A0A087XAQ4_POEFO Loading...

Oxysterol-binding protein

AlphaFold DB , UniProt , Accession A0A087XAQ4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 922 aa.

						>A0A087XAQ4_POEFO|A0A087XAQ4
MESSSESQLEPETTLHHAELREHHAASGAITSSDDPILLTPGRMSQRQVKERDKEKEKEKEKEAGLQTPNREHIATPSNLSPGVSYTHGFERVKEDLLPLPLKEDSNSISKSKSETKLYNGSDKDVPASGGKLTKKESLKVQKKNYREEKKRATKELLSTITDPSVIVMADWLKIRGTLKSWTKLWCVLKPGVLLIYKTNKNGQWVGTVLLNACELIERPSKKDGFCFKLFHPLEQSIWAVKGPKGEAVGSITQPLPSSHLIFRAASESDGRCWMDALELALKCSSLLKRTMIREGKEDMSTMSTGGEHSINFYSLLRAHNMQGFQFNDGDHLKDPDLYSDKSDREGEQDHEESDPEGLEKSEESDSDTSERQDDSYIEMDPNEHLRETPYMEQSHEELGEAGEAAQTETVSEENKSLIWTLLKQVRPGMDLSKVVLPTFVLEPRSFLDKLSDYYYHADFLSEAAIEENAYNRMKKVVKWYISGFYKKPKGLKKPYNPIIGETYRCMWLHQKTNSKTFYIAEQVSHHPPVSAFYVSNRKDGFCLSGSILAKSKFYGNSLSAILDGEARLTFLNRGEDYVMNMPYAHCKGILYGTMTLELGGQITIACEKTGYSSQLEFKLKPFLGSSDCVNQISGKIKLGKEVLATLEGHWDSEIFINDKKTGTMDTFWDPTPELRQNRLTRYTVPPEEQGDFESERLWQHVTRAINNKDQTEATNEKFILEEAQRKAARERKTKCEDWIPALFEQDPITGEWHYRYADTRPWDPLNDLIQFEKDGCIQTKVRHRTPMVRSGSLISLSNQGPRRDNCKCQVTVPKRTHKSDNPKSLESGCSSPEPDHHDSSGSERHKSKHNCRLRKKGADLSELQSAINSIKQTQEDINRNVVALRMRSESRAENTSFLQQRDYVIIACLVVLQVLINYIFK
					

Structure Viewer

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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	28.8	Very low	34.6	Very low	219 Å²	219	140.7 Å²	140.7	100%	1.079	77%	0.774	S	S	*	*				0	67.7	0	-58.9	175.9	-174.9	0	0	107.9
2	E	31.1	Very low	34.2	Very low	174 Å²	174	142.5 Å²	142.5	81%	0.813	77%	0.772	S	S	*	*				79.1	137.3	54.5	-67.9	153.7	126.3	0	0	112.6
3	S	33.8	Very low	33.8	Very low	100 Å²	100	140 Å²	140	70%	0.699	77%	0.765	S	S	*	*			cis	-172.5	157.2	-5.3	48	0	0	0	0	113.4
4	S	36.1	Very low	33.4	Very low	112 Å²	112	138.5 Å²	138.5	78%	0.783	76%	0.762	S	S	*	*			trans	71.5	155.1	152.4	-52.9	0	0	0	0	118.5
5	S	38.2	Very low	33.2	Very low	98 Å²	98	138.9 Å²	138.9	69%	0.685	76%	0.762	S	S	*	*			cis	-142.7	125.6	5.3	51.8	0	0	0	0	110.8
6	E	40.7	Very low	32.9	Very low	171 Å²	171	138.8 Å²	138.8	80%	0.799	75%	0.754	S	S	*	*				72.6	147.9	100.3	-62.2	-171.6	116.5	0	0	115.6
7	S	30.1	Very low	32.7	Very low	101 Å²	101	139.9 Å²	139.9	71%	0.706	75%	0.753	S	S	*	*			cis	-155.2	151.6	23	60.1	0	0	0	0	115.7
8	Q	31.9	Very low	32.5	Very low	161 Å²	161	136.4 Å²	136.4	75%	0.752	75%	0.746	S	S	*	*				25.6	151.5	128.6	-58.2	-172.5	18.3	0	0	121.8
9	L	30.4	Very low	32.3	Very low	150 Å²	150	137.9 Å²	137.9	79%	0.785	75%	0.748	S	S	*	*			cis	-170.5	171.8	-19.5	-136.1	137.1	0	0	0	109.1
10	E	29.3	Very low	32.1	Very low	161 Å²	161	137.7 Å²	137.7	75%	0.752	75%	0.745	S	S	*	*			trans	-35.1	164	173.3	-73.9	-94.5	151.4	0	0	118.7
11	P	50.7	Low	31.9	Very low	101 Å²	101	138.8 Å²	138.8	66%	0.656	74%	0.738	S	S	*	*			cis	-156.2	-171.1	39	43.1	-19.2	0	0	0	121.1
12	E	29.1	Very low	31.9	Very low	162 Å²	162	134.9 Å²	134.9	76%	0.757	72%	0.718	S	S	*	*			trans	101.4	108.4	134.5	-97.1	174.4	-172	0	0	126
13	T	29.2	Very low	31.9	Very low	110 Å²	110	132.4 Å²	132.4	68%	0.675	71%	0.706	S	S	*	*			trans	68.1	99.1	130.5	48.9	0	0	0	0	126.6
14	T	28.6	Very low	31.7	Very low	119 Å²	119	135.9 Å²	135.9	73%	0.73	71%	0.711	S	S	*	*				52	154.1	111.7	59.1	0	0	0	0	126.4
15	L	29.6	Very low	31.2	Very low	145 Å²	145	135.8 Å²	135.8	76%	0.759	72%	0.716	S	S	*	*			trans	91.1	144.5	163.6	-60.5	169.7	0	0	0	116.7
16	H	29.6	Very low	30.7	Very low	137 Å²	137	135.6 Å²	135.6	63%	0.634	72%	0.721	S	S	*	*			cis	-153.8	150.2	11.2	-123.3	-63.6	0	0	0	112.6
17	H	28.7	Very low	30.3	Very low	157 Å²	157	133.7 Å²	133.7	73%	0.727	73%	0.726	S	S	*	*			trans	60.2	142.1	164.7	-66.1	-67.8	0	0	0	119.7
18	A	29.4	Very low	30.2	Very low	77 Å²	77	132.8 Å²	132.8	64%	0.636	73%	0.733	S	S	*	*			cis	84.6	140.9	33.1	0	0	0	0	0	113.7
19	E	28	Very low	30.3	Very low	166 Å²	166	129.7 Å²	129.7	78%	0.776	74%	0.735	S	S	*	*			cis	-162.5	155.1	10.3	-134.6	173.5	158.5	0	0	115.3
20	L	28.8	Very low	30.1	Very low	132 Å²	132	130.8 Å²	130.8	69%	0.691	74%	0.74	S	S	*	*			trans	29.9	138.2	148.4	-70.7	168.1	0	0	0	126.6
21	R	28.8	Very low	29.9	Very low	162 Å²	162	128.5 Å²	128.5	61%	0.611	74%	0.737	S	S	*	*			trans	72.3	173	138.6	-70.3	-178.9	90.2	-107.9	-8.3	117.2	H23	R21-H23 PolarHBondContact NH2-CD2 2.69Å; R21-H23 PolarHBondContact NH2-NE2 2.71Å; R21-H23 VanDerWaalsContact NH2-NE2 3.14Å
22	E	28.8	Very low	28.7	Very low	137 Å²	137	128.8 Å²	128.8	64%	0.64	74%	0.741	S	S	*	*			cis	-131.5	-149.5	20.6	-122.4	-74.3	161.1	0	0	112.9
23	H	29.9	Very low	28.6	Very low	122 Å²	122	125.4 Å²	125.4	57%	0.565	74%	0.736	S	S	*	*			trans	-125.3	172	-160.9	-73.9	-87.8	0	0	0	118.2	R21	R21-H23 PolarHBondContact NH2-CD2 2.69Å; R21-H23 PolarHBondContact NH2-NE2 2.71Å; R21-H23 VanDerWaalsContact NH2-NE2 3.14Å
24	H	29.1	Very low	28.5	Very low	173 Å²	173	127.5 Å²	127.5	80%	0.801	74%	0.743	S	S	*	*			trans	-9	140.2	156.7	-42.4	-69.4	0	0	0	121.3
25	A	26.9	Very low	28.5	Very low	109 Å²	109	129.3 Å²	129.3	90%	0.901	75%	0.748	S	S	*	*			trans	-149.9	169.6	133.1	0	0	0	0	0	109.4
26	A	27.9	Very low	29.5	Very low	95 Å²	95	127.4 Å²	127.4	79%	0.785	74%	0.744	S	S	*	*			trans	-134.6	158.9	-167.9	0	0	0	0	0	114.8
27	S	32	Very low	29.5	Very low	130 Å²	130	128.1 Å²	128.1	91%	0.909	75%	0.751	S	S	*	*			trans	48.2	116.9	149.8	-164.2	0	0	0	0	119.9
28	G	27	Very low	29.7	Very low	83 Å²	83	127.7 Å²	127.7	86%	0.856	75%	0.753	S	S	*	*			trans	-168	120.1	162.1	0	0	0	0	0	112.1
29	A	33.6	Very low	29.6	Very low	95 Å²	95	131.4 Å²	131.4	79%	0.785	76%	0.762	S	S	*	*			trans	-120.9	138.7	171.3	0	0	0	0	0	109.4
30	I	27	Very low	29.6	Very low	174 Å²	174	129.8 Å²	129.8	89%	0.892	76%	0.763	S	S	*	*			trans	-165.4	161.9	161.1	-106.4	152.1	0	0	0	109.4
31	T	25.9	Very low	30.2	Very low	113 Å²	113	129 Å²	129	69%	0.693	77%	0.766	S	S	*	*			trans	-99.4	168.4	-169.5	56	0	0	0	0	113.5
32	S	25.5	Very low	30.3	Very low	106 Å²	106	124.8 Å²	124.8	74%	0.741	77%	0.773	S	S	*	*			trans	63.7	148.5	151.5	43.5	0	0	0	0	118.2
33	S	25.6	Very low	30.4	Very low	92 Å²	92	128.7 Å²	128.7	64%	0.643	78%	0.782	S	S	*	*			cis	-165.1	-177.9	-8.4	40.6	0	0	0	0	110
34	D	26.8	Very low	30.4	Very low	154 Å²	154	130.5 Å²	130.5	82%	0.824	79%	0.793	S	S	*	*			trans	98.8	120.1	151.5	-53.3	-52	0	0	0	120.9
35	D	30.4	Very low	30.4	Very low	156 Å²	156	126.5 Å²	126.5	83%	0.834	78%	0.784	S	S	*	*			trans	-75.2	-174.3	174.7	-104.9	-45.9	0	0	0	111.6
36	P	48.9	Very low	30.5	Very low	105 Å²	105	128.9 Å²	128.9	68%	0.682	78%	0.777	S	S	*	*			cis	-152.5	-168.6	31.5	33.9	-6.5	0	0	0	119.1
37	I	30.1	Very low	30.7	Very low	153 Å²	153	134.5 Å²	134.5	79%	0.785	78%	0.778	S	S	*	*			trans	98.6	133.1	155.4	-57.8	170	0	0	0	116.6
38	L	32.8	Very low	30.5	Very low	147 Å²	147	136.7 Å²	136.7	77%	0.77	77%	0.774	S	S	*	*			cis	-176.1	166.8	-34.5	-125.4	169.2	0	0	0	110.2
39	L	28.1	Very low	30.5	Very low	155 Å²	155	139 Å²	139	81%	0.812	77%	0.771	S	S	*	*			trans	86.2	135.1	172.9	-54.7	167.7	0	0	0	115.3
40	T	28.4	Very low	30.2	Very low	132 Å²	132	143.8 Å²	143.8	81%	0.81	77%	0.774	S	S	*	*			cis	-130.8	168.8	14.9	20.3	0	0	0	0	114
41	P	41.3	Very low	30.3	Very low	116 Å²	116	141.7 Å²	141.7	75%	0.753	76%	0.76	S	S	*	*			trans	-89.6	168.4	-173.7	37.1	-36.9	0	0	0	114.3
42	G	30.2	Very low	30.4	Very low	74 Å²	74	145 Å²	145	76%	0.763	76%	0.76	S	S	*	*			cis	174.1	-161.2	5.5	0	0	0	0	0	109.8
43	R	32	Very low	30.6	Very low	218 Å²	218	146 Å²	146	82%	0.823	76%	0.757	S	S	*	*			cis	-173.2	127.1	-7.9	-124.7	-172.6	-179.8	-174.8	0.5	111.5
44	M	29.5	Very low	30.8	Very low	161 Å²	161	150.1 Å²	150.1	79%	0.793	76%	0.763	S	S	*	*			trans	67.8	153.3	146.7	-61.1	169.3	69.7	0	0	120.6
45	S	28.2	Very low	30.9	Very low	88 Å²	88	148.9 Å²	148.9	62%	0.615	75%	0.753	S	S	*	*			cis	-155	145.2	-2.3	-138.2	0	0	0	0	116.3
46	Q	29.4	Very low	31	Very low	159 Å²	159	148.7 Å²	148.7	74%	0.743	75%	0.745	S	S	*	*			trans	25	136.1	141.5	-59.6	-174.5	8.4	0	0	126
47	R	31.2	Very low	30.2	Very low	214 Å²	214	150.5 Å²	150.5	81%	0.808	74%	0.744	S	S	*	*			trans	53.9	113.5	130.8	-68.2	-178.1	170.7	170.6	-3.4	123.1
48	Q	28.5	Very low	30.3	Very low	176 Å²	176	149.9 Å²	149.9	82%	0.822	74%	0.735	S	S	*	*				62.4	133.9	115.6	-127.3	179	9.4	0	0	122.2
49	V	27.5	Very low	30.2	Very low	132 Å²	132	148.6 Å²	148.6	80%	0.8	73%	0.726	S	S	*	*			trans	71.7	110.7	163.6	-169.8	0	0	0	0	118.3
50	K	26.9	Very low	30.3	Very low	194 Å²	194	148.9 Å²	148.9	84%	0.843	72%	0.72	S	S	*	*				-175.4	178.4	104.1	-154.7	156.8	-179.7	-179.7	0	111.6
51	E	28.6	Very low	30.4	Very low	131 Å²	131	149 Å²	149	61%	0.612	71%	0.712	S	S	*	*			trans	-94.7	168.3	-170.4	-33.6	164.8	113.1	0	0	115.5
52	R	28.1	Very low	29.7	Very low	181 Å²	181	152 Å²	152	68%	0.683	71%	0.713	S	S	*	*			trans	87	129.7	138	-87.2	-173.8	-108	-132.5	-8.4	123.7
53	D	31.2	Very low	29.7	Very low	129 Å²	129	157.5 Å²	157.5	69%	0.69	72%	0.719	S	S	*	*			trans	64.8	108.8	135.7	-51.7	-20.9	0	0	0	123.1
54	K	28	Very low	29.6	Very low	177 Å²	177	152.1 Å²	152.1	77%	0.77	72%	0.721	S	S	*	*				173.6	134.6	109.9	-93.8	176.2	177.3	-179.9	0	112.7
55	E	29.6	Very low	29.4	Very low	129 Å²	129	147.9 Å²	147.9	60%	0.603	72%	0.718	S	S	*	*				57.9	137.9	89.7	-61.7	-167.9	113.3	0	0	114.6
56	K	31.7	Very low	29.4	Very low	152 Å²	152	151.3 Å²	151.3	66%	0.661	73%	0.729	S	S	*	*			cis	-171.3	156.5	1.6	-118.6	173.8	175.4	149.8	0	110.9
57	E	33.5	Very low	29.2	Very low	142 Å²	142	152.2 Å²	152.2	66%	0.664	73%	0.733	S	S	*	*			trans	62.4	162.7	148.5	-68	-168.4	159.4	0	0	119.6
58	K	31.3	Very low	29.3	Very low	140 Å²	140	148.3 Å²	148.3	61%	0.609	73%	0.733	S	S	*	*			cis	-155.6	151.1	-4.2	-128.1	168.9	-173.1	139.7	0	115.3
59	E	30.3	Very low	30.2	Very low	121 Å²	121	145 Å²	145	57%	0.565	73%	0.727	S	S	*	*			trans	19.1	133.6	142.6	-69.2	-179.9	104.5	0	0	126
60	K	31.6	Very low	30.4	Very low	161 Å²	161	146.3 Å²	146.3	70%	0.7	73%	0.729	S	S	*	*				64.1	169.2	127.8	-59.2	174.1	177.8	161.7	0	119.5
61	E	30.3	Very low	30.7	Very low	135 Å²	135	146.6 Å²	146.6	63%	0.631	73%	0.725	S	S	*	*			cis	-159.1	178.3	6.7	-145.1	171.3	-121.1	0	0	113.4
62	K	27	Very low	30.9	Very low	179 Å²	179	146.3 Å²	146.3	78%	0.778	72%	0.724	S	S	*	*			trans	94	157.3	148.6	-82.3	-177.6	178.5	72.7	0	122.5
63	E	29.1	Very low	31.2	Very low	188 Å²	188	145.1 Å²	145.1	88%	0.879	73%	0.726	S	S	*	*			trans	-124.3	173.8	-165.7	-57.5	171.7	88.6	0	0	113.3
64	A	29.6	Very low	31.1	Very low	106 Å²	106	147 Å²	147	88%	0.876	73%	0.734	S	S	*	*			trans	78.3	129.8	144.2	0	0	0	0	0	121.9
65	G	25.6	Very low	31.1	Very low	71 Å²	71	142.6 Å²	142.6	73%	0.732	73%	0.731	S	S	*	*				136	89.3	124.5	0	0	0	0	0	121.5
66	L	29.6	Very low	31.1	Very low	161 Å²	161	142.8 Å²	142.8	84%	0.843	74%	0.741	S	S	*	*			trans	74.8	152.6	134.9	-115.2	69.4	0	0	0	124
67	Q	25.1	Very low	32.1	Very low	178 Å²	178	141.3 Å²	141.3	83%	0.832	75%	0.747	S	S	*	*			trans	90.4	160.9	153.8	-71.1	176.6	5.7	0	0	122.5
68	T	32.4	Very low	31.9	Very low	132 Å²	132	139.4 Å²	139.4	81%	0.81	75%	0.749	S	S	*	*			trans	-120	-165.2	-157.9	54.7	0	0	0	0	110.9
69	P	46.7	Very low	32	Very low	106 Å²	106	139.6 Å²	139.6	69%	0.688	76%	0.757	S	S	*	*			cis	-144.8	-177.9	3.6	44.6	-23.9	0	0	0	119.1
70	N	33	Very low	32	Very low	159 Å²	159	141.4 Å²	141.4	85%	0.85	77%	0.77	S	S	*	*			trans	21.9	148.3	149	-62.8	-8.2	0	0	0	124.5
71	R	33.4	Very low	31.8	Very low	200 Å²	200	138.8 Å²	138.8	76%	0.755	77%	0.772	S	S	*	*				160.5	131.7	99.4	-170.6	166.2	-177	-153	-16.7	117.5
72	E	32.1	Very low	32.8	Very low	125 Å²	125	138.3 Å²	138.3	58%	0.584	78%	0.78	S	S	*	*			trans	64.1	159.8	152.1	-75.1	170	-166.6	0	0	122.5
73	H	33.3	Very low	32.9	Very low	156 Å²	156	133.3 Å²	133.3	72%	0.722	78%	0.779	S	S	*	*			cis	-159.8	-178	-11	-122	-27.9	0	0	0	113.2
74	I	30.2	Very low	32.9	Very low	168 Å²	168	130.9 Å²	130.9	86%	0.862	78%	0.777	S	S	*	*			trans	77	145.5	163.4	-86.7	169.4	0	0	0	117.2
75	A	28	Very low	32.8	Very low	85 Å²	85	130.1 Å²	130.1	70%	0.702	77%	0.766	S	S	*	*			cis	-157.5	-135.7	-16.5	0	0	0	0	0	113.5
76	T	30.1	Very low	32.9	Very low	134 Å²	134	136.8 Å²	136.8	82%	0.822	77%	0.77	S	S	*	*			trans	-153.6	172.1	-161.7	36.5	0	0	0	0	112.7
77	P	53	Low	32.8	Very low	121 Å²	121	134.6 Å²	134.6	79%	0.786	76%	0.763	S	S	*	*			cis	-131.2	-152.3	21.1	44.4	-24.1	0	0	0	113.7
78	S	29.3	Very low	33	Very low	101 Å²	101	135 Å²	135	71%	0.706	77%	0.765	S	S	*	*			cis	-160	155.2	7.3	51.9	0	0	0	0	115.6
79	N	33.3	Very low	32.7	Very low	145 Å²	145	132 Å²	132	78%	0.775	76%	0.759	S	S	*	*			trans	-1.5	152.1	145.3	-65.3	7.9	0	0	0	121.3
80	L	28.4	Very low	31.9	Very low	158 Å²	158	136 Å²	136	83%	0.827	77%	0.766	S	S	*	*			cis	-154.9	172.4	16.2	-126	160.3	0	0	0	112.4
81	S	29.3	Very low	31.5	Very low	106 Å²	106	134.4 Å²	134.4	74%	0.741	75%	0.754	S	S	*	*			trans	-120.2	-154.6	-172	-32.3	0	0	0	0	111.8
82	P	50.5	Low	31.3	Very low	126 Å²	126	134.1 Å²	134.1	82%	0.818	75%	0.753	S	S	*	*			cis	-145.2	171	7.2	43.7	-23.7	0	0	0	120.2
83	G	28.1	Very low	30.9	Very low	73 Å²	73	134.2 Å²	134.2	75%	0.753	76%	0.762	S	S	*	*			trans	101	158.2	145	0	0	0	0	0	120
84	V	29.3	Very low	30.7	Very low	137 Å²	137	135.3 Å²	135.3	83%	0.83	76%	0.764	S	S	*	*			cis	-159.4	136.2	-8.9	136.8	0	0	0	0	111.8
85	S	27.1	Very low	30.7	Very low	91 Å²	91	135.1 Å²	135.1	64%	0.636	76%	0.76	S	S	*	*			trans	44.1	121.7	146.8	-58.1	0	0	0	0	127.9
86	Y	28.6	Very low	30.6	Very low	211 Å²	211	138.3 Å²	138.3	83%	0.827	77%	0.765	S	S	*	*				71.7	139.1	120	-78.8	-67.7	0	0	0	128
87	T	28.3	Very low	30.5	Very low	114 Å²	114	138.6 Å²	138.6	70%	0.699	76%	0.761	S	S	*	*			trans	83.8	127.5	139.6	44.4	0	0	0	0	126.2
88	H	29.5	Very low	29.3	Very low	188 Å²	188	140.3 Å²	140.3	87%	0.87	76%	0.763	S	S	*	*			trans	43.9	134.7	141.7	-76	-77.2	0	0	0	124.7
89	G	26	Very low	29.8	Very low	67 Å²	67	141.2 Å²	141.2	69%	0.691	77%	0.766	S	S	*	*				131.8	104.6	112.5	0	0	0	0	0	121.8
90	F	28.3	Very low	29.8	Very low	190 Å²	190	142.1 Å²	142.1	83%	0.833	77%	0.77	S	S	*	*			trans	54.9	126.8	136.9	-92	-106.4	0	0	0	125.4
91	E	26.1	Very low	30.3	Very low	127 Å²	127	139.8 Å²	139.8	59%	0.593	77%	0.765	S	S	*	*			trans	65.9	129.7	135.1	-84.1	-162.1	138.5	0	0	126.8
92	R	28.2	Very low	30.3	Very low	194 Å²	194	142.2 Å²	142.2	73%	0.732	77%	0.768	S	S	*	*			trans	74.7	125.2	133.6	-74.8	-173.4	-158.6	180	20.3	123.8
93	V	24.9	Very low	29.4	Very low	127 Å²	127	143.4 Å²	143.4	77%	0.77	76%	0.761	S	S	*	*			trans	73.4	142.1	130.8	174.9	0	0	0	0	115.4
94	K	27.5	Very low	29.4	Very low	178 Å²	178	146.7 Å²	146.7	77%	0.774	76%	0.756	S	S	*	*			cis	-147	177.5	24.3	-152.8	168.4	179.2	-163.1	0	113.1
95	E	30.5	Very low	29.4	Very low	164 Å²	164	146.8 Å²	146.8	77%	0.766	75%	0.752	S	S	*	*			trans	-69.7	156.8	163.6	-54.1	146.3	117.4	0	0	112.7
96	D	27.1	Very low	29.6	Very low	153 Å²	153	146.7 Å²	146.7	82%	0.818	75%	0.752	S	S	*	*			trans	-164.1	179.5	131.4	-120.8	-44.8	0	0	0	113.8
97	L	27.2	Very low	29.6	Very low	139 Å²	139	142.9 Å²	142.9	73%	0.728	75%	0.745	S	S	*	*			trans	-110.1	139.8	-152.4	-71	150.3	0	0	0	118.6
98	L	27.2	Very low	29.7	Very low	158 Å²	158	141.4 Å²	141.4	83%	0.827	74%	0.74	S	S	*	*			trans	61.7	178.3	144.4	-63.4	172.1	0	0	0	118.6
99	P	41.4	Very low	29.8	Very low	120 Å²	120	139.8 Å²	139.8	78%	0.779	74%	0.736	S	S	*	*			cis	-126.4	-169.8	-14.9	22.8	2.3	0	0	0	115
100	L	32.2	Very low	30.1	Very low	163 Å²	163	140 Å²	140	85%	0.853	73%	0.727	S	S	*	*			trans	-81.6	160.6	177.5	-64	163.6	0	0	0	115.2
101	P	39.2	Very low	30.3	Very low	110 Å²	110	140.5 Å²	140.5	71%	0.714	73%	0.729	S	S	*	*				-124.9	150.2	117	2	20.2	0	0	0	112.2
102	L	29.1	Very low	30.4	Very low	156 Å²	156	140.2 Å²	140.2	82%	0.817	74%	0.741	S	S	*	*				65.4	134	66.3	-58.6	175.9	0	0	0	113.1
103	K	31	Very low	30.6	Very low	152 Å²	152	139.9 Å²	139.9	66%	0.661	75%	0.745	S	S	*	*			cis	-168.4	-174.8	7.3	-143.8	170.5	147.7	-123.5	0	112.4
104	E	28.9	Very low	30.8	Very low	141 Å²	141	139.8 Å²	139.8	66%	0.659	75%	0.75	S	S	*	*			trans	82.1	142.3	145.9	-84.7	156.5	-147.1	0	0	120.6
105	D	30.2	Very low	30.9	Very low	139 Å²	139	139.1 Å²	139.1	74%	0.743	75%	0.75	S	S	*	*			cis	-157.2	169.3	-7.7	-148.2	11.9	0	0	0	119.1
106	S	30.2	Very low	30.8	Very low	90 Å²	90	138.4 Å²	138.4	63%	0.629	76%	0.756	S	S	*	*			trans	81.5	160.6	161.4	88.4	0	0	0	0	116.9
107	N	28	Very low	31	Very low	130 Å²	130	140.3 Å²	140.3	70%	0.695	76%	0.757	S	S	*	*			cis	-126.5	160.4	2.4	-114.7	-87.6	0	0	0	108.9
108	S	30.8	Very low	31.2	Very low	84 Å²	84	141.5 Å²	141.5	59%	0.587	76%	0.763	S	S	*	*			cis	75.6	135.3	32.4	144.5	0	0	0	0	114.8
109	I	32.7	Very low	31.1	Very low	153 Å²	153	144.1 Å²	144.1	79%	0.785	76%	0.764	S	S	*	*			cis	-161.3	160.7	-5.9	-115.4	164.4	0	0	0	108.7
110	S	31.7	Very low	30.6	Very low	73 Å²	73	145.8 Å²	145.8	51%	0.51	77%	0.766	S	S	.	*			cis	-171.5	157.9	-44.8	67.3	0	0	0	0	111.5
111	K	32.5	Very low	30.5	Very low	199 Å²	199	140.5 Å²	140.5	87%	0.865	75%	0.751	S	S	*	*			trans	79.8	131.6	155.7	-57	159	-174.1	173.1	0	121.3
112	S	28	Very low	30	Very low	121 Å²	121	141.1 Å²	141.1	85%	0.846	76%	0.758	S	S	*	*				-153.6	168.9	100.6	67.7	0	0	0	0	110.9
113	K	32.8	Very low	30	Very low	188 Å²	188	140 Å²	140	82%	0.817	75%	0.753	S	S	*	*			trans	-133.4	151.7	-178.3	-85.8	-168.6	174.6	-166.7	0	110.2
114	S	28.2	Very low	30.1	Very low	124 Å²	124	140.9 Å²	140.9	87%	0.867	76%	0.757	S	S	*	*			trans	-156.8	155.1	141	27.8	0	0	0	0	110.1
115	E	29.5	Very low	30.1	Very low	165 Å²	165	141.4 Å²	141.4	77%	0.771	76%	0.764	S	S	*	*			trans	-120.6	154	-175.2	-59.1	169.9	132.4	0	0	109.5
116	T	28.8	Very low	30.2	Very low	148 Å²	148	141.4 Å²	141.4	91%	0.908	77%	0.768	S	S	*	*			trans	-160.5	154.2	141.1	-3.9	0	0	0	0	111.4
117	K	32.3	Very low	30.7	Very low	194 Å²	194	142.7 Å²	142.7	84%	0.843	78%	0.775	S	S	*	*			trans	-118.7	-177.8	177.9	-81.7	-176.3	175.4	177.3	0	110.1
118	L	29.9	Very low	31.2	Very low	163 Å²	163	141.3 Å²	141.3	85%	0.853	78%	0.782	S	S	*	*			trans	103.7	142	176.7	-58.6	169	0	0	0	111.6
119	Y	25.4	Very low	31.3	Very low	214 Å²	214	143 Å²	143	84%	0.839	79%	0.793	S	S	*	*			cis	-133.7	-174.1	11.2	-155.8	-99.9	0	0	0	111.7
120	N	31.2	Very low	31.6	Very low	155 Å²	155	139.4 Å²	139.4	83%	0.829	79%	0.794	S	S	*	*			trans	-144.3	150.4	-178.7	-172.4	37.2	0	0	0	113.1
121	G	29.7	Very low	31.8	Very low	51 Å²	51	139.1 Å²	139.1	53%	0.526	80%	0.803	S	S	.	*			trans	124.8	124	-177.4	0	0	0	0	0	111.9
122	S	29.8	Very low	32.6	Very low	123 Å²	123	139.4 Å²	139.4	86%	0.86	80%	0.804	S	S	*	*				74	129.3	68.9	72	0	0	0	0	112.7
123	D	28.6	Very low	33.6	Very low	133 Å²	133	138.9 Å²	138.9	71%	0.711	79%	0.791	S	S	*	*			cis	-159.3	158.8	12	-171.2	21.1	0	0	0	111.1
124	K	33	Very low	34.8	Very low	171 Å²	171	133.7 Å²	133.7	74%	0.743	78%	0.775	S	S	*	*			trans	62.2	150.3	173.7	-48.7	-175.5	-175.3	172.5	0	115.9
125	D	28.8	Very low	35.9	Very low	152 Å²	152	137.3 Å²	137.3	81%	0.813	78%	0.776	S	S	*	*			cis	-141.7	171.7	36.6	-89.5	-44.6	0	0	0	114.5
126	V	32.8	Very low	36.6	Very low	138 Å²	138	137.5 Å²	137.5	84%	0.836	77%	0.774	S	S	*	*			trans	-140.1	121.5	172.1	169.4	0	0	0	0	108.4
127	P	39.5	Very low	37.4	Very low	118 Å²	118	134.3 Å²	134.3	77%	0.766	75%	0.749	S	S	*	*				-143.7	158.9	100.3	37.7	-22.9	0	0	0	116.5
128	A	38.5	Very low	38.4	Very low	101 Å²	101	127.7 Å²	127.7	84%	0.835	73%	0.727	S	S	*	*			trans	52.2	92.7	154.2	0	0	0	0	0	119.1
129	S	32.6	Very low	39.6	Very low	118 Å²	118	123.6 Å²	123.6	83%	0.825	71%	0.705	S	S	*	*			trans	-128.9	128.1	135.1	65.4	0	0	0	0	110.6	G131	S129-G131 PolarHBondContact O-N 2.9Å
130	G	40	Very low	41.2	Very low	79 Å²	79	120.7 Å²	120.7	81%	0.814	70%	0.697	S	S	*	*			trans	-77	85.1	177.3	0	0	0	0	0	110.4	K132	G130-K132 PolarHBondContact O-N 3.27Å
131	G	35.9	Very low	42.8	Very low	67 Å²	67	116.8 Å²	116.8	69%	0.691	68%	0.678	S	S	*	*			trans	-58.4	100.2	178.9	0	0	0	0	0	111.9	S129 L133	S129-G131 PolarHBondContact O-N 2.9Å; G131-L133 PolarHBondContact O-N 3.11Å
132	K	48.8	Very low	43.9	Very low	204 Å²	204	118.5 Å²	118.5	89%	0.887	67%	0.673	S	S	*	*			trans	-60.7	98.9	170.2	-78.7	-178.6	175.9	175.1	0	108.5	G130 T134	G130-K132 PolarHBondContact O-N 3.27Å; K132-T134 PolarHBondContact O-N 3.49Å
133	L	48.9	Very low	45.2	Very low	111 Å²	111	117.8 Å²	117.8	58%	0.581	65%	0.654	S	S	*	*			trans	-46.5	131.3	169.6	-77	174.1	0	0	0	108.9	G131 E137	G131-L133 PolarHBondContact O-N 3.11Å; L133-E137 HydrophobicContact CB-CB 4.22Å; L133-E137 HydrophobicContact CD2-CB 4.24Å
134	T	58.2	Low	47	Very low	78 Å²	78	117 Å²	117	48%	0.479	64%	0.644	S	S	.	*			trans	-61.5	156.7	-173.1	65.1	0	0	0	0	110.3	K132 K136 E137 S138	K132-T134 PolarHBondContact O-N 3.49Å; T134-K136 PolarHBondContact O-N 3.37Å; T134-E137 WeakPolarHBondContact CB-OE2 3.48Å; T134-E137 WeakPolarHBondContact CG2-OE2 3.29Å; T134-E137 PolarHBondContact N-OE2 3.06Å; T134-E137 PolarHBondContact O-N 3.21Å; T134-E137 WeakPolarHBondContact OG1-CG 3.32Å; T134-E137 PolarHBondContact OG1-OE2 3.4Å; T134-S138 PolarHBondContact O-N 3.05Å; T134-S138 VanDerWaalsContact O-N 3.13Å
135	K	51.4	Low	48.5	Very low	201 Å²	201	113.1 Å²	113.1	87%	0.874	63%	0.632	S	S	*	*	H	α-helix	trans	-53.8	-20.9	179.9	-154.8	169.5	-174.1	175.5	0	112.9
136	K	45.4	Very low	50	Low	169 Å²	169	110.7 Å²	110.7	74%	0.735	61%	0.612	S	S	*	*	H	α-helix	trans	-82.9	-25.4	176.6	-161.2	171.4	-174	174.4	0	114	T134	T134-K136 PolarHBondContact O-N 3.37Å
137	E	44.4	Very low	51.2	Low	81 Å²	81	112.1 Å²	112.1	38%	0.379	60%	0.602	S	S	.	*	H	α-helix	trans	-92.8	-42	-179	-69.3	164.8	122.3	0	0	112.2	L133 T134 L139 K140 V141	L133-E137 HydrophobicContact CB-CB 4.22Å; L133-E137 HydrophobicContact CD2-CB 4.24Å; T134-E137 WeakPolarHBondContact CB-OE2 3.48Å; T134-E137 WeakPolarHBondContact CG2-OE2 3.29Å; T134-E137 PolarHBondContact N-OE2 3.06Å; T134-E137 PolarHBondContact O-N 3.21Å; T134-E137 WeakPolarHBondContact OG1-CG 3.32Å; T134-E137 PolarHBondContact OG1-OE2 3.4Å; E137-L139 PolarHBondContact O-N 3.31Å; E137-K140 WeakPolarHBondContact O-CA 3.45Å; E137-K140 WeakPolarHBondContact O-CB 3.44Å; E137-K140 PolarHBondContact O-N 3.39Å; E137-V141 PolarHBondContact O-N 3.38Å
138	S	54.3	Low	52.3	Low	55 Å²	55	111 Å²	111	39%	0.385	59%	0.587	S	S	.	*	H	α-helix	trans	-53.4	-44.9	169.3	177.1	0	0	0	0	110.9	T134 K140 V141 Q142	T134-S138 PolarHBondContact O-N 3.05Å; T134-S138 VanDerWaalsContact O-N 3.13Å; S138-K140 VanDerWaalsContact C-N 3.28Å; S138-K140 PolarHBondContact O-N 3.39Å; S138-V141 PolarHBondContact O-N 3.37Å; S138-Q142 PolarHBondContact O-N 2.96Å
139	L	54.8	Low	53.2	Low	76 Å²	76	111.4 Å²	111.4	40%	0.398	57%	0.571	S	S	.	*	H	α-helix	trans	-63.1	-27.2	175.1	-170.9	63.9	0	0	0	113.7	E137 K143	E137-L139 PolarHBondContact O-N 3.31Å; L139-K143 HydrophobicContact CD1-CD 4.38Å; L139-K143 HydrophobicContact CG-CD 4.1Å; L139-K143 WeakPolarHBondContact O-CB 3.33Å; L139-K143 WeakPolarHBondContact O-CD 3.47Å; L139-K143 WeakPolarHBondContact O-CG 3.3Å; L139-K143 PolarHBondContact O-N 3.49Å; L139-K143 VanDerWaalsContact O-N 3.08Å
140	K	59.3	Low	54.2	Low	153 Å²	153	108.3 Å²	108.3	67%	0.665	54%	0.543	S	S	*	.	H	α-helix	trans	-71.2	-41.6	171.3	-79.4	179.1	176.2	178	0	111.2	E137 S138 K143 K144	E137-K140 WeakPolarHBondContact O-CA 3.45Å; E137-K140 WeakPolarHBondContact O-CB 3.44Å; E137-K140 PolarHBondContact O-N 3.39Å; S138-K140 VanDerWaalsContact C-N 3.28Å; S138-K140 PolarHBondContact O-N 3.39Å; K140-K143 CarbonylContact O-C 3.58Å; K140-K143 PolarHBondContact O-N 3.38Å; K140-K144 PolarHBondContact O-N 3.17Å
141	V	64.4	Low	55	Low	73 Å²	73	111.3 Å²	111.3	44%	0.442	53%	0.534	S	S	.	.	H	α-helix	trans	-67.1	-48.1	178.3	179.6	0	0	0	0	110.7	E137 S138 K143 K144 N145	E137-V141 PolarHBondContact O-N 3.38Å; S138-V141 PolarHBondContact O-N 3.37Å; V141-K143 VanDerWaalsContact C-N 3.32Å; V141-K143 PolarHBondContact O-N 3.19Å; V141-K144 WeakPolarHBondContact O-CA 3.35Å; V141-K144 WeakPolarHBondContact O-CB 3.49Å; V141-K144 PolarHBondContact O-N 2.99Å; V141-N145 PolarHBondContact O-N 3.12Å; V141-N145 PolarHBondContact O-OD1 3.31Å
142	Q	51.8	Low	56.3	Low	87 Å²	87	115.6 Å²	115.6	41%	0.407	53%	0.529	S	S	.	.	H	α-helix	trans	-55.9	-45.3	172.4	-70.6	-176.4	-42.1	0	0	111.8	S138 K144 N145 Y146 N328	S138-Q142 PolarHBondContact O-N 2.96Å; Q142-K144 PolarHBondContact O-N 3.17Å; Q142-N145 PolarHBondContact O-N 3.47Å; Q142-Y146 WeakPolarHBondContact O-CB 3.38Å; Q142-Y146 PolarHBondContact O-N 3.41Å; Q142-N328 PolarHBondContact NE2-OD1 3.07Å; Q142-N328 VanDerWaalsContact NE2-OD1 3.09Å
143	K	58.5	Low	56.4	Low	109 Å²	109	107 Å²	107	47%	0.474	50%	0.496	S	S	.	.	H	α-helix	trans	-68.7	-12.2	175.3	-74.8	174	179.8	173.6	0	114.3	L139 K140 V141 R147	L139-K143 HydrophobicContact CD1-CD 4.38Å; L139-K143 HydrophobicContact CG-CD 4.1Å; L139-K143 WeakPolarHBondContact O-CB 3.33Å; L139-K143 WeakPolarHBondContact O-CD 3.47Å; L139-K143 WeakPolarHBondContact O-CG 3.3Å; L139-K143 PolarHBondContact O-N 3.49Å; L139-K143 VanDerWaalsContact O-N 3.08Å; K140-K143 CarbonylContact O-C 3.58Å; K140-K143 PolarHBondContact O-N 3.38Å; V141-K143 VanDerWaalsContact C-N 3.32Å; V141-K143 PolarHBondContact O-N 3.19Å; K143-R147 WeakPolarHBondContact O-CD 3.27Å; K143-R147 WeakPolarHBondContact O-CG 3.42Å; K143-R147 PolarHBondContact O-NE 3.37Å
144	K	65.4	Low	56.6	Low	116 Å²	116	102 Å²	102	50%	0.504	47%	0.471	S	S	.	.	H	α-helix	trans	-85.7	-54.8	169	-177.5	-172.9	168.7	-169.7	0	109.8	K140 V141 Q142 Y146 R147 E148	K140-K144 PolarHBondContact O-N 3.17Å; V141-K144 WeakPolarHBondContact O-CA 3.35Å; V141-K144 WeakPolarHBondContact O-CB 3.49Å; V141-K144 PolarHBondContact O-N 2.99Å; Q142-K144 PolarHBondContact O-N 3.17Å; K144-Y146 VanDerWaalsContact C-N 3.32Å; K144-Y146 PolarHBondContact O-N 3.49Å; K144-R147 WeakPolarHBondContact O-CA 3.48Å; K144-R147 WeakPolarHBondContact O-CB 3.4Å; K144-R147 PolarHBondContact O-N 3.28Å; K144-E148 WeakPolarHBondContact CE-OE1 3.33Å; K144-E148 WeakPolarHBondContact CE-OE2 3.48Å; K144-E148 WeakPolarHBondContact CG-OE1 3.46Å; K144-E148 IonicContact NZ-OE1 3.39Å; K144-E148 PolarHBondContact O-N 3.32Å; K144-E148 VanDerWaalsContact O-N 3.09Å
145	N	63.8	Low	56.3	Low	90 Å²	90	106.1 Å²	106.1	48%	0.481	48%	0.482	S	S	.	.	H	α-helix	trans	-55.7	-46.1	-179.6	-66.8	17.8	0	0	0	111.2	V141 Q142 R147 E148 E149	V141-N145 PolarHBondContact O-N 3.12Å; V141-N145 PolarHBondContact O-OD1 3.31Å; Q142-N145 PolarHBondContact O-N 3.47Å; N145-R147 PolarHBondContact O-N 3.33Å; N145-E148 PolarHBondContact O-N 2.92Å; N145-E149 WeakPolarHBondContact O-CB 3.46Å; N145-E149 PolarHBondContact O-N 3.08Å
146	Y	61.5	Low	56.4	Low	100 Å²	100	100.2 Å²	100.2	39%	0.392	46%	0.457	S	S	.	.	H	α-helix	trans	-56.3	-33.5	174.4	177.9	-96.3	0	0	0	113.5	Q142 K144 K150 Q326	Q142-Y146 WeakPolarHBondContact O-CB 3.38Å; Q142-Y146 PolarHBondContact O-N 3.41Å; K144-Y146 VanDerWaalsContact C-N 3.32Å; K144-Y146 PolarHBondContact O-N 3.49Å; Y146-K150 HydrophobicContact CE1-CD 3.93Å; Y146-K150 WeakPolarHBondContact O-CB 3.48Å; Y146-K150 PolarHBondContact O-N 2.68Å; Y146-K150 VanDerWaalsContact O-N 3.16Å; Y146-K150 PolarHBondContact OH-NZ 2.99Å; Y146-Q326 VanDerWaalsContact CE2-OE1 3.22Å
147	R	58.3	Low	57	Low	169 Å²	169	94 Å²	94	64%	0.638	43%	0.432	S	S	*	.	H	α-helix	trans	-75.7	-33.4	176.3	-65	169.8	-160.9	-159.1	0.2	111.9	K143 K144 N145 K151	K143-R147 WeakPolarHBondContact O-CD 3.27Å; K143-R147 WeakPolarHBondContact O-CG 3.42Å; K143-R147 PolarHBondContact O-NE 3.37Å; K144-R147 WeakPolarHBondContact O-CA 3.48Å; K144-R147 WeakPolarHBondContact O-CB 3.4Å; K144-R147 PolarHBondContact O-N 3.28Å; N145-R147 PolarHBondContact O-N 3.33Å; R147-K151 WeakPolarHBondContact O-CG 3.43Å; R147-K151 PolarHBondContact O-N 3.48Å
148	E	62.4	Low	57.5	Low	93 Å²	93	92.6 Å²	92.6	44%	0.435	43%	0.426	S	S	.	.	H	α-helix	trans	-80.3	-40.4	-176.7	-72.9	170.2	-177.4	0	0	111.3	K144 N145 K151 R152	K144-E148 WeakPolarHBondContact CE-OE1 3.33Å; K144-E148 WeakPolarHBondContact CE-OE2 3.48Å; K144-E148 WeakPolarHBondContact CG-OE1 3.46Å; K144-E148 IonicContact NZ-OE1 3.39Å; K144-E148 PolarHBondContact O-N 3.32Å; K144-E148 VanDerWaalsContact O-N 3.09Å; N145-E148 PolarHBondContact O-N 2.92Å; E148-K151 CarbonylContact O-C 3.55Å; E148-K151 WeakPolarHBondContact O-CA 3.21Å; E148-K151 WeakPolarHBondContact O-CB 3.46Å; E148-K151 PolarHBondContact O-N 3.43Å; E148-K151 VanDerWaalsContact O-N 3.12Å; E148-R152 PolarHBondContact O-N 3.25Å
149	E	57.9	Low	57.5	Low	110 Å²	110	93 Å²	93	51%	0.514	43%	0.429	S	S	.	.	H	α-helix	trans	-64.4	-41.1	170.2	-173.9	151.7	-103.2	0	0	112	N145 K151 R152 A153	N145-E149 WeakPolarHBondContact O-CB 3.46Å; N145-E149 PolarHBondContact O-N 3.08Å; E149-K151 VanDerWaalsContact C-N 3.33Å; E149-K151 PolarHBondContact O-N 3.04Å; E149-R152 WeakPolarHBondContact O-CB 3.44Å; E149-R152 PolarHBondContact O-N 3.43Å; E149-R152 VanDerWaalsContact O-N 3.07Å; E149-R152 IonicContact OE1-NH1 3.25Å; E149-R152 PolarHBondContact OE1-NH1 3.4Å; E149-A153 PolarHBondContact O-N 2.8Å
150	K	52.1	Low	57.6	Low	53 Å²	53	91.6 Å²	91.6	23%	0.23	42%	0.424	C	S	.	.	H	α-helix	trans	-59.2	-43.3	169	-164.4	160.9	-160.1	156.9	0	110.7	Y146 R152 T154 Y314	Y146-K150 HydrophobicContact CE1-CD 3.93Å; Y146-K150 WeakPolarHBondContact O-CB 3.48Å; Y146-K150 PolarHBondContact O-N 2.68Å; Y146-K150 VanDerWaalsContact O-N 3.16Å; Y146-K150 PolarHBondContact OH-NZ 2.99Å; K150-R152 VanDerWaalsContact C-N 3.33Å; K150-R152 PolarHBondContact O-N 3.25Å; K150-T154 WeakPolarHBondContact O-CB 3.48Å; K150-T154 PolarHBondContact O-N 3.24Å; K150-T154 PolarHBondContact O-OG1 3.19Å; K150-Y314 HydrophobicContact CB-CD2 4.28Å; K150-Y314 HydrophobicContact CD-CD2 4.49Å; K150-Y314 HydrophobicContact CG-CD2 3.35Å; K150-Y314 HydrophobicContact CG-CE2 3.91Å; K150-Y314 HydrophobicContact CG-CG 4.18Å; K150-Y314 WeakPolarHBondContact O-CD2 3.37Å; K150-Y314 WeakPolarHBondContact O-CE2 3.41Å
151	K	58.3	Low	57.3	Low	143 Å²	143	85.4 Å²	85.4	62%	0.622	40%	0.398	S	S	*	.	H	α-helix	trans	-61.9	-35.4	172.3	-77.8	174.7	176.2	-174.3	0	113.2	R147 E148 E149 T154 K155	R147-K151 WeakPolarHBondContact O-CG 3.43Å; R147-K151 PolarHBondContact O-N 3.48Å; E148-K151 CarbonylContact O-C 3.55Å; E148-K151 WeakPolarHBondContact O-CA 3.21Å; E148-K151 WeakPolarHBondContact O-CB 3.46Å; E148-K151 PolarHBondContact O-N 3.43Å; E148-K151 VanDerWaalsContact O-N 3.12Å; E149-K151 VanDerWaalsContact C-N 3.33Å; E149-K151 PolarHBondContact O-N 3.04Å; K151-T154 WeakPolarHBondContact CA-OG1 3.23Å; K151-T154 PolarHBondContact O-OG1 3.22Å; K151-T154 VanDerWaalsContact O-OG1 3.06Å; K151-K155 WeakPolarHBondContact O-CB 3.26Å; K151-K155 PolarHBondContact O-N 3.45Å; K151-K155 VanDerWaalsContact O-N 3.15Å
152	R	63	Low	56.7	Low	156 Å²	156	86 Å²	86	59%	0.589	40%	0.402	S	S	*	.	H	α-helix	trans	-62.8	-64.1	177	-174.7	-170.1	-69.1	132	-7.5	111.3	E148 E149 K150 T154 K155 E156	E148-R152 PolarHBondContact O-N 3.25Å; E149-R152 WeakPolarHBondContact O-CB 3.44Å; E149-R152 PolarHBondContact O-N 3.43Å; E149-R152 VanDerWaalsContact O-N 3.07Å; E149-R152 IonicContact OE1-NH1 3.25Å; E149-R152 PolarHBondContact OE1-NH1 3.4Å; K150-R152 VanDerWaalsContact C-N 3.33Å; K150-R152 PolarHBondContact O-N 3.25Å; R152-T154 PolarHBondContact O-N 3.14Å; R152-T154 VanDerWaalsContact O-N 3.09Å; R152-K155 WeakPolarHBondContact O-CB 3.3Å; R152-K155 PolarHBondContact O-N 3.05Å; R152-E156 PolarHBondContact O-N 3.45Å
153	A	50.8	Low	56.9	Low	24 Å²	24	84.8 Å²	84.8	20%	0.198	40%	0.398	C	S	.	.	H	α-helix	trans	-66.7	-16.8	-174.5	0	0	0	0	0	113.6	E149 L157 Y314	E149-A153 PolarHBondContact O-N 2.8Å; A153-L157 WeakPolarHBondContact O-CB 3.18Å; A153-L157 PolarHBondContact O-N 3.11Å; A153-Y314 HydrophobicContact CB-CE2 4.03Å; A153-Y314 VanDerWaalsContact CB-OH 3.29Å; A153-Y314 WeakPolarHBondContact CB-OH 3.31Å
154	T	51.9	Low	56.7	Low	7 Å²	7	84.8 Å²	84.8	4%	0.043	41%	0.409	C	S	.	.	H	α-helix	trans	-76.9	-43	167.5	43.3	0	0	0	0	113.1	K150 K151 R152 E156 L158 F313 Y314	K150-T154 WeakPolarHBondContact O-CB 3.48Å; K150-T154 PolarHBondContact O-N 3.24Å; K150-T154 PolarHBondContact O-OG1 3.19Å; K151-T154 WeakPolarHBondContact CA-OG1 3.23Å; K151-T154 PolarHBondContact O-OG1 3.22Å; K151-T154 VanDerWaalsContact O-OG1 3.06Å; R152-T154 PolarHBondContact O-N 3.14Å; R152-T154 VanDerWaalsContact O-N 3.09Å; T154-E156 VanDerWaalsContact C-N 3.27Å; T154-E156 PolarHBondContact O-N 3.18Å; T154-L158 VanDerWaalsContact O-CB 3.24Å; T154-L158 WeakPolarHBondContact O-CB 3.38Å; T154-L158 PolarHBondContact O-N 3.15Å; T154-F313 HydrophobicContact CG2-CB 3.54Å; T154-F313 HydrophobicContact CG2-CD1 4.31Å; T154-F313 HydrophobicContact CG2-CG 4.43Å; T154-Y314 HydrophobicContact CG2-CD2 4.42Å; T154-Y314 HydrophobicContact CG2-CG 4.32Å
155	K	52.8	Low	56.1	Low	164 Å²	164	83.7 Å²	83.7	71%	0.713	42%	0.417	S	S	*	.	H	α-helix	trans	-61.3	-40.1	174.4	-177.6	-177.6	176.5	-174.4	0	110.8	K151 R152 S159	K151-K155 WeakPolarHBondContact O-CB 3.26Å; K151-K155 PolarHBondContact O-N 3.45Å; K151-K155 VanDerWaalsContact O-N 3.15Å; R152-K155 WeakPolarHBondContact O-CB 3.3Å; R152-K155 PolarHBondContact O-N 3.05Å; K155-S159 PolarHBondContact O-N 2.96Å
156	E	53.8	Low	56.3	Low	76 Å²	76	81.6 Å²	81.6	36%	0.355	41%	0.407	S	S	.	.	H	α-helix	trans	-64.2	-56.8	178.8	-164.1	-179	143.1	0	0	111.9	R152 T154 L158 S159 T160	R152-E156 PolarHBondContact O-N 3.45Å; T154-E156 VanDerWaalsContact C-N 3.27Å; T154-E156 PolarHBondContact O-N 3.18Å; E156-L158 VanDerWaalsContact C-N 3.26Å; E156-L158 PolarHBondContact O-N 3.34Å; E156-S159 WeakPolarHBondContact O-CA 3.32Å; E156-S159 WeakPolarHBondContact O-CB 3.5Å; E156-S159 PolarHBondContact O-N 3.33Å; E156-S159 PolarHBondContact O-OG 3.48Å; E156-T160 PolarHBondContact O-N 3.19Å; E156-T160 PolarHBondContact O-OG1 3.02Å
157	L	56.5	Low	57.1	Low	40 Å²	40	80.7 Å²	80.7	21%	0.209	41%	0.408	C	S	.	.	H	α-helix	trans	-60.5	-34.9	177.1	178.5	60.2	0	0	0	112.8	A153 S159 I161 F313 L317	A153-L157 WeakPolarHBondContact O-CB 3.18Å; A153-L157 PolarHBondContact O-N 3.11Å; L157-S159 VanDerWaalsContact C-N 3.35Å; L157-I161 HydrophobicContact CD1-CD1 4.21Å; L157-I161 HydrophobicContact CG-CD1 4.18Å; L157-I161 WeakPolarHBondContact O-CG1 3.34Å; L157-I161 PolarHBondContact O-N 3.39Å; L157-F313 HydrophobicContact CD2-CE1 3.94Å; L157-F313 HydrophobicContact CG-CE1 4.08Å; L157-L317 HydrophobicContact CD2-CD1 3.77Å
158	L	56.1	Low	58.2	Low	50 Å²	50	75.4 Å²	75.4	26%	0.262	39%	0.394	S	S	.	.	H	α-helix	trans	-64.3	-40.7	173.2	-179.3	61	0	0	0	111.1	T154 E156 T160 I161 T162 F313	T154-L158 VanDerWaalsContact O-CB 3.24Å; T154-L158 WeakPolarHBondContact O-CB 3.38Å; T154-L158 PolarHBondContact O-N 3.15Å; E156-L158 VanDerWaalsContact C-N 3.26Å; E156-L158 PolarHBondContact O-N 3.34Å; L158-T160 PolarHBondContact O-N 3.4Å; L158-I161 PolarHBondContact O-N 3.26Å; L158-I161 VanDerWaalsContact O-N 3.16Å; L158-T162 HydrophobicContact CD1-CG2 4.32Å; L158-T162 PolarHBondContact O-N 3.08Å; L158-T162 PolarHBondContact O-OG1 2.87Å; L158-F313 HydrophobicContact CB-CG 4.43Å; L158-F313 HydrophobicContact CD1-CD2 3.78Å; L158-F313 HydrophobicContact CD1-CE2 4.2Å; L158-F313 HydrophobicContact CD1-CG 4.26Å; L158-F313 HydrophobicContact CD2-CB 4.45Å
159	S	55	Low	59.3	Low	64 Å²	64	72.9 Å²	72.9	45%	0.448	38%	0.383	S	S	.	.	H	α-helix	trans	-60.4	-45.2	179.1	77.9	0	0	0	0	112	K155 E156 L157 I161 T162 D163	K155-S159 PolarHBondContact O-N 2.96Å; E156-S159 WeakPolarHBondContact O-CA 3.32Å; E156-S159 WeakPolarHBondContact O-CB 3.5Å; E156-S159 PolarHBondContact O-N 3.33Å; E156-S159 PolarHBondContact O-OG 3.48Å; L157-S159 VanDerWaalsContact C-N 3.35Å; S159-I161 VanDerWaalsContact C-N 3.29Å; S159-I161 PolarHBondContact O-N 3.4Å; S159-T162 WeakPolarHBondContact CA-OG1 3.46Å; S159-T162 PolarHBondContact O-N 3.19Å; S159-T162 VanDerWaalsContact O-N 3.13Å; S159-T162 PolarHBondContact O-OG1 3.28Å; S159-D163 PolarHBondContact O-N 2.73Å
160	T	55.1	Low	60.8	Low	47 Å²	47	69.5 Å²	69.5	29%	0.288	37%	0.374	S	S	.	.	H	α-helix	trans	-61.9	-35.2	175.8	-37.3	0	0	0	0	112.3	E156 L158	E156-T160 PolarHBondContact O-N 3.19Å; E156-T160 PolarHBondContact O-OG1 3.02Å; L158-T160 PolarHBondContact O-N 3.4Å
161	I	53.9	Low	62.7	Low	23 Å²	23	70.7 Å²	70.7	12%	0.118	38%	0.383	C	S	.	.	H	α-helix	trans	-74.5	-33	177.4	-69.6	169	0	0	0	111.1	L157 L158 S159 K190 F313	L157-I161 HydrophobicContact CD1-CD1 4.21Å; L157-I161 HydrophobicContact CG-CD1 4.18Å; L157-I161 WeakPolarHBondContact O-CG1 3.34Å; L157-I161 PolarHBondContact O-N 3.39Å; L158-I161 PolarHBondContact O-N 3.26Å; L158-I161 VanDerWaalsContact O-N 3.16Å; S159-I161 VanDerWaalsContact C-N 3.29Å; S159-I161 PolarHBondContact O-N 3.4Å; I161-K190 PolarHBondContact O-NZ 2.83Å; I161-F313 HydrophobicContact CD1-CE1 4.09Å; I161-F313 HydrophobicContact CD1-CE2 4.24Å; I161-F313 HydrophobicContact CD1-CZ 3.47Å; I161-F313 VanDerWaalsContact CD1-CZ 3.47Å
162	T	51.6	Low	64.2	Low	84 Å²	84	67.8 Å²	67.8	52%	0.515	37%	0.368	S	S	.	.	H	α-helix	trans	-78.2	-22.6	174.7	51.8	0	0	0	0	114.5	L158 S159 P164	L158-T162 HydrophobicContact CD1-CG2 4.32Å; L158-T162 PolarHBondContact O-N 3.08Å; L158-T162 PolarHBondContact O-OG1 2.87Å; S159-T162 WeakPolarHBondContact CA-OG1 3.46Å; S159-T162 PolarHBondContact O-N 3.19Å; S159-T162 VanDerWaalsContact O-N 3.13Å; S159-T162 PolarHBondContact O-OG1 3.28Å; T162-P164 WeakPolarHBondContact O-CD 3.34Å
163	D	55.5	Low	65.6	Low	62 Å²	62	60.4 Å²	60.4	33%	0.332	34%	0.34	S	S	.	.			trans	-60.4	119.2	-178.1	-172	-26	0	0	0	112	S159 S165 V166 K190	S159-D163 PolarHBondContact O-N 2.73Å; D163-S165 VanDerWaalsContact C-N 3.29Å; D163-S165 VanDerWaalsContact CG-OG 3.23Å; D163-S165 PolarHBondContact O-N 3.34Å; D163-S165 VanDerWaalsContact OD1-CB 3.29Å; D163-S165 WeakPolarHBondContact OD1-CB 3.27Å; D163-S165 PolarHBondContact OD1-N 3.12Å; D163-S165 PolarHBondContact OD1-OG 2.95Å; D163-S165 PolarHBondContact OD2-OG 3.41Å; D163-V166 HydrophobicContact CB-CG2 4.28Å; D163-K190 PolarHBondContact O-NZ 2.88Å
164	P	55.1	Low	67.5	Low	109 Å²	109	64 Å²	64	71%	0.708	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-17.4	-179.5	30.7	-35.8	0	0	0	114.1	T162	T162-P164 WeakPolarHBondContact O-CD 3.34Å
165	S	53.6	Low	69.5	Low	94 Å²	94	63.7 Å²	63.7	66%	0.657	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-25.4	179.7	71.8	0	0	0	0	113.1	D163 I167	D163-S165 VanDerWaalsContact C-N 3.29Å; D163-S165 VanDerWaalsContact CG-OG 3.23Å; D163-S165 PolarHBondContact O-N 3.34Å; D163-S165 VanDerWaalsContact OD1-CB 3.29Å; D163-S165 WeakPolarHBondContact OD1-CB 3.27Å; D163-S165 PolarHBondContact OD1-N 3.12Å; D163-S165 PolarHBondContact OD1-OG 2.95Å; D163-S165 PolarHBondContact OD2-OG 3.41Å; S165-I167 PolarHBondContact O-N 2.84Å
166	V	66.6	Low	71.2	Confident	46 Å²	46	60.1 Å²	60.1	28%	0.279	33%	0.331	S	S	.	.			trans	-93.8	73.8	-176.8	-168.6	0	0	0	0	110.7	D163 K190 P191	D163-V166 HydrophobicContact CB-CG2 4.28Å; V166-K190 VanDerWaalsContact O-CD 3.23Å; V166-K190 WeakPolarHBondContact O-CD 3.05Å; V166-K190 WeakPolarHBondContact O-CE 3.43Å; V166-K190 VanDerWaalsContact O-CG 3.29Å; V166-K190 WeakPolarHBondContact O-CG 3.41Å; V166-P191 HydrophobicContact CG1-CG 3.97Å
167	I	77.9	Confident	72.6	Confident	81 Å²	81	56.7 Å²	56.7	42%	0.415	32%	0.317	S	S	.	.			trans	-123	125.5	171.4	-64	174.2	0	0	0	108.7	S165 A170 V188	S165-I167 PolarHBondContact O-N 2.84Å; I167-A170 HydrophobicContact CG2-CB 4.08Å; I167-V188 HydrophobicContact CD1-CG1 4.11Å; I167-V188 HydrophobicContact CG1-CG1 4.15Å; I167-V188 HydrophobicContact CG2-CG1 4.04Å
168	V	82	Confident	73.7	Confident	58 Å²	58	58.1 Å²	58.1	35%	0.352	33%	0.327	S	S	.	.	S	Bend	trans	-83.9	-40.6	179.3	-177.5	0	0	0	0	110.7	L189 P191 A277	V168-L189 HydrophobicContact CB-CB 4.5Å; V168-L189 HydrophobicContact CB-CD2 4.27Å; V168-L189 HydrophobicContact CB-CG 4.1Å; V168-L189 HydrophobicContact CG1-CD2 4.18Å; V168-L189 PolarHBondContact N-O 3.49Å; V168-P191 HydrophobicContact CG2-CG 4.27Å; V168-A277 HydrophobicContact CG1-CB 4.29Å
169	M	85.9	Confident	74.8	Confident	40 Å²	40	62.3 Å²	62.3	20%	0.197	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	147.2	177.9	-175.3	171.8	-77.6	0	0	109.9	L189 C273 W274 A277	M169-L189 HydrophobicContact CB-CB 4.23Å; M169-L189 HydrophobicContact CB-CD2 4.38Å; M169-L189 PolarHBondContact O-N 2.88Å; M169-C273 HydrophobicContact CE-CB 4.39Å; M169-C273 WeakPolarHBondContact CE-SG 3.46Å; M169-W274 HydrophobicContact CG-CD2 4.37Å; M169-W274 HydrophobicContact CG-CH2 4.11Å; M169-W274 HydrophobicContact CG-CZ2 3.94Å; M169-W274 HydrophobicContact CG-CZ3 4.39Å; M169-W274 HydrophobicContact SD-CB 4.39Å; M169-W274 HydrophobicContact SD-CD2 3.35Å; M169-W274 HydrophobicContact SD-CE3 3.77Å; M169-W274 HydrophobicContact SD-CG 3.64Å; M169-W274 HydrophobicContact SD-CH2 4.32Å; M169-W274 HydrophobicContact SD-CZ2 3.96Å; M169-W274 HydrophobicContact SD-CZ3 4.23Å; M169-A277 HydrophobicContact CB-CB 4.37Å; M169-A277 HydrophobicContact CE-CB 3.71Å; M169-A277 HydrophobicContact SD-CB 4.12Å
170	A	89.5	Confident	75.9	Confident	39 Å²	39	66.5 Å²	66.5	32%	0.322	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	112.5	171.9	0	0	0	0	0	111.9	I167 W186 C187 V188	I167-A170 HydrophobicContact CG2-CB 4.08Å; A170-W186 HydrophobicContact CB-CZ2 3.81Å; A170-W186 WeakPolarHBondContact O-CH2 3.37Å; A170-C187 VanDerWaalsContact CA-O 3.27Å; A170-C187 WeakPolarHBondContact CA-O 3.34Å; A170-V188 HydrophobicContact CB-CB 4.46Å; A170-V188 HydrophobicContact CB-CG1 4.34Å; A170-V188 HydrophobicContact CB-CG2 4.07Å
171	D	91.6	Very high	77.3	Confident	78 Å²	78	66.2 Å²	66.2	42%	0.417	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	178.9	174.1	-160.5	9.4	0	0	0	112.1	W186 C187 W274	D171-W186 VanDerWaalsContact CA-CZ3 3.44Å; D171-W186 HydrophobicContact CB-CZ3 4.48Å; D171-W186 WeakPolarHBondContact OD1-CZ3 3.42Å; D171-C187 PolarHBondContact N-O 3.48Å; D171-C187 VanDerWaalsContact N-O 3.09Å; D171-C187 PolarHBondContact O-N 2.93Å; D171-W274 HydrophobicContact CB-CZ2 4.09Å
172	W	90.6	Very high	78.8	Confident	81 Å²	81	69.7 Å²	69.7	31%	0.307	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	121.6	176.9	-65	97.9	0	0	0	113.5	K184 L185 W186	W172-K184 HydrophobicContact CB-CD 4.3Å; W172-K184 HydrophobicContact CB-CG 4.08Å; W172-K184 HydrophobicContact CD2-CD 4.31Å; W172-K184 HydrophobicContact CD2-CG 4.23Å; W172-K184 HydrophobicContact CE3-CD 4.24Å; W172-K184 HydrophobicContact CE3-CG 3.78Å; W172-K184 HydrophobicContact CG-CD 4.38Å; W172-K184 HydrophobicContact CG-CG 4.41Å; W172-L185 WeakPolarHBondContact CA-O 3.23Å; W172-L185 VanDerWaalsContact CE3-C 3.4Å; W172-W186 AromaticContact CD1-CE3 3.51Å; W172-W186 AromaticContact CD1-CZ3 3.52Å; W172-W186 HydrophobicContact CD2-CB 4.42Å; W172-W186 AromaticContact CD2-CE3 3.79Å; W172-W186 HydrophobicContact CD2-CE3 3.79Å; W172-W186 AromaticContact CE2-CE3 3.66Å; W172-W186 HydrophobicContact CE3-CB 4.09Å; W172-W186 AromaticContact CG-CE3 3.74Å; W172-W186 HydrophobicContact CG-CE3 3.74Å; W172-W186 HydrophobicContact CG-CZ3 4.14Å; W172-W186 HydrophobicContact CH2-CB 4.37Å; W172-W186 HydrophobicContact CZ2-CE3 4.37Å; W172-W186 HydrophobicContact CZ3-CB 4.07Å; W172-W186 AromaticContact NE1-CE3 3.45Å; W172-W186 AromaticContact NE1-CZ3 3.63Å
173	L	91.9	Very high	80.6	Confident	2 Å²	2	67.6 Å²	67.6	1%	0.01	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	150.6	165.6	-67.1	173.9	0	0	0	111	K184 L185 C187 F228 F263 A265 W274	L173-K184 WeakPolarHBondContact O-CA 3.08Å; L173-L185 PolarHBondContact N-O 3.02Å; L173-L185 PolarHBondContact O-N 3.39Å; L173-C187 HydrophobicContact CD1-CB 4.26Å; L173-F228 HydrophobicContact CD1-CZ 4.01Å; L173-F228 HydrophobicContact CD2-CZ 4.47Å; L173-F263 HydrophobicContact CB-CD1 3.93Å; L173-F263 HydrophobicContact CD1-CB 4.29Å; L173-F263 HydrophobicContact CD1-CD1 3.43Å; L173-F263 VanDerWaalsContact CD1-CD1 3.43Å; L173-F263 HydrophobicContact CD1-CE1 3.95Å; L173-F263 HydrophobicContact CD1-CG 4.07Å; L173-F263 HydrophobicContact CG-CD1 4.3Å; L173-A265 HydrophobicContact CD2-CB 4.28Å; L173-W274 HydrophobicContact CD1-CD2 3.78Å; L173-W274 HydrophobicContact CD1-CE3 3.85Å; L173-W274 HydrophobicContact CD1-CG 4.37Å; L173-W274 HydrophobicContact CD1-CH2 4.18Å; L173-W274 HydrophobicContact CD1-CZ2 4.1Å; L173-W274 HydrophobicContact CD1-CZ3 4.05Å; L173-W274 HydrophobicContact CD2-CD2 4.12Å; L173-W274 HydrophobicContact CD2-CG 4.02Å; L173-W274 HydrophobicContact CG-CD2 4.2Å; L173-W274 HydrophobicContact CG-CZ2 4.08Å
174	K	91.4	Very high	82.2	Confident	100 Å²	100	70.5 Å²	70.5	44%	0.435	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	115.1	164.9	-71.1	172	-177.9	167.6	0	108	W182 T183 K184 F263 R264	K174-W182 HydrophobicContact CB-CE3 4.04Å; K174-W182 WeakPolarHBondContact O-CZ3 3.34Å; K174-T183 CarbonylContact C-O 3.54Å; K174-T183 WeakPolarHBondContact CA-O 3.25Å; K174-K184 HydrophobicContact CG-CB 4.44Å; K174-F263 CarbonylContact O-C 3.6Å; K174-F263 WeakPolarHBondContact O-CA 3.29Å; K174-R264 HydrophobicContact CB-CB 4.24Å; K174-R264 PolarHBondContact N-O 2.9Å; K174-R264 PolarHBondContact O-N 2.97Å
175	I	92	Very high	83.9	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	140.4	178.9	-50.8	-167.5	0	0	0	109.2	W182 T183 L185 I196 L256 L261 F263	I175-W182 WeakPolarHBondContact O-CA 3.27Å; I175-T183 PolarHBondContact N-O 3.2Å; I175-T183 PolarHBondContact O-N 2.64Å; I175-L185 HydrophobicContact CB-CD1 4.33Å; I175-L185 HydrophobicContact CD1-CB 4.14Å; I175-L185 HydrophobicContact CD1-CD1 3.98Å; I175-L185 HydrophobicContact CG1-CB 4.37Å; I175-L185 HydrophobicContact CG1-CD1 4.31Å; I175-I196 HydrophobicContact CD1-CD1 3.83Å; I175-I196 HydrophobicContact CD1-CG1 4.46Å; I175-I196 HydrophobicContact CD1-CG2 3.94Å; I175-L256 HydrophobicContact CG2-CD2 4.03Å; I175-L261 HydrophobicContact CG2-CD2 3.61Å; I175-L261 HydrophobicContact CG2-CG 4.47Å; I175-F263 HydrophobicContact CD1-CD1 4.02Å; I175-F263 HydrophobicContact CD1-CE1 3.56Å; I175-F263 HydrophobicContact CG1-CD1 3.79Å; I175-F263 HydrophobicContact CG1-CE1 3.88Å
176	R	88.6	Confident	85.7	Confident	88 Å²	88	62.7 Å²	62.7	33%	0.332	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	124.8	178.1	-157.4	-177.9	-171.9	-173.8	2.7	112.3	K180 S181 W182 I262	R176-K180 PolarHBondContact NE-O 2.84Å; R176-S181 CarbonylContact C-O 3.28Å; R176-S181 VanDerWaalsContact CA-O 3.29Å; R176-S181 WeakPolarHBondContact CA-O 3.4Å; R176-S181 WeakPolarHBondContact CG-O 3.46Å; R176-W182 HydrophobicContact CB-CD2 4.26Å; R176-W182 HydrophobicContact CB-CE3 3.94Å; R176-W182 HydrophobicContact CB-CH2 4.21Å; R176-W182 HydrophobicContact CB-CZ2 4.48Å; R176-W182 HydrophobicContact CB-CZ3 3.91Å; R176-W182 HydrophobicContact CG-CD2 4.24Å; R176-W182 HydrophobicContact CG-CE3 4.42Å; R176-W182 HydrophobicContact CG-CZ2 4.36Å; R176-I262 HydrophobicContact CB-CB 4.09Å; R176-I262 PolarHBondContact N-O 3.13Å
177	G	85	Confident	87	Confident	5 Å²	5	60.5 Å²	60.5	5%	0.052	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-80.4	167.8	173.4	0	0	0	0	0	113.3	L179 K180 S181	G177-L179 VanDerWaalsContact C-N 3.26Å; G177-L179 PolarHBondContact O-N 3.14Å; G177-K180 WeakPolarHBondContact O-CA 3.36Å; G177-K180 PolarHBondContact O-N 2.98Å; G177-S181 PolarHBondContact N-O 2.68Å
178	T	79.9	Confident	87.6	Confident	69 Å²	69	57.3 Å²	57.3	42%	0.423	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-34.5	179	59.2	0	0	0	0	112.4	K180 P255 P257	T178-K180 PolarHBondContact O-N 3.44Å; T178-P255 HydrophobicContact CG2-CB 4.42Å; T178-P255 PolarHBondContact N-O 2.86Å; T178-P255 WeakPolarHBondContact OG1-CG 3.21Å; T178-P255 PolarHBondContact OG1-O 3.46Å; T178-P257 HydrophobicContact CG2-CB 4.28Å; T178-P257 HydrophobicContact CG2-CG 4.06Å
179	L	78.6	Confident	87.9	Confident	139 Å²	139	54.6 Å²	54.6	73%	0.728	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	16.8	172.1	-59.4	179.9	0	0	0	113.5	G177 S181	G177-L179 VanDerWaalsContact C-N 3.26Å; G177-L179 PolarHBondContact O-N 3.14Å; L179-S181 PolarHBondContact O-N 3.33Å
180	K	78.1	Confident	88	Confident	152 Å²	152	53.3 Å²	53.3	66%	0.661	26%	0.258	S	S	*	.	S	Bend	trans	63.1	0.4	178.6	-58.7	172	-175.2	170.6	0	115.3	R176 G177 T178	R176-K180 PolarHBondContact NE-O 2.84Å; G177-K180 WeakPolarHBondContact O-CA 3.36Å; G177-K180 PolarHBondContact O-N 2.98Å; T178-K180 PolarHBondContact O-N 3.44Å
181	S	83.6	Confident	87.5	Confident	40 Å²	40	53 Å²	53	28%	0.28	25%	0.253	S	S	.	.			trans	-60.3	159.5	170.5	54.2	0	0	0	0	112.5	R176 G177 L179 Q254	R176-S181 CarbonylContact C-O 3.28Å; R176-S181 VanDerWaalsContact CA-O 3.29Å; R176-S181 WeakPolarHBondContact CA-O 3.4Å; R176-S181 WeakPolarHBondContact CG-O 3.46Å; G177-S181 PolarHBondContact N-O 2.68Å; L179-S181 PolarHBondContact O-N 3.33Å; S181-Q254 PolarHBondContact OG-OE1 3.31Å; S181-Q254 VanDerWaalsContact OG-OE1 3.07Å
182	W	86.8	Confident	86.9	Confident	97 Å²	97	49.6 Å²	49.6	37%	0.367	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	130.4	173	-68.6	95.7	0	0	0	110.3	K174 I175 R176 I262 R264	K174-W182 HydrophobicContact CB-CE3 4.04Å; K174-W182 WeakPolarHBondContact O-CZ3 3.34Å; I175-W182 WeakPolarHBondContact O-CA 3.27Å; R176-W182 HydrophobicContact CB-CD2 4.26Å; R176-W182 HydrophobicContact CB-CE3 3.94Å; R176-W182 HydrophobicContact CB-CH2 4.21Å; R176-W182 HydrophobicContact CB-CZ2 4.48Å; R176-W182 HydrophobicContact CB-CZ3 3.91Å; R176-W182 HydrophobicContact CG-CD2 4.24Å; R176-W182 HydrophobicContact CG-CE3 4.42Å; R176-W182 HydrophobicContact CG-CZ2 4.36Å; W182-I262 HydrophobicContact CH2-CG2 3.98Å; W182-R264 HydrophobicContact CE3-CB 4.23Å; W182-R264 HydrophobicContact CH2-CB 3.83Å; W182-R264 HydrophobicContact CZ3-CB 3.56Å
183	T	88.4	Confident	86.7	Confident	39 Å²	39	46.4 Å²	46.4	24%	0.239	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129.2	-179	-56.8	0	0	0	0	109.7	K174 I175 L185 Q254	K174-T183 CarbonylContact C-O 3.54Å; K174-T183 WeakPolarHBondContact CA-O 3.25Å; I175-T183 PolarHBondContact N-O 3.2Å; I175-T183 PolarHBondContact O-N 2.64Å; T183-L185 HydrophobicContact CG2-CD1 4.48Å; T183-L185 HydrophobicContact CG2-CD2 4.06Å; T183-L185 HydrophobicContact CG2-CG 4.05Å; T183-L185 PolarHBondContact O-N 3.34Å; T183-Q254 PolarHBondContact OG1-OE1 2.7Å
184	K	90.1	Very high	86.6	Confident	123 Å²	123	46.3 Å²	46.3	54%	0.535	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.6	178.1	-166.5	-175.6	175.2	-175.4	0	108.7	W172 L173 K174	W172-K184 HydrophobicContact CB-CD 4.3Å; W172-K184 HydrophobicContact CB-CG 4.08Å; W172-K184 HydrophobicContact CD2-CD 4.31Å; W172-K184 HydrophobicContact CD2-CG 4.23Å; W172-K184 HydrophobicContact CE3-CD 4.24Å; W172-K184 HydrophobicContact CE3-CG 3.78Å; W172-K184 HydrophobicContact CG-CD 4.38Å; W172-K184 HydrophobicContact CG-CG 4.41Å; L173-K184 WeakPolarHBondContact O-CA 3.08Å; K174-K184 HydrophobicContact CG-CB 4.44Å
185	L	90.8	Very high	86.4	Confident	9 Å²	9	41.9 Å²	41.9	5%	0.047	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	144.2	-175.7	-67.1	174.6	0	0	0	110.6	W172 L173 I175 T183 I196 V206	W172-L185 WeakPolarHBondContact CA-O 3.23Å; W172-L185 VanDerWaalsContact CE3-C 3.4Å; L173-L185 PolarHBondContact N-O 3.02Å; L173-L185 PolarHBondContact O-N 3.39Å; I175-L185 HydrophobicContact CB-CD1 4.33Å; I175-L185 HydrophobicContact CD1-CB 4.14Å; I175-L185 HydrophobicContact CD1-CD1 3.98Å; I175-L185 HydrophobicContact CG1-CB 4.37Å; I175-L185 HydrophobicContact CG1-CD1 4.31Å; T183-L185 HydrophobicContact CG2-CD1 4.48Å; T183-L185 HydrophobicContact CG2-CD2 4.06Å; T183-L185 HydrophobicContact CG2-CG 4.05Å; T183-L185 PolarHBondContact O-N 3.34Å; L185-I196 HydrophobicContact CB-CG2 3.92Å; L185-I196 HydrophobicContact CD1-CG2 3.93Å; L185-I196 HydrophobicContact CG-CG2 4.48Å; L185-V206 HydrophobicContact CD1-CG1 4.32Å; L185-V206 HydrophobicContact CD2-CG2 4.28Å
186	W	91.3	Very high	86.3	Confident	30 Å²	30	41.9 Å²	41.9	11%	0.114	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	118.3	-179.5	-178	-101.9	0	0	0	109.1	A170 D171 W172 Y197 N200	A170-W186 HydrophobicContact CB-CZ2 3.81Å; A170-W186 WeakPolarHBondContact O-CH2 3.37Å; D171-W186 VanDerWaalsContact CA-CZ3 3.44Å; D171-W186 HydrophobicContact CB-CZ3 4.48Å; D171-W186 WeakPolarHBondContact OD1-CZ3 3.42Å; W172-W186 AromaticContact CD1-CE3 3.51Å; W172-W186 AromaticContact CD1-CZ3 3.52Å; W172-W186 HydrophobicContact CD2-CB 4.42Å; W172-W186 AromaticContact CD2-CE3 3.79Å; W172-W186 HydrophobicContact CD2-CE3 3.79Å; W172-W186 AromaticContact CE2-CE3 3.66Å; W172-W186 HydrophobicContact CE3-CB 4.09Å; W172-W186 AromaticContact CG-CE3 3.74Å; W172-W186 HydrophobicContact CG-CE3 3.74Å; W172-W186 HydrophobicContact CG-CZ3 4.14Å; W172-W186 HydrophobicContact CH2-CB 4.37Å; W172-W186 HydrophobicContact CZ2-CE3 4.37Å; W172-W186 HydrophobicContact CZ3-CB 4.07Å; W172-W186 AromaticContact NE1-CE3 3.45Å; W172-W186 AromaticContact NE1-CZ3 3.63Å; W186-Y197 PolarHBondContact N-O 3.08Å; W186-Y197 PolarHBondContact O-N 2.86Å; W186-N200 HydrophobicContact CD2-CB 3.73Å; W186-N200 HydrophobicContact CE3-CB 4.01Å; W186-N200 HydrophobicContact CG-CB 4.08Å; W186-N200 WeakPolarHBondContact CH2-ND2 3.48Å; W186-N200 HydrophobicContact CZ2-CB 4.4Å; W186-N200 WeakPolarHBondContact CZ2-ND2 3.41Å; W186-N200 HydrophobicContact CZ3-CB 4.44Å; W186-N200 WeakPolarHBondContact CZ3-ND2 3.45Å
187	C	92.1	Very high	86.2	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	129.6	-173.3	-64.1	0	0	0	0	109.2	A170 D171 L173 L194 L195 W274	A170-C187 VanDerWaalsContact CA-O 3.27Å; A170-C187 WeakPolarHBondContact CA-O 3.34Å; D171-C187 PolarHBondContact N-O 3.48Å; D171-C187 VanDerWaalsContact N-O 3.09Å; D171-C187 PolarHBondContact O-N 2.93Å; L173-C187 HydrophobicContact CD1-CB 4.26Å; C187-L194 HydrophobicContact CB-CD1 4.21Å; C187-L195 WeakPolarHBondContact CA-O 3.02Å; C187-W274 HydrophobicContact CB-CH2 3.61Å; C187-W274 HydrophobicContact CB-CZ2 4.18Å; C187-W274 HydrophobicContact CB-CZ3 4.32Å
188	V	90.6	Very high	86.2	Confident	15 Å²	15	43.2 Å²	43.2	9%	0.091	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	111.2	178.7	-178.1	0	0	0	0	108.6	I167 A170 L195 Y197	I167-V188 HydrophobicContact CD1-CG1 4.11Å; I167-V188 HydrophobicContact CG1-CG1 4.15Å; I167-V188 HydrophobicContact CG2-CG1 4.04Å; A170-V188 HydrophobicContact CB-CB 4.46Å; A170-V188 HydrophobicContact CB-CG1 4.34Å; A170-V188 HydrophobicContact CB-CG2 4.07Å; V188-L195 HydrophobicContact CB-CB 4.32Å; V188-L195 PolarHBondContact N-O 2.97Å; V188-L195 PolarHBondContact O-N 3.31Å; V188-Y197 HydrophobicContact CB-CE2 4.38Å; V188-Y197 HydrophobicContact CG2-CD2 4.17Å; V188-Y197 HydrophobicContact CG2-CE2 4.09Å
189	L	89.9	Confident	86.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	128.4	-177.9	-178.2	59.8	0	0	0	110.9	V168 M169 L194 L211 W274 A277 L278 A281	V168-L189 HydrophobicContact CB-CB 4.5Å; V168-L189 HydrophobicContact CB-CD2 4.27Å; V168-L189 HydrophobicContact CB-CG 4.1Å; V168-L189 HydrophobicContact CG1-CD2 4.18Å; V168-L189 PolarHBondContact N-O 3.49Å; M169-L189 HydrophobicContact CB-CB 4.23Å; M169-L189 HydrophobicContact CB-CD2 4.38Å; M169-L189 PolarHBondContact O-N 2.88Å; L189-L194 HydrophobicContact CB-CD1 4.08Å; L189-L194 HydrophobicContact CD1-CB 4.29Å; L189-L194 HydrophobicContact CD1-CD1 4.16Å; L189-L211 HydrophobicContact CD1-CD1 3.53Å; L189-W274 HydrophobicContact CB-CZ3 4.17Å; L189-A277 HydrophobicContact CD2-CB 3.84Å; L189-A277 WeakPolarHBondContact CD2-O 3.25Å; L189-L278 HydrophobicContact CD1-CD2 3.68Å; L189-L278 HydrophobicContact CD2-CD2 4.17Å; L189-L278 HydrophobicContact CD2-CG 4.17Å; L189-A281 HydrophobicContact CD1-CB 3.74Å; L189-A281 HydrophobicContact CD2-CB 4.07Å; L189-A281 HydrophobicContact CG-CB 3.96Å
190	K	86.6	Confident	85.8	Confident	13 Å²	13	40.3 Å²	40.3	6%	0.057	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	164.4	171.9	-63.9	-159	165.2	-162.5	0	109.7	I161 D163 V166 G192 V193 L195	I161-K190 PolarHBondContact O-NZ 2.83Å; D163-K190 PolarHBondContact O-NZ 2.88Å; V166-K190 VanDerWaalsContact O-CD 3.23Å; V166-K190 WeakPolarHBondContact O-CD 3.05Å; V166-K190 WeakPolarHBondContact O-CE 3.43Å; V166-K190 VanDerWaalsContact O-CG 3.29Å; V166-K190 WeakPolarHBondContact O-CG 3.41Å; K190-G192 PolarHBondContact O-N 2.94Å; K190-V193 CarbonylContact C-O 3.56Å; K190-V193 HydrophobicContact CB-CG2 3.93Å; K190-V193 PolarHBondContact N-O 2.59Å; K190-V193 PolarHBondContact O-N 3.07Å; K190-L195 HydrophobicContact CD-CD1 4.44Å
191	P	80.8	Confident	84.8	Confident	34 Å²	34	41.7 Å²	41.7	22%	0.221	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	124.7	174.9	-26.3	36.5	0	0	0	111.4	V166 V168 V193 C284 L288	V166-P191 HydrophobicContact CG1-CG 3.97Å; V168-P191 HydrophobicContact CG2-CG 4.27Å; P191-V193 PolarHBondContact O-N 3.03Å; P191-V193 VanDerWaalsContact O-N 3.12Å; P191-C284 HydrophobicContact CB-CB 4.37Å; P191-L288 HydrophobicContact CB-CD1 3.79Å
192	G	77.7	Confident	83.5	Confident	5 Å²	5	47.4 Å²	47.4	5%	0.052	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.2	-8.4	-179.7	0	0	0	0	0	117.8	K190 L211 N212 A281	K190-G192 PolarHBondContact O-N 2.94Å; G192-L211 WeakPolarHBondContact O-CB 3.43Å; G192-L211 PolarHBondContact O-N 3Å; G192-N212 VanDerWaalsContact CA-OD1 3.27Å; G192-N212 WeakPolarHBondContact CA-OD1 3.29Å; G192-N212 PolarHBondContact O-OD1 3.02Å; G192-A281 PolarHBondContact N-O 2.97Å
193	V	86.5	Confident	82.3	Confident	15 Å²	15	43.5 Å²	43.5	9%	0.091	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	141.5	-179.9	-61	0	0	0	0	113.9	K190 P191 V209 L210	K190-V193 CarbonylContact C-O 3.56Å; K190-V193 HydrophobicContact CB-CG2 3.93Å; K190-V193 PolarHBondContact N-O 2.59Å; K190-V193 PolarHBondContact O-N 3.07Å; P191-V193 PolarHBondContact O-N 3.03Å; P191-V193 VanDerWaalsContact O-N 3.12Å; V193-V209 WeakPolarHBondContact CA-O 3.46Å; V193-L210 HydrophobicContact CG1-CD2 4.03Å
194	L	89.3	Confident	81.7	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	119	171.8	174.9	69.2	0	0	0	109.4	C187 L189 I196 V209 L211 F263 W274 L278	C187-L194 HydrophobicContact CB-CD1 4.21Å; L189-L194 HydrophobicContact CB-CD1 4.08Å; L189-L194 HydrophobicContact CD1-CB 4.29Å; L189-L194 HydrophobicContact CD1-CD1 4.16Å; L194-I196 HydrophobicContact CG-CG1 4.39Å; L194-V209 HydrophobicContact CB-CB 4.25Å; L194-V209 PolarHBondContact N-O 3.04Å; L194-V209 PolarHBondContact O-N 3.49Å; L194-L211 HydrophobicContact CB-CD1 4.49Å; L194-L211 HydrophobicContact CB-CD2 4.01Å; L194-L211 HydrophobicContact CB-CG 4.44Å; L194-F263 HydrophobicContact CD2-CE1 4.15Å; L194-F263 HydrophobicContact CD2-CZ 3.65Å; L194-W274 HydrophobicContact CD1-CZ3 4.16Å; L194-L278 HydrophobicContact CD2-CD2 4.44Å
195	L	88.1	Confident	81.4	Confident	7 Å²	7	42.1 Å²	42.1	4%	0.037	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	132.6	-179.8	-59.9	167.5	0	0	0	109.6	C187 V188 K190 Y197 T208 P244	C187-L195 WeakPolarHBondContact CA-O 3.02Å; V188-L195 HydrophobicContact CB-CB 4.32Å; V188-L195 PolarHBondContact N-O 2.97Å; V188-L195 PolarHBondContact O-N 3.31Å; K190-L195 HydrophobicContact CD-CD1 4.44Å; L195-Y197 HydrophobicContact CB-CD2 4.46Å; L195-Y197 HydrophobicContact CB-CE2 3.6Å; L195-T208 HydrophobicContact CD2-CG2 3.78Å; L195-T208 WeakPolarHBondContact CD2-OG1 3.5Å; L195-P244 HydrophobicContact CD2-CG 4.18Å
196	I	89.8	Confident	81	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127	-176	-55.6	174.3	0	0	0	109.4	I175 L185 L194 V206 G207 V209 W239 L261	I175-I196 HydrophobicContact CD1-CD1 3.83Å; I175-I196 HydrophobicContact CD1-CG1 4.46Å; I175-I196 HydrophobicContact CD1-CG2 3.94Å; L185-I196 HydrophobicContact CB-CG2 3.92Å; L185-I196 HydrophobicContact CD1-CG2 3.93Å; L185-I196 HydrophobicContact CG-CG2 4.48Å; L194-I196 HydrophobicContact CG-CG1 4.39Å; I196-V206 HydrophobicContact CG2-CB 4.17Å; I196-V206 HydrophobicContact CG2-CG1 4.44Å; I196-V206 PolarHBondContact O-N 2.92Å; I196-G207 PolarHBondContact N-O 3.31Å; I196-G207 PolarHBondContact O-N 3.41Å; I196-V209 HydrophobicContact CD1-CG2 3.96Å; I196-W239 HydrophobicContact CD1-CH2 3.91Å; I196-W239 HydrophobicContact CD1-CZ3 3.98Å; I196-L261 HydrophobicContact CD1-CD1 3.59Å
197	Y	87.1	Confident	80.7	Confident	45 Å²	45	42 Å²	42	18%	0.176	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	155.2	-177.1	-58.5	-86.3	0	0	0	111.4	W186 V188 L195 Q204 W205	W186-Y197 PolarHBondContact N-O 3.08Å; W186-Y197 PolarHBondContact O-N 2.86Å; V188-Y197 HydrophobicContact CB-CE2 4.38Å; V188-Y197 HydrophobicContact CG2-CD2 4.17Å; V188-Y197 HydrophobicContact CG2-CE2 4.09Å; L195-Y197 HydrophobicContact CB-CD2 4.46Å; L195-Y197 HydrophobicContact CB-CE2 3.6Å; Y197-Q204 WeakPolarHBondContact CA-O 3.43Å; Y197-W205 HydrophobicContact CD1-CB 4.21Å; Y197-W205 HydrophobicContact CE1-CB 4.14Å
198	K	83.6	Confident	80.4	Confident	76 Å²	76	42.6 Å²	42.6	33%	0.33	22%	0.219	S	C	.	.	S	Bend	trans	-77.4	-26.1	176.1	-168.3	174.2	169.7	-172.9	0	113	Q204 V206 T253	K198-Q204 HydrophobicContact CB-CB 4.21Å; K198-Q204 HydrophobicContact CD-CB 4.39Å; K198-Q204 VanDerWaalsContact CD-OE1 3.3Å; K198-Q204 PolarHBondContact N-O 3.23Å; K198-V206 HydrophobicContact CB-CG2 4.06Å; K198-T253 HydrophobicContact CD-CG2 4.32Å
199	T	78.4	Confident	80.3	Confident	68 Å²	68	41.9 Å²	41.9	42%	0.417	22%	0.215	S	C	.	.	S	Bend	trans	-145.9	157.4	178.4	53.3	0	0	0	0	111.3	G203	T199-G203 WeakPolarHBondContact OG1-CA 3.33Å
200	N	72.1	Confident	80.1	Confident	78 Å²	78	43.6 Å²	43.6	42%	0.417	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-49.9	-175.3	170	-55.6	0	0	0	113.5	W186	W186-N200 HydrophobicContact CD2-CB 3.73Å; W186-N200 HydrophobicContact CE3-CB 4.01Å; W186-N200 HydrophobicContact CG-CB 4.08Å; W186-N200 WeakPolarHBondContact CH2-ND2 3.48Å; W186-N200 HydrophobicContact CZ2-CB 4.4Å; W186-N200 WeakPolarHBondContact CZ2-ND2 3.41Å; W186-N200 HydrophobicContact CZ3-CB 4.44Å; W186-N200 WeakPolarHBondContact CZ3-ND2 3.45Å
201	K	56.4	Low	80	Confident	181 Å²	181	43 Å²	43	79%	0.787	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.7	118.2	-177.5	-62.5	-173.2	178.8	-176.7	0	110.9	G203	K201-G203 PolarHBondContact O-N 3.15Å
202	N	57.4	Low	79.8	Confident	160 Å²	160	45.5 Å²	45.5	86%	0.856	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.9	32.8	179.7	-69.1	4.2	0	0	0	114.8
203	G	62.3	Low	79.5	Confident	15 Å²	15	47.1 Å²	47.1	16%	0.155	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-69.8	157.8	-167.6	0	0	0	0	0	115.4	T199 K201 W205	T199-G203 WeakPolarHBondContact OG1-CA 3.33Å; K201-G203 PolarHBondContact O-N 3.15Å; G203-W205 PolarHBondContact O-N 3.01Å
204	Q	75.3	Confident	79.4	Confident	106 Å²	106	46.9 Å²	46.9	50%	0.495	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-55.9	121.6	170.2	-62.1	-174	-67.1	0	0	109.2	Y197 K198	Y197-Q204 WeakPolarHBondContact CA-O 3.43Å; K198-Q204 HydrophobicContact CB-CB 4.21Å; K198-Q204 HydrophobicContact CD-CB 4.39Å; K198-Q204 VanDerWaalsContact CD-OE1 3.3Å; K198-Q204 PolarHBondContact N-O 3.23Å
205	W	82.8	Confident	79.3	Confident	28 Å²	28	52 Å²	52	11%	0.106	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	131.3	172.9	173.4	77.1	0	0	0	109.9	Y197 G203 G207 T208 E247 V249	Y197-W205 HydrophobicContact CD1-CB 4.21Å; Y197-W205 HydrophobicContact CE1-CB 4.14Å; G203-W205 PolarHBondContact O-N 3.01Å; W205-G207 VanDerWaalsContact CE2-C 3.49Å; W205-G207 VanDerWaalsContact CE2-CA 3.44Å; W205-G207 PolarHBondContact NE1-O 3.4Å; W205-T208 PolarHBondContact NE1-OG1 3.15Å; W205-E247 HydrophobicContact CE3-CB 3.86Å; W205-E247 HydrophobicContact CZ3-CB 4.15Å; W205-V249 HydrophobicContact CH2-CG2 3.58Å; W205-V249 HydrophobicContact CZ3-CG2 4.2Å
206	V	82.2	Confident	79.4	Confident	34 Å²	34	53.4 Å²	53.4	21%	0.206	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-34.6	-179.7	178.3	0	0	0	0	110.5	L185 I196 K198 L256	L185-V206 HydrophobicContact CD1-CG1 4.32Å; L185-V206 HydrophobicContact CD2-CG2 4.28Å; I196-V206 HydrophobicContact CG2-CB 4.17Å; I196-V206 HydrophobicContact CG2-CG1 4.44Å; I196-V206 PolarHBondContact O-N 2.92Å; K198-V206 HydrophobicContact CB-CG2 4.06Å; V206-L256 HydrophobicContact CG1-CD1 4.17Å
207	G	85.3	Confident	79.5	Confident	3 Å²	3	57.5 Å²	57.5	3%	0.031	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.6	163.6	175.5	0	0	0	0	0	113.2	I196 W205	I196-G207 PolarHBondContact N-O 3.31Å; I196-G207 PolarHBondContact O-N 3.41Å; W205-G207 VanDerWaalsContact CE2-C 3.49Å; W205-G207 VanDerWaalsContact CE2-CA 3.44Å; W205-G207 PolarHBondContact NE1-O 3.4Å
208	T	87.2	Confident	79.7	Confident	12 Å²	12	59.5 Å²	59.5	7%	0.074	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125	173.6	-62	0	0	0	0	108	L195 W205 W239 A240	L195-T208 HydrophobicContact CD2-CG2 3.78Å; L195-T208 WeakPolarHBondContact CD2-OG1 3.5Å; W205-T208 PolarHBondContact NE1-OG1 3.15Å; T208-W239 WeakPolarHBondContact O-CA 3.38Å; T208-A240 HydrophobicContact CG2-CB 4.08Å; T208-A240 PolarHBondContact O-N 2.85Å
209	V	87.5	Confident	79.8	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	131.9	177.9	-179.2	0	0	0	0	109.5	V193 L194 I196 L211 L230 I238 W239 L261	V193-V209 WeakPolarHBondContact CA-O 3.46Å; L194-V209 HydrophobicContact CB-CB 4.25Å; L194-V209 PolarHBondContact N-O 3.04Å; L194-V209 PolarHBondContact O-N 3.49Å; I196-V209 HydrophobicContact CD1-CG2 3.96Å; V209-L211 HydrophobicContact CG1-CD2 4.35Å; V209-L230 HydrophobicContact CG1-CD2 3.87Å; V209-I238 CarbonylContact C-O 3.44Å; V209-I238 WeakPolarHBondContact CA-O 3.05Å; V209-I238 HydrophobicContact CG1-CB 4.08Å; V209-I238 HydrophobicContact CG1-CD1 3.9Å; V209-I238 HydrophobicContact CG1-CG1 4.12Å; V209-W239 HydrophobicContact CG2-CD2 4.3Å; V209-W239 HydrophobicContact CG2-CE3 3.72Å; V209-W239 HydrophobicContact CG2-CH2 4.04Å; V209-W239 HydrophobicContact CG2-CZ3 3.57Å; V209-L261 HydrophobicContact CG2-CD1 3.87Å
210	L	85.4	Confident	79.8	Confident	35 Å²	35	64 Å²	64	18%	0.183	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	108.4	177.3	-60.4	179.3	0	0	0	109.3	V193 N212 C214 I238 A240	V193-L210 HydrophobicContact CG1-CD2 4.03Å; L210-N212 VanDerWaalsContact C-N 3.35Å; L210-N212 PolarHBondContact O-N 3.39Å; L210-C214 PolarHBondContact O-SG 2.91Å; L210-I238 PolarHBondContact N-O 3.23Å; L210-A240 HydrophobicContact CD1-CB 4.31Å; L210-A240 HydrophobicContact CD2-CB 4.03Å; L210-A240 HydrophobicContact CG-CB 4.08Å
211	L	84.4	Confident	79.8	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-73.3	-29.4	-174.4	-58.1	178.1	0	0	0	112	L189 G192 L194 V209 A213 C214 L230 L278 A281 L282	L189-L211 HydrophobicContact CD1-CD1 3.53Å; G192-L211 WeakPolarHBondContact O-CB 3.43Å; G192-L211 PolarHBondContact O-N 3Å; L194-L211 HydrophobicContact CB-CD1 4.49Å; L194-L211 HydrophobicContact CB-CD2 4.01Å; L194-L211 HydrophobicContact CB-CG 4.44Å; V209-L211 HydrophobicContact CG1-CD2 4.35Å; L211-A213 PolarHBondContact O-N 2.95Å; L211-C214 WeakPolarHBondContact O-CB 3.46Å; L211-C214 PolarHBondContact O-N 2.83Å; L211-L230 HydrophobicContact CD2-CD1 4.33Å; L211-L230 HydrophobicContact CD2-CD2 3.76Å; L211-L278 HydrophobicContact CD1-CD2 4.24Å; L211-L278 HydrophobicContact CD2-CD2 4.1Å; L211-A281 HydrophobicContact CD1-CB 4.06Å; L211-L282 HydrophobicContact CB-CD2 3.78Å; L211-L282 HydrophobicContact CB-CG 4.3Å; L211-L282 WeakPolarHBondContact O-CD2 3.49Å
212	N	77.9	Confident	80	Confident	88 Å²	88	64.4 Å²	64.4	47%	0.471	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-56.4	-8.4	-172.6	-59.2	-1.7	0	0	0	116.8	G192 L210 S285	G192-N212 VanDerWaalsContact CA-OD1 3.27Å; G192-N212 WeakPolarHBondContact CA-OD1 3.29Å; G192-N212 PolarHBondContact O-OD1 3.02Å; L210-N212 VanDerWaalsContact C-N 3.35Å; L210-N212 PolarHBondContact O-N 3.39Å; N212-S285 WeakPolarHBondContact OD1-CB 3.18Å
213	A	69.4	Low	80.4	Confident	38 Å²	38	64.1 Å²	64.1	31%	0.314	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-132	18.8	175.8	0	0	0	0	0	112.6	L211 H232	L211-A213 PolarHBondContact O-N 2.95Å; A213-H232 PolarHBondContact O-CD2 3.06Å
214	C	84.5	Confident	80.5	Confident	11 Å²	11	70.8 Å²	70.8	7%	0.074	36%	0.359	C	S	.	.			trans	-107.4	138	178.9	-65.9	0	0	0	0	111.7	L210 L211 L230 F231 I238 L282	L210-C214 PolarHBondContact O-SG 2.91Å; L211-C214 WeakPolarHBondContact O-CB 3.46Å; L211-C214 PolarHBondContact O-N 2.83Å; C214-L230 HydrophobicContact CB-CD1 3.64Å; C214-L230 HydrophobicContact CB-CG 3.88Å; C214-F231 CarbonylContact C-O 3.58Å; C214-F231 VanDerWaalsContact CA-O 3.29Å; C214-F231 WeakPolarHBondContact CA-O 3.42Å; C214-I238 WeakPolarHBondContact SG-CG2 3.36Å; C214-L282 WeakPolarHBondContact O-CD2 3.33Å
215	E	87.4	Confident	80.1	Confident	107 Å²	107	66.7 Å²	66.7	50%	0.5	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	162.1	161	-75.8	177.1	-165.4	0	0	111	L230 F231 P233	E215-L230 CarbonylContact O-C 3.59Å; E215-L230 WeakPolarHBondContact O-CA 3.29Å; E215-F231 HydrophobicContact CB-CD1 4.37Å; E215-F231 HydrophobicContact CB-CE1 3.79Å; E215-F231 HydrophobicContact CB-CE2 4.42Å; E215-F231 HydrophobicContact CB-CZ 3.81Å; E215-F231 PolarHBondContact N-O 3.07Å; E215-F231 WeakPolarHBondContact O-CD1 3.33Å; E215-F231 PolarHBondContact O-N 3.09Å; E215-P233 HydrophobicContact CB-CG 4.21Å; E215-P233 HydrophobicContact CG-CG 3.7Å; E215-P233 VanDerWaalsContact OE1-CG 3.29Å; E215-P233 WeakPolarHBondContact OE1-CG 3.4Å
216	L	91	Very high	80.3	Confident	37 Å²	37	66 Å²	66	19%	0.194	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	129.1	-173.1	-178.9	64.3	0	0	0	109.4	F228 L230 M275 L278 L282	L216-F228 HydrophobicContact CD1-CB 4.44Å; L216-F228 HydrophobicContact CD1-CD2 3.67Å; L216-F228 HydrophobicContact CD1-CE2 4.34Å; L216-F228 HydrophobicContact CD1-CG 4.41Å; L216-L230 HydrophobicContact CB-CD1 4.42Å; L216-L230 HydrophobicContact CD1-CB 4.47Å; L216-L230 HydrophobicContact CD1-CD1 4.22Å; L216-M275 HydrophobicContact CD1-CG 4.29Å; L216-M275 HydrophobicContact CD2-CB 4.14Å; L216-M275 HydrophobicContact CD2-CG 3.99Å; L216-M275 HydrophobicContact CG-CE 4.45Å; L216-M275 HydrophobicContact CG-CG 4.22Å; L216-L278 HydrophobicContact CD1-CD1 4.19Å; L216-L278 HydrophobicContact CD2-CB 3.73Å; L216-L278 HydrophobicContact CD2-CD1 4.47Å; L216-L282 HydrophobicContact CB-CD1 4.49Å
217	I	91.3	Very high	80.7	Confident	85 Å²	85	64.9 Å²	64.9	44%	0.436	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	135.1	-178.7	-165.5	173.5	0	0	0	111.8	F228 K229 F231	I217-F228 CarbonylContact O-C 3.58Å; I217-F228 WeakPolarHBondContact O-CA 2.96Å; I217-K229 HydrophobicContact CG2-CB 3.93Å; I217-K229 PolarHBondContact N-O 2.83Å; I217-K229 PolarHBondContact O-N 2.83Å; I217-F231 HydrophobicContact CB-CE1 4.2Å; I217-F231 HydrophobicContact CG2-CD1 4.24Å; I217-F231 HydrophobicContact CG2-CE1 3.7Å
218	E	91.1	Very high	81.1	Confident	88 Å²	88	64.7 Å²	64.7	41%	0.411	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	148	170.9	-172.9	170.8	147.2	0	0	110.2	F226 R272 M275	E218-F226 HydrophobicContact CB-CZ 4.3Å; E218-F226 HydrophobicContact CG-CE1 4.44Å; E218-F226 HydrophobicContact CG-CE2 3.65Å; E218-F226 HydrophobicContact CG-CZ 3.6Å; E218-F226 WeakPolarHBondContact OE1-CE2 3.24Å; E218-F226 VanDerWaalsContact OE2-CE2 3.27Å; E218-F226 WeakPolarHBondContact OE2-CE2 3.25Å; E218-F226 WeakPolarHBondContact OE2-CZ 3.39Å; E218-R272 IonicContact OE1-NH2 2.73Å; E218-R272 IonicContact OE2-CZ 3.93Å; E218-R272 IonicContact OE2-NH1 2.87Å; E218-R272 PolarHBondContact OE2-NH1 2.94Å; E218-R272 IonicContact OE2-NH2 3.88Å; E218-M275 HydrophobicContact CB-CE 4.46Å; E218-M275 HydrophobicContact CB-SD 4.22Å
219	R	86.3	Confident	81.4	Confident	109 Å²	109	65.5 Å²	65.5	41%	0.411	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	130.5	175.2	-79.1	-164.6	168.2	-94.1	-7.8	112.2	S221 C227 K229	R219-S221 PolarHBondContact O-N 3.07Å; R219-C227 HydrophobicContact CB-CB 4.36Å; R219-C227 PolarHBondContact N-O 3.27Å; R219-K229 HydrophobicContact CG-CB 4.29Å
220	P	78.5	Confident	81.7	Confident	130 Å²	130	65.5 Å²	65.5	84%	0.844	34%	0.338	S	S	*	.			trans	-61.8	129.6	178.3	25.6	-34.2	0	0	0	111.1
221	S	72.3	Confident	82	Confident	51 Å²	51	65.5 Å²	65.5	36%	0.357	34%	0.336	S	S	.	.			trans	-108.1	135.3	178.1	-174.5	0	0	0	0	110.8	R219 K223	R219-S221 PolarHBondContact O-N 3.07Å; S221-K223 VanDerWaalsContact C-N 3.32Å; S221-K223 PolarHBondContact OG-N 2.88Å; S221-K223 PolarHBondContact OG-O 2.85Å
222	K	59.8	Low	82.2	Confident	216 Å²	216	66.2 Å²	66.2	94%	0.939	34%	0.34	S	S	*	.	S	Bend	trans	-91.7	16.4	172.4	-66.5	-167.7	175.5	-168.6	0	113.4
223	K	67.4	Low	82.3	Confident	153 Å²	153	64.7 Å²	64.7	67%	0.665	33%	0.334	S	S	*	.	S	Bend	trans	-151.7	149.9	178.5	-66.6	-166.8	176	-165.3	0	109.8	S221 R264	S221-K223 VanDerWaalsContact C-N 3.32Å; S221-K223 PolarHBondContact OG-N 2.88Å; S221-K223 PolarHBondContact OG-O 2.85Å; K223-R264 VanDerWaalsContact CB-NH2 3.31Å; K223-R264 PolarHBondContact O-NH2 2.72Å
224	D	62.9	Low	82.7	Confident	155 Å²	155	69.2 Å²	69.2	83%	0.829	35%	0.353	S	S	*	.	S	Bend	trans	-52.6	133.8	-171	-41.8	-62.4	0	0	0	114.4	R264	D224-R264 PolarHBondContact O-NH2 2.85Å
225	G	68.1	Low	82.4	Confident	21 Å²	21	74.8 Å²	74.8	22%	0.216	38%	0.378	C	S	.	.	S	Bend	trans	98.4	142	-176.4	0	0	0	0	0	113.6
226	F	85.4	Confident	82	Confident	13 Å²	13	73.9 Å²	73.9	6%	0.057	37%	0.373	C	S	.	.			trans	-82.8	145.8	-164.5	179.5	-85.2	0	0	0	113.2	E218 F228 R264 A265 S267 E268 G271 R272 M275	E218-F226 HydrophobicContact CB-CZ 4.3Å; E218-F226 HydrophobicContact CG-CE1 4.44Å; E218-F226 HydrophobicContact CG-CE2 3.65Å; E218-F226 HydrophobicContact CG-CZ 3.6Å; E218-F226 WeakPolarHBondContact OE1-CE2 3.24Å; E218-F226 VanDerWaalsContact OE2-CE2 3.27Å; E218-F226 WeakPolarHBondContact OE2-CE2 3.25Å; E218-F226 WeakPolarHBondContact OE2-CZ 3.39Å; F226-F228 AromaticContact CD1-CD1 3.99Å; F226-F228 HydrophobicContact CD1-CD1 3.99Å; F226-F228 HydrophobicContact CE1-CB 4.29Å; F226-F228 AromaticContact CE1-CD1 3.92Å; F226-F228 HydrophobicContact CE1-CD1 3.92Å; F226-R264 VanDerWaalsContact O-CA 3.3Å; F226-R264 WeakPolarHBondContact O-CA 3.47Å; F226-A265 PolarHBondContact O-N 2.95Å; F226-S267 PolarHBondContact N-O 2.68Å; F226-E268 HydrophobicContact CD2-CG 4Å; F226-G271 WeakPolarHBondContact CE1-O 3.24Å; F226-R272 HydrophobicContact CE2-CG 4Å; F226-R272 HydrophobicContact CZ-CG 4.15Å; F226-M275 HydrophobicContact CE1-CG 4.1Å; F226-M275 HydrophobicContact CE1-SD 3.53Å; F226-M275 VanDerWaalsContact CE1-SD 3.53Å; F226-M275 HydrophobicContact CZ-SD 3.56Å; F226-M275 VanDerWaalsContact CZ-SD 3.56Å
227	C	91.5	Very high	81.6	Confident	10 Å²	10	74.7 Å²	74.7	7%	0.068	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	140.5	-177.1	-65.1	0	0	0	0	111.2	R219 F263	R219-C227 HydrophobicContact CB-CB 4.36Å; R219-C227 PolarHBondContact N-O 3.27Å; C227-F263 VanDerWaalsContact CA-O 3.31Å; C227-F263 WeakPolarHBondContact CA-O 3.35Å
228	F	93.4	Very high	81.3	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	153.6	175.6	56.8	-91.6	0	0	0	111.3	L173 L216 I217 F226 I262 F263 W274 M275 L278	L173-F228 HydrophobicContact CD1-CZ 4.01Å; L173-F228 HydrophobicContact CD2-CZ 4.47Å; L216-F228 HydrophobicContact CD1-CB 4.44Å; L216-F228 HydrophobicContact CD1-CD2 3.67Å; L216-F228 HydrophobicContact CD1-CE2 4.34Å; L216-F228 HydrophobicContact CD1-CG 4.41Å; I217-F228 CarbonylContact O-C 3.58Å; I217-F228 WeakPolarHBondContact O-CA 2.96Å; F226-F228 AromaticContact CD1-CD1 3.99Å; F226-F228 HydrophobicContact CD1-CD1 3.99Å; F226-F228 HydrophobicContact CE1-CB 4.29Å; F226-F228 AromaticContact CE1-CD1 3.92Å; F226-F228 HydrophobicContact CE1-CD1 3.92Å; F228-I262 WeakPolarHBondContact O-CA 3.38Å; F228-F263 HydrophobicContact CD1-CB 4.28Å; F228-F263 HydrophobicContact CD2-CB 3.9Å; F228-F263 AromaticContact CD2-CD2 3.74Å; F228-F263 HydrophobicContact CD2-CD2 3.74Å; F228-F263 HydrophobicContact CD2-CG 4.18Å; F228-F263 HydrophobicContact CE1-CB 3.92Å; F228-F263 HydrophobicContact CE2-CB 3.5Å; F228-F263 AromaticContact CE2-CD2 3.36Å; F228-F263 HydrophobicContact CE2-CD2 3.36Å; F228-F263 HydrophobicContact CE2-CE2 4.16Å; F228-F263 AromaticContact CE2-CG 3.57Å; F228-F263 HydrophobicContact CE2-CG 3.57Å; F228-F263 HydrophobicContact CG-CB 4.29Å; F228-F263 HydrophobicContact CZ-CB 3.52Å; F228-F263 HydrophobicContact CZ-CD2 4.18Å; F228-F263 AromaticContact CZ-CG 3.92Å; F228-F263 HydrophobicContact CZ-CG 3.92Å; F228-F263 PolarHBondContact N-O 3.38Å; F228-F263 VanDerWaalsContact N-O 3.07Å; F228-F263 PolarHBondContact O-N 3.27Å; F228-W274 HydrophobicContact CE1-CB 3.94Å; F228-W274 HydrophobicContact CZ-CB 3.88Å; F228-W274 HydrophobicContact CZ-CG 4.47Å; F228-M275 HydrophobicContact CB-CG 4.03Å; F228-M275 HydrophobicContact CB-SD 3.75Å; F228-M275 HydrophobicContact CD1-CG 4.13Å; F228-M275 HydrophobicContact CD2-CG 4.42Å; F228-M275 HydrophobicContact CG-CG 3.97Å; F228-M275 HydrophobicContact CG-SD 4.34Å; F228-L278 HydrophobicContact CD2-CD1 4.33Å; F228-L278 HydrophobicContact CE2-CD1 3.52Å; F228-L278 HydrophobicContact CZ-CD1 4.08Å
229	K	93.5	Very high	81	Confident	28 Å²	28	68.8 Å²	68.8	12%	0.122	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	123.8	174.8	174.7	-176.6	168.2	-177.3	0	108.9	I217 R219 F231 H260 L261 I262	I217-K229 HydrophobicContact CG2-CB 3.93Å; I217-K229 PolarHBondContact N-O 2.83Å; I217-K229 PolarHBondContact O-N 2.83Å; R219-K229 HydrophobicContact CG-CB 4.29Å; K229-F231 HydrophobicContact CD-CB 4.28Å; K229-F231 HydrophobicContact CD-CD1 4.18Å; K229-F231 HydrophobicContact CD-CG 4.28Å; K229-F231 VanDerWaalsContact CE-CG 3.48Å; K229-F231 HydrophobicContact CG-CB 4.12Å; K229-F231 HydrophobicContact CG-CD1 3.97Å; K229-F231 HydrophobicContact CG-CG 4.32Å; K229-H260 HydrophobicContact CG-CB 4.35Å; K229-L261 WeakPolarHBondContact CA-O 3.37Å; K229-I262 HydrophobicContact CB-CG1 4.36Å; K229-I262 HydrophobicContact CG-CG1 4.37Å
230	L	93.3	Very high	80.8	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	132.2	164.8	-175.1	75.7	0	0	0	107.7	V209 L211 C214 E215 L216 H260 L261 F263	V209-L230 HydrophobicContact CG1-CD2 3.87Å; L211-L230 HydrophobicContact CD2-CD1 4.33Å; L211-L230 HydrophobicContact CD2-CD2 3.76Å; C214-L230 HydrophobicContact CB-CD1 3.64Å; C214-L230 HydrophobicContact CB-CG 3.88Å; E215-L230 CarbonylContact O-C 3.59Å; E215-L230 WeakPolarHBondContact O-CA 3.29Å; L216-L230 HydrophobicContact CB-CD1 4.42Å; L216-L230 HydrophobicContact CD1-CB 4.47Å; L216-L230 HydrophobicContact CD1-CD1 4.22Å; L230-H260 CarbonylContact O-C 3.57Å; L230-H260 WeakPolarHBondContact O-CA 3.24Å; L230-H260 WeakPolarHBondContact O-CB 3.41Å; L230-L261 PolarHBondContact N-O 2.87Å; L230-L261 PolarHBondContact O-N 2.88Å; L230-F263 HydrophobicContact CB-CD2 4.45Å; L230-F263 HydrophobicContact CB-CE2 3.83Å; L230-F263 HydrophobicContact CD2-CE2 4.25Å
231	F	91.9	Very high	80.2	Confident	35 Å²	35	62 Å²	62	15%	0.154	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	153.3	-172.6	67.6	-72.3	0	0	0	114.6	C214 E215 I217 K229 S259 H260	C214-F231 CarbonylContact C-O 3.58Å; C214-F231 VanDerWaalsContact CA-O 3.29Å; C214-F231 WeakPolarHBondContact CA-O 3.42Å; E215-F231 HydrophobicContact CB-CD1 4.37Å; E215-F231 HydrophobicContact CB-CE1 3.79Å; E215-F231 HydrophobicContact CB-CE2 4.42Å; E215-F231 HydrophobicContact CB-CZ 3.81Å; E215-F231 PolarHBondContact N-O 3.07Å; E215-F231 WeakPolarHBondContact O-CD1 3.33Å; E215-F231 PolarHBondContact O-N 3.09Å; I217-F231 HydrophobicContact CB-CE1 4.2Å; I217-F231 HydrophobicContact CG2-CD1 4.24Å; I217-F231 HydrophobicContact CG2-CE1 3.7Å; K229-F231 HydrophobicContact CD-CB 4.28Å; K229-F231 HydrophobicContact CD-CD1 4.18Å; K229-F231 HydrophobicContact CD-CG 4.28Å; K229-F231 VanDerWaalsContact CE-CG 3.48Å; K229-F231 HydrophobicContact CG-CB 4.12Å; K229-F231 HydrophobicContact CG-CD1 3.97Å; K229-F231 HydrophobicContact CG-CG 4.32Å; F231-S259 WeakPolarHBondContact CA-O 3.5Å; F231-H260 HydrophobicContact CB-CB 3.56Å
232	H	88.4	Confident	80	Confident	15 Å²	15	63.3 Å²	63.3	7%	0.069	32%	0.319	C	S	.	.			trans	-79.4	128.2	166.3	-165.1	-74.4	0	0	0	109.9	A213 L234 E235 Q236 I238 S259 H320	A213-H232 PolarHBondContact O-CD2 3.06Å; H232-L234 PolarHBondContact ND1-N 3.45Å; H232-L234 VanDerWaalsContact ND1-N 3.13Å; H232-L234 PolarHBondContact O-N 3.36Å; H232-E235 WeakPolarHBondContact O-CA 3.49Å; H232-E235 PolarHBondContact O-N 3.01Å; H232-Q236 HydrophobicContact CB-CB 4.49Å; H232-Q236 VanDerWaalsContact CB-O 3.31Å; H232-Q236 WeakPolarHBondContact CB-O 3.34Å; H232-Q236 PolarHBondContact ND1-N 2.84Å; H232-I238 HydrophobicContact CB-CG2 3.78Å; H232-S259 PolarHBondContact N-O 3.37Å; H232-H320 AromaticContact NE2-CE1 3.77Å
233	P	80.9	Confident	80.6	Confident	56 Å²	56	53.2 Å²	53.2	36%	0.364	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-44.5	-179.1	-28.2	37.5	0	0	0	113.2	E215 E235	E215-P233 HydrophobicContact CB-CG 4.21Å; E215-P233 HydrophobicContact CG-CG 3.7Å; E215-P233 VanDerWaalsContact OE1-CG 3.29Å; E215-P233 WeakPolarHBondContact OE1-CG 3.4Å; P233-E235 PolarHBondContact O-N 2.94Å
234	L	77.3	Confident	80.6	Confident	133 Å²	133	47.1 Å²	47.1	70%	0.696	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	22	174.5	-47.7	176.7	0	0	0	114	H232 Q236	H232-L234 PolarHBondContact ND1-N 3.45Å; H232-L234 VanDerWaalsContact ND1-N 3.13Å; H232-L234 PolarHBondContact O-N 3.36Å; L234-Q236 HydrophobicContact CB-CG 4.25Å; L234-Q236 WeakPolarHBondContact O-CG 3.43Å; L234-Q236 PolarHBondContact O-N 2.89Å
235	E	79.4	Confident	80.7	Confident	129 Å²	129	47.5 Å²	47.5	60%	0.603	25%	0.247	S	C	*	.			trans	49.1	24.8	-177.8	-55.2	-144.1	127.2	0	0	117.2	H232 P233 S259	H232-E235 WeakPolarHBondContact O-CA 3.49Å; H232-E235 PolarHBondContact O-N 3.01Å; P233-E235 PolarHBondContact O-N 2.94Å; E235-S259 WeakPolarHBondContact O-CB 3.15Å
236	Q	77.6	Confident	80.4	Confident	87 Å²	87	47.8 Å²	47.8	41%	0.407	25%	0.249	S	C	.	.			trans	-75	167.1	176.8	-54.1	-177.8	17.7	0	0	112.2	H232 L234 I238 S259 H320	H232-Q236 HydrophobicContact CB-CB 4.49Å; H232-Q236 VanDerWaalsContact CB-O 3.31Å; H232-Q236 WeakPolarHBondContact CB-O 3.34Å; H232-Q236 PolarHBondContact ND1-N 2.84Å; L234-Q236 HydrophobicContact CB-CG 4.25Å; L234-Q236 WeakPolarHBondContact O-CG 3.43Å; L234-Q236 PolarHBondContact O-N 2.89Å; Q236-I238 PolarHBondContact O-N 2.87Å; Q236-S259 WeakPolarHBondContact O-CA 3.48Å; Q236-H320 PolarHBondContact OE1-CE1 3.36Å
237	S	82.4	Confident	79.8	Confident	54 Å²	54	50.2 Å²	50.2	38%	0.378	26%	0.261	S	S	.	.			trans	-71.4	115	-174.9	176.8	0	0	0	0	112.6	W239 S258	S237-W239 PolarHBondContact O-N 3.2Å; S237-S258 WeakPolarHBondContact CA-O 3.21Å
238	I	85.5	Confident	78.3	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.021	29%	0.286	C	S	.	.			trans	-77.2	-6.1	178.7	64.3	172.1	0	0	0	113.7	V209 L210 C214 H232 Q236 S258 S259 L261	V209-I238 CarbonylContact C-O 3.44Å; V209-I238 WeakPolarHBondContact CA-O 3.05Å; V209-I238 HydrophobicContact CG1-CB 4.08Å; V209-I238 HydrophobicContact CG1-CD1 3.9Å; V209-I238 HydrophobicContact CG1-CG1 4.12Å; L210-I238 PolarHBondContact N-O 3.23Å; C214-I238 WeakPolarHBondContact SG-CG2 3.36Å; H232-I238 HydrophobicContact CB-CG2 3.78Å; Q236-I238 PolarHBondContact O-N 2.87Å; I238-S258 PolarHBondContact N-O 3.4Å; I238-S259 WeakPolarHBondContact CG2-O 3.32Å; I238-L261 HydrophobicContact CD1-CG 4.16Å
239	W	86	Confident	76.6	Confident	45 Å²	45	57.8 Å²	57.8	17%	0.17	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-92.8	138.5	-174.1	-58.8	96.1	0	0	0	113.6	I196 T208 V209 S237 L256 P257 S258 L261	I196-W239 HydrophobicContact CD1-CH2 3.91Å; I196-W239 HydrophobicContact CD1-CZ3 3.98Å; T208-W239 WeakPolarHBondContact O-CA 3.38Å; V209-W239 HydrophobicContact CG2-CD2 4.3Å; V209-W239 HydrophobicContact CG2-CE3 3.72Å; V209-W239 HydrophobicContact CG2-CH2 4.04Å; V209-W239 HydrophobicContact CG2-CZ3 3.57Å; S237-W239 PolarHBondContact O-N 3.2Å; W239-L256 HydrophobicContact CH2-CB 4.41Å; W239-L256 HydrophobicContact CH2-CD1 3.63Å; W239-L256 HydrophobicContact CZ2-CB 3.83Å; W239-L256 HydrophobicContact CZ2-CD1 3.92Å; W239-P257 PolarHBondContact NE1-O 3.02Å; W239-S258 VanDerWaalsContact CD1-O 3.28Å; W239-L261 HydrophobicContact CH2-CD1 3.78Å; W239-L261 HydrophobicContact CH2-CD2 4.12Å; W239-L261 HydrophobicContact CH2-CG 4.33Å; W239-L261 HydrophobicContact CZ2-CD1 3.94Å; W239-L261 HydrophobicContact CZ2-CD2 3.67Å; W239-L261 HydrophobicContact CZ2-CG 3.98Å
240	A	80.5	Confident	74.7	Confident	10 Å²	10	59.6 Å²	59.6	8%	0.083	34%	0.341	C	S	.	.			trans	-79.5	148.3	167.8	0	0	0	0	0	111.9	T208 L210 K242 V249	T208-A240 HydrophobicContact CG2-CB 4.08Å; T208-A240 PolarHBondContact O-N 2.85Å; L210-A240 HydrophobicContact CD1-CB 4.31Å; L210-A240 HydrophobicContact CD2-CB 4.03Å; L210-A240 HydrophobicContact CG-CB 4.08Å; A240-K242 VanDerWaalsContact C-N 3.28Å; A240-K242 PolarHBondContact O-N 2.71Å; A240-V249 WeakPolarHBondContact O-CG2 3.36Å
241	V	67.3	Low	72.3	Confident	86 Å²	86	64.6 Å²	64.6	52%	0.521	38%	0.376	S	S	.	.	S	Bend	trans	-74.9	-12.8	-172.9	-168.9	0	0	0	0	113.6	L316	V241-L316 HydrophobicContact CB-CD2 3.89Å
242	K	68	Low	70.2	Confident	80 Å²	80	68.8 Å²	68.8	35%	0.348	40%	0.398	S	S	.	.	B	Isolated β-bridge	trans	-144.6	154.6	176.8	-60.9	-176.4	176.2	-161.1	0	112.6	A240 E247 L316	A240-K242 VanDerWaalsContact C-N 3.28Å; A240-K242 PolarHBondContact O-N 2.71Å; K242-E247 CarbonylContact C-O 3.57Å; K242-E247 WeakPolarHBondContact CA-O 3.27Å; K242-E247 VanDerWaalsContact CB-O 3.24Å; K242-E247 WeakPolarHBondContact CB-O 3.4Å; K242-L316 HydrophobicContact CB-CD1 4.19Å; K242-L316 HydrophobicContact CB-CD2 3.69Å; K242-L316 HydrophobicContact CB-CG 4.46Å; K242-L316 HydrophobicContact CG-CD2 3.98Å
243	G	72.2	Confident	68.4	Low	3 Å²	3	71.8 Å²	71.8	3%	0.031	42%	0.418	C	S	.	.			trans	-78.2	170.4	173.2	0	0	0	0	0	113.6	K245 G246 E247	G243-K245 PolarHBondContact O-N 3.47Å; G243-G246 PolarHBondContact O-N 2.75Å; G243-E247 PolarHBondContact N-O 2.8Å
244	P	66.4	Low	67.3	Low	25 Å²	25	73.6 Å²	73.6	16%	0.162	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-20.1	-175.9	26.8	-33.8	0	0	0	113.6	L195	L195-P244 HydrophobicContact CD2-CG 4.18Å
245	K	65.8	Low	66.7	Low	163 Å²	163	70.9 Å²	70.9	71%	0.709	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	13.5	172.6	-56	179.6	177.8	178.5	0	113.2	G243 E247	G243-K245 PolarHBondContact O-N 3.47Å; K245-E247 VanDerWaalsContact C-N 3.32Å; K245-E247 HydrophobicContact CB-CG 4.33Å; K245-E247 WeakPolarHBondContact CB-OE2 3.39Å; K245-E247 PolarHBondContact N-OE2 2.73Å
246	G	62.2	Low	66.7	Low	27 Å²	27	66.3 Å²	66.3	28%	0.278	39%	0.391	S	S	.	.	S	Bend	trans	83.3	2.8	-177.5	0	0	0	0	0	115	G243	G243-G246 PolarHBondContact O-N 2.75Å
247	E	73.3	Confident	67	Low	65 Å²	65	63 Å²	63	30%	0.304	38%	0.378	S	S	.	.			trans	-51.6	134	175.5	-61	137.2	121.8	0	0	111	W205 K242 G243 K245	W205-E247 HydrophobicContact CE3-CB 3.86Å; W205-E247 HydrophobicContact CZ3-CB 4.15Å; K242-E247 CarbonylContact C-O 3.57Å; K242-E247 WeakPolarHBondContact CA-O 3.27Å; K242-E247 VanDerWaalsContact CB-O 3.24Å; K242-E247 WeakPolarHBondContact CB-O 3.4Å; G243-E247 PolarHBondContact N-O 2.8Å; K245-E247 VanDerWaalsContact C-N 3.32Å; K245-E247 HydrophobicContact CB-CG 4.33Å; K245-E247 WeakPolarHBondContact CB-OE2 3.39Å; K245-E247 PolarHBondContact N-OE2 2.73Å
248	A	59.7	Low	67.1	Low	71 Å²	71	63.3 Å²	63.3	59%	0.587	38%	0.379	S	S	*	.	B	Isolated β-bridge	trans	-85.9	147.7	176.8	0	0	0	0	0	111.6	G250	A248-G250 PolarHBondContact O-N 3.29Å
249	V	57	Low	67.1	Low	98 Å²	98	63.7 Å²	63.7	59%	0.594	38%	0.383	S	S	*	.	S	Bend	trans	-64.2	95	171.7	179.3	0	0	0	0	109.3	W205 A240	W205-V249 HydrophobicContact CH2-CG2 3.58Å; W205-V249 HydrophobicContact CZ3-CG2 4.2Å; A240-V249 WeakPolarHBondContact O-CG2 3.36Å
250	G	53.4	Low	67.4	Low	66 Å²	66	63.7 Å²	63.7	68%	0.68	38%	0.384	S	S	*	.			trans	176.9	34	-170.9	0	0	0	0	0	119.1	A248	A248-G250 PolarHBondContact O-N 3.29Å
251	S	44.3	Very low	68	Low	105 Å²	105	63.2 Å²	63.2	73%	0.734	38%	0.381	S	S	*	.	S	Bend	trans	-165.9	133.9	155.6	38.8	0	0	0	0	114.3
252	I	47.6	Very low	69.2	Low	122 Å²	122	60.3 Å²	60.3	63%	0.626	36%	0.362	S	S	*	.	S	Bend	trans	57.2	74.6	156.6	-49	161.9	0	0	0	116.4
253	T	50.4	Low	70.4	Confident	78 Å²	78	56.5 Å²	56.5	48%	0.479	35%	0.345	S	S	.	.	S	Bend		-174.6	166.4	116.5	22.6	0	0	0	0	111.6	K198	K198-T253 HydrophobicContact CD-CG2 4.32Å
254	Q	56.3	Low	71.3	Confident	95 Å²	95	58.4 Å²	58.4	44%	0.444	35%	0.351	S	S	.	.			trans	-30.3	144	-169.2	-62.3	-173	6.2	0	0	117.9	S181 T183 L256	S181-Q254 PolarHBondContact OG-OE1 3.31Å; S181-Q254 VanDerWaalsContact OG-OE1 3.07Å; T183-Q254 PolarHBondContact OG1-OE1 2.7Å; Q254-L256 PolarHBondContact O-N 3.17Å; Q254-L256 VanDerWaalsContact O-N 3.1Å
255	P	65.5	Low	72.5	Confident	76 Å²	76	57.5 Å²	57.5	49%	0.494	35%	0.346	S	S	.	.			trans	-61.7	114.4	175.4	26.7	-34.8	0	0	0	112	T178	T178-P255 HydrophobicContact CG2-CB 4.42Å; T178-P255 PolarHBondContact N-O 2.86Å; T178-P255 WeakPolarHBondContact OG1-CG 3.21Å; T178-P255 PolarHBondContact OG1-O 3.46Å
256	L	80.3	Confident	73.4	Confident	33 Å²	33	53.9 Å²	53.9	17%	0.173	35%	0.346	C	S	.	.			trans	-92.4	152.1	167.1	-59.9	179.4	0	0	0	109.7	I175 V206 W239 Q254 L261	I175-L256 HydrophobicContact CG2-CD2 4.03Å; V206-L256 HydrophobicContact CG1-CD1 4.17Å; W239-L256 HydrophobicContact CH2-CB 4.41Å; W239-L256 HydrophobicContact CH2-CD1 3.63Å; W239-L256 HydrophobicContact CZ2-CB 3.83Å; W239-L256 HydrophobicContact CZ2-CD1 3.92Å; Q254-L256 PolarHBondContact O-N 3.17Å; Q254-L256 VanDerWaalsContact O-N 3.1Å; L256-L261 HydrophobicContact CB-CD2 4.19Å; L256-L261 HydrophobicContact CD1-CD2 4.34Å
257	P	83.7	Confident	74.6	Confident	18 Å²	18	54.4 Å²	54.4	12%	0.117	35%	0.346	C	S	.	.			trans	-66.9	147.1	179.9	-12.4	26.1	0	0	0	112	T178 W239 H260	T178-P257 HydrophobicContact CG2-CB 4.28Å; T178-P257 HydrophobicContact CG2-CG 4.06Å; W239-P257 PolarHBondContact NE1-O 3.02Å; P257-H260 WeakPolarHBondContact CB-O 3.22Å
258	S	83.6	Confident	75	Confident	59 Å²	59	56.5 Å²	56.5	41%	0.413	36%	0.356	S	S	.	.	S	Bend	trans	-74.9	-36.1	-176.9	47.5	0	0	0	0	113.9	S237 I238 W239	S237-S258 WeakPolarHBondContact CA-O 3.21Å; I238-S258 PolarHBondContact N-O 3.4Å; W239-S258 VanDerWaalsContact CD1-O 3.28Å
259	S	86.3	Confident	76.2	Confident	13 Å²	13	57.1 Å²	57.1	9%	0.091	36%	0.356	C	S	.	.	S	Bend	trans	-99.3	-11.2	-169.9	62.3	0	0	0	0	115.2	F231 H232 E235 Q236 I238	F231-S259 WeakPolarHBondContact CA-O 3.5Å; H232-S259 PolarHBondContact N-O 3.37Å; E235-S259 WeakPolarHBondContact O-CB 3.15Å; Q236-S259 WeakPolarHBondContact O-CA 3.48Å; I238-S259 WeakPolarHBondContact CG2-O 3.32Å
260	H	91.5	Very high	77.7	Confident	45 Å²	45	55.3 Å²	55.3	21%	0.208	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	157.7	-174.9	64.7	-85	0	0	0	112.4	K229 L230 F231 P257	K229-H260 HydrophobicContact CG-CB 4.35Å; L230-H260 CarbonylContact O-C 3.57Å; L230-H260 WeakPolarHBondContact O-CA 3.24Å; L230-H260 WeakPolarHBondContact O-CB 3.41Å; F231-H260 HydrophobicContact CB-CB 3.56Å; P257-H260 WeakPolarHBondContact CB-O 3.22Å
261	L	92.5	Very high	79.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.6	165.5	-74.5	179.1	0	0	0	109.6	I175 I196 V209 K229 L230 I238 W239 L256 F263	I175-L261 HydrophobicContact CG2-CD2 3.61Å; I175-L261 HydrophobicContact CG2-CG 4.47Å; I196-L261 HydrophobicContact CD1-CD1 3.59Å; V209-L261 HydrophobicContact CG2-CD1 3.87Å; K229-L261 WeakPolarHBondContact CA-O 3.37Å; L230-L261 PolarHBondContact N-O 2.87Å; L230-L261 PolarHBondContact O-N 2.88Å; I238-L261 HydrophobicContact CD1-CG 4.16Å; W239-L261 HydrophobicContact CH2-CD1 3.78Å; W239-L261 HydrophobicContact CH2-CD2 4.12Å; W239-L261 HydrophobicContact CH2-CG 4.33Å; W239-L261 HydrophobicContact CZ2-CD1 3.94Å; W239-L261 HydrophobicContact CZ2-CD2 3.67Å; W239-L261 HydrophobicContact CZ2-CG 3.98Å; L256-L261 HydrophobicContact CB-CD2 4.19Å; L256-L261 HydrophobicContact CD1-CD2 4.34Å; L261-F263 HydrophobicContact CB-CD2 4.1Å; L261-F263 HydrophobicContact CB-CE1 4.49Å; L261-F263 HydrophobicContact CB-CE2 3.44Å; L261-F263 VanDerWaalsContact CB-CE2 3.44Å; L261-F263 HydrophobicContact CB-CZ 3.68Å; L261-F263 HydrophobicContact CD1-CE1 4.15Å; L261-F263 HydrophobicContact CD1-CE2 4.13Å; L261-F263 HydrophobicContact CD1-CZ 3.49Å; L261-F263 VanDerWaalsContact CD1-CZ 3.49Å; L261-F263 HydrophobicContact CG-CE2 4.45Å; L261-F263 HydrophobicContact CG-CZ 4.25Å
262	I	92.8	Very high	81.4	Confident	24 Å²	24	51.9 Å²	51.9	12%	0.123	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	119	167.5	-53.7	179.9	0	0	0	107.1	R176 W182 F228 K229	R176-I262 HydrophobicContact CB-CB 4.09Å; R176-I262 PolarHBondContact N-O 3.13Å; W182-I262 HydrophobicContact CH2-CG2 3.98Å; F228-I262 WeakPolarHBondContact O-CA 3.38Å; K229-I262 HydrophobicContact CB-CG1 4.36Å; K229-I262 HydrophobicContact CG-CG1 4.37Å
263	F	93.7	Very high	83.4	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	155.1	178.7	-60.1	-90.1	0	0	0	110.3	L173 K174 I175 L194 C227 F228 L230 L261	L173-F263 HydrophobicContact CB-CD1 3.93Å; L173-F263 HydrophobicContact CD1-CB 4.29Å; L173-F263 HydrophobicContact CD1-CD1 3.43Å; L173-F263 VanDerWaalsContact CD1-CD1 3.43Å; L173-F263 HydrophobicContact CD1-CE1 3.95Å; L173-F263 HydrophobicContact CD1-CG 4.07Å; L173-F263 HydrophobicContact CG-CD1 4.3Å; K174-F263 CarbonylContact O-C 3.6Å; K174-F263 WeakPolarHBondContact O-CA 3.29Å; I175-F263 HydrophobicContact CD1-CD1 4.02Å; I175-F263 HydrophobicContact CD1-CE1 3.56Å; I175-F263 HydrophobicContact CG1-CD1 3.79Å; I175-F263 HydrophobicContact CG1-CE1 3.88Å; L194-F263 HydrophobicContact CD2-CE1 4.15Å; L194-F263 HydrophobicContact CD2-CZ 3.65Å; C227-F263 VanDerWaalsContact CA-O 3.31Å; C227-F263 WeakPolarHBondContact CA-O 3.35Å; F228-F263 HydrophobicContact CD1-CB 4.28Å; F228-F263 HydrophobicContact CD2-CB 3.9Å; F228-F263 AromaticContact CD2-CD2 3.74Å; F228-F263 HydrophobicContact CD2-CD2 3.74Å; F228-F263 HydrophobicContact CD2-CG 4.18Å; F228-F263 HydrophobicContact CE1-CB 3.92Å; F228-F263 HydrophobicContact CE2-CB 3.5Å; F228-F263 AromaticContact CE2-CD2 3.36Å; F228-F263 HydrophobicContact CE2-CD2 3.36Å; F228-F263 HydrophobicContact CE2-CE2 4.16Å; F228-F263 AromaticContact CE2-CG 3.57Å; F228-F263 HydrophobicContact CE2-CG 3.57Å; F228-F263 HydrophobicContact CG-CB 4.29Å; F228-F263 HydrophobicContact CZ-CB 3.52Å; F228-F263 HydrophobicContact CZ-CD2 4.18Å; F228-F263 AromaticContact CZ-CG 3.92Å; F228-F263 HydrophobicContact CZ-CG 3.92Å; F228-F263 PolarHBondContact N-O 3.38Å; F228-F263 VanDerWaalsContact N-O 3.07Å; F228-F263 PolarHBondContact O-N 3.27Å; L230-F263 HydrophobicContact CB-CD2 4.45Å; L230-F263 HydrophobicContact CB-CE2 3.83Å; L230-F263 HydrophobicContact CD2-CE2 4.25Å; L261-F263 HydrophobicContact CB-CD2 4.1Å; L261-F263 HydrophobicContact CB-CE1 4.49Å; L261-F263 HydrophobicContact CB-CE2 3.44Å; L261-F263 VanDerWaalsContact CB-CE2 3.44Å; L261-F263 HydrophobicContact CB-CZ 3.68Å; L261-F263 HydrophobicContact CD1-CE1 4.15Å; L261-F263 HydrophobicContact CD1-CE2 4.13Å; L261-F263 HydrophobicContact CD1-CZ 3.49Å; L261-F263 VanDerWaalsContact CD1-CZ 3.49Å; L261-F263 HydrophobicContact CG-CE2 4.45Å; L261-F263 HydrophobicContact CG-CZ 4.25Å
264	R	91.8	Very high	85.5	Confident	43 Å²	43	46 Å²	46	16%	0.162	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	124.9	168.4	177.8	171.5	179.1	173.4	-4.2	109.8	K174 W182 K223 D224 F226	K174-R264 HydrophobicContact CB-CB 4.24Å; K174-R264 PolarHBondContact N-O 2.9Å; K174-R264 PolarHBondContact O-N 2.97Å; W182-R264 HydrophobicContact CE3-CB 4.23Å; W182-R264 HydrophobicContact CH2-CB 3.83Å; W182-R264 HydrophobicContact CZ3-CB 3.56Å; K223-R264 VanDerWaalsContact CB-NH2 3.31Å; K223-R264 PolarHBondContact O-NH2 2.72Å; D224-R264 PolarHBondContact O-NH2 2.85Å; F226-R264 VanDerWaalsContact O-CA 3.3Å; F226-R264 WeakPolarHBondContact O-CA 3.47Å
265	A	90.6	Very high	87.1	Confident	6 Å²	6	43 Å²	43	5%	0.05	25%	0.25	C	S	.	.			trans	-82.6	176.6	175.6	0	0	0	0	0	111.2	L173 F226 D270	L173-A265 HydrophobicContact CD2-CB 4.28Å; F226-A265 PolarHBondContact O-N 2.95Å; A265-D270 HydrophobicContact CB-CB 3.94Å
266	A	84.8	Confident	88.2	Confident	87 Å²	87	44.3 Å²	44.3	72%	0.719	25%	0.253	S	S	*	.	S	Bend	trans	-79.5	-48.4	178.8	0	0	0	0	0	111.9	D270	A266-D270 WeakPolarHBondContact CB-OD2 3.34Å
267	S	87.1	Confident	88.6	Confident	38 Å²	38	43.2 Å²	43.2	27%	0.266	25%	0.249	S	C	.	.	S	Bend	trans	-114.1	-173.6	174	70.9	0	0	0	0	112.4	F226 S269 D270	F226-S267 PolarHBondContact N-O 2.68Å; S267-S269 PolarHBondContact OG-N 3.3Å; S267-S269 PolarHBondContact OG-OG 2.9Å; S267-D270 WeakPolarHBondContact CB-OD2 3.34Å; S267-D270 PolarHBondContact N-OD2 3.19Å; S267-D270 PolarHBondContact OG-N 2.76Å; S267-D270 VanDerWaalsContact OG-N 3.14Å; S267-D270 PolarHBondContact OG-OD1 2.98Å; S267-D270 PolarHBondContact OG-OD2 3.5Å
268	E	83.2	Confident	88.8	Confident	109 Å²	109	42.3 Å²	42.3	51%	0.509	24%	0.243	S	C	.	.	H	α-helix	trans	-77.6	-43	169.3	-176.2	172.9	163	0	0	112.5	F226 D270 G271 R272	F226-E268 HydrophobicContact CD2-CG 4Å; E268-D270 VanDerWaalsContact C-N 3.32Å; E268-D270 PolarHBondContact O-N 2.81Å; E268-G271 WeakPolarHBondContact O-CA 3.44Å; E268-G271 PolarHBondContact O-N 3.29Å; E268-R272 HydrophobicContact CG-CG 4.43Å; E268-R272 PolarHBondContact O-N 3.14Å; E268-R272 IonicContact OE1-CZ 2.68Å; E268-R272 VanDerWaalsContact OE1-CZ 3.22Å; E268-R272 IonicContact OE1-NE 2.73Å; E268-R272 PolarHBondContact OE1-NE 3.24Å; E268-R272 IonicContact OE1-NH2 3.34Å; E268-R272 PolarHBondContact OE1-NH2 2.85Å
269	S	84.6	Confident	88.9	Confident	85 Å²	85	43.6 Å²	43.6	59%	0.594	24%	0.243	S	C	*	.	H	α-helix	trans	-58.8	-42.1	176.9	39	0	0	0	0	112.1	S267 G271 R272 C273	S267-S269 PolarHBondContact OG-N 3.3Å; S267-S269 PolarHBondContact OG-OG 2.9Å; S269-G271 VanDerWaalsContact C-N 3.27Å; S269-G271 PolarHBondContact O-N 2.9Å; S269-R272 PolarHBondContact O-N 2.79Å; S269-C273 WeakPolarHBondContact O-CB 3.46Å; S269-C273 PolarHBondContact O-N 3Å
270	D	87.3	Confident	88.7	Confident	60 Å²	60	47.7 Å²	47.7	32%	0.321	26%	0.263	S	S	.	.	H	α-helix	trans	-63.1	-38.5	175.2	-48.6	-33.4	0	0	0	110.9	A265 A266 S267 E268 W274	A265-D270 HydrophobicContact CB-CB 3.94Å; A266-D270 WeakPolarHBondContact CB-OD2 3.34Å; S267-D270 WeakPolarHBondContact CB-OD2 3.34Å; S267-D270 PolarHBondContact N-OD2 3.19Å; S267-D270 PolarHBondContact OG-N 2.76Å; S267-D270 VanDerWaalsContact OG-N 3.14Å; S267-D270 PolarHBondContact OG-OD1 2.98Å; S267-D270 PolarHBondContact OG-OD2 3.5Å; E268-D270 VanDerWaalsContact C-N 3.32Å; E268-D270 PolarHBondContact O-N 2.81Å; D270-W274 WeakPolarHBondContact O-CB 3.29Å; D270-W274 VanDerWaalsContact O-CD1 3.27Å; D270-W274 PolarHBondContact O-N 2.81Å
271	G	88	Confident	88.2	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.6	-42.9	-178.3	0	0	0	0	0	113.2	F226 E268 S269 M275	F226-G271 WeakPolarHBondContact CE1-O 3.24Å; E268-G271 WeakPolarHBondContact O-CA 3.44Å; E268-G271 PolarHBondContact O-N 3.29Å; S269-G271 VanDerWaalsContact C-N 3.27Å; S269-G271 PolarHBondContact O-N 2.9Å; G271-M275 PolarHBondContact O-N 2.97Å; G271-M275 VanDerWaalsContact O-N 3.07Å
272	R	87.7	Confident	87.5	Confident	99 Å²	99	47.1 Å²	47.1	37%	0.374	26%	0.261	S	S	.	.	H	α-helix	trans	-66.7	-46.3	173.4	-63.6	-169.5	-177	-64.1	-8.2	110.8	E218 F226 E268 S269 W274 M275 D276	E218-R272 IonicContact OE1-NH2 2.73Å; E218-R272 IonicContact OE2-CZ 3.93Å; E218-R272 IonicContact OE2-NH1 2.87Å; E218-R272 PolarHBondContact OE2-NH1 2.94Å; E218-R272 IonicContact OE2-NH2 3.88Å; F226-R272 HydrophobicContact CE2-CG 4Å; F226-R272 HydrophobicContact CZ-CG 4.15Å; E268-R272 HydrophobicContact CG-CG 4.43Å; E268-R272 PolarHBondContact O-N 3.14Å; E268-R272 IonicContact OE1-CZ 2.68Å; E268-R272 VanDerWaalsContact OE1-CZ 3.22Å; E268-R272 IonicContact OE1-NE 2.73Å; E268-R272 PolarHBondContact OE1-NE 3.24Å; E268-R272 IonicContact OE1-NH2 3.34Å; E268-R272 PolarHBondContact OE1-NH2 2.85Å; S269-R272 PolarHBondContact O-N 2.79Å; R272-W274 VanDerWaalsContact C-N 3.33Å; R272-W274 PolarHBondContact O-N 3.1Å; R272-M275 WeakPolarHBondContact O-CA 3.45Å; R272-M275 WeakPolarHBondContact O-CB 3.41Å; R272-M275 PolarHBondContact O-N 3.02Å; R272-D276 VanDerWaalsContact O-CG 3.26Å; R272-D276 PolarHBondContact O-N 2.86Å
273	C	90.6	Very high	86.4	Confident	66 Å²	66	51.7 Å²	51.7	45%	0.446	28%	0.28	S	S	.	.	H	α-helix	trans	-58.5	-40.7	176.5	-164.6	0	0	0	0	112.8	M169 S269 A277	M169-C273 HydrophobicContact CE-CB 4.39Å; M169-C273 WeakPolarHBondContact CE-SG 3.46Å; S269-C273 WeakPolarHBondContact O-CB 3.46Å; S269-C273 PolarHBondContact O-N 3Å; C273-A277 VanDerWaalsContact O-CB 3.26Å; C273-A277 WeakPolarHBondContact O-CB 3.25Å; C273-A277 PolarHBondContact O-N 2.8Å
274	W	93.3	Very high	84.9	Confident	9 Å²	9	53.5 Å²	53.5	3%	0.034	29%	0.292	C	S	.	.	H	α-helix	trans	-65.3	-36.9	172.1	-94.5	100.2	0	0	0	113.2	M169 D171 L173 C187 L189 L194 F228 D270 R272 L278	M169-W274 HydrophobicContact CG-CD2 4.37Å; M169-W274 HydrophobicContact CG-CH2 4.11Å; M169-W274 HydrophobicContact CG-CZ2 3.94Å; M169-W274 HydrophobicContact CG-CZ3 4.39Å; M169-W274 HydrophobicContact SD-CB 4.39Å; M169-W274 HydrophobicContact SD-CD2 3.35Å; M169-W274 HydrophobicContact SD-CE3 3.77Å; M169-W274 HydrophobicContact SD-CG 3.64Å; M169-W274 HydrophobicContact SD-CH2 4.32Å; M169-W274 HydrophobicContact SD-CZ2 3.96Å; M169-W274 HydrophobicContact SD-CZ3 4.23Å; D171-W274 HydrophobicContact CB-CZ2 4.09Å; L173-W274 HydrophobicContact CD1-CD2 3.78Å; L173-W274 HydrophobicContact CD1-CE3 3.85Å; L173-W274 HydrophobicContact CD1-CG 4.37Å; L173-W274 HydrophobicContact CD1-CH2 4.18Å; L173-W274 HydrophobicContact CD1-CZ2 4.1Å; L173-W274 HydrophobicContact CD1-CZ3 4.05Å; L173-W274 HydrophobicContact CD2-CD2 4.12Å; L173-W274 HydrophobicContact CD2-CG 4.02Å; L173-W274 HydrophobicContact CG-CD2 4.2Å; L173-W274 HydrophobicContact CG-CZ2 4.08Å; C187-W274 HydrophobicContact CB-CH2 3.61Å; C187-W274 HydrophobicContact CB-CZ2 4.18Å; C187-W274 HydrophobicContact CB-CZ3 4.32Å; L189-W274 HydrophobicContact CB-CZ3 4.17Å; L194-W274 HydrophobicContact CD1-CZ3 4.16Å; F228-W274 HydrophobicContact CE1-CB 3.94Å; F228-W274 HydrophobicContact CZ-CB 3.88Å; F228-W274 HydrophobicContact CZ-CG 4.47Å; D270-W274 WeakPolarHBondContact O-CB 3.29Å; D270-W274 VanDerWaalsContact O-CD1 3.27Å; D270-W274 PolarHBondContact O-N 2.81Å; R272-W274 VanDerWaalsContact C-N 3.33Å; R272-W274 PolarHBondContact O-N 3.1Å; W274-L278 HydrophobicContact CE3-CD1 4.5Å; W274-L278 WeakPolarHBondContact O-CB 3.28Å; W274-L278 WeakPolarHBondContact O-CD1 3.2Å; W274-L278 VanDerWaalsContact O-CG 3.27Å; W274-L278 WeakPolarHBondContact O-CG 3.46Å; W274-L278 PolarHBondContact O-N 2.96Å
275	M	90.7	Very high	83.3	Confident	32 Å²	32	52.4 Å²	52.4	16%	0.158	29%	0.292	C	S	.	.	H	α-helix	trans	-67.9	-47.9	175.1	-84.7	-171.3	44.4	0	0	112	L216 E218 F226 F228 G271 R272 A277 L278 E279	L216-M275 HydrophobicContact CD1-CG 4.29Å; L216-M275 HydrophobicContact CD2-CB 4.14Å; L216-M275 HydrophobicContact CD2-CG 3.99Å; L216-M275 HydrophobicContact CG-CE 4.45Å; L216-M275 HydrophobicContact CG-CG 4.22Å; E218-M275 HydrophobicContact CB-CE 4.46Å; E218-M275 HydrophobicContact CB-SD 4.22Å; F226-M275 HydrophobicContact CE1-CG 4.1Å; F226-M275 HydrophobicContact CE1-SD 3.53Å; F226-M275 VanDerWaalsContact CE1-SD 3.53Å; F226-M275 HydrophobicContact CZ-SD 3.56Å; F226-M275 VanDerWaalsContact CZ-SD 3.56Å; F228-M275 HydrophobicContact CB-CG 4.03Å; F228-M275 HydrophobicContact CB-SD 3.75Å; F228-M275 HydrophobicContact CD1-CG 4.13Å; F228-M275 HydrophobicContact CD2-CG 4.42Å; F228-M275 HydrophobicContact CG-CG 3.97Å; F228-M275 HydrophobicContact CG-SD 4.34Å; G271-M275 PolarHBondContact O-N 2.97Å; G271-M275 VanDerWaalsContact O-N 3.07Å; R272-M275 WeakPolarHBondContact O-CA 3.45Å; R272-M275 WeakPolarHBondContact O-CB 3.41Å; R272-M275 PolarHBondContact O-N 3.02Å; M275-A277 VanDerWaalsContact C-N 3.31Å; M275-A277 PolarHBondContact O-N 2.85Å; M275-L278 PolarHBondContact O-N 2.88Å; M275-L278 VanDerWaalsContact O-N 3.15Å; M275-E279 PolarHBondContact O-N 2.75Å
276	D	88.4	Confident	81.2	Confident	104 Å²	104	55.3 Å²	55.3	56%	0.556	31%	0.312	S	S	*	.	H	α-helix	trans	-59.4	-43.1	178.6	-60	-28.8	0	0	0	111.1	R272 E279 L280	R272-D276 VanDerWaalsContact O-CG 3.26Å; R272-D276 PolarHBondContact O-N 2.86Å; D276-E279 PolarHBondContact O-N 2.88Å; D276-L280 WeakPolarHBondContact O-CB 3.44Å; D276-L280 PolarHBondContact O-N 2.83Å
277	A	88.4	Confident	79.4	Confident	10 Å²	10	56.2 Å²	56.2	8%	0.083	30%	0.303	C	S	.	.	H	α-helix	trans	-64.9	-40.9	176.2	0	0	0	0	0	112.3	V168 M169 L189 C273 M275 L280 A281	V168-A277 HydrophobicContact CG1-CB 4.29Å; M169-A277 HydrophobicContact CB-CB 4.37Å; M169-A277 HydrophobicContact CE-CB 3.71Å; M169-A277 HydrophobicContact SD-CB 4.12Å; L189-A277 HydrophobicContact CD2-CB 3.84Å; L189-A277 WeakPolarHBondContact CD2-O 3.25Å; C273-A277 VanDerWaalsContact O-CB 3.26Å; C273-A277 WeakPolarHBondContact O-CB 3.25Å; C273-A277 PolarHBondContact O-N 2.8Å; M275-A277 VanDerWaalsContact C-N 3.31Å; M275-A277 PolarHBondContact O-N 2.85Å; A277-L280 PolarHBondContact O-N 2.81Å; A277-A281 WeakPolarHBondContact O-CB 3.47Å; A277-A281 PolarHBondContact O-N 2.94Å
278	L	88.4	Confident	77.6	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-65.2	-42.5	174.8	-81	164.7	0	0	0	111.8	L189 L194 L211 L216 F228 W274 M275 A281 L282	L189-L278 HydrophobicContact CD1-CD2 3.68Å; L189-L278 HydrophobicContact CD2-CD2 4.17Å; L189-L278 HydrophobicContact CD2-CG 4.17Å; L194-L278 HydrophobicContact CD2-CD2 4.44Å; L211-L278 HydrophobicContact CD1-CD2 4.24Å; L211-L278 HydrophobicContact CD2-CD2 4.1Å; L216-L278 HydrophobicContact CD1-CD1 4.19Å; L216-L278 HydrophobicContact CD2-CB 3.73Å; L216-L278 HydrophobicContact CD2-CD1 4.47Å; F228-L278 HydrophobicContact CD2-CD1 4.33Å; F228-L278 HydrophobicContact CE2-CD1 3.52Å; F228-L278 HydrophobicContact CZ-CD1 4.08Å; W274-L278 HydrophobicContact CE3-CD1 4.5Å; W274-L278 WeakPolarHBondContact O-CB 3.28Å; W274-L278 WeakPolarHBondContact O-CD1 3.2Å; W274-L278 VanDerWaalsContact O-CG 3.27Å; W274-L278 WeakPolarHBondContact O-CG 3.46Å; W274-L278 PolarHBondContact O-N 2.96Å; M275-L278 PolarHBondContact O-N 2.88Å; M275-L278 VanDerWaalsContact O-N 3.15Å; L278-A281 PolarHBondContact O-N 3.27Å; L278-L282 WeakPolarHBondContact O-CB 3.42Å; L278-L282 WeakPolarHBondContact O-CD1 3.35Å; L278-L282 VanDerWaalsContact O-CG 3.24Å; L278-L282 WeakPolarHBondContact O-CG 3.45Å; L278-L282 PolarHBondContact O-N 2.56Å
279	E	85.4	Confident	75.9	Confident	86 Å²	86	58.2 Å²	58.2	40%	0.402	31%	0.308	S	S	.	.	H	α-helix	trans	-66.7	-36.7	177.7	-160.7	-175.1	151.9	0	0	111.9	M275 D276 L282 K283	M275-E279 PolarHBondContact O-N 2.75Å; D276-E279 PolarHBondContact O-N 2.88Å; E279-L282 WeakPolarHBondContact O-CB 3.42Å; E279-K283 HydrophobicContact CG-CD 4.47Å; E279-K283 VanDerWaalsContact O-CG 3.29Å; E279-K283 WeakPolarHBondContact O-CG 3.1Å; E279-K283 PolarHBondContact O-N 2.83Å; E279-K283 WeakPolarHBondContact OE1-CE 3.26Å; E279-K283 IonicContact OE1-NZ 3.22Å; E279-K283 PolarHBondContact OE1-NZ 2.82Å
280	L	81.6	Confident	73.7	Confident	98 Å²	98	63.2 Å²	63.2	51%	0.513	31%	0.314	S	S	.	.	H	α-helix	trans	-64.3	-47.9	170.6	-175.7	63.3	0	0	0	111.4	D276 A277 L282 K283 C284	D276-L280 WeakPolarHBondContact O-CB 3.44Å; D276-L280 PolarHBondContact O-N 2.83Å; A277-L280 PolarHBondContact O-N 2.81Å; L280-L282 VanDerWaalsContact C-N 3.29Å; L280-L282 PolarHBondContact O-N 2.94Å; L280-K283 PolarHBondContact O-N 2.84Å; L280-K283 VanDerWaalsContact O-N 3.17Å; L280-C284 WeakPolarHBondContact O-CB 3.4Å; L280-C284 PolarHBondContact O-N 2.96Å; L280-C284 PolarHBondContact O-SG 2.76Å
281	A	82	Confident	71.6	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.008	32%	0.32	C	S	.	.	H	α-helix	trans	-64.2	-31.6	178.7	0	0	0	0	0	113.3	L189 G192 L211 A277 L278	L189-A281 HydrophobicContact CD1-CB 3.74Å; L189-A281 HydrophobicContact CD2-CB 4.07Å; L189-A281 HydrophobicContact CG-CB 3.96Å; G192-A281 PolarHBondContact N-O 2.97Å; L211-A281 HydrophobicContact CD1-CB 4.06Å; A277-A281 WeakPolarHBondContact O-CB 3.47Å; A277-A281 PolarHBondContact O-N 2.94Å; L278-A281 PolarHBondContact O-N 3.27Å
282	L	77.3	Confident	69.4	Low	32 Å²	32	67.5 Å²	67.5	17%	0.168	34%	0.338	C	S	.	.	H	α-helix	trans	-62.3	-54.9	168.5	-80.4	162.6	0	0	0	110.7	L211 C214 L216 L278 E279 L280 C284 S285	L211-L282 HydrophobicContact CB-CD2 3.78Å; L211-L282 HydrophobicContact CB-CG 4.3Å; L211-L282 WeakPolarHBondContact O-CD2 3.49Å; C214-L282 WeakPolarHBondContact O-CD2 3.33Å; L216-L282 HydrophobicContact CB-CD1 4.49Å; L278-L282 WeakPolarHBondContact O-CB 3.42Å; L278-L282 WeakPolarHBondContact O-CD1 3.35Å; L278-L282 VanDerWaalsContact O-CG 3.24Å; L278-L282 WeakPolarHBondContact O-CG 3.45Å; L278-L282 PolarHBondContact O-N 2.56Å; E279-L282 WeakPolarHBondContact O-CB 3.42Å; L280-L282 VanDerWaalsContact C-N 3.29Å; L280-L282 PolarHBondContact O-N 2.94Å; L282-C284 PolarHBondContact O-N 3.19Å; L282-S285 WeakPolarHBondContact O-CB 3.02Å; L282-S285 PolarHBondContact O-N 2.7Å; L282-S285 PolarHBondContact O-OG 3.09Å
283	K	69.2	Low	67.2	Low	121 Å²	121	69.4 Å²	69.4	53%	0.526	35%	0.354	S	S	.	.	H	α-helix	trans	-62.2	-42	-178.8	-72.1	167.9	-176.3	170.5	0	112.6	E279 L280 S285 S286	E279-K283 HydrophobicContact CG-CD 4.47Å; E279-K283 VanDerWaalsContact O-CG 3.29Å; E279-K283 WeakPolarHBondContact O-CG 3.1Å; E279-K283 PolarHBondContact O-N 2.83Å; E279-K283 WeakPolarHBondContact OE1-CE 3.26Å; E279-K283 IonicContact OE1-NZ 3.22Å; E279-K283 PolarHBondContact OE1-NZ 2.82Å; L280-K283 PolarHBondContact O-N 2.84Å; L280-K283 VanDerWaalsContact O-N 3.17Å; K283-S285 PolarHBondContact O-N 2.88Å; K283-S285 VanDerWaalsContact O-N 3.16Å; K283-S286 WeakPolarHBondContact O-CB 3.27Å; K283-S286 PolarHBondContact O-N 3.49Å; K283-S286 VanDerWaalsContact O-N 3.1Å; K283-S286 PolarHBondContact O-OG 2.94Å
284	C	61.7	Low	64.5	Low	37 Å²	37	76.6 Å²	76.6	25%	0.25	37%	0.372	C	S	.	.	H	α-helix	trans	-62.2	-20.5	179.2	-71.6	0	0	0	0	114.2	P191 L280 L282 S286 L287 L288	P191-C284 HydrophobicContact CB-CB 4.37Å; L280-C284 WeakPolarHBondContact O-CB 3.4Å; L280-C284 PolarHBondContact O-N 2.96Å; L280-C284 PolarHBondContact O-SG 2.76Å; L282-C284 PolarHBondContact O-N 3.19Å; C284-S286 PolarHBondContact O-N 3.18Å; C284-L287 PolarHBondContact O-N 2.98Å; C284-L287 VanDerWaalsContact O-N 3.09Å; C284-L288 PolarHBondContact O-N 2.97Å
285	S	58.9	Low	61.7	Low	21 Å²	21	83.4 Å²	83.4	15%	0.147	40%	0.404	C	S	.	.	H	α-helix	trans	-60	-24.6	173.1	74.2	0	0	0	0	113.5	N212 L282 K283	N212-S285 WeakPolarHBondContact OD1-CB 3.18Å; L282-S285 WeakPolarHBondContact O-CB 3.02Å; L282-S285 PolarHBondContact O-N 2.7Å; L282-S285 PolarHBondContact O-OG 3.09Å; K283-S285 PolarHBondContact O-N 2.88Å; K283-S285 VanDerWaalsContact O-N 3.16Å
286	S	46.8	Very low	59.3	Low	67 Å²	67	85.5 Å²	85.5	47%	0.469	43%	0.434	S	S	.	.	H	α-helix	trans	-78.5	-28.4	176	69.7	0	0	0	0	113.3	K283 C284 R290	K283-S286 WeakPolarHBondContact O-CB 3.27Å; K283-S286 PolarHBondContact O-N 3.49Å; K283-S286 VanDerWaalsContact O-N 3.1Å; K283-S286 PolarHBondContact O-OG 2.94Å; C284-S286 PolarHBondContact O-N 3.18Å; S286-R290 PolarHBondContact O-N 3.07Å
287	L	46.2	Very low	56.7	Low	105 Å²	105	89.9 Å²	89.9	55%	0.55	45%	0.448	S	S	.	.	H	α-helix	trans	-76.6	-41.3	-179.7	-72.1	168.7	0	0	0	111.5	C284 K289 R290 T291	C284-L287 PolarHBondContact O-N 2.98Å; C284-L287 VanDerWaalsContact O-N 3.09Å; L287-K289 PolarHBondContact O-N 2.99Å; L287-R290 WeakPolarHBondContact O-CA 3.49Å; L287-R290 PolarHBondContact O-N 2.97Å; L287-T291 PolarHBondContact O-N 3.34Å
288	L	50.2	Low	54	Low	63 Å²	63	97.8 Å²	97.8	33%	0.33	48%	0.484	S	S	.	.	H	α-helix	trans	-59.3	-30.8	172.6	-80.1	162.8	0	0	0	112.8	P191 C284 R290 T291 M292	P191-L288 HydrophobicContact CB-CD1 3.79Å; C284-L288 PolarHBondContact O-N 2.97Å; L288-R290 VanDerWaalsContact C-N 3.33Å; L288-T291 PolarHBondContact O-OG1 3.11Å; L288-M292 PolarHBondContact O-N 3.43Å
289	K	46.7	Very low	51.2	Low	126 Å²	126	105.5 Å²	105.5	55%	0.548	53%	0.525	S	S	.	.	H	α-helix	trans	-70.7	-25.3	171.2	-69.9	176.2	-178.8	175.9	0	113.2	L287 I293	L287-K289 PolarHBondContact O-N 2.99Å; K289-I293 VanDerWaalsContact O-CD1 3.23Å; K289-I293 WeakPolarHBondContact O-CD1 3.29Å; K289-I293 WeakPolarHBondContact O-CG1 3.45Å
290	R	39.2	Very low	48.4	Very low	191 Å²	191	110.5 Å²	110.5	72%	0.721	55%	0.55	S	S	*	*	H	α-helix	trans	-88	-28.3	179.8	-83.3	177	63.6	163.1	-1.9	113.5	S286 L287 L288	S286-R290 PolarHBondContact O-N 3.07Å; L287-R290 WeakPolarHBondContact O-CA 3.49Å; L287-R290 PolarHBondContact O-N 2.97Å; L288-R290 VanDerWaalsContact C-N 3.33Å
291	T	42.8	Very low	45.9	Very low	70 Å²	70	110.8 Å²	110.8	43%	0.429	56%	0.56	S	S	.	*	H	α-helix	trans	-73.2	-45.4	174	45	0	0	0	0	112.1	L287 L288 I293 R294 E295	L287-T291 PolarHBondContact O-N 3.34Å; L288-T291 PolarHBondContact O-OG1 3.11Å; T291-I293 PolarHBondContact O-N 3.17Å; T291-R294 PolarHBondContact O-N 3.35Å; T291-E295 PolarHBondContact O-N 3.41Å
292	M	41.7	Very low	43.3	Very low	79 Å²	79	117.2 Å²	117.2	39%	0.389	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-63.5	-7.9	176.9	-69.4	-169.6	-61.2	0	0	114.9	L288	L288-M292 PolarHBondContact O-N 3.43Å
293	I	42.6	Very low	41	Very low	140 Å²	140	124.5 Å²	124.5	72%	0.718	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-18.9	172	-67.1	171.9	0	0	0	111.5	K289 T291	K289-I293 VanDerWaalsContact O-CD1 3.23Å; K289-I293 WeakPolarHBondContact O-CD1 3.29Å; K289-I293 WeakPolarHBondContact O-CG1 3.45Å; T291-I293 PolarHBondContact O-N 3.17Å
294	R	32.9	Very low	39	Very low	217 Å²	217	124.6 Å²	124.6	82%	0.819	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-29	-166.4	-151	177.8	-167.5	-161.3	0.8	114.5	T291	T291-R294 PolarHBondContact O-N 3.35Å
295	E	34.9	Very low	37.6	Very low	152 Å²	152	129.9 Å²	129.9	71%	0.71	68%	0.682	S	S	*	*	S	Bend	trans	-82.9	-14.8	179.5	-66.8	179.3	179.4	0	0	113	T291 K297	T291-E295 PolarHBondContact O-N 3.41Å; E295-K297 PolarHBondContact O-N 3.44Å
296	G	39.9	Very low	35.9	Very low	76 Å²	76	132.8 Å²	132.8	78%	0.784	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	30	-179.6	0	0	0	0	0	116.1
297	K	34.6	Very low	35.2	Very low	195 Å²	195	133.2 Å²	133.2	85%	0.848	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.2	-1.4	-177.7	-136.9	179.6	-175.4	-179	0	116.1	E295	E295-K297 PolarHBondContact O-N 3.44Å
298	E	31.5	Very low	34.2	Very low	177 Å²	177	136.9 Å²	136.9	83%	0.827	75%	0.745	S	S	*	*	S	Bend	trans	-128.9	154.1	174.2	-67.3	179.2	174.2	0	0	109.9
299	D	29.5	Very low	33.6	Very low	162 Å²	162	143.2 Å²	143.2	87%	0.866	77%	0.773	S	S	*	*			trans	57.1	104	177.8	-64.6	-18.4	0	0	0	120.4
300	M	27.3	Very low	32.8	Very low	191 Å²	191	142.7 Å²	142.7	94%	0.941	79%	0.785	S	S	*	*			trans	-122.3	91.4	154	-176.6	178	67.8	0	0	110.6
301	S	27.7	Very low	32.6	Very low	103 Å²	103	139 Å²	139	72%	0.72	78%	0.779	S	S	*	*			trans	-152.8	155.3	161.7	73.5	0	0	0	0	113.6
302	T	27.4	Very low	32.1	Very low	137 Å²	137	139.8 Å²	139.8	84%	0.84	78%	0.78	S	S	*	*			trans	80.8	138.5	173.2	-40.6	0	0	0	0	116.8
303	M	29.8	Very low	31.8	Very low	184 Å²	184	137.6 Å²	137.6	91%	0.906	77%	0.769	S	S	*	*			trans	-117.2	152.8	-178.6	-53.5	-165.7	79.9	0	0	111.5
304	S	26.2	Very low	31.5	Very low	123 Å²	123	133.4 Å²	133.4	86%	0.86	74%	0.744	S	S	*	*			trans	-149.1	149.8	150.1	67.2	0	0	0	0	111.6
305	T	32.7	Very low	31.8	Very low	148 Å²	148	126.7 Å²	126.7	91%	0.908	73%	0.73	S	S	*	*			trans	-88.7	150.7	177.8	39.6	0	0	0	0	111.4
306	G	24.1	Very low	31.8	Very low	83 Å²	83	120.4 Å²	120.4	86%	0.856	70%	0.702	S	S	*	*			trans	174.5	108.5	175.1	0	0	0	0	0	110.3
307	G	30.9	Very low	31.6	Very low	76 Å²	76	119.7 Å²	119.7	78%	0.784	68%	0.68	S	S	*	*			trans	-110.5	123.7	-177.4	0	0	0	0	0	111.6
308	E	26.6	Very low	31.7	Very low	182 Å²	182	116.2 Å²	116.2	85%	0.85	66%	0.661	S	S	*	*			trans	-158.5	170.2	160.1	-123.7	170.9	-151.5	0	0	111.3	S310	E308-S310 PolarHBondContact O-N 3.47Å
309	H	37.9	Very low	31.9	Very low	195 Å²	195	111.6 Å²	111.6	90%	0.903	65%	0.653	S	S	*	*			trans	-71.2	108.2	-162.7	-68.3	-97.1	0	0	0	113.7
310	S	28.4	Very low	32.2	Very low	116 Å²	116	107.1 Å²	107.1	81%	0.811	63%	0.627	S	S	*	*			trans	-110.2	121.9	176.4	49.2	0	0	0	0	112.8	E308	E308-S310 PolarHBondContact O-N 3.47Å
311	I	35.2	Very low	32.3	Very low	114 Å²	114	103.7 Å²	103.7	59%	0.585	61%	0.612	S	S	*	*			trans	-82.5	137.6	-176.9	-64.8	177	0	0	0	111.1	F313	I311-F313 PolarHBondContact O-N 3.18Å
312	N	33.3	Very low	32.2	Very low	86 Å²	86	105.6 Å²	105.6	46%	0.46	61%	0.611	S	S	.	*			trans	-76.7	83.8	-168.1	-164.3	-17.8	0	0	0	113.3	Y314 S315	N312-Y314 PolarHBondContact O-N 2.89Å; N312-S315 WeakPolarHBondContact O-CB 3.27Å; N312-S315 PolarHBondContact O-N 2.94Å
313	F	35.6	Very low	32.1	Very low	33 Å²	33	105.9 Å²	105.9	15%	0.145	60%	0.603	C	S	.	*	G	3₁₀ helix	trans	-65.5	-17.6	-179.1	177.1	-79.2	0	0	0	113.9	T154 L157 L158 I161 I311 S315 L316	T154-F313 HydrophobicContact CG2-CB 3.54Å; T154-F313 HydrophobicContact CG2-CD1 4.31Å; T154-F313 HydrophobicContact CG2-CG 4.43Å; L157-F313 HydrophobicContact CD2-CE1 3.94Å; L157-F313 HydrophobicContact CG-CE1 4.08Å; L158-F313 HydrophobicContact CB-CG 4.43Å; L158-F313 HydrophobicContact CD1-CD2 3.78Å; L158-F313 HydrophobicContact CD1-CE2 4.2Å; L158-F313 HydrophobicContact CD1-CG 4.26Å; L158-F313 HydrophobicContact CD2-CB 4.45Å; I161-F313 HydrophobicContact CD1-CE1 4.09Å; I161-F313 HydrophobicContact CD1-CE2 4.24Å; I161-F313 HydrophobicContact CD1-CZ 3.47Å; I161-F313 VanDerWaalsContact CD1-CZ 3.47Å; I311-F313 PolarHBondContact O-N 3.18Å; F313-S315 PolarHBondContact O-N 2.86Å; F313-S315 VanDerWaalsContact O-N 3.13Å; F313-L316 HydrophobicContact CB-CD1 4.4Å; F313-L316 HydrophobicContact CD2-CD1 3.3Å; F313-L316 HydrophobicContact CE2-CD1 3.62Å; F313-L316 HydrophobicContact CG-CD1 3.89Å; F313-L316 HydrophobicContact CZ-CD1 4.42Å; F313-L316 WeakPolarHBondContact O-CB 3.48Å; F313-L316 PolarHBondContact O-N 3.19Å
314	Y	35.4	Very low	31.8	Very low	51 Å²	51	99.9 Å²	99.9	20%	0.2	59%	0.589	C	S	.	*	G	3₁₀ helix	trans	-75.3	12.3	164	-93.3	-28.4	0	0	0	114	K150 A153 T154 N312 L317 R318	K150-Y314 HydrophobicContact CB-CD2 4.28Å; K150-Y314 HydrophobicContact CD-CD2 4.49Å; K150-Y314 HydrophobicContact CG-CD2 3.35Å; K150-Y314 HydrophobicContact CG-CE2 3.91Å; K150-Y314 HydrophobicContact CG-CG 4.18Å; K150-Y314 WeakPolarHBondContact O-CD2 3.37Å; K150-Y314 WeakPolarHBondContact O-CE2 3.41Å; A153-Y314 HydrophobicContact CB-CE2 4.03Å; A153-Y314 VanDerWaalsContact CB-OH 3.29Å; A153-Y314 WeakPolarHBondContact CB-OH 3.31Å; T154-Y314 HydrophobicContact CG2-CD2 4.42Å; T154-Y314 HydrophobicContact CG2-CG 4.32Å; N312-Y314 PolarHBondContact O-N 2.89Å; Y314-L317 HydrophobicContact CD1-CB 4.47Å; Y314-L317 HydrophobicContact CD1-CD1 4.07Å; Y314-L317 HydrophobicContact CE1-CD1 3.91Å; Y314-R318 PolarHBondContact O-NE 2.59Å; Y314-R318 PolarHBondContact O-NH2 3.15Å
315	S	38.1	Very low	31.7	Very low	76 Å²	76	103 Å²	103	53%	0.531	59%	0.587	S	S	.	*	G	3₁₀ helix	trans	-84.1	-17.4	157.3	-161.8	0	0	0	0	112.6	N312 F313	N312-S315 WeakPolarHBondContact O-CB 3.27Å; N312-S315 PolarHBondContact O-N 2.94Å; F313-S315 PolarHBondContact O-N 2.86Å; F313-S315 VanDerWaalsContact O-N 3.13Å
316	L	35.1	Very low	31.2	Very low	21 Å²	21	103.3 Å²	103.3	11%	0.11	58%	0.578	C	S	.	*	T	Hydrogen-bonded Turn	trans	-83.8	-48.3	-176.3	-71.9	156.6	0	0	0	112.3	V241 K242 F313 R318	V241-L316 HydrophobicContact CB-CD2 3.89Å; K242-L316 HydrophobicContact CB-CD1 4.19Å; K242-L316 HydrophobicContact CB-CD2 3.69Å; K242-L316 HydrophobicContact CB-CG 4.46Å; K242-L316 HydrophobicContact CG-CD2 3.98Å; F313-L316 HydrophobicContact CB-CD1 4.4Å; F313-L316 HydrophobicContact CD2-CD1 3.3Å; F313-L316 HydrophobicContact CE2-CD1 3.62Å; F313-L316 HydrophobicContact CG-CD1 3.89Å; F313-L316 HydrophobicContact CZ-CD1 4.42Å; F313-L316 WeakPolarHBondContact O-CB 3.48Å; F313-L316 PolarHBondContact O-N 3.19Å; L316-R318 PolarHBondContact O-N 2.97Å
317	L	36.1	Very low	31.1	Very low	61 Å²	61	107.1 Å²	107.1	32%	0.319	57%	0.571	S	S	.	*	G	3₁₀ helix	trans	-69.5	-20.1	176.2	-68.5	171.1	0	0	0	113	L157 Y314 A319 H320 N321	L157-L317 HydrophobicContact CD2-CD1 3.77Å; Y314-L317 HydrophobicContact CD1-CB 4.47Å; Y314-L317 HydrophobicContact CD1-CD1 4.07Å; Y314-L317 HydrophobicContact CE1-CD1 3.91Å; L317-A319 PolarHBondContact O-N 3.18Å; L317-H320 PolarHBondContact O-N 2.86Å; L317-N321 PolarHBondContact O-N 3.16Å
318	R	37.3	Very low	30.9	Very low	122 Å²	122	108.8 Å²	108.8	46%	0.46	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-71	-16.1	-177.8	-150.7	-174.6	-54	-170.1	6.5	113.9	Y314 L316 H320 M322	Y314-R318 PolarHBondContact O-NE 2.59Å; Y314-R318 PolarHBondContact O-NH2 3.15Å; L316-R318 PolarHBondContact O-N 2.97Å; R318-H320 VanDerWaalsContact C-N 3.34Å; R318-M322 HydrophobicContact CG-CG 4.44Å
319	A	35.9	Very low	30.8	Very low	79 Å²	79	107 Å²	107	65%	0.653	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-78.7	-16	174.2	0	0	0	0	0	113.4	L317	L317-A319 PolarHBondContact O-N 3.18Å
320	H	34.8	Very low	30.2	Very low	69 Å²	69	101.2 Å²	101.2	32%	0.319	55%	0.552	S	S	.	*	T	Hydrogen-bonded Turn	trans	-126.5	2.7	-173.4	-146.9	-56	0	0	0	114.2	H232 Q236 L317 R318	H232-H320 AromaticContact NE2-CE1 3.77Å; Q236-H320 PolarHBondContact OE1-CE1 3.36Å; L317-H320 PolarHBondContact O-N 2.86Å; R318-H320 VanDerWaalsContact C-N 3.34Å
321	N	30.4	Very low	30.2	Very low	119 Å²	119	103.2 Å²	103.2	64%	0.636	55%	0.553	S	S	*	*			trans	-151	97.6	172.3	-147.8	2.8	0	0	0	113.5	L317	L317-N321 PolarHBondContact O-N 3.16Å
322	M	25.2	Very low	29.8	Very low	142 Å²	142	107.1 Å²	107.1	70%	0.7	57%	0.568	S	S	*	*			trans	-150.1	58.5	168	-98.2	-63.4	114.3	0	0	111.4	R318	R318-M322 HydrophobicContact CG-CG 4.44Å
323	Q	25.2	Very low	29.4	Very low	144 Å²	144	109.9 Å²	109.9	67%	0.673	58%	0.582	S	S	*	*	S	Bend	trans	-144.1	124.6	146	-80.9	-160.3	3.1	0	0	108.4
324	G	24.5	Very low	28.9	Very low	58 Å²	58	116.3 Å²	116.3	60%	0.598	61%	0.61	S	S	*	*	S	Bend	trans	124.7	108.8	176.4	0	0	0	0	0	113.5
325	F	23.5	Very low	28.3	Very low	188 Å²	188	120.8 Å²	120.8	83%	0.825	64%	0.638	S	S	*	*			trans	54.4	115.2	156.2	-53.6	-75.6	0	0	0	119.9	F327	F325-F327 HydrophobicContact CD1-CD2 4.41Å
326	Q	20.8	Very low	28.7	Very low	154 Å²	154	122.2 Å²	122.2	72%	0.72	65%	0.645	S	S	*	*				-137.6	110.1	116.8	-166.1	165.8	15.4	0	0	108	Y146	Y146-Q326 VanDerWaalsContact CE2-OE1 3.22Å
327	F	23.8	Very low	28.1	Very low	163 Å²	163	127.7 Å²	127.7	72%	0.715	68%	0.675	S	S	*	*			trans	-72.8	159.7	161.2	-106.3	-95.2	0	0	0	108.6	F325	F325-F327 HydrophobicContact CD1-CD2 4.41Å
328	N	24.8	Very low	27.6	Very low	112 Å²	112	131.8 Å²	131.8	60%	0.599	70%	0.696	S	S	*	*			trans	-109.4	112.3	168.6	178.4	110.3	0	0	0	107.1	Q142	Q142-N328 PolarHBondContact NE2-OD1 3.07Å; Q142-N328 VanDerWaalsContact NE2-OD1 3.09Å
329	D	25.4	Very low	27.1	Very low	145 Å²	145	136.1 Å²	136.1	78%	0.775	71%	0.714	S	S	*	*			trans	-59.5	139.3	173.4	-63.1	-60.7	0	0	0	111
330	G	25.9	Very low	26.8	Very low	73 Å²	73	136.7 Å²	136.7	75%	0.753	71%	0.713	S	S	*	*			trans	-108.2	116.6	156.5	0	0	0	0	0	107.2	H332	G330-H332 PolarHBondContact O-N 3.35Å
331	D	27.9	Very low	26.3	Very low	157 Å²	157	138.9 Å²	138.9	84%	0.84	73%	0.727	S	S	*	*			trans	-63.5	124.6	170.8	-84.1	-53.1	0	0	0	110
332	H	26.4	Very low	26.2	Very low	196 Å²	196	140.4 Å²	140.4	91%	0.907	73%	0.728	S	S	*	*			trans	-155.5	136.4	139.1	-107.7	-75.7	0	0	0	109.1	G330	G330-H332 PolarHBondContact O-N 3.35Å
333	L	24.4	Very low	26.4	Very low	144 Å²	144	138.4 Å²	138.4	75%	0.754	73%	0.728	S	S	*	*			trans	-142.8	122.9	-177.5	-171	73	0	0	0	109.9
334	K	25.1	Very low	26.6	Very low	168 Å²	168	137.7 Å²	137.7	73%	0.73	73%	0.729	S	S	*	*			trans	70.5	116.7	169.5	-68.3	164.8	179.5	-173.2	0	118.7
335	D	23.4	Very low	26.9	Very low	146 Å²	146	144.4 Å²	144.4	78%	0.781	74%	0.736	S	S	*	*				37.3	148.6	99.2	-45.8	-33.9	0	0	0	119.8
336	P	46.3	Very low	27.3	Very low	106 Å²	106	142.7 Å²	142.7	69%	0.688	73%	0.731	S	S	*	*			cis	-137.9	-154.1	-20.7	32.1	-7.9	0	0	0	113
337	D	24	Very low	27.6	Very low	135 Å²	135	138.3 Å²	138.3	72%	0.722	73%	0.727	S	S	*	*			trans	101.2	124.9	149.6	-64.9	-24.4	0	0	0	123.2
338	L	25.2	Very low	28	Very low	148 Å²	148	140 Å²	140	78%	0.775	74%	0.737	S	S	*	*			trans	72.9	126.6	139.9	-97.4	63.8	0	0	0	124.8
339	Y	27.4	Very low	28.3	Very low	213 Å²	213	142.3 Å²	142.3	84%	0.835	74%	0.744	S	S	*	*			trans	64.2	122.5	145.6	-96.2	-125.1	0	0	0	118.8
340	S	27.9	Very low	28.5	Very low	91 Å²	91	141.6 Å²	141.6	64%	0.636	74%	0.74	S	S	*	*				80.4	138.5	88.2	-159.2	0	0	0	0	112.4
341	D	26.1	Very low	28.7	Very low	114 Å²	114	145 Å²	145	61%	0.61	74%	0.736	S	S	*	*			cis	-148.6	-174.3	24.1	-156.8	10.1	0	0	0	113.4
342	K	27.7	Very low	28.9	Very low	152 Å²	152	145.8 Å²	145.8	66%	0.661	74%	0.735	S	S	*	*			trans	-21.5	161.3	163.7	-63.4	162.9	-157.3	72.3	0	117.4
343	S	29.9	Very low	29	Very low	100 Å²	100	145.1 Å²	145.1	70%	0.699	73%	0.732	S	S	*	*			cis	-179.7	172.1	33.1	13.3	0	0	0	0	107.3
344	D	28.4	Very low	29.2	Very low	129 Å²	129	143.1 Å²	143.1	69%	0.69	73%	0.731	S	S	*	*			cis	-170.3	146.6	-12.5	-100.2	-23.4	0	0	0	107.9
345	R	30.7	Very low	29.5	Very low	198 Å²	198	143 Å²	143	75%	0.747	74%	0.738	S	S	*	*			trans	61	157	145.9	-61	171.2	100.9	117.3	9.3	118.9
346	E	31.4	Very low	30.9	Very low	153 Å²	153	141.3 Å²	141.3	72%	0.715	74%	0.735	S	S	*	*			cis	-158.5	170.5	-1.9	-127.6	157.5	-171.5	0	0	111.3
347	G	27.8	Very low	30.1	Very low	61 Å²	61	145.6 Å²	145.6	63%	0.629	75%	0.745	S	S	*	*			trans	102.8	100.2	175.6	0	0	0	0	0	113
348	E	32.4	Very low	30.4	Very low	198 Å²	198	142.5 Å²	142.5	93%	0.925	75%	0.746	S	S	*	*				63.6	125.6	70.2	-61.2	-173.6	163	0	0	113.2
349	Q	30.7	Very low	30.5	Very low	162 Å²	162	143 Å²	143	76%	0.757	75%	0.748	S	S	*	*			cis	-101.7	-137.5	0.8	-137.7	172	-103.2	0	0	110
350	D	29.1	Very low	30.6	Very low	129 Å²	129	141.9 Å²	141.9	69%	0.69	75%	0.751	S	S	*	*			cis	-153.1	175.4	3.4	-145.2	-17.7	0	0	0	112.4
351	H	31.5	Very low	30.9	Very low	144 Å²	144	146.5 Å²	146.5	67%	0.667	76%	0.759	S	S	*	*			trans	-77.8	156.9	179.7	-72.2	-113.2	0	0	0	113.3
352	E	30.5	Very low	31	Very low	175 Å²	175	146.3 Å²	146.3	82%	0.818	77%	0.767	S	S	*	*			cis	-148.9	157.2	3.8	-142.1	153	-122.4	0	0	111
353	E	28.8	Very low	31.2	Very low	181 Å²	181	147.3 Å²	147.3	85%	0.846	77%	0.774	S	S	*	*			trans	-144.8	163.7	-168	-175.1	177.2	-130.4	0	0	112.1
354	S	29.6	Very low	31.5	Very low	103 Å²	103	151.6 Å²	151.6	72%	0.72	78%	0.783	S	S	*	*			trans	115.2	87.5	155.2	-50.2	0	0	0	0	117.9
355	D	30.1	Very low	31.6	Very low	164 Å²	164	150.8 Å²	150.8	88%	0.877	79%	0.788	S	S	*	*				38.7	158.6	109.5	-86.7	15.5	0	0	0	124.1
356	P	53.4	Low	32	Very low	111 Å²	111	149.1 Å²	149.1	72%	0.721	79%	0.793	S	S	*	*			trans	-104.6	166.6	-173.7	41.4	-35	0	0	0	114.6
357	E	30.5	Very low	32	Very low	196 Å²	196	146.5 Å²	146.5	92%	0.916	79%	0.792	S	S	*	*			trans	-173.4	158.5	131.7	-116.4	-170.1	-162.2	0	0	115
358	G	29.3	Very low	32.5	Very low	71 Å²	71	151.4 Å²	151.4	73%	0.732	80%	0.804	S	S	*	*			trans	82.4	163	156.2	0	0	0	0	0	118.7
359	L	28.2	Very low	32.6	Very low	157 Å²	157	147.5 Å²	147.5	82%	0.822	79%	0.794	S	S	*	*			cis	-171.2	126.8	-17.7	171	68.3	0	0	0	109
360	E	29.6	Very low	32.9	Very low	191 Å²	191	144.6 Å²	144.6	89%	0.893	79%	0.791	S	S	*	*			trans	-164.4	170	144.1	-122.5	171.1	-163	0	0	113.7
361	K	32.3	Very low	33.2	Very low	187 Å²	187	147.7 Å²	147.7	81%	0.813	80%	0.801	S	S	*	*			trans	-136.2	134.8	-174.3	-66.6	179	177.9	179.6	0	112.7
362	S	29.6	Very low	33.4	Very low	110 Å²	110	151.5 Å²	151.5	77%	0.769	81%	0.81	S	S	*	*			trans	-167.4	116.4	147.1	42.5	0	0	0	0	106.9
363	E	32.4	Very low	33.7	Very low	173 Å²	173	150.9 Å²	150.9	81%	0.808	81%	0.807	S	S	*	*				76.3	96.8	74.7	-73	-178.1	-167.5	0	0	113.7
364	E	36.3	Very low	33.9	Very low	190 Å²	190	148.8 Å²	148.8	89%	0.888	80%	0.802	S	S	*	*			trans	64.3	107.6	144	-54.1	-170.2	-153.1	0	0	121.3
365	S	28.7	Very low	34.3	Very low	113 Å²	113	151.5 Å²	151.5	79%	0.79	81%	0.808	S	S	*	*				-166.4	139	124.6	-168.5	0	0	0	0	111.6
366	D	40.5	Very low	34.6	Very low	162 Å²	162	147 Å²	147	87%	0.866	79%	0.79	S	S	*	*			trans	-71.9	137.3	156	-80.8	-48.9	0	0	0	109.4
367	S	31.1	Very low	34.2	Very low	98 Å²	98	150 Å²	150	69%	0.685	79%	0.788	S	S	*	*			trans	-158.5	114.5	155.2	65.2	0	0	0	0	112	T369	S367-T369 PolarHBondContact O-N 2.87Å
368	D	37.9	Very low	35.1	Very low	165 Å²	165	145 Å²	145	88%	0.882	77%	0.766	S	S	*	*			trans	-72.9	112.9	171.2	176.7	20.9	0	0	0	110.9
369	T	33.8	Very low	35.9	Very low	116 Å²	116	149 Å²	149	71%	0.712	77%	0.766	S	S	*	*			trans	-140.3	127.3	170.3	54.8	0	0	0	0	111.6	S367 E371	S367-T369 PolarHBondContact O-N 2.87Å; T369-E371 PolarHBondContact O-N 3.07Å
370	S	38.7	Very low	36.8	Very low	100 Å²	100	145.8 Å²	145.8	70%	0.699	75%	0.748	S	S	*	*			trans	-65.9	126.5	176.6	48.5	0	0	0	0	113	R372	S370-R372 PolarHBondContact O-N 3.26Å
371	E	34.3	Very low	37.8	Very low	194 Å²	194	141.8 Å²	141.8	91%	0.907	73%	0.733	S	S	*	*			trans	-65.9	113.2	158.9	-69.2	-168.7	150.1	0	0	108.8	T369	T369-E371 PolarHBondContact O-N 3.07Å
372	R	35.9	Very low	38.8	Very low	224 Å²	224	139.2 Å²	139.2	85%	0.845	74%	0.735	S	S	*	*			trans	-72.8	132.3	163.3	-66.4	-177	174.8	104.8	1.2	107.2	S370 D374	S370-R372 PolarHBondContact O-N 3.26Å; R372-D374 PolarHBondContact O-N 3.09Å
373	Q	37.5	Very low	39.7	Very low	163 Å²	163	139.4 Å²	139.4	76%	0.762	73%	0.728	S	S	*	*			trans	-61.1	126.8	166.1	-71.8	-177.5	-42.7	0	0	108.3	D375	Q373-D375 PolarHBondContact O-N 3.44Å
374	D	32.8	Very low	40.8	Very low	136 Å²	136	137.6 Å²	137.6	73%	0.727	72%	0.719	S	S	*	*			trans	-76.6	115.8	174.5	-175.5	34.4	0	0	0	108.7	R372 S376	R372-D374 PolarHBondContact O-N 3.09Å; D374-S376 PolarHBondContact O-N 2.69Å
375	D	38.2	Very low	42.1	Very low	160 Å²	160	135.4 Å²	135.4	86%	0.856	71%	0.709	S	S	*	*			trans	-73.6	52.3	175.8	-82.8	-41.4	0	0	0	110.5	Q373 Y377	Q373-D375 PolarHBondContact O-N 3.44Å; D375-Y377 PolarHBondContact O-N 3.1Å
376	S	36	Very low	44.1	Very low	71 Å²	71	133 Å²	133	50%	0.497	69%	0.687	S	S	.	*			trans	-61.7	109	179.1	54.6	0	0	0	0	110.2	D374 I378	D374-S376 PolarHBondContact O-N 2.69Å; S376-I378 PolarHBondContact O-N 3.16Å
377	Y	45.2	Very low	45.9	Very low	172 Å²	172	135.2 Å²	135.2	68%	0.675	68%	0.683	S	S	*	*			trans	-65.2	96.8	171.5	-178.7	-92.1	0	0	0	108.7	D375 E379	D375-Y377 PolarHBondContact O-N 3.1Å; Y377-E379 HydrophobicContact CD1-CB 4.23Å; Y377-E379 HydrophobicContact CE1-CB 4.01Å; Y377-E379 HydrophobicContact CE1-CG 4.31Å; Y377-E379 PolarHBondContact O-N 3.19Å
378	I	49.3	Very low	48.7	Very low	91 Å²	91	134 Å²	134	47%	0.467	67%	0.666	S	S	.	*			trans	-72	97.3	170.3	-58.2	178	0	0	0	107.1	S376 M380	S376-I378 PolarHBondContact O-N 3.16Å; I378-M380 PolarHBondContact O-N 2.78Å; I378-M380 VanDerWaalsContact O-N 3.13Å
379	E	45.3	Very low	51.3	Low	157 Å²	157	126.5 Å²	126.5	73%	0.734	63%	0.627	S	S	*	*			trans	-59.5	113.7	166.8	-168	163.8	-121.4	0	0	107.9	Y377 D381	Y377-E379 HydrophobicContact CD1-CB 4.23Å; Y377-E379 HydrophobicContact CE1-CB 4.01Å; Y377-E379 HydrophobicContact CE1-CG 4.31Å; Y377-E379 PolarHBondContact O-N 3.19Å; E379-D381 PolarHBondContact O-N 2.79Å
380	M	46.4	Very low	54	Low	89 Å²	89	123.5 Å²	123.5	44%	0.438	61%	0.609	S	S	.	*			trans	-70.2	122.2	-169	-72.2	177.5	55.2	0	0	111	I378 P382 L769	I378-M380 PolarHBondContact O-N 2.78Å; I378-M380 VanDerWaalsContact O-N 3.13Å; M380-P382 WeakPolarHBondContact O-CD 3.29Å; M380-P382 VanDerWaalsContact O-N 3.17Å; M380-L769 HydrophobicContact CE-CD1 4.25Å; M380-L769 HydrophobicContact SD-CD1 4.38Å
381	D	51.3	Low	56.6	Low	106 Å²	106	120.2 Å²	120.2	57%	0.567	58%	0.582	S	S	*	*			trans	-57.1	117.1	162.9	-176.4	-13.6	0	0	0	108.8	E379 N383	E379-D381 PolarHBondContact O-N 2.79Å; D381-N383 PolarHBondContact O-N 2.94Å; D381-N383 VanDerWaalsContact O-N 3.09Å; D381-N383 VanDerWaalsContact OD1-CB 3.27Å; D381-N383 WeakPolarHBondContact OD1-CB 3.46Å; D381-N383 PolarHBondContact OD1-N 2.65Å
382	P	53.7	Low	59.4	Low	133 Å²	133	115.9 Å²	115.9	86%	0.864	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.2	-16	179.6	-22.5	34.8	0	0	0	113.7	M380	M380-P382 WeakPolarHBondContact O-CD 3.29Å; M380-P382 VanDerWaalsContact O-N 3.17Å
383	N	48.6	Very low	62	Low	115 Å²	115	110.6 Å²	110.6	62%	0.615	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	0.2	-169.3	-131	-1.9	0	0	0	114.1	D381 H385	D381-N383 PolarHBondContact O-N 2.94Å; D381-N383 VanDerWaalsContact O-N 3.09Å; D381-N383 VanDerWaalsContact OD1-CB 3.27Å; D381-N383 WeakPolarHBondContact OD1-CB 3.46Å; D381-N383 PolarHBondContact OD1-N 2.65Å; N383-H385 VanDerWaalsContact C-N 3.3Å; N383-H385 PolarHBondContact O-N 3.25Å; N383-H385 PolarHBondContact O-ND1 2.85Å
384	E	56.4	Low	63.9	Low	134 Å²	134	105.7 Å²	105.7	63%	0.626	53%	0.525	S	S	*	.			trans	-69.4	85.3	174.5	-167.5	-161.6	-135	0	0	111	L386 K781	E384-L386 PolarHBondContact O-N 3.41Å; E384-K781 IonicContact OE2-NZ 3.43Å; E384-K781 PolarHBondContact OE2-NZ 2.95Å
385	H	61.5	Low	64.9	Low	145 Å²	145	104.9 Å²	104.9	67%	0.671	53%	0.53	S	S	*	.			trans	-59.1	119.3	179.6	-78.6	57.8	0	0	0	111	N383 R387	N383-H385 VanDerWaalsContact C-N 3.3Å; N383-H385 PolarHBondContact O-N 3.25Å; N383-H385 PolarHBondContact O-ND1 2.85Å; H385-R387 PolarHBondContact O-N 2.99Å
386	L	72.3	Confident	65.7	Low	62 Å²	62	104.9 Å²	104.9	33%	0.325	52%	0.524	S	S	.	.			trans	-66.9	100.7	-179.4	-169.7	101.8	0	0	0	110.5	E384 E388 I770 F772 K781	E384-L386 PolarHBondContact O-N 3.41Å; L386-E388 VanDerWaalsContact C-N 3.27Å; L386-E388 HydrophobicContact CD2-CB 4.25Å; L386-E388 HydrophobicContact CD2-CG 4.33Å; L386-E388 PolarHBondContact O-N 2.72Å; L386-I770 HydrophobicContact CD1-CG2 4.34Å; L386-I770 HydrophobicContact CD2-CD1 4.43Å; L386-F772 HydrophobicContact CD1-CD1 3.91Å; L386-F772 HydrophobicContact CD1-CE1 3.81Å; L386-F772 HydrophobicContact CD1-CE2 4.48Å; L386-F772 HydrophobicContact CD1-CG 4.3Å; L386-F772 HydrophobicContact CD1-CZ 4.11Å; L386-F772 HydrophobicContact CD2-CB 4Å; L386-F772 HydrophobicContact CD2-CD1 4.24Å; L386-F772 HydrophobicContact CD2-CD2 4.33Å; L386-F772 HydrophobicContact CD2-CG 3.95Å; L386-F772 HydrophobicContact CG-CD1 4.47Å; L386-F772 HydrophobicContact CG-CD2 4.44Å; L386-F772 HydrophobicContact CG-CG 4.37Å; L386-K781 HydrophobicContact CD1-CB 4.27Å; L386-K781 HydrophobicContact CD1-CD 3.74Å
387	R	78.1	Confident	66.9	Low	208 Å²	208	103.8 Å²	103.8	79%	0.785	51%	0.511	S	S	*	.			trans	-78.7	71.7	175.6	-59.5	-171.5	-171.5	-168.7	3.2	111.1	H385 K774	H385-R387 PolarHBondContact O-N 2.99Å; R387-K774 WeakPolarHBondContact O-CD 3.47Å; R387-K774 WeakPolarHBondContact O-CE 3.42Å; R387-K774 WeakPolarHBondContact O-CG 3.48Å
388	E	89.8	Confident	67.5	Low	72 Å²	72	101.5 Å²	101.5	34%	0.336	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-72.2	155.3	162.9	63.3	176.1	-161.7	0	0	110.8	L386 K516 F772 E773	L386-E388 VanDerWaalsContact C-N 3.27Å; L386-E388 HydrophobicContact CD2-CB 4.25Å; L386-E388 HydrophobicContact CD2-CG 4.33Å; L386-E388 PolarHBondContact O-N 2.72Å; E388-K516 IonicContact OE1-NZ 3.52Å; E388-K516 PolarHBondContact OE1-NZ 2.88Å; E388-K516 IonicContact OE2-NZ 3.66Å; E388-K516 PolarHBondContact OE2-NZ 3.43Å; E388-F772 HydrophobicContact CB-CB 4.07Å; E388-F772 HydrophobicContact CB-CD2 4.07Å; E388-F772 HydrophobicContact CB-CG 4.5Å; E388-E773 WeakPolarHBondContact CA-O 3.2Å; E388-E773 WeakPolarHBondContact CB-O 3.32Å
389	T	91.6	Very high	67.9	Low	9 Å²	9	99.4 Å²	99.4	6%	0.055	50%	0.496	C	S	.	.	P	Polyproline II helix	trans	-65.2	135.9	171.2	-72.1	0	0	0	0	109.1	Y391 R505 V685 E773 D775	T389-Y391 HydrophobicContact CG2-CE2 4.36Å; T389-Y391 VanDerWaalsContact O-CD2 3.24Å; T389-Y391 WeakPolarHBondContact O-CD2 3.24Å; T389-Y391 PolarHBondContact O-N 3.44Å; T389-R505 PolarHBondContact OG1-NH1 2.83Å; T389-V685 HydrophobicContact CG2-CB 4.4Å; T389-V685 HydrophobicContact CG2-CG1 3.85Å; T389-V685 HydrophobicContact CG2-CG2 3.64Å; T389-E773 VanDerWaalsContact CB-OE2 3.26Å; T389-E773 WeakPolarHBondContact CB-OE2 3.35Å; T389-E773 PolarHBondContact N-O 2.85Å; T389-E773 PolarHBondContact OG1-OE2 2.61Å; T389-D775 PolarHBondContact OG1-N 3.14Å; T389-D775 VanDerWaalsContact OG1-N 3.16Å
390	P	92	Very high	68.4	Low	53 Å²	53	92.1 Å²	92.1	34%	0.344	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-71.4	131.2	177.1	27.4	-32	0	0	0	111.2	P686 E689	P390-P686 WeakPolarHBondContact O-CD 3.29Å; P390-E689 VanDerWaalsContact CG-CD 3.41Å; P390-E689 WeakPolarHBondContact CG-OE1 3.37Å; P390-E689 WeakPolarHBondContact CG-OE2 3.42Å
391	Y	93.3	Very high	69	Low	30 Å²	30	94.2 Å²	94.2	12%	0.118	47%	0.472	C	S	.	.			trans	-120.1	121.1	179.3	-82.2	-80.2	0	0	0	109.4	T389 M507 F518 T684 V685 E773	T389-Y391 HydrophobicContact CG2-CE2 4.36Å; T389-Y391 VanDerWaalsContact O-CD2 3.24Å; T389-Y391 WeakPolarHBondContact O-CD2 3.24Å; T389-Y391 PolarHBondContact O-N 3.44Å; Y391-M507 HydrophobicContact CD1-CG 4.02Å; Y391-M507 HydrophobicContact CD2-CG 4.27Å; Y391-M507 HydrophobicContact CD2-SD 4.03Å; Y391-M507 HydrophobicContact CE1-CG 4.47Å; Y391-M507 HydrophobicContact CG-CE 4.27Å; Y391-M507 HydrophobicContact CG-CG 3.91Å; Y391-M507 HydrophobicContact CG-SD 4.07Å; Y391-F518 HydrophobicContact CE2-CE1 4.33Å; Y391-T684 WeakPolarHBondContact CA-O 3.45Å; Y391-V685 HydrophobicContact CD1-CG2 4.01Å; Y391-V685 HydrophobicContact CE1-CG2 3.63Å; Y391-E773 HydrophobicContact CE2-CB 4.28Å; Y391-E773 VanDerWaalsContact OH-CD 3.25Å; Y391-E773 PolarHBondContact OH-OE2 2.85Å
392	M	92.3	Very high	69.3	Low	103 Å²	103	91.9 Å²	91.9	51%	0.507	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	151.1	179.8	-62.8	-161.2	-53.1	0	0	112.1	Q394 Y683 T684 P686	M392-Q394 PolarHBondContact O-N 3.25Å; M392-Y683 VanDerWaalsContact C-CD1 3.48Å; M392-Y683 CarbonylContact O-C 3.56Å; M392-Y683 WeakPolarHBondContact O-CA 3.36Å; M392-Y683 WeakPolarHBondContact O-CB 3.49Å; M392-T684 PolarHBondContact N-O 3.18Å; M392-T684 PolarHBondContact O-N 3.07Å; M392-P686 HydrophobicContact CE-CB 3.93Å; M392-P686 HydrophobicContact CE-CG 3.84Å; M392-P686 HydrophobicContact CG-CG 4.06Å; M392-P686 HydrophobicContact SD-CG 4.1Å
393	E	90.1	Very high	69.5	Low	114 Å²	114	86.8 Å²	86.8	53%	0.533	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	126.7	178.5	-177	152.1	166.8	0	0	111.6	S395 T681 Y683	E393-S395 PolarHBondContact O-N 2.66Å; E393-S395 VanDerWaalsContact O-N 3.14Å; E393-T681 HydrophobicContact CG-CG2 3.57Å; E393-Y683 HydrophobicContact CB-CD1 4.01Å; E393-Y683 HydrophobicContact CB-CE1 3.58Å; E393-Y683 HydrophobicContact CG-CE1 4.22Å; E393-Y683 PolarHBondContact OE2-OH 2.64Å
394	Q	78.1	Confident	70	Confident	60 Å²	60	84.3 Å²	84.3	28%	0.28	42%	0.424	S	S	.	.			trans	-81.1	98.5	-178.9	-167.3	166.5	53.8	0	0	111.1	M392 H396 R682	M392-Q394 PolarHBondContact O-N 3.25Å; Q394-H396 PolarHBondContact O-N 3.26Å; Q394-R682 WeakPolarHBondContact CB-O 3.43Å; Q394-R682 PolarHBondContact N-O 3.37Å; Q394-R682 VanDerWaalsContact N-O 3.16Å
395	S	54.2	Low	69.9	Low	119 Å²	119	81.8 Å²	81.8	83%	0.832	43%	0.426	S	S	*	.			trans	-77.2	-2.2	-163.1	57.7	0	0	0	0	117.4	E393	E393-S395 PolarHBondContact O-N 2.66Å; E393-S395 VanDerWaalsContact O-N 3.14Å
396	H	54.6	Low	69.8	Low	159 Å²	159	75.3 Å²	75.3	74%	0.736	40%	0.397	S	S	*	.			trans	-146.6	127.5	-179.8	-171.7	-83.6	0	0	0	113.3	Q394	Q394-H396 PolarHBondContact O-N 3.26Å
397	E	61.2	Low	69.2	Low	49 Å²	49	72.7 Å²	72.7	23%	0.229	38%	0.384	C	S	.	.			trans	-149.3	113	-179	179.4	165.4	-99.6	0	0	111.1	L399 Y456 K487 R679	E397-L399 HydrophobicContact CG-CD2 4.12Å; E397-Y456 PolarHBondContact OE1-OH 3.48Å; E397-K487 WeakPolarHBondContact OE1-CE 3.43Å; E397-K487 IonicContact OE1-NZ 3.42Å; E397-K487 PolarHBondContact OE1-NZ 3.11Å; E397-R679 IonicContact OE2-CZ 2.68Å; E397-R679 VanDerWaalsContact OE2-CZ 3.23Å; E397-R679 IonicContact OE2-NE 3.87Å; E397-R679 PolarHBondContact OE2-NE 2.95Å; E397-R679 IonicContact OE2-NH2 2.65Å; E397-R679 PolarHBondContact OE2-NH2 2.75Å
398	E	56.5	Low	68.3	Low	124 Å²	124	64.7 Å²	64.7	58%	0.579	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-86.4	118.7	174.1	-169	-180	179.5	0	0	109.9	K490	E398-K490 WeakPolarHBondContact OE1-CD 3.49Å; E398-K490 IonicContact OE1-NZ 3.44Å; E398-K490 PolarHBondContact OE1-NZ 3.05Å
399	L	58.6	Low	67.2	Low	47 Å²	47	63.6 Å²	63.6	25%	0.246	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-94.3	136.4	176.6	-62	177.4	0	0	0	110.7	E397 K487 R676	E397-L399 HydrophobicContact CG-CD2 4.12Å; L399-K487 HydrophobicContact CD2-CD 4.36Å; L399-K487 HydrophobicContact CD2-CG 3.92Å; L399-R676 HydrophobicContact CD1-CB 4.33Å; L399-R676 HydrophobicContact CD1-CG 4.45Å
400	G	55.8	Low	65.7	Low	4 Å²	4	69.5 Å²	69.5	4%	0.041	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-66.5	145.5	174	0	0	0	0	0	113.8	K488	G400-K488 WeakPolarHBondContact CA-O 3.44Å; G400-K488 PolarHBondContact N-O 2.61Å
401	E	58.7	Low	64.3	Low	133 Å²	133	67.6 Å²	67.6	62%	0.621	38%	0.376	S	S	*	.	P	Polyproline II helix	trans	-70.2	157.1	172	-67.8	167.9	-155.3	0	0	111.5	A406 K488	E401-A406 HydrophobicContact CB-CB 4.4Å; E401-A406 WeakPolarHBondContact O-CB 3.48Å; E401-K488 WeakPolarHBondContact O-CE 3.44Å; E401-K488 PolarHBondContact O-NZ 3.14Å
402	A	58.4	Low	63.1	Low	57 Å²	57	68.6 Å²	68.6	47%	0.471	39%	0.388	S	S	.	.	S	Bend	trans	-73.2	157.9	-179.9	0	0	0	0	0	112.9
403	G	57.8	Low	62	Low	26 Å²	26	70.2 Å²	70.2	27%	0.268	39%	0.394	S	S	.	.	S	Bend	trans	78.4	-174.2	173.7	0	0	0	0	0	116.4	A405 A406 Q407 K488 D652	G403-A405 VanDerWaalsContact C-N 3.34Å; G403-A405 PolarHBondContact O-N 3.38Å; G403-A406 PolarHBondContact O-N 3.32Å; G403-Q407 PolarHBondContact O-OE1 3.19Å; G403-K488 VanDerWaalsContact N-NZ 3.17Å; G403-K488 PolarHBondContact O-NZ 3.25Å; G403-D652 PolarHBondContact N-OD2 3.11Å
404	E	58.1	Low	61.1	Low	62 Å²	62	71.9 Å²	71.9	29%	0.29	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-66.5	-27.5	-165.9	-168.4	165.5	-164.2	0	0	114.6	A406 Q407 T408 K621 V630	E404-A406 PolarHBondContact O-N 3.34Å; E404-Q407 PolarHBondContact O-N 3.27Å; E404-T408 WeakPolarHBondContact O-CB 3.44Å; E404-T408 PolarHBondContact O-N 3.06Å; E404-T408 PolarHBondContact O-OG1 3.2Å; E404-K621 IonicContact OE1-NZ 3.74Å; E404-K621 PolarHBondContact OE1-NZ 3.45Å; E404-K621 IonicContact OE2-NZ 2.79Å; E404-K621 PolarHBondContact OE2-NZ 3.1Å; E404-V630 HydrophobicContact CB-CG1 4.16Å; E404-V630 HydrophobicContact CB-CG2 4.08Å; E404-V630 HydrophobicContact CG-CG2 4.22Å; E404-V630 WeakPolarHBondContact OE2-CG2 3.06Å
405	A	55.9	Low	60.9	Low	81 Å²	81	71 Å²	71	67%	0.669	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-62.1	-41	-179.4	0	0	0	0	0	112.3	G403 Q407 T408	G403-A405 VanDerWaalsContact C-N 3.34Å; G403-A405 PolarHBondContact O-N 3.38Å; A405-Q407 VanDerWaalsContact C-N 3.3Å; A405-Q407 PolarHBondContact O-N 2.66Å; A405-T408 PolarHBondContact O-N 3.12Å
406	A	58.6	Low	61.8	Low	9 Å²	9	69.4 Å²	69.4	7%	0.074	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-73	-20.1	178.9	0	0	0	0	0	113.8	E401 G403 E404 G491	E401-A406 HydrophobicContact CB-CB 4.4Å; E401-A406 WeakPolarHBondContact O-CB 3.48Å; G403-A406 PolarHBondContact O-N 3.32Å; E404-A406 PolarHBondContact O-N 3.34Å; A406-G491 WeakPolarHBondContact O-CA 3.35Å; A406-G491 PolarHBondContact O-N 3.4Å
407	Q	59.3	Low	62.7	Low	8 Å²	8	64.7 Å²	64.7	4%	0.037	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-96.3	0.2	178.1	-76.3	157.1	-89.4	0	0	113.4	G403 E404 A405 K488 T596 L597 N631	G403-Q407 PolarHBondContact O-OE1 3.19Å; E404-Q407 PolarHBondContact O-N 3.27Å; A405-Q407 VanDerWaalsContact C-N 3.3Å; A405-Q407 PolarHBondContact O-N 2.66Å; Q407-K488 HydrophobicContact CG-CD 4.09Å; Q407-T596 HydrophobicContact CB-CG2 4.48Å; Q407-T596 WeakPolarHBondContact O-CA 3.43Å; Q407-L597 WeakPolarHBondContact CG-O 3.38Å; Q407-L597 PolarHBondContact NE2-O 2.85Å; Q407-L597 PolarHBondContact O-N 3.21Å; Q407-N631 PolarHBondContact NE2-OD1 2.78Å; Q407-N631 PolarHBondContact OE1-ND2 2.79Å
408	T	60	Low	63.4	Low	39 Å²	39	66.6 Å²	66.6	24%	0.239	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	132.7	-176.8	-70.4	0	0	0	0	109.6	E404 A405 T594	E404-T408 WeakPolarHBondContact O-CB 3.44Å; E404-T408 PolarHBondContact O-N 3.06Å; E404-T408 PolarHBondContact O-OG1 3.2Å; A405-T408 PolarHBondContact O-N 3.12Å; T408-T594 HydrophobicContact CG2-CG2 3.4Å; T408-T594 VanDerWaalsContact CG2-CG2 3.4Å
409	E	66.3	Low	64.4	Low	49 Å²	49	61.3 Å²	61.3	23%	0.229	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	120.3	173.2	-169.5	165.4	176.9	0	0	111.3	V411 L492 K493 M595	E409-V411 VanDerWaalsContact C-N 3.27Å; E409-V411 PolarHBondContact O-N 2.9Å; E409-L492 HydrophobicContact CB-CB 3.96Å; E409-L492 PolarHBondContact OE2-N 3.45Å; E409-K493 IonicContact OE1-NZ 3.31Å; E409-K493 PolarHBondContact OE1-NZ 3.43Å; E409-K493 WeakPolarHBondContact OE2-CE 3.3Å; E409-K493 IonicContact OE2-NZ 3.73Å; E409-K493 PolarHBondContact OE2-NZ 3.13Å; E409-M595 PolarHBondContact N-O 2.78Å
410	T	60.7	Low	65.1	Low	133 Å²	133	65.2 Å²	65.2	82%	0.816	36%	0.36	S	S	*	.			trans	-77.8	78.3	174.5	52.4	0	0	0	0	110	S412	T410-S412 PolarHBondContact O-N 2.84Å
411	V	62.8	Low	66.2	Low	13 Å²	13	68.5 Å²	68.5	8%	0.079	38%	0.38	C	S	.	.			trans	-55.6	133	176.2	-173.5	0	0	0	0	110.5	E409 N415 K416 F440 M595	E409-V411 VanDerWaalsContact C-N 3.27Å; E409-V411 PolarHBondContact O-N 2.9Å; V411-N415 HydrophobicContact CG1-CB 3.35Å; V411-K416 HydrophobicContact CB-CG 4.09Å; V411-K416 HydrophobicContact CG1-CG 3.97Å; V411-K416 WeakPolarHBondContact O-CE 3.23Å; V411-F440 HydrophobicContact CG1-CE2 3.85Å; V411-F440 HydrophobicContact CG1-CZ 4.15Å; V411-M595 HydrophobicContact CG2-CE 3.84Å; V411-M595 HydrophobicContact CG2-SD 3.78Å
412	S	67.4	Low	66.9	Low	52 Å²	52	64.3 Å²	64.3	36%	0.364	36%	0.362	S	S	.	.			trans	-64.5	156.1	176	64.7	0	0	0	0	111.9	T410 E414 N415 K416	T410-S412 PolarHBondContact O-N 2.84Å; S412-E414 PolarHBondContact O-N 2.8Å; S412-N415 PolarHBondContact O-N 3.49Å; S412-N415 VanDerWaalsContact O-N 3.07Å; S412-N415 WeakPolarHBondContact OG-CB 3.49Å; S412-N415 PolarHBondContact OG-N 3.23Å; S412-N415 PolarHBondContact OG-ND2 3.11Å; S412-K416 WeakPolarHBondContact O-CG 3.1Å; S412-K416 PolarHBondContact O-N 3.41Å
413	E	68.7	Low	67.6	Low	136 Å²	136	62.5 Å²	62.5	64%	0.636	34%	0.344	S	S	*	.	H	α-helix	trans	-59	-35.2	-179.6	-67.8	-54.4	134.7	0	0	113	K416 S417	E413-K416 PolarHBondContact O-N 3.13Å; E413-K416 IonicContact OE1-NZ 3.18Å; E413-K416 PolarHBondContact OE1-NZ 3.19Å; E413-S417 WeakPolarHBondContact O-CB 3.29Å; E413-S417 PolarHBondContact O-N 3Å
414	E	70.8	Confident	68.3	Low	150 Å²	150	67.7 Å²	67.7	70%	0.701	36%	0.359	S	S	*	.	H	α-helix	trans	-59.2	-50.9	172.8	-64.7	167.3	177.3	0	0	111	S412 S417 L418	S412-E414 PolarHBondContact O-N 2.8Å; E414-S417 WeakPolarHBondContact O-CB 3.38Å; E414-S417 PolarHBondContact O-N 3.32Å; E414-S417 VanDerWaalsContact O-N 3.08Å; E414-S417 PolarHBondContact O-OG 3.37Å; E414-L418 PolarHBondContact O-N 2.94Å; E414-L418 VanDerWaalsContact O-N 3.09Å
415	N	74.2	Confident	69	Low	41 Å²	41	71.4 Å²	71.4	22%	0.219	38%	0.376	C	S	.	.	H	α-helix	trans	-68.4	-34.3	179.6	-79.6	-19	0	0	0	112.7	V411 S412 S417 L418 I419 F440	V411-N415 HydrophobicContact CG1-CB 3.35Å; S412-N415 PolarHBondContact O-N 3.49Å; S412-N415 VanDerWaalsContact O-N 3.07Å; S412-N415 WeakPolarHBondContact OG-CB 3.49Å; S412-N415 PolarHBondContact OG-N 3.23Å; S412-N415 PolarHBondContact OG-ND2 3.11Å; N415-S417 VanDerWaalsContact C-N 3.33Å; N415-L418 PolarHBondContact O-N 3.45Å; N415-I419 PolarHBondContact O-N 2.86Å; N415-I419 VanDerWaalsContact O-N 3.08Å; N415-F440 HydrophobicContact CB-CD1 4.08Å; N415-F440 HydrophobicContact CB-CD2 4.37Å; N415-F440 HydrophobicContact CB-CE1 3.53Å; N415-F440 HydrophobicContact CB-CE2 3.88Å; N415-F440 HydrophobicContact CB-CG 4.48Å; N415-F440 HydrophobicContact CB-CZ 3.44Å; N415-F440 VanDerWaalsContact CB-CZ 3.44Å; N415-F440 VanDerWaalsContact CG-CD1 3.43Å; N415-F440 VanDerWaalsContact OD1-CD1 3.27Å; N415-F440 WeakPolarHBondContact OD1-CD1 3.45Å; N415-F440 VanDerWaalsContact OD1-CE1 3.29Å; N415-F440 WeakPolarHBondContact OD1-CE1 3.05Å
416	K	72.6	Confident	69.8	Low	86 Å²	86	68 Å²	68	37%	0.374	35%	0.347	S	S	.	.	H	α-helix	trans	-61.7	-40.8	167.9	-71.5	176.2	-176	165.6	0	111.1	V411 S412 E413 L418 I419 W420	V411-K416 HydrophobicContact CB-CG 4.09Å; V411-K416 HydrophobicContact CG1-CG 3.97Å; V411-K416 WeakPolarHBondContact O-CE 3.23Å; S412-K416 WeakPolarHBondContact O-CG 3.1Å; S412-K416 PolarHBondContact O-N 3.41Å; E413-K416 PolarHBondContact O-N 3.13Å; E413-K416 IonicContact OE1-NZ 3.18Å; E413-K416 PolarHBondContact OE1-NZ 3.19Å; K416-L418 VanDerWaalsContact C-N 3.34Å; K416-L418 PolarHBondContact O-N 2.94Å; K416-I419 PolarHBondContact O-N 3.08Å; K416-W420 VanDerWaalsContact O-CB 3.24Å; K416-W420 WeakPolarHBondContact O-CB 3.37Å; K416-W420 PolarHBondContact O-N 3.41Å
417	S	73.9	Confident	70.8	Confident	60 Å²	60	75.9 Å²	75.9	42%	0.42	38%	0.375	S	S	.	.	H	α-helix	trans	-65.7	-35.4	179.6	86.1	0	0	0	0	112.6	E413 E414 N415 T421	E413-S417 WeakPolarHBondContact O-CB 3.29Å; E413-S417 PolarHBondContact O-N 3Å; E414-S417 WeakPolarHBondContact O-CB 3.38Å; E414-S417 PolarHBondContact O-N 3.32Å; E414-S417 VanDerWaalsContact O-N 3.08Å; E414-S417 PolarHBondContact O-OG 3.37Å; N415-S417 VanDerWaalsContact C-N 3.33Å; S417-T421 VanDerWaalsContact O-CB 3.28Å; S417-T421 WeakPolarHBondContact O-CB 3.49Å; S417-T421 PolarHBondContact O-N 2.62Å; S417-T421 PolarHBondContact O-OG1 2.78Å
418	L	76.5	Confident	71.6	Confident	89 Å²	89	80 Å²	80	47%	0.466	40%	0.403	S	S	.	.	H	α-helix	trans	-65.2	-50.6	172.5	-68.1	173.7	0	0	0	111.1	E414 N415 K416 W420 T421 L422	E414-L418 PolarHBondContact O-N 2.94Å; E414-L418 VanDerWaalsContact O-N 3.09Å; N415-L418 PolarHBondContact O-N 3.45Å; K416-L418 VanDerWaalsContact C-N 3.34Å; K416-L418 PolarHBondContact O-N 2.94Å; L418-W420 PolarHBondContact O-N 3.48Å; L418-T421 PolarHBondContact O-N 3.19Å; L418-T421 VanDerWaalsContact O-N 3.15Å; L418-L422 PolarHBondContact O-N 2.92Å
419	I	76.6	Confident	72.2	Confident	13 Å²	13	80.7 Å²	80.7	7%	0.067	42%	0.417	C	S	.	.	H	α-helix	trans	-56.3	-49.9	175.1	-76.4	175.4	0	0	0	111	N415 K416 T421 L422 L423 P438 F440 I590 M595	N415-I419 PolarHBondContact O-N 2.86Å; N415-I419 VanDerWaalsContact O-N 3.08Å; K416-I419 PolarHBondContact O-N 3.08Å; I419-T421 VanDerWaalsContact C-N 3.26Å; I419-T421 PolarHBondContact O-N 3.21Å; I419-L422 PolarHBondContact O-N 2.8Å; I419-L423 HydrophobicContact CG2-CD1 3.67Å; I419-L423 HydrophobicContact CG2-CG 4.27Å; I419-L423 WeakPolarHBondContact O-CB 3.46Å; I419-L423 VanDerWaalsContact O-CG 3.3Å; I419-L423 WeakPolarHBondContact O-CG 3.31Å; I419-L423 PolarHBondContact O-N 2.97Å; I419-P438 HydrophobicContact CG1-CG 4.41Å; I419-F440 HydrophobicContact CD1-CE2 3.99Å; I419-F440 HydrophobicContact CD1-CZ 3.62Å; I419-F440 HydrophobicContact CG1-CZ 3.91Å; I419-I590 HydrophobicContact CG2-CG2 3.73Å; I419-I590 VanDerWaalsContact CG2-O 3.32Å; I419-I590 WeakPolarHBondContact CG2-O 3.45Å; I419-M595 HydrophobicContact CD1-CE 3.77Å; I419-M595 HydrophobicContact CD1-SD 3.87Å
420	W	74.3	Confident	72.8	Confident	128 Å²	128	81.9 Å²	81.9	49%	0.485	42%	0.424	S	S	.	.	H	α-helix	trans	-60.3	-34.1	178	-178.4	-125.8	0	0	0	112.5	K416 L418 K424 L591	K416-W420 VanDerWaalsContact O-CB 3.24Å; K416-W420 WeakPolarHBondContact O-CB 3.37Å; K416-W420 PolarHBondContact O-N 3.41Å; L418-W420 PolarHBondContact O-N 3.48Å; W420-K424 VanDerWaalsContact O-CG 3.29Å; W420-K424 WeakPolarHBondContact O-CG 3.13Å; W420-K424 PolarHBondContact O-N 3.07Å; W420-L591 HydrophobicContact CE3-CB 4.43Å; W420-L591 HydrophobicContact CE3-CD2 3.69Å; W420-L591 HydrophobicContact CZ3-CB 4.09Å; W420-L591 HydrophobicContact CZ3-CD1 4.5Å; W420-L591 HydrophobicContact CZ3-CD2 3.77Å; W420-L591 HydrophobicContact CZ3-CG 4.33Å
421	T	77.7	Confident	73.4	Confident	74 Å²	74	79 Å²	79	45%	0.454	40%	0.403	S	S	.	.	H	α-helix	trans	-74.9	-35.6	177.8	-61.3	0	0	0	0	112.8	S417 L418 I419 Q425	S417-T421 VanDerWaalsContact O-CB 3.28Å; S417-T421 WeakPolarHBondContact O-CB 3.49Å; S417-T421 PolarHBondContact O-N 2.62Å; S417-T421 PolarHBondContact O-OG1 2.78Å; L418-T421 PolarHBondContact O-N 3.19Å; L418-T421 VanDerWaalsContact O-N 3.15Å; I419-T421 VanDerWaalsContact C-N 3.26Å; I419-T421 PolarHBondContact O-N 3.21Å; T421-Q425 PolarHBondContact O-NE2 2.86Å
422	L	74.6	Confident	73.8	Confident	45 Å²	45	78.8 Å²	78.8	24%	0.236	40%	0.402	C	S	.	.	H	α-helix	trans	-67.1	-46.4	168.9	-68.8	169.1	0	0	0	110.9	L418 I419 K424 Q425 P438	L418-L422 PolarHBondContact O-N 2.92Å; I419-L422 PolarHBondContact O-N 2.8Å; L422-K424 VanDerWaalsContact C-N 3.32Å; L422-K424 PolarHBondContact O-N 2.82Å; L422-Q425 VanDerWaalsContact O-CB 3.31Å; L422-Q425 WeakPolarHBondContact O-CB 3.27Å; L422-Q425 PolarHBondContact O-N 2.92Å; L422-P438 HydrophobicContact CD1-CG 3.81Å
423	L	72	Confident	73.7	Confident	18 Å²	18	78.8 Å²	78.8	9%	0.094	40%	0.402	C	S	.	.	H	α-helix	trans	-73.8	-17.9	-173.9	-65.1	-178.9	0	0	0	114.3	I419 Q425 V426 L432 F554 I590 L591	I419-L423 HydrophobicContact CG2-CD1 3.67Å; I419-L423 HydrophobicContact CG2-CG 4.27Å; I419-L423 WeakPolarHBondContact O-CB 3.46Å; I419-L423 VanDerWaalsContact O-CG 3.3Å; I419-L423 WeakPolarHBondContact O-CG 3.31Å; I419-L423 PolarHBondContact O-N 2.97Å; L423-Q425 PolarHBondContact O-N 3.02Å; L423-V426 HydrophobicContact CB-CG2 4.48Å; L423-V426 HydrophobicContact CD2-CG2 3.78Å; L423-V426 WeakPolarHBondContact O-CG2 3.34Å; L423-V426 PolarHBondContact O-N 2.9Å; L423-L432 HydrophobicContact CD2-CD1 4.4Å; L423-F554 HydrophobicContact CB-CZ 4.35Å; L423-F554 HydrophobicContact CD1-CE2 3.96Å; L423-F554 HydrophobicContact CD1-CZ 4.36Å; L423-F554 HydrophobicContact CD2-CD2 4.05Å; L423-F554 HydrophobicContact CD2-CE2 3.57Å; L423-F554 HydrophobicContact CD2-CZ 4Å; L423-F554 HydrophobicContact CG-CE2 4.25Å; L423-F554 HydrophobicContact CG-CZ 4.46Å; L423-I590 HydrophobicContact CD1-CB 4.1Å; L423-I590 HydrophobicContact CD1-CG2 3.66Å; L423-L591 HydrophobicContact CB-CD2 3.67Å; L423-L591 HydrophobicContact CD1-CD2 3.48Å; L423-L591 VanDerWaalsContact CD1-CD2 3.48Å; L423-L591 HydrophobicContact CD1-CG 4.36Å; L423-L591 HydrophobicContact CG-CD2 4.23Å
424	K	73.4	Confident	73.6	Confident	135 Å²	135	80.6 Å²	80.6	59%	0.587	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-22.8	164.4	-80.4	167.4	-173.4	167.6	0	113.8	W420 L422	W420-K424 VanDerWaalsContact O-CG 3.29Å; W420-K424 WeakPolarHBondContact O-CG 3.13Å; W420-K424 PolarHBondContact O-N 3.07Å; L422-K424 VanDerWaalsContact C-N 3.32Å; L422-K424 PolarHBondContact O-N 2.82Å
425	Q	72.6	Confident	73.6	Confident	141 Å²	141	75.1 Å²	75.1	66%	0.659	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-14.2	-176.8	-53.1	178.8	33.8	0	0	112.5	T421 L422 L423	T421-Q425 PolarHBondContact O-NE2 2.86Å; L422-Q425 VanDerWaalsContact O-CB 3.31Å; L422-Q425 WeakPolarHBondContact O-CB 3.27Å; L422-Q425 PolarHBondContact O-N 2.92Å; L423-Q425 PolarHBondContact O-N 3.02Å
426	V	72.5	Confident	73.4	Confident	10 Å²	10	77 Å²	77	6%	0.061	40%	0.397	C	S	.	.			trans	-108.1	158.4	-174.5	-43.7	0	0	0	0	110.8	L423 M430 L432 V435 F554	L423-V426 HydrophobicContact CB-CG2 4.48Å; L423-V426 HydrophobicContact CD2-CG2 3.78Å; L423-V426 WeakPolarHBondContact O-CG2 3.34Å; L423-V426 PolarHBondContact O-N 2.9Å; V426-M430 HydrophobicContact CB-CE 3.71Å; V426-M430 HydrophobicContact CB-SD 4.45Å; V426-M430 HydrophobicContact CG1-CE 3.71Å; V426-L432 HydrophobicContact CB-CD2 3.87Å; V426-L432 HydrophobicContact CG1-CD2 3.72Å; V426-L432 HydrophobicContact CG2-CD2 4.12Å; V426-V435 HydrophobicContact CG1-CG1 4.49Å; V426-V435 HydrophobicContact CG1-CG2 3.94Å; V426-F554 HydrophobicContact CG2-CD1 3.47Å; V426-F554 VanDerWaalsContact CG2-CD1 3.47Å; V426-F554 HydrophobicContact CG2-CD2 4.31Å; V426-F554 HydrophobicContact CG2-CE1 3.47Å; V426-F554 VanDerWaalsContact CG2-CE1 3.47Å; V426-F554 HydrophobicContact CG2-CE2 4.32Å; V426-F554 HydrophobicContact CG2-CG 3.89Å; V426-F554 HydrophobicContact CG2-CZ 3.89Å
427	R	79	Confident	73.5	Confident	173 Å²	173	75.4 Å²	75.4	65%	0.653	39%	0.392	S	S	*	.			trans	-120.2	147.1	179.1	-63.4	-178.2	-179.2	-178.9	0.2	110.3	G429 M430	R427-G429 PolarHBondContact O-N 3.23Å; R427-M430 WeakPolarHBondContact O-CB 3.47Å; R427-M430 PolarHBondContact O-N 2.86Å
428	P	76.6	Confident	73.7	Confident	96 Å²	96	73.7 Å²	73.7	62%	0.623	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	132.9	171.6	-27	35.9	0	0	0	111.4
429	G	74.1	Confident	74	Confident	53 Å²	53	69.8 Å²	69.8	55%	0.546	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.7	-9.7	-171.3	0	0	0	0	0	115.2	R427 F554	R427-G429 PolarHBondContact O-N 3.23Å; G429-F554 PolarHBondContact N-O 2.83Å
430	M	77.7	Confident	74.2	Confident	73 Å²	73	70.2 Å²	70.2	36%	0.36	36%	0.361	S	S	.	.			trans	-77.9	143.4	178.8	-160.3	173.3	103	0	0	111.9	V426 R427 L432 V435 F554	V426-M430 HydrophobicContact CB-CE 3.71Å; V426-M430 HydrophobicContact CB-SD 4.45Å; V426-M430 HydrophobicContact CG1-CE 3.71Å; R427-M430 WeakPolarHBondContact O-CB 3.47Å; R427-M430 PolarHBondContact O-N 2.86Å; M430-L432 HydrophobicContact CE-CD2 4.47Å; M430-V435 HydrophobicContact CE-CG2 4.29Å; M430-F554 PolarHBondContact O-N 3.12Å; M430-F554 VanDerWaalsContact O-N 3.12Å
431	D	73.6	Confident	74.6	Confident	73 Å²	73	64.7 Å²	64.7	39%	0.39	34%	0.342	S	S	.	.			trans	-75.3	134.3	170.1	176	18.9	0	0	0	110.6	S433 S552	D431-S433 VanDerWaalsContact OD1-CB 3.31Å; D431-S433 WeakPolarHBondContact OD1-CB 3.36Å; D431-S433 PolarHBondContact OD1-N 2.91Å; D431-S433 PolarHBondContact OD1-OG 2.8Å; D431-S433 WeakPolarHBondContact OD2-CB 3.07Å; D431-S433 PolarHBondContact OD2-OG 3.31Å; D431-S552 WeakPolarHBondContact CA-O 3.32Å; D431-S552 WeakPolarHBondContact OD1-CB 3.39Å
432	L	71.1	Confident	75.1	Confident	9 Å²	9	61.7 Å²	61.7	5%	0.047	32%	0.322	C	S	.	.			trans	-98.5	3.7	179	-55.9	-161.7	0	0	0	113.7	L423 V426 M430 K434 V435 F554 L559	L423-L432 HydrophobicContact CD2-CD1 4.4Å; V426-L432 HydrophobicContact CB-CD2 3.87Å; V426-L432 HydrophobicContact CG1-CD2 3.72Å; V426-L432 HydrophobicContact CG2-CD2 4.12Å; M430-L432 HydrophobicContact CE-CD2 4.47Å; L432-K434 PolarHBondContact O-N 2.86Å; L432-V435 HydrophobicContact CB-CB 4.4Å; L432-V435 HydrophobicContact CD2-CG2 4.15Å; L432-V435 PolarHBondContact O-N 2.77Å; L432-F554 HydrophobicContact CD1-CB 4.09Å; L432-F554 HydrophobicContact CD1-CD2 4.23Å; L432-F554 HydrophobicContact CD1-CG 4.46Å; L432-F554 HydrophobicContact CD2-CB 3.91Å; L432-F554 HydrophobicContact CG-CB 3.95Å; L432-L559 HydrophobicContact CB-CD1 4.44Å; L432-L559 HydrophobicContact CD1-CD1 3.63Å; L432-L559 HydrophobicContact CD1-CD2 4.05Å; L432-L559 HydrophobicContact CD1-CG 4.42Å; L432-L559 HydrophobicContact CG-CD1 3.98Å
433	S	65.9	Low	75.7	Confident	52 Å²	52	60.2 Å²	60.2	36%	0.364	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-21	175.9	66.7	0	0	0	0	114.4	D431	D431-S433 VanDerWaalsContact OD1-CB 3.31Å; D431-S433 WeakPolarHBondContact OD1-CB 3.36Å; D431-S433 PolarHBondContact OD1-N 2.91Å; D431-S433 PolarHBondContact OD1-OG 2.8Å; D431-S433 WeakPolarHBondContact OD2-CB 3.07Å; D431-S433 PolarHBondContact OD2-OG 3.31Å
434	K	66.3	Low	76.5	Confident	174 Å²	174	61.7 Å²	61.7	76%	0.757	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	6.7	179.8	-60.6	176.9	-174.9	174.5	0	113.7	L432	L432-K434 PolarHBondContact O-N 2.86Å
435	V	71.1	Confident	77.4	Confident	35 Å²	35	57.2 Å²	57.2	21%	0.212	31%	0.305	C	S	.	.	S	Bend	trans	-109.3	118	179.6	-178.7	0	0	0	0	108.5	V426 M430 L432 L437	V426-V435 HydrophobicContact CG1-CG1 4.49Å; V426-V435 HydrophobicContact CG1-CG2 3.94Å; M430-V435 HydrophobicContact CE-CG2 4.29Å; L432-V435 HydrophobicContact CB-CB 4.4Å; L432-V435 HydrophobicContact CD2-CG2 4.15Å; L432-V435 PolarHBondContact O-N 2.77Å; V435-L437 PolarHBondContact O-N 3.1Å
436	V	69.6	Low	78.5	Confident	80 Å²	80	50.7 Å²	50.7	49%	0.485	27%	0.274	S	S	.	.			trans	-70.3	114.9	177.8	-178.1	0	0	0	0	108.9
437	L	74.6	Confident	79.6	Confident	53 Å²	53	51.5 Å²	51.5	28%	0.277	28%	0.277	S	S	.	.			trans	-76.1	150.8	170.9	-61.9	177.7	0	0	0	110.4	V435 V441 K494	V435-L437 PolarHBondContact O-N 3.1Å; L437-V441 HydrophobicContact CB-CG2 4.15Å; L437-K494 HydrophobicContact CD1-CD 4.09Å
438	P	78.9	Confident	80.4	Confident	23 Å²	23	43.2 Å²	43.2	15%	0.149	25%	0.246	C	C	.	.			trans	-61.3	157.2	176.8	-22	34.7	0	0	0	113	I419 L422 F440 V441	I419-P438 HydrophobicContact CG1-CG 4.41Å; L422-P438 HydrophobicContact CD1-CG 3.81Å; P438-F440 VanDerWaalsContact C-N 3.34Å; P438-F440 HydrophobicContact CB-CD1 3.51Å; P438-F440 HydrophobicContact CB-CE1 3.28Å; P438-F440 HydrophobicContact CB-CG 4.44Å; P438-F440 HydrophobicContact CB-CZ 4.07Å; P438-F440 HydrophobicContact CG-CD1 4.41Å; P438-F440 HydrophobicContact CG-CE1 3.7Å; P438-F440 HydrophobicContact CG-CZ 4.15Å; P438-F440 PolarHBondContact O-N 2.89Å; P438-V441 VanDerWaalsContact O-CG2 3.27Å; P438-V441 WeakPolarHBondContact O-CG2 3.1Å
439	T	82.5	Confident	81.3	Confident	8 Å²	8	39 Å²	39	5%	0.049	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-69.4	-27	-179.6	48.2	0	0	0	0	114.2	V441 L442 Q711 A714 T715 K718	T439-V441 PolarHBondContact O-N 3.01Å; T439-L442 HydrophobicContact CG2-CD1 4.13Å; T439-L442 VanDerWaalsContact O-CB 3.29Å; T439-L442 WeakPolarHBondContact O-CB 3.38Å; T439-L442 PolarHBondContact O-N 2.82Å; T439-Q711 PolarHBondContact OG1-O 3.12Å; T439-Q711 PolarHBondContact OG1-OE1 3.17Å; T439-A714 HydrophobicContact CG2-CB 3.94Å; T439-T715 WeakPolarHBondContact CG2-OG1 3.24Å; T439-K718 HydrophobicContact CG2-CD 4.32Å
440	F	80.5	Confident	82.2	Confident	22 Å²	22	38.3 Å²	38.3	10%	0.096	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-68.7	-17	-176.6	69.3	-100	0	0	0	114.2	V411 N415 I419 P438 K493 Q711	V411-F440 HydrophobicContact CG1-CE2 3.85Å; V411-F440 HydrophobicContact CG1-CZ 4.15Å; N415-F440 HydrophobicContact CB-CD1 4.08Å; N415-F440 HydrophobicContact CB-CD2 4.37Å; N415-F440 HydrophobicContact CB-CE1 3.53Å; N415-F440 HydrophobicContact CB-CE2 3.88Å; N415-F440 HydrophobicContact CB-CG 4.48Å; N415-F440 HydrophobicContact CB-CZ 3.44Å; N415-F440 VanDerWaalsContact CB-CZ 3.44Å; N415-F440 VanDerWaalsContact CG-CD1 3.43Å; N415-F440 VanDerWaalsContact OD1-CD1 3.27Å; N415-F440 WeakPolarHBondContact OD1-CD1 3.45Å; N415-F440 VanDerWaalsContact OD1-CE1 3.29Å; N415-F440 WeakPolarHBondContact OD1-CE1 3.05Å; I419-F440 HydrophobicContact CD1-CE2 3.99Å; I419-F440 HydrophobicContact CD1-CZ 3.62Å; I419-F440 HydrophobicContact CG1-CZ 3.91Å; P438-F440 VanDerWaalsContact C-N 3.34Å; P438-F440 HydrophobicContact CB-CD1 3.51Å; P438-F440 HydrophobicContact CB-CE1 3.28Å; P438-F440 HydrophobicContact CB-CG 4.44Å; P438-F440 HydrophobicContact CB-CZ 4.07Å; P438-F440 HydrophobicContact CG-CD1 4.41Å; P438-F440 HydrophobicContact CG-CE1 3.7Å; P438-F440 HydrophobicContact CG-CZ 4.15Å; P438-F440 PolarHBondContact O-N 2.89Å; F440-K493 PolarHBondContact O-NZ 2.75Å; F440-Q711 VanDerWaalsContact N-OE1 3.08Å
441	V	83.2	Confident	83	Confident	12 Å²	12	35.2 Å²	35.2	7%	0.073	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-92.3	7.6	171.5	-58.5	0	0	0	0	112.9	L437 P438 T439 K493 K494	L437-V441 HydrophobicContact CB-CG2 4.15Å; P438-V441 VanDerWaalsContact O-CG2 3.27Å; P438-V441 WeakPolarHBondContact O-CG2 3.1Å; T439-V441 PolarHBondContact O-N 3.01Å; V441-K493 CarbonylContact O-C 3.52Å; V441-K493 WeakPolarHBondContact O-CA 3.28Å; V441-K494 PolarHBondContact O-N 3.28Å
442	L	87.1	Confident	84	Confident	10 Å²	10	31.7 Å²	31.7	5%	0.052	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	137.7	179	-59.1	175.7	0	0	0	111.9	T439 K494 Y496 I706 K718	T439-L442 HydrophobicContact CG2-CD1 4.13Å; T439-L442 VanDerWaalsContact O-CB 3.29Å; T439-L442 WeakPolarHBondContact O-CB 3.38Å; T439-L442 PolarHBondContact O-N 2.82Å; L442-K494 CarbonylContact C-O 3.43Å; L442-K494 VanDerWaalsContact CA-O 3.26Å; L442-K494 WeakPolarHBondContact CA-O 3.29Å; L442-Y496 HydrophobicContact CB-CD1 4.3Å; L442-Y496 HydrophobicContact CB-CE1 4.05Å; L442-Y496 HydrophobicContact CD1-CD1 4.03Å; L442-Y496 HydrophobicContact CD1-CE1 3.98Å; L442-I706 HydrophobicContact CB-CD1 3.87Å; L442-I706 HydrophobicContact CD1-CD1 4.31Å; L442-K718 HydrophobicContact CD1-CD 3.77Å
443	E	87.6	Confident	85	Confident	14 Å²	14	31.5 Å²	31.5	7%	0.065	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	139.2	161.7	-163.6	176.2	160.6	0	0	107.5	R445 K493 K494	E443-R445 PolarHBondContact O-N 2.91Å; E443-R445 IonicContact OE1-CZ 2.91Å; E443-R445 VanDerWaalsContact OE1-CZ 3.24Å; E443-R445 IonicContact OE1-NE 2.76Å; E443-R445 PolarHBondContact OE1-NE 2.85Å; E443-R445 IonicContact OE1-NH2 2.84Å; E443-R445 PolarHBondContact OE1-NH2 3.19Å; E443-K493 HydrophobicContact CB-CB 3.86Å; E443-K493 HydrophobicContact CG-CB 4.4Å; E443-K494 PolarHBondContact N-O 3.39Å
444	P	89.7	Confident	86.3	Confident	50 Å²	50	30.9 Å²	30.9	33%	0.325	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	42.5	-179.5	32.3	-36.5	0	0	0	113.2	Y496 T703 I706	P444-Y496 WeakPolarHBondContact CA-OH 3.23Å; P444-T703 HydrophobicContact CB-CG2 4.15Å; P444-I706 HydrophobicContact CB-CG2 4.34Å
445	R	91.3	Very high	87.7	Confident	41 Å²	41	22.9 Å²	22.9	16%	0.155	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	147.5	-177.6	-62.4	-163.7	-56.9	150.6	-16.1	110.6	E443 D449 K450 D453 P495 Y496	E443-R445 PolarHBondContact O-N 2.91Å; E443-R445 IonicContact OE1-CZ 2.91Å; E443-R445 VanDerWaalsContact OE1-CZ 3.24Å; E443-R445 IonicContact OE1-NE 2.76Å; E443-R445 PolarHBondContact OE1-NE 2.85Å; E443-R445 IonicContact OE1-NH2 2.84Å; E443-R445 PolarHBondContact OE1-NH2 3.19Å; R445-D449 HydrophobicContact CB-CB 4.39Å; R445-D449 WeakPolarHBondContact CB-OD2 3.21Å; R445-D449 VanDerWaalsContact CD-OD2 3.23Å; R445-D449 WeakPolarHBondContact CD-OD2 3.04Å; R445-D449 WeakPolarHBondContact CG-OD2 3.32Å; R445-D449 IonicContact CZ-OD1 3.23Å; R445-D449 IonicContact NH1-OD1 3.89Å; R445-D449 PolarHBondContact NH1-OD1 2.92Å; R445-K450 VanDerWaalsContact NH2-CD 3.31Å; R445-D453 IonicContact CZ-OD1 3.44Å; R445-D453 IonicContact CZ-OD2 2.85Å; R445-D453 IonicContact NH1-OD1 2.68Å; R445-D453 PolarHBondContact NH1-OD1 3.28Å; R445-D453 IonicContact NH1-OD2 3.33Å; R445-D453 IonicContact NH2-OD1 3.96Å; R445-D453 PolarHBondContact NH2-OD1 3.44Å; R445-D453 IonicContact NH2-OD2 3.79Å; R445-D453 PolarHBondContact NH2-OD2 3.4Å; R445-P495 CarbonylContact O-C 3.54Å; R445-P495 VanDerWaalsContact O-CA 3.27Å; R445-P495 WeakPolarHBondContact O-CA 3.24Å; R445-P495 VanDerWaalsContact O-CB 3.25Å; R445-P495 WeakPolarHBondContact O-CB 3.49Å; R445-Y496 PolarHBondContact O-N 3.03Å
446	S	95.3	Very high	88.8	Confident	3 Å²	3	21.5 Å²	21.5	2%	0.021	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	159.9	171.9	-179.9	0	0	0	0	111.7	L448 D449 K450 E502 S695	S446-L448 PolarHBondContact O-N 3.09Å; S446-L448 PolarHBondContact OG-N 3.28Å; S446-D449 PolarHBondContact O-N 3.46Å; S446-K450 WeakPolarHBondContact O-CB 3.42Å; S446-K450 PolarHBondContact O-N 3.31Å; S446-E502 WeakPolarHBondContact CB-OE1 3.49Å; S446-E502 PolarHBondContact OG-OE1 2.93Å; S446-S695 WeakPolarHBondContact CB-OG 3.42Å
447	F	95.3	Very high	90	Very high	27 Å²	27	17.9 Å²	17.9	12%	0.118	9%	0.089	C	C	.	.	H	α-helix	trans	-64.9	-29.3	168.4	-176.1	-121	0	0	0	111.6	K450 L451 P495 Y496 P498 S531 I548 L563	F447-K450 PolarHBondContact O-N 3.49Å; F447-L451 HydrophobicContact CD1-CD1 4.11Å; F447-L451 HydrophobicContact CD2-CG 4.43Å; F447-L451 HydrophobicContact CE1-CD1 3.7Å; F447-L451 HydrophobicContact CE1-CD2 4.5Å; F447-L451 HydrophobicContact CE1-CG 4.16Å; F447-L451 HydrophobicContact CE2-CD1 4.49Å; F447-L451 HydrophobicContact CE2-CD2 4.09Å; F447-L451 HydrophobicContact CE2-CG 4.05Å; F447-L451 HydrophobicContact CZ-CD1 3.91Å; F447-L451 HydrophobicContact CZ-CD2 3.86Å; F447-L451 HydrophobicContact CZ-CG 3.9Å; F447-L451 WeakPolarHBondContact O-CG 3.2Å; F447-L451 PolarHBondContact O-N 3.49Å; F447-P495 HydrophobicContact CB-CB 4.41Å; F447-P495 HydrophobicContact CB-CG 4.23Å; F447-P495 HydrophobicContact CD2-CG 3.96Å; F447-Y496 PolarHBondContact N-O 2.79Å; F447-P498 HydrophobicContact CB-CG 3.81Å; F447-S531 WeakPolarHBondContact CD1-OG 3.46Å; F447-I548 HydrophobicContact CE1-CG2 4.06Å; F447-I548 HydrophobicContact CZ-CG2 4.01Å; F447-L563 HydrophobicContact CE2-CD2 4.27Å; F447-L563 HydrophobicContact CZ-CD1 4.33Å; F447-L563 HydrophobicContact CZ-CD2 3.81Å
448	L	97.4	Very high	91.1	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-66.1	-38.5	175.9	-54.2	-174.8	0	0	0	112	S446 P498 E502 Y519 A521	S446-L448 PolarHBondContact O-N 3.09Å; S446-L448 PolarHBondContact OG-N 3.28Å; L448-P498 HydrophobicContact CD1-CB 4.39Å; L448-P498 HydrophobicContact CD2-CG 4.13Å; L448-P498 HydrophobicContact CG-CB 4.16Å; L448-P498 HydrophobicContact CG-CG 3.9Å; L448-E502 HydrophobicContact CD1-CB 4.18Å; L448-E502 HydrophobicContact CD1-CG 4Å; L448-E502 VanDerWaalsContact CD1-O 3.23Å; L448-E502 WeakPolarHBondContact CD1-O 3.26Å; L448-Y519 PolarHBondContact O-OH 3.09Å; L448-A521 HydrophobicContact CB-CB 4.21Å; L448-A521 HydrophobicContact CD2-CB 4.29Å
449	D	95.2	Very high	91.9	Very high	7 Å²	7	15.2 Å²	15.2	4%	0.037	7%	0.074	C	C	.	.	H	α-helix	trans	-68.1	-48.3	169.3	172	-10	0	0	0	110.9	R445 S446 L451 S452 Y504 R682	R445-D449 HydrophobicContact CB-CB 4.39Å; R445-D449 WeakPolarHBondContact CB-OD2 3.21Å; R445-D449 VanDerWaalsContact CD-OD2 3.23Å; R445-D449 WeakPolarHBondContact CD-OD2 3.04Å; R445-D449 WeakPolarHBondContact CG-OD2 3.32Å; R445-D449 IonicContact CZ-OD1 3.23Å; R445-D449 IonicContact NH1-OD1 3.89Å; R445-D449 PolarHBondContact NH1-OD1 2.92Å; S446-D449 PolarHBondContact O-N 3.46Å; D449-L451 PolarHBondContact O-N 3.21Å; D449-L451 VanDerWaalsContact O-N 3.13Å; D449-S452 WeakPolarHBondContact O-CA 3.35Å; D449-S452 VanDerWaalsContact O-CB 3.24Å; D449-S452 WeakPolarHBondContact O-CB 3.47Å; D449-S452 PolarHBondContact O-N 3.26Å; D449-S452 PolarHBondContact O-OG 3.41Å; D449-Y504 HydrophobicContact CB-CD1 4.2Å; D449-Y504 HydrophobicContact CB-CD2 4.13Å; D449-Y504 HydrophobicContact CB-CE1 4.02Å; D449-Y504 HydrophobicContact CB-CE2 3.94Å; D449-Y504 HydrophobicContact CB-CG 4.24Å; D449-R682 IonicContact OD1-CZ 2.71Å; D449-R682 IonicContact OD1-NH1 2.72Å; D449-R682 PolarHBondContact OD1-NH1 2.83Å; D449-R682 IonicContact OD1-NH2 2.73Å; D449-R682 PolarHBondContact OD1-NH2 3.32Å
450	K	92.5	Very high	92.6	Very high	38 Å²	38	15.8 Å²	15.8	17%	0.165	8%	0.076	C	C	.	.	H	α-helix	trans	-60.4	-28.4	-177.9	-174.8	60.4	-172.3	170.2	0	113.4	R445 S446 F447 S452 D453 K487 P495	R445-K450 VanDerWaalsContact NH2-CD 3.31Å; S446-K450 WeakPolarHBondContact O-CB 3.42Å; S446-K450 PolarHBondContact O-N 3.31Å; F447-K450 PolarHBondContact O-N 3.49Å; K450-S452 VanDerWaalsContact C-N 3.3Å; K450-D453 WeakPolarHBondContact CD-OD2 3.42Å; K450-D453 WeakPolarHBondContact CE-OD2 3.42Å; K450-D453 IonicContact NZ-OD2 3.28Å; K450-D453 PolarHBondContact NZ-OD2 3.18Å; K450-D453 WeakPolarHBondContact O-CB 3.4Å; K450-D453 PolarHBondContact O-N 3.46Å; K450-K487 PolarHBondContact NZ-O 3.39Å; K450-K487 VanDerWaalsContact NZ-O 3.11Å; K450-P495 HydrophobicContact CB-CB 4.02Å; K450-P495 HydrophobicContact CB-CG 4.03Å; K450-P495 HydrophobicContact CG-CB 4.46Å; K450-P495 HydrophobicContact CG-CG 4.08Å
451	L	93.9	Very high	93.5	Very high	8 Å²	8	14.8 Å²	14.8	4%	0.042	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-71.9	-18.8	172.6	-75.7	175	0	0	0	113.9	F447 D449 D453 Y454 Y519 F533 I548	F447-L451 HydrophobicContact CD1-CD1 4.11Å; F447-L451 HydrophobicContact CD2-CG 4.43Å; F447-L451 HydrophobicContact CE1-CD1 3.7Å; F447-L451 HydrophobicContact CE1-CD2 4.5Å; F447-L451 HydrophobicContact CE1-CG 4.16Å; F447-L451 HydrophobicContact CE2-CD1 4.49Å; F447-L451 HydrophobicContact CE2-CD2 4.09Å; F447-L451 HydrophobicContact CE2-CG 4.05Å; F447-L451 HydrophobicContact CZ-CD1 3.91Å; F447-L451 HydrophobicContact CZ-CD2 3.86Å; F447-L451 HydrophobicContact CZ-CG 3.9Å; F447-L451 WeakPolarHBondContact O-CG 3.2Å; F447-L451 PolarHBondContact O-N 3.49Å; D449-L451 PolarHBondContact O-N 3.21Å; D449-L451 VanDerWaalsContact O-N 3.13Å; L451-D453 VanDerWaalsContact C-N 3.28Å; L451-D453 PolarHBondContact O-N 3.08Å; L451-Y454 WeakPolarHBondContact O-CD2 3.47Å; L451-Y519 WeakPolarHBondContact CB-OH 3.43Å; L451-F533 HydrophobicContact CD1-CD1 4.35Å; L451-I548 HydrophobicContact CD1-CD1 4.07Å; L451-I548 HydrophobicContact CD2-CD1 3.53Å; L451-I548 HydrophobicContact CG-CD1 4.48Å
452	S	94.7	Very high	94.1	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.071	C	C	.	.	G	3₁₀ helix	trans	-75.1	-15	174.3	79.4	0	0	0	0	113.2	D449 K450 Y454 Y455 W508 R682	D449-S452 WeakPolarHBondContact O-CA 3.35Å; D449-S452 VanDerWaalsContact O-CB 3.24Å; D449-S452 WeakPolarHBondContact O-CB 3.47Å; D449-S452 PolarHBondContact O-N 3.26Å; D449-S452 PolarHBondContact O-OG 3.41Å; K450-S452 VanDerWaalsContact C-N 3.3Å; S452-Y454 PolarHBondContact O-N 2.92Å; S452-Y455 PolarHBondContact O-N 3.15Å; S452-W508 WeakPolarHBondContact O-CH2 3.44Å; S452-W508 WeakPolarHBondContact O-CZ2 3.2Å; S452-R682 PolarHBondContact OG-NH1 3.04Å
453	D	91.9	Very high	94.6	Very high	5 Å²	5	18 Å²	18	3%	0.027	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-59.5	-17.3	177.6	-78.5	-1	0	0	0	113.7	R445 K450 L451 Y455 Y456 K487	R445-D453 IonicContact CZ-OD1 3.44Å; R445-D453 IonicContact CZ-OD2 2.85Å; R445-D453 IonicContact NH1-OD1 2.68Å; R445-D453 PolarHBondContact NH1-OD1 3.28Å; R445-D453 IonicContact NH1-OD2 3.33Å; R445-D453 IonicContact NH2-OD1 3.96Å; R445-D453 PolarHBondContact NH2-OD1 3.44Å; R445-D453 IonicContact NH2-OD2 3.79Å; R445-D453 PolarHBondContact NH2-OD2 3.4Å; K450-D453 WeakPolarHBondContact CD-OD2 3.42Å; K450-D453 WeakPolarHBondContact CE-OD2 3.42Å; K450-D453 IonicContact NZ-OD2 3.28Å; K450-D453 PolarHBondContact NZ-OD2 3.18Å; K450-D453 WeakPolarHBondContact O-CB 3.4Å; K450-D453 PolarHBondContact O-N 3.46Å; L451-D453 VanDerWaalsContact C-N 3.28Å; L451-D453 PolarHBondContact O-N 3.08Å; D453-Y455 VanDerWaalsContact C-N 3.29Å; D453-Y455 PolarHBondContact O-N 3.33Å; D453-Y456 WeakPolarHBondContact O-CD2 3.24Å; D453-K487 HydrophobicContact CB-CD 4.09Å; D453-K487 WeakPolarHBondContact OD1-CE 3.31Å; D453-K487 IonicContact OD1-NZ 2.68Å; D453-K487 PolarHBondContact OD1-NZ 3.23Å; D453-K487 IonicContact OD2-NZ 3.97Å
454	Y	93.3	Very high	95.1	Very high	38 Å²	38	17.4 Å²	17.4	15%	0.149	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-77.3	-8	-179.8	-69.2	-98.9	0	0	0	114.3	L451 S452 W480 F485 M582	L451-Y454 WeakPolarHBondContact O-CD2 3.47Å; S452-Y454 PolarHBondContact O-N 2.92Å; Y454-W480 PolarHBondContact O-NE1 3.25Å; Y454-F485 HydrophobicContact CE1-CD1 4.19Å; Y454-F485 AromaticContact CE1-CE1 3.68Å; Y454-F485 HydrophobicContact CE1-CE1 3.68Å; Y454-F485 HydrophobicContact CE1-CE2 4.06Å; Y454-F485 AromaticContact CE1-CZ 3.63Å; Y454-F485 HydrophobicContact CE1-CZ 3.63Å; Y454-F485 AromaticContact CZ-CE1 3.89Å; Y454-F485 VanDerWaalsContact OH-CE1 3.22Å; Y454-F485 WeakPolarHBondContact OH-CE1 3.4Å; Y454-M582 HydrophobicContact CD1-CE 4.43Å; Y454-M582 HydrophobicContact CE1-CE 3.7Å; Y454-M582 HydrophobicContact CE2-CE 4.03Å; Y454-M582 VanDerWaalsContact CZ-CE 3.47Å; Y454-M582 WeakPolarHBondContact OH-CE 3.28Å
455	Y	95.7	Very high	95.5	Very high	7 Å²	7	15.5 Å²	15.5	3%	0.027	7%	0.072	C	C	.	.	G	3₁₀ helix	trans	-111.5	6.2	-169.9	-58.5	-83	0	0	0	114.8	S452 D453 H457 A458 W480 W508 Y519 V535 L544	S452-Y455 PolarHBondContact O-N 3.15Å; D453-Y455 VanDerWaalsContact C-N 3.29Å; D453-Y455 PolarHBondContact O-N 3.33Å; Y455-H457 PolarHBondContact O-N 3.13Å; Y455-H457 VanDerWaalsContact O-N 3.11Å; Y455-A458 VanDerWaalsContact O-CB 3.27Å; Y455-A458 WeakPolarHBondContact O-CB 3.4Å; Y455-A458 PolarHBondContact O-N 2.9Å; Y455-W480 AromaticContact CD1-CZ2 3.98Å; Y455-W480 HydrophobicContact CD1-CZ2 3.98Å; Y455-W480 HydrophobicContact CE1-CH2 4.22Å; Y455-W480 AromaticContact CE1-CZ2 3.52Å; Y455-W480 HydrophobicContact CE1-CZ2 3.52Å; Y455-W508 HydrophobicContact CD2-CH2 4.3Å; Y455-W508 HydrophobicContact CG-CH2 4.28Å; Y455-W508 HydrophobicContact CG-CZ3 4.4Å; Y455-Y519 AromaticContact CD2-CD2 3.88Å; Y455-Y519 HydrophobicContact CD2-CD2 3.88Å; Y455-Y519 HydrophobicContact CD2-CE2 4.26Å; Y455-Y519 AromaticContact CE2-CD2 3.74Å; Y455-Y519 HydrophobicContact CE2-CD2 3.74Å; Y455-Y519 AromaticContact CE2-CE2 3.83Å; Y455-Y519 HydrophobicContact CE2-CE2 3.83Å; Y455-V535 HydrophobicContact CD1-CG1 4Å; Y455-V535 HydrophobicContact CD1-CG2 4.32Å; Y455-V535 HydrophobicContact CE1-CB 4.18Å; Y455-V535 HydrophobicContact CE1-CG1 3.98Å; Y455-V535 HydrophobicContact CE1-CG2 3.76Å; Y455-V535 HydrophobicContact CE2-CG2 4.03Å; Y455-L544 HydrophobicContact CE1-CD1 4.22Å; Y455-L544 WeakPolarHBondContact OH-CD2 3.06Å
456	Y	93.9	Very high	95.8	Very high	5 Å²	5	19.4 Å²	19.4	2%	0.02	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.3	174.5	-78.8	-99	0	0	0	114.3	E397 D453 K487 W508 R679 L680 R682	E397-Y456 PolarHBondContact OE1-OH 3.48Å; D453-Y456 WeakPolarHBondContact O-CD2 3.24Å; Y456-K487 HydrophobicContact CD2-CD 4.46Å; Y456-K487 HydrophobicContact CE2-CD 4.3Å; Y456-K487 PolarHBondContact OH-NZ 2.85Å; Y456-W508 HydrophobicContact CD2-CZ2 4.39Å; Y456-W508 HydrophobicContact CE2-CZ2 4.25Å; Y456-R679 HydrophobicContact CD1-CG 4.06Å; Y456-L680 WeakPolarHBondContact CD1-O 3.16Å; Y456-L680 WeakPolarHBondContact O-CB 3.45Å; Y456-L680 PolarHBondContact O-N 2.84Å; Y456-R682 HydrophobicContact CE1-CB 4.11Å; Y456-R682 WeakPolarHBondContact OH-CD 3.34Å; Y456-R682 PolarHBondContact OH-NE 3.44Å; Y456-R682 VanDerWaalsContact OH-NE 3.14Å
457	H	95.8	Very high	95.9	Very high	4 Å²	4	21.2 Å²	21.2	2%	0.019	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.4	39.9	171.2	-55.9	-88.2	0	0	0	111.3	Y455 D459 F460 Y486	Y455-H457 PolarHBondContact O-N 3.13Å; Y455-H457 VanDerWaalsContact O-N 3.11Å; H457-D459 PolarHBondContact O-N 3.34Å; H457-F460 HydrophobicContact CB-CD2 3.5Å; H457-F460 VanDerWaalsContact CB-CD2 3.5Å; H457-F460 HydrophobicContact CB-CE2 3.45Å; H457-F460 VanDerWaalsContact CB-CE2 3.45Å; H457-F460 HydrophobicContact CB-CG 4.28Å; H457-F460 HydrophobicContact CB-CZ 4.21Å; H457-F460 AromaticContact CG-CE2 3.81Å; H457-F460 AromaticContact ND1-CE2 3.99Å; H457-F460 WeakPolarHBondContact O-CB 3.49Å; H457-F460 PolarHBondContact O-N 2.83Å; H457-Y486 AromaticContact CD2-CE1 3.93Å; H457-Y486 AromaticContact NE2-CE1 3.49Å; H457-Y486 WeakPolarHBondContact NE2-CE1 3.16Å; H457-Y486 AromaticContact NE2-CZ 3.64Å; H457-Y486 PolarHBondContact NE2-OH 3.2Å
458	A	97.3	Very high	96	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-10.1	173.1	0	0	0	0	0	113.2	Y455 F460 L461 S462 H510 T517 F542 L680	Y455-A458 VanDerWaalsContact O-CB 3.27Å; Y455-A458 WeakPolarHBondContact O-CB 3.4Å; Y455-A458 PolarHBondContact O-N 2.9Å; A458-F460 VanDerWaalsContact C-N 3.26Å; A458-F460 PolarHBondContact O-N 2.87Å; A458-L461 WeakPolarHBondContact O-CB 3.35Å; A458-L461 PolarHBondContact O-N 3.5Å; A458-L461 VanDerWaalsContact O-N 3.08Å; A458-S462 PolarHBondContact O-N 2.93Å; A458-S462 PolarHBondContact O-OG 3.42Å; A458-H510 PolarHBondContact O-CE1 2.81Å; A458-T517 HydrophobicContact CB-CG2 4.17Å; A458-F542 HydrophobicContact CB-CZ 4.33Å; A458-L680 HydrophobicContact CB-CD1 3.93Å
459	D	96.2	Very high	96	Very high	20 Å²	20	30.3 Å²	30.3	11%	0.107	15%	0.148	C	C	.	.	H	α-helix	trans	-66.4	-28	168.4	70.3	-37.4	0	0	0	111.9	H457 L461 S462 E463 K512 L680	H457-D459 PolarHBondContact O-N 3.34Å; D459-L461 VanDerWaalsContact C-N 3.26Å; D459-L461 PolarHBondContact O-N 3.3Å; D459-S462 WeakPolarHBondContact O-CB 3.43Å; D459-S462 PolarHBondContact O-N 2.97Å; D459-E463 WeakPolarHBondContact O-CB 3.27Å; D459-E463 PolarHBondContact O-N 3.12Å; D459-K512 IonicContact OD2-NZ 3.41Å; D459-K512 PolarHBondContact OD2-NZ 2.87Å; D459-L680 HydrophobicContact CB-CD1 4.4Å; D459-L680 HydrophobicContact CB-CD2 4.44Å
460	F	97.4	Very high	96.1	Very high	21 Å²	21	31 Å²	31	9%	0.092	16%	0.155	C	C	.	.	H	α-helix	trans	-63.4	-27.5	167.9	-62.1	-28.7	0	0	0	113.4	H457 A458 A464 K479 W480 W669 L675	H457-F460 HydrophobicContact CB-CD2 3.5Å; H457-F460 VanDerWaalsContact CB-CD2 3.5Å; H457-F460 HydrophobicContact CB-CE2 3.45Å; H457-F460 VanDerWaalsContact CB-CE2 3.45Å; H457-F460 HydrophobicContact CB-CG 4.28Å; H457-F460 HydrophobicContact CB-CZ 4.21Å; H457-F460 AromaticContact CG-CE2 3.81Å; H457-F460 AromaticContact ND1-CE2 3.99Å; H457-F460 WeakPolarHBondContact O-CB 3.49Å; H457-F460 PolarHBondContact O-N 2.83Å; A458-F460 VanDerWaalsContact C-N 3.26Å; A458-F460 PolarHBondContact O-N 2.87Å; F460-A464 VanDerWaalsContact O-CB 3.25Å; F460-A464 WeakPolarHBondContact O-CB 3.41Å; F460-A464 PolarHBondContact O-N 2.81Å; F460-K479 HydrophobicContact CD2-CG 4.37Å; F460-K479 HydrophobicContact CE2-CG 4.28Å; F460-W480 HydrophobicContact CB-CB 3.96Å; F460-W480 HydrophobicContact CD2-CB 4.46Å; F460-W669 HydrophobicContact CE2-CE3 4.48Å; F460-W669 AromaticContact CE2-CZ3 3.68Å; F460-W669 HydrophobicContact CE2-CZ3 3.68Å; F460-W669 HydrophobicContact CZ-CZ3 4.08Å; F460-L675 HydrophobicContact CZ-CD1 4.43Å
461	L	98.3	Very high	96.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-74.3	-40.7	172.9	-66.2	-179.8	0	0	0	111.3	A458 D459 E463 A464 A465 W480 F542 L569 F571	A458-L461 WeakPolarHBondContact O-CB 3.35Å; A458-L461 PolarHBondContact O-N 3.5Å; A458-L461 VanDerWaalsContact O-N 3.08Å; D459-L461 VanDerWaalsContact C-N 3.26Å; D459-L461 PolarHBondContact O-N 3.3Å; L461-E463 VanDerWaalsContact C-N 3.33Å; L461-E463 PolarHBondContact O-N 2.86Å; L461-A464 WeakPolarHBondContact O-CB 3.4Å; L461-A464 PolarHBondContact O-N 3.39Å; L461-A464 VanDerWaalsContact O-N 3.1Å; L461-A465 PolarHBondContact O-N 2.89Å; L461-W480 HydrophobicContact CD1-CD2 3.98Å; L461-W480 HydrophobicContact CD1-CE3 4.48Å; L461-W480 HydrophobicContact CD1-CG 4.32Å; L461-W480 HydrophobicContact CD1-CZ2 4.23Å; L461-W480 HydrophobicContact CD2-CB 4.05Å; L461-W480 HydrophobicContact CD2-CD2 3.55Å; L461-W480 HydrophobicContact CD2-CE3 3.66Å; L461-W480 HydrophobicContact CD2-CG 3.68Å; L461-W480 HydrophobicContact CD2-CZ3 4.43Å; L461-W480 HydrophobicContact CG-CB 4.4Å; L461-W480 HydrophobicContact CG-CD2 3.82Å; L461-W480 HydrophobicContact CG-CE3 4.38Å; L461-W480 HydrophobicContact CG-CG 3.74Å; L461-F542 HydrophobicContact CB-CD1 3.91Å; L461-F542 HydrophobicContact CB-CD2 4.1Å; L461-F542 HydrophobicContact CB-CE1 3.8Å; L461-F542 HydrophobicContact CB-CE2 4Å; L461-F542 HydrophobicContact CB-CG 4.07Å; L461-F542 HydrophobicContact CB-CZ 3.85Å; L461-F542 HydrophobicContact CD1-CD2 3.9Å; L461-F542 HydrophobicContact CD1-CE2 3.65Å; L461-F542 HydrophobicContact CD1-CZ 4.2Å; L461-F542 HydrophobicContact CG-CE2 4.5Å; L461-L569 HydrophobicContact CD1-CD1 4.17Å; L461-L569 HydrophobicContact CD2-CD1 4.01Å; L461-L569 HydrophobicContact CD2-CD2 3.58Å; L461-L569 HydrophobicContact CD2-CG 4.47Å; L461-F571 WeakPolarHBondContact O-CE1 3.4Å
462	S	97.6	Very high	96.5	Very high	10 Å²	10	32.3 Å²	32.3	7%	0.07	16%	0.162	C	C	.	.	H	α-helix	trans	-58.6	-47.6	172.7	-43.6	0	0	0	0	110.7	A458 D459 A464 A465 I466 H510 D540	A458-S462 PolarHBondContact O-N 2.93Å; A458-S462 PolarHBondContact O-OG 3.42Å; D459-S462 WeakPolarHBondContact O-CB 3.43Å; D459-S462 PolarHBondContact O-N 2.97Å; S462-A464 VanDerWaalsContact C-N 3.27Å; S462-A464 PolarHBondContact O-N 2.86Å; S462-A465 PolarHBondContact O-N 3.35Å; S462-I466 PolarHBondContact O-N 3.01Å; S462-H510 PolarHBondContact OG-CE1 2.83Å; S462-H510 PolarHBondContact OG-ND1 2.78Å; S462-H510 VanDerWaalsContact OG-ND1 3.09Å; S462-D540 WeakPolarHBondContact CB-OD2 3.38Å; S462-D540 PolarHBondContact OG-OD2 2.78Å
463	E	97.5	Very high	96.7	Very high	81 Å²	81	32.7 Å²	32.7	38%	0.379	16%	0.164	S	C	.	.	H	α-helix	trans	-64.1	-25.6	174	-93.1	-156.1	-135.3	0	0	114.3	D459 L461 E467 K476	D459-E463 WeakPolarHBondContact O-CB 3.27Å; D459-E463 PolarHBondContact O-N 3.12Å; L461-E463 VanDerWaalsContact C-N 3.33Å; L461-E463 PolarHBondContact O-N 2.86Å; E463-E467 WeakPolarHBondContact O-CB 3.47Å; E463-E467 PolarHBondContact O-N 2.93Å; E463-K476 HydrophobicContact CB-CD 4.04Å; E463-K476 VanDerWaalsContact O-CD 3.31Å; E463-K476 WeakPolarHBondContact O-CD 3.25Å; E463-K476 PolarHBondContact O-NZ 3.17Å; E463-K476 IonicContact OE2-NZ 3.7Å; E463-K476 PolarHBondContact OE2-NZ 2.93Å
464	A	98.2	Very high	97	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-82.4	-37	176.1	0	0	0	0	0	111.8	F460 L461 S462 I466 E467 R473 K476 V477 F571	F460-A464 VanDerWaalsContact O-CB 3.25Å; F460-A464 WeakPolarHBondContact O-CB 3.41Å; F460-A464 PolarHBondContact O-N 2.81Å; L461-A464 WeakPolarHBondContact O-CB 3.4Å; L461-A464 PolarHBondContact O-N 3.39Å; L461-A464 VanDerWaalsContact O-N 3.1Å; S462-A464 VanDerWaalsContact C-N 3.27Å; S462-A464 PolarHBondContact O-N 2.86Å; A464-I466 VanDerWaalsContact C-N 3.3Å; A464-I466 PolarHBondContact O-N 3.43Å; A464-E467 PolarHBondContact O-N 3.34Å; A464-R473 HydrophobicContact CB-CG 4.37Å; A464-R473 WeakPolarHBondContact O-CD 3.42Å; A464-R473 VanDerWaalsContact O-CG 3.27Å; A464-R473 WeakPolarHBondContact O-CG 3.39Å; A464-K476 HydrophobicContact CB-CB 3.74Å; A464-K476 HydrophobicContact CB-CD 4.39Å; A464-V477 HydrophobicContact CB-CG2 4.3Å; A464-F571 HydrophobicContact CB-CE1 3.96Å; A464-F571 HydrophobicContact CB-CE2 4.24Å; A464-F571 HydrophobicContact CB-CZ 3.43Å; A464-F571 VanDerWaalsContact CB-CZ 3.43Å
465	A	97.5	Very high	97.2	Very high	10 Å²	10	32.9 Å²	32.9	8%	0.083	17%	0.165	C	C	.	.	H	α-helix	trans	-58.8	-42	176.5	0	0	0	0	0	111.8	L461 S462 D540 F571 R574	L461-A465 PolarHBondContact O-N 2.89Å; S462-A465 PolarHBondContact O-N 3.35Å; A465-D540 VanDerWaalsContact CB-O 3.25Å; A465-D540 WeakPolarHBondContact CB-O 3.5Å; A465-F571 HydrophobicContact CB-CD1 3.62Å; A465-F571 HydrophobicContact CB-CE1 3.99Å; A465-F571 HydrophobicContact CB-CG 4.47Å; A465-R574 PolarHBondContact O-NE 2.7Å; A465-R574 PolarHBondContact O-NH2 3.1Å
466	I	96.6	Very high	97.3	Very high	123 Å²	123	34.7 Å²	34.7	63%	0.631	17%	0.173	S	C	*	.	S	Bend	trans	-86.5	-14	-179.8	68.6	174.7	0	0	0	114.7	S462 A464 E468 R574	S462-I466 PolarHBondContact O-N 3.01Å; A464-I466 VanDerWaalsContact C-N 3.3Å; A464-I466 PolarHBondContact O-N 3.43Å; I466-E468 PolarHBondContact O-N 3.5Å; I466-R574 PolarHBondContact O-NH2 3.12Å
467	E	98.1	Very high	97.6	Very high	42 Å²	42	34.5 Å²	34.5	20%	0.196	17%	0.172	C	C	.	.			trans	-65.4	123.8	174.3	169.9	66.2	-124.1	0	0	109.9	E463 A464 N469 N472 R473 K476 R574	E463-E467 WeakPolarHBondContact O-CB 3.47Å; E463-E467 PolarHBondContact O-N 2.93Å; A464-E467 PolarHBondContact O-N 3.34Å; E467-N469 WeakPolarHBondContact OE1-CB 3.25Å; E467-N469 PolarHBondContact OE1-N 3.19Å; E467-N469 VanDerWaalsContact OE1-N 3.14Å; E467-N472 HydrophobicContact CG-CB 3.63Å; E467-N472 VanDerWaalsContact OE1-CB 3.3Å; E467-N472 WeakPolarHBondContact OE1-CB 3.33Å; E467-N472 PolarHBondContact OE1-ND2 2.89Å; E467-R473 HydrophobicContact CB-CB 4.33Å; E467-R473 HydrophobicContact CG-CB 3.95Å; E467-R473 PolarHBondContact O-NH1 2.81Å; E467-K476 HydrophobicContact CB-CD 4.28Å; E467-K476 IonicContact OE2-NZ 2.8Å; E467-R574 PolarHBondContact O-NH2 3.16Å
468	E	97.3	Very high	97.7	Very high	137 Å²	137	34.3 Å²	34.3	64%	0.64	17%	0.171	S	C	*	.			trans	-79.1	-37.5	-177.7	-73.9	-54.1	137.2	0	0	113.4	I466 A470 R473 R574	I466-E468 PolarHBondContact O-N 3.5Å; E468-A470 PolarHBondContact O-N 2.99Å; E468-R473 PolarHBondContact O-NH1 3.13Å; E468-R574 VanDerWaalsContact CD-NH1 3.29Å; E468-R574 VanDerWaalsContact CD-NH2 3.32Å; E468-R574 IonicContact OE1-CZ 3.69Å; E468-R574 IonicContact OE1-NH1 2.84Å; E468-R574 PolarHBondContact OE1-NH1 2.67Å; E468-R574 IonicContact OE1-NH2 3.69Å; E468-R574 PolarHBondContact OE1-NH2 3.23Å; E468-R574 IonicContact OE2-CZ 2.7Å; E468-R574 IonicContact OE2-NH1 2.67Å; E468-R574 PolarHBondContact OE2-NH1 3.25Å; E468-R574 IonicContact OE2-NH2 2.65Å
469	N	97.7	Very high	97.7	Very high	80 Å²	80	37.5 Å²	37.5	43%	0.428	19%	0.186	S	C	.	.			trans	-78.7	115.5	-174.6	-177.4	-61.7	0	0	0	110.8	E467 Y471 N472 R473	E467-N469 WeakPolarHBondContact OE1-CB 3.25Å; E467-N469 PolarHBondContact OE1-N 3.19Å; E467-N469 VanDerWaalsContact OE1-N 3.14Å; N469-Y471 PolarHBondContact O-N 2.6Å; N469-Y471 VanDerWaalsContact O-N 3.1Å; N469-Y471 WeakPolarHBondContact OD1-CB 3.45Å; N469-Y471 PolarHBondContact OD1-N 2.77Å; N469-N472 HydrophobicContact CB-CB 4.08Å; N469-N472 CarbonylContact O-C 3.6Å; N469-N472 WeakPolarHBondContact O-CA 3.31Å; N469-N472 WeakPolarHBondContact O-CB 3.49Å; N469-N472 PolarHBondContact O-N 3.42Å; N469-N472 PolarHBondContact OD1-N 3.48Å; N469-R473 WeakPolarHBondContact O-CB 3.46Å; N469-R473 PolarHBondContact O-N 3.47Å
470	A	97.6	Very high	97.8	Very high	22 Å²	22	37 Å²	37	18%	0.182	18%	0.182	C	C	.	.	H	α-helix	trans	-56.4	-30.5	-175.4	0	0	0	0	0	114.6	E468 M474 T610 Y612	E468-A470 PolarHBondContact O-N 2.99Å; A470-M474 WeakPolarHBondContact O-CB 3.47Å; A470-M474 PolarHBondContact O-N 3.45Å; A470-T610 HydrophobicContact CB-CG2 4.23Å; A470-Y612 HydrophobicContact CB-CD2 4.06Å; A470-Y612 HydrophobicContact CB-CE2 3.76Å
471	Y	97.3	Very high	97.8	Very high	23 Å²	23	36.1 Å²	36.1	9%	0.09	18%	0.178	C	C	.	.	H	α-helix	trans	-74.5	-40.5	175.1	171.7	-121.3	0	0	0	112.2	N469 M474 K475 Y612 I637 L644 A645 D659	N469-Y471 PolarHBondContact O-N 2.6Å; N469-Y471 VanDerWaalsContact O-N 3.1Å; N469-Y471 WeakPolarHBondContact OD1-CB 3.45Å; N469-Y471 PolarHBondContact OD1-N 2.77Å; Y471-M474 PolarHBondContact O-N 3.04Å; Y471-K475 HydrophobicContact CE1-CD 4.25Å; Y471-K475 HydrophobicContact CE2-CD 4.4Å; Y471-K475 HydrophobicContact CE2-CG 4.45Å; Y471-K475 PolarHBondContact O-N 2.67Å; Y471-Y612 HydrophobicContact CD2-CD1 4.34Å; Y471-Y612 AromaticContact CD2-CE1 3.94Å; Y471-Y612 HydrophobicContact CD2-CE1 3.94Å; Y471-Y612 HydrophobicContact CG-CE1 4.17Å; Y471-I637 HydrophobicContact CD2-CG2 3.91Å; Y471-I637 HydrophobicContact CE2-CB 4.33Å; Y471-I637 HydrophobicContact CE2-CG2 3.7Å; Y471-L644 HydrophobicContact CD2-CB 4.47Å; Y471-L644 HydrophobicContact CD2-CD1 4.01Å; Y471-L644 HydrophobicContact CE2-CB 3.85Å; Y471-L644 HydrophobicContact CE2-CD1 4.23Å; Y471-A645 VanDerWaalsContact OH-CB 3.29Å; Y471-A645 WeakPolarHBondContact OH-CB 3.41Å; Y471-D659 WeakPolarHBondContact CE1-OD2 3.36Å; Y471-D659 VanDerWaalsContact CZ-OD2 3.29Å; Y471-D659 PolarHBondContact OH-OD2 2.95Å
472	N	97.6	Very high	97.7	Very high	51 Å²	51	36.1 Å²	36.1	27%	0.273	18%	0.178	S	C	.	.	H	α-helix	trans	-64.9	-40.2	170.3	-70.9	-15.3	0	0	0	111.7	E467 N469 K475 K476	E467-N472 HydrophobicContact CG-CB 3.63Å; E467-N472 VanDerWaalsContact OE1-CB 3.3Å; E467-N472 WeakPolarHBondContact OE1-CB 3.33Å; E467-N472 PolarHBondContact OE1-ND2 2.89Å; N469-N472 HydrophobicContact CB-CB 4.08Å; N469-N472 CarbonylContact O-C 3.6Å; N469-N472 WeakPolarHBondContact O-CA 3.31Å; N469-N472 WeakPolarHBondContact O-CB 3.49Å; N469-N472 PolarHBondContact O-N 3.42Å; N469-N472 PolarHBondContact OD1-N 3.48Å; N472-K475 CarbonylContact O-C 3.59Å; N472-K475 WeakPolarHBondContact O-CA 3.45Å; N472-K475 WeakPolarHBondContact O-CB 3.44Å; N472-K475 PolarHBondContact O-N 2.95Å; N472-K475 VanDerWaalsContact O-N 3.08Å; N472-K475 WeakPolarHBondContact OD1-CE 3.27Å; N472-K475 PolarHBondContact OD1-NZ 3.21Å; N472-K476 PolarHBondContact O-N 3.31Å
473	R	98.2	Very high	97.6	Very high	7 Å²	7	35.8 Å²	35.8	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-61.6	-44.3	176.4	-173.2	158.8	61.2	-102.6	6.1	111.2	A464 E467 E468 N469 K475 K476 V477 F571 E576	A464-R473 HydrophobicContact CB-CG 4.37Å; A464-R473 WeakPolarHBondContact O-CD 3.42Å; A464-R473 VanDerWaalsContact O-CG 3.27Å; A464-R473 WeakPolarHBondContact O-CG 3.39Å; E467-R473 HydrophobicContact CB-CB 4.33Å; E467-R473 HydrophobicContact CG-CB 3.95Å; E467-R473 PolarHBondContact O-NH1 2.81Å; E468-R473 PolarHBondContact O-NH1 3.13Å; N469-R473 WeakPolarHBondContact O-CB 3.46Å; N469-R473 PolarHBondContact O-N 3.47Å; R473-K475 PolarHBondContact O-N 3.49Å; R473-K476 PolarHBondContact O-N 2.75Å; R473-V477 WeakPolarHBondContact O-CG2 3.34Å; R473-V477 PolarHBondContact O-N 2.93Å; R473-F571 HydrophobicContact CG-CD2 4.31Å; R473-F571 HydrophobicContact CG-CE2 3.83Å; R473-E576 IonicContact CZ-OE1 3.8Å; R473-E576 IonicContact CZ-OE2 2.7Å; R473-E576 VanDerWaalsContact CZ-OE2 3.22Å; R473-E576 IonicContact NE-OE1 2.93Å; R473-E576 IonicContact NE-OE2 2.86Å; R473-E576 PolarHBondContact NE-OE2 3.4Å; R473-E576 IonicContact NH2-OE1 2.67Å; R473-E576 PolarHBondContact NH2-OE1 3.31Å; R473-E576 IonicContact NH2-OE2 2.64Å; R473-E576 PolarHBondContact NH2-OE2 3.29Å
474	M	98.2	Very high	97.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.3	-42.9	169.5	179.6	58.1	78.2	0	0	112.3	A470 Y471 K476 V477 V478 Y578 I605 C607 Y612 I637	A470-M474 WeakPolarHBondContact O-CB 3.47Å; A470-M474 PolarHBondContact O-N 3.45Å; Y471-M474 PolarHBondContact O-N 3.04Å; M474-K476 PolarHBondContact O-N 3.34Å; M474-V477 PolarHBondContact O-N 2.92Å; M474-V478 HydrophobicContact CG-CG2 4.45Å; M474-V478 WeakPolarHBondContact O-CB 3.35Å; M474-V478 VanDerWaalsContact O-CG2 3.24Å; M474-V478 WeakPolarHBondContact O-CG2 3.43Å; M474-V478 PolarHBondContact O-N 3.16Å; M474-V478 HydrophobicContact SD-CG2 4.02Å; M474-Y578 HydrophobicContact CB-CE1 4.46Å; M474-Y578 HydrophobicContact CE-CD1 3.83Å; M474-Y578 HydrophobicContact CE-CE1 3.57Å; M474-Y578 HydrophobicContact SD-CD1 4.29Å; M474-Y578 HydrophobicContact SD-CE1 4.06Å; M474-I605 HydrophobicContact SD-CG2 4.21Å; M474-C607 HydrophobicContact CE-CB 4.37Å; M474-Y612 WeakPolarHBondContact CE-O 3.42Å; M474-I637 HydrophobicContact CG-CG2 3.91Å
475	K	97.9	Very high	97.1	Very high	48 Å²	48	32.5 Å²	32.5	21%	0.209	16%	0.161	C	C	.	.	H	α-helix	trans	-58.5	-43.3	173	-77.7	-179	-63.3	-175.7	0	112	Y471 N472 R473 V478 K479 I637 I657 F668	Y471-K475 HydrophobicContact CE1-CD 4.25Å; Y471-K475 HydrophobicContact CE2-CD 4.4Å; Y471-K475 HydrophobicContact CE2-CG 4.45Å; Y471-K475 PolarHBondContact O-N 2.67Å; N472-K475 CarbonylContact O-C 3.59Å; N472-K475 WeakPolarHBondContact O-CA 3.45Å; N472-K475 WeakPolarHBondContact O-CB 3.44Å; N472-K475 PolarHBondContact O-N 2.95Å; N472-K475 VanDerWaalsContact O-N 3.08Å; N472-K475 WeakPolarHBondContact OD1-CE 3.27Å; N472-K475 PolarHBondContact OD1-NZ 3.21Å; R473-K475 PolarHBondContact O-N 3.49Å; K475-V478 PolarHBondContact O-N 2.85Å; K475-K479 WeakPolarHBondContact O-CB 3.5Å; K475-K479 PolarHBondContact O-N 3.04Å; K475-I637 HydrophobicContact CG-CD1 3.6Å; K475-I657 HydrophobicContact CD-CD1 3.78Å; K475-I657 HydrophobicContact CG-CD1 4.07Å; K475-F668 HydrophobicContact CB-CE2 4.06Å; K475-F668 HydrophobicContact CG-CE2 4.26Å; K475-F668 VanDerWaalsContact O-CZ 3.27Å; K475-F668 WeakPolarHBondContact O-CZ 3.17Å
476	K	98.4	Very high	96.5	Very high	45 Å²	45	32.4 Å²	32.4	20%	0.196	16%	0.159	C	C	.	.	H	α-helix	trans	-66.1	-41.9	177.3	-65.7	-167.1	-176	-164.3	0	112.7	E463 A464 E467 N472 R473 M474 V478 K479 W480	E463-K476 HydrophobicContact CB-CD 4.04Å; E463-K476 VanDerWaalsContact O-CD 3.31Å; E463-K476 WeakPolarHBondContact O-CD 3.25Å; E463-K476 PolarHBondContact O-NZ 3.17Å; E463-K476 IonicContact OE2-NZ 3.7Å; E463-K476 PolarHBondContact OE2-NZ 2.93Å; A464-K476 HydrophobicContact CB-CB 3.74Å; A464-K476 HydrophobicContact CB-CD 4.39Å; E467-K476 HydrophobicContact CB-CD 4.28Å; E467-K476 IonicContact OE2-NZ 2.8Å; N472-K476 PolarHBondContact O-N 3.31Å; R473-K476 PolarHBondContact O-N 2.75Å; M474-K476 PolarHBondContact O-N 3.34Å; K476-V478 PolarHBondContact O-N 2.85Å; K476-K479 PolarHBondContact O-N 3.28Å; K476-W480 PolarHBondContact O-N 3.05Å
477	V	98.6	Very high	95.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.6	-42.9	173.8	175.4	0	0	0	0	111.6	A464 R473 M474 K479 W480 Y481 L569 F571 Y578 M580 I605	A464-V477 HydrophobicContact CB-CG2 4.3Å; R473-V477 WeakPolarHBondContact O-CG2 3.34Å; R473-V477 PolarHBondContact O-N 2.93Å; M474-V477 PolarHBondContact O-N 2.92Å; V477-K479 VanDerWaalsContact C-N 3.34Å; V477-K479 PolarHBondContact O-N 3.06Å; V477-W480 PolarHBondContact O-N 3.4Å; V477-Y481 WeakPolarHBondContact O-CB 3.45Å; V477-Y481 PolarHBondContact O-N 2.92Å; V477-L569 HydrophobicContact CG1-CD2 3.9Å; V477-L569 HydrophobicContact CG2-CD2 3.87Å; V477-F571 HydrophobicContact CG2-CE2 3.72Å; V477-F571 HydrophobicContact CG2-CZ 3.67Å; V477-Y578 HydrophobicContact CB-CD1 4.23Å; V477-Y578 HydrophobicContact CB-CE1 4.43Å; V477-Y578 HydrophobicContact CG1-CD1 3.98Å; V477-Y578 HydrophobicContact CG1-CG 4.43Å; V477-Y578 HydrophobicContact CG2-CD1 4.01Å; V477-Y578 HydrophobicContact CG2-CE1 4.06Å; V477-Y578 HydrophobicContact CG2-CG 4.38Å; V477-M580 HydrophobicContact CG1-CE 4.37Å; V477-I605 HydrophobicContact CG1-CG2 3.95Å
478	V	98.4	Very high	94.7	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.6	-38.5	175.3	172.2	0	0	0	0	111.5	M474 K475 K476 I482 I605 S614 L616 I637 L647 F668	M474-V478 HydrophobicContact CG-CG2 4.45Å; M474-V478 WeakPolarHBondContact O-CB 3.35Å; M474-V478 VanDerWaalsContact O-CG2 3.24Å; M474-V478 WeakPolarHBondContact O-CG2 3.43Å; M474-V478 PolarHBondContact O-N 3.16Å; M474-V478 HydrophobicContact SD-CG2 4.02Å; K475-V478 PolarHBondContact O-N 2.85Å; K476-V478 PolarHBondContact O-N 2.85Å; V478-I482 HydrophobicContact CG1-CD1 3.94Å; V478-I482 WeakPolarHBondContact O-CB 3.32Å; V478-I482 WeakPolarHBondContact O-CG1 3.09Å; V478-I482 PolarHBondContact O-N 3.48Å; V478-I605 HydrophobicContact CG2-CD1 4.14Å; V478-S614 VanDerWaalsContact CG2-CB 3.43Å; V478-S614 WeakPolarHBondContact CG2-OG 3.17Å; V478-L616 HydrophobicContact CG1-CD2 4.21Å; V478-I637 HydrophobicContact CG2-CD1 4.38Å; V478-I637 HydrophobicContact CG2-CG1 4.49Å; V478-L647 HydrophobicContact CG1-CD2 3.97Å; V478-F668 HydrophobicContact CB-CZ 4.07Å; V478-F668 HydrophobicContact CG1-CE1 4.01Å; V478-F668 HydrophobicContact CG1-CZ 3.81Å
479	K	97.8	Very high	93.2	Very high	68 Å²	68	20.9 Å²	20.9	30%	0.296	11%	0.105	S	C	.	.	H	α-helix	trans	-66.3	-45.2	176.4	-172.7	172.6	-179.9	165.8	0	111.9	F460 K475 K476 V477 I482 S483 F668 W669	F460-K479 HydrophobicContact CD2-CG 4.37Å; F460-K479 HydrophobicContact CE2-CG 4.28Å; K475-K479 WeakPolarHBondContact O-CB 3.5Å; K475-K479 PolarHBondContact O-N 3.04Å; K476-K479 PolarHBondContact O-N 3.28Å; V477-K479 VanDerWaalsContact C-N 3.34Å; V477-K479 PolarHBondContact O-N 3.06Å; K479-I482 PolarHBondContact O-N 2.84Å; K479-S483 PolarHBondContact O-N 2.93Å; K479-F668 HydrophobicContact CB-CE1 3.84Å; K479-F668 HydrophobicContact CB-CZ 3.76Å; K479-F668 WeakPolarHBondContact CD-O 3.36Å; K479-F668 VanDerWaalsContact CE-O 3.26Å; K479-F668 WeakPolarHBondContact CE-O 3.5Å; K479-F668 HydrophobicContact CG-CE1 4.33Å; K479-F668 PolarHBondContact NZ-O 2.91Å; K479-W669 HydrophobicContact CG-CE3 4Å
480	W	97.7	Very high	91.7	Very high	8 Å²	8	22.8 Å²	22.8	3%	0.03	11%	0.109	C	C	.	.	H	α-helix	trans	-57.1	-51.5	172.5	168	65.7	0	0	0	111.7	Y454 Y455 F460 L461 K476 V477 I482 S483 L544 M580	Y454-W480 PolarHBondContact O-NE1 3.25Å; Y455-W480 AromaticContact CD1-CZ2 3.98Å; Y455-W480 HydrophobicContact CD1-CZ2 3.98Å; Y455-W480 HydrophobicContact CE1-CH2 4.22Å; Y455-W480 AromaticContact CE1-CZ2 3.52Å; Y455-W480 HydrophobicContact CE1-CZ2 3.52Å; F460-W480 HydrophobicContact CB-CB 3.96Å; F460-W480 HydrophobicContact CD2-CB 4.46Å; L461-W480 HydrophobicContact CD1-CD2 3.98Å; L461-W480 HydrophobicContact CD1-CE3 4.48Å; L461-W480 HydrophobicContact CD1-CG 4.32Å; L461-W480 HydrophobicContact CD1-CZ2 4.23Å; L461-W480 HydrophobicContact CD2-CB 4.05Å; L461-W480 HydrophobicContact CD2-CD2 3.55Å; L461-W480 HydrophobicContact CD2-CE3 3.66Å; L461-W480 HydrophobicContact CD2-CG 3.68Å; L461-W480 HydrophobicContact CD2-CZ3 4.43Å; L461-W480 HydrophobicContact CG-CB 4.4Å; L461-W480 HydrophobicContact CG-CD2 3.82Å; L461-W480 HydrophobicContact CG-CE3 4.38Å; L461-W480 HydrophobicContact CG-CG 3.74Å; K476-W480 PolarHBondContact O-N 3.05Å; V477-W480 PolarHBondContact O-N 3.4Å; W480-I482 VanDerWaalsContact C-N 3.29Å; W480-I482 PolarHBondContact O-N 2.95Å; W480-S483 WeakPolarHBondContact O-CB 3.47Å; W480-S483 PolarHBondContact O-N 3.12Å; W480-S483 PolarHBondContact O-OG 3.15Å; W480-L544 HydrophobicContact CH2-CD1 3.44Å; W480-L544 VanDerWaalsContact CH2-CD1 3.44Å; W480-L544 HydrophobicContact CZ2-CD1 4.22Å; W480-L544 HydrophobicContact CZ3-CD1 3.99Å; W480-M580 HydrophobicContact CH2-SD 4.46Å; W480-M580 HydrophobicContact CZ3-CE 4.23Å; W480-M580 HydrophobicContact CZ3-SD 3.74Å
481	Y	97.8	Very high	90.3	Very high	3 Å²	3	22.3 Å²	22.3	1%	0.012	11%	0.106	C	C	.	.	H	α-helix	trans	-56.1	-45.1	-179.7	-177.5	-88.3	0	0	0	111.9	V477 S483 G484 F485 M580 N581 M582 P583 I603 I605 L616 F618	V477-Y481 WeakPolarHBondContact O-CB 3.45Å; V477-Y481 PolarHBondContact O-N 2.92Å; Y481-S483 VanDerWaalsContact C-N 3.33Å; Y481-S483 PolarHBondContact O-N 2.86Å; Y481-G484 PolarHBondContact O-N 3.38Å; Y481-F485 AromaticContact CD1-CE2 3.79Å; Y481-F485 HydrophobicContact CD1-CE2 3.79Å; Y481-F485 HydrophobicContact CD1-CZ 4.49Å; Y481-F485 AromaticContact CE1-CE2 3.47Å; Y481-F485 HydrophobicContact CE1-CE2 3.47Å; Y481-F485 VanDerWaalsContact CE1-CE2 3.47Å; Y481-F485 AromaticContact CE1-CZ 3.78Å; Y481-F485 HydrophobicContact CE1-CZ 3.78Å; Y481-F485 AromaticContact CZ-CZ 3.95Å; Y481-F485 WeakPolarHBondContact O-CD2 3.38Å; Y481-F485 WeakPolarHBondContact O-CE2 3.35Å; Y481-M580 HydrophobicContact CD2-CG 4.31Å; Y481-M580 HydrophobicContact CD2-SD 3.59Å; Y481-M580 VanDerWaalsContact CD2-SD 3.59Å; Y481-M580 HydrophobicContact CE2-CB 4.42Å; Y481-M580 HydrophobicContact CE2-CG 4.19Å; Y481-M580 HydrophobicContact CE2-SD 4.07Å; Y481-N581 PolarHBondContact OH-O 2.99Å; Y481-M582 HydrophobicContact CE2-SD 4.21Å; Y481-P583 WeakPolarHBondContact OH-CD 3.45Å; Y481-I603 HydrophobicContact CE1-CB 4.48Å; Y481-I603 HydrophobicContact CE1-CG1 4.13Å; Y481-I603 HydrophobicContact CE1-CG2 3.8Å; Y481-I603 HydrophobicContact CE2-CG2 4.32Å; Y481-I603 WeakPolarHBondContact OH-CD1 3.16Å; Y481-I603 WeakPolarHBondContact OH-CG2 3.49Å; Y481-I605 HydrophobicContact CD1-CD1 4.02Å; Y481-I605 HydrophobicContact CD2-CD1 4.12Å; Y481-I605 HydrophobicContact CG-CD1 3.71Å; Y481-L616 HydrophobicContact CD1-CD1 4Å; Y481-L616 HydrophobicContact CE1-CD1 4.24Å; Y481-F618 HydrophobicContact CE1-CE2 4.41Å
482	I	96.7	Very high	89.4	Confident	1 Å²	1	22 Å²	22	1%	0.005	11%	0.105	C	C	.	.	H	α-helix	trans	-63.3	-36.2	176.3	-77.9	171.1	0	0	0	112.2	V478 K479 W480 G484 F485 L616 I633 L647 I655 F668 W669	V478-I482 HydrophobicContact CG1-CD1 3.94Å; V478-I482 WeakPolarHBondContact O-CB 3.32Å; V478-I482 WeakPolarHBondContact O-CG1 3.09Å; V478-I482 PolarHBondContact O-N 3.48Å; K479-I482 PolarHBondContact O-N 2.84Å; W480-I482 VanDerWaalsContact C-N 3.29Å; W480-I482 PolarHBondContact O-N 2.95Å; I482-G484 PolarHBondContact O-N 2.92Å; I482-G484 VanDerWaalsContact O-N 3.13Å; I482-F485 PolarHBondContact O-N 2.81Å; I482-L616 HydrophobicContact CD1-CD1 4.2Å; I482-L616 HydrophobicContact CG1-CD1 4.1Å; I482-I633 HydrophobicContact CD1-CD1 4.39Å; I482-I633 HydrophobicContact CG1-CD1 4.37Å; I482-L647 HydrophobicContact CD1-CD2 4.37Å; I482-I655 HydrophobicContact CD1-CD1 4.06Å; I482-I655 HydrophobicContact CG2-CD1 3.61Å; I482-F668 HydrophobicContact CD1-CE1 4.09Å; I482-W669 HydrophobicContact CG2-CB 4.14Å; I482-W669 HydrophobicContact CG2-CD2 4.08Å; I482-W669 HydrophobicContact CG2-CG 3.63Å
483	S	94.9	Very high	88.7	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.014	10%	0.102	C	C	.	.	H	α-helix	trans	-63.1	-18	-179.2	78.5	0	0	0	0	114.4	K479 W480 Y481 F485 Y486 W669	K479-S483 PolarHBondContact O-N 2.93Å; W480-S483 WeakPolarHBondContact O-CB 3.47Å; W480-S483 PolarHBondContact O-N 3.12Å; W480-S483 PolarHBondContact O-OG 3.15Å; Y481-S483 VanDerWaalsContact C-N 3.33Å; Y481-S483 PolarHBondContact O-N 2.86Å; S483-F485 VanDerWaalsContact C-N 3.28Å; S483-F485 PolarHBondContact O-N 2.78Å; S483-Y486 WeakPolarHBondContact O-CD1 3.36Å; S483-Y486 WeakPolarHBondContact O-CE1 3.43Å; S483-W669 VanDerWaalsContact CB-CH2 3.41Å
484	G	93.1	Very high	88.1	Confident	4 Å²	4	24.9 Å²	24.9	4%	0.041	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-13.5	176.2	0	0	0	0	0	115.3	Y481 I482	Y481-G484 PolarHBondContact O-N 3.38Å; I482-G484 PolarHBondContact O-N 2.92Å; I482-G484 VanDerWaalsContact O-N 3.13Å
485	F	91.4	Very high	87.8	Confident	9 Å²	9	25.6 Å²	25.6	4%	0.039	12%	0.121	C	C	.	.	S	Bend	trans	-98.1	-27	-169	-63.3	-75	0	0	0	115.7	Y454 Y481 I482 S483 K487 P583 L599 F618 W651	Y454-F485 HydrophobicContact CE1-CD1 4.19Å; Y454-F485 AromaticContact CE1-CE1 3.68Å; Y454-F485 HydrophobicContact CE1-CE1 3.68Å; Y454-F485 HydrophobicContact CE1-CE2 4.06Å; Y454-F485 AromaticContact CE1-CZ 3.63Å; Y454-F485 HydrophobicContact CE1-CZ 3.63Å; Y454-F485 AromaticContact CZ-CE1 3.89Å; Y454-F485 VanDerWaalsContact OH-CE1 3.22Å; Y454-F485 WeakPolarHBondContact OH-CE1 3.4Å; Y481-F485 AromaticContact CD1-CE2 3.79Å; Y481-F485 HydrophobicContact CD1-CE2 3.79Å; Y481-F485 HydrophobicContact CD1-CZ 4.49Å; Y481-F485 AromaticContact CE1-CE2 3.47Å; Y481-F485 HydrophobicContact CE1-CE2 3.47Å; Y481-F485 VanDerWaalsContact CE1-CE2 3.47Å; Y481-F485 AromaticContact CE1-CZ 3.78Å; Y481-F485 HydrophobicContact CE1-CZ 3.78Å; Y481-F485 AromaticContact CZ-CZ 3.95Å; Y481-F485 WeakPolarHBondContact O-CD2 3.38Å; Y481-F485 WeakPolarHBondContact O-CE2 3.35Å; I482-F485 PolarHBondContact O-N 2.81Å; S483-F485 VanDerWaalsContact C-N 3.28Å; S483-F485 PolarHBondContact O-N 2.78Å; F485-K487 PolarHBondContact O-N 2.95Å; F485-K487 VanDerWaalsContact O-N 3.15Å; F485-P583 HydrophobicContact CD1-CG 4.42Å; F485-P583 HydrophobicContact CE1-CG 3.4Å; F485-P583 HydrophobicContact CZ-CG 3.68Å; F485-L599 HydrophobicContact CB-CD1 4.4Å; F485-L599 HydrophobicContact CD1-CD1 3.48Å; F485-L599 VanDerWaalsContact CD1-CD1 3.48Å; F485-L599 HydrophobicContact CE1-CD1 4.12Å; F485-L599 HydrophobicContact CG-CD1 4.24Å; F485-F618 HydrophobicContact CD1-CE1 4.22Å; F485-F618 HydrophobicContact CD1-CZ 4.39Å; F485-F618 HydrophobicContact CD2-CE1 4.11Å; F485-F618 AromaticContact CD2-CZ 3.71Å; F485-F618 HydrophobicContact CD2-CZ 3.71Å; F485-F618 HydrophobicContact CE1-CE1 4.42Å; F485-F618 HydrophobicContact CE1-CZ 4.28Å; F485-F618 HydrophobicContact CE2-CE1 4.33Å; F485-F618 HydrophobicContact CE2-CE2 4.42Å; F485-F618 AromaticContact CE2-CZ 3.59Å; F485-F618 HydrophobicContact CE2-CZ 3.59Å; F485-F618 HydrophobicContact CG-CE1 4.04Å; F485-F618 HydrophobicContact CG-CZ 4.11Å; F485-F618 HydrophobicContact CZ-CE1 4.46Å; F485-F618 AromaticContact CZ-CZ 3.88Å; F485-F618 HydrophobicContact CZ-CZ 3.88Å; F485-W651 HydrophobicContact CB-CD2 4.39Å; F485-W651 HydrophobicContact CB-CE3 3.75Å; F485-W651 HydrophobicContact CB-CZ3 4.39Å; F485-W651 VanDerWaalsContact O-CZ3 3.27Å; F485-W651 WeakPolarHBondContact O-CZ3 3.32Å
486	Y	86.3	Confident	87.6	Confident	8 Å²	8	23.4 Å²	23.4	3%	0.031	11%	0.111	C	C	.	.	S	Bend	trans	-64.3	-22.6	-177.2	79.7	-87.8	0	0	0	113.1	H457 S483 K488 W669 P671 R676	H457-Y486 AromaticContact CD2-CE1 3.93Å; H457-Y486 AromaticContact NE2-CE1 3.49Å; H457-Y486 WeakPolarHBondContact NE2-CE1 3.16Å; H457-Y486 AromaticContact NE2-CZ 3.64Å; H457-Y486 PolarHBondContact NE2-OH 3.2Å; S483-Y486 WeakPolarHBondContact O-CD1 3.36Å; S483-Y486 WeakPolarHBondContact O-CE1 3.43Å; Y486-K488 VanDerWaalsContact C-N 3.26Å; Y486-K488 PolarHBondContact O-N 2.97Å; Y486-W669 HydrophobicContact CD1-CH2 4.21Å; Y486-W669 AromaticContact CD1-CZ2 3.54Å; Y486-W669 HydrophobicContact CD1-CZ2 3.54Å; Y486-W669 HydrophobicContact CE1-CH2 4.15Å; Y486-W669 AromaticContact CE1-CZ2 3.94Å; Y486-W669 HydrophobicContact CE1-CZ2 3.94Å; Y486-W669 HydrophobicContact CG-CZ2 4.32Å; Y486-P671 HydrophobicContact CD1-CB 4.31Å; Y486-P671 HydrophobicContact CD2-CB 3.96Å; Y486-P671 HydrophobicContact CG-CB 3.79Å; Y486-R676 HydrophobicContact CE2-CG 3.9Å
487	K	80.6	Confident	87.3	Confident	16 Å²	16	24.4 Å²	24.4	7%	0.07	12%	0.119	C	C	.	.			trans	-77.6	71.4	176.3	-169	-178	174.5	-167.7	0	111.5	E397 L399 K450 D453 Y456 F485	E397-K487 WeakPolarHBondContact OE1-CE 3.43Å; E397-K487 IonicContact OE1-NZ 3.42Å; E397-K487 PolarHBondContact OE1-NZ 3.11Å; L399-K487 HydrophobicContact CD2-CD 4.36Å; L399-K487 HydrophobicContact CD2-CG 3.92Å; K450-K487 PolarHBondContact NZ-O 3.39Å; K450-K487 VanDerWaalsContact NZ-O 3.11Å; D453-K487 HydrophobicContact CB-CD 4.09Å; D453-K487 WeakPolarHBondContact OD1-CE 3.31Å; D453-K487 IonicContact OD1-NZ 2.68Å; D453-K487 PolarHBondContact OD1-NZ 3.23Å; D453-K487 IonicContact OD2-NZ 3.97Å; Y456-K487 HydrophobicContact CD2-CD 4.46Å; Y456-K487 HydrophobicContact CE2-CD 4.3Å; Y456-K487 PolarHBondContact OH-NZ 2.85Å; F485-K487 PolarHBondContact O-N 2.95Å; F485-K487 VanDerWaalsContact O-N 3.15Å
488	K	74.9	Confident	87.2	Confident	15 Å²	15	24.5 Å²	24.5	7%	0.065	12%	0.119	C	C	.	.	P	Polyproline II helix	trans	-90	143	174.2	63.8	-168.7	-171.9	177.1	0	111.9	G400 E401 G403 Q407 Y486 W651 D652	G400-K488 WeakPolarHBondContact CA-O 3.44Å; G400-K488 PolarHBondContact N-O 2.61Å; E401-K488 WeakPolarHBondContact O-CE 3.44Å; E401-K488 PolarHBondContact O-NZ 3.14Å; G403-K488 VanDerWaalsContact N-NZ 3.17Å; G403-K488 PolarHBondContact O-NZ 3.25Å; Q407-K488 HydrophobicContact CG-CD 4.09Å; Y486-K488 VanDerWaalsContact C-N 3.26Å; Y486-K488 PolarHBondContact O-N 2.97Å; K488-W651 HydrophobicContact CD-CH2 4.27Å; K488-W651 HydrophobicContact CD-CZ3 4.29Å; K488-D652 IonicContact NZ-OD2 3.9Å; K488-D652 PolarHBondContact NZ-OD2 3.35Å
489	P	66.9	Low	87.1	Confident	29 Å²	29	25.1 Å²	25.1	19%	0.188	12%	0.122	C	C	.	.	P	Polyproline II helix	trans	-69.2	166	172	32.3	-35.9	0	0	0	110.7	K493	P489-K493 HydrophobicContact CB-CB 4.26Å; P489-K493 HydrophobicContact CG-CB 4.26Å
490	K	65.9	Low	87	Confident	120 Å²	120	22.7 Å²	22.7	52%	0.522	11%	0.113	S	C	.	.	S	Bend	trans	-87.5	116.2	179.1	-168.5	165.6	179	166.1	0	110.3	E398	E398-K490 WeakPolarHBondContact OE1-CD 3.49Å; E398-K490 IonicContact OE1-NZ 3.44Å; E398-K490 PolarHBondContact OE1-NZ 3.05Å
491	G	68.8	Low	86.9	Confident	11 Å²	11	22.7 Å²	22.7	11%	0.113	12%	0.115	C	C	.	.	S	Bend	trans	81.3	-167.7	-174	0	0	0	0	0	113.2	A406 K493	A406-G491 WeakPolarHBondContact O-CA 3.35Å; A406-G491 PolarHBondContact O-N 3.4Å; G491-K493 PolarHBondContact O-N 3.47Å; G491-K493 VanDerWaalsContact O-N 3.15Å
492	L	76.8	Confident	87	Confident	16 Å²	16	22.5 Å²	22.5	8%	0.084	11%	0.114	C	C	.	.	S	Bend	trans	-93.6	73.4	-170.4	-162.5	122.1	0	0	0	111.3	E409 M595 T596 L597	E409-L492 HydrophobicContact CB-CB 3.96Å; E409-L492 PolarHBondContact OE2-N 3.45Å; L492-M595 HydrophobicContact CD1-CB 4.39Å; L492-M595 HydrophobicContact CD2-CE 3.68Å; L492-T596 VanDerWaalsContact CD1-C 3.46Å; L492-L597 HydrophobicContact CD1-CB 3.71Å; L492-L597 HydrophobicContact CG-CB 4.3Å
493	K	82.8	Confident	87	Confident	48 Å²	48	23.6 Å²	23.6	21%	0.209	12%	0.121	C	C	.	.			trans	-101.6	146.2	-177.4	-51.2	-53.1	175.8	-152.9	0	113	E409 F440 V441 E443 P489 G491	E409-K493 IonicContact OE1-NZ 3.31Å; E409-K493 PolarHBondContact OE1-NZ 3.43Å; E409-K493 WeakPolarHBondContact OE2-CE 3.3Å; E409-K493 IonicContact OE2-NZ 3.73Å; E409-K493 PolarHBondContact OE2-NZ 3.13Å; F440-K493 PolarHBondContact O-NZ 2.75Å; V441-K493 CarbonylContact O-C 3.52Å; V441-K493 WeakPolarHBondContact O-CA 3.28Å; E443-K493 HydrophobicContact CB-CB 3.86Å; E443-K493 HydrophobicContact CG-CB 4.4Å; P489-K493 HydrophobicContact CB-CB 4.26Å; P489-K493 HydrophobicContact CG-CB 4.26Å; G491-K493 PolarHBondContact O-N 3.47Å; G491-K493 VanDerWaalsContact O-N 3.15Å
494	K	87.3	Confident	87.2	Confident	71 Å²	71	23.8 Å²	23.8	31%	0.309	12%	0.121	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	130.5	174.5	-178.2	-154.5	168.4	-71.8	0	108.7	L437 V441 L442 E443	L437-K494 HydrophobicContact CD1-CD 4.09Å; V441-K494 PolarHBondContact O-N 3.28Å; L442-K494 CarbonylContact C-O 3.43Å; L442-K494 VanDerWaalsContact CA-O 3.26Å; L442-K494 WeakPolarHBondContact CA-O 3.29Å; E443-K494 PolarHBondContact N-O 3.39Å
495	P	91.7	Very high	87.4	Confident	16 Å²	16	24.5 Å²	24.5	10%	0.104	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	161.1	174.6	27.1	-36.8	0	0	0	112.7	R445 F447 K450	R445-P495 CarbonylContact O-C 3.54Å; R445-P495 VanDerWaalsContact O-CA 3.27Å; R445-P495 WeakPolarHBondContact O-CA 3.24Å; R445-P495 VanDerWaalsContact O-CB 3.25Å; R445-P495 WeakPolarHBondContact O-CB 3.49Å; F447-P495 HydrophobicContact CB-CB 4.41Å; F447-P495 HydrophobicContact CB-CG 4.23Å; F447-P495 HydrophobicContact CD2-CG 3.96Å; K450-P495 HydrophobicContact CB-CB 4.02Å; K450-P495 HydrophobicContact CB-CG 4.03Å; K450-P495 HydrophobicContact CG-CB 4.46Å; K450-P495 HydrophobicContact CG-CG 4.08Å
496	Y	92.8	Very high	87.7	Confident	1 Å²	1	24 Å²	24	0%	0.004	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	149.3	172.6	-54	-45.7	0	0	0	111.2	L442 P444 R445 F447 P498 W699 V702 T703 I706	L442-Y496 HydrophobicContact CB-CD1 4.3Å; L442-Y496 HydrophobicContact CB-CE1 4.05Å; L442-Y496 HydrophobicContact CD1-CD1 4.03Å; L442-Y496 HydrophobicContact CD1-CE1 3.98Å; P444-Y496 WeakPolarHBondContact CA-OH 3.23Å; R445-Y496 PolarHBondContact O-N 3.03Å; F447-Y496 PolarHBondContact N-O 2.79Å; Y496-P498 WeakPolarHBondContact O-CD 3.36Å; Y496-W699 HydrophobicContact CD1-CE3 4.3Å; Y496-W699 HydrophobicContact CD2-CB 3.76Å; Y496-W699 AromaticContact CD2-CD1 3.97Å; Y496-W699 AromaticContact CD2-CD2 3.54Å; Y496-W699 HydrophobicContact CD2-CD2 3.54Å; Y496-W699 AromaticContact CD2-CE3 3.89Å; Y496-W699 HydrophobicContact CD2-CE3 3.89Å; Y496-W699 AromaticContact CD2-CG 3.47Å; Y496-W699 HydrophobicContact CD2-CG 3.47Å; Y496-W699 VanDerWaalsContact CD2-CG 3.47Å; Y496-W699 HydrophobicContact CE2-CB 3.61Å; Y496-W699 HydrophobicContact CE2-CD2 4.12Å; Y496-W699 HydrophobicContact CE2-CE3 4.24Å; Y496-W699 AromaticContact CE2-CG 3.87Å; Y496-W699 HydrophobicContact CE2-CG 3.87Å; Y496-W699 AromaticContact CG-CD2 3.85Å; Y496-W699 HydrophobicContact CG-CD2 3.85Å; Y496-W699 AromaticContact CG-CE3 3.92Å; Y496-W699 HydrophobicContact CG-CE3 3.92Å; Y496-W699 HydrophobicContact CG-CG 4.27Å; Y496-W699 HydrophobicContact CG-CZ3 4.35Å; Y496-V702 HydrophobicContact CE1-CG1 3.77Å; Y496-T703 WeakPolarHBondContact OH-CA 3.48Å; Y496-T703 PolarHBondContact OH-N 3.43Å; Y496-T703 PolarHBondContact OH-OG1 3.12Å; Y496-I706 HydrophobicContact CE1-CD1 3.93Å
497	N	92.7	Very high	88.2	Confident	67 Å²	67	24.1 Å²	24.1	36%	0.358	12%	0.121	S	C	.	.			trans	-88.8	113	174.7	-179.4	80.7	0	0	0	108	H526	N497-H526 PolarHBondContact ND2-CE1 3.02Å
498	P	95.9	Very high	89	Confident	2 Å²	2	23.3 Å²	23.3	1%	0.013	12%	0.118	C	C	.	.	P	Polyproline II helix	trans	-64.3	146	-167.4	-20.9	32.3	0	0	0	112.7	F447 L448 Y496 E502 Q523 H526	F447-P498 HydrophobicContact CB-CG 3.81Å; L448-P498 HydrophobicContact CD1-CB 4.39Å; L448-P498 HydrophobicContact CD2-CG 4.13Å; L448-P498 HydrophobicContact CG-CB 4.16Å; L448-P498 HydrophobicContact CG-CG 3.9Å; Y496-P498 WeakPolarHBondContact O-CD 3.36Å; P498-E502 WeakPolarHBondContact CA-OE2 3.4Å; P498-E502 HydrophobicContact CB-CB 4.23Å; P498-E502 HydrophobicContact CB-CG 4.41Å; P498-E502 WeakPolarHBondContact CB-OE2 3.29Å; P498-Q523 HydrophobicContact CB-CB 3.87Å; P498-Q523 HydrophobicContact CB-CG 3.82Å; P498-H526 PolarHBondContact O-ND1 3.14Å
499	I	95.5	Very high	89.9	Confident	12 Å²	12	25.2 Å²	25.2	6%	0.062	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-79.1	156.8	173	71.5	173.4	0	0	0	110.3	G501 E502 Q523 F693 L698 W699 Q725	I499-G501 PolarHBondContact O-N 3.27Å; I499-E502 HydrophobicContact CG1-CB 3.94Å; I499-E502 PolarHBondContact N-OE2 3.05Å; I499-E502 WeakPolarHBondContact O-CB 3.38Å; I499-E502 PolarHBondContact O-N 2.89Å; I499-Q523 WeakPolarHBondContact O-CB 3.23Å; I499-Q523 WeakPolarHBondContact O-CG 3.35Å; I499-F693 HydrophobicContact CD1-CD1 4.01Å; I499-F693 HydrophobicContact CD1-CE1 3.93Å; I499-L698 HydrophobicContact CD1-CD1 3.87Å; I499-L698 HydrophobicContact CD1-CD2 3.6Å; I499-L698 HydrophobicContact CD1-CG 4.34Å; I499-L698 HydrophobicContact CG1-CD2 3.71Å; I499-W699 HydrophobicContact CG2-CZ2 4.14Å; I499-Q725 HydrophobicContact CB-CG 4.07Å; I499-Q725 HydrophobicContact CG2-CB 4.49Å; I499-Q725 HydrophobicContact CG2-CG 4.41Å
500	I	96.3	Very high	91.3	Very high	18 Å²	18	24.1 Å²	24.1	9%	0.092	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	126.9	176.4	-171	72.1	0	0	0	110.6	E502 H526 Q725 W739	I500-E502 VanDerWaalsContact C-N 3.32Å; I500-H526 HydrophobicContact CB-CB 4.06Å; I500-H526 HydrophobicContact CD1-CB 4.18Å; I500-Q725 HydrophobicContact CG2-CG 3.97Å; I500-W739 HydrophobicContact CD1-CB 4.43Å; I500-W739 HydrophobicContact CD1-CD2 4.49Å; I500-W739 HydrophobicContact CD1-CG 3.92Å; I500-W739 HydrophobicContact CG1-CB 4.25Å; I500-W739 HydrophobicContact CG1-CD2 3.74Å; I500-W739 HydrophobicContact CG1-CE3 4.39Å; I500-W739 HydrophobicContact CG1-CG 3.62Å
501	G	96.6	Very high	92.5	Very high	7 Å²	7	26.2 Å²	26.2	7%	0.072	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	4	-177.1	0	0	0	0	0	115.8	I499 Q523	I499-G501 PolarHBondContact O-N 3.27Å; G501-Q523 PolarHBondContact N-O 2.97Å; G501-Q523 VanDerWaalsContact N-O 3.12Å
502	E	98.4	Very high	93.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.162	C	C	.	.			trans	-64.5	140.6	168.7	-172.1	177.7	139	0	0	110.6	S446 L448 P498 I499 I500 E522 Q523 F693 S695 L698 W699	S446-E502 WeakPolarHBondContact CB-OE1 3.49Å; S446-E502 PolarHBondContact OG-OE1 2.93Å; L448-E502 HydrophobicContact CD1-CB 4.18Å; L448-E502 HydrophobicContact CD1-CG 4Å; L448-E502 VanDerWaalsContact CD1-O 3.23Å; L448-E502 WeakPolarHBondContact CD1-O 3.26Å; P498-E502 WeakPolarHBondContact CA-OE2 3.4Å; P498-E502 HydrophobicContact CB-CB 4.23Å; P498-E502 HydrophobicContact CB-CG 4.41Å; P498-E502 WeakPolarHBondContact CB-OE2 3.29Å; I499-E502 HydrophobicContact CG1-CB 3.94Å; I499-E502 PolarHBondContact N-OE2 3.05Å; I499-E502 WeakPolarHBondContact O-CB 3.38Å; I499-E502 PolarHBondContact O-N 2.89Å; I500-E502 VanDerWaalsContact C-N 3.32Å; E502-E522 CarbonylContact O-C 3.6Å; E502-E522 WeakPolarHBondContact O-CA 3.45Å; E502-Q523 HydrophobicContact CB-CB 4.3Å; E502-Q523 PolarHBondContact O-N 2.83Å; E502-F693 WeakPolarHBondContact CA-O 3.5Å; E502-S695 PolarHBondContact OE1-OG 3Å; E502-S695 VanDerWaalsContact OE1-OG 3.13Å; E502-L698 HydrophobicContact CB-CD2 4.23Å; E502-L698 HydrophobicContact CG-CD2 3.67Å; E502-L698 WeakPolarHBondContact OE2-CD2 3.32Å; E502-W699 PolarHBondContact OE1-NE1 2.97Å; E502-W699 PolarHBondContact OE2-NE1 2.91Å
503	T	98.3	Very high	94.4	Very high	23 Å²	23	35.8 Å²	35.8	14%	0.141	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	159.7	178.4	51.9	0	0	0	0	112.2	A521 E522 F693 E694 S695 L743	T503-A521 CarbonylContact C-O 3.59Å; T503-A521 VanDerWaalsContact CA-O 3.25Å; T503-A521 WeakPolarHBondContact CA-O 3.41Å; T503-E522 HydrophobicContact CG2-CB 4.18Å; T503-E522 HydrophobicContact CG2-CG 3.97Å; T503-F693 PolarHBondContact N-O 2.76Å; T503-E694 CarbonylContact O-C 3.56Å; T503-E694 WeakPolarHBondContact O-CA 3.36Å; T503-S695 PolarHBondContact O-N 2.98Å; T503-S695 PolarHBondContact O-OG 3.19Å; T503-L743 HydrophobicContact CG2-CD1 4.02Å
504	Y	98.1	Very high	94.9	Very high	6 Å²	6	40 Å²	40	2%	0.024	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	142.7	166.7	-171.9	-109.8	0	0	0	110.6	D449 C506 Y519 A521 R682 T684 E696	D449-Y504 HydrophobicContact CB-CD1 4.2Å; D449-Y504 HydrophobicContact CB-CD2 4.13Å; D449-Y504 HydrophobicContact CB-CE1 4.02Å; D449-Y504 HydrophobicContact CB-CE2 3.94Å; D449-Y504 HydrophobicContact CB-CG 4.24Å; Y504-C506 HydrophobicContact CE1-CB 3.97Å; Y504-Y519 HydrophobicContact CD1-CD1 4.18Å; Y504-Y519 AromaticContact CD1-CE1 3.88Å; Y504-Y519 HydrophobicContact CD1-CE1 3.88Å; Y504-A521 PolarHBondContact N-O 3.02Å; Y504-A521 PolarHBondContact O-N 2.93Å; Y504-R682 PolarHBondContact OH-NH1 2.83Å; Y504-T684 WeakPolarHBondContact OH-CG2 3.35Å; Y504-E696 HydrophobicContact CE2-CG 3.97Å; Y504-E696 WeakPolarHBondContact CE2-OE1 3.42Å; Y504-E696 PolarHBondContact OH-OE1 3.19Å
505	R	97.1	Very high	95.2	Very high	19 Å²	19	37 Å²	37	7%	0.072	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	139.4	175.5	53.6	177	170.3	157	1.9	112	T389 Y519 I520 V685 E694 E773	T389-R505 PolarHBondContact OG1-NH1 2.83Å; R505-Y519 VanDerWaalsContact CA-O 3.28Å; R505-Y519 WeakPolarHBondContact CA-O 3.39Å; R505-I520 HydrophobicContact CB-CD1 3.65Å; R505-V685 HydrophobicContact CG-CG2 4.12Å; R505-E694 VanDerWaalsContact CG-OE2 3.32Å; R505-E694 WeakPolarHBondContact CG-OE2 3.26Å; R505-E694 IonicContact CZ-OE1 3.82Å; R505-E694 IonicContact CZ-OE2 2.6Å; R505-E694 IonicContact NE-OE1 2.61Å; R505-E694 PolarHBondContact NE-OE1 2.77Å; R505-E694 IonicContact NE-OE2 3.81Å; R505-E694 PolarHBondContact NE-OE2 2.71Å; R505-E694 IonicContact NH2-OE1 2.69Å; R505-E694 PolarHBondContact NH2-OE1 2.88Å; R505-E694 IonicContact NH2-OE2 2.75Å; R505-E773 WeakPolarHBondContact CD-OE1 3.18Å; R505-E773 IonicContact CZ-OE1 3.23Å; R505-E773 IonicContact NE-OE1 2.68Å; R505-E773 IonicContact NH1-OE1 2.81Å; R505-E773 PolarHBondContact NH1-OE1 2.69Å; R505-E773 IonicContact NH1-OE2 3.58Å; R505-E773 PolarHBondContact NH1-OE2 3.42Å
506	C	97.4	Very high	95.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	164.7	176.1	62.9	0	0	0	0	109.9	Y504 W508 Y519 R682 Y683 T684	Y504-C506 HydrophobicContact CE1-CB 3.97Å; C506-W508 WeakPolarHBondContact SG-CH2 3.23Å; C506-Y519 PolarHBondContact N-O 2.98Å; C506-Y519 VanDerWaalsContact N-O 3.16Å; C506-Y519 PolarHBondContact O-N 3.23Å; C506-R682 HydrophobicContact CB-CG 4.04Å; C506-Y683 VanDerWaalsContact CA-O 3.3Å; C506-Y683 WeakPolarHBondContact CA-O 3.41Å; C506-Y683 WeakPolarHBondContact CB-O 3.36Å; C506-T684 HydrophobicContact CB-CG2 4.12Å
507	M	97.4	Very high	95.7	Very high	9 Å²	9	37.9 Å²	37.9	4%	0.044	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	164.8	172.5	73.2	164.9	-164.2	0	0	112.6	Y391 L509 K516 T517 F518 Y683	Y391-M507 HydrophobicContact CD1-CG 4.02Å; Y391-M507 HydrophobicContact CD2-CG 4.27Å; Y391-M507 HydrophobicContact CD2-SD 4.03Å; Y391-M507 HydrophobicContact CE1-CG 4.47Å; Y391-M507 HydrophobicContact CG-CE 4.27Å; Y391-M507 HydrophobicContact CG-CG 3.91Å; Y391-M507 HydrophobicContact CG-SD 4.07Å; M507-L509 HydrophobicContact CE-CD1 4.4Å; M507-L509 HydrophobicContact CE-CD2 3.54Å; M507-L509 HydrophobicContact CE-CG 3.96Å; M507-L509 HydrophobicContact SD-CD2 4.11Å; M507-K516 HydrophobicContact SD-CD 3.93Å; M507-K516 HydrophobicContact SD-CG 4.41Å; M507-T517 CarbonylContact C-O 3.55Å; M507-T517 WeakPolarHBondContact CA-O 3.38Å; M507-T517 WeakPolarHBondContact CB-O 3.33Å; M507-F518 HydrophobicContact CB-CD1 3.85Å; M507-F518 HydrophobicContact CB-CE1 4.15Å; M507-F518 HydrophobicContact SD-CE1 4.07Å; M507-Y683 HydrophobicContact CE-CD1 4.22Å; M507-Y683 HydrophobicContact CE-CD2 4.22Å; M507-Y683 HydrophobicContact CE-CG 3.87Å; M507-Y683 PolarHBondContact N-O 3.04Å; M507-Y683 PolarHBondContact O-N 3.08Å
508	W	97	Very high	96	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	138.5	168.8	-63.9	-98.1	0	0	0	110.5	S452 Y455 Y456 C506 T517 L680 T681 R682	S452-W508 WeakPolarHBondContact O-CH2 3.44Å; S452-W508 WeakPolarHBondContact O-CZ2 3.2Å; Y455-W508 HydrophobicContact CD2-CH2 4.3Å; Y455-W508 HydrophobicContact CG-CH2 4.28Å; Y455-W508 HydrophobicContact CG-CZ3 4.4Å; Y456-W508 HydrophobicContact CD2-CZ2 4.39Å; Y456-W508 HydrophobicContact CE2-CZ2 4.25Å; C506-W508 WeakPolarHBondContact SG-CH2 3.23Å; W508-T517 HydrophobicContact CE3-CG2 4.26Å; W508-T517 PolarHBondContact N-O 2.99Å; W508-T517 PolarHBondContact O-N 2.85Å; W508-L680 HydrophobicContact CB-CB 4.02Å; W508-L680 HydrophobicContact CB-CD1 4.16Å; W508-L680 HydrophobicContact CG-CB 4.09Å; W508-T681 VanDerWaalsContact CD1-O 3.26Å; W508-R682 HydrophobicContact CZ2-CG 4.02Å
509	L	95.1	Very high	96.1	Very high	55 Å²	55	34.6 Å²	34.6	29%	0.288	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	115.3	178.2	-64.5	-175.7	0	0	0	111.2	M507 Q511 K516 Y683	M507-L509 HydrophobicContact CE-CD1 4.4Å; M507-L509 HydrophobicContact CE-CD2 3.54Å; M507-L509 HydrophobicContact CE-CG 3.96Å; M507-L509 HydrophobicContact SD-CD2 4.11Å; L509-Q511 PolarHBondContact O-N 2.73Å; L509-K516 HydrophobicContact CD2-CD 4.4Å; L509-K516 HydrophobicContact CD2-CG 3.83Å; L509-Y683 HydrophobicContact CB-CE2 4.14Å; L509-Y683 HydrophobicContact CD1-CD2 4.4Å; L509-Y683 HydrophobicContact CD1-CE1 4.2Å; L509-Y683 HydrophobicContact CD1-CE2 3.72Å; L509-Y683 HydrophobicContact CG-CD2 4.05Å; L509-Y683 HydrophobicContact CG-CE2 3.65Å
510	H	95.4	Very high	96.3	Very high	5 Å²	5	34 Å²	34	2%	0.023	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	84.1	176.3	-70.1	-153.6	0	0	0	109.3	A458 S462 K512 T513 N514 S515 T517 N537 D540 L680	A458-H510 PolarHBondContact O-CE1 2.81Å; S462-H510 PolarHBondContact OG-CE1 2.83Å; S462-H510 PolarHBondContact OG-ND1 2.78Å; S462-H510 VanDerWaalsContact OG-ND1 3.09Å; H510-K512 PolarHBondContact O-N 2.73Å; H510-T513 VanDerWaalsContact CB-OG1 3.25Å; H510-T513 WeakPolarHBondContact CB-OG1 3.47Å; H510-T513 PolarHBondContact O-N 2.9Å; H510-T513 VanDerWaalsContact O-N 3.15Å; H510-T513 PolarHBondContact O-OG1 3.09Å; H510-N514 WeakPolarHBondContact O-CA 3.34Å; H510-N514 PolarHBondContact O-N 3.2Å; H510-S515 WeakPolarHBondContact CB-OG 3.16Å; H510-S515 PolarHBondContact N-O 2.73Å; H510-S515 PolarHBondContact O-N 3.18Å; H510-T517 PolarHBondContact CE1-OG1 2.85Å; H510-T517 PolarHBondContact NE2-OG1 2.87Å; H510-N537 PolarHBondContact ND1-ND2 3.09Å; H510-D540 IonicContact CE1-OD2 2.66Å; H510-D540 IonicContact CG-OD2 2.82Å; H510-D540 IonicContact ND1-OD2 3.55Å; H510-D540 PolarHBondContact ND1-OD2 2.86Å; H510-L680 WeakPolarHBondContact NE2-CD1 3.24Å
511	Q	91.4	Very high	96.4	Very high	164 Å²	164	33.2 Å²	33.2	77%	0.766	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-37.1	-175.8	-62.2	-179.4	3.4	0	0	113.2	L509 T513	L509-Q511 PolarHBondContact O-N 2.73Å; Q511-T513 PolarHBondContact O-N 3.08Å
512	K	91.6	Very high	96.5	Very high	169 Å²	169	33 Å²	33	74%	0.735	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-36.9	180	-60.7	170.9	-173	163.3	0	113.4	D459 H510	D459-K512 IonicContact OD2-NZ 3.41Å; D459-K512 PolarHBondContact OD2-NZ 2.87Å; H510-K512 PolarHBondContact O-N 2.73Å
513	T	92.9	Very high	96.5	Very high	59 Å²	59	33 Å²	33	36%	0.362	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-4	-175.5	47.9	0	0	0	0	113	H510 Q511 S515 K539 D540	H510-T513 VanDerWaalsContact CB-OG1 3.25Å; H510-T513 WeakPolarHBondContact CB-OG1 3.47Å; H510-T513 PolarHBondContact O-N 2.9Å; H510-T513 VanDerWaalsContact O-N 3.15Å; H510-T513 PolarHBondContact O-OG1 3.09Å; Q511-T513 PolarHBondContact O-N 3.08Å; T513-S515 VanDerWaalsContact C-N 3.35Å; T513-S515 PolarHBondContact O-N 3.44Å; T513-S515 PolarHBondContact OG1-OG 3.09Å; T513-S515 VanDerWaalsContact OG1-OG 3.1Å; T513-K539 PolarHBondContact O-NZ 3.4Å; T513-D540 WeakPolarHBondContact CB-OD1 3.18Å; T513-D540 PolarHBondContact OG1-OD1 3.16Å; T513-D540 VanDerWaalsContact OG1-OD1 3.14Å; T513-D540 PolarHBondContact OG1-OD2 2.97Å
514	N	93.4	Very high	96.4	Very high	138 Å²	138	32.2 Å²	32.2	74%	0.738	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.7	54.3	-170.5	-169.9	17.4	0	0	0	111.8	H510 K539	H510-N514 WeakPolarHBondContact O-CA 3.34Å; H510-N514 PolarHBondContact O-N 3.2Å; N514-K539 PolarHBondContact O-NZ 2.87Å
515	S	95.3	Very high	96.3	Very high	7 Å²	7	33.5 Å²	33.5	5%	0.049	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	171.1	178.6	71.8	0	0	0	0	111.7	H510 T513 N537 D540	H510-S515 WeakPolarHBondContact CB-OG 3.16Å; H510-S515 PolarHBondContact N-O 2.73Å; H510-S515 PolarHBondContact O-N 3.18Å; T513-S515 VanDerWaalsContact C-N 3.35Å; T513-S515 PolarHBondContact O-N 3.44Å; T513-S515 PolarHBondContact OG1-OG 3.09Å; T513-S515 VanDerWaalsContact OG1-OG 3.1Å; S515-N537 WeakPolarHBondContact CB-OD1 3.39Å; S515-N537 PolarHBondContact OG-ND2 3.22Å; S515-N537 PolarHBondContact OG-OD1 2.62Å; S515-D540 WeakPolarHBondContact CB-OD1 3.22Å; S515-D540 PolarHBondContact OG-OD1 2.85Å; S515-D540 PolarHBondContact OG-OD2 3.39Å
516	K	96.1	Very high	96	Very high	35 Å²	35	34.4 Å²	34.4	15%	0.152	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	126.5	-177.7	-61.6	-175.1	172.8	-168.9	0	108.5	E388 M507 L509 F518 N537	E388-K516 IonicContact OE1-NZ 3.52Å; E388-K516 PolarHBondContact OE1-NZ 2.88Å; E388-K516 IonicContact OE2-NZ 3.66Å; E388-K516 PolarHBondContact OE2-NZ 3.43Å; M507-K516 HydrophobicContact SD-CD 3.93Å; M507-K516 HydrophobicContact SD-CG 4.41Å; L509-K516 HydrophobicContact CD2-CD 4.4Å; L509-K516 HydrophobicContact CD2-CG 3.83Å; K516-F518 HydrophobicContact CB-CD2 4.14Å; K516-F518 HydrophobicContact CB-CE1 4.43Å; K516-F518 HydrophobicContact CB-CE2 3.47Å; K516-F518 VanDerWaalsContact CB-CE2 3.47Å; K516-F518 HydrophobicContact CB-CZ 3.66Å; K516-F518 HydrophobicContact CD-CE1 4.18Å; K516-F518 HydrophobicContact CD-CE2 4.03Å; K516-F518 HydrophobicContact CD-CZ 3.41Å; K516-F518 VanDerWaalsContact CD-CZ 3.41Å; K516-F518 HydrophobicContact CG-CE2 4.38Å; K516-F518 HydrophobicContact CG-CZ 4.18Å; K516-N537 PolarHBondContact O-ND2 3.34Å
517	T	98.3	Very high	95.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	113.4	166.4	-65	0	0	0	0	108.2	A458 M507 W508 H510 V535 S536 N537 F542	A458-T517 HydrophobicContact CB-CG2 4.17Å; M507-T517 CarbonylContact C-O 3.55Å; M507-T517 WeakPolarHBondContact CA-O 3.38Å; M507-T517 WeakPolarHBondContact CB-O 3.33Å; W508-T517 HydrophobicContact CE3-CG2 4.26Å; W508-T517 PolarHBondContact N-O 2.99Å; W508-T517 PolarHBondContact O-N 2.85Å; H510-T517 PolarHBondContact CE1-OG1 2.85Å; H510-T517 PolarHBondContact NE2-OG1 2.87Å; T517-V535 HydrophobicContact CG2-CG1 3.61Å; T517-S536 WeakPolarHBondContact CA-O 3.49Å; T517-N537 WeakPolarHBondContact OG1-CB 3.43Å; T517-N537 PolarHBondContact OG1-ND2 2.97Å; T517-F542 HydrophobicContact CG2-CE2 4.34Å; T517-F542 HydrophobicContact CG2-CZ 4.25Å
518	F	98.4	Very high	95.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	139.4	177.2	-64.3	-81.1	0	0	0	110.7	Y391 M507 K516 V535 S536 Q771 E773 I778	Y391-F518 HydrophobicContact CE2-CE1 4.33Å; M507-F518 HydrophobicContact CB-CD1 3.85Å; M507-F518 HydrophobicContact CB-CE1 4.15Å; M507-F518 HydrophobicContact SD-CE1 4.07Å; K516-F518 HydrophobicContact CB-CD2 4.14Å; K516-F518 HydrophobicContact CB-CE1 4.43Å; K516-F518 HydrophobicContact CB-CE2 3.47Å; K516-F518 VanDerWaalsContact CB-CE2 3.47Å; K516-F518 HydrophobicContact CB-CZ 3.66Å; K516-F518 HydrophobicContact CD-CE1 4.18Å; K516-F518 HydrophobicContact CD-CE2 4.03Å; K516-F518 HydrophobicContact CD-CZ 3.41Å; K516-F518 VanDerWaalsContact CD-CZ 3.41Å; K516-F518 HydrophobicContact CG-CE2 4.38Å; K516-F518 HydrophobicContact CG-CZ 4.18Å; F518-V535 CarbonylContact O-C 3.56Å; F518-V535 WeakPolarHBondContact O-CA 3.33Å; F518-V535 WeakPolarHBondContact O-CG1 3.37Å; F518-S536 PolarHBondContact N-O 3.48Å; F518-S536 PolarHBondContact O-N 3.46Å; F518-Q771 HydrophobicContact CD2-CG 4.22Å; F518-Q771 HydrophobicContact CE2-CG 4Å; F518-E773 HydrophobicContact CD1-CB 3.51Å; F518-E773 HydrophobicContact CD1-CG 4.34Å; F518-E773 HydrophobicContact CE1-CB 3.49Å; F518-E773 VanDerWaalsContact CE1-CB 3.49Å; F518-E773 HydrophobicContact CG-CB 4.26Å; F518-E773 HydrophobicContact CZ-CB 4.22Å; F518-I778 HydrophobicContact CB-CD1 3.71Å; F518-I778 HydrophobicContact CB-CG1 4.07Å; F518-I778 HydrophobicContact CG-CG1 4.46Å
519	Y	98.6	Very high	95	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.5	171.5	170.7	-74.9	0	0	0	109.5	L448 L451 Y455 Y504 R505 C506 A521 F533 V535	L448-Y519 PolarHBondContact O-OH 3.09Å; L451-Y519 WeakPolarHBondContact CB-OH 3.43Å; Y455-Y519 AromaticContact CD2-CD2 3.88Å; Y455-Y519 HydrophobicContact CD2-CD2 3.88Å; Y455-Y519 HydrophobicContact CD2-CE2 4.26Å; Y455-Y519 AromaticContact CE2-CD2 3.74Å; Y455-Y519 HydrophobicContact CE2-CD2 3.74Å; Y455-Y519 AromaticContact CE2-CE2 3.83Å; Y455-Y519 HydrophobicContact CE2-CE2 3.83Å; Y504-Y519 HydrophobicContact CD1-CD1 4.18Å; Y504-Y519 AromaticContact CD1-CE1 3.88Å; Y504-Y519 HydrophobicContact CD1-CE1 3.88Å; R505-Y519 VanDerWaalsContact CA-O 3.28Å; R505-Y519 WeakPolarHBondContact CA-O 3.39Å; C506-Y519 PolarHBondContact N-O 2.98Å; C506-Y519 VanDerWaalsContact N-O 3.16Å; C506-Y519 PolarHBondContact O-N 3.23Å; Y519-A521 HydrophobicContact CE1-CB 3.61Å; Y519-F533 HydrophobicContact CE2-CB 4.25Å; Y519-F533 HydrophobicContact CE2-CD2 4.32Å; Y519-V535 HydrophobicContact CD2-CG2 3.5Å; Y519-V535 VanDerWaalsContact CD2-CG2 3.5Å; Y519-V535 HydrophobicContact CE2-CG2 4.32Å; Y519-V535 HydrophobicContact CG-CG2 4.2Å
520	I	98.6	Very high	95.1	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	134.1	176.5	-57	-64.5	0	0	0	108.5	R505 F533 Y534 L743 F744 Y755 E773 I778	R505-I520 HydrophobicContact CB-CD1 3.65Å; I520-F533 CarbonylContact O-C 3.41Å; I520-F533 VanDerWaalsContact O-CA 3.26Å; I520-F533 WeakPolarHBondContact O-CA 3.45Å; I520-Y534 PolarHBondContact N-O 3.5Å; I520-Y534 PolarHBondContact O-N 3.35Å; I520-L743 HydrophobicContact CG2-CD1 3.63Å; I520-F744 HydrophobicContact CG2-CE2 4.29Å; I520-Y755 HydrophobicContact CB-CE2 4.28Å; I520-Y755 HydrophobicContact CG1-CE2 4.39Å; I520-Y755 HydrophobicContact CG2-CD2 4.36Å; I520-Y755 HydrophobicContact CG2-CE2 3.82Å; I520-E773 HydrophobicContact CD1-CG 4.04Å; I520-I778 HydrophobicContact CG1-CD1 3.83Å; I520-I778 HydrophobicContact CG1-CG1 4.11Å
521	A	98.6	Very high	95.2	Very high	1 Å²	1	43 Å²	43	1%	0.008	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	150.4	173.9	0	0	0	0	0	112.7	L448 T503 Y504 Y519 A532 F533	L448-A521 HydrophobicContact CB-CB 4.21Å; L448-A521 HydrophobicContact CD2-CB 4.29Å; T503-A521 CarbonylContact C-O 3.59Å; T503-A521 VanDerWaalsContact CA-O 3.25Å; T503-A521 WeakPolarHBondContact CA-O 3.41Å; Y504-A521 PolarHBondContact N-O 3.02Å; Y504-A521 PolarHBondContact O-N 2.93Å; Y519-A521 HydrophobicContact CE1-CB 3.61Å; A521-A532 CarbonylContact C-O 3.56Å; A521-A532 VanDerWaalsContact CA-O 3.25Å; A521-A532 WeakPolarHBondContact CA-O 3.35Å; A521-A532 WeakPolarHBondContact CB-O 3.27Å; A521-F533 HydrophobicContact CB-CB 3.87Å
522	E	98.6	Very high	95.5	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.6	176.4	-172.9	178.3	179	0	0	111.3	E502 T503 V524 A532 P741 A742 L743 F744	E502-E522 CarbonylContact O-C 3.6Å; E502-E522 WeakPolarHBondContact O-CA 3.45Å; T503-E522 HydrophobicContact CG2-CB 4.18Å; T503-E522 HydrophobicContact CG2-CG 3.97Å; E522-V524 VanDerWaalsContact C-N 3.31Å; E522-V524 HydrophobicContact CB-CG1 4.24Å; E522-V524 HydrophobicContact CG-CG1 4.36Å; E522-V524 PolarHBondContact O-N 3.28Å; E522-A532 PolarHBondContact N-O 3.08Å; E522-A532 PolarHBondContact O-N 2.84Å; E522-P741 WeakPolarHBondContact OE1-CA 3.25Å; E522-P741 VanDerWaalsContact OE1-CB 3.27Å; E522-P741 WeakPolarHBondContact OE1-CB 3.27Å; E522-P741 WeakPolarHBondContact OE2-CB 3.46Å; E522-A742 PolarHBondContact OE1-N 3.25Å; E522-A742 PolarHBondContact OE2-N 3.39Å; E522-A742 VanDerWaalsContact OE2-N 3.14Å; E522-L743 PolarHBondContact OE2-N 3.49Å; E522-F744 HydrophobicContact CB-CD2 3.59Å; E522-F744 HydrophobicContact CB-CE2 3.78Å; E522-F744 PolarHBondContact OE2-N 2.79Å
523	Q	98.4	Very high	95.9	Very high	1 Å²	1	27.6 Å²	27.6	1%	0.005	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	79.7	168.7	-167.9	67.6	25.8	0	0	111	P498 I499 G501 E502 S525 V530 S531	P498-Q523 HydrophobicContact CB-CB 3.87Å; P498-Q523 HydrophobicContact CB-CG 3.82Å; I499-Q523 WeakPolarHBondContact O-CB 3.23Å; I499-Q523 WeakPolarHBondContact O-CG 3.35Å; G501-Q523 PolarHBondContact N-O 2.97Å; G501-Q523 VanDerWaalsContact N-O 3.12Å; E502-Q523 HydrophobicContact CB-CB 4.3Å; E502-Q523 PolarHBondContact O-N 2.83Å; Q523-S525 VanDerWaalsContact C-N 3.31Å; Q523-S525 PolarHBondContact NE2-O 2.76Å; Q523-S525 PolarHBondContact O-N 2.93Å; Q523-V530 PolarHBondContact NE2-O 3.12Å; Q523-V530 VanDerWaalsContact NE2-O 3.11Å; Q523-S531 PolarHBondContact OE1-OG 2.97Å
524	V	97.6	Very high	96.1	Very high	6 Å²	6	25 Å²	25	4%	0.036	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	-27.9	-175.4	-61.9	0	0	0	0	114.3	E522 V530 A532 P741 F744 W753	E522-V524 VanDerWaalsContact C-N 3.31Å; E522-V524 HydrophobicContact CB-CG1 4.24Å; E522-V524 HydrophobicContact CG-CG1 4.36Å; E522-V524 PolarHBondContact O-N 3.28Å; V524-V530 HydrophobicContact CG2-CB 3.98Å; V524-V530 HydrophobicContact CG2-CG1 3.77Å; V524-V530 WeakPolarHBondContact CG2-O 3.27Å; V524-V530 PolarHBondContact N-O 3.03Å; V524-A532 HydrophobicContact CB-CB 4.5Å; V524-A532 HydrophobicContact CG1-CB 3.6Å; V524-A532 HydrophobicContact CG2-CB 4.01Å; V524-P741 HydrophobicContact CB-CB 4.23Å; V524-P741 HydrophobicContact CB-CG 3.81Å; V524-P741 HydrophobicContact CG1-CB 3.9Å; V524-P741 HydrophobicContact CG1-CG 4.04Å; V524-F744 HydrophobicContact CG1-CB 3.75Å; V524-F744 HydrophobicContact CG1-CD2 4.31Å; V524-F744 HydrophobicContact CG1-CG 4.16Å; V524-W753 HydrophobicContact CB-CD2 4.04Å; V524-W753 HydrophobicContact CB-CE3 3.93Å; V524-W753 HydrophobicContact CB-CH2 3.91Å; V524-W753 HydrophobicContact CB-CZ2 4.02Å; V524-W753 HydrophobicContact CB-CZ3 3.87Å; V524-W753 HydrophobicContact CG1-CD2 4.24Å; V524-W753 HydrophobicContact CG1-CE3 3.89Å; V524-W753 HydrophobicContact CG1-CZ3 4.11Å; V524-W753 HydrophobicContact CG2-CD2 3.73Å; V524-W753 HydrophobicContact CG2-CE3 4.16Å; V524-W753 HydrophobicContact CG2-CG 4.16Å; V524-W753 HydrophobicContact CG2-CH2 4.3Å; V524-W753 HydrophobicContact CG2-CZ2 3.89Å; V524-W753 HydrophobicContact CG2-CZ3 4.43Å
525	S	95.1	Very high	96.4	Very high	34 Å²	34	18.5 Å²	18.5	24%	0.238	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	154.7	172.5	-168.6	0	0	0	0	112.1	Q523 P528 P529 V530	Q523-S525 VanDerWaalsContact C-N 3.31Å; Q523-S525 PolarHBondContact NE2-O 2.76Å; Q523-S525 PolarHBondContact O-N 2.93Å; S525-P528 CarbonylContact C-O 3.53Å; S525-P528 WeakPolarHBondContact CB-O 3.45Å; S525-P528 PolarHBondContact OG-O 2.63Å; S525-P528 VanDerWaalsContact OG-O 3.09Å; S525-P529 WeakPolarHBondContact O-CA 3.37Å; S525-V530 PolarHBondContact N-O 2.98Å; S525-V530 VanDerWaalsContact N-O 3.15Å; S525-V530 PolarHBondContact O-N 3.09Å
526	H	91.3	Very high	96.5	Very high	37 Å²	37	18.2 Å²	18.2	17%	0.171	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	-24.1	-179	-174.5	88.8	0	0	0	113.3	N497 P498 I500 P528 Q725	N497-H526 PolarHBondContact ND2-CE1 3.02Å; P498-H526 PolarHBondContact O-ND1 3.14Å; I500-H526 HydrophobicContact CB-CB 4.06Å; I500-H526 HydrophobicContact CD1-CB 4.18Å; H526-P528 CarbonylContact C-O 3.51Å; H526-P528 PolarHBondContact N-O 3.31Å; H526-P528 CarbonylContact O-C 3.5Å; H526-Q725 PolarHBondContact CD2-NE2 2.94Å; H526-Q725 PolarHBondContact CE1-NE2 3.31Å; H526-Q725 VanDerWaalsContact CE1-NE2 3.31Å; H526-Q725 PolarHBondContact CE1-OE1 3.34Å; H526-Q725 PolarHBondContact ND1-NE2 3.19Å; H526-Q725 VanDerWaalsContact ND1-NE2 3.14Å; H526-Q725 PolarHBondContact NE2-NE2 2.98Å
527	H	87.8	Confident	96.6	Very high	141 Å²	141	16.6 Å²	16.6	65%	0.653	9%	0.09	S	C	*	.	T	Hydrogen-bonded Turn	trans	-137.8	87.4	177.8	-75.4	-5.5	0	0	0	110.4
528	P	90.1	Very high	96.6	Very high	74 Å²	74	16.6 Å²	16.6	48%	0.481	9%	0.09	S	C	.	.	T	Hydrogen-bonded Turn	cis	-74.5	156.8	2.5	34.1	-37.6	0	0	0	112.8	S525 H526 V530 L549	S525-P528 CarbonylContact C-O 3.53Å; S525-P528 WeakPolarHBondContact CB-O 3.45Å; S525-P528 PolarHBondContact OG-O 2.63Å; S525-P528 VanDerWaalsContact OG-O 3.09Å; H526-P528 CarbonylContact C-O 3.51Å; H526-P528 PolarHBondContact N-O 3.31Å; H526-P528 CarbonylContact O-C 3.5Å; P528-V530 PolarHBondContact O-N 3.45Å; P528-L549 HydrophobicContact CB-CD1 3.66Å; P528-L549 HydrophobicContact CG-CD1 4.23Å
529	P	93.2	Very high	96.5	Very high	15 Å²	15	20.5 Å²	20.5	10%	0.097	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	114.8	-177.8	31	-34.1	0	0	0	110.9	S525 L549 A550	S525-P529 WeakPolarHBondContact O-CA 3.37Å; P529-L549 WeakPolarHBondContact O-CA 3.34Å; P529-L549 WeakPolarHBondContact O-CD1 3.35Å; P529-A550 HydrophobicContact CG-CB 4.35Å; P529-A550 VanDerWaalsContact CG-O 3.27Å; P529-A550 WeakPolarHBondContact CG-O 3.19Å; P529-A550 PolarHBondContact O-N 2.89Å; P529-A550 VanDerWaalsContact O-N 3.09Å
530	V	96.6	Very high	96.4	Very high	17 Å²	17	21.1 Å²	21.1	10%	0.103	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	124.4	177.3	-175.5	0	0	0	0	109	Q523 V524 S525 P528 I548 L549	Q523-V530 PolarHBondContact NE2-O 3.12Å; Q523-V530 VanDerWaalsContact NE2-O 3.11Å; V524-V530 HydrophobicContact CG2-CB 3.98Å; V524-V530 HydrophobicContact CG2-CG1 3.77Å; V524-V530 WeakPolarHBondContact CG2-O 3.27Å; V524-V530 PolarHBondContact N-O 3.03Å; S525-V530 PolarHBondContact N-O 2.98Å; S525-V530 VanDerWaalsContact N-O 3.15Å; S525-V530 PolarHBondContact O-N 3.09Å; P528-V530 PolarHBondContact O-N 3.45Å; V530-I548 WeakPolarHBondContact CA-O 3.36Å; V530-L549 HydrophobicContact CG2-CB 4.27Å; V530-L549 HydrophobicContact CG2-CD1 4.21Å
531	S	98	Very high	96.4	Very high	2 Å²	2	21.1 Å²	21.1	1%	0.014	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	124.6	171.4	-47.2	0	0	0	0	108.2	F447 Q523 S547 I548	F447-S531 WeakPolarHBondContact CD1-OG 3.46Å; Q523-S531 PolarHBondContact OE1-OG 2.97Å; S531-S547 CarbonylContact O-C 3.47Å; S531-S547 VanDerWaalsContact O-CA 3.27Å; S531-S547 WeakPolarHBondContact O-CA 3.35Å; S531-I548 PolarHBondContact N-O 3.2Å; S531-I548 PolarHBondContact O-N 3.17Å
532	A	98.3	Very high	96.4	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	147.7	172.5	0	0	0	0	0	109.9	A521 E522 V524 F744 W753	A521-A532 CarbonylContact C-O 3.56Å; A521-A532 VanDerWaalsContact CA-O 3.25Å; A521-A532 WeakPolarHBondContact CA-O 3.35Å; A521-A532 WeakPolarHBondContact CB-O 3.27Å; E522-A532 PolarHBondContact N-O 3.08Å; E522-A532 PolarHBondContact O-N 2.84Å; V524-A532 HydrophobicContact CB-CB 4.5Å; V524-A532 HydrophobicContact CG1-CB 3.6Å; V524-A532 HydrophobicContact CG2-CB 4.01Å; A532-F744 HydrophobicContact CB-CB 4.41Å; A532-F744 HydrophobicContact CB-CD1 3.58Å; A532-F744 HydrophobicContact CB-CD2 4.23Å; A532-F744 HydrophobicContact CB-CE1 3.82Å; A532-F744 HydrophobicContact CB-CE2 4.46Å; A532-F744 HydrophobicContact CB-CG 3.82Å; A532-F744 HydrophobicContact CB-CZ 4.28Å; A532-W753 HydrophobicContact CB-CB 3.92Å; A532-W753 HydrophobicContact CB-CG 4.33Å
533	F	98.4	Very high	96.3	Very high	10 Å²	10	21.3 Å²	21.3	4%	0.044	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	153.2	178.6	62.7	-81.8	0	0	0	112.2	L451 Y519 I520 A521 L544 G546 I548 A567	L451-F533 HydrophobicContact CD1-CD1 4.35Å; Y519-F533 HydrophobicContact CE2-CB 4.25Å; Y519-F533 HydrophobicContact CE2-CD2 4.32Å; I520-F533 CarbonylContact O-C 3.41Å; I520-F533 VanDerWaalsContact O-CA 3.26Å; I520-F533 WeakPolarHBondContact O-CA 3.45Å; A521-F533 HydrophobicContact CB-CB 3.87Å; F533-L544 HydrophobicContact CD2-CD2 4.27Å; F533-L544 HydrophobicContact CE2-CD2 3.58Å; F533-L544 HydrophobicContact CZ-CD2 4.47Å; F533-G546 PolarHBondContact N-O 3.23Å; F533-G546 PolarHBondContact O-N 2.62Å; F533-I548 HydrophobicContact CE1-CD1 3.75Å; F533-I548 HydrophobicContact CE1-CG1 4.04Å; F533-I548 HydrophobicContact CZ-CD1 4.29Å; F533-A567 HydrophobicContact CZ-CB 4.19Å
534	Y	98.6	Very high	96.3	Very high	6 Å²	6	21.2 Å²	21.2	2%	0.024	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	139.4	178	-177.8	-103.6	0	0	0	110.2	I520 C543 L544 Y755 A758 I778	I520-Y534 PolarHBondContact N-O 3.5Å; I520-Y534 PolarHBondContact O-N 3.35Å; Y534-C543 HydrophobicContact CE2-CB 4.18Å; Y534-L544 CarbonylContact C-O 3.56Å; Y534-L544 WeakPolarHBondContact CA-O 3.24Å; Y534-L544 WeakPolarHBondContact CD2-O 3.39Å; Y534-Y755 AromaticContact CD1-CD1 3.22Å; Y534-Y755 HydrophobicContact CD1-CD1 3.22Å; Y534-Y755 AromaticContact CD1-CE1 3.65Å; Y534-Y755 HydrophobicContact CD1-CE1 3.65Å; Y534-Y755 AromaticContact CD1-CG 3.81Å; Y534-Y755 HydrophobicContact CD1-CG 3.81Å; Y534-Y755 HydrophobicContact CD2-CD1 4.4Å; Y534-Y755 AromaticContact CE1-CD1 3.59Å; Y534-Y755 HydrophobicContact CE1-CD1 3.59Å; Y534-Y755 AromaticContact CE1-CE1 3.94Å; Y534-Y755 HydrophobicContact CE1-CE1 3.94Å; Y534-Y755 AromaticContact CG-CD1 3.68Å; Y534-Y755 HydrophobicContact CG-CD1 3.68Å; Y534-Y755 HydrophobicContact CG-CE1 4.48Å; Y534-Y755 AromaticContact CG-CG 3.82Å; Y534-Y755 HydrophobicContact CG-CG 3.82Å; Y534-A758 HydrophobicContact CE1-CB 4.44Å; Y534-A758 HydrophobicContact CE2-CB 3.92Å; Y534-I778 HydrophobicContact CD1-CD1 4.02Å; Y534-I778 HydrophobicContact CE1-CD1 4.14Å
535	V	98.6	Very high	96.3	Very high	0 Å²	0	22 Å²	22	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	136.9	-179.9	-176.3	0	0	0	0	109.2	Y455 T517 F518 Y519 C543 L544	Y455-V535 HydrophobicContact CD1-CG1 4Å; Y455-V535 HydrophobicContact CD1-CG2 4.32Å; Y455-V535 HydrophobicContact CE1-CB 4.18Å; Y455-V535 HydrophobicContact CE1-CG1 3.98Å; Y455-V535 HydrophobicContact CE1-CG2 3.76Å; Y455-V535 HydrophobicContact CE2-CG2 4.03Å; T517-V535 HydrophobicContact CG2-CG1 3.61Å; F518-V535 CarbonylContact O-C 3.56Å; F518-V535 WeakPolarHBondContact O-CA 3.33Å; F518-V535 WeakPolarHBondContact O-CG1 3.37Å; Y519-V535 HydrophobicContact CD2-CG2 3.5Å; Y519-V535 VanDerWaalsContact CD2-CG2 3.5Å; Y519-V535 HydrophobicContact CE2-CG2 4.32Å; Y519-V535 HydrophobicContact CG-CG2 4.2Å; V535-C543 CarbonylContact O-C 3.58Å; V535-C543 VanDerWaalsContact O-CA 3.23Å; V535-C543 WeakPolarHBondContact O-CA 3.39Å; V535-C543 WeakPolarHBondContact O-CB 3.26Å; V535-L544 HydrophobicContact CB-CB 4.3Å; V535-L544 PolarHBondContact N-O 3.29Å; V535-L544 PolarHBondContact O-N 2.98Å
536	S	98.3	Very high	96.3	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.007	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	132	-179.3	177	0	0	0	0	111.7	T517 F518 Q771	T517-S536 WeakPolarHBondContact CA-O 3.49Å; F518-S536 PolarHBondContact N-O 3.48Å; F518-S536 PolarHBondContact O-N 3.46Å; S536-Q771 VanDerWaalsContact OG-CD 3.28Å; S536-Q771 PolarHBondContact OG-NE2 3.16Å; S536-Q771 PolarHBondContact OG-OE1 3.22Å
537	N	98.3	Very high	96.6	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	81.2	154.4	-170.5	-25.2	0	0	0	107.2	H510 S515 K516 T517 K539 D540 G541 F542	H510-N537 PolarHBondContact ND1-ND2 3.09Å; S515-N537 WeakPolarHBondContact CB-OD1 3.39Å; S515-N537 PolarHBondContact OG-ND2 3.22Å; S515-N537 PolarHBondContact OG-OD1 2.62Å; K516-N537 PolarHBondContact O-ND2 3.34Å; T517-N537 WeakPolarHBondContact OG1-CB 3.43Å; T517-N537 PolarHBondContact OG1-ND2 2.97Å; N537-K539 PolarHBondContact O-N 3.24Å; N537-D540 HydrophobicContact CB-CB 4.41Å; N537-D540 PolarHBondContact O-N 2.84Å; N537-D540 PolarHBondContact OD1-N 3.06Å; N537-G541 PolarHBondContact O-N 3.11Å; N537-G541 VanDerWaalsContact O-N 3.12Å; N537-F542 CarbonylContact C-O 3.55Å; N537-F542 VanDerWaalsContact C-O 3.28Å; N537-F542 HydrophobicContact CB-CD1 4.28Å; N537-F542 HydrophobicContact CB-CE1 3.71Å; N537-F542 HydrophobicContact CB-CE2 4.15Å; N537-F542 HydrophobicContact CB-CZ 3.64Å; N537-F542 PolarHBondContact N-O 3.45Å; N537-F542 PolarHBondContact O-N 3.13Å; N537-F542 VanDerWaalsContact O-N 3.17Å; N537-F542 VanDerWaalsContact O-O 3.12Å
538	R	96.6	Very high	97	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-38.3	-177.7	-79.4	-175.2	68.4	-129.9	-7.5	111.1	G541 L572 D759 R761 P762 W763 D768 T780	R538-G541 WeakPolarHBondContact O-CA 3.43Å; R538-G541 PolarHBondContact O-N 2.95Å; R538-L572 HydrophobicContact CB-CD1 4.18Å; R538-L572 HydrophobicContact CG-CD1 3.88Å; R538-D759 WeakPolarHBondContact CD-O 3.2Å; R538-D759 IonicContact CZ-OD2 2.76Å; R538-D759 VanDerWaalsContact CZ-OD2 3.31Å; R538-D759 IonicContact NE-OD1 2.75Å; R538-D759 IonicContact NE-OD2 3.91Å; R538-D759 PolarHBondContact NE-OD2 3.14Å; R538-D759 IonicContact NH1-OD2 3.62Å; R538-D759 PolarHBondContact NH1-OD2 3.08Å; R538-R761 PolarHBondContact NE-O 2.89Å; R538-R761 PolarHBondContact NH2-O 2.68Å; R538-P762 PolarHBondContact NH2-O 2.85Å; R538-W763 HydrophobicContact CB-CE3 3.84Å; R538-W763 HydrophobicContact CB-CZ3 4.46Å; R538-W763 WeakPolarHBondContact O-CB 3.35Å; R538-D768 IonicContact CZ-OD1 2.75Å; R538-D768 IonicContact CZ-OD2 2.95Å; R538-D768 VanDerWaalsContact NH1-CG 3.27Å; R538-D768 IonicContact NH1-OD1 3.58Å; R538-D768 PolarHBondContact NH1-OD1 3.16Å; R538-D768 IonicContact NH1-OD2 3.81Å; R538-D768 PolarHBondContact NH1-OD2 2.98Å; R538-D768 IonicContact NH2-OD1 2.78Å; R538-D768 IonicContact NH2-OD2 3.69Å; R538-D768 PolarHBondContact NH2-OD2 3.02Å; R538-T780 PolarHBondContact NH1-OG1 3.26Å; R538-T780 VanDerWaalsContact NH1-OG1 3.09Å
539	K	96.6	Very high	97.2	Very high	82 Å²	82	11.9 Å²	11.9	36%	0.357	7%	0.066	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-40.4	-177.3	-171.7	175.1	-179.7	-125.3	0	112.9	T513 N514 N537 G541 W763	T513-K539 PolarHBondContact O-NZ 3.4Å; N514-K539 PolarHBondContact O-NZ 2.87Å; N537-K539 PolarHBondContact O-N 3.24Å; K539-G541 PolarHBondContact O-N 3.42Å; K539-W763 HydrophobicContact CB-CD2 3.97Å; K539-W763 HydrophobicContact CB-CE3 3.97Å; K539-W763 HydrophobicContact CB-CH2 4.43Å; K539-W763 HydrophobicContact CB-CZ2 4.44Å; K539-W763 HydrophobicContact CB-CZ3 4.22Å; K539-W763 HydrophobicContact CD-CZ2 4.27Å; K539-W763 HydrophobicContact CG-CD2 4.22Å; K539-W763 HydrophobicContact CG-CZ2 4.28Å
540	D	97.5	Very high	97.2	Very high	14 Å²	14	12.5 Å²	12.5	8%	0.075	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	3.6	172.6	-68.6	20	0	0	0	112.3	S462 A465 H510 T513 S515 N537 F542	S462-D540 WeakPolarHBondContact CB-OD2 3.38Å; S462-D540 PolarHBondContact OG-OD2 2.78Å; A465-D540 VanDerWaalsContact CB-O 3.25Å; A465-D540 WeakPolarHBondContact CB-O 3.5Å; H510-D540 IonicContact CE1-OD2 2.66Å; H510-D540 IonicContact CG-OD2 2.82Å; H510-D540 IonicContact ND1-OD2 3.55Å; H510-D540 PolarHBondContact ND1-OD2 2.86Å; T513-D540 WeakPolarHBondContact CB-OD1 3.18Å; T513-D540 PolarHBondContact OG1-OD1 3.16Å; T513-D540 VanDerWaalsContact OG1-OD1 3.14Å; T513-D540 PolarHBondContact OG1-OD2 2.97Å; S515-D540 WeakPolarHBondContact CB-OD1 3.22Å; S515-D540 PolarHBondContact OG-OD1 2.85Å; S515-D540 PolarHBondContact OG-OD2 3.39Å; N537-D540 HydrophobicContact CB-CB 4.41Å; N537-D540 PolarHBondContact O-N 2.84Å; N537-D540 PolarHBondContact OD1-N 3.06Å; D540-F542 HydrophobicContact CB-CD1 4.23Å; D540-F542 HydrophobicContact CB-CE1 4.02Å
541	G	97.3	Very high	96.8	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.01	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.7	18.9	166.4	0	0	0	0	0	116.1	N537 R538 K539 F571 L572	N537-G541 PolarHBondContact O-N 3.11Å; N537-G541 VanDerWaalsContact O-N 3.12Å; R538-G541 WeakPolarHBondContact O-CA 3.43Å; R538-G541 PolarHBondContact O-N 2.95Å; K539-G541 PolarHBondContact O-N 3.42Å; G541-F571 CarbonylContact O-C 3.54Å; G541-F571 WeakPolarHBondContact O-CA 3.43Å; G541-L572 PolarHBondContact O-N 2.67Å
542	F	98.4	Very high	96.4	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	149.4	179.8	72	-90.4	0	0	0	114.7	A458 L461 T517 N537 D540 L569 T570 F571	A458-F542 HydrophobicContact CB-CZ 4.33Å; L461-F542 HydrophobicContact CB-CD1 3.91Å; L461-F542 HydrophobicContact CB-CD2 4.1Å; L461-F542 HydrophobicContact CB-CE1 3.8Å; L461-F542 HydrophobicContact CB-CE2 4Å; L461-F542 HydrophobicContact CB-CG 4.07Å; L461-F542 HydrophobicContact CB-CZ 3.85Å; L461-F542 HydrophobicContact CD1-CD2 3.9Å; L461-F542 HydrophobicContact CD1-CE2 3.65Å; L461-F542 HydrophobicContact CD1-CZ 4.2Å; L461-F542 HydrophobicContact CG-CE2 4.5Å; T517-F542 HydrophobicContact CG2-CE2 4.34Å; T517-F542 HydrophobicContact CG2-CZ 4.25Å; N537-F542 CarbonylContact C-O 3.55Å; N537-F542 VanDerWaalsContact C-O 3.28Å; N537-F542 HydrophobicContact CB-CD1 4.28Å; N537-F542 HydrophobicContact CB-CE1 3.71Å; N537-F542 HydrophobicContact CB-CE2 4.15Å; N537-F542 HydrophobicContact CB-CZ 3.64Å; N537-F542 PolarHBondContact N-O 3.45Å; N537-F542 PolarHBondContact O-N 3.13Å; N537-F542 VanDerWaalsContact O-N 3.17Å; N537-F542 VanDerWaalsContact O-O 3.12Å; D540-F542 HydrophobicContact CB-CD1 4.23Å; D540-F542 HydrophobicContact CB-CE1 4.02Å; F542-L569 HydrophobicContact CB-CD1 4.26Å; F542-L569 HydrophobicContact CD2-CD1 4.38Å; F542-T570 WeakPolarHBondContact CA-O 3.22Å; F542-F571 HydrophobicContact CB-CD1 3.94Å; F542-F571 HydrophobicContact CB-CE1 4.17Å
543	C	98.1	Very high	95.8	Very high	5 Å²	5	21.4 Å²	21.4	3%	0.034	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	162.8	159.5	70.2	0	0	0	0	110	Y534 V535 T570 L572	Y534-C543 HydrophobicContact CE2-CB 4.18Å; V535-C543 CarbonylContact O-C 3.58Å; V535-C543 VanDerWaalsContact O-CA 3.23Å; V535-C543 WeakPolarHBondContact O-CA 3.39Å; V535-C543 WeakPolarHBondContact O-CB 3.26Å; C543-T570 PolarHBondContact N-O 2.99Å; C543-T570 VanDerWaalsContact N-O 3.12Å; C543-T570 PolarHBondContact O-N 2.84Å; C543-L572 HydrophobicContact CB-CD2 4.35Å
544	L	98.2	Very high	95.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	129.8	175.8	-173.3	163	0	0	0	109.6	Y455 W480 F533 Y534 V535 A567 R568 L569	Y455-L544 HydrophobicContact CE1-CD1 4.22Å; Y455-L544 WeakPolarHBondContact OH-CD2 3.06Å; W480-L544 HydrophobicContact CH2-CD1 3.44Å; W480-L544 VanDerWaalsContact CH2-CD1 3.44Å; W480-L544 HydrophobicContact CZ2-CD1 4.22Å; W480-L544 HydrophobicContact CZ3-CD1 3.99Å; F533-L544 HydrophobicContact CD2-CD2 4.27Å; F533-L544 HydrophobicContact CE2-CD2 3.58Å; F533-L544 HydrophobicContact CZ-CD2 4.47Å; Y534-L544 CarbonylContact C-O 3.56Å; Y534-L544 WeakPolarHBondContact CA-O 3.24Å; Y534-L544 WeakPolarHBondContact CD2-O 3.39Å; V535-L544 HydrophobicContact CB-CB 4.3Å; V535-L544 PolarHBondContact N-O 3.29Å; V535-L544 PolarHBondContact O-N 2.98Å; L544-A567 HydrophobicContact CD2-CB 4.09Å; L544-R568 CarbonylContact C-O 3.53Å; L544-R568 VanDerWaalsContact CA-O 3.27Å; L544-R568 WeakPolarHBondContact CA-O 3.35Å; L544-L569 HydrophobicContact CB-CD1 4.3Å; L544-L569 HydrophobicContact CD1-CB 3.98Å; L544-L569 HydrophobicContact CD1-CD1 4.32Å; L544-L569 HydrophobicContact CG-CB 4.17Å
545	S	97	Very high	94.6	Very high	22 Å²	22	25.8 Å²	25.8	15%	0.154	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	152.4	173.5	57.9	0	0	0	0	110.9	A567 R568	S545-A567 CarbonylContact O-C 3.55Å; S545-A567 WeakPolarHBondContact O-CA 3.49Å; S545-R568 PolarHBondContact N-O 3.15Å; S545-R568 PolarHBondContact O-N 3.41Å
546	G	96.3	Very high	94	Very high	7 Å²	7	26.4 Å²	26.4	7%	0.072	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	163.8	175.1	0	0	0	0	0	113.9	F533 E566	F533-G546 PolarHBondContact N-O 3.23Å; F533-G546 PolarHBondContact O-N 2.62Å; G546-E566 WeakPolarHBondContact CA-O 3.26Å
547	S	96.5	Very high	93.3	Very high	26 Å²	26	28.1 Å²	28.1	18%	0.182	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	138.9	167.5	67.1	0	0	0	0	111.4	S531 E566	S531-S547 CarbonylContact O-C 3.47Å; S531-S547 VanDerWaalsContact O-CA 3.27Å; S531-S547 WeakPolarHBondContact O-CA 3.35Å; S547-E566 PolarHBondContact N-O 3.04Å
548	I	96.1	Very high	92.8	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.015	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	120.6	-175.5	-69.4	165.1	0	0	0	109.8	F447 L451 V530 S531 F533 L563 D564 M582	F447-I548 HydrophobicContact CE1-CG2 4.06Å; F447-I548 HydrophobicContact CZ-CG2 4.01Å; L451-I548 HydrophobicContact CD1-CD1 4.07Å; L451-I548 HydrophobicContact CD2-CD1 3.53Å; L451-I548 HydrophobicContact CG-CD1 4.48Å; V530-I548 WeakPolarHBondContact CA-O 3.36Å; S531-I548 PolarHBondContact N-O 3.2Å; S531-I548 PolarHBondContact O-N 3.17Å; F533-I548 HydrophobicContact CE1-CD1 3.75Å; F533-I548 HydrophobicContact CE1-CG1 4.04Å; F533-I548 HydrophobicContact CZ-CD1 4.29Å; I548-L563 HydrophobicContact CG2-CB 3.89Å; I548-L563 HydrophobicContact CG2-CD2 3.98Å; I548-L563 HydrophobicContact CG2-CG 4.4Å; I548-D564 CarbonylContact C-O 3.6Å; I548-D564 WeakPolarHBondContact CA-O 3.06Å; I548-M582 HydrophobicContact CD1-CG 4.14Å
549	L	94.8	Very high	92.4	Very high	38 Å²	38	30.5 Å²	30.5	20%	0.199	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	104.9	172.8	165.8	48.8	0	0	0	109.4	P528 P529 V530 K551 D564	P528-L549 HydrophobicContact CB-CD1 3.66Å; P528-L549 HydrophobicContact CG-CD1 4.23Å; P529-L549 WeakPolarHBondContact O-CA 3.34Å; P529-L549 WeakPolarHBondContact O-CD1 3.35Å; V530-L549 HydrophobicContact CG2-CB 4.27Å; V530-L549 HydrophobicContact CG2-CD1 4.21Å; L549-K551 HydrophobicContact CD1-CG 4.31Å; L549-K551 VanDerWaalsContact CD2-CE 3.48Å; L549-K551 HydrophobicContact CG-CD 4.27Å; L549-K551 HydrophobicContact CG-CG 4.24Å; L549-K551 PolarHBondContact O-N 2.94Å; L549-D564 HydrophobicContact CB-CB 4.26Å; L549-D564 HydrophobicContact CG-CB 4.37Å; L549-D564 PolarHBondContact N-O 2.77Å; L549-D564 PolarHBondContact O-N 2.97Å
550	A	92	Very high	92.2	Very high	28 Å²	28	26.7 Å²	26.7	23%	0.231	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	112.5	-177.4	0	0	0	0	0	111.8	P529	P529-A550 HydrophobicContact CG-CB 4.35Å; P529-A550 VanDerWaalsContact CG-O 3.27Å; P529-A550 WeakPolarHBondContact CG-O 3.19Å; P529-A550 PolarHBondContact O-N 2.89Å; P529-A550 VanDerWaalsContact O-N 3.09Å
551	K	89.8	Confident	91.9	Very high	87 Å²	87	27.9 Å²	27.9	38%	0.378	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	127.4	179.3	-74.1	166.2	174.4	164.9	0	110.6	L549 I562 D564	L549-K551 HydrophobicContact CD1-CG 4.31Å; L549-K551 VanDerWaalsContact CD2-CE 3.48Å; L549-K551 HydrophobicContact CG-CD 4.27Å; L549-K551 HydrophobicContact CG-CG 4.24Å; L549-K551 PolarHBondContact O-N 2.94Å; K551-I562 HydrophobicContact CB-CB 4.19Å; K551-I562 PolarHBondContact N-O 2.79Å; K551-I562 PolarHBondContact O-N 3.3Å; K551-D564 HydrophobicContact CD-CB 4.23Å; K551-D564 IonicContact NZ-OD2 3.58Å; K551-D564 PolarHBondContact NZ-OD2 2.83Å
552	S	88	Confident	91.6	Very high	34 Å²	34	30.3 Å²	30.3	24%	0.238	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	142.3	174.4	-68.7	0	0	0	0	110.9	D431 S560	D431-S552 WeakPolarHBondContact CA-O 3.32Å; D431-S552 WeakPolarHBondContact OD1-CB 3.39Å; S552-S560 CarbonylContact C-O 3.56Å; S552-S560 WeakPolarHBondContact CA-O 3.42Å
553	K	87.4	Confident	91.4	Very high	84 Å²	84	31.9 Å²	31.9	37%	0.365	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	118.1	178.3	-172.9	167.9	167.8	-164.7	0	112.6	Y555 L559 S560 I562	K553-Y555 HydrophobicContact CB-CE2 4.18Å; K553-Y555 HydrophobicContact CD-CE1 4.22Å; K553-Y555 HydrophobicContact CD-CE2 4.41Å; K553-Y555 WeakPolarHBondContact CD-OH 3.11Å; K553-Y555 WeakPolarHBondContact CE-OH 3.21Å; K553-Y555 HydrophobicContact CG-CE1 4.29Å; K553-Y555 HydrophobicContact CG-CE2 3.98Å; K553-Y555 PolarHBondContact NZ-OH 2.93Å; K553-Y555 VanDerWaalsContact O-CD2 3.32Å; K553-Y555 WeakPolarHBondContact O-CD2 3.3Å; K553-Y555 VanDerWaalsContact O-CE2 3.3Å; K553-Y555 WeakPolarHBondContact O-CE2 3.38Å; K553-L559 WeakPolarHBondContact O-CD1 3.48Å; K553-S560 PolarHBondContact N-O 2.84Å; K553-S560 PolarHBondContact O-N 2.79Å; K553-I562 HydrophobicContact CB-CD1 4.36Å; K553-I562 HydrophobicContact CD-CD1 4.46Å
554	F	85.6	Confident	91.1	Very high	5 Å²	5	35 Å²	35	2%	0.022	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	141.5	179.1	-176.4	-111.7	0	0	0	112.1	L423 V426 G429 M430 L432 G556 L591	L423-F554 HydrophobicContact CB-CZ 4.35Å; L423-F554 HydrophobicContact CD1-CE2 3.96Å; L423-F554 HydrophobicContact CD1-CZ 4.36Å; L423-F554 HydrophobicContact CD2-CD2 4.05Å; L423-F554 HydrophobicContact CD2-CE2 3.57Å; L423-F554 HydrophobicContact CD2-CZ 4Å; L423-F554 HydrophobicContact CG-CE2 4.25Å; L423-F554 HydrophobicContact CG-CZ 4.46Å; V426-F554 HydrophobicContact CG2-CD1 3.47Å; V426-F554 VanDerWaalsContact CG2-CD1 3.47Å; V426-F554 HydrophobicContact CG2-CD2 4.31Å; V426-F554 HydrophobicContact CG2-CE1 3.47Å; V426-F554 VanDerWaalsContact CG2-CE1 3.47Å; V426-F554 HydrophobicContact CG2-CE2 4.32Å; V426-F554 HydrophobicContact CG2-CG 3.89Å; V426-F554 HydrophobicContact CG2-CZ 3.89Å; G429-F554 PolarHBondContact N-O 2.83Å; M430-F554 PolarHBondContact O-N 3.12Å; M430-F554 VanDerWaalsContact O-N 3.12Å; L432-F554 HydrophobicContact CD1-CB 4.09Å; L432-F554 HydrophobicContact CD1-CD2 4.23Å; L432-F554 HydrophobicContact CD1-CG 4.46Å; L432-F554 HydrophobicContact CD2-CB 3.91Å; L432-F554 HydrophobicContact CG-CB 3.95Å; F554-G556 WeakPolarHBondContact CE2-O 3.34Å; F554-G556 WeakPolarHBondContact CZ-O 3.2Å; F554-L591 HydrophobicContact CZ-CD1 4.4Å
555	Y	85.8	Confident	90.8	Very high	103 Å²	103	36.4 Å²	36.4	40%	0.404	21%	0.207	S	C	.	.			trans	-123.1	-0.8	-177	-64.5	-85.4	0	0	0	114	K553 S558 S560	K553-Y555 HydrophobicContact CB-CE2 4.18Å; K553-Y555 HydrophobicContact CD-CE1 4.22Å; K553-Y555 HydrophobicContact CD-CE2 4.41Å; K553-Y555 WeakPolarHBondContact CD-OH 3.11Å; K553-Y555 WeakPolarHBondContact CE-OH 3.21Å; K553-Y555 HydrophobicContact CG-CE1 4.29Å; K553-Y555 HydrophobicContact CG-CE2 3.98Å; K553-Y555 PolarHBondContact NZ-OH 2.93Å; K553-Y555 VanDerWaalsContact O-CD2 3.32Å; K553-Y555 WeakPolarHBondContact O-CD2 3.3Å; K553-Y555 VanDerWaalsContact O-CE2 3.3Å; K553-Y555 WeakPolarHBondContact O-CE2 3.38Å; Y555-S558 PolarHBondContact N-O 2.9Å; Y555-S560 WeakPolarHBondContact CE2-OG 3.44Å
556	G	84.8	Confident	90.6	Very high	13 Å²	13	41 Å²	41	13%	0.134	23%	0.226	C	C	.	.	S	Bend	trans	109.6	-103.5	-169	0	0	0	0	0	109.7	F554 S558 L591	F554-G556 WeakPolarHBondContact CE2-O 3.34Å; F554-G556 WeakPolarHBondContact CZ-O 3.2Å; G556-S558 PolarHBondContact O-N 2.91Å; G556-S558 VanDerWaalsContact O-N 3.15Å; G556-L591 VanDerWaalsContact C-CD1 3.44Å; G556-L591 VanDerWaalsContact O-CD1 3.24Å; G556-L591 WeakPolarHBondContact O-CD1 3.25Å; G556-L591 WeakPolarHBondContact O-CG 3.42Å
557	N	84.4	Confident	90.6	Very high	38 Å²	38	41 Å²	41	20%	0.203	23%	0.226	C	C	.	.	S	Bend	trans	-78.3	11.3	177.7	-159.1	30.8	0	0	0	114.4	K588 G589 I590 L591 Y592	N557-K588 CarbonylContact O-C 3.52Å; N557-G589 PolarHBondContact O-N 3.01Å; N557-G589 VanDerWaalsContact OD1-C 3.27Å; N557-I590 PolarHBondContact O-N 3.13Å; N557-I590 PolarHBondContact OD1-N 2.89Å; N557-L591 WeakPolarHBondContact OD1-CA 3.42Å; N557-L591 WeakPolarHBondContact OD1-CB 3.5Å; N557-L591 PolarHBondContact OD1-N 2.86Å; N557-Y592 HydrophobicContact CB-CD1 4.37Å; N557-Y592 HydrophobicContact CB-CE1 3.74Å; N557-Y592 HydrophobicContact CB-CE2 4.22Å; N557-Y592 WeakPolarHBondContact ND2-CD2 3.35Å; N557-Y592 VanDerWaalsContact ND2-CE2 3.27Å; N557-Y592 WeakPolarHBondContact ND2-CE2 3.29Å; N557-Y592 PolarHBondContact ND2-O 2.94Å; N557-Y592 PolarHBondContact OD1-N 2.94Å; N557-Y592 PolarHBondContact OD1-O 2.88Å
558	S	87.6	Confident	90.7	Very high	21 Å²	21	43 Å²	43	15%	0.147	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	160.8	177	57.2	0	0	0	0	113.2	Y555 G556 C587	Y555-S558 PolarHBondContact N-O 2.9Å; G556-S558 PolarHBondContact O-N 2.91Å; G556-S558 VanDerWaalsContact O-N 3.15Å; S558-C587 CarbonylContact C-O 3.59Å; S558-C587 WeakPolarHBondContact CA-O 3.25Å; S558-C587 WeakPolarHBondContact CB-O 3.24Å
559	L	88.9	Confident	90.8	Very high	29 Å²	29	42.9 Å²	42.9	15%	0.152	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	147	177.9	172.9	59.7	0	0	0	107.9	L432 K553 H586 C587 I590	L432-L559 HydrophobicContact CB-CD1 4.44Å; L432-L559 HydrophobicContact CD1-CD1 3.63Å; L432-L559 HydrophobicContact CD1-CD2 4.05Å; L432-L559 HydrophobicContact CD1-CG 4.42Å; L432-L559 HydrophobicContact CG-CD1 3.98Å; K553-L559 WeakPolarHBondContact O-CD1 3.48Å; L559-H586 WeakPolarHBondContact O-CA 3.3Å; L559-C587 PolarHBondContact N-O 2.88Å; L559-C587 PolarHBondContact O-N 3.34Å; L559-I590 HydrophobicContact CB-CD1 3.38Å
560	S	91.4	Very high	91	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.014	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	135.2	166	-51.3	0	0	0	0	111.7	S552 K553 Y555 A585 H586	S552-S560 CarbonylContact C-O 3.56Å; S552-S560 WeakPolarHBondContact CA-O 3.42Å; K553-S560 PolarHBondContact N-O 2.84Å; K553-S560 PolarHBondContact O-N 2.79Å; Y555-S560 WeakPolarHBondContact CE2-OG 3.44Å; S560-A585 CarbonylContact C-O 3.56Å; S560-A585 WeakPolarHBondContact CA-O 3.25Å; S560-H586 PolarHBondContact OG-ND1 2.84Å
561	A	91.3	Very high	91.3	Very high	39 Å²	39	40.9 Å²	40.9	32%	0.322	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	101.7	162	0	0	0	0	0	107.1	Y584 A585	A561-Y584 WeakPolarHBondContact O-CA 3.44Å; A561-Y584 WeakPolarHBondContact O-CB 3.47Å; A561-A585 HydrophobicContact CB-CB 4.45Å; A561-A585 PolarHBondContact N-O 3.02Å; A561-A585 PolarHBondContact O-N 2.88Å
562	I	92.4	Very high	91.6	Very high	52 Å²	52	37.3 Å²	37.3	27%	0.267	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	121.1	177.7	-59.6	167.7	0	0	0	107	K551 K553	K551-I562 HydrophobicContact CB-CB 4.19Å; K551-I562 PolarHBondContact N-O 2.79Å; K551-I562 PolarHBondContact O-N 3.3Å; K553-I562 HydrophobicContact CB-CD1 4.36Å; K553-I562 HydrophobicContact CD-CD1 4.46Å
563	L	93	Very high	92	Very high	33 Å²	33	40.6 Å²	40.6	17%	0.173	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	104.7	173.8	-55.9	-174.3	0	0	0	107	F447 I548 M582	F447-L563 HydrophobicContact CE2-CD2 4.27Å; F447-L563 HydrophobicContact CZ-CD1 4.33Å; F447-L563 HydrophobicContact CZ-CD2 3.81Å; I548-L563 HydrophobicContact CG2-CB 3.89Å; I548-L563 HydrophobicContact CG2-CD2 3.98Å; I548-L563 HydrophobicContact CG2-CG 4.4Å; L563-M582 HydrophobicContact CB-CB 3.94Å; L563-M582 HydrophobicContact CD1-CB 4.4Å
564	D	92.9	Very high	92.3	Very high	72 Å²	72	39 Å²	39	39%	0.385	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	148.4	-176.6	-166.7	16.4	0	0	0	110.1	I548 L549 K551	I548-D564 CarbonylContact C-O 3.6Å; I548-D564 WeakPolarHBondContact CA-O 3.06Å; L549-D564 HydrophobicContact CB-CB 4.26Å; L549-D564 HydrophobicContact CG-CB 4.37Å; L549-D564 PolarHBondContact N-O 2.77Å; L549-D564 PolarHBondContact O-N 2.97Å; K551-D564 HydrophobicContact CD-CB 4.23Å; K551-D564 IonicContact NZ-OD2 3.58Å; K551-D564 PolarHBondContact NZ-OD2 2.83Å
565	G	91.4	Very high	92.8	Very high	28 Å²	28	40.7 Å²	40.7	29%	0.289	23%	0.226	S	C	.	.	S	Bend	trans	106.1	179	-169.3	0	0	0	0	0	113.9
566	E	93.2	Very high	93.4	Very high	118 Å²	118	36.7 Å²	36.7	55%	0.551	21%	0.211	S	C	*	.			trans	-134.4	156.2	-167.8	-61.7	-174.7	162.4	0	0	111.6	G546 S547 V579 M580	G546-E566 WeakPolarHBondContact CA-O 3.26Å; S547-E566 PolarHBondContact N-O 3.04Å; E566-V579 HydrophobicContact CB-CG1 4.18Å; E566-V579 HydrophobicContact CG-CG1 4.48Å; E566-V579 VanDerWaalsContact OE2-CG1 3.26Å; E566-V579 WeakPolarHBondContact OE2-CG1 3.14Å; E566-M580 CarbonylContact C-O 3.41Å; E566-M580 WeakPolarHBondContact CA-O 3.18Å
567	A	96.3	Very high	94	Very high	9 Å²	9	38.7 Å²	38.7	7%	0.074	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	138.5	170.9	0	0	0	0	0	109.6	F533 L544 S545 V579 M580	F533-A567 HydrophobicContact CZ-CB 4.19Å; L544-A567 HydrophobicContact CD2-CB 4.09Å; S545-A567 CarbonylContact O-C 3.55Å; S545-A567 WeakPolarHBondContact O-CA 3.49Å; A567-V579 CarbonylContact O-C 3.52Å; A567-V579 WeakPolarHBondContact O-CA 3.36Å; A567-M580 HydrophobicContact CB-CG 4.06Å; A567-M580 PolarHBondContact N-O 3.27Å; A567-M580 PolarHBondContact O-N 3.18Å
568	R	97.7	Very high	94.7	Very high	67 Å²	67	36.9 Å²	36.9	25%	0.253	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	103.6	-176.9	179.9	-171.6	-60.3	-74.2	-4.5	108.4	L544 S545 D577 V579 E752	L544-R568 CarbonylContact C-O 3.53Å; L544-R568 VanDerWaalsContact CA-O 3.27Å; L544-R568 WeakPolarHBondContact CA-O 3.35Å; S545-R568 PolarHBondContact N-O 3.15Å; S545-R568 PolarHBondContact O-N 3.41Å; R568-D577 VanDerWaalsContact CD-OD2 3.28Å; R568-D577 WeakPolarHBondContact CD-OD2 3.47Å; R568-D577 HydrophobicContact CG-CB 4.48Å; R568-D577 WeakPolarHBondContact CG-OD2 3.35Å; R568-D577 IonicContact CZ-OD2 3.83Å; R568-D577 IonicContact NE-OD2 2.75Å; R568-D577 IonicContact NH1-OD2 3.49Å; R568-D577 PolarHBondContact NH1-OD2 3.16Å; R568-V579 HydrophobicContact CG-CG2 4.5Å; R568-E752 IonicContact CZ-OE1 2.88Å; R568-E752 IonicContact NE-OE2 2.71Å; R568-E752 IonicContact NH2-OE1 3.75Å; R568-E752 PolarHBondContact NH2-OE1 3.31Å; R568-E752 IonicContact NH2-OE2 2.82Å
569	L	98.6	Very high	95.2	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	123	171.6	166.7	69	0	0	0	108.7	L461 V477 F542 L544 F571 D577 Y578 M580	L461-L569 HydrophobicContact CD1-CD1 4.17Å; L461-L569 HydrophobicContact CD2-CD1 4.01Å; L461-L569 HydrophobicContact CD2-CD2 3.58Å; L461-L569 HydrophobicContact CD2-CG 4.47Å; V477-L569 HydrophobicContact CG1-CD2 3.9Å; V477-L569 HydrophobicContact CG2-CD2 3.87Å; F542-L569 HydrophobicContact CB-CD1 4.26Å; F542-L569 HydrophobicContact CD2-CD1 4.38Å; L544-L569 HydrophobicContact CB-CD1 4.3Å; L544-L569 HydrophobicContact CD1-CB 3.98Å; L544-L569 HydrophobicContact CD1-CD1 4.32Å; L544-L569 HydrophobicContact CG-CB 4.17Å; L569-F571 HydrophobicContact CD1-CE1 4.4Å; L569-F571 HydrophobicContact CD2-CE1 4.42Å; L569-F571 HydrophobicContact CD2-CE2 4.35Å; L569-F571 HydrophobicContact CD2-CZ 3.9Å; L569-F571 HydrophobicContact CG-CZ 4.4Å; L569-D577 CarbonylContact O-C 3.53Å; L569-D577 WeakPolarHBondContact O-CA 3.46Å; L569-Y578 PolarHBondContact N-O 3.15Å; L569-Y578 PolarHBondContact O-N 3.13Å; L569-M580 HydrophobicContact CB-CE 3.74Å; L569-M580 HydrophobicContact CD2-CE 4.33Å
570	T	98.5	Very high	95.6	Very high	24 Å²	24	36.3 Å²	36.3	15%	0.147	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	120	179.5	-56.3	0	0	0	0	110.4	F542 C543 L572 E576 D577	F542-T570 WeakPolarHBondContact CA-O 3.22Å; C543-T570 PolarHBondContact N-O 2.99Å; C543-T570 VanDerWaalsContact N-O 3.12Å; C543-T570 PolarHBondContact O-N 2.84Å; T570-L572 HydrophobicContact CG2-CD2 4.35Å; T570-L572 PolarHBondContact O-N 2.65Å; T570-E576 WeakPolarHBondContact CA-O 3.34Å; T570-D577 WeakPolarHBondContact CB-OD1 3.43Å; T570-D577 WeakPolarHBondContact CG2-OD1 3.34Å; T570-D577 PolarHBondContact OG1-OD1 3.15Å
571	F	98.6	Very high	95.8	Very high	1 Å²	1	38.3 Å²	38.3	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	102.1	167.9	-66.6	-53.4	0	0	0	109.6	L461 A464 A465 R473 V477 G541 F542 L569 N573 R574 G575 E576 Y578	L461-F571 WeakPolarHBondContact O-CE1 3.4Å; A464-F571 HydrophobicContact CB-CE1 3.96Å; A464-F571 HydrophobicContact CB-CE2 4.24Å; A464-F571 HydrophobicContact CB-CZ 3.43Å; A464-F571 VanDerWaalsContact CB-CZ 3.43Å; A465-F571 HydrophobicContact CB-CD1 3.62Å; A465-F571 HydrophobicContact CB-CE1 3.99Å; A465-F571 HydrophobicContact CB-CG 4.47Å; R473-F571 HydrophobicContact CG-CD2 4.31Å; R473-F571 HydrophobicContact CG-CE2 3.83Å; V477-F571 HydrophobicContact CG2-CE2 3.72Å; V477-F571 HydrophobicContact CG2-CZ 3.67Å; G541-F571 CarbonylContact O-C 3.54Å; G541-F571 WeakPolarHBondContact O-CA 3.43Å; F542-F571 HydrophobicContact CB-CD1 3.94Å; F542-F571 HydrophobicContact CB-CE1 4.17Å; L569-F571 HydrophobicContact CD1-CE1 4.4Å; L569-F571 HydrophobicContact CD2-CE1 4.42Å; L569-F571 HydrophobicContact CD2-CE2 4.35Å; L569-F571 HydrophobicContact CD2-CZ 3.9Å; L569-F571 HydrophobicContact CG-CZ 4.4Å; F571-N573 PolarHBondContact O-N 2.81Å; F571-R574 HydrophobicContact CB-CB 4.35Å; F571-R574 CarbonylContact O-C 3.48Å; F571-R574 PolarHBondContact O-N 2.96Å; F571-R574 VanDerWaalsContact O-N 3.07Å; F571-G575 PolarHBondContact O-N 3.33Å; F571-E576 PolarHBondContact N-O 3.05Å; F571-E576 PolarHBondContact O-N 3.27Å; F571-Y578 AromaticContact CD2-CD2 3.93Å; F571-Y578 HydrophobicContact CD2-CD2 3.93Å; F571-Y578 AromaticContact CD2-CE2 3.59Å; F571-Y578 HydrophobicContact CD2-CE2 3.59Å; F571-Y578 AromaticContact CE2-CD2 3.87Å; F571-Y578 HydrophobicContact CE2-CD2 3.87Å; F571-Y578 AromaticContact CE2-CE2 3.61Å; F571-Y578 HydrophobicContact CE2-CE2 3.61Å
572	L	96.8	Very high	96	Very high	11 Å²	11	37.6 Å²	37.6	6%	0.058	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-55.2	-51.8	-168.1	-53.8	177.4	0	0	0	111.7	R538 G541 C543 T570 R574 G575	R538-L572 HydrophobicContact CB-CD1 4.18Å; R538-L572 HydrophobicContact CG-CD1 3.88Å; G541-L572 PolarHBondContact O-N 2.67Å; C543-L572 HydrophobicContact CB-CD2 4.35Å; T570-L572 HydrophobicContact CG2-CD2 4.35Å; T570-L572 PolarHBondContact O-N 2.65Å; L572-R574 PolarHBondContact O-N 3.48Å; L572-R574 VanDerWaalsContact O-N 3.16Å; L572-G575 PolarHBondContact O-N 3.08Å
573	N	95.1	Very high	96.1	Very high	104 Å²	104	35.3 Å²	35.3	56%	0.556	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-66.7	-18.3	-176.2	-60	-3.9	0	0	0	113.2	F571 P762	F571-N573 PolarHBondContact O-N 2.81Å; N573-P762 WeakPolarHBondContact OD1-CB 3.43Å
574	R	95.3	Very high	96.1	Very high	50 Å²	50	37.2 Å²	37.2	19%	0.189	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-104.6	-16.9	177.9	-57.9	-171.9	-173.6	-80.3	-10.4	112.6	A465 I466 E467 E468 F571 L572 E576 K609	A465-R574 PolarHBondContact O-NE 2.7Å; A465-R574 PolarHBondContact O-NH2 3.1Å; I466-R574 PolarHBondContact O-NH2 3.12Å; E467-R574 PolarHBondContact O-NH2 3.16Å; E468-R574 VanDerWaalsContact CD-NH1 3.29Å; E468-R574 VanDerWaalsContact CD-NH2 3.32Å; E468-R574 IonicContact OE1-CZ 3.69Å; E468-R574 IonicContact OE1-NH1 2.84Å; E468-R574 PolarHBondContact OE1-NH1 2.67Å; E468-R574 IonicContact OE1-NH2 3.69Å; E468-R574 PolarHBondContact OE1-NH2 3.23Å; E468-R574 IonicContact OE2-CZ 2.7Å; E468-R574 IonicContact OE2-NH1 2.67Å; E468-R574 PolarHBondContact OE2-NH1 3.25Å; E468-R574 IonicContact OE2-NH2 2.65Å; F571-R574 HydrophobicContact CB-CB 4.35Å; F571-R574 CarbonylContact O-C 3.48Å; F571-R574 PolarHBondContact O-N 2.96Å; F571-R574 VanDerWaalsContact O-N 3.07Å; L572-R574 PolarHBondContact O-N 3.48Å; L572-R574 VanDerWaalsContact O-N 3.16Å; R574-E576 VanDerWaalsContact C-N 3.28Å; R574-E576 HydrophobicContact CB-CB 4.2Å; R574-E576 HydrophobicContact CB-CG 3.84Å; R574-E576 PolarHBondContact O-N 3.34Å; R574-K609 PolarHBondContact O-NZ 2.86Å
575	G	95.1	Very high	96.1	Very high	41 Å²	41	35.1 Å²	35.1	42%	0.423	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	46.7	-168.3	0	0	0	0	0	111.5	F571 L572 K609	F571-G575 PolarHBondContact O-N 3.33Å; L572-G575 PolarHBondContact O-N 3.08Å; G575-K609 WeakPolarHBondContact O-CD 3.37Å; G575-K609 PolarHBondContact O-NZ 2.88Å
576	E	97.8	Very high	96.1	Very high	18 Å²	18	34.8 Å²	34.8	8%	0.084	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	116.3	-179.4	-76.5	175.1	-172.1	0	0	110.2	R473 T570 F571 R574 Y578 K609 T610	R473-E576 IonicContact CZ-OE1 3.8Å; R473-E576 IonicContact CZ-OE2 2.7Å; R473-E576 VanDerWaalsContact CZ-OE2 3.22Å; R473-E576 IonicContact NE-OE1 2.93Å; R473-E576 IonicContact NE-OE2 2.86Å; R473-E576 PolarHBondContact NE-OE2 3.4Å; R473-E576 IonicContact NH2-OE1 2.67Å; R473-E576 PolarHBondContact NH2-OE1 3.31Å; R473-E576 IonicContact NH2-OE2 2.64Å; R473-E576 PolarHBondContact NH2-OE2 3.29Å; T570-E576 WeakPolarHBondContact CA-O 3.34Å; F571-E576 PolarHBondContact N-O 3.05Å; F571-E576 PolarHBondContact O-N 3.27Å; R574-E576 VanDerWaalsContact C-N 3.28Å; R574-E576 HydrophobicContact CB-CB 4.2Å; R574-E576 HydrophobicContact CB-CG 3.84Å; R574-E576 PolarHBondContact O-N 3.34Å; E576-Y578 HydrophobicContact CB-CE2 4.01Å; E576-K609 HydrophobicContact CG-CD 3.95Å; E576-T610 HydrophobicContact CG-CG2 4.11Å; E576-T610 WeakPolarHBondContact OE1-CG2 3.49Å
577	D	98	Very high	95.9	Very high	55 Å²	55	29.8 Å²	29.8	29%	0.294	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	137.1	171.8	-85.2	13.2	0	0	0	111	R568 L569 T570 C607	R568-D577 VanDerWaalsContact CD-OD2 3.28Å; R568-D577 WeakPolarHBondContact CD-OD2 3.47Å; R568-D577 HydrophobicContact CG-CB 4.48Å; R568-D577 WeakPolarHBondContact CG-OD2 3.35Å; R568-D577 IonicContact CZ-OD2 3.83Å; R568-D577 IonicContact NE-OD2 2.75Å; R568-D577 IonicContact NH1-OD2 3.49Å; R568-D577 PolarHBondContact NH1-OD2 3.16Å; L569-D577 CarbonylContact O-C 3.53Å; L569-D577 WeakPolarHBondContact O-CA 3.46Å; T570-D577 WeakPolarHBondContact CB-OD1 3.43Å; T570-D577 WeakPolarHBondContact CG2-OD1 3.34Å; T570-D577 PolarHBondContact OG1-OD1 3.15Å; D577-C607 VanDerWaalsContact O-CA 3.25Å; D577-C607 WeakPolarHBondContact O-CA 3.46Å; D577-C607 WeakPolarHBondContact O-CB 3.24Å; D577-C607 PolarHBondContact O-SG 2.88Å
578	Y	98.6	Very high	95.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	103	170.5	-73.6	-108	0	0	0	107.6	M474 V477 L569 F571 E576 M580 I605 A606 C607	M474-Y578 HydrophobicContact CB-CE1 4.46Å; M474-Y578 HydrophobicContact CE-CD1 3.83Å; M474-Y578 HydrophobicContact CE-CE1 3.57Å; M474-Y578 HydrophobicContact SD-CD1 4.29Å; M474-Y578 HydrophobicContact SD-CE1 4.06Å; V477-Y578 HydrophobicContact CB-CD1 4.23Å; V477-Y578 HydrophobicContact CB-CE1 4.43Å; V477-Y578 HydrophobicContact CG1-CD1 3.98Å; V477-Y578 HydrophobicContact CG1-CG 4.43Å; V477-Y578 HydrophobicContact CG2-CD1 4.01Å; V477-Y578 HydrophobicContact CG2-CE1 4.06Å; V477-Y578 HydrophobicContact CG2-CG 4.38Å; L569-Y578 PolarHBondContact N-O 3.15Å; L569-Y578 PolarHBondContact O-N 3.13Å; F571-Y578 AromaticContact CD2-CD2 3.93Å; F571-Y578 HydrophobicContact CD2-CD2 3.93Å; F571-Y578 AromaticContact CD2-CE2 3.59Å; F571-Y578 HydrophobicContact CD2-CE2 3.59Å; F571-Y578 AromaticContact CE2-CD2 3.87Å; F571-Y578 HydrophobicContact CE2-CD2 3.87Å; F571-Y578 AromaticContact CE2-CE2 3.61Å; F571-Y578 HydrophobicContact CE2-CE2 3.61Å; E576-Y578 HydrophobicContact CB-CE2 4.01Å; Y578-M580 WeakPolarHBondContact O-CE 3.47Å; Y578-I605 HydrophobicContact CD1-CG2 4.41Å; Y578-A606 WeakPolarHBondContact CA-O 3.27Å; Y578-C607 HydrophobicContact CD1-CB 3.86Å; Y578-C607 HydrophobicContact CD2-CB 4.12Å; Y578-C607 HydrophobicContact CE1-CB 3.77Å; Y578-C607 HydrophobicContact CE2-CB 4.01Å; Y578-C607 HydrophobicContact CG-CB 4.04Å
579	V	98.2	Very high	94.8	Very high	35 Å²	35	29.1 Å²	29.1	21%	0.212	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	135.1	-179.6	-178	0	0	0	0	109.8	E566 A567 R568 I605 A606	E566-V579 HydrophobicContact CB-CG1 4.18Å; E566-V579 HydrophobicContact CG-CG1 4.48Å; E566-V579 VanDerWaalsContact OE2-CG1 3.26Å; E566-V579 WeakPolarHBondContact OE2-CG1 3.14Å; A567-V579 CarbonylContact O-C 3.52Å; A567-V579 WeakPolarHBondContact O-CA 3.36Å; R568-V579 HydrophobicContact CG-CG2 4.5Å; V579-I605 CarbonylContact O-C 3.52Å; V579-I605 WeakPolarHBondContact O-CA 3.36Å; V579-A606 PolarHBondContact N-O 3.34Å; V579-A606 PolarHBondContact O-N 2.74Å
580	M	97.6	Very high	93.9	Very high	3 Å²	3	30.1 Å²	30.1	2%	0.015	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	145.7	-176.6	65.3	-159	84	0	0	114.4	V477 W480 Y481 E566 A567 L569 Y578 T604 I605	V477-M580 HydrophobicContact CG1-CE 4.37Å; W480-M580 HydrophobicContact CH2-SD 4.46Å; W480-M580 HydrophobicContact CZ3-CE 4.23Å; W480-M580 HydrophobicContact CZ3-SD 3.74Å; Y481-M580 HydrophobicContact CD2-CG 4.31Å; Y481-M580 HydrophobicContact CD2-SD 3.59Å; Y481-M580 VanDerWaalsContact CD2-SD 3.59Å; Y481-M580 HydrophobicContact CE2-CB 4.42Å; Y481-M580 HydrophobicContact CE2-CG 4.19Å; Y481-M580 HydrophobicContact CE2-SD 4.07Å; E566-M580 CarbonylContact C-O 3.41Å; E566-M580 WeakPolarHBondContact CA-O 3.18Å; A567-M580 HydrophobicContact CB-CG 4.06Å; A567-M580 PolarHBondContact N-O 3.27Å; A567-M580 PolarHBondContact O-N 3.18Å; L569-M580 HydrophobicContact CB-CE 3.74Å; L569-M580 HydrophobicContact CD2-CE 4.33Å; Y578-M580 WeakPolarHBondContact O-CE 3.47Å; M580-T604 VanDerWaalsContact CA-O 3.29Å; M580-T604 WeakPolarHBondContact CA-O 3.36Å; M580-I605 HydrophobicContact CB-CB 4.35Å; M580-I605 HydrophobicContact CB-CG1 3.84Å; M580-I605 HydrophobicContact CB-CG2 4.41Å; M580-I605 HydrophobicContact CE-CG2 4.39Å
581	N	96.1	Very high	92.8	Very high	44 Å²	44	31.4 Å²	31.4	24%	0.235	17%	0.172	C	C	.	.			trans	-100.7	-177.5	174.6	70.3	-46.7	0	0	0	112.1	Y481 Q602 I603 T604	Y481-N581 PolarHBondContact OH-O 2.99Å; N581-Q602 PolarHBondContact ND2-O 2.83Å; N581-I603 VanDerWaalsContact OD1-CA 3.27Å; N581-I603 WeakPolarHBondContact OD1-CA 3.21Å; N581-T604 PolarHBondContact OD1-N 3.28Å; N581-T604 PolarHBondContact OD1-O 2.64Å
582	M	94.3	Very high	91.6	Very high	24 Å²	24	39.2 Å²	39.2	12%	0.118	20%	0.203	C	C	.	.			trans	-119.5	151.7	-175.5	-61.9	-61.5	-79.1	0	0	112.9	Y454 Y481 I548 L563 I603	Y454-M582 HydrophobicContact CD1-CE 4.43Å; Y454-M582 HydrophobicContact CE1-CE 3.7Å; Y454-M582 HydrophobicContact CE2-CE 4.03Å; Y454-M582 VanDerWaalsContact CZ-CE 3.47Å; Y454-M582 WeakPolarHBondContact OH-CE 3.28Å; Y481-M582 HydrophobicContact CE2-SD 4.21Å; I548-M582 HydrophobicContact CD1-CG 4.14Å; L563-M582 HydrophobicContact CB-CB 3.94Å; L563-M582 HydrophobicContact CD1-CB 4.4Å; M582-I603 VanDerWaalsContact C-CD1 3.45Å
583	P	95.1	Very high	90.8	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.032	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-73.4	156.6	171	29.6	-32.3	0	0	0	110.7	Y481 F485 G600 I603 F618	Y481-P583 WeakPolarHBondContact OH-CD 3.45Å; F485-P583 HydrophobicContact CD1-CG 4.42Å; F485-P583 HydrophobicContact CE1-CG 3.4Å; F485-P583 HydrophobicContact CZ-CG 3.68Å; P583-G600 WeakPolarHBondContact CB-O 3.1Å; P583-I603 HydrophobicContact CB-CD1 3.99Å; P583-I603 HydrophobicContact CG-CD1 4.35Å; P583-I603 VanDerWaalsContact N-CD1 3.31Å; P583-F618 HydrophobicContact CB-CD2 4.24Å; P583-F618 HydrophobicContact CB-CG 4.25Å
584	Y	93.7	Very high	90	Very high	72 Å²	72	40.8 Å²	40.8	28%	0.282	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	143.2	169.1	64.1	-95.5	0	0	0	110.5	A561 H586 G600 L620	A561-Y584 WeakPolarHBondContact O-CA 3.44Å; A561-Y584 WeakPolarHBondContact O-CB 3.47Å; Y584-H586 HydrophobicContact CD2-CB 4.09Å; Y584-H586 HydrophobicContact CE2-CB 3.93Å; Y584-G600 WeakPolarHBondContact CD1-O 3.45Å; Y584-G600 VanDerWaalsContact CE1-C 3.44Å; Y584-G600 VanDerWaalsContact CE1-O 3.32Å; Y584-G600 WeakPolarHBondContact CE1-O 3.27Å; Y584-G600 PolarHBondContact N-O 2.92Å; Y584-G600 PolarHBondContact O-N 2.84Å; Y584-L620 HydrophobicContact CE2-CD1 4.28Å
585	A	91.9	Very high	89.4	Confident	29 Å²	29	39 Å²	39	24%	0.24	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	133.4	170.3	0	0	0	0	0	109.5	S560 A561 L597 L599	S560-A585 CarbonylContact C-O 3.56Å; S560-A585 WeakPolarHBondContact CA-O 3.25Å; A561-A585 HydrophobicContact CB-CB 4.45Å; A561-A585 PolarHBondContact N-O 3.02Å; A561-A585 PolarHBondContact O-N 2.88Å; A585-L597 HydrophobicContact CB-CD1 4.22Å; A585-L599 HydrophobicContact CB-CD2 4.24Å
586	H	91.2	Very high	88.9	Confident	21 Å²	21	37.8 Å²	37.8	10%	0.097	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	111.7	-174.1	-170.2	92.5	0	0	0	110.5	L559 S560 Y584 E598 L620	L559-H586 WeakPolarHBondContact O-CA 3.3Å; S560-H586 PolarHBondContact OG-ND1 2.84Å; Y584-H586 HydrophobicContact CD2-CB 4.09Å; Y584-H586 HydrophobicContact CE2-CB 3.93Å; H586-E598 PolarHBondContact N-O 3.49Å; H586-E598 PolarHBondContact O-N 3.25Å; H586-L620 HydrophobicContact CB-CD1 4.46Å; H586-L620 HydrophobicContact CB-CD2 3.81Å
587	C	89.2	Confident	88.4	Confident	13 Å²	13	38.9 Å²	38.9	9%	0.088	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	123.8	175.5	179.4	0	0	0	0	109.7	S558 L559 I590 T596 L597	S558-C587 CarbonylContact C-O 3.59Å; S558-C587 WeakPolarHBondContact CA-O 3.25Å; S558-C587 WeakPolarHBondContact CB-O 3.24Å; L559-C587 PolarHBondContact N-O 2.88Å; L559-C587 PolarHBondContact O-N 3.34Å; C587-I590 HydrophobicContact CB-CD1 3.94Å; C587-I590 HydrophobicContact CB-CG1 4.48Å; C587-T596 WeakPolarHBondContact CA-O 3.15Å; C587-L597 HydrophobicContact CB-CD1 4.48Å
588	K	88.3	Confident	88	Confident	53 Å²	53	36.8 Å²	36.8	23%	0.23	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	167.6	173.5	-61.6	-177.7	-175	159.3	0	111	N557 I590 M595 T596 E598 K621	N557-K588 CarbonylContact O-C 3.52Å; K588-I590 PolarHBondContact O-N 2.93Å; K588-M595 WeakPolarHBondContact O-CA 3.36Å; K588-T596 PolarHBondContact N-O 3.44Å; K588-T596 PolarHBondContact O-N 3.21Å; K588-E598 WeakPolarHBondContact CD-OE1 3.26Å; K588-E598 VanDerWaalsContact CE-OE1 3.25Å; K588-E598 WeakPolarHBondContact CE-OE1 3.49Å; K588-E598 VanDerWaalsContact CE-OE2 3.3Å; K588-E598 WeakPolarHBondContact CE-OE2 3.25Å; K588-E598 IonicContact NZ-OE1 3.86Å; K588-E598 PolarHBondContact NZ-OE1 3.14Å; K588-E598 IonicContact NZ-OE2 2.78Å; K588-E598 PolarHBondContact NZ-OE2 3.25Å; K588-K621 PolarHBondContact NZ-O 2.92Å
589	G	82.9	Confident	87.7	Confident	9 Å²	9	38.1 Å²	38.1	9%	0.093	21%	0.21	C	C	.	.			trans	76.2	12.9	166.8	0	0	0	0	0	116.5	N557 L591 Y592 T594	N557-G589 PolarHBondContact O-N 3.01Å; N557-G589 VanDerWaalsContact OD1-C 3.27Å; G589-L591 VanDerWaalsContact C-N 3.28Å; G589-L591 PolarHBondContact O-N 3.03Å; G589-Y592 WeakPolarHBondContact CA-O 3.38Å; G589-T594 WeakPolarHBondContact CA-O 3.49Å
590	I	79.9	Confident	87.5	Confident	20 Å²	20	36.5 Å²	36.5	10%	0.103	20%	0.2	C	C	.	.	S	Bend	trans	-72.3	-18.7	-166.8	-31.1	-177.9	0	0	0	113.5	I419 L423 N557 L559 C587 K588 M595	I419-I590 HydrophobicContact CG2-CG2 3.73Å; I419-I590 VanDerWaalsContact CG2-O 3.32Å; I419-I590 WeakPolarHBondContact CG2-O 3.45Å; L423-I590 HydrophobicContact CD1-CB 4.1Å; L423-I590 HydrophobicContact CD1-CG2 3.66Å; N557-I590 PolarHBondContact O-N 3.13Å; N557-I590 PolarHBondContact OD1-N 2.89Å; L559-I590 HydrophobicContact CB-CD1 3.38Å; C587-I590 HydrophobicContact CB-CD1 3.94Å; C587-I590 HydrophobicContact CB-CG1 4.48Å; K588-I590 PolarHBondContact O-N 2.93Å; I590-M595 HydrophobicContact CG2-SD 4.12Å
591	L	74.4	Confident	87.4	Confident	51 Å²	51	37.2 Å²	37.2	27%	0.267	21%	0.208	S	C	.	.	S	Bend	trans	-106.9	-37	173.2	-59.4	179.1	0	0	0	112.2	W420 L423 F554 G556 N557 G589	W420-L591 HydrophobicContact CE3-CB 4.43Å; W420-L591 HydrophobicContact CE3-CD2 3.69Å; W420-L591 HydrophobicContact CZ3-CB 4.09Å; W420-L591 HydrophobicContact CZ3-CD1 4.5Å; W420-L591 HydrophobicContact CZ3-CD2 3.77Å; W420-L591 HydrophobicContact CZ3-CG 4.33Å; L423-L591 HydrophobicContact CB-CD2 3.67Å; L423-L591 HydrophobicContact CD1-CD2 3.48Å; L423-L591 VanDerWaalsContact CD1-CD2 3.48Å; L423-L591 HydrophobicContact CD1-CG 4.36Å; L423-L591 HydrophobicContact CG-CD2 4.23Å; F554-L591 HydrophobicContact CZ-CD1 4.4Å; G556-L591 VanDerWaalsContact C-CD1 3.44Å; G556-L591 VanDerWaalsContact O-CD1 3.24Å; G556-L591 WeakPolarHBondContact O-CD1 3.25Å; G556-L591 WeakPolarHBondContact O-CG 3.42Å; N557-L591 WeakPolarHBondContact OD1-CA 3.42Å; N557-L591 WeakPolarHBondContact OD1-CB 3.5Å; N557-L591 PolarHBondContact OD1-N 2.86Å; G589-L591 VanDerWaalsContact C-N 3.28Å; G589-L591 PolarHBondContact O-N 3.03Å
592	Y	75.1	Confident	87.4	Confident	165 Å²	165	40.8 Å²	40.8	65%	0.647	22%	0.224	S	C	*	.	S	Bend	trans	-156.8	141.2	-177.6	52.8	-91.4	0	0	0	111.7	N557 G589	N557-Y592 HydrophobicContact CB-CD1 4.37Å; N557-Y592 HydrophobicContact CB-CE1 3.74Å; N557-Y592 HydrophobicContact CB-CE2 4.22Å; N557-Y592 WeakPolarHBondContact ND2-CD2 3.35Å; N557-Y592 VanDerWaalsContact ND2-CE2 3.27Å; N557-Y592 WeakPolarHBondContact ND2-CE2 3.29Å; N557-Y592 PolarHBondContact ND2-O 2.94Å; N557-Y592 PolarHBondContact OD1-N 2.94Å; N557-Y592 PolarHBondContact OD1-O 2.88Å; G589-Y592 WeakPolarHBondContact CA-O 3.38Å
593	G	78.6	Confident	87.6	Confident	65 Å²	65	39.7 Å²	39.7	67%	0.67	22%	0.218	S	C	*	.	S	Bend	trans	94.5	-161.4	-170.8	0	0	0	0	0	112.2
594	T	79.9	Confident	87.7	Confident	83 Å²	83	41.9 Å²	41.9	51%	0.509	23%	0.231	S	C	.	.			trans	-91.5	135.3	-179.9	-56.7	0	0	0	0	110.3	T408 G589 T596	T408-T594 HydrophobicContact CG2-CG2 3.4Å; T408-T594 VanDerWaalsContact CG2-CG2 3.4Å; G589-T594 WeakPolarHBondContact CA-O 3.49Å; T594-T596 PolarHBondContact O-N 3.25Å
595	M	82.4	Confident	87.9	Confident	14 Å²	14	38.4 Å²	38.4	7%	0.069	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	118.5	175	-88.2	167.8	56.9	0	0	110.7	E409 V411 I419 L492 K588 I590	E409-M595 PolarHBondContact N-O 2.78Å; V411-M595 HydrophobicContact CG2-CE 3.84Å; V411-M595 HydrophobicContact CG2-SD 3.78Å; I419-M595 HydrophobicContact CD1-CE 3.77Å; I419-M595 HydrophobicContact CD1-SD 3.87Å; L492-M595 HydrophobicContact CD1-CB 4.39Å; L492-M595 HydrophobicContact CD2-CE 3.68Å; K588-M595 WeakPolarHBondContact O-CA 3.36Å; I590-M595 HydrophobicContact CG2-SD 4.12Å
596	T	83.9	Confident	88.3	Confident	14 Å²	14	38.7 Å²	38.7	9%	0.086	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	136.4	-174.9	-52.3	0	0	0	0	110.6	Q407 L492 C587 K588 T594	Q407-T596 HydrophobicContact CB-CG2 4.48Å; Q407-T596 WeakPolarHBondContact O-CA 3.43Å; L492-T596 VanDerWaalsContact CD1-C 3.46Å; C587-T596 WeakPolarHBondContact CA-O 3.15Å; K588-T596 PolarHBondContact N-O 3.44Å; K588-T596 PolarHBondContact O-N 3.21Å; T594-T596 PolarHBondContact O-N 3.25Å
597	L	87.1	Confident	88.6	Confident	42 Å²	42	37.8 Å²	37.8	22%	0.22	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	120.1	177.8	-173.5	65.5	0	0	0	111.2	Q407 L492 A585 C587	Q407-L597 WeakPolarHBondContact CG-O 3.38Å; Q407-L597 PolarHBondContact NE2-O 2.85Å; Q407-L597 PolarHBondContact O-N 3.21Å; L492-L597 HydrophobicContact CD1-CB 3.71Å; L492-L597 HydrophobicContact CG-CB 4.3Å; A585-L597 HydrophobicContact CB-CD1 4.22Å; C587-L597 HydrophobicContact CB-CD1 4.48Å
598	E	89.2	Confident	89	Confident	10 Å²	10	45.9 Å²	45.9	5%	0.047	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	152	175.5	-68.4	171.9	-149	0	0	110.7	H586 K588 L620 K621	H586-E598 PolarHBondContact N-O 3.49Å; H586-E598 PolarHBondContact O-N 3.25Å; K588-E598 WeakPolarHBondContact CD-OE1 3.26Å; K588-E598 VanDerWaalsContact CE-OE1 3.25Å; K588-E598 WeakPolarHBondContact CE-OE1 3.49Å; K588-E598 VanDerWaalsContact CE-OE2 3.3Å; K588-E598 WeakPolarHBondContact CE-OE2 3.25Å; K588-E598 IonicContact NZ-OE1 3.86Å; K588-E598 PolarHBondContact NZ-OE1 3.14Å; K588-E598 IonicContact NZ-OE2 2.78Å; K588-E598 PolarHBondContact NZ-OE2 3.25Å; E598-L620 HydrophobicContact CB-CD2 3.7Å; E598-L620 WeakPolarHBondContact OE2-CA 3.26Å; E598-L620 WeakPolarHBondContact OE2-CB 3.34Å; E598-K621 WeakPolarHBondContact OE1-CB 2.94Å; E598-K621 PolarHBondContact OE2-N 2.93Å
599	L	92.5	Very high	89.4	Confident	29 Å²	29	49.9 Å²	49.9	15%	0.152	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	139.8	166.4	-64	-178.4	0	0	0	109.4	F485 A585 F618 W651	F485-L599 HydrophobicContact CB-CD1 4.4Å; F485-L599 HydrophobicContact CD1-CD1 3.48Å; F485-L599 VanDerWaalsContact CD1-CD1 3.48Å; F485-L599 HydrophobicContact CE1-CD1 4.12Å; F485-L599 HydrophobicContact CG-CD1 4.24Å; A585-L599 HydrophobicContact CB-CD2 4.24Å; L599-F618 HydrophobicContact CB-CD1 3.8Å; L599-F618 HydrophobicContact CD1-CD1 4.25Å; L599-F618 HydrophobicContact CD1-CE1 4.14Å; L599-W651 HydrophobicContact CB-CZ2 4.08Å; L599-W651 HydrophobicContact CD1-CD2 4.08Å; L599-W651 HydrophobicContact CD1-CE3 4.2Å; L599-W651 HydrophobicContact CD1-CH2 3.92Å; L599-W651 HydrophobicContact CD1-CZ2 3.76Å; L599-W651 HydrophobicContact CD1-CZ3 4.13Å; L599-W651 HydrophobicContact CG-CH2 4.16Å; L599-W651 HydrophobicContact CG-CZ2 3.73Å
600	G	94	Very high	90	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	156.5	-177.6	0	0	0	0	0	113.9	P583 Y584 F618	P583-G600 WeakPolarHBondContact CB-O 3.1Å; Y584-G600 WeakPolarHBondContact CD1-O 3.45Å; Y584-G600 VanDerWaalsContact CE1-C 3.44Å; Y584-G600 VanDerWaalsContact CE1-O 3.32Å; Y584-G600 WeakPolarHBondContact CE1-O 3.27Å; Y584-G600 PolarHBondContact N-O 2.92Å; Y584-G600 PolarHBondContact O-N 2.84Å; G600-F618 WeakPolarHBondContact CA-O 3.27Å
601	G	95.1	Very high	90.9	Very high	18 Å²	18	51.3 Å²	51.3	19%	0.186	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	118.8	172.7	169.4	0	0	0	0	0	114.4	F618	G601-F618 PolarHBondContact N-O 2.82Å; G601-F618 PolarHBondContact O-N 3.14Å
602	Q	96.8	Very high	92	Very high	120 Å²	120	50.8 Å²	50.8	56%	0.561	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	125.7	178.2	-171.3	175.7	19.6	0	0	110.4	N581 L616	N581-Q602 PolarHBondContact ND2-O 2.83Å; Q602-L616 CarbonylContact C-O 3.33Å; Q602-L616 WeakPolarHBondContact CA-O 3.39Å
603	I	97.9	Very high	93.1	Very high	0 Å²	0	44 Å²	44	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	141.1	172.5	-46.7	-51.5	0	0	0	108.7	Y481 N581 M582 P583 I605 Q615 L616 F618	Y481-I603 HydrophobicContact CE1-CB 4.48Å; Y481-I603 HydrophobicContact CE1-CG1 4.13Å; Y481-I603 HydrophobicContact CE1-CG2 3.8Å; Y481-I603 HydrophobicContact CE2-CG2 4.32Å; Y481-I603 WeakPolarHBondContact OH-CD1 3.16Å; Y481-I603 WeakPolarHBondContact OH-CG2 3.49Å; N581-I603 VanDerWaalsContact OD1-CA 3.27Å; N581-I603 WeakPolarHBondContact OD1-CA 3.21Å; M582-I603 VanDerWaalsContact C-CD1 3.45Å; P583-I603 HydrophobicContact CB-CD1 3.99Å; P583-I603 HydrophobicContact CG-CD1 4.35Å; P583-I603 VanDerWaalsContact N-CD1 3.31Å; I603-I605 HydrophobicContact CG2-CG1 4.14Å; I603-Q615 CarbonylContact O-C 3.57Å; I603-Q615 VanDerWaalsContact O-CA 3.27Å; I603-Q615 WeakPolarHBondContact O-CA 3.06Å; I603-L616 HydrophobicContact CB-CB 4.08Å; I603-L616 HydrophobicContact CG1-CB 4.38Å; I603-L616 PolarHBondContact N-O 2.96Å; I603-L616 PolarHBondContact O-N 3.42Å; I603-F618 HydrophobicContact CD1-CD2 4.41Å; I603-F618 HydrophobicContact CD1-CE2 4.48Å; I603-F618 HydrophobicContact CG1-CD2 3.83Å; I603-F618 HydrophobicContact CG1-CE2 3.72Å
604	T	98	Very high	94.1	Very high	51 Å²	51	40.9 Å²	40.9	31%	0.313	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	136.3	161.4	-58.9	0	0	0	0	108.2	M580 N581 A606 S614 Q615	M580-T604 VanDerWaalsContact CA-O 3.29Å; M580-T604 WeakPolarHBondContact CA-O 3.36Å; N581-T604 PolarHBondContact OD1-N 3.28Å; N581-T604 PolarHBondContact OD1-O 2.64Å; T604-A606 HydrophobicContact CG2-CB 4.18Å; T604-S614 WeakPolarHBondContact CA-O 3.41Å; T604-Q615 HydrophobicContact CG2-CG 4.48Å
605	I	98.6	Very high	95	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	115.5	168.4	-56.8	173.8	0	0	0	105.3	M474 V477 V478 Y481 Y578 V579 M580 I603 S613 S614	M474-I605 HydrophobicContact SD-CG2 4.21Å; V477-I605 HydrophobicContact CG1-CG2 3.95Å; V478-I605 HydrophobicContact CG2-CD1 4.14Å; Y481-I605 HydrophobicContact CD1-CD1 4.02Å; Y481-I605 HydrophobicContact CD2-CD1 4.12Å; Y481-I605 HydrophobicContact CG-CD1 3.71Å; Y578-I605 HydrophobicContact CD1-CG2 4.41Å; V579-I605 CarbonylContact O-C 3.52Å; V579-I605 WeakPolarHBondContact O-CA 3.36Å; M580-I605 HydrophobicContact CB-CB 4.35Å; M580-I605 HydrophobicContact CB-CG1 3.84Å; M580-I605 HydrophobicContact CB-CG2 4.41Å; M580-I605 HydrophobicContact CE-CG2 4.39Å; I603-I605 HydrophobicContact CG2-CG1 4.14Å; I605-S613 CarbonylContact O-C 3.48Å; I605-S613 VanDerWaalsContact O-CA 3.24Å; I605-S613 WeakPolarHBondContact O-CA 3.43Å; I605-S614 PolarHBondContact N-O 3.11Å; I605-S614 PolarHBondContact O-N 2.72Å
606	A	98.4	Very high	95.7	Very high	35 Å²	35	39.1 Å²	39.1	29%	0.289	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	137.5	-171.8	0	0	0	0	0	112.6	Y578 V579 T604	Y578-A606 WeakPolarHBondContact CA-O 3.27Å; V579-A606 PolarHBondContact N-O 3.34Å; V579-A606 PolarHBondContact O-N 2.74Å; T604-A606 HydrophobicContact CG2-CB 4.18Å
607	C	98.3	Very high	96.4	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.014	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	101.5	172.2	179.4	0	0	0	0	109.3	M474 D577 Y578 K609 T610 G611 Y612	M474-C607 HydrophobicContact CE-CB 4.37Å; D577-C607 VanDerWaalsContact O-CA 3.25Å; D577-C607 WeakPolarHBondContact O-CA 3.46Å; D577-C607 WeakPolarHBondContact O-CB 3.24Å; D577-C607 PolarHBondContact O-SG 2.88Å; Y578-C607 HydrophobicContact CD1-CB 3.86Å; Y578-C607 HydrophobicContact CD2-CB 4.12Å; Y578-C607 HydrophobicContact CE1-CB 3.77Å; Y578-C607 HydrophobicContact CE2-CB 4.01Å; Y578-C607 HydrophobicContact CG-CB 4.04Å; C607-K609 PolarHBondContact O-N 2.92Å; C607-T610 WeakPolarHBondContact CB-OG1 3.36Å; C607-T610 PolarHBondContact O-N 2.83Å; C607-T610 PolarHBondContact O-OG1 3.12Å; C607-T610 PolarHBondContact SG-OG1 3.04Å; C607-G611 PolarHBondContact O-N 2.9Å; C607-Y612 PolarHBondContact N-O 3.15Å
608	E	96.8	Very high	96.8	Very high	182 Å²	182	41.3 Å²	41.3	85%	0.85	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-58.8	-46	-175.9	-177.2	172.4	-163	0	0	111.8	T610 G611	E608-T610 PolarHBondContact O-N 3.2Å; E608-T610 VanDerWaalsContact O-N 3.15Å; E608-G611 PolarHBondContact O-N 2.85Å; E608-G611 VanDerWaalsContact O-N 3.08Å
609	K	96.8	Very high	97.1	Very high	137 Å²	137	43.6 Å²	43.6	60%	0.596	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-57.5	-30.9	-178.3	-173.2	174.1	-175	-179.3	0	114.2	R574 G575 E576 C607	R574-K609 PolarHBondContact O-NZ 2.86Å; G575-K609 WeakPolarHBondContact O-CD 3.37Å; G575-K609 PolarHBondContact O-NZ 2.88Å; E576-K609 HydrophobicContact CG-CD 3.95Å; C607-K609 PolarHBondContact O-N 2.92Å
610	T	97.2	Very high	97.1	Very high	26 Å²	26	44.7 Å²	44.7	16%	0.16	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-102.4	-10.2	179.6	66	0	0	0	0	112.9	A470 E576 C607 E608 Y612	A470-T610 HydrophobicContact CB-CG2 4.23Å; E576-T610 HydrophobicContact CG-CG2 4.11Å; E576-T610 WeakPolarHBondContact OE1-CG2 3.49Å; C607-T610 WeakPolarHBondContact CB-OG1 3.36Å; C607-T610 PolarHBondContact O-N 2.83Å; C607-T610 PolarHBondContact O-OG1 3.12Å; C607-T610 PolarHBondContact SG-OG1 3.04Å; E608-T610 PolarHBondContact O-N 3.2Å; E608-T610 VanDerWaalsContact O-N 3.15Å; T610-Y612 VanDerWaalsContact O-CD2 3.23Å; T610-Y612 WeakPolarHBondContact O-CD2 3.31Å; T610-Y612 PolarHBondContact O-N 2.97Å
611	G	97.4	Very high	96.7	Very high	34 Å²	34	46.6 Å²	46.6	35%	0.351	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	1	-175.7	0	0	0	0	0	115.1	C607 E608 G640	C607-G611 PolarHBondContact O-N 2.9Å; E608-G611 PolarHBondContact O-N 2.85Å; E608-G611 VanDerWaalsContact O-N 3.08Å; G611-G640 PolarHBondContact O-N 3.2Å
612	Y	98.4	Very high	96.3	Very high	39 Å²	39	49.3 Å²	49.3	15%	0.153	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	142.8	178.5	-74	-92.1	0	0	0	111.4	A470 Y471 M474 C607 T610 K638 L639 L644	A470-Y612 HydrophobicContact CB-CD2 4.06Å; A470-Y612 HydrophobicContact CB-CE2 3.76Å; Y471-Y612 HydrophobicContact CD2-CD1 4.34Å; Y471-Y612 AromaticContact CD2-CE1 3.94Å; Y471-Y612 HydrophobicContact CD2-CE1 3.94Å; Y471-Y612 HydrophobicContact CG-CE1 4.17Å; M474-Y612 WeakPolarHBondContact CE-O 3.42Å; C607-Y612 PolarHBondContact N-O 3.15Å; T610-Y612 VanDerWaalsContact O-CD2 3.23Å; T610-Y612 WeakPolarHBondContact O-CD2 3.31Å; T610-Y612 PolarHBondContact O-N 2.97Å; Y612-K638 WeakPolarHBondContact CA-O 3.37Å; Y612-K638 WeakPolarHBondContact CD1-O 3.47Å; Y612-L639 HydrophobicContact CD1-CB 4.33Å; Y612-L639 HydrophobicContact CD1-CD1 4.47Å; Y612-L639 HydrophobicContact CD2-CD1 4.02Å; Y612-L639 HydrophobicContact CE1-CB 4.14Å; Y612-L639 HydrophobicContact CE1-CD1 4.4Å; Y612-L639 HydrophobicContact CE2-CD1 3.93Å; Y612-L639 HydrophobicContact CG-CD1 4.29Å; Y612-L644 HydrophobicContact CD1-CD1 4.18Å; Y612-L644 HydrophobicContact CE1-CD1 3.52Å
613	S	98.5	Very high	95.2	Very high	22 Å²	22	53.4 Å²	53.4	15%	0.154	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	151.2	168	55.2	0	0	0	0	111.3	I605 I637 K638	I605-S613 CarbonylContact O-C 3.48Å; I605-S613 VanDerWaalsContact O-CA 3.24Å; I605-S613 WeakPolarHBondContact O-CA 3.43Å; S613-I637 CarbonylContact O-C 3.57Å; S613-K638 PolarHBondContact N-O 2.95Å; S613-K638 PolarHBondContact O-N 2.74Å
614	S	98.5	Very high	94.2	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141.7	163.8	-168.5	0	0	0	0	108.9	V478 T604 I605 K636	V478-S614 VanDerWaalsContact CG2-CB 3.43Å; V478-S614 WeakPolarHBondContact CG2-OG 3.17Å; T604-S614 WeakPolarHBondContact CA-O 3.41Å; I605-S614 PolarHBondContact N-O 3.11Å; I605-S614 PolarHBondContact O-N 2.72Å; S614-K636 WeakPolarHBondContact CA-O 3.47Å
615	Q	98.3	Very high	92.9	Very high	58 Å²	58	59.7 Å²	59.7	27%	0.271	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	123.1	167.7	-72.5	-179.3	-30.9	0	0	108.3	I603 T604 G635 K636	I603-Q615 CarbonylContact O-C 3.57Å; I603-Q615 VanDerWaalsContact O-CA 3.27Å; I603-Q615 WeakPolarHBondContact O-CA 3.06Å; T604-Q615 HydrophobicContact CG2-CG 4.48Å; Q615-G635 CarbonylContact O-C 3.57Å; Q615-G635 WeakPolarHBondContact O-CA 3.35Å; Q615-K636 PolarHBondContact N-O 3.03Å; Q615-K636 PolarHBondContact O-N 3.26Å
616	L	98.3	Very high	91.9	Very high	3 Å²	3	62.3 Å²	62.3	2%	0.016	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	152.2	175.7	-45.1	176.7	0	0	0	109.5	V478 Y481 I482 Q602 I603 I633 S634	V478-L616 HydrophobicContact CG1-CD2 4.21Å; Y481-L616 HydrophobicContact CD1-CD1 4Å; Y481-L616 HydrophobicContact CE1-CD1 4.24Å; I482-L616 HydrophobicContact CD1-CD1 4.2Å; I482-L616 HydrophobicContact CG1-CD1 4.1Å; Q602-L616 CarbonylContact C-O 3.33Å; Q602-L616 WeakPolarHBondContact CA-O 3.39Å; I603-L616 HydrophobicContact CB-CB 4.08Å; I603-L616 HydrophobicContact CG1-CB 4.38Å; I603-L616 PolarHBondContact N-O 2.96Å; I603-L616 PolarHBondContact O-N 3.42Å; L616-I633 HydrophobicContact CB-CD1 4.38Å; L616-I633 HydrophobicContact CD1-CD1 4.37Å; L616-S634 CarbonylContact C-O 3.6Å
617	E	97.8	Very high	90.8	Very high	97 Å²	97	64.3 Å²	64.3	45%	0.453	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	111.3	174.7	-177.2	-177.4	-144.1	0	0	108.5	K619 I633 S634	E617-K619 HydrophobicContact CG-CG 3.95Å; E617-K619 WeakPolarHBondContact OE2-CE 3.49Å; E617-I633 WeakPolarHBondContact O-CA 3.13Å; E617-S634 PolarHBondContact N-O 3.49Å; E617-S634 PolarHBondContact O-N 3.4Å; E617-S634 VanDerWaalsContact O-N 3.12Å
618	F	96.9	Very high	90	Very high	4 Å²	4	69 Å²	69	2%	0.018	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	116.6	168	-73.8	-107.1	0	0	0	107.5	Y481 F485 P583 L599 G600 G601 I603 I633 W651	Y481-F618 HydrophobicContact CE1-CE2 4.41Å; F485-F618 HydrophobicContact CD1-CE1 4.22Å; F485-F618 HydrophobicContact CD1-CZ 4.39Å; F485-F618 HydrophobicContact CD2-CE1 4.11Å; F485-F618 AromaticContact CD2-CZ 3.71Å; F485-F618 HydrophobicContact CD2-CZ 3.71Å; F485-F618 HydrophobicContact CE1-CE1 4.42Å; F485-F618 HydrophobicContact CE1-CZ 4.28Å; F485-F618 HydrophobicContact CE2-CE1 4.33Å; F485-F618 HydrophobicContact CE2-CE2 4.42Å; F485-F618 AromaticContact CE2-CZ 3.59Å; F485-F618 HydrophobicContact CE2-CZ 3.59Å; F485-F618 HydrophobicContact CG-CE1 4.04Å; F485-F618 HydrophobicContact CG-CZ 4.11Å; F485-F618 HydrophobicContact CZ-CE1 4.46Å; F485-F618 AromaticContact CZ-CZ 3.88Å; F485-F618 HydrophobicContact CZ-CZ 3.88Å; P583-F618 HydrophobicContact CB-CD2 4.24Å; P583-F618 HydrophobicContact CB-CG 4.25Å; L599-F618 HydrophobicContact CB-CD1 3.8Å; L599-F618 HydrophobicContact CD1-CD1 4.25Å; L599-F618 HydrophobicContact CD1-CE1 4.14Å; G600-F618 WeakPolarHBondContact CA-O 3.27Å; G601-F618 PolarHBondContact N-O 2.82Å; G601-F618 PolarHBondContact O-N 3.14Å; I603-F618 HydrophobicContact CD1-CD2 4.41Å; I603-F618 HydrophobicContact CD1-CE2 4.48Å; I603-F618 HydrophobicContact CG1-CD2 3.83Å; I603-F618 HydrophobicContact CG1-CE2 3.72Å; F618-I633 HydrophobicContact CD2-CD1 4.2Å; F618-I633 HydrophobicContact CE1-CD1 4.18Å; F618-I633 HydrophobicContact CE2-CD1 3.75Å; F618-I633 HydrophobicContact CZ-CD1 3.74Å; F618-W651 HydrophobicContact CD1-CB 4.37Å; F618-W651 AromaticContact CD1-CD1 3.42Å; F618-W651 VanDerWaalsContact CD1-CD1 3.42Å; F618-W651 AromaticContact CD1-CG 3.9Å; F618-W651 HydrophobicContact CD1-CG 3.9Å; F618-W651 AromaticContact CD1-NE1 3.84Å; F618-W651 HydrophobicContact CE1-CB 3.79Å; F618-W651 AromaticContact CE1-CD1 3.69Å; F618-W651 HydrophobicContact CE1-CD2 4.33Å; F618-W651 AromaticContact CE1-CG 3.67Å; F618-W651 HydrophobicContact CE1-CG 3.67Å
619	K	94.5	Very high	89.4	Confident	59 Å²	59	61.9 Å²	61.9	26%	0.257	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-98.4	129	-173	-64.9	172.9	-173.4	167.4	0	111.1	E617 Q632 S634	E617-K619 HydrophobicContact CG-CG 3.95Å; E617-K619 WeakPolarHBondContact OE2-CE 3.49Å; K619-Q632 HydrophobicContact CB-CB 4.44Å; K619-Q632 WeakPolarHBondContact CB-O 3.43Å; K619-Q632 HydrophobicContact CD-CB 4.46Å; K619-Q632 HydrophobicContact CD-CG 4.25Å; K619-Q632 PolarHBondContact N-O 3.48Å; K619-S634 WeakPolarHBondContact CE-OG 3.45Å; K619-S634 PolarHBondContact NZ-OG 3.38Å
620	L	91.9	Very high	88.9	Confident	51 Å²	51	56 Å²	56	27%	0.267	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-72.2	140.1	168.6	-59.3	-178.4	0	0	0	110	Y584 H586 E598 P622	Y584-L620 HydrophobicContact CE2-CD1 4.28Å; H586-L620 HydrophobicContact CB-CD1 4.46Å; H586-L620 HydrophobicContact CB-CD2 3.81Å; E598-L620 HydrophobicContact CB-CD2 3.7Å; E598-L620 WeakPolarHBondContact OE2-CA 3.26Å; E598-L620 WeakPolarHBondContact OE2-CB 3.34Å; L620-P622 WeakPolarHBondContact O-CD 3.48Å
621	K	87.3	Confident	88.6	Confident	40 Å²	40	55 Å²	55	17%	0.174	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-57.4	121.9	177.2	-168.7	-175	-173.1	170.8	0	110	E404 K588 E598 S626 C629 V630	E404-K621 IonicContact OE1-NZ 3.74Å; E404-K621 PolarHBondContact OE1-NZ 3.45Å; E404-K621 IonicContact OE2-NZ 2.79Å; E404-K621 PolarHBondContact OE2-NZ 3.1Å; K588-K621 PolarHBondContact NZ-O 2.92Å; E598-K621 WeakPolarHBondContact OE1-CB 2.94Å; E598-K621 PolarHBondContact OE2-N 2.93Å; K621-S626 VanDerWaalsContact CE-O 3.26Å; K621-S626 WeakPolarHBondContact CE-O 2.95Å; K621-C629 HydrophobicContact CG-CB 4.22Å; K621-V630 HydrophobicContact CD-CG2 3.7Å; K621-V630 HydrophobicContact CG-CG2 4.34Å
622	P	85	Confident	88.5	Confident	75 Å²	75	56.4 Å²	56.4	49%	0.487	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-62.3	151.1	175	-22.2	34.2	0	0	0	111.5	L620 L624 G625	L620-P622 WeakPolarHBondContact O-CD 3.48Å; P622-L624 PolarHBondContact O-N 3.38Å; P622-L624 VanDerWaalsContact O-N 3.11Å; P622-G625 PolarHBondContact O-N 3.49Å
623	F	74.9	Confident	88.4	Confident	207 Å²	207	54.8 Å²	54.8	91%	0.908	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.8	-178.6	-177.1	-101.3	0	0	0	114.1
624	L	75.9	Confident	88.4	Confident	161 Å²	161	54.6 Å²	54.6	84%	0.843	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.8	20.8	174.9	-57.3	177.1	0	0	0	112.1	P622	P622-L624 PolarHBondContact O-N 3.38Å; P622-L624 VanDerWaalsContact O-N 3.11Å
625	G	71.8	Confident	88.3	Confident	22 Å²	22	54.8 Å²	54.8	23%	0.227	30%	0.295	C	S	.	.			trans	-82.2	147.4	179.9	0	0	0	0	0	112.8	P622	P622-G625 PolarHBondContact O-N 3.49Å
626	S	77.8	Confident	88.3	Confident	54 Å²	54	57 Å²	57	38%	0.378	30%	0.304	S	S	.	.			trans	-67.6	176.6	171.8	60.9	0	0	0	0	112.3	K621 D628 C629	K621-S626 VanDerWaalsContact CE-O 3.26Å; K621-S626 WeakPolarHBondContact CE-O 2.95Å; S626-D628 VanDerWaalsContact CB-OD2 3.22Å; S626-D628 WeakPolarHBondContact CB-OD2 3.07Å; S626-D628 PolarHBondContact O-N 2.86Å; S626-D628 PolarHBondContact OG-N 3.43Å; S626-D628 PolarHBondContact OG-OD2 3.47Å; S626-C629 WeakPolarHBondContact O-CB 3.37Å; S626-C629 PolarHBondContact O-N 3.15Å; S626-C629 VanDerWaalsContact O-N 3.16Å
627	S	75.6	Confident	88.3	Confident	77 Å²	77	56.8 Å²	56.8	54%	0.538	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-45	-41.3	163	34.9	0	0	0	0	112.3	C629 V630	S627-C629 PolarHBondContact O-N 3.18Å; S627-C629 VanDerWaalsContact O-N 3.12Å; S627-V630 WeakPolarHBondContact O-CB 3.5Å; S627-V630 WeakPolarHBondContact O-CG2 3.24Å; S627-V630 PolarHBondContact O-N 3.04Å
628	D	80.9	Confident	88.3	Confident	100 Å²	100	54.1 Å²	54.1	54%	0.535	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-78.9	2.7	-171.3	-9.7	-60.1	0	0	0	112.1	S626 H650	S626-D628 VanDerWaalsContact CB-OD2 3.22Å; S626-D628 WeakPolarHBondContact CB-OD2 3.07Å; S626-D628 PolarHBondContact O-N 2.86Å; S626-D628 PolarHBondContact OG-N 3.43Å; S626-D628 PolarHBondContact OG-OD2 3.47Å; D628-H650 PolarHBondContact O-CE1 3.02Å
629	C	84.4	Confident	88.3	Confident	33 Å²	33	57 Å²	57	22%	0.223	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-95.1	-3.4	166.3	-59	0	0	0	0	113.2	K621 S626 S627	K621-C629 HydrophobicContact CG-CB 4.22Å; S626-C629 WeakPolarHBondContact O-CB 3.37Å; S626-C629 PolarHBondContact O-N 3.15Å; S626-C629 VanDerWaalsContact O-N 3.16Å; S627-C629 PolarHBondContact O-N 3.18Å; S627-C629 VanDerWaalsContact O-N 3.12Å
630	V	86.4	Confident	88.3	Confident	14 Å²	14	56.7 Å²	56.7	9%	0.085	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	136.9	177.2	174.2	0	0	0	0	110	E404 K621 S627 Q632 H650	E404-V630 HydrophobicContact CB-CG1 4.16Å; E404-V630 HydrophobicContact CB-CG2 4.08Å; E404-V630 HydrophobicContact CG-CG2 4.22Å; E404-V630 WeakPolarHBondContact OE2-CG2 3.06Å; K621-V630 HydrophobicContact CD-CG2 3.7Å; K621-V630 HydrophobicContact CG-CG2 4.34Å; S627-V630 WeakPolarHBondContact O-CB 3.5Å; S627-V630 WeakPolarHBondContact O-CG2 3.24Å; S627-V630 PolarHBondContact O-N 3.04Å; V630-Q632 PolarHBondContact O-N 3.18Å; V630-H650 PolarHBondContact O-CE1 2.96Å; V630-H650 PolarHBondContact O-ND1 2.97Å
631	N	90.1	Very high	88.3	Confident	4 Å²	4	64.1 Å²	64.1	2%	0.021	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	19.7	175.5	-57.2	-19.8	0	0	0	115.7	Q407 I633 H650 W651 D652	Q407-N631 PolarHBondContact NE2-OD1 2.78Å; Q407-N631 PolarHBondContact OE1-ND2 2.79Å; N631-I633 PolarHBondContact O-N 3.15Å; N631-H650 WeakPolarHBondContact O-CA 3.43Å; N631-W651 HydrophobicContact CB-CD2 4.16Å; N631-W651 HydrophobicContact CB-CG 4.3Å; N631-W651 HydrophobicContact CB-CZ2 4.05Å; N631-W651 VanDerWaalsContact CG-CZ2 3.45Å; N631-W651 PolarHBondContact O-N 3.09Å; N631-W651 WeakPolarHBondContact OD1-CZ2 3.4Å; N631-D652 WeakPolarHBondContact CB-OD1 3.4Å; N631-D652 PolarHBondContact ND2-OD1 3.11Å; N631-D652 PolarHBondContact ND2-OD2 2.63Å
632	Q	95	Very high	88.7	Confident	65 Å²	65	67.4 Å²	67.4	30%	0.304	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	133.9	-178.8	-170.6	-177.8	100	0	0	110.4	K619 V630 G649	K619-Q632 HydrophobicContact CB-CB 4.44Å; K619-Q632 WeakPolarHBondContact CB-O 3.43Å; K619-Q632 HydrophobicContact CD-CB 4.46Å; K619-Q632 HydrophobicContact CD-CG 4.25Å; K619-Q632 PolarHBondContact N-O 3.48Å; V630-Q632 PolarHBondContact O-N 3.18Å; Q632-G649 WeakPolarHBondContact CA-O 3.45Å
633	I	97	Very high	89.3	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.021	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	140.7	172.4	-171.7	172.3	0	0	0	109.2	I482 L616 E617 F618 N631 G649 W651 I655	I482-I633 HydrophobicContact CD1-CD1 4.39Å; I482-I633 HydrophobicContact CG1-CD1 4.37Å; L616-I633 HydrophobicContact CB-CD1 4.38Å; L616-I633 HydrophobicContact CD1-CD1 4.37Å; E617-I633 WeakPolarHBondContact O-CA 3.13Å; F618-I633 HydrophobicContact CD2-CD1 4.2Å; F618-I633 HydrophobicContact CE1-CD1 4.18Å; F618-I633 HydrophobicContact CE2-CD1 3.75Å; F618-I633 HydrophobicContact CZ-CD1 3.74Å; N631-I633 PolarHBondContact O-N 3.15Å; I633-G649 PolarHBondContact N-O 3.25Å; I633-G649 PolarHBondContact O-N 3.06Å; I633-G649 VanDerWaalsContact O-N 3.12Å; I633-W651 HydrophobicContact CB-CB 4.44Å; I633-W651 HydrophobicContact CD1-CB 4.47Å; I633-W651 HydrophobicContact CG2-CB 4.31Å; I633-I655 HydrophobicContact CG2-CD1 3.6Å; I633-I655 HydrophobicContact CG2-CG1 3.9Å
634	S	97.5	Very high	90.4	Very high	19 Å²	19	56.6 Å²	56.6	13%	0.133	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	143.3	165.1	59.6	0	0	0	0	111.2	L616 E617 K619 L647	L616-S634 CarbonylContact C-O 3.6Å; E617-S634 PolarHBondContact N-O 3.49Å; E617-S634 PolarHBondContact O-N 3.4Å; E617-S634 VanDerWaalsContact O-N 3.12Å; K619-S634 WeakPolarHBondContact CE-OG 3.45Å; K619-S634 PolarHBondContact NZ-OG 3.38Å; S634-L647 CarbonylContact C-O 3.39Å; S634-L647 WeakPolarHBondContact CA-O 3.43Å
635	G	97.7	Very high	91.4	Very high	4 Å²	4	48.9 Å²	48.9	4%	0.041	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	167.2	-174.3	0	0	0	0	0	114.2	Q615 T646 L647	Q615-G635 CarbonylContact O-C 3.57Å; Q615-G635 WeakPolarHBondContact O-CA 3.35Å; G635-T646 CarbonylContact O-C 3.46Å; G635-T646 WeakPolarHBondContact O-CA 3.37Å; G635-L647 PolarHBondContact N-O 3.44Å; G635-L647 PolarHBondContact O-N 3.26Å
636	K	98	Very high	92.7	Very high	103 Å²	103	48.9 Å²	48.9	45%	0.448	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	118.3	-179.2	-55.5	-171	179.1	175.1	0	110.1	S614 Q615 V643 A645 T646	S614-K636 WeakPolarHBondContact CA-O 3.47Å; Q615-K636 PolarHBondContact N-O 3.03Å; Q615-K636 PolarHBondContact O-N 3.26Å; K636-V643 HydrophobicContact CB-CG1 4.27Å; K636-A645 CarbonylContact C-O 3.58Å; K636-A645 WeakPolarHBondContact CA-O 3.27Å; K636-T646 HydrophobicContact CG-CG2 4.22Å
637	I	98.3	Very high	93.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	136.3	170	-61.3	172	0	0	0	108.5	Y471 M474 K475 V478 S613 L644 A645 L647 I657	Y471-I637 HydrophobicContact CD2-CG2 3.91Å; Y471-I637 HydrophobicContact CE2-CB 4.33Å; Y471-I637 HydrophobicContact CE2-CG2 3.7Å; M474-I637 HydrophobicContact CG-CG2 3.91Å; K475-I637 HydrophobicContact CG-CD1 3.6Å; V478-I637 HydrophobicContact CG2-CD1 4.38Å; V478-I637 HydrophobicContact CG2-CG1 4.49Å; S613-I637 CarbonylContact O-C 3.57Å; I637-L644 PolarHBondContact O-N 3.31Å; I637-A645 HydrophobicContact CB-CB 4.46Å; I637-A645 PolarHBondContact N-O 3.13Å; I637-A645 PolarHBondContact O-N 3.01Å; I637-L647 HydrophobicContact CD1-CD1 4.08Å; I637-L647 HydrophobicContact CG1-CD1 3.93Å; I637-I657 HydrophobicContact CD1-CD1 4.28Å
638	K	97.9	Very high	94.7	Very high	40 Å²	40	48.3 Å²	48.3	17%	0.174	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.9	-168.3	-66	174.5	175.8	178.1	0	112.1	Y612 S613 E642 V643	Y612-K638 WeakPolarHBondContact CA-O 3.37Å; Y612-K638 WeakPolarHBondContact CD1-O 3.47Å; S613-K638 PolarHBondContact N-O 2.95Å; S613-K638 PolarHBondContact O-N 2.74Å; K638-E642 CarbonylContact C-O 3.56Å; K638-E642 WeakPolarHBondContact CA-O 3.22Å; K638-E642 VanDerWaalsContact CB-O 3.23Å; K638-E642 WeakPolarHBondContact CB-O 3.38Å; K638-V643 HydrophobicContact CG-CG2 4.09Å
639	L	97.4	Very high	95.4	Very high	64 Å²	64	44.1 Å²	44.1	34%	0.335	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	108.3	162.1	178	57.7	0	0	0	107.5	Y612 K641 E642 L644	Y612-L639 HydrophobicContact CD1-CB 4.33Å; Y612-L639 HydrophobicContact CD1-CD1 4.47Å; Y612-L639 HydrophobicContact CD2-CD1 4.02Å; Y612-L639 HydrophobicContact CE1-CB 4.14Å; Y612-L639 HydrophobicContact CE1-CD1 4.4Å; Y612-L639 HydrophobicContact CE2-CD1 3.93Å; Y612-L639 HydrophobicContact CG-CD1 4.29Å; L639-K641 PolarHBondContact O-N 3.29Å; L639-E642 PolarHBondContact N-O 2.58Å; L639-E642 VanDerWaalsContact N-O 3.07Å; L639-E642 PolarHBondContact O-N 3.33Å; L639-L644 HydrophobicContact CB-CD1 3.78Å; L639-L644 HydrophobicContact CB-CG 4.4Å
640	G	93.1	Very high	95.9	Very high	53 Å²	53	45.3 Å²	45.3	55%	0.546	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	-103.8	-167.9	0	0	0	0	0	112.8	G611	G611-G640 PolarHBondContact O-N 3.2Å
641	K	91.4	Very high	96.2	Very high	208 Å²	208	45 Å²	45	90%	0.904	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-16.4	179	-65.8	-178.8	-177.9	175	0	114.3	L639	L639-K641 PolarHBondContact O-N 3.29Å
642	E	96.4	Very high	96.1	Very high	109 Å²	109	45.2 Å²	45.2	51%	0.509	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	137.5	179.8	-170.7	-176.8	157.4	0	0	110.1	K638 L639 L644	K638-E642 CarbonylContact C-O 3.56Å; K638-E642 WeakPolarHBondContact CA-O 3.22Å; K638-E642 VanDerWaalsContact CB-O 3.23Å; K638-E642 WeakPolarHBondContact CB-O 3.38Å; L639-E642 PolarHBondContact N-O 2.58Å; L639-E642 VanDerWaalsContact N-O 3.07Å; L639-E642 PolarHBondContact O-N 3.33Å; E642-L644 HydrophobicContact CG-CD2 4.08Å; E642-L644 VanDerWaalsContact OE1-CD2 3.25Å; E642-L644 WeakPolarHBondContact OE1-CD2 3.16Å
643	V	97.4	Very high	96	Very high	51 Å²	51	44.3 Å²	44.3	31%	0.309	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	114.3	172.5	177.1	0	0	0	0	108.3	K636 K638 T646	K636-V643 HydrophobicContact CB-CG1 4.27Å; K638-V643 HydrophobicContact CG-CG2 4.09Å; V643-T646 HydrophobicContact CG1-CG2 4.05Å
644	L	97.4	Very high	95.8	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.016	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-34	-177.1	-62.3	177.7	0	0	0	112.3	Y471 Y612 I637 L639 E642 K660	Y471-L644 HydrophobicContact CD2-CB 4.47Å; Y471-L644 HydrophobicContact CD2-CD1 4.01Å; Y471-L644 HydrophobicContact CE2-CB 3.85Å; Y471-L644 HydrophobicContact CE2-CD1 4.23Å; Y612-L644 HydrophobicContact CD1-CD1 4.18Å; Y612-L644 HydrophobicContact CE1-CD1 3.52Å; I637-L644 PolarHBondContact O-N 3.31Å; L639-L644 HydrophobicContact CB-CD1 3.78Å; L639-L644 HydrophobicContact CB-CG 4.4Å; E642-L644 HydrophobicContact CG-CD2 4.08Å; E642-L644 VanDerWaalsContact OE1-CD2 3.25Å; E642-L644 WeakPolarHBondContact OE1-CD2 3.16Å; L644-K660 WeakPolarHBondContact O-CB 3.11Å; L644-K660 PolarHBondContact O-N 2.9Å
645	A	97.9	Very high	95.8	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	157.4	173.7	0	0	0	0	0	112.1	Y471 K636 I637 I657 N658	Y471-A645 VanDerWaalsContact OH-CB 3.29Å; Y471-A645 WeakPolarHBondContact OH-CB 3.41Å; K636-A645 CarbonylContact C-O 3.58Å; K636-A645 WeakPolarHBondContact CA-O 3.27Å; I637-A645 HydrophobicContact CB-CB 4.46Å; I637-A645 PolarHBondContact N-O 3.13Å; I637-A645 PolarHBondContact O-N 3.01Å; A645-I657 HydrophobicContact CB-CD1 3.83Å; A645-I657 HydrophobicContact CB-CG1 3.8Å; A645-N658 CarbonylContact C-O 3.53Å; A645-N658 VanDerWaalsContact CA-O 3.22Å; A645-N658 WeakPolarHBondContact CA-O 3.22Å; A645-N658 WeakPolarHBondContact CB-O 3.32Å
646	T	98.2	Very high	95.8	Very high	21 Å²	21	50.1 Å²	50.1	13%	0.129	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	137.6	170.9	50.4	0	0	0	0	109.6	G635 K636 V643 I657 N658 K660	G635-T646 CarbonylContact O-C 3.46Å; G635-T646 WeakPolarHBondContact O-CA 3.37Å; K636-T646 HydrophobicContact CG-CG2 4.22Å; V643-T646 HydrophobicContact CG1-CG2 4.05Å; T646-I657 WeakPolarHBondContact O-CA 3.48Å; T646-N658 PolarHBondContact N-O 2.83Å; T646-N658 PolarHBondContact O-N 3.46Å; T646-K660 PolarHBondContact OG1-NZ 3.37Å
647	L	98.1	Very high	95.8	Very high	3 Å²	3	46 Å²	46	2%	0.016	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	135.4	176.6	-63.3	87.4	0	0	0	109.1	V478 I482 S634 G635 I637 I655 F656 I657 F668	V478-L647 HydrophobicContact CG1-CD2 3.97Å; I482-L647 HydrophobicContact CD1-CD2 4.37Å; S634-L647 CarbonylContact C-O 3.39Å; S634-L647 WeakPolarHBondContact CA-O 3.43Å; G635-L647 PolarHBondContact N-O 3.44Å; G635-L647 PolarHBondContact O-N 3.26Å; I637-L647 HydrophobicContact CD1-CD1 4.08Å; I637-L647 HydrophobicContact CG1-CD1 3.93Å; L647-I655 HydrophobicContact CB-CG2 4.2Å; L647-F656 CarbonylContact C-O 3.59Å; L647-F656 VanDerWaalsContact CA-O 3.24Å; L647-F656 WeakPolarHBondContact CA-O 3.34Å; L647-I657 HydrophobicContact CD1-CD1 4.47Å; L647-I657 HydrophobicContact CG-CB 4.41Å; L647-I657 HydrophobicContact CG-CD1 4.36Å; L647-I657 HydrophobicContact CG-CG1 4.21Å; L647-F668 HydrophobicContact CD2-CD1 3.64Å; L647-F668 HydrophobicContact CD2-CD2 4.28Å; L647-F668 HydrophobicContact CD2-CE1 3.56Å; L647-F668 HydrophobicContact CD2-CE2 4.19Å; L647-F668 HydrophobicContact CD2-CG 4.01Å; L647-F668 HydrophobicContact CD2-CZ 3.83Å
648	E	97.3	Very high	95.8	Very high	116 Å²	116	48 Å²	48	54%	0.542	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	138.1	178.9	-62	-173.7	174	0	0	110.2	F656	E648-F656 PolarHBondContact N-O 2.96Å; E648-F656 PolarHBondContact O-N 2.86Å
649	G	96.1	Very high	95.6	Very high	13 Å²	13	47 Å²	47	13%	0.134	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.2	-146.9	-179	0	0	0	0	0	113.2	Q632 I633 E654	Q632-G649 WeakPolarHBondContact CA-O 3.45Å; I633-G649 PolarHBondContact N-O 3.25Å; I633-G649 PolarHBondContact O-N 3.06Å; I633-G649 VanDerWaalsContact O-N 3.12Å; G649-E654 WeakPolarHBondContact CA-O 3.12Å
650	H	94.7	Very high	95.4	Very high	58 Å²	58	49.3 Å²	49.3	27%	0.269	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	135.8	-178.4	-58	-101.1	0	0	0	111.4	D628 V630 N631 D652 S653 E654 I655	D628-H650 PolarHBondContact O-CE1 3.02Å; V630-H650 PolarHBondContact O-CE1 2.96Å; V630-H650 PolarHBondContact O-ND1 2.97Å; N631-H650 WeakPolarHBondContact O-CA 3.43Å; H650-D652 VanDerWaalsContact C-N 3.28Å; H650-D652 PolarHBondContact O-N 3.02Å; H650-S653 CarbonylContact O-C 3.58Å; H650-S653 PolarHBondContact O-N 3.2Å; H650-S653 VanDerWaalsContact O-O 3.05Å; H650-E654 PolarHBondContact N-O 3.41Å; H650-I655 VanDerWaalsContact O-CG1 3.32Å; H650-I655 WeakPolarHBondContact O-CG1 3.37Å
651	W	92.5	Very high	95.2	Very high	8 Å²	8	53.8 Å²	53.8	3%	0.03	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-14.9	-172.7	59.9	-104.8	0	0	0	115.2	F485 K488 L599 F618 N631 I633	F485-W651 HydrophobicContact CB-CD2 4.39Å; F485-W651 HydrophobicContact CB-CE3 3.75Å; F485-W651 HydrophobicContact CB-CZ3 4.39Å; F485-W651 VanDerWaalsContact O-CZ3 3.27Å; F485-W651 WeakPolarHBondContact O-CZ3 3.32Å; K488-W651 HydrophobicContact CD-CH2 4.27Å; K488-W651 HydrophobicContact CD-CZ3 4.29Å; L599-W651 HydrophobicContact CB-CZ2 4.08Å; L599-W651 HydrophobicContact CD1-CD2 4.08Å; L599-W651 HydrophobicContact CD1-CE3 4.2Å; L599-W651 HydrophobicContact CD1-CH2 3.92Å; L599-W651 HydrophobicContact CD1-CZ2 3.76Å; L599-W651 HydrophobicContact CD1-CZ3 4.13Å; L599-W651 HydrophobicContact CG-CH2 4.16Å; L599-W651 HydrophobicContact CG-CZ2 3.73Å; F618-W651 HydrophobicContact CD1-CB 4.37Å; F618-W651 AromaticContact CD1-CD1 3.42Å; F618-W651 VanDerWaalsContact CD1-CD1 3.42Å; F618-W651 AromaticContact CD1-CG 3.9Å; F618-W651 HydrophobicContact CD1-CG 3.9Å; F618-W651 AromaticContact CD1-NE1 3.84Å; F618-W651 HydrophobicContact CE1-CB 3.79Å; F618-W651 AromaticContact CE1-CD1 3.69Å; F618-W651 HydrophobicContact CE1-CD2 4.33Å; F618-W651 AromaticContact CE1-CG 3.67Å; F618-W651 HydrophobicContact CE1-CG 3.67Å; N631-W651 HydrophobicContact CB-CD2 4.16Å; N631-W651 HydrophobicContact CB-CG 4.3Å; N631-W651 HydrophobicContact CB-CZ2 4.05Å; N631-W651 VanDerWaalsContact CG-CZ2 3.45Å; N631-W651 PolarHBondContact O-N 3.09Å; N631-W651 WeakPolarHBondContact OD1-CZ2 3.4Å; I633-W651 HydrophobicContact CB-CB 4.44Å; I633-W651 HydrophobicContact CD1-CB 4.47Å; I633-W651 HydrophobicContact CG2-CB 4.31Å
652	D	89.4	Confident	95.1	Very high	7 Å²	7	48.2 Å²	48.2	4%	0.037	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	11.1	172.7	68.4	-42.9	0	0	0	114.1	G403 K488 N631 H650	G403-D652 PolarHBondContact N-OD2 3.11Å; K488-D652 IonicContact NZ-OD2 3.9Å; K488-D652 PolarHBondContact NZ-OD2 3.35Å; N631-D652 WeakPolarHBondContact CB-OD1 3.4Å; N631-D652 PolarHBondContact ND2-OD1 3.11Å; N631-D652 PolarHBondContact ND2-OD2 2.63Å; H650-D652 VanDerWaalsContact C-N 3.28Å; H650-D652 PolarHBondContact O-N 3.02Å
653	S	91.3	Very high	94.7	Very high	47 Å²	47	45.8 Å²	45.8	33%	0.329	25%	0.246	S	C	.	.	S	Bend	trans	-149.5	-151.8	-179.5	-162.6	0	0	0	0	110.3	H650 P671	H650-S653 CarbonylContact O-C 3.58Å; H650-S653 PolarHBondContact O-N 3.2Å; H650-S653 VanDerWaalsContact O-O 3.05Å; S653-P671 VanDerWaalsContact O-CD 3.25Å; S653-P671 WeakPolarHBondContact O-CD 3.49Å
654	E	94.8	Very high	94.3	Very high	87 Å²	87	46.3 Å²	46.3	41%	0.407	25%	0.25	S	C	.	.			trans	-61.3	139.6	178.1	-61.5	178.8	155.2	0	0	113.6	G649 H650 F656 W669 D670	G649-E654 WeakPolarHBondContact CA-O 3.12Å; H650-E654 PolarHBondContact N-O 3.41Å; E654-F656 HydrophobicContact CB-CE2 4.08Å; E654-F656 HydrophobicContact CB-CZ 4.09Å; E654-F656 WeakPolarHBondContact OE2-CZ 3.49Å; E654-W669 CarbonylContact C-O 3.56Å; E654-W669 WeakPolarHBondContact CA-O 3.15Å; E654-D670 HydrophobicContact CG-CB 4.31Å
655	I	97.3	Very high	94.2	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	132.6	167.1	-54.8	169.9	0	0	0	108.5	I482 I633 L647 H650 F668 W669	I482-I655 HydrophobicContact CD1-CD1 4.06Å; I482-I655 HydrophobicContact CG2-CD1 3.61Å; I633-I655 HydrophobicContact CG2-CD1 3.6Å; I633-I655 HydrophobicContact CG2-CG1 3.9Å; L647-I655 HydrophobicContact CB-CG2 4.2Å; H650-I655 VanDerWaalsContact O-CG1 3.32Å; H650-I655 WeakPolarHBondContact O-CG1 3.37Å; I655-F668 WeakPolarHBondContact O-CA 3.25Å; I655-F668 WeakPolarHBondContact O-CB 3.28Å; I655-F668 PolarHBondContact O-N 2.89Å; I655-W669 HydrophobicContact CB-CB 4.24Å; I655-W669 HydrophobicContact CD1-CB 4.38Å; I655-W669 HydrophobicContact CD1-CG 4.48Å; I655-W669 PolarHBondContact N-O 2.89Å; I655-W669 PolarHBondContact O-N 3.05Å; I655-W669 VanDerWaalsContact O-N 3.15Å
656	F	97.8	Very high	94.1	Very high	61 Å²	61	55.5 Å²	55.5	27%	0.268	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	149.1	177.8	-56.4	-83	0	0	0	110.7	L647 E648 E654 M665 D666	L647-F656 CarbonylContact C-O 3.59Å; L647-F656 VanDerWaalsContact CA-O 3.24Å; L647-F656 WeakPolarHBondContact CA-O 3.34Å; E648-F656 PolarHBondContact N-O 2.96Å; E648-F656 PolarHBondContact O-N 2.86Å; E654-F656 HydrophobicContact CB-CE2 4.08Å; E654-F656 HydrophobicContact CB-CZ 4.09Å; E654-F656 WeakPolarHBondContact OE2-CZ 3.49Å; F656-M665 HydrophobicContact CB-CE 3.48Å; F656-M665 VanDerWaalsContact CB-CE 3.48Å; F656-M665 HydrophobicContact CB-CG 4.17Å; F656-M665 HydrophobicContact CD2-CE 4.17Å; F656-M665 HydrophobicContact CG-CE 3.82Å; F656-D666 CarbonylContact C-O 3.54Å; F656-D666 WeakPolarHBondContact CA-O 3.37Å
657	I	97.8	Very high	94	Very high	15 Å²	15	58.6 Å²	58.6	8%	0.077	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	134.2	168.5	-170	165.6	0	0	0	109.5	K475 I637 A645 T646 L647 M665 D666 F668	K475-I657 HydrophobicContact CD-CD1 3.78Å; K475-I657 HydrophobicContact CG-CD1 4.07Å; I637-I657 HydrophobicContact CD1-CD1 4.28Å; A645-I657 HydrophobicContact CB-CD1 3.83Å; A645-I657 HydrophobicContact CB-CG1 3.8Å; T646-I657 WeakPolarHBondContact O-CA 3.48Å; L647-I657 HydrophobicContact CD1-CD1 4.47Å; L647-I657 HydrophobicContact CG-CB 4.41Å; L647-I657 HydrophobicContact CG-CD1 4.36Å; L647-I657 HydrophobicContact CG-CG1 4.21Å; I657-M665 CarbonylContact O-C 3.58Å; I657-M665 WeakPolarHBondContact O-CA 3.37Å; I657-D666 HydrophobicContact CG2-CB 4.31Å; I657-D666 PolarHBondContact N-O 2.93Å; I657-D666 PolarHBondContact O-N 3.13Å; I657-F668 HydrophobicContact CB-CB 3.89Å; I657-F668 HydrophobicContact CB-CD2 3.9Å; I657-F668 HydrophobicContact CB-CG 4.18Å; I657-F668 HydrophobicContact CD1-CD2 3.83Å; I657-F668 HydrophobicContact CD1-CE2 4.01Å; I657-F668 HydrophobicContact CG1-CD2 4.46Å; I657-F668 HydrophobicContact CG2-CB 3.91Å; I657-F668 HydrophobicContact CG2-CD2 3.91Å; I657-F668 HydrophobicContact CG2-CG 4.36Å
658	N	97.3	Very high	93.9	Very high	43 Å²	43	59.2 Å²	59.2	23%	0.23	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	110.1	172.4	176.6	-70.7	0	0	0	108.1	A645 T646 K660 T664	A645-N658 CarbonylContact C-O 3.53Å; A645-N658 VanDerWaalsContact CA-O 3.22Å; A645-N658 WeakPolarHBondContact CA-O 3.22Å; A645-N658 WeakPolarHBondContact CB-O 3.32Å; T646-N658 PolarHBondContact N-O 2.83Å; T646-N658 PolarHBondContact O-N 3.46Å; N658-K660 PolarHBondContact OD1-NZ 3.2Å; N658-T664 WeakPolarHBondContact CA-O 3.34Å
659	D	94.3	Very high	93.9	Very high	20 Å²	20	53.7 Å²	53.7	11%	0.107	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	125.1	-179.4	-171.9	-55.7	0	0	0	110.3	Y471 K661 G663 T664	Y471-D659 WeakPolarHBondContact CE1-OD2 3.36Å; Y471-D659 VanDerWaalsContact CZ-OD2 3.29Å; Y471-D659 PolarHBondContact OH-OD2 2.95Å; D659-K661 PolarHBondContact O-N 2.97Å; D659-K661 WeakPolarHBondContact OD1-CB 3.16Å; D659-K661 PolarHBondContact OD1-N 3.15Å; D659-G663 WeakPolarHBondContact O-CA 3.19Å; D659-G663 PolarHBondContact O-N 2.99Å; D659-T664 PolarHBondContact N-O 2.89Å
660	K	92.9	Very high	93.8	Very high	111 Å²	111	55.5 Å²	55.5	48%	0.483	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-12.4	-174	-62.9	-56.7	178.2	-151.1	0	114	L644 T646 N658	L644-K660 WeakPolarHBondContact O-CB 3.11Å; L644-K660 PolarHBondContact O-N 2.9Å; T646-K660 PolarHBondContact OG1-NZ 3.37Å; N658-K660 PolarHBondContact OD1-NZ 3.2Å
661	K	88.6	Confident	93.6	Very high	148 Å²	148	53 Å²	53	64%	0.643	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-34.3	178.9	-66.7	179.7	174.3	174.1	0	112.6	D659	D659-K661 PolarHBondContact O-N 2.97Å; D659-K661 WeakPolarHBondContact OD1-CB 3.16Å; D659-K661 PolarHBondContact OD1-N 3.15Å
662	T	88.8	Confident	93.5	Very high	91 Å²	91	54.6 Å²	54.6	56%	0.558	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-29.6	176	60.7	0	0	0	0	112.7	T664	T662-T664 PolarHBondContact O-N 2.94Å; T662-T664 PolarHBondContact OG1-N 2.95Å; T662-T664 VanDerWaalsContact OG1-N 3.09Å; T662-T664 PolarHBondContact OG1-OG1 3.41Å
663	G	88.3	Confident	93.4	Very high	57 Å²	57	58.8 Å²	58.8	59%	0.588	33%	0.326	S	S	*	.			trans	72.2	5.7	-167.2	0	0	0	0	0	113.8	D659	D659-G663 WeakPolarHBondContact O-CA 3.19Å; D659-G663 PolarHBondContact O-N 2.99Å
664	T	90.4	Very high	93.3	Very high	62 Å²	62	62.8 Å²	62.8	38%	0.38	34%	0.34	S	S	.	.			trans	-77.4	149.8	177.2	59.7	0	0	0	0	110.8	N658 D659 T662 D666	N658-T664 WeakPolarHBondContact CA-O 3.34Å; D659-T664 PolarHBondContact N-O 2.89Å; T662-T664 PolarHBondContact O-N 2.94Å; T662-T664 PolarHBondContact OG1-N 2.95Å; T662-T664 VanDerWaalsContact OG1-N 3.09Å; T662-T664 PolarHBondContact OG1-OG1 3.41Å; T664-D666 VanDerWaalsContact CB-OD2 3.24Å; T664-D666 WeakPolarHBondContact CB-OD2 3.23Å; T664-D666 PolarHBondContact OG1-OD2 3.32Å
665	M	94.4	Very high	93.1	Very high	116 Å²	116	60.6 Å²	60.6	57%	0.571	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.5	112	173.5	-176.1	168.4	176.5	0	0	107.7	F656 I657	F656-M665 HydrophobicContact CB-CE 3.48Å; F656-M665 VanDerWaalsContact CB-CE 3.48Å; F656-M665 HydrophobicContact CB-CG 4.17Å; F656-M665 HydrophobicContact CD2-CE 4.17Å; F656-M665 HydrophobicContact CG-CE 3.82Å; I657-M665 CarbonylContact O-C 3.58Å; I657-M665 WeakPolarHBondContact O-CA 3.37Å
666	D	95.6	Very high	92.6	Very high	80 Å²	80	63.1 Å²	63.1	43%	0.428	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	147.3	-166.1	-58.3	-71.1	0	0	0	109.8	F656 I657 T664 F668	F656-D666 CarbonylContact C-O 3.54Å; F656-D666 WeakPolarHBondContact CA-O 3.37Å; I657-D666 HydrophobicContact CG2-CB 4.31Å; I657-D666 PolarHBondContact N-O 2.93Å; I657-D666 PolarHBondContact O-N 3.13Å; T664-D666 VanDerWaalsContact CB-OD2 3.24Å; T664-D666 WeakPolarHBondContact CB-OD2 3.23Å; T664-D666 PolarHBondContact OG1-OD2 3.32Å; D666-F668 PolarHBondContact O-N 2.79Å
667	T	96.6	Very high	92	Very high	86 Å²	86	67.4 Å²	67.4	53%	0.528	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	119.5	175.3	-51.7	0	0	0	0	109.8	D670	T667-D670 HydrophobicContact CG2-CB 4.17Å
668	F	96.8	Very high	91.6	Very high	16 Å²	16	71.8 Å²	71.8	7%	0.07	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-44.7	-175.4	179.6	-96.6	0	0	0	111.9	K475 V478 K479 I482 L647 I655 I657 D666	K475-F668 HydrophobicContact CB-CE2 4.06Å; K475-F668 HydrophobicContact CG-CE2 4.26Å; K475-F668 VanDerWaalsContact O-CZ 3.27Å; K475-F668 WeakPolarHBondContact O-CZ 3.17Å; V478-F668 HydrophobicContact CB-CZ 4.07Å; V478-F668 HydrophobicContact CG1-CE1 4.01Å; V478-F668 HydrophobicContact CG1-CZ 3.81Å; K479-F668 HydrophobicContact CB-CE1 3.84Å; K479-F668 HydrophobicContact CB-CZ 3.76Å; K479-F668 WeakPolarHBondContact CD-O 3.36Å; K479-F668 VanDerWaalsContact CE-O 3.26Å; K479-F668 WeakPolarHBondContact CE-O 3.5Å; K479-F668 HydrophobicContact CG-CE1 4.33Å; K479-F668 PolarHBondContact NZ-O 2.91Å; I482-F668 HydrophobicContact CD1-CE1 4.09Å; L647-F668 HydrophobicContact CD2-CD1 3.64Å; L647-F668 HydrophobicContact CD2-CD2 4.28Å; L647-F668 HydrophobicContact CD2-CE1 3.56Å; L647-F668 HydrophobicContact CD2-CE2 4.19Å; L647-F668 HydrophobicContact CD2-CG 4.01Å; L647-F668 HydrophobicContact CD2-CZ 3.83Å; I655-F668 WeakPolarHBondContact O-CA 3.25Å; I655-F668 WeakPolarHBondContact O-CB 3.28Å; I655-F668 PolarHBondContact O-N 2.89Å; I657-F668 HydrophobicContact CB-CB 3.89Å; I657-F668 HydrophobicContact CB-CD2 3.9Å; I657-F668 HydrophobicContact CB-CG 4.18Å; I657-F668 HydrophobicContact CD1-CD2 3.83Å; I657-F668 HydrophobicContact CD1-CE2 4.01Å; I657-F668 HydrophobicContact CG1-CD2 4.46Å; I657-F668 HydrophobicContact CG2-CB 3.91Å; I657-F668 HydrophobicContact CG2-CD2 3.91Å; I657-F668 HydrophobicContact CG2-CG 4.36Å; D666-F668 PolarHBondContact O-N 2.79Å
669	W	95.8	Very high	91.2	Very high	1 Å²	1	72.9 Å²	72.9	0%	0.004	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	137.2	-179.5	173.4	-103.1	0	0	0	109.4	F460 K479 I482 S483 Y486 E654 I655 P671 L675	F460-W669 HydrophobicContact CE2-CE3 4.48Å; F460-W669 AromaticContact CE2-CZ3 3.68Å; F460-W669 HydrophobicContact CE2-CZ3 3.68Å; F460-W669 HydrophobicContact CZ-CZ3 4.08Å; K479-W669 HydrophobicContact CG-CE3 4Å; I482-W669 HydrophobicContact CG2-CB 4.14Å; I482-W669 HydrophobicContact CG2-CD2 4.08Å; I482-W669 HydrophobicContact CG2-CG 3.63Å; S483-W669 VanDerWaalsContact CB-CH2 3.41Å; Y486-W669 HydrophobicContact CD1-CH2 4.21Å; Y486-W669 AromaticContact CD1-CZ2 3.54Å; Y486-W669 HydrophobicContact CD1-CZ2 3.54Å; Y486-W669 HydrophobicContact CE1-CH2 4.15Å; Y486-W669 AromaticContact CE1-CZ2 3.94Å; Y486-W669 HydrophobicContact CE1-CZ2 3.94Å; Y486-W669 HydrophobicContact CG-CZ2 4.32Å; E654-W669 CarbonylContact C-O 3.56Å; E654-W669 WeakPolarHBondContact CA-O 3.15Å; I655-W669 HydrophobicContact CB-CB 4.24Å; I655-W669 HydrophobicContact CD1-CB 4.38Å; I655-W669 HydrophobicContact CD1-CG 4.48Å; I655-W669 PolarHBondContact N-O 2.89Å; I655-W669 PolarHBondContact O-N 3.05Å; I655-W669 VanDerWaalsContact O-N 3.15Å; W669-P671 HydrophobicContact CZ2-CB 3.93Å; W669-L675 HydrophobicContact CE3-CD2 4.32Å; W669-L675 HydrophobicContact CH2-CD2 3.52Å; W669-L675 HydrophobicContact CZ2-CD2 4.34Å; W669-L675 HydrophobicContact CZ3-CD2 3.51Å
670	D	93.9	Very high	91.2	Very high	51 Å²	51	72.9 Å²	72.9	27%	0.273	39%	0.385	S	S	.	.			trans	-154	118.1	170.6	173.2	10.2	0	0	0	107.6	E654 T667 T672 L675	E654-D670 HydrophobicContact CG-CB 4.31Å; T667-D670 HydrophobicContact CG2-CB 4.17Å; D670-T672 HydrophobicContact CB-CG2 4.27Å; D670-T672 VanDerWaalsContact CG-CG2 3.46Å; D670-T672 PolarHBondContact O-N 3.07Å; D670-T672 WeakPolarHBondContact OD2-CG2 3.3Å; D670-L675 VanDerWaalsContact O-CD2 3.26Å; D670-L675 WeakPolarHBondContact O-CD2 3.35Å
671	P	91.2	Very high	91.1	Very high	4 Å²	4	69.8 Å²	69.8	3%	0.026	38%	0.376	C	S	.	.			trans	-78.8	64.4	177.7	34	-33.9	0	0	0	111.1	Y486 S653 W669 R676	Y486-P671 HydrophobicContact CD1-CB 4.31Å; Y486-P671 HydrophobicContact CD2-CB 3.96Å; Y486-P671 HydrophobicContact CG-CB 3.79Å; S653-P671 VanDerWaalsContact O-CD 3.25Å; S653-P671 WeakPolarHBondContact O-CD 3.49Å; W669-P671 HydrophobicContact CZ2-CB 3.93Å; P671-R676 VanDerWaalsContact O-CZ 3.3Å; P671-R676 PolarHBondContact O-NE 3.27Å; P671-R676 PolarHBondContact O-NH2 2.79Å
672	T	90.8	Very high	91.3	Very high	42 Å²	42	63.2 Å²	63.2	26%	0.258	35%	0.347	S	S	.	.			trans	-60.4	158.9	178.6	66.4	0	0	0	0	112.6	D670 E674 L675 R676	D670-T672 HydrophobicContact CB-CG2 4.27Å; D670-T672 VanDerWaalsContact CG-CG2 3.46Å; D670-T672 PolarHBondContact O-N 3.07Å; D670-T672 WeakPolarHBondContact OD2-CG2 3.3Å; T672-E674 PolarHBondContact O-N 2.88Å; T672-L675 PolarHBondContact O-N 3.28Å; T672-L675 WeakPolarHBondContact OG1-CB 3.4Å; T672-L675 PolarHBondContact OG1-N 2.84Å; T672-R676 VanDerWaalsContact O-CG 3.31Å; T672-R676 WeakPolarHBondContact O-CG 3.45Å; T672-R676 PolarHBondContact O-N 2.7Å
673	P	87.7	Confident	91.6	Very high	96 Å²	96	60.2 Å²	60.2	62%	0.623	33%	0.326	S	S	*	.	H	α-helix	trans	-55.9	-38.3	172.2	-26.1	35.8	0	0	0	113.2	R676 Q677	P673-R676 PolarHBondContact O-N 3.2Å; P673-Q677 VanDerWaalsContact O-CG 3.32Å; P673-Q677 WeakPolarHBondContact O-CG 3.46Å; P673-Q677 PolarHBondContact O-N 2.84Å
674	E	88.8	Confident	91.9	Very high	130 Å²	130	58.2 Å²	58.2	61%	0.607	30%	0.302	S	S	*	.	H	α-helix	trans	-63.6	-47.3	174.9	178.9	179.3	-176.1	0	0	111.6	T672 R676 Q677 N678	T672-E674 PolarHBondContact O-N 2.88Å; E674-R676 VanDerWaalsContact C-N 3.27Å; E674-R676 PolarHBondContact O-N 2.82Å; E674-Q677 PolarHBondContact O-N 3.22Å; E674-Q677 VanDerWaalsContact O-N 3.08Å; E674-N678 WeakPolarHBondContact CG-ND2 3.46Å; E674-N678 WeakPolarHBondContact O-CB 3Å; E674-N678 PolarHBondContact O-N 3.37Å; E674-N678 PolarHBondContact O-ND2 3.38Å
675	L	89.1	Confident	92.1	Very high	41 Å²	41	55.3 Å²	55.3	22%	0.215	28%	0.284	C	S	.	.	H	α-helix	trans	-65	-32.7	177.8	-172.1	65.7	0	0	0	112.1	F460 W669 D670 T672 R679	F460-L675 HydrophobicContact CZ-CD1 4.43Å; W669-L675 HydrophobicContact CE3-CD2 4.32Å; W669-L675 HydrophobicContact CH2-CD2 3.52Å; W669-L675 HydrophobicContact CZ2-CD2 4.34Å; W669-L675 HydrophobicContact CZ3-CD2 3.51Å; D670-L675 VanDerWaalsContact O-CD2 3.26Å; D670-L675 WeakPolarHBondContact O-CD2 3.35Å; T672-L675 PolarHBondContact O-N 3.28Å; T672-L675 WeakPolarHBondContact OG1-CB 3.4Å; T672-L675 PolarHBondContact OG1-N 2.84Å; L675-R679 PolarHBondContact O-N 2.93Å
676	R	87.6	Confident	92	Very high	55 Å²	55	50 Å²	50	21%	0.208	26%	0.259	C	S	.	.	H	α-helix	trans	-68.1	-34.7	172.4	-67	175.3	-157.5	-138.6	-0.2	112.2	L399 Y486 P671 T672 P673 E674 R679	L399-R676 HydrophobicContact CD1-CB 4.33Å; L399-R676 HydrophobicContact CD1-CG 4.45Å; Y486-R676 HydrophobicContact CE2-CG 3.9Å; P671-R676 VanDerWaalsContact O-CZ 3.3Å; P671-R676 PolarHBondContact O-NE 3.27Å; P671-R676 PolarHBondContact O-NH2 2.79Å; T672-R676 VanDerWaalsContact O-CG 3.31Å; T672-R676 WeakPolarHBondContact O-CG 3.45Å; T672-R676 PolarHBondContact O-N 2.7Å; P673-R676 PolarHBondContact O-N 3.2Å; E674-R676 VanDerWaalsContact C-N 3.27Å; E674-R676 PolarHBondContact O-N 2.82Å; R676-R679 VanDerWaalsContact O-CD 3.25Å; R676-R679 WeakPolarHBondContact O-CD 3.48Å; R676-R679 VanDerWaalsContact O-CG 3.26Å; R676-R679 WeakPolarHBondContact O-CG 3.06Å; R676-R679 PolarHBondContact O-NH1 2.93Å
677	Q	86.3	Confident	91.7	Very high	150 Å²	150	49 Å²	49	70%	0.701	26%	0.256	S	S	*	.	H	α-helix	trans	-73	-41.9	175.3	-72.8	169	4.5	0	0	111.5	P673 E674 R679	P673-Q677 VanDerWaalsContact O-CG 3.32Å; P673-Q677 WeakPolarHBondContact O-CG 3.46Å; P673-Q677 PolarHBondContact O-N 2.84Å; E674-Q677 PolarHBondContact O-N 3.22Å; E674-Q677 VanDerWaalsContact O-N 3.08Å; Q677-R679 PolarHBondContact O-N 3.27Å
678	N	87.4	Confident	91.4	Very high	108 Å²	108	51.6 Å²	51.6	58%	0.578	26%	0.263	S	S	*	.	S	Bend	trans	-79.4	9	179.8	-68	-27.8	0	0	0	114.5	E674	E674-N678 WeakPolarHBondContact CG-ND2 3.46Å; E674-N678 WeakPolarHBondContact O-CB 3Å; E674-N678 PolarHBondContact O-N 3.37Å; E674-N678 PolarHBondContact O-ND2 3.38Å
679	R	90.9	Very high	91.3	Very high	65 Å²	65	56.2 Å²	56.2	25%	0.245	28%	0.284	C	S	.	.	S	Bend	trans	-65	151.7	174.8	77.2	-171.5	-176.3	-66.8	0.4	110.7	E397 Y456 L675 R676 Q677 T681	E397-R679 IonicContact OE2-CZ 2.68Å; E397-R679 VanDerWaalsContact OE2-CZ 3.23Å; E397-R679 IonicContact OE2-NE 3.87Å; E397-R679 PolarHBondContact OE2-NE 2.95Å; E397-R679 IonicContact OE2-NH2 2.65Å; E397-R679 PolarHBondContact OE2-NH2 2.75Å; Y456-R679 HydrophobicContact CD1-CG 4.06Å; L675-R679 PolarHBondContact O-N 2.93Å; R676-R679 VanDerWaalsContact O-CD 3.25Å; R676-R679 WeakPolarHBondContact O-CD 3.48Å; R676-R679 VanDerWaalsContact O-CG 3.26Å; R676-R679 WeakPolarHBondContact O-CG 3.06Å; R676-R679 PolarHBondContact O-NH1 2.93Å; Q677-R679 PolarHBondContact O-N 3.27Å; R679-T681 PolarHBondContact O-N 2.93Å
680	L	93	Very high	91.2	Very high	20 Å²	20	56.5 Å²	56.5	11%	0.105	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-63.2	131.1	175.3	-62.5	174	0	0	0	110.8	Y456 A458 D459 W508 H510 R682	Y456-L680 WeakPolarHBondContact CD1-O 3.16Å; Y456-L680 WeakPolarHBondContact O-CB 3.45Å; Y456-L680 PolarHBondContact O-N 2.84Å; A458-L680 HydrophobicContact CB-CD1 3.93Å; D459-L680 HydrophobicContact CB-CD1 4.4Å; D459-L680 HydrophobicContact CB-CD2 4.44Å; W508-L680 HydrophobicContact CB-CB 4.02Å; W508-L680 HydrophobicContact CB-CD1 4.16Å; W508-L680 HydrophobicContact CG-CB 4.09Å; H510-L680 WeakPolarHBondContact NE2-CD1 3.24Å; L680-R682 PolarHBondContact O-N 2.95Å
681	T	90.9	Very high	91.2	Very high	47 Å²	47	55.8 Å²	55.8	29%	0.288	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-66.2	127.9	172.7	-59.1	0	0	0	0	110.7	E393 W508 R679 Y683	E393-T681 HydrophobicContact CG-CG2 3.57Å; W508-T681 VanDerWaalsContact CD1-O 3.26Å; R679-T681 PolarHBondContact O-N 2.93Å; T681-Y683 HydrophobicContact CG2-CD2 4.16Å; T681-Y683 HydrophobicContact CG2-CE2 3.52Å; T681-Y683 WeakPolarHBondContact O-CD2 3.32Å
682	R	93	Very high	91.4	Very high	10 Å²	10	60.6 Å²	60.6	4%	0.038	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.2	172.8	-170.6	169.9	74.4	162.8	5.2	109.9	Q394 D449 S452 Y456 Y504 C506 W508 L680 T684	Q394-R682 WeakPolarHBondContact CB-O 3.43Å; Q394-R682 PolarHBondContact N-O 3.37Å; Q394-R682 VanDerWaalsContact N-O 3.16Å; D449-R682 IonicContact OD1-CZ 2.71Å; D449-R682 IonicContact OD1-NH1 2.72Å; D449-R682 PolarHBondContact OD1-NH1 2.83Å; D449-R682 IonicContact OD1-NH2 2.73Å; D449-R682 PolarHBondContact OD1-NH2 3.32Å; S452-R682 PolarHBondContact OG-NH1 3.04Å; Y456-R682 HydrophobicContact CE1-CB 4.11Å; Y456-R682 WeakPolarHBondContact OH-CD 3.34Å; Y456-R682 PolarHBondContact OH-NE 3.44Å; Y456-R682 VanDerWaalsContact OH-NE 3.14Å; Y504-R682 PolarHBondContact OH-NH1 2.83Å; C506-R682 HydrophobicContact CB-CG 4.04Å; W508-R682 HydrophobicContact CZ2-CG 4.02Å; L680-R682 PolarHBondContact O-N 2.95Å; R682-T684 HydrophobicContact CG-CG2 4.49Å
683	Y	94.8	Very high	91.7	Very high	28 Å²	28	63.7 Å²	63.7	11%	0.11	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	138.3	173.1	-62.1	-107.8	0	0	0	109.9	M392 E393 C506 M507 L509 T681	M392-Y683 VanDerWaalsContact C-CD1 3.48Å; M392-Y683 CarbonylContact O-C 3.56Å; M392-Y683 WeakPolarHBondContact O-CA 3.36Å; M392-Y683 WeakPolarHBondContact O-CB 3.49Å; E393-Y683 HydrophobicContact CB-CD1 4.01Å; E393-Y683 HydrophobicContact CB-CE1 3.58Å; E393-Y683 HydrophobicContact CG-CE1 4.22Å; E393-Y683 PolarHBondContact OE2-OH 2.64Å; C506-Y683 VanDerWaalsContact CA-O 3.3Å; C506-Y683 WeakPolarHBondContact CA-O 3.41Å; C506-Y683 WeakPolarHBondContact CB-O 3.36Å; M507-Y683 HydrophobicContact CE-CD1 4.22Å; M507-Y683 HydrophobicContact CE-CD2 4.22Å; M507-Y683 HydrophobicContact CE-CG 3.87Å; M507-Y683 PolarHBondContact N-O 3.04Å; M507-Y683 PolarHBondContact O-N 3.08Å; L509-Y683 HydrophobicContact CB-CE2 4.14Å; L509-Y683 HydrophobicContact CD1-CD2 4.4Å; L509-Y683 HydrophobicContact CD1-CE1 4.2Å; L509-Y683 HydrophobicContact CD1-CE2 3.72Å; L509-Y683 HydrophobicContact CG-CD2 4.05Å; L509-Y683 HydrophobicContact CG-CE2 3.65Å; T681-Y683 HydrophobicContact CG2-CD2 4.16Å; T681-Y683 HydrophobicContact CG2-CE2 3.52Å; T681-Y683 WeakPolarHBondContact O-CD2 3.32Å
684	T	94.7	Very high	92.1	Very high	15 Å²	15	59.9 Å²	59.9	9%	0.092	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	162.9	179.1	62.8	0	0	0	0	111.1	Y391 M392 Y504 C506 R682	Y391-T684 WeakPolarHBondContact CA-O 3.45Å; M392-T684 PolarHBondContact N-O 3.18Å; M392-T684 PolarHBondContact O-N 3.07Å; Y504-T684 WeakPolarHBondContact OH-CG2 3.35Å; C506-T684 HydrophobicContact CB-CG2 4.12Å; R682-T684 HydrophobicContact CG-CG2 4.49Å
685	V	94.4	Very high	92.5	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.006	27%	0.271	C	S	.	.			trans	-77.1	139.1	178.5	-176.1	0	0	0	0	109.3	T389 Y391 R505 E689 Q690	T389-V685 HydrophobicContact CG2-CB 4.4Å; T389-V685 HydrophobicContact CG2-CG1 3.85Å; T389-V685 HydrophobicContact CG2-CG2 3.64Å; Y391-V685 HydrophobicContact CD1-CG2 4.01Å; Y391-V685 HydrophobicContact CE1-CG2 3.63Å; R505-V685 HydrophobicContact CG-CG2 4.12Å; V685-E689 HydrophobicContact CG1-CB 4.09Å; V685-Q690 HydrophobicContact CB-CG 3.97Å; V685-Q690 HydrophobicContact CG1-CG 4.06Å; V685-Q690 PolarHBondContact O-NE2 2.93Å
686	P	92.7	Very high	92.7	Very high	5 Å²	5	53.9 Å²	53.9	3%	0.032	27%	0.271	C	S	.	.			trans	-53.6	134	174.7	-20.5	27.5	0	0	0	112.1	P390 M392 E688 E689 Q690	P390-P686 WeakPolarHBondContact O-CD 3.29Å; M392-P686 HydrophobicContact CE-CB 3.93Å; M392-P686 HydrophobicContact CE-CG 3.84Å; M392-P686 HydrophobicContact CG-CG 4.06Å; M392-P686 HydrophobicContact SD-CG 4.1Å; P686-E688 HydrophobicContact CB-CG 3.86Å; P686-E688 WeakPolarHBondContact CB-OE2 3.45Å; P686-E688 PolarHBondContact O-N 2.82Å; P686-E688 VanDerWaalsContact O-N 3.1Å; P686-E689 HydrophobicContact CB-CB 4.35Å; P686-E689 HydrophobicContact CB-CG 4.42Å; P686-E689 HydrophobicContact CG-CB 4.48Å; P686-E689 HydrophobicContact CG-CG 4.46Å; P686-E689 CarbonylContact O-C 3.51Å; P686-E689 WeakPolarHBondContact O-CA 3.43Å; P686-E689 PolarHBondContact O-N 2.71Å; P686-Q690 PolarHBondContact O-N 3.41Å
687	P	89.3	Confident	93.1	Very high	58 Å²	58	54.5 Å²	54.5	38%	0.377	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-27.3	179.4	-28.3	36.3	0	0	0	115.1	R697	P687-R697 WeakPolarHBondContact O-CD 3.4Å; P687-R697 PolarHBondContact O-NH1 3.25Å
688	E	91.2	Very high	93.6	Very high	141 Å²	141	48.4 Å²	48.4	66%	0.659	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-34.1	172.6	54.7	-91.7	-130.5	0	0	113.1	P686 R697	P686-E688 HydrophobicContact CB-CG 3.86Å; P686-E688 WeakPolarHBondContact CB-OE2 3.45Å; P686-E688 PolarHBondContact O-N 2.82Å; P686-E688 VanDerWaalsContact O-N 3.1Å; E688-R697 PolarHBondContact O-NH1 2.96Å; E688-R697 VanDerWaalsContact O-NH1 3.09Å
689	E	92.8	Very high	94	Very high	113 Å²	113	43.4 Å²	43.4	53%	0.528	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-14.3	178.2	-66	-164.8	-119.4	0	0	113.7	P390 V685 P686	P390-E689 VanDerWaalsContact CG-CD 3.41Å; P390-E689 WeakPolarHBondContact CG-OE1 3.37Å; P390-E689 WeakPolarHBondContact CG-OE2 3.42Å; V685-E689 HydrophobicContact CG1-CB 4.09Å; P686-E689 HydrophobicContact CB-CB 4.35Å; P686-E689 HydrophobicContact CB-CG 4.42Å; P686-E689 HydrophobicContact CG-CB 4.48Å; P686-E689 HydrophobicContact CG-CG 4.46Å; P686-E689 CarbonylContact O-C 3.51Å; P686-E689 WeakPolarHBondContact O-CA 3.43Å; P686-E689 PolarHBondContact O-N 2.71Å
690	Q	94.9	Very high	94.2	Very high	7 Å²	7	43.8 Å²	43.8	3%	0.033	22%	0.223	C	C	.	.	S	Bend	trans	-61.2	141.8	171.5	-79.6	-179.4	35.2	0	0	112	V685 P686 E694 E696 R697	V685-Q690 HydrophobicContact CB-CG 3.97Å; V685-Q690 HydrophobicContact CG1-CG 4.06Å; V685-Q690 PolarHBondContact O-NE2 2.93Å; P686-Q690 PolarHBondContact O-N 3.41Å; Q690-E694 WeakPolarHBondContact CA-OE1 3.25Å; Q690-E694 HydrophobicContact CB-CB 4Å; Q690-E694 HydrophobicContact CB-CG 4.47Å; Q690-E694 HydrophobicContact CG-CB 4.12Å; Q690-E696 PolarHBondContact NE2-OE2 2.68Å; Q690-E696 VanDerWaalsContact NE2-OE2 3.07Å; Q690-R697 HydrophobicContact CB-CB 3.93Å; Q690-R697 WeakPolarHBondContact O-CD 3.42Å; Q690-R697 PolarHBondContact O-NE 2.86Å; Q690-R697 PolarHBondContact O-NH1 3.24Å
691	G	94.5	Very high	94.3	Very high	35 Å²	35	46.8 Å²	46.8	36%	0.361	24%	0.236	S	C	.	.			trans	-71.2	155.8	169.2	0	0	0	0	0	112.8	F693 E694 R697	G691-F693 PolarHBondContact O-N 3.27Å; G691-E694 PolarHBondContact N-OE1 3.49Å; G691-E694 WeakPolarHBondContact O-CB 3.42Å; G691-E694 PolarHBondContact O-N 3.37Å; G691-R697 WeakPolarHBondContact O-CD 3.3Å
692	D	95.2	Very high	94.5	Very high	106 Å²	106	44.6 Å²	44.6	57%	0.567	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-13.1	-171.6	-63.8	-34.2	0	0	0	115.8	R697	D692-R697 IonicContact OD1-CZ 3.26Å; D692-R697 VanDerWaalsContact OD1-CZ 3.26Å; D692-R697 IonicContact OD1-NE 2.88Å; D692-R697 PolarHBondContact OD1-NE 2.97Å; D692-R697 IonicContact OD1-NH2 2.76Å; D692-R697 PolarHBondContact OD1-NH2 2.97Å
693	F	96.1	Very high	94.6	Very high	107 Å²	107	45.7 Å²	45.7	47%	0.469	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	1.9	175	-73.8	-94	0	0	0	113.7	I499 E502 T503 G691	I499-F693 HydrophobicContact CD1-CD1 4.01Å; I499-F693 HydrophobicContact CD1-CE1 3.93Å; E502-F693 WeakPolarHBondContact CA-O 3.5Å; T503-F693 PolarHBondContact N-O 2.76Å; G691-F693 PolarHBondContact O-N 3.27Å
694	E	97.3	Very high	94.6	Very high	15 Å²	15	50.6 Å²	50.6	7%	0.07	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-72.5	137.3	170.8	-66.6	-168.7	-118.3	0	0	110.1	T503 R505 Q690 G691 E696 R697 L698	T503-E694 CarbonylContact O-C 3.56Å; T503-E694 WeakPolarHBondContact O-CA 3.36Å; R505-E694 VanDerWaalsContact CG-OE2 3.32Å; R505-E694 WeakPolarHBondContact CG-OE2 3.26Å; R505-E694 IonicContact CZ-OE1 3.82Å; R505-E694 IonicContact CZ-OE2 2.6Å; R505-E694 IonicContact NE-OE1 2.61Å; R505-E694 PolarHBondContact NE-OE1 2.77Å; R505-E694 IonicContact NE-OE2 3.81Å; R505-E694 PolarHBondContact NE-OE2 2.71Å; R505-E694 IonicContact NH2-OE1 2.69Å; R505-E694 PolarHBondContact NH2-OE1 2.88Å; R505-E694 IonicContact NH2-OE2 2.75Å; Q690-E694 WeakPolarHBondContact CA-OE1 3.25Å; Q690-E694 HydrophobicContact CB-CB 4Å; Q690-E694 HydrophobicContact CB-CG 4.47Å; Q690-E694 HydrophobicContact CG-CB 4.12Å; G691-E694 PolarHBondContact N-OE1 3.49Å; G691-E694 WeakPolarHBondContact O-CB 3.42Å; G691-E694 PolarHBondContact O-N 3.37Å; E694-E696 PolarHBondContact O-N 3.2Å; E694-R697 PolarHBondContact O-N 2.94Å; E694-L698 VanDerWaalsContact O-CB 3.25Å; E694-L698 WeakPolarHBondContact O-CB 3.19Å; E694-L698 PolarHBondContact O-N 3.3Å
695	S	96.8	Very high	94.6	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.021	24%	0.244	C	C	.	.	H	α-helix	trans	-56.3	-40.7	-161.8	-61.7	0	0	0	0	115.1	S446 E502 T503 W699	S446-S695 WeakPolarHBondContact CB-OG 3.42Å; E502-S695 PolarHBondContact OE1-OG 3Å; E502-S695 VanDerWaalsContact OE1-OG 3.13Å; T503-S695 PolarHBondContact O-N 2.98Å; T503-S695 PolarHBondContact O-OG 3.19Å; S695-W699 WeakPolarHBondContact O-CB 3.41Å; S695-W699 VanDerWaalsContact O-CD1 3.25Å; S695-W699 PolarHBondContact O-N 3.29Å; S695-W699 VanDerWaalsContact O-N 3.09Å
696	E	93.1	Very high	94.4	Very high	43 Å²	43	50.9 Å²	50.9	20%	0.201	25%	0.25	C	C	.	.	H	α-helix	trans	-73.8	-44.6	-173.6	-54.7	177.3	173.3	0	0	110.8	Y504 Q690 E694 Q700	Y504-E696 HydrophobicContact CE2-CG 3.97Å; Y504-E696 WeakPolarHBondContact CE2-OE1 3.42Å; Y504-E696 PolarHBondContact OH-OE1 3.19Å; Q690-E696 PolarHBondContact NE2-OE2 2.68Å; Q690-E696 VanDerWaalsContact NE2-OE2 3.07Å; E694-E696 PolarHBondContact O-N 3.2Å; E696-Q700 WeakPolarHBondContact O-CA 3.31Å; E696-Q700 WeakPolarHBondContact O-CB 3.43Å; E696-Q700 PolarHBondContact O-N 2.88Å; E696-Q700 VanDerWaalsContact O-N 3.15Å
697	R	95.6	Very high	94.2	Very high	68 Å²	68	55.4 Å²	55.4	26%	0.257	27%	0.273	S	S	.	.	H	α-helix	trans	-64	-46.3	172.5	-179.3	177.9	176.9	129.8	-19.2	112.6	P687 E688 Q690 G691 D692 E694 W699 Q700	P687-R697 WeakPolarHBondContact O-CD 3.4Å; P687-R697 PolarHBondContact O-NH1 3.25Å; E688-R697 PolarHBondContact O-NH1 2.96Å; E688-R697 VanDerWaalsContact O-NH1 3.09Å; Q690-R697 HydrophobicContact CB-CB 3.93Å; Q690-R697 WeakPolarHBondContact O-CD 3.42Å; Q690-R697 PolarHBondContact O-NE 2.86Å; Q690-R697 PolarHBondContact O-NH1 3.24Å; G691-R697 WeakPolarHBondContact O-CD 3.3Å; D692-R697 IonicContact OD1-CZ 3.26Å; D692-R697 VanDerWaalsContact OD1-CZ 3.26Å; D692-R697 IonicContact OD1-NE 2.88Å; D692-R697 PolarHBondContact OD1-NE 2.97Å; D692-R697 IonicContact OD1-NH2 2.76Å; D692-R697 PolarHBondContact OD1-NH2 2.97Å; E694-R697 PolarHBondContact O-N 2.94Å; R697-W699 PolarHBondContact O-N 3.06Å; R697-Q700 WeakPolarHBondContact O-CB 3.31Å; R697-Q700 WeakPolarHBondContact O-CG 3.32Å; R697-Q700 PolarHBondContact O-N 3.17Å
698	L	96.7	Very high	94.4	Very high	21 Å²	21	58 Å²	58	11%	0.11	28%	0.284	C	S	.	.	H	α-helix	trans	-59.8	-48.4	-179.6	175.4	70	0	0	0	112	I499 E502 E694 Q700 L721	I499-L698 HydrophobicContact CD1-CD1 3.87Å; I499-L698 HydrophobicContact CD1-CD2 3.6Å; I499-L698 HydrophobicContact CD1-CG 4.34Å; I499-L698 HydrophobicContact CG1-CD2 3.71Å; E502-L698 HydrophobicContact CB-CD2 4.23Å; E502-L698 HydrophobicContact CG-CD2 3.67Å; E502-L698 WeakPolarHBondContact OE2-CD2 3.32Å; E694-L698 VanDerWaalsContact O-CB 3.25Å; E694-L698 WeakPolarHBondContact O-CB 3.19Å; E694-L698 PolarHBondContact O-N 3.3Å; L698-Q700 VanDerWaalsContact C-N 3.32Å; L698-Q700 PolarHBondContact O-N 3.07Å; L698-L721 HydrophobicContact CD1-CD2 3.96Å
699	W	96.3	Very high	94.2	Very high	4 Å²	4	59.5 Å²	59.5	2%	0.015	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	2	-176.9	-68.4	100.7	0	0	0	113.5	Y496 I499 E502 S695 R697 H701 V702 T703 K718 L721	Y496-W699 HydrophobicContact CD1-CE3 4.3Å; Y496-W699 HydrophobicContact CD2-CB 3.76Å; Y496-W699 AromaticContact CD2-CD1 3.97Å; Y496-W699 AromaticContact CD2-CD2 3.54Å; Y496-W699 HydrophobicContact CD2-CD2 3.54Å; Y496-W699 AromaticContact CD2-CE3 3.89Å; Y496-W699 HydrophobicContact CD2-CE3 3.89Å; Y496-W699 AromaticContact CD2-CG 3.47Å; Y496-W699 HydrophobicContact CD2-CG 3.47Å; Y496-W699 VanDerWaalsContact CD2-CG 3.47Å; Y496-W699 HydrophobicContact CE2-CB 3.61Å; Y496-W699 HydrophobicContact CE2-CD2 4.12Å; Y496-W699 HydrophobicContact CE2-CE3 4.24Å; Y496-W699 AromaticContact CE2-CG 3.87Å; Y496-W699 HydrophobicContact CE2-CG 3.87Å; Y496-W699 AromaticContact CG-CD2 3.85Å; Y496-W699 HydrophobicContact CG-CD2 3.85Å; Y496-W699 AromaticContact CG-CE3 3.92Å; Y496-W699 HydrophobicContact CG-CE3 3.92Å; Y496-W699 HydrophobicContact CG-CG 4.27Å; Y496-W699 HydrophobicContact CG-CZ3 4.35Å; I499-W699 HydrophobicContact CG2-CZ2 4.14Å; E502-W699 PolarHBondContact OE1-NE1 2.97Å; E502-W699 PolarHBondContact OE2-NE1 2.91Å; S695-W699 WeakPolarHBondContact O-CB 3.41Å; S695-W699 VanDerWaalsContact O-CD1 3.25Å; S695-W699 PolarHBondContact O-N 3.29Å; S695-W699 VanDerWaalsContact O-N 3.09Å; R697-W699 PolarHBondContact O-N 3.06Å; W699-H701 PolarHBondContact O-N 2.98Å; W699-V702 HydrophobicContact CE3-CB 4.15Å; W699-V702 HydrophobicContact CE3-CG2 3.83Å; W699-V702 HydrophobicContact CZ3-CG2 4.21Å; W699-V702 PolarHBondContact O-N 2.95Å; W699-T703 PolarHBondContact O-N 3.44Å; W699-T703 PolarHBondContact O-OG1 3.16Å; W699-K718 HydrophobicContact CZ3-CG 4.28Å; W699-L721 HydrophobicContact CD2-CD1 4.26Å; W699-L721 HydrophobicContact CE3-CD1 3.68Å; W699-L721 HydrophobicContact CZ3-CD1 3.82Å
700	Q	95.3	Very high	94.2	Very high	73 Å²	73	57.4 Å²	57.4	34%	0.341	28%	0.281	S	S	.	.	H	α-helix	trans	-50.7	-37.1	-169.1	73.5	179.9	-28.4	0	0	114.9	E696 R697 L698 R704	E696-Q700 WeakPolarHBondContact O-CA 3.31Å; E696-Q700 WeakPolarHBondContact O-CB 3.43Å; E696-Q700 PolarHBondContact O-N 2.88Å; E696-Q700 VanDerWaalsContact O-N 3.15Å; R697-Q700 WeakPolarHBondContact O-CB 3.31Å; R697-Q700 WeakPolarHBondContact O-CG 3.32Å; R697-Q700 PolarHBondContact O-N 3.17Å; L698-Q700 VanDerWaalsContact C-N 3.32Å; L698-Q700 PolarHBondContact O-N 3.07Å; Q700-R704 VanDerWaalsContact O-CB 3.22Å; Q700-R704 WeakPolarHBondContact O-CB 3.08Å; Q700-R704 PolarHBondContact O-N 3Å
701	H	95.8	Very high	93.8	Very high	83 Å²	83	60 Å²	60	38%	0.384	29%	0.293	S	S	.	.	H	α-helix	trans	-74.3	-40.5	-178.4	-64.1	-85.2	0	0	0	111.5	W699 R704 A705 E717	W699-H701 PolarHBondContact O-N 2.98Å; H701-R704 PolarHBondContact O-N 2.62Å; H701-A705 WeakPolarHBondContact O-CB 2.8Å; H701-A705 PolarHBondContact O-N 2.85Å; H701-E717 HydrophobicContact CB-CB 4.1Å; H701-E717 HydrophobicContact CB-CG 3.94Å
702	V	95	Very high	93.6	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-67.3	-42.2	174.2	-170.1	0	0	0	0	110.4	Y496 W699 A705 I706 E717 K718 L721	Y496-V702 HydrophobicContact CE1-CG1 3.77Å; W699-V702 HydrophobicContact CE3-CB 4.15Å; W699-V702 HydrophobicContact CE3-CG2 3.83Å; W699-V702 HydrophobicContact CZ3-CG2 4.21Å; W699-V702 PolarHBondContact O-N 2.95Å; V702-A705 PolarHBondContact O-N 3.4Å; V702-I706 HydrophobicContact CG1-CD1 4.11Å; V702-I706 WeakPolarHBondContact O-CB 3.27Å; V702-I706 WeakPolarHBondContact O-CG1 3.45Å; V702-I706 PolarHBondContact O-N 3.4Å; V702-E717 HydrophobicContact CG2-CB 3.84Å; V702-K718 HydrophobicContact CG1-CB 4.23Å; V702-K718 HydrophobicContact CG2-CB 4.06Å; V702-L721 HydrophobicContact CG2-CD1 3.91Å
703	T	93.6	Very high	93.6	Very high	33 Å²	33	62.5 Å²	62.5	20%	0.202	30%	0.3	C	S	.	.	H	α-helix	trans	-59.6	-47.8	174.8	-68.6	0	0	0	0	111.3	P444 Y496 W699 I706 N707	P444-T703 HydrophobicContact CB-CG2 4.15Å; Y496-T703 WeakPolarHBondContact OH-CA 3.48Å; Y496-T703 PolarHBondContact OH-N 3.43Å; Y496-T703 PolarHBondContact OH-OG1 3.12Å; W699-T703 PolarHBondContact O-N 3.44Å; W699-T703 PolarHBondContact O-OG1 3.16Å; T703-I706 PolarHBondContact O-N 3.47Å; T703-N707 WeakPolarHBondContact O-CB 3.19Å; T703-N707 PolarHBondContact O-N 3.24Å; T703-N707 PolarHBondContact O-ND2 2.88Å
704	R	94.6	Very high	93.4	Very high	131 Å²	131	57.4 Å²	57.4	49%	0.494	28%	0.278	S	S	.	.	H	α-helix	trans	-59.2	-49.1	177.8	-172.9	-177.2	-56.6	177.6	4	111.9	Q700 H701 N707 N708	Q700-R704 VanDerWaalsContact O-CB 3.22Å; Q700-R704 WeakPolarHBondContact O-CB 3.08Å; Q700-R704 PolarHBondContact O-N 3Å; H701-R704 PolarHBondContact O-N 2.62Å; R704-N707 PolarHBondContact O-N 3.24Å; R704-N708 WeakPolarHBondContact O-CB 3.29Å; R704-N708 PolarHBondContact O-N 3.16Å; R704-N708 PolarHBondContact O-ND2 2.85Å
705	A	94.6	Very high	93.1	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.8	-43.2	179	0	0	0	0	0	112.6	H701 V702 N708 K709 D710 E713 A714	H701-A705 WeakPolarHBondContact O-CB 2.8Å; H701-A705 PolarHBondContact O-N 2.85Å; V702-A705 PolarHBondContact O-N 3.4Å; A705-N708 CarbonylContact O-C 3.59Å; A705-N708 PolarHBondContact O-N 3.49Å; A705-K709 PolarHBondContact O-N 3.31Å; A705-D710 PolarHBondContact O-N 3.14Å; A705-E713 HydrophobicContact CB-CB 3.84Å; A705-E713 HydrophobicContact CB-CG 3.74Å; A705-E713 WeakPolarHBondContact CB-OE2 3.34Å; A705-A714 HydrophobicContact CB-CB 3.72Å; A705-A714 VanDerWaalsContact CB-N 3.33Å
706	I	90.3	Very high	93	Very high	23 Å²	23	64 Å²	64	12%	0.118	32%	0.316	C	S	.	.	H	α-helix	trans	-62.7	-43	175.6	-74	-178.6	0	0	0	111.5	L442 P444 Y496 V702 T703 K709 A714	L442-I706 HydrophobicContact CB-CD1 3.87Å; L442-I706 HydrophobicContact CD1-CD1 4.31Å; P444-I706 HydrophobicContact CB-CG2 4.34Å; Y496-I706 HydrophobicContact CE1-CD1 3.93Å; V702-I706 HydrophobicContact CG1-CD1 4.11Å; V702-I706 WeakPolarHBondContact O-CB 3.27Å; V702-I706 WeakPolarHBondContact O-CG1 3.45Å; V702-I706 PolarHBondContact O-N 3.4Å; T703-I706 PolarHBondContact O-N 3.47Å; I706-K709 WeakPolarHBondContact O-CA 3.39Å; I706-K709 PolarHBondContact O-N 2.53Å; I706-A714 HydrophobicContact CG1-CB 3.7Å
707	N	89.9	Confident	93.2	Very high	100 Å²	100	64.1 Å²	64.1	54%	0.535	32%	0.316	S	S	.	.	H	α-helix	trans	-66.8	-37.4	177.9	-68.3	-11.1	0	0	0	111.9	T703 R704 K709	T703-N707 WeakPolarHBondContact O-CB 3.19Å; T703-N707 PolarHBondContact O-N 3.24Å; T703-N707 PolarHBondContact O-ND2 2.88Å; R704-N707 PolarHBondContact O-N 3.24Å; N707-K709 PolarHBondContact O-N 3.23Å
708	N	92.3	Very high	93.1	Very high	111 Å²	111	61.8 Å²	61.8	59%	0.594	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-8	169.8	-69.8	-12.7	0	0	0	113.4	R704 A705 D710	R704-N708 WeakPolarHBondContact O-CB 3.29Å; R704-N708 PolarHBondContact O-N 3.16Å; R704-N708 PolarHBondContact O-ND2 2.85Å; A705-N708 CarbonylContact O-C 3.59Å; A705-N708 PolarHBondContact O-N 3.49Å; N708-D710 PolarHBondContact O-N 3.38Å
709	K	88.8	Confident	92.9	Very high	173 Å²	173	66 Å²	66	75%	0.752	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	6.3	-175.2	-54.1	172.5	-175.6	171.5	0	115.1	A705 I706 N707 Q711	A705-K709 PolarHBondContact O-N 3.31Å; I706-K709 WeakPolarHBondContact O-CA 3.39Å; I706-K709 PolarHBondContact O-N 2.53Å; N707-K709 PolarHBondContact O-N 3.23Å; K709-Q711 PolarHBondContact O-N 3.44Å; K709-Q711 VanDerWaalsContact O-N 3.11Å; K709-Q711 PolarHBondContact O-NE2 2.82Å; K709-Q711 VanDerWaalsContact O-NE2 3.12Å
710	D	90.9	Very high	92.9	Very high	70 Å²	70	69.8 Å²	69.8	37%	0.374	35%	0.345	S	S	.	.			trans	-74.8	101.4	175.5	-165.3	-33.5	0	0	0	110.9	A705 N708 T712 E713 A714	A705-D710 PolarHBondContact O-N 3.14Å; N708-D710 PolarHBondContact O-N 3.38Å; D710-T712 VanDerWaalsContact C-N 3.28Å; D710-T712 PolarHBondContact O-N 3.27Å; D710-T712 VanDerWaalsContact OD1-CA 3.32Å; D710-T712 WeakPolarHBondContact OD1-CA 3.34Å; D710-T712 VanDerWaalsContact OD1-CB 3.25Å; D710-T712 WeakPolarHBondContact OD1-CB 3.41Å; D710-T712 PolarHBondContact OD1-N 3.32Å; D710-E713 HydrophobicContact CB-CB 4.03Å; D710-E713 PolarHBondContact OD1-N 2.74Å; D710-A714 WeakPolarHBondContact O-CB 3.38Å; D710-A714 PolarHBondContact O-N 2.75Å; D710-A714 VanDerWaalsContact O-N 3.08Å
711	Q	87.3	Confident	92.8	Very high	60 Å²	60	68.2 Å²	68.2	28%	0.28	34%	0.339	S	S	.	.	H	α-helix	trans	-73.8	-19.5	177.8	-56.2	-51.6	-57.8	0	0	113.1	T439 F440 K709 T715	T439-Q711 PolarHBondContact OG1-O 3.12Å; T439-Q711 PolarHBondContact OG1-OE1 3.17Å; F440-Q711 VanDerWaalsContact N-OE1 3.08Å; K709-Q711 PolarHBondContact O-N 3.44Å; K709-Q711 VanDerWaalsContact O-N 3.11Å; K709-Q711 PolarHBondContact O-NE2 2.82Å; K709-Q711 VanDerWaalsContact O-NE2 3.12Å; Q711-T715 VanDerWaalsContact O-CB 3.25Å; Q711-T715 WeakPolarHBondContact O-CB 3.26Å; Q711-T715 PolarHBondContact O-N 2.8Å; Q711-T715 VanDerWaalsContact O-N 3.14Å; Q711-T715 PolarHBondContact O-OG1 2.75Å
712	T	90.3	Very high	92.6	Very high	115 Å²	115	65.8 Å²	65.8	71%	0.706	33%	0.328	S	S	*	.	H	α-helix	trans	-79.6	-50.9	179.8	-44.9	0	0	0	0	109.8	D710 T715 N716	D710-T712 VanDerWaalsContact C-N 3.28Å; D710-T712 PolarHBondContact O-N 3.27Å; D710-T712 VanDerWaalsContact OD1-CA 3.32Å; D710-T712 WeakPolarHBondContact OD1-CA 3.34Å; D710-T712 VanDerWaalsContact OD1-CB 3.25Å; D710-T712 WeakPolarHBondContact OD1-CB 3.41Å; D710-T712 PolarHBondContact OD1-N 3.32Å; T712-T715 PolarHBondContact O-N 2.88Å; T712-N716 PolarHBondContact O-N 2.61Å
713	E	94.3	Very high	92.6	Very high	80 Å²	80	68.6 Å²	68.6	37%	0.374	34%	0.341	S	S	.	.	H	α-helix	trans	-59.1	-48.6	172.6	-173	-176.6	-141.9	0	0	110	A705 D710 T715 N716 E717	A705-E713 HydrophobicContact CB-CB 3.84Å; A705-E713 HydrophobicContact CB-CG 3.74Å; A705-E713 WeakPolarHBondContact CB-OE2 3.34Å; D710-E713 HydrophobicContact CB-CB 4.03Å; D710-E713 PolarHBondContact OD1-N 2.74Å; E713-T715 PolarHBondContact O-N 3.44Å; E713-N716 WeakPolarHBondContact O-CB 3.34Å; E713-N716 PolarHBondContact O-N 2.78Å; E713-E717 HydrophobicContact CG-CG 4.23Å; E713-E717 WeakPolarHBondContact O-CG 3.41Å; E713-E717 PolarHBondContact O-N 3.38Å
714	A	92.9	Very high	92.7	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-58.8	-35.2	178.4	0	0	0	0	0	112.9	T439 A705 I706 D710 K718	T439-A714 HydrophobicContact CG2-CB 3.94Å; A705-A714 HydrophobicContact CB-CB 3.72Å; A705-A714 VanDerWaalsContact CB-N 3.33Å; I706-A714 HydrophobicContact CG1-CB 3.7Å; D710-A714 WeakPolarHBondContact O-CB 3.38Å; D710-A714 PolarHBondContact O-N 2.75Å; D710-A714 VanDerWaalsContact O-N 3.08Å; A714-K718 WeakPolarHBondContact O-CB 3.33Å; A714-K718 PolarHBondContact O-N 3.48Å
715	T	91.5	Very high	92.6	Very high	75 Å²	75	64.5 Å²	64.5	46%	0.46	34%	0.335	S	S	.	.	H	α-helix	trans	-73.1	-38	176.7	-64	0	0	0	0	111.3	T439 Q711 T712 E713 F719	T439-T715 WeakPolarHBondContact CG2-OG1 3.24Å; Q711-T715 VanDerWaalsContact O-CB 3.25Å; Q711-T715 WeakPolarHBondContact O-CB 3.26Å; Q711-T715 PolarHBondContact O-N 2.8Å; Q711-T715 VanDerWaalsContact O-N 3.14Å; Q711-T715 PolarHBondContact O-OG1 2.75Å; T712-T715 PolarHBondContact O-N 2.88Å; E713-T715 PolarHBondContact O-N 3.44Å; T715-F719 VanDerWaalsContact O-CB 3.3Å; T715-F719 WeakPolarHBondContact O-CB 3.43Å; T715-F719 PolarHBondContact O-N 3.21Å
716	N	94.4	Very high	92.6	Very high	82 Å²	82	68.8 Å²	68.8	44%	0.439	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-52.9	177.2	-175.1	74	0	0	0	112	T712 E713 K718 F719 I720	T712-N716 PolarHBondContact O-N 2.61Å; E713-N716 WeakPolarHBondContact O-CB 3.34Å; E713-N716 PolarHBondContact O-N 2.78Å; N716-K718 VanDerWaalsContact C-N 3.32Å; N716-K718 PolarHBondContact O-N 3.18Å; N716-F719 WeakPolarHBondContact O-CA 3.4Å; N716-F719 WeakPolarHBondContact O-CB 3.43Å; N716-F719 PolarHBondContact O-N 2.69Å; N716-I720 WeakPolarHBondContact ND2-CD1 3.4Å; N716-I720 WeakPolarHBondContact O-CG1 3.32Å; N716-I720 PolarHBondContact O-N 3.11Å
717	E	96	Very high	92.8	Very high	44 Å²	44	73.1 Å²	73.1	21%	0.206	37%	0.369	C	S	.	.	H	α-helix	trans	-63.3	-40.4	-177.8	-62.1	-49.9	109.2	0	0	111.5	H701 V702 E713 F719 I720 L721	H701-E717 HydrophobicContact CB-CB 4.1Å; H701-E717 HydrophobicContact CB-CG 3.94Å; V702-E717 HydrophobicContact CG2-CB 3.84Å; E713-E717 HydrophobicContact CG-CG 4.23Å; E713-E717 WeakPolarHBondContact O-CG 3.41Å; E713-E717 PolarHBondContact O-N 3.38Å; E717-F719 VanDerWaalsContact C-N 3.33Å; E717-F719 PolarHBondContact O-N 2.76Å; E717-I720 PolarHBondContact O-N 2.75Å; E717-L721 PolarHBondContact O-N 2.66Å; E717-L721 VanDerWaalsContact O-N 3.09Å
718	K	93.8	Very high	93	Very high	19 Å²	19	70.3 Å²	70.3	8%	0.083	36%	0.36	C	S	.	.	H	α-helix	trans	-63.2	-38.1	172.9	-179	174.3	179.5	-61.8	0	112.2	T439 L442 W699 V702 A714 N716 E722	T439-K718 HydrophobicContact CG2-CD 4.32Å; L442-K718 HydrophobicContact CD1-CD 3.77Å; W699-K718 HydrophobicContact CZ3-CG 4.28Å; V702-K718 HydrophobicContact CG1-CB 4.23Å; V702-K718 HydrophobicContact CG2-CB 4.06Å; A714-K718 WeakPolarHBondContact O-CB 3.33Å; A714-K718 PolarHBondContact O-N 3.48Å; N716-K718 VanDerWaalsContact C-N 3.32Å; N716-K718 PolarHBondContact O-N 3.18Å; K718-E722 IonicContact NZ-OE1 2.87Å; K718-E722 PolarHBondContact NZ-OE1 2.78Å; K718-E722 WeakPolarHBondContact O-CB 3.45Å; K718-E722 WeakPolarHBondContact O-CG 2.86Å; K718-E722 PolarHBondContact O-N 2.85Å; K718-E722 VanDerWaalsContact O-N 3.11Å
719	F	93.1	Very high	93.1	Very high	110 Å²	110	67.1 Å²	67.1	48%	0.482	35%	0.349	S	S	.	.	H	α-helix	trans	-67.4	-38.7	175.3	173.6	-96.2	0	0	0	112.3	T715 N716 E717 E722 E723	T715-F719 VanDerWaalsContact O-CB 3.3Å; T715-F719 WeakPolarHBondContact O-CB 3.43Å; T715-F719 PolarHBondContact O-N 3.21Å; N716-F719 WeakPolarHBondContact O-CA 3.4Å; N716-F719 WeakPolarHBondContact O-CB 3.43Å; N716-F719 PolarHBondContact O-N 2.69Å; E717-F719 VanDerWaalsContact C-N 3.33Å; E717-F719 PolarHBondContact O-N 2.76Å; F719-E722 PolarHBondContact O-N 3.08Å; F719-E723 HydrophobicContact CE1-CB 4.35Å; F719-E723 HydrophobicContact CE2-CB 4.5Å; F719-E723 HydrophobicContact CZ-CB 4.19Å; F719-E723 HydrophobicContact CZ-CG 4.3Å; F719-E723 WeakPolarHBondContact O-CB 3.44Å; F719-E723 PolarHBondContact O-N 3.43Å
720	I	95.6	Very high	93.4	Very high	84 Å²	84	64.9 Å²	64.9	43%	0.431	34%	0.336	S	S	.	.	H	α-helix	trans	-60.8	-51.1	176.6	-70.4	168.5	0	0	0	110.5	N716 E717 E722 E723 A724	N716-I720 WeakPolarHBondContact ND2-CD1 3.4Å; N716-I720 WeakPolarHBondContact O-CG1 3.32Å; N716-I720 PolarHBondContact O-N 3.11Å; E717-I720 PolarHBondContact O-N 2.75Å; I720-E722 PolarHBondContact O-N 3.01Å; I720-E723 PolarHBondContact O-N 2.81Å; I720-A724 WeakPolarHBondContact O-CB 3.37Å; I720-A724 PolarHBondContact O-N 3.24Å
721	L	94.4	Very high	93.6	Very high	39 Å²	39	65.9 Å²	65.9	20%	0.204	34%	0.338	C	S	.	.	H	α-helix	trans	-58	-48.9	177.3	-70.2	173	0	0	0	111.8	L698 W699 V702 E717 E723 A724 Q725	L698-L721 HydrophobicContact CD1-CD2 3.96Å; W699-L721 HydrophobicContact CD2-CD1 4.26Å; W699-L721 HydrophobicContact CE3-CD1 3.68Å; W699-L721 HydrophobicContact CZ3-CD1 3.82Å; V702-L721 HydrophobicContact CG2-CD1 3.91Å; E717-L721 PolarHBondContact O-N 2.66Å; E717-L721 VanDerWaalsContact O-N 3.09Å; L721-E723 PolarHBondContact O-N 3.27Å; L721-A724 PolarHBondContact O-N 3.24Å; L721-Q725 PolarHBondContact O-N 3.35Å
722	E	91.9	Very high	94	Very high	32 Å²	32	65.3 Å²	65.3	15%	0.15	33%	0.333	C	S	.	.	H	α-helix	trans	-66.1	-37.7	179.3	-71.4	179.1	177.5	0	0	113.2	K718 F719 I720 Q725 R726	K718-E722 IonicContact NZ-OE1 2.87Å; K718-E722 PolarHBondContact NZ-OE1 2.78Å; K718-E722 WeakPolarHBondContact O-CB 3.45Å; K718-E722 WeakPolarHBondContact O-CG 2.86Å; K718-E722 PolarHBondContact O-N 2.85Å; K718-E722 VanDerWaalsContact O-N 3.11Å; F719-E722 PolarHBondContact O-N 3.08Å; I720-E722 PolarHBondContact O-N 3.01Å; E722-Q725 WeakPolarHBondContact O-CB 3.46Å; E722-Q725 PolarHBondContact O-N 3.39Å; E722-R726 VanDerWaalsContact O-CG 3.29Å; E722-R726 WeakPolarHBondContact O-CG 3.22Å; E722-R726 PolarHBondContact O-N 3.06Å; E722-R726 IonicContact OE2-CZ 2.71Å; E722-R726 IonicContact OE2-NH2 3.75Å; E722-R726 PolarHBondContact OE2-NH2 3.22Å
723	E	94	Very high	94.1	Very high	59 Å²	59	66.2 Å²	66.2	28%	0.276	33%	0.328	S	S	.	.	H	α-helix	trans	-74.5	-32.5	179.8	-170.2	57.9	-155.5	0	0	111.9	F719 I720 L721 R726 K727 R730	F719-E723 HydrophobicContact CE1-CB 4.35Å; F719-E723 HydrophobicContact CE2-CB 4.5Å; F719-E723 HydrophobicContact CZ-CB 4.19Å; F719-E723 HydrophobicContact CZ-CG 4.3Å; F719-E723 WeakPolarHBondContact O-CB 3.44Å; F719-E723 PolarHBondContact O-N 3.43Å; I720-E723 PolarHBondContact O-N 2.81Å; L721-E723 PolarHBondContact O-N 3.27Å; E723-R726 PolarHBondContact O-N 2.83Å; E723-R726 WeakPolarHBondContact OE2-CD 3.34Å; E723-R726 IonicContact OE2-CZ 3.73Å; E723-R726 IonicContact OE2-NE 3.24Å; E723-R726 IonicContact OE2-NH1 3.55Å; E723-R726 PolarHBondContact OE2-NH1 3.15Å; E723-K727 WeakPolarHBondContact O-CB 3.36Å; E723-K727 PolarHBondContact O-N 3.29Å; E723-R730 IonicContact OE1-CZ 2.83Å; E723-R730 IonicContact OE1-NH1 3.73Å; E723-R730 PolarHBondContact OE1-NH1 2.85Å; E723-R730 IonicContact OE1-NH2 3.44Å; E723-R730 PolarHBondContact OE1-NH2 3.33Å
724	A	95.3	Very high	94.2	Very high	58 Å²	58	67.7 Å²	67.7	48%	0.479	34%	0.342	S	S	.	.	H	α-helix	trans	-60	-46.3	167.1	0	0	0	0	0	111	I720 L721 R726 K727 A728	I720-A724 WeakPolarHBondContact O-CB 3.37Å; I720-A724 PolarHBondContact O-N 3.24Å; L721-A724 PolarHBondContact O-N 3.24Å; A724-R726 PolarHBondContact O-N 2.78Å; A724-K727 WeakPolarHBondContact O-CB 3.29Å; A724-K727 PolarHBondContact O-N 2.9Å; A724-K727 VanDerWaalsContact O-N 3.15Å; A724-A728 PolarHBondContact O-N 2.82Å
725	Q	93.9	Very high	94.3	Very high	21 Å²	21	74.2 Å²	74.2	10%	0.098	37%	0.371	C	S	.	.	H	α-helix	trans	-60.1	-46.4	174.4	-164.8	-157.9	-2.2	0	0	111.9	I499 I500 H526 L721 E722 K727 A728 A729	I499-Q725 HydrophobicContact CB-CG 4.07Å; I499-Q725 HydrophobicContact CG2-CB 4.49Å; I499-Q725 HydrophobicContact CG2-CG 4.41Å; I500-Q725 HydrophobicContact CG2-CG 3.97Å; H526-Q725 PolarHBondContact CD2-NE2 2.94Å; H526-Q725 PolarHBondContact CE1-NE2 3.31Å; H526-Q725 VanDerWaalsContact CE1-NE2 3.31Å; H526-Q725 PolarHBondContact CE1-OE1 3.34Å; H526-Q725 PolarHBondContact ND1-NE2 3.19Å; H526-Q725 VanDerWaalsContact ND1-NE2 3.14Å; H526-Q725 PolarHBondContact NE2-NE2 2.98Å; L721-Q725 PolarHBondContact O-N 3.35Å; E722-Q725 WeakPolarHBondContact O-CB 3.46Å; E722-Q725 PolarHBondContact O-N 3.39Å; Q725-K727 VanDerWaalsContact C-N 3.26Å; Q725-K727 PolarHBondContact O-N 3.2Å; Q725-A728 PolarHBondContact O-N 3.38Å; Q725-A729 WeakPolarHBondContact O-CB 3.47Å; Q725-A729 PolarHBondContact O-N 3.42Å
726	R	93.4	Very high	94.4	Very high	90 Å²	90	76 Å²	76	34%	0.34	39%	0.385	S	S	.	.	H	α-helix	trans	-62.6	-32.5	175.8	-70.3	178.4	-149.9	109.8	5.3	112	E722 E723 A724 R730	E722-R726 VanDerWaalsContact O-CG 3.29Å; E722-R726 WeakPolarHBondContact O-CG 3.22Å; E722-R726 PolarHBondContact O-N 3.06Å; E722-R726 IonicContact OE2-CZ 2.71Å; E722-R726 IonicContact OE2-NH2 3.75Å; E722-R726 PolarHBondContact OE2-NH2 3.22Å; E723-R726 PolarHBondContact O-N 2.83Å; E723-R726 WeakPolarHBondContact OE2-CD 3.34Å; E723-R726 IonicContact OE2-CZ 3.73Å; E723-R726 IonicContact OE2-NE 3.24Å; E723-R726 IonicContact OE2-NH1 3.55Å; E723-R726 PolarHBondContact OE2-NH1 3.15Å; A724-R726 PolarHBondContact O-N 2.78Å; R726-R730 VanDerWaalsContact C-NH2 3.34Å; R726-R730 WeakPolarHBondContact O-CG 3.47Å; R726-R730 PolarHBondContact O-N 3.45Å; R726-R730 PolarHBondContact O-NE 3.33Å
727	K	95.6	Very high	94.4	Very high	113 Å²	113	76.2 Å²	76.2	49%	0.491	38%	0.384	S	S	.	.	H	α-helix	trans	-67.2	-55.6	174.7	-178.7	-171.1	161.9	-167.7	0	110.3	E723 A724 Q725 A729 R730 E731	E723-K727 WeakPolarHBondContact O-CB 3.36Å; E723-K727 PolarHBondContact O-N 3.29Å; A724-K727 WeakPolarHBondContact O-CB 3.29Å; A724-K727 PolarHBondContact O-N 2.9Å; A724-K727 VanDerWaalsContact O-N 3.15Å; Q725-K727 VanDerWaalsContact C-N 3.26Å; Q725-K727 PolarHBondContact O-N 3.2Å; K727-A729 VanDerWaalsContact C-N 3.27Å; K727-A729 PolarHBondContact O-N 3.23Å; K727-R730 VanDerWaalsContact CA-NH2 3.27Å; K727-R730 VanDerWaalsContact N-NH2 3.11Å; K727-R730 WeakPolarHBondContact O-CA 3.44Å; K727-R730 WeakPolarHBondContact O-CB 3.18Å; K727-R730 PolarHBondContact O-N 3.48Å; K727-E731 WeakPolarHBondContact CE-OE1 3.42Å; K727-E731 IonicContact NZ-OE1 2.7Å; K727-E731 PolarHBondContact O-N 3.24Å
728	A	94.1	Very high	94.1	Very high	41 Å²	41	81.2 Å²	81.2	34%	0.339	41%	0.412	S	S	.	.	H	α-helix	trans	-57	-39.2	178.4	0	0	0	0	0	112.6	A724 Q725 E731 R732	A724-A728 PolarHBondContact O-N 2.82Å; Q725-A728 PolarHBondContact O-N 3.38Å; A728-E731 PolarHBondContact O-N 3.21Å; A728-R732 PolarHBondContact O-N 3.01Å
729	A	93.3	Very high	94.1	Very high	44 Å²	44	84.8 Å²	84.8	36%	0.364	43%	0.425	S	S	.	.	H	α-helix	trans	-66.1	-34.5	175.2	0	0	0	0	0	113.5	Q725 K727 K733	Q725-A729 WeakPolarHBondContact O-CB 3.47Å; Q725-A729 PolarHBondContact O-N 3.42Å; K727-A729 VanDerWaalsContact C-N 3.27Å; K727-A729 PolarHBondContact O-N 3.23Å; A729-K733 VanDerWaalsContact O-CB 3.28Å; A729-K733 WeakPolarHBondContact O-CB 3.39Å; A729-K733 PolarHBondContact O-N 3.16Å
730	R	94.6	Very high	94.2	Very high	126 Å²	126	85.9 Å²	85.9	48%	0.475	43%	0.434	S	S	.	.	H	α-helix	trans	-69.4	-39.5	172.2	-77.5	170.5	-71.2	-166.1	-3	111.5	E723 R726 K727 T734	E723-R730 IonicContact OE1-CZ 2.83Å; E723-R730 IonicContact OE1-NH1 3.73Å; E723-R730 PolarHBondContact OE1-NH1 2.85Å; E723-R730 IonicContact OE1-NH2 3.44Å; E723-R730 PolarHBondContact OE1-NH2 3.33Å; R726-R730 VanDerWaalsContact C-NH2 3.34Å; R726-R730 WeakPolarHBondContact O-CG 3.47Å; R726-R730 PolarHBondContact O-N 3.45Å; R726-R730 PolarHBondContact O-NE 3.33Å; K727-R730 VanDerWaalsContact CA-NH2 3.27Å; K727-R730 VanDerWaalsContact N-NH2 3.11Å; K727-R730 WeakPolarHBondContact O-CA 3.44Å; K727-R730 WeakPolarHBondContact O-CB 3.18Å; K727-R730 PolarHBondContact O-N 3.48Å; R730-T734 WeakPolarHBondContact O-CB 3.41Å; R730-T734 PolarHBondContact O-N 2.98Å; R730-T734 PolarHBondContact O-OG1 2.97Å
731	E	95.8	Very high	94.2	Very high	92 Å²	92	82.2 Å²	82.2	43%	0.43	42%	0.416	S	S	.	.	H	α-helix	trans	-67.5	-51.3	-179.5	-72.3	167.6	166.1	0	0	111.2	K727 A728 K733 T734 K735	K727-E731 WeakPolarHBondContact CE-OE1 3.42Å; K727-E731 IonicContact NZ-OE1 2.7Å; K727-E731 PolarHBondContact O-N 3.24Å; A728-E731 PolarHBondContact O-N 3.21Å; E731-K733 VanDerWaalsContact C-N 3.34Å; E731-K733 PolarHBondContact O-N 3.09Å; E731-T734 WeakPolarHBondContact O-CA 3.14Å; E731-T734 WeakPolarHBondContact O-CB 3.44Å; E731-T734 PolarHBondContact O-N 2.98Å; E731-K735 PolarHBondContact O-N 2.86Å; E731-K735 VanDerWaalsContact O-N 3.07Å
732	R	94.9	Very high	94.3	Very high	47 Å²	47	83.3 Å²	83.3	18%	0.177	43%	0.431	C	S	.	.	H	α-helix	trans	-54	-47.4	172.6	-77.9	-165.1	-72.9	109.9	-14.6	112.5	A728 T734 K735 C736 E737	A728-R732 PolarHBondContact O-N 3.01Å; R732-T734 VanDerWaalsContact C-N 3.27Å; R732-T734 PolarHBondContact O-N 3.09Å; R732-K735 PolarHBondContact O-N 2.82Å; R732-C736 PolarHBondContact O-N 3.41Å; R732-E737 HydrophobicContact CB-CB 4.22Å; R732-E737 WeakPolarHBondContact CB-O 3.33Å; R732-E737 HydrophobicContact CG-CB 4.22Å; R732-E737 PolarHBondContact O-N 3.23Å
733	K	93.1	Very high	94.6	Very high	134 Å²	134	82.7 Å²	82.7	58%	0.583	43%	0.428	S	S	*	.	H	α-helix	trans	-62.8	-27.9	175.2	-177.5	164.6	-176.7	164.4	0	114	A729 E731	A729-K733 VanDerWaalsContact O-CB 3.28Å; A729-K733 WeakPolarHBondContact O-CB 3.39Å; A729-K733 PolarHBondContact O-N 3.16Å; E731-K733 VanDerWaalsContact C-N 3.34Å; E731-K733 PolarHBondContact O-N 3.09Å
734	T	95.6	Very high	94.8	Very high	111 Å²	111	80 Å²	80	68%	0.681	42%	0.415	S	S	*	.	H	α-helix	trans	-77.4	-30.9	177.8	-57.9	0	0	0	0	111.7	R730 E731 R732	R730-T734 WeakPolarHBondContact O-CB 3.41Å; R730-T734 PolarHBondContact O-N 2.98Å; R730-T734 PolarHBondContact O-OG1 2.97Å; E731-T734 WeakPolarHBondContact O-CA 3.14Å; E731-T734 WeakPolarHBondContact O-CB 3.44Å; E731-T734 PolarHBondContact O-N 2.98Å; R732-T734 VanDerWaalsContact C-N 3.27Å; R732-T734 PolarHBondContact O-N 3.09Å
735	K	96.3	Very high	94.8	Very high	137 Å²	137	80.4 Å²	80.4	60%	0.596	41%	0.407	S	S	*	.	H	α-helix	trans	-86.2	-8.4	173.8	-61.6	174.1	172.3	-175.2	0	114.6	E731 R732 E737	E731-K735 PolarHBondContact O-N 2.86Å; E731-K735 VanDerWaalsContact O-N 3.07Å; R732-K735 PolarHBondContact O-N 2.82Å; K735-E737 VanDerWaalsContact C-N 3.31Å; K735-E737 HydrophobicContact CB-CG 3.93Å; K735-E737 HydrophobicContact CD-CG 4.04Å; K735-E737 WeakPolarHBondContact CD-OE1 3.49Å; K735-E737 WeakPolarHBondContact CD-OE2 3.4Å; K735-E737 IonicContact NZ-OE1 3.65Å; K735-E737 PolarHBondContact NZ-OE1 3.04Å; K735-E737 IonicContact NZ-OE2 3.68Å; K735-E737 PolarHBondContact NZ-OE2 2.81Å
736	C	93.8	Very high	94.9	Very high	114 Å²	114	84.2 Å²	84.2	77%	0.77	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	33.9	-167.2	-59.6	0	0	0	0	114.2	R732	R732-C736 PolarHBondContact O-N 3.41Å
737	E	94	Very high	94.8	Very high	86 Å²	86	81.3 Å²	81.3	40%	0.402	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-89	127.2	169.7	-68.9	172	172.4	0	0	110.4	R732 K735	R732-E737 HydrophobicContact CB-CB 4.22Å; R732-E737 WeakPolarHBondContact CB-O 3.33Å; R732-E737 HydrophobicContact CG-CB 4.22Å; R732-E737 PolarHBondContact O-N 3.23Å; K735-E737 VanDerWaalsContact C-N 3.31Å; K735-E737 HydrophobicContact CB-CG 3.93Å; K735-E737 HydrophobicContact CD-CG 4.04Å; K735-E737 WeakPolarHBondContact CD-OE1 3.49Å; K735-E737 WeakPolarHBondContact CD-OE2 3.4Å; K735-E737 IonicContact NZ-OE1 3.65Å; K735-E737 PolarHBondContact NZ-OE1 3.04Å; K735-E737 IonicContact NZ-OE2 3.68Å; K735-E737 PolarHBondContact NZ-OE2 2.81Å
738	D	89.9	Confident	94.5	Very high	148 Å²	148	82 Å²	82	79%	0.791	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-81.7	171.2	167.8	-80.1	-49.2	0	0	0	111.9
739	W	94	Very high	94.3	Very high	94 Å²	94	87.5 Å²	87.5	36%	0.356	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-88.9	131.1	170.4	-176.9	-102.7	0	0	0	110	I500	I500-W739 HydrophobicContact CD1-CB 4.43Å; I500-W739 HydrophobicContact CD1-CD2 4.49Å; I500-W739 HydrophobicContact CD1-CG 3.92Å; I500-W739 HydrophobicContact CG1-CB 4.25Å; I500-W739 HydrophobicContact CG1-CD2 3.74Å; I500-W739 HydrophobicContact CG1-CE3 4.39Å; I500-W739 HydrophobicContact CG1-CG 3.62Å
740	I	94.4	Very high	94.1	Very high	133 Å²	133	89 Å²	89	68%	0.682	46%	0.459	S	S	*	.			trans	-112.6	111.9	172.5	-57.9	176.7	0	0	0	107
741	P	96.8	Very high	93.9	Very high	8 Å²	8	84.5 Å²	84.5	5%	0.052	45%	0.453	C	S	.	.			trans	-63.4	144.4	176.4	-24.3	36.5	0	0	0	112.4	E522 V524 W753 R756	E522-P741 WeakPolarHBondContact OE1-CA 3.25Å; E522-P741 VanDerWaalsContact OE1-CB 3.27Å; E522-P741 WeakPolarHBondContact OE1-CB 3.27Å; E522-P741 WeakPolarHBondContact OE2-CB 3.46Å; V524-P741 HydrophobicContact CB-CB 4.23Å; V524-P741 HydrophobicContact CB-CG 3.81Å; V524-P741 HydrophobicContact CG1-CB 3.9Å; V524-P741 HydrophobicContact CG1-CG 4.04Å; P741-W753 HydrophobicContact CB-CZ3 4.43Å; P741-W753 HydrophobicContact CG-CH2 3.89Å; P741-W753 HydrophobicContact CG-CZ3 3.7Å; P741-R756 PolarHBondContact O-NE 3.15Å; P741-R756 PolarHBondContact O-NH2 2.88Å
742	A	96	Very high	93.7	Very high	62 Å²	62	83.3 Å²	83.3	51%	0.512	45%	0.447	S	S	.	.	S	Bend	trans	-77.2	-44.4	-171.8	0	0	0	0	0	112.4	E522 R756	E522-A742 PolarHBondContact OE1-N 3.25Å; E522-A742 PolarHBondContact OE2-N 3.39Å; E522-A742 VanDerWaalsContact OE2-N 3.14Å; A742-R756 WeakPolarHBondContact O-CD 3.23Å; A742-R756 PolarHBondContact O-NE 3.35Å
743	L	97.6	Very high	93.7	Very high	19 Å²	19	82.8 Å²	82.8	10%	0.099	45%	0.445	C	S	.	.	S	Bend	trans	-103.4	-17.4	-170.4	-58.6	179.5	0	0	0	112.8	T503 I520 E522 Y755 R756 Y757	T503-L743 HydrophobicContact CG2-CD1 4.02Å; I520-L743 HydrophobicContact CG2-CD1 3.63Å; E522-L743 PolarHBondContact OE2-N 3.49Å; L743-Y755 HydrophobicContact CB-CD2 4.33Å; L743-Y755 HydrophobicContact CB-CE2 4.18Å; L743-Y755 VanDerWaalsContact O-CD2 3.24Å; L743-Y755 WeakPolarHBondContact O-CD2 3.26Å; L743-R756 WeakPolarHBondContact O-CG 3.12Å; L743-R756 PolarHBondContact O-N 3.36Å; L743-Y757 HydrophobicContact CD2-CE2 4.18Å
744	F	98	Very high	93.8	Very high	1 Å²	1	79.7 Å²	79.7	0%	0.004	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	152.3	-178.3	-64.7	-100.2	0	0	0	113	I520 E522 V524 A532 W753 H754 Y755 R756	I520-F744 HydrophobicContact CG2-CE2 4.29Å; E522-F744 HydrophobicContact CB-CD2 3.59Å; E522-F744 HydrophobicContact CB-CE2 3.78Å; E522-F744 PolarHBondContact OE2-N 2.79Å; V524-F744 HydrophobicContact CG1-CB 3.75Å; V524-F744 HydrophobicContact CG1-CD2 4.31Å; V524-F744 HydrophobicContact CG1-CG 4.16Å; A532-F744 HydrophobicContact CB-CB 4.41Å; A532-F744 HydrophobicContact CB-CD1 3.58Å; A532-F744 HydrophobicContact CB-CD2 4.23Å; A532-F744 HydrophobicContact CB-CE1 3.82Å; A532-F744 HydrophobicContact CB-CE2 4.46Å; A532-F744 HydrophobicContact CB-CG 3.82Å; A532-F744 HydrophobicContact CB-CZ 4.28Å; F744-W753 HydrophobicContact CB-CE3 4.09Å; F744-H754 CarbonylContact C-O 3.52Å; F744-H754 VanDerWaalsContact CA-O 3.26Å; F744-H754 WeakPolarHBondContact CA-O 3.29Å; F744-Y755 HydrophobicContact CE1-CD2 4.3Å; F744-Y755 HydrophobicContact CE1-CG 4.48Å; F744-Y755 HydrophobicContact CE2-CD2 4.24Å; F744-Y755 HydrophobicContact CZ-CD2 4.05Å; F744-R756 PolarHBondContact O-NE 3Å; F744-R756 PolarHBondContact O-NH2 2.86Å
745	E	96.2	Very high	93.9	Very high	67 Å²	67	74.8 Å²	74.8	31%	0.313	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	149.1	170.3	54.6	-165	-146.2	0	0	110.8	W753 H754 R756 R790	E745-W753 WeakPolarHBondContact O-CA 3.27Å; E745-H754 PolarHBondContact N-O 2.68Å; E745-H754 PolarHBondContact O-N 3.25Å; E745-R756 HydrophobicContact CB-CG 4.31Å; E745-R756 HydrophobicContact CG-CG 4.03Å; E745-R756 IonicContact OE2-CZ 2.69Å; E745-R756 IonicContact OE2-NH1 3.22Å; E745-R756 PolarHBondContact OE2-NH1 3.48Å; E745-R790 IonicContact OE1-NH1 2.73Å
746	Q	95	Very high	93.9	Very high	102 Å²	102	71.5 Å²	71.5	48%	0.477	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	130.1	177.4	-163	173.3	23.2	0	0	109.6	P748 G751 E752 W753	Q746-P748 WeakPolarHBondContact O-CD 3.18Å; Q746-G751 PolarHBondContact NE2-O 2.68Å; Q746-E752 WeakPolarHBondContact CA-O 2.83Å; Q746-E752 WeakPolarHBondContact CG-O 3.28Å; Q746-W753 HydrophobicContact CB-CD2 3.96Å; Q746-W753 HydrophobicContact CB-CE3 3.85Å; Q746-W753 HydrophobicContact CB-CH2 3.83Å; Q746-W753 HydrophobicContact CB-CZ2 3.93Å; Q746-W753 HydrophobicContact CB-CZ3 3.78Å; Q746-W753 HydrophobicContact CG-CD2 4.15Å; Q746-W753 HydrophobicContact CG-CZ2 4.14Å
747	D	91.4	Very high	94	Very high	29 Å²	29	70.5 Å²	70.5	16%	0.155	37%	0.366	C	S	.	.			trans	-67.5	120.6	169.8	169.8	17.8	0	0	0	109.4	I749 T750 G751 E752	D747-I749 PolarHBondContact O-N 3Å; D747-I749 WeakPolarHBondContact OD1-CB 3.49Å; D747-I749 PolarHBondContact OD1-N 3.3Å; D747-T750 WeakPolarHBondContact CB-OG1 3.19Å; D747-T750 VanDerWaalsContact OD2-CB 3.25Å; D747-T750 WeakPolarHBondContact OD2-CB 3.24Å; D747-T750 WeakPolarHBondContact OD2-CG2 3.45Å; D747-T750 PolarHBondContact OD2-N 2.83Å; D747-T750 PolarHBondContact OD2-OG1 3.17Å; D747-G751 VanDerWaalsContact O-CA 3.25Å; D747-G751 WeakPolarHBondContact O-CA 3.29Å; D747-G751 PolarHBondContact O-N 3.38Å; D747-E752 PolarHBondContact N-O 2.94Å
748	P	89.8	Confident	94.1	Very high	128 Å²	128	68.2 Å²	68.2	83%	0.831	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-10.5	179.5	29.7	-36.9	0	0	0	114.1	Q746	Q746-P748 WeakPolarHBondContact O-CD 3.18Å
749	I	90.4	Very high	94.2	Very high	155 Å²	155	62.4 Å²	62.4	80%	0.795	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-56	179.7	-55.7	178.6	0	0	0	111.2	D747	D747-I749 PolarHBondContact O-N 3Å; D747-I749 WeakPolarHBondContact OD1-CB 3.49Å; D747-I749 PolarHBondContact OD1-N 3.3Å
750	T	89.1	Confident	94.2	Very high	75 Å²	75	60.8 Å²	60.8	46%	0.46	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-27.8	-179.4	61.7	0	0	0	0	113.7	D747 E752	D747-T750 WeakPolarHBondContact CB-OG1 3.19Å; D747-T750 VanDerWaalsContact OD2-CB 3.25Å; D747-T750 WeakPolarHBondContact OD2-CB 3.24Å; D747-T750 WeakPolarHBondContact OD2-CG2 3.45Å; D747-T750 PolarHBondContact OD2-N 2.83Å; D747-T750 PolarHBondContact OD2-OG1 3.17Å; T750-E752 PolarHBondContact OG1-N 2.91Å; T750-E752 VanDerWaalsContact OG1-N 3.15Å
751	G	89.4	Confident	94.2	Very high	33 Å²	33	57 Å²	57	34%	0.34	31%	0.309	S	S	.	.			trans	77	3.2	-168.3	0	0	0	0	0	114.5	Q746 D747	Q746-G751 PolarHBondContact NE2-O 2.68Å; D747-G751 VanDerWaalsContact O-CA 3.25Å; D747-G751 WeakPolarHBondContact O-CA 3.29Å; D747-G751 PolarHBondContact O-N 3.38Å
752	E	91.4	Very high	94.1	Very high	67 Å²	67	60 Å²	60	31%	0.313	33%	0.328	S	S	.	.			trans	-65.3	152.1	171.7	-71	-167	-177.6	0	0	111.1	R568 Q746 D747 T750 H754	R568-E752 IonicContact CZ-OE1 2.88Å; R568-E752 IonicContact NE-OE2 2.71Å; R568-E752 IonicContact NH2-OE1 3.75Å; R568-E752 PolarHBondContact NH2-OE1 3.31Å; R568-E752 IonicContact NH2-OE2 2.82Å; Q746-E752 WeakPolarHBondContact CA-O 2.83Å; Q746-E752 WeakPolarHBondContact CG-O 3.28Å; D747-E752 PolarHBondContact N-O 2.94Å; T750-E752 PolarHBondContact OG1-N 2.91Å; T750-E752 VanDerWaalsContact OG1-N 3.15Å; E752-H754 IonicContact OE2-CE1 3.96Å; E752-H754 PolarHBondContact OE2-CE1 2.83Å
753	W	95.2	Very high	94	Very high	35 Å²	35	58.7 Å²	58.7	13%	0.133	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	125.9	172.5	-71.9	91.5	0	0	0	110.2	V524 A532 P741 F744 E745 Q746	V524-W753 HydrophobicContact CB-CD2 4.04Å; V524-W753 HydrophobicContact CB-CE3 3.93Å; V524-W753 HydrophobicContact CB-CH2 3.91Å; V524-W753 HydrophobicContact CB-CZ2 4.02Å; V524-W753 HydrophobicContact CB-CZ3 3.87Å; V524-W753 HydrophobicContact CG1-CD2 4.24Å; V524-W753 HydrophobicContact CG1-CE3 3.89Å; V524-W753 HydrophobicContact CG1-CZ3 4.11Å; V524-W753 HydrophobicContact CG2-CD2 3.73Å; V524-W753 HydrophobicContact CG2-CE3 4.16Å; V524-W753 HydrophobicContact CG2-CG 4.16Å; V524-W753 HydrophobicContact CG2-CH2 4.3Å; V524-W753 HydrophobicContact CG2-CZ2 3.89Å; V524-W753 HydrophobicContact CG2-CZ3 4.43Å; A532-W753 HydrophobicContact CB-CB 3.92Å; A532-W753 HydrophobicContact CB-CG 4.33Å; P741-W753 HydrophobicContact CB-CZ3 4.43Å; P741-W753 HydrophobicContact CG-CH2 3.89Å; P741-W753 HydrophobicContact CG-CZ3 3.7Å; F744-W753 HydrophobicContact CB-CE3 4.09Å; E745-W753 WeakPolarHBondContact O-CA 3.27Å; Q746-W753 HydrophobicContact CB-CD2 3.96Å; Q746-W753 HydrophobicContact CB-CE3 3.85Å; Q746-W753 HydrophobicContact CB-CH2 3.83Å; Q746-W753 HydrophobicContact CB-CZ2 3.93Å; Q746-W753 HydrophobicContact CB-CZ3 3.78Å; Q746-W753 HydrophobicContact CG-CD2 4.15Å; Q746-W753 HydrophobicContact CG-CZ2 4.14Å
754	H	95.6	Very high	93.9	Very high	69 Å²	69	61 Å²	61	32%	0.319	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	142.3	179.5	-58.1	-37.2	0	0	0	110.5	F744 E745 E752	F744-H754 CarbonylContact C-O 3.52Å; F744-H754 VanDerWaalsContact CA-O 3.26Å; F744-H754 WeakPolarHBondContact CA-O 3.29Å; E745-H754 PolarHBondContact N-O 2.68Å; E745-H754 PolarHBondContact O-N 3.25Å; E752-H754 IonicContact OE2-CE1 3.96Å; E752-H754 PolarHBondContact OE2-CE1 2.83Å
755	Y	98	Very high	93.6	Very high	8 Å²	8	65.7 Å²	65.7	3%	0.031	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	126.3	175.7	173	-114.7	0	0	0	109.9	I520 Y534 L743 F744 Y757 A758 G776 C777 I778	I520-Y755 HydrophobicContact CB-CE2 4.28Å; I520-Y755 HydrophobicContact CG1-CE2 4.39Å; I520-Y755 HydrophobicContact CG2-CD2 4.36Å; I520-Y755 HydrophobicContact CG2-CE2 3.82Å; Y534-Y755 AromaticContact CD1-CD1 3.22Å; Y534-Y755 HydrophobicContact CD1-CD1 3.22Å; Y534-Y755 AromaticContact CD1-CE1 3.65Å; Y534-Y755 HydrophobicContact CD1-CE1 3.65Å; Y534-Y755 AromaticContact CD1-CG 3.81Å; Y534-Y755 HydrophobicContact CD1-CG 3.81Å; Y534-Y755 HydrophobicContact CD2-CD1 4.4Å; Y534-Y755 AromaticContact CE1-CD1 3.59Å; Y534-Y755 HydrophobicContact CE1-CD1 3.59Å; Y534-Y755 AromaticContact CE1-CE1 3.94Å; Y534-Y755 HydrophobicContact CE1-CE1 3.94Å; Y534-Y755 AromaticContact CG-CD1 3.68Å; Y534-Y755 HydrophobicContact CG-CD1 3.68Å; Y534-Y755 HydrophobicContact CG-CE1 4.48Å; Y534-Y755 AromaticContact CG-CG 3.82Å; Y534-Y755 HydrophobicContact CG-CG 3.82Å; L743-Y755 HydrophobicContact CB-CD2 4.33Å; L743-Y755 HydrophobicContact CB-CE2 4.18Å; L743-Y755 VanDerWaalsContact O-CD2 3.24Å; L743-Y755 WeakPolarHBondContact O-CD2 3.26Å; F744-Y755 HydrophobicContact CE1-CD2 4.3Å; F744-Y755 HydrophobicContact CE1-CG 4.48Å; F744-Y755 HydrophobicContact CE2-CD2 4.24Å; F744-Y755 HydrophobicContact CZ-CD2 4.05Å; Y755-Y757 HydrophobicContact CE1-CD2 4.49Å; Y755-Y757 AromaticContact CE2-CD2 3.99Å; Y755-Y757 HydrophobicContact CE2-CD2 3.99Å; Y755-Y757 AromaticContact CZ-CD2 3.91Å; Y755-Y757 PolarHBondContact O-N 3.39Å; Y755-Y757 VanDerWaalsContact O-N 3.09Å; Y755-A758 HydrophobicContact CD1-CB 4.06Å; Y755-A758 VanDerWaalsContact O-CB 3.29Å; Y755-A758 WeakPolarHBondContact O-CB 3.01Å; Y755-A758 PolarHBondContact O-N 2.94Å; Y755-A758 VanDerWaalsContact O-N 3.08Å; Y755-G776 PolarHBondContact OH-O 2.83Å; Y755-C777 VanDerWaalsContact OH-CA 3.32Å; Y755-C777 WeakPolarHBondContact OH-CA 3.3Å; Y755-I778 HydrophobicContact CE1-CB 4.3Å; Y755-I778 HydrophobicContact CE1-CD1 4.23Å; Y755-I778 HydrophobicContact CE1-CG1 4.42Å; Y755-I778 PolarHBondContact OH-N 2.87Å
756	R	96.9	Very high	93.3	Very high	68 Å²	68	69 Å²	69	26%	0.257	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.9	-168.8	-65.3	-178.8	-172.5	-89.1	10.4	114.2	P741 A742 L743 F744 E745	P741-R756 PolarHBondContact O-NE 3.15Å; P741-R756 PolarHBondContact O-NH2 2.88Å; A742-R756 WeakPolarHBondContact O-CD 3.23Å; A742-R756 PolarHBondContact O-NE 3.35Å; L743-R756 WeakPolarHBondContact O-CG 3.12Å; L743-R756 PolarHBondContact O-N 3.36Å; F744-R756 PolarHBondContact O-NE 3Å; F744-R756 PolarHBondContact O-NH2 2.86Å; E745-R756 HydrophobicContact CB-CG 4.31Å; E745-R756 HydrophobicContact CG-CG 4.03Å; E745-R756 IonicContact OE2-CZ 2.69Å; E745-R756 IonicContact OE2-NH1 3.22Å; E745-R756 PolarHBondContact OE2-NH1 3.48Å
757	Y	95.9	Very high	93.2	Very high	93 Å²	93	64.4 Å²	64.4	37%	0.365	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	21.4	-177.2	-45.4	-81.8	0	0	0	112.2	L743 Y755 D759 C777	L743-Y757 HydrophobicContact CD2-CE2 4.18Å; Y755-Y757 HydrophobicContact CE1-CD2 4.49Å; Y755-Y757 AromaticContact CE2-CD2 3.99Å; Y755-Y757 HydrophobicContact CE2-CD2 3.99Å; Y755-Y757 AromaticContact CZ-CD2 3.91Å; Y755-Y757 PolarHBondContact O-N 3.39Å; Y755-Y757 VanDerWaalsContact O-N 3.09Å; Y757-D759 PolarHBondContact O-N 2.82Å; Y757-C777 HydrophobicContact CD1-CB 4.44Å; Y757-C777 HydrophobicContact CD2-CB 4.24Å; Y757-C777 HydrophobicContact CE2-CB 4.46Å; Y757-C777 VanDerWaalsContact CE2-SG 3.53Å; Y757-C777 HydrophobicContact CG-CB 4.23Å; Y757-C777 VanDerWaalsContact CZ-SG 3.57Å
758	A	94.9	Very high	93.3	Very high	38 Å²	38	63.4 Å²	63.4	31%	0.314	35%	0.346	S	S	.	.			trans	-66.8	114.2	178.5	0	0	0	0	0	111.7	Y534 Y755	Y534-A758 HydrophobicContact CE1-CB 4.44Å; Y534-A758 HydrophobicContact CE2-CB 3.92Å; Y755-A758 HydrophobicContact CD1-CB 4.06Å; Y755-A758 VanDerWaalsContact O-CB 3.29Å; Y755-A758 WeakPolarHBondContact O-CB 3.01Å; Y755-A758 PolarHBondContact O-N 2.94Å; Y755-A758 VanDerWaalsContact O-N 3.08Å
759	D	93	Very high	93.4	Very high	26 Å²	26	60.6 Å²	60.6	14%	0.139	32%	0.323	C	S	.	.			trans	-101.3	104	166.9	-176.2	3.1	0	0	0	109.5	R538 Y757 R761	R538-D759 WeakPolarHBondContact CD-O 3.2Å; R538-D759 IonicContact CZ-OD2 2.76Å; R538-D759 VanDerWaalsContact CZ-OD2 3.31Å; R538-D759 IonicContact NE-OD1 2.75Å; R538-D759 IonicContact NE-OD2 3.91Å; R538-D759 PolarHBondContact NE-OD2 3.14Å; R538-D759 IonicContact NH1-OD2 3.62Å; R538-D759 PolarHBondContact NH1-OD2 3.08Å; Y757-D759 PolarHBondContact O-N 2.82Å; D759-R761 VanDerWaalsContact OD1-CB 3.31Å; D759-R761 WeakPolarHBondContact OD1-CB 3.34Å; D759-R761 VanDerWaalsContact OD1-CG 3.24Å; D759-R761 WeakPolarHBondContact OD1-CG 3.18Å; D759-R761 IonicContact OD1-CZ 3.61Å; D759-R761 PolarHBondContact OD1-N 3.09Å; D759-R761 VanDerWaalsContact OD1-N 3.13Å; D759-R761 IonicContact OD1-NE 2.59Å; D759-R761 PolarHBondContact OD1-NE 3.28Å; D759-R761 IonicContact OD1-NH2 2.72Å; D759-R761 IonicContact OD2-CZ 3.61Å; D759-R761 IonicContact OD2-NE 3.59Å; D759-R761 PolarHBondContact OD2-NE 3.38Å; D759-R761 IonicContact OD2-NH2 2.75Å; D759-R761 PolarHBondContact OD2-NH2 2.87Å
760	T	93.5	Very high	93.4	Very high	61 Å²	61	56.4 Å²	56.4	37%	0.374	30%	0.302	S	S	.	.			trans	-99.1	17.1	-178.9	65	0	0	0	0	112.5
761	R	94	Very high	93.7	Very high	54 Å²	54	53.5 Å²	53.5	20%	0.204	28%	0.283	C	S	.	.	S	Bend	trans	-75.1	140.3	174.8	-60.6	174.7	-59	140.3	12.2	109.8	R538 D759 D768	R538-R761 PolarHBondContact NE-O 2.89Å; R538-R761 PolarHBondContact NH2-O 2.68Å; D759-R761 VanDerWaalsContact OD1-CB 3.31Å; D759-R761 WeakPolarHBondContact OD1-CB 3.34Å; D759-R761 VanDerWaalsContact OD1-CG 3.24Å; D759-R761 WeakPolarHBondContact OD1-CG 3.18Å; D759-R761 IonicContact OD1-CZ 3.61Å; D759-R761 PolarHBondContact OD1-N 3.09Å; D759-R761 VanDerWaalsContact OD1-N 3.13Å; D759-R761 IonicContact OD1-NE 2.59Å; D759-R761 PolarHBondContact OD1-NE 3.28Å; D759-R761 IonicContact OD1-NH2 2.72Å; D759-R761 IonicContact OD2-CZ 3.61Å; D759-R761 IonicContact OD2-NE 3.59Å; D759-R761 PolarHBondContact OD2-NE 3.38Å; D759-R761 IonicContact OD2-NH2 2.75Å; D759-R761 PolarHBondContact OD2-NH2 2.87Å; R761-D768 IonicContact NH2-OD1 3.44Å
762	P	94.8	Very high	93.9	Very high	71 Å²	71	52.9 Å²	52.9	46%	0.461	27%	0.271	S	S	.	.			trans	-45.4	148.5	163.3	-28.5	36.2	0	0	0	111.8	R538 N573	R538-P762 PolarHBondContact NH2-O 2.85Å; N573-P762 WeakPolarHBondContact OD1-CB 3.43Å
763	W	94.8	Very high	94.1	Very high	34 Å²	34	49.7 Å²	49.7	13%	0.129	26%	0.256	C	S	.	.			trans	-72.4	129.8	174.5	-176.9	-85.9	0	0	0	110.4	R538 K539 P765 D768 Q771 T780	R538-W763 HydrophobicContact CB-CE3 3.84Å; R538-W763 HydrophobicContact CB-CZ3 4.46Å; R538-W763 WeakPolarHBondContact O-CB 3.35Å; K539-W763 HydrophobicContact CB-CD2 3.97Å; K539-W763 HydrophobicContact CB-CE3 3.97Å; K539-W763 HydrophobicContact CB-CH2 4.43Å; K539-W763 HydrophobicContact CB-CZ2 4.44Å; K539-W763 HydrophobicContact CB-CZ3 4.22Å; K539-W763 HydrophobicContact CD-CZ2 4.27Å; K539-W763 HydrophobicContact CG-CD2 4.22Å; K539-W763 HydrophobicContact CG-CZ2 4.28Å; W763-P765 WeakPolarHBondContact O-CD 3.43Å; W763-D768 HydrophobicContact CD2-CB 3.65Å; W763-D768 HydrophobicContact CE3-CB 3.73Å; W763-D768 HydrophobicContact CG-CB 4.36Å; W763-D768 HydrophobicContact CH2-CB 3.7Å; W763-D768 HydrophobicContact CZ2-CB 3.6Å; W763-D768 WeakPolarHBondContact CZ2-O 3.25Å; W763-D768 HydrophobicContact CZ3-CB 3.75Å; W763-Q771 HydrophobicContact CZ3-CB 4.02Å; W763-T780 HydrophobicContact CH2-CG2 4.11Å; W763-T780 HydrophobicContact CZ3-CG2 3.76Å
764	D	94.2	Very high	94.1	Very high	67 Å²	67	51.5 Å²	51.5	36%	0.358	27%	0.265	S	S	.	.			trans	-100.3	106	173.7	179.7	-2.3	0	0	0	110.2	L766 N767 D768	D764-L766 PolarHBondContact O-N 3.49Å; D764-L766 VanDerWaalsContact O-N 3.08Å; D764-L766 WeakPolarHBondContact OD1-CA 3.15Å; D764-L766 WeakPolarHBondContact OD1-CB 3.38Å; D764-L766 PolarHBondContact OD1-N 3.03Å; D764-N767 HydrophobicContact CB-CB 4.15Å; D764-N767 PolarHBondContact O-N 2.9Å; D764-N767 PolarHBondContact OD1-N 3.13Å; D764-N767 WeakPolarHBondContact OD2-CB 3.5Å; D764-D768 PolarHBondContact N-OD2 3.46Å; D764-D768 PolarHBondContact O-N 2.98Å
765	P	91.5	Very high	93.9	Very high	100 Å²	100	53 Å²	53	65%	0.649	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-13.8	178.6	-20.1	33.2	0	0	0	114.7	W763	W763-P765 WeakPolarHBondContact O-CD 3.43Å
766	L	91.4	Very high	93.7	Very high	135 Å²	135	52.9 Å²	52.9	71%	0.707	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-19.4	176	-57.6	-179.6	0	0	0	112.5	D764 R783	D764-L766 PolarHBondContact O-N 3.49Å; D764-L766 VanDerWaalsContact O-N 3.08Å; D764-L766 WeakPolarHBondContact OD1-CA 3.15Å; D764-L766 WeakPolarHBondContact OD1-CB 3.38Å; D764-L766 PolarHBondContact OD1-N 3.03Å; L766-R783 WeakPolarHBondContact O-CD 3.27Å; L766-R783 PolarHBondContact O-NH1 2.85Å
767	N	92.1	Very high	93.7	Very high	7 Å²	7	50.5 Å²	50.5	4%	0.037	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	-46.4	-174.9	-167.1	36.3	0	0	0	115	D764 L769 V782 R783 H784 T786	D764-N767 HydrophobicContact CB-CB 4.15Å; D764-N767 PolarHBondContact O-N 2.9Å; D764-N767 PolarHBondContact OD1-N 3.13Å; D764-N767 WeakPolarHBondContact OD2-CB 3.5Å; N767-L769 PolarHBondContact O-N 3.21Å; N767-V782 CarbonylContact O-C 3.49Å; N767-V782 VanDerWaalsContact O-CA 3.23Å; N767-V782 WeakPolarHBondContact O-CA 3.49Å; N767-R783 PolarHBondContact O-N 3.19Å; N767-R783 PolarHBondContact OD1-N 3.34Å; N767-H784 PolarHBondContact ND2-O 3.15Å; N767-H784 PolarHBondContact OD1-N 2.96Å; N767-H784 PolarHBondContact OD1-O 3.46Å; N767-T786 PolarHBondContact ND2-OG1 3.08Å
768	D	93.2	Very high	93.7	Very high	8 Å²	8	46.5 Å²	46.5	4%	0.043	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	121.3	177.1	-66.9	-59	0	0	0	109.7	R538 R761 W763 D764 T780	R538-D768 IonicContact CZ-OD1 2.75Å; R538-D768 IonicContact CZ-OD2 2.95Å; R538-D768 VanDerWaalsContact NH1-CG 3.27Å; R538-D768 IonicContact NH1-OD1 3.58Å; R538-D768 PolarHBondContact NH1-OD1 3.16Å; R538-D768 IonicContact NH1-OD2 3.81Å; R538-D768 PolarHBondContact NH1-OD2 2.98Å; R538-D768 IonicContact NH2-OD1 2.78Å; R538-D768 IonicContact NH2-OD2 3.69Å; R538-D768 PolarHBondContact NH2-OD2 3.02Å; R761-D768 IonicContact NH2-OD1 3.44Å; W763-D768 HydrophobicContact CD2-CB 3.65Å; W763-D768 HydrophobicContact CE3-CB 3.73Å; W763-D768 HydrophobicContact CG-CB 4.36Å; W763-D768 HydrophobicContact CH2-CB 3.7Å; W763-D768 HydrophobicContact CZ2-CB 3.6Å; W763-D768 WeakPolarHBondContact CZ2-O 3.25Å; W763-D768 HydrophobicContact CZ3-CB 3.75Å; D764-D768 PolarHBondContact N-OD2 3.46Å; D764-D768 PolarHBondContact O-N 2.98Å; D768-T780 HydrophobicContact CB-CG2 3.89Å; D768-T780 VanDerWaalsContact OD1-CG2 3.29Å; D768-T780 WeakPolarHBondContact OD1-CG2 3.49Å
769	L	91.6	Very high	93.7	Very high	68 Å²	68	48.9 Å²	48.9	36%	0.356	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-53.1	-177.6	-65	172.8	0	0	0	112	M380 N767 K781 R783	M380-L769 HydrophobicContact CE-CD1 4.25Å; M380-L769 HydrophobicContact SD-CD1 4.38Å; N767-L769 PolarHBondContact O-N 3.21Å; L769-K781 WeakPolarHBondContact CB-O 3.5Å; L769-K781 HydrophobicContact CD1-CG 4.44Å; L769-K781 PolarHBondContact N-O 3.42Å; L769-R783 HydrophobicContact CD1-CG 4.03Å; L769-R783 HydrophobicContact CD2-CG 3.71Å; L769-R783 HydrophobicContact CG-CG 3.93Å
770	I	91.7	Very high	93.7	Very high	68 Å²	68	48.9 Å²	48.9	35%	0.349	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	132.4	-177.7	-177.2	165.9	0	0	0	110.3	L386 T780 K781	L386-I770 HydrophobicContact CD1-CG2 4.34Å; L386-I770 HydrophobicContact CD2-CD1 4.43Å; I770-T780 CarbonylContact O-C 3.53Å; I770-T780 WeakPolarHBondContact O-CA 3.36Å; I770-T780 WeakPolarHBondContact O-CG2 3.43Å; I770-K781 HydrophobicContact CG2-CB 3.98Å; I770-K781 PolarHBondContact O-N 3.28Å
771	Q	94	Very high	93.6	Very high	14 Å²	14	48 Å²	48	7%	0.065	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	129.3	164.3	-179.3	162.2	65.5	0	0	108.6	F518 S536 W763 I778 Q779	F518-Q771 HydrophobicContact CD2-CG 4.22Å; F518-Q771 HydrophobicContact CE2-CG 4Å; S536-Q771 VanDerWaalsContact OG-CD 3.28Å; S536-Q771 PolarHBondContact OG-NE2 3.16Å; S536-Q771 PolarHBondContact OG-OE1 3.22Å; W763-Q771 HydrophobicContact CZ3-CB 4.02Å; Q771-I778 HydrophobicContact CG-CG2 3.79Å; Q771-Q779 WeakPolarHBondContact CA-O 3.25Å
772	F	94.8	Very high	93.4	Very high	19 Å²	19	47.3 Å²	47.3	8%	0.083	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	167.9	-179	67.5	-80.3	0	0	0	110.3	L386 E388 K774 I778 Q779 K781	L386-F772 HydrophobicContact CD1-CD1 3.91Å; L386-F772 HydrophobicContact CD1-CE1 3.81Å; L386-F772 HydrophobicContact CD1-CE2 4.48Å; L386-F772 HydrophobicContact CD1-CG 4.3Å; L386-F772 HydrophobicContact CD1-CZ 4.11Å; L386-F772 HydrophobicContact CD2-CB 4Å; L386-F772 HydrophobicContact CD2-CD1 4.24Å; L386-F772 HydrophobicContact CD2-CD2 4.33Å; L386-F772 HydrophobicContact CD2-CG 3.95Å; L386-F772 HydrophobicContact CG-CD1 4.47Å; L386-F772 HydrophobicContact CG-CD2 4.44Å; L386-F772 HydrophobicContact CG-CG 4.37Å; E388-F772 HydrophobicContact CB-CB 4.07Å; E388-F772 HydrophobicContact CB-CD2 4.07Å; E388-F772 HydrophobicContact CB-CG 4.5Å; F772-K774 HydrophobicContact CE2-CB 4.37Å; F772-I778 WeakPolarHBondContact O-CA 3.37Å; F772-Q779 HydrophobicContact CD1-CB 4.34Å; F772-Q779 HydrophobicContact CE1-CB 3.77Å; F772-Q779 HydrophobicContact CE2-CB 4.01Å; F772-Q779 HydrophobicContact CZ-CB 3.59Å; F772-Q779 HydrophobicContact CZ-CG 4.49Å; F772-Q779 PolarHBondContact N-O 2.91Å; F772-Q779 PolarHBondContact O-N 2.71Å; F772-Q779 VanDerWaalsContact O-O 3.12Å; F772-K781 HydrophobicContact CE1-CB 4.17Å
773	E	95.8	Very high	93	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	145.2	173.4	-173.3	-82.8	177	0	0	109.2	E388 T389 Y391 R505 F518 I520 G776 C777 I778	E388-E773 WeakPolarHBondContact CA-O 3.2Å; E388-E773 WeakPolarHBondContact CB-O 3.32Å; T389-E773 VanDerWaalsContact CB-OE2 3.26Å; T389-E773 WeakPolarHBondContact CB-OE2 3.35Å; T389-E773 PolarHBondContact N-O 2.85Å; T389-E773 PolarHBondContact OG1-OE2 2.61Å; Y391-E773 HydrophobicContact CE2-CB 4.28Å; Y391-E773 VanDerWaalsContact OH-CD 3.25Å; Y391-E773 PolarHBondContact OH-OE2 2.85Å; R505-E773 WeakPolarHBondContact CD-OE1 3.18Å; R505-E773 IonicContact CZ-OE1 3.23Å; R505-E773 IonicContact NE-OE1 2.68Å; R505-E773 IonicContact NH1-OE1 2.81Å; R505-E773 PolarHBondContact NH1-OE1 2.69Å; R505-E773 IonicContact NH1-OE2 3.58Å; R505-E773 PolarHBondContact NH1-OE2 3.42Å; F518-E773 HydrophobicContact CD1-CB 3.51Å; F518-E773 HydrophobicContact CD1-CG 4.34Å; F518-E773 HydrophobicContact CE1-CB 3.49Å; F518-E773 VanDerWaalsContact CE1-CB 3.49Å; F518-E773 HydrophobicContact CG-CB 4.26Å; F518-E773 HydrophobicContact CZ-CB 4.22Å; I520-E773 HydrophobicContact CD1-CG 4.04Å; E773-G776 WeakPolarHBondContact OE1-CA 3.41Å; E773-G776 PolarHBondContact OE1-N 2.69Å; E773-C777 WeakPolarHBondContact CA-O 3.37Å; E773-I778 HydrophobicContact CB-CG1 4.44Å; E773-I778 HydrophobicContact CG-CG1 4.21Å
774	K	94.5	Very high	92.5	Very high	73 Å²	73	53 Å²	53	32%	0.317	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	124	174.2	-171.8	-172.2	-175.2	-80.9	0	109.2	R387 F772 G776 C777	R387-K774 WeakPolarHBondContact O-CD 3.47Å; R387-K774 WeakPolarHBondContact O-CE 3.42Å; R387-K774 WeakPolarHBondContact O-CG 3.48Å; F772-K774 HydrophobicContact CE2-CB 4.37Å; K774-G776 VanDerWaalsContact C-N 3.31Å; K774-G776 PolarHBondContact O-N 3.39Å; K774-C777 PolarHBondContact N-O 2.82Å; K774-C777 WeakPolarHBondContact O-CA 3.48Å; K774-C777 VanDerWaalsContact O-CB 3.22Å; K774-C777 WeakPolarHBondContact O-CB 3.13Å; K774-C777 PolarHBondContact O-N 2.9Å
775	D	92.1	Very high	91.3	Very high	100 Å²	100	59.7 Å²	59.7	54%	0.535	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.4	43.4	170.9	-48.1	-33.5	0	0	0	113.9	T389 C777	T389-D775 PolarHBondContact OG1-N 3.14Å; T389-D775 VanDerWaalsContact OG1-N 3.16Å; D775-C777 VanDerWaalsContact C-N 3.27Å; D775-C777 PolarHBondContact O-N 2.83Å
776	G	93.4	Very high	89.8	Confident	5 Å²	5	58.2 Å²	58.2	5%	0.052	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	-3.2	-176.4	0	0	0	0	0	114.9	Y755 E773 K774	Y755-G776 PolarHBondContact OH-O 2.83Å; E773-G776 WeakPolarHBondContact OE1-CA 3.41Å; E773-G776 PolarHBondContact OE1-N 2.69Å; K774-G776 VanDerWaalsContact C-N 3.31Å; K774-G776 PolarHBondContact O-N 3.39Å
777	C	96.2	Very high	88.1	Confident	18 Å²	18	55.9 Å²	55.9	12%	0.122	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	112.9	-174.9	-53.8	0	0	0	0	111.3	Y755 Y757 E773 K774 D775	Y755-C777 VanDerWaalsContact OH-CA 3.32Å; Y755-C777 WeakPolarHBondContact OH-CA 3.3Å; Y757-C777 HydrophobicContact CD1-CB 4.44Å; Y757-C777 HydrophobicContact CD2-CB 4.24Å; Y757-C777 HydrophobicContact CE2-CB 4.46Å; Y757-C777 VanDerWaalsContact CE2-SG 3.53Å; Y757-C777 HydrophobicContact CG-CB 4.23Å; Y757-C777 VanDerWaalsContact CZ-SG 3.57Å; E773-C777 WeakPolarHBondContact CA-O 3.37Å; K774-C777 PolarHBondContact N-O 2.82Å; K774-C777 WeakPolarHBondContact O-CA 3.48Å; K774-C777 VanDerWaalsContact O-CB 3.22Å; K774-C777 WeakPolarHBondContact O-CB 3.13Å; K774-C777 PolarHBondContact O-N 2.9Å; D775-C777 VanDerWaalsContact C-N 3.27Å; D775-C777 PolarHBondContact O-N 2.83Å
778	I	96.6	Very high	86.1	Confident	10 Å²	10	62.2 Å²	62.2	5%	0.051	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	128.9	171.5	-60.7	167.8	0	0	0	108.5	F518 I520 Y534 Y755 Q771 F772 E773	F518-I778 HydrophobicContact CB-CD1 3.71Å; F518-I778 HydrophobicContact CB-CG1 4.07Å; F518-I778 HydrophobicContact CG-CG1 4.46Å; I520-I778 HydrophobicContact CG1-CD1 3.83Å; I520-I778 HydrophobicContact CG1-CG1 4.11Å; Y534-I778 HydrophobicContact CD1-CD1 4.02Å; Y534-I778 HydrophobicContact CE1-CD1 4.14Å; Y755-I778 HydrophobicContact CE1-CB 4.3Å; Y755-I778 HydrophobicContact CE1-CD1 4.23Å; Y755-I778 HydrophobicContact CE1-CG1 4.42Å; Y755-I778 PolarHBondContact OH-N 2.87Å; Q771-I778 HydrophobicContact CG-CG2 3.79Å; F772-I778 WeakPolarHBondContact O-CA 3.37Å; E773-I778 HydrophobicContact CB-CG1 4.44Å; E773-I778 HydrophobicContact CG-CG1 4.21Å
779	Q	94.3	Very high	84	Confident	87 Å²	87	67.2 Å²	67.2	41%	0.407	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	159.3	-174.8	-64.3	-174.7	-8.9	0	0	110.5	Q771 F772	Q771-Q779 WeakPolarHBondContact CA-O 3.25Å; F772-Q779 HydrophobicContact CD1-CB 4.34Å; F772-Q779 HydrophobicContact CE1-CB 3.77Å; F772-Q779 HydrophobicContact CE2-CB 4.01Å; F772-Q779 HydrophobicContact CZ-CB 3.59Å; F772-Q779 HydrophobicContact CZ-CG 4.49Å; F772-Q779 PolarHBondContact N-O 2.91Å; F772-Q779 PolarHBondContact O-N 2.71Å; F772-Q779 VanDerWaalsContact O-O 3.12Å
780	T	93	Very high	81.7	Confident	27 Å²	27	72.8 Å²	72.8	17%	0.166	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	123.3	172.5	-45.9	0	0	0	0	109.5	R538 W763 D768 I770	R538-T780 PolarHBondContact NH1-OG1 3.26Å; R538-T780 VanDerWaalsContact NH1-OG1 3.09Å; W763-T780 HydrophobicContact CH2-CG2 4.11Å; W763-T780 HydrophobicContact CZ3-CG2 3.76Å; D768-T780 HydrophobicContact CB-CG2 3.89Å; D768-T780 VanDerWaalsContact OD1-CG2 3.29Å; D768-T780 WeakPolarHBondContact OD1-CG2 3.49Å; I770-T780 CarbonylContact O-C 3.53Å; I770-T780 WeakPolarHBondContact O-CA 3.36Å; I770-T780 WeakPolarHBondContact O-CG2 3.43Å
781	K	90.9	Very high	79.3	Confident	43 Å²	43	73.7 Å²	73.7	19%	0.187	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	128.7	170.7	-172.1	159.1	176	160.8	0	108	E384 L386 L769 I770 F772	E384-K781 IonicContact OE2-NZ 3.43Å; E384-K781 PolarHBondContact OE2-NZ 2.95Å; L386-K781 HydrophobicContact CD1-CB 4.27Å; L386-K781 HydrophobicContact CD1-CD 3.74Å; L769-K781 WeakPolarHBondContact CB-O 3.5Å; L769-K781 HydrophobicContact CD1-CG 4.44Å; L769-K781 PolarHBondContact N-O 3.42Å; I770-K781 HydrophobicContact CG2-CB 3.98Å; I770-K781 PolarHBondContact O-N 3.28Å; F772-K781 HydrophobicContact CE1-CB 4.17Å
782	V	90.6	Very high	76.5	Confident	38 Å²	38	75.8 Å²	75.8	23%	0.23	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	154.3	-175.3	-66.6	0	0	0	0	111	N767 H784	N767-V782 CarbonylContact O-C 3.49Å; N767-V782 VanDerWaalsContact O-CA 3.23Å; N767-V782 WeakPolarHBondContact O-CA 3.49Å; V782-H784 VanDerWaalsContact CG2-O 3.28Å; V782-H784 WeakPolarHBondContact CG2-O 3.39Å
783	R	86.4	Confident	73.5	Confident	123 Å²	123	79 Å²	79	46%	0.464	41%	0.412	S	S	.	.	S	Bend	trans	-70.9	-39.4	171.9	-65.5	-171.5	177	126.6	1.4	112.1	L766 N767 L769	L766-R783 WeakPolarHBondContact O-CD 3.27Å; L766-R783 PolarHBondContact O-NH1 2.85Å; N767-R783 PolarHBondContact O-N 3.19Å; N767-R783 PolarHBondContact OD1-N 3.34Å; L769-R783 HydrophobicContact CD1-CG 4.03Å; L769-R783 HydrophobicContact CD2-CG 3.71Å; L769-R783 HydrophobicContact CG-CG 3.93Å
784	H	83.6	Confident	70.6	Confident	102 Å²	102	86.8 Å²	86.8	47%	0.472	45%	0.453	S	S	.	.	S	Bend	trans	-131.2	135.4	-176	-51.8	-64.8	0	0	0	109.3	N767 V782 T786	N767-H784 PolarHBondContact ND2-O 3.15Å; N767-H784 PolarHBondContact OD1-N 2.96Å; N767-H784 PolarHBondContact OD1-O 3.46Å; V782-H784 VanDerWaalsContact CG2-O 3.28Å; V782-H784 WeakPolarHBondContact CG2-O 3.39Å; H784-T786 PolarHBondContact O-N 3.34Å
785	R	70.6	Confident	67.7	Low	208 Å²	208	90.1 Å²	90.1	79%	0.785	47%	0.473	S	S	*	.			trans	-72.5	83.8	-176.4	-70.9	-178.7	174.2	175.6	-0.5	111.6
786	T	59.1	Low	64.7	Low	69 Å²	69	90.2 Å²	90.2	42%	0.423	48%	0.481	S	S	.	.			trans	-66.1	135.6	168.5	-34.9	0	0	0	0	109.9	N767 H784 M788	N767-T786 PolarHBondContact ND2-OG1 3.08Å; H784-T786 PolarHBondContact O-N 3.34Å; T786-M788 PolarHBondContact O-N 2.68Å
787	P	56.1	Low	61.8	Low	85 Å²	85	98.5 Å²	98.5	55%	0.552	52%	0.523	S	S	*	.			trans	-61.2	132.2	173.2	23.5	-33.3	0	0	0	111.6	V789	P787-V789 PolarHBondContact O-N 2.76Å
788	M	50.4	Low	58.8	Low	140 Å²	140	102.1 Å²	102.1	69%	0.69	55%	0.549	S	S	*	.			trans	-71.1	105.6	173.7	-79.3	175.9	61.2	0	0	110.7	T786 R790	T786-M788 PolarHBondContact O-N 2.68Å; M788-R790 PolarHBondContact O-N 2.84Å
789	V	48	Very low	55.7	Low	114 Å²	114	109.4 Å²	109.4	69%	0.691	59%	0.588	S	S	*	*			trans	-77.1	102.7	167.8	-177.7	0	0	0	0	108.7	P787 S791	P787-V789 PolarHBondContact O-N 2.76Å; V789-S791 PolarHBondContact O-N 2.74Å; V789-S791 VanDerWaalsContact O-N 3.15Å
790	R	43.2	Very low	52.7	Low	185 Å²	185	114.5 Å²	114.5	70%	0.698	61%	0.612	S	S	*	*			trans	-64	112.2	165.3	-75	-171.5	176.5	-145.3	-1	108.4	E745 M788 G792	E745-R790 IonicContact OE1-NH1 2.73Å; M788-R790 PolarHBondContact O-N 2.84Å; R790-G792 PolarHBondContact O-N 2.97Å
791	S	41.6	Very low	49.5	Very low	86 Å²	86	116.5 Å²	116.5	60%	0.601	64%	0.637	S	S	*	*			trans	-76.9	82.3	-177.5	-171.8	0	0	0	0	111.5	V789	V789-S791 PolarHBondContact O-N 2.74Å; V789-S791 VanDerWaalsContact O-N 3.15Å
792	G	36.2	Very low	46.8	Very low	58 Å²	58	120.8 Å²	120.8	60%	0.598	67%	0.67	S	S	*	*			trans	-59.4	141.4	168.4	0	0	0	0	0	111.4	R790 L794	R790-G792 PolarHBondContact O-N 2.97Å; G792-L794 PolarHBondContact O-N 3.46Å
793	S	31.6	Very low	43.8	Very low	87 Å²	87	130.2 Å²	130.2	61%	0.608	70%	0.701	S	S	*	*			trans	-54.2	119.1	-170.7	-176.2	0	0	0	0	113.3	I795	S793-I795 VanDerWaalsContact C-N 3.28Å; S793-I795 PolarHBondContact O-N 2.81Å
794	L	34	Very low	41.1	Very low	165 Å²	165	135.1 Å²	135.1	86%	0.864	72%	0.72	S	S	*	*			trans	-89.6	35.8	-174.7	-99.5	172.2	0	0	0	113.7	G792	G792-L794 PolarHBondContact O-N 3.46Å
795	I	34	Very low	38.4	Very low	142 Å²	142	136.9 Å²	136.9	73%	0.728	73%	0.732	S	S	*	*			trans	-129.9	78.6	178.5	-47.3	-178.9	0	0	0	112	S793	S793-I795 VanDerWaalsContact C-N 3.28Å; S793-I795 PolarHBondContact O-N 2.81Å
796	S	29.6	Very low	36.4	Very low	102 Å²	102	133.7 Å²	133.7	71%	0.713	73%	0.731	S	S	*	*			trans	-168	106.5	143.8	-171.1	0	0	0	0	112
797	L	31.8	Very low	34.8	Very low	179 Å²	179	136.8 Å²	136.8	94%	0.937	75%	0.754	S	S	*	*			trans	-131.2	78.7	164.9	-85	177.2	0	0	0	110.6
798	S	33.9	Very low	33.4	Very low	95 Å²	95	141.6 Å²	141.6	66%	0.664	77%	0.766	S	S	*	*			trans	-148.5	148.6	157.1	65.9	0	0	0	0	110.8
799	N	31.8	Very low	32.2	Very low	162 Å²	162	140.2 Å²	140.2	87%	0.866	77%	0.769	S	S	*	*			trans	60.3	87.7	179.1	-62.9	-22.9	0	0	0	117.4
800	Q	29.7	Very low	31.1	Very low	195 Å²	195	143.7 Å²	143.7	91%	0.911	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-99.6	130.6	149.8	-73	-169.6	1.8	0	0	110.7
801	G	26.9	Very low	30.3	Very low	68 Å²	68	141.7 Å²	141.7	70%	0.701	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-96.4	153.8	166.5	0	0	0	0	0	111.5
802	P	34.7	Very low	29.5	Very low	133 Å²	133	144 Å²	144	86%	0.864	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-94.3	118.1	-158.4	33.9	-35.5	0	0	0	116.3
803	R	27.4	Very low	29.1	Very low	237 Å²	237	147.1 Å²	147.1	89%	0.894	80%	0.804	S	S	*	*			trans	-143.5	127.4	146.4	-61.3	-170.8	179	179.7	-0.1	106.1
804	R	28.9	Very low	29	Very low	226 Å²	226	149.1 Å²	149.1	85%	0.853	82%	0.815	S	S	*	*				56.4	128.4	68.2	-75.5	-163	-175.8	-170.8	1.5	112.2
805	D	27.6	Very low	28.7	Very low	138 Å²	138	151 Å²	151	74%	0.738	82%	0.816	S	S	*	*			cis	-127.5	-171.6	21.3	-85.1	-60.9	0	0	0	116
806	N	28.7	Very low	28.3	Very low	142 Å²	142	155.5 Å²	155.5	76%	0.759	82%	0.824	S	S	*	*			trans	-90.1	150.9	-166.7	-54.7	-87.9	0	0	0	114.2
807	C	24.6	Very low	28.1	Very low	133 Å²	133	156.7 Å²	156.7	90%	0.899	83%	0.827	S	S	*	*			trans	-146	161.6	133.8	-140.1	0	0	0	0	110.5
808	K	26.4	Very low	28	Very low	187 Å²	187	157 Å²	157	81%	0.813	82%	0.823	S	S	*	*			trans	-139.4	130.1	-173.7	-73.5	-178.8	178.6	176.4	0	112.7
809	C	24.8	Very low	27.8	Very low	111 Å²	111	160.3 Å²	160.3	75%	0.75	83%	0.825	S	S	*	*				-168.6	116.3	128.2	-102.9	0	0	0	0	108.3
810	Q	26.6	Very low	27.5	Very low	187 Å²	187	156.8 Å²	156.8	87%	0.874	81%	0.813	S	S	*	*				65.9	104.2	92	-71.2	-161.9	19.1	0	0	114.6
811	V	25.8	Very low	27.4	Very low	142 Å²	142	153.1 Å²	153.1	86%	0.861	80%	0.8	S	S	*	*			trans	-123.2	141.5	151.9	176.8	0	0	0	0	108.3
812	T	24.6	Very low	27.5	Very low	136 Å²	136	157.5 Å²	157.5	83%	0.834	81%	0.807	S	S	*	*			trans	-72.1	144.1	-168.2	-18.7	0	0	0	0	113.5
813	V	28.1	Very low	28.8	Very low	123 Å²	123	156.6 Å²	156.6	75%	0.745	80%	0.802	S	S	*	*			trans	-126.8	129.9	166.2	180	0	0	0	0	109
814	P	30.1	Very low	28.8	Very low	129 Å²	129	154.9 Å²	154.9	84%	0.838	80%	0.801	S	S	*	*			trans	-72.5	139.1	-179.2	28.6	-34.2	0	0	0	112.7
815	K	26.4	Very low	28.7	Very low	205 Å²	205	148.1 Å²	148.1	89%	0.891	79%	0.788	S	S	*	*			trans	-102.1	134.1	179.7	-83.8	-176.7	173.7	177.9	0	113.5
816	R	26.1	Very low	28.7	Very low	236 Å²	236	149 Å²	149	89%	0.891	79%	0.792	S	S	*	*			trans	-154	141.1	144.8	-69.9	-164.5	176.4	171.4	-1.2	107.9
817	T	25.6	Very low	28.6	Very low	127 Å²	127	149.8 Å²	149.8	78%	0.779	79%	0.791	S	S	*	*			cis	-158.5	170.6	-8.6	9.9	0	0	0	0	110.4
818	H	30.4	Very low	28.7	Very low	184 Å²	184	149.4 Å²	149.4	85%	0.852	79%	0.79	S	S	*	*			trans	-56.7	168	178.4	-55.5	-94	0	0	0	114.8
819	K	28.1	Very low	28.6	Very low	165 Å²	165	143.9 Å²	143.9	72%	0.717	79%	0.786	S	S	*	*			cis	-142.9	-164.4	12.9	-153.3	-159.3	155.3	-151.5	0	107.1	D821	K819-D821 WeakPolarHBondContact CE-OD1 3.42Å; K819-D821 IonicContact NZ-OD1 3.77Å; K819-D821 PolarHBondContact NZ-OD1 3.43Å; K819-D821 IonicContact NZ-OD2 3.46Å; K819-D821 PolarHBondContact NZ-OD2 3.09Å
820	S	26.6	Very low	28.6	Very low	88 Å²	88	144.5 Å²	144.5	62%	0.615	79%	0.79	S	S	*	*			cis	-165.4	-171.3	2	78.8	0	0	0	0	110.7
821	D	27.6	Very low	28.5	Very low	119 Å²	119	141.2 Å²	141.2	64%	0.636	79%	0.788	S	S	*	*			cis	-147.7	-140.3	-3.3	-119.1	-45.1	0	0	0	110.9	K819	K819-D821 WeakPolarHBondContact CE-OD1 3.42Å; K819-D821 IonicContact NZ-OD1 3.77Å; K819-D821 PolarHBondContact NZ-OD1 3.43Å; K819-D821 IonicContact NZ-OD2 3.46Å; K819-D821 PolarHBondContact NZ-OD2 3.09Å
822	N	29.6	Very low	28.9	Very low	159 Å²	159	139.8 Å²	139.8	85%	0.85	78%	0.784	S	S	*	*			trans	-121.7	169.7	-168.8	-110.1	-2.4	0	0	0	116.5
823	P	60.3	Low	29.9	Very low	115 Å²	115	139.7 Å²	139.7	75%	0.747	79%	0.786	S	S	*	*			trans	-108.5	173.6	-152	41.9	-40	0	0	0	118.8
824	K	28.3	Very low	29.9	Very low	201 Å²	201	142.4 Å²	142.4	87%	0.874	79%	0.79	S	S	*	*			trans	-158.5	173.2	170.1	-86.9	-160.5	176.2	-172.3	0	111.8
825	S	27.2	Very low	31	Very low	83 Å²	83	141.2 Å²	141.2	58%	0.58	78%	0.783	S	S	*	*				178	123.4	-53.4	56.4	0	0	0	0	111.9
826	L	26.3	Very low	31.2	Very low	156 Å²	156	137.7 Å²	137.7	82%	0.817	77%	0.774	S	S	*	*			trans	62.4	167.5	167.4	-80.2	75.4	0	0	0	117.1
827	E	27.3	Very low	31.6	Very low	159 Å²	159	133.3 Å²	133.3	74%	0.743	76%	0.763	S	S	*	*			cis	-174.9	158.7	-33.2	-173.6	164.6	-115.8	0	0	110.2
828	S	27.6	Very low	32	Very low	125 Å²	125	134 Å²	134	87%	0.874	76%	0.757	S	S	*	*			trans	66.8	160.3	173.5	78.4	0	0	0	0	117.8
829	G	23.7	Very low	31.8	Very low	71 Å²	71	131.1 Å²	131.1	73%	0.732	75%	0.748	S	S	*	*			cis	-168.1	177	1.1	0	0	0	0	0	113.7
830	C	24.1	Very low	32	Very low	124 Å²	124	128.2 Å²	128.2	84%	0.838	75%	0.749	S	S	*	*			trans	-58	159.2	-170.9	-53.8	0	0	0	0	116
831	S	24.4	Very low	32.2	Very low	118 Å²	118	129.6 Å²	129.6	83%	0.825	76%	0.758	S	S	*	*				-173.4	161.1	69.1	-58.5	0	0	0	0	114.6
832	S	35	Very low	32.2	Very low	112 Å²	112	127 Å²	127	78%	0.783	76%	0.76	S	S	*	*			trans	-90	-179	173.1	-48.1	0	0	0	0	113
833	P	44.3	Very low	32.3	Very low	135 Å²	135	124.8 Å²	124.8	88%	0.877	76%	0.757	S	S	*	*				-142	177.9	91.5	39	-23.5	0	0	0	116.6
834	E	29.5	Very low	30.9	Very low	179 Å²	179	126.2 Å²	126.2	84%	0.836	75%	0.753	S	S	*	*			trans	-109.4	-165.3	-167.7	-119.3	176.5	176.1	0	0	111.5
835	P	52.2	Low	31	Very low	105 Å²	105	126 Å²	126	68%	0.682	75%	0.747	S	S	*	*			cis	-99.2	-161	7.9	42.7	-34.3	0	0	0	112.6
836	D	31.3	Very low	31.1	Very low	131 Å²	131	129.3 Å²	129.3	70%	0.701	75%	0.753	S	S	*	*			cis	-159.3	170.7	17.3	-136.1	-8.7	0	0	0	108.8
837	H	34.9	Very low	31.2	Very low	143 Å²	143	130 Å²	130	66%	0.662	75%	0.749	S	S	*	*			cis	-158	-175.6	13.7	-160.8	57	0	0	0	112
838	H	33.9	Very low	31.3	Very low	143 Å²	143	127.1 Å²	127.1	66%	0.662	75%	0.747	S	S	*	*			trans	-44.3	147.7	170.2	-75.5	-71.2	0	0	0	116.3
839	D	26	Very low	31.7	Very low	122 Å²	122	130.1 Å²	130.1	65%	0.652	74%	0.744	S	S	*	*			cis	-160.5	165	-9.7	-140.1	-37.3	0	0	0	113.9
840	S	32.7	Very low	32.4	Very low	105 Å²	105	134.5 Å²	134.5	73%	0.734	75%	0.745	S	S	*	*			trans	-0.2	150.6	153	-61.5	0	0	0	0	120.9
841	S	29.2	Very low	33	Very low	116 Å²	116	135.1 Å²	135.1	81%	0.811	74%	0.74	S	S	*	*			cis	-154	153.8	9.5	-162.8	0	0	0	0	107.5
842	G	28.7	Very low	33.3	Very low	65 Å²	65	136.1 Å²	136.1	67%	0.67	75%	0.745	S	S	*	*			cis	89.1	132	44.4	0	0	0	0	0	110.8
843	S	32	Very low	33.7	Very low	113 Å²	113	141.8 Å²	141.8	79%	0.79	75%	0.75	S	S	*	*			cis	-162.3	168.7	1.5	56.1	0	0	0	0	112.9
844	E	29.3	Very low	33.4	Very low	145 Å²	145	142.9 Å²	142.9	68%	0.678	75%	0.747	S	S	*	*			trans	28	122.9	153.2	-62	-124.9	114.8	0	0	121.5
845	R	31.1	Very low	34	Very low	197 Å²	197	145.4 Å²	145.4	74%	0.743	75%	0.749	S	S	*	*				91.2	93.2	52.6	-178.2	-164.8	-164.1	-172.6	7.4	114.6
846	H	29.1	Very low	33.4	Very low	151 Å²	151	150.4 Å²	150.4	70%	0.699	76%	0.76	S	S	*	*			trans	-170.7	136.8	141.5	-105.6	6.8	0	0	0	117.5
847	K	29.1	Very low	34.2	Very low	171 Å²	171	153 Å²	153	74%	0.743	77%	0.765	S	S	*	*			trans	42.3	126.1	140.2	-63.4	168.3	-180	157.7	0	122.7
848	S	29.3	Very low	34.7	Very low	98 Å²	98	149.5 Å²	149.5	69%	0.685	77%	0.768	S	S	*	*				89.3	116.5	128.2	-177.4	0	0	0	0	122.9
849	K	35.5	Very low	35.4	Very low	188 Å²	188	145.9 Å²	145.9	82%	0.817	76%	0.762	S	S	*	*			trans	67.5	120.7	143.3	-69.3	177.5	179.8	-178.6	0	122.3
850	H	37.8	Very low	36.9	Very low	163 Å²	163	144 Å²	144	76%	0.755	75%	0.753	S	S	*	*			trans	51	129.5	138.3	-80	-67.9	0	0	0	124.3
851	N	37	Very low	38.3	Very low	138 Å²	138	145.6 Å²	145.6	74%	0.738	75%	0.752	S	S	*	*			trans	55.1	114.4	138	-55.8	0.8	0	0	0	120.5
852	C	31.4	Very low	39.7	Very low	138 Å²	138	144.3 Å²	144.3	93%	0.932	74%	0.743	S	S	*	*				-175.2	179.1	102.1	-115.8	0	0	0	0	114.2
853	R	42.7	Very low	41.5	Very low	231 Å²	231	147.9 Å²	147.9	87%	0.872	74%	0.742	S	S	*	*			trans	-110.3	166.6	-178.3	-73.1	177.3	165.7	168.7	-5.3	113
854	L	37.8	Very low	43	Very low	158 Å²	158	147.7 Å²	147.7	83%	0.827	73%	0.732	S	S	*	*			trans	94.9	133.6	149.1	-77	148	0	0	0	121.8
855	R	42.4	Very low	44.8	Very low	232 Å²	232	145.5 Å²	145.5	88%	0.875	72%	0.721	S	S	*	*			trans	67.9	114.1	157.4	-73.1	-174	169.5	-161.2	-1.8	120.4
856	K	40.9	Very low	46.7	Very low	211 Å²	211	140 Å²	140	92%	0.917	71%	0.713	S	S	*	*				-153.5	138.9	95.3	-106.4	173.4	179.3	177.6	0	111
857	K	47.7	Very low	48.5	Very low	186 Å²	186	135 Å²	135	81%	0.809	70%	0.698	S	S	*	*			trans	-113.7	138.5	164.9	-82.2	-165.4	168.7	-161.4	0	107.4
858	G	44.7	Very low	50.9	Low	69 Å²	69	130.4 Å²	130.4	71%	0.711	68%	0.68	S	S	*	*			trans	174.1	-25	178.8	0	0	0	0	0	116.3
859	A	49.8	Very low	52.9	Low	66 Å²	66	130.1 Å²	130.1	55%	0.545	67%	0.672	S	S	.	*	S	Bend	trans	-80.5	-34.1	176.1	0	0	0	0	0	112.7	L861 S862	A859-L861 PolarHBondContact O-N 3.08Å; A859-S862 PolarHBondContact O-N 2.87Å; A859-S862 PolarHBondContact O-OG 3.43Å
860	D	56.5	Low	54.8	Low	84 Å²	84	124.5 Å²	124.5	45%	0.449	66%	0.656	S	S	.	*	H	α-helix	trans	-51.3	-27.7	-168.5	-38	-6	0	0	0	115.1	L864	D860-L864 WeakPolarHBondContact O-CB 3.4Å; D860-L864 PolarHBondContact O-N 2.65Å
861	L	61.5	Low	56.2	Low	137 Å²	137	121.9 Å²	121.9	72%	0.717	65%	0.646	S	S	*	*	H	α-helix	trans	-78	-31.8	-165.6	-124.2	164.4	0	0	0	113.7	A859 Q865	A859-L861 PolarHBondContact O-N 3.08Å; L861-Q865 PolarHBondContact O-N 2.82Å
862	S	60.2	Low	58	Low	89 Å²	89	122.1 Å²	122.1	62%	0.622	64%	0.641	S	S	*	*	H	α-helix	trans	-76.7	-38.4	174.3	49.1	0	0	0	0	111.9	A859 Q865 S866	A859-S862 PolarHBondContact O-N 2.87Å; A859-S862 PolarHBondContact O-OG 3.43Å; S862-Q865 PolarHBondContact O-N 2.82Å; S862-S866 PolarHBondContact O-N 2.95Å; S862-S866 VanDerWaalsContact O-N 3.11Å
863	E	65.3	Low	59.8	Low	141 Å²	141	121.9 Å²	121.9	66%	0.659	63%	0.626	S	S	*	*	H	α-helix	trans	-64.5	-43.8	176.4	-63.2	-172.4	152.8	0	0	111.4	Q865 S866 A867	E863-Q865 VanDerWaalsContact C-N 3.31Å; E863-Q865 PolarHBondContact O-N 2.87Å; E863-S866 WeakPolarHBondContact O-CB 3.49Å; E863-S866 PolarHBondContact O-N 2.88Å; E863-A867 PolarHBondContact O-N 3.06Å
864	L	64.3	Low	61	Low	108 Å²	108	114.5 Å²	114.5	57%	0.565	61%	0.607	S	S	*	*	H	α-helix	trans	-59.7	-41.1	176.3	-166.4	73.6	0	0	0	112	D860 A867 I868	D860-L864 WeakPolarHBondContact O-CB 3.4Å; D860-L864 PolarHBondContact O-N 2.65Å; L864-A867 PolarHBondContact O-N 2.99Å; L864-I868 HydrophobicContact CG-CD1 4.23Å; L864-I868 WeakPolarHBondContact O-CD1 3.44Å; L864-I868 VanDerWaalsContact O-CG1 3.29Å; L864-I868 WeakPolarHBondContact O-CG1 3.34Å; L864-I868 PolarHBondContact O-N 3.25Å
865	Q	67.8	Low	62.3	Low	100 Å²	100	112.2 Å²	112.2	47%	0.467	59%	0.592	S	S	.	*	H	α-helix	trans	-68.8	-33.7	179	-170	57.5	70.1	0	0	112.6	L861 S862 E863 N869	L861-Q865 PolarHBondContact O-N 2.82Å; S862-Q865 PolarHBondContact O-N 2.82Å; E863-Q865 VanDerWaalsContact C-N 3.31Å; E863-Q865 PolarHBondContact O-N 2.87Å; Q865-N869 PolarHBondContact O-N 3.26Å
866	S	69.5	Low	63.7	Low	80 Å²	80	106.6 Å²	106.6	56%	0.559	58%	0.575	S	S	*	*	H	α-helix	trans	-65.7	-47	172.1	-171.3	0	0	0	0	111.5	S862 E863 I868 N869 S870	S862-S866 PolarHBondContact O-N 2.95Å; S862-S866 VanDerWaalsContact O-N 3.11Å; E863-S866 WeakPolarHBondContact O-CB 3.49Å; E863-S866 PolarHBondContact O-N 2.88Å; S866-I868 PolarHBondContact O-N 2.92Å; S866-N869 PolarHBondContact O-N 2.97Å; S866-S870 PolarHBondContact O-N 3.36Å; S866-S870 VanDerWaalsContact O-N 3.12Å
867	A	68.4	Low	65	Low	46 Å²	46	100 Å²	100	38%	0.38	55%	0.55	S	S	.	.	H	α-helix	trans	-59.5	-42.6	178	0	0	0	0	0	112.6	E863 L864 N869 S870 I871	E863-A867 PolarHBondContact O-N 3.06Å; L864-A867 PolarHBondContact O-N 2.99Å; A867-N869 VanDerWaalsContact C-N 3.31Å; A867-N869 PolarHBondContact O-N 3.35Å; A867-S870 PolarHBondContact O-N 3.19Å; A867-I871 VanDerWaalsContact O-CG1 3.3Å; A867-I871 WeakPolarHBondContact O-CG1 3.46Å; A867-I871 PolarHBondContact O-N 2.82Å
868	I	77.8	Confident	65.9	Low	75 Å²	75	95.2 Å²	95.2	39%	0.385	53%	0.532	S	S	.	.	H	α-helix	trans	-60	-39.3	177.4	-71.6	164.1	0	0	0	111.9	L864 S866 K872	L864-I868 HydrophobicContact CG-CD1 4.23Å; L864-I868 WeakPolarHBondContact O-CD1 3.44Å; L864-I868 VanDerWaalsContact O-CG1 3.29Å; L864-I868 WeakPolarHBondContact O-CG1 3.34Å; L864-I868 PolarHBondContact O-N 3.25Å; S866-I868 PolarHBondContact O-N 2.92Å; I868-K872 PolarHBondContact O-N 2.93Å; I868-K872 VanDerWaalsContact O-N 3.17Å
869	N	71.5	Confident	67.1	Low	93 Å²	93	96.2 Å²	96.2	50%	0.497	52%	0.522	S	S	.	.	H	α-helix	trans	-69.6	-41.5	178.4	-70.1	-12.5	0	0	0	111.8	Q865 S866 A867 I871 K872 Q873	Q865-N869 PolarHBondContact O-N 3.26Å; S866-N869 PolarHBondContact O-N 2.97Å; A867-N869 VanDerWaalsContact C-N 3.31Å; A867-N869 PolarHBondContact O-N 3.35Å; N869-I871 PolarHBondContact O-N 3.42Å; N869-K872 PolarHBondContact O-N 3.08Å; N869-Q873 PolarHBondContact O-N 2.94Å; N869-Q873 VanDerWaalsContact O-N 3.17Å
870	S	75	Confident	68	Low	70 Å²	70	100.2 Å²	100.2	49%	0.49	52%	0.523	S	S	.	.	H	α-helix	trans	-60.9	-42.1	174.8	-177.5	0	0	0	0	112.7	S866 A867 K872 Q873 T874	S866-S870 PolarHBondContact O-N 3.36Å; S866-S870 VanDerWaalsContact O-N 3.12Å; A867-S870 PolarHBondContact O-N 3.19Å; S870-K872 PolarHBondContact O-N 2.89Å; S870-Q873 PolarHBondContact O-N 2.83Å; S870-T874 PolarHBondContact O-N 2.87Å; S870-T874 VanDerWaalsContact O-N 3.08Å; S870-T874 PolarHBondContact O-OG1 3.11Å
871	I	69.1	Low	68.6	Low	108 Å²	108	101.1 Å²	101.1	55%	0.554	53%	0.528	S	S	*	.	H	α-helix	trans	-63	-42.7	176.8	-68.9	164.5	0	0	0	111	A867 N869 Q873 T874 Q875	A867-I871 VanDerWaalsContact O-CG1 3.3Å; A867-I871 WeakPolarHBondContact O-CG1 3.46Å; A867-I871 PolarHBondContact O-N 2.82Å; N869-I871 PolarHBondContact O-N 3.42Å; I871-Q873 PolarHBondContact O-N 2.87Å; I871-T874 PolarHBondContact O-N 3.49Å; I871-Q875 PolarHBondContact O-N 3.09Å
872	K	73.8	Confident	68.9	Low	142 Å²	142	97.7 Å²	97.7	62%	0.617	51%	0.512	S	S	*	.	H	α-helix	trans	-58.5	-46.4	175.1	-84.5	-172.6	171.7	-175.3	0	112.5	I868 N869 S870 T874 Q875 E876	I868-K872 PolarHBondContact O-N 2.93Å; I868-K872 VanDerWaalsContact O-N 3.17Å; N869-K872 PolarHBondContact O-N 3.08Å; S870-K872 PolarHBondContact O-N 2.89Å; K872-T874 VanDerWaalsContact C-N 3.3Å; K872-T874 PolarHBondContact O-N 3.48Å; K872-Q875 WeakPolarHBondContact O-CB 3.36Å; K872-Q875 PolarHBondContact O-N 3.07Å; K872-E876 PolarHBondContact O-N 3.1Å
873	Q	69.9	Low	69.5	Low	134 Å²	134	98 Å²	98	63%	0.626	51%	0.51	S	S	*	.	H	α-helix	trans	-62.4	-40	-179.9	-168.5	170.5	2.1	0	0	111.5	N869 S870 I871 Q875 E876 D877	N869-Q873 PolarHBondContact O-N 2.94Å; N869-Q873 VanDerWaalsContact O-N 3.17Å; S870-Q873 PolarHBondContact O-N 2.83Å; I871-Q873 PolarHBondContact O-N 2.87Å; Q873-Q875 PolarHBondContact O-N 3.5Å; Q873-E876 PolarHBondContact O-N 2.95Å; Q873-D877 PolarHBondContact O-N 3.35Å
874	T	67.7	Low	69.4	Low	76 Å²	76	94 Å²	94	47%	0.466	50%	0.501	S	S	.	.	H	α-helix	trans	-65.8	-37	176.4	-51.5	0	0	0	0	111.9	S870 I871 K872 E876 D877 I878	S870-T874 PolarHBondContact O-N 2.87Å; S870-T874 VanDerWaalsContact O-N 3.08Å; S870-T874 PolarHBondContact O-OG1 3.11Å; I871-T874 PolarHBondContact O-N 3.49Å; K872-T874 VanDerWaalsContact C-N 3.3Å; K872-T874 PolarHBondContact O-N 3.48Å; T874-E876 VanDerWaalsContact C-N 3.32Å; T874-E876 PolarHBondContact O-N 3.5Å; T874-D877 PolarHBondContact O-N 3.14Å; T874-I878 HydrophobicContact CG2-CD1 4.08Å; T874-I878 WeakPolarHBondContact O-CG1 3.46Å; T874-I878 PolarHBondContact O-N 2.91Å
875	Q	65.6	Low	69.2	Low	110 Å²	110	94.2 Å²	94.2	51%	0.514	50%	0.502	S	S	.	.	H	α-helix	trans	-62	-37.3	176.3	-164.1	74.5	15.2	0	0	112.4	I871 K872 Q873 N879	I871-Q875 PolarHBondContact O-N 3.09Å; K872-Q875 WeakPolarHBondContact O-CB 3.36Å; K872-Q875 PolarHBondContact O-N 3.07Å; Q873-Q875 PolarHBondContact O-N 3.5Å; Q875-N879 PolarHBondContact O-N 3.34Å; Q875-N879 VanDerWaalsContact O-N 3.14Å; Q875-N879 PolarHBondContact O-ND2 3.15Å
876	E	70.7	Confident	68.9	Low	113 Å²	113	97.9 Å²	97.9	53%	0.528	51%	0.512	S	S	.	.	H	α-helix	trans	-68.9	-42.9	178.4	-70.2	-176.4	-169.1	0	0	112.4	K872 Q873 T874 N879 R880	K872-E876 PolarHBondContact O-N 3.1Å; Q873-E876 PolarHBondContact O-N 2.95Å; T874-E876 VanDerWaalsContact C-N 3.32Å; T874-E876 PolarHBondContact O-N 3.5Å; E876-N879 PolarHBondContact O-N 3.09Å; E876-R880 WeakPolarHBondContact O-CG 3.43Å; E876-R880 PolarHBondContact O-N 3.49Å
877	D	67.6	Low	68.2	Low	72 Å²	72	100.9 Å²	100.9	39%	0.385	52%	0.519	S	S	.	.	H	α-helix	trans	-69.9	-33.3	176.9	-81.5	-36.4	0	0	0	112.9	Q873 T874 N879 R880 N881	Q873-D877 PolarHBondContact O-N 3.35Å; T874-D877 PolarHBondContact O-N 3.14Å; D877-N879 VanDerWaalsContact C-N 3.34Å; D877-R880 PolarHBondContact O-N 3.01Å; D877-R880 WeakPolarHBondContact OD1-CD 3.22Å; D877-R880 IonicContact OD1-CZ 2.69Å; D877-R880 IonicContact OD1-NE 3.63Å; D877-R880 IonicContact OD1-NH1 2.71Å; D877-R880 PolarHBondContact OD1-NH1 2.92Å; D877-N881 PolarHBondContact O-N 3.24Å; D877-N881 VanDerWaalsContact O-N 3.11Å; D877-N881 PolarHBondContact O-ND2 3.41Å
878	I	67.7	Low	67.4	Low	86 Å²	86	108.2 Å²	108.2	44%	0.441	54%	0.536	S	S	.	.	H	α-helix	trans	-60.4	-45.4	169.8	-70.8	168.2	0	0	0	110.3	T874 R880 N881 V882	T874-I878 HydrophobicContact CG2-CD1 4.08Å; T874-I878 WeakPolarHBondContact O-CG1 3.46Å; T874-I878 PolarHBondContact O-N 2.91Å; I878-R880 PolarHBondContact O-N 3.45Å; I878-N881 PolarHBondContact O-N 2.97Å; I878-V882 HydrophobicContact CG2-CG2 4.4Å; I878-V882 WeakPolarHBondContact O-CG2 3.43Å; I878-V882 PolarHBondContact O-N 3.28Å
879	N	69.4	Low	65.8	Low	91 Å²	91	108.8 Å²	108.8	49%	0.487	55%	0.547	S	S	.	.	H	α-helix	trans	-62.2	-41.4	178.5	-77.9	-32.1	0	0	0	112.6	Q875 E876 D877 N881 V882 V883	Q875-N879 PolarHBondContact O-N 3.34Å; Q875-N879 VanDerWaalsContact O-N 3.14Å; Q875-N879 PolarHBondContact O-ND2 3.15Å; E876-N879 PolarHBondContact O-N 3.09Å; D877-N879 VanDerWaalsContact C-N 3.34Å; N879-N881 VanDerWaalsContact C-N 3.34Å; N879-N881 PolarHBondContact O-N 3Å; N879-V882 PolarHBondContact O-N 3.27Å; N879-V883 WeakPolarHBondContact O-CG2 3.44Å; N879-V883 PolarHBondContact O-N 3.04Å; N879-V883 VanDerWaalsContact O-N 3.15Å
880	R	69.6	Low	64.6	Low	150 Å²	150	111.8 Å²	111.8	57%	0.566	56%	0.558	S	S	*	*	H	α-helix	trans	-57.4	-46.1	173.5	-69.5	173.2	-174.3	148.5	4.1	111.7	E876 D877 I878 V883 A884	E876-R880 WeakPolarHBondContact O-CG 3.43Å; E876-R880 PolarHBondContact O-N 3.49Å; D877-R880 PolarHBondContact O-N 3.01Å; D877-R880 WeakPolarHBondContact OD1-CD 3.22Å; D877-R880 IonicContact OD1-CZ 2.69Å; D877-R880 IonicContact OD1-NE 3.63Å; D877-R880 IonicContact OD1-NH1 2.71Å; D877-R880 PolarHBondContact OD1-NH1 2.92Å; I878-R880 PolarHBondContact O-N 3.45Å; R880-V883 PolarHBondContact O-N 3.25Å; R880-A884 PolarHBondContact O-N 3.39Å
881	N	68.1	Low	63	Low	103 Å²	103	113.3 Å²	113.3	55%	0.551	57%	0.569	S	S	*	*	H	α-helix	trans	-66.4	-38.3	179.5	-78.9	-74.1	0	0	0	112.9	D877 I878 N879 V883 A884 L885	D877-N881 PolarHBondContact O-N 3.24Å; D877-N881 VanDerWaalsContact O-N 3.11Å; D877-N881 PolarHBondContact O-ND2 3.41Å; I878-N881 PolarHBondContact O-N 2.97Å; N879-N881 VanDerWaalsContact C-N 3.34Å; N879-N881 PolarHBondContact O-N 3Å; N881-V883 PolarHBondContact O-N 2.7Å; N881-A884 PolarHBondContact O-N 2.66Å; N881-L885 WeakPolarHBondContact O-CG 3.2Å; N881-L885 PolarHBondContact O-N 3.44Å
882	V	67.9	Low	61.9	Low	64 Å²	64	118.9 Å²	118.9	39%	0.388	58%	0.583	S	S	.	*	H	α-helix	trans	-64.1	-38.2	176.4	170.2	0	0	0	0	112	I878 N879 L885 R886	I878-V882 HydrophobicContact CG2-CG2 4.4Å; I878-V882 WeakPolarHBondContact O-CG2 3.43Å; I878-V882 PolarHBondContact O-N 3.28Å; N879-V882 PolarHBondContact O-N 3.27Å; V882-L885 PolarHBondContact O-N 3.25Å; V882-R886 PolarHBondContact O-N 2.7Å
883	V	73.6	Confident	60.2	Low	95 Å²	95	116.5 Å²	116.5	58%	0.576	59%	0.589	S	S	*	*	H	α-helix	trans	-64	-47.2	174.5	173.5	0	0	0	0	110.8	N879 R880 N881 L885 R886 M887	N879-V883 WeakPolarHBondContact O-CG2 3.44Å; N879-V883 PolarHBondContact O-N 3.04Å; N879-V883 VanDerWaalsContact O-N 3.15Å; R880-V883 PolarHBondContact O-N 3.25Å; N881-V883 PolarHBondContact O-N 2.7Å; V883-L885 VanDerWaalsContact C-N 3.25Å; V883-L885 PolarHBondContact O-N 3.5Å; V883-R886 PolarHBondContact O-N 3.32Å; V883-M887 PolarHBondContact O-N 2.7Å
884	A	63.6	Low	58.9	Low	57 Å²	57	118.3 Å²	118.3	47%	0.471	60%	0.598	S	S	.	*	H	α-helix	trans	-60.7	-32.5	177.6	0	0	0	0	0	113.3	R880 N881	R880-A884 PolarHBondContact O-N 3.39Å; N881-A884 PolarHBondContact O-N 2.66Å
885	L	58.8	Low	57.5	Low	113 Å²	113	122 Å²	122	59%	0.592	62%	0.615	S	S	*	*	H	α-helix	trans	-73.1	-34.2	176.6	-74.9	168.5	0	0	0	113.4	N881 V882 V883 R888 S889	N881-L885 WeakPolarHBondContact O-CG 3.2Å; N881-L885 PolarHBondContact O-N 3.44Å; V882-L885 PolarHBondContact O-N 3.25Å; V883-L885 VanDerWaalsContact C-N 3.25Å; V883-L885 PolarHBondContact O-N 3.5Å; L885-R888 PolarHBondContact O-N 3.25Å; L885-S889 PolarHBondContact O-N 3.31Å
886	R	61.2	Low	56.2	Low	178 Å²	178	123.9 Å²	123.9	67%	0.672	63%	0.634	S	S	*	*	H	α-helix	trans	-63.1	-45.7	175.5	-72.3	-172.8	-175.8	-145.8	2.8	111.9	V882 V883 R888 S889	V882-R886 PolarHBondContact O-N 2.7Å; V883-R886 PolarHBondContact O-N 3.32Å; R886-R888 PolarHBondContact O-N 3.46Å; R886-R888 VanDerWaalsContact O-N 3.08Å; R886-S889 WeakPolarHBondContact O-CB 3.34Å; R886-S889 PolarHBondContact O-N 3.07Å
887	M	54.7	Low	54.7	Low	143 Å²	143	124.6 Å²	124.6	70%	0.704	65%	0.652	S	S	*	*	H	α-helix	trans	-59.5	-22.5	177.7	-56.8	-61.4	-75.3	0	0	113.3	V883	V883-M887 PolarHBondContact O-N 2.7Å
888	R	51.6	Low	53.6	Low	199 Å²	199	130.2 Å²	130.2	75%	0.751	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-9.8	173.9	-83.5	-177.4	166.6	175.7	-2.3	114.7	L885 R886	L885-R888 PolarHBondContact O-N 3.25Å; R886-R888 PolarHBondContact O-N 3.46Å; R886-R888 VanDerWaalsContact O-N 3.08Å
889	S	45.6	Very low	52.9	Low	87 Å²	87	131.9 Å²	131.9	61%	0.608	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-28.3	-177.6	-167	0	0	0	0	113.1	L885 R886	L885-S889 PolarHBondContact O-N 3.31Å; R886-S889 WeakPolarHBondContact O-CB 3.34Å; R886-S889 PolarHBondContact O-N 3.07Å
890	E	45.1	Very low	52.5	Low	156 Å²	156	134.8 Å²	134.8	73%	0.729	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-78	-25.6	-174.5	-67	173.7	172.3	0	0	112.1	R892	E890-R892 PolarHBondContact O-N 3.13Å; E890-R892 VanDerWaalsContact O-N 3.12Å
891	S	42.8	Very low	51.4	Low	103 Å²	103	135.8 Å²	135.8	72%	0.72	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-81.8	22.3	-178.5	77.4	0	0	0	0	115
892	R	44.2	Very low	50.9	Low	225 Å²	225	140.6 Å²	140.6	85%	0.849	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-144	20.1	-166.3	-141.4	178	-169.7	-179.6	3.7	115.7	E890	E890-R892 PolarHBondContact O-N 3.13Å; E890-R892 VanDerWaalsContact O-N 3.12Å
893	A	38.7	Very low	51	Low	91 Å²	91	140.9 Å²	140.9	75%	0.752	71%	0.713	S	S	*	*			trans	-106.1	28.5	-167	0	0	0	0	0	115.5
894	E	42	Very low	50.8	Low	173 Å²	173	144.2 Å²	144.2	81%	0.808	72%	0.717	S	S	*	*			trans	-129.3	149.2	176.5	-65.3	-168.1	153.5	0	0	113
895	N	39.2	Very low	51.2	Low	154 Å²	154	145.8 Å²	145.8	82%	0.824	72%	0.72	S	S	*	*			trans	77.8	92.5	174.3	-55.2	-65.7	0	0	0	119.2
896	T	37.9	Very low	52	Low	148 Å²	148	145.3 Å²	145.3	91%	0.908	72%	0.718	S	S	*	*			trans	-147.5	131.7	145.3	53	0	0	0	0	111.4
897	S	38.6	Very low	52.8	Low	129 Å²	129	141.9 Å²	141.9	90%	0.902	71%	0.711	S	S	*	*			trans	-139.1	175	168.4	62.7	0	0	0	0	110.9
898	F	45.4	Very low	54	Low	189 Å²	189	137.7 Å²	137.7	83%	0.829	70%	0.699	S	S	*	*			trans	-105.3	146.8	-153.7	-133.3	-109.7	0	0	0	114.6
899	L	52.8	Low	55.3	Low	122 Å²	122	132 Å²	132	64%	0.639	69%	0.69	S	S	*	*			trans	28.9	139.3	164.5	-64.6	175.7	0	0	0	121
900	Q	61.4	Low	56.8	Low	152 Å²	152	133.2 Å²	133.2	71%	0.71	69%	0.689	S	S	*	*			trans	-113.4	158.5	-174.9	-78.1	-168.9	-14.5	0	0	114.9	R902 D903	Q900-R902 PolarHBondContact O-N 2.92Å; Q900-D903 PolarHBondContact O-N 3.07Å; Q900-D903 VanDerWaalsContact O-N 3.11Å
901	Q	45.7	Very low	58.6	Low	170 Å²	170	130 Å²	130	79%	0.794	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.5	-23	-174.4	-166.1	175.5	6.5	0	0	115.6	D903	Q901-D903 VanDerWaalsContact C-N 3.32Å; Q901-D903 PolarHBondContact O-N 3.09Å
902	R	58.6	Low	60.6	Low	205 Å²	205	129.5 Å²	129.5	77%	0.774	67%	0.672	S	S	*	*	H	α-helix	trans	-61.2	-36.2	176.4	-92.1	-178.6	157.5	174.5	-6.5	113.4	Q900 Y904 V905 I906	Q900-R902 PolarHBondContact O-N 2.92Å; R902-Y904 VanDerWaalsContact C-N 3.3Å; R902-Y904 PolarHBondContact O-N 2.8Å; R902-V905 PolarHBondContact O-N 2.88Å; R902-I906 PolarHBondContact O-N 2.76Å
903	D	70.3	Confident	62.2	Low	69 Å²	69	123.5 Å²	123.5	37%	0.369	66%	0.656	S	S	.	*	H	α-helix	trans	-66.6	-34.9	-171.3	-58.2	-37.3	0	0	0	111.5	Q900 Q901 I906 I907	Q900-D903 PolarHBondContact O-N 3.07Å; Q900-D903 VanDerWaalsContact O-N 3.11Å; Q901-D903 VanDerWaalsContact C-N 3.32Å; Q901-D903 PolarHBondContact O-N 3.09Å; D903-I906 PolarHBondContact O-N 3.03Å; D903-I907 WeakPolarHBondContact O-CG1 3.37Å; D903-I907 PolarHBondContact O-N 2.89Å
904	Y	68.3	Low	63.7	Low	165 Å²	165	124 Å²	124	65%	0.647	64%	0.643	S	S	*	*	H	α-helix	trans	-66.6	-34.4	175.9	-67.8	-83.2	0	0	0	113.4	R902 I907 A908	R902-Y904 VanDerWaalsContact C-N 3.3Å; R902-Y904 PolarHBondContact O-N 2.8Å; Y904-I907 PolarHBondContact O-N 2.92Å; Y904-A908 PolarHBondContact O-N 3.46Å; Y904-A908 VanDerWaalsContact O-N 3.09Å
905	V	72.5	Confident	65.5	Low	90 Å²	90	120.3 Å²	120.3	55%	0.545	63%	0.632	S	S	.	*	H	α-helix	trans	-67.5	-42	179.3	-178.1	0	0	0	0	110.6	R902 I907 A908 C909	R902-V905 PolarHBondContact O-N 2.88Å; V905-I907 VanDerWaalsContact C-N 3.34Å; V905-I907 PolarHBondContact O-N 3.14Å; V905-A908 PolarHBondContact O-N 2.92Å; V905-C909 PolarHBondContact O-N 3.03Å; V905-C909 VanDerWaalsContact O-N 3.08Å; V905-C909 PolarHBondContact O-SG 2.97Å; V905-C909 VanDerWaalsContact O-SG 3.41Å
906	I	75	Confident	67.1	Low	104 Å²	104	117.5 Å²	117.5	53%	0.533	62%	0.616	S	S	.	*	H	α-helix	trans	-62.3	-43.3	178.2	-62.2	170.8	0	0	0	110.5	R902 D903 A908 C909 L910	R902-I906 PolarHBondContact O-N 2.76Å; D903-I906 PolarHBondContact O-N 3.03Å; I906-A908 PolarHBondContact O-N 3.03Å; I906-C909 PolarHBondContact O-N 3.25Å; I906-L910 HydrophobicContact CG2-CD1 4.3Å; I906-L910 WeakPolarHBondContact O-CG 3.32Å; I906-L910 PolarHBondContact O-N 3.19Å
907	I	78.6	Confident	68.9	Low	105 Å²	105	113.7 Å²	113.7	54%	0.538	59%	0.59	S	S	.	*	H	α-helix	trans	-61.9	-43.1	177.1	-66.3	166.1	0	0	0	111	D903 Y904 V905 L910 V911	D903-I907 WeakPolarHBondContact O-CG1 3.37Å; D903-I907 PolarHBondContact O-N 2.89Å; Y904-I907 PolarHBondContact O-N 2.92Å; V905-I907 VanDerWaalsContact C-N 3.34Å; V905-I907 PolarHBondContact O-N 3.14Å; I907-L910 PolarHBondContact O-N 3.08Å; I907-V911 PolarHBondContact O-N 2.9Å
908	A	79	Confident	70.2	Confident	55 Å²	55	112.3 Å²	112.3	46%	0.455	57%	0.572	S	S	.	*	H	α-helix	trans	-61.8	-44.6	177.7	0	0	0	0	0	112.5	Y904 V905 I906 L910 V911 V912	Y904-A908 PolarHBondContact O-N 3.46Å; Y904-A908 VanDerWaalsContact O-N 3.09Å; V905-A908 PolarHBondContact O-N 2.92Å; I906-A908 PolarHBondContact O-N 3.03Å; A908-L910 VanDerWaalsContact C-N 3.32Å; A908-L910 PolarHBondContact O-N 2.96Å; A908-V911 PolarHBondContact O-N 2.94Å; A908-V912 WeakPolarHBondContact O-CG2 3.39Å; A908-V912 PolarHBondContact O-N 3.33Å; A908-V912 VanDerWaalsContact O-N 3.13Å
909	C	80.3	Confident	71.4	Confident	81 Å²	81	112.3 Å²	112.3	55%	0.547	57%	0.568	S	S	.	*	H	α-helix	trans	-60.6	-39	177.7	-68.4	0	0	0	0	112.9	V905 I906 V912 L913	V905-C909 PolarHBondContact O-N 3.03Å; V905-C909 VanDerWaalsContact O-N 3.08Å; V905-C909 PolarHBondContact O-SG 2.97Å; V905-C909 VanDerWaalsContact O-SG 3.41Å; I906-C909 PolarHBondContact O-N 3.25Å; C909-V912 PolarHBondContact O-N 3.46Å; C909-L913 PolarHBondContact O-N 3.48Å
910	L	75.8	Confident	72.2	Confident	112 Å²	112	112 Å²	112	59%	0.586	57%	0.566	S	S	*	*	H	α-helix	trans	-66.2	-38	178.2	-69.9	169.1	0	0	0	112.4	I906 I907 A908 Q914	I906-L910 HydrophobicContact CG2-CD1 4.3Å; I906-L910 WeakPolarHBondContact O-CG 3.32Å; I906-L910 PolarHBondContact O-N 3.19Å; I907-L910 PolarHBondContact O-N 3.08Å; A908-L910 VanDerWaalsContact C-N 3.32Å; A908-L910 PolarHBondContact O-N 2.96Å; L910-Q914 PolarHBondContact O-N 3.4Å; L910-Q914 VanDerWaalsContact O-N 3.14Å
911	V	84.6	Confident	72.1	Confident	89 Å²	89	112.9 Å²	112.9	54%	0.539	57%	0.567	S	S	.	*	H	α-helix	trans	-66.3	-43.8	175.8	174.8	0	0	0	0	111.2	I907 A908 L913 Q914 V915	I907-V911 PolarHBondContact O-N 2.9Å; A908-V911 PolarHBondContact O-N 2.94Å; V911-L913 PolarHBondContact O-N 2.9Å; V911-Q914 PolarHBondContact O-N 3.32Å; V911-V915 WeakPolarHBondContact O-CG2 3.41Å; V911-V915 PolarHBondContact O-N 3.01Å; V911-V915 VanDerWaalsContact O-N 3.15Å
912	V	82.8	Confident	72	Confident	92 Å²	92	116.4 Å²	116.4	56%	0.558	58%	0.58	S	S	*	*	H	α-helix	trans	-61.4	-44.1	177.1	173.9	0	0	0	0	111.2	A908 C909 Q914 V915 L916	A908-V912 WeakPolarHBondContact O-CG2 3.39Å; A908-V912 PolarHBondContact O-N 3.33Å; A908-V912 VanDerWaalsContact O-N 3.13Å; C909-V912 PolarHBondContact O-N 3.46Å; V912-Q914 VanDerWaalsContact C-N 3.33Å; V912-Q914 PolarHBondContact O-N 3.43Å; V912-V915 PolarHBondContact O-N 2.76Å; V912-L916 PolarHBondContact O-N 3.34Å
913	L	79.8	Confident	72.7	Confident	98 Å²	98	112 Å²	112	51%	0.513	57%	0.57	S	S	.	*	H	α-helix	trans	-59.9	-41.7	177.5	-176	63.8	0	0	0	112.1	C909 V911 V915 L916 I917	C909-L913 PolarHBondContact O-N 3.48Å; V911-L913 PolarHBondContact O-N 2.9Å; L913-V915 PolarHBondContact O-N 3.11Å; L913-L916 PolarHBondContact O-N 2.96Å; L913-I917 HydrophobicContact CD1-CD1 4.45Å; L913-I917 HydrophobicContact CG-CD1 4.1Å; L913-I917 WeakPolarHBondContact O-CG1 3.33Å; L913-I917 PolarHBondContact O-N 2.9Å
914	Q	68.3	Low	72.8	Confident	103 Å²	103	114.3 Å²	114.3	48%	0.481	58%	0.581	S	S	.	*	H	α-helix	trans	-64.6	-38	178	-172.8	63	66.2	0	0	112.7	L910 V911 V912 N918	L910-Q914 PolarHBondContact O-N 3.4Å; L910-Q914 VanDerWaalsContact O-N 3.14Å; V911-Q914 PolarHBondContact O-N 3.32Å; V912-Q914 VanDerWaalsContact C-N 3.33Å; V912-Q914 PolarHBondContact O-N 3.43Å; Q914-N918 PolarHBondContact NE2-OD1 3.48Å; Q914-N918 WeakPolarHBondContact O-CB 3.33Å; Q914-N918 PolarHBondContact O-N 2.9Å; Q914-N918 VanDerWaalsContact O-N 3.08Å; Q914-N918 PolarHBondContact O-OD1 2.94Å
915	V	80.9	Confident	73.1	Confident	95 Å²	95	111.4 Å²	111.4	58%	0.576	58%	0.577	S	S	*	*	H	α-helix	trans	-66.7	-40.3	174.9	173.9	0	0	0	0	111	V911 V912 L913 N918 Y919	V911-V915 WeakPolarHBondContact O-CG2 3.41Å; V911-V915 PolarHBondContact O-N 3.01Å; V911-V915 VanDerWaalsContact O-N 3.15Å; V912-V915 PolarHBondContact O-N 2.76Å; L913-V915 PolarHBondContact O-N 3.11Å; V915-N918 CarbonylContact O-C 3.53Å; V915-N918 PolarHBondContact O-N 2.87Å; V915-Y919 PolarHBondContact O-N 3.12Å
916	L	71.8	Confident	73.1	Confident	95 Å²	95	112.7 Å²	112.7	50%	0.497	58%	0.579	S	S	.	*	H	α-helix	trans	-67.2	-40.7	-179.4	-137.2	161.1	0	0	0	111.7	V912 L913 Y919 I920	V912-L916 PolarHBondContact O-N 3.34Å; L913-L916 PolarHBondContact O-N 2.96Å; L916-Y919 PolarHBondContact O-N 3.27Å; L916-I920 HydrophobicContact CD2-CD1 3.62Å; L916-I920 HydrophobicContact CD2-CG1 4.29Å; L916-I920 WeakPolarHBondContact O-CG1 3.47Å; L916-I920 PolarHBondContact O-N 3.02Å; L916-I920 VanDerWaalsContact O-N 3.14Å
917	I	76.9	Confident	73	Confident	68 Å²	68	113.3 Å²	113.3	35%	0.349	58%	0.582	S	S	.	*	H	α-helix	trans	-59.4	-49.3	170.2	-69.4	166.6	0	0	0	110.4	L913 Y919 I920 F921	L913-I917 HydrophobicContact CD1-CD1 4.45Å; L913-I917 HydrophobicContact CG-CD1 4.1Å; L913-I917 WeakPolarHBondContact O-CG1 3.33Å; L913-I917 PolarHBondContact O-N 2.9Å; I917-Y919 PolarHBondContact O-N 2.89Å; I917-Y919 VanDerWaalsContact O-N 3.13Å; I917-I920 PolarHBondContact O-N 3.3Å; I917-I920 VanDerWaalsContact O-N 3.16Å; I917-F921 HydrophobicContact CG2-CD2 3.9Å; I917-F921 HydrophobicContact CG2-CE2 4.21Å; I917-F921 WeakPolarHBondContact O-CD2 3.25Å; I917-F921 PolarHBondContact O-N 2.64Å; I917-F921 VanDerWaalsContact O-N 3.15Å
918	N	64.7	Low	72.6	Confident	99 Å²	99	113.8 Å²	113.8	53%	0.529	59%	0.585	S	S	.	*	H	α-helix	trans	-66.6	-11.7	179.6	-70.2	5	0	0	0	114.3	Q914 V915	Q914-N918 PolarHBondContact NE2-OD1 3.48Å; Q914-N918 WeakPolarHBondContact O-CB 3.33Å; Q914-N918 PolarHBondContact O-N 2.9Å; Q914-N918 VanDerWaalsContact O-N 3.08Å; Q914-N918 PolarHBondContact O-OD1 2.94Å; V915-N918 CarbonylContact O-C 3.53Å; V915-N918 PolarHBondContact O-N 2.87Å
919	Y	72.3	Confident	72.2	Confident	190 Å²	190	118 Å²	118	75%	0.745	59%	0.594	S	S	*	*	H	α-helix	trans	-92.7	-32.1	173.4	-176.1	-95	0	0	0	112.6	V915 L916 I917	V915-Y919 PolarHBondContact O-N 3.12Å; L916-Y919 PolarHBondContact O-N 3.27Å; I917-Y919 PolarHBondContact O-N 2.89Å; I917-Y919 VanDerWaalsContact O-N 3.13Å
920	I	67.9	Low	71.6	Confident	115 Å²	115	120.8 Å²	120.8	59%	0.59	60%	0.598	S	S	*	*	H	α-helix	trans	-77.4	-30.7	178.8	-70.5	169.7	0	0	0	112.1	L916 I917	L916-I920 HydrophobicContact CD2-CD1 3.62Å; L916-I920 HydrophobicContact CD2-CG1 4.29Å; L916-I920 WeakPolarHBondContact O-CG1 3.47Å; L916-I920 PolarHBondContact O-N 3.02Å; L916-I920 VanDerWaalsContact O-N 3.14Å; I917-I920 PolarHBondContact O-N 3.3Å; I917-I920 VanDerWaalsContact O-N 3.16Å
921	F	59.3	Low	71.2	Confident	170 Å²	170	121.6 Å²	121.6	75%	0.746	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.8	48.9	-179.6	-67.4	-76.8	0	0	0	112.7	I917	I917-F921 HydrophobicContact CG2-CD2 3.9Å; I917-F921 HydrophobicContact CG2-CE2 4.21Å; I917-F921 WeakPolarHBondContact O-CD2 3.25Å; I917-F921 PolarHBondContact O-N 2.64Å; I917-F921 VanDerWaalsContact O-N 3.15Å
922	K	45.4	Very low	70	Confident	245 Å²	245	124.5 Å²	124.5	100%	1.065	60%	0.604	S	S	*	*			trans	-141.1	0	-177.4	-162	-174.2	179.9	-167.9	0	113.2

Retrieved 922 of 922 residues in 580 ms (Link to these results)

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