Å
782	M	87.9	Confident	83.3	Confident	1 Å²	1	27.5 Å²	27.5	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	125.9	173.2	-56.3	-170.9	-66.4	0	0	110.3	V235 V756 F772 L773 T790 L791 F792 I819 L821	V235-M782 HydrophobicContact CB-CE 4.16Å; V235-M782 HydrophobicContact CG1-CE 3.76Å; V756-M782 HydrophobicContact CG2-CE 3.83Å; V756-M782 HydrophobicContact CG2-SD 3.77Å; F772-M782 WeakPolarHBondContact O-CA 3.48Å; L773-M782 HydrophobicContact CD1-CG 3.98Å; M782-T790 CarbonylContact O-C 3.57Å; M782-L791 PolarHBondContact O-N 2.82Å; M782-F792 HydrophobicContact CB-CB 4.14Å; M782-F792 HydrophobicContact CE-CB 3.39Å; M782-F792 HydrophobicContact CE-CD1 3.77Å; M782-F792 HydrophobicContact CE-CG 3.73Å; M782-F792 HydrophobicContact CG-CB 4.36Å; M782-F792 HydrophobicContact CG-CD1 4.46Å; M782-F792 PolarHBondContact N-O 3.35Å; M782-F792 PolarHBondContact O-N 2.87Å; M782-I819 HydrophobicContact CE-CD1 3.87Å; M782-I819 HydrophobicContact CE-CG1 4.32Å; M782-I819 HydrophobicContact CE-CG2 3.8Å; M782-I819 HydrophobicContact SD-CG2 4.17Å; M782-L821 HydrophobicContact SD-CD2 3.67Å
783	I	83.3	Confident	82.8	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127.6	-177.1	-51.1	173.1	0	0	0	108.6	C119 I122 C771 F772 V781 T789	C119-I783 HydrophobicContact CB-CD1 3.73Å; I122-I783 HydrophobicContact CB-CD1 4.27Å; I122-I783 HydrophobicContact CD1-CD1 4.33Å; I122-I783 HydrophobicContact CG2-CD1 4.26Å; C771-I783 CarbonylContact C-O 3.45Å; C771-I783 WeakPolarHBondContact CA-O 3.4Å; C771-I783 WeakPolarHBondContact CB-O 3.48Å; F772-I783 HydrophobicContact CB-CB 4.47Å; F772-I783 HydrophobicContact CD2-CB 4.41Å; F772-I783 PolarHBondContact N-O 3.05Å; F772-I783 PolarHBondContact O-N 2.82Å; V781-I783 HydrophobicContact CG1-CG1 4.22Å; I783-T789 CarbonylContact C-O 3.55Å; I783-T789 WeakPolarHBondContact CA-O 3.19Å
784	E	85.1	Confident	82.2	Confident	11 Å²	11	27.6 Å²	27.6	5%	0.051	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	130.7	176.4	-177.1	170.8	-129.3	0	0	111.2	R233 V769 S786 T787 E788 T789 L791	R233-E784 IonicContact CZ-OE1 3.33Å; R233-E784 VanDerWaalsContact CZ-OE1 3.26Å; R233-E784 IonicContact CZ-OE2 2.79Å; R233-E784 IonicContact NH1-OE1 2.81Å; R233-E784 PolarHBondContact NH1-OE1 3.13Å; R233-E784 IonicContact NH1-OE2 3.22Å; R233-E784 PolarHBondContact NH1-OE2 3.13Å; R233-E784 IonicContact NH2-OE1 2.93Å; R233-E784 PolarHBondContact NH2-OE1 3.25Å; V769-E784 HydrophobicContact CG1-CB 4.49Å; V769-E784 HydrophobicContact CG1-CG 3.75Å; V769-E784 WeakPolarHBondContact CG1-OE1 3.31Å; E784-S786 VanDerWaalsContact C-N 3.35Å; E784-S786 WeakPolarHBondContact CG-OG 3.4Å; E784-S786 PolarHBondContact O-N 2.92Å; E784-T787 WeakPolarHBondContact OE2-CB 3.19Å; E784-T787 WeakPolarHBondContact OE2-CG2 3.28Å; E784-T787 PolarHBondContact OE2-OG1 2.91Å; E784-E788 WeakPolarHBondContact O-CA 3.36Å; E784-E788 PolarHBondContact O-N 3.01Å; E784-T789 PolarHBondContact N-O 3.39Å; E784-L791 HydrophobicContact CB-CD1 3.88Å; E784-L791 HydrophobicContact CB-CD2 4.08Å; E784-L791 HydrophobicContact CB-CG 3.86Å
785	R	82.6	Confident	81.8	Confident	122 Å²	122	27.7 Å²	27.7	46%	0.46	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-31.5	-175.6	-176.1	174.2	-158.5	136.3	18.6	113.9	D753 D770 F772	D753-R785 IonicContact OD1-CZ 3.79Å; D753-R785 VanDerWaalsContact OD1-CZ 3.27Å; D753-R785 IonicContact OD1-NH1 2.82Å; D753-R785 PolarHBondContact OD1-NH1 2.87Å; D753-R785 IonicContact OD1-NH2 3.47Å; D753-R785 PolarHBondContact OD1-NH2 3.41Å; D770-R785 HydrophobicContact CB-CB 4.19Å; D770-R785 WeakPolarHBondContact O-CB 3.14Å; D770-R785 PolarHBondContact O-N 2.95Å; F772-R785 HydrophobicContact CE1-CG 4.34Å; F772-R785 HydrophobicContact CE2-CB 4.36Å; F772-R785 HydrophobicContact CE2-CG 4.26Å; F772-R785 HydrophobicContact CZ-CB 4.24Å; F772-R785 HydrophobicContact CZ-CG 3.75Å
786	S	79.2	Confident	81.6	Confident	98 Å²	98	28.2 Å²	28.2	69%	0.685	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-27.3	-174.6	52	0	0	0	0	114.1	E784	E784-S786 VanDerWaalsContact C-N 3.35Å; E784-S786 WeakPolarHBondContact CG-OG 3.4Å; E784-S786 PolarHBondContact O-N 2.92Å
787	T	74.8	Confident	81.5	Confident	72 Å²	72	30.8 Å²	30.8	44%	0.442	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-7.2	-175.6	65.3	0	0	0	0	113.9	E784 T789	E784-T787 WeakPolarHBondContact OE2-CB 3.19Å; E784-T787 WeakPolarHBondContact OE2-CG2 3.28Å; E784-T787 PolarHBondContact OE2-OG1 2.91Å; T787-T789 PolarHBondContact O-N 2.86Å; T787-T789 VanDerWaalsContact O-N 3.09Å; T787-T789 PolarHBondContact OG1-N 3.4Å; T787-T789 PolarHBondContact OG1-OG1 2.86Å
788	E	74.6	Confident	81.7	Confident	96 Å²	96	29.4 Å²	29.4	45%	0.449	15%	0.154	S	C	.	.			trans	54.9	18.7	-170.5	-62.4	-176.3	-165.8	0	0	113.7	C123 E784	C123-E788 HydrophobicContact CB-CB 4.43Å; C123-E788 HydrophobicContact CB-CG 4.19Å; C123-E788 WeakPolarHBondContact CB-OE2 3.35Å; E784-E788 WeakPolarHBondContact O-CA 3.36Å; E784-E788 PolarHBondContact O-N 3.01Å
789	T	73.2	Confident	82.2	Confident	40 Å²	40	27.5 Å²	27.5	25%	0.245	15%	0.145	C	C	.	.			trans	-91.1	137.8	-179.9	66.6	0	0	0	0	112.3	I783 E784 T787 L791	I783-T789 CarbonylContact C-O 3.55Å; I783-T789 WeakPolarHBondContact CA-O 3.19Å; E784-T789 PolarHBondContact N-O 3.39Å; T787-T789 PolarHBondContact O-N 2.86Å; T787-T789 VanDerWaalsContact O-N 3.09Å; T787-T789 PolarHBondContact OG1-N 3.4Å; T787-T789 PolarHBondContact OG1-OG1 2.86Å; T789-L791 PolarHBondContact O-N 3.26Å
790	T	76.5	Confident	82.6	Confident	17 Å²	17	26.8 Å²	26.8	10%	0.104	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	114.1	171.8	-58.7	0	0	0	0	109.9	A283 A286 V781 M782 F792	A283-T790 HydrophobicContact CB-CG2 3.58Å; A283-T790 WeakPolarHBondContact CB-O 3.18Å; A286-T790 HydrophobicContact CB-CG2 4.02Å; V781-T790 HydrophobicContact CG1-CG2 3.5Å; M782-T790 CarbonylContact O-C 3.57Å; T790-F792 WeakPolarHBondContact CG2-O 3.27Å
791	L	76.6	Confident	82.7	Confident	10 Å²	10	26.6 Å²	26.6	5%	0.052	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	-31.6	177	-58.9	-177.3	0	0	0	112.4	V235 I280 V769 M782 E784 T789	V235-L791 HydrophobicContact CG2-CB 3.74Å; V235-L791 WeakPolarHBondContact CG2-O 3.26Å; I280-L791 WeakPolarHBondContact CD1-O 3.33Å; V769-L791 HydrophobicContact CG1-CD1 3.99Å; M782-L791 PolarHBondContact O-N 2.82Å; E784-L791 HydrophobicContact CB-CD1 3.88Å; E784-L791 HydrophobicContact CB-CD2 4.08Å; E784-L791 HydrophobicContact CB-CG 3.86Å; T789-L791 PolarHBondContact O-N 3.26Å
792	F	80.2	Confident	83	Confident	11 Å²	11	26.7 Å²	26.7	5%	0.048	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	143.6	-177.7	-177.3	-106.1	0	0	0	112.1	V235 I280 L780 V781 M782 T790 T794 Y813 I819	V235-F792 HydrophobicContact CG2-CB 4.07Å; I280-F792 HydrophobicContact CD1-CD2 4.25Å; L780-F792 HydrophobicContact CD2-CD1 4.05Å; L780-F792 HydrophobicContact CD2-CE1 3.93Å; V781-F792 CarbonylContact C-O 3.08Å; V781-F792 WeakPolarHBondContact CA-O 3.45Å; V781-F792 WeakPolarHBondContact CG1-O 3.21Å; M782-F792 HydrophobicContact CB-CB 4.14Å; M782-F792 HydrophobicContact CE-CB 3.39Å; M782-F792 HydrophobicContact CE-CD1 3.77Å; M782-F792 HydrophobicContact CE-CG 3.73Å; M782-F792 HydrophobicContact CG-CB 4.36Å; M782-F792 HydrophobicContact CG-CD1 4.46Å; M782-F792 PolarHBondContact N-O 3.35Å; M782-F792 PolarHBondContact O-N 2.87Å; T790-F792 WeakPolarHBondContact CG2-O 3.27Å; F792-T794 HydrophobicContact CE1-CG2 3.51Å; F792-T794 HydrophobicContact CZ-CG2 3.71Å; F792-Y813 HydrophobicContact CE2-CE1 4.33Å; F792-Y813 AromaticContact CE2-CE2 3.97Å; F792-Y813 HydrophobicContact CE2-CE2 3.97Å; F792-Y813 AromaticContact CE2-CZ 3.76Å; F792-Y813 HydrophobicContact CZ-CD1 4.36Å; F792-Y813 HydrophobicContact CZ-CD2 4.17Å; F792-Y813 HydrophobicContact CZ-CE1 4.06Å; F792-Y813 AromaticContact CZ-CE2 3.87Å; F792-Y813 HydrophobicContact CZ-CE2 3.87Å; F792-Y813 HydrophobicContact CZ-CG 4.43Å; F792-Y813 AromaticContact CZ-CZ 3.81Å; F792-I819 HydrophobicContact CD1-CD1 3.65Å; F792-I819 HydrophobicContact CD2-CD1 3.89Å; F792-I819 HydrophobicContact CE1-CD1 3.37Å; F792-I819 HydrophobicContact CE2-CD1 3.65Å; F792-I819 HydrophobicContact CG-CD1 3.88Å; F792-I819 HydrophobicContact CZ-CD1 3.37Å
793	C	80.6	Confident	83	Confident	5 Å²	5	27.3 Å²	27.3	3%	0.034	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	134.6	169.1	178.4	0	0	0	0	109.6	S282 A286 L780 V781	S282-C793 VanDerWaalsContact O-CB 3.28Å; S282-C793 WeakPolarHBondContact O-CB 3.48Å; S282-C793 PolarHBondContact OG-O 3.45Å; A286-C793 HydrophobicContact CB-CB 3.66Å; A286-C793 VanDerWaalsContact CB-SG 3.53Å; L780-C793 WeakPolarHBondContact O-CA 3.49Å; V781-C793 HydrophobicContact CG2-CB 4.33Å
794	T	80.4	Confident	83.1	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	158.3	168.2	-163.7	0	0	0	0	110.1	Y779 L780 F792 S798	Y779-T794 WeakPolarHBondContact CA-O 3.19Å; L780-T794 HydrophobicContact CB-CG2 4.23Å; L780-T794 PolarHBondContact N-O 3.27Å; L780-T794 PolarHBondContact O-N 3.16Å; F792-T794 HydrophobicContact CE1-CG2 3.51Å; F792-T794 HydrophobicContact CZ-CG2 3.71Å; T794-S798 WeakPolarHBondContact OG1-CB 3.35Å
795	A	81.8	Confident	82.8	Confident	2 Å²	2	36 Å²	36	2%	0.017	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	151.4	174.6	0	0	0	0	0	111	D778 H797 S798	D778-A795 CarbonylContact O-C 3.5Å; D778-A795 WeakPolarHBondContact O-CA 3.38Å; A795-H797 WeakPolarHBondContact CB-CE1 3.29Å; A795-H797 WeakPolarHBondContact CB-ND1 3.26Å; A795-H797 PolarHBondContact O-N 3.16Å; A795-S798 WeakPolarHBondContact O-CB 3.37Å; A795-S798 PolarHBondContact O-N 3.32Å
796	T	87.1	Confident	82.7	Confident	12 Å²	12	32.8 Å²	32.8	7%	0.074	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-63.9	-24.6	178.9	49.6	0	0	0	0	113.3	A777 D778 S798 V842 T843	A777-T796 WeakPolarHBondContact O-CG2 3.39Å; A777-T796 PolarHBondContact O-OG1 2.99Å; D778-T796 PolarHBondContact O-N 3.39Å; D778-T796 PolarHBondContact O-OG1 2.87Å; T796-S798 VanDerWaalsContact C-N 3.28Å; T796-S798 PolarHBondContact O-N 3.25Å; T796-V842 WeakPolarHBondContact CB-O 3.44Å; T796-V842 HydrophobicContact CG2-CB 4.07Å; T796-V842 HydrophobicContact CG2-CG2 3.64Å; T796-T843 WeakPolarHBondContact O-CB 3.48Å
797	H	84.9	Confident	82.8	Confident	54 Å²	54	31.2 Å²	31.2	25%	0.25	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-69.9	-23.1	172.1	71.2	-108.4	0	0	0	113.4	L301 A795 V799 G940	L301-H797 PolarHBondContact O-NE2 2.94Å; L301-H797 VanDerWaalsContact O-NE2 3.16Å; A795-H797 WeakPolarHBondContact CB-CE1 3.29Å; A795-H797 WeakPolarHBondContact CB-ND1 3.26Å; A795-H797 PolarHBondContact O-N 3.16Å; H797-V799 VanDerWaalsContact C-N 3.28Å; H797-V799 PolarHBondContact O-N 3.27Å; H797-G940 PolarHBondContact CD2-O 2.94Å
798	S	87.4	Confident	83.3	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-74	-18.7	-179.3	-77.7	0	0	0	0	112.9	T794 A795 T796 I800 Y813 D814 G940	T794-S798 WeakPolarHBondContact OG1-CB 3.35Å; A795-S798 WeakPolarHBondContact O-CB 3.37Å; A795-S798 PolarHBondContact O-N 3.32Å; T796-S798 VanDerWaalsContact C-N 3.28Å; T796-S798 PolarHBondContact O-N 3.25Å; S798-I800 PolarHBondContact O-N 2.62Å; S798-Y813 CarbonylContact O-C 3.58Å; S798-Y813 WeakPolarHBondContact O-CA 3.4Å; S798-Y813 WeakPolarHBondContact O-CB 3.39Å; S798-D814 WeakPolarHBondContact CB-OD1 3.44Å; S798-D814 PolarHBondContact O-N 2.88Å; S798-D814 PolarHBondContact OG-OD1 2.91Å; S798-G940 PolarHBondContact OG-O 3.02Å
799	V	91.1	Very high	84.1	Confident	3 Å²	3	24.8 Å²	24.8	2%	0.018	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	114.3	-178.3	-175.6	0	0	0	0	110.9	H797 W802 L811 T843 G845	H797-V799 VanDerWaalsContact C-N 3.28Å; H797-V799 PolarHBondContact O-N 3.27Å; V799-W802 HydrophobicContact CG1-CE3 4.04Å; V799-W802 HydrophobicContact CG1-CZ3 4.16Å; V799-L811 HydrophobicContact CG1-CD1 4.16Å; V799-L811 HydrophobicContact CG1-CD2 4.16Å; V799-L811 HydrophobicContact CG1-CG 4.07Å; V799-L811 HydrophobicContact CG2-CD2 4.26Å; V799-T843 HydrophobicContact CB-CG2 3.84Å; V799-T843 HydrophobicContact CG1-CG2 4.2Å; V799-T843 HydrophobicContact CG2-CG2 4.08Å; V799-G845 PolarHBondContact O-N 2.97Å
800	I	91.7	Very high	84.8	Confident	3 Å²	3	23.9 Å²	23.9	2%	0.015	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	-22.1	-178.1	58.5	170.4	0	0	0	113.3	S798 Y812 A816 G845 C846 R898 V900 I929 R938	S798-I800 PolarHBondContact O-N 2.62Å; I800-Y812 WeakPolarHBondContact CG1-O 3.45Å; I800-Y812 PolarHBondContact N-O 2.77Å; I800-A816 HydrophobicContact CD1-CB 4.28Å; I800-G845 WeakPolarHBondContact O-CA 3.24Å; I800-C846 PolarHBondContact O-N 3.1Å; I800-R898 HydrophobicContact CD1-CG 4.2Å; I800-V900 HydrophobicContact CD1-CG1 4.15Å; I800-I929 HydrophobicContact CB-CD1 4.47Å; I800-I929 HydrophobicContact CD1-CD1 4.13Å; I800-I929 HydrophobicContact CG1-CD1 4.02Å; I800-R938 HydrophobicContact CB-CB 4.29Å; I800-R938 HydrophobicContact CG2-CB 4.34Å
801	G	91.9	Very high	85.6	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.9	-177.7	174.2	0	0	0	0	0	114	Y812 C846	G801-Y812 PolarHBondContact N-O 2.85Å; G801-Y812 PolarHBondContact O-N 3.43Å; G801-C846 CarbonylContact C-O 3.53Å; G801-C846 WeakPolarHBondContact CA-O 3.39Å
802	W	92.1	Very high	86.3	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.008	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	155.7	-177	54	85.5	0	0	0	112.1	V799 L809 K810 L839 K840 T843 C846 E847 L848	V799-W802 HydrophobicContact CG1-CE3 4.04Å; V799-W802 HydrophobicContact CG1-CZ3 4.16Å; W802-L809 HydrophobicContact CB-CD1 3.86Å; W802-L809 HydrophobicContact CG-CD1 4.07Å; W802-K810 CarbonylContact C-O 3.56Å; W802-K810 WeakPolarHBondContact CA-O 3.3Å; W802-K810 VanDerWaalsContact CB-O 3.24Å; W802-K810 WeakPolarHBondContact CB-O 3.32Å; W802-L839 HydrophobicContact CD2-CD1 4.21Å; W802-L839 HydrophobicContact CE3-CB 4.23Å; W802-L839 HydrophobicContact CE3-CD1 4.22Å; W802-L839 HydrophobicContact CH2-CB 3.87Å; W802-L839 HydrophobicContact CZ2-CB 4.16Å; W802-L839 HydrophobicContact CZ3-CB 3.88Å; W802-K840 HydrophobicContact CH2-CG 4.28Å; W802-K840 HydrophobicContact CZ2-CG 3.76Å; W802-T843 WeakPolarHBondContact CZ3-OG1 3.45Å; W802-C846 PolarHBondContact N-O 3.2Å; W802-E847 HydrophobicContact CZ2-CB 4.22Å; W802-L848 WeakPolarHBondContact O-CB 3.16Å; W802-L848 PolarHBondContact O-N 2.71Å
803	T	88	Confident	86.7	Confident	14 Å²	14	22.7 Å²	22.7	9%	0.086	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	147.1	173.8	-164.8	0	0	0	0	111.8	K810 Y812 L848 I849 L927	T803-K810 HydrophobicContact CG2-CB 3.9Å; T803-K810 HydrophobicContact CG2-CD 3.97Å; T803-K810 HydrophobicContact CG2-CG 4.07Å; T803-K810 PolarHBondContact N-O 2.55Å; T803-K810 PolarHBondContact O-N 2.93Å; T803-Y812 HydrophobicContact CG2-CE2 4.16Å; T803-L848 HydrophobicContact CG2-CD1 4.46Å; T803-I849 WeakPolarHBondContact OG1-CD1 3.39Å; T803-I849 WeakPolarHBondContact OG1-CG1 3.44Å; T803-L927 HydrophobicContact CG2-CD2 4.07Å
804	L	86.4	Confident	86.9	Confident	67 Å²	67	22.5 Å²	22.5	35%	0.351	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	139.1	179.5	-174.2	63.7	0	0	0	110.9	G806 I832 I849	L804-G806 WeakPolarHBondContact CD1-O 3.28Å; L804-I832 HydrophobicContact CD1-CD1 3.83Å; L804-I832 HydrophobicContact CD1-CG2 3.52Å; L804-I832 HydrophobicContact CD2-CG2 4.16Å; L804-I832 HydrophobicContact CG-CG2 4.5Å; L804-I849 HydrophobicContact CB-CD1 4.25Å; L804-I849 WeakPolarHBondContact O-CD1 3.25Å
805	Q	78.8	Confident	87.2	Confident	126 Å²	126	22.7 Å²	22.7	59%	0.589	13%	0.13	S	C	*	.			trans	-141.6	78.8	179.2	-170.3	-177.7	-31.4	0	0	110.3	S808	Q805-S808 PolarHBondContact N-O 2.98Å
806	G	79.2	Confident	87.4	Confident	56 Å²	56	22.6 Å²	22.6	58%	0.577	13%	0.129	S	C	*	.	S	Bend	trans	65	-141.9	-165.9	0	0	0	0	0	109.9	L804 S808	L804-G806 WeakPolarHBondContact CD1-O 3.28Å; G806-S808 PolarHBondContact O-N 2.83Å
807	N	80.8	Confident	87.2	Confident	64 Å²	64	22.4 Å²	22.4	34%	0.342	13%	0.128	S	C	.	.	S	Bend	trans	-76.8	39.2	177.4	-59.3	41.2	0	0	0	112.3	R822 T823 D826 I832	N807-R822 WeakPolarHBondContact O-CA 3.08Å; N807-R822 WeakPolarHBondContact O-CG 3.25Å; N807-T823 PolarHBondContact O-N 3.05Å; N807-D826 PolarHBondContact ND2-O 2.85Å; N807-I832 HydrophobicContact CB-CD1 4.48Å
808	S	86.7	Confident	87.2	Confident	30 Å²	30	20 Å²	20	21%	0.21	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	128.3	-179.6	-60.3	0	0	0	0	111.8	Q805 G806 L821	Q805-S808 PolarHBondContact N-O 2.98Å; G806-S808 PolarHBondContact O-N 2.83Å; S808-L821 CarbonylContact C-O 3.52Å; S808-L821 WeakPolarHBondContact CA-O 3.4Å; S808-L821 WeakPolarHBondContact CB-O 3.35Å
809	L	90.2	Very high	87.2	Confident	3 Å²	3	20.1 Å²	20.1	2%	0.016	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	112.8	-175.4	178	66.9	0	0	0	108.7	W802 L821 I835 I836 L839	W802-L809 HydrophobicContact CB-CD1 3.86Å; W802-L809 HydrophobicContact CG-CD1 4.07Å; L809-L821 HydrophobicContact CB-CB 4.29Å; L809-L821 HydrophobicContact CD2-CD1 4.12Å; L809-L821 HydrophobicContact CG-CD1 4.5Å; L809-L821 PolarHBondContact N-O 2.81Å; L809-L821 PolarHBondContact O-N 2.8Å; L809-I835 HydrophobicContact CD2-CG2 3.84Å; L809-I836 HydrophobicContact CD1-CD1 4.11Å; L809-I836 HydrophobicContact CD1-CG1 4.12Å; L809-I836 HydrophobicContact CD2-CG1 4.34Å; L809-L839 HydrophobicContact CD2-CD1 4.16Å
810	K	89.5	Confident	87.1	Confident	21 Å²	21	21.1 Å²	21.1	9%	0.091	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	126.6	167	-52.3	-171.9	176.1	-177.7	0	108.6	W802 T803 Y812 V818 I819 I820 E901	W802-K810 CarbonylContact C-O 3.56Å; W802-K810 WeakPolarHBondContact CA-O 3.3Å; W802-K810 VanDerWaalsContact CB-O 3.24Å; W802-K810 WeakPolarHBondContact CB-O 3.32Å; T803-K810 HydrophobicContact CG2-CB 3.9Å; T803-K810 HydrophobicContact CG2-CD 3.97Å; T803-K810 HydrophobicContact CG2-CG 4.07Å; T803-K810 PolarHBondContact N-O 2.55Å; T803-K810 PolarHBondContact O-N 2.93Å; K810-Y812 HydrophobicContact CB-CE2 4.27Å; K810-Y812 WeakPolarHBondContact CD-OH 3.07Å; K810-V818 HydrophobicContact CB-CG2 4.12Å; K810-I819 CarbonylContact C-O 3.47Å; K810-I819 WeakPolarHBondContact CA-O 3.41Å; K810-I820 HydrophobicContact CD-CD1 4.36Å; K810-I820 HydrophobicContact CG-CD1 4.19Å; K810-I820 HydrophobicContact CG-CG1 4.06Å; K810-I820 HydrophobicContact CG-CG2 4.44Å; K810-E901 IonicContact NZ-OE1 2.97Å; K810-E901 PolarHBondContact NZ-OE1 2.91Å; K810-E901 IonicContact NZ-OE2 2.89Å; K810-E901 PolarHBondContact NZ-OE2 2.9Å
811	L	91.7	Very high	87	Confident	2 Å²	2	21.3 Å²	21.3	1%	0.01	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	126.7	177.7	-176.6	145.2	0	0	0	109.8	L780 V799 Y813 V818 I819 L839	L780-L811 HydrophobicContact CD1-CD1 3.8Å; V799-L811 HydrophobicContact CG1-CD1 4.16Å; V799-L811 HydrophobicContact CG1-CD2 4.16Å; V799-L811 HydrophobicContact CG1-CG 4.07Å; V799-L811 HydrophobicContact CG2-CD2 4.26Å; L811-Y813 HydrophobicContact CD2-CD1 4.42Å; L811-V818 WeakPolarHBondContact O-CA 3.34Å; L811-I819 PolarHBondContact N-O 3.11Å; L811-I819 PolarHBondContact O-N 2.78Å; L811-L839 HydrophobicContact CD1-CD1 3.93Å; L811-L839 HydrophobicContact CD1-CD2 3.98Å
812	Y	90.9	Very high	86.9	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	135.2	-177.9	-57.5	-82.4	0	0	0	110.9	I800 G801 T803 K810 D817 V818 L848 V900 E901 L927 I929	I800-Y812 WeakPolarHBondContact CG1-O 3.45Å; I800-Y812 PolarHBondContact N-O 2.77Å; G801-Y812 PolarHBondContact N-O 2.85Å; G801-Y812 PolarHBondContact O-N 3.43Å; T803-Y812 HydrophobicContact CG2-CE2 4.16Å; K810-Y812 HydrophobicContact CB-CE2 4.27Å; K810-Y812 WeakPolarHBondContact CD-OH 3.07Å; Y812-D817 VanDerWaalsContact CA-O 3.3Å; Y812-D817 WeakPolarHBondContact CA-O 3.41Å; Y812-V818 HydrophobicContact CD1-CB 3.76Å; Y812-V818 HydrophobicContact CD1-CG2 3.7Å; Y812-V818 HydrophobicContact CE1-CB 3.82Å; Y812-V818 HydrophobicContact CE1-CG2 3.47Å; Y812-V818 VanDerWaalsContact CE1-CG2 3.47Å; Y812-V818 HydrophobicContact CG-CG2 4.47Å; Y812-L848 HydrophobicContact CD2-CD1 3.97Å; Y812-L848 HydrophobicContact CE2-CD1 3.6Å; Y812-V900 HydrophobicContact CD1-CB 3.83Å; Y812-V900 HydrophobicContact CD1-CG1 4.38Å; Y812-V900 HydrophobicContact CD1-CG2 4.06Å; Y812-V900 HydrophobicContact CD2-CG2 4.17Å; Y812-V900 HydrophobicContact CE1-CB 3.92Å; Y812-V900 HydrophobicContact CE1-CG2 3.84Å; Y812-V900 HydrophobicContact CE2-CG2 3.96Å; Y812-V900 HydrophobicContact CG-CB 4.23Å; Y812-V900 HydrophobicContact CG-CG1 4.41Å; Y812-V900 HydrophobicContact CG-CG2 4.23Å; Y812-E901 HydrophobicContact CE1-CG 4.15Å; Y812-E901 VanDerWaalsContact OH-CD 3.23Å; Y812-E901 WeakPolarHBondContact OH-CG 3.35Å; Y812-E901 PolarHBondContact OH-OE1 3.39Å; Y812-L927 HydrophobicContact CE2-CD2 4.31Å; Y812-L927 VanDerWaalsContact OH-CD2 3.31Å; Y812-L927 WeakPolarHBondContact OH-CD2 3.25Å; Y812-I929 HydrophobicContact CD2-CD1 4.49Å
813	Y	88.8	Confident	86.6	Confident	12 Å²	12	27.6 Å²	27.6	5%	0.047	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	169.9	-176.2	69.3	-80.2	0	0	0	113.1	S236 F792 S798 L811 H815 A816 D817 I819	S236-Y813 WeakPolarHBondContact CB-OH 3.3Å; S236-Y813 PolarHBondContact OG-OH 3.05Å; F792-Y813 HydrophobicContact CE2-CE1 4.33Å; F792-Y813 AromaticContact CE2-CE2 3.97Å; F792-Y813 HydrophobicContact CE2-CE2 3.97Å; F792-Y813 AromaticContact CE2-CZ 3.76Å; F792-Y813 HydrophobicContact CZ-CD1 4.36Å; F792-Y813 HydrophobicContact CZ-CD2 4.17Å; F792-Y813 HydrophobicContact CZ-CE1 4.06Å; F792-Y813 AromaticContact CZ-CE2 3.87Å; F792-Y813 HydrophobicContact CZ-CE2 3.87Å; F792-Y813 HydrophobicContact CZ-CG 4.43Å; F792-Y813 AromaticContact CZ-CZ 3.81Å; S798-Y813 CarbonylContact O-C 3.58Å; S798-Y813 WeakPolarHBondContact O-CA 3.4Å; S798-Y813 WeakPolarHBondContact O-CB 3.39Å; L811-Y813 HydrophobicContact CD2-CD1 4.42Å; Y813-H815 PolarHBondContact O-N 3.09Å; Y813-A816 WeakPolarHBondContact O-CA 2.99Å; Y813-A816 PolarHBondContact O-N 3.23Å; Y813-D817 HydrophobicContact CD1-CB 4.12Å; Y813-D817 WeakPolarHBondContact CD1-O 3.29Å; Y813-D817 HydrophobicContact CD2-CB 4.34Å; Y813-D817 HydrophobicContact CE1-CB 3.56Å; Y813-D817 HydrophobicContact CE2-CB 3.81Å; Y813-D817 HydrophobicContact CG-CB 4.46Å; Y813-D817 PolarHBondContact N-O 3.32Å; Y813-D817 PolarHBondContact O-N 2.87Å; Y813-D817 VanDerWaalsContact O-N 3.14Å; Y813-I819 HydrophobicContact CD1-CD1 4.23Å; Y813-I819 HydrophobicContact CE1-CD1 3.68Å; Y813-I819 HydrophobicContact CE1-CG1 3.97Å
814	D	85.9	Confident	86	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.1	-95.7	177.8	-78.5	-23.1	0	0	0	114.8	C302 A303 S798 G940	C302-D814 WeakPolarHBondContact CA-OD1 3.31Å; C302-D814 HydrophobicContact CB-CB 3.96Å; C302-D814 WeakPolarHBondContact CB-OD1 3.43Å; C302-D814 WeakPolarHBondContact CB-OD2 3.33Å; A303-D814 PolarHBondContact N-OD2 3.23Å; S798-D814 WeakPolarHBondContact CB-OD1 3.44Å; S798-D814 PolarHBondContact O-N 2.88Å; S798-D814 PolarHBondContact OG-OD1 2.91Å; D814-G940 PolarHBondContact O-N 3.25Å
815	H	85.7	Confident	85.4	Confident	6 Å²	6	30.8 Å²	30.8	3%	0.028	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	28.5	-175.3	-63.9	-54.6	0	0	0	113.5	C302 Y813 E876 R898 V949	C302-H815 PolarHBondContact SG-NE2 2.73Å; Y813-H815 PolarHBondContact O-N 3.09Å; H815-E876 HydrophobicContact CB-CB 4.3Å; H815-E876 IonicContact CE1-OE2 2.95Å; H815-E876 IonicContact CG-OE2 3.68Å; H815-E876 IonicContact ND1-OE2 2.86Å; H815-E876 PolarHBondContact ND1-OE2 2.94Å; H815-R898 VanDerWaalsContact C-NH2 3.3Å; H815-V949 VanDerWaalsContact CE1-CG2 3.47Å; H815-V949 WeakPolarHBondContact CE1-CG2 3.5Å; H815-V949 WeakPolarHBondContact ND1-CG2 3.48Å
816	A	85.9	Confident	85.4	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	76	24.3	-170.2	0	0	0	0	0	114.8	I800 Y813 V900 S906 A908	I800-A816 HydrophobicContact CD1-CB 4.28Å; Y813-A816 WeakPolarHBondContact O-CA 2.99Å; Y813-A816 PolarHBondContact O-N 3.23Å; A816-V900 HydrophobicContact CB-CB 4.35Å; A816-V900 HydrophobicContact CB-CG1 3.92Å; A816-S906 PolarHBondContact O-OG 2.79Å; A816-A908 WeakPolarHBondContact O-CB 3.43Å
817	D	83.7	Confident	85.2	Confident	8 Å²	8	30 Å²	30	4%	0.043	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	152.2	163.1	-67.7	-63.4	0	0	0	110.3	Y304 Y812 Y813 A908	Y304-D817 PolarHBondContact OH-OD2 2.91Å; Y812-D817 VanDerWaalsContact CA-O 3.3Å; Y812-D817 WeakPolarHBondContact CA-O 3.41Å; Y813-D817 HydrophobicContact CD1-CB 4.12Å; Y813-D817 WeakPolarHBondContact CD1-O 3.29Å; Y813-D817 HydrophobicContact CD2-CB 4.34Å; Y813-D817 HydrophobicContact CE1-CB 3.56Å; Y813-D817 HydrophobicContact CE2-CB 3.81Å; Y813-D817 HydrophobicContact CG-CB 4.46Å; Y813-D817 PolarHBondContact N-O 3.32Å; Y813-D817 PolarHBondContact O-N 2.87Å; Y813-D817 VanDerWaalsContact O-N 3.14Å; D817-A908 WeakPolarHBondContact OD1-CB 3.46Å
818	V	85.6	Confident	85.1	Confident	2 Å²	2	33.6 Å²	33.6	1%	0.012	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	132.9	-170.2	66.3	0	0	0	0	113.2	S236 L237 K810 L811 Y812	S236-V818 WeakPolarHBondContact CA-O 3.45Å; S236-V818 PolarHBondContact OG-N 3.39Å; S236-V818 PolarHBondContact OG-O 3.39Å; L237-V818 HydrophobicContact CB-CG1 3.91Å; L237-V818 HydrophobicContact CD1-CG1 4.22Å; L237-V818 HydrophobicContact CG-CG1 4.26Å; L237-V818 PolarHBondContact N-O 2.65Å; K810-V818 HydrophobicContact CB-CG2 4.12Å; L811-V818 WeakPolarHBondContact O-CA 3.34Å; Y812-V818 HydrophobicContact CD1-CB 3.76Å; Y812-V818 HydrophobicContact CD1-CG2 3.7Å; Y812-V818 HydrophobicContact CE1-CB 3.82Å; Y812-V818 HydrophobicContact CE1-CG2 3.47Å; Y812-V818 VanDerWaalsContact CE1-CG2 3.47Å; Y812-V818 HydrophobicContact CG-CG2 4.47Å
819	I	87.2	Confident	84.8	Confident	3 Å²	3	33.4 Å²	33.4	2%	0.015	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	142.7	170	-72.2	155.4	0	0	0	108.3	V756 M782 F792 K810 L811 Y813 L821	V756-I819 HydrophobicContact CG2-CG2 3.79Å; M782-I819 HydrophobicContact CE-CD1 3.87Å; M782-I819 HydrophobicContact CE-CG1 4.32Å; M782-I819 HydrophobicContact CE-CG2 3.8Å; M782-I819 HydrophobicContact SD-CG2 4.17Å; F792-I819 HydrophobicContact CD1-CD1 3.65Å; F792-I819 HydrophobicContact CD2-CD1 3.89Å; F792-I819 HydrophobicContact CE1-CD1 3.37Å; F792-I819 HydrophobicContact CE2-CD1 3.65Å; F792-I819 HydrophobicContact CG-CD1 3.88Å; F792-I819 HydrophobicContact CZ-CD1 3.37Å; K810-I819 CarbonylContact C-O 3.47Å; K810-I819 WeakPolarHBondContact CA-O 3.41Å; L811-I819 PolarHBondContact N-O 3.11Å; L811-I819 PolarHBondContact O-N 2.78Å; Y813-I819 HydrophobicContact CD1-CD1 4.23Å; Y813-I819 HydrophobicContact CE1-CD1 3.68Å; Y813-I819 HydrophobicContact CE1-CG1 3.97Å; I819-L821 HydrophobicContact CG2-CD2 4.34Å; I819-L821 HydrophobicContact CG2-CG 4.2Å
820	I	87.9	Confident	84.5	Confident	25 Å²	25	36.7 Å²	36.7	13%	0.128	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	114.6	173.5	-49.6	-171.8	0	0	0	109.4	L237 L757 K810	L237-I820 HydrophobicContact CD1-CD1 3.61Å; L237-I820 HydrophobicContact CD1-CG1 3.9Å; L757-I820 HydrophobicContact CB-CB 4.28Å; L757-I820 HydrophobicContact CD1-CG2 4.24Å; L757-I820 HydrophobicContact CD2-CB 4.31Å; L757-I820 HydrophobicContact CD2-CG2 4.16Å; L757-I820 PolarHBondContact N-O 2.86Å; K810-I820 HydrophobicContact CD-CD1 4.36Å; K810-I820 HydrophobicContact CG-CD1 4.19Å; K810-I820 HydrophobicContact CG-CG1 4.06Å; K810-I820 HydrophobicContact CG-CG2 4.44Å
821	L	90.2	Very high	84.3	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.037	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	149.4	175.5	-60.8	159.2	0	0	0	109.5	V754 Q755 V756 L773 M782 S808 L809 I819	V754-L821 HydrophobicContact CG2-CD2 4.02Å; Q755-L821 CarbonylContact O-C 3.57Å; V756-L821 HydrophobicContact CG2-CD2 4.21Å; L773-L821 HydrophobicContact CD2-CD1 4.01Å; L773-L821 HydrophobicContact CD2-CD2 4.38Å; M782-L821 HydrophobicContact SD-CD2 3.67Å; S808-L821 CarbonylContact C-O 3.52Å; S808-L821 WeakPolarHBondContact CA-O 3.4Å; S808-L821 WeakPolarHBondContact CB-O 3.35Å; L809-L821 HydrophobicContact CB-CB 4.29Å; L809-L821 HydrophobicContact CD2-CD1 4.12Å; L809-L821 HydrophobicContact CG-CD1 4.5Å; L809-L821 PolarHBondContact N-O 2.81Å; L809-L821 PolarHBondContact O-N 2.8Å; I819-L821 HydrophobicContact CG2-CD2 4.34Å; I819-L821 HydrophobicContact CG2-CG 4.2Å
822	R	88.7	Confident	84.1	Confident	126 Å²	126	36.9 Å²	36.9	48%	0.475	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	137	169.5	170.3	172.5	-174.6	175.6	0.9	108.5	V754 Q755 N807	V754-R822 CarbonylContact C-O 3.46Å; V754-R822 WeakPolarHBondContact CA-O 3.18Å; Q755-R822 HydrophobicContact CB-CB 4.25Å; Q755-R822 PolarHBondContact N-O 2.83Å; Q755-R822 PolarHBondContact O-N 2.8Å; N807-R822 WeakPolarHBondContact O-CA 3.08Å; N807-R822 WeakPolarHBondContact O-CG 3.25Å
823	T	87.1	Confident	83.9	Confident	8 Å²	8	39 Å²	39	5%	0.049	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	148.1	172.4	42.2	0	0	0	0	111.3	V754 N807 D826 I831 I832 I835	V754-T823 HydrophobicContact CG1-CG2 4.42Å; N807-T823 PolarHBondContact O-N 3.05Å; T823-D826 VanDerWaalsContact CB-OD2 3.31Å; T823-D826 WeakPolarHBondContact CB-OD2 3.28Å; T823-D826 WeakPolarHBondContact OG1-CB 3.46Å; T823-D826 PolarHBondContact OG1-OD2 2.79Å; T823-I831 HydrophobicContact CG2-CB 3.94Å; T823-I831 HydrophobicContact CG2-CG2 3.81Å; T823-I832 HydrophobicContact CG2-CD1 4.33Å; T823-I832 HydrophobicContact CG2-CG1 3.68Å; T823-I832 WeakPolarHBondContact OG1-CD1 3.4Å; T823-I832 WeakPolarHBondContact OG1-CG1 3.33Å; T823-I835 HydrophobicContact CG2-CD1 4.06Å
824	V	75	Confident	83.7	Confident	43 Å²	43	40.1 Å²	40.1	26%	0.261	22%	0.218	S	C	.	.	S	Bend	trans	-105.2	133.2	177.4	-172.4	0	0	0	0	107.9	R108 Q755	R108-V824 PolarHBondContact NH2-O 3.45Å; Q755-V824 HydrophobicContact CB-CG2 4.49Å; Q755-V824 HydrophobicContact CG-CG2 3.83Å
825	D	74.1	Confident	83.8	Confident	105 Å²	105	40.3 Å²	40.3	56%	0.561	22%	0.219	S	C	*	.	S	Bend	trans	51.2	65.2	-177.5	-47.5	-31.5	0	0	0	112.5	R108	R108-D825 PolarHBondContact NH1-O 2.87Å
826	D	77.7	Confident	84	Confident	7 Å²	7	40.4 Å²	40.4	4%	0.037	22%	0.22	C	C	.	.			trans	-136.9	43.4	-172.9	-165.6	21.5	0	0	0	111.6	N807 T823 D828 G829 L830 I831 I832	N807-D826 PolarHBondContact ND2-O 2.85Å; T823-D826 VanDerWaalsContact CB-OD2 3.31Å; T823-D826 WeakPolarHBondContact CB-OD2 3.28Å; T823-D826 WeakPolarHBondContact OG1-CB 3.46Å; T823-D826 PolarHBondContact OG1-OD2 2.79Å; D826-D828 PolarHBondContact O-N 3.4Å; D826-G829 PolarHBondContact O-N 2.98Å; D826-G829 VanDerWaalsContact OD1-C 3.22Å; D826-G829 WeakPolarHBondContact OD1-CA 3.31Å; D826-G829 PolarHBondContact OD1-N 2.88Å; D826-L830 PolarHBondContact OD1-N 2.88Å; D826-I831 HydrophobicContact CB-CB 4.45Å; D826-I831 HydrophobicContact CB-CD1 3.71Å; D826-I831 HydrophobicContact CB-CG1 4.11Å; D826-I831 WeakPolarHBondContact OD1-CG1 3.32Å; D826-I831 PolarHBondContact OD1-N 2.79Å; D826-I832 PolarHBondContact OD2-N 2.9Å
827	D	75.1	Confident	84.1	Confident	158 Å²	158	42.7 Å²	42.7	85%	0.845	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-28.4	-174.8	-65.4	-40.5	0	0	0	113.1
828	D	79.7	Confident	84.3	Confident	139 Å²	139	42.5 Å²	42.5	74%	0.743	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	-8.2	173	-67.8	-36.4	0	0	0	113.6	D826 L830	D826-D828 PolarHBondContact O-N 3.4Å; D828-L830 HydrophobicContact CB-CD1 3.74Å; D828-L830 HydrophobicContact CB-CG 3.69Å; D828-L830 PolarHBondContact O-N 2.85Å
829	G	81	Confident	84.6	Confident	26 Å²	26	42.4 Å²	42.4	27%	0.268	23%	0.232	S	C	.	.	S	Bend	trans	67.5	16.7	-177	0	0	0	0	0	115.4	D826 A833	D826-G829 PolarHBondContact O-N 2.98Å; D826-G829 VanDerWaalsContact OD1-C 3.22Å; D826-G829 WeakPolarHBondContact OD1-CA 3.31Å; D826-G829 PolarHBondContact OD1-N 2.88Å; G829-A833 PolarHBondContact O-N 2.89Å; G829-A833 VanDerWaalsContact O-N 3.12Å
830	L	82.6	Confident	84.6	Confident	73 Å²	73	46.7 Å²	46.7	38%	0.382	25%	0.251	S	S	.	.	H	α-helix	trans	-72.3	-38	-174.2	-67.4	171.1	0	0	0	112.8	R737 D826 D828 I832 A833 D834	R737-L830 VanDerWaalsContact NH1-CD1 3.33Å; D826-L830 PolarHBondContact OD1-N 2.88Å; D828-L830 HydrophobicContact CB-CD1 3.74Å; D828-L830 HydrophobicContact CB-CG 3.69Å; D828-L830 PolarHBondContact O-N 2.85Å; L830-I832 VanDerWaalsContact C-N 3.34Å; L830-A833 WeakPolarHBondContact O-CB 3.49Å; L830-A833 PolarHBondContact O-N 2.82Å; L830-A833 VanDerWaalsContact O-N 3.15Å; L830-D834 PolarHBondContact O-N 3Å
831	I	85.4	Confident	84.5	Confident	16 Å²	16	49.7 Å²	49.7	8%	0.082	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-44.4	180	-48.6	173	0	0	0	109.3	W752 T823 D826 A833 D834 I835	W752-I831 HydrophobicContact CB-CG2 4.33Å; W752-I831 HydrophobicContact CG-CG2 4.15Å; T823-I831 HydrophobicContact CG2-CB 3.94Å; T823-I831 HydrophobicContact CG2-CG2 3.81Å; D826-I831 HydrophobicContact CB-CB 4.45Å; D826-I831 HydrophobicContact CB-CD1 3.71Å; D826-I831 HydrophobicContact CB-CG1 4.11Å; D826-I831 WeakPolarHBondContact OD1-CG1 3.32Å; D826-I831 PolarHBondContact OD1-N 2.79Å; I831-A833 VanDerWaalsContact C-N 3.3Å; I831-A833 PolarHBondContact O-N 2.67Å; I831-D834 PolarHBondContact O-N 3.49Å; I831-I835 HydrophobicContact CG2-CD1 3.98Å; I831-I835 VanDerWaalsContact O-CG1 3.31Å; I831-I835 WeakPolarHBondContact O-CG1 3.46Å; I831-I835 PolarHBondContact O-N 2.92Å
832	I	87.9	Confident	84.3	Confident	10 Å²	10	50.6 Å²	50.6	5%	0.051	27%	0.268	C	S	.	.	H	α-helix	trans	-58.9	-41.1	172.8	-81.1	176.9	0	0	0	111.6	L804 N807 T823 D826 L830 I835 I836	L804-I832 HydrophobicContact CD1-CD1 3.83Å; L804-I832 HydrophobicContact CD1-CG2 3.52Å; L804-I832 HydrophobicContact CD2-CG2 4.16Å; L804-I832 HydrophobicContact CG-CG2 4.5Å; N807-I832 HydrophobicContact CB-CD1 4.48Å; T823-I832 HydrophobicContact CG2-CD1 4.33Å; T823-I832 HydrophobicContact CG2-CG1 3.68Å; T823-I832 WeakPolarHBondContact OG1-CD1 3.4Å; T823-I832 WeakPolarHBondContact OG1-CG1 3.33Å; D826-I832 PolarHBondContact OD2-N 2.9Å; L830-I832 VanDerWaalsContact C-N 3.34Å; I832-I835 PolarHBondContact O-N 2.91Å; I832-I836 HydrophobicContact CG2-CD1 3.68Å; I832-I836 HydrophobicContact CG2-CG1 4.44Å; I832-I836 VanDerWaalsContact O-CB 3.25Å; I832-I836 WeakPolarHBondContact O-CB 3.29Å; I832-I836 VanDerWaalsContact O-CG1 3.24Å; I832-I836 WeakPolarHBondContact O-CG1 3.31Å; I832-I836 PolarHBondContact O-N 2.82Å
833	A	86.2	Confident	84.3	Confident	45 Å²	45	45.4 Å²	45.4	37%	0.372	25%	0.251	S	S	.	.	H	α-helix	trans	-63.8	-39.1	176.9	0	0	0	0	0	112.5	G829 L830 I831 T837	G829-A833 PolarHBondContact O-N 2.89Å; G829-A833 VanDerWaalsContact O-N 3.12Å; L830-A833 WeakPolarHBondContact O-CB 3.49Å; L830-A833 PolarHBondContact O-N 2.82Å; L830-A833 VanDerWaalsContact O-N 3.15Å; I831-A833 VanDerWaalsContact C-N 3.3Å; I831-A833 PolarHBondContact O-N 2.67Å; A833-T837 VanDerWaalsContact O-CB 3.31Å; A833-T837 WeakPolarHBondContact O-CB 3.38Å; A833-T837 PolarHBondContact O-N 2.84Å; A833-T837 PolarHBondContact O-OG1 3.21Å
834	D	84.4	Confident	84.2	Confident	35 Å²	35	52.4 Å²	52.4	19%	0.187	28%	0.28	C	S	.	.	H	α-helix	trans	-67.4	-47.2	175.6	-74.6	-9.6	0	0	0	111.8	Q112 W752 L830 I831 I836 T837 R838	Q112-D834 PolarHBondContact NE2-OD2 3.14Å; W752-D834 HydrophobicContact CZ2-CB 4.42Å; L830-D834 PolarHBondContact O-N 3Å; I831-D834 PolarHBondContact O-N 3.49Å; D834-I836 PolarHBondContact O-N 3.23Å; D834-T837 WeakPolarHBondContact O-CB 3.44Å; D834-T837 PolarHBondContact O-N 2.93Å; D834-T837 VanDerWaalsContact O-N 3.11Å; D834-R838 PolarHBondContact O-N 3.38Å
835	I	88.7	Confident	84.7	Confident	4 Å²	4	51 Å²	51	2%	0.021	28%	0.275	C	S	.	.	H	α-helix	trans	-56.9	-49.5	175.1	-69.1	163.5	0	0	0	110.4	W752 V754 L773 L809 T823 I831 I832 T837 R838 L839	W752-I835 HydrophobicContact CB-CD1 4.12Å; W752-I835 HydrophobicContact CB-CG1 4.33Å; W752-I835 HydrophobicContact CD2-CD1 4.25Å; W752-I835 HydrophobicContact CD2-CG1 3.47Å; W752-I835 VanDerWaalsContact CD2-CG1 3.47Å; W752-I835 HydrophobicContact CE3-CG1 3.89Å; W752-I835 HydrophobicContact CG-CD1 3.99Å; W752-I835 HydrophobicContact CG-CG1 3.7Å; W752-I835 HydrophobicContact CZ2-CG1 4.2Å; W752-I835 HydrophobicContact CZ3-CG1 4.41Å; V754-I835 HydrophobicContact CG1-CD1 4.32Å; L773-I835 HydrophobicContact CD2-CD1 4.13Å; L773-I835 HydrophobicContact CD2-CG1 4.37Å; L773-I835 HydrophobicContact CD2-CG2 4.03Å; L809-I835 HydrophobicContact CD2-CG2 3.84Å; T823-I835 HydrophobicContact CG2-CD1 4.06Å; I831-I835 HydrophobicContact CG2-CD1 3.98Å; I831-I835 VanDerWaalsContact O-CG1 3.31Å; I831-I835 WeakPolarHBondContact O-CG1 3.46Å; I831-I835 PolarHBondContact O-N 2.92Å; I832-I835 PolarHBondContact O-N 2.91Å; I835-T837 VanDerWaalsContact C-N 3.28Å; I835-T837 PolarHBondContact O-N 2.96Å; I835-R838 PolarHBondContact O-N 2.91Å; I835-L839 HydrophobicContact CG2-CD1 3.97Å; I835-L839 HydrophobicContact CG2-CG 4.45Å; I835-L839 WeakPolarHBondContact O-CG 3.43Å; I835-L839 PolarHBondContact O-N 3.45Å
836	I	89.8	Confident	85.1	Confident	9 Å²	9	46.9 Å²	46.9	5%	0.046	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-37	177.6	-75.5	174	0	0	0	111.2	L809 I832 D834 L839 K840 E847	L809-I836 HydrophobicContact CD1-CD1 4.11Å; L809-I836 HydrophobicContact CD1-CG1 4.12Å; L809-I836 HydrophobicContact CD2-CG1 4.34Å; I832-I836 HydrophobicContact CG2-CD1 3.68Å; I832-I836 HydrophobicContact CG2-CG1 4.44Å; I832-I836 VanDerWaalsContact O-CB 3.25Å; I832-I836 WeakPolarHBondContact O-CB 3.29Å; I832-I836 VanDerWaalsContact O-CG1 3.24Å; I832-I836 WeakPolarHBondContact O-CG1 3.31Å; I832-I836 PolarHBondContact O-N 2.82Å; D834-I836 PolarHBondContact O-N 3.23Å; I836-L839 PolarHBondContact O-N 3.1Å; I836-K840 HydrophobicContact CG2-CD 3.97Å; I836-K840 VanDerWaalsContact CG2-CE 3.43Å; I836-K840 WeakPolarHBondContact O-CD 3.25Å; I836-K840 VanDerWaalsContact O-CG 3.24Å; I836-K840 WeakPolarHBondContact O-CG 3.39Å; I836-K840 PolarHBondContact O-N 3.41Å; I836-E847 VanDerWaalsContact CG2-OE1 3.25Å; I836-E847 WeakPolarHBondContact CG2-OE1 3.47Å
837	T	87.4	Confident	85.1	Confident	48 Å²	48	48.7 Å²	48.7	29%	0.294	26%	0.262	S	S	.	.	H	α-helix	trans	-65.7	-43.1	176.8	-63.1	0	0	0	0	111.2	A833 D834 I835 K840 F841	A833-T837 VanDerWaalsContact O-CB 3.31Å; A833-T837 WeakPolarHBondContact O-CB 3.38Å; A833-T837 PolarHBondContact O-N 2.84Å; A833-T837 PolarHBondContact O-OG1 3.21Å; D834-T837 WeakPolarHBondContact O-CB 3.44Å; D834-T837 PolarHBondContact O-N 2.93Å; D834-T837 VanDerWaalsContact O-N 3.11Å; I835-T837 VanDerWaalsContact C-N 3.28Å; I835-T837 PolarHBondContact O-N 2.96Å; T837-K840 PolarHBondContact O-N 3.44Å; T837-F841 HydrophobicContact CG2-CD2 4.43Å; T837-F841 HydrophobicContact CG2-CE2 4.37Å; T837-F841 WeakPolarHBondContact O-CD2 3.31Å; T837-F841 PolarHBondContact O-N 2.75Å
838	R	88.5	Confident	84.7	Confident	3 Å²	3	41.5 Å²	41.5	1%	0.011	22%	0.224	C	C	.	.	H	α-helix	trans	-61.6	-47.4	172.9	179.6	63	162.2	175.1	-9.3	112	A744 N746 G748 I750 W752 V775 D834 I835 K840 F841 V842	A744-R838 VanDerWaalsContact C-NH1 3.34Å; A744-R838 PolarHBondContact O-NH1 3.34Å; N746-R838 VanDerWaalsContact O-CZ 3.3Å; N746-R838 PolarHBondContact O-NH1 3Å; N746-R838 PolarHBondContact O-NH2 3.17Å; G748-R838 PolarHBondContact O-NH2 2.66Å; I750-R838 HydrophobicContact CD1-CG 4.44Å; W752-R838 HydrophobicContact CH2-CB 3.71Å; W752-R838 HydrophobicContact CH2-CG 3.88Å; W752-R838 HydrophobicContact CZ2-CB 4.39Å; V775-R838 HydrophobicContact CB-CG 3.97Å; V775-R838 HydrophobicContact CG1-CG 3.71Å; V775-R838 PolarHBondContact O-NE 3.06Å; V775-R838 PolarHBondContact O-NH2 2.93Å; D834-R838 PolarHBondContact O-N 3.38Å; I835-R838 PolarHBondContact O-N 2.91Å; R838-K840 VanDerWaalsContact C-N 3.26Å; R838-K840 PolarHBondContact O-N 2.92Å; R838-F841 PolarHBondContact O-N 3.08Å; R838-V842 PolarHBondContact O-N 3.41Å; R838-V842 VanDerWaalsContact O-N 3.1Å
839	L	91.2	Very high	83.4	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-57.9	-37.5	178.8	-72.7	171.1	0	0	0	112.4	L780 W802 L809 L811 I835 I836 F841 T843	L780-L839 HydrophobicContact CD1-CD2 3.91Å; W802-L839 HydrophobicContact CD2-CD1 4.21Å; W802-L839 HydrophobicContact CE3-CB 4.23Å; W802-L839 HydrophobicContact CE3-CD1 4.22Å; W802-L839 HydrophobicContact CH2-CB 3.87Å; W802-L839 HydrophobicContact CZ2-CB 4.16Å; W802-L839 HydrophobicContact CZ3-CB 3.88Å; L809-L839 HydrophobicContact CD2-CD1 4.16Å; L811-L839 HydrophobicContact CD1-CD1 3.93Å; L811-L839 HydrophobicContact CD1-CD2 3.98Å; I835-L839 HydrophobicContact CG2-CD1 3.97Å; I835-L839 HydrophobicContact CG2-CG 4.45Å; I835-L839 WeakPolarHBondContact O-CG 3.43Å; I835-L839 PolarHBondContact O-N 3.45Å; I836-L839 PolarHBondContact O-N 3.1Å; L839-F841 VanDerWaalsContact C-N 3.25Å; L839-F841 PolarHBondContact O-N 2.64Å; L839-T843 HydrophobicContact CD2-CG2 4.04Å; L839-T843 WeakPolarHBondContact O-CB 3.48Å; L839-T843 WeakPolarHBondContact O-CG2 3.39Å; L839-T843 PolarHBondContact O-N 2.65Å; L839-T843 VanDerWaalsContact O-N 3.12Å; L839-T843 PolarHBondContact O-OG1 3.38Å
840	K	88.7	Confident	81.7	Confident	93 Å²	93	43.8 Å²	43.8	40%	0.404	22%	0.223	S	C	.	.	H	α-helix	trans	-65.3	-22.7	174.9	-74.4	164.8	177.7	162.2	0	114.1	W802 I836 T837 R838 E847	W802-K840 HydrophobicContact CH2-CG 4.28Å; W802-K840 HydrophobicContact CZ2-CG 3.76Å; I836-K840 HydrophobicContact CG2-CD 3.97Å; I836-K840 VanDerWaalsContact CG2-CE 3.43Å; I836-K840 WeakPolarHBondContact O-CD 3.25Å; I836-K840 VanDerWaalsContact O-CG 3.24Å; I836-K840 WeakPolarHBondContact O-CG 3.39Å; I836-K840 PolarHBondContact O-N 3.41Å; T837-K840 PolarHBondContact O-N 3.44Å; R838-K840 VanDerWaalsContact C-N 3.26Å; R838-K840 PolarHBondContact O-N 2.92Å; K840-E847 WeakPolarHBondContact CE-OE2 3.37Å; K840-E847 IonicContact NZ-OE1 2.67Å; K840-E847 PolarHBondContact NZ-OE1 2.77Å; K840-E847 IonicContact NZ-OE2 2.76Å; K840-E847 PolarHBondContact NZ-OE2 3.24Å
841	F	85	Confident	79.4	Confident	88 Å²	88	52.4 Å²	52.4	39%	0.386	25%	0.25	S	S	.	.	H	α-helix	trans	-93.1	-38.4	178.4	-86.6	-66.5	0	0	0	113.9	F741 A744 F745 T837 R838 L839	F741-F841 HydrophobicContact CD2-CE2 4.15Å; F741-F841 HydrophobicContact CD2-CZ 4.35Å; F741-F841 AromaticContact CE2-CE2 3.75Å; F741-F841 HydrophobicContact CE2-CE2 3.75Å; F741-F841 AromaticContact CE2-CZ 3.54Å; F741-F841 HydrophobicContact CE2-CZ 3.54Å; F741-F841 HydrophobicContact CZ-CE2 4.41Å; F741-F841 AromaticContact CZ-CZ 3.81Å; F741-F841 HydrophobicContact CZ-CZ 3.81Å; A744-F841 HydrophobicContact CB-CD2 3.7Å; A744-F841 HydrophobicContact CB-CE2 4.2Å; A744-F841 HydrophobicContact CB-CG 4.4Å; F745-F841 HydrophobicContact CD1-CD1 4.1Å; F745-F841 HydrophobicContact CD1-CE1 4.18Å; F745-F841 AromaticContact CE1-CD1 3.62Å; F745-F841 HydrophobicContact CE1-CD1 3.62Å; F745-F841 AromaticContact CE1-CE1 3.26Å; F745-F841 HydrophobicContact CE1-CE1 3.26Å; F745-F841 HydrophobicContact CE1-CE2 4.5Å; F745-F841 HydrophobicContact CE1-CG 4.4Å; F745-F841 AromaticContact CE1-CZ 3.75Å; F745-F841 HydrophobicContact CE1-CZ 3.75Å; F745-F841 HydrophobicContact CZ-CD1 4.41Å; F745-F841 AromaticContact CZ-CE1 3.72Å; F745-F841 HydrophobicContact CZ-CE1 3.72Å; F745-F841 HydrophobicContact CZ-CE2 4.43Å; F745-F841 AromaticContact CZ-CZ 3.71Å; F745-F841 HydrophobicContact CZ-CZ 3.71Å; T837-F841 HydrophobicContact CG2-CD2 4.43Å; T837-F841 HydrophobicContact CG2-CE2 4.37Å; T837-F841 WeakPolarHBondContact O-CD2 3.31Å; T837-F841 PolarHBondContact O-N 2.75Å; R838-F841 PolarHBondContact O-N 3.08Å; L839-F841 VanDerWaalsContact C-N 3.25Å; L839-F841 PolarHBondContact O-N 2.64Å
842	V	85.9	Confident	76.8	Confident	25 Å²	25	55.1 Å²	55.1	15%	0.152	28%	0.275	C	S	.	.	H	α-helix	trans	-95.8	-17.7	-173.3	-53	0	0	0	0	114.2	V775 T796 R838	V775-V842 HydrophobicContact CG1-CG2 3.73Å; T796-V842 WeakPolarHBondContact CB-O 3.44Å; T796-V842 HydrophobicContact CG2-CB 4.07Å; T796-V842 HydrophobicContact CG2-CG2 3.64Å; R838-V842 PolarHBondContact O-N 3.41Å; R838-V842 VanDerWaalsContact O-N 3.1Å
843	T	89.1	Confident	74	Confident	17 Å²	17	60.2 Å²	60.2	10%	0.104	31%	0.307	C	S	.	.			trans	-112.7	163.8	-177.8	80	0	0	0	0	112.2	T796 V799 W802 L839 G845	T796-T843 WeakPolarHBondContact O-CB 3.48Å; V799-T843 HydrophobicContact CB-CG2 3.84Å; V799-T843 HydrophobicContact CG1-CG2 4.2Å; V799-T843 HydrophobicContact CG2-CG2 4.08Å; W802-T843 WeakPolarHBondContact CZ3-OG1 3.45Å; L839-T843 HydrophobicContact CD2-CG2 4.04Å; L839-T843 WeakPolarHBondContact O-CB 3.48Å; L839-T843 WeakPolarHBondContact O-CG2 3.39Å; L839-T843 PolarHBondContact O-N 2.65Å; L839-T843 VanDerWaalsContact O-N 3.12Å; L839-T843 PolarHBondContact O-OG1 3.38Å; T843-G845 VanDerWaalsContact C-N 3.3Å; T843-G845 PolarHBondContact OG1-N 3.15Å
844	K	85.4	Confident	71.4	Confident	155 Å²	155	66.1 Å²	66.1	67%	0.674	33%	0.331	S	S	*	.			trans	-93.6	17.7	162.6	-67.9	-171.2	176.6	-173.9	0	112.6	R938	K844-R938 PolarHBondContact O-NH1 3.05Å
845	G	84.6	Confident	69.4	Low	14 Å²	14	70 Å²	70	14%	0.144	35%	0.348	C	S	.	.			trans	-70.1	165.8	179.3	0	0	0	0	0	112.8	V799 I800 T843	V799-G845 PolarHBondContact O-N 2.97Å; I800-G845 WeakPolarHBondContact O-CA 3.24Å; T843-G845 VanDerWaalsContact C-N 3.3Å; T843-G845 PolarHBondContact OG1-N 3.15Å
846	C	82.6	Confident	67.3	Low	18 Å²	18	71 Å²	71	12%	0.122	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	139.9	178.4	-175.5	0	0	0	0	111.4	I800 G801 W802 I929	I800-C846 PolarHBondContact O-N 3.1Å; G801-C846 CarbonylContact C-O 3.53Å; G801-C846 WeakPolarHBondContact CA-O 3.39Å; W802-C846 PolarHBondContact N-O 3.2Å; C846-I929 HydrophobicContact CB-CG2 3.79Å
847	E	78.3	Confident	65.6	Low	45 Å²	45	76.3 Å²	76.3	21%	0.21	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	113.4	175.1	176.1	174.9	-114.3	0	0	110.1	W802 I836 K840 I849	W802-E847 HydrophobicContact CZ2-CB 4.22Å; I836-E847 VanDerWaalsContact CG2-OE1 3.25Å; I836-E847 WeakPolarHBondContact CG2-OE1 3.47Å; K840-E847 WeakPolarHBondContact CE-OE2 3.37Å; K840-E847 IonicContact NZ-OE1 2.67Å; K840-E847 PolarHBondContact NZ-OE1 2.77Å; K840-E847 IonicContact NZ-OE2 2.76Å; K840-E847 PolarHBondContact NZ-OE2 3.24Å; E847-I849 PolarHBondContact O-N 2.89Å; E847-I849 VanDerWaalsContact O-N 3.07Å
848	L	66.9	Low	64.1	Low	8 Å²	8	79.2 Å²	79.2	4%	0.042	39%	0.388	C	S	.	.	S	Bend	trans	-70.1	0.6	-173.9	-81	157	0	0	0	115.4	W802 T803 Y812 T856 V900 L927 V928 I929	W802-L848 WeakPolarHBondContact O-CB 3.16Å; W802-L848 PolarHBondContact O-N 2.71Å; T803-L848 HydrophobicContact CG2-CD1 4.46Å; Y812-L848 HydrophobicContact CD2-CD1 3.97Å; Y812-L848 HydrophobicContact CE2-CD1 3.6Å; L848-T856 WeakPolarHBondContact CA-OG1 3.43Å; L848-T856 HydrophobicContact CD2-CG2 4.14Å; L848-T856 PolarHBondContact O-OG1 3.22Å; L848-V900 HydrophobicContact CD1-CG2 4.42Å; L848-L927 HydrophobicContact CD1-CD1 4.5Å; L848-L927 HydrophobicContact CD1-CD2 4.03Å; L848-L927 HydrophobicContact CD1-CG 4.14Å; L848-L927 HydrophobicContact CD2-CD1 4.1Å; L848-L927 HydrophobicContact CD2-CG 4.14Å; L848-V928 VanDerWaalsContact CD2-O 3.26Å; L848-V928 WeakPolarHBondContact CD2-O 3.42Å; L848-I929 HydrophobicContact CD1-CG1 3.97Å; L848-I929 HydrophobicContact CD2-CB 4.4Å; L848-I929 HydrophobicContact CD2-CG1 3.75Å; L848-I929 HydrophobicContact CG-CG1 4.02Å
849	I	52.6	Low	62.9	Low	83 Å²	83	79.5 Å²	79.5	43%	0.426	39%	0.39	S	S	.	.			trans	-129.1	78.9	-176.8	-50.8	-172.3	0	0	0	111	T803 L804 E847	T803-I849 WeakPolarHBondContact OG1-CD1 3.39Å; T803-I849 WeakPolarHBondContact OG1-CG1 3.44Å; L804-I849 HydrophobicContact CB-CD1 4.25Å; L804-I849 WeakPolarHBondContact O-CD1 3.25Å; E847-I849 PolarHBondContact O-N 2.89Å; E847-I849 VanDerWaalsContact O-N 3.07Å
850	K	43.9	Very low	61.5	Low	130 Å²	130	83.7 Å²	83.7	57%	0.565	41%	0.411	S	S	*	.			trans	-124.5	96.9	153.7	-80.7	-169.4	174.7	-178.9	0	111.1	A852	K850-A852 PolarHBondContact O-N 2.87Å
851	R	34.9	Very low	60.4	Low	253 Å²	253	79.5 Å²	79.5	96%	0.955	39%	0.393	S	S	*	.			trans	-70.7	57	168.4	-73.9	-176.6	170.1	175.1	-2.4	112.2
852	A	30.8	Very low	59.2	Low	73 Å²	73	82.7 Å²	82.7	60%	0.603	40%	0.402	S	S	*	.	S	Bend	trans	-160.3	121.7	163.6	0	0	0	0	0	109.1	K850	K850-A852 PolarHBondContact O-N 2.87Å
853	T	29.6	Very low	57.8	Low	117 Å²	117	83.8 Å²	83.8	72%	0.718	41%	0.405	S	S	*	.	S	Bend	trans	64.5	83.3	167.8	-41.6	0	0	0	0	116.3	Q855	T853-Q855 PolarHBondContact O-N 2.86Å
854	I	31.8	Very low	55.8	Low	170 Å²	170	87.8 Å²	87.8	87%	0.872	43%	0.434	S	S	*	.	S	Bend	trans	71.4	-24.1	151.6	-58.5	170.6	0	0	0	117.3	T856	I854-T856 PolarHBondContact O-N 2.79Å
855	Q	40.6	Very low	54.4	Low	117 Å²	117	84.7 Å²	84.7	55%	0.547	45%	0.446	S	S	.	.	S	Bend	trans	-92.9	105.8	-174.5	-65.7	-176.3	-10.2	0	0	113.5	T853	T853-Q855 PolarHBondContact O-N 2.86Å
856	T	45.6	Very low	53	Low	23 Å²	23	87.6 Å²	87.6	14%	0.141	46%	0.464	C	S	.	.			trans	66.5	138.8	173.9	66.4	0	0	0	0	116.8	L848 I854 V928 A930	L848-T856 WeakPolarHBondContact CA-OG1 3.43Å; L848-T856 HydrophobicContact CD2-CG2 4.14Å; L848-T856 PolarHBondContact O-OG1 3.22Å; I854-T856 PolarHBondContact O-N 2.79Å; T856-V928 WeakPolarHBondContact CB-O 3.26Å; T856-V928 WeakPolarHBondContact CG2-O 3.37Å; T856-A930 HydrophobicContact CG2-CB 3.88Å
857	Q	53	Low	52.1	Low	122 Å²	122	94.6 Å²	94.6	57%	0.57	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-157.5	150.3	-172	-165.8	162.4	-15.1	0	0	111.4	M859	Q857-M859 HydrophobicContact CB-CG 4.02Å; Q857-M859 HydrophobicContact CG-CG 4.38Å; Q857-M859 PolarHBondContact O-N 3.46Å
858	E	56.3	Low	51.9	Low	108 Å²	108	96 Å²	96	51%	0.505	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	112.4	160.7	-177.2	-175.7	-177.6	0	0	107.3	R925	E858-R925 WeakPolarHBondContact OE1-CD 3.44Å; E858-R925 IonicContact OE1-CZ 3.87Å; E858-R925 IonicContact OE1-NE 3.89Å; E858-R925 IonicContact OE1-NH1 2.81Å; E858-R925 PolarHBondContact OE1-NH1 2.75Å
859	M	62.9	Low	52.8	Low	10 Å²	10	97 Å²	97	5%	0.049	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	131.7	-168.7	-59.8	171.4	53.1	0	0	110.9	Q857 L861 A891 L893 R925 V926 V928	Q857-M859 HydrophobicContact CB-CG 4.02Å; Q857-M859 HydrophobicContact CG-CG 4.38Å; Q857-M859 PolarHBondContact O-N 3.46Å; M859-L861 HydrophobicContact CE-CD2 4.41Å; M859-A891 HydrophobicContact CE-CB 3.71Å; M859-A891 WeakPolarHBondContact CE-O 3.44Å; M859-L893 HydrophobicContact CE-CB 3.82Å; M859-L893 HydrophobicContact CE-CD1 4.23Å; M859-L893 HydrophobicContact SD-CD1 4.35Å; M859-R925 CarbonylContact O-C 3.54Å; M859-R925 VanDerWaalsContact O-CA 3.29Å; M859-R925 WeakPolarHBondContact O-CA 3.44Å; M859-V926 HydrophobicContact CB-CG2 3.85Å; M859-V926 PolarHBondContact N-O 3.42Å; M859-V926 PolarHBondContact O-N 2.89Å; M859-V928 HydrophobicContact SD-CB 4.21Å; M859-V928 HydrophobicContact SD-CG2 3.78Å
860	M	62.6	Low	54.5	Low	88 Å²	88	93.7 Å²	93.7	43%	0.433	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	104.1	173.5	-173.8	-175.3	-67.6	0	0	109.3	R862 N923	M860-R862 HydrophobicContact CG-CG 4.27Å; M860-R862 PolarHBondContact O-N 3.41Å; M860-R862 HydrophobicContact SD-CG 4.37Å; M860-N923 HydrophobicContact CG-CB 3.84Å; M860-N923 HydrophobicContact SD-CB 3.87Å; M860-N923 PolarHBondContact SD-OD1 3.04Å; M860-N923 VanDerWaalsContact SD-OD1 3.39Å
861	L	66.5	Low	56.7	Low	5 Å²	5	87.9 Å²	87.9	3%	0.026	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	113.9	175.2	-54.5	176.9	0	0	0	108.4	M859 F871 L919 N923 S924 V926	M859-L861 HydrophobicContact CE-CD2 4.41Å; L861-F871 HydrophobicContact CD1-CE1 4.08Å; L861-F871 HydrophobicContact CD1-CZ 4.01Å; L861-L919 HydrophobicContact CD1-CD2 3.94Å; L861-N923 WeakPolarHBondContact O-CA 3.43Å; L861-S924 PolarHBondContact N-O 3.45Å; L861-S924 PolarHBondContact O-N 3.42Å; L861-V926 HydrophobicContact CD1-CG1 3.79Å; L861-V926 HydrophobicContact CD1-CG2 3.97Å; L861-V926 HydrophobicContact CD2-CG2 4.23Å; L861-V926 HydrophobicContact CG-CG1 4.44Å; L861-V926 HydrophobicContact CG-CG2 3.99Å
862	R	59.9	Low	59.4	Low	156 Å²	156	83.7 Å²	83.7	59%	0.589	46%	0.457	S	S	*	.			trans	-109.4	98.9	176.8	-79.1	-172.6	164.4	-173.5	-3.3	109.5	M860 H887 N923	M860-R862 HydrophobicContact CG-CG 4.27Å; M860-R862 PolarHBondContact O-N 3.41Å; M860-R862 HydrophobicContact SD-CG 4.37Å; R862-H887 WeakPolarHBondContact O-CB 3.33Å; R862-H887 PolarHBondContact O-CD2 2.96Å; R862-H887 VanDerWaalsContact O-CG 3.28Å; R862-N923 PolarHBondContact NE-OD1 3.37Å; R862-N923 PolarHBondContact NH2-OD1 2.91Å
863	Q	56.2	Low	62.2	Low	47 Å²	47	80.7 Å²	80.7	22%	0.22	43%	0.43	C	S	.	.			trans	-96	134.9	166.4	-63.9	-152.3	-62.3	0	0	110.5	S868	Q863-S868 PolarHBondContact NE2-O 3.08Å
864	S	45.7	Very low	65.1	Low	101 Å²	101	78.4 Å²	78.4	71%	0.706	41%	0.412	S	S	*	.			trans	-99.9	94.9	175.7	-63.1	0	0	0	0	109.9	C866	S864-C866 VanDerWaalsContact C-N 3.25Å; S864-C866 PolarHBondContact O-N 3.43Å
865	G	55.8	Low	67.6	Low	90 Å²	90	74.7 Å²	74.7	93%	0.928	39%	0.387	S	S	*	.	S	Bend	trans	67.7	2.7	164.2	0	0	0	0	0	118.4
866	C	55.6	Low	69.7	Low	76 Å²	76	69.3 Å²	69.3	51%	0.514	36%	0.362	S	S	.	.			trans	-94.8	138.3	178.7	-164.7	0	0	0	0	111.5	S864 S868	S864-C866 VanDerWaalsContact C-N 3.25Å; S864-C866 PolarHBondContact O-N 3.43Å; C866-S868 VanDerWaalsContact C-N 3.31Å; C866-S868 PolarHBondContact O-N 3.07Å; C866-S868 PolarHBondContact SG-OG 3.11Å; C866-S868 VanDerWaalsContact SG-OG 3.33Å
867	E	64.4	Low	71.8	Confident	165 Å²	165	68.2 Å²	68.2	77%	0.771	36%	0.355	S	S	*	.	S	Bend	trans	-76.5	-12.8	-179.7	-63.4	-165	141	0	0	114.4	K920	E867-K920 WeakPolarHBondContact O-CE 3.49Å; E867-K920 PolarHBondContact O-NZ 3.32Å
868	S	75.2	Confident	73.6	Confident	74 Å²	74	62.6 Å²	62.6	52%	0.517	33%	0.329	S	S	.	.	S	Bend	trans	-104.2	132.2	-177.6	55.3	0	0	0	0	112.5	Q863 C866	Q863-S868 PolarHBondContact NE2-O 3.08Å; C866-S868 VanDerWaalsContact C-N 3.31Å; C866-S868 PolarHBondContact O-N 3.07Å; C866-S868 PolarHBondContact SG-OG 3.11Å; C866-S868 VanDerWaalsContact SG-OG 3.33Å
869	L	84	Confident	75.4	Confident	29 Å²	29	57.4 Å²	57.4	15%	0.152	31%	0.305	C	S	.	.			trans	-63.9	138.9	168.8	-61.9	174.5	0	0	0	110.1	F871 I916 L919 K920	L869-F871 HydrophobicContact CB-CD1 4.17Å; L869-F871 HydrophobicContact CB-CE1 4.05Å; L869-F871 HydrophobicContact CB-CZ 4.4Å; L869-F871 HydrophobicContact CD1-CE1 4.48Å; L869-F871 HydrophobicContact CD1-CE2 4.32Å; L869-F871 HydrophobicContact CD1-CZ 4.03Å; L869-F871 HydrophobicContact CD2-CE1 4.07Å; L869-F871 HydrophobicContact CD2-CZ 4.2Å; L869-F871 HydrophobicContact CG-CE1 4.42Å; L869-F871 HydrophobicContact CG-CZ 4.45Å; L869-F871 PolarHBondContact O-N 3.49Å; L869-F871 VanDerWaalsContact O-N 3.13Å; L869-I916 HydrophobicContact CD1-CD1 3.95Å; L869-L919 HydrophobicContact CD1-CB 3.93Å; L869-L919 HydrophobicContact CD1-CD1 4.14Å; L869-L919 HydrophobicContact CD2-CB 4Å; L869-K920 HydrophobicContact CD2-CG 4.25Å
870	D	88.2	Confident	76.8	Confident	13 Å²	13	58.9 Å²	58.9	7%	0.07	32%	0.316	C	S	.	.	S	Bend	trans	-83.3	29.1	177	63.4	-32.6	0	0	0	112.8	D883 G886 H887 S888	D870-D883 VanDerWaalsContact CA-OD2 3.28Å; D870-D883 WeakPolarHBondContact CA-OD2 3.38Å; D870-D883 HydrophobicContact CB-CB 4.3Å; D870-D883 PolarHBondContact O-N 3.49Å; D870-G886 VanDerWaalsContact OD2-C 3.27Å; D870-G886 WeakPolarHBondContact OD2-CA 3.28Å; D870-H887 WeakPolarHBondContact OD2-CA 3.46Å; D870-H887 PolarHBondContact OD2-N 3.31Å; D870-S888 VanDerWaalsContact OD1-CB 3.31Å; D870-S888 WeakPolarHBondContact OD1-CB 3.42Å; D870-S888 PolarHBondContact OD1-OG 2.97Å; D870-S888 PolarHBondContact OD2-N 3.32Å
871	F	91.5	Very high	78.2	Confident	9 Å²	9	57.1 Å²	57.1	4%	0.039	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	155	177.5	62.8	-83.1	0	0	0	110.1	L861 L869 I873 V879 D881 V882 S888 L893 I899 L919	L861-F871 HydrophobicContact CD1-CE1 4.08Å; L861-F871 HydrophobicContact CD1-CZ 4.01Å; L869-F871 HydrophobicContact CB-CD1 4.17Å; L869-F871 HydrophobicContact CB-CE1 4.05Å; L869-F871 HydrophobicContact CB-CZ 4.4Å; L869-F871 HydrophobicContact CD1-CE1 4.48Å; L869-F871 HydrophobicContact CD1-CE2 4.32Å; L869-F871 HydrophobicContact CD1-CZ 4.03Å; L869-F871 HydrophobicContact CD2-CE1 4.07Å; L869-F871 HydrophobicContact CD2-CZ 4.2Å; L869-F871 HydrophobicContact CG-CE1 4.42Å; L869-F871 HydrophobicContact CG-CZ 4.45Å; L869-F871 PolarHBondContact O-N 3.49Å; L869-F871 VanDerWaalsContact O-N 3.13Å; F871-I873 HydrophobicContact CD2-CB 4.3Å; F871-I873 HydrophobicContact CE2-CB 4.18Å; F871-I873 HydrophobicContact CE2-CD1 4.4Å; F871-I873 HydrophobicContact CE2-CG2 4.36Å; F871-V879 HydrophobicContact CB-CG1 4.27Å; F871-V879 HydrophobicContact CD2-CG1 4.4Å; F871-D881 CarbonylContact C-O 3.59Å; F871-D881 VanDerWaalsContact CA-O 3.25Å; F871-D881 WeakPolarHBondContact CA-O 3.07Å; F871-D881 VanDerWaalsContact CB-O 3.27Å; F871-D881 WeakPolarHBondContact CB-O 3.36Å; F871-V882 HydrophobicContact CB-CB 4.34Å; F871-V882 HydrophobicContact CB-CG1 4.3Å; F871-V882 HydrophobicContact CB-CG2 4.03Å; F871-S888 VanDerWaalsContact CD1-OG 3.31Å; F871-S888 WeakPolarHBondContact CD1-OG 3.48Å; F871-S888 WeakPolarHBondContact CE1-OG 3.33Å; F871-L893 HydrophobicContact CB-CD2 4.18Å; F871-L893 HydrophobicContact CD1-CD2 3.99Å; F871-L893 HydrophobicContact CD2-CD2 3.96Å; F871-L893 HydrophobicContact CE1-CD2 4.35Å; F871-L893 HydrophobicContact CE2-CD2 4.32Å; F871-L893 HydrophobicContact CG-CD2 3.78Å; F871-I899 HydrophobicContact CE2-CD1 4.27Å; F871-L919 HydrophobicContact CE2-CD1 4.19Å; F871-L919 HydrophobicContact CZ-CD1 4.17Å; F871-L919 HydrophobicContact CZ-CD2 4.23Å
872	R	90.8	Very high	79.3	Confident	165 Å²	165	57.5 Å²	57.5	62%	0.623	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.9	175	-68.7	-175.3	-84.3	-173.2	-7.8	110.2	V879 S880 D881	R872-V879 CarbonylContact O-C 3.55Å; R872-V879 WeakPolarHBondContact O-CA 3.48Å; R872-S880 WeakPolarHBondContact CB-OG 3.46Å; R872-S880 PolarHBondContact O-N 2.79Å; R872-S880 PolarHBondContact O-OG 3.29Å; R872-S880 VanDerWaalsContact O-OG 3.14Å; R872-D881 HydrophobicContact CB-CB 4.14Å; R872-D881 IonicContact CZ-OD2 3.37Å; R872-D881 PolarHBondContact N-O 3.42Å; R872-D881 IonicContact NE-OD2 3.27Å; R872-D881 PolarHBondContact NE-OD2 2.88Å; R872-D881 IonicContact NH2-OD2 2.71Å; R872-D881 PolarHBondContact NH2-OD2 3.28Å
873	I	90.4	Very high	80.8	Confident	10 Å²	10	54.3 Å²	54.3	5%	0.051	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	140.6	-175	-171.7	163.7	0	0	0	111.5	F871 I878 I899 Y912 M915 I916 L919	F871-I873 HydrophobicContact CD2-CB 4.3Å; F871-I873 HydrophobicContact CE2-CB 4.18Å; F871-I873 HydrophobicContact CE2-CD1 4.4Å; F871-I873 HydrophobicContact CE2-CG2 4.36Å; I873-I878 CarbonylContact C-O 3.58Å; I873-I878 WeakPolarHBondContact CA-O 3.32Å; I873-I899 HydrophobicContact CD1-CB 4.26Å; I873-I899 HydrophobicContact CD1-CD1 3.86Å; I873-I899 HydrophobicContact CD1-CG1 4.16Å; I873-Y912 PolarHBondContact O-OH 3.47Å; I873-M915 HydrophobicContact CB-CE 4.46Å; I873-M915 HydrophobicContact CD1-CE 4.12Å; I873-M915 HydrophobicContact CD1-SD 4.26Å; I873-M915 HydrophobicContact CG1-CE 3.99Å; I873-M915 HydrophobicContact CG2-CE 3.71Å; I873-I916 HydrophobicContact CG2-CD1 3.74Å; I873-L919 HydrophobicContact CD1-CD1 3.96Å; I873-L919 HydrophobicContact CG2-CD1 4.14Å
874	Q	90.1	Very high	82.2	Confident	69 Å²	69	58.4 Å²	58.4	32%	0.322	33%	0.326	S	S	.	.			trans	-91.2	160.7	177.5	-59.3	-176.5	-14.6	0	0	111.3	E876 G877 I878	Q874-E876 PolarHBondContact O-N 3.18Å; Q874-G877 PolarHBondContact O-N 3.35Å; Q874-I878 HydrophobicContact CB-CB 4.23Å; Q874-I878 HydrophobicContact CG-CB 4.37Å; Q874-I878 PolarHBondContact N-O 2.84Å
875	Y	83.5	Confident	84.1	Confident	92 Å²	92	60.9 Å²	60.9	36%	0.361	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	-22.7	179.6	-76.6	-100.8	0	0	0	116.2	R241 Y912 V949 R950	R241-Y875 PolarHBondContact NH1-O 2.83Å; R241-Y875 PolarHBondContact NH2-O 3.45Å; Y875-Y912 HydrophobicContact CD1-CD2 4.08Å; Y875-Y912 HydrophobicContact CD1-CG 4.09Å; Y875-Y912 HydrophobicContact CD2-CD2 4.31Å; Y875-Y912 HydrophobicContact CE1-CD2 4.38Å; Y875-Y912 AromaticContact CE1-CG 4Å; Y875-Y912 HydrophobicContact CE1-CG 4Å; Y875-Y912 HydrophobicContact CG-CD2 4.04Å; Y875-Y912 HydrophobicContact CG-CG 4.47Å; Y875-V949 HydrophobicContact CG-CG1 4.37Å; Y875-R950 HydrophobicContact CD1-CG 4.4Å; Y875-R950 HydrophobicContact CG-CG 4.38Å
876	E	85.2	Confident	85.4	Confident	3 Å²	3	57.3 Å²	57.3	1%	0.014	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	13.9	-179.6	69	175.7	138.2	0	0	113.6	H815 Q874 I878 R898 R939 V949	H815-E876 HydrophobicContact CB-CB 4.3Å; H815-E876 IonicContact CE1-OE2 2.95Å; H815-E876 IonicContact CG-OE2 3.68Å; H815-E876 IonicContact ND1-OE2 2.86Å; H815-E876 PolarHBondContact ND1-OE2 2.94Å; Q874-E876 PolarHBondContact O-N 3.18Å; E876-I878 HydrophobicContact CG-CD1 3.93Å; E876-I878 HydrophobicContact CG-CG1 4.08Å; E876-I878 WeakPolarHBondContact OE1-CD1 3.27Å; E876-R898 VanDerWaalsContact CB-NH2 3.29Å; E876-R898 VanDerWaalsContact CG-NH2 3.32Å; E876-R898 PolarHBondContact O-NE 2.88Å; E876-R898 PolarHBondContact O-NH2 2.84Å; E876-R898 IonicContact OE2-CZ 2.61Å; E876-R898 IonicContact OE2-NH1 2.81Å; E876-R898 PolarHBondContact OE2-NH1 3.21Å; E876-R898 IonicContact OE2-NH2 3.74Å; E876-R898 PolarHBondContact OE2-NH2 3.35Å; E876-R939 IonicContact OE1-CZ 3.58Å; E876-R939 IonicContact OE1-NH1 3.73Å; E876-R939 PolarHBondContact OE1-NH1 3.27Å; E876-R939 IonicContact OE1-NH2 2.66Å; E876-V949 HydrophobicContact CB-CG1 3.99Å; E876-V949 HydrophobicContact CB-CG2 4.16Å; E876-V949 HydrophobicContact CG-CG1 4.48Å; E876-V949 HydrophobicContact CG-CG2 4.36Å
877	G	89.3	Confident	86.7	Confident	0 Å²	0	58 Å²	58	0%	0	28%	0.28	C	S	.	.	S	Bend	trans	89.9	2.9	176.2	0	0	0	0	0	116	Q874 V879 I899	Q874-G877 PolarHBondContact O-N 3.35Å; G877-V879 PolarHBondContact O-N 3.41Å; G877-I899 WeakPolarHBondContact CA-O 3.4Å; G877-I899 PolarHBondContact O-N 3.38Å
878	I	92.4	Very high	87.7	Confident	4 Å²	4	50.3 Å²	50.3	2%	0.021	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-73.9	125.8	177.5	-66.8	170.3	0	0	0	110.5	I873 Q874 E876 S880 P937 R939	I873-I878 CarbonylContact C-O 3.58Å; I873-I878 WeakPolarHBondContact CA-O 3.32Å; Q874-I878 HydrophobicContact CB-CB 4.23Å; Q874-I878 HydrophobicContact CG-CB 4.37Å; Q874-I878 PolarHBondContact N-O 2.84Å; E876-I878 HydrophobicContact CG-CD1 3.93Å; E876-I878 HydrophobicContact CG-CG1 4.08Å; E876-I878 WeakPolarHBondContact OE1-CD1 3.27Å; I878-S880 PolarHBondContact O-N 3.12Å; I878-P937 HydrophobicContact CD1-CB 3.98Å; I878-P937 HydrophobicContact CD1-CG 4.23Å; I878-P937 HydrophobicContact CG1-CB 4.07Å; I878-P937 HydrophobicContact CG2-CB 3.75Å; I878-P937 HydrophobicContact CG2-CG 4.11Å; I878-R939 HydrophobicContact CD1-CG 4.03Å
879	V	93.2	Very high	88.2	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	106	170.8	-177.3	0	0	0	0	108.7	F871 R872 G877 D881 V882 L893 G896 S897 I899	F871-V879 HydrophobicContact CB-CG1 4.27Å; F871-V879 HydrophobicContact CD2-CG1 4.4Å; R872-V879 CarbonylContact O-C 3.55Å; R872-V879 WeakPolarHBondContact O-CA 3.48Å; G877-V879 PolarHBondContact O-N 3.41Å; V879-D881 WeakPolarHBondContact CG1-O 3.26Å; V879-V882 HydrophobicContact CG1-CG2 3.3Å; V879-L893 HydrophobicContact CG1-CD2 4.19Å; V879-L893 HydrophobicContact CG1-CG 4.35Å; V879-L893 HydrophobicContact CG2-CD1 4.13Å; V879-L893 HydrophobicContact CG2-CD2 4.09Å; V879-L893 HydrophobicContact CG2-CG 4.23Å; V879-G896 PolarHBondContact O-N 3.01Å; V879-S897 WeakPolarHBondContact CB-O 3.4Å; V879-S897 PolarHBondContact N-O 3.2Å; V879-I899 HydrophobicContact CG2-CD1 4.26Å; V879-I899 HydrophobicContact CG2-CG1 4.03Å
880	S	92.5	Very high	88.2	Confident	41 Å²	41	55.2 Å²	55.2	29%	0.287	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-19.7	-177	55.5	0	0	0	0	113.7	R872 I878 Q895	R872-S880 WeakPolarHBondContact CB-OG 3.46Å; R872-S880 PolarHBondContact O-N 2.79Å; R872-S880 PolarHBondContact O-OG 3.29Å; R872-S880 VanDerWaalsContact O-OG 3.14Å; I878-S880 PolarHBondContact O-N 3.12Å; S880-Q895 WeakPolarHBondContact O-CG 3.47Å; S880-Q895 PolarHBondContact O-NE2 3.29Å
881	D	92.2	Very high	88	Confident	50 Å²	50	56.1 Å²	56.1	27%	0.267	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	151.3	-178.5	-165.3	13.4	0	0	0	110.4	F871 R872 V879	F871-D881 CarbonylContact C-O 3.59Å; F871-D881 VanDerWaalsContact CA-O 3.25Å; F871-D881 WeakPolarHBondContact CA-O 3.07Å; F871-D881 VanDerWaalsContact CB-O 3.27Å; F871-D881 WeakPolarHBondContact CB-O 3.36Å; R872-D881 HydrophobicContact CB-CB 4.14Å; R872-D881 IonicContact CZ-OD2 3.37Å; R872-D881 PolarHBondContact N-O 3.42Å; R872-D881 IonicContact NE-OD2 3.27Å; R872-D881 PolarHBondContact NE-OD2 2.88Å; R872-D881 IonicContact NH2-OD2 2.71Å; R872-D881 PolarHBondContact NH2-OD2 3.28Å; V879-D881 WeakPolarHBondContact CG1-O 3.26Å
882	V	89.9	Confident	87.6	Confident	13 Å²	13	57.4 Å²	57.4	8%	0.079	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	129.2	178.1	-173.1	0	0	0	0	109.7	F871 V879 M884 W889 L893	F871-V882 HydrophobicContact CB-CB 4.34Å; F871-V882 HydrophobicContact CB-CG1 4.3Å; F871-V882 HydrophobicContact CB-CG2 4.03Å; V879-V882 HydrophobicContact CG1-CG2 3.3Å; V882-M884 PolarHBondContact O-N 2.91Å; V882-W889 HydrophobicContact CG1-CB 3.88Å; V882-L893 HydrophobicContact CG2-CD2 4.38Å; V882-L893 HydrophobicContact CG2-CG 4.31Å
883	D	90.3	Very high	87.4	Confident	90 Å²	90	49.6 Å²	49.6	48%	0.481	25%	0.251	S	S	.	.			trans	-63.1	122.3	178.4	-67.7	-36.6	0	0	0	110.9	D870 Y885 G886 W889	D870-D883 VanDerWaalsContact CA-OD2 3.28Å; D870-D883 WeakPolarHBondContact CA-OD2 3.38Å; D870-D883 HydrophobicContact CB-CB 4.3Å; D870-D883 PolarHBondContact O-N 3.49Å; D883-Y885 PolarHBondContact O-N 2.9Å; D883-G886 PolarHBondContact O-N 2.86Å; D883-W889 VanDerWaalsContact O-CB 3.31Å; D883-W889 WeakPolarHBondContact O-CB 3.42Å
884	M	87	Confident	87.3	Confident	132 Å²	132	53.6 Å²	53.6	65%	0.65	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	128.5	179.2	-74.2	-172.6	65.6	0	0	110.7	V882 G886	V882-M884 PolarHBondContact O-N 2.91Å; M884-G886 PolarHBondContact O-N 3.42Å
885	Y	84.8	Confident	87.4	Confident	153 Å²	153	56.2 Å²	56.2	60%	0.6	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	9.2	-174.7	-42.7	-76.4	0	0	0	115.5	D883 W889 Q890	D883-Y885 PolarHBondContact O-N 2.9Å; Y885-W889 HydrophobicContact CD1-CE3 4.13Å; Y885-W889 AromaticContact CD1-CH2 3.94Å; Y885-W889 HydrophobicContact CD1-CH2 3.94Å; Y885-W889 AromaticContact CD1-CZ3 3.67Å; Y885-W889 HydrophobicContact CD1-CZ3 3.67Å; Y885-W889 AromaticContact CE1-CH2 3.85Å; Y885-W889 HydrophobicContact CE1-CH2 3.85Å; Y885-W889 HydrophobicContact CE1-CZ2 4.45Å; Y885-W889 HydrophobicContact CE1-CZ3 4.06Å; Y885-Q890 PolarHBondContact O-NE2 2.88Å
886	G	84.3	Confident	87.8	Confident	15 Å²	15	52 Å²	52	16%	0.155	26%	0.263	C	S	.	.	S	Bend	trans	-60.7	167.7	166.9	0	0	0	0	0	112.9	D870 D883 M884 S888 W889 Q890	D870-G886 VanDerWaalsContact OD2-C 3.27Å; D870-G886 WeakPolarHBondContact OD2-CA 3.28Å; D883-G886 PolarHBondContact O-N 2.86Å; M884-G886 PolarHBondContact O-N 3.42Å; G886-S888 VanDerWaalsContact C-N 3.31Å; G886-S888 PolarHBondContact O-N 3.1Å; G886-W889 WeakPolarHBondContact O-CB 3.46Å; G886-W889 PolarHBondContact O-N 3.1Å; G886-W889 VanDerWaalsContact O-N 3.15Å; G886-Q890 WeakPolarHBondContact O-CB 3.4Å; G886-Q890 VanDerWaalsContact O-CG 3.3Å; G886-Q890 WeakPolarHBondContact O-CG 3.5Å; G886-Q890 PolarHBondContact O-N 3.45Å
887	H	82.2	Confident	88.1	Confident	92 Å²	92	52.2 Å²	52.2	43%	0.426	26%	0.264	S	S	.	.	H	α-helix	trans	-58.9	-42.6	179.7	-64.7	85.9	0	0	0	111.7	R862 D870 Q890 A891	R862-H887 WeakPolarHBondContact O-CB 3.33Å; R862-H887 PolarHBondContact O-CD2 2.96Å; R862-H887 VanDerWaalsContact O-CG 3.28Å; D870-H887 WeakPolarHBondContact OD2-CA 3.46Å; D870-H887 PolarHBondContact OD2-N 3.31Å; H887-Q890 PolarHBondContact O-N 3.47Å; H887-A891 WeakPolarHBondContact O-CB 3.46Å; H887-A891 PolarHBondContact O-N 3.38Å
888	S	85.6	Confident	88.2	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.014	26%	0.264	C	S	.	.	H	α-helix	trans	-66.1	-39.5	176.3	-63.9	0	0	0	0	111.6	D870 F871 G886 A891 G892 L893	D870-S888 VanDerWaalsContact OD1-CB 3.31Å; D870-S888 WeakPolarHBondContact OD1-CB 3.42Å; D870-S888 PolarHBondContact OD1-OG 2.97Å; D870-S888 PolarHBondContact OD2-N 3.32Å; F871-S888 VanDerWaalsContact CD1-OG 3.31Å; F871-S888 WeakPolarHBondContact CD1-OG 3.48Å; F871-S888 WeakPolarHBondContact CE1-OG 3.33Å; G886-S888 VanDerWaalsContact C-N 3.31Å; G886-S888 PolarHBondContact O-N 3.1Å; S888-A891 PolarHBondContact O-N 2.99Å; S888-G892 PolarHBondContact O-N 3.03Å; S888-L893 WeakPolarHBondContact O-CB 3.4Å; S888-L893 PolarHBondContact O-N 3Å
889	W	85.5	Confident	88.1	Confident	70 Å²	70	52 Å²	52	27%	0.265	26%	0.263	S	S	.	.	H	α-helix	trans	-65.2	-42.7	174.4	-171	99.6	0	0	0	112.2	V882 D883 Y885 G886 A891 G892 R894	V882-W889 HydrophobicContact CG1-CB 3.88Å; D883-W889 VanDerWaalsContact O-CB 3.31Å; D883-W889 WeakPolarHBondContact O-CB 3.42Å; Y885-W889 HydrophobicContact CD1-CE3 4.13Å; Y885-W889 AromaticContact CD1-CH2 3.94Å; Y885-W889 HydrophobicContact CD1-CH2 3.94Å; Y885-W889 AromaticContact CD1-CZ3 3.67Å; Y885-W889 HydrophobicContact CD1-CZ3 3.67Å; Y885-W889 AromaticContact CE1-CH2 3.85Å; Y885-W889 HydrophobicContact CE1-CH2 3.85Å; Y885-W889 HydrophobicContact CE1-CZ2 4.45Å; Y885-W889 HydrophobicContact CE1-CZ3 4.06Å; G886-W889 WeakPolarHBondContact O-CB 3.46Å; G886-W889 PolarHBondContact O-N 3.1Å; G886-W889 VanDerWaalsContact O-N 3.15Å; W889-A891 VanDerWaalsContact C-N 3.34Å; W889-G892 PolarHBondContact O-N 3.2Å; W889-R894 PolarHBondContact O-NH1 3Å
890	Q	84.7	Confident	87.9	Confident	136 Å²	136	52 Å²	52	64%	0.636	26%	0.263	S	S	*	.	H	α-helix	trans	-64.6	-37.4	176.5	-71	177.7	31.9	0	0	111.9	Y885 G886 H887 G892	Y885-Q890 PolarHBondContact O-NE2 2.88Å; G886-Q890 WeakPolarHBondContact O-CB 3.4Å; G886-Q890 VanDerWaalsContact O-CG 3.3Å; G886-Q890 WeakPolarHBondContact O-CG 3.5Å; G886-Q890 PolarHBondContact O-N 3.45Å; H887-Q890 PolarHBondContact O-N 3.47Å; Q890-G892 PolarHBondContact O-N 2.91Å
891	A	82.3	Confident	87.7	Confident	33 Å²	33	50.9 Å²	50.9	27%	0.273	25%	0.253	S	S	.	.	H	α-helix	trans	-67.5	-14.9	173	0	0	0	0	0	113.6	M859 H887 S888 W889	M859-A891 HydrophobicContact CE-CB 3.71Å; M859-A891 WeakPolarHBondContact CE-O 3.44Å; H887-A891 WeakPolarHBondContact O-CB 3.46Å; H887-A891 PolarHBondContact O-N 3.38Å; S888-A891 PolarHBondContact O-N 2.99Å; W889-A891 VanDerWaalsContact C-N 3.34Å
892	G	82.8	Confident	87.4	Confident	36 Å²	36	48.5 Å²	48.5	37%	0.371	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	118.5	1.1	175	0	0	0	0	0	115.8	S888 W889 Q890	S888-G892 PolarHBondContact O-N 3.03Å; W889-G892 PolarHBondContact O-N 3.2Å; Q890-G892 PolarHBondContact O-N 2.91Å
893	L	87.3	Confident	87.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.254	C	S	.	.			trans	-72.2	139	-173.3	-159.7	66.6	0	0	0	110.2	M859 F871 V879 V882 S888 V928	M859-L893 HydrophobicContact CE-CB 3.82Å; M859-L893 HydrophobicContact CE-CD1 4.23Å; M859-L893 HydrophobicContact SD-CD1 4.35Å; F871-L893 HydrophobicContact CB-CD2 4.18Å; F871-L893 HydrophobicContact CD1-CD2 3.99Å; F871-L893 HydrophobicContact CD2-CD2 3.96Å; F871-L893 HydrophobicContact CE1-CD2 4.35Å; F871-L893 HydrophobicContact CE2-CD2 4.32Å; F871-L893 HydrophobicContact CG-CD2 3.78Å; V879-L893 HydrophobicContact CG1-CD2 4.19Å; V879-L893 HydrophobicContact CG1-CG 4.35Å; V879-L893 HydrophobicContact CG2-CD1 4.13Å; V879-L893 HydrophobicContact CG2-CD2 4.09Å; V879-L893 HydrophobicContact CG2-CG 4.23Å; V882-L893 HydrophobicContact CG2-CD2 4.38Å; V882-L893 HydrophobicContact CG2-CG 4.31Å; S888-L893 WeakPolarHBondContact O-CB 3.4Å; S888-L893 PolarHBondContact O-N 3Å; L893-V928 HydrophobicContact CD1-CG1 3.92Å; L893-V928 HydrophobicContact CD1-CG2 4.19Å
894	R	89.5	Confident	86.6	Confident	95 Å²	95	53 Å²	53	36%	0.358	26%	0.261	S	S	.	.			trans	-130.2	158.4	-179.6	-61.3	-64.9	175.1	-98.5	5.8	110.7	W889 S897	W889-R894 PolarHBondContact O-NH1 3Å; R894-S897 PolarHBondContact N-OG 3.33Å; R894-S897 WeakPolarHBondContact O-CB 3.31Å; R894-S897 PolarHBondContact O-N 3.21Å; R894-S897 VanDerWaalsContact O-N 3.1Å; R894-S897 PolarHBondContact O-OG 3.25Å; R894-S897 VanDerWaalsContact O-OG 3.12Å
895	Q	91.8	Very high	86.2	Confident	124 Å²	124	49.1 Å²	49.1	58%	0.579	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	140	164.1	-171.8	172.5	42	0	0	109.2	S880 S897	S880-Q895 WeakPolarHBondContact O-CG 3.47Å; S880-Q895 PolarHBondContact O-NE2 3.29Å; Q895-S897 PolarHBondContact O-N 3Å
896	G	90.9	Very high	86.1	Confident	4 Å²	4	42.1 Å²	42.1	4%	0.041	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	-9.7	-174.2	0	0	0	0	0	115	V879 P937	V879-G896 PolarHBondContact O-N 3.01Å; G896-P937 WeakPolarHBondContact O-CA 3.45Å
897	S	91.6	Very high	86	Confident	6 Å²	6	41.4 Å²	41.4	4%	0.042	21%	0.211	C	C	.	.			trans	-58.8	148.3	169.7	-73.1	0	0	0	0	111.5	V879 R894 Q895	V879-S897 WeakPolarHBondContact CB-O 3.4Å; V879-S897 PolarHBondContact N-O 3.2Å; R894-S897 PolarHBondContact N-OG 3.33Å; R894-S897 WeakPolarHBondContact O-CB 3.31Å; R894-S897 PolarHBondContact O-N 3.21Å; R894-S897 VanDerWaalsContact O-N 3.1Å; R894-S897 PolarHBondContact O-OG 3.25Å; R894-S897 VanDerWaalsContact O-OG 3.12Å; Q895-S897 PolarHBondContact O-N 3Å
898	R	90.5	Very high	85.9	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	104.1	-177.9	-174.3	80.9	-175.2	-129.6	9.8	109.3	I800 H815 E876 V900 V928 I929 R938	I800-R898 HydrophobicContact CD1-CG 4.2Å; H815-R898 VanDerWaalsContact C-NH2 3.3Å; E876-R898 VanDerWaalsContact CB-NH2 3.29Å; E876-R898 VanDerWaalsContact CG-NH2 3.32Å; E876-R898 PolarHBondContact O-NE 2.88Å; E876-R898 PolarHBondContact O-NH2 2.84Å; E876-R898 IonicContact OE2-CZ 2.61Å; E876-R898 IonicContact OE2-NH1 2.81Å; E876-R898 PolarHBondContact OE2-NH1 3.21Å; E876-R898 IonicContact OE2-NH2 3.74Å; E876-R898 PolarHBondContact OE2-NH2 3.35Å; R898-V900 HydrophobicContact CG-CG1 4.08Å; R898-V928 WeakPolarHBondContact O-CA 3.45Å; R898-I929 HydrophobicContact CB-CB 4.23Å; R898-I929 PolarHBondContact N-O 3.32Å; R898-I929 PolarHBondContact O-N 2.97Å; R898-R938 PolarHBondContact NH1-O 2.95Å
899	I	92	Very high	85.4	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	129.5	172.1	-51.6	-166.3	0	0	0	108	F871 I873 G877 V879 I902 V907 L919 V926 V928	F871-I899 HydrophobicContact CE2-CD1 4.27Å; I873-I899 HydrophobicContact CD1-CB 4.26Å; I873-I899 HydrophobicContact CD1-CD1 3.86Å; I873-I899 HydrophobicContact CD1-CG1 4.16Å; G877-I899 WeakPolarHBondContact CA-O 3.4Å; G877-I899 PolarHBondContact O-N 3.38Å; V879-I899 HydrophobicContact CG2-CD1 4.26Å; V879-I899 HydrophobicContact CG2-CG1 4.03Å; I899-I902 HydrophobicContact CG2-CG1 3.88Å; I899-V907 HydrophobicContact CG2-CG2 4.1Å; I899-L919 HydrophobicContact CD1-CD2 4.37Å; I899-V926 HydrophobicContact CD1-CB 4.43Å; I899-V926 HydrophobicContact CD1-CG1 4.33Å; I899-V926 HydrophobicContact CG2-CB 4Å; I899-V926 HydrophobicContact CG2-CG1 4.15Å; I899-V928 HydrophobicContact CG1-CG2 4.21Å
900	V	89.2	Confident	85	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	-25.9	-178.8	-62.7	0	0	0	0	113.8	I800 Y812 A816 L848 R898 V907 L927 I929	I800-V900 HydrophobicContact CD1-CG1 4.15Å; Y812-V900 HydrophobicContact CD1-CB 3.83Å; Y812-V900 HydrophobicContact CD1-CG1 4.38Å; Y812-V900 HydrophobicContact CD1-CG2 4.06Å; Y812-V900 HydrophobicContact CD2-CG2 4.17Å; Y812-V900 HydrophobicContact CE1-CB 3.92Å; Y812-V900 HydrophobicContact CE1-CG2 3.84Å; Y812-V900 HydrophobicContact CE2-CG2 3.96Å; Y812-V900 HydrophobicContact CG-CB 4.23Å; Y812-V900 HydrophobicContact CG-CG1 4.41Å; Y812-V900 HydrophobicContact CG-CG2 4.23Å; A816-V900 HydrophobicContact CB-CB 4.35Å; A816-V900 HydrophobicContact CB-CG1 3.92Å; L848-V900 HydrophobicContact CD1-CG2 4.42Å; R898-V900 HydrophobicContact CG-CG1 4.08Å; V900-V907 PolarHBondContact O-N 2.95Å; V900-L927 HydrophobicContact CG2-CB 4.36Å; V900-L927 HydrophobicContact CG2-CD2 4.18Å; V900-L927 HydrophobicContact CG2-CG 4.18Å; V900-L927 PolarHBondContact N-O 3.45Å; V900-I929 HydrophobicContact CG1-CD1 3.6Å; V900-I929 HydrophobicContact CG1-CG1 4.07Å; V900-I929 HydrophobicContact CG2-CD1 4.31Å; V900-I929 HydrophobicContact CG2-CG1 4.22Å
901	E	87.6	Confident	84.8	Confident	18 Å²	18	30.9 Å²	30.9	8%	0.084	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	145.6	166.3	-54.8	-166.7	136.6	0	0	111.1	K810 Y812 V905 V926 L927	K810-E901 IonicContact NZ-OE1 2.97Å; K810-E901 PolarHBondContact NZ-OE1 2.91Å; K810-E901 IonicContact NZ-OE2 2.89Å; K810-E901 PolarHBondContact NZ-OE2 2.9Å; Y812-E901 HydrophobicContact CE1-CG 4.15Å; Y812-E901 VanDerWaalsContact OH-CD 3.23Å; Y812-E901 WeakPolarHBondContact OH-CG 3.35Å; Y812-E901 PolarHBondContact OH-OE1 3.39Å; E901-V905 CarbonylContact C-O 3.55Å; E901-V905 WeakPolarHBondContact CA-O 3.47Å; E901-V905 WeakPolarHBondContact CB-O 3.37Å; E901-V926 WeakPolarHBondContact O-CA 3.37Å; E901-L927 HydrophobicContact CB-CB 3.89Å; E901-L927 HydrophobicContact CB-CD2 4.43Å; E901-L927 HydrophobicContact CG-CB 4.37Å; E901-L927 HydrophobicContact CG-CD2 4.04Å; E901-L927 PolarHBondContact O-N 2.87Å
902	I	86.1	Confident	84.9	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	124	170.4	-51.6	156.5	0	0	0	107.3	I899 K904 V905 V907 L910 M915 F918 L919 V926	I899-I902 HydrophobicContact CG2-CG1 3.88Å; I902-K904 PolarHBondContact O-N 3.35Å; I902-K904 VanDerWaalsContact O-N 3.1Å; I902-V905 PolarHBondContact N-O 3.44Å; I902-V905 WeakPolarHBondContact O-CB 3.48Å; I902-V905 PolarHBondContact O-N 2.88Å; I902-V907 HydrophobicContact CD1-CG2 3.91Å; I902-V907 HydrophobicContact CG1-CG2 4.04Å; I902-L910 HydrophobicContact CD1-CD1 4.2Å; I902-M915 HydrophobicContact CD1-CG 3.49Å; I902-M915 VanDerWaalsContact CD1-CG 3.49Å; I902-F918 HydrophobicContact CB-CB 4.43Å; I902-F918 HydrophobicContact CG2-CB 3.78Å; I902-L919 HydrophobicContact CD1-CD1 4.22Å; I902-L919 HydrophobicContact CD1-CD2 3.96Å; I902-L919 HydrophobicContact CD1-CG 3.83Å; I902-L919 HydrophobicContact CG1-CD2 3.96Å; I902-L919 HydrophobicContact CG1-CG 4.38Å; I902-L919 HydrophobicContact CG2-CD2 4.01Å; I902-L919 HydrophobicContact CG2-CG 4.43Å; I902-V926 HydrophobicContact CB-CG1 4.43Å; I902-V926 HydrophobicContact CG1-CG1 4.11Å; I902-V926 HydrophobicContact CG2-CG1 4.09Å
903	C	83.5	Confident	85	Confident	54 Å²	54	35.9 Å²	35.9	37%	0.365	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	32.2	-175.1	-66	0	0	0	0	114	V905 F918 R925	C903-V905 VanDerWaalsContact C-N 3.3Å; C903-F918 HydrophobicContact CB-CD1 4.47Å; C903-R925 PolarHBondContact N-O 3.27Å
904	K	79.3	Confident	84.8	Confident	143 Å²	143	39.3 Å²	39.3	62%	0.622	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.7	10.8	-173.2	-51.3	-177.3	175.5	-172.9	0	116.2	I902	I902-K904 PolarHBondContact O-N 3.35Å; I902-K904 VanDerWaalsContact O-N 3.1Å
905	V	78.6	Confident	84.7	Confident	50 Å²	50	34.8 Å²	34.8	30%	0.303	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	136.7	167.7	-170.7	0	0	0	0	108.5	E901 I902 C903 L910 F918	E901-V905 CarbonylContact C-O 3.55Å; E901-V905 WeakPolarHBondContact CA-O 3.47Å; E901-V905 WeakPolarHBondContact CB-O 3.37Å; I902-V905 PolarHBondContact N-O 3.44Å; I902-V905 WeakPolarHBondContact O-CB 3.48Å; I902-V905 PolarHBondContact O-N 2.88Å; C903-V905 VanDerWaalsContact C-N 3.3Å; V905-L910 HydrophobicContact CG1-CD1 4.31Å; V905-L910 HydrophobicContact CG1-CD2 3.92Å; V905-L910 HydrophobicContact CG1-CG 4.03Å; V905-F918 HydrophobicContact CG2-CZ 4.47Å
906	S	81.7	Confident	84.5	Confident	6 Å²	6	30.6 Å²	30.6	4%	0.042	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	142.6	177.2	178.1	0	0	0	0	111.5	A816 A908 S909 L910	A816-S906 PolarHBondContact O-OG 2.79Å; S906-A908 PolarHBondContact O-N 3Å; S906-A908 PolarHBondContact OG-N 2.82Å; S906-S909 PolarHBondContact O-N 2.82Å; S906-S909 PolarHBondContact O-OG 3.16Å; S906-L910 WeakPolarHBondContact O-CG 3.25Å
907	V	83.5	Confident	84.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.19	C	C	.	.	S	Bend	trans	-64	-29.1	173.4	169.1	0	0	0	0	111.7	R241 I899 V900 I902 L910 M915	R241-V907 PolarHBondContact NH2-O 3.49Å; I899-V907 HydrophobicContact CG2-CG2 4.1Å; V900-V907 PolarHBondContact O-N 2.95Å; I902-V907 HydrophobicContact CD1-CG2 3.91Å; I902-V907 HydrophobicContact CG1-CG2 4.04Å; V907-L910 PolarHBondContact O-N 2.82Å; V907-M915 HydrophobicContact CG1-SD 3.82Å
908	A	79.2	Confident	83.9	Confident	2 Å²	2	39.6 Å²	39.6	2%	0.017	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-37.7	177.8	0	0	0	0	0	113.2	R241 A816 D817 S906 L910	R241-A908 VanDerWaalsContact CD-O 3.22Å; R241-A908 WeakPolarHBondContact CD-O 3.37Å; R241-A908 VanDerWaalsContact CG-O 3.29Å; R241-A908 WeakPolarHBondContact CG-O 3.43Å; R241-A908 PolarHBondContact NE-O 2.87Å; A816-A908 WeakPolarHBondContact O-CB 3.43Å; D817-A908 WeakPolarHBondContact OD1-CB 3.46Å; S906-A908 PolarHBondContact O-N 3Å; S906-A908 PolarHBondContact OG-N 2.82Å; A908-L910 PolarHBondContact O-N 2.83Å
909	S	75.7	Confident	83.8	Confident	22 Å²	22	39.8 Å²	39.8	15%	0.154	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	9.1	177.1	51.7	0	0	0	0	114.4	L237 S906	L237-S909 WeakPolarHBondContact O-CB 3.35Å; S906-S909 PolarHBondContact O-N 2.82Å; S906-S909 PolarHBondContact O-OG 3.16Å
910	L	76.8	Confident	83.4	Confident	6 Å²	6	44.8 Å²	44.8	3%	0.031	23%	0.225	C	C	.	.	S	Bend	trans	-109.4	135.3	173.7	-64.5	175.4	0	0	0	111.4	R241 I902 V905 S906 V907 A908 K914 M915 F918	R241-L910 PolarHBondContact NE-O 3.42Å; R241-L910 PolarHBondContact NH2-O 2.67Å; I902-L910 HydrophobicContact CD1-CD1 4.2Å; V905-L910 HydrophobicContact CG1-CD1 4.31Å; V905-L910 HydrophobicContact CG1-CD2 3.92Å; V905-L910 HydrophobicContact CG1-CG 4.03Å; S906-L910 WeakPolarHBondContact O-CG 3.25Å; V907-L910 PolarHBondContact O-N 2.82Å; A908-L910 PolarHBondContact O-N 2.83Å; L910-K914 HydrophobicContact CD2-CB 4.05Å; L910-K914 HydrophobicContact CD2-CD 4.24Å; L910-M915 HydrophobicContact CB-CB 4.29Å; L910-F918 HydrophobicContact CD1-CD2 3.88Å; L910-F918 HydrophobicContact CD1-CE2 4.43Å; L910-F918 HydrophobicContact CD2-CD2 3.75Å; L910-F918 HydrophobicContact CD2-CE2 3.58Å; L910-F918 HydrophobicContact CG-CD2 4.5Å
911	T	81.1	Confident	83.1	Confident	49 Å²	49	47.1 Å²	47.1	30%	0.301	24%	0.242	S	C	.	.			trans	-69.5	157.1	161.4	64.8	0	0	0	0	110.5	K914 M915	T911-K914 PolarHBondContact O-N 2.79Å; T911-K914 WeakPolarHBondContact OG1-CG 3.39Å; T911-M915 WeakPolarHBondContact O-CB 3.27Å; T911-M915 PolarHBondContact O-N 3.01Å
912	Y	83.5	Confident	82.4	Confident	79 Å²	79	50.9 Å²	50.9	31%	0.31	27%	0.268	S	S	.	.	H	α-helix	trans	-57.1	-41.2	-178.4	-171.6	-100.1	0	0	0	114	I873 Y875 M915 I916	I873-Y912 PolarHBondContact O-OH 3.47Å; Y875-Y912 HydrophobicContact CD1-CD2 4.08Å; Y875-Y912 HydrophobicContact CD1-CG 4.09Å; Y875-Y912 HydrophobicContact CD2-CD2 4.31Å; Y875-Y912 HydrophobicContact CE1-CD2 4.38Å; Y875-Y912 AromaticContact CE1-CG 4Å; Y875-Y912 HydrophobicContact CE1-CG 4Å; Y875-Y912 HydrophobicContact CG-CD2 4.04Å; Y875-Y912 HydrophobicContact CG-CG 4.47Å; Y912-M915 HydrophobicContact CD2-CE 3.47Å; Y912-M915 VanDerWaalsContact CD2-CE 3.47Å; Y912-M915 HydrophobicContact CE2-CE 3.51Å; Y912-M915 WeakPolarHBondContact O-CB 3.42Å; Y912-M915 PolarHBondContact O-N 2.89Å; Y912-I916 HydrophobicContact CD1-CG1 4.36Å; Y912-I916 HydrophobicContact CE1-CD1 4.47Å; Y912-I916 HydrophobicContact CE1-CG1 4Å; Y912-I916 HydrophobicContact CE2-CD1 4.42Å; Y912-I916 WeakPolarHBondContact O-CG1 3.4Å; Y912-I916 PolarHBondContact O-N 3.4Å; Y912-I916 VanDerWaalsContact O-N 3.1Å
913	P	85.3	Confident	81.8	Confident	95 Å²	95	54 Å²	54	62%	0.617	29%	0.285	S	S	*	.	H	α-helix	trans	-60.4	-49.7	173.5	-24.8	36	0	0	0	113.2	M915 I916 E917	P913-M915 VanDerWaalsContact C-N 3.28Å; P913-M915 PolarHBondContact O-N 3.21Å; P913-I916 PolarHBondContact O-N 2.81Å; P913-E917 PolarHBondContact O-N 3.23Å
914	K	84.2	Confident	81.7	Confident	72 Å²	72	51.5 Å²	51.5	31%	0.313	27%	0.268	S	S	.	.	H	α-helix	trans	-58.1	-40.8	176.1	-68.4	177.9	-177.3	176.4	0	111.4	E240 L910 T911 I916 E917 F918	E240-K914 IonicContact OE1-NZ 2.85Å; E240-K914 PolarHBondContact OE1-NZ 3.48Å; E240-K914 IonicContact OE2-NZ 3.72Å; E240-K914 PolarHBondContact OE2-NZ 3.27Å; L910-K914 HydrophobicContact CD2-CB 4.05Å; L910-K914 HydrophobicContact CD2-CD 4.24Å; T911-K914 PolarHBondContact O-N 2.79Å; T911-K914 WeakPolarHBondContact OG1-CG 3.39Å; K914-I916 VanDerWaalsContact C-N 3.35Å; K914-I916 PolarHBondContact O-N 3Å; K914-E917 WeakPolarHBondContact O-CB 3.44Å; K914-E917 PolarHBondContact O-N 2.86Å; K914-F918 WeakPolarHBondContact O-CB 3.25Å; K914-F918 VanDerWaalsContact O-CD2 3.26Å; K914-F918 WeakPolarHBondContact O-CD2 3.35Å; K914-F918 PolarHBondContact O-N 3.17Å
915	M	85.9	Confident	81.8	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.5	-43.2	178.3	-170.8	-171.3	72.1	0	0	111.6	I873 I902 V907 L910 T911 Y912 P913 L919	I873-M915 HydrophobicContact CB-CE 4.46Å; I873-M915 HydrophobicContact CD1-CE 4.12Å; I873-M915 HydrophobicContact CD1-SD 4.26Å; I873-M915 HydrophobicContact CG1-CE 3.99Å; I873-M915 HydrophobicContact CG2-CE 3.71Å; I902-M915 HydrophobicContact CD1-CG 3.49Å; I902-M915 VanDerWaalsContact CD1-CG 3.49Å; V907-M915 HydrophobicContact CG1-SD 3.82Å; L910-M915 HydrophobicContact CB-CB 4.29Å; T911-M915 WeakPolarHBondContact O-CB 3.27Å; T911-M915 PolarHBondContact O-N 3.01Å; Y912-M915 HydrophobicContact CD2-CE 3.47Å; Y912-M915 VanDerWaalsContact CD2-CE 3.47Å; Y912-M915 HydrophobicContact CE2-CE 3.51Å; Y912-M915 WeakPolarHBondContact O-CB 3.42Å; Y912-M915 PolarHBondContact O-N 2.89Å; P913-M915 VanDerWaalsContact C-N 3.28Å; P913-M915 PolarHBondContact O-N 3.21Å; M915-L919 HydrophobicContact CG-CD1 4.37Å; M915-L919 VanDerWaalsContact O-CG 3.26Å; M915-L919 WeakPolarHBondContact O-CG 3.42Å; M915-L919 PolarHBondContact O-N 2.69Å
916	I	88.3	Confident	82.3	Confident	36 Å²	36	47.6 Å²	47.6	19%	0.185	24%	0.244	C	C	.	.	H	α-helix	trans	-69.5	-39.9	176.6	-63.3	-62.6	0	0	0	111.4	L869 I873 Y912 P913 K914 L919 K920	L869-I916 HydrophobicContact CD1-CD1 3.95Å; I873-I916 HydrophobicContact CG2-CD1 3.74Å; Y912-I916 HydrophobicContact CD1-CG1 4.36Å; Y912-I916 HydrophobicContact CE1-CD1 4.47Å; Y912-I916 HydrophobicContact CE1-CG1 4Å; Y912-I916 HydrophobicContact CE2-CD1 4.42Å; Y912-I916 WeakPolarHBondContact O-CG1 3.4Å; Y912-I916 PolarHBondContact O-N 3.4Å; Y912-I916 VanDerWaalsContact O-N 3.1Å; P913-I916 PolarHBondContact O-N 2.81Å; K914-I916 VanDerWaalsContact C-N 3.35Å; K914-I916 PolarHBondContact O-N 3Å; I916-L919 PolarHBondContact O-N 3.43Å; I916-K920 HydrophobicContact CG2-CD 4.35Å; I916-K920 HydrophobicContact CG2-CG 4.4Å; I916-K920 WeakPolarHBondContact O-CG 3.38Å; I916-K920 PolarHBondContact O-N 3.44Å
917	E	86	Confident	82.6	Confident	131 Å²	131	48.5 Å²	48.5	61%	0.612	25%	0.248	S	C	*	.	H	α-helix	trans	-58.5	-48.8	174	-176.4	-174.2	175.3	0	0	112.1	P913 K914 L919 K920 S921	P913-E917 PolarHBondContact O-N 3.23Å; K914-E917 WeakPolarHBondContact O-CB 3.44Å; K914-E917 PolarHBondContact O-N 2.86Å; E917-L919 VanDerWaalsContact C-N 3.3Å; E917-L919 PolarHBondContact O-N 3.07Å; E917-K920 PolarHBondContact O-N 2.81Å; E917-S921 PolarHBondContact O-N 3.06Å; E917-S921 PolarHBondContact O-OG 3.42Å
918	F	84.8	Confident	82.8	Confident	69 Å²	69	48.8 Å²	48.8	30%	0.303	25%	0.249	S	C	.	.	H	α-helix	trans	-62.7	-32.4	174.4	-86.7	-66.2	0	0	0	112.8	I902 C903 V905 L910 K914 S924	I902-F918 HydrophobicContact CB-CB 4.43Å; I902-F918 HydrophobicContact CG2-CB 3.78Å; C903-F918 HydrophobicContact CB-CD1 4.47Å; V905-F918 HydrophobicContact CG2-CZ 4.47Å; L910-F918 HydrophobicContact CD1-CD2 3.88Å; L910-F918 HydrophobicContact CD1-CE2 4.43Å; L910-F918 HydrophobicContact CD2-CD2 3.75Å; L910-F918 HydrophobicContact CD2-CE2 3.58Å; L910-F918 HydrophobicContact CG-CD2 4.5Å; K914-F918 WeakPolarHBondContact O-CB 3.25Å; K914-F918 VanDerWaalsContact O-CD2 3.26Å; K914-F918 WeakPolarHBondContact O-CD2 3.35Å; K914-F918 PolarHBondContact O-N 3.17Å; F918-S924 WeakPolarHBondContact O-CB 3.17Å; F918-S924 PolarHBondContact O-OG 2.94Å
919	L	87.7	Confident	83.3	Confident	3 Å²	3	48.7 Å²	48.7	2%	0.016	25%	0.249	C	C	.	.	H	α-helix	trans	-77	-30.7	176.5	-72.4	169.8	0	0	0	113.4	L861 L869 F871 I873 I899 I902 M915 I916 E917 S921 V926	L861-L919 HydrophobicContact CD1-CD2 3.94Å; L869-L919 HydrophobicContact CD1-CB 3.93Å; L869-L919 HydrophobicContact CD1-CD1 4.14Å; L869-L919 HydrophobicContact CD2-CB 4Å; F871-L919 HydrophobicContact CE2-CD1 4.19Å; F871-L919 HydrophobicContact CZ-CD1 4.17Å; F871-L919 HydrophobicContact CZ-CD2 4.23Å; I873-L919 HydrophobicContact CD1-CD1 3.96Å; I873-L919 HydrophobicContact CG2-CD1 4.14Å; I899-L919 HydrophobicContact CD1-CD2 4.37Å; I902-L919 HydrophobicContact CD1-CD1 4.22Å; I902-L919 HydrophobicContact CD1-CD2 3.96Å; I902-L919 HydrophobicContact CD1-CG 3.83Å; I902-L919 HydrophobicContact CG1-CD2 3.96Å; I902-L919 HydrophobicContact CG1-CG 4.38Å; I902-L919 HydrophobicContact CG2-CD2 4.01Å; I902-L919 HydrophobicContact CG2-CG 4.43Å; M915-L919 HydrophobicContact CG-CD1 4.37Å; M915-L919 VanDerWaalsContact O-CG 3.26Å; M915-L919 WeakPolarHBondContact O-CG 3.42Å; M915-L919 PolarHBondContact O-N 2.69Å; I916-L919 PolarHBondContact O-N 3.43Å; E917-L919 VanDerWaalsContact C-N 3.3Å; E917-L919 PolarHBondContact O-N 3.07Å; L919-S921 VanDerWaalsContact C-N 3.26Å; L919-S921 PolarHBondContact O-N 3.07Å; L919-V926 HydrophobicContact CD2-CG1 3.63Å
920	K	84.3	Confident	83.8	Confident	105 Å²	105	48.7 Å²	48.7	46%	0.457	25%	0.25	S	C	.	.	H	α-helix	trans	-76.2	-9.5	175.2	-71.5	-171.7	-173.3	-159.2	0	113.9	E867 L869 I916 E917	E867-K920 WeakPolarHBondContact O-CE 3.49Å; E867-K920 PolarHBondContact O-NZ 3.32Å; L869-K920 HydrophobicContact CD2-CG 4.25Å; I916-K920 HydrophobicContact CG2-CD 4.35Å; I916-K920 HydrophobicContact CG2-CG 4.4Å; I916-K920 WeakPolarHBondContact O-CG 3.38Å; I916-K920 PolarHBondContact O-N 3.44Å; E917-K920 PolarHBondContact O-N 2.81Å
921	S	81.7	Confident	84.4	Confident	50 Å²	50	49.7 Å²	49.7	35%	0.35	26%	0.257	S	S	.	.	S	Bend	trans	-67.2	143.3	179.6	-66.4	0	0	0	0	111.8	E917 L919 N923 S924	E917-S921 PolarHBondContact O-N 3.06Å; E917-S921 PolarHBondContact O-OG 3.42Å; L919-S921 VanDerWaalsContact C-N 3.26Å; L919-S921 PolarHBondContact O-N 3.07Å; S921-N923 PolarHBondContact O-N 3.13Å; S921-S924 WeakPolarHBondContact CB-OG 3.19Å; S921-S924 PolarHBondContact O-N 3.37Å; S921-S924 PolarHBondContact O-OG 3.07Å
922	P	73.5	Confident	84.7	Confident	97 Å²	97	49.7 Å²	49.7	63%	0.63	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	129.4	-177.1	26.2	-33.7	0	0	0	111.6
923	N	73.6	Confident	84.7	Confident	66 Å²	66	55.2 Å²	55.2	35%	0.353	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	30.2	-174.3	-51.9	-80.7	0	0	0	114.6	M860 L861 R862 S921 R925	M860-N923 HydrophobicContact CG-CB 3.84Å; M860-N923 HydrophobicContact SD-CB 3.87Å; M860-N923 PolarHBondContact SD-OD1 3.04Å; M860-N923 VanDerWaalsContact SD-OD1 3.39Å; L861-N923 WeakPolarHBondContact O-CA 3.43Å; R862-N923 PolarHBondContact NE-OD1 3.37Å; R862-N923 PolarHBondContact NH2-OD1 2.91Å; S921-N923 PolarHBondContact O-N 3.13Å; N923-R925 PolarHBondContact O-N 3.13Å
924	S	80.4	Confident	84.9	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.007	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.5	126.5	175.8	-75.2	0	0	0	0	112.7	L861 F918 S921	L861-S924 PolarHBondContact N-O 3.45Å; L861-S924 PolarHBondContact O-N 3.42Å; F918-S924 WeakPolarHBondContact O-CB 3.17Å; F918-S924 PolarHBondContact O-OG 2.94Å; S921-S924 WeakPolarHBondContact CB-OG 3.19Å; S921-S924 PolarHBondContact O-N 3.37Å; S921-S924 PolarHBondContact O-OG 3.07Å
925	R	82.8	Confident	85	Confident	110 Å²	110	55 Å²	55	42%	0.415	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	119	-179.7	-70.7	-171.9	-70.4	153	-17.9	110.5	E858 M859 C903 N923	E858-R925 WeakPolarHBondContact OE1-CD 3.44Å; E858-R925 IonicContact OE1-CZ 3.87Å; E858-R925 IonicContact OE1-NE 3.89Å; E858-R925 IonicContact OE1-NH1 2.81Å; E858-R925 PolarHBondContact OE1-NH1 2.75Å; M859-R925 CarbonylContact O-C 3.54Å; M859-R925 VanDerWaalsContact O-CA 3.29Å; M859-R925 WeakPolarHBondContact O-CA 3.44Å; C903-R925 PolarHBondContact N-O 3.27Å; N923-R925 PolarHBondContact O-N 3.13Å
926	V	88.4	Confident	85.2	Confident	1 Å²	1	57 Å²	57	1%	0.006	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	142	-178.5	-64.2	0	0	0	0	111.7	M859 L861 I899 E901 I902 L919 V928	M859-V926 HydrophobicContact CB-CG2 3.85Å; M859-V926 PolarHBondContact N-O 3.42Å; M859-V926 PolarHBondContact O-N 2.89Å; L861-V926 HydrophobicContact CD1-CG1 3.79Å; L861-V926 HydrophobicContact CD1-CG2 3.97Å; L861-V926 HydrophobicContact CD2-CG2 4.23Å; L861-V926 HydrophobicContact CG-CG1 4.44Å; L861-V926 HydrophobicContact CG-CG2 3.99Å; I899-V926 HydrophobicContact CD1-CB 4.43Å; I899-V926 HydrophobicContact CD1-CG1 4.33Å; I899-V926 HydrophobicContact CG2-CB 4Å; I899-V926 HydrophobicContact CG2-CG1 4.15Å; E901-V926 WeakPolarHBondContact O-CA 3.37Å; I902-V926 HydrophobicContact CB-CG1 4.43Å; I902-V926 HydrophobicContact CG1-CG1 4.11Å; I902-V926 HydrophobicContact CG2-CG1 4.09Å; L919-V926 HydrophobicContact CD2-CG1 3.63Å; V926-V928 HydrophobicContact CB-CG2 4.12Å; V926-V928 HydrophobicContact CG2-CG2 3.64Å
927	L	87.6	Confident	85.3	Confident	24 Å²	24	56.9 Å²	56.9	13%	0.126	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	120.4	171.1	-171.6	65.5	0	0	0	108.5	T803 Y812 L848 V900 E901	T803-L927 HydrophobicContact CG2-CD2 4.07Å; Y812-L927 HydrophobicContact CE2-CD2 4.31Å; Y812-L927 VanDerWaalsContact OH-CD2 3.31Å; Y812-L927 WeakPolarHBondContact OH-CD2 3.25Å; L848-L927 HydrophobicContact CD1-CD1 4.5Å; L848-L927 HydrophobicContact CD1-CD2 4.03Å; L848-L927 HydrophobicContact CD1-CG 4.14Å; L848-L927 HydrophobicContact CD2-CD1 4.1Å; L848-L927 HydrophobicContact CD2-CG 4.14Å; V900-L927 HydrophobicContact CG2-CB 4.36Å; V900-L927 HydrophobicContact CG2-CD2 4.18Å; V900-L927 HydrophobicContact CG2-CG 4.18Å; V900-L927 PolarHBondContact N-O 3.45Å; E901-L927 HydrophobicContact CB-CB 3.89Å; E901-L927 HydrophobicContact CB-CD2 4.43Å; E901-L927 HydrophobicContact CG-CB 4.37Å; E901-L927 HydrophobicContact CG-CD2 4.04Å; E901-L927 PolarHBondContact O-N 2.87Å
928	V	88.9	Confident	85.5	Confident	6 Å²	6	52.5 Å²	52.5	4%	0.036	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	119.8	-165.4	-171.6	0	0	0	0	111.4	L848 T856 M859 L893 R898 I899 V926	L848-V928 VanDerWaalsContact CD2-O 3.26Å; L848-V928 WeakPolarHBondContact CD2-O 3.42Å; T856-V928 WeakPolarHBondContact CB-O 3.26Å; T856-V928 WeakPolarHBondContact CG2-O 3.37Å; M859-V928 HydrophobicContact SD-CB 4.21Å; M859-V928 HydrophobicContact SD-CG2 3.78Å; L893-V928 HydrophobicContact CD1-CG1 3.92Å; L893-V928 HydrophobicContact CD1-CG2 4.19Å; R898-V928 WeakPolarHBondContact O-CA 3.45Å; I899-V928 HydrophobicContact CG1-CG2 4.21Å; V926-V928 HydrophobicContact CB-CG2 4.12Å; V926-V928 HydrophobicContact CG2-CG2 3.64Å
929	I	88.8	Confident	85.7	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	135.3	168.2	-51	172	0	0	0	108.5	I800 Y812 C846 L848 R898 V900	I800-I929 HydrophobicContact CB-CD1 4.47Å; I800-I929 HydrophobicContact CD1-CD1 4.13Å; I800-I929 HydrophobicContact CG1-CD1 4.02Å; Y812-I929 HydrophobicContact CD2-CD1 4.49Å; C846-I929 HydrophobicContact CB-CG2 3.79Å; L848-I929 HydrophobicContact CD1-CG1 3.97Å; L848-I929 HydrophobicContact CD2-CB 4.4Å; L848-I929 HydrophobicContact CD2-CG1 3.75Å; L848-I929 HydrophobicContact CG-CG1 4.02Å; R898-I929 HydrophobicContact CB-CB 4.23Å; R898-I929 PolarHBondContact N-O 3.32Å; R898-I929 PolarHBondContact O-N 2.97Å; V900-I929 HydrophobicContact CG1-CD1 3.6Å; V900-I929 HydrophobicContact CG1-CG1 4.07Å; V900-I929 HydrophobicContact CG2-CD1 4.31Å; V900-I929 HydrophobicContact CG2-CG1 4.22Å
930	A	86.4	Confident	85.5	Confident	22 Å²	22	52 Å²	52	18%	0.182	28%	0.279	C	S	.	.			trans	-71.2	154.1	178.8	0	0	0	0	0	111.8	T856 R938	T856-A930 HydrophobicContact CG2-CB 3.88Å; A930-R938 PolarHBondContact O-NE 3.4Å
931	P	88.6	Confident	85.5	Confident	28 Å²	28	47 Å²	47	18%	0.182	26%	0.258	C	S	.	.			trans	-58.5	174.7	168.3	25.6	-34.1	0	0	0	112.4	S936 R938	P931-S936 WeakPolarHBondContact CA-O 3.34Å; P931-S936 WeakPolarHBondContact CB-O 3.37Å; P931-R938 PolarHBondContact O-NH2 2.94Å
932	L	87.1	Confident	85.5	Confident	48 Å²	48	50 Å²	50	25%	0.251	27%	0.267	S	S	.	.			trans	-71.4	170.6	165.3	-71.3	165.1	0	0	0	110.7	D934 G935 S936 R938	L932-D934 VanDerWaalsContact CB-OD1 3.23Å; L932-D934 WeakPolarHBondContact CB-OD1 3.42Å; L932-D934 PolarHBondContact O-N 3.15Å; L932-G935 WeakPolarHBondContact O-CA 3.49Å; L932-G935 PolarHBondContact O-N 3.2Å; L932-S936 WeakPolarHBondContact CD1-OG 3.36Å; L932-S936 PolarHBondContact N-O 2.63Å; L932-R938 HydrophobicContact CD2-CG 4.31Å; L932-R938 HydrophobicContact CG-CG 3.97Å
933	E	85.2	Confident	86	Confident	195 Å²	195	47.1 Å²	47.1	91%	0.911	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-21.4	-175.5	-61.3	-175.4	157	0	0	113.3	G935	E933-G935 VanDerWaalsContact C-N 3.26Å
934	D	88.5	Confident	86.4	Confident	124 Å²	124	47.1 Å²	47.1	66%	0.663	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	1.6	170.7	60.4	7.8	0	0	0	113.6	L932 S936	L932-D934 VanDerWaalsContact CB-OD1 3.23Å; L932-D934 WeakPolarHBondContact CB-OD1 3.42Å; L932-D934 PolarHBondContact O-N 3.15Å; D934-S936 VanDerWaalsContact C-N 3.27Å; D934-S936 VanDerWaalsContact CG-OG 3.3Å; D934-S936 PolarHBondContact O-N 2.73Å; D934-S936 WeakPolarHBondContact OD1-CB 3.39Å; D934-S936 PolarHBondContact OD1-N 3.32Å; D934-S936 PolarHBondContact OD1-OG 2.91Å; D934-S936 PolarHBondContact OD2-OG 3.14Å
935	G	86.9	Confident	86.5	Confident	40 Å²	40	54.9 Å²	54.9	41%	0.412	29%	0.285	S	S	.	.	S	Bend	trans	80.2	-2.4	-175.4	0	0	0	0	0	114.8	L932 E933	L932-G935 WeakPolarHBondContact O-CA 3.49Å; L932-G935 PolarHBondContact O-N 3.2Å; E933-G935 VanDerWaalsContact C-N 3.26Å
936	S	90.3	Very high	86.3	Confident	41 Å²	41	49.7 Å²	49.7	29%	0.287	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-73.1	147.5	-179.1	71.7	0	0	0	0	112.4	P931 L932 D934	P931-S936 WeakPolarHBondContact CA-O 3.34Å; P931-S936 WeakPolarHBondContact CB-O 3.37Å; L932-S936 WeakPolarHBondContact CD1-OG 3.36Å; L932-S936 PolarHBondContact N-O 2.63Å; D934-S936 VanDerWaalsContact C-N 3.27Å; D934-S936 VanDerWaalsContact CG-OG 3.3Å; D934-S936 PolarHBondContact O-N 2.73Å; D934-S936 WeakPolarHBondContact OD1-CB 3.39Å; D934-S936 PolarHBondContact OD1-N 3.32Å; D934-S936 PolarHBondContact OD1-OG 2.91Å; D934-S936 PolarHBondContact OD2-OG 3.14Å
937	P	90.4	Very high	85.6	Confident	34 Å²	34	51.4 Å²	51.4	22%	0.221	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-71.9	139	179.5	28.3	-34	0	0	0	111.9	I878 G896 R939	I878-P937 HydrophobicContact CD1-CB 3.98Å; I878-P937 HydrophobicContact CD1-CG 4.23Å; I878-P937 HydrophobicContact CG1-CB 4.07Å; I878-P937 HydrophobicContact CG2-CB 3.75Å; I878-P937 HydrophobicContact CG2-CG 4.11Å; G896-P937 WeakPolarHBondContact O-CA 3.45Å; P937-R939 PolarHBondContact O-N 2.91Å
938	R	89.8	Confident	84.7	Confident	38 Å²	38	50.4 Å²	50.4	14%	0.143	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-66.7	128	170.3	-64	-178	-157.4	-106	-9.2	109.7	I800 K844 R898 A930 P931 L932	I800-R938 HydrophobicContact CB-CB 4.29Å; I800-R938 HydrophobicContact CG2-CB 4.34Å; K844-R938 PolarHBondContact O-NH1 3.05Å; R898-R938 PolarHBondContact NH1-O 2.95Å; A930-R938 PolarHBondContact O-NE 3.4Å; P931-R938 PolarHBondContact O-NH2 2.94Å; L932-R938 HydrophobicContact CD2-CG 4.31Å; L932-R938 HydrophobicContact CG-CG 3.97Å
939	R	88.9	Confident	84	Confident	60 Å²	60	50.7 Å²	50.7	23%	0.226	27%	0.274	C	S	.	.			trans	-135.9	135.8	-179.4	-63.1	174.1	166.9	-72.9	-7.2	108.1	E876 I878 P937 C941	E876-R939 IonicContact OE1-CZ 3.58Å; E876-R939 IonicContact OE1-NH1 3.73Å; E876-R939 PolarHBondContact OE1-NH1 3.27Å; E876-R939 IonicContact OE1-NH2 2.66Å; I878-R939 HydrophobicContact CD1-CG 4.03Å; P937-R939 PolarHBondContact O-N 2.91Å; R939-C941 VanDerWaalsContact CB-O 3.31Å; R939-C941 WeakPolarHBondContact CB-O 3.29Å
940	G	83.8	Confident	83	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.01	30%	0.298	C	S	.	.	S	Bend	trans	-84.4	-16	168.8	0	0	0	0	0	113.6	H797 S798 D814	H797-G940 PolarHBondContact CD2-O 2.94Å; S798-G940 PolarHBondContact OG-O 3.02Å; D814-G940 PolarHBondContact O-N 3.25Å
941	C	84.1	Confident	81.5	Confident	2 Å²	2	57.4 Å²	57.4	1%	0.014	30%	0.303	C	S	.	.	S	Bend	trans	-106.6	129.3	168.4	-164.9	0	0	0	0	110.8	C302 R939 D943	C302-C941 HydrophobicContact CB-CB 3.78Å; C302-C941 PolarHBondContact N-SG 2.84Å; C302-C941 VanDerWaalsContact N-SG 3.4Å; R939-C941 VanDerWaalsContact CB-O 3.31Å; R939-C941 WeakPolarHBondContact CB-O 3.29Å; C941-D943 PolarHBondContact O-N 3.09Å
942	E	82.2	Confident	79.7	Confident	113 Å²	113	60.8 Å²	60.8	53%	0.528	32%	0.317	S	S	.	.	S	Bend	trans	-70.5	-13.8	175.2	-170	166	-120.9	0	0	113	R300 P944	R300-E942 HydrophobicContact CB-CB 3.86Å; R300-E942 HydrophobicContact CB-CG 4.42Å; R300-E942 WeakPolarHBondContact CB-OE2 3.49Å; R300-E942 VanDerWaalsContact CD-OE1 3.26Å; R300-E942 WeakPolarHBondContact CD-OE1 3.3Å; R300-E942 IonicContact CZ-OE1 3.66Å; R300-E942 IonicContact NE-OE1 2.82Å; R300-E942 PolarHBondContact NE-OE1 2.78Å; R300-E942 IonicContact NE-OE2 2.74Å; R300-E942 VanDerWaalsContact O-CB 3.3Å; R300-E942 WeakPolarHBondContact O-CB 3.1Å; R300-E942 PolarHBondContact O-N 3.37Å; E942-P944 WeakPolarHBondContact O-CD 3.46Å
943	D	82.7	Confident	77.8	Confident	35 Å²	35	59.2 Å²	59.2	19%	0.187	31%	0.309	C	S	.	.			trans	-85.3	112.9	170.6	-175.6	-13.1	0	0	0	111.6	L301 R305 C941 H945 C946	L301-D943 HydrophobicContact CD2-CB 4Å; R305-D943 IonicContact CZ-OD2 3.26Å; R305-D943 IonicContact NH1-OD2 3.85Å; R305-D943 PolarHBondContact NH1-OD2 3.16Å; R305-D943 IonicContact NH2-OD2 3.76Å; R305-D943 PolarHBondContact NH2-OD2 3.35Å; C941-D943 PolarHBondContact O-N 3.09Å; D943-H945 PolarHBondContact O-N 3.49Å; D943-H945 WeakPolarHBondContact OD1-CA 3.4Å; D943-H945 PolarHBondContact OD1-N 2.83Å; D943-C946 HydrophobicContact CB-CB 4.32Å; D943-C946 PolarHBondContact O-N 2.95Å; D943-C946 PolarHBondContact OD1-N 3.12Å
944	P	82	Confident	75.2	Confident	66 Å²	66	54 Å²	54	43%	0.429	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-15.4	-179.7	-17.4	32.9	0	0	0	114.8	E942	E942-P944 WeakPolarHBondContact O-CD 3.46Å
945	H	82	Confident	72.4	Confident	164 Å²	164	49.7 Å²	49.7	76%	0.759	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	22.7	-177.6	-58.8	103.1	0	0	0	111.8	D943 P947	D943-H945 PolarHBondContact O-N 3.49Å; D943-H945 WeakPolarHBondContact OD1-CA 3.4Å; D943-H945 PolarHBondContact OD1-N 2.83Å; H945-P947 WeakPolarHBondContact O-CD 3.38Å
946	C	80.2	Confident	69.5	Low	2 Å²	2	52.9 Å²	52.9	1%	0.014	28%	0.276	C	S	.	.			trans	-52.4	121.8	-174.8	-172.2	0	0	0	0	112.7	R305 D943 A948 V949	R305-C946 VanDerWaalsContact CG-SG 3.58Å; R305-C946 PolarHBondContact NH1-SG 3.01Å; D943-C946 HydrophobicContact CB-CB 4.32Å; D943-C946 PolarHBondContact O-N 2.95Å; D943-C946 PolarHBondContact OD1-N 3.12Å; C946-A948 PolarHBondContact O-N 3.26Å; C946-A948 VanDerWaalsContact SG-CB 3.51Å; C946-V949 HydrophobicContact CB-CG2 4.37Å; C946-V949 VanDerWaalsContact O-CB 3.32Å; C946-V949 WeakPolarHBondContact O-CB 3.44Å; C946-V949 WeakPolarHBondContact O-CG2 3.25Å; C946-V949 PolarHBondContact O-N 2.96Å
947	P	72.6	Confident	66.4	Low	36 Å²	36	55.4 Å²	55.4	23%	0.234	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-58.8	-24.2	177.4	-26	35.6	0	0	0	113.4	R245 R305 H945 V949 R950 E952 V953	R245-P947 PolarHBondContact NH2-O 3.17Å; R305-P947 VanDerWaalsContact NH1-CD 3.32Å; H945-P947 WeakPolarHBondContact O-CD 3.38Å; P947-V949 PolarHBondContact O-N 3.21Å; P947-R950 PolarHBondContact O-N 3.45Å; P947-E952 WeakPolarHBondContact CB-O 3.27Å; P947-V953 HydrophobicContact CB-CG2 4.31Å
948	A	69.6	Low	63.2	Low	3 Å²	3	58.5 Å²	58.5	3%	0.025	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-60.9	-10.1	172.2	0	0	0	0	0	114.1	R245 Y304 C946	R245-A948 VanDerWaalsContact CZ-O 3.23Å; R245-A948 PolarHBondContact NH1-O 3.34Å; R245-A948 PolarHBondContact NH2-O 3.33Å; Y304-A948 HydrophobicContact CD2-CB 3.77Å; Y304-A948 HydrophobicContact CG-CB 3.79Å; C946-A948 PolarHBondContact O-N 3.26Å; C946-A948 VanDerWaalsContact SG-CB 3.51Å
949	V	74.5	Confident	60.2	Low	13 Å²	13	60.8 Å²	60.8	8%	0.079	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-73.7	-42.7	171.5	170	0	0	0	0	113.9	R241 H815 Y875 E876 C946 P947	R241-V949 PolarHBondContact NH1-O 3.5Å; H815-V949 VanDerWaalsContact CE1-CG2 3.47Å; H815-V949 WeakPolarHBondContact CE1-CG2 3.5Å; H815-V949 WeakPolarHBondContact ND1-CG2 3.48Å; Y875-V949 HydrophobicContact CG-CG1 4.37Å; E876-V949 HydrophobicContact CB-CG1 3.99Å; E876-V949 HydrophobicContact CB-CG2 4.16Å; E876-V949 HydrophobicContact CG-CG1 4.48Å; E876-V949 HydrophobicContact CG-CG2 4.36Å; C946-V949 HydrophobicContact CB-CG2 4.37Å; C946-V949 VanDerWaalsContact O-CB 3.32Å; C946-V949 WeakPolarHBondContact O-CB 3.44Å; C946-V949 WeakPolarHBondContact O-CG2 3.25Å; C946-V949 PolarHBondContact O-N 2.96Å; P947-V949 PolarHBondContact O-N 3.21Å
950	R	66.2	Low	57.1	Low	135 Å²	135	65.2 Å²	65.2	51%	0.509	36%	0.359	S	S	.	.	S	Bend	trans	-97.8	-3	-154.9	-72	-176.4	175.6	-173.5	-0.5	117.6	Y875 P947 E952	Y875-R950 HydrophobicContact CD1-CG 4.4Å; Y875-R950 HydrophobicContact CG-CG 4.38Å; P947-R950 PolarHBondContact O-N 3.45Å; R950-E952 HydrophobicContact CB-CB 4Å; R950-E952 HydrophobicContact CB-CG 3.85Å; R950-E952 VanDerWaalsContact CD-OE1 3.29Å; R950-E952 WeakPolarHBondContact CD-OE1 3.48Å; R950-E952 WeakPolarHBondContact CD-OE2 3.42Å; R950-E952 IonicContact CZ-OE2 3.8Å; R950-E952 IonicContact NE-OE2 3.57Å; R950-E952 IonicContact NH1-OE1 2.79Å; R950-E952 PolarHBondContact NH1-OE1 3.4Å; R950-E952 IonicContact NH1-OE2 3.67Å; R950-E952 PolarHBondContact NH1-OE2 2.72Å; R950-E952 PolarHBondContact O-N 3.41Å
951	G	56.5	Low	54.4	Low	27 Å²	27	75.8 Å²	75.8	28%	0.278	40%	0.399	S	S	.	.	S	Bend	trans	86.2	-35.8	-158	0	0	0	0	0	112.2	R245 V953	R245-G951 PolarHBondContact NE-O 3.28Å; R245-G951 VanDerWaalsContact NE-O 3.12Å; G951-V953 PolarHBondContact O-N 2.85Å
952	E	50.3	Low	51.6	Low	100 Å²	100	81.5 Å²	81.5	47%	0.467	43%	0.433	S	S	.	.			trans	-56.1	62.8	179.6	-62.9	170.2	-162.6	0	0	115.5	P947 R950	P947-E952 WeakPolarHBondContact CB-O 3.27Å; R950-E952 HydrophobicContact CB-CB 4Å; R950-E952 HydrophobicContact CB-CG 3.85Å; R950-E952 VanDerWaalsContact CD-OE1 3.29Å; R950-E952 WeakPolarHBondContact CD-OE1 3.48Å; R950-E952 WeakPolarHBondContact CD-OE2 3.42Å; R950-E952 IonicContact CZ-OE2 3.8Å; R950-E952 IonicContact NE-OE2 3.57Å; R950-E952 IonicContact NH1-OE1 2.79Å; R950-E952 PolarHBondContact NH1-OE1 3.4Å; R950-E952 IonicContact NH1-OE2 3.67Å; R950-E952 PolarHBondContact NH1-OE2 2.72Å; R950-E952 PolarHBondContact O-N 3.41Å
953	V	46.5	Very low	49	Very low	15 Å²	15	81.1 Å²	81.1	9%	0.091	44%	0.443	C	S	.	.			trans	-124	54.7	165.2	-173.4	0	0	0	0	106.4	R245 C662 P947 G951	R245-V953 HydrophobicContact CG-CB 4.44Å; C662-V953 HydrophobicContact CB-CG1 3.47Å; C662-V953 VanDerWaalsContact CB-CG1 3.47Å; C662-V953 VanDerWaalsContact SG-CG1 3.59Å; P947-V953 HydrophobicContact CB-CG2 4.31Å; G951-V953 PolarHBondContact O-N 2.85Å
954	T	30.6	Very low	46.2	Very low	84 Å²	84	87.9 Å²	87.9	52%	0.515	47%	0.474	S	S	.	.			trans	-69.3	135.6	172.3	43.8	0	0	0	0	109.4	I956	T954-I956 PolarHBondContact O-N 2.73Å; T954-I956 VanDerWaalsContact O-N 3.08Å
955	P	29.5	Very low	43.5	Very low	35 Å²	35	91.2 Å²	91.2	23%	0.227	50%	0.496	C	S	.	.			trans	-47.8	117.8	160.5	-29.1	37.6	0	0	0	110	F663 V957	F663-P955 HydrophobicContact CE2-CB 3.97Å; F663-P955 HydrophobicContact CE2-CG 4.33Å; F663-P955 HydrophobicContact CZ-CB 4.35Å; F663-P955 HydrophobicContact CZ-CG 4.38Å; P955-V957 PolarHBondContact O-N 2.76Å
956	I	26.5	Very low	40.8	Very low	107 Å²	107	86.9 Å²	86.9	55%	0.549	50%	0.495	S	S	.	.			trans	-75	89	169.2	-61.8	-175.1	0	0	0	106.5	I660 T954 P958	I660-I956 HydrophobicContact CD1-CD1 4.04Å; I660-I956 HydrophobicContact CG1-CD1 4.02Å; I660-I956 HydrophobicContact CG2-CD1 3.96Å; I660-I956 HydrophobicContact CG2-CG1 4.34Å; T954-I956 PolarHBondContact O-N 2.73Å; T954-I956 VanDerWaalsContact O-N 3.08Å; I956-P958 VanDerWaalsContact O-CD 3.23Å; I956-P958 WeakPolarHBondContact O-CD 3.36Å
957	V	24.4	Very low	38.3	Very low	94 Å²	94	92.3 Å²	92.3	57%	0.57	53%	0.533	S	S	*	.			trans	-58.7	120.1	165.9	-178.2	0	0	0	0	106.9	P955 S959	P955-V957 PolarHBondContact O-N 2.76Å; V957-S959 PolarHBondContact O-N 3.18Å
958	P	24.9	Very low	36	Very low	99 Å²	99	99 Å²	99	64%	0.643	57%	0.566	S	S	*	*			trans	-73.2	67.2	-174.6	-21.5	36	0	0	0	113.9	I956	I956-P958 VanDerWaalsContact O-CD 3.23Å; I956-P958 WeakPolarHBondContact O-CD 3.36Å
959	S	25.6	Very low	34	Very low	86 Å²	86	104.4 Å²	104.4	60%	0.601	60%	0.601	S	S	*	*			trans	-77.3	-25.8	179	-57.1	0	0	0	0	113.1	V957	V957-S959 PolarHBondContact O-N 3.18Å
960	D	25	Very low	31.8	Very low	153 Å²	153	111.8 Å²	111.8	82%	0.818	64%	0.639	S	S	*	*			trans	-92.3	5.6	-169.2	-59.2	-26.9	0	0	0	114.1	V962	D960-V962 PolarHBondContact O-N 2.97Å
961	W	25.7	Very low	29.9	Very low	223 Å²	223	113.1 Å²	113.1	85%	0.845	65%	0.651	S	S	*	*			trans	-82.8	38.8	176.9	-80.4	75.9	0	0	0	113.5
962	V	25.9	Very low	28.4	Very low	121 Å²	121	119.4 Å²	119.4	73%	0.733	68%	0.677	S	S	*	*			trans	-100.4	91.8	159.3	-178.8	0	0	0	0	108	D960 Q964	D960-V962 PolarHBondContact O-N 2.97Å; V962-Q964 PolarHBondContact O-N 3.34Å
963	S	26.9	Very low	27.4	Very low	105 Å²	105	120.1 Å²	120.1	73%	0.734	69%	0.69	S	S	*	*			trans	-61.9	97	175.3	-62.6	0	0	0	0	111.2	P965	S963-P965 WeakPolarHBondContact O-CD 3.01Å
964	Q	23.8	Very low	26.2	Very low	178 Å²	178	123.1 Å²	123.1	83%	0.832	73%	0.725	S	S	*	*			trans	-74.4	117.8	160.5	-71.2	-159.3	8	0	0	109.2	V962 G966	V962-Q964 PolarHBondContact O-N 3.34Å; Q964-G966 PolarHBondContact O-N 3.14Å; Q964-G966 VanDerWaalsContact O-N 3.16Å
965	P	25.8	Very low	26.1	Very low	136 Å²	136	131.2 Å²	131.2	88%	0.883	75%	0.746	S	S	*	*			trans	-82.6	94.9	-178.5	32.6	-32.7	0	0	0	110.9	S963	S963-P965 WeakPolarHBondContact O-CD 3.01Å
966	G	24.8	Very low	25.9	Very low	73 Å²	73	134.5 Å²	134.5	75%	0.753	77%	0.77	S	S	*	*			trans	151	69.9	162.1	0	0	0	0	0	119.1	Q964	Q964-G966 PolarHBondContact O-N 3.14Å; Q964-G966 VanDerWaalsContact O-N 3.16Å
967	S	29.3	Very low	25.9	Very low	116 Å²	116	135.4 Å²	135.4	81%	0.811	78%	0.782	S	S	*	*			trans	-155.7	128.4	145	57.4	0	0	0	0	112.2
968	L	23.6	Very low	26.2	Very low	176 Å²	176	136.7 Å²	136.7	92%	0.921	79%	0.793	S	S	*	*			trans	-103.2	130.1	170	-80.1	169.6	0	0	0	109.5
969	P	28.4	Very low	26.3	Very low	117 Å²	117	137.5 Å²	137.5	76%	0.76	80%	0.801	S	S	*	*			trans	-107.9	104	160.2	0.3	21.1	0	0	0	111.9
970	L	28.5	Very low	26.4	Very low	168 Å²	168	144.3 Å²	144.3	88%	0.88	82%	0.815	S	S	*	*			trans	15.3	101	143.4	-63.6	163.6	0	0	0	119.1
971	H	24.7	Very low	26.5	Very low	163 Å²	163	144.7 Å²	144.7	76%	0.755	82%	0.817	S	S	*	*				29.9	119.2	114.9	-147	-70.6	0	0	0	119
972	L	26.2	Very low	26.6	Very low	158 Å²	158	138.6 Å²	138.6	83%	0.827	81%	0.808	S	S	*	*				174.2	164.1	127.3	-88.9	166.7	0	0	0	110.6
973	P	28.7	Very low	26.8	Very low	115 Å²	115	140.6 Å²	140.6	75%	0.747	81%	0.814	S	S	*	*			trans	-110.3	172	-139.5	42	-37.9	0	0	0	116
974	G	22.3	Very low	26.7	Very low	79 Å²	79	141.4 Å²	141.4	81%	0.814	81%	0.814	S	S	*	*			trans	-78.8	171.1	-176.3	0	0	0	0	0	116.4
975	R	28.2	Very low	27	Very low	253 Å²	253	139 Å²	139	96%	0.955	81%	0.812	S	S	*	*			trans	-142.7	146.3	167	-106	-177.6	173.4	-135.2	-1.4	110
976	S	24.8	Very low	27	Very low	105 Å²	105	143.4 Å²	143.4	73%	0.734	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-78.6	154.5	172.7	41.5	0	0	0	0	112.1
977	P	26.9	Very low	27.4	Very low	125 Å²	125	145.5 Å²	145.5	81%	0.812	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-78.6	130.7	172.2	31.6	-32.7	0	0	0	111
978	P	31.2	Very low	27.2	Very low	121 Å²	121	150.6 Å²	150.6	79%	0.786	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-84.8	157.4	172.1	34.4	-33.8	0	0	0	112
979	S	26.7	Very low	27.5	Very low	117 Å²	117	150.3 Å²	150.3	82%	0.818	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-73.2	148.9	174.4	51.3	0	0	0	0	112.8
980	Y	27.5	Very low	27.5	Very low	229 Å²	229	147.6 Å²	147.6	90%	0.898	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-73.7	136.1	163.2	-98.7	-102.3	0	0	0	110.8
981	D	26.7	Very low	27.6	Very low	161 Å²	161	145.5 Å²	145.5	86%	0.861	80%	0.798	S	S	*	*			trans	-141.9	159.5	141.9	-150.4	-18.8	0	0	0	108.7
982	S	27.6	Very low	27.9	Very low	94 Å²	94	144.5 Å²	144.5	66%	0.657	80%	0.798	S	S	*	*			trans	-95.3	144.4	-168.2	-174.5	0	0	0	0	112.5
983	L	29.9	Very low	28.2	Very low	164 Å²	164	143.7 Å²	143.7	86%	0.859	79%	0.794	S	S	*	*				-168.4	154.9	127.8	-104.2	166.8	0	0	0	114.5
984	V	26	Very low	28.1	Very low	121 Å²	121	147.2 Å²	147.2	73%	0.733	80%	0.8	S	S	*	*			trans	-69.7	141	-173.6	171.1	0	0	0	0	113.5
985	T	29.2	Very low	28.5	Very low	127 Å²	127	147 Å²	147	78%	0.779	80%	0.798	S	S	*	*				-175.7	144.4	126.9	-76.1	0	0	0	0	112.6
986	R	25.6	Very low	28.6	Very low	229 Å²	229	141.7 Å²	141.7	86%	0.864	79%	0.793	S	S	*	*			trans	-128.5	147.5	165.4	-103.2	-175.6	170	-173.4	-2.3	108.2
987	P	32.8	Very low	29.3	Very low	118 Å²	118	141.7 Å²	141.7	77%	0.766	79%	0.791	S	S	*	*				-146.8	121.4	115.3	32.9	-15.2	0	0	0	116.5
988	R	26.8	Very low	29.5	Very low	222 Å²	222	140.6 Å²	140.6	84%	0.838	79%	0.786	S	S	*	*				34.3	144.5	125.9	-83.2	-177	173.8	170.8	-1.4	123.6
989	I	28.7	Very low	29.4	Very low	171 Å²	171	140 Å²	140	88%	0.877	79%	0.785	S	S	*	*			trans	81	131	157.3	-59.9	146.3	0	0	0	115
990	G	28.5	Very low	29.4	Very low	59 Å²	59	140.3 Å²	140.3	61%	0.608	79%	0.786	S	S	*	*			cis	-171.7	161.5	-5.1	0	0	0	0	0	114.4
991	T	30.1	Very low	29.3	Very low	124 Å²	124	139.4 Å²	139.4	76%	0.761	79%	0.786	S	S	*	*			trans	25.7	130.7	141.2	54.3	0	0	0	0	119.2
992	D	30.7	Very low	29.4	Very low	142 Å²	142	135.5 Å²	135.5	76%	0.759	79%	0.785	S	S	*	*				-174.1	170	66.3	-107.2	-41.6	0	0	0	116.8
993	L	32.8	Very low	29.4	Very low	141 Å²	141	135.6 Å²	135.6	74%	0.738	79%	0.791	S	S	*	*			trans	69.4	107.2	153.7	-70.2	164	0	0	0	124.1
994	E	28.3	Very low	29.4	Very low	190 Å²	190	135.9 Å²	135.9	89%	0.888	79%	0.792	S	S	*	*				43.1	138.1	128.9	-60.5	-168.9	149.7	0	0	125.3
995	G	29.9	Very low	29.5	Very low	75 Å²	75	138.4 Å²	138.4	77%	0.773	79%	0.793	S	S	*	*			trans	167.7	106.5	164.1	0	0	0	0	0	115
996	V	30.3	Very low	29.3	Very low	140 Å²	140	137.6 Å²	137.6	85%	0.848	79%	0.788	S	S	*	*			trans	-155.6	154.3	-168.9	170.7	0	0	0	0	108.7
997	P	38.8	Very low	29.5	Very low	106 Å²	106	135.8 Å²	135.8	69%	0.688	79%	0.789	S	S	*	*			cis	-132.1	178	-3.1	33.7	-12.2	0	0	0	117.6
998	S	31.8	Very low	29.3	Very low	101 Å²	101	133.8 Å²	133.8	71%	0.706	79%	0.79	S	S	*	*			trans	55.1	119.3	138.4	67.1	0	0	0	0	125.2
999	S	28.9	Very low	29.2	Very low	109 Å²	109	129.4 Å²	129.4	76%	0.762	79%	0.793	S	S	*	*				50.7	121.6	122.8	-168.7	0	0	0	0	122.2
1000	C	26.2	Very low	29.1	Very low	124 Å²	124	124.9 Å²	124.9	84%	0.838	79%	0.789	S	S	*	*				-170.3	163.9	115.8	-102.1	0	0	0	0	116.4
1001	K	26.3	Very low	29	Very low	209 Å²	209	129.3 Å²	129.3	91%	0.909	80%	0.799	S	S	*	*			trans	-59.8	155.9	-174.3	-57.2	162.7	178.6	172.9	0	116.1
1002	G	28.8	Very low	28.9	Very low	80 Å²	80	130.3 Å²	130.3	83%	0.825	80%	0.799	S	S	*	*			trans	-164.7	129.4	156.4	0	0	0	0	0	112.2
1003	A	26.7	Very low	28.9	Very low	96 Å²	96	131.3 Å²	131.3	79%	0.793	80%	0.804	S	S	*	*			trans	-151.1	132.2	-177.3	0	0	0	0	0	112.8
1004	L	29.7	Very low	28.4	Very low	169 Å²	169	130.2 Å²	130.2	89%	0.885	81%	0.807	S	S	*	*			trans	-171.7	155.4	172.4	-109.3	112	0	0	0	107.7
1005	K	27.8	Very low	28.8	Very low	174 Å²	174	126.6 Å²	126.6	76%	0.757	80%	0.8	S	S	*	*			cis	-171.2	108.7	-21.8	-179.1	171	180	-177.5	0	112.3
1006	V	26.7	Very low	28.7	Very low	110 Å²	110	128.1 Å²	128.1	67%	0.667	80%	0.798	S	S	*	*				56.5	144.1	127.8	179.9	0	0	0	0	122.6
1007	H	28.6	Very low	28.6	Very low	191 Å²	191	128.3 Å²	128.3	88%	0.884	80%	0.795	S	S	*	*			trans	80.1	149.2	173.7	-60	-38.1	0	0	0	117.2
1008	G	28.3	Very low	28.1	Very low	76 Å²	76	128.5 Å²	128.5	78%	0.784	80%	0.797	S	S	*	*			cis	-162	-179.5	2.6	0	0	0	0	0	113.6
1009	S	24.9	Very low	27.9	Very low	130 Å²	130	128.9 Å²	128.9	91%	0.909	80%	0.8	S	S	*	*			trans	-103.3	153.6	-166.8	54.6	0	0	0	0	115.8
1010	G	27.9	Very low	27.8	Very low	76 Å²	76	128.1 Å²	128.1	78%	0.784	80%	0.795	S	S	*	*			trans	-179.4	139.7	162.6	0	0	0	0	0	113.8
1011	N	25.6	Very low	27.9	Very low	153 Å²	153	131.8 Å²	131.8	82%	0.818	80%	0.796	S	S	*	*			trans	-88.4	153.6	166.5	-68.4	-12	0	0	0	109.8
1012	D	27.9	Very low	27.8	Very low	144 Å²	144	127.3 Å²	127.3	77%	0.77	79%	0.791	S	S	*	*				168.7	156.7	108.8	-93.9	-21.1	0	0	0	114.9
1013	L	29.7	Very low	27.8	Very low	164 Å²	164	129.8 Å²	129.8	86%	0.859	79%	0.785	S	S	*	*			trans	65	109.4	154.9	-67.6	161	0	0	0	122
1014	C	24.2	Very low	27.6	Very low	118 Å²	118	133.4 Å²	133.4	80%	0.797	79%	0.791	S	S	*	*			trans	-67.7	173	144.3	-72.3	0	0	0	0	110.9
1015	P	36.1	Very low	27.5	Very low	114 Å²	114	132.7 Å²	132.7	74%	0.74	78%	0.783	S	S	*	*			cis	-154.8	-174.7	32	45.1	-23.5	0	0	0	120.3
1016	S	28.4	Very low	27.5	Very low	106 Å²	106	132.1 Å²	132.1	74%	0.741	79%	0.788	S	S	*	*			trans	76.4	150.6	159.6	82.1	0	0	0	0	117.4
1017	N	27.7	Very low	27.3	Very low	145 Å²	145	138.9 Å²	138.9	78%	0.775	80%	0.801	S	S	*	*			cis	-156.9	175.9	19.7	-139	-23.8	0	0	0	113.5
1018	C	28.6	Very low	27.2	Very low	110 Å²	110	135.1 Å²	135.1	74%	0.743	80%	0.796	S	S	*	*			trans	66.3	118	176.7	-61.3	0	0	0	0	116.4
1019	S	27.8	Very low	27.1	Very low	108 Å²	108	142.8 Å²	142.8	76%	0.755	80%	0.801	S	S	*	*			cis	68.9	137.4	49.8	122.8	0	0	0	0	114.4
1020	S	25.6	Very low	27.3	Very low	94 Å²	94	148.7 Å²	148.7	66%	0.657	80%	0.804	S	S	*	*			cis	-169.6	175.7	-1.1	45	0	0	0	0	112.8
1021	K	28.9	Very low	27.1	Very low	201 Å²	201	149 Å²	149	87%	0.874	80%	0.798	S	S	*	*			trans	105.5	145.2	158.4	-60.8	-176.8	-179.7	178.8	0	118.4
1022	S	24.6	Very low	27.1	Very low	114 Å²	114	150.1 Å²	150.1	80%	0.797	80%	0.799	S	S	*	*			trans	-82.9	161.2	-178.9	48.1	0	0	0	0	112.3
1023	L	27.4	Very low	27	Very low	132 Å²	132	147.5 Å²	147.5	69%	0.691	79%	0.79	S	S	*	*			trans	-135	84	177	-159.5	128.2	0	0	0	111.5	E1025	L1023-E1025 HydrophobicContact CD2-CB 3.81Å; L1023-E1025 HydrophobicContact CG-CB 3.97Å; L1023-E1025 PolarHBondContact O-N 3.45Å
1024	D	24.2	Very low	26.9	Very low	173 Å²	173	149.6 Å²	149.6	93%	0.925	79%	0.788	S	S	*	*			trans	-76.5	55.3	169.3	-124.8	-36.1	0	0	0	109.9
1025	E	27.4	Very low	27	Very low	154 Å²	154	148.1 Å²	148.1	72%	0.72	78%	0.78	S	S	*	*			trans	-151.4	57.6	-165.9	-151	175.4	-158.7	0	0	114.4	L1023	L1023-E1025 HydrophobicContact CD2-CB 3.81Å; L1023-E1025 HydrophobicContact CG-CB 3.97Å; L1023-E1025 PolarHBondContact O-N 3.45Å
1026	L	27	Very low	26.6	Very low	162 Å²	162	149.8 Å²	149.8	85%	0.848	78%	0.782	S	S	*	*			trans	-147.9	44.9	168.9	-117.2	169.4	0	0	0	114.9
1027	R	23.5	Very low	26.6	Very low	252 Å²	252	150.6 Å²	150.6	95%	0.951	78%	0.783	S	S	*	*	S	Bend	trans	-138.3	60	170.6	-80.8	-165.8	175.7	-178.6	2	114.4
1028	S	25	Very low	26.7	Very low	111 Å²	111	148.9 Å²	148.9	78%	0.776	79%	0.789	S	S	*	*			trans	-164.4	167.9	149.5	-150.4	0	0	0	0	113.4
1029	R	28	Very low	26.8	Very low	238 Å²	238	149 Å²	149	90%	0.898	80%	0.798	S	S	*	*			trans	59.6	99.1	163.7	-61	179.7	174.9	-156.2	-3.3	118.5
1030	R	27.6	Very low	26.9	Very low	254 Å²	254	147.7 Å²	147.7	96%	0.958	80%	0.801	S	S	*	*				-156	128.2	113.1	-144	171.9	-171.3	158.8	3.6	112.7
1031	A	23.8	Very low	27.1	Very low	81 Å²	81	151.8 Å²	151.8	67%	0.669	81%	0.814	S	S	*	*			trans	-160.5	141.4	167.1	0	0	0	0	0	109.8
1032	H	26.4	Very low	27	Very low	178 Å²	178	149.4 Å²	149.4	82%	0.824	81%	0.811	S	S	*	*			trans	60.3	147.5	172.3	-61.4	-72.3	0	0	0	117.8
1033	C	25.4	Very low	27.3	Very low	88 Å²	88	149 Å²	149	60%	0.595	81%	0.808	S	S	*	*			cis	-148.7	-170.2	-13.8	-114.9	0	0	0	0	106.7
1034	Y	28.4	Very low	27.4	Very low	208 Å²	208	146.1 Å²	146.1	82%	0.816	81%	0.811	S	S	*	*			cis	-143.1	152.7	13.5	-80.1	-75.8	0	0	0	106.3
1035	S	25.6	Very low	27.5	Very low	88 Å²	88	146.8 Å²	146.8	62%	0.615	81%	0.806	S	S	*	*			cis	98.8	109.8	37.8	85.4	0	0	0	0	114.8
1036	D	28.4	Very low	27.3	Very low	148 Å²	148	146.5 Å²	146.5	79%	0.791	81%	0.809	S	S	*	*			trans	157.4	150.3	147.4	-92.9	-33	0	0	0	112.2
1037	T	28.6	Very low	27.3	Very low	124 Å²	124	142.6 Å²	142.6	76%	0.761	80%	0.796	S	S	*	*			cis	-161.3	133.6	-41	2.9	0	0	0	0	108.8
1038	A	29.5	Very low	27.4	Very low	109 Å²	109	136.5 Å²	136.5	90%	0.901	79%	0.786	S	S	*	*			trans	-178.3	147.4	155.4	0	0	0	0	0	113.2
1039	A	30.1	Very low	27.3	Very low	112 Å²	112	142.5 Å²	142.5	93%	0.926	79%	0.792	S	S	*	*			trans	-74.6	153.7	-170.4	0	0	0	0	0	117.3
1040	G	29.2	Very low	27.3	Very low	80 Å²	80	139.4 Å²	139.4	83%	0.825	79%	0.793	S	S	*	*			trans	179	110.1	166.7	0	0	0	0	0	112.8
1041	L	29.3	Very low	27.1	Very low	180 Å²	180	132.6 Å²	132.6	94%	0.942	79%	0.785	S	S	*	*			trans	-74.8	132.2	-173.5	-67.3	150.8	0	0	0	113.6
1042	D	28.4	Very low	27	Very low	151 Å²	151	132.1 Å²	132.1	81%	0.807	78%	0.78	S	S	*	*				-168	173.8	104	-143.5	-42.6	0	0	0	111.4
1043	S	31	Very low	26.8	Very low	105 Å²	105	130.8 Å²	130.8	73%	0.734	78%	0.779	S	S	*	*			trans	-58.9	160.6	176	50.9	0	0	0	0	115
1044	G	28.1	Very low	26.7	Very low	72 Å²	72	138 Å²	138	74%	0.742	80%	0.796	S	S	*	*			cis	115.1	139.4	13.5	0	0	0	0	0	110.4
1045	F	27.6	Very low	26.3	Very low	187 Å²	187	136.6 Å²	136.6	82%	0.82	80%	0.797	S	S	*	*			cis	-159.3	128.7	5.2	177.9	-103.3	0	0	0	108.6	S1047	F1045-S1047 WeakPolarHBondContact CE1-OG 3.43Å; F1045-S1047 WeakPolarHBondContact CZ-OG 3.39Å
1046	D	21.8	Very low	26	Very low	149 Å²	149	137.5 Å²	137.5	80%	0.797	80%	0.803	S	S	*	*			trans	-105	149.8	171.2	-172.4	10.8	0	0	0	109.3
1047	S	28.2	Very low	25.7	Very low	80 Å²	80	136.9 Å²	136.9	56%	0.559	81%	0.805	S	S	*	*			trans	-161	118.6	-179.7	-89.9	0	0	0	0	114.2	F1045	F1045-S1047 WeakPolarHBondContact CE1-OG 3.43Å; F1045-S1047 WeakPolarHBondContact CZ-OG 3.39Å
1048	T	24.5	Very low	25.4	Very low	123 Å²	123	137.5 Å²	137.5	76%	0.755	81%	0.809	S	S	*	*			trans	-127.1	151.3	157.2	59.1	0	0	0	0	110.3
1049	R	24.6	Very low	25.1	Very low	238 Å²	238	137.2 Å²	137.2	90%	0.898	81%	0.806	S	S	*	*			trans	73.8	124.8	175.7	-55.7	179.4	131.3	114.4	-1.9	117.4
1050	N	27.1	Very low	24.7	Very low	172 Å²	172	137.4 Å²	137.4	92%	0.92	80%	0.801	S	S	*	*				-131.4	164.7	115.7	-124.6	-22.1	0	0	0	109.7
1051	S	22.7	Very low	24.4	Very low	112 Å²	112	138 Å²	138	78%	0.783	79%	0.792	S	S	*	*			trans	-115.7	177.2	176.3	-139.6	0	0	0	0	108.5
1052	A	22.2	Very low	24.1	Very low	70 Å²	70	137 Å²	137	58%	0.579	79%	0.787	S	S	*	*			cis	-151.7	-158.2	12.1	0	0	0	0	0	111.4
1053	D	23.1	Very low	24	Very low	150 Å²	150	133.8 Å²	133.8	80%	0.802	78%	0.777	S	S	*	*			trans	66.2	110.8	159.1	-56.4	-24.4	0	0	0	120.9
1054	Y	22.6	Very low	23.8	Very low	239 Å²	239	133.6 Å²	133.6	94%	0.937	78%	0.775	S	S	*	*				-165.5	149.8	115.2	-119.8	-89.8	0	0	0	110
1055	Q	20.3	Very low	23.9	Very low	180 Å²	180	134 Å²	134	84%	0.841	76%	0.757	S	S	*	*			trans	-120.5	151.7	-177.7	-70.1	-170.3	-1	0	0	113.7
1056	S	19	Very low	24	Very low	106 Å²	106	130.5 Å²	130.5	74%	0.741	75%	0.747	S	S	*	*			trans	60.2	126.2	157.8	-144.8	0	0	0	0	117.8
1057	T	22.2	Very low	24.3	Very low	135 Å²	135	133.3 Å²	133.3	83%	0.828	75%	0.747	S	S	*	*				-165.2	-179	72	29.9	0	0	0	0	113.1
1058	T	20.9	Very low	24.6	Very low	138 Å²	138	138 Å²	138	85%	0.847	75%	0.752	S	S	*	*			trans	-87.4	150	-166.3	51.7	0	0	0	0	116.9
1059	A	24.5	Very low	24.8	Very low	102 Å²	102	139.9 Å²	139.9	84%	0.843	75%	0.747	S	S	*	*			trans	-162.7	152.3	139.9	0	0	0	0	0	113
1060	S	21.1	Very low	25.1	Very low	116 Å²	116	134.4 Å²	134.4	81%	0.811	73%	0.731	S	S	*	*			trans	-90.6	174.8	170.1	61.8	0	0	0	0	110.5
1061	S	22.4	Very low	25.5	Very low	93 Å²	93	130.1 Å²	130.1	65%	0.65	72%	0.715	S	S	*	*			cis	-169.5	-176.6	29.9	63.2	0	0	0	0	113.3
1062	L	23.3	Very low	26.2	Very low	159 Å²	159	129.8 Å²	129.8	83%	0.832	70%	0.704	S	S	*	*			trans	71.1	162.7	157.2	-68.3	167.4	0	0	0	120
1063	S	25.9	Very low	26.7	Very low	84 Å²	84	133 Å²	133	59%	0.587	71%	0.709	S	S	*	*			trans	-120.8	151	-161.3	53.2	0	0	0	0	113.9
1064	S	27.9	Very low	26.9	Very low	101 Å²	101	132.1 Å²	132.1	71%	0.706	70%	0.703	S	S	*	*			trans	-149.7	9.9	-179.9	-45.1	0	0	0	0	114.5
1065	E	30.5	Very low	27.2	Very low	79 Å²	79	129.3 Å²	129.3	37%	0.369	70%	0.699	S	S	.	*	S	Bend	trans	-78.5	-30.3	-162	-75	156.6	-163.4	0	0	113.7	K467 R522 R1067	K467-E1065 WeakPolarHBondContact CE-OE1 3.4Å; K467-E1065 IonicContact NZ-OE1 3.37Å; K467-E1065 PolarHBondContact NZ-OE1 2.82Å; R522-E1065 IonicContact CZ-OE2 3.5Å; R522-E1065 IonicContact NH1-OE2 2.76Å; R522-E1065 PolarHBondContact NH1-OE2 3.48Å; R522-E1065 IonicContact NH2-OE2 3.61Å; R522-E1065 PolarHBondContact NH2-OE2 3.36Å; E1065-R1067 PolarHBondContact O-N 2.86Å
1066	D	29.9	Very low	27.5	Very low	114 Å²	114	125.5 Å²	125.5	61%	0.61	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-20.4	-173.5	-53.8	-65.3	0	0	0	115.1	W1068	D1066-W1068 VanDerWaalsContact C-N 3.32Å; D1066-W1068 PolarHBondContact O-N 2.93Å
1067	R	27.9	Very low	27.8	Very low	209 Å²	209	127.3 Å²	127.3	79%	0.789	70%	0.699	S	S	*	*	H	α-helix	trans	-67.5	-28.7	-173.4	-99.8	-177.1	171.5	156.8	-1	113.8	E1065 S1071	E1065-R1067 PolarHBondContact O-N 2.86Å; R1067-S1071 WeakPolarHBondContact O-CB 3.42Å; R1067-S1071 PolarHBondContact O-N 2.99Å
1068	W	33	Very low	28.1	Very low	177 Å²	177	126 Å²	126	67%	0.67	70%	0.702	S	S	*	*	H	α-helix	trans	-72.7	-39.3	-175.1	-121.7	76.6	0	0	0	112.7	D1066 S1071	D1066-W1068 VanDerWaalsContact C-N 3.32Å; D1066-W1068 PolarHBondContact O-N 2.93Å; W1068-S1071 PolarHBondContact O-N 3.44Å
1069	Y	30.3	Very low	28.6	Very low	164 Å²	164	131.5 Å²	131.5	64%	0.643	71%	0.707	S	S	*	*	H	α-helix	trans	-69.1	-37.8	175.9	-112	-90.3	0	0	0	112.3
1070	Q	30.4	Very low	28.7	Very low	122 Å²	122	131.2 Å²	131.2	57%	0.57	71%	0.705	S	S	*	*	H	α-helix	trans	-68.9	-34.2	175.8	-70	-175.1	-20.9	0	0	112.7	L1072 M1073 L1074	Q1070-L1072 PolarHBondContact O-N 3.04Å; Q1070-L1072 VanDerWaalsContact O-N 3.15Å; Q1070-M1073 PolarHBondContact O-N 2.88Å; Q1070-L1074 PolarHBondContact O-N 2.85Å
1071	S	35.2	Very low	29.2	Very low	83 Å²	83	136 Å²	136	58%	0.58	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-14	-179.7	-166.7	0	0	0	0	114.6	R1067 W1068	R1067-S1071 WeakPolarHBondContact O-CB 3.42Å; R1067-S1071 PolarHBondContact O-N 2.99Å; W1068-S1071 PolarHBondContact O-N 3.44Å
1072	L	36.7	Very low	29.4	Very low	105 Å²	105	138.3 Å²	138.3	55%	0.55	72%	0.716	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.8	-17.2	173.3	-75.2	165.4	0	0	0	113.2	T689 Q1070	T689-L1072 HydrophobicContact CG2-CD2 4.49Å; Q1070-L1072 PolarHBondContact O-N 3.04Å; Q1070-L1072 VanDerWaalsContact O-N 3.15Å
1073	M	34.4	Very low	29.6	Very low	137 Å²	137	138.3 Å²	138.3	68%	0.675	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	-2.8	-175.4	-63.6	-64.2	-69.7	0	0	113.5	F596 Q1070	F596-M1073 HydrophobicContact CZ-CE 4.44Å; Q1070-M1073 PolarHBondContact O-N 2.88Å
1074	L	27	Very low	29.7	Very low	131 Å²	131	139.5 Å²	139.5	69%	0.686	72%	0.724	S	S	*	*			trans	-126.2	82.6	-178.8	-74.1	169.9	0	0	0	111.3	Q1070	Q1070-L1074 PolarHBondContact O-N 2.85Å
1075	Q	29.1	Very low	29.7	Very low	181 Å²	181	139.8 Å²	139.8	85%	0.846	73%	0.726	S	S	*	*			trans	-127.1	74.3	162.9	-78.9	-163.5	-17.8	0	0	111.5
1076	S	25.1	Very low	29.6	Very low	99 Å²	99	140.4 Å²	140.4	69%	0.692	74%	0.74	S	S	*	*	S	Bend	trans	-131.2	145	148.5	55.7	0	0	0	0	109
1077	T	25.6	Very low	29.5	Very low	144 Å²	144	140.5 Å²	140.5	88%	0.883	75%	0.749	S	S	*	*	S	Bend	trans	49.9	83.2	171.7	55.3	0	0	0	0	119
1078	A	29.7	Very low	29.4	Very low	109 Å²	109	136.3 Å²	136.3	90%	0.901	75%	0.752	S	S	*	*			trans	-154.7	134.5	140.1	0	0	0	0	0	111.2
1079	R	30.8	Very low	29.1	Very low	252 Å²	252	131.5 Å²	131.5	95%	0.951	76%	0.757	S	S	*	*			trans	-102.5	128.9	-179.4	-171.9	179.4	-172.9	174.3	3.3	110
1080	A	26.7	Very low	28.9	Very low	96 Å²	96	127.7 Å²	127.7	79%	0.793	77%	0.767	S	S	*	*			trans	-73.7	147.3	-175.9	0	0	0	0	0	114
1081	K	30.5	Very low	28.8	Very low	216 Å²	216	126.9 Å²	126.9	94%	0.939	78%	0.776	S	S	*	*			trans	-159.3	155.6	145.4	-108.3	173	-174.9	-174.8	0	109
1082	N	26.6	Very low	28.6	Very low	143 Å²	143	127.2 Å²	127.2	77%	0.765	78%	0.778	S	S	*	*			trans	-146.3	149.6	-158	-152.8	0.7	0	0	0	111.6
1083	L	29	Very low	28.2	Very low	158 Å²	158	129 Å²	129	83%	0.827	79%	0.788	S	S	*	*			trans	66.6	151.6	169.5	-57.3	167.4	0	0	0	116.1
1084	S	27.6	Very low	28	Very low	109 Å²	109	129.8 Å²	129.8	76%	0.762	79%	0.794	S	S	*	*			cis	-149.5	-176.8	0.6	45.2	0	0	0	0	112.4
1085	S	27.9	Very low	28	Very low	107 Å²	107	128.5 Å²	128.5	75%	0.748	80%	0.796	S	S	*	*			trans	-62.4	168.8	177.9	57.5	0	0	0	0	114.8
1086	S	27.7	Very low	28.2	Very low	93 Å²	93	126.1 Å²	126.1	65%	0.65	80%	0.799	S	S	*	*			cis	-173.7	155.2	36.1	47.3	0	0	0	0	113.3
1087	S	27.9	Very low	28.3	Very low	116 Å²	116	130.7 Å²	130.7	81%	0.811	81%	0.81	S	S	*	*			trans	57.3	157.2	164.9	48.6	0	0	0	0	117.4
1088	S	27	Very low	28.6	Very low	121 Å²	121	128.2 Å²	128.2	85%	0.846	80%	0.804	S	S	*	*			cis	-166.5	174.6	-13	44.5	0	0	0	0	106.6
1089	G	26.5	Very low	28.7	Very low	75 Å²	75	127.5 Å²	127.5	77%	0.773	80%	0.798	S	S	*	*			cis	165	137.8	-7	0	0	0	0	0	110.8
1090	G	26.2	Very low	28.6	Very low	84 Å²	84	121.3 Å²	121.3	87%	0.866	79%	0.788	S	S	*	*			trans	86.3	160	-171.7	0	0	0	0	0	113.9
1091	S	27.8	Very low	29	Very low	106 Å²	106	124 Å²	124	74%	0.741	78%	0.784	S	S	*	*			cis	-165.1	153.5	-8.2	179.7	0	0	0	0	109.8
1092	S	30.6	Very low	29	Very low	89 Å²	89	121.9 Å²	121.9	62%	0.622	78%	0.777	S	S	*	*			trans	54.8	146.2	153.9	45.1	0	0	0	0	120.2
1093	D	27.6	Very low	29.1	Very low	142 Å²	142	118.5 Å²	118.5	76%	0.759	78%	0.776	S	S	*	*			cis	-157.8	166	-15.5	-87.1	-35.3	0	0	0	105.8
1094	L	32.1	Very low	29.3	Very low	154 Å²	154	120.7 Å²	120.7	81%	0.806	78%	0.779	S	S	*	*				-172.4	137.2	69.9	-82.7	164.8	0	0	0	112.8
1095	S	26.6	Very low	29.5	Very low	105 Å²	105	121.2 Å²	121.2	73%	0.734	78%	0.777	S	S	*	*			trans	49.4	111.9	135.4	-49.6	0	0	0	0	123.2
1096	S	33.4	Very low	29.5	Very low	130 Å²	130	122.8 Å²	122.8	91%	0.909	78%	0.777	S	S	*	*				-159.7	153.9	120	3.8	0	0	0	0	110.3
1097	E	26.9	Very low	29.7	Very low	195 Å²	195	125 Å²	125	91%	0.911	79%	0.787	S	S	*	*			trans	-115	141.9	-159.3	-60.2	170.6	94.2	0	0	115.6
1098	A	32.7	Very low	29.7	Very low	92 Å²	92	124.6 Å²	124.6	76%	0.76	78%	0.78	S	S	*	*			trans	-177.7	121.2	139.3	0	0	0	0	0	108
1099	A	30.4	Very low	29.9	Very low	95 Å²	95	126 Å²	126	79%	0.785	78%	0.777	S	S	*	*			cis	73.5	128.4	47.3	0	0	0	0	0	112.9
1100	V	30	Very low	30	Very low	122 Å²	122	130.2 Å²	130.2	74%	0.739	78%	0.781	S	S	*	*			cis	-164.6	-179.6	-7.8	93.9	0	0	0	0	110.7
1101	H	33.5	Very low	30	Very low	153 Å²	153	134.8 Å²	134.8	71%	0.708	78%	0.779	S	S	*	*			trans	74.2	150.3	173.1	-66.8	-65.7	0	0	0	119.6
1102	Q	30.6	Very low	30.5	Very low	171 Å²	171	134.5 Å²	134.5	80%	0.799	78%	0.775	S	S	*	*			cis	-169.8	144.1	-42.4	-127.8	175.9	-0.4	0	0	113
1103	G	29.8	Very low	30.5	Very low	71 Å²	71	139 Å²	139	73%	0.732	79%	0.786	S	S	*	*			trans	78.1	111.4	131.8	0	0	0	0	0	121.6
1104	K	32.2	Very low	30.4	Very low	205 Å²	205	138.6 Å²	138.6	89%	0.891	79%	0.788	S	S	*	*			trans	152.5	132.6	138.2	-90	-164.5	176	-177.9	0	111
1105	V	32.7	Very low	30.3	Very low	119 Å²	119	135 Å²	135	72%	0.721	79%	0.789	S	S	*	*			cis	-144.5	148.6	-13.6	164.8	0	0	0	0	107.5
1106	D	27.2	Very low	30.4	Very low	140 Å²	140	136.9 Å²	136.9	75%	0.749	80%	0.796	S	S	*	*			trans	-74	165.7	178.7	-48	-96	0	0	0	115
1107	T	32.6	Very low	30.2	Very low	139 Å²	139	134.6 Å²	134.6	85%	0.853	79%	0.792	S	S	*	*				-170.8	136.8	114	-70.5	0	0	0	0	111
1108	T	27.9	Very low	30.2	Very low	109 Å²	109	132.1 Å²	132.1	67%	0.669	79%	0.785	S	S	*	*			trans	-82.3	159	-173.8	46.5	0	0	0	0	114.5
1109	L	30.8	Very low	29.9	Very low	151 Å²	151	134.6 Å²	134.6	79%	0.791	79%	0.785	S	S	*	*				171.6	131	107.4	-87.7	174.2	0	0	0	115.4
1110	L	29.3	Very low	29.6	Very low	162 Å²	162	135.3 Å²	135.3	85%	0.848	78%	0.78	S	S	*	*			trans	27.2	142.9	147.1	-60	174.9	0	0	0	125.5
1111	H	25	Very low	29.5	Very low	180 Å²	180	137.1 Å²	137.1	83%	0.833	78%	0.783	S	S	*	*			trans	-54.3	178.9	156.3	-109.6	-113	0	0	0	114.5
1112	P	38.7	Very low	29	Very low	101 Å²	101	132.6 Å²	132.6	66%	0.656	78%	0.778	S	S	*	*			cis	-134.6	177.9	-6.4	40.7	-25.1	0	0	0	115.1
1113	Q	29.7	Very low	28.8	Very low	182 Å²	182	130.1 Å²	130.1	85%	0.85	78%	0.78	S	S	*	*				178.1	150.2	126.2	-91.7	-95.1	-25.2	0	0	110.9
1114	V	26.3	Very low	28.8	Very low	134 Å²	134	138.6 Å²	138.6	81%	0.812	79%	0.79	S	S	*	*			trans	-122.2	121	179.5	171	0	0	0	0	109.8
1115	G	30.3	Very low	28.5	Very low	79 Å²	79	135.8 Å²	135.8	81%	0.814	78%	0.784	S	S	*	*			trans	-91	109.3	-178.3	0	0	0	0	0	113.5
1116	V	28.9	Very low	28.1	Very low	145 Å²	145	137.8 Å²	137.8	88%	0.879	79%	0.79	S	S	*	*			trans	-40.8	137.1	175.3	-175.9	0	0	0	0	115.1
1117	G	28.4	Very low	28.5	Very low	81 Å²	81	136 Å²	136	84%	0.835	79%	0.786	S	S	*	*			trans	-176.6	87.7	168.9	0	0	0	0	0	113
1118	N	26.4	Very low	28.2	Very low	143 Å²	143	137.6 Å²	137.6	77%	0.765	79%	0.788	S	S	*	*			trans	-125.3	173.9	-168	-151.8	-2.5	0	0	0	112.1
1119	L	26.2	Very low	28.1	Very low	144 Å²	144	139.2 Å²	139.2	75%	0.754	79%	0.793	S	S	*	*			trans	70	145.3	167.1	-89.1	46.2	0	0	0	118.7
1120	V	24.7	Very low	28	Very low	111 Å²	111	139.7 Å²	139.7	67%	0.673	79%	0.794	S	S	*	*			cis	171.9	169.4	-13.2	72.7	0	0	0	0	108.7
1121	I	27.4	Very low	27.8	Very low	160 Å²	160	137 Å²	137	82%	0.821	79%	0.79	S	S	*	*			trans	71.8	149.5	160.4	-71.9	168.6	0	0	0	118.3
1122	G	24.2	Very low	28	Very low	57 Å²	57	132.5 Å²	132.5	59%	0.588	78%	0.783	S	S	*	*			trans	-150.7	-162.8	168.2	0	0	0	0	0	111.6
1123	S	26.9	Very low	27.5	Very low	120 Å²	120	135 Å²	135	84%	0.839	79%	0.789	S	S	*	*			trans	76.6	108.5	179.4	-47.3	0	0	0	0	117.5
1124	R	28.5	Very low	27.4	Very low	249 Å²	249	130 Å²	130	94%	0.94	79%	0.787	S	S	*	*				-175.9	173.8	112.6	-98.7	169.7	-178.5	-164	-0.2	112.4
1125	N	25.8	Very low	27.6	Very low	145 Å²	145	128.4 Å²	128.4	78%	0.775	78%	0.782	S	S	*	*			trans	-101.7	147.9	-165.7	-63.8	-36.8	0	0	0	113.8
1126	L	25	Very low	27.6	Very low	162 Å²	162	130.5 Å²	130.5	85%	0.848	77%	0.774	S	S	*	*			trans	63.7	163.6	142.8	-73	165.7	0	0	0	118.6
1127	P	36.5	Very low	27.8	Very low	101 Å²	101	132.2 Å²	132.2	66%	0.656	77%	0.77	S	S	*	*			cis	-134.6	-167.4	-22.7	36.4	-17.4	0	0	0	114
1128	L	25.9	Very low	27.8	Very low	174 Å²	174	132.4 Å²	132.4	91%	0.911	77%	0.772	S	S	*	*			trans	84.7	167.4	156.2	-70.6	172.7	0	0	0	119.6
1129	N	25.5	Very low	27.7	Very low	143 Å²	143	130.3 Å²	130.3	77%	0.765	77%	0.774	S	S	*	*			trans	-139.3	144.1	-152.6	171.1	26.4	0	0	0	108.5
1130	I	28.4	Very low	28.1	Very low	160 Å²	160	129.8 Å²	129.8	82%	0.821	78%	0.78	S	S	*	*			trans	-176.8	148.2	150.2	-101.8	155.6	0	0	0	111.1
1131	S	26	Very low	28.1	Very low	107 Å²	107	128.7 Å²	128.7	75%	0.748	78%	0.782	S	S	*	*			trans	-78.8	174.6	171.9	57.2	0	0	0	0	111.4
1132	A	27.9	Very low	28.1	Very low	84 Å²	84	129.1 Å²	129.1	69%	0.694	78%	0.783	S	S	*	*			cis	-152.3	-156.6	16.2	0	0	0	0	0	107.1
1133	I	27.6	Very low	28.2	Very low	154 Å²	154	132.1 Å²	132.1	79%	0.79	79%	0.789	S	S	*	*			cis	-154	170.4	3.5	-155.6	161.6	0	0	0	109.3
1134	G	29.2	Very low	28.4	Very low	78 Å²	78	131.3 Å²	131.3	80%	0.804	78%	0.784	S	S	*	*			trans	-176.1	81.3	173	0	0	0	0	0	112
1135	S	29.3	Very low	28.5	Very low	100 Å²	100	125.2 Å²	125.2	70%	0.699	78%	0.78	S	S	*	*			trans	-102.5	147.9	-171.2	-49.4	0	0	0	0	112.7
1136	D	30.6	Very low	28.7	Very low	123 Å²	123	122.1 Å²	122.1	66%	0.658	78%	0.781	S	S	*	*			trans	-154.6	145.5	141.8	-141.4	-11.6	0	0	0	114.8
1137	K	32.8	Very low	28.9	Very low	181 Å²	181	118 Å²	118	79%	0.787	78%	0.778	S	S	*	*			trans	32.4	131.2	164.9	-70.1	136.8	-163.7	153.7	0	122.9
1138	G	28.1	Very low	28.7	Very low	85 Å²	85	120.1 Å²	120.1	88%	0.876	79%	0.789	S	S	*	*			trans	147.9	84.6	132.6	0	0	0	0	0	119.5
1139	A	25	Very low	29	Very low	99 Å²	99	115.4 Å²	115.4	82%	0.818	78%	0.783	S	S	*	*			trans	-122.5	171.2	157.4	0	0	0	0	0	107.7
1140	P	35	Very low	29.2	Very low	133 Å²	133	114.4 Å²	114.4	86%	0.864	79%	0.787	S	S	*	*			cis	-139.2	-147.8	19.9	43.4	-21.6	0	0	0	114.4
1141	A	25.4	Very low	29.2	Very low	88 Å²	88	113.6 Å²	113.6	73%	0.727	79%	0.79	S	S	*	*			trans	-100.6	164	-173.5	0	0	0	0	0	114.7
1142	M	27.4	Very low	29.5	Very low	168 Å²	168	113.5 Å²	113.5	83%	0.828	80%	0.795	S	S	*	*				176.2	129.4	123.5	-95	-171.4	75.4	0	0	115.9
1143	V	26.4	Very low	29.5	Very low	120 Å²	120	119 Å²	119	73%	0.727	80%	0.803	S	S	*	*				39.4	120.2	129.2	-174.4	0	0	0	0	122.5
1144	S	30.5	Very low	29.6	Very low	104 Å²	104	118.9 Å²	118.9	73%	0.727	80%	0.803	S	S	*	*				177.3	110.7	128.6	28.8	0	0	0	0	109.9
1145	S	30	Very low	29.4	Very low	121 Å²	121	122 Å²	122	85%	0.846	80%	0.802	S	S	*	*				69	124.9	91.4	71.2	0	0	0	0	116
1146	G	30.4	Very low	29.3	Very low	79 Å²	79	121.1 Å²	121.1	81%	0.814	80%	0.801	S	S	*	*			cis	169.6	-173.4	-4.1	0	0	0	0	0	114.5
1147	G	28.9	Very low	29.3	Very low	75 Å²	75	124.2 Å²	124.2	77%	0.773	81%	0.809	S	S	*	*			trans	92.1	143	165.9	0	0	0	0	0	116.3
1148	V	33.2	Very low	29.1	Very low	146 Å²	146	126 Å²	126	89%	0.885	81%	0.811	S	S	*	*			cis	-146.8	133.4	3.6	174.7	0	0	0	0	110.8
1149	G	31	Very low	29.1	Very low	76 Å²	76	127 Å²	127	78%	0.784	81%	0.81	S	S	*	*			trans	72.3	147.6	160.3	0	0	0	0	0	117.5
1150	S	30.5	Very low	29.5	Very low	122 Å²	122	126.8 Å²	126.8	85%	0.853	80%	0.801	S	S	*	*			cis	-155.8	149.8	-13.6	-170.3	0	0	0	0	109.1
1151	T	26.9	Very low	29.7	Very low	143 Å²	143	125.9 Å²	125.9	88%	0.877	80%	0.795	S	S	*	*			trans	-139.6	139.2	177.9	52.9	0	0	0	0	112.3
1152	A	33.7	Very low	29.8	Very low	105 Å²	105	130 Å²	130	87%	0.868	80%	0.801	S	S	*	*			trans	-150.6	139.6	167.1	0	0	0	0	0	110
1153	K	28.4	Very low	30.1	Very low	198 Å²	198	127.6 Å²	127.6	86%	0.861	80%	0.798	S	S	*	*			trans	-108	136.1	165.2	-69.4	176.5	176.8	176.2	0	107.9
1154	L	28.2	Very low	30.2	Very low	152 Å²	152	127.6 Å²	127.6	80%	0.796	80%	0.798	S	S	*	*				159.3	140.7	129.4	-87.5	158.2	0	0	0	112.8
1155	N	26.6	Very low	30.2	Very low	143 Å²	143	132.6 Å²	132.6	77%	0.765	81%	0.807	S	S	*	*			trans	66.4	138.7	148.8	-63.8	-14	0	0	0	122.7
1156	A	26.6	Very low	30.2	Very low	83 Å²	83	134 Å²	134	69%	0.686	81%	0.805	S	S	*	*			trans	83.4	155.4	148.7	0	0	0	0	0	120.2
1157	F	30	Very low	30	Very low	187 Å²	187	141.3 Å²	141.3	82%	0.82	81%	0.81	S	S	*	*			trans	64.1	104.5	-179.9	-60.2	-81.8	0	0	0	116
1158	R	28.7	Very low	30	Very low	219 Å²	219	146 Å²	146	83%	0.826	81%	0.809	S	S	*	*			cis	76.5	99.7	34.3	-162	-168.6	-173.9	-177.6	3.4	113.3
1159	A	28	Very low	29.9	Very low	105 Å²	105	146.4 Å²	146.4	87%	0.868	80%	0.801	S	S	*	*			trans	-109.3	120.2	169.1	0	0	0	0	0	111.3
1160	P	34.3	Very low	29.8	Very low	96 Å²	96	153.4 Å²	153.4	62%	0.623	80%	0.804	S	S	*	*			trans	-134	177.5	166.8	40.9	-27.8	0	0	0	112.4
1161	P	37.7	Very low	29.8	Very low	114 Å²	114	151.4 Å²	151.4	74%	0.74	79%	0.79	S	S	*	*			cis	-133.5	176.1	-43.6	38.2	-23.4	0	0	0	112.5
1162	M	28.1	Very low	29.9	Very low	173 Å²	173	149.1 Å²	149.1	85%	0.852	78%	0.78	S	S	*	*	S	Bend	trans	-122.9	157.5	154.7	-84.2	-66.6	-82.3	0	0	109.3
1163	P	33.4	Very low	29.7	Very low	119 Å²	119	150.8 Å²	150.8	77%	0.773	77%	0.774	S	S	*	*			trans	-83.1	155.2	-141.1	29.8	-37	0	0	0	116.5
1164	T	28.4	Very low	29.6	Very low	119 Å²	119	147 Å²	147	73%	0.73	77%	0.768	S	S	*	*			trans	-94.2	146.1	-177.6	48.9	0	0	0	0	113.6
1165	K	32.2	Very low	29.4	Very low	210 Å²	210	144.8 Å²	144.8	91%	0.913	77%	0.765	S	S	*	*			trans	-135.6	146.2	140.8	-78.1	-163.7	175.8	179	0	109.5
1166	N	29.4	Very low	29.3	Very low	149 Å²	149	146 Å²	146	80%	0.797	77%	0.768	S	S	*	*			trans	-85.2	149.3	-158.6	-57.6	-45.7	0	0	0	114.2
1167	Y	25.4	Very low	29.4	Very low	234 Å²	234	148.9 Å²	148.9	92%	0.918	78%	0.777	S	S	*	*			trans	-109	155.4	149.9	-105.1	-92.3	0	0	0	109.5
1168	K	29.7	Very low	29.1	Very low	173 Å²	173	145.7 Å²	145.7	75%	0.752	77%	0.772	S	S	*	*			trans	-147.9	112.6	-180	-124.7	-166.4	175.8	-173.8	0	112
1169	H	31.1	Very low	28.8	Very low	155 Å²	155	142.3 Å²	142.3	72%	0.718	77%	0.77	S	S	*	*			trans	59.7	168.3	167.6	-52.2	-73.2	0	0	0	115.7
1170	R	27.8	Very low	28.6	Very low	222 Å²	222	144.7 Å²	144.7	84%	0.838	76%	0.761	S	S	*	*			cis	-163.3	161.1	-36.8	-107.1	-162.7	159.2	171.4	-6	105.6
1171	S	30.3	Very low	28	Very low	81 Å²	81	147.2 Å²	147.2	57%	0.566	76%	0.764	S	S	*	*			cis	-178.3	168.4	-31.3	51.1	0	0	0	0	107.8
1172	S	30.2	Very low	27.8	Very low	95 Å²	95	146.9 Å²	146.9	66%	0.664	76%	0.762	S	S	*	*			trans	61	140.7	158.6	50.3	0	0	0	0	118.9
1173	D	28.6	Very low	27.6	Very low	140 Å²	140	145.3 Å²	145.3	75%	0.749	76%	0.762	S	S	*	*			cis	-168.5	158.9	-14.9	-113.4	-56.1	0	0	0	111
1174	T	27.5	Very low	27.3	Very low	118 Å²	118	145.3 Å²	145.3	72%	0.724	77%	0.765	S	S	*	*			trans	32.3	135.2	133.1	-55.1	0	0	0	0	120.5
1175	S	24.2	Very low	27.4	Very low	105 Å²	105	143.7 Å²	143.7	73%	0.734	76%	0.758	S	S	*	*			cis	-172.2	-177.5	-7.7	58.9	0	0	0	0	112.4
1176	M	24.9	Very low	27.2	Very low	170 Å²	170	141.3 Å²	141.3	84%	0.837	75%	0.751	S	S	*	*			trans	-30.9	152.8	176.7	-47.5	-175.1	-61.1	0	0	120.4
1177	V	27.1	Very low	27.1	Very low	143 Å²	143	140.8 Å²	140.8	87%	0.867	74%	0.743	S	S	*	*				-179.3	166.5	122.6	144.3	0	0	0	0	112.5
1178	T	24.1	Very low	27.3	Very low	119 Å²	119	135.4 Å²	135.4	73%	0.73	73%	0.73	S	S	*	*			trans	-101.4	162.8	-169.8	-11.3	0	0	0	0	115.5
1179	L	23.3	Very low	27.2	Very low	148 Å²	148	134.2 Å²	134.2	78%	0.775	73%	0.729	S	S	*	*			trans	77.8	124.2	154.2	-68.9	166	0	0	0	122
1180	K	22.2	Very low	27	Very low	156 Å²	156	132.9 Å²	132.9	68%	0.678	73%	0.727	S	S	*	*			trans	52.9	121.7	139.3	-80.7	177.2	158.1	-89.4	0	123
1181	E	21.7	Very low	27	Very low	148 Å²	148	128.1 Å²	128.1	69%	0.692	72%	0.718	S	S	*	*			trans	70	166.9	134	-73.2	162.4	-139.6	0	0	119.4
1182	P	34.1	Very low	27	Very low	107 Å²	107	130.6 Å²	130.6	70%	0.695	72%	0.724	S	S	*	*			cis	-138.7	159.2	-44	38.6	-23.1	0	0	0	116.7
1183	V	24.6	Very low	26.8	Very low	141 Å²	141	130.3 Å²	130.3	86%	0.855	72%	0.721	S	S	*	*			trans	16	125.1	140.1	-171.9	0	0	0	0	121.7
1184	S	26.8	Very low	26.8	Very low	118 Å²	118	130.3 Å²	130.3	83%	0.825	72%	0.721	S	S	*	*				-159.5	156.6	128.3	61.8	0	0	0	0	108.9
1185	S	29.6	Very low	26.9	Very low	86 Å²	86	129.3 Å²	129.3	60%	0.601	72%	0.719	S	S	*	*			cis	-144.3	135.6	20	56.4	0	0	0	0	114.6
1186	Q	29.6	Very low	27.1	Very low	160 Å²	160	131.7 Å²	131.7	75%	0.748	72%	0.724	S	S	*	*			trans	61.4	142.1	130.2	-64.4	169.2	-81.1	0	0	120.4
1187	Q	27.2	Very low	27.3	Very low	137 Å²	137	127.2 Å²	127.2	64%	0.64	71%	0.714	S	S	*	*			cis	-157.8	175.6	2.7	-135.2	172.6	-98.5	0	0	114.8
1188	D	28.1	Very low	27.2	Very low	121 Å²	121	124.9 Å²	124.9	65%	0.647	70%	0.704	S	S	*	*			trans	88.7	100.1	148.9	-66.2	-19	0	0	0	122.9
1189	M	28.1	Very low	27.3	Very low	149 Å²	149	126.6 Å²	126.6	73%	0.734	70%	0.701	S	S	*	*				91.7	105.8	118.8	-67.9	-117.9	-63.3	0	0	121.8
1190	L	27.6	Very low	27.4	Very low	127 Å²	127	125.3 Å²	125.3	67%	0.665	69%	0.691	S	S	*	*				82	132.4	125.4	-66	-175.4	0	0	0	122.5
1191	N	27.5	Very low	27.6	Very low	121 Å²	121	123.6 Å²	123.6	65%	0.647	69%	0.694	S	S	*	*			trans	91.6	118.4	131.6	-77.7	-1.8	0	0	0	122.8
1192	I	29.2	Very low	27.9	Very low	134 Å²	134	124.1 Å²	124.1	69%	0.687	70%	0.7	S	S	*	*				82.6	96.5	121.8	-66.2	173.3	0	0	0	118.6
1193	S	26.9	Very low	27.6	Very low	88 Å²	88	123.3 Å²	123.3	62%	0.615	70%	0.697	S	S	*	*				84.7	143.1	119.7	81.2	0	0	0	0	123.6
1194	D	28.5	Very low	27.7	Very low	141 Å²	141	124.4 Å²	124.4	75%	0.754	70%	0.697	S	S	*	*			trans	79.1	99.8	133.9	-65.7	2.7	0	0	0	124
1195	S	29.5	Very low	27.8	Very low	96 Å²	96	122.3 Å²	122.3	67%	0.671	69%	0.687	S	S	*	*				99.7	134.2	107.7	77.5	0	0	0	0	121.3
1196	D	27.9	Very low	27.8	Very low	156 Å²	156	124.2 Å²	124.2	83%	0.834	69%	0.69	S	S	*	*				55.7	154.2	129.7	-68.4	2	0	0	0	123.4
1197	A	28.8	Very low	27.8	Very low	76 Å²	76	121.8 Å²	121.8	63%	0.628	69%	0.686	S	S	*	*			cis	-164	135.9	-26.2	0	0	0	0	0	112.4
1198	S	25	Very low	27.9	Very low	94 Å²	94	122.2 Å²	122.2	66%	0.657	69%	0.693	S	S	*	*			trans	42.4	137.4	139.8	92.2	0	0	0	0	124.2
1199	K	27.3	Very low	28	Very low	155 Å²	155	121.6 Å²	121.6	67%	0.674	70%	0.698	S	S	*	*			trans	98.8	120.8	137.7	-74.3	166.1	-175.8	141.3	0	123.3
1200	E	25.8	Very low	27.8	Very low	120 Å²	120	119.1 Å²	119.1	56%	0.561	70%	0.702	S	S	*	*				69.5	89.6	125	-62.6	-179.9	116.4	0	0	122.8
1201	T	25.7	Very low	27.7	Very low	120 Å²	120	123.4 Å²	123.4	74%	0.736	71%	0.709	S	S	*	*				58.8	144.2	116.4	-22.6	0	0	0	0	122.6
1202	I	28.8	Very low	28	Very low	159 Å²	159	123.3 Å²	123.3	82%	0.815	72%	0.715	S	S	*	*			trans	80.6	127.7	163.9	-51.8	-173.7	0	0	0	113.8
1203	S	27	Very low	27.8	Very low	91 Å²	91	123.9 Å²	123.9	64%	0.636	72%	0.718	S	S	*	*			cis	-158.9	152.7	7.5	44.8	0	0	0	0	112.5
1204	L	26.3	Very low	27.7	Very low	163 Å²	163	125.1 Å²	125.1	85%	0.853	73%	0.727	S	S	*	*			trans	44.6	145.5	143.3	-75	91.2	0	0	0	120.5
1205	A	29.5	Very low	28	Very low	74 Å²	74	123.9 Å²	123.9	61%	0.612	73%	0.727	S	S	*	*			cis	-144.7	156.3	24.2	0	0	0	0	0	114.1
1206	D	29.8	Very low	27.7	Very low	127 Å²	127	125.2 Å²	125.2	68%	0.679	74%	0.735	S	S	*	*			trans	51.3	116.5	146.9	-53.5	-28.4	0	0	0	120
1207	T	29.1	Very low	27.6	Very low	109 Å²	109	124 Å²	124	67%	0.669	74%	0.739	S	S	*	*				62.9	138.3	57.4	81	0	0	0	0	112.8
1208	N	30.5	Very low	27.5	Very low	145 Å²	145	124.3 Å²	124.3	78%	0.775	75%	0.749	S	S	*	*			cis	-162	167.1	-4.8	-107.8	-14.9	0	0	0	107
1209	S	29.4	Very low	27.6	Very low	108 Å²	108	124.6 Å²	124.6	76%	0.755	76%	0.757	S	S	*	*			cis	-164.1	161.4	-17.9	52.2	0	0	0	0	108.1
1210	A	24.8	Very low	27.5	Very low	98 Å²	98	127 Å²	127	81%	0.81	77%	0.768	S	S	*	*			trans	-122.6	152.9	171.6	0	0	0	0	0	111.7
1211	R	24.1	Very low	27.5	Very low	217 Å²	217	132 Å²	132	82%	0.819	78%	0.783	S	S	*	*			trans	-58.9	157	162.3	-103.3	-178	172.9	-165.7	-0.7	110
1212	P	33.3	Very low	27.4	Very low	118 Å²	118	138.3 Å²	138.3	77%	0.766	79%	0.794	S	S	*	*			cis	-148	166.8	49.1	40.1	-19.6	0	0	0	119.9
1213	L	25.8	Very low	27.3	Very low	146 Å²	146	136.8 Å²	136.8	76%	0.764	80%	0.797	S	S	*	*			trans	1.9	139.2	151.6	-58.6	167.7	0	0	0	121
1214	S	25.8	Very low	27.2	Very low	114 Å²	114	137.8 Å²	137.8	80%	0.797	80%	0.804	S	S	*	*			trans	-131.8	163.3	158.1	62.1	0	0	0	0	111.1
1215	P	33.2	Very low	27.3	Very low	115 Å²	115	141 Å²	141	75%	0.747	81%	0.805	S	S	*	*			trans	-113.7	166.8	-171.1	41.2	-33.7	0	0	0	116.2
1216	C	23.9	Very low	27.2	Very low	124 Å²	124	147.1 Å²	147.1	84%	0.838	82%	0.818	S	S	*	*			trans	65.8	106.1	155.1	-66.1	0	0	0	0	121.2
1217	S	25.4	Very low	27	Very low	131 Å²	131	145.2 Å²	145.2	92%	0.916	82%	0.82	S	S	*	*				-172.4	170.9	116	42.5	0	0	0	0	110.7
1218	G	26.6	Very low	26.9	Very low	82 Å²	82	147.9 Å²	147.9	85%	0.845	83%	0.83	S	S	*	*			trans	-106.4	135	-160.5	0	0	0	0	0	116.4
1219	A	27.5	Very low	26.8	Very low	101 Å²	101	145.3 Å²	145.3	84%	0.835	82%	0.819	S	S	*	*			trans	-155	69.3	165.1	0	0	0	0	0	111.5
1220	K	24.8	Very low	26.7	Very low	206 Å²	206	145.5 Å²	145.5	90%	0.896	82%	0.818	S	S	*	*			trans	-116.9	78.8	179.2	-78.2	-166.6	175.5	-174.9	0	112.9
1221	Y	25.7	Very low	26.7	Very low	223 Å²	223	146.7 Å²	146.7	88%	0.875	82%	0.82	S	S	*	*	S	Bend	trans	-151.4	12.6	158	-116.5	-73.7	0	0	0	115.2
1222	W	24.8	Very low	27	Very low	254 Å²	254	142.1 Å²	142.1	96%	0.962	82%	0.817	S	S	*	*	S	Bend	trans	-135.4	50.8	-178.3	-83.9	71	0	0	0	112.4
1223	S	26.2	Very low	26.8	Very low	127 Å²	127	142.4 Å²	142.4	89%	0.888	82%	0.822	S	S	*	*			trans	-153.7	59.9	176.7	-83.1	0	0	0	0	113.2
1224	S	25.6	Very low	27.4	Very low	112 Å²	112	140.7 Å²	140.7	78%	0.783	82%	0.818	S	S	*	*	S	Bend	trans	-151.5	23.7	178.4	55.6	0	0	0	0	115.4
1225	R	28	Very low	28.1	Very low	231 Å²	231	139.4 Å²	139.4	87%	0.872	80%	0.802	S	S	*	*	S	Bend	trans	-138.3	17.9	174.6	-74.3	-162.4	178.8	-160.2	1.3	115.1
1226	F	26.6	Very low	28.5	Very low	201 Å²	201	139.7 Å²	139.7	88%	0.882	80%	0.796	S	S	*	*			trans	-129.3	44.2	174.8	-71.7	-68.6	0	0	0	111.7
1227	A	26.4	Very low	29.6	Very low	88 Å²	88	139.4 Å²	139.4	73%	0.727	79%	0.791	S	S	*	*			trans	-116	92.3	161.5	0	0	0	0	0	106.1
1228	D	27.4	Very low	30.6	Very low	164 Å²	164	140.1 Å²	140.1	88%	0.877	78%	0.777	S	S	*	*			trans	151.3	73.9	166	-80.5	-14.4	0	0	0	109.7
1229	V	26.8	Very low	31.6	Very low	91 Å²	91	137.8 Å²	137.8	55%	0.552	75%	0.748	S	S	*	*			trans	-137.2	124.4	167.4	-177.9	0	0	0	0	108	M1256	V1229-M1256 HydrophobicContact CG1-CE 3.98Å
1230	P	27.5	Very low	33.2	Very low	112 Å²	112	138.3 Å²	138.3	73%	0.727	75%	0.746	S	S	*	*			trans	-64.3	146	178.5	-23.1	34.4	0	0	0	113.2	T1232	P1230-T1232 PolarHBondContact O-N 3.16Å; P1230-T1232 VanDerWaalsContact O-N 3.08Å
1231	S	26	Very low	35.1	Very low	123 Å²	123	130.9 Å²	130.9	86%	0.86	72%	0.719	S	S	*	*			trans	-78.3	88.5	-178.9	56.6	0	0	0	0	112.8
1232	T	30.3	Very low	36.5	Very low	121 Å²	121	127.3 Å²	127.3	74%	0.742	71%	0.714	S	S	*	*			trans	-94.5	105.9	165	52.4	0	0	0	0	110.3	P1230 T1234	P1230-T1232 PolarHBondContact O-N 3.16Å; P1230-T1232 VanDerWaalsContact O-N 3.08Å; T1232-T1234 PolarHBondContact O-N 3.39Å
1233	S	29.4	Very low	38.4	Very low	125 Å²	125	120 Å²	120	87%	0.874	70%	0.697	S	S	*	*			trans	-79.7	94.2	-176.1	56.8	0	0	0	0	112.9
1234	T	37.9	Very low	40.1	Very low	110 Å²	110	116.3 Å²	116.3	68%	0.675	67%	0.668	S	S	*	*			trans	-91.7	115.1	162.5	50	0	0	0	0	110.3	T1232 L1236	T1232-T1234 PolarHBondContact O-N 3.39Å; T1234-L1236 PolarHBondContact O-N 3.39Å
1235	D	40	Very low	42.1	Very low	86 Å²	86	114.4 Å²	114.4	46%	0.46	65%	0.649	S	S	.	*			trans	-70.4	94.3	-173.9	-177.9	10.3	0	0	0	112.1	T1237 K1238	D1235-T1237 PolarHBondContact O-N 3.41Å; D1235-T1237 VanDerWaalsContact O-N 3.07Å; D1235-T1237 WeakPolarHBondContact OD1-CB 3.34Å; D1235-T1237 WeakPolarHBondContact OD1-CG2 3.49Å; D1235-T1237 PolarHBondContact OD1-N 3.38Å; D1235-T1237 PolarHBondContact OD1-OG1 3.17Å; D1235-T1237 PolarHBondContact OD2-OG1 3.25Å; D1235-K1238 WeakPolarHBondContact OD2-CE 3.43Å; D1235-K1238 IonicContact OD2-NZ 3.82Å; D1235-K1238 PolarHBondContact OD2-NZ 2.72Å
1236	L	41.9	Very low	43.4	Very low	122 Å²	122	105.9 Å²	105.9	64%	0.639	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-64	-9.5	-176.4	-77.5	159.3	0	0	0	114.3	T1234 K1238 L1245	T1234-L1236 PolarHBondContact O-N 3.39Å; L1236-K1238 VanDerWaalsContact C-N 3.25Å; L1236-K1238 PolarHBondContact O-N 3.36Å; L1236-L1245 HydrophobicContact CD2-CD1 3.76Å
1237	T	47.1	Very low	45.5	Very low	117 Å²	117	99.5 Å²	99.5	72%	0.718	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-74	-6.8	-174.9	66.5	0	0	0	0	115	D1235	D1235-T1237 PolarHBondContact O-N 3.41Å; D1235-T1237 VanDerWaalsContact O-N 3.07Å; D1235-T1237 WeakPolarHBondContact OD1-CB 3.34Å; D1235-T1237 WeakPolarHBondContact OD1-CG2 3.49Å; D1235-T1237 PolarHBondContact OD1-N 3.38Å; D1235-T1237 PolarHBondContact OD1-OG1 3.17Å; D1235-T1237 PolarHBondContact OD2-OG1 3.25Å
1238	K	46.4	Very low	47	Very low	146 Å²	146	101.1 Å²	101.1	64%	0.635	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-112.4	32.8	-170.5	-67.3	174.5	-178.6	146.4	0	114.9	D1235 L1236 R1248	D1235-K1238 WeakPolarHBondContact OD2-CE 3.43Å; D1235-K1238 IonicContact OD2-NZ 3.82Å; D1235-K1238 PolarHBondContact OD2-NZ 2.72Å; L1236-K1238 VanDerWaalsContact C-N 3.25Å; L1236-K1238 PolarHBondContact O-N 3.36Å; K1238-R1248 PolarHBondContact O-NH1 2.97Å
1239	C	46.3	Very low	48.5	Very low	34 Å²	34	96 Å²	96	23%	0.23	57%	0.573	C	S	.	*			trans	-98.2	123.8	176.1	-56.7	0	0	0	0	109.6	D1244 L1245 R1248	C1239-D1244 HydrophobicContact CB-CB 3.86Å; C1239-L1245 HydrophobicContact CB-CB 4.12Å; C1239-R1248 PolarHBondContact SG-NH1 2.83Å
1240	S	61.2	Low	50.2	Low	112 Å²	112	96 Å²	96	78%	0.783	57%	0.569	S	S	*	*	S	Bend	trans	-81.7	-17.4	-175.6	73.9	0	0	0	0	113.7	D1244	S1240-D1244 WeakPolarHBondContact CA-OD2 3.13Å; S1240-D1244 WeakPolarHBondContact CB-OD2 3.3Å; S1240-D1244 PolarHBondContact N-OD2 2.94Å; S1240-D1244 PolarHBondContact OG-OD2 2.98Å
1241	S	65.6	Low	51.5	Low	49 Å²	49	95.2 Å²	95.2	34%	0.343	56%	0.556	S	S	.	*	S	Bend	trans	-146.3	168.3	177.7	74.4	0	0	0	0	111.7	V1243 D1244 L1245	S1241-V1243 PolarHBondContact O-N 2.99Å; S1241-V1243 PolarHBondContact OG-N 3.13Å; S1241-V1243 VanDerWaalsContact OG-N 3.15Å; S1241-D1244 PolarHBondContact O-N 3.08Å; S1241-D1244 PolarHBondContact OG-N 3.02Å; S1241-D1244 VanDerWaalsContact OG-N 3.07Å; S1241-D1244 PolarHBondContact OG-OD1 3.22Å; S1241-L1245 PolarHBondContact O-N 2.86Å
1242	L	56	Low	52.9	Low	148 Å²	148	91 Å²	91	78%	0.775	53%	0.531	S	S	*	.	H	α-helix	trans	-61	-26.2	167.6	-88.7	167.6	0	0	0	112.6	L1245 A1246	L1242-L1245 HydrophobicContact CD2-CD2 4.39Å; L1242-A1246 WeakPolarHBondContact O-CB 3.42Å; L1242-A1246 PolarHBondContact O-N 3.22Å
1243	V	64.6	Low	53.8	Low	100 Å²	100	88.6 Å²	88.6	61%	0.606	52%	0.516	S	S	*	.	H	α-helix	trans	-73.4	-40.6	178.1	-173.9	0	0	0	0	110.6	S1241 L1245 A1246 T1247	S1241-V1243 PolarHBondContact O-N 2.99Å; S1241-V1243 PolarHBondContact OG-N 3.13Å; S1241-V1243 VanDerWaalsContact OG-N 3.15Å; V1243-L1245 VanDerWaalsContact C-N 3.3Å; V1243-L1245 PolarHBondContact O-N 3.1Å; V1243-A1246 PolarHBondContact O-N 3.09Å; V1243-T1247 VanDerWaalsContact O-CB 3.31Å; V1243-T1247 WeakPolarHBondContact O-CB 3.46Å; V1243-T1247 PolarHBondContact O-N 3.25Å; V1243-T1247 PolarHBondContact O-OG1 2.66Å
1244	D	60.3	Low	54.7	Low	51 Å²	51	84 Å²	84	27%	0.273	48%	0.483	S	S	.	.	H	α-helix	trans	-58.7	-44.5	172.4	-68.1	8.6	0	0	0	111.1	C1239 S1240 S1241 T1247 R1248	C1239-D1244 HydrophobicContact CB-CB 3.86Å; S1240-D1244 WeakPolarHBondContact CA-OD2 3.13Å; S1240-D1244 WeakPolarHBondContact CB-OD2 3.3Å; S1240-D1244 PolarHBondContact N-OD2 2.94Å; S1240-D1244 PolarHBondContact OG-OD2 2.98Å; S1241-D1244 PolarHBondContact O-N 3.08Å; S1241-D1244 PolarHBondContact OG-N 3.02Å; S1241-D1244 VanDerWaalsContact OG-N 3.07Å; S1241-D1244 PolarHBondContact OG-OD1 3.22Å; D1244-T1247 PolarHBondContact O-N 3.08Å; D1244-R1248 WeakPolarHBondContact O-CB 3.28Å; D1244-R1248 PolarHBondContact O-N 3.05Å
1245	L	68.5	Low	55.2	Low	71 Å²	71	85.7 Å²	85.7	37%	0.372	48%	0.483	S	S	.	.	H	α-helix	trans	-64.7	-45.5	-178.8	-176	65	0	0	0	111.3	L1236 C1239 S1241 L1242 V1243 A1249	L1236-L1245 HydrophobicContact CD2-CD1 3.76Å; C1239-L1245 HydrophobicContact CB-CB 4.12Å; S1241-L1245 PolarHBondContact O-N 2.86Å; L1242-L1245 HydrophobicContact CD2-CD2 4.39Å; V1243-L1245 VanDerWaalsContact C-N 3.3Å; V1243-L1245 PolarHBondContact O-N 3.1Å; L1245-A1249 WeakPolarHBondContact O-CB 3.4Å; L1245-A1249 PolarHBondContact O-N 3.39Å
1246	A	56.2	Low	55.4	Low	52 Å²	52	87 Å²	87	43%	0.43	49%	0.488	S	S	.	.	H	α-helix	trans	-63.4	-42.7	175	0	0	0	0	0	112	L1242 V1243 A1249 I1250	L1242-A1246 WeakPolarHBondContact O-CB 3.42Å; L1242-A1246 PolarHBondContact O-N 3.22Å; V1243-A1246 PolarHBondContact O-N 3.09Å; A1246-A1249 PolarHBondContact O-N 3.41Å; A1246-I1250 WeakPolarHBondContact O-CD1 3.34Å; A1246-I1250 VanDerWaalsContact O-CG1 3.3Å; A1246-I1250 WeakPolarHBondContact O-CG1 3.48Å; A1246-I1250 PolarHBondContact O-N 3.12Å
1247	T	69.2	Low	55.6	Low	68 Å²	68	81.8 Å²	81.8	42%	0.417	46%	0.462	S	S	.	.	H	α-helix	trans	-63.4	-49.7	-180	-57.7	0	0	0	0	110.9	V1243 D1244 A1249 I1250 E1251	V1243-T1247 VanDerWaalsContact O-CB 3.31Å; V1243-T1247 WeakPolarHBondContact O-CB 3.46Å; V1243-T1247 PolarHBondContact O-N 3.25Å; V1243-T1247 PolarHBondContact O-OG1 2.66Å; D1244-T1247 PolarHBondContact O-N 3.08Å; T1247-A1249 VanDerWaalsContact C-N 3.32Å; T1247-A1249 PolarHBondContact O-N 3.46Å; T1247-I1250 WeakPolarHBondContact O-CB 3.25Å; T1247-I1250 PolarHBondContact O-N 3.11Å; T1247-I1250 VanDerWaalsContact O-N 3.14Å; T1247-E1251 WeakPolarHBondContact O-CG 3.31Å; T1247-E1251 PolarHBondContact O-N 3.17Å
1248	R	58.8	Low	55.7	Low	122 Å²	122	81.1 Å²	81.1	46%	0.46	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-33.2	177.2	-74.9	-177.3	177	150.6	2.2	113.3	K1238 C1239 D1244 E1251 G1252	K1238-R1248 PolarHBondContact O-NH1 2.97Å; C1239-R1248 PolarHBondContact SG-NH1 2.83Å; D1244-R1248 WeakPolarHBondContact O-CB 3.28Å; D1244-R1248 PolarHBondContact O-N 3.05Å; R1248-E1251 PolarHBondContact O-N 3.02Å; R1248-G1252 PolarHBondContact O-N 2.95Å
1249	A	58.2	Low	55.7	Low	57 Å²	57	78.6 Å²	78.6	47%	0.471	46%	0.459	S	S	.	.	H	α-helix	trans	-63.8	-41.9	172.8	0	0	0	0	0	111.7	L1245 A1246 T1247 G1252 V1253	L1245-A1249 WeakPolarHBondContact O-CB 3.4Å; L1245-A1249 PolarHBondContact O-N 3.39Å; A1246-A1249 PolarHBondContact O-N 3.41Å; T1247-A1249 VanDerWaalsContact C-N 3.32Å; T1247-A1249 PolarHBondContact O-N 3.46Å; A1249-G1252 PolarHBondContact O-N 2.64Å; A1249-V1253 WeakPolarHBondContact O-CG2 3.47Å; A1249-V1253 PolarHBondContact O-N 3.24Å; A1249-V1253 VanDerWaalsContact O-N 3.1Å
1250	I	62.3	Low	55.5	Low	90 Å²	90	84 Å²	84	46%	0.462	48%	0.481	S	S	.	.	H	α-helix	trans	-65.8	-41.6	175.3	-67	163.1	0	0	0	111	A1246 T1247 V1253 T1254 L1273	A1246-I1250 WeakPolarHBondContact O-CD1 3.34Å; A1246-I1250 VanDerWaalsContact O-CG1 3.3Å; A1246-I1250 WeakPolarHBondContact O-CG1 3.48Å; A1246-I1250 PolarHBondContact O-N 3.12Å; T1247-I1250 WeakPolarHBondContact O-CB 3.25Å; T1247-I1250 PolarHBondContact O-N 3.11Å; T1247-I1250 VanDerWaalsContact O-N 3.14Å; I1250-V1253 PolarHBondContact O-N 3Å; I1250-T1254 WeakPolarHBondContact O-CB 3.09Å; I1250-T1254 PolarHBondContact O-N 3Å; I1250-T1254 PolarHBondContact O-OG1 2.72Å; I1250-L1273 HydrophobicContact CG2-CD2 4.38Å
1251	E	54.9	Low	54.2	Low	96 Å²	96	87.7 Å²	87.7	45%	0.449	49%	0.485	S	S	.	.	H	α-helix	trans	-64.7	-42.1	176.4	-70.1	-176.7	134.6	0	0	112.7	T1247 R1248 T1254 Q1255	T1247-E1251 WeakPolarHBondContact O-CG 3.31Å; T1247-E1251 PolarHBondContact O-N 3.17Å; R1248-E1251 PolarHBondContact O-N 3.02Å; E1251-T1254 WeakPolarHBondContact O-CA 3.24Å; E1251-T1254 VanDerWaalsContact O-CB 3.31Å; E1251-T1254 WeakPolarHBondContact O-CB 3.45Å; E1251-T1254 PolarHBondContact O-N 2.81Å; E1251-T1254 VanDerWaalsContact O-N 3.11Å; E1251-Q1255 PolarHBondContact O-N 3.1Å
1252	G	55	Low	52.9	Low	33 Å²	33	89 Å²	89	34%	0.34	51%	0.507	S	S	.	.	H	α-helix	trans	-61.2	-45.2	175.2	0	0	0	0	0	112.7	R1248 A1249 T1254 Q1255 M1256	R1248-G1252 PolarHBondContact O-N 2.95Å; A1249-G1252 PolarHBondContact O-N 2.64Å; G1252-T1254 VanDerWaalsContact C-N 3.26Å; G1252-T1254 PolarHBondContact O-N 3.43Å; G1252-Q1255 PolarHBondContact O-N 3.38Å; G1252-M1256 PolarHBondContact O-N 2.88Å; G1252-M1256 VanDerWaalsContact O-N 3.08Å
1253	V	50	Low	52	Low	72 Å²	72	84 Å²	84	44%	0.436	48%	0.484	S	S	.	.	H	α-helix	trans	-61.8	-35.2	172.9	171.9	0	0	0	0	111.5	A1249 I1250 M1256 A1257 Y1269	A1249-V1253 WeakPolarHBondContact O-CG2 3.47Å; A1249-V1253 PolarHBondContact O-N 3.24Å; A1249-V1253 VanDerWaalsContact O-N 3.1Å; I1250-V1253 PolarHBondContact O-N 3Å; V1253-M1256 PolarHBondContact O-N 2.99Å; V1253-A1257 PolarHBondContact O-N 2.97Å; V1253-A1257 VanDerWaalsContact O-N 3.13Å; V1253-Y1269 HydrophobicContact CG1-CE1 4.1Å
1254	T	48.8	Very low	51.1	Low	28 Å²	28	83.2 Å²	83.2	17%	0.172	48%	0.481	C	S	.	.	H	α-helix	trans	-65.4	-42.2	175.4	-53.5	0	0	0	0	111.6	I1250 E1251 G1252 A1257 V1258 L1273	I1250-T1254 WeakPolarHBondContact O-CB 3.09Å; I1250-T1254 PolarHBondContact O-N 3Å; I1250-T1254 PolarHBondContact O-OG1 2.72Å; E1251-T1254 WeakPolarHBondContact O-CA 3.24Å; E1251-T1254 VanDerWaalsContact O-CB 3.31Å; E1251-T1254 WeakPolarHBondContact O-CB 3.45Å; E1251-T1254 PolarHBondContact O-N 2.81Å; E1251-T1254 VanDerWaalsContact O-N 3.11Å; G1252-T1254 VanDerWaalsContact C-N 3.26Å; G1252-T1254 PolarHBondContact O-N 3.43Å; T1254-A1257 PolarHBondContact O-N 2.64Å; T1254-V1258 PolarHBondContact O-N 2.96Å; T1254-L1273 HydrophobicContact CG2-CD1 4.22Å; T1254-L1273 WeakPolarHBondContact OG1-CD2 3.11Å
1255	Q	47.5	Very low	50.1	Low	146 Å²	146	87.8 Å²	87.8	68%	0.682	50%	0.501	S	S	*	.	H	α-helix	trans	-66.5	-36.2	176.9	-70.9	-175.4	-5	0	0	112.7	E1251 G1252 A1257 V1258 S1259	E1251-Q1255 PolarHBondContact O-N 3.1Å; G1252-Q1255 PolarHBondContact O-N 3.38Å; Q1255-A1257 VanDerWaalsContact C-N 3.3Å; Q1255-A1257 PolarHBondContact O-N 2.77Å; Q1255-V1258 PolarHBondContact O-N 2.97Å; Q1255-S1259 PolarHBondContact O-OG 3.32Å
1256	M	44.7	Very low	48.7	Very low	114 Å²	114	86.4 Å²	86.4	56%	0.562	49%	0.494	S	S	*	.	H	α-helix	trans	-66.4	-29	172.7	-68.9	-168.4	74.4	0	0	113.2	V1229 G1252 V1253 S1259	V1229-M1256 HydrophobicContact CG1-CE 3.98Å; G1252-M1256 PolarHBondContact O-N 2.88Å; G1252-M1256 VanDerWaalsContact O-N 3.08Å; V1253-M1256 PolarHBondContact O-N 2.99Å; M1256-S1259 PolarHBondContact O-OG 3.08Å
1257	A	46.1	Very low	48.2	Very low	11 Å²	11	88.9 Å²	88.9	9%	0.091	50%	0.504	C	S	.	.	H	α-helix	trans	-73	-31.4	175.8	0	0	0	0	0	112.9	V1253 T1254 Q1255 S1259 L1266	V1253-A1257 PolarHBondContact O-N 2.97Å; V1253-A1257 VanDerWaalsContact O-N 3.13Å; T1254-A1257 PolarHBondContact O-N 2.64Å; Q1255-A1257 VanDerWaalsContact C-N 3.3Å; Q1255-A1257 PolarHBondContact O-N 2.77Å; A1257-S1259 VanDerWaalsContact C-N 3.3Å; A1257-S1259 PolarHBondContact O-N 2.93Å; A1257-L1266 HydrophobicContact CB-CD1 4.49Å; A1257-L1266 WeakPolarHBondContact O-CD1 3.27Å
1258	V	48.5	Very low	47	Very low	103 Å²	103	89.4 Å²	89.4	62%	0.624	51%	0.51	S	S	*	.	H	α-helix	trans	-72.2	-24	-179.2	174.4	0	0	0	0	112.6	T1254 Q1255	T1254-V1258 PolarHBondContact O-N 2.96Å; Q1255-V1258 PolarHBondContact O-N 2.97Å
1259	S	48	Very low	46.2	Very low	94 Å²	94	89.8 Å²	89.8	66%	0.657	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	2.2	-174.8	47.3	0	0	0	0	115.7	Q1255 M1256 A1257	Q1255-S1259 PolarHBondContact O-OG 3.32Å; M1256-S1259 PolarHBondContact O-OG 3.08Å; A1257-S1259 VanDerWaalsContact C-N 3.3Å; A1257-S1259 PolarHBondContact O-N 2.93Å
1260	Q	41	Very low	45.7	Very low	147 Å²	147	90.7 Å²	90.7	69%	0.687	51%	0.509	S	S	*	.			trans	-120	77.2	172	-67.9	-162.2	7	0	0	112.8	G1262 L1266	Q1260-G1262 PolarHBondContact O-N 3.13Å; Q1260-L1266 WeakPolarHBondContact O-CD2 3.45Å
1261	Q	34.5	Very low	45.1	Very low	189 Å²	189	92.1 Å²	92.1	88%	0.883	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	113.2	168.2	-67	-177	-11.9	0	0	110.2
1262	G	38.9	Very low	44.9	Very low	78 Å²	78	92 Å²	92	80%	0.804	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	159.4	-22.8	169.8	0	0	0	0	0	118.3	Q1260	Q1260-G1262 PolarHBondContact O-N 3.13Å
1263	S	37.2	Very low	44.8	Very low	42 Å²	42	91.5 Å²	91.5	29%	0.294	51%	0.512	S	S	.	.			trans	-97.3	138.5	-178.5	174.8	0	0	0	0	113.4	E1265 L1266	S1263-E1265 PolarHBondContact O-N 3.06Å; S1263-E1265 WeakPolarHBondContact OG-CB 3.4Å; S1263-E1265 WeakPolarHBondContact OG-CG 3.26Å; S1263-E1265 PolarHBondContact OG-N 3.35Å; S1263-E1265 PolarHBondContact OG-OE2 3.41Å; S1263-L1266 WeakPolarHBondContact O-CB 3.14Å; S1263-L1266 PolarHBondContact O-N 3.03Å; S1263-L1266 VanDerWaalsContact O-N 3.13Å
1264	P	45.7	Very low	45	Very low	84 Å²	84	93.4 Å²	93.4	55%	0.545	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.2	170.4	28.9	-35.9	0	0	0	113.5	L1266 T1267	P1264-L1266 PolarHBondContact O-N 3.15Å; P1264-T1267 PolarHBondContact O-N 3.38Å
1265	E	38.9	Very low	45.2	Very low	147 Å²	147	94.7 Å²	94.7	69%	0.687	53%	0.53	S	S	*	.	H	α-helix	trans	-66.2	-28	174.1	-59.4	157	132	0	0	111	S1263 T1267 S1268 Y1269	S1263-E1265 PolarHBondContact O-N 3.06Å; S1263-E1265 WeakPolarHBondContact OG-CB 3.4Å; S1263-E1265 WeakPolarHBondContact OG-CG 3.26Å; S1263-E1265 PolarHBondContact OG-N 3.35Å; S1263-E1265 PolarHBondContact OG-OE2 3.41Å; E1265-T1267 VanDerWaalsContact C-N 3.33Å; E1265-T1267 PolarHBondContact O-N 2.77Å; E1265-S1268 WeakPolarHBondContact O-CB 3.44Å; E1265-S1268 PolarHBondContact O-N 2.87Å; E1265-Y1269 PolarHBondContact O-N 3.05Å
1266	L	39.1	Very low	45.4	Very low	42 Å²	42	90.3 Å²	90.3	22%	0.22	52%	0.516	C	S	.	.	H	α-helix	trans	-65.8	-33.8	179	-149.1	84.5	0	0	0	112.4	A1257 Q1260 S1263 P1264 Y1269 N1270	A1257-L1266 HydrophobicContact CB-CD1 4.49Å; A1257-L1266 WeakPolarHBondContact O-CD1 3.27Å; Q1260-L1266 WeakPolarHBondContact O-CD2 3.45Å; S1263-L1266 WeakPolarHBondContact O-CB 3.14Å; S1263-L1266 PolarHBondContact O-N 3.03Å; S1263-L1266 VanDerWaalsContact O-N 3.13Å; P1264-L1266 PolarHBondContact O-N 3.15Å; L1266-Y1269 PolarHBondContact O-N 3.49Å; L1266-N1270 PolarHBondContact O-N 3.4Å; L1266-N1270 PolarHBondContact O-ND2 2.95Å
1267	T	44.2	Very low	46.2	Very low	103 Å²	103	92.3 Å²	92.3	63%	0.632	52%	0.517	S	S	*	.	H	α-helix	trans	-64.3	-44	176	-47.6	0	0	0	0	110.6	P1264 E1265 Y1269 N1270 L1271	P1264-T1267 PolarHBondContact O-N 3.38Å; E1265-T1267 VanDerWaalsContact C-N 3.33Å; E1265-T1267 PolarHBondContact O-N 2.77Å; T1267-Y1269 VanDerWaalsContact C-N 3.34Å; T1267-Y1269 PolarHBondContact O-N 3.2Å; T1267-N1270 PolarHBondContact O-N 3.02Å; T1267-L1271 PolarHBondContact O-N 3.37Å
1268	S	44.3	Very low	47	Very low	80 Å²	80	100 Å²	100	56%	0.559	54%	0.544	S	S	*	.	H	α-helix	trans	-63.2	-40.4	174.1	-63.8	0	0	0	0	111.7	E1265 L1271 V1272	E1265-S1268 WeakPolarHBondContact O-CB 3.44Å; E1265-S1268 PolarHBondContact O-N 2.87Å; S1268-L1271 PolarHBondContact O-N 3.43Å; S1268-V1272 WeakPolarHBondContact O-CG2 3.47Å; S1268-V1272 PolarHBondContact O-N 3.06Å
1269	Y	42	Very low	47.5	Very low	129 Å²	129	101.3 Å²	101.3	51%	0.506	54%	0.541	S	S	.	.	H	α-helix	trans	-66.1	-41.3	179.6	-139.2	-90.9	0	0	0	112.4	V1253 E1265 L1266 T1267 V1272 L1273	V1253-Y1269 HydrophobicContact CG1-CE1 4.1Å; E1265-Y1269 PolarHBondContact O-N 3.05Å; L1266-Y1269 PolarHBondContact O-N 3.49Å; T1267-Y1269 VanDerWaalsContact C-N 3.34Å; T1267-Y1269 PolarHBondContact O-N 3.2Å; Y1269-V1272 PolarHBondContact O-N 2.92Å; Y1269-L1273 HydrophobicContact CD1-CD1 4.03Å; Y1269-L1273 HydrophobicContact CE1-CD1 4.44Å; Y1269-L1273 WeakPolarHBondContact O-CB 3.26Å; Y1269-L1273 PolarHBondContact O-N 2.93Å
1270	N	48.9	Very low	48.5	Very low	76 Å²	76	100.8 Å²	100.8	41%	0.406	53%	0.53	S	S	.	.	H	α-helix	trans	-63.9	-40.8	173.9	-83.2	-80.5	0	0	0	112.1	L1266 T1267 V1272 L1273 Q1274	L1266-N1270 PolarHBondContact O-N 3.4Å; L1266-N1270 PolarHBondContact O-ND2 2.95Å; T1267-N1270 PolarHBondContact O-N 3.02Å; N1270-V1272 VanDerWaalsContact C-N 3.35Å; N1270-V1272 PolarHBondContact O-N 3.46Å; N1270-L1273 PolarHBondContact O-N 3.32Å; N1270-Q1274 WeakPolarHBondContact O-CB 3.13Å; N1270-Q1274 PolarHBondContact O-N 3.1Å
1271	L	49.7	Very low	50	Low	120 Å²	120	98.1 Å²	98.1	63%	0.628	52%	0.523	S	S	*	.	H	α-helix	trans	-62.5	-42	176.8	-149.2	76.2	0	0	0	111.6	T1267 S1268 Q1274 A1275	T1267-L1271 PolarHBondContact O-N 3.37Å; S1268-L1271 PolarHBondContact O-N 3.43Å; L1271-Q1274 PolarHBondContact O-N 3.08Å; L1271-A1275 WeakPolarHBondContact O-CB 3.2Å; L1271-A1275 PolarHBondContact O-N 3.33Å
1272	V	50.4	Low	51.5	Low	93 Å²	93	92.2 Å²	92.2	56%	0.564	50%	0.497	S	S	*	.	H	α-helix	trans	-65.5	-40.6	175	170.7	0	0	0	0	111.7	S1268 Y1269 N1270 S1276	S1268-V1272 WeakPolarHBondContact O-CG2 3.47Å; S1268-V1272 PolarHBondContact O-N 3.06Å; Y1269-V1272 PolarHBondContact O-N 2.92Å; N1270-V1272 VanDerWaalsContact C-N 3.35Å; N1270-V1272 PolarHBondContact O-N 3.46Å; V1272-S1276 WeakPolarHBondContact O-CB 3.4Å; V1272-S1276 PolarHBondContact O-N 3.42Å; V1272-S1276 PolarHBondContact O-OG 2.76Å
1273	L	51.6	Low	52.9	Low	23 Å²	23	93.9 Å²	93.9	12%	0.12	49%	0.487	C	S	.	.	H	α-helix	trans	-63.9	-41.8	174.5	-94.8	160.9	0	0	0	112	I1250 T1254 Y1269 N1270 S1276 R1277	I1250-L1273 HydrophobicContact CG2-CD2 4.38Å; T1254-L1273 HydrophobicContact CG2-CD1 4.22Å; T1254-L1273 WeakPolarHBondContact OG1-CD2 3.11Å; Y1269-L1273 HydrophobicContact CD1-CD1 4.03Å; Y1269-L1273 HydrophobicContact CE1-CD1 4.44Å; Y1269-L1273 WeakPolarHBondContact O-CB 3.26Å; Y1269-L1273 PolarHBondContact O-N 2.93Å; N1270-L1273 PolarHBondContact O-N 3.32Å; L1273-S1276 PolarHBondContact O-N 2.82Å; L1273-R1277 PolarHBondContact O-N 2.99Å
1274	Q	55.8	Low	54.6	Low	113 Å²	113	97.5 Å²	97.5	53%	0.528	50%	0.499	S	S	.	.	H	α-helix	trans	-67.9	-41.1	178.8	-162.7	177.6	32.1	0	0	111.6	N1270 L1271 R1278	N1270-Q1274 WeakPolarHBondContact O-CB 3.13Å; N1270-Q1274 PolarHBondContact O-N 3.1Å; L1271-Q1274 PolarHBondContact O-N 3.08Å; Q1274-R1278 WeakPolarHBondContact O-CG 3.29Å; Q1274-R1278 PolarHBondContact O-N 2.89Å; Q1274-R1278 VanDerWaalsContact O-N 3.08Å
1275	A	52.2	Low	56.2	Low	54 Å²	54	98.7 Å²	98.7	45%	0.446	50%	0.498	S	S	.	.	H	α-helix	trans	-63.1	-39.4	170.8	0	0	0	0	0	112.3	L1271 R1278 K1279	L1271-A1275 WeakPolarHBondContact O-CB 3.2Å; L1271-A1275 PolarHBondContact O-N 3.33Å; A1275-R1278 PolarHBondContact O-N 2.78Å; A1275-K1279 PolarHBondContact O-N 2.74Å
1276	S	52.4	Low	57.9	Low	55 Å²	55	98.2 Å²	98.2	39%	0.385	49%	0.49	S	S	.	.	H	α-helix	trans	-66.3	-43.4	177.4	-58.5	0	0	0	0	112	V1272 L1273 R1278 K1279 I1280	V1272-S1276 WeakPolarHBondContact O-CB 3.4Å; V1272-S1276 PolarHBondContact O-N 3.42Å; V1272-S1276 PolarHBondContact O-OG 2.76Å; L1273-S1276 PolarHBondContact O-N 2.82Å; S1276-R1278 PolarHBondContact O-N 3.16Å; S1276-K1279 PolarHBondContact O-N 3.45Å; S1276-I1280 WeakPolarHBondContact O-CG1 3.33Å; S1276-I1280 PolarHBondContact O-N 3.27Å
1277	R	61.8	Low	59.8	Low	155 Å²	155	100.1 Å²	100.1	59%	0.585	50%	0.503	S	S	*	.	H	α-helix	trans	-60.7	-41.8	173.5	-77.3	-175	170.3	-154.7	-6	112.1	L1273 K1279 I1280 V1281	L1273-R1277 PolarHBondContact O-N 2.99Å; R1277-K1279 PolarHBondContact O-N 2.94Å; R1277-I1280 PolarHBondContact O-N 3.18Å; R1277-V1281 PolarHBondContact O-N 3.36Å
1278	R	61.4	Low	61.5	Low	173 Å²	173	102.5 Å²	102.5	65%	0.653	50%	0.504	S	S	*	.	H	α-helix	trans	-61.5	-40.9	173.5	-75.2	179.7	175.5	178.8	-0.6	112.3	Q1274 A1275 S1276 I1280 V1281 L1282	Q1274-R1278 WeakPolarHBondContact O-CG 3.29Å; Q1274-R1278 PolarHBondContact O-N 2.89Å; Q1274-R1278 VanDerWaalsContact O-N 3.08Å; A1275-R1278 PolarHBondContact O-N 2.78Å; S1276-R1278 PolarHBondContact O-N 3.16Å; R1278-I1280 PolarHBondContact O-N 3.31Å; R1278-V1281 PolarHBondContact O-N 2.87Å; R1278-L1282 WeakPolarHBondContact O-CG 3.45Å; R1278-L1282 PolarHBondContact O-N 2.81Å; R1278-L1282 VanDerWaalsContact O-N 3.1Å
1279	K	59.4	Low	63.2	Low	131 Å²	131	102 Å²	102	57%	0.57	49%	0.493	S	S	*	.	H	α-helix	trans	-62.2	-38.9	174.7	-87.3	-172	170.7	-175.2	0	113.3	A1275 S1276 R1277 L1282 L1283	A1275-K1279 PolarHBondContact O-N 2.74Å; S1276-K1279 PolarHBondContact O-N 3.45Å; R1277-K1279 PolarHBondContact O-N 2.94Å; K1279-L1282 PolarHBondContact O-N 3.09Å; K1279-L1283 WeakPolarHBondContact O-CB 3.4Å; K1279-L1283 WeakPolarHBondContact O-CG 3.41Å; K1279-L1283 PolarHBondContact O-N 3.32Å
1280	I	70	Confident	64.8	Low	83 Å²	83	100 Å²	100	43%	0.426	49%	0.491	S	S	.	.	H	α-helix	trans	-63.1	-48.5	177.5	-68.2	166.5	0	0	0	110.7	S1276 R1277 R1278 L1282 L1283 E1284	S1276-I1280 WeakPolarHBondContact O-CG1 3.33Å; S1276-I1280 PolarHBondContact O-N 3.27Å; R1277-I1280 PolarHBondContact O-N 3.18Å; R1278-I1280 PolarHBondContact O-N 3.31Å; I1280-L1282 VanDerWaalsContact C-N 3.33Å; I1280-L1282 PolarHBondContact O-N 3.18Å; I1280-L1283 WeakPolarHBondContact O-CB 3.38Å; I1280-L1283 PolarHBondContact O-N 2.81Å; I1280-L1283 VanDerWaalsContact O-N 3.11Å; I1280-E1284 WeakPolarHBondContact O-CG 3.35Å; I1280-E1284 PolarHBondContact O-N 3.13Å
1281	V	70.7	Confident	66.3	Low	90 Å²	90	101.5 Å²	101.5	55%	0.545	50%	0.498	S	S	.	.	H	α-helix	trans	-62.1	-38.8	178.6	177.9	0	0	0	0	112.1	R1277 R1278 E1284 E1285	R1277-V1281 PolarHBondContact O-N 3.36Å; R1278-V1281 PolarHBondContact O-N 2.87Å; V1281-E1284 PolarHBondContact O-N 2.95Å; V1281-E1285 PolarHBondContact O-N 2.83Å
1282	L	67.8	Low	68	Low	65 Å²	65	100 Å²	100	34%	0.34	49%	0.494	S	S	.	.	H	α-helix	trans	-66.8	-34.9	174.5	-75.7	167.4	0	0	0	112.9	R1278 K1279 I1280 R1286	R1278-L1282 WeakPolarHBondContact O-CG 3.45Å; R1278-L1282 PolarHBondContact O-N 2.81Å; R1278-L1282 VanDerWaalsContact O-N 3.1Å; K1279-L1282 PolarHBondContact O-N 3.09Å; I1280-L1282 VanDerWaalsContact C-N 3.33Å; I1280-L1282 PolarHBondContact O-N 3.18Å; L1282-R1286 WeakPolarHBondContact O-CB 3.36Å; L1282-R1286 PolarHBondContact O-N 3.45Å
1283	L	66.4	Low	69.3	Low	114 Å²	114	99.8 Å²	99.8	60%	0.597	49%	0.487	S	S	*	.	H	α-helix	trans	-67.5	-40.6	172.8	-78.2	163.4	0	0	0	111.5	K1279 I1280 R1286 V1287	K1279-L1283 WeakPolarHBondContact O-CB 3.4Å; K1279-L1283 WeakPolarHBondContact O-CG 3.41Å; K1279-L1283 PolarHBondContact O-N 3.32Å; I1280-L1283 WeakPolarHBondContact O-CB 3.38Å; I1280-L1283 PolarHBondContact O-N 2.81Å; I1280-L1283 VanDerWaalsContact O-N 3.11Å; L1283-R1286 PolarHBondContact O-N 3.37Å; L1283-V1287 WeakPolarHBondContact O-CB 3.48Å; L1283-V1287 VanDerWaalsContact O-CG2 3.3Å; L1283-V1287 WeakPolarHBondContact O-CG2 3.43Å; L1283-V1287 PolarHBondContact O-N 3.13Å
1284	E	74.3	Confident	70.8	Confident	117 Å²	117	102 Å²	102	55%	0.547	50%	0.499	S	S	.	.	H	α-helix	trans	-63.7	-40.7	175	-70.3	176.9	166	0	0	112.4	I1280 V1281 K1288	I1280-E1284 WeakPolarHBondContact O-CG 3.35Å; I1280-E1284 PolarHBondContact O-N 3.13Å; V1281-E1284 PolarHBondContact O-N 2.95Å; E1284-K1288 PolarHBondContact O-N 3.22Å; E1284-K1288 VanDerWaalsContact O-N 3.09Å
1285	E	78	Confident	72.1	Confident	109 Å²	109	99.6 Å²	99.6	51%	0.509	49%	0.494	S	S	.	.	H	α-helix	trans	-59.9	-49.5	169.2	-89.5	-143.7	162.4	0	0	111.7	K269 V1281 V1287 K1288 H1289	K269-E1285 IonicContact NZ-OE2 2.64Å; K269-E1285 PolarHBondContact NZ-OE2 2.85Å; V1281-E1285 PolarHBondContact O-N 2.83Å; E1285-V1287 VanDerWaalsContact C-N 3.34Å; E1285-V1287 PolarHBondContact O-N 2.88Å; E1285-K1288 PolarHBondContact O-N 2.82Å; E1285-H1289 PolarHBondContact O-N 3.37Å
1286	R	75.7	Confident	73.5	Confident	138 Å²	138	98.6 Å²	98.6	52%	0.521	49%	0.489	S	S	.	.	H	α-helix	trans	-66.3	-36.2	-176.1	-168.9	68.5	-169.2	-172.3	10.8	111.9	L1282 L1283 H1289 L1290	L1282-R1286 WeakPolarHBondContact O-CB 3.36Å; L1282-R1286 PolarHBondContact O-N 3.45Å; L1283-R1286 PolarHBondContact O-N 3.37Å; R1286-H1289 PolarHBondContact O-N 3.25Å; R1286-L1290 HydrophobicContact CG-CD1 4.05Å; R1286-L1290 HydrophobicContact CG-CG 4.43Å; R1286-L1290 WeakPolarHBondContact O-CB 3.15Å; R1286-L1290 VanDerWaalsContact O-CG 3.29Å; R1286-L1290 WeakPolarHBondContact O-CG 3.43Å; R1286-L1290 PolarHBondContact O-N 3.24Å
1287	V	78.6	Confident	74.8	Confident	81 Å²	81	102.3 Å²	102.3	49%	0.491	50%	0.5	S	S	.	.	H	α-helix	trans	-65.2	-43	173.4	169.3	0	0	0	0	111.3	L1283 E1285 H1289 L1290 L1291	L1283-V1287 WeakPolarHBondContact O-CB 3.48Å; L1283-V1287 VanDerWaalsContact O-CG2 3.3Å; L1283-V1287 WeakPolarHBondContact O-CG2 3.43Å; L1283-V1287 PolarHBondContact O-N 3.13Å; E1285-V1287 VanDerWaalsContact C-N 3.34Å; E1285-V1287 PolarHBondContact O-N 2.88Å; V1287-H1289 VanDerWaalsContact C-N 3.32Å; V1287-H1289 PolarHBondContact O-N 2.7Å; V1287-L1290 PolarHBondContact O-N 3.43Å; V1287-L1291 HydrophobicContact CG1-CD1 4.01Å; V1287-L1291 HydrophobicContact CG1-CG 4.5Å; V1287-L1291 WeakPolarHBondContact O-CB 3.44Å; V1287-L1291 VanDerWaalsContact O-CG 3.27Å; V1287-L1291 WeakPolarHBondContact O-CG 3.39Å; V1287-L1291 PolarHBondContact O-N 3.14Å
1288	K	80.7	Confident	75.9	Confident	153 Å²	153	102.3 Å²	102.3	67%	0.665	50%	0.501	S	S	*	.	H	α-helix	trans	-60.5	-40.7	172.6	-80.6	177.9	176	172.6	0	112.3	E1284 E1285 T1292	E1284-K1288 PolarHBondContact O-N 3.22Å; E1284-K1288 VanDerWaalsContact O-N 3.09Å; E1285-K1288 PolarHBondContact O-N 2.82Å; K1288-T1292 PolarHBondContact O-N 3Å; K1288-T1292 VanDerWaalsContact O-N 3.16Å; K1288-T1292 PolarHBondContact O-OG1 3.47Å
1289	H	80.1	Confident	77	Confident	70 Å²	70	99.4 Å²	99.4	32%	0.324	49%	0.494	S	S	.	.	H	α-helix	trans	-66.7	-48.7	178.9	-166.5	46.6	0	0	0	111.7	E1285 R1286 V1287 L1291 T1292 E1293	E1285-H1289 PolarHBondContact O-N 3.37Å; R1286-H1289 PolarHBondContact O-N 3.25Å; V1287-H1289 VanDerWaalsContact C-N 3.32Å; V1287-H1289 PolarHBondContact O-N 2.7Å; H1289-L1291 VanDerWaalsContact C-N 3.32Å; H1289-L1291 PolarHBondContact O-N 2.75Å; H1289-T1292 CarbonylContact O-C 3.58Å; H1289-T1292 WeakPolarHBondContact O-CA 3.47Å; H1289-T1292 VanDerWaalsContact O-CB 3.25Å; H1289-T1292 WeakPolarHBondContact O-CB 2.77Å; H1289-T1292 PolarHBondContact O-N 2.67Å; H1289-E1293 IonicContact CD2-OE2 3.16Å; H1289-E1293 PolarHBondContact O-N 3.45Å
1290	L	75.2	Confident	78.2	Confident	86 Å²	86	96.6 Å²	96.6	45%	0.45	49%	0.491	S	S	.	.	H	α-helix	trans	-60.6	-37.1	176.1	-73.4	166.5	0	0	0	112.7	R1286 V1287 T1292 E1293 L1294	R1286-L1290 HydrophobicContact CG-CD1 4.05Å; R1286-L1290 HydrophobicContact CG-CG 4.43Å; R1286-L1290 WeakPolarHBondContact O-CB 3.15Å; R1286-L1290 VanDerWaalsContact O-CG 3.29Å; R1286-L1290 WeakPolarHBondContact O-CG 3.43Å; R1286-L1290 PolarHBondContact O-N 3.24Å; V1287-L1290 PolarHBondContact O-N 3.43Å; L1290-T1292 PolarHBondContact O-N 3.3Å; L1290-E1293 PolarHBondContact O-N 2.69Å; L1290-L1294 WeakPolarHBondContact O-CB 3.46Å; L1290-L1294 PolarHBondContact O-N 3.42Å
1291	L	80.1	Confident	79	Confident	109 Å²	109	98.4 Å²	98.4	57%	0.571	50%	0.496	S	S	*	.	H	α-helix	trans	-64.4	-29.7	172.3	-75.7	169.2	0	0	0	112.6	V1287 H1289 S1295	V1287-L1291 HydrophobicContact CG1-CD1 4.01Å; V1287-L1291 HydrophobicContact CG1-CG 4.5Å; V1287-L1291 WeakPolarHBondContact O-CB 3.44Å; V1287-L1291 VanDerWaalsContact O-CG 3.27Å; V1287-L1291 WeakPolarHBondContact O-CG 3.39Å; V1287-L1291 PolarHBondContact O-N 3.14Å; H1289-L1291 VanDerWaalsContact C-N 3.32Å; H1289-L1291 PolarHBondContact O-N 2.75Å; L1291-S1295 PolarHBondContact O-N 2.91Å
1292	T	84.7	Confident	79.7	Confident	89 Å²	89	100.2 Å²	100.2	55%	0.546	49%	0.493	S	S	.	.	H	α-helix	trans	-76.5	-47.3	176	-50.6	0	0	0	0	110.6	K1288 H1289 L1290 L1294 S1295 G1296	K1288-T1292 PolarHBondContact O-N 3Å; K1288-T1292 VanDerWaalsContact O-N 3.16Å; K1288-T1292 PolarHBondContact O-OG1 3.47Å; H1289-T1292 CarbonylContact O-C 3.58Å; H1289-T1292 WeakPolarHBondContact O-CA 3.47Å; H1289-T1292 VanDerWaalsContact O-CB 3.25Å; H1289-T1292 WeakPolarHBondContact O-CB 2.77Å; H1289-T1292 PolarHBondContact O-N 2.67Å; L1290-T1292 PolarHBondContact O-N 3.3Å; T1292-L1294 PolarHBondContact O-N 2.85Å; T1292-S1295 WeakPolarHBondContact O-CB 3.46Å; T1292-S1295 PolarHBondContact O-N 3.43Å; T1292-S1295 VanDerWaalsContact O-N 3.09Å; T1292-S1295 PolarHBondContact O-OG 2.83Å; T1292-G1296 PolarHBondContact O-N 3.2Å
1293	E	79.7	Confident	80.7	Confident	88 Å²	88	102.5 Å²	102.5	41%	0.411	50%	0.502	S	S	.	.	H	α-helix	trans	-56.4	-48.6	173.5	-68.5	178.3	104.7	0	0	111.4	H1289 L1290 S1295 G1296 E1297	H1289-E1293 IonicContact CD2-OE2 3.16Å; H1289-E1293 PolarHBondContact O-N 3.45Å; L1290-E1293 PolarHBondContact O-N 2.69Å; E1293-S1295 PolarHBondContact O-N 3.01Å; E1293-G1296 CarbonylContact O-C 3.49Å; E1293-G1296 WeakPolarHBondContact O-CA 3.48Å; E1293-G1296 PolarHBondContact O-N 3.1Å; E1293-E1297 PolarHBondContact O-N 3.35Å
1294	L	81.2	Confident	81.5	Confident	69 Å²	69	102.5 Å²	102.5	36%	0.361	50%	0.502	S	S	.	.	H	α-helix	trans	-60.4	-29.7	176.8	-171.9	73	0	0	0	112.7	L1290 T1292 R1298	L1290-L1294 WeakPolarHBondContact O-CB 3.46Å; L1290-L1294 PolarHBondContact O-N 3.42Å; T1292-L1294 PolarHBondContact O-N 2.85Å; L1294-R1298 WeakPolarHBondContact O-CB 3.49Å; L1294-R1298 VanDerWaalsContact O-CD 3.27Å; L1294-R1298 WeakPolarHBondContact O-CD 3.25Å; L1294-R1298 WeakPolarHBondContact O-CG 3.46Å; L1294-R1298 PolarHBondContact O-N 3.18Å
1295	S	83.2	Confident	82.1	Confident	63 Å²	63	102 Å²	102	44%	0.441	50%	0.499	S	S	.	.	H	α-helix	trans	-72.2	-39.9	172.9	78.8	0	0	0	0	111.7	L1291 T1292 E1293 R1298 E1299	L1291-S1295 PolarHBondContact O-N 2.91Å; T1292-S1295 WeakPolarHBondContact O-CB 3.46Å; T1292-S1295 PolarHBondContact O-N 3.43Å; T1292-S1295 VanDerWaalsContact O-N 3.09Å; T1292-S1295 PolarHBondContact O-OG 2.83Å; E1293-S1295 PolarHBondContact O-N 3.01Å; S1295-R1298 PolarHBondContact O-N 3.01Å; S1295-E1299 PolarHBondContact O-N 3.41Å; S1295-E1299 VanDerWaalsContact O-N 3.08Å
1296	G	83.5	Confident	82.6	Confident	33 Å²	33	99.7 Å²	99.7	34%	0.34	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-48.8	174.4	0	0	0	0	0	112.7	T1292 E1293 R1298 E1299 S1300	T1292-G1296 PolarHBondContact O-N 3.2Å; E1293-G1296 CarbonylContact O-C 3.49Å; E1293-G1296 WeakPolarHBondContact O-CA 3.48Å; E1293-G1296 PolarHBondContact O-N 3.1Å; G1296-R1298 PolarHBondContact O-N 3.3Å; G1296-E1299 WeakPolarHBondContact O-CA 3.41Å; G1296-E1299 VanDerWaalsContact O-CB 3.32Å; G1296-E1299 WeakPolarHBondContact O-CB 3.39Å; G1296-E1299 PolarHBondContact O-N 3.04Å; G1296-S1300 PolarHBondContact O-N 2.75Å; G1296-S1300 PolarHBondContact O-OG 2.9Å
1297	E	79.1	Confident	83.2	Confident	132 Å²	132	96 Å²	96	62%	0.617	49%	0.488	S	S	*	.	H	α-helix	trans	-57.2	-38.3	174.4	-72.7	-166	128.3	0	0	112.2	E1293 E1299 K1301	E1293-E1297 PolarHBondContact O-N 3.35Å; E1297-E1299 VanDerWaalsContact C-N 3.29Å; E1297-E1299 PolarHBondContact O-N 2.89Å; E1297-K1301 WeakPolarHBondContact O-CB 3.32Å; E1297-K1301 PolarHBondContact O-N 2.94Å
1298	R	83.9	Confident	83.5	Confident	156 Å²	156	96.2 Å²	96.2	59%	0.589	49%	0.489	S	S	*	.	H	α-helix	trans	-70.2	-22.7	175.4	-74.3	169.9	179.5	-172.4	-0.7	113.3	L1294 S1295 G1296 R1302	L1294-R1298 WeakPolarHBondContact O-CB 3.49Å; L1294-R1298 VanDerWaalsContact O-CD 3.27Å; L1294-R1298 WeakPolarHBondContact O-CD 3.25Å; L1294-R1298 WeakPolarHBondContact O-CG 3.46Å; L1294-R1298 PolarHBondContact O-N 3.18Å; S1295-R1298 PolarHBondContact O-N 3.01Å; G1296-R1298 PolarHBondContact O-N 3.3Å; R1298-R1302 PolarHBondContact O-NE 3.42Å; R1298-R1302 PolarHBondContact O-NH2 3.07Å
1299	E	86.1	Confident	83.8	Confident	111 Å²	111	92.1 Å²	92.1	52%	0.519	48%	0.48	S	S	.	.	H	α-helix	trans	-78.6	-52.2	171.6	-149.2	69.9	-126.9	0	0	109.9	S1295 G1296 E1297 K1301 R1302 H1303	S1295-E1299 PolarHBondContact O-N 3.41Å; S1295-E1299 VanDerWaalsContact O-N 3.08Å; G1296-E1299 WeakPolarHBondContact O-CA 3.41Å; G1296-E1299 VanDerWaalsContact O-CB 3.32Å; G1296-E1299 WeakPolarHBondContact O-CB 3.39Å; G1296-E1299 PolarHBondContact O-N 3.04Å; E1297-E1299 VanDerWaalsContact C-N 3.29Å; E1297-E1299 PolarHBondContact O-N 2.89Å; E1299-K1301 VanDerWaalsContact C-N 3.32Å; E1299-K1301 PolarHBondContact O-N 3.48Å; E1299-R1302 PolarHBondContact O-N 3.21Å; E1299-R1302 VanDerWaalsContact O-N 3.1Å; E1299-R1302 IonicContact OE1-CZ 3.96Å; E1299-R1302 VanDerWaalsContact OE1-CZ 3.27Å; E1299-R1302 IonicContact OE1-NH1 3.8Å; E1299-R1302 PolarHBondContact OE1-NH1 3.21Å; E1299-R1302 IonicContact OE1-NH2 2.81Å; E1299-R1302 PolarHBondContact OE1-NH2 2.81Å; E1299-R1302 IonicContact OE2-CZ 3.3Å; E1299-R1302 IonicContact OE2-NH1 3.83Å; E1299-R1302 PolarHBondContact OE2-NH1 3.35Å; E1299-R1302 IonicContact OE2-NH2 2.69Å; E1299-R1302 PolarHBondContact OE2-NH2 3.48Å; E1299-H1303 PolarHBondContact O-N 3.19Å
1300	S	84.1	Confident	84.4	Confident	72 Å²	72	94 Å²	94	50%	0.503	48%	0.484	S	S	.	.	H	α-helix	trans	-59.2	-39.5	177.1	-59.2	0	0	0	0	112.6	G1296 H1303 L1304	G1296-S1300 PolarHBondContact O-N 2.75Å; G1296-S1300 PolarHBondContact O-OG 2.9Å; S1300-H1303 PolarHBondContact O-N 3.44Å; S1300-L1304 WeakPolarHBondContact O-CG 3.41Å; S1300-L1304 PolarHBondContact O-N 2.78Å
1301	K	86.4	Confident	84.9	Confident	121 Å²	121	93.3 Å²	93.3	53%	0.526	48%	0.48	S	S	.	.	H	α-helix	trans	-60.3	-46.9	173.8	176.4	174.1	170	175.5	0	111.6	E1297 E1299 H1303 L1304 E1305	E1297-K1301 WeakPolarHBondContact O-CB 3.32Å; E1297-K1301 PolarHBondContact O-N 2.94Å; E1299-K1301 VanDerWaalsContact C-N 3.32Å; E1299-K1301 PolarHBondContact O-N 3.48Å; K1301-H1303 VanDerWaalsContact C-N 3.3Å; K1301-H1303 PolarHBondContact O-N 3.16Å; K1301-L1304 PolarHBondContact O-N 3.13Å; K1301-E1305 WeakPolarHBondContact CE-OE1 3.38Å; K1301-E1305 WeakPolarHBondContact CE-OE2 3.29Å; K1301-E1305 HydrophobicContact CG-CG 4.33Å; K1301-E1305 IonicContact NZ-OE1 3.88Å; K1301-E1305 PolarHBondContact NZ-OE1 3.4Å; K1301-E1305 WeakPolarHBondContact O-CB 3.47Å; K1301-E1305 WeakPolarHBondContact O-CG 3.49Å; K1301-E1305 PolarHBondContact O-N 3.35Å
1302	R	86.2	Confident	85.2	Confident	129 Å²	129	93 Å²	93	49%	0.487	48%	0.479	S	S	.	.	H	α-helix	trans	-61.7	-38.1	177.1	-83.8	177.2	-77.5	135.6	-0.9	111.9	R1298 E1299 A1306	R1298-R1302 PolarHBondContact O-NE 3.42Å; R1298-R1302 PolarHBondContact O-NH2 3.07Å; E1299-R1302 PolarHBondContact O-N 3.21Å; E1299-R1302 VanDerWaalsContact O-N 3.1Å; E1299-R1302 IonicContact OE1-CZ 3.96Å; E1299-R1302 VanDerWaalsContact OE1-CZ 3.27Å; E1299-R1302 IonicContact OE1-NH1 3.8Å; E1299-R1302 PolarHBondContact OE1-NH1 3.21Å; E1299-R1302 IonicContact OE1-NH2 2.81Å; E1299-R1302 PolarHBondContact OE1-NH2 2.81Å; E1299-R1302 IonicContact OE2-CZ 3.3Å; E1299-R1302 IonicContact OE2-NH1 3.83Å; E1299-R1302 PolarHBondContact OE2-NH1 3.35Å; E1299-R1302 IonicContact OE2-NH2 2.69Å; E1299-R1302 PolarHBondContact OE2-NH2 3.48Å; R1302-A1306 WeakPolarHBondContact O-CB 3.4Å; R1302-A1306 PolarHBondContact O-N 3.21Å
1303	H	88.3	Confident	85.4	Confident	112 Å²	112	93.2 Å²	93.2	52%	0.519	48%	0.477	S	S	.	.	H	α-helix	trans	-65.6	-41.4	174.2	-170.5	-49.7	0	0	0	112.3	E1299 S1300 K1301 A1306 E1307	E1299-H1303 PolarHBondContact O-N 3.19Å; S1300-H1303 PolarHBondContact O-N 3.44Å; K1301-H1303 VanDerWaalsContact C-N 3.3Å; K1301-H1303 PolarHBondContact O-N 3.16Å; H1303-A1306 PolarHBondContact O-N 3.11Å; H1303-E1307 PolarHBondContact O-N 2.98Å
1304	L	83.2	Confident	85.9	Confident	115 Å²	115	93.1 Å²	93.1	60%	0.602	48%	0.477	S	S	*	.	H	α-helix	trans	-68.4	-39.2	176.6	-72.6	169.3	0	0	0	112.1	S1300 K1301 A1306 E1307 V1308	S1300-L1304 WeakPolarHBondContact O-CG 3.41Å; S1300-L1304 PolarHBondContact O-N 2.78Å; K1301-L1304 PolarHBondContact O-N 3.13Å; L1304-A1306 VanDerWaalsContact C-N 3.32Å; L1304-A1306 PolarHBondContact O-N 3.09Å; L1304-E1307 PolarHBondContact O-N 3.21Å; L1304-V1308 WeakPolarHBondContact O-CB 3.34Å; L1304-V1308 VanDerWaalsContact O-CG2 3.29Å; L1304-V1308 WeakPolarHBondContact O-CG2 3.43Å; L1304-V1308 PolarHBondContact O-N 2.85Å
1305	E	86.5	Confident	86	Confident	106 Å²	106	94.7 Å²	94.7	50%	0.495	49%	0.486	S	S	.	.	H	α-helix	trans	-63	-38.2	174.4	-73.4	173.9	146.1	0	0	111.6	K1301 S1309	K1301-E1305 WeakPolarHBondContact CE-OE1 3.38Å; K1301-E1305 WeakPolarHBondContact CE-OE2 3.29Å; K1301-E1305 HydrophobicContact CG-CG 4.33Å; K1301-E1305 IonicContact NZ-OE1 3.88Å; K1301-E1305 PolarHBondContact NZ-OE1 3.4Å; K1301-E1305 WeakPolarHBondContact O-CB 3.47Å; K1301-E1305 WeakPolarHBondContact O-CG 3.49Å; K1301-E1305 PolarHBondContact O-N 3.35Å; E1305-S1309 PolarHBondContact O-N 3.48Å; E1305-S1309 VanDerWaalsContact O-N 3.11Å
1306	A	88.7	Confident	86.3	Confident	61 Å²	61	98 Å²	98	50%	0.504	49%	0.492	S	S	.	.	H	α-helix	trans	-66.1	-45.6	173.2	0	0	0	0	0	112.8	R1302 H1303 L1304 S1309 R1310	R1302-A1306 WeakPolarHBondContact O-CB 3.4Å; R1302-A1306 PolarHBondContact O-N 3.21Å; H1303-A1306 PolarHBondContact O-N 3.11Å; L1304-A1306 VanDerWaalsContact C-N 3.32Å; L1304-A1306 PolarHBondContact O-N 3.09Å; A1306-S1309 WeakPolarHBondContact O-CB 3.47Å; A1306-S1309 PolarHBondContact O-N 3.09Å; A1306-S1309 VanDerWaalsContact O-N 3.16Å; A1306-R1310 PolarHBondContact O-N 3.49Å
1307	E	87.2	Confident	86.5	Confident	61 Å²	61	98.7 Å²	98.7	29%	0.285	49%	0.494	S	S	.	.	H	α-helix	trans	-67.1	-37	179.2	-176.6	57.5	-159.9	0	0	112.2	H1303 L1304 S1309 R1310 L1311	H1303-E1307 PolarHBondContact O-N 2.98Å; L1304-E1307 PolarHBondContact O-N 3.21Å; E1307-S1309 VanDerWaalsContact C-N 3.3Å; E1307-S1309 PolarHBondContact O-N 3.36Å; E1307-R1310 VanDerWaalsContact CD-NE 3.32Å; E1307-R1310 WeakPolarHBondContact O-CB 3.41Å; E1307-R1310 PolarHBondContact O-N 3.17Å; E1307-R1310 IonicContact OE1-CZ 2.85Å; E1307-R1310 IonicContact OE1-NE 3.59Å; E1307-R1310 PolarHBondContact OE1-NE 3.03Å; E1307-R1310 VanDerWaalsContact OE1-NE 3.12Å; E1307-R1310 IonicContact OE1-NH2 3.12Å; E1307-R1310 PolarHBondContact OE1-NH2 2.85Å; E1307-R1310 WeakPolarHBondContact OE2-CD 3.47Å; E1307-R1310 IonicContact OE2-CZ 3.34Å; E1307-R1310 IonicContact OE2-NE 3.95Å; E1307-R1310 PolarHBondContact OE2-NE 2.89Å; E1307-R1310 IonicContact OE2-NH2 2.75Å; E1307-L1311 HydrophobicContact CG-CD1 4.06Å; E1307-L1311 HydrophobicContact CG-CG 4.49Å; E1307-L1311 WeakPolarHBondContact O-CB 3.46Å; E1307-L1311 WeakPolarHBondContact O-CG 3.46Å; E1307-L1311 PolarHBondContact O-N 3.29Å
1308	V	86.1	Confident	86.9	Confident	84 Å²	84	97.1 Å²	97.1	51%	0.509	49%	0.49	S	S	.	.	H	α-helix	trans	-64.6	-33.6	172	168.9	0	0	0	0	111.6	L1304 N1312	L1304-V1308 WeakPolarHBondContact O-CB 3.34Å; L1304-V1308 VanDerWaalsContact O-CG2 3.29Å; L1304-V1308 WeakPolarHBondContact O-CG2 3.43Å; L1304-V1308 PolarHBondContact O-N 2.85Å; V1308-N1312 WeakPolarHBondContact O-CB 3.44Å; V1308-N1312 PolarHBondContact O-N 3.1Å; V1308-N1312 VanDerWaalsContact O-N 3.13Å; V1308-N1312 PolarHBondContact O-ND2 2.97Å
1309	S	86.7	Confident	87	Confident	68 Å²	68	93.4 Å²	93.4	48%	0.476	49%	0.488	S	S	.	.	H	α-helix	trans	-65	-48.3	170.5	-162.1	0	0	0	0	111.1	E1305 A1306 E1307 L1311 N1312 D1313	E1305-S1309 PolarHBondContact O-N 3.48Å; E1305-S1309 VanDerWaalsContact O-N 3.11Å; A1306-S1309 WeakPolarHBondContact O-CB 3.47Å; A1306-S1309 PolarHBondContact O-N 3.09Å; A1306-S1309 VanDerWaalsContact O-N 3.16Å; E1307-S1309 VanDerWaalsContact C-N 3.3Å; E1307-S1309 PolarHBondContact O-N 3.36Å; S1309-L1311 PolarHBondContact O-N 3.45Å; S1309-N1312 PolarHBondContact O-N 3.12Å; S1309-N1312 VanDerWaalsContact O-N 3.12Å; S1309-D1313 PolarHBondContact O-N 3.34Å; S1309-D1313 VanDerWaalsContact O-N 3.1Å
1310	R	93.1	Very high	87.1	Confident	108 Å²	108	93 Å²	93	41%	0.408	49%	0.489	S	S	.	.	H	α-helix	trans	-55.9	-48.2	179.4	-159	-171.7	72.2	64.2	21.2	111.7	A1306 E1307 N1312 D1313 E1314	A1306-R1310 PolarHBondContact O-N 3.49Å; E1307-R1310 VanDerWaalsContact CD-NE 3.32Å; E1307-R1310 WeakPolarHBondContact O-CB 3.41Å; E1307-R1310 PolarHBondContact O-N 3.17Å; E1307-R1310 IonicContact OE1-CZ 2.85Å; E1307-R1310 IonicContact OE1-NE 3.59Å; E1307-R1310 PolarHBondContact OE1-NE 3.03Å; E1307-R1310 VanDerWaalsContact OE1-NE 3.12Å; E1307-R1310 IonicContact OE1-NH2 3.12Å; E1307-R1310 PolarHBondContact OE1-NH2 2.85Å; E1307-R1310 WeakPolarHBondContact OE2-CD 3.47Å; E1307-R1310 IonicContact OE2-CZ 3.34Å; E1307-R1310 IonicContact OE2-NE 3.95Å; E1307-R1310 PolarHBondContact OE2-NE 2.89Å; E1307-R1310 IonicContact OE2-NH2 2.75Å; R1310-N1312 VanDerWaalsContact C-N 3.35Å; R1310-N1312 PolarHBondContact O-N 2.99Å; R1310-D1313 PolarHBondContact O-N 3.11Å; R1310-E1314 IonicContact CZ-OE1 3.7Å; R1310-E1314 IonicContact CZ-OE2 3.37Å; R1310-E1314 IonicContact NH1-OE1 2.69Å; R1310-E1314 PolarHBondContact NH1-OE1 3.1Å; R1310-E1314 IonicContact NH1-OE2 3.11Å; R1310-E1314 PolarHBondContact NH1-OE2 2.99Å; R1310-E1314 VanDerWaalsContact NH1-OE2 3.11Å; R1310-E1314 IonicContact NH2-OE1 3.9Å; R1310-E1314 IonicContact NH2-OE2 2.99Å; R1310-E1314 PolarHBondContact NH2-OE2 3.37Å; R1310-E1314 PolarHBondContact O-N 2.69Å
1311	L	85.6	Confident	87.4	Confident	73 Å²	73	95.3 Å²	95.3	38%	0.382	49%	0.492	S	S	.	.	H	α-helix	trans	-67.1	-30.6	178.1	-69.7	167.5	0	0	0	113.1	E1307 S1309 N1315	E1307-L1311 HydrophobicContact CG-CD1 4.06Å; E1307-L1311 HydrophobicContact CG-CG 4.49Å; E1307-L1311 WeakPolarHBondContact O-CB 3.46Å; E1307-L1311 WeakPolarHBondContact O-CG 3.46Å; E1307-L1311 PolarHBondContact O-N 3.29Å; S1309-L1311 PolarHBondContact O-N 3.45Å; L1311-N1315 WeakPolarHBondContact O-CB 3.35Å; L1311-N1315 PolarHBondContact O-N 3.34Å; L1311-N1315 PolarHBondContact O-ND2 3.3Å
1312	N	86.8	Confident	87.3	Confident	101 Å²	101	95.8 Å²	95.8	54%	0.54	50%	0.499	S	S	.	.	H	α-helix	trans	-69.3	-39.5	173.9	-84.9	-52.3	0	0	0	111.9	V1308 S1309 R1310 K1316	V1308-N1312 WeakPolarHBondContact O-CB 3.44Å; V1308-N1312 PolarHBondContact O-N 3.1Å; V1308-N1312 VanDerWaalsContact O-N 3.13Å; V1308-N1312 PolarHBondContact O-ND2 2.97Å; S1309-N1312 PolarHBondContact O-N 3.12Å; S1309-N1312 VanDerWaalsContact O-N 3.12Å; R1310-N1312 VanDerWaalsContact C-N 3.35Å; R1310-N1312 PolarHBondContact O-N 2.99Å; N1312-K1316 VanDerWaalsContact O-CB 3.32Å; N1312-K1316 WeakPolarHBondContact O-CB 3.49Å; N1312-K1316 PolarHBondContact O-N 3.12Å
1313	D	88.9	Confident	87.4	Confident	95 Å²	95	94.9 Å²	94.9	51%	0.508	50%	0.499	S	S	.	.	H	α-helix	trans	-69.5	-37	175.6	-74	-46	0	0	0	112	S1309 R1310 K1316 A1317	S1309-D1313 PolarHBondContact O-N 3.34Å; S1309-D1313 VanDerWaalsContact O-N 3.1Å; R1310-D1313 PolarHBondContact O-N 3.11Å; D1313-K1316 WeakPolarHBondContact O-CB 3.32Å; D1313-K1316 PolarHBondContact O-N 3.15Å; D1313-A1317 PolarHBondContact O-N 3.29Å
1314	E	88.7	Confident	87.4	Confident	86 Å²	86	91.9 Å²	91.9	40%	0.402	49%	0.493	S	S	.	.	H	α-helix	trans	-62.6	-47.3	171.2	-73.2	-178.1	146.4	0	0	112.3	R1310 K1316 A1317 L1318	R1310-E1314 IonicContact CZ-OE1 3.7Å; R1310-E1314 IonicContact CZ-OE2 3.37Å; R1310-E1314 IonicContact NH1-OE1 2.69Å; R1310-E1314 PolarHBondContact NH1-OE1 3.1Å; R1310-E1314 IonicContact NH1-OE2 3.11Å; R1310-E1314 PolarHBondContact NH1-OE2 2.99Å; R1310-E1314 VanDerWaalsContact NH1-OE2 3.11Å; R1310-E1314 IonicContact NH2-OE1 3.9Å; R1310-E1314 IonicContact NH2-OE2 2.99Å; R1310-E1314 PolarHBondContact NH2-OE2 3.37Å; R1310-E1314 PolarHBondContact O-N 2.69Å; E1314-K1316 PolarHBondContact O-N 2.99Å; E1314-A1317 WeakPolarHBondContact O-CB 3.42Å; E1314-A1317 PolarHBondContact O-N 3.01Å; E1314-A1317 VanDerWaalsContact O-N 3.15Å; E1314-L1318 WeakPolarHBondContact O-CG 3.29Å; E1314-L1318 PolarHBondContact O-N 3.42Å
1315	N	84.3	Confident	87.5	Confident	102 Å²	102	88.9 Å²	88.9	55%	0.545	49%	0.485	S	S	.	.	H	α-helix	trans	-60.6	-33.9	175.3	-83.6	-70.8	0	0	0	112.4	L1311 S1319	L1311-N1315 WeakPolarHBondContact O-CB 3.35Å; L1311-N1315 PolarHBondContact O-N 3.34Å; L1311-N1315 PolarHBondContact O-ND2 3.3Å; N1315-S1319 VanDerWaalsContact O-CB 3.29Å; N1315-S1319 WeakPolarHBondContact O-CB 3.47Å; N1315-S1319 PolarHBondContact O-N 2.94Å
1316	K	88.5	Confident	87.6	Confident	132 Å²	132	89.8 Å²	89.8	57%	0.574	49%	0.488	S	S	*	.	H	α-helix	trans	-70.9	-37.1	175.9	-176	-179.1	174.4	-170.3	0	112.2	N1312 D1313 E1314 N1320	N1312-K1316 VanDerWaalsContact O-CB 3.32Å; N1312-K1316 WeakPolarHBondContact O-CB 3.49Å; N1312-K1316 PolarHBondContact O-N 3.12Å; D1313-K1316 WeakPolarHBondContact O-CB 3.32Å; D1313-K1316 PolarHBondContact O-N 3.15Å; E1314-K1316 PolarHBondContact O-N 2.99Å; K1316-N1320 VanDerWaalsContact O-CG 3.32Å; K1316-N1320 PolarHBondContact O-N 3.42Å; K1316-N1320 PolarHBondContact O-ND2 2.97Å
1317	A	88.2	Confident	87.6	Confident	47 Å²	47	91.4 Å²	91.4	39%	0.388	49%	0.485	S	S	.	.	H	α-helix	trans	-63.6	-52	172	0	0	0	0	0	111.3	D1313 E1314 S1319 N1320 E1321	D1313-A1317 PolarHBondContact O-N 3.29Å; E1314-A1317 WeakPolarHBondContact O-CB 3.42Å; E1314-A1317 PolarHBondContact O-N 3.01Å; E1314-A1317 VanDerWaalsContact O-N 3.15Å; A1317-S1319 VanDerWaalsContact C-N 3.27Å; A1317-S1319 PolarHBondContact O-N 2.92Å; A1317-N1320 WeakPolarHBondContact O-CA 3.31Å; A1317-N1320 WeakPolarHBondContact O-CB 3.47Å; A1317-N1320 PolarHBondContact O-N 2.99Å; A1317-E1321 PolarHBondContact O-N 3.17Å
1318	L	87.3	Confident	87.5	Confident	100 Å²	100	95.3 Å²	95.3	52%	0.524	50%	0.503	S	S	.	.	H	α-helix	trans	-58.6	-35.9	177.4	-69	168.6	0	0	0	112.7	E1314 N1320 E1321 L1322	E1314-L1318 WeakPolarHBondContact O-CG 3.29Å; E1314-L1318 PolarHBondContact O-N 3.42Å; L1318-N1320 VanDerWaalsContact C-N 3.34Å; L1318-E1321 PolarHBondContact O-N 3.24Å; L1318-L1322 VanDerWaalsContact O-CB 3.31Å; L1318-L1322 WeakPolarHBondContact O-CB 3.39Å; L1318-L1322 PolarHBondContact O-N 3.26Å
1319	S	86.3	Confident	87.5	Confident	78 Å²	78	96.6 Å²	96.6	55%	0.545	51%	0.507	S	S	.	.	H	α-helix	trans	-65.3	-35	174.4	-170.7	0	0	0	0	112.7	N1315 A1317 K1323	N1315-S1319 VanDerWaalsContact O-CB 3.29Å; N1315-S1319 WeakPolarHBondContact O-CB 3.47Å; N1315-S1319 PolarHBondContact O-N 2.94Å; A1317-S1319 VanDerWaalsContact C-N 3.27Å; A1317-S1319 PolarHBondContact O-N 2.92Å; S1319-K1323 WeakPolarHBondContact O-CB 3.47Å; S1319-K1323 PolarHBondContact O-N 3.32Å; S1319-K1323 VanDerWaalsContact O-N 3.14Å
1320	N	88.9	Confident	87.4	Confident	101 Å²	101	98.4 Å²	98.4	54%	0.54	51%	0.507	S	S	.	.	H	α-helix	trans	-72.5	-41.6	174.3	-66	-33.2	0	0	0	111.8	K1316 A1317 L1318 K1323 A1324	K1316-N1320 VanDerWaalsContact O-CG 3.32Å; K1316-N1320 PolarHBondContact O-N 3.42Å; K1316-N1320 PolarHBondContact O-ND2 2.97Å; A1317-N1320 WeakPolarHBondContact O-CA 3.31Å; A1317-N1320 WeakPolarHBondContact O-CB 3.47Å; A1317-N1320 PolarHBondContact O-N 2.99Å; L1318-N1320 VanDerWaalsContact C-N 3.34Å; N1320-K1323 WeakPolarHBondContact O-CB 3.45Å; N1320-K1323 PolarHBondContact O-N 3.21Å; N1320-A1324 PolarHBondContact O-N 2.86Å
1321	E	88.9	Confident	87	Confident	122 Å²	122	99.5 Å²	99.5	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-61.3	-45	174.9	-69.4	178.4	173.6	0	0	111.5	A1317 L1318 K1323 A1324 A1325	A1317-E1321 PolarHBondContact O-N 3.17Å; L1318-E1321 PolarHBondContact O-N 3.24Å; E1321-K1323 PolarHBondContact O-N 3.25Å; E1321-A1324 PolarHBondContact O-N 3.13Å; E1321-A1324 VanDerWaalsContact O-N 3.13Å; E1321-A1325 WeakPolarHBondContact O-CB 3.34Å; E1321-A1325 PolarHBondContact O-N 3.43Å
1322	L	85.5	Confident	86.9	Confident	131 Å²	131	101.5 Å²	101.5	69%	0.686	52%	0.523	S	S	*	.	H	α-helix	trans	-65	-28.8	176.8	-170.6	145.8	0	0	0	112.4	L1318 K1326	L1318-L1322 VanDerWaalsContact O-CB 3.31Å; L1318-L1322 WeakPolarHBondContact O-CB 3.39Å; L1318-L1322 PolarHBondContact O-N 3.26Å; L1322-K1326 WeakPolarHBondContact O-CB 3.47Å; L1322-K1326 PolarHBondContact O-N 3.14Å
1323	K	86.8	Confident	86.7	Confident	110 Å²	110	99.9 Å²	99.9	48%	0.478	52%	0.517	S	S	.	.	H	α-helix	trans	-71.7	-43.9	170.3	-178.1	179.9	173.1	-63.5	0	111.8	S1319 N1320 E1321 K1326 E1327	S1319-K1323 WeakPolarHBondContact O-CB 3.47Å; S1319-K1323 PolarHBondContact O-N 3.32Å; S1319-K1323 VanDerWaalsContact O-N 3.14Å; N1320-K1323 WeakPolarHBondContact O-CB 3.45Å; N1320-K1323 PolarHBondContact O-N 3.21Å; E1321-K1323 PolarHBondContact O-N 3.25Å; K1323-K1326 WeakPolarHBondContact O-CB 3.47Å; K1323-K1326 PolarHBondContact O-N 2.99Å; K1323-E1327 VanDerWaalsContact CE-OE1 3.27Å; K1323-E1327 WeakPolarHBondContact CE-OE1 3.46Å; K1323-E1327 VanDerWaalsContact NZ-CD 3.29Å; K1323-E1327 IonicContact NZ-OE1 2.61Å; K1323-E1327 PolarHBondContact NZ-OE1 3.17Å; K1323-E1327 IonicContact NZ-OE2 3.17Å; K1323-E1327 PolarHBondContact NZ-OE2 2.61Å; K1323-E1327 VanDerWaalsContact NZ-OE2 3.17Å; K1323-E1327 PolarHBondContact O-N 3.31Å
1324	A	88.5	Confident	86.2	Confident	48 Å²	48	102 Å²	102	40%	0.397	52%	0.523	S	S	.	.	H	α-helix	trans	-62.7	-49.6	177.3	0	0	0	0	0	111.7	N1320 E1321 K1326 E1327 E1328	N1320-A1324 PolarHBondContact O-N 2.86Å; E1321-A1324 PolarHBondContact O-N 3.13Å; E1321-A1324 VanDerWaalsContact O-N 3.13Å; A1324-K1326 PolarHBondContact O-N 2.95Å; A1324-E1327 CarbonylContact O-C 3.58Å; A1324-E1327 WeakPolarHBondContact O-CA 3.49Å; A1324-E1327 WeakPolarHBondContact O-CB 3.49Å; A1324-E1327 PolarHBondContact O-N 2.96Å; A1324-E1328 PolarHBondContact O-N 2.9Å
1325	A	86.6	Confident	85.9	Confident	53 Å²	53	104 Å²	104	44%	0.438	53%	0.527	S	S	.	.	H	α-helix	trans	-60.4	-30.7	176.5	0	0	0	0	0	112.8	E1321 L1329	E1321-A1325 WeakPolarHBondContact O-CB 3.34Å; E1321-A1325 PolarHBondContact O-N 3.43Å; A1325-L1329 VanDerWaalsContact O-CB 3.31Å; A1325-L1329 WeakPolarHBondContact O-CB 3.34Å; A1325-L1329 PolarHBondContact O-N 3.17Å
1326	K	87.9	Confident	85.7	Confident	125 Å²	125	104.3 Å²	104.3	54%	0.543	52%	0.524	S	S	.	.	H	α-helix	trans	-70.3	-39.3	171.8	-179.6	-175.3	173.5	-171.4	0	112.2	L1322 K1323 A1324 L1329 Q1330	L1322-K1326 WeakPolarHBondContact O-CB 3.47Å; L1322-K1326 PolarHBondContact O-N 3.14Å; K1323-K1326 WeakPolarHBondContact O-CB 3.47Å; K1323-K1326 PolarHBondContact O-N 2.99Å; A1324-K1326 PolarHBondContact O-N 2.95Å; K1326-L1329 PolarHBondContact O-N 3.38Å; K1326-Q1330 WeakPolarHBondContact O-CB 3.31Å; K1326-Q1330 WeakPolarHBondContact O-CG 3.34Å; K1326-Q1330 PolarHBondContact O-N 3.22Å
1327	E	87.9	Confident	85	Confident	94 Å²	94	102.7 Å²	102.7	44%	0.439	52%	0.518	S	S	.	.	H	α-helix	trans	-68.9	-39.9	177.2	-77	163.9	-170.8	0	0	111	K1323 A1324 Q1330 H1331	K1323-E1327 VanDerWaalsContact CE-OE1 3.27Å; K1323-E1327 WeakPolarHBondContact CE-OE1 3.46Å; K1323-E1327 VanDerWaalsContact NZ-CD 3.29Å; K1323-E1327 IonicContact NZ-OE1 2.61Å; K1323-E1327 PolarHBondContact NZ-OE1 3.17Å; K1323-E1327 IonicContact NZ-OE2 3.17Å; K1323-E1327 PolarHBondContact NZ-OE2 2.61Å; K1323-E1327 VanDerWaalsContact NZ-OE2 3.17Å; K1323-E1327 PolarHBondContact O-N 3.31Å; A1324-E1327 CarbonylContact O-C 3.58Å; A1324-E1327 WeakPolarHBondContact O-CA 3.49Å; A1324-E1327 WeakPolarHBondContact O-CB 3.49Å; A1324-E1327 PolarHBondContact O-N 2.96Å; E1327-Q1330 PolarHBondContact O-N 3.02Å; E1327-H1331 PolarHBondContact O-N 2.87Å
1328	E	86.9	Confident	84.1	Confident	143 Å²	143	104 Å²	104	67%	0.668	52%	0.524	S	S	*	.	H	α-helix	trans	-60.4	-46.5	169.2	-70.4	-176.9	163.1	0	0	112.3	A1324 Q1330 H1331 F1332	A1324-E1328 PolarHBondContact O-N 2.9Å; E1328-Q1330 VanDerWaalsContact C-N 3.29Å; E1328-Q1330 PolarHBondContact O-N 2.69Å; E1328-H1331 PolarHBondContact O-N 2.94Å; E1328-F1332 WeakPolarHBondContact O-CB 3.27Å; E1328-F1332 PolarHBondContact O-N 2.81Å
1329	L	85.5	Confident	83.2	Confident	112 Å²	112	101.5 Å²	101.5	59%	0.586	51%	0.514	S	S	*	.	H	α-helix	trans	-63.5	-35.2	177.7	-172.6	67.3	0	0	0	111.9	A1325 K1326 T1333	A1325-L1329 VanDerWaalsContact O-CB 3.31Å; A1325-L1329 WeakPolarHBondContact O-CB 3.34Å; A1325-L1329 PolarHBondContact O-N 3.17Å; K1326-L1329 PolarHBondContact O-N 3.38Å; L1329-T1333 WeakPolarHBondContact O-CB 3.47Å; L1329-T1333 PolarHBondContact O-N 2.9Å; L1329-T1333 PolarHBondContact O-OG1 3.35Å
1330	Q	85.1	Confident	82.1	Confident	105 Å²	105	102 Å²	102	49%	0.491	51%	0.513	S	S	.	.	H	α-helix	trans	-67.7	-41.9	172.8	-76.7	-176.9	-40.8	0	0	112	K1326 E1327 E1328 T1333 Q1334	K1326-Q1330 WeakPolarHBondContact O-CB 3.31Å; K1326-Q1330 WeakPolarHBondContact O-CG 3.34Å; K1326-Q1330 PolarHBondContact O-N 3.22Å; E1327-Q1330 PolarHBondContact O-N 3.02Å; E1328-Q1330 VanDerWaalsContact C-N 3.29Å; E1328-Q1330 PolarHBondContact O-N 2.69Å; Q1330-T1333 PolarHBondContact O-N 2.86Å; Q1330-Q1334 WeakPolarHBondContact O-CG 3.26Å; Q1330-Q1334 PolarHBondContact O-N 3.32Å
1331	H	83.4	Confident	80.6	Confident	132 Å²	132	104.1 Å²	104.1	61%	0.611	52%	0.52	S	S	*	.	H	α-helix	trans	-64.8	-44.1	175.8	-169.3	-97.4	0	0	0	111.8	E1327 E1328 T1333 Q1334 W1335	E1327-H1331 PolarHBondContact O-N 2.87Å; E1328-H1331 PolarHBondContact O-N 2.94Å; H1331-T1333 VanDerWaalsContact C-N 3.33Å; H1331-T1333 PolarHBondContact O-N 3.27Å; H1331-Q1334 PolarHBondContact O-N 3.44Å; H1331-W1335 WeakPolarHBondContact O-CB 3.39Å; H1331-W1335 PolarHBondContact O-N 3.29Å
1332	F	84	Confident	79.1	Confident	115 Å²	115	102.8 Å²	102.8	50%	0.504	52%	0.516	S	S	.	.	H	α-helix	trans	-60.4	-40.9	172.7	180	-97.2	0	0	0	111.9	E1328 W1335 F1336	E1328-F1332 WeakPolarHBondContact O-CB 3.27Å; E1328-F1332 PolarHBondContact O-N 2.81Å; F1332-W1335 HydrophobicContact CD2-CE3 4.11Å; F1332-W1335 HydrophobicContact CD2-CZ3 4.44Å; F1332-W1335 AromaticContact CE2-CE3 3.98Å; F1332-W1335 HydrophobicContact CE2-CE3 3.98Å; F1332-W1335 AromaticContact CE2-CZ3 3.87Å; F1332-W1335 HydrophobicContact CE2-CZ3 3.87Å; F1332-W1335 HydrophobicContact CZ-CZ3 4.49Å; F1332-W1335 PolarHBondContact O-N 2.83Å; F1332-F1336 VanDerWaalsContact O-CB 3.26Å; F1332-F1336 WeakPolarHBondContact O-CB 3.48Å; F1332-F1336 PolarHBondContact O-N 3.44Å
1333	T	82.7	Confident	77.7	Confident	67 Å²	67	101.1 Å²	101.1	41%	0.411	51%	0.514	S	S	.	.	H	α-helix	trans	-64.3	-42.6	176.2	-58	0	0	0	0	111.5	L1329 Q1330 H1331 F1336 H1337	L1329-T1333 WeakPolarHBondContact O-CB 3.47Å; L1329-T1333 PolarHBondContact O-N 2.9Å; L1329-T1333 PolarHBondContact O-OG1 3.35Å; Q1330-T1333 PolarHBondContact O-N 2.86Å; H1331-T1333 VanDerWaalsContact C-N 3.33Å; H1331-T1333 PolarHBondContact O-N 3.27Å; T1333-F1336 PolarHBondContact O-N 2.91Å; T1333-H1337 PolarHBondContact O-CD2 3Å; T1333-H1337 PolarHBondContact O-N 2.93Å
1334	Q	79.1	Confident	76.2	Confident	138 Å²	138	102.3 Å²	102.3	65%	0.645	52%	0.522	S	S	*	.	H	α-helix	trans	-65.3	-44.2	175.7	-76.2	-177.1	-20.6	0	0	112.3	Q1330 H1331 F1336 H1337 S1338	Q1330-Q1334 WeakPolarHBondContact O-CG 3.26Å; Q1330-Q1334 PolarHBondContact O-N 3.32Å; H1331-Q1334 PolarHBondContact O-N 3.44Å; Q1334-F1336 VanDerWaalsContact C-N 3.35Å; Q1334-H1337 PolarHBondContact O-N 3.39Å; Q1334-S1338 PolarHBondContact O-N 3.44Å; Q1334-S1338 PolarHBondContact O-OG 3.14Å
1335	W	81.9	Confident	74.5	Confident	129 Å²	129	103.2 Å²	103.2	49%	0.489	53%	0.53	S	S	.	.	H	α-helix	trans	-61.8	-41.2	175	174.1	82	0	0	0	112.1	H1331 F1332 S1338 T1339	H1331-W1335 WeakPolarHBondContact O-CB 3.39Å; H1331-W1335 PolarHBondContact O-N 3.29Å; F1332-W1335 HydrophobicContact CD2-CE3 4.11Å; F1332-W1335 HydrophobicContact CD2-CZ3 4.44Å; F1332-W1335 AromaticContact CE2-CE3 3.98Å; F1332-W1335 HydrophobicContact CE2-CE3 3.98Å; F1332-W1335 AromaticContact CE2-CZ3 3.87Å; F1332-W1335 HydrophobicContact CE2-CZ3 3.87Å; F1332-W1335 HydrophobicContact CZ-CZ3 4.49Å; F1332-W1335 PolarHBondContact O-N 2.83Å; W1335-S1338 PolarHBondContact O-N 3.35Å; W1335-S1338 PolarHBondContact O-OG 3.23Å; W1335-S1338 VanDerWaalsContact O-OG 3.14Å; W1335-T1339 HydrophobicContact CZ2-CG2 4.43Å; W1335-T1339 PolarHBondContact NE1-OG1 2.75Å; W1335-T1339 WeakPolarHBondContact O-CB 3.22Å; W1335-T1339 PolarHBondContact O-N 2.95Å; W1335-T1339 PolarHBondContact O-OG1 2.92Å
1336	F	79.5	Confident	72.7	Confident	109 Å²	109	108.9 Å²	108.9	48%	0.478	54%	0.541	S	S	.	.	H	α-helix	trans	-63.2	-45.9	176.3	-174.7	-93.2	0	0	0	111.1	F1332 T1333 Q1334 V1340	F1332-F1336 VanDerWaalsContact O-CB 3.26Å; F1332-F1336 WeakPolarHBondContact O-CB 3.48Å; F1332-F1336 PolarHBondContact O-N 3.44Å; T1333-F1336 PolarHBondContact O-N 2.91Å; Q1334-F1336 VanDerWaalsContact C-N 3.35Å; F1336-V1340 HydrophobicContact CD1-CG2 4.26Å; F1336-V1340 HydrophobicContact CD2-CG2 4.3Å; F1336-V1340 HydrophobicContact CE1-CG2 4.02Å; F1336-V1340 HydrophobicContact CE2-CG2 4.06Å; F1336-V1340 HydrophobicContact CG-CG2 4.39Å; F1336-V1340 HydrophobicContact CZ-CG2 3.92Å; F1336-V1340 VanDerWaalsContact O-CB 3.26Å; F1336-V1340 WeakPolarHBondContact O-CB 3.22Å; F1336-V1340 VanDerWaalsContact O-CG2 3.22Å; F1336-V1340 WeakPolarHBondContact O-CG2 3.26Å; F1336-V1340 PolarHBondContact O-N 2.73Å
1337	H	74.6	Confident	70.8	Confident	97 Å²	97	109.1 Å²	109.1	45%	0.449	55%	0.548	S	S	.	.	H	α-helix	trans	-61	-49.8	174.8	-90.6	-84.5	0	0	0	112.4	T1333 Q1334 T1339 V1340 E1341	T1333-H1337 PolarHBondContact O-CD2 3Å; T1333-H1337 PolarHBondContact O-N 2.93Å; Q1334-H1337 PolarHBondContact O-N 3.39Å; H1337-T1339 VanDerWaalsContact C-N 3.33Å; H1337-T1339 PolarHBondContact O-N 3.47Å; H1337-V1340 PolarHBondContact O-N 2.9Å; H1337-E1341 IonicContact CE1-OE1 3.67Å; H1337-E1341 IonicContact CG-OE1 3.76Å; H1337-E1341 IonicContact ND1-OE1 2.75Å; H1337-E1341 PolarHBondContact ND1-OE1 3.33Å; H1337-E1341 VanDerWaalsContact O-CB 3.26Å; H1337-E1341 WeakPolarHBondContact O-CB 3.37Å; H1337-E1341 WeakPolarHBondContact O-CG 3.26Å; H1337-E1341 PolarHBondContact O-N 3.4Å
1338	S	69.4	Low	68.5	Low	74 Å²	74	113.4 Å²	113.4	52%	0.517	57%	0.568	S	S	.	*	H	α-helix	trans	-64.8	-35.5	-179	63	0	0	0	0	113.3	Q1334 W1335 N1342	Q1334-S1338 PolarHBondContact O-N 3.44Å; Q1334-S1338 PolarHBondContact O-OG 3.14Å; W1335-S1338 PolarHBondContact O-N 3.35Å; W1335-S1338 PolarHBondContact O-OG 3.23Å; W1335-S1338 VanDerWaalsContact O-OG 3.14Å; S1338-N1342 PolarHBondContact O-N 3.44Å
1339	T	66.8	Low	66.2	Low	49 Å²	49	114.2 Å²	114.2	30%	0.301	57%	0.572	S	S	.	*	H	α-helix	trans	-74.9	-37.6	178.7	-53.8	0	0	0	0	112.2	W1335 H1337	W1335-T1339 HydrophobicContact CZ2-CG2 4.43Å; W1335-T1339 PolarHBondContact NE1-OG1 2.75Å; W1335-T1339 WeakPolarHBondContact O-CB 3.22Å; W1335-T1339 PolarHBondContact O-N 2.95Å; W1335-T1339 PolarHBondContact O-OG1 2.92Å; H1337-T1339 VanDerWaalsContact C-N 3.33Å; H1337-T1339 PolarHBondContact O-N 3.47Å
1340	V	64.2	Low	64.1	Low	89 Å²	89	114.8 Å²	114.8	54%	0.539	58%	0.582	S	S	.	*	H	α-helix	trans	-81.1	-33.4	-179	173.8	0	0	0	0	112.5	F1336 H1337	F1336-V1340 HydrophobicContact CD1-CG2 4.26Å; F1336-V1340 HydrophobicContact CD2-CG2 4.3Å; F1336-V1340 HydrophobicContact CE1-CG2 4.02Å; F1336-V1340 HydrophobicContact CE2-CG2 4.06Å; F1336-V1340 HydrophobicContact CG-CG2 4.39Å; F1336-V1340 HydrophobicContact CZ-CG2 3.92Å; F1336-V1340 VanDerWaalsContact O-CB 3.26Å; F1336-V1340 WeakPolarHBondContact O-CB 3.22Å; F1336-V1340 VanDerWaalsContact O-CG2 3.22Å; F1336-V1340 WeakPolarHBondContact O-CG2 3.26Å; F1336-V1340 PolarHBondContact O-N 2.73Å; H1337-V1340 PolarHBondContact O-N 2.9Å
1341	E	58.3	Low	62	Low	145 Å²	145	116.1 Å²	116.1	68%	0.678	60%	0.597	S	S	*	*	H	α-helix	trans	-81.4	-18.2	179.2	-67.7	176.4	-156	0	0	113.2	H1337	H1337-E1341 IonicContact CE1-OE1 3.67Å; H1337-E1341 IonicContact CG-OE1 3.76Å; H1337-E1341 IonicContact ND1-OE1 2.75Å; H1337-E1341 PolarHBondContact ND1-OE1 3.33Å; H1337-E1341 VanDerWaalsContact O-CB 3.26Å; H1337-E1341 WeakPolarHBondContact O-CB 3.37Å; H1337-E1341 WeakPolarHBondContact O-CG 3.26Å; H1337-E1341 PolarHBondContact O-N 3.4Å
1342	N	56.1	Low	59.8	Low	93 Å²	93	116.7 Å²	116.7	50%	0.497	60%	0.604	S	S	.	*			trans	-141.7	66.6	176.8	-162.5	-1.2	0	0	0	114.6	S1338 M1344 A1345	S1338-N1342 PolarHBondContact O-N 3.44Å; N1342-M1344 PolarHBondContact O-N 3.16Å; N1342-A1345 WeakPolarHBondContact O-CB 3.48Å; N1342-A1345 PolarHBondContact O-N 3Å; N1342-A1345 VanDerWaalsContact O-N 3.16Å
1343	P	56.5	Low	57.7	Low	97 Å²	97	119.2 Å²	119.2	63%	0.63	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-5.9	-179.1	27.7	-36.5	0	0	0	114.9
1344	M	54.5	Low	55.4	Low	134 Å²	134	122.3 Å²	122.3	66%	0.66	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-13.2	175.9	-68.7	-61.3	-60.7	0	0	113.4	N1342 Y1346 L1347	N1342-M1344 PolarHBondContact O-N 3.16Å; M1344-Y1346 PolarHBondContact O-N 3.49Å; M1344-L1347 HydrophobicContact CE-CD1 3.97Å; M1344-L1347 PolarHBondContact O-N 3.22Å; M1344-L1347 HydrophobicContact SD-CD1 3.93Å
1345	A	53.3	Low	53.4	Low	68 Å²	68	124.6 Å²	124.6	56%	0.562	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-17.2	-175.3	0	0	0	0	0	114.6	N1342	N1342-A1345 WeakPolarHBondContact O-CB 3.48Å; N1342-A1345 PolarHBondContact O-N 3Å; N1342-A1345 VanDerWaalsContact O-N 3.16Å
1346	Y	49.9	Very low	51.2	Low	171 Å²	171	131.5 Å²	131.5	67%	0.671	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	11.8	-176.5	-90.5	-80.7	0	0	0	114.9	M1344 Q1348	M1344-Y1346 PolarHBondContact O-N 3.49Å; Y1346-Q1348 VanDerWaalsContact C-N 3.33Å
1347	L	46.9	Very low	49.8	Very low	130 Å²	130	132.6 Å²	132.6	68%	0.681	70%	0.695	S	S	*	*	S	Bend	trans	-92.5	18.5	175.7	-73.8	173.9	0	0	0	114.1	M1344	M1344-L1347 HydrophobicContact CE-CD1 3.97Å; M1344-L1347 PolarHBondContact O-N 3.22Å; M1344-L1347 HydrophobicContact SD-CD1 3.93Å
1348	Q	39.6	Very low	48.5	Very low	185 Å²	185	134.5 Å²	134.5	86%	0.864	71%	0.708	S	S	*	*			trans	-140.4	58.9	174.1	-70.2	-166.2	-19.7	0	0	112.9	Y1346	Y1346-Q1348 VanDerWaalsContact C-N 3.33Å
1349	E	39	Very low	47.4	Very low	160 Å²	160	137.8 Å²	137.8	75%	0.748	72%	0.719	S	S	*	*			trans	-92.4	120.7	156.9	-75.8	-166.9	159.2	0	0	110.4
1350	P	41.7	Very low	46.2	Very low	124 Å²	124	143.1 Å²	143.1	81%	0.805	74%	0.743	S	S	*	*			trans	-81.1	121.5	169.8	31.6	-30.8	0	0	0	110.7
1351	V	41.7	Very low	45.1	Very low	132 Å²	132	146.4 Å²	146.4	80%	0.8	76%	0.756	S	S	*	*			trans	5	112.7	159.8	-174.8	0	0	0	0	117
1352	L	36.3	Very low	44.2	Very low	145 Å²	145	146.5 Å²	146.5	76%	0.759	76%	0.761	S	S	*	*			trans	20.3	123.4	140.5	-68	162.9	0	0	0	118.4
1353	N	40.2	Very low	43.4	Very low	167 Å²	167	150.4 Å²	150.4	89%	0.893	78%	0.78	S	S	*	*			trans	-146	108.1	140.9	-109.3	-21.5	0	0	0	109.4
1354	D	35.2	Very low	42.3	Very low	132 Å²	132	154.5 Å²	154.5	71%	0.706	79%	0.792	S	S	*	*			trans	-67.6	138.3	164.7	-70	-65.8	0	0	0	110
1355	H	37	Very low	41.3	Very low	187 Å²	187	156.2 Å²	156.2	87%	0.866	80%	0.803	S	S	*	*			trans	153.8	82.8	144	-78.6	-29.6	0	0	0	112.9
1356	Q	35.5	Very low	40.3	Very low	273 Å²	273	164.2 Å²	164.2	100%	1.276	82%	0.824	S	S	*	*				-167.9	0	125.3	-109.1	177.5	-3.1	0	0	112.1

Retrieved 1,356 of 1,356 residues in 681.1 ms (Link to these results)

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