A0A087YEV2_POEFO Loading...

RAS protein activator like 3

AlphaFold DB , UniProt , Accession A0A087YEV2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,173 aa.

						>A0A087YEV2_POEFO|A0A087YEV2
MGTEEKDSELAAQPLSKEQGSPEKEKDSPVEHPQPSETTDPLNTYKWHTGSKGTLNEQREEADGAAAASTSTIDKIHKASSNKWSKMQNWRKALSEDPGDKNSTGGKSGEATKAEKGAGVTRKNPFRRALSEPPGSLFAALTPSSSSASSAQPASSSSSSSAAPEAAGASSNDPSSKGSGGTLFKKYLWNVTQKLKRPRLQSRNSEHALLPDLKEVEPAHAAAGEFTRQNWVPPQEVPLWDITNCILGDGQILITQEDEPTTWIRNRVSSCLSNLSVQNLTDNDAECSPDPVGVPGGSRPKNQDGGVRGLIKRRLDKAKRNSATQLNPGLNKLSRQYGSRESVSVPVGSLDLSADTSTVIRPVHSSILGEKYCFEVINSENTHCFGCSSAAERDRWIEDLRRAAQPNKDNIERTENSLSLWVNEAKDLPPKRRYYCEVHLDGTLFARTSSRAVGKPTNRSSMAGDGASGSSGGLGGGGGAAGGCQLFWGEFFELDNLPSISQISLHLFREEDSKKKRHSRDECSLHPLGSVNIPLADIRGRTYQEKWYPITPFKASATAGNKEVLSSQASLRIKARFQNLKVLPMEKYKEFAEYVTVRYVEMCGNLEPLLNVKEKEELAGALVHVLQSIGKAKEFLIDLGDAEVNRLGEKEALIFRENTLATKAIDEYMKLVGQKYLIDTLGDFINRLYASVENCEVDPLKCPAAELSSNQQHLRETCEDVVQKIIEIHGSFPEELNKIFSNWMELCEDKGKAEIGQRLISASLFLRFLCPAILSPSLFGLTQAYPEPNTLRTLTLTAKVIQNLANSTLFGEKEEYMLFMNEFLEQHWDGMRCFLQTVSNQDTEIPMTSFDGYVDLPLRLAVLHGLLVDIIYKKDQDTIDKLHPLPSILNQISDSLGPEAPRIIVNSHTKPSKPVYVPPRELRKYSPLQSSLQRLPVDSKGLQDSESRPRKNMRERKPVARTQSAPHRRPGHGKQALKRQISSEALPTSDHEEQEAEVNEPVITRPDTIESNRRPPAPVPWIVNSNRESSEMKAEDEQFSLLDRHAQELSELRLGIEQVTERELDMAKRLEDFIIQSQDQNAMLQNEVYELKNLLAVRDEQLASATFRLGVIEEEREEDERRLDVALAAAERMNVLEEQFAGLMKNLQQLNEAYSSSQNKTQHPEKPHINSST
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.3	Very low	32.2	Very low	252 Å²	252	148.2 Å²	148.2	100%	1.241	81%	0.811	S	S	*	*				0	120.1	0	-62.7	-178.3	-72.6	0	0	106.6
2	G	32	Very low	31.9	Very low	65 Å²	65	144.1 Å²	144.1	67%	0.67	81%	0.811	S	S	*	*			cis	-176.7	172.2	-5.7	0	0	0	0	0	111.5
3	T	33.3	Very low	31.8	Very low	125 Å²	125	147.7 Å²	147.7	77%	0.767	82%	0.817	S	S	*	*			trans	53.2	109.5	156	53	0	0	0	0	118.3
4	E	37.6	Very low	32.8	Very low	183 Å²	183	144.8 Å²	144.8	86%	0.855	81%	0.809	S	S	*	*				78.6	120.6	67.2	-76.8	-173.7	134.7	0	0	114.5
5	E	36.5	Very low	32.4	Very low	191 Å²	191	145.7 Å²	145.7	89%	0.893	81%	0.81	S	S	*	*			trans	172.7	162.1	140.5	-96.6	-175.6	174	0	0	108.9
6	K	36.3	Very low	32	Very low	173 Å²	173	142.4 Å²	142.4	75%	0.752	80%	0.8	S	S	*	*				-161.6	173.6	-58.7	-136.7	-176.1	170.6	-172.6	0	110.4
7	D	30.5	Very low	31.7	Very low	130 Å²	130	145 Å²	145	70%	0.695	80%	0.801	S	S	*	*			trans	64.9	155.3	158.4	-61.1	-1.4	0	0	0	118.3
8	S	29.7	Very low	31.5	Very low	98 Å²	98	145.1 Å²	145.1	69%	0.685	79%	0.794	S	S	*	*			cis	-161.2	126.4	-23.6	-97.2	0	0	0	0	113.2
9	E	30.3	Very low	31.2	Very low	169 Å²	169	146.9 Å²	146.9	79%	0.79	80%	0.797	S	S	*	*			trans	58.9	150.1	130.2	-116.4	-168.1	163.8	0	0	126.6
10	L	30	Very low	30.8	Very low	148 Å²	148	143.5 Å²	143.5	78%	0.775	80%	0.797	S	S	*	*			trans	69.7	113.9	155.7	-61	170.3	0	0	0	121.7
11	A	28.2	Very low	30.6	Very low	96 Å²	96	142.3 Å²	142.3	79%	0.793	80%	0.799	S	S	*	*				172	157.1	92.6	0	0	0	0	0	116
12	A	28.2	Very low	31.4	Very low	99 Å²	99	135.8 Å²	135.8	82%	0.818	78%	0.775	S	S	*	*			trans	67	99.8	153	0	0	0	0	0	122.8
13	Q	30.4	Very low	31.3	Very low	191 Å²	191	139.7 Å²	139.7	89%	0.893	78%	0.776	S	S	*	*			trans	-98.9	-178.4	135.7	-78.5	-167.6	7.8	0	0	108.4
14	P	46.1	Very low	31.2	Very low	107 Å²	107	140.6 Å²	140.6	70%	0.695	77%	0.769	S	S	*	*			cis	-141.6	-177.1	9.8	44.7	-27.2	0	0	0	116.8
15	L	26.4	Very low	30.9	Very low	158 Å²	158	139 Å²	139	83%	0.827	76%	0.762	S	S	*	*			trans	-172.2	141.1	132	-104.5	157.4	0	0	0	113.9
16	S	26.1	Very low	30.6	Very low	93 Å²	93	137 Å²	137	65%	0.65	75%	0.75	S	S	*	*			trans	19.8	129.5	156.4	56.9	0	0	0	0	121
17	K	27.2	Very low	30.2	Very low	187 Å²	187	135 Å²	135	81%	0.813	75%	0.748	S	S	*	*				55.4	145.5	57.4	-65.5	-170.4	171.1	-170.6	0	113.5
18	E	27.3	Very low	30.1	Very low	147 Å²	147	134.1 Å²	134.1	69%	0.687	75%	0.752	S	S	*	*			cis	-153.5	-175.2	27.8	-152.7	145.5	-124.1	0	0	114.9
19	Q	25.7	Very low	31.3	Very low	179 Å²	179	134.4 Å²	134.4	84%	0.836	75%	0.751	S	S	*	*			trans	-58.2	171.5	-170.2	-57.6	152	-18.1	0	0	118.6
20	G	25	Very low	31.6	Very low	78 Å²	78	132.5 Å²	132.5	80%	0.804	75%	0.751	S	S	*	*			trans	163.9	87.5	153.2	0	0	0	0	0	119.8
21	S	25.8	Very low	31.4	Very low	120 Å²	120	134 Å²	134	84%	0.839	75%	0.754	S	S	*	*			trans	-92.9	172.7	150.3	-52	0	0	0	0	108.4
22	P	46.4	Very low	31.3	Very low	114 Å²	114	137.5 Å²	137.5	74%	0.74	75%	0.754	S	S	*	*			cis	-154.8	-174.1	26.9	45.1	-22.3	0	0	0	119.4
23	E	29.6	Very low	31.9	Very low	147 Å²	147	138.8 Å²	138.8	69%	0.687	75%	0.753	S	S	*	*			trans	58.8	136	141.8	-82.7	-159	158.1	0	0	126.6
24	K	31	Very low	31.6	Very low	145 Å²	145	137 Å²	137	63%	0.63	75%	0.745	S	S	*	*			trans	70.2	153.8	138.8	-74.4	-167.6	177.8	90	0	120.9
25	E	31.9	Very low	31.3	Very low	148 Å²	148	136.7 Å²	136.7	69%	0.692	74%	0.743	S	S	*	*			cis	-172.1	171.6	-21.6	-164.8	174.6	-101.8	0	0	110
26	K	30.3	Very low	31.3	Very low	149 Å²	149	133.3 Å²	133.3	65%	0.648	73%	0.733	S	S	*	*			trans	105.4	125.7	148.2	-74	-170.9	140.5	-72.6	0	124.8
27	D	27.5	Very low	31.2	Very low	132 Å²	132	136.6 Å²	136.6	71%	0.706	74%	0.738	S	S	*	*			trans	82.4	162.2	135.5	-58	-9.4	0	0	0	122.8
28	S	28.1	Very low	31.3	Very low	111 Å²	111	133 Å²	133	78%	0.776	73%	0.731	S	S	*	*			trans	-130.3	-151.8	-146.7	59	0	0	0	0	111.8
29	P	55.9	Low	31.3	Very low	104 Å²	104	131.4 Å²	131.4	68%	0.675	73%	0.732	S	S	*	*			cis	-147.3	176.4	5.6	44.7	-24.2	0	0	0	120.2
30	V	35.8	Very low	31.3	Very low	129 Å²	129	130 Å²	130	78%	0.782	73%	0.73	S	S	*	*			trans	69.2	145.5	141	156.2	0	0	0	0	119.8
31	E	27	Very low	31.9	Very low	180 Å²	180	131.1 Å²	131.1	84%	0.841	72%	0.724	S	S	*	*			cis	-141.7	-160.1	11.6	-145.6	160.3	-161.5	0	0	115.3
32	H	25.8	Very low	31.8	Very low	170 Å²	170	132.3 Å²	132.3	79%	0.787	72%	0.72	S	S	*	*			trans	-108.1	179	-159.9	-101.2	-50.3	0	0	0	114.4
33	P	40.5	Very low	30.6	Very low	125 Å²	125	133.4 Å²	133.4	81%	0.812	72%	0.719	S	S	*	*			cis	-139.8	-174.6	31.6	42.8	-21.8	0	0	0	118.8
34	Q	23.7	Very low	30.3	Very low	153 Å²	153	132.6 Å²	132.6	72%	0.715	73%	0.725	S	S	*	*			trans	-120.1	-155.8	-174.6	-137.8	-152.4	7	0	0	109.8
35	P	40.1	Very low	30	Very low	101 Å²	101	136 Å²	136	66%	0.656	74%	0.735	S	S	*	*			cis	-91.4	-161.7	3.7	45.3	-40.6	0	0	0	111.1
36	S	25.7	Very low	29.4	Very low	87 Å²	87	138.8 Å²	138.8	61%	0.608	75%	0.745	S	S	*	*			cis	-159.9	178.6	6.3	34.8	0	0	0	0	108.7
37	E	25.6	Very low	29.1	Very low	162 Å²	162	142.6 Å²	142.6	76%	0.757	76%	0.755	S	S	*	*			cis	-175.8	152.7	-34.6	-90	165.7	98.9	0	0	105.1
38	T	27.5	Very low	28.8	Very low	111 Å²	111	145.1 Å²	145.1	68%	0.681	76%	0.762	S	S	*	*			cis	-157	130.3	-32.9	28.4	0	0	0	0	104.4
39	T	27.3	Very low	28.6	Very low	115 Å²	115	146.1 Å²	146.1	71%	0.706	76%	0.764	S	S	*	*				65.9	141	63	69.6	0	0	0	0	113.8
40	D	26.1	Very low	27	Very low	148 Å²	148	144.8 Å²	144.8	79%	0.791	77%	0.77	S	S	*	*			cis	-160.8	178.6	2.6	-123.1	18.8	0	0	0	113.6
41	P	39	Very low	26.9	Very low	103 Å²	103	144.6 Å²	144.6	67%	0.669	77%	0.774	S	S	*	*			trans	-112.2	-152.6	-175	43.3	-34.3	0	0	0	114.7
42	L	22.2	Very low	26.8	Very low	145 Å²	145	146 Å²	146	76%	0.759	78%	0.777	S	S	*	*			trans	88.6	141	164.3	-76.5	165.8	0	0	0	121.2
43	N	22.4	Very low	26.7	Very low	136 Å²	136	141.3 Å²	141.3	73%	0.727	78%	0.775	S	S	*	*			trans	68.4	140.5	157.2	-69.4	-20.1	0	0	0	119.2
44	T	23.5	Very low	25.8	Very low	130 Å²	130	141.7 Å²	141.7	80%	0.798	78%	0.775	S	S	*	*			cis	-149.5	165.8	1.6	-14.5	0	0	0	0	112.7
45	Y	23.1	Very low	25.8	Very low	216 Å²	216	141.2 Å²	141.2	85%	0.847	78%	0.777	S	S	*	*			trans	-66	142.4	175.1	-88	-113.2	0	0	0	115
46	K	21.1	Very low	25	Very low	207 Å²	207	141.6 Å²	141.6	90%	0.9	77%	0.773	S	S	*	*				-168.5	153.1	125.6	-111.2	174.8	-178.9	179.7	0	112.5
47	W	22.6	Very low	25	Very low	229 Å²	229	143.9 Å²	143.9	87%	0.867	77%	0.774	S	S	*	*			trans	-85.5	142.6	168.8	-81.9	73.3	0	0	0	110.8
48	H	21.1	Very low	25	Very low	185 Å²	185	142.8 Å²	142.8	86%	0.856	77%	0.769	S	S	*	*				-172.2	153.8	128.5	-99.9	-59.1	0	0	0	112.3
49	T	25.1	Very low	25	Very low	132 Å²	132	146.6 Å²	146.6	81%	0.81	77%	0.771	S	S	*	*			trans	-80.4	142.2	169.5	47.4	0	0	0	0	111.4
50	G	20.9	Very low	25	Very low	77 Å²	77	147.2 Å²	147.2	79%	0.794	77%	0.766	S	S	*	*			trans	-178.8	102.2	170.6	0	0	0	0	0	114.8
51	S	35.1	Very low	25	Very low	124 Å²	124	148.6 Å²	148.6	87%	0.867	77%	0.768	S	S	*	*			trans	-79.7	142.4	167.3	-175.8	0	0	0	0	110.7
52	K	25.3	Very low	24.4	Very low	210 Å²	210	148.3 Å²	148.3	91%	0.913	77%	0.774	S	S	*	*			trans	-147.3	145.7	166.2	-71.2	-166	176.7	-176.2	0	109.8
53	G	23.3	Very low	24.6	Very low	71 Å²	71	149.9 Å²	149.9	73%	0.732	78%	0.783	S	S	*	*			cis	-155.7	-179	-4.3	0	0	0	0	0	110.3
54	T	22.1	Very low	24.7	Very low	134 Å²	134	146.7 Å²	146.7	82%	0.822	78%	0.782	S	S	*	*			cis	-129.1	-174	9.2	57	0	0	0	0	110.3
55	L	22.1	Very low	24.7	Very low	143 Å²	143	145.8 Å²	145.8	75%	0.749	79%	0.788	S	S	*	*			cis	-147.7	-173.4	4.7	-150.2	66.4	0	0	0	105.1
56	N	23.9	Very low	24.9	Very low	108 Å²	108	140.5 Å²	140.5	58%	0.578	79%	0.789	S	S	*	*			cis	-155.3	-170.1	4	-160.7	18.8	0	0	0	111.6
57	E	25.4	Very low	25.1	Very low	135 Å²	135	135.7 Å²	135.7	63%	0.631	79%	0.788	S	S	*	*			trans	-20.4	155.5	149.3	-70	175.4	109.2	0	0	118.2
58	Q	26	Very low	25.3	Very low	140 Å²	140	129.7 Å²	129.7	65%	0.654	79%	0.787	S	S	*	*			cis	-163.5	149.5	12.7	-125	170.5	49.2	0	0	111.1
59	R	26.6	Very low	25.7	Very low	190 Å²	190	126.2 Å²	126.2	72%	0.717	78%	0.784	S	S	*	*			trans	59	158.5	150.3	-69.1	179.7	130.2	-170.2	-26.4	119.7
60	E	28.3	Very low	25.7	Very low	128 Å²	128	126.7 Å²	126.7	60%	0.598	79%	0.787	S	S	*	*			cis	-155.1	175.5	-18.9	-118	157.2	-175.5	0	0	109.4
61	E	26.5	Very low	25.9	Very low	178 Å²	178	127 Å²	127	83%	0.832	78%	0.776	S	S	*	*			trans	11.5	129.2	165.9	-60.2	174.4	149.7	0	0	120.7
62	A	26.3	Very low	25.8	Very low	96 Å²	96	126.8 Å²	126.8	79%	0.793	77%	0.77	S	S	*	*			cis	88.9	96.6	36.9	0	0	0	0	0	116.1
63	D	25.3	Very low	26	Very low	178 Å²	178	121.5 Å²	121.5	95%	0.952	75%	0.751	S	S	*	*			trans	-160.6	169.1	132.3	-135.7	-26.2	0	0	0	111.4
64	G	24.2	Very low	26.2	Very low	70 Å²	70	124.4 Å²	124.4	72%	0.722	75%	0.749	S	S	*	*			trans	-123.8	157.3	-165.2	0	0	0	0	0	118.2
65	A	23.8	Very low	26.5	Very low	110 Å²	110	126.4 Å²	126.4	91%	0.909	75%	0.747	S	S	*	*			trans	-150.7	152.7	166.6	0	0	0	0	0	111
66	A	27.6	Very low	27.2	Very low	106 Å²	106	124.7 Å²	124.7	88%	0.876	74%	0.737	S	S	*	*			trans	-107	146	-179.1	0	0	0	0	0	112.3
67	A	25.1	Very low	27.5	Very low	105 Å²	105	124.1 Å²	124.1	87%	0.868	73%	0.731	S	S	*	*			trans	-146.2	160	175.7	0	0	0	0	0	112.2
68	A	26.8	Very low	27.7	Very low	103 Å²	103	125.4 Å²	125.4	85%	0.851	73%	0.734	S	S	*	*			trans	-80.2	175.4	-161.8	0	0	0	0	0	116.4
69	S	30.8	Very low	27.9	Very low	113 Å²	113	121.6 Å²	121.6	79%	0.79	73%	0.727	S	S	*	*			trans	-102.2	128.4	-173.1	56	0	0	0	0	115
70	T	24.9	Very low	28.1	Very low	142 Å²	142	116.5 Å²	116.5	87%	0.871	72%	0.72	S	S	*	*			trans	-153.9	160.3	166	43.4	0	0	0	0	108.4
71	S	25.6	Very low	28.1	Very low	83 Å²	83	113.5 Å²	113.5	58%	0.58	71%	0.714	S	S	*	*			cis	-154.5	156.7	-27.1	178.9	0	0	0	0	107.2	I73	S71-I73 PolarHBondContact O-N 2.68Å
72	T	31.7	Very low	28.5	Very low	119 Å²	119	109.3 Å²	109.3	73%	0.73	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.4	24.2	-166.8	-37.4	0	0	0	0	115.1
73	I	30.1	Very low	29.1	Very low	100 Å²	100	108.2 Å²	108.2	51%	0.513	67%	0.674	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.7	-36.3	-167.9	-68.7	171.3	0	0	0	113.5	S71 K75 I76	S71-I73 PolarHBondContact O-N 2.68Å; I73-K75 PolarHBondContact O-N 3.33Å; I73-I76 PolarHBondContact O-N 3.18Å
74	D	26.9	Very low	29.4	Very low	131 Å²	131	103.1 Å²	103.1	70%	0.701	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.9	-25.4	-171.8	-87.7	-57.6	0	0	0	116.1	I76	D74-I76 VanDerWaalsContact C-N 3.27Å; D74-I76 PolarHBondContact O-N 2.96Å
75	K	29.6	Very low	29.7	Very low	176 Å²	176	101.9 Å²	101.9	77%	0.765	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-21.8	-179	-70.4	179.4	-179.6	172.9	0	112.7	I73	I73-K75 PolarHBondContact O-N 3.33Å
76	I	35.4	Very low	30.4	Very low	107 Å²	107	103.2 Å²	103.2	55%	0.549	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-75.2	-42	-178.6	-58	176.5	0	0	0	110.7	I73 D74 K78 A79	I73-I76 PolarHBondContact O-N 3.18Å; D74-I76 VanDerWaalsContact C-N 3.27Å; D74-I76 PolarHBondContact O-N 2.96Å; I76-K78 PolarHBondContact O-N 3.06Å; I76-A79 PolarHBondContact O-N 3.43Å
77	H	31.6	Very low	30.9	Very low	97 Å²	97	101.7 Å²	101.7	45%	0.449	58%	0.583	S	S	.	*	G	3₁₀ helix	trans	-69.2	11.3	-179.7	-70.8	-91.9	0	0	0	115.4	K813	H77-K813 PolarHBondContact O-NZ 3.35Å
78	K	29.6	Very low	31.3	Very low	161 Å²	161	101.6 Å²	101.6	70%	0.7	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-108.8	-9.4	175.5	-154	164.9	-173.8	170.8	0	113.4	I76 N82	I76-K78 PolarHBondContact O-N 3.06Å; K78-N82 PolarHBondContact O-ND2 3.06Å; K78-N82 VanDerWaalsContact O-ND2 3.11Å
79	A	30.1	Very low	31.6	Very low	61 Å²	61	101.1 Å²	101.1	50%	0.504	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-41.5	178.1	0	0	0	0	0	113.4	I76 N82	I76-A79 PolarHBondContact O-N 3.43Å; A79-N82 WeakPolarHBondContact O-CB 3.39Å; A79-N82 PolarHBondContact O-N 3.17Å; A79-N82 VanDerWaalsContact O-N 3.16Å
80	S	30.3	Very low	31.7	Very low	82 Å²	82	104 Å²	104	57%	0.573	54%	0.541	S	S	*	.	H	α-helix	trans	-60.4	-49.1	-178.3	52	0	0	0	0	112.8	N82 K83	S80-N82 PolarHBondContact O-N 3.44Å; S80-N82 VanDerWaalsContact O-N 3.12Å; S80-K83 PolarHBondContact O-N 3.24Å
81	S	28.8	Very low	32.5	Very low	66 Å²	66	101 Å²	101	46%	0.462	51%	0.514	S	S	.	.	H	α-helix	trans	-52.3	-33.4	174.9	172.7	0	0	0	0	113	K83 W84 S85	S81-K83 PolarHBondContact O-N 2.95Å; S81-W84 WeakPolarHBondContact O-CB 3.49Å; S81-W84 PolarHBondContact O-N 3.29Å; S81-S85 PolarHBondContact O-N 3.41Å; S81-S85 PolarHBondContact O-OG 3.17Å
82	N	34	Very low	32.8	Very low	89 Å²	89	102.2 Å²	102.2	48%	0.476	51%	0.509	S	S	.	.	H	α-helix	trans	-70.7	-24.7	179.7	-89.6	-48.5	0	0	0	114.2	K78 A79 S80 K86	K78-N82 PolarHBondContact O-ND2 3.06Å; K78-N82 VanDerWaalsContact O-ND2 3.11Å; A79-N82 WeakPolarHBondContact O-CB 3.39Å; A79-N82 PolarHBondContact O-N 3.17Å; A79-N82 VanDerWaalsContact O-N 3.16Å; S80-N82 PolarHBondContact O-N 3.44Å; S80-N82 VanDerWaalsContact O-N 3.12Å; N82-K86 WeakPolarHBondContact O-CB 3.44Å; N82-K86 WeakPolarHBondContact O-CG 3.48Å; N82-K86 PolarHBondContact O-N 3.22Å
83	K	39	Very low	32.9	Very low	73 Å²	73	100.3 Å²	100.3	32%	0.317	51%	0.505	S	S	.	.	H	α-helix	trans	-72.4	-42.7	168.8	-85.6	-161.2	175.3	-169.6	0	110.9	S80 S81 K86 M87 R656	S80-K83 PolarHBondContact O-N 3.24Å; S81-K83 PolarHBondContact O-N 2.95Å; K83-K86 PolarHBondContact O-N 3.46Å; K83-M87 WeakPolarHBondContact O-CB 3.25Å; K83-M87 PolarHBondContact O-N 3.23Å; K83-R656 WeakPolarHBondContact CE-O 3.32Å; K83-R656 PolarHBondContact NZ-O 3.15Å
84	W	31.3	Very low	33	Very low	72 Å²	72	99 Å²	99	27%	0.273	50%	0.499	S	S	.	.	H	α-helix	trans	-59.6	-50.1	176.7	-167.9	-93.1	0	0	0	112	S81 K86 M87 Q88 T795 K799	S81-W84 WeakPolarHBondContact O-CB 3.49Å; S81-W84 PolarHBondContact O-N 3.29Å; W84-K86 PolarHBondContact O-N 3.47Å; W84-M87 HydrophobicContact CE3-CE 4.06Å; W84-M87 HydrophobicContact CZ3-CE 4.4Å; W84-M87 PolarHBondContact O-N 2.88Å; W84-Q88 PolarHBondContact O-N 3.09Å; W84-T795 HydrophobicContact CH2-CG2 3.52Å; W84-T795 HydrophobicContact CZ2-CG2 3.46Å; W84-T795 VanDerWaalsContact CZ2-CG2 3.46Å; W84-K799 HydrophobicContact CH2-CB 4.23Å; W84-K799 VanDerWaalsContact CH2-CE 3.49Å; W84-K799 HydrophobicContact CZ3-CB 4.41Å
85	S	31.5	Very low	33.2	Very low	43 Å²	43	96.6 Å²	96.6	30%	0.301	49%	0.493	S	S	.	.	H	α-helix	trans	-66.9	-31.4	175.4	-62.3	0	0	0	0	113.2	S81 N89	S81-S85 PolarHBondContact O-N 3.41Å; S81-S85 PolarHBondContact O-OG 3.17Å; S85-N89 WeakPolarHBondContact O-CB 3.41Å; S85-N89 PolarHBondContact O-N 2.91Å
86	K	38.4	Very low	33	Very low	139 Å²	139	94.6 Å²	94.6	60%	0.604	49%	0.486	S	S	*	.	H	α-helix	trans	-69	-35.1	171.8	-81.6	176.8	179	-178.9	0	112.7	N82 K83 W84 N89 W90	N82-K86 WeakPolarHBondContact O-CB 3.44Å; N82-K86 WeakPolarHBondContact O-CG 3.48Å; N82-K86 PolarHBondContact O-N 3.22Å; K83-K86 PolarHBondContact O-N 3.46Å; W84-K86 PolarHBondContact O-N 3.47Å; K86-N89 CarbonylContact O-C 3.54Å; K86-N89 PolarHBondContact O-N 3.25Å; K86-W90 PolarHBondContact O-N 3.49Å
87	M	37.9	Very low	32.6	Very low	74 Å²	74	94.2 Å²	94.2	37%	0.365	49%	0.485	S	S	.	.	H	α-helix	trans	-71.4	-37.4	175.6	-171.3	163.3	55.4	0	0	111.6	K83 W84 N89 W90 R91 L774	K83-M87 WeakPolarHBondContact O-CB 3.25Å; K83-M87 PolarHBondContact O-N 3.23Å; W84-M87 HydrophobicContact CE3-CE 4.06Å; W84-M87 HydrophobicContact CZ3-CE 4.4Å; W84-M87 PolarHBondContact O-N 2.88Å; M87-N89 VanDerWaalsContact C-N 3.35Å; M87-W90 PolarHBondContact O-N 3.43Å; M87-R91 PolarHBondContact O-N 3.17Å; M87-R91 VanDerWaalsContact O-N 3.14Å; M87-L774 HydrophobicContact CE-CD2 3.28Å; M87-L774 HydrophobicContact CG-CD2 4.48Å; M87-L774 HydrophobicContact SD-CD2 3.43Å; M87-L774 WeakPolarHBondContact SD-CD2 3.4Å
88	Q	32.6	Very low	32.5	Very low	103 Å²	103	95.7 Å²	95.7	48%	0.481	50%	0.503	S	S	.	.	H	α-helix	trans	-64.4	-36.6	166	-71.5	-176.7	-32.6	0	0	112.2	W84 R91 K92	W84-Q88 PolarHBondContact O-N 3.09Å; Q88-R91 CarbonylContact O-C 3.51Å; Q88-R91 WeakPolarHBondContact O-CB 3.39Å; Q88-R91 PolarHBondContact O-N 3.49Å; Q88-K92 WeakPolarHBondContact O-CB 3.34Å; Q88-K92 PolarHBondContact O-N 2.91Å
89	N	33	Very low	32.3	Very low	93 Å²	93	91.4 Å²	91.4	50%	0.497	51%	0.505	S	S	.	.	H	α-helix	trans	-71.7	-25.8	174	-74.4	-9.1	0	0	0	113.5	S85 K86 M87 K92 A93	S85-N89 WeakPolarHBondContact O-CB 3.41Å; S85-N89 PolarHBondContact O-N 2.91Å; K86-N89 CarbonylContact O-C 3.54Å; K86-N89 PolarHBondContact O-N 3.25Å; M87-N89 VanDerWaalsContact C-N 3.35Å; N89-K92 PolarHBondContact O-N 3.05Å; N89-A93 VanDerWaalsContact O-CB 3.24Å; N89-A93 WeakPolarHBondContact O-CB 3.21Å; N89-A93 PolarHBondContact O-N 3.48Å
90	W	32.5	Very low	32.1	Very low	173 Å²	173	96.2 Å²	96.2	66%	0.655	52%	0.522	S	S	*	.	H	α-helix	trans	-65	-45.1	166.5	-95.8	68.6	0	0	0	110.7	K86 M87 K92 L94	K86-W90 PolarHBondContact O-N 3.49Å; M87-W90 PolarHBondContact O-N 3.43Å; W90-K92 VanDerWaalsContact C-N 3.28Å; W90-K92 PolarHBondContact O-N 2.89Å; W90-L94 WeakPolarHBondContact O-CG 3.41Å; W90-L94 PolarHBondContact O-N 3.29Å
91	R	43.5	Very low	32.1	Very low	79 Å²	79	102.2 Å²	102.2	30%	0.298	54%	0.538	S	S	.	.	H	α-helix	trans	-59.7	-38.6	171.2	-66.7	178.6	175.5	-178.6	-3.2	111.7	M87 Q88 L94 S95 L774 S775	M87-R91 PolarHBondContact O-N 3.17Å; M87-R91 VanDerWaalsContact O-N 3.14Å; Q88-R91 CarbonylContact O-C 3.51Å; Q88-R91 WeakPolarHBondContact O-CB 3.39Å; Q88-R91 PolarHBondContact O-N 3.49Å; R91-L94 CarbonylContact O-C 3.55Å; R91-L94 PolarHBondContact O-N 3.22Å; R91-S95 WeakPolarHBondContact O-CB 3.38Å; R91-S95 PolarHBondContact O-N 2.88Å; R91-L774 PolarHBondContact NH2-O 2.82Å; R91-S775 PolarHBondContact NH2-OG 3.32Å
92	K	31.2	Very low	32	Very low	108 Å²	108	106.6 Å²	106.6	47%	0.47	56%	0.556	S	S	.	*	H	α-helix	trans	-72.5	-41.9	-179.9	-152.1	167.4	-170.8	-84.2	0	113.2	Q88 N89 W90 L94 S95 E96	Q88-K92 WeakPolarHBondContact O-CB 3.34Å; Q88-K92 PolarHBondContact O-N 2.91Å; N89-K92 PolarHBondContact O-N 3.05Å; W90-K92 VanDerWaalsContact C-N 3.28Å; W90-K92 PolarHBondContact O-N 2.89Å; K92-L94 PolarHBondContact O-N 2.97Å; K92-S95 CarbonylContact O-C 3.44Å; K92-S95 WeakPolarHBondContact O-CA 3.27Å; K92-S95 PolarHBondContact O-N 3.17Å; K92-E96 HydrophobicContact CG-CG 4.15Å; K92-E96 IonicContact NZ-OE1 3.33Å; K92-E96 PolarHBondContact NZ-OE1 3.27Å; K92-E96 WeakPolarHBondContact O-CG 3.5Å; K92-E96 PolarHBondContact O-N 3Å; K92-E96 VanDerWaalsContact O-N 3.07Å
93	A	32.7	Very low	31.7	Very low	80 Å²	80	107.4 Å²	107.4	66%	0.661	57%	0.569	S	S	*	*	H	α-helix	trans	-66.5	-19.5	174.4	0	0	0	0	0	113.2	N89	N89-A93 VanDerWaalsContact O-CB 3.24Å; N89-A93 WeakPolarHBondContact O-CB 3.21Å; N89-A93 PolarHBondContact O-N 3.48Å
94	L	33.8	Very low	31	Very low	72 Å²	72	111.2 Å²	111.2	38%	0.377	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.8	12.8	168.9	-63.5	170.6	0	0	0	112.7	W90 R91 K92 R572 K574	W90-L94 WeakPolarHBondContact O-CG 3.41Å; W90-L94 PolarHBondContact O-N 3.29Å; R91-L94 CarbonylContact O-C 3.55Å; R91-L94 PolarHBondContact O-N 3.22Å; K92-L94 PolarHBondContact O-N 2.97Å; L94-R572 PolarHBondContact O-NH2 3.48Å; L94-K574 VanDerWaalsContact CD2-NZ 3.34Å
95	S	31.4	Very low	30.7	Very low	81 Å²	81	111.6 Å²	111.6	57%	0.566	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.9	4.9	-171.1	-172.5	0	0	0	0	115.3	R91 K92	R91-S95 WeakPolarHBondContact O-CB 3.38Å; R91-S95 PolarHBondContact O-N 2.88Å; K92-S95 CarbonylContact O-C 3.44Å; K92-S95 WeakPolarHBondContact O-CA 3.27Å; K92-S95 PolarHBondContact O-N 3.17Å
96	E	25.4	Very low	30.3	Very low	133 Å²	133	112.9 Å²	112.9	62%	0.621	65%	0.645	S	S	*	*			trans	-94.7	102.4	178.4	-79.4	-177.3	164.4	0	0	112.1	K92	K92-E96 HydrophobicContact CG-CG 4.15Å; K92-E96 IonicContact NZ-OE1 3.33Å; K92-E96 PolarHBondContact NZ-OE1 3.27Å; K92-E96 WeakPolarHBondContact O-CG 3.5Å; K92-E96 PolarHBondContact O-N 3Å; K92-E96 VanDerWaalsContact O-N 3.07Å
97	D	26.8	Very low	29.8	Very low	99 Å²	99	116.2 Å²	116.2	53%	0.529	66%	0.659	S	S	.	*			trans	-77.3	132.9	168.8	-149.7	35	0	0	0	108.9	G99 K426 W547	D97-G99 PolarHBondContact O-N 3.41Å; D97-G99 VanDerWaalsContact O-N 3.13Å; D97-K426 IonicContact OD2-NZ 3.2Å; D97-W547 PolarHBondContact OD1-NE1 3.21Å
98	P	29.2	Very low	29.1	Very low	128 Å²	128	118.3 Å²	118.3	83%	0.831	68%	0.681	S	S	*	*			trans	-79.2	98.9	-174.1	30.2	-34	0	0	0	111.9
99	G	25.6	Very low	28.7	Very low	72 Å²	72	116.7 Å²	116.7	74%	0.742	69%	0.692	S	S	*	*			trans	-126.6	103.1	-176.2	0	0	0	0	0	115.2	D97	D97-G99 PolarHBondContact O-N 3.41Å; D97-G99 VanDerWaalsContact O-N 3.13Å
100	D	25.7	Very low	28.2	Very low	161 Å²	161	121.8 Å²	121.8	86%	0.861	71%	0.712	S	S	*	*			trans	13.8	110.6	161.1	-65.2	-35.9	0	0	0	120.4
101	K	29.2	Very low	27.8	Very low	208 Å²	208	117.4 Å²	117.4	90%	0.904	71%	0.714	S	S	*	*			trans	-74.7	119.9	143.9	-71.8	180	-179.5	176.3	0	108.6
102	N	26.7	Very low	26.9	Very low	158 Å²	158	119.8 Å²	119.8	85%	0.845	74%	0.737	S	S	*	*			trans	-145.8	137.5	152	-132.5	-23.6	0	0	0	112.6
103	S	27.8	Very low	26.5	Very low	106 Å²	106	122.5 Å²	122.5	74%	0.741	75%	0.749	S	S	*	*			trans	-107.3	134.9	-169.6	53.3	0	0	0	0	111.9
104	T	24.5	Very low	26.1	Very low	153 Å²	153	123.3 Å²	123.3	94%	0.939	76%	0.756	S	S	*	*			trans	-102.8	105.8	170.2	52.9	0	0	0	0	111.4
105	G	25	Very low	25.6	Very low	81 Å²	81	127.3 Å²	127.3	84%	0.835	77%	0.772	S	S	*	*			trans	-162.6	111	168.8	0	0	0	0	0	109
106	G	23.7	Very low	25.3	Very low	69 Å²	69	133.7 Å²	133.7	71%	0.711	79%	0.79	S	S	*	*			trans	-161.1	170.9	-173	0	0	0	0	0	113.6
107	K	26.8	Very low	25.2	Very low	210 Å²	210	130.6 Å²	130.6	91%	0.913	79%	0.794	S	S	*	*			trans	87.9	139.4	-157.7	-63	-178.8	177.2	-177.8	0	112.7
108	S	23.3	Very low	25	Very low	118 Å²	118	131.3 Å²	131.3	83%	0.825	81%	0.814	S	S	*	*			cis	-168.5	160.1	-5	39.1	0	0	0	0	112.4
109	G	24.3	Very low	25	Very low	68 Å²	68	128.3 Å²	128.3	70%	0.701	81%	0.806	S	S	*	*			trans	110	123.9	171.9	0	0	0	0	0	112.8
110	E	23.2	Very low	24.9	Very low	200 Å²	200	131.7 Å²	131.7	94%	0.935	81%	0.812	S	S	*	*			cis	78.6	120.7	28.6	-158.3	172.9	-147.6	0	0	112.8
111	A	23.6	Very low	24.8	Very low	82 Å²	82	129.9 Å²	129.9	68%	0.678	81%	0.807	S	S	*	*			cis	-150.4	-159.1	-9.7	0	0	0	0	0	108.9
112	T	24.5	Very low	24.7	Very low	129 Å²	129	132 Å²	132	79%	0.791	81%	0.809	S	S	*	*			cis	-157.9	125.8	4.8	-6.1	0	0	0	0	107.5
113	K	23.7	Very low	24.6	Very low	165 Å²	165	134.4 Å²	134.4	72%	0.717	81%	0.812	S	S	*	*				66.5	107.7	95.2	-161.1	-164	179.2	-153.5	0	118.9	E115	K113-E115 VanDerWaalsContact CE-OE1 3.23Å; K113-E115 WeakPolarHBondContact CE-OE1 3.4Å; K113-E115 IonicContact NZ-OE1 2.78Å; K113-E115 PolarHBondContact NZ-OE1 3.47Å
114	A	23.7	Very low	25.1	Very low	97 Å²	97	136.6 Å²	136.6	80%	0.802	82%	0.815	S	S	*	*			trans	-166	99	146.6	0	0	0	0	0	109.3
115	E	23.1	Very low	25.2	Very low	155 Å²	155	134.1 Å²	134.1	72%	0.724	80%	0.802	S	S	*	*				65.3	108.3	85.8	-83.3	-170	-158.5	0	0	118.4	K113	K113-E115 VanDerWaalsContact CE-OE1 3.23Å; K113-E115 WeakPolarHBondContact CE-OE1 3.4Å; K113-E115 IonicContact NZ-OE1 2.78Å; K113-E115 PolarHBondContact NZ-OE1 3.47Å
116	K	25.9	Very low	25	Very low	215 Å²	215	137.3 Å²	137.3	94%	0.935	79%	0.793	S	S	*	*			trans	-162.7	147.2	133.1	-111.6	172	-176.8	176.5	0	111.7
117	G	23.4	Very low	25.2	Very low	69 Å²	69	143.9 Å²	143.9	71%	0.711	80%	0.796	S	S	*	*			trans	-71.4	156.1	175.9	0	0	0	0	0	113
118	A	21.8	Very low	25.2	Very low	114 Å²	114	144.6 Å²	144.6	94%	0.942	79%	0.793	S	S	*	*				69.7	127.5	54.4	0	0	0	0	0	113.4
119	G	28.5	Very low	25.6	Very low	65 Å²	65	143.1 Å²	143.1	67%	0.67	79%	0.788	S	S	*	*			cis	169.4	127.8	-9.4	0	0	0	0	0	113.4
120	V	24.7	Very low	26.1	Very low	142 Å²	142	145.1 Å²	145.1	86%	0.861	78%	0.782	S	S	*	*			trans	-141.8	89.5	177.2	-179.5	0	0	0	0	108.9
121	T	22.8	Very low	26	Very low	124 Å²	124	138.9 Å²	138.9	76%	0.761	76%	0.76	S	S	*	*				72.2	75.9	76.4	67.2	0	0	0	0	116.5
122	R	27.8	Very low	26.1	Very low	253 Å²	253	143.4 Å²	143.4	96%	0.955	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-101.8	164.2	145.3	-79	-175.5	170.5	-176	-2.6	109.4
123	K	23.8	Very low	26.2	Very low	208 Å²	208	142.1 Å²	142.1	90%	0.904	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-98.5	150.3	-160.2	-59	176.9	-179.8	178.7	0	114.2
124	N	39.9	Very low	26	Very low	151 Å²	151	140.8 Å²	140.8	81%	0.807	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-75.8	163.5	164.8	-65.4	-12	0	0	0	110.5
125	P	24.7	Very low	26.5	Very low	101 Å²	101	139 Å²	139	66%	0.656	76%	0.761	S	S	*	*				-107.8	-179.5	73.4	36.9	-38.5	0	0	0	112.8
126	F	21.5	Very low	26.7	Very low	149 Å²	149	136.7 Å²	136.7	65%	0.654	76%	0.762	S	S	*	*			cis	-144.5	177.6	0.3	-126.2	-33.4	0	0	0	110	L130 S131	F126-L130 HydrophobicContact CE1-CB 4.43Å; F126-L130 HydrophobicContact CE1-CD2 4.09Å; F126-L130 HydrophobicContact CZ-CD2 4.47Å; F126-S131 WeakPolarHBondContact CE1-OG 3.44Å
127	R	27.9	Very low	26.6	Very low	206 Å²	206	134.1 Å²	134.1	78%	0.777	76%	0.758	S	S	*	*			trans	-163.3	162.7	175.6	-138.1	-177.7	-165.2	-118.6	7.6	112.7	L130	R127-L130 CarbonylContact O-C 3.58Å; R127-L130 WeakPolarHBondContact O-CA 3.49Å; R127-L130 PolarHBondContact O-N 3.01Å
128	R	28	Very low	26.8	Very low	226 Å²	226	140 Å²	140	85%	0.853	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.7	123.8	135.4	-56.2	-174.9	-179	149.8	-3.9	112.7
129	A	31.5	Very low	27.1	Very low	87 Å²	87	138.6 Å²	138.6	72%	0.719	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	cis	-102.6	63.4	4	0	0	0	0	0	111
130	L	33.3	Very low	27.1	Very low	109 Å²	109	139.6 Å²	139.6	57%	0.571	75%	0.754	S	S	*	*			trans	63.2	174.8	-157.6	-54.9	172.6	0	0	0	111	F126 R127	F126-L130 HydrophobicContact CE1-CB 4.43Å; F126-L130 HydrophobicContact CE1-CD2 4.09Å; F126-L130 HydrophobicContact CZ-CD2 4.47Å; R127-L130 CarbonylContact O-C 3.58Å; R127-L130 WeakPolarHBondContact O-CA 3.49Å; R127-L130 PolarHBondContact O-N 3.01Å
131	S	21.6	Very low	27	Very low	69 Å²	69	140.2 Å²	140.2	48%	0.483	75%	0.752	S	S	.	*			trans	-91.3	110.2	153.3	50.6	0	0	0	0	107.2	F126	F126-S131 WeakPolarHBondContact CE1-OG 3.44Å
132	E	26.5	Very low	26.9	Very low	178 Å²	178	140 Å²	140	83%	0.832	75%	0.75	S	S	*	*			trans	-66	161.6	164.9	-102.8	-169.9	-179	0	0	110.9
133	P	25.2	Very low	27.5	Very low	101 Å²	101	133.1 Å²	133.1	66%	0.656	74%	0.739	S	S	*	*			trans	-78.8	159.9	-147.2	29.7	-37.5	0	0	0	114.7	G135	P133-G135 PolarHBondContact O-N 2.9Å
134	P	21.4	Very low	27.4	Very low	137 Å²	137	128.8 Å²	128.8	89%	0.89	74%	0.735	S	S	*	*			trans	-70.8	70.2	160.8	33.2	-34.9	0	0	0	110.1	S136	P134-S136 PolarHBondContact O-N 3.46Å
135	G	33	Very low	26.7	Very low	61 Å²	61	126.6 Å²	126.6	63%	0.629	73%	0.731	S	S	*	*			trans	-79.1	100.7	-178.7	0	0	0	0	0	112.5	P133	P133-G135 PolarHBondContact O-N 2.9Å
136	S	27.6	Very low	26.6	Very low	106 Å²	106	127.5 Å²	127.5	74%	0.741	74%	0.739	S	S	*	*			trans	176.7	112	130.6	37.1	0	0	0	0	113.2	P134	P134-S136 PolarHBondContact O-N 3.46Å
137	L	24.7	Very low	26.8	Very low	160 Å²	160	125.3 Å²	125.3	84%	0.838	74%	0.743	S	S	*	*	S	Bend		-114.5	139.5	112.8	-74.3	175	0	0	0	107.7
138	F	27.3	Very low	26.7	Very low	194 Å²	194	119.8 Å²	119.8	85%	0.851	74%	0.741	S	S	*	*			trans	-6.9	142.8	160.3	-62.5	-91.7	0	0	0	118.5
139	A	28.1	Very low	26.5	Very low	84 Å²	84	114.1 Å²	114.1	69%	0.694	74%	0.736	S	S	*	*			cis	-171	178.7	-2.3	0	0	0	0	0	112.2
140	A	26.9	Very low	26.2	Very low	85 Å²	85	115.2 Å²	115.2	70%	0.702	74%	0.739	S	S	*	*			trans	64.6	107.7	156.6	0	0	0	0	0	117.5
141	L	23.4	Very low	25.7	Very low	155 Å²	155	114.9 Å²	114.9	81%	0.812	75%	0.752	S	S	*	*				91.8	107.6	60.6	-79.6	166.4	0	0	0	113.5
142	T	21.6	Very low	26.1	Very low	119 Å²	119	120.2 Å²	120.2	73%	0.73	77%	0.769	S	S	*	*				32.3	149.4	128.7	58.6	0	0	0	0	121.6
143	P	38.6	Very low	26.6	Very low	110 Å²	110	118 Å²	118	71%	0.714	77%	0.77	S	S	*	*			cis	-144	-155.7	-24	40	-19.6	0	0	0	112.7
144	S	22.4	Very low	26.6	Very low	117 Å²	117	117.6 Å²	117.6	82%	0.818	78%	0.775	S	S	*	*			trans	100.8	153.7	150	81.2	0	0	0	0	119.1
145	S	24.8	Very low	27	Very low	105 Å²	105	116.4 Å²	116.4	73%	0.734	77%	0.77	S	S	*	*			trans	-79.4	154.6	-170.6	51	0	0	0	0	114.2
146	S	24.4	Very low	26.7	Very low	119 Å²	119	118 Å²	118	83%	0.832	77%	0.772	S	S	*	*				176.3	179.3	112.4	49.9	0	0	0	0	113.6
147	S	24.9	Very low	26.8	Very low	104 Å²	104	118.4 Å²	118.4	73%	0.727	77%	0.774	S	S	*	*			trans	-66.6	139.9	-170.6	50.4	0	0	0	0	118.3
148	A	25.8	Very low	26.9	Very low	89 Å²	89	116.3 Å²	116.3	74%	0.736	77%	0.773	S	S	*	*				66.4	162.8	125.5	0	0	0	0	0	123
149	S	24.1	Very low	26.9	Very low	107 Å²	107	112 Å²	112	75%	0.748	77%	0.767	S	S	*	*			trans	81.4	106.3	154.9	69.7	0	0	0	0	121.1
150	S	24.4	Very low	26.9	Very low	111 Å²	111	112.5 Å²	112.5	78%	0.776	77%	0.766	S	S	*	*				60.7	148.3	122.8	67.3	0	0	0	0	124.6
151	A	24.1	Very low	26.9	Very low	102 Å²	102	114.3 Å²	114.3	84%	0.843	77%	0.773	S	S	*	*			trans	94.6	149.7	146.6	0	0	0	0	0	119.8
152	Q	28.3	Very low	27	Very low	181 Å²	181	111.6 Å²	111.6	85%	0.846	77%	0.773	S	S	*	*			trans	-88.6	179.6	176.1	-57.1	-179	-60.7	0	0	111.3
153	P	37.2	Very low	27.2	Very low	130 Å²	130	110.4 Å²	110.4	84%	0.844	78%	0.775	S	S	*	*				-140.6	176.9	98.8	36	-21.5	0	0	0	115.7
154	A	26.6	Very low	27.5	Very low	94 Å²	94	110.2 Å²	110.2	78%	0.777	77%	0.774	S	S	*	*			trans	-86.6	-172.1	175.9	0	0	0	0	0	111.6
155	S	28.7	Very low	27.7	Very low	111 Å²	111	113.3 Å²	113.3	78%	0.776	78%	0.776	S	S	*	*			cis	-160.5	-175.3	7.3	53.1	0	0	0	0	107.5
156	S	27.8	Very low	27.8	Very low	96 Å²	96	112.5 Å²	112.5	67%	0.671	78%	0.775	S	S	*	*			cis	-179.3	164.9	35.3	49.3	0	0	0	0	112.5
157	S	27.9	Very low	28	Very low	113 Å²	113	111.8 Å²	111.8	79%	0.79	78%	0.777	S	S	*	*			trans	65.4	151.7	162.9	76.4	0	0	0	0	118.7
158	S	27.8	Very low	28	Very low	116 Å²	116	110.3 Å²	110.3	81%	0.811	78%	0.777	S	S	*	*			cis	-170.7	-178.2	-23.4	63.8	0	0	0	0	106.8
159	S	27.9	Very low	28.1	Very low	103 Å²	103	111.2 Å²	111.2	72%	0.72	79%	0.785	S	S	*	*			cis	-166	178.7	-1.9	96.4	0	0	0	0	106.3
160	S	27.8	Very low	28.3	Very low	96 Å²	96	111.4 Å²	111.4	67%	0.671	79%	0.786	S	S	*	*			cis	-176.4	171.6	-23.9	54.3	0	0	0	0	109.3
161	S	26.6	Very low	28.4	Very low	122 Å²	122	110.2 Å²	110.2	85%	0.853	78%	0.778	S	S	*	*			trans	71.5	148.5	171.8	81.4	0	0	0	0	117.9
162	A	25.1	Very low	28.5	Very low	99 Å²	99	112.3 Å²	112.3	82%	0.818	78%	0.775	S	S	*	*			cis	-149.4	173.2	-2.8	0	0	0	0	0	112
163	A	26.3	Very low	28.4	Very low	93 Å²	93	110.9 Å²	110.9	77%	0.769	77%	0.773	S	S	*	*			trans	-113.6	-174.8	173.4	0	0	0	0	0	110.7
164	P	45.2	Very low	28.8	Very low	107 Å²	107	109.3 Å²	109.3	70%	0.695	76%	0.763	S	S	*	*				-134.5	-155.2	51	37.3	-13.7	0	0	0	112.3
165	E	26.3	Very low	28.8	Very low	182 Å²	182	110.4 Å²	110.4	85%	0.85	77%	0.765	S	S	*	*			cis	-155.9	-134	8.2	-152.4	151.3	-89.4	0	0	115.2
166	A	27.2	Very low	28.7	Very low	87 Å²	87	108.9 Å²	108.9	72%	0.719	75%	0.754	S	S	*	*			trans	-80.6	169.1	-166.7	0	0	0	0	0	117.4
167	A	27.7	Very low	28.7	Very low	105 Å²	105	114.1 Å²	114.1	87%	0.868	77%	0.765	S	S	*	*			cis	-173.5	164.7	-20.9	0	0	0	0	0	112.2
168	G	25.3	Very low	28.6	Very low	72 Å²	72	112.1 Å²	112.1	74%	0.742	76%	0.762	S	S	*	*			trans	113.8	109.4	168.8	0	0	0	0	0	113.6
169	A	28	Very low	28.6	Very low	108 Å²	108	113 Å²	113	89%	0.893	77%	0.768	S	S	*	*			cis	77.1	137.4	50	0	0	0	0	0	113.7
170	S	27.7	Very low	28.5	Very low	111 Å²	111	111.9 Å²	111.9	78%	0.776	77%	0.773	S	S	*	*			cis	-169.5	-179.4	-15.4	79.5	0	0	0	0	107.9
171	S	27.3	Very low	28.5	Very low	86 Å²	86	110.5 Å²	110.5	60%	0.601	77%	0.774	S	S	*	*			cis	-175.8	160.2	-8.9	35.7	0	0	0	0	110.9
172	N	27.1	Very low	28.7	Very low	147 Å²	147	111 Å²	111	79%	0.786	77%	0.772	S	S	*	*			trans	75.5	118.9	157.3	-54.5	-16	0	0	0	121.8
173	D	24.6	Very low	29	Very low	151 Å²	151	113.2 Å²	113.2	81%	0.807	77%	0.77	S	S	*	*				28.7	159.8	98.5	-91.7	9.5	0	0	0	121.6
174	P	46.8	Very low	28.9	Very low	96 Å²	96	116.4 Å²	116.4	62%	0.623	77%	0.766	S	S	*	*			cis	-147	-172.9	-32.9	40.4	-21.8	0	0	0	115.1
175	S	25.6	Very low	28.1	Very low	118 Å²	118	118.8 Å²	118.8	83%	0.825	77%	0.766	S	S	*	*			trans	74.6	168	152.9	88	0	0	0	0	118
176	S	26.7	Very low	28.2	Very low	78 Å²	78	118.5 Å²	118.5	55%	0.545	76%	0.762	S	S	.	*			cis	-160.2	150.6	-1.8	101.5	0	0	0	0	112
177	K	27.7	Very low	28.2	Very low	206 Å²	206	123.6 Å²	123.6	90%	0.896	76%	0.764	S	S	*	*			trans	57.6	148.5	151.7	-57.3	166	-172.6	167.9	0	119.1
178	G	26.8	Very low	28.2	Very low	71 Å²	71	124.4 Å²	124.4	73%	0.732	75%	0.753	S	S	*	*			cis	160.7	156.4	-11.9	0	0	0	0	0	114.4
179	S	26.5	Very low	28.2	Very low	134 Å²	134	132.6 Å²	132.6	94%	0.937	76%	0.761	S	S	*	*			trans	64.6	131.9	152.3	-154.2	0	0	0	0	122.2
180	G	27	Very low	28.2	Very low	80 Å²	80	132.4 Å²	132.4	83%	0.825	75%	0.745	S	S	*	*			trans	89.3	146	160.7	0	0	0	0	0	116.2
181	G	27.6	Very low	28	Very low	68 Å²	68	132.9 Å²	132.9	70%	0.701	74%	0.744	S	S	*	*			cis	171.7	107.4	-7.4	0	0	0	0	0	114.4
182	T	30.4	Very low	27.9	Very low	131 Å²	131	134.2 Å²	134.2	80%	0.804	75%	0.748	S	S	*	*			trans	50	116.4	152.8	51.4	0	0	0	0	122.3
183	L	31.2	Very low	27.8	Very low	147 Å²	147	134.4 Å²	134.4	77%	0.77	74%	0.744	S	S	*	*				83.5	135.6	127.1	-67.7	170	0	0	0	123.2
184	F	25.4	Very low	27.9	Very low	159 Å²	159	136.4 Å²	136.4	70%	0.697	75%	0.746	S	S	*	*				112.2	132	126.8	-109.2	-51.7	0	0	0	120.6
185	K	28.1	Very low	27	Very low	157 Å²	157	139.7 Å²	139.7	68%	0.683	76%	0.757	S	S	*	*			trans	75.2	125.4	156.7	-84.4	136.6	-173.4	173.6	0	115.6
186	K	28.5	Very low	26.9	Very low	177 Å²	177	144 Å²	144	77%	0.77	76%	0.761	S	S	*	*				71.5	140.2	73.6	-82.4	-161.3	179.5	-168.4	0	111.9
187	Y	25.9	Very low	26.8	Very low	193 Å²	193	151.6 Å²	151.6	76%	0.757	78%	0.778	S	S	*	*			cis	-168.7	158.7	-9.6	-136.7	-144.1	0	0	0	107.1
188	L	27.3	Very low	27.6	Very low	122 Å²	122	147.2 Å²	147.2	64%	0.639	77%	0.77	S	S	*	*			trans	41.7	122.4	164.1	-90.2	82.8	0	0	0	121.3
189	W	26.1	Very low	27.4	Very low	244 Å²	244	155.8 Å²	155.8	92%	0.924	78%	0.781	S	S	*	*				-154.9	104.9	121.1	-131.8	48.7	0	0	0	107.9
190	N	27.2	Very low	27.3	Very low	104 Å²	104	157.3 Å²	157.3	56%	0.556	78%	0.777	S	S	*	*				71.6	116	87.6	-80.1	3.6	0	0	0	115.3
191	V	24.3	Very low	27.1	Very low	122 Å²	122	162.6 Å²	162.6	74%	0.739	78%	0.781	S	S	*	*			trans	2.7	146.8	139.7	-99	0	0	0	0	118
192	T	25.5	Very low	26.9	Very low	113 Å²	113	163.6 Å²	163.6	69%	0.693	78%	0.777	S	S	*	*			cis	-169.6	169	43.8	-13.6	0	0	0	0	112.9
193	Q	24.3	Very low	26.6	Very low	151 Å²	151	167.5 Å²	167.5	71%	0.706	78%	0.777	S	S	*	*			trans	66.1	117.7	145.4	-71.5	-80.8	-13	0	0	120.6
194	K	27	Very low	26.2	Very low	193 Å²	193	166 Å²	166	84%	0.839	77%	0.77	S	S	*	*				174.1	153.9	91.6	-84.9	-155.8	178	-178.5	0	113.7
195	L	27.7	Very low	26.2	Very low	166 Å²	166	162.4 Å²	162.4	87%	0.869	76%	0.764	S	S	*	*			trans	-67	143.6	171.2	-66.3	119.9	0	0	0	113.2
196	K	24.9	Very low	26	Very low	209 Å²	209	164 Å²	164	91%	0.909	77%	0.774	S	S	*	*			trans	-167.6	116.7	145.2	-111.3	168.1	-175.9	-178.5	0	113.6
197	R	24.3	Very low	25.9	Very low	237 Å²	237	165 Å²	165	89%	0.894	78%	0.781	S	S	*	*			trans	-83.6	179.9	152.1	-75	-177.1	171.5	-179.3	-2.1	108.5
198	P	43.3	Very low	25.9	Very low	113 Å²	113	160 Å²	160	73%	0.734	78%	0.78	S	S	*	*				-133.6	176	-56.5	39.1	-25.1	0	0	0	112
199	R	22.3	Very low	25.8	Very low	252 Å²	252	162.3 Å²	162.3	95%	0.951	79%	0.792	S	S	*	*				178.9	161.4	127.8	-103.6	174.1	172.7	157.6	-0.3	115
200	L	25.9	Very low	25.8	Very low	165 Å²	165	158.2 Å²	158.2	86%	0.864	79%	0.787	S	S	*	*			trans	-84.5	175.1	177.2	-71.1	149.1	0	0	0	112.6
201	Q	22.6	Very low	26.3	Very low	192 Å²	192	158.3 Å²	158.3	90%	0.897	79%	0.794	S	S	*	*			trans	113.6	142.1	163.9	-69.3	-171.8	1.9	0	0	114.8
202	S	22.4	Very low	26.3	Very low	89 Å²	89	158.8 Å²	158.8	62%	0.622	79%	0.792	S	S	*	*			cis	-172.5	149.5	-9.4	175.6	0	0	0	0	111.2
203	R	23.7	Very low	26.2	Very low	213 Å²	213	159.8 Å²	159.8	80%	0.804	79%	0.792	S	S	*	*			trans	66	159.9	165.6	-68.7	167.3	76.1	177.4	1.9	116.3
204	N	24.2	Very low	26.2	Very low	116 Å²	116	160.2 Å²	160.2	62%	0.62	79%	0.792	S	S	*	*			cis	-144.4	154.1	-3.3	-134	30.9	0	0	0	113.1
205	S	25.2	Very low	26	Very low	83 Å²	83	158.4 Å²	158.4	58%	0.58	79%	0.787	S	S	*	*			trans	-35.5	153.6	161.2	54.2	0	0	0	0	119.2
206	E	24.3	Very low	25.9	Very low	191 Å²	191	157.5 Å²	157.5	89%	0.893	79%	0.788	S	S	*	*				-163.8	166.5	106.1	-108.5	169.1	-157.8	0	0	114.3
207	H	26.6	Very low	25.9	Very low	196 Å²	196	156.4 Å²	156.4	91%	0.907	79%	0.785	S	S	*	*			trans	-131.7	138.6	-169.1	-104	-91.2	0	0	0	111.5
208	A	24.2	Very low	26.1	Very low	89 Å²	89	151 Å²	151	74%	0.736	78%	0.782	S	S	*	*			trans	-170.1	153.5	154.7	0	0	0	0	0	111.1
209	L	25.2	Very low	25.1	Very low	170 Å²	170	150.1 Å²	150.1	89%	0.89	78%	0.784	S	S	*	*			cis	-161.6	155.5	-26.2	-111.3	170.3	0	0	0	107.7
210	L	26.4	Very low	25.5	Very low	159 Å²	159	147.8 Å²	147.8	83%	0.832	78%	0.783	S	S	*	*			trans	-104.6	174.6	172.4	-84.6	170.1	0	0	0	110.1
211	P	37.3	Very low	25.5	Very low	106 Å²	106	144.5 Å²	144.5	69%	0.688	78%	0.78	S	S	*	*			cis	-125.6	-149.3	14	34.4	-9.2	0	0	0	112.4
212	D	24.3	Very low	25.6	Very low	132 Å²	132	140.2 Å²	140.2	71%	0.706	78%	0.777	S	S	*	*			cis	-163	175.5	13	-146.9	-3.4	0	0	0	115.7
213	L	25.2	Very low	25.8	Very low	133 Å²	133	140.8 Å²	140.8	70%	0.696	79%	0.787	S	S	*	*			trans	0.3	131.9	157.3	-72.4	163	0	0	0	119.4
214	K	23.1	Very low	25.8	Very low	161 Å²	161	133.6 Å²	133.6	70%	0.7	78%	0.78	S	S	*	*				-174.3	150	59.4	-130.3	166.6	-176.2	-91.7	0	115.8
215	E	23.7	Very low	25.8	Very low	155 Å²	155	137.5 Å²	137.5	72%	0.724	79%	0.794	S	S	*	*			trans	18.6	111.7	151.6	-62.7	164.9	133.6	0	0	122.7
216	V	24.8	Very low	25.8	Very low	147 Å²	147	143.4 Å²	143.4	89%	0.891	81%	0.809	S	S	*	*			trans	-150.9	147	139.4	-171.7	0	0	0	0	109.2
217	E	25	Very low	25.8	Very low	185 Å²	185	140.3 Å²	140.3	86%	0.864	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-75	143.6	172.8	-66.8	-171.1	145.1	0	0	113.6
218	P	27.6	Very low	25.8	Very low	125 Å²	125	141.5 Å²	141.5	81%	0.812	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-94.9	133.4	166.6	34.8	-29.8	0	0	0	112.5
219	A	23.8	Very low	26	Very low	94 Å²	94	142.2 Å²	142.2	78%	0.777	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-74.9	171.6	171.4	0	0	0	0	0	112.7	A221	A219-A221 PolarHBondContact O-N 3.42Å; A219-A221 VanDerWaalsContact O-N 3.16Å
220	H	29.7	Very low	26.2	Very low	203 Å²	203	141 Å²	141	94%	0.94	78%	0.783	S	S	*	*			trans	-41	114.2	-178.4	-65.1	-80.9	0	0	0	114.7
221	A	25.9	Very low	26.8	Very low	96 Å²	96	137.9 Å²	137.9	79%	0.793	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-88.3	149.6	163.2	0	0	0	0	0	110.5	A219	A219-A221 PolarHBondContact O-N 3.42Å; A219-A221 VanDerWaalsContact O-N 3.16Å
222	A	25	Very low	26.7	Very low	101 Å²	101	136.9 Å²	136.9	84%	0.835	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-69.9	148.5	-178.5	0	0	0	0	0	112.3	G224	A222-G224 PolarHBondContact O-N 3.41Å
223	A	26.8	Very low	27.2	Very low	101 Å²	101	131.7 Å²	131.7	84%	0.835	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-64.9	126.9	169.7	0	0	0	0	0	110
224	G	24.2	Very low	27.8	Very low	63 Å²	63	129.3 Å²	129.3	65%	0.649	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-71.4	141	171	0	0	0	0	0	111	A222 F226	A222-G224 PolarHBondContact O-N 3.41Å; G224-F226 PolarHBondContact O-N 3Å; G224-F226 VanDerWaalsContact O-N 3.17Å
225	E	24.2	Very low	28.6	Very low	198 Å²	198	128.3 Å²	128.3	93%	0.925	72%	0.716	S	S	*	*			trans	-67.6	110.4	172.9	-65.8	-179.4	117.6	0	0	109.7	T227	E225-T227 PolarHBondContact O-N 2.9Å
226	F	24.3	Very low	29.7	Very low	206 Å²	206	129.7 Å²	129.7	90%	0.904	72%	0.722	S	S	*	*			trans	-65.7	129.4	167.2	-86.2	-90.9	0	0	0	109.5	G224 R228	G224-F226 PolarHBondContact O-N 3Å; G224-F226 VanDerWaalsContact O-N 3.17Å; F226-R228 PolarHBondContact O-N 3.46Å
227	T	23.7	Very low	31.2	Very low	127 Å²	127	124 Å²	124	78%	0.779	69%	0.688	S	S	*	*			trans	-60.3	125.9	-179.9	32.2	0	0	0	0	110.8	E225 Q229	E225-T227 PolarHBondContact O-N 2.9Å; T227-Q229 VanDerWaalsContact C-N 3.34Å; T227-Q229 PolarHBondContact O-N 3.35Å
228	R	27.7	Very low	33.1	Very low	221 Å²	221	117.5 Å²	117.5	83%	0.834	66%	0.661	S	S	*	*			trans	-68.5	84	-175.4	-166.6	-177.8	-165.4	-173.9	4.4	111.4	F226	F226-R228 PolarHBondContact O-N 3.46Å
229	Q	28.6	Very low	35.2	Very low	103 Å²	103	112.9 Å²	112.9	48%	0.481	63%	0.63	S	S	.	*			trans	-55.4	138.4	169.2	-81.9	171.4	-58.3	0	0	109.9	T227 W231	T227-Q229 VanDerWaalsContact C-N 3.34Å; T227-Q229 PolarHBondContact O-N 3.35Å; Q229-W231 HydrophobicContact CB-CD2 4.34Å; Q229-W231 HydrophobicContact CB-CZ2 3.82Å; Q229-W231 HydrophobicContact CG-CZ2 4.44Å; Q229-W231 PolarHBondContact O-N 2.78Å; Q229-W231 PolarHBondContact O-NE1 3.23Å; Q229-W231 VanDerWaalsContact OE1-CZ2 3.24Å
230	N	28.3	Very low	37.6	Very low	146 Å²	146	110.4 Å²	110.4	78%	0.781	60%	0.6	S	S	*	*			trans	-98.4	73.4	-166.5	-154.9	32.9	0	0	0	109.2	V232	N230-V232 PolarHBondContact O-N 3.02Å
231	W	39	Very low	39.9	Very low	93 Å²	93	104.8 Å²	104.8	35%	0.352	58%	0.577	S	S	.	*			trans	-69.8	62	-174	-48	96.1	0	0	0	113.1	Q229 I377 T443	Q229-W231 HydrophobicContact CB-CD2 4.34Å; Q229-W231 HydrophobicContact CB-CZ2 3.82Å; Q229-W231 HydrophobicContact CG-CZ2 4.44Å; Q229-W231 PolarHBondContact O-N 2.78Å; Q229-W231 PolarHBondContact O-NE1 3.23Å; Q229-W231 VanDerWaalsContact OE1-CZ2 3.24Å; W231-I377 HydrophobicContact CE3-CD1 3.69Å; W231-I377 HydrophobicContact CE3-CG2 4.04Å; W231-I377 HydrophobicContact CZ3-CB 4.02Å; W231-I377 HydrophobicContact CZ3-CD1 3.82Å; W231-I377 HydrophobicContact CZ3-CG2 3.63Å; W231-T443 HydrophobicContact CB-CG2 4.16Å; W231-T443 WeakPolarHBondContact CB-OG1 3.3Å; W231-T443 WeakPolarHBondContact O-CG2 3.48Å
232	V	36.4	Very low	42.5	Very low	84 Å²	84	100.2 Å²	100.2	51%	0.509	54%	0.539	S	S	.	.			trans	-114.5	118.4	167	177.6	0	0	0	0	105.8	N230 P234	N230-V232 PolarHBondContact O-N 3.02Å; V232-P234 WeakPolarHBondContact O-CD 3.44Å; V232-P234 VanDerWaalsContact O-N 3.12Å
233	P	35	Very low	44.8	Very low	23 Å²	23	99.1 Å²	99.1	15%	0.149	52%	0.522	C	S	.	.			trans	-57.5	122	171.8	23.7	-31.9	0	0	0	107.6	V237 I367	P233-V237 HydrophobicContact CB-CG2 4.04Å; P233-I367 HydrophobicContact CG-CG2 4.47Å
234	P	36.4	Very low	46.8	Very low	83 Å²	83	97.9 Å²	97.9	54%	0.539	50%	0.502	S	S	.	.			trans	-57.5	160.9	-177.4	18.9	-29.7	0	0	0	110.9	V232 E236 V237	V232-P234 WeakPolarHBondContact O-CD 3.44Å; V232-P234 VanDerWaalsContact O-N 3.12Å; P234-E236 PolarHBondContact O-N 3.34Å; P234-V237 HydrophobicContact CG-CG2 3.57Å; P234-V237 PolarHBondContact O-N 3.12Å
235	Q	40.5	Very low	49.3	Very low	141 Å²	141	95.4 Å²	95.4	66%	0.659	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-6.1	-163.5	-141.1	163.6	2.8	0	0	114.4	R267	Q235-R267 VanDerWaalsContact CG-NH2 3.3Å; Q235-R267 PolarHBondContact O-NH2 3.36Å
236	E	47.6	Very low	51.8	Low	183 Å²	183	91 Å²	91	86%	0.855	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.7	36.9	-168.5	-59.2	174.5	159.7	0	0	111.7	P234	P234-E236 PolarHBondContact O-N 3.34Å
237	V	56.1	Low	54.3	Low	28 Å²	28	84 Å²	84	17%	0.17	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-65.3	127.7	173.2	-180	0	0	0	0	110.2	P233 P234 C384	P233-V237 HydrophobicContact CB-CG2 4.04Å; P234-V237 HydrophobicContact CG-CG2 3.57Å; P234-V237 PolarHBondContact O-N 3.12Å; V237-C384 HydrophobicContact CG1-CB 3.96Å
238	P	63.7	Low	56.4	Low	48 Å²	48	79.1 Å²	79.1	31%	0.312	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-63.6	135.6	171.7	23.2	-31.5	0	0	0	111.9	P260	P238-P260 HydrophobicContact CB-CB 3.51Å; P238-P260 HydrophobicContact CB-CG 3.96Å
239	L	71.8	Confident	58.1	Low	28 Å²	28	76.8 Å²	76.8	15%	0.147	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125.3	169.2	-173	63.9	0	0	0	108.7	T261 W263 L368 E370 C384	L239-T261 PolarHBondContact O-N 2.9Å; L239-W263 HydrophobicContact CD2-CE3 4.47Å; L239-W263 HydrophobicContact CD2-CZ3 3.91Å; L239-L368 HydrophobicContact CD1-CD1 4.26Å; L239-E370 HydrophobicContact CD2-CG 4.21Å; L239-C384 HydrophobicContact CD1-CB 4.02Å
240	W	75.4	Confident	59.7	Low	42 Å²	42	72.6 Å²	72.6	16%	0.159	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	146.7	174.4	-63.2	82.7	0	0	0	109.8	I254 P260 C384 F385 G386	W240-I254 HydrophobicContact CE3-CD1 4.33Å; W240-I254 HydrophobicContact CE3-CG2 4.05Å; W240-I254 HydrophobicContact CZ3-CD1 4.37Å; W240-I254 HydrophobicContact CZ3-CG2 3.7Å; W240-P260 HydrophobicContact CD2-CB 4.01Å; W240-P260 HydrophobicContact CE3-CB 4.3Å; W240-P260 HydrophobicContact CH2-CB 4.13Å; W240-P260 HydrophobicContact CH2-CG 4.09Å; W240-P260 HydrophobicContact CZ2-CB 3.82Å; W240-P260 HydrophobicContact CZ2-CG 3.88Å; W240-P260 HydrophobicContact CZ3-CB 4.34Å; W240-C384 PolarHBondContact N-O 3.23Å; W240-F385 HydrophobicContact CB-CD1 3.68Å; W240-F385 HydrophobicContact CB-CE1 3.91Å; W240-F385 HydrophobicContact CG-CD1 4.49Å; W240-F385 HydrophobicContact CG-CE1 4.31Å; W240-F385 CarbonylContact O-C 3.49Å; W240-F385 WeakPolarHBondContact O-CA 3.48Å; W240-G386 PolarHBondContact O-N 3.26Å
241	D	78.1	Confident	61.6	Low	85 Å²	85	68.5 Å²	68.5	46%	0.455	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	128.2	169.1	-160	-50.9	0	0	0	109.2	T243	D241-T243 VanDerWaalsContact C-N 3.31Å; D241-T243 WeakPolarHBondContact OD1-CB 3.48Å; D241-T243 WeakPolarHBondContact OD1-CG2 3.49Å; D241-T243 PolarHBondContact OD1-N 2.89Å; D241-T243 PolarHBondContact OD1-OG1 3.15Å
242	I	79.9	Confident	63.3	Low	0 Å²	0	64 Å²	64	0%	0	35%	0.35	C	S	.	.	S	Bend	trans	-77.2	-18.2	-179.2	-154.8	66.1	0	0	0	112.8	N244 C245 F374 F385 G386 C387 E392 W396	I242-N244 PolarHBondContact O-N 3.36Å; I242-C245 HydrophobicContact CD1-CB 3.86Å; I242-C245 HydrophobicContact CG1-CB 4.38Å; I242-C245 WeakPolarHBondContact O-CB 3.33Å; I242-C245 PolarHBondContact O-N 3.35Å; I242-F374 HydrophobicContact CD1-CE1 4.03Å; I242-F374 HydrophobicContact CD1-CZ 3.63Å; I242-F374 HydrophobicContact CG1-CE1 4.05Å; I242-F374 HydrophobicContact CG1-CZ 4.13Å; I242-F385 HydrophobicContact CD1-CB 4.05Å; I242-F385 HydrophobicContact CD1-CD1 3.51Å; I242-F385 HydrophobicContact CD1-CE1 4.12Å; I242-F385 HydrophobicContact CD1-CG 3.86Å; I242-G386 WeakPolarHBondContact CB-O 3.34Å; I242-G386 VanDerWaalsContact CG2-O 3.3Å; I242-G386 WeakPolarHBondContact CG2-O 3.49Å; I242-G386 PolarHBondContact N-O 3.48Å; I242-G386 VanDerWaalsContact N-O 3.1Å; I242-C387 HydrophobicContact CG2-CB 4.19Å; I242-E392 HydrophobicContact CG2-CG 4.28Å; I242-W396 HydrophobicContact CD1-CD2 3.99Å; I242-W396 HydrophobicContact CD1-CE3 4.03Å; I242-W396 HydrophobicContact CD1-CG 4.48Å; I242-W396 HydrophobicContact CD1-CH2 4.38Å; I242-W396 HydrophobicContact CD1-CZ2 4.34Å; I242-W396 HydrophobicContact CD1-CZ3 4.22Å; I242-W396 HydrophobicContact CG1-CD2 3.5Å; I242-W396 HydrophobicContact CG1-CE3 4.07Å; I242-W396 HydrophobicContact CG1-CG 3.74Å; I242-W396 HydrophobicContact CG1-CH2 4.34Å; I242-W396 HydrophobicContact CG1-CZ2 3.82Å; I242-W396 HydrophobicContact CG1-CZ3 4.45Å
243	T	72.6	Confident	65	Low	78 Å²	78	63.5 Å²	63.5	48%	0.479	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-24.5	-175.1	57.5	0	0	0	0	113.2	D241	D241-T243 VanDerWaalsContact C-N 3.31Å; D241-T243 WeakPolarHBondContact OD1-CB 3.48Å; D241-T243 WeakPolarHBondContact OD1-CG2 3.49Å; D241-T243 PolarHBondContact OD1-N 2.89Å; D241-T243 PolarHBondContact OD1-OG1 3.15Å
244	N	68.6	Low	66.6	Low	76 Å²	76	63.3 Å²	63.3	41%	0.406	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93	2.6	174.1	-66	-4.9	0	0	0	113.4	I242 T255 D258	I242-N244 PolarHBondContact O-N 3.36Å; N244-T255 PolarHBondContact O-OG1 2.98Å; N244-D258 PolarHBondContact ND2-OD2 2.88Å
245	C	78.2	Confident	67.6	Low	10 Å²	10	62.4 Å²	62.4	7%	0.068	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	143.9	-179.7	-66.3	0	0	0	0	111.9	I242 I252 W396	I242-C245 HydrophobicContact CD1-CB 3.86Å; I242-C245 HydrophobicContact CG1-CB 4.38Å; I242-C245 WeakPolarHBondContact O-CB 3.33Å; I242-C245 PolarHBondContact O-N 3.35Å; C245-I252 HydrophobicContact CB-CG2 3.76Å; C245-W396 HydrophobicContact CB-CH2 4.07Å; C245-W396 HydrophobicContact CB-CZ2 4.41Å; C245-W396 WeakPolarHBondContact O-CH2 3.29Å; C245-W396 WeakPolarHBondContact O-CZ2 3.45Å
246	I	74.9	Confident	67.9	Low	106 Å²	106	65.2 Å²	65.2	54%	0.544	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	130.3	176.4	-58.4	178.5	0	0	0	109.9	G248 L253	I246-G248 PolarHBondContact O-N 2.87Å; I246-L253 HydrophobicContact CB-CB 4.49Å; I246-L253 PolarHBondContact N-O 2.91Å; I246-L253 WeakPolarHBondContact O-CB 3.22Å; I246-L253 PolarHBondContact O-N 3.47Å
247	L	77.4	Confident	67.9	Low	60 Å²	60	64.5 Å²	64.5	31%	0.314	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	105.1	173.7	-176	55.3	0	0	0	110.1	Q251 L352 W396 D399 L400 A403	L247-Q251 WeakPolarHBondContact CD1-O 3.28Å; L247-L352 HydrophobicContact CD1-CD1 4.29Å; L247-W396 HydrophobicContact CB-CH2 4.25Å; L247-W396 HydrophobicContact CB-CZ3 3.94Å; L247-D399 HydrophobicContact CD2-CB 3.97Å; L247-L400 HydrophobicContact CD1-CD2 3.92Å; L247-L400 HydrophobicContact CD2-CD2 4.39Å; L247-A403 HydrophobicContact CD1-CB 4.33Å
248	G	67.5	Low	67.4	Low	23 Å²	23	66.9 Å²	66.9	24%	0.237	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	127.5	-179.8	0	0	0	0	0	111.8	I246 G250 Q251	I246-G248 PolarHBondContact O-N 2.87Å; G248-G250 PolarHBondContact O-N 2.94Å; G248-Q251 PolarHBondContact N-O 3.01Å; G248-Q251 PolarHBondContact O-N 3.32Å
249	D	63.7	Low	66.7	Low	173 Å²	173	72.8 Å²	72.8	93%	0.925	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.9	31.9	177.9	-68.8	-21.6	0	0	0	115.8
250	G	62.9	Low	65.7	Low	15 Å²	15	73 Å²	73	16%	0.155	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	15.9	-179.7	0	0	0	0	0	115.3	G248 L352	G248-G250 PolarHBondContact O-N 2.94Å; G250-L352 VanDerWaalsContact O-CB 3.29Å; G250-L352 WeakPolarHBondContact O-CB 3.42Å; G250-L352 WeakPolarHBondContact O-CG 3.34Å; G250-L352 PolarHBondContact O-N 3.05Å; G250-L352 VanDerWaalsContact O-N 3.17Å
251	Q	67.4	Low	64.3	Low	59 Å²	59	74.6 Å²	74.6	28%	0.276	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	145.8	176.3	-40.5	-173	-29.8	0	0	111.1	L247 G248 L253 S349 L350 D351	L247-Q251 WeakPolarHBondContact CD1-O 3.28Å; G248-Q251 PolarHBondContact N-O 3.01Å; G248-Q251 PolarHBondContact O-N 3.32Å; Q251-L253 PolarHBondContact O-N 3.49Å; Q251-S349 WeakPolarHBondContact CB-OG 3.38Å; Q251-S349 PolarHBondContact OE1-OG 3.4Å; Q251-L350 CarbonylContact C-O 3.57Å; Q251-L350 VanDerWaalsContact CA-O 3.27Å; Q251-L350 WeakPolarHBondContact CA-O 3.41Å; Q251-D351 HydrophobicContact CG-CB 4.13Å; Q251-D351 VanDerWaalsContact NE2-CG 3.29Å; Q251-D351 PolarHBondContact NE2-OD2 2.94Å
252	I	74.7	Confident	62.3	Low	0 Å²	0	75.2 Å²	75.2	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	106.5	168.8	-43.1	-174.3	0	0	0	108.2	C245 S349 L350 L352 F385 L400	C245-I252 HydrophobicContact CB-CG2 3.76Å; I252-S349 CarbonylContact O-C 3.58Å; I252-S349 WeakPolarHBondContact O-CA 3.47Å; I252-L350 HydrophobicContact CB-CB 4.19Å; I252-L350 HydrophobicContact CD1-CD2 4.07Å; I252-L350 HydrophobicContact CG1-CB 4.45Å; I252-L350 PolarHBondContact N-O 2.93Å; I252-L350 PolarHBondContact O-N 2.97Å; I252-L352 HydrophobicContact CG1-CD1 4.32Å; I252-F385 HydrophobicContact CD1-CE1 4.46Å; I252-F385 HydrophobicContact CD1-CE2 4.07Å; I252-F385 HydrophobicContact CD1-CZ 3.8Å; I252-L400 HydrophobicContact CD1-CD1 4.06Å; I252-L400 HydrophobicContact CD1-CD2 3.55Å; I252-L400 HydrophobicContact CD1-CG 4.5Å; I252-L400 HydrophobicContact CG1-CD2 3.51Å
253	L	72.1	Confident	60.2	Low	73 Å²	73	82.1 Å²	82.1	38%	0.382	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	123.9	170.1	-58.6	176.1	0	0	0	108.6	I246 Q251	I246-L253 HydrophobicContact CB-CB 4.49Å; I246-L253 PolarHBondContact N-O 2.91Å; I246-L253 WeakPolarHBondContact O-CB 3.22Å; I246-L253 PolarHBondContact O-N 3.47Å; Q251-L253 PolarHBondContact O-N 3.49Å
254	I	69.4	Low	58	Low	18 Å²	18	85.7 Å²	85.7	9%	0.092	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	123	177.4	-59.8	177.8	0	0	0	107.1	W240 Q256 G348	W240-I254 HydrophobicContact CE3-CD1 4.33Å; W240-I254 HydrophobicContact CE3-CG2 4.05Å; W240-I254 HydrophobicContact CZ3-CD1 4.37Å; W240-I254 HydrophobicContact CZ3-CG2 3.7Å; I254-Q256 PolarHBondContact O-N 2.73Å; I254-G348 PolarHBondContact N-O 3.23Å
255	T	57	Low	56.1	Low	64 Å²	64	89.6 Å²	89.6	39%	0.393	45%	0.454	S	S	.	.			trans	-62.8	134.2	179.6	42.4	0	0	0	0	111.3	N244 E257	N244-T255 PolarHBondContact O-OG1 2.98Å; T255-E257 PolarHBondContact O-N 2.76Å
256	Q	47.7	Very low	53.6	Low	201 Å²	201	95.9 Å²	95.9	94%	0.939	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	3.5	-161.1	-156	173.5	-6.9	0	0	115.2	I254	I254-Q256 PolarHBondContact O-N 2.73Å
257	E	46.9	Very low	51.8	Low	168 Å²	168	98.3 Å²	98.3	79%	0.785	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-20	-177.5	-59.8	-168.1	168.2	0	0	113.9	T255	T255-E257 PolarHBondContact O-N 2.76Å
258	D	45.6	Very low	49.3	Very low	78 Å²	78	99.4 Å²	99.4	42%	0.417	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-95.8	122	-172.3	-76.2	-46.1	0	0	0	113.9	N244	N244-D258 PolarHBondContact ND2-OD2 2.88Å
259	E	48.8	Very low	47.4	Very low	171 Å²	171	102.4 Å²	102.4	80%	0.799	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-73	145.2	153.8	-76.3	-162.4	135.6	0	0	110	T261	E259-T261 PolarHBondContact O-N 2.85Å
260	P	50.5	Low	45.7	Very low	34 Å²	34	97.5 Å²	97.5	22%	0.221	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-59.6	138.2	172.5	24.2	-31.9	0	0	0	110.7	P238 W240 T262	P238-P260 HydrophobicContact CB-CB 3.51Å; P238-P260 HydrophobicContact CB-CG 3.96Å; W240-P260 HydrophobicContact CD2-CB 4.01Å; W240-P260 HydrophobicContact CE3-CB 4.3Å; W240-P260 HydrophobicContact CH2-CB 4.13Å; W240-P260 HydrophobicContact CH2-CG 4.09Å; W240-P260 HydrophobicContact CZ2-CB 3.82Å; W240-P260 HydrophobicContact CZ2-CG 3.88Å; W240-P260 HydrophobicContact CZ3-CB 4.34Å; P260-T262 VanDerWaalsContact C-N 3.34Å; P260-T262 PolarHBondContact O-N 3.14Å
261	T	46.3	Very low	44.1	Very low	75 Å²	75	102.1 Å²	102.1	46%	0.46	52%	0.524	S	S	.	.			trans	-71	87.3	-175.3	-41	0	0	0	0	110.9	L239 E259 W263	L239-T261 PolarHBondContact O-N 2.9Å; E259-T261 PolarHBondContact O-N 2.85Å; T261-W263 VanDerWaalsContact C-N 3.27Å; T261-W263 PolarHBondContact O-N 3.06Å
262	T	36.6	Very low	42.1	Very low	98 Å²	98	107.4 Å²	107.4	60%	0.601	55%	0.553	S	S	*	*			trans	-72.5	75.7	-176.8	51.1	0	0	0	0	111.9	P260 I264	P260-T262 VanDerWaalsContact C-N 3.34Å; P260-T262 PolarHBondContact O-N 3.14Å; T262-I264 VanDerWaalsContact C-N 3.29Å; T262-I264 PolarHBondContact O-N 3.14Å
263	W	36.2	Very low	39.7	Very low	144 Å²	144	112.2 Å²	112.2	55%	0.545	59%	0.587	S	S	.	*			trans	-68.2	86	170	-72.7	-24.6	0	0	0	111.3	L239 T261 R265 E370	L239-W263 HydrophobicContact CD2-CE3 4.47Å; L239-W263 HydrophobicContact CD2-CZ3 3.91Å; T261-W263 VanDerWaalsContact C-N 3.27Å; T261-W263 PolarHBondContact O-N 3.06Å; W263-R265 PolarHBondContact O-N 3.25Å; W263-E370 HydrophobicContact CH2-CG 4.03Å; W263-E370 HydrophobicContact CZ3-CG 3.47Å; W263-E370 VanDerWaalsContact CZ3-CG 3.47Å
264	I	26.4	Very low	37.4	Very low	154 Å²	154	116 Å²	116	79%	0.79	61%	0.607	S	S	*	*			trans	-71.2	63.1	167.7	-50	179.7	0	0	0	109.5	T262 N266	T262-I264 VanDerWaalsContact C-N 3.29Å; T262-I264 PolarHBondContact O-N 3.14Å; I264-N266 PolarHBondContact O-N 3.03Å
265	R	28.7	Very low	35.3	Very low	157 Å²	157	123.1 Å²	123.1	59%	0.592	65%	0.645	S	S	*	*			trans	-82.1	104.2	171	-87.6	-178.7	164.4	164.2	-4.1	109	W263 R267 E370	W263-R265 PolarHBondContact O-N 3.25Å; R265-R267 PolarHBondContact O-N 2.94Å; R265-R267 VanDerWaalsContact O-N 3.09Å; R265-E370 IonicContact NH1-OE1 2.61Å
266	N	26	Very low	33.8	Very low	142 Å²	142	125.3 Å²	125.3	76%	0.759	66%	0.663	S	S	*	*			trans	-44.4	116.9	164.6	-97.2	-82.3	0	0	0	109.9	I264 V268	I264-N266 PolarHBondContact O-N 3.03Å; N266-V268 VanDerWaalsContact C-N 3.35Å; N266-V268 PolarHBondContact O-N 3.15Å
267	R	35.7	Very low	32.8	Very low	157 Å²	157	122.6 Å²	122.6	59%	0.592	66%	0.659	S	S	*	*	S	Bend	trans	-63.5	86.4	-175.6	-67.7	-173	-178.4	-168.3	0.5	112.3	Q235 R265	Q235-R267 VanDerWaalsContact CG-NH2 3.3Å; Q235-R267 PolarHBondContact O-NH2 3.36Å; R265-R267 PolarHBondContact O-N 2.94Å; R265-R267 VanDerWaalsContact O-N 3.09Å
268	V	25.2	Very low	31.7	Very low	84 Å²	84	123.6 Å²	123.6	51%	0.509	66%	0.664	S	S	.	*			trans	-150.2	133.1	170.5	-169.9	0	0	0	0	109.5	N266 K516	N266-V268 VanDerWaalsContact C-N 3.35Å; N266-V268 PolarHBondContact O-N 3.15Å; V268-K516 VanDerWaalsContact CG2-NZ 3.29Å
269	S	28.4	Very low	30.7	Very low	86 Å²	86	127.7 Å²	127.7	60%	0.601	69%	0.686	S	S	*	*			trans	67.7	110.9	169.8	-139.5	0	0	0	0	117.5
270	S	28	Very low	29.5	Very low	70 Å²	70	127.3 Å²	127.3	49%	0.49	69%	0.689	S	S	.	*	S	Bend	trans	-52.7	146.9	138.3	55.4	0	0	0	0	110.7
271	C	28.5	Very low	28.3	Very low	112 Å²	112	132.3 Å²	132.3	76%	0.757	72%	0.719	S	S	*	*			trans	55.9	95.3	163.4	-48.5	0	0	0	0	116.8
272	L	24.8	Very low	27.3	Very low	170 Å²	170	135.5 Å²	135.5	89%	0.89	73%	0.733	S	S	*	*				-173.5	144.7	129.6	-102.4	167.1	0	0	0	111.2
273	S	25.6	Very low	26.8	Very low	101 Å²	101	137.7 Å²	137.7	71%	0.706	74%	0.741	S	S	*	*			trans	49.6	98.3	169	59.4	0	0	0	0	118.5
274	N	23.7	Very low	26.2	Very low	151 Å²	151	139 Å²	139	81%	0.807	76%	0.759	S	S	*	*			trans	-114.2	120.1	132.1	-105.7	7.3	0	0	0	106.6
275	L	25.8	Very low	26.3	Very low	169 Å²	169	136.3 Å²	136.3	89%	0.885	76%	0.76	S	S	*	*			trans	-145.4	146.2	174.5	-104.8	172.2	0	0	0	107.6
276	S	24.8	Very low	26	Very low	110 Å²	110	138.2 Å²	138.2	77%	0.769	78%	0.775	S	S	*	*			trans	69	72.3	175.9	-177.3	0	0	0	0	117.2
277	V	26	Very low	26	Very low	143 Å²	143	137.9 Å²	137.9	87%	0.867	78%	0.782	S	S	*	*				-142.2	94.9	123.7	-167.1	0	0	0	0	109.3
278	Q	24.2	Very low	25.3	Very low	189 Å²	189	135.9 Å²	135.9	88%	0.883	79%	0.792	S	S	*	*			trans	-179.5	110.1	152.4	-104.9	165.8	9.5	0	0	109.3
279	N	25.5	Very low	26.2	Very low	164 Å²	164	136.9 Å²	136.9	88%	0.877	80%	0.801	S	S	*	*			trans	-165.3	147.7	166.2	-110.4	-44.4	0	0	0	104.8
280	L	23.9	Very low	26.2	Very low	164 Å²	164	139.8 Å²	139.8	86%	0.859	81%	0.81	S	S	*	*			trans	74.4	71.8	-163.8	-50.2	170	0	0	0	113.7
281	T	24.6	Very low	27.1	Very low	139 Å²	139	141.1 Å²	141.1	85%	0.853	82%	0.817	S	S	*	*				-70.9	130.9	125.7	48.7	0	0	0	0	107.8
282	D	25.7	Very low	27	Very low	141 Å²	141	142.9 Å²	142.9	75%	0.754	82%	0.823	S	S	*	*			trans	-155.1	166.7	151	-136.5	-32.6	0	0	0	111.4
283	N	26.3	Very low	27.1	Very low	145 Å²	145	138 Å²	138	78%	0.775	81%	0.814	S	S	*	*			trans	-88	157.1	-158.2	-61.8	-99.9	0	0	0	114.1
284	D	23.1	Very low	27.1	Very low	171 Å²	171	139.8 Å²	139.8	91%	0.914	82%	0.82	S	S	*	*			trans	-67.5	133.8	164.9	-69.5	-66	0	0	0	112.2
285	A	27.1	Very low	28.3	Very low	98 Å²	98	138.7 Å²	138.7	81%	0.81	82%	0.822	S	S	*	*			trans	-160.6	111.3	158.2	0	0	0	0	0	110.1
286	E	23.1	Very low	28.2	Very low	197 Å²	197	134.6 Å²	134.6	92%	0.921	82%	0.82	S	S	*	*			trans	-74.7	135.4	175.2	-64.1	-172.3	109	0	0	112.3
287	C	25.4	Very low	28.2	Very low	134 Å²	134	133.2 Å²	133.2	91%	0.905	82%	0.823	S	S	*	*			trans	-170.2	153.4	137.4	-102.6	0	0	0	0	112.5
288	S	22.8	Very low	28.2	Very low	115 Å²	115	132.6 Å²	132.6	80%	0.804	83%	0.825	S	S	*	*			trans	-138.2	170	-176.5	-85.2	0	0	0	0	109.9
289	P	43.8	Very low	28.5	Very low	106 Å²	106	135 Å²	135	69%	0.688	83%	0.826	S	S	*	*			cis	-138.6	-180	-33.6	36.6	-18.8	0	0	0	114.1
290	D	27.5	Very low	29.2	Very low	147 Å²	147	132.4 Å²	132.4	79%	0.786	82%	0.818	S	S	*	*			trans	70.8	163.6	141.1	-95	16.8	0	0	0	122.2
291	P	46.1	Very low	29.4	Very low	98 Å²	98	133.4 Å²	133.4	64%	0.636	82%	0.816	S	S	*	*			cis	-142	-167.4	-49.7	34.1	-12.6	0	0	0	115.6
292	V	27.8	Very low	29.6	Very low	148 Å²	148	132.7 Å²	132.7	90%	0.897	81%	0.806	S	S	*	*			trans	88.5	127.3	158	-161.6	0	0	0	0	120.4
293	G	26.3	Very low	29.9	Very low	67 Å²	67	132.8 Å²	132.8	69%	0.691	80%	0.802	S	S	*	*			trans	164	116.1	158.3	0	0	0	0	0	116.6
294	V	25.3	Very low	30.1	Very low	139 Å²	139	132.3 Å²	132.3	84%	0.842	80%	0.8	S	S	*	*			trans	-157.4	157.4	-173.7	-174.5	0	0	0	0	109.3
295	P	48.6	Very low	30.4	Very low	129 Å²	129	128 Å²	128	84%	0.838	80%	0.795	S	S	*	*			cis	-123.1	-172.8	-36.5	39.2	-23.7	0	0	0	113.1
296	G	24.8	Very low	30.6	Very low	82 Å²	82	126.7 Å²	126.7	85%	0.845	79%	0.792	S	S	*	*			trans	171.5	151.3	158.1	0	0	0	0	0	114.6
297	G	24.6	Very low	31	Very low	82 Å²	82	124.5 Å²	124.5	85%	0.845	79%	0.792	S	S	*	*			trans	175.9	165.8	174.3	0	0	0	0	0	116.8
298	S	26.6	Very low	31.6	Very low	129 Å²	129	129.6 Å²	129.6	90%	0.902	79%	0.792	S	S	*	*			trans	-164.3	164.5	173.2	51	0	0	0	0	113
299	R	29.6	Very low	32.7	Very low	241 Å²	241	127.7 Å²	127.7	91%	0.909	79%	0.791	S	S	*	*			trans	-117.6	165.2	178.3	-116.7	179.2	176.3	179.2	-0.3	108.9
300	P	41.1	Very low	32.5	Very low	108 Å²	108	130.5 Å²	130.5	70%	0.701	80%	0.799	S	S	*	*				-155.7	-178.8	55.1	43.1	-21.4	0	0	0	118.7
301	K	27.8	Very low	33.2	Very low	186 Å²	186	131.7 Å²	131.7	81%	0.809	80%	0.804	S	S	*	*			trans	28.7	141.6	142.2	-67.5	178.4	178.2	179.9	0	120.2
302	N	28.8	Very low	32.6	Very low	123 Å²	123	135.2 Å²	135.2	66%	0.658	81%	0.809	S	S	*	*			cis	-159.7	-175	24.3	-125.2	23.3	0	0	0	108.9
303	Q	30.6	Very low	33	Very low	143 Å²	143	139.3 Å²	139.3	67%	0.668	81%	0.808	S	S	*	*			cis	-153.3	-140.7	4.7	-149.5	170.2	-89.3	0	0	112
304	D	31.2	Very low	33.3	Very low	135 Å²	135	148 Å²	148	72%	0.722	82%	0.82	S	S	*	*			trans	4.5	144.4	165.1	-53.8	-13.2	0	0	0	121.4
305	G	30.1	Very low	33.7	Very low	80 Å²	80	148.7 Å²	148.7	83%	0.825	82%	0.818	S	S	*	*			cis	117.9	103	-1	0	0	0	0	0	114.1
306	G	30.2	Very low	32.7	Very low	72 Å²	72	149.2 Å²	149.2	74%	0.742	81%	0.814	S	S	*	*			cis	169.3	122.1	-12.1	0	0	0	0	0	114.4
307	V	32.1	Very low	32.9	Very low	151 Å²	151	155.3 Å²	155.3	92%	0.915	82%	0.818	S	S	*	*	S	Bend	trans	-132.8	52.5	166.8	-163.7	0	0	0	0	110.6
308	R	39	Very low	33.1	Very low	240 Å²	240	156.2 Å²	156.2	91%	0.906	82%	0.817	S	S	*	*			trans	-124.3	20.7	171.3	-74.8	-168.7	172.9	-131.7	0.2	113.2	L310	R308-L310 PolarHBondContact O-N 3.48Å
309	G	45.3	Very low	33.2	Very low	76 Å²	76	159.6 Å²	159.6	78%	0.784	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	60.3	-178.2	0	0	0	0	0	114.8
310	L	38.2	Very low	33.1	Very low	165 Å²	165	159.5 Å²	159.5	86%	0.864	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.2	-32.9	159.2	-138.9	73.2	0	0	0	114.1	R308	R308-L310 PolarHBondContact O-N 3.48Å
311	I	43.2	Very low	32.3	Very low	171 Å²	171	161.7 Å²	161.7	88%	0.877	82%	0.821	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-27.7	-174.1	-62.1	175.7	0	0	0	112.5	R313	I311-R313 PolarHBondContact O-N 3.03Å
312	K	34.1	Very low	32.2	Very low	172 Å²	172	158.3 Å²	158.3	75%	0.748	82%	0.821	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	62.3	178.4	-162.2	170.3	-177.3	169.6	0	113.5
313	R	35.8	Very low	32	Very low	234 Å²	234	156.9 Å²	156.9	88%	0.883	83%	0.826	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.3	25.2	167.7	-150.4	-175.8	-93.1	-170.7	-5.3	115.7	I311	I311-R313 PolarHBondContact O-N 3.03Å
314	R	32.7	Very low	31.8	Very low	249 Å²	249	155.5 Å²	155.5	94%	0.94	83%	0.827	S	S	*	*	S	Bend	trans	-134	0	170.8	-83	-167.1	174.6	171.3	-0.2	116.2
315	L	33.8	Very low	31.5	Very low	154 Å²	154	156.4 Å²	156.4	81%	0.806	83%	0.827	S	S	*	*	S	Bend	trans	-127.6	103.7	171.5	-167.1	69.1	0	0	0	107.6
316	D	27.7	Very low	31.2	Very low	140 Å²	140	157.9 Å²	157.9	75%	0.749	82%	0.816	S	S	*	*	S	Bend	trans	149.7	54.2	168	-80.9	-23.7	0	0	0	111.8
317	K	28.3	Very low	30.8	Very low	211 Å²	211	160.8 Å²	160.8	92%	0.917	81%	0.814	S	S	*	*			trans	-157.6	54.6	166.2	-149.5	-179.3	-176.6	-174.5	0	115
318	A	29.1	Very low	31.2	Very low	100 Å²	100	158.5 Å²	158.5	83%	0.826	80%	0.802	S	S	*	*			trans	-142.5	26.6	-175	0	0	0	0	0	116.6
319	K	28.6	Very low	30.6	Very low	201 Å²	201	150.2 Å²	150.2	87%	0.874	79%	0.792	S	S	*	*	S	Bend	trans	-158.2	77.1	166.6	-131.1	173.1	-173.6	179.1	0	115.6
320	R	27.1	Very low	29.7	Very low	239 Å²	239	152.5 Å²	152.5	90%	0.902	79%	0.786	S	S	*	*			trans	-174.2	151.9	143.9	-116.3	168.6	-83.6	-174.9	-9	113.1
321	N	25.3	Very low	29.1	Very low	154 Å²	154	150.8 Å²	150.8	82%	0.824	78%	0.777	S	S	*	*			trans	82.7	100.4	172.8	-58.7	19.4	0	0	0	117.2
322	S	24.9	Very low	28.2	Very low	115 Å²	115	151 Å²	151	80%	0.804	77%	0.772	S	S	*	*			trans	-75.9	-171.8	147.3	46.1	0	0	0	0	111
323	A	24	Very low	27.7	Very low	93 Å²	93	150.6 Å²	150.6	77%	0.769	78%	0.777	S	S	*	*			trans	76.1	133.4	174.3	0	0	0	0	0	117.1
324	T	26.9	Very low	27.1	Very low	113 Å²	113	143.2 Å²	143.2	69%	0.693	76%	0.761	S	S	*	*			cis	-163.7	167.3	-19.4	-37.7	0	0	0	0	109
325	Q	26.3	Very low	26.7	Very low	155 Å²	155	143.7 Å²	143.7	72%	0.724	76%	0.763	S	S	*	*			trans	69.4	152.2	163.1	-48.9	-47	22.2	0	0	118.2
326	L	22	Very low	26.3	Very low	111 Å²	111	144.3 Å²	144.3	58%	0.581	76%	0.762	S	S	*	*			cis	-155.8	175.5	-14	-116.7	169.1	0	0	0	111.9	L1123	L326-L1123 HydrophobicContact CD2-CD1 4.36Å
327	N	22.8	Very low	26.2	Very low	132 Å²	132	149.1 Å²	149.1	71%	0.706	77%	0.771	S	S	*	*			trans	-73.9	-170.9	176.2	-74.2	-33.4	0	0	0	112.9
328	P	41.3	Very low	26	Very low	103 Å²	103	142.5 Å²	142.5	67%	0.669	76%	0.763	S	S	*	*			cis	-147.2	178.9	12	44.6	-24.3	0	0	0	119.9	L1127	P328-L1127 HydrophobicContact CB-CD2 4.25Å; P328-L1127 HydrophobicContact CG-CD2 4.3Å
329	G	24.8	Very low	25.7	Very low	67 Å²	67	142.9 Å²	142.9	69%	0.691	76%	0.76	S	S	*	*			trans	102	151.7	145.7	0	0	0	0	0	118.6
330	L	26.2	Very low	25.6	Very low	124 Å²	124	142.6 Å²	142.6	65%	0.649	75%	0.753	S	S	*	*			cis	-164.9	140.1	-12.5	-157	76.8	0	0	0	111.6
331	N	25.6	Very low	25.7	Very low	129 Å²	129	138 Å²	138	69%	0.69	74%	0.742	S	S	*	*			trans	67	154.1	162.2	-82.9	-51.7	0	0	0	118.7
332	K	25.4	Very low	25.9	Very low	175 Å²	175	136.6 Å²	136.6	76%	0.761	74%	0.744	S	S	*	*			cis	-154.6	145.2	17.7	-139.9	158	-166.4	166.7	0	115.4
333	L	23.1	Very low	26	Very low	164 Å²	164	137.3 Å²	137.3	86%	0.859	74%	0.743	S	S	*	*			trans	74.5	118.6	150.1	-129.2	74.9	0	0	0	122.2
334	S	23.3	Very low	26.3	Very low	79 Å²	79	138.1 Å²	138.1	55%	0.552	74%	0.743	S	S	*	*			trans	-76.6	155.8	169.5	164.7	0	0	0	0	113.7	Q336	S334-Q336 PolarHBondContact OG-N 2.96Å
335	R	24.9	Very low	26.3	Very low	259 Å²	259	138 Å²	138	98%	0.977	74%	0.742	S	S	*	*			trans	-125.9	130.4	132.9	-83.9	-167.7	176.5	-174.7	0.6	109.2
336	Q	24.4	Very low	26.8	Very low	167 Å²	167	136.6 Å²	136.6	78%	0.78	75%	0.746	S	S	*	*			trans	-133.1	127.3	-174.4	-170.3	169.5	6.3	0	0	108.9	S334	S334-Q336 PolarHBondContact OG-N 2.96Å
337	Y	25.6	Very low	27.9	Very low	240 Å²	240	133.4 Å²	133.4	94%	0.941	73%	0.731	S	S	*	*			trans	-136.8	107.9	160.9	-114.5	-91.3	0	0	0	105
338	G	24.1	Very low	29.3	Very low	72 Å²	72	129.4 Å²	129.4	74%	0.742	72%	0.721	S	S	*	*			trans	-95.2	153.8	-176.1	0	0	0	0	0	111.9
339	S	23.9	Very low	30.2	Very low	109 Å²	109	126.4 Å²	126.4	76%	0.762	70%	0.703	S	S	*	*			trans	-143.2	101.4	157.8	-175.7	0	0	0	0	110.1
340	R	25.7	Very low	32.3	Very low	194 Å²	194	123.6 Å²	123.6	73%	0.732	67%	0.672	S	S	*	*			trans	47.8	114	137.7	-55.4	-172.3	69.3	-171.5	-4.4	119
341	E	30.2	Very low	34.1	Very low	144 Å²	144	120.1 Å²	120.1	67%	0.673	65%	0.654	S	S	*	*				56.2	91.1	119.9	-60.2	152.1	178.9	0	0	116.7
342	S	28	Very low	36.2	Very low	124 Å²	124	114 Å²	114	87%	0.867	62%	0.621	S	S	*	*			trans	-139.4	66.3	152.2	-62.2	0	0	0	0	108.2	S344	S342-S344 PolarHBondContact O-N 3Å
343	V	28.2	Very low	37.8	Very low	129 Å²	129	109.4 Å²	109.4	78%	0.782	61%	0.611	S	S	*	*			trans	-67.7	120.3	166.8	177.3	0	0	0	0	106.4	V345	V343-V345 PolarHBondContact O-N 3.42Å
344	S	29	Very low	39.3	Very low	110 Å²	110	105.2 Å²	105.2	77%	0.769	60%	0.6	S	S	*	*			trans	-61.1	109	173.6	46.2	0	0	0	0	109.2	S342	S342-S344 PolarHBondContact O-N 3Å
345	V	27.3	Very low	41	Very low	112 Å²	112	103.4 Å²	103.4	68%	0.679	58%	0.584	S	S	*	*			trans	-59.8	136.9	169.3	178.3	0	0	0	0	107.7	V343 V347	V343-V345 PolarHBondContact O-N 3.42Å; V345-V347 WeakPolarHBondContact O-CG2 3.29Å; V345-V347 PolarHBondContact O-N 3.01Å
346	P	36.1	Very low	42.7	Very low	125 Å²	125	98.3 Å²	98.3	81%	0.812	58%	0.582	S	S	*	*			trans	-65.1	103.6	172	26.3	-33.4	0	0	0	109.3	G348	P346-G348 PolarHBondContact O-N 3.48Å; P346-G348 VanDerWaalsContact O-N 3.13Å
347	V	45.5	Very low	44.6	Very low	44 Å²	44	93.1 Å²	93.1	27%	0.267	56%	0.564	S	S	.	*			trans	-81.1	88.6	-179.4	-179	0	0	0	0	108.6	V345 S349 L350	V345-V347 WeakPolarHBondContact O-CG2 3.29Å; V345-V347 PolarHBondContact O-N 3.01Å; V347-S349 WeakPolarHBondContact CG1-O 3.5Å; V347-S349 PolarHBondContact O-N 3Å; V347-L350 HydrophobicContact CG1-CB 4.48Å
348	G	52.6	Low	47	Very low	48 Å²	48	82.6 Å²	82.6	50%	0.495	53%	0.525	S	S	.	.	S	Bend	trans	-69	-9.6	174.9	0	0	0	0	0	114.5	I254 P346	I254-G348 PolarHBondContact N-O 3.23Å; P346-G348 PolarHBondContact O-N 3.48Å; P346-G348 VanDerWaalsContact O-N 3.13Å
349	S	59.6	Low	49.4	Very low	39 Å²	39	81.6 Å²	81.6	27%	0.273	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	129	172.4	-175.7	0	0	0	0	111.1	Q251 I252 V347	Q251-S349 WeakPolarHBondContact CB-OG 3.38Å; Q251-S349 PolarHBondContact OE1-OG 3.4Å; I252-S349 CarbonylContact O-C 3.58Å; I252-S349 WeakPolarHBondContact O-CA 3.47Å; V347-S349 WeakPolarHBondContact CG1-O 3.5Å; V347-S349 PolarHBondContact O-N 3Å
350	L	69.1	Low	52.1	Low	9 Å²	9	76.8 Å²	76.8	5%	0.047	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	101.6	171.7	-179.3	66.9	0	0	0	110	Q251 I252 V347 L352 V376 H383 F385	Q251-L350 CarbonylContact C-O 3.57Å; Q251-L350 VanDerWaalsContact CA-O 3.27Å; Q251-L350 WeakPolarHBondContact CA-O 3.41Å; I252-L350 HydrophobicContact CB-CB 4.19Å; I252-L350 HydrophobicContact CD1-CD2 4.07Å; I252-L350 HydrophobicContact CG1-CB 4.45Å; I252-L350 PolarHBondContact N-O 2.93Å; I252-L350 PolarHBondContact O-N 2.97Å; V347-L350 HydrophobicContact CG1-CB 4.48Å; L350-L352 HydrophobicContact CD2-CD2 4.42Å; L350-L352 HydrophobicContact CG-CD2 4.35Å; L350-V376 HydrophobicContact CD2-CB 4.31Å; L350-V376 HydrophobicContact CD2-CG1 4.03Å; L350-H383 HydrophobicContact CD2-CB 4.46Å; L350-F385 HydrophobicContact CD2-CZ 4.48Å
351	D	64.9	Low	54.7	Low	51 Å²	51	68.4 Å²	68.4	27%	0.273	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	133.1	177.5	-161.4	-28.5	0	0	0	111.9	Q251 S353 N378	Q251-D351 HydrophobicContact CG-CB 4.13Å; Q251-D351 VanDerWaalsContact NE2-CG 3.29Å; Q251-D351 PolarHBondContact NE2-OD2 2.94Å; D351-S353 WeakPolarHBondContact OD1-CA 3.39Å; D351-S353 WeakPolarHBondContact OD1-CB 3.36Å; D351-S353 PolarHBondContact OD1-N 3.46Å; D351-S353 PolarHBondContact OD1-OG 2.97Å; D351-N378 PolarHBondContact O-ND2 2.81Å
352	L	69.4	Low	57.1	Low	1 Å²	1	63.3 Å²	63.3	1%	0.005	42%	0.418	C	S	.	.	S	Bend	trans	-111.5	-9.1	178.9	-46.2	167	0	0	0	112.1	L247 G250 I252 L350 T358 V376 L400 A403 A404	L247-L352 HydrophobicContact CD1-CD1 4.29Å; G250-L352 VanDerWaalsContact O-CB 3.29Å; G250-L352 WeakPolarHBondContact O-CB 3.42Å; G250-L352 WeakPolarHBondContact O-CG 3.34Å; G250-L352 PolarHBondContact O-N 3.05Å; G250-L352 VanDerWaalsContact O-N 3.17Å; I252-L352 HydrophobicContact CG1-CD1 4.32Å; L350-L352 HydrophobicContact CD2-CD2 4.42Å; L350-L352 HydrophobicContact CG-CD2 4.35Å; L352-T358 HydrophobicContact CD2-CG2 4.3Å; L352-V376 HydrophobicContact CD2-CG1 3.94Å; L352-L400 HydrophobicContact CD1-CB 4.12Å; L352-L400 HydrophobicContact CD1-CD2 3.48Å; L352-L400 VanDerWaalsContact CD1-CD2 3.48Å; L352-L400 HydrophobicContact CD1-CG 4.41Å; L352-A403 HydrophobicContact CD1-CB 4.22Å; L352-A404 HydrophobicContact CB-CB 4.35Å
353	S	59.6	Low	59.7	Low	78 Å²	78	57.5 Å²	57.5	55%	0.545	38%	0.377	S	S	.	.	S	Bend	trans	-86.2	-24	-173.3	73.7	0	0	0	0	113.5	D351	D351-S353 WeakPolarHBondContact OD1-CA 3.39Å; D351-S353 WeakPolarHBondContact OD1-CB 3.36Å; D351-S353 PolarHBondContact OD1-N 3.46Å; D351-S353 PolarHBondContact OD1-OG 2.97Å
354	A	53.8	Low	62.3	Low	76 Å²	76	53 Å²	53	63%	0.628	35%	0.347	S	S	*	.	S	Bend	trans	-81.9	-34.1	-177.8	0	0	0	0	0	113.7
355	D	58.4	Low	64.7	Low	40 Å²	40	49.6 Å²	49.6	21%	0.214	32%	0.324	C	S	.	.			trans	-102.5	99.3	-169.9	-98.7	11.5	0	0	0	112.2	S357 T358 S379	D355-S357 PolarHBondContact O-N 2.77Å; D355-T358 WeakPolarHBondContact CB-OG1 3.33Å; D355-T358 WeakPolarHBondContact O-CB 3.17Å; D355-T358 PolarHBondContact O-N 3.22Å; D355-T358 PolarHBondContact O-OG1 2.92Å; D355-S379 PolarHBondContact OD1-OG 3.23Å; D355-S379 WeakPolarHBondContact OD2-CB 3.28Å; D355-S379 PolarHBondContact OD2-N 3.37Å; D355-S379 PolarHBondContact OD2-OG 2.86Å
356	T	61	Low	67.1	Low	153 Å²	153	45.9 Å²	45.9	94%	0.939	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-3.3	170.4	59.2	0	0	0	0	113.8
357	S	65.4	Low	69.2	Low	58 Å²	58	40.9 Å²	40.9	41%	0.406	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-0.1	174.4	48.2	0	0	0	0	114.3	D355 V359	D355-S357 PolarHBondContact O-N 2.77Å; S357-V359 PolarHBondContact O-N 3.09Å
358	T	74.4	Confident	70.7	Confident	19 Å²	19	41.8 Å²	41.8	12%	0.117	27%	0.272	C	S	.	.			trans	-62.4	119.3	-178.7	-71.5	0	0	0	0	112	L352 D355 I360 V376 I377 N378	L352-T358 HydrophobicContact CD2-CG2 4.3Å; D355-T358 WeakPolarHBondContact CB-OG1 3.33Å; D355-T358 WeakPolarHBondContact O-CB 3.17Å; D355-T358 PolarHBondContact O-N 3.22Å; D355-T358 PolarHBondContact O-OG1 2.92Å; T358-I360 HydrophobicContact CG2-CD1 4.08Å; T358-I360 HydrophobicContact CG2-CG1 3.94Å; T358-V376 HydrophobicContact CG2-CG1 3.97Å; T358-I377 CarbonylContact C-O 3.59Å; T358-I377 VanDerWaalsContact CA-O 3.31Å; T358-I377 WeakPolarHBondContact CA-O 3.35Å; T358-N378 VanDerWaalsContact CG2-OD1 3.27Å; T358-N378 WeakPolarHBondContact CG2-OD1 3.5Å; T358-N378 VanDerWaalsContact OG1-CG 3.29Å; T358-N378 PolarHBondContact OG1-OD1 3.21Å
359	V	75	Confident	71.6	Confident	50 Å²	50	42.3 Å²	42.3	30%	0.303	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	115.9	176.5	178.1	0	0	0	0	109.2	S357 I377	S357-V359 PolarHBondContact O-N 3.09Å; V359-I377 HydrophobicContact CB-CB 4.35Å; V359-I377 HydrophobicContact CB-CD1 4.21Å; V359-I377 HydrophobicContact CB-CG1 4.31Å; V359-I377 HydrophobicContact CG1-CD1 4.22Å; V359-I377 PolarHBondContact N-O 3.47Å; V359-I377 PolarHBondContact O-N 3.35Å
360	I	81.5	Confident	72.1	Confident	9 Å²	9	43.7 Å²	43.7	5%	0.046	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	118.8	174.6	-58.8	148.1	0	0	0	108.1	T358 F374 E375 V376 I397 L400 R401	T358-I360 HydrophobicContact CG2-CD1 4.08Å; T358-I360 HydrophobicContact CG2-CG1 3.94Å; I360-F374 HydrophobicContact CG2-CD2 4.49Å; I360-E375 WeakPolarHBondContact CA-O 3.46Å; I360-V376 HydrophobicContact CG1-CG1 4.04Å; I360-V376 HydrophobicContact CG1-CG2 4.22Å; I360-V376 HydrophobicContact CG2-CG2 4.48Å; I360-I397 HydrophobicContact CG2-CB 4.35Å; I360-I397 HydrophobicContact CG2-CG1 4.3Å; I360-I397 HydrophobicContact CG2-CG2 4.22Å; I360-L400 VanDerWaalsContact CD1-C 3.5Å; I360-L400 HydrophobicContact CD1-CB 3.68Å; I360-L400 HydrophobicContact CG1-CB 4.41Å; I360-L400 HydrophobicContact CG2-CB 4.41Å; I360-R401 HydrophobicContact CB-CG 4.08Å; I360-R401 HydrophobicContact CD1-CG 3.89Å; I360-R401 HydrophobicContact CG2-CG 4.45Å; I360-R401 PolarHBondContact O-NE 2.91Å; I360-R401 PolarHBondContact O-NH2 3.39Å
361	R	80.1	Confident	72.4	Confident	17 Å²	17	47.4 Å²	47.4	6%	0.064	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	149.6	-175.8	69.9	-178.9	-171.9	96.6	-3.6	113	F374 E375	R361-F374 WeakPolarHBondContact O-CA 3.47Å; R361-F374 WeakPolarHBondContact O-CB 3.45Å; R361-E375 HydrophobicContact CG-CG 3.61Å; R361-E375 IonicContact CZ-OE1 3.23Å; R361-E375 IonicContact CZ-OE2 2.76Å; R361-E375 PolarHBondContact N-O 3.36Å; R361-E375 IonicContact NE-OE1 2.73Å; R361-E375 PolarHBondContact NE-OE1 3.11Å; R361-E375 IonicContact NE-OE2 2.71Å; R361-E375 IonicContact NH2-OE1 3.19Å; R361-E375 PolarHBondContact NH2-OE1 3.28Å; R361-E375 IonicContact NH2-OE2 3.62Å; R361-E375 PolarHBondContact NH2-OE2 2.8Å; R361-E375 PolarHBondContact O-N 3.39Å
362	P	81.3	Confident	73.2	Confident	37 Å²	37	46.8 Å²	46.8	24%	0.24	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	147.2	169.6	28.9	-34	0	0	0	110.6	I397	P362-I397 HydrophobicContact CB-CD1 3.76Å; P362-I397 HydrophobicContact CG-CD1 4.36Å
363	V	82.4	Confident	74	Confident	3 Å²	3	46.8 Å²	46.8	2%	0.018	29%	0.29	C	S	.	.			trans	-108.8	125.4	175	178.8	0	0	0	0	108.6	S365 I367 L368 C373 E375	V363-S365 PolarHBondContact O-N 3.46Å; V363-I367 HydrophobicContact CG1-CB 3.93Å; V363-I367 HydrophobicContact CG1-CD1 4.2Å; V363-I367 HydrophobicContact CG1-CG2 4.15Å; V363-L368 HydrophobicContact CB-CD1 4.35Å; V363-L368 HydrophobicContact CG1-CD1 3.74Å; V363-L368 HydrophobicContact CG1-CG 3.89Å; V363-C373 HydrophobicContact CB-CB 4.06Å; V363-C373 PolarHBondContact N-O 3.13Å; V363-E375 HydrophobicContact CG2-CB 3.71Å; V363-E375 HydrophobicContact CG2-CG 3.62Å; V363-E375 VanDerWaalsContact CG2-OE2 3.29Å; V363-E375 WeakPolarHBondContact CG2-OE2 3.45Å
364	H	82.3	Confident	75.2	Confident	33 Å²	33	43.1 Å²	43.1	15%	0.153	26%	0.264	C	S	.	.			trans	-67.6	135.6	178.1	-166.1	-95.7	0	0	0	110.5	S366 I367 F445 A446 F492	H364-S366 PolarHBondContact ND1-OG 2.99Å; H364-S366 PolarHBondContact O-N 3.02Å; H364-I367 WeakPolarHBondContact O-CB 3.36Å; H364-I367 PolarHBondContact O-N 2.92Å; H364-F445 WeakPolarHBondContact CB-O 3.43Å; H364-A446 HydrophobicContact CB-CB 4.04Å; H364-F492 AromaticContact CE1-CD1 3.78Å; H364-F492 AromaticContact CE1-CE1 3.6Å; H364-F492 AromaticContact NE2-CD1 3.64Å; H364-F492 AromaticContact NE2-CE1 3.91Å
365	S	78.1	Confident	76.7	Confident	40 Å²	40	39.7 Å²	39.7	28%	0.28	24%	0.235	S	C	.	.	H	α-helix	trans	-55.1	-32.7	-171.6	53.9	0	0	0	0	114	V363 I367 L368 G369 E370	V363-S365 PolarHBondContact O-N 3.46Å; S365-I367 PolarHBondContact O-N 2.98Å; S365-I367 VanDerWaalsContact O-N 3.13Å; S365-L368 PolarHBondContact O-N 3.01Å; S365-G369 CarbonylContact O-C 3.58Å; S365-G369 WeakPolarHBondContact O-CA 3.27Å; S365-G369 PolarHBondContact O-N 3.44Å; S365-E370 WeakPolarHBondContact CA-O 3.45Å; S365-E370 WeakPolarHBondContact CB-O 3.19Å
366	S	78.5	Confident	77.9	Confident	33 Å²	33	37.8 Å²	37.8	23%	0.231	23%	0.225	C	C	.	.	H	α-helix	trans	-69.2	-1.8	176.1	72.9	0	0	0	0	115.6	H364 R447	H364-S366 PolarHBondContact ND1-OG 2.99Å; H364-S366 PolarHBondContact O-N 3.02Å; S366-R447 WeakPolarHBondContact CB-O 3.35Å; S366-R447 PolarHBondContact O-NH1 2.93Å; S366-R447 VanDerWaalsContact O-NH1 3.11Å; S366-R447 PolarHBondContact OG-N 3.14Å; S366-R447 PolarHBondContact OG-O 3.42Å
367	I	79.9	Confident	78.8	Confident	20 Å²	20	31.1 Å²	31.1	10%	0.103	18%	0.183	C	C	.	.	H	α-helix	trans	-86	-55.1	171.1	-66.1	-179.8	0	0	0	110.3	P233 V363 H364 S365 L444 F445 R447	P233-I367 HydrophobicContact CG-CG2 4.47Å; V363-I367 HydrophobicContact CG1-CB 3.93Å; V363-I367 HydrophobicContact CG1-CD1 4.2Å; V363-I367 HydrophobicContact CG1-CG2 4.15Å; H364-I367 WeakPolarHBondContact O-CB 3.36Å; H364-I367 PolarHBondContact O-N 2.92Å; S365-I367 PolarHBondContact O-N 2.98Å; S365-I367 VanDerWaalsContact O-N 3.13Å; I367-L444 HydrophobicContact CD1-CG 4.31Å; I367-L444 HydrophobicContact CG1-CD2 4.38Å; I367-L444 HydrophobicContact CG1-CG 4.39Å; I367-F445 WeakPolarHBondContact CD1-O 3.46Å; I367-R447 PolarHBondContact O-NH1 3.14Å
368	L	77	Confident	79.3	Confident	63 Å²	63	29.4 Å²	29.4	33%	0.33	17%	0.17	S	C	.	.	H	α-helix	trans	-95.9	-25.3	-172.2	-63	175.3	0	0	0	113.6	L239 V363 S365 C373 C384	L239-L368 HydrophobicContact CD1-CD1 4.26Å; V363-L368 HydrophobicContact CB-CD1 4.35Å; V363-L368 HydrophobicContact CG1-CD1 3.74Å; V363-L368 HydrophobicContact CG1-CG 3.89Å; S365-L368 PolarHBondContact O-N 3.01Å; L368-C373 HydrophobicContact CD1-CB 3.74Å; L368-C384 HydrophobicContact CD1-CB 4.24Å
369	G	70.9	Confident	79	Confident	60 Å²	60	31.5 Å²	31.5	62%	0.619	19%	0.185	S	C	*	.	S	Bend	trans	106.6	-30.2	-176.5	0	0	0	0	0	113.4	S365	S365-G369 CarbonylContact O-C 3.58Å; S365-G369 WeakPolarHBondContact O-CA 3.27Å; S365-G369 PolarHBondContact O-N 3.44Å
370	E	72	Confident	78.5	Confident	67 Å²	67	37.2 Å²	37.2	31%	0.313	21%	0.208	S	C	.	.	S	Bend	trans	-90.8	162.4	-178.6	-62.5	-45.6	135.3	0	0	114.2	L239 W263 R265 S365	L239-E370 HydrophobicContact CD2-CG 4.21Å; W263-E370 HydrophobicContact CH2-CG 4.03Å; W263-E370 HydrophobicContact CZ3-CG 3.47Å; W263-E370 VanDerWaalsContact CZ3-CG 3.47Å; R265-E370 IonicContact NH1-OE1 2.61Å; S365-E370 WeakPolarHBondContact CA-O 3.45Å; S365-E370 WeakPolarHBondContact CB-O 3.19Å
371	K	75.2	Confident	77.9	Confident	87 Å²	87	40.6 Å²	40.6	38%	0.378	23%	0.227	S	C	.	.	S	Bend	trans	-82.3	156.2	171.8	-61.3	-171.9	-179.4	-173.1	0	110.5	C373 L781	K371-C373 VanDerWaalsContact C-N 3.33Å; K371-C373 PolarHBondContact O-N 3.06Å; K371-L781 PolarHBondContact NZ-O 3.4Å
372	Y	81.9	Confident	77.7	Confident	39 Å²	39	42.2 Å²	42.2	15%	0.153	24%	0.238	C	C	.	.	S	Bend	trans	58.3	28.6	166.8	-38.4	-53.6	0	0	0	117.3	C387 S389 A390 R393	Y372-C387 WeakPolarHBondContact O-CB 3.4Å; Y372-C387 PolarHBondContact O-SG 3.31Å; Y372-C387 VanDerWaalsContact O-SG 3.4Å; Y372-S389 WeakPolarHBondContact CB-O 3.33Å; Y372-S389 VanDerWaalsContact CG-C 3.45Å; Y372-A390 HydrophobicContact CD1-CB 3.62Å; Y372-A390 HydrophobicContact CE1-CB 3.78Å; Y372-A390 HydrophobicContact CG-CB 4.45Å; Y372-R393 WeakPolarHBondContact O-CB 3.21Å; Y372-R393 WeakPolarHBondContact O-CD 3.47Å; Y372-R393 VanDerWaalsContact O-CG 3.26Å; Y372-R393 WeakPolarHBondContact O-CG 3.31Å
373	C	85.3	Confident	77.7	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.007	23%	0.231	C	C	.	.			trans	-77.2	154.3	173.9	-56.1	0	0	0	0	113.9	V363 L368 K371 F385 R393	V363-C373 HydrophobicContact CB-CB 4.06Å; V363-C373 PolarHBondContact N-O 3.13Å; L368-C373 HydrophobicContact CD1-CB 3.74Å; K371-C373 VanDerWaalsContact C-N 3.33Å; K371-C373 PolarHBondContact O-N 3.06Å; C373-F385 CarbonylContact C-O 3.55Å; C373-F385 WeakPolarHBondContact CA-O 3.38Å; C373-F385 WeakPolarHBondContact CB-O 3.41Å; C373-R393 VanDerWaalsContact O-CD 3.23Å; C373-R393 WeakPolarHBondContact O-CD 3.42Å
374	F	85.4	Confident	77.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	166	163.7	72.2	-92.6	0	0	0	111.5	I242 I360 R361 V376 C384 F385 R393 W396 I397 L400	I242-F374 HydrophobicContact CD1-CE1 4.03Å; I242-F374 HydrophobicContact CD1-CZ 3.63Å; I242-F374 HydrophobicContact CG1-CE1 4.05Å; I242-F374 HydrophobicContact CG1-CZ 4.13Å; I360-F374 HydrophobicContact CG2-CD2 4.49Å; R361-F374 WeakPolarHBondContact O-CA 3.47Å; R361-F374 WeakPolarHBondContact O-CB 3.45Å; F374-V376 HydrophobicContact CD2-CG2 4.08Å; F374-V376 HydrophobicContact CE2-CG2 3.73Å; F374-C384 WeakPolarHBondContact O-CA 3.49Å; F374-F385 HydrophobicContact CD1-CB 4.02Å; F374-F385 HydrophobicContact CD2-CB 4.35Å; F374-F385 HydrophobicContact CD2-CD2 4.1Å; F374-F385 HydrophobicContact CE1-CB 3.62Å; F374-F385 HydrophobicContact CE1-CG 4.35Å; F374-F385 HydrophobicContact CE2-CB 3.98Å; F374-F385 AromaticContact CE2-CD2 3.51Å; F374-F385 HydrophobicContact CE2-CD2 3.51Å; F374-F385 HydrophobicContact CE2-CE2 4.29Å; F374-F385 AromaticContact CE2-CG 3.97Å; F374-F385 HydrophobicContact CE2-CG 3.97Å; F374-F385 HydrophobicContact CG-CB 4.37Å; F374-F385 HydrophobicContact CZ-CB 3.61Å; F374-F385 AromaticContact CZ-CD2 3.85Å; F374-F385 HydrophobicContact CZ-CD2 3.85Å; F374-F385 AromaticContact CZ-CG 3.82Å; F374-F385 HydrophobicContact CZ-CG 3.82Å; F374-F385 PolarHBondContact N-O 2.78Å; F374-F385 PolarHBondContact O-N 2.88Å; F374-R393 HydrophobicContact CB-CG 4.04Å; F374-R393 HydrophobicContact CD1-CG 3.99Å; F374-R393 HydrophobicContact CG-CG 4.49Å; F374-W396 HydrophobicContact CE1-CB 3.71Å; F374-W396 HydrophobicContact CE1-CG 4.34Å; F374-W396 HydrophobicContact CZ-CB 3.92Å; F374-I397 HydrophobicContact CB-CD1 3.75Å; F374-I397 HydrophobicContact CB-CG1 3.63Å; F374-I397 HydrophobicContact CD1-CG1 4.38Å; F374-I397 HydrophobicContact CD2-CG1 4.28Å; F374-I397 HydrophobicContact CG-CD1 4.48Å; F374-I397 HydrophobicContact CG-CG1 3.89Å; F374-L400 HydrophobicContact CD2-CD1 4.39Å; F374-L400 HydrophobicContact CE2-CD1 3.36Å; F374-L400 HydrophobicContact CZ-CD1 3.62Å
375	E	85.1	Confident	77.9	Confident	5 Å²	5	39.6 Å²	39.6	2%	0.023	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	146.4	172.9	67.8	-177.6	-127.7	0	0	111.7	I360 R361 V363 I377 H383	I360-E375 WeakPolarHBondContact CA-O 3.46Å; R361-E375 HydrophobicContact CG-CG 3.61Å; R361-E375 IonicContact CZ-OE1 3.23Å; R361-E375 IonicContact CZ-OE2 2.76Å; R361-E375 PolarHBondContact N-O 3.36Å; R361-E375 IonicContact NE-OE1 2.73Å; R361-E375 PolarHBondContact NE-OE1 3.11Å; R361-E375 IonicContact NE-OE2 2.71Å; R361-E375 IonicContact NH2-OE1 3.19Å; R361-E375 PolarHBondContact NH2-OE1 3.28Å; R361-E375 IonicContact NH2-OE2 3.62Å; R361-E375 PolarHBondContact NH2-OE2 2.8Å; R361-E375 PolarHBondContact O-N 3.39Å; V363-E375 HydrophobicContact CG2-CB 3.71Å; V363-E375 HydrophobicContact CG2-CG 3.62Å; V363-E375 VanDerWaalsContact CG2-OE2 3.29Å; V363-E375 WeakPolarHBondContact CG2-OE2 3.45Å; E375-I377 HydrophobicContact CG-CG1 4.28Å; E375-I377 WeakPolarHBondContact OE1-CD1 3.39Å; E375-H383 CarbonylContact C-O 3.56Å; E375-H383 VanDerWaalsContact CA-O 3.24Å; E375-H383 WeakPolarHBondContact CA-O 3.16Å
376	V	83.7	Confident	78.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	122.9	172.9	-174.2	0	0	0	0	107.4	L350 L352 T358 I360 F374 H383 F385 L400	L350-V376 HydrophobicContact CD2-CB 4.31Å; L350-V376 HydrophobicContact CD2-CG1 4.03Å; L352-V376 HydrophobicContact CD2-CG1 3.94Å; T358-V376 HydrophobicContact CG2-CG1 3.97Å; I360-V376 HydrophobicContact CG1-CG1 4.04Å; I360-V376 HydrophobicContact CG1-CG2 4.22Å; I360-V376 HydrophobicContact CG2-CG2 4.48Å; F374-V376 HydrophobicContact CD2-CG2 4.08Å; F374-V376 HydrophobicContact CE2-CG2 3.73Å; V376-H383 PolarHBondContact N-O 2.94Å; V376-H383 PolarHBondContact O-N 3.11Å; V376-F385 HydrophobicContact CB-CE2 4.27Å; V376-F385 HydrophobicContact CG2-CD2 4.12Å; V376-F385 HydrophobicContact CG2-CE2 3.77Å; V376-L400 HydrophobicContact CG2-CD1 4.21Å
377	I	78.6	Confident	78.5	Confident	12 Å²	12	37.4 Å²	37.4	6%	0.062	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	110.8	-178.4	-26.5	173.2	0	0	0	108.7	W231 T358 V359 E375 T382	W231-I377 HydrophobicContact CE3-CD1 3.69Å; W231-I377 HydrophobicContact CE3-CG2 4.04Å; W231-I377 HydrophobicContact CZ3-CB 4.02Å; W231-I377 HydrophobicContact CZ3-CD1 3.82Å; W231-I377 HydrophobicContact CZ3-CG2 3.63Å; T358-I377 CarbonylContact C-O 3.59Å; T358-I377 VanDerWaalsContact CA-O 3.31Å; T358-I377 WeakPolarHBondContact CA-O 3.35Å; V359-I377 HydrophobicContact CB-CB 4.35Å; V359-I377 HydrophobicContact CB-CD1 4.21Å; V359-I377 HydrophobicContact CB-CG1 4.31Å; V359-I377 HydrophobicContact CG1-CD1 4.22Å; V359-I377 PolarHBondContact N-O 3.47Å; V359-I377 PolarHBondContact O-N 3.35Å; E375-I377 HydrophobicContact CG-CG1 4.28Å; E375-I377 WeakPolarHBondContact OE1-CD1 3.39Å; I377-T382 HydrophobicContact CG1-CG2 4.3Å; I377-T382 HydrophobicContact CG2-CG2 4.13Å; I377-T382 WeakPolarHBondContact CG2-OG1 3.43Å
378	N	76.6	Confident	78.3	Confident	23 Å²	23	40.8 Å²	40.8	12%	0.123	23%	0.234	C	C	.	.			trans	-96.4	-179.9	173.4	-75	16.2	0	0	0	109.8	D351 T358 E380 N381	D351-N378 PolarHBondContact O-ND2 2.81Å; T358-N378 VanDerWaalsContact CG2-OD1 3.27Å; T358-N378 WeakPolarHBondContact CG2-OD1 3.5Å; T358-N378 VanDerWaalsContact OG1-CG 3.29Å; T358-N378 PolarHBondContact OG1-OD1 3.21Å; N378-E380 VanDerWaalsContact C-N 3.26Å; N378-E380 PolarHBondContact O-N 3.37Å; N378-N381 PolarHBondContact N-O 3.19Å
379	S	67.9	Low	78.2	Confident	63 Å²	63	39.4 Å²	39.4	44%	0.441	23%	0.23	S	C	.	.	S	Bend	trans	-63.4	-29.6	177	60.8	0	0	0	0	113.5	D355	D355-S379 PolarHBondContact OD1-OG 3.23Å; D355-S379 WeakPolarHBondContact OD2-CB 3.28Å; D355-S379 PolarHBondContact OD2-N 3.37Å; D355-S379 PolarHBondContact OD2-OG 2.86Å
380	E	64	Low	78.3	Confident	170 Å²	170	37.8 Å²	37.8	79%	0.794	21%	0.211	S	C	*	.	S	Bend	trans	-101.3	-39	-177.7	-56.8	-166.4	150.5	0	0	114.3	N378	N378-E380 VanDerWaalsContact C-N 3.26Å; N378-E380 PolarHBondContact O-N 3.37Å
381	N	69.9	Low	78.3	Confident	80 Å²	80	35.9 Å²	35.9	43%	0.428	21%	0.207	S	C	.	.			trans	-134.7	161.3	-167.5	-69.2	-47	0	0	0	113.9	N378	N378-N381 PolarHBondContact N-O 3.19Å
382	T	76.2	Confident	78.5	Confident	51 Å²	51	33 Å²	33	31%	0.313	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	126.3	170.4	-48.2	0	0	0	0	109.9	I377	I377-T382 HydrophobicContact CG1-CG2 4.3Å; I377-T382 HydrophobicContact CG2-CG2 4.13Å; I377-T382 WeakPolarHBondContact CG2-OG1 3.43Å
383	H	80.8	Confident	78.6	Confident	18 Å²	18	33.3 Å²	33.3	8%	0.083	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	131.1	178.8	-64.2	-102.3	0	0	0	110.1	L350 E375 V376 F385	L350-H383 HydrophobicContact CD2-CB 4.46Å; E375-H383 CarbonylContact C-O 3.56Å; E375-H383 VanDerWaalsContact CA-O 3.24Å; E375-H383 WeakPolarHBondContact CA-O 3.16Å; V376-H383 PolarHBondContact N-O 2.94Å; V376-H383 PolarHBondContact O-N 3.11Å; H383-F385 HydrophobicContact CB-CD2 4.44Å; H383-F385 HydrophobicContact CB-CE2 3.57Å; H383-F385 HydrophobicContact CB-CZ 3.86Å
384	C	85.1	Confident	78.4	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	135.7	173.4	-72.7	0	0	0	0	110	V237 L239 W240 L368 F374	V237-C384 HydrophobicContact CG1-CB 3.96Å; L239-C384 HydrophobicContact CD1-CB 4.02Å; W240-C384 PolarHBondContact N-O 3.23Å; L368-C384 HydrophobicContact CD1-CB 4.24Å; F374-C384 WeakPolarHBondContact O-CA 3.49Å
385	F	84.8	Confident	78.1	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	136.8	-179.7	-61.3	-88	0	0	0	110.4	W240 I242 I252 L350 C373 F374 V376 H383	W240-F385 HydrophobicContact CB-CD1 3.68Å; W240-F385 HydrophobicContact CB-CE1 3.91Å; W240-F385 HydrophobicContact CG-CD1 4.49Å; W240-F385 HydrophobicContact CG-CE1 4.31Å; W240-F385 CarbonylContact O-C 3.49Å; W240-F385 WeakPolarHBondContact O-CA 3.48Å; I242-F385 HydrophobicContact CD1-CB 4.05Å; I242-F385 HydrophobicContact CD1-CD1 3.51Å; I242-F385 HydrophobicContact CD1-CE1 4.12Å; I242-F385 HydrophobicContact CD1-CG 3.86Å; I252-F385 HydrophobicContact CD1-CE1 4.46Å; I252-F385 HydrophobicContact CD1-CE2 4.07Å; I252-F385 HydrophobicContact CD1-CZ 3.8Å; L350-F385 HydrophobicContact CD2-CZ 4.48Å; C373-F385 CarbonylContact C-O 3.55Å; C373-F385 WeakPolarHBondContact CA-O 3.38Å; C373-F385 WeakPolarHBondContact CB-O 3.41Å; F374-F385 HydrophobicContact CD1-CB 4.02Å; F374-F385 HydrophobicContact CD2-CB 4.35Å; F374-F385 HydrophobicContact CD2-CD2 4.1Å; F374-F385 HydrophobicContact CE1-CB 3.62Å; F374-F385 HydrophobicContact CE1-CG 4.35Å; F374-F385 HydrophobicContact CE2-CB 3.98Å; F374-F385 AromaticContact CE2-CD2 3.51Å; F374-F385 HydrophobicContact CE2-CD2 3.51Å; F374-F385 HydrophobicContact CE2-CE2 4.29Å; F374-F385 AromaticContact CE2-CG 3.97Å; F374-F385 HydrophobicContact CE2-CG 3.97Å; F374-F385 HydrophobicContact CG-CB 4.37Å; F374-F385 HydrophobicContact CZ-CB 3.61Å; F374-F385 AromaticContact CZ-CD2 3.85Å; F374-F385 HydrophobicContact CZ-CD2 3.85Å; F374-F385 AromaticContact CZ-CG 3.82Å; F374-F385 HydrophobicContact CZ-CG 3.82Å; F374-F385 PolarHBondContact N-O 2.78Å; F374-F385 PolarHBondContact O-N 2.88Å; V376-F385 HydrophobicContact CB-CE2 4.27Å; V376-F385 HydrophobicContact CG2-CD2 4.12Å; V376-F385 HydrophobicContact CG2-CE2 3.77Å; H383-F385 HydrophobicContact CB-CD2 4.44Å; H383-F385 HydrophobicContact CB-CE2 3.57Å; H383-F385 HydrophobicContact CB-CZ 3.86Å
386	G	84.4	Confident	77.9	Confident	12 Å²	12	41.3 Å²	41.3	12%	0.124	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	149.5	170.9	0	0	0	0	0	110.8	W240 I242	W240-G386 PolarHBondContact O-N 3.26Å; I242-G386 WeakPolarHBondContact CB-O 3.34Å; I242-G386 VanDerWaalsContact CG2-O 3.3Å; I242-G386 WeakPolarHBondContact CG2-O 3.49Å; I242-G386 PolarHBondContact N-O 3.48Å; I242-G386 VanDerWaalsContact N-O 3.1Å
387	C	82.9	Confident	77.8	Confident	15 Å²	15	41.6 Å²	41.6	10%	0.101	23%	0.232	C	C	.	.			trans	-131.8	151.6	179.3	-51.3	0	0	0	0	109.7	I242 Y372 S389 E392 R393	I242-C387 HydrophobicContact CG2-CB 4.19Å; Y372-C387 WeakPolarHBondContact O-CB 3.4Å; Y372-C387 PolarHBondContact O-SG 3.31Å; Y372-C387 VanDerWaalsContact O-SG 3.4Å; C387-S389 VanDerWaalsContact C-N 3.28Å; C387-S389 PolarHBondContact O-N 3.15Å; C387-E392 HydrophobicContact CB-CB 4.37Å; C387-E392 HydrophobicContact CB-CG 4.09Å; C387-R393 HydrophobicContact CB-CB 4Å; C387-R393 VanDerWaalsContact SG-CA 3.54Å
388	S	76.6	Confident	77.8	Confident	90 Å²	90	41.4 Å²	41.4	63%	0.629	23%	0.231	S	C	*	.	S	Bend	trans	-64.5	-31.2	173.8	69.9	0	0	0	0	112.8	E392	S388-E392 WeakPolarHBondContact CA-OE2 3.24Å; S388-E392 VanDerWaalsContact CB-OE2 3.3Å; S388-E392 WeakPolarHBondContact CB-OE2 3.3Å; S388-E392 PolarHBondContact N-OE2 3.09Å; S388-E392 PolarHBondContact OG-OE2 2.87Å
389	S	74.4	Confident	78	Confident	35 Å²	35	42.9 Å²	42.9	25%	0.245	24%	0.238	C	C	.	.	S	Bend	trans	-146.1	162.2	-173.9	73.4	0	0	0	0	113.9	Y372 C387 A391 E392 R393	Y372-S389 WeakPolarHBondContact CB-O 3.33Å; Y372-S389 VanDerWaalsContact CG-C 3.45Å; C387-S389 VanDerWaalsContact C-N 3.28Å; C387-S389 PolarHBondContact O-N 3.15Å; S389-A391 VanDerWaalsContact C-N 3.34Å; S389-E392 VanDerWaalsContact OG-CB 3.3Å; S389-E392 WeakPolarHBondContact OG-CB 3.48Å; S389-E392 PolarHBondContact OG-N 2.66Å; S389-E392 VanDerWaalsContact OG-N 3.13Å; S389-R393 PolarHBondContact O-N 2.89Å
390	A	74.1	Confident	78.6	Confident	26 Å²	26	39.9 Å²	39.9	22%	0.215	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-38.4	173.7	0	0	0	0	0	112.5	Y372 R393 D394	Y372-A390 HydrophobicContact CD1-CB 3.62Å; Y372-A390 HydrophobicContact CE1-CB 3.78Å; Y372-A390 HydrophobicContact CG-CB 4.45Å; A390-R393 PolarHBondContact O-N 3.47Å; A390-D394 WeakPolarHBondContact O-CB 3.3Å; A390-D394 VanDerWaalsContact O-CG 3.27Å; A390-D394 PolarHBondContact O-N 3.36Å
391	A	72.4	Confident	79.3	Confident	27 Å²	27	33.4 Å²	33.4	22%	0.223	19%	0.186	C	C	.	.	H	α-helix	trans	-67.5	-41.6	-179.8	0	0	0	0	0	111.6	S389 D394 R395 D851	S389-A391 VanDerWaalsContact C-N 3.34Å; A391-D394 PolarHBondContact O-N 2.82Å; A391-R395 VanDerWaalsContact O-CB 3.29Å; A391-R395 WeakPolarHBondContact O-CB 3.48Å; A391-R395 PolarHBondContact O-N 3.33Å; A391-D851 VanDerWaalsContact CB-OD1 3.3Å; A391-D851 WeakPolarHBondContact CB-OD1 3.47Å
392	E	79.1	Confident	79.7	Confident	25 Å²	25	33.3 Å²	33.3	12%	0.117	18%	0.179	C	C	.	.	H	α-helix	trans	-60.6	-48.3	171.3	176.8	176.2	-130.1	0	0	111.8	I242 C387 S388 S389 D394 R395 W396	I242-E392 HydrophobicContact CG2-CG 4.28Å; C387-E392 HydrophobicContact CB-CB 4.37Å; C387-E392 HydrophobicContact CB-CG 4.09Å; S388-E392 WeakPolarHBondContact CA-OE2 3.24Å; S388-E392 VanDerWaalsContact CB-OE2 3.3Å; S388-E392 WeakPolarHBondContact CB-OE2 3.3Å; S388-E392 PolarHBondContact N-OE2 3.09Å; S388-E392 PolarHBondContact OG-OE2 2.87Å; S389-E392 VanDerWaalsContact OG-CB 3.3Å; S389-E392 WeakPolarHBondContact OG-CB 3.48Å; S389-E392 PolarHBondContact OG-N 2.66Å; S389-E392 VanDerWaalsContact OG-N 3.13Å; E392-D394 VanDerWaalsContact C-N 3.33Å; E392-D394 PolarHBondContact O-N 3.09Å; E392-R395 PolarHBondContact O-N 3.35Å; E392-W396 PolarHBondContact O-N 3.3Å
393	R	84.1	Confident	79.7	Confident	46 Å²	46	32.2 Å²	32.2	17%	0.174	18%	0.175	C	C	.	.	H	α-helix	trans	-55.2	-48.6	175.8	-175.9	-155.1	61.3	-154.1	-10.1	111.7	Y372 C373 F374 C387 S389 A390 W396 I397	Y372-R393 WeakPolarHBondContact O-CB 3.21Å; Y372-R393 WeakPolarHBondContact O-CD 3.47Å; Y372-R393 VanDerWaalsContact O-CG 3.26Å; Y372-R393 WeakPolarHBondContact O-CG 3.31Å; C373-R393 VanDerWaalsContact O-CD 3.23Å; C373-R393 WeakPolarHBondContact O-CD 3.42Å; F374-R393 HydrophobicContact CB-CG 4.04Å; F374-R393 HydrophobicContact CD1-CG 3.99Å; F374-R393 HydrophobicContact CG-CG 4.49Å; C387-R393 HydrophobicContact CB-CB 4Å; C387-R393 VanDerWaalsContact SG-CA 3.54Å; S389-R393 PolarHBondContact O-N 2.89Å; A390-R393 PolarHBondContact O-N 3.47Å; R393-W396 PolarHBondContact O-N 2.97Å; R393-I397 HydrophobicContact CG-CD1 3.78Å; R393-I397 HydrophobicContact CG-CG1 4.44Å; R393-I397 WeakPolarHBondContact O-CB 3.29Å; R393-I397 VanDerWaalsContact O-CG1 3.23Å; R393-I397 WeakPolarHBondContact O-CG1 3.21Å; R393-I397 PolarHBondContact O-N 3.15Å
394	D	80	Confident	79.4	Confident	65 Å²	65	32.9 Å²	32.9	35%	0.348	18%	0.184	S	C	.	.	H	α-helix	trans	-74.8	-29.6	-174.2	-67.4	-21.7	0	0	0	112.3	A390 A391 E392 E398	A390-D394 WeakPolarHBondContact O-CB 3.3Å; A390-D394 VanDerWaalsContact O-CG 3.27Å; A390-D394 PolarHBondContact O-N 3.36Å; A391-D394 PolarHBondContact O-N 2.82Å; E392-D394 VanDerWaalsContact C-N 3.33Å; E392-D394 PolarHBondContact O-N 3.09Å; D394-E398 PolarHBondContact O-N 3.12Å
395	R	78.6	Confident	78.8	Confident	73 Å²	73	37.6 Å²	37.6	28%	0.275	21%	0.206	S	C	.	.	H	α-helix	trans	-62.4	-55.3	166.5	-175.2	-171.6	-48.3	118.4	19.4	110.9	A391 E392 I397 E398 D399 D851	A391-R395 VanDerWaalsContact O-CB 3.29Å; A391-R395 WeakPolarHBondContact O-CB 3.48Å; A391-R395 PolarHBondContact O-N 3.33Å; E392-R395 PolarHBondContact O-N 3.35Å; R395-I397 PolarHBondContact O-N 3.07Å; R395-E398 PolarHBondContact O-N 3.13Å; R395-E398 VanDerWaalsContact O-N 3.1Å; R395-D399 VanDerWaalsContact CG-OD2 3.3Å; R395-D399 WeakPolarHBondContact CG-OD2 3.25Å; R395-D399 WeakPolarHBondContact O-CB 3.19Å; R395-D399 PolarHBondContact O-N 2.89Å; R395-D851 IonicContact CZ-OD2 3.95Å; R395-D851 PolarHBondContact NE-O 2.87Å; R395-D851 VanDerWaalsContact NH2-CB 3.3Å; R395-D851 PolarHBondContact NH2-O 2.9Å; R395-D851 IonicContact NH2-OD1 2.63Å; R395-D851 IonicContact NH2-OD2 3.09Å; R395-D851 PolarHBondContact NH2-OD2 3.29Å
396	W	82.5	Confident	78.2	Confident	37 Å²	37	42.1 Å²	42.1	14%	0.14	24%	0.236	C	C	.	.	H	α-helix	trans	-58.1	-46.8	178.7	-88.5	105.6	0	0	0	112.2	I242 C245 L247 F374 E392 R393 E398 D399 L400	I242-W396 HydrophobicContact CD1-CD2 3.99Å; I242-W396 HydrophobicContact CD1-CE3 4.03Å; I242-W396 HydrophobicContact CD1-CG 4.48Å; I242-W396 HydrophobicContact CD1-CH2 4.38Å; I242-W396 HydrophobicContact CD1-CZ2 4.34Å; I242-W396 HydrophobicContact CD1-CZ3 4.22Å; I242-W396 HydrophobicContact CG1-CD2 3.5Å; I242-W396 HydrophobicContact CG1-CE3 4.07Å; I242-W396 HydrophobicContact CG1-CG 3.74Å; I242-W396 HydrophobicContact CG1-CH2 4.34Å; I242-W396 HydrophobicContact CG1-CZ2 3.82Å; I242-W396 HydrophobicContact CG1-CZ3 4.45Å; C245-W396 HydrophobicContact CB-CH2 4.07Å; C245-W396 HydrophobicContact CB-CZ2 4.41Å; C245-W396 WeakPolarHBondContact O-CH2 3.29Å; C245-W396 WeakPolarHBondContact O-CZ2 3.45Å; L247-W396 HydrophobicContact CB-CH2 4.25Å; L247-W396 HydrophobicContact CB-CZ3 3.94Å; F374-W396 HydrophobicContact CE1-CB 3.71Å; F374-W396 HydrophobicContact CE1-CG 4.34Å; F374-W396 HydrophobicContact CZ-CB 3.92Å; E392-W396 PolarHBondContact O-N 3.3Å; R393-W396 PolarHBondContact O-N 2.97Å; W396-E398 VanDerWaalsContact C-N 3.26Å; W396-E398 PolarHBondContact O-N 3.34Å; W396-D399 PolarHBondContact O-N 3.26Å; W396-L400 HydrophobicContact CE3-CD1 4.12Å; W396-L400 HydrophobicContact CE3-CD2 4.09Å; W396-L400 HydrophobicContact CE3-CG 4.02Å; W396-L400 HydrophobicContact CZ3-CD2 4.19Å; W396-L400 VanDerWaalsContact O-CB 3.25Å; W396-L400 WeakPolarHBondContact O-CB 3.37Å; W396-L400 WeakPolarHBondContact O-CD1 3.39Å; W396-L400 WeakPolarHBondContact O-CG 3.26Å; W396-L400 PolarHBondContact O-N 3.45Å
397	I	81.9	Confident	77.6	Confident	6 Å²	6	46.4 Å²	46.4	3%	0.031	26%	0.256	C	S	.	.	H	α-helix	trans	-51.4	-46.6	174.7	-76.7	166.8	0	0	0	111.1	I360 P362 F374 R393 R395 R401	I360-I397 HydrophobicContact CG2-CB 4.35Å; I360-I397 HydrophobicContact CG2-CG1 4.3Å; I360-I397 HydrophobicContact CG2-CG2 4.22Å; P362-I397 HydrophobicContact CB-CD1 3.76Å; P362-I397 HydrophobicContact CG-CD1 4.36Å; F374-I397 HydrophobicContact CB-CD1 3.75Å; F374-I397 HydrophobicContact CB-CG1 3.63Å; F374-I397 HydrophobicContact CD1-CG1 4.38Å; F374-I397 HydrophobicContact CD2-CG1 4.28Å; F374-I397 HydrophobicContact CG-CD1 4.48Å; F374-I397 HydrophobicContact CG-CG1 3.89Å; R393-I397 HydrophobicContact CG-CD1 3.78Å; R393-I397 HydrophobicContact CG-CG1 4.44Å; R393-I397 WeakPolarHBondContact O-CB 3.29Å; R393-I397 VanDerWaalsContact O-CG1 3.23Å; R393-I397 WeakPolarHBondContact O-CG1 3.21Å; R393-I397 PolarHBondContact O-N 3.15Å; R395-I397 PolarHBondContact O-N 3.07Å; I397-R401 WeakPolarHBondContact O-CB 3.46Å; I397-R401 VanDerWaalsContact O-CD 3.26Å; I397-R401 WeakPolarHBondContact O-CD 3.39Å; I397-R401 WeakPolarHBondContact O-CG 3.41Å; I397-R401 PolarHBondContact O-N 3.21Å; I397-R401 VanDerWaalsContact O-N 3.16Å
398	E	77.7	Confident	77.4	Confident	8 Å²	8	46.2 Å²	46.2	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-78.5	-38.2	-176.8	-174.1	75.4	166.8	0	0	113.3	D394 R395 W396 L400 R401 R402 K408 Y853	D394-E398 PolarHBondContact O-N 3.12Å; R395-E398 PolarHBondContact O-N 3.13Å; R395-E398 VanDerWaalsContact O-N 3.1Å; W396-E398 VanDerWaalsContact C-N 3.26Å; W396-E398 PolarHBondContact O-N 3.34Å; E398-L400 VanDerWaalsContact C-N 3.34Å; E398-L400 PolarHBondContact O-N 2.9Å; E398-R401 CarbonylContact O-C 3.54Å; E398-R401 WeakPolarHBondContact O-CA 3.47Å; E398-R401 WeakPolarHBondContact O-CB 3.28Å; E398-R401 PolarHBondContact O-N 2.85Å; E398-R401 VanDerWaalsContact O-N 3.12Å; E398-R401 IonicContact OE2-NH1 2.74Å; E398-R402 WeakPolarHBondContact O-CB 3.26Å; E398-R402 PolarHBondContact O-N 3.4Å; E398-R402 IonicContact OE1-NH2 3.96Å; E398-K408 IonicContact OE1-NZ 3.61Å; E398-K408 PolarHBondContact OE1-NZ 3.34Å; E398-K408 IonicContact OE2-NZ 3.11Å; E398-K408 PolarHBondContact OE2-NZ 3.09Å; E398-Y853 HydrophobicContact CB-CD1 4.12Å; E398-Y853 HydrophobicContact CG-CD1 3.53Å; E398-Y853 HydrophobicContact CG-CE1 3.55Å; E398-Y853 HydrophobicContact CG-CG 4.19Å; E398-Y853 WeakPolarHBondContact OE1-CE1 3.44Å
399	D	80.6	Confident	77.5	Confident	54 Å²	54	43.8 Å²	43.8	29%	0.289	23%	0.233	S	C	.	.	H	α-helix	trans	-67.6	-37.3	179	-69.5	-20	0	0	0	111.1	L247 R395 W396 R401 R402 A403	L247-D399 HydrophobicContact CD2-CB 3.97Å; R395-D399 VanDerWaalsContact CG-OD2 3.3Å; R395-D399 WeakPolarHBondContact CG-OD2 3.25Å; R395-D399 WeakPolarHBondContact O-CB 3.19Å; R395-D399 PolarHBondContact O-N 2.89Å; W396-D399 PolarHBondContact O-N 3.26Å; D399-R401 VanDerWaalsContact C-N 3.35Å; D399-R402 PolarHBondContact O-N 2.94Å; D399-R402 IonicContact OD1-CZ 2.67Å; D399-R402 IonicContact OD1-NH1 3.48Å; D399-R402 PolarHBondContact OD1-NH1 3.11Å; D399-A403 WeakPolarHBondContact O-CB 3.47Å; D399-A403 PolarHBondContact O-N 2.84Å
400	L	81.6	Confident	77.9	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64	-37.9	169.4	-63.2	169.9	0	0	0	111.9	L247 I252 L352 I360 F374 V376 W396 E398 A404	L247-L400 HydrophobicContact CD1-CD2 3.92Å; L247-L400 HydrophobicContact CD2-CD2 4.39Å; I252-L400 HydrophobicContact CD1-CD1 4.06Å; I252-L400 HydrophobicContact CD1-CD2 3.55Å; I252-L400 HydrophobicContact CD1-CG 4.5Å; I252-L400 HydrophobicContact CG1-CD2 3.51Å; L352-L400 HydrophobicContact CD1-CB 4.12Å; L352-L400 HydrophobicContact CD1-CD2 3.48Å; L352-L400 VanDerWaalsContact CD1-CD2 3.48Å; L352-L400 HydrophobicContact CD1-CG 4.41Å; I360-L400 VanDerWaalsContact CD1-C 3.5Å; I360-L400 HydrophobicContact CD1-CB 3.68Å; I360-L400 HydrophobicContact CG1-CB 4.41Å; I360-L400 HydrophobicContact CG2-CB 4.41Å; F374-L400 HydrophobicContact CD2-CD1 4.39Å; F374-L400 HydrophobicContact CE2-CD1 3.36Å; F374-L400 HydrophobicContact CZ-CD1 3.62Å; V376-L400 HydrophobicContact CG2-CD1 4.21Å; W396-L400 HydrophobicContact CE3-CD1 4.12Å; W396-L400 HydrophobicContact CE3-CD2 4.09Å; W396-L400 HydrophobicContact CE3-CG 4.02Å; W396-L400 HydrophobicContact CZ3-CD2 4.19Å; W396-L400 VanDerWaalsContact O-CB 3.25Å; W396-L400 WeakPolarHBondContact O-CB 3.37Å; W396-L400 WeakPolarHBondContact O-CD1 3.39Å; W396-L400 WeakPolarHBondContact O-CG 3.26Å; W396-L400 PolarHBondContact O-N 3.45Å; E398-L400 VanDerWaalsContact C-N 3.34Å; E398-L400 PolarHBondContact O-N 2.9Å; L400-A404 WeakPolarHBondContact O-CB 3.5Å; L400-A404 PolarHBondContact O-N 3.35Å
401	R	78.4	Confident	78.4	Confident	33 Å²	33	48.5 Å²	48.5	13%	0.125	25%	0.251	C	S	.	.	H	α-helix	trans	-69.4	-35.4	173.8	-75.6	164.6	177.2	-177.8	-2.3	112.5	I360 I397 E398 D399 A404 Q405 N496	I360-R401 HydrophobicContact CB-CG 4.08Å; I360-R401 HydrophobicContact CD1-CG 3.89Å; I360-R401 HydrophobicContact CG2-CG 4.45Å; I360-R401 PolarHBondContact O-NE 2.91Å; I360-R401 PolarHBondContact O-NH2 3.39Å; I397-R401 WeakPolarHBondContact O-CB 3.46Å; I397-R401 VanDerWaalsContact O-CD 3.26Å; I397-R401 WeakPolarHBondContact O-CD 3.39Å; I397-R401 WeakPolarHBondContact O-CG 3.41Å; I397-R401 PolarHBondContact O-N 3.21Å; I397-R401 VanDerWaalsContact O-N 3.16Å; E398-R401 CarbonylContact O-C 3.54Å; E398-R401 WeakPolarHBondContact O-CA 3.47Å; E398-R401 WeakPolarHBondContact O-CB 3.28Å; E398-R401 PolarHBondContact O-N 2.85Å; E398-R401 VanDerWaalsContact O-N 3.12Å; E398-R401 IonicContact OE2-NH1 2.74Å; D399-R401 VanDerWaalsContact C-N 3.35Å; R401-A404 PolarHBondContact O-N 2.93Å; R401-Q405 WeakPolarHBondContact O-CA 3.17Å; R401-Q405 WeakPolarHBondContact O-CB 3.26Å; R401-Q405 PolarHBondContact O-N 2.58Å; R401-N496 PolarHBondContact NH1-ND2 2.92Å; R401-N496 PolarHBondContact NH1-OD1 3.08Å
402	R	76.9	Confident	79.2	Confident	78 Å²	78	52.3 Å²	52.3	29%	0.294	26%	0.264	S	S	.	.	H	α-helix	trans	-73.7	-31.4	177.2	-163.6	179.6	-62.8	104.2	1	111.1	E398 D399 Q405 P406 Y853	E398-R402 WeakPolarHBondContact O-CB 3.26Å; E398-R402 PolarHBondContact O-N 3.4Å; E398-R402 IonicContact OE1-NH2 3.96Å; D399-R402 PolarHBondContact O-N 2.94Å; D399-R402 IonicContact OD1-CZ 2.67Å; D399-R402 IonicContact OD1-NH1 3.48Å; D399-R402 PolarHBondContact OD1-NH1 3.11Å; R402-Q405 CarbonylContact O-C 3.43Å; R402-Q405 VanDerWaalsContact O-C 3.31Å; R402-P406 WeakPolarHBondContact O-CA 3.49Å; R402-Y853 PolarHBondContact NH2-OH 2.67Å
403	A	77.3	Confident	79.5	Confident	28 Å²	28	52.3 Å²	52.3	23%	0.231	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-49.4	166.3	0	0	0	0	0	112.1	L247 L352 D399 Q405	L247-A403 HydrophobicContact CD1-CB 4.33Å; L352-A403 HydrophobicContact CD1-CB 4.22Å; D399-A403 WeakPolarHBondContact O-CB 3.47Å; D399-A403 PolarHBondContact O-N 2.84Å; A403-Q405 VanDerWaalsContact C-N 3.34Å; A403-Q405 PolarHBondContact O-N 3.09Å
404	A	74.6	Confident	79.7	Confident	32 Å²	32	53.6 Å²	53.6	26%	0.264	28%	0.276	S	S	.	.	H	α-helix	trans	-69.6	-28.4	177.7	0	0	0	0	0	113.6	L352 L400 R401	L352-A404 HydrophobicContact CB-CB 4.35Å; L400-A404 WeakPolarHBondContact O-CB 3.5Å; L400-A404 PolarHBondContact O-N 3.35Å; R401-A404 PolarHBondContact O-N 2.93Å
405	Q	72.4	Confident	80.1	Confident	99 Å²	99	51.9 Å²	51.9	46%	0.463	27%	0.266	S	S	.	.			trans	-138.4	71.3	-176.7	-58.9	-173	9.5	0	0	111.5	R401 R402 A403 N407 K408	R401-Q405 WeakPolarHBondContact O-CA 3.17Å; R401-Q405 WeakPolarHBondContact O-CB 3.26Å; R401-Q405 PolarHBondContact O-N 2.58Å; R402-Q405 CarbonylContact O-C 3.43Å; R402-Q405 VanDerWaalsContact O-C 3.31Å; A403-Q405 VanDerWaalsContact C-N 3.34Å; A403-Q405 PolarHBondContact O-N 3.09Å; Q405-N407 PolarHBondContact O-N 3.33Å; Q405-K408 HydrophobicContact CB-CB 4.29Å; Q405-K408 VanDerWaalsContact O-CB 3.3Å; Q405-K408 WeakPolarHBondContact O-CB 3.33Å; Q405-K408 PolarHBondContact O-N 3.4Å
406	P	70.8	Confident	80.5	Confident	96 Å²	96	48.8 Å²	48.8	62%	0.623	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-13.9	-175.9	24	-34.5	0	0	0	114.4	R402	R402-P406 WeakPolarHBondContact O-CA 3.49Å
407	N	73.3	Confident	80.9	Confident	102 Å²	102	47.8 Å²	47.8	55%	0.545	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	12.1	174.2	-70.4	-55.5	0	0	0	114	Q405 D409 N410 I411	Q405-N407 PolarHBondContact O-N 3.33Å; N407-D409 PolarHBondContact O-N 3.04Å; N407-N410 PolarHBondContact O-N 3.16Å; N407-I411 HydrophobicContact CB-CG2 4.35Å; N407-I411 PolarHBondContact O-N 2.81Å
408	K	77.2	Confident	81.3	Confident	11 Å²	11	47.5 Å²	47.5	5%	0.048	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-45.5	-38.3	-174.5	-174.6	-169.6	168.8	-158.9	0	113.8	E398 Q405 I411 R413 D855	E398-K408 IonicContact OE1-NZ 3.61Å; E398-K408 PolarHBondContact OE1-NZ 3.34Å; E398-K408 IonicContact OE2-NZ 3.11Å; E398-K408 PolarHBondContact OE2-NZ 3.09Å; Q405-K408 HydrophobicContact CB-CB 4.29Å; Q405-K408 VanDerWaalsContact O-CB 3.3Å; Q405-K408 WeakPolarHBondContact O-CB 3.33Å; Q405-K408 PolarHBondContact O-N 3.4Å; K408-I411 WeakPolarHBondContact O-CG1 3.32Å; K408-R413 WeakPolarHBondContact O-CD 3.47Å; K408-R413 PolarHBondContact O-NH1 2.9Å; K408-D855 IonicContact NZ-OD2 3.86Å; K408-D855 PolarHBondContact NZ-OD2 2.93Å
409	D	79.8	Confident	82	Confident	39 Å²	39	47.1 Å²	47.1	21%	0.209	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-88.8	-10.2	-176.1	-60.7	-38.9	0	0	0	114.7	N407 R413 M585 P857	N407-D409 PolarHBondContact O-N 3.04Å; D409-R413 IonicContact OD1-CZ 3.38Å; D409-R413 IonicContact OD1-NH1 2.84Å; D409-R413 PolarHBondContact OD1-NH1 3.22Å; D409-R413 IonicContact OD1-NH2 3.74Å; D409-M585 WeakPolarHBondContact O-CB 3.37Å; D409-M585 PolarHBondContact O-N 3.25Å; D409-P857 HydrophobicContact CB-CG 3.91Å
410	N	83.1	Confident	82.7	Confident	87 Å²	87	44.6 Å²	44.6	47%	0.465	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-106.3	8.5	178	-59.4	-38.1	0	0	0	112.5	N407	N407-N410 PolarHBondContact O-N 3.16Å
411	I	84.8	Confident	83.3	Confident	72 Å²	72	47 Å²	47	37%	0.369	25%	0.246	S	C	.	.	S	Bend	trans	-117	151.8	177.3	62	174.9	0	0	0	111.6	N407 K408	N407-I411 HydrophobicContact CB-CG2 4.35Å; N407-I411 PolarHBondContact O-N 2.81Å; K408-I411 WeakPolarHBondContact O-CG1 3.32Å
412	E	88.6	Confident	84	Confident	108 Å²	108	45.4 Å²	45.4	51%	0.505	24%	0.24	S	C	.	.			trans	-72.3	125.6	166.7	-178.4	177.9	128.4	0	0	109.1	K581 V582 L583	E412-K581 HydrophobicContact CG-CD 4.48Å; E412-K581 HydrophobicContact CG-CG 4.33Å; E412-K581 VanDerWaalsContact OE1-CE 3.24Å; E412-K581 WeakPolarHBondContact OE1-CE 3.38Å; E412-K581 IonicContact OE1-NZ 3.67Å; E412-K581 PolarHBondContact OE1-NZ 3.21Å; E412-K581 WeakPolarHBondContact OE2-CE 3.44Å; E412-K581 IonicContact OE2-NZ 3.16Å; E412-K581 PolarHBondContact OE2-NZ 3.1Å; E412-V582 WeakPolarHBondContact CA-O 3.44Å; E412-L583 HydrophobicContact CG-CD2 4.5Å
413	R	86.2	Confident	84.8	Confident	24 Å²	24	42.1 Å²	42.1	9%	0.091	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	162.1	-179.3	67	-170.1	-157.3	-112.2	-4.2	111.7	K408 D409 E415 V582 D855	K408-R413 WeakPolarHBondContact O-CD 3.47Å; K408-R413 PolarHBondContact O-NH1 2.9Å; D409-R413 IonicContact OD1-CZ 3.38Å; D409-R413 IonicContact OD1-NH1 2.84Å; D409-R413 PolarHBondContact OD1-NH1 3.22Å; D409-R413 IonicContact OD1-NH2 3.74Å; R413-E415 IonicContact CZ-OE1 3.87Å; R413-E415 IonicContact NE-OE1 3.94Å; R413-E415 PolarHBondContact NE-OE1 3.01Å; R413-E415 IonicContact NH2-OE1 2.7Å; R413-V582 HydrophobicContact CG-CB 3.92Å; R413-V582 HydrophobicContact CG-CG1 4.39Å; R413-V582 PolarHBondContact N-O 3.04Å; R413-V582 PolarHBondContact O-N 3.15Å; R413-D855 IonicContact CZ-OD1 3.46Å; R413-D855 IonicContact CZ-OD2 2.83Å; R413-D855 IonicContact NH2-OD1 3.78Å; R413-D855 PolarHBondContact NH2-OD1 2.93Å; R413-D855 IonicContact NH2-OD2 3.66Å; R413-D855 PolarHBondContact NH2-OD2 2.65Å
414	T	87.7	Confident	85.5	Confident	73 Å²	73	41.3 Å²	41.3	45%	0.448	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	109	-178.3	-63.9	0	0	0	0	109.9	N579 L580	T414-N579 WeakPolarHBondContact CG2-ND2 3.44Å; T414-L580 WeakPolarHBondContact CA-O 3.34Å
415	E	87.3	Confident	86.3	Confident	29 Å²	29	39.8 Å²	39.8	14%	0.136	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	131.6	179	-58.6	-64.2	177	0	0	109.9	R413 N579 L580 V582 L858	R413-E415 IonicContact CZ-OE1 3.87Å; R413-E415 IonicContact NE-OE1 3.94Å; R413-E415 PolarHBondContact NE-OE1 3.01Å; R413-E415 IonicContact NH2-OE1 2.7Å; E415-N579 WeakPolarHBondContact O-CA 3.45Å; E415-L580 PolarHBondContact N-O 2.89Å; E415-L580 PolarHBondContact O-N 3.43Å; E415-V582 HydrophobicContact CG-CG2 3.76Å; E415-L858 HydrophobicContact CB-CD1 4.08Å; E415-L858 HydrophobicContact CG-CD1 4Å; E415-L858 HydrophobicContact CG-CD2 4.28Å
416	N	88.4	Confident	87.2	Confident	8 Å²	8	37.6 Å²	37.6	4%	0.043	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	135.4	176.1	-52.9	-69.9	0	0	0	109.8	N496 L497 F577 Q578 N579	N416-N496 PolarHBondContact O-N 3.21Å; N416-L497 HydrophobicContact CB-CB 3.97Å; N416-L497 WeakPolarHBondContact CB-O 3.46Å; N416-L497 PolarHBondContact ND2-O 3.14Å; N416-L497 PolarHBondContact O-N 2.87Å; N416-F577 HydrophobicContact CB-CE2 3.95Å; N416-F577 HydrophobicContact CB-CZ 4.03Å; N416-Q578 CarbonylContact C-O 3.56Å; N416-Q578 WeakPolarHBondContact CA-O 3.49Å; N416-N579 PolarHBondContact OD1-ND2 3.49Å
417	S	90.3	Very high	88	Confident	17 Å²	17	35.1 Å²	35.1	12%	0.119	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	149.8	171.5	64	0	0	0	0	112.8	L494 D495 F577 Q578	S417-L494 CarbonylContact C-O 3.31Å; S417-L494 VanDerWaalsContact CA-O 3.31Å; S417-L494 WeakPolarHBondContact CA-O 3.41Å; S417-D495 WeakPolarHBondContact CB-OD1 3.48Å; S417-F577 WeakPolarHBondContact O-CA 3.43Å; S417-F577 VanDerWaalsContact O-CD2 3.28Å; S417-F577 WeakPolarHBondContact O-CD2 3.38Å; S417-Q578 PolarHBondContact N-O 2.91Å; S417-Q578 PolarHBondContact O-N 3.42Å
418	L	91.1	Very high	88.5	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	114.1	179.1	173	60.3	0	0	0	109.8	L420 L440 L494 L497 I503 I538 F577	L418-L420 HydrophobicContact CD1-CB 4.36Å; L418-L420 HydrophobicContact CG-CB 4.18Å; L418-L440 HydrophobicContact CD2-CD1 4.42Å; L418-L440 HydrophobicContact CD2-CD2 3.57Å; L418-L494 HydrophobicContact CB-CB 4.38Å; L418-L494 HydrophobicContact CD2-CD1 4.45Å; L418-L494 PolarHBondContact N-O 2.99Å; L418-L494 PolarHBondContact O-N 3.46Å; L418-L497 HydrophobicContact CB-CD1 3.65Å; L418-I503 HydrophobicContact CD1-CD1 3.65Å; L418-I503 HydrophobicContact CD2-CD1 3.54Å; L418-I503 HydrophobicContact CD2-CG1 3.95Å; L418-I503 HydrophobicContact CG-CD1 4.26Å; L418-I538 HydrophobicContact CD1-CD1 4.02Å; L418-F577 HydrophobicContact CB-CD2 4.45Å
419	S	92.8	Very high	88.6	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	112.5	169.3	-45.6	0	0	0	0	108	E493 Y543 A575 R576	S419-E493 WeakPolarHBondContact CB-OE1 3.36Å; S419-E493 PolarHBondContact OG-OE1 2.94Å; S419-Y543 VanDerWaalsContact CB-OH 3.25Å; S419-Y543 WeakPolarHBondContact CB-OH 3.32Å; S419-A575 CarbonylContact O-C 3.51Å; S419-A575 WeakPolarHBondContact O-CA 3.36Å; S419-R576 PolarHBondContact N-O 3.09Å; S419-R576 PolarHBondContact O-N 3.12Å; S419-R576 PolarHBondContact OG-NH2 3.47Å
420	L	93.7	Very high	88.5	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	126.7	-169.4	175.5	67.4	0	0	0	111.8	L418 V438 F491 F492 I573 A575	L418-L420 HydrophobicContact CD1-CB 4.36Å; L418-L420 HydrophobicContact CG-CB 4.18Å; L420-V438 HydrophobicContact CD2-CB 4.48Å; L420-V438 HydrophobicContact CD2-CG1 3.53Å; L420-V438 HydrophobicContact CD2-CG2 4.06Å; L420-F491 CarbonylContact O-C 3.54Å; L420-F491 WeakPolarHBondContact O-CD2 3.49Å; L420-F492 HydrophobicContact CB-CB 4.49Å; L420-F492 PolarHBondContact N-O 2.71Å; L420-F492 PolarHBondContact O-N 3.38Å; L420-I573 HydrophobicContact CD1-CG2 3.51Å; L420-A575 HydrophobicContact CD1-CB 3.84Å
421	W	94.1	Very high	87.6	Confident	50 Å²	50	36.2 Å²	36.2	19%	0.189	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	125.8	171.4	-75.3	80.9	0	0	0	110.7	G489 E490 F491 I573 K574 L778	W421-G489 WeakPolarHBondContact CZ3-O 3.18Å; W421-E490 WeakPolarHBondContact CA-O 3.37Å; W421-F491 AromaticContact CD1-CD2 3.4Å; W421-F491 AromaticContact CD1-CE2 3.8Å; W421-F491 HydrophobicContact CD2-CB 3.95Å; W421-F491 AromaticContact CD2-CD2 3.94Å; W421-F491 HydrophobicContact CD2-CD2 3.94Å; W421-F491 HydrophobicContact CD2-CG 4.28Å; W421-F491 AromaticContact CE2-CD2 3.47Å; W421-F491 VanDerWaalsContact CE2-CD2 3.47Å; W421-F491 AromaticContact CE2-CG 3.73Å; W421-F491 HydrophobicContact CE3-CB 4.1Å; W421-F491 AromaticContact CG-CD2 3.89Å; W421-F491 HydrophobicContact CG-CD2 3.89Å; W421-F491 HydrophobicContact CH2-CB 3.89Å; W421-F491 HydrophobicContact CH2-CG 4.48Å; W421-F491 HydrophobicContact CZ2-CB 3.74Å; W421-F491 HydrophobicContact CZ2-CD1 4.49Å; W421-F491 HydrophobicContact CZ2-CD2 4.06Å; W421-F491 AromaticContact CZ2-CG 3.85Å; W421-F491 HydrophobicContact CZ2-CG 3.85Å; W421-F491 HydrophobicContact CZ3-CB 4.07Å; W421-F491 AromaticContact NE1-CD2 3.1Å; W421-F491 AromaticContact NE1-CE2 3.46Å; W421-F491 AromaticContact NE1-CG 3.82Å; W421-I573 WeakPolarHBondContact O-CA 3.12Å; W421-K574 HydrophobicContact CB-CB 3.96Å; W421-K574 WeakPolarHBondContact CB-O 3.28Å; W421-K574 HydrophobicContact CG-CD 4.37Å; W421-K574 PolarHBondContact N-O 3.13Å; W421-K574 PolarHBondContact O-N 3.47Å; W421-K574 VanDerWaalsContact O-N 3.08Å; W421-L778 HydrophobicContact CH2-CD2 3.71Å; W421-L778 HydrophobicContact CZ2-CD2 3.91Å
422	V	94.4	Very high	87.4	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	96.7	167.9	-174.3	0	0	0	0	107.3	V438 T448 W488 G489 E490 F492 L505 L571	V422-V438 HydrophobicContact CG2-CG2 4.48Å; V422-T448 HydrophobicContact CB-CG2 3.9Å; V422-T448 HydrophobicContact CG1-CG2 3.91Å; V422-T448 HydrophobicContact CG2-CG2 4.13Å; V422-W488 HydrophobicContact CG1-CE3 4.25Å; V422-G489 PolarHBondContact O-N 3.05Å; V422-E490 PolarHBondContact N-O 2.88Å; V422-E490 PolarHBondContact O-N 2.66Å; V422-E490 VanDerWaalsContact O-N 3.15Å; V422-F492 HydrophobicContact CB-CE2 4.4Å; V422-F492 HydrophobicContact CG2-CD2 4.33Å; V422-F492 HydrophobicContact CG2-CE2 3.89Å; V422-L505 HydrophobicContact CG2-CD2 3.67Å; V422-L571 HydrophobicContact CG1-CD1 4.11Å
423	N	92.3	Very high	87.3	Confident	10 Å²	10	35.2 Å²	35.2	5%	0.053	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	-63.8	-169.5	-73	-23.7	0	0	0	111.4	W488 G489 E545 R572	N423-W488 PolarHBondContact O-N 3.47Å; N423-G489 PolarHBondContact O-N 2.63Å; N423-E545 PolarHBondContact ND2-OE1 3.44Å; N423-R572 HydrophobicContact CB-CB 4.38Å; N423-R572 PolarHBondContact N-O 2.67Å; N423-R572 VanDerWaalsContact N-O 3.09Å
424	E	92.8	Very high	87.5	Confident	11 Å²	11	34 Å²	34	5%	0.051	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.9	157	-173.1	56.6	177.1	-173.3	0	0	113.7	Q485 L486 F487 W547 L571 R572	E424-Q485 PolarHBondContact OE2-NE2 2.82Å; E424-L486 CarbonylContact C-O 3.58Å; E424-L486 WeakPolarHBondContact CA-O 3.43Å; E424-L486 VanDerWaalsContact CB-O 3.25Å; E424-L486 WeakPolarHBondContact CB-O 3.5Å; E424-F487 HydrophobicContact CB-CB 4.44Å; E424-F487 HydrophobicContact CB-CD2 4.08Å; E424-W547 HydrophobicContact CG-CH2 3.77Å; E424-W547 HydrophobicContact CG-CZ2 4.41Å; E424-W547 HydrophobicContact CG-CZ3 4.37Å; E424-W547 WeakPolarHBondContact OE1-CH2 3.43Å; E424-W547 VanDerWaalsContact OE1-CZ2 3.27Å; E424-W547 WeakPolarHBondContact OE1-CZ2 3.33Å; E424-L571 CarbonylContact O-C 3.49Å; E424-L571 WeakPolarHBondContact O-CA 3.21Å; E424-R572 VanDerWaalsContact CD-NH1 3.26Å; E424-R572 HydrophobicContact CG-CB 3.69Å; E424-R572 PolarHBondContact O-N 2.84Å; E424-R572 WeakPolarHBondContact OE1-CD 3.28Å; E424-R572 IonicContact OE1-CZ 3.87Å; E424-R572 IonicContact OE1-NE 2.76Å; E424-R572 IonicContact OE1-NH1 3.61Å; E424-R572 PolarHBondContact OE1-NH1 3.07Å; E424-R572 IonicContact OE2-NH1 2.76Å
425	A	92.1	Very high	87.6	Confident	0 Å²	0	33 Å²	33	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	152.8	167.2	0	0	0	0	0	111.8	L428 Q485 L486 W488 S570 L571	A425-L428 HydrophobicContact CB-CD1 3.61Å; A425-L428 HydrophobicContact CB-CD2 4.48Å; A425-L428 HydrophobicContact CB-CG 3.97Å; A425-Q485 CarbonylContact O-C 3.5Å; A425-Q485 WeakPolarHBondContact O-CA 3.28Å; A425-L486 PolarHBondContact N-O 3.31Å; A425-L486 PolarHBondContact O-N 3.41Å; A425-W488 HydrophobicContact CB-CH2 4.16Å; A425-W488 HydrophobicContact CB-CZ3 3.7Å; A425-S570 CarbonylContact C-O 3.58Å; A425-S570 WeakPolarHBondContact CA-O 3.45Å; A425-L571 HydrophobicContact CB-CD1 3.92Å
426	K	91.3	Very high	87.9	Confident	53 Å²	53	31.7 Å²	31.7	23%	0.23	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	167.2	173.1	63.2	-177	170.3	-161.2	0	112.4	D97 L428 W547 A569 S570	D97-K426 IonicContact OD2-NZ 3.2Å; K426-L428 PolarHBondContact O-N 3.49Å; K426-W547 HydrophobicContact CB-CH2 4.25Å; K426-W547 HydrophobicContact CB-CZ3 4.32Å; K426-W547 HydrophobicContact CD-CE3 4.27Å; K426-W547 HydrophobicContact CD-CH2 3.6Å; K426-W547 HydrophobicContact CD-CZ2 3.98Å; K426-W547 HydrophobicContact CD-CZ3 3.75Å; K426-W547 HydrophobicContact CG-CE3 4.32Å; K426-W547 HydrophobicContact CG-CH2 3.85Å; K426-W547 HydrophobicContact CG-CZ3 3.63Å; K426-A569 WeakPolarHBondContact O-CA 3.32Å; K426-S570 VanDerWaalsContact CE-OG 3.27Å; K426-S570 WeakPolarHBondContact CE-OG 3.42Å; K426-S570 WeakPolarHBondContact CG-OG 3.4Å; K426-S570 PolarHBondContact N-O 3.34Å; K426-S570 PolarHBondContact O-N 3.46Å
427	D	86	Confident	88.1	Confident	43 Å²	43	32.3 Å²	32.3	23%	0.23	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	56.9	28.4	-178	-53	-67.5	0	0	0	114.4	G483 C484 S566 Q568	D427-G483 VanDerWaalsContact OD1-CA 3.23Å; D427-G483 WeakPolarHBondContact OD1-CA 3.4Å; D427-C484 PolarHBondContact N-O 3.25Å; D427-S566 VanDerWaalsContact CB-OG 3.27Å; D427-S566 WeakPolarHBondContact CB-OG 3.41Å; D427-S566 PolarHBondContact O-OG 3.03Å; D427-Q568 HydrophobicContact CB-CB 4.25Å
428	L	85	Confident	88.2	Confident	4 Å²	4	31.5 Å²	31.5	2%	0.021	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	150.2	176.2	-64.8	-169.6	0	0	0	112.6	A425 K426 Y434 V453 C484 L486 L507 I550 L565 A569	A425-L428 HydrophobicContact CB-CD1 3.61Å; A425-L428 HydrophobicContact CB-CD2 4.48Å; A425-L428 HydrophobicContact CB-CG 3.97Å; K426-L428 PolarHBondContact O-N 3.49Å; L428-Y434 HydrophobicContact CD1-CD1 4.47Å; L428-Y434 HydrophobicContact CD1-CD2 4.46Å; L428-Y434 HydrophobicContact CD1-CG 4.34Å; L428-V453 HydrophobicContact CB-CG2 4.09Å; L428-V453 HydrophobicContact CD1-CG2 4.37Å; L428-C484 PolarHBondContact N-O 2.88Å; L428-L486 HydrophobicContact CD1-CB 4.3Å; L428-L486 HydrophobicContact CD1-CD2 3.96Å; L428-L507 HydrophobicContact CD1-CD2 4.29Å; L428-L507 HydrophobicContact CD2-CD2 3.67Å; L428-I550 HydrophobicContact CD2-CD1 4.33Å; L428-L565 HydrophobicContact CD2-CD2 4.02Å; L428-A569 HydrophobicContact CD2-CB 4.35Å
429	P	80.1	Confident	88.2	Confident	26 Å²	26	32.5 Å²	32.5	17%	0.169	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-63.4	128.7	175.9	-20	29.7	0	0	0	113	Y434	P429-Y434 WeakPolarHBondContact CB-OH 3.45Å; P429-Y434 WeakPolarHBondContact CD-OH 3.3Å; P429-Y434 PolarHBondContact O-OH 3.13Å
430	P	75.8	Confident	88	Confident	57 Å²	57	32.6 Å²	32.6	37%	0.37	15%	0.147	S	C	.	.	S	Bend	trans	-73.7	167.3	-173.6	28.7	-35.8	0	0	0	114.5	R432 V453 C484	P430-R432 VanDerWaalsContact C-N 3.28Å; P430-R432 PolarHBondContact O-N 3.05Å; P430-V453 HydrophobicContact CB-CG1 4.34Å; P430-C484 HydrophobicContact CB-CB 4.24Å
431	K	65.9	Low	87.7	Confident	175 Å²	175	35 Å²	35	76%	0.761	16%	0.16	S	C	*	.	S	Bend	trans	62.3	26.2	176	-50.5	175.8	-176	171.6	0	114.7
432	R	80.4	Confident	87.1	Confident	68 Å²	68	34.6 Å²	34.6	26%	0.257	17%	0.171	S	C	.	.			trans	-132.5	159	175.5	-60.8	-172.7	-178.6	-105.3	7.9	110.2	P430 Y434 V453 E563	P430-R432 VanDerWaalsContact C-N 3.28Å; P430-R432 PolarHBondContact O-N 3.05Å; R432-Y434 HydrophobicContact CB-CE2 3.68Å; R432-Y434 WeakPolarHBondContact O-CE2 3.42Å; R432-V453 PolarHBondContact O-N 3.05Å; R432-E563 IonicContact CZ-OE1 2.81Å; R432-E563 IonicContact CZ-OE2 2.79Å; R432-E563 IonicContact NE-OE1 2.57Å; R432-E563 PolarHBondContact NE-OE1 3.28Å; R432-E563 IonicContact NE-OE2 3.33Å; R432-E563 PolarHBondContact NE-OE2 3.39Å; R432-E563 IonicContact NH2-OE1 2.83Å; R432-E563 PolarHBondContact NH2-OE1 2.83Å; R432-E563 IonicContact NH2-OE2 3.49Å; R432-E563 PolarHBondContact NH2-OE2 3.15Å
433	R	85.9	Confident	86.6	Confident	91 Å²	91	35.6 Å²	35.6	34%	0.343	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	143.2	174.9	-67.6	-179.9	78.4	-162.6	17.8	111.4	S450 R451 A452 E510	R433-S450 WeakPolarHBondContact CB-OG 3.47Å; R433-S450 VanDerWaalsContact CZ-O 3.26Å; R433-S450 PolarHBondContact NE-O 3.32Å; R433-S450 VanDerWaalsContact NE-O 3.16Å; R433-S450 PolarHBondContact NH2-O 3.41Å; R433-R451 CarbonylContact C-O 3.53Å; R433-R451 WeakPolarHBondContact CA-O 3.49Å; R433-A452 HydrophobicContact CG-CB 3.93Å; R433-E510 HydrophobicContact CB-CB 4.05Å; R433-E510 WeakPolarHBondContact CB-OE2 3.41Å; R433-E510 WeakPolarHBondContact CD-OE2 3.46Å; R433-E510 IonicContact CZ-OE2 3.51Å; R433-E510 IonicContact NE-OE2 3.87Å; R433-E510 PolarHBondContact NE-OE2 2.8Å; R433-E510 IonicContact NH1-OE1 3.67Å; R433-E510 PolarHBondContact NH1-OE1 3.02Å; R433-E510 IonicContact NH1-OE2 2.7Å; R433-E510 PolarHBondContact NH1-OE2 3.39Å; R433-E510 PolarHBondContact O-N 2.84Å
434	Y	89.4	Confident	86.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	152.7	-177.4	-58.4	-103.2	0	0	0	110.9	L428 P429 R432 S450 R451 V453 L486 L507 F508 R509 L528	L428-Y434 HydrophobicContact CD1-CD1 4.47Å; L428-Y434 HydrophobicContact CD1-CD2 4.46Å; L428-Y434 HydrophobicContact CD1-CG 4.34Å; P429-Y434 WeakPolarHBondContact CB-OH 3.45Å; P429-Y434 WeakPolarHBondContact CD-OH 3.3Å; P429-Y434 PolarHBondContact O-OH 3.13Å; R432-Y434 HydrophobicContact CB-CE2 3.68Å; R432-Y434 WeakPolarHBondContact O-CE2 3.42Å; Y434-S450 WeakPolarHBondContact O-CA 3.35Å; Y434-R451 PolarHBondContact N-O 3.09Å; Y434-R451 PolarHBondContact O-N 2.75Å; Y434-V453 HydrophobicContact CD2-CG2 3.52Å; Y434-V453 HydrophobicContact CE2-CB 4.4Å; Y434-V453 HydrophobicContact CE2-CG2 3.36Å; Y434-L486 HydrophobicContact CD2-CD2 4.1Å; Y434-L486 HydrophobicContact CG-CD2 4.3Å; Y434-L507 HydrophobicContact CD1-CD1 4.27Å; Y434-L507 HydrophobicContact CD1-CD2 4.36Å; Y434-L507 HydrophobicContact CD1-CG 4.32Å; Y434-F508 VanDerWaalsContact CA-O 3.32Å; Y434-F508 WeakPolarHBondContact CA-O 3.18Å; Y434-F508 WeakPolarHBondContact CB-O 3.45Å; Y434-F508 WeakPolarHBondContact CD1-O 3.38Å; Y434-R509 HydrophobicContact CD1-CB 4.09Å; Y434-R509 HydrophobicContact CD1-CG 4.16Å; Y434-R509 HydrophobicContact CE1-CB 4.14Å; Y434-R509 HydrophobicContact CE1-CG 3.88Å; Y434-L528 HydrophobicContact CD1-CD1 4Å; Y434-L528 HydrophobicContact CE1-CD1 3.57Å
435	Y	91.3	Very high	85.9	Confident	52 Å²	52	36 Å²	36	20%	0.204	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	158.4	171.4	63.9	-84.7	0	0	0	109.5	E437 T448 F508	Y435-E437 HydrophobicContact CD2-CG 4.3Å; Y435-E437 HydrophobicContact CE2-CG 3.89Å; Y435-T448 WeakPolarHBondContact CA-OG1 3.15Å; Y435-F508 HydrophobicContact CD1-CB 4.06Å; Y435-F508 HydrophobicContact CD2-CB 4.08Å; Y435-F508 HydrophobicContact CE1-CB 3.58Å; Y435-F508 HydrophobicContact CE2-CB 3.61Å; Y435-F508 HydrophobicContact CE2-CD2 4.08Å; Y435-F508 AromaticContact CE2-CG 3.98Å; Y435-F508 HydrophobicContact CE2-CG 3.98Å; Y435-F508 HydrophobicContact CG-CB 4.3Å; Y435-F508 AromaticContact CZ-CG 3.88Å; Y435-F508 PolarHBondContact N-O 3.13Å; Y435-F508 PolarHBondContact O-N 3.05Å
436	C	92.5	Very high	85.8	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	134.5	173	-68.5	0	0	0	0	110.3	R447 T448 H506	C436-R447 CarbonylContact O-C 3.58Å; C436-R447 VanDerWaalsContact O-CA 3.25Å; C436-R447 WeakPolarHBondContact O-CA 3.49Å; C436-T448 HydrophobicContact CB-CG2 4.03Å; C436-T448 PolarHBondContact N-OG1 3.26Å; C436-T448 PolarHBondContact O-N 3Å; C436-H506 CarbonylContact C-O 3.56Å; C436-H506 VanDerWaalsContact CA-O 3.28Å; C436-H506 WeakPolarHBondContact CA-O 3.35Å
437	E	92.9	Very high	85.7	Confident	22 Å²	22	35.6 Å²	35.6	10%	0.103	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	134	162.5	-62	-162.1	134.8	0	0	109.2	Y435 H439 L444 R447 L505 H506 F508	Y435-E437 HydrophobicContact CD2-CG 4.3Å; Y435-E437 HydrophobicContact CE2-CG 3.89Å; E437-H439 WeakPolarHBondContact CB-NE2 3.31Å; E437-H439 IonicContact OE2-NE2 3.54Å; E437-L444 HydrophobicContact CB-CD1 3.76Å; E437-L444 HydrophobicContact CG-CD1 4.24Å; E437-R447 HydrophobicContact CG-CG 4.1Å; E437-R447 IonicContact OE1-CZ 2.73Å; E437-R447 IonicContact OE1-NE 3.24Å; E437-R447 PolarHBondContact OE1-NE 2.86Å; E437-R447 IonicContact OE1-NH2 3.91Å; E437-R447 PolarHBondContact OE1-NH2 3.3Å; E437-L505 CarbonylContact O-C 3.58Å; E437-L505 VanDerWaalsContact O-CA 3.31Å; E437-L505 WeakPolarHBondContact O-CA 3.15Å; E437-H506 HydrophobicContact CB-CB 4.36Å; E437-H506 PolarHBondContact N-O 3.2Å; E437-H506 PolarHBondContact O-N 3.38Å; E437-F508 HydrophobicContact CB-CD2 4.35Å; E437-F508 HydrophobicContact CB-CE2 4.09Å; E437-F508 HydrophobicContact CG-CD2 3.71Å; E437-F508 HydrophobicContact CG-CE2 3.61Å; E437-F508 WeakPolarHBondContact OE2-CE2 3.4Å; E437-F508 WeakPolarHBondContact OE2-CZ 3.3Å
438	V	92.5	Very high	86	Confident	0 Å²	0	34 Å²	34	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	117	178.4	178.1	0	0	0	0	108.7	L420 V422 F445 A446 I503 L505	L420-V438 HydrophobicContact CD2-CB 4.48Å; L420-V438 HydrophobicContact CD2-CG1 3.53Å; L420-V438 HydrophobicContact CD2-CG2 4.06Å; V422-V438 HydrophobicContact CG2-CG2 4.48Å; V438-F445 PolarHBondContact O-N 3.39Å; V438-A446 HydrophobicContact CB-CB 4.2Å; V438-A446 HydrophobicContact CG2-CB 4.48Å; V438-A446 PolarHBondContact N-O 3.15Å; V438-A446 PolarHBondContact O-N 3.43Å; V438-I503 HydrophobicContact CG1-CG2 4.42Å; V438-L505 HydrophobicContact CG2-CD2 4.31Å; V438-L505 HydrophobicContact CG2-CG 4.49Å
439	H	90.8	Very high	86.1	Confident	21 Å²	21	35.3 Å²	35.3	10%	0.097	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	149.4	177.2	-58.9	-121.9	0	0	0	111.9	E437 G442 T443 I503 S504 H506	E437-H439 WeakPolarHBondContact CB-NE2 3.31Å; E437-H439 IonicContact OE2-NE2 3.54Å; H439-G442 PolarHBondContact ND1-O 2.89Å; H439-T443 CarbonylContact C-O 3.53Å; H439-T443 WeakPolarHBondContact CA-O 3.26Å; H439-T443 VanDerWaalsContact CB-O 3.3Å; H439-T443 WeakPolarHBondContact CB-O 3.31Å; H439-I503 WeakPolarHBondContact O-CA 3.26Å; H439-S504 WeakPolarHBondContact CA-O 3.32Å; H439-S504 WeakPolarHBondContact CB-O 3.35Å; H439-S504 PolarHBondContact N-O 3.04Å; H439-S504 PolarHBondContact O-N 3.38Å; H439-H506 AromaticContact CD2-CE1 3.82Å; H439-H506 AromaticContact CD2-ND1 3.09Å; H439-H506 PolarHBondContact CD2-ND1 3.04Å; H439-H506 AromaticContact CE1-ND1 3.73Å; H439-H506 AromaticContact CG-ND1 3.79Å; H439-H506 AromaticContact NE2-CE1 3.88Å; H439-H506 AromaticContact NE2-ND1 3.03Å; H439-H506 PolarHBondContact NE2-ND1 3.32Å
440	L	89.3	Confident	86.4	Confident	1 Å²	1	35 Å²	35	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	118.7	171.3	-52.2	176.5	0	0	0	107.5	L418 G442 T443 F445 L494 L497 I500 I503	L418-L440 HydrophobicContact CD2-CD1 4.42Å; L418-L440 HydrophobicContact CD2-CD2 3.57Å; L440-G442 PolarHBondContact O-N 2.96Å; L440-T443 PolarHBondContact N-O 2.97Å; L440-T443 WeakPolarHBondContact O-CB 3.5Å; L440-T443 PolarHBondContact O-N 2.89Å; L440-F445 HydrophobicContact CB-CD2 3.72Å; L440-F445 HydrophobicContact CB-CE2 3.79Å; L440-F445 HydrophobicContact CD1-CB 4.29Å; L440-F445 HydrophobicContact CD1-CD1 4Å; L440-F445 HydrophobicContact CD1-CD2 3.54Å; L440-F445 HydrophobicContact CD1-CE1 4.19Å; L440-F445 HydrophobicContact CD1-CE2 3.74Å; L440-F445 HydrophobicContact CD1-CG 3.67Å; L440-F445 HydrophobicContact CD1-CZ 4.07Å; L440-F445 HydrophobicContact CG-CB 4.37Å; L440-F445 HydrophobicContact CG-CD2 3.59Å; L440-F445 HydrophobicContact CG-CE2 4.03Å; L440-F445 HydrophobicContact CG-CG 4.02Å; L440-L494 HydrophobicContact CD1-CD1 4.15Å; L440-L497 HydrophobicContact CD1-CD1 3.86Å; L440-L497 HydrophobicContact CD1-CD2 3.62Å; L440-L497 HydrophobicContact CD1-CG 4.39Å; L440-I500 HydrophobicContact CB-CG2 3.98Å; L440-I500 HydrophobicContact CD1-CD1 4.22Å; L440-I500 HydrophobicContact CD2-CD1 4.25Å; L440-I503 HydrophobicContact CD2-CB 4.22Å; L440-I503 HydrophobicContact CD2-CG1 3.81Å; L440-I503 HydrophobicContact CD2-CG2 4.01Å
441	D	87.3	Confident	86.8	Confident	52 Å²	52	33.5 Å²	33.5	28%	0.278	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	6.7	-172.6	-65.1	-20.8	0	0	0	117.5	I500 S501 Q502	D441-I500 WeakPolarHBondContact OD2-CA 3.25Å; D441-S501 VanDerWaalsContact CG-N 3.34Å; D441-S501 WeakPolarHBondContact OD1-CA 3.35Å; D441-S501 WeakPolarHBondContact OD1-CB 3.43Å; D441-S501 PolarHBondContact OD1-N 2.8Å; D441-S501 PolarHBondContact OD1-OG 2.85Å; D441-S501 PolarHBondContact OD2-N 3.28Å; D441-Q502 PolarHBondContact N-O 3.49Å; D441-Q502 VanDerWaalsContact N-O 3.08Å; D441-Q502 WeakPolarHBondContact OD1-CG 3.36Å; D441-Q502 PolarHBondContact OD1-N 3.21Å
442	G	82.2	Confident	87.6	Confident	40 Å²	40	28.3 Å²	28.3	41%	0.412	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	125.6	-28.3	-178.7	0	0	0	0	0	113.2	H439 L440	H439-G442 PolarHBondContact ND1-O 2.89Å; L440-G442 PolarHBondContact O-N 2.96Å
443	T	83.3	Confident	87.4	Confident	22 Å²	22	25.3 Å²	25.3	14%	0.135	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	132.1	175.5	-56	0	0	0	0	110.8	W231 H439 L440 F445	W231-T443 HydrophobicContact CB-CG2 4.16Å; W231-T443 WeakPolarHBondContact CB-OG1 3.3Å; W231-T443 WeakPolarHBondContact O-CG2 3.48Å; H439-T443 CarbonylContact C-O 3.53Å; H439-T443 WeakPolarHBondContact CA-O 3.26Å; H439-T443 VanDerWaalsContact CB-O 3.3Å; H439-T443 WeakPolarHBondContact CB-O 3.31Å; L440-T443 PolarHBondContact N-O 2.97Å; L440-T443 WeakPolarHBondContact O-CB 3.5Å; L440-T443 PolarHBondContact O-N 2.89Å; T443-F445 HydrophobicContact CG2-CD2 3.75Å; T443-F445 HydrophobicContact CG2-CE2 3.36Å; T443-F445 HydrophobicContact CG2-CZ 4.18Å
444	L	85.3	Confident	86.4	Confident	16 Å²	16	23 Å²	23	8%	0.084	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	122.7	174.8	177.9	66.9	0	0	0	110.8	I367 E437 A446 R447	I367-L444 HydrophobicContact CD1-CG 4.31Å; I367-L444 HydrophobicContact CG1-CD2 4.38Å; I367-L444 HydrophobicContact CG1-CG 4.39Å; E437-L444 HydrophobicContact CB-CD1 3.76Å; E437-L444 HydrophobicContact CG-CD1 4.24Å; L444-A446 WeakPolarHBondContact CD1-O 3.19Å; L444-R447 VanDerWaalsContact CD2-NH2 3.31Å
445	F	85.6	Confident	84.6	Confident	12 Å²	12	31 Å²	31	5%	0.053	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	-31.8	-180	-89.2	-94	0	0	0	114.4	H364 I367 V438 L440 T443 L494 L497	H364-F445 WeakPolarHBondContact CB-O 3.43Å; I367-F445 WeakPolarHBondContact CD1-O 3.46Å; V438-F445 PolarHBondContact O-N 3.39Å; L440-F445 HydrophobicContact CB-CD2 3.72Å; L440-F445 HydrophobicContact CB-CE2 3.79Å; L440-F445 HydrophobicContact CD1-CB 4.29Å; L440-F445 HydrophobicContact CD1-CD1 4Å; L440-F445 HydrophobicContact CD1-CD2 3.54Å; L440-F445 HydrophobicContact CD1-CE1 4.19Å; L440-F445 HydrophobicContact CD1-CE2 3.74Å; L440-F445 HydrophobicContact CD1-CG 3.67Å; L440-F445 HydrophobicContact CD1-CZ 4.07Å; L440-F445 HydrophobicContact CG-CB 4.37Å; L440-F445 HydrophobicContact CG-CD2 3.59Å; L440-F445 HydrophobicContact CG-CE2 4.03Å; L440-F445 HydrophobicContact CG-CG 4.02Å; T443-F445 HydrophobicContact CG2-CD2 3.75Å; T443-F445 HydrophobicContact CG2-CE2 3.36Å; T443-F445 HydrophobicContact CG2-CZ 4.18Å; F445-L494 HydrophobicContact CB-CD1 3.99Å; F445-L494 HydrophobicContact CD1-CD1 4.35Å; F445-L494 HydrophobicContact CD1-CD2 4.37Å; F445-L494 HydrophobicContact CG-CD1 4.44Å; F445-L497 HydrophobicContact CD1-CD2 4.04Å; F445-L497 HydrophobicContact CE1-CD2 3.42Å; F445-L497 VanDerWaalsContact CE1-CD2 3.42Å; F445-L497 HydrophobicContact CZ-CD2 3.82Å
446	A	88.8	Confident	82.3	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	172.8	176.7	0	0	0	0	0	112.7	H364 V438 L444 F492	H364-A446 HydrophobicContact CB-CB 4.04Å; V438-A446 HydrophobicContact CB-CB 4.2Å; V438-A446 HydrophobicContact CG2-CB 4.48Å; V438-A446 PolarHBondContact N-O 3.15Å; V438-A446 PolarHBondContact O-N 3.43Å; L444-A446 WeakPolarHBondContact CD1-O 3.19Å; A446-F492 HydrophobicContact CB-CD1 3.47Å; A446-F492 VanDerWaalsContact CB-CD1 3.47Å; A446-F492 HydrophobicContact CB-CE1 3.67Å; A446-F492 HydrophobicContact CB-CG 4.18Å
447	R	90.4	Very high	79.6	Confident	46 Å²	46	38.6 Å²	38.6	17%	0.174	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	148	168.7	-54.2	-171.9	168.4	95.7	5.4	109.9	S366 I367 C436 E437 L444 F492	S366-R447 WeakPolarHBondContact CB-O 3.35Å; S366-R447 PolarHBondContact O-NH1 2.93Å; S366-R447 VanDerWaalsContact O-NH1 3.11Å; S366-R447 PolarHBondContact OG-N 3.14Å; S366-R447 PolarHBondContact OG-O 3.42Å; I367-R447 PolarHBondContact O-NH1 3.14Å; C436-R447 CarbonylContact O-C 3.58Å; C436-R447 VanDerWaalsContact O-CA 3.25Å; C436-R447 WeakPolarHBondContact O-CA 3.49Å; E437-R447 HydrophobicContact CG-CG 4.1Å; E437-R447 IonicContact OE1-CZ 2.73Å; E437-R447 IonicContact OE1-NE 3.24Å; E437-R447 PolarHBondContact OE1-NE 2.86Å; E437-R447 IonicContact OE1-NH2 3.91Å; E437-R447 PolarHBondContact OE1-NH2 3.3Å; L444-R447 VanDerWaalsContact CD2-NH2 3.31Å; R447-F492 WeakPolarHBondContact O-CE1 3.07Å
448	T	91	Very high	76.7	Confident	9 Å²	9	44.9 Å²	44.9	6%	0.055	27%	0.269	C	S	.	.			trans	-79.2	165.2	167.3	69	0	0	0	0	111.9	V422 Y435 C436 W488 E490 F492	V422-T448 HydrophobicContact CB-CG2 3.9Å; V422-T448 HydrophobicContact CG1-CG2 3.91Å; V422-T448 HydrophobicContact CG2-CG2 4.13Å; Y435-T448 WeakPolarHBondContact CA-OG1 3.15Å; C436-T448 HydrophobicContact CB-CG2 4.03Å; C436-T448 PolarHBondContact N-OG1 3.26Å; C436-T448 PolarHBondContact O-N 3Å; T448-W488 HydrophobicContact CG2-CG 4.46Å; T448-W488 PolarHBondContact OG1-NE1 2.88Å; T448-E490 WeakPolarHBondContact CA-OE2 3.43Å; T448-E490 WeakPolarHBondContact CB-OE2 3.26Å; T448-F492 HydrophobicContact CG2-CE2 4.01Å; T448-F492 HydrophobicContact CG2-CZ 3.89Å
449	S	87.2	Confident	73.8	Confident	31 Å²	31	56.4 Å²	56.4	22%	0.217	31%	0.312	C	S	.	.			trans	-62.9	153.2	167.2	74.5	0	0	0	0	112	R451 W488 E490	S449-R451 PolarHBondContact O-N 3.45Å; S449-R451 PolarHBondContact OG-NE 3.39Å; S449-W488 VanDerWaalsContact O-CD1 3.27Å; S449-W488 PolarHBondContact O-NE1 3.27Å; S449-E490 VanDerWaalsContact CB-OE1 3.22Å; S449-E490 WeakPolarHBondContact CB-OE1 3.41Å; S449-E490 PolarHBondContact N-OE1 3.13Å; S449-E490 VanDerWaalsContact N-OE1 3.09Å; S449-E490 PolarHBondContact N-OE2 3.13Å; S449-E490 PolarHBondContact OG-OE1 3.32Å
450	S	86	Confident	70.9	Confident	21 Å²	21	60.9 Å²	60.9	15%	0.147	35%	0.346	C	S	.	.			trans	-81.8	114.9	175.5	-173.7	0	0	0	0	110.6	R433 Y434 E510	R433-S450 WeakPolarHBondContact CB-OG 3.47Å; R433-S450 VanDerWaalsContact CZ-O 3.26Å; R433-S450 PolarHBondContact NE-O 3.32Å; R433-S450 VanDerWaalsContact NE-O 3.16Å; R433-S450 PolarHBondContact NH2-O 3.41Å; Y434-S450 WeakPolarHBondContact O-CA 3.35Å; S450-E510 WeakPolarHBondContact CB-OE2 3.38Å; S450-E510 PolarHBondContact OG-OE2 3.14Å
451	R	85.8	Confident	68.1	Low	25 Å²	25	65.8 Å²	65.8	9%	0.094	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	141.4	-173.1	-68.6	-170	166.2	-94.8	-28.9	112.9	R433 Y434 S449 L486 F487 W488 E490 Y785 E787	R433-R451 CarbonylContact C-O 3.53Å; R433-R451 WeakPolarHBondContact CA-O 3.49Å; Y434-R451 PolarHBondContact N-O 3.09Å; Y434-R451 PolarHBondContact O-N 2.75Å; S449-R451 PolarHBondContact O-N 3.45Å; S449-R451 PolarHBondContact OG-NE 3.39Å; R451-L486 HydrophobicContact CB-CD1 3.58Å; R451-L486 HydrophobicContact CB-CG 4.39Å; R451-F487 WeakPolarHBondContact CD-O 3.17Å; R451-F487 PolarHBondContact NH1-O 2.8Å; R451-W488 VanDerWaalsContact CD-CD1 3.44Å; R451-E490 IonicContact NE-OE1 3.91Å; R451-Y785 PolarHBondContact NH2-O 3.12Å; R451-E787 IonicContact CZ-OE1 3.91Å; R451-E787 IonicContact NH1-OE1 2.63Å; R451-E787 PolarHBondContact NH1-OE1 2.89Å; R451-E787 IonicContact NH2-OE1 2.86Å
452	A	81.3	Confident	65.5	Low	66 Å²	66	72.5 Å²	72.5	55%	0.545	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	129.3	-179.9	0	0	0	0	0	111.2	R433 G454 L486	R433-A452 HydrophobicContact CG-CB 3.93Å; A452-G454 PolarHBondContact O-N 3.39Å; A452-L486 WeakPolarHBondContact O-CD1 3.4Å
453	V	77.8	Confident	63.1	Low	5 Å²	5	74.9 Å²	74.9	3%	0.03	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-64.2	120.6	169.3	177.4	0	0	0	0	108.9	L428 P430 R432 Y434 C484 L486	L428-V453 HydrophobicContact CB-CG2 4.09Å; L428-V453 HydrophobicContact CD1-CG2 4.37Å; P430-V453 HydrophobicContact CB-CG1 4.34Å; R432-V453 PolarHBondContact O-N 3.05Å; Y434-V453 HydrophobicContact CD2-CG2 3.52Å; Y434-V453 HydrophobicContact CE2-CB 4.4Å; Y434-V453 HydrophobicContact CE2-CG2 3.36Å; V453-C484 HydrophobicContact CG1-CB 3.29Å; V453-L486 HydrophobicContact CG2-CB 4.21Å; V453-L486 HydrophobicContact CG2-CD1 4.47Å; V453-L486 HydrophobicContact CG2-CD2 3.96Å; V453-L486 HydrophobicContact CG2-CG 4.46Å
454	G	63.3	Low	60.5	Low	43 Å²	43	77.3 Å²	77.3	44%	0.443	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-55.8	149.8	-179.9	0	0	0	0	0	112.3	A452	A452-G454 PolarHBondContact O-N 3.39Å
455	K	51.5	Low	57.8	Low	168 Å²	168	85 Å²	85	73%	0.73	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-64.7	134.3	168.4	-67.4	174.7	-174.4	166.8	0	107.8	T457	K455-T457 PolarHBondContact O-N 2.89Å
456	P	43.2	Very low	55	Low	78 Å²	78	88 Å²	88	51%	0.506	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-59.8	124.7	171.6	25.4	-32.3	0	0	0	108.6	N458	P456-N458 PolarHBondContact O-N 3.28Å
457	T	36.6	Very low	52.1	Low	133 Å²	133	92.8 Å²	92.8	82%	0.816	57%	0.573	S	S	*	*			trans	-73.3	93.9	-178.9	50.2	0	0	0	0	109.7	K455 R459	K455-T457 PolarHBondContact O-N 2.89Å; T457-R459 PolarHBondContact O-N 2.95Å; T457-R459 VanDerWaalsContact O-N 3.17Å
458	N	32.1	Very low	49.1	Very low	154 Å²	154	96.9 Å²	96.9	82%	0.824	61%	0.609	S	S	*	*			trans	-52.1	122.6	160.1	-90.6	2.3	0	0	0	107.9	P456 S460	P456-N458 PolarHBondContact O-N 3.28Å; N458-S460 PolarHBondContact O-N 3.06Å
459	R	30.3	Very low	46.1	Very low	242 Å²	242	100.2 Å²	100.2	91%	0.913	64%	0.644	S	S	*	*			trans	-61.3	107.4	175.1	-70.1	-178	176.5	-175.2	-1.1	108.7	T457 S461	T457-R459 PolarHBondContact O-N 2.95Å; T457-R459 VanDerWaalsContact O-N 3.17Å; R459-S461 VanDerWaalsContact C-N 3.27Å; R459-S461 PolarHBondContact O-N 3.27Å
460	S	29.7	Very low	43.2	Very low	115 Å²	115	104.4 Å²	104.4	80%	0.804	67%	0.674	S	S	*	*			trans	-73	81.4	175.1	52.7	0	0	0	0	110	N458 M462	N458-S460 PolarHBondContact O-N 3.06Å; S460-M462 PolarHBondContact O-N 3.25Å
461	S	31.1	Very low	40.5	Very low	104 Å²	104	109 Å²	109	73%	0.727	71%	0.706	S	S	*	*			trans	-70.4	107	172.4	-177.9	0	0	0	0	109.7	R459 A463	R459-S461 VanDerWaalsContact C-N 3.27Å; R459-S461 PolarHBondContact O-N 3.27Å; S461-A463 PolarHBondContact O-N 3.24Å
462	M	32.9	Very low	37.6	Very low	193 Å²	193	111.9 Å²	111.9	95%	0.951	74%	0.744	S	S	*	*			trans	-81	108.2	160.8	-68.1	-153	76.6	0	0	109	S460	S460-M462 PolarHBondContact O-N 3.25Å
463	A	31.8	Very low	35.1	Very low	90 Å²	90	112.7 Å²	112.7	74%	0.744	76%	0.758	S	S	*	*			trans	-146.7	130.1	167.2	0	0	0	0	0	107.8	S461	S461-A463 PolarHBondContact O-N 3.24Å
464	G	28.6	Very low	32.9	Very low	73 Å²	73	121.6 Å²	121.6	75%	0.753	81%	0.805	S	S	*	*			trans	-87.1	175	-175.2	0	0	0	0	0	114.5
465	D	28.4	Very low	31.2	Very low	176 Å²	176	123.2 Å²	123.2	94%	0.941	82%	0.822	S	S	*	*			trans	-45.8	144.7	-174	-53.8	-64.5	0	0	0	116.8
466	G	28.1	Very low	30.2	Very low	77 Å²	77	119.6 Å²	119.6	79%	0.794	83%	0.831	S	S	*	*			trans	-170.2	43.7	-174.7	0	0	0	0	0	118.1
467	A	27.3	Very low	29.4	Very low	99 Å²	99	119.3 Å²	119.3	82%	0.818	84%	0.843	S	S	*	*			trans	33.8	124.4	158.2	0	0	0	0	0	123
468	S	27.5	Very low	28.9	Very low	133 Å²	133	117.1 Å²	117.1	93%	0.93	85%	0.847	S	S	*	*			trans	66.9	117.2	140.5	-158.7	0	0	0	0	121.3
469	G	26.8	Very low	28.7	Very low	78 Å²	78	113.4 Å²	113.4	80%	0.804	85%	0.845	S	S	*	*			trans	176.4	116.8	163.4	0	0	0	0	0	112.3
470	S	27.8	Very low	28.8	Very low	119 Å²	119	106.9 Å²	106.9	83%	0.832	84%	0.843	S	S	*	*			trans	-111.7	129.5	-176.2	-179.5	0	0	0	0	112.2
471	S	27.8	Very low	29.3	Very low	117 Å²	117	106 Å²	106	82%	0.818	84%	0.842	S	S	*	*				166.5	138	125.8	47.4	0	0	0	0	114.6
472	G	26.6	Very low	29.8	Very low	87 Å²	87	103.9 Å²	103.9	90%	0.897	84%	0.837	S	S	*	*			trans	51.4	117.7	142.1	0	0	0	0	0	122.3
473	G	27.2	Very low	30.9	Very low	82 Å²	82	96.6 Å²	96.6	85%	0.845	81%	0.812	S	S	*	*			trans	170.2	96	159.8	0	0	0	0	0	114.8
474	L	31.4	Very low	32.8	Very low	193 Å²	193	92.9 Å²	92.9	100%	1.01	78%	0.78	S	S	*	*			trans	-85.5	129.3	172.4	-80.3	163.6	0	0	0	110.8
475	G	27.8	Very low	35.3	Very low	77 Å²	77	94.9 Å²	94.9	79%	0.794	77%	0.77	S	S	*	*			trans	-168.4	91.7	175.8	0	0	0	0	0	112
476	G	30.3	Very low	38.1	Very low	91 Å²	91	86.9 Å²	86.9	94%	0.938	73%	0.727	S	S	*	*			trans	-83.5	122.9	179.7	0	0	0	0	0	112.6
477	G	26.4	Very low	41.1	Very low	73 Å²	73	87 Å²	87	75%	0.753	71%	0.705	S	S	*	*			trans	-152.6	133.2	170.8	0	0	0	0	0	109.3	G479	G477-G479 PolarHBondContact O-N 3.33Å
478	G	27.4	Very low	44.1	Very low	86 Å²	86	82.3 Å²	82.3	89%	0.887	67%	0.666	S	S	*	*			trans	-65.9	123	-169.2	0	0	0	0	0	113.2
479	G	27.4	Very low	47	Very low	76 Å²	76	76 Å²	76	78%	0.784	62%	0.623	S	S	*	*			trans	-67.4	131.6	170.3	0	0	0	0	0	111	G477 A481	G477-G479 PolarHBondContact O-N 3.33Å; G479-A481 PolarHBondContact O-N 2.59Å; G479-A481 VanDerWaalsContact O-N 3.15Å
480	A	33.3	Very low	50	Low	106 Å²	106	72.4 Å²	72.4	88%	0.876	59%	0.585	S	S	*	*			trans	-64.2	113.6	174.3	0	0	0	0	0	109.9	G482	A480-G482 PolarHBondContact O-N 2.71Å
481	A	40.1	Very low	53	Low	96 Å²	96	69 Å²	69	79%	0.793	56%	0.556	S	S	*	*			trans	-68.6	114.2	170.4	0	0	0	0	0	108.4	G479 G483	G479-A481 PolarHBondContact O-N 2.59Å; G479-A481 VanDerWaalsContact O-N 3.15Å; A481-G483 PolarHBondContact O-N 3.18Å
482	G	41.5	Very low	55.9	Low	60 Å²	60	63.6 Å²	63.6	62%	0.619	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-57.6	124.2	179.1	0	0	0	0	0	111.2	A480 C484	A480-G482 PolarHBondContact O-N 2.71Å; G482-C484 PolarHBondContact O-N 3.34Å
483	G	56.3	Low	58.8	Low	40 Å²	40	64 Å²	64	41%	0.412	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-54.5	134.2	178.7	0	0	0	0	0	111.9	D427 A481	D427-G483 VanDerWaalsContact OD1-CA 3.23Å; D427-G483 WeakPolarHBondContact OD1-CA 3.4Å; A481-G483 PolarHBondContact O-N 3.18Å
484	C	71.1	Confident	61.6	Low	11 Å²	11	60.9 Å²	60.9	7%	0.074	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.5	179.6	-60.2	0	0	0	0	109.5	D427 L428 P430 V453 G482	D427-C484 PolarHBondContact N-O 3.25Å; L428-C484 PolarHBondContact N-O 2.88Å; P430-C484 HydrophobicContact CB-CB 4.24Å; V453-C484 HydrophobicContact CG1-CB 3.29Å; G482-C484 PolarHBondContact O-N 3.34Å
485	Q	81.7	Confident	64.1	Low	116 Å²	116	55 Å²	55	54%	0.542	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	148.8	-174.4	-168.9	172.4	3.4	0	0	110.7	E424 A425	E424-Q485 PolarHBondContact OE2-NE2 2.82Å; A425-Q485 CarbonylContact O-C 3.5Å; A425-Q485 WeakPolarHBondContact O-CA 3.28Å
486	L	87.4	Confident	66.3	Low	7 Å²	7	53.8 Å²	53.8	4%	0.037	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	113.8	-179.7	-178.5	57.4	0	0	0	109.6	E424 A425 L428 Y434 R451 A452 V453 W488	E424-L486 CarbonylContact C-O 3.58Å; E424-L486 WeakPolarHBondContact CA-O 3.43Å; E424-L486 VanDerWaalsContact CB-O 3.25Å; E424-L486 WeakPolarHBondContact CB-O 3.5Å; A425-L486 PolarHBondContact N-O 3.31Å; A425-L486 PolarHBondContact O-N 3.41Å; L428-L486 HydrophobicContact CD1-CB 4.3Å; L428-L486 HydrophobicContact CD1-CD2 3.96Å; Y434-L486 HydrophobicContact CD2-CD2 4.1Å; Y434-L486 HydrophobicContact CG-CD2 4.3Å; R451-L486 HydrophobicContact CB-CD1 3.58Å; R451-L486 HydrophobicContact CB-CG 4.39Å; A452-L486 WeakPolarHBondContact O-CD1 3.4Å; V453-L486 HydrophobicContact CG2-CB 4.21Å; V453-L486 HydrophobicContact CG2-CD1 4.47Å; V453-L486 HydrophobicContact CG2-CD2 3.96Å; V453-L486 HydrophobicContact CG2-CG 4.46Å; L486-W488 HydrophobicContact CD2-CH2 3.54Å; L486-W488 HydrophobicContact CD2-CZ2 3.48Å; L486-W488 VanDerWaalsContact CD2-CZ2 3.48Å; L486-W488 HydrophobicContact CD2-CZ3 4.16Å; L486-W488 HydrophobicContact CG-CD2 4.5Å; L486-W488 HydrophobicContact CG-CE3 4.43Å; L486-W488 HydrophobicContact CG-CH2 4.1Å; L486-W488 HydrophobicContact CG-CZ2 4.15Å; L486-W488 HydrophobicContact CG-CZ3 4.23Å
487	F	89.4	Confident	68.8	Low	80 Å²	80	50 Å²	50	35%	0.351	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.8	179.5	-176.2	-89.6	0	0	0	110.6	E424 R451 Y785	E424-F487 HydrophobicContact CB-CB 4.44Å; E424-F487 HydrophobicContact CB-CD2 4.08Å; R451-F487 WeakPolarHBondContact CD-O 3.17Å; R451-F487 PolarHBondContact NH1-O 2.8Å; F487-Y785 HydrophobicContact CD1-CD1 4.29Å; F487-Y785 AromaticContact CE1-CD1 3.85Å; F487-Y785 HydrophobicContact CE1-CD1 3.85Å; F487-Y785 HydrophobicContact CE1-CD2 4.12Å; F487-Y785 HydrophobicContact CE1-CE1 4.05Å; F487-Y785 HydrophobicContact CE1-CE2 4.31Å; F487-Y785 AromaticContact CE1-CG 3.91Å; F487-Y785 HydrophobicContact CE1-CG 3.91Å
488	W	90.7	Very high	71.2	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	-53.1	168.5	-71.6	-87	0	0	0	111	V422 N423 A425 T448 S449 R451 L486 E490 L507 L571 Y785	V422-W488 HydrophobicContact CG1-CE3 4.25Å; N423-W488 PolarHBondContact O-N 3.47Å; A425-W488 HydrophobicContact CB-CH2 4.16Å; A425-W488 HydrophobicContact CB-CZ3 3.7Å; T448-W488 HydrophobicContact CG2-CG 4.46Å; T448-W488 PolarHBondContact OG1-NE1 2.88Å; S449-W488 VanDerWaalsContact O-CD1 3.27Å; S449-W488 PolarHBondContact O-NE1 3.27Å; R451-W488 VanDerWaalsContact CD-CD1 3.44Å; L486-W488 HydrophobicContact CD2-CH2 3.54Å; L486-W488 HydrophobicContact CD2-CZ2 3.48Å; L486-W488 VanDerWaalsContact CD2-CZ2 3.48Å; L486-W488 HydrophobicContact CD2-CZ3 4.16Å; L486-W488 HydrophobicContact CG-CD2 4.5Å; L486-W488 HydrophobicContact CG-CE3 4.43Å; L486-W488 HydrophobicContact CG-CH2 4.1Å; L486-W488 HydrophobicContact CG-CZ2 4.15Å; L486-W488 HydrophobicContact CG-CZ3 4.23Å; W488-E490 VanDerWaalsContact C-N 3.28Å; W488-E490 HydrophobicContact CB-CB 4.41Å; W488-E490 HydrophobicContact CB-CG 4.11Å; W488-E490 PolarHBondContact O-N 3.24Å; W488-L507 HydrophobicContact CH2-CD1 3.93Å; W488-L507 HydrophobicContact CZ2-CD1 4.37Å; W488-L571 HydrophobicContact CE3-CD1 4.42Å; W488-L571 HydrophobicContact CZ3-CD1 3.75Å; W488-Y785 WeakPolarHBondContact O-CB 3.42Å
489	G	88.3	Confident	73.7	Confident	2 Å²	2	51.1 Å²	51.1	2%	0.021	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	61.3	36.2	-175	0	0	0	0	0	113	W421 V422 N423	W421-G489 WeakPolarHBondContact CZ3-O 3.18Å; V422-G489 PolarHBondContact O-N 3.05Å; N423-G489 PolarHBondContact O-N 2.63Å
490	E	91.1	Very high	76.4	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	137	-172.7	-70.7	179.1	-141.5	0	0	111.6	W421 V422 T448 S449 R451 W488 F492	W421-E490 WeakPolarHBondContact CA-O 3.37Å; V422-E490 PolarHBondContact N-O 2.88Å; V422-E490 PolarHBondContact O-N 2.66Å; V422-E490 VanDerWaalsContact O-N 3.15Å; T448-E490 WeakPolarHBondContact CA-OE2 3.43Å; T448-E490 WeakPolarHBondContact CB-OE2 3.26Å; S449-E490 VanDerWaalsContact CB-OE1 3.22Å; S449-E490 WeakPolarHBondContact CB-OE1 3.41Å; S449-E490 PolarHBondContact N-OE1 3.13Å; S449-E490 VanDerWaalsContact N-OE1 3.09Å; S449-E490 PolarHBondContact N-OE2 3.13Å; S449-E490 PolarHBondContact OG-OE1 3.32Å; R451-E490 IonicContact NE-OE1 3.91Å; W488-E490 VanDerWaalsContact C-N 3.28Å; W488-E490 HydrophobicContact CB-CB 4.41Å; W488-E490 HydrophobicContact CB-CG 4.11Å; W488-E490 PolarHBondContact O-N 3.24Å; E490-F492 HydrophobicContact CB-CE2 4.17Å; E490-F492 HydrophobicContact CB-CZ 4.2Å
491	F	89.9	Confident	78.9	Confident	48 Å²	48	47 Å²	47	21%	0.211	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	145	-178	-179.1	-128.6	0	0	0	111.3	L420 W421 E493 Q783	L420-F491 CarbonylContact O-C 3.54Å; L420-F491 WeakPolarHBondContact O-CD2 3.49Å; W421-F491 AromaticContact CD1-CD2 3.4Å; W421-F491 AromaticContact CD1-CE2 3.8Å; W421-F491 HydrophobicContact CD2-CB 3.95Å; W421-F491 AromaticContact CD2-CD2 3.94Å; W421-F491 HydrophobicContact CD2-CD2 3.94Å; W421-F491 HydrophobicContact CD2-CG 4.28Å; W421-F491 AromaticContact CE2-CD2 3.47Å; W421-F491 VanDerWaalsContact CE2-CD2 3.47Å; W421-F491 AromaticContact CE2-CG 3.73Å; W421-F491 HydrophobicContact CE3-CB 4.1Å; W421-F491 AromaticContact CG-CD2 3.89Å; W421-F491 HydrophobicContact CG-CD2 3.89Å; W421-F491 HydrophobicContact CH2-CB 3.89Å; W421-F491 HydrophobicContact CH2-CG 4.48Å; W421-F491 HydrophobicContact CZ2-CB 3.74Å; W421-F491 HydrophobicContact CZ2-CD1 4.49Å; W421-F491 HydrophobicContact CZ2-CD2 4.06Å; W421-F491 AromaticContact CZ2-CG 3.85Å; W421-F491 HydrophobicContact CZ2-CG 3.85Å; W421-F491 HydrophobicContact CZ3-CB 4.07Å; W421-F491 AromaticContact NE1-CD2 3.1Å; W421-F491 AromaticContact NE1-CE2 3.46Å; W421-F491 AromaticContact NE1-CG 3.82Å; F491-E493 HydrophobicContact CE1-CB 3.96Å; F491-E493 HydrophobicContact CZ-CB 3.97Å; F491-E493 HydrophobicContact CZ-CG 4.41Å; F491-Q783 PolarHBondContact O-NE2 2.89Å
492	F	89.1	Confident	81.2	Confident	3 Å²	3	45.9 Å²	45.9	1%	0.013	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	121.1	174.4	-53.1	-82.7	0	0	0	108.2	H364 L420 V422 A446 R447 T448 E490	H364-F492 AromaticContact CE1-CD1 3.78Å; H364-F492 AromaticContact CE1-CE1 3.6Å; H364-F492 AromaticContact NE2-CD1 3.64Å; H364-F492 AromaticContact NE2-CE1 3.91Å; L420-F492 HydrophobicContact CB-CB 4.49Å; L420-F492 PolarHBondContact N-O 2.71Å; L420-F492 PolarHBondContact O-N 3.38Å; V422-F492 HydrophobicContact CB-CE2 4.4Å; V422-F492 HydrophobicContact CG2-CD2 4.33Å; V422-F492 HydrophobicContact CG2-CE2 3.89Å; A446-F492 HydrophobicContact CB-CD1 3.47Å; A446-F492 VanDerWaalsContact CB-CD1 3.47Å; A446-F492 HydrophobicContact CB-CE1 3.67Å; A446-F492 HydrophobicContact CB-CG 4.18Å; R447-F492 WeakPolarHBondContact O-CE1 3.07Å; T448-F492 HydrophobicContact CG2-CE2 4.01Å; T448-F492 HydrophobicContact CG2-CZ 3.89Å; E490-F492 HydrophobicContact CB-CE2 4.17Å; E490-F492 HydrophobicContact CB-CZ 4.2Å
493	E	86.9	Confident	83.7	Confident	96 Å²	96	43 Å²	43	45%	0.449	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	121.8	170.3	-164.3	113.7	-107.5	0	0	107.5	S419 F491 R576	S419-E493 WeakPolarHBondContact CB-OE1 3.36Å; S419-E493 PolarHBondContact OG-OE1 2.94Å; F491-E493 HydrophobicContact CE1-CB 3.96Å; F491-E493 HydrophobicContact CZ-CB 3.97Å; F491-E493 HydrophobicContact CZ-CG 4.41Å; E493-R576 IonicContact OE1-NH2 2.67Å
494	L	86.6	Confident	85.5	Confident	16 Å²	16	41.7 Å²	41.7	8%	0.084	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	92.4	-175.1	-62	176	0	0	0	108.8	S417 L418 L440 F445 L497	S417-L494 CarbonylContact C-O 3.31Å; S417-L494 VanDerWaalsContact CA-O 3.31Å; S417-L494 WeakPolarHBondContact CA-O 3.41Å; L418-L494 HydrophobicContact CB-CB 4.38Å; L418-L494 HydrophobicContact CD2-CD1 4.45Å; L418-L494 PolarHBondContact N-O 2.99Å; L418-L494 PolarHBondContact O-N 3.46Å; L440-L494 HydrophobicContact CD1-CD1 4.15Å; F445-L494 HydrophobicContact CB-CD1 3.99Å; F445-L494 HydrophobicContact CD1-CD1 4.35Å; F445-L494 HydrophobicContact CD1-CD2 4.37Å; F445-L494 HydrophobicContact CG-CD1 4.44Å; L494-L497 HydrophobicContact CB-CD1 4.02Å; L494-L497 HydrophobicContact CB-CD2 4.23Å; L494-L497 HydrophobicContact CB-CG 4.32Å; L494-L497 VanDerWaalsContact O-CD1 3.3Å; L494-L497 WeakPolarHBondContact O-CD1 3.39Å; L494-L497 WeakPolarHBondContact O-CG 3.42Å
495	D	82.9	Confident	86.6	Confident	71 Å²	71	41.2 Å²	41.2	38%	0.38	23%	0.225	S	C	.	.			trans	-92.8	161.6	179.5	-71.6	-47.2	0	0	0	112.9	S417 L497	S417-D495 WeakPolarHBondContact CB-OD1 3.48Å; D495-L497 VanDerWaalsContact C-N 3.32Å; D495-L497 PolarHBondContact O-N 3.02Å
496	N	75.2	Confident	87.1	Confident	51 Å²	51	37.8 Å²	37.8	27%	0.273	21%	0.209	S	C	.	.	S	Bend	trans	58.2	40.4	177.8	-41.8	-80.1	0	0	0	112.9	R401 N416	R401-N496 PolarHBondContact NH1-ND2 2.92Å; R401-N496 PolarHBondContact NH1-OD1 3.08Å; N416-N496 PolarHBondContact O-N 3.21Å
497	L	81.6	Confident	87.2	Confident	10 Å²	10	37.7 Å²	37.7	5%	0.052	21%	0.208	C	C	.	.			trans	-73.2	147.5	-178.7	-70.7	171.4	0	0	0	111.7	N416 L418 L440 F445 L494 D495 I500	N416-L497 HydrophobicContact CB-CB 3.97Å; N416-L497 WeakPolarHBondContact CB-O 3.46Å; N416-L497 PolarHBondContact ND2-O 3.14Å; N416-L497 PolarHBondContact O-N 2.87Å; L418-L497 HydrophobicContact CB-CD1 3.65Å; L440-L497 HydrophobicContact CD1-CD1 3.86Å; L440-L497 HydrophobicContact CD1-CD2 3.62Å; L440-L497 HydrophobicContact CD1-CG 4.39Å; F445-L497 HydrophobicContact CD1-CD2 4.04Å; F445-L497 HydrophobicContact CE1-CD2 3.42Å; F445-L497 VanDerWaalsContact CE1-CD2 3.42Å; F445-L497 HydrophobicContact CZ-CD2 3.82Å; L494-L497 HydrophobicContact CB-CD1 4.02Å; L494-L497 HydrophobicContact CB-CD2 4.23Å; L494-L497 HydrophobicContact CB-CG 4.32Å; L494-L497 VanDerWaalsContact O-CD1 3.3Å; L494-L497 WeakPolarHBondContact O-CD1 3.39Å; L494-L497 WeakPolarHBondContact O-CG 3.42Å; D495-L497 VanDerWaalsContact C-N 3.32Å; D495-L497 PolarHBondContact O-N 3.02Å; L497-I500 HydrophobicContact CD1-CD1 4Å
498	P	78.4	Confident	87.2	Confident	72 Å²	72	34.8 Å²	34.8	47%	0.468	20%	0.195	S	C	.	.			trans	-62.7	172	166.8	29	-34.6	0	0	0	110.8	I500	P498-I500 VanDerWaalsContact C-N 3.29Å; P498-I500 HydrophobicContact CG-CG2 4.24Å; P498-I500 PolarHBondContact O-N 3.49Å
499	S	79.6	Confident	87	Confident	112 Å²	112	37.2 Å²	37.2	78%	0.783	20%	0.204	S	C	*	.	S	Bend	trans	-65.7	83.4	176.6	-63.2	0	0	0	0	112.1
500	I	83.8	Confident	86.7	Confident	21 Å²	21	39.9 Å²	39.9	11%	0.108	22%	0.216	C	C	.	.			trans	-83.9	158.8	-179.5	50.3	159	0	0	0	112.9	L440 D441 L497 P498 L535 F577	L440-I500 HydrophobicContact CB-CG2 3.98Å; L440-I500 HydrophobicContact CD1-CD1 4.22Å; L440-I500 HydrophobicContact CD2-CD1 4.25Å; D441-I500 WeakPolarHBondContact OD2-CA 3.25Å; L497-I500 HydrophobicContact CD1-CD1 4Å; P498-I500 VanDerWaalsContact C-N 3.29Å; P498-I500 HydrophobicContact CG-CG2 4.24Å; P498-I500 PolarHBondContact O-N 3.49Å; I500-L535 VanDerWaalsContact C-CD1 3.44Å; I500-L535 HydrophobicContact CB-CD1 4.01Å; I500-L535 HydrophobicContact CD1-CD1 3.59Å; I500-L535 HydrophobicContact CD1-CD2 4.08Å; I500-L535 HydrophobicContact CD1-CG 4.47Å; I500-L535 HydrophobicContact CG1-CD1 3.49Å; I500-L535 VanDerWaalsContact CG1-CD1 3.49Å; I500-L535 WeakPolarHBondContact O-CD1 3.35Å; I500-F577 HydrophobicContact CD1-CD2 4.29Å; I500-F577 HydrophobicContact CD1-CE2 3.79Å; I500-F577 HydrophobicContact CD1-CZ 4.46Å; I500-F577 HydrophobicContact CG1-CE2 3.95Å; I500-F577 HydrophobicContact CG1-CZ 4.18Å
501	S	85.1	Confident	85.6	Confident	74 Å²	74	45.4 Å²	45.4	52%	0.517	24%	0.242	S	C	.	.			trans	-115.9	-36.4	-179.8	79.4	0	0	0	0	115	D441 L535	D441-S501 VanDerWaalsContact CG-N 3.34Å; D441-S501 WeakPolarHBondContact OD1-CA 3.35Å; D441-S501 WeakPolarHBondContact OD1-CB 3.43Å; D441-S501 PolarHBondContact OD1-N 2.8Å; D441-S501 PolarHBondContact OD1-OG 2.85Å; D441-S501 PolarHBondContact OD2-N 3.28Å; S501-L535 VanDerWaalsContact C-CD1 3.5Å; S501-L535 WeakPolarHBondContact O-CG 3.29Å; S501-L535 PolarHBondContact O-N 3.27Å
502	Q	89.8	Confident	83.9	Confident	73 Å²	73	47.2 Å²	47.2	34%	0.341	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	152.8	-175.8	60.9	-178.4	-24.8	0	0	112.9	D441	D441-Q502 PolarHBondContact N-O 3.49Å; D441-Q502 VanDerWaalsContact N-O 3.08Å; D441-Q502 WeakPolarHBondContact OD1-CG 3.36Å; D441-Q502 PolarHBondContact OD1-N 3.21Å
503	I	93.8	Very high	81.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	132.7	168.5	-48.3	170.5	0	0	0	108.2	L418 V438 H439 L440 L505 N532 I533 L535 I538	L418-I503 HydrophobicContact CD1-CD1 3.65Å; L418-I503 HydrophobicContact CD2-CD1 3.54Å; L418-I503 HydrophobicContact CD2-CG1 3.95Å; L418-I503 HydrophobicContact CG-CD1 4.26Å; V438-I503 HydrophobicContact CG1-CG2 4.42Å; H439-I503 WeakPolarHBondContact O-CA 3.26Å; L440-I503 HydrophobicContact CD2-CB 4.22Å; L440-I503 HydrophobicContact CD2-CG1 3.81Å; L440-I503 HydrophobicContact CD2-CG2 4.01Å; I503-L505 HydrophobicContact CG2-CD1 3.73Å; I503-N532 CarbonylContact O-C 3.41Å; I503-N532 WeakPolarHBondContact O-CA 3.39Å; I503-I533 HydrophobicContact CB-CB 4.38Å; I503-I533 PolarHBondContact N-O 3.36Å; I503-I533 PolarHBondContact O-N 3.43Å; I503-L535 HydrophobicContact CD1-CD2 3.91Å; I503-L535 HydrophobicContact CG1-CD2 3.68Å; I503-I538 HydrophobicContact CD1-CD1 3.52Å
504	S	93.1	Very high	80.2	Confident	11 Å²	11	56.5 Å²	56.5	8%	0.077	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	116.5	173.6	-70.2	0	0	0	0	110.1	H439 V531 N532	H439-S504 WeakPolarHBondContact CA-O 3.32Å; H439-S504 WeakPolarHBondContact CB-O 3.35Å; H439-S504 PolarHBondContact N-O 3.04Å; H439-S504 PolarHBondContact O-N 3.38Å; S504-V531 CarbonylContact C-O 3.58Å; S504-V531 WeakPolarHBondContact CA-O 3.43Å; S504-N532 WeakPolarHBondContact CB-OD1 3.26Å; S504-N532 PolarHBondContact OG-OD1 3.3Å
505	L	94	Very high	78.5	Confident	2 Å²	2	61.9 Å²	61.9	1%	0.01	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	121.6	173.6	-62.6	88.2	0	0	0	109.5	V422 E437 V438 I503 S530 V531 I533 L571 I573	V422-L505 HydrophobicContact CG2-CD2 3.67Å; E437-L505 CarbonylContact O-C 3.58Å; E437-L505 VanDerWaalsContact O-CA 3.31Å; E437-L505 WeakPolarHBondContact O-CA 3.15Å; V438-L505 HydrophobicContact CG2-CD2 4.31Å; V438-L505 HydrophobicContact CG2-CG 4.49Å; I503-L505 HydrophobicContact CG2-CD1 3.73Å; L505-S530 CarbonylContact O-C 3.56Å; L505-S530 VanDerWaalsContact O-CA 3.27Å; L505-S530 WeakPolarHBondContact O-CA 3.41Å; L505-V531 HydrophobicContact CB-CB 4.49Å; L505-V531 PolarHBondContact N-O 2.99Å; L505-V531 PolarHBondContact O-N 3.45Å; L505-I533 HydrophobicContact CD1-CD1 4.29Å; L505-L571 HydrophobicContact CB-CD2 4.27Å; L505-L571 HydrophobicContact CD2-CD2 4.16Å; L505-I573 HydrophobicContact CD1-CD1 3.81Å; L505-I573 HydrophobicContact CD2-CD1 3.89Å; L505-I573 HydrophobicContact CD2-CG1 4.4Å; L505-I573 HydrophobicContact CG-CD1 4.41Å
506	H	91.9	Very high	76.8	Confident	44 Å²	44	65.6 Å²	65.6	20%	0.204	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	121	-179.9	-67.4	119.6	0	0	0	110.4	C436 E437 H439 F508 P527	C436-H506 CarbonylContact C-O 3.56Å; C436-H506 VanDerWaalsContact CA-O 3.28Å; C436-H506 WeakPolarHBondContact CA-O 3.35Å; E437-H506 HydrophobicContact CB-CB 4.36Å; E437-H506 PolarHBondContact N-O 3.2Å; E437-H506 PolarHBondContact O-N 3.38Å; H439-H506 AromaticContact CD2-CE1 3.82Å; H439-H506 AromaticContact CD2-ND1 3.09Å; H439-H506 PolarHBondContact CD2-ND1 3.04Å; H439-H506 AromaticContact CE1-ND1 3.73Å; H439-H506 AromaticContact CG-ND1 3.79Å; H439-H506 AromaticContact NE2-CE1 3.88Å; H439-H506 AromaticContact NE2-ND1 3.03Å; H439-H506 PolarHBondContact NE2-ND1 3.32Å; H506-F508 HydrophobicContact CB-CD2 4.11Å; H506-F508 HydrophobicContact CB-CE2 3.57Å; H506-F508 HydrophobicContact CB-CZ 4.5Å; H506-P527 HydrophobicContact CB-CB 3.95Å
507	L	91.2	Very high	75.2	Confident	4 Å²	4	74.3 Å²	74.3	2%	0.021	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	118.5	177.1	-179	68.4	0	0	0	110.5	L428 Y434 W488 L528 G529 I550	L428-L507 HydrophobicContact CD1-CD2 4.29Å; L428-L507 HydrophobicContact CD2-CD2 3.67Å; Y434-L507 HydrophobicContact CD1-CD1 4.27Å; Y434-L507 HydrophobicContact CD1-CD2 4.36Å; Y434-L507 HydrophobicContact CD1-CG 4.32Å; W488-L507 HydrophobicContact CH2-CD1 3.93Å; W488-L507 HydrophobicContact CZ2-CD1 4.37Å; L507-L528 PolarHBondContact O-N 3Å; L507-G529 PolarHBondContact N-O 3.46Å; L507-I550 HydrophobicContact CD2-CD1 4.04Å
508	F	89.1	Confident	73.3	Confident	19 Å²	19	82.5 Å²	82.5	8%	0.083	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	167.7	175.4	-75	-92.8	0	0	0	112.2	Y434 Y435 E437 H506 P527	Y434-F508 VanDerWaalsContact CA-O 3.32Å; Y434-F508 WeakPolarHBondContact CA-O 3.18Å; Y434-F508 WeakPolarHBondContact CB-O 3.45Å; Y434-F508 WeakPolarHBondContact CD1-O 3.38Å; Y435-F508 HydrophobicContact CD1-CB 4.06Å; Y435-F508 HydrophobicContact CD2-CB 4.08Å; Y435-F508 HydrophobicContact CE1-CB 3.58Å; Y435-F508 HydrophobicContact CE2-CB 3.61Å; Y435-F508 HydrophobicContact CE2-CD2 4.08Å; Y435-F508 AromaticContact CE2-CG 3.98Å; Y435-F508 HydrophobicContact CE2-CG 3.98Å; Y435-F508 HydrophobicContact CG-CB 4.3Å; Y435-F508 AromaticContact CZ-CG 3.88Å; Y435-F508 PolarHBondContact N-O 3.13Å; Y435-F508 PolarHBondContact O-N 3.05Å; E437-F508 HydrophobicContact CB-CD2 4.35Å; E437-F508 HydrophobicContact CB-CE2 4.09Å; E437-F508 HydrophobicContact CG-CD2 3.71Å; E437-F508 HydrophobicContact CG-CE2 3.61Å; E437-F508 WeakPolarHBondContact OE2-CE2 3.4Å; E437-F508 WeakPolarHBondContact OE2-CZ 3.3Å; H506-F508 HydrophobicContact CB-CD2 4.11Å; H506-F508 HydrophobicContact CB-CE2 3.57Å; H506-F508 HydrophobicContact CB-CZ 4.5Å; F508-P527 HydrophobicContact CD1-CB 4.45Å; F508-P527 HydrophobicContact CD2-CB 4.29Å; F508-P527 HydrophobicContact CE1-CB 4.08Å; F508-P527 HydrophobicContact CE2-CB 3.91Å; F508-P527 HydrophobicContact CZ-CB 3.8Å; F508-P527 HydrophobicContact CZ-CG 4.23Å
509	R	86.3	Confident	71.4	Confident	51 Å²	51	82.3 Å²	82.3	19%	0.192	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	123.1	-176.1	-171.7	172.5	74.3	168.7	0.1	110	Y434 L528 E563	Y434-R509 HydrophobicContact CD1-CB 4.09Å; Y434-R509 HydrophobicContact CD1-CG 4.16Å; Y434-R509 HydrophobicContact CE1-CB 4.14Å; Y434-R509 HydrophobicContact CE1-CG 3.88Å; R509-L528 HydrophobicContact CB-CD1 3.98Å; R509-L528 HydrophobicContact CB-CG 4.33Å; R509-E563 IonicContact CZ-OE2 2.88Å; R509-E563 IonicContact NH1-OE2 3.52Å; R509-E563 PolarHBondContact NH1-OE2 3.29Å; R509-E563 IonicContact NH2-OE2 2.75Å
510	E	80.9	Confident	69.5	Low	59 Å²	59	88.9 Å²	88.9	28%	0.276	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	145	176.2	-168	-178.5	-161.4	0	0	110.1	R433 S450	R433-E510 HydrophobicContact CB-CB 4.05Å; R433-E510 WeakPolarHBondContact CB-OE2 3.41Å; R433-E510 WeakPolarHBondContact CD-OE2 3.46Å; R433-E510 IonicContact CZ-OE2 3.51Å; R433-E510 IonicContact NE-OE2 3.87Å; R433-E510 PolarHBondContact NE-OE2 2.8Å; R433-E510 IonicContact NH1-OE1 3.67Å; R433-E510 PolarHBondContact NH1-OE1 3.02Å; R433-E510 IonicContact NH1-OE2 2.7Å; R433-E510 PolarHBondContact NH1-OE2 3.39Å; R433-E510 PolarHBondContact O-N 2.84Å; S450-E510 WeakPolarHBondContact CB-OE2 3.38Å; S450-E510 PolarHBondContact OG-OE2 3.14Å
511	E	69.8	Low	67.5	Low	117 Å²	117	91.8 Å²	91.8	55%	0.547	43%	0.43	S	S	.	.			trans	-110.8	141.4	-175.2	-172.4	161.6	-124.7	0	0	112.4	S513	E511-S513 PolarHBondContact O-N 2.92Å; E511-S513 VanDerWaalsContact O-N 3.08Å
512	D	54	Low	65.5	Low	85 Å²	85	95.7 Å²	95.7	46%	0.455	44%	0.44	S	S	.	.			trans	-57.9	112.5	-177	-64.8	-52.4	0	0	0	111.8	K514 K515	D512-K514 PolarHBondContact O-N 2.94Å; D512-K515 HydrophobicContact CB-CD 4.19Å; D512-K515 HydrophobicContact CB-CG 4.35Å; D512-K515 PolarHBondContact O-N 3.39Å; D512-K515 IonicContact OD2-NZ 3.33Å; D512-K515 PolarHBondContact OD2-NZ 3Å
513	S	47.2	Very low	63.2	Low	88 Å²	88	95.5 Å²	95.5	62%	0.615	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-52.1	-27.4	174.6	57.2	0	0	0	0	113.6	E511 K515 K516	E511-S513 PolarHBondContact O-N 2.92Å; E511-S513 VanDerWaalsContact O-N 3.08Å; S513-K515 PolarHBondContact O-N 3.49Å; S513-K516 WeakPolarHBondContact O-CB 3.27Å; S513-K516 PolarHBondContact O-N 3.09Å
514	K	49.4	Very low	61.2	Low	206 Å²	206	98.4 Å²	98.4	90%	0.896	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-66.1	-12.8	175.4	-64.2	-179.5	-179	176.1	0	114.7	D512	D512-K514 PolarHBondContact O-N 2.94Å
515	K	50.8	Low	59.4	Low	129 Å²	129	103.9 Å²	103.9	56%	0.561	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-103.6	-6.3	178.9	-68.9	172.1	-175.2	148.6	0	114.2	D512 S513 R517 H518	D512-K515 HydrophobicContact CB-CD 4.19Å; D512-K515 HydrophobicContact CB-CG 4.35Å; D512-K515 PolarHBondContact O-N 3.39Å; D512-K515 IonicContact OD2-NZ 3.33Å; D512-K515 PolarHBondContact OD2-NZ 3Å; S513-K515 PolarHBondContact O-N 3.49Å; K515-R517 PolarHBondContact O-N 3.25Å; K515-H518 PolarHBondContact O-N 3.26Å
516	K	47.2	Very low	58.2	Low	149 Å²	149	109 Å²	109	65%	0.648	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	21.1	-170.7	-149.8	-179.1	-176.5	-178.8	0	116.3	V268 S513	V268-K516 VanDerWaalsContact CG2-NZ 3.29Å; S513-K516 WeakPolarHBondContact O-CB 3.27Å; S513-K516 PolarHBondContact O-N 3.09Å
517	R	42.4	Very low	57.7	Low	234 Å²	234	107.9 Å²	107.9	88%	0.883	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.2	-15.6	179.2	-79.5	-169.7	174	-170.5	-1.8	115.4	K515	K515-R517 PolarHBondContact O-N 3.25Å
518	H	41	Very low	57.4	Low	183 Å²	183	109.6 Å²	109.6	85%	0.847	52%	0.524	S	S	*	.	S	Bend	trans	-133.4	8	-167.6	-77.7	82.3	0	0	0	115.5	K515	K515-H518 PolarHBondContact O-N 3.26Å
519	S	40.1	Very low	57.3	Low	68 Å²	68	108.8 Å²	108.8	48%	0.476	52%	0.521	S	S	.	.			trans	-146.7	140.7	168.2	177.8	0	0	0	0	110.5	D521	S519-D521 WeakPolarHBondContact OG-CB 3.46Å; S519-D521 PolarHBondContact OG-N 2.64Å; S519-D521 PolarHBondContact OG-OD1 3.03Å; S519-D521 PolarHBondContact OG-OD2 3.38Å
520	R	39.5	Very low	57.5	Low	250 Å²	250	107.5 Å²	107.5	94%	0.943	52%	0.519	S	S	*	.			trans	-117.3	39.8	165.7	-167.3	-171.5	169.1	172	-1.9	108.6
521	D	40.2	Very low	58.2	Low	82 Å²	82	104.9 Å²	104.9	44%	0.439	51%	0.507	S	S	.	.			trans	-61.6	134.3	172.4	-71.2	-27	0	0	0	109.5	S519 C523 K562	S519-D521 WeakPolarHBondContact OG-CB 3.46Å; S519-D521 PolarHBondContact OG-N 2.64Å; S519-D521 PolarHBondContact OG-OD1 3.03Å; S519-D521 PolarHBondContact OG-OD2 3.38Å; D521-C523 HydrophobicContact CB-CB 4.48Å; D521-C523 PolarHBondContact O-N 3.4Å; D521-K562 IonicContact OD2-NZ 3.43Å; D521-K562 PolarHBondContact OD2-NZ 3.28Å
522	E	43.6	Very low	59.2	Low	155 Å²	155	103.3 Å²	103.3	72%	0.724	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-70.8	2.4	-177.6	-60.9	169.5	134	0	0	113.4	S524 L525	E522-S524 PolarHBondContact O-N 3.07Å; E522-L525 PolarHBondContact O-N 3.01Å
523	C	42	Very low	61.1	Low	70 Å²	70	99.3 Å²	99.3	47%	0.473	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-67.3	-4.1	-171.5	-62.4	0	0	0	0	116.3	D521	D521-C523 HydrophobicContact CB-CB 4.48Å; D521-C523 PolarHBondContact O-N 3.4Å
524	S	51.2	Low	63.1	Low	61 Å²	61	98.3 Å²	98.3	43%	0.427	47%	0.472	S	S	.	.	G	3₁₀ helix	trans	-95.9	-9	177.9	50.1	0	0	0	0	113.9	E522	E522-S524 PolarHBondContact O-N 3.07Å
525	L	56.4	Low	64.8	Low	125 Å²	125	89 Å²	89	65%	0.654	43%	0.432	S	S	*	.	S	Bend	trans	-97	-8.3	-178.5	-64.6	175.9	0	0	0	114.2	E522	E522-L525 PolarHBondContact O-N 3.01Å
526	H	68.4	Low	66.5	Low	110 Å²	110	86.9 Å²	86.9	51%	0.509	44%	0.439	S	S	.	.	S	Bend	trans	-111.1	138.8	-177.8	-67.4	-54.1	0	0	0	112
527	P	81.6	Confident	68.3	Low	21 Å²	21	83.4 Å²	83.4	14%	0.136	43%	0.428	C	S	.	.			trans	-67.9	146.7	174.5	29.9	-34.8	0	0	0	110.3	H506 F508 G529 F553	H506-P527 HydrophobicContact CB-CB 3.95Å; F508-P527 HydrophobicContact CD1-CB 4.45Å; F508-P527 HydrophobicContact CD2-CB 4.29Å; F508-P527 HydrophobicContact CE1-CB 4.08Å; F508-P527 HydrophobicContact CE2-CB 3.91Å; F508-P527 HydrophobicContact CZ-CB 3.8Å; F508-P527 HydrophobicContact CZ-CG 4.23Å; P527-G529 VanDerWaalsContact C-N 3.26Å; P527-G529 PolarHBondContact O-N 3.02Å; P527-F553 HydrophobicContact CG-CD2 4.42Å; P527-F553 VanDerWaalsContact O-CB 3.24Å; P527-F553 WeakPolarHBondContact O-CB 3.28Å
528	L	84.1	Confident	70.5	Confident	40 Å²	40	72.3 Å²	72.3	21%	0.209	39%	0.386	C	S	.	.	S	Bend	trans	-68.5	-30.7	173.6	-59.8	-177.5	0	0	0	111.7	Y434 L507 R509 P552 F553 L565	Y434-L528 HydrophobicContact CD1-CD1 4Å; Y434-L528 HydrophobicContact CE1-CD1 3.57Å; L507-L528 PolarHBondContact O-N 3Å; R509-L528 HydrophobicContact CB-CD1 3.98Å; R509-L528 HydrophobicContact CB-CG 4.33Å; L528-P552 WeakPolarHBondContact O-CA 3.29Å; L528-F553 PolarHBondContact O-N 3.23Å; L528-L565 HydrophobicContact CB-CD1 3.74Å; L528-L565 HydrophobicContact CB-CG 4.09Å; L528-L565 HydrophobicContact CD1-CD2 4.17Å
529	G	87.8	Confident	72.6	Confident	2 Å²	2	71.2 Å²	71.2	2%	0.021	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	174.8	178.5	0	0	0	0	0	112.4	L507 P527 T551	L507-G529 PolarHBondContact N-O 3.46Å; P527-G529 VanDerWaalsContact C-N 3.26Å; P527-G529 PolarHBondContact O-N 3.02Å; G529-T551 CarbonylContact C-O 3.58Å; G529-T551 WeakPolarHBondContact CA-O 3.32Å
530	S	90.9	Very high	74.4	Confident	24 Å²	24	69.4 Å²	69.4	17%	0.168	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	154.7	-177	60.1	0	0	0	0	113.1	L505 T551	L505-S530 CarbonylContact O-C 3.56Å; L505-S530 VanDerWaalsContact O-CA 3.27Å; L505-S530 WeakPolarHBondContact O-CA 3.41Å; S530-T551 PolarHBondContact N-O 2.7Å; S530-T551 PolarHBondContact O-N 3.04Å
531	V	93.7	Very high	76.2	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.024	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	120.9	166.2	167.8	0	0	0	0	107.6	S504 L505 I533 Y548 I550 L571 I573	S504-V531 CarbonylContact C-O 3.58Å; S504-V531 WeakPolarHBondContact CA-O 3.43Å; L505-V531 HydrophobicContact CB-CB 4.49Å; L505-V531 PolarHBondContact N-O 2.99Å; L505-V531 PolarHBondContact O-N 3.45Å; V531-I533 HydrophobicContact CG1-CD1 4.43Å; V531-I533 HydrophobicContact CG1-CG1 4.07Å; V531-Y548 VanDerWaalsContact CG1-CB 3.45Å; V531-Y548 HydrophobicContact CG1-CD1 4.16Å; V531-Y548 HydrophobicContact CG1-CG 3.83Å; V531-I550 HydrophobicContact CG2-CB 4.45Å; V531-I550 HydrophobicContact CG2-CG1 3.89Å; V531-L571 HydrophobicContact CG2-CB 4.25Å; V531-L571 HydrophobicContact CG2-CD2 4.37Å; V531-I573 HydrophobicContact CG1-CD1 3.79Å
532	N	92.5	Very high	78.2	Confident	84 Å²	84	61.6 Å²	61.6	45%	0.449	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	131.2	176.7	-65.1	-21.5	0	0	0	109.8	I503 S504	I503-N532 CarbonylContact O-C 3.41Å; I503-N532 WeakPolarHBondContact O-CA 3.39Å; S504-N532 WeakPolarHBondContact CB-OD1 3.26Å; S504-N532 PolarHBondContact OG-OD1 3.3Å
533	I	92.7	Very high	80.3	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	112.9	-180	-52.7	-180	0	0	0	108.5	I503 L505 V531 I538 Y548 I573	I503-I533 HydrophobicContact CB-CB 4.38Å; I503-I533 PolarHBondContact N-O 3.36Å; I503-I533 PolarHBondContact O-N 3.43Å; L505-I533 HydrophobicContact CD1-CD1 4.29Å; V531-I533 HydrophobicContact CG1-CD1 4.43Å; V531-I533 HydrophobicContact CG1-CG1 4.07Å; I533-I538 HydrophobicContact CG2-CG2 3.9Å; I533-Y548 HydrophobicContact CD1-CD1 4.41Å; I533-Y548 HydrophobicContact CD1-CD2 4.2Å; I533-Y548 HydrophobicContact CD1-CE1 3.99Å; I533-Y548 HydrophobicContact CD1-CE2 3.73Å; I533-Y548 HydrophobicContact CG1-CD1 4.1Å; I533-Y548 HydrophobicContact CG1-CE1 3.74Å; I533-Y548 HydrophobicContact CG1-CE2 4.4Å; I533-Y548 HydrophobicContact CG2-CE1 4.3Å; I533-I573 HydrophobicContact CD1-CB 4.38Å; I533-I573 HydrophobicContact CD1-CD1 3.8Å; I533-I573 HydrophobicContact CD1-CG2 3.94Å
534	P	89.8	Confident	82.6	Confident	67 Å²	67	57.9 Å²	57.9	44%	0.435	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	134	169.6	-18.2	31.9	0	0	0	110.3	A536 D537	P534-A536 PolarHBondContact O-N 2.91Å; P534-A536 VanDerWaalsContact O-N 3.13Å; P534-D537 WeakPolarHBondContact O-CB 3.34Å; P534-D537 PolarHBondContact O-N 3.26Å
535	L	85.9	Confident	84.7	Confident	10 Å²	10	58.2 Å²	58.2	5%	0.052	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-63.4	-24.2	-176.9	-65.3	171.6	0	0	0	113.5	I500 S501 I503 D537 I538 R539 F577	I500-L535 VanDerWaalsContact C-CD1 3.44Å; I500-L535 HydrophobicContact CB-CD1 4.01Å; I500-L535 HydrophobicContact CD1-CD1 3.59Å; I500-L535 HydrophobicContact CD1-CD2 4.08Å; I500-L535 HydrophobicContact CD1-CG 4.47Å; I500-L535 HydrophobicContact CG1-CD1 3.49Å; I500-L535 VanDerWaalsContact CG1-CD1 3.49Å; I500-L535 WeakPolarHBondContact O-CD1 3.35Å; S501-L535 VanDerWaalsContact C-CD1 3.5Å; S501-L535 WeakPolarHBondContact O-CG 3.29Å; S501-L535 PolarHBondContact O-N 3.27Å; I503-L535 HydrophobicContact CD1-CD2 3.91Å; I503-L535 HydrophobicContact CG1-CD2 3.68Å; L535-D537 PolarHBondContact O-N 3.26Å; L535-I538 HydrophobicContact CD2-CD1 4.04Å; L535-I538 HydrophobicContact CD2-CG1 4.42Å; L535-I538 WeakPolarHBondContact O-CG1 3.4Å; L535-I538 PolarHBondContact O-N 3.1Å; L535-I538 VanDerWaalsContact O-N 3.15Å; L535-R539 PolarHBondContact O-N 2.97Å; L535-F577 HydrophobicContact CB-CD1 4.01Å; L535-F577 HydrophobicContact CB-CE1 4.36Å; L535-F577 HydrophobicContact CB-CG 4.41Å; L535-F577 HydrophobicContact CD1-CD1 4.39Å; L535-F577 HydrophobicContact CD1-CE1 4.14Å; L535-F577 HydrophobicContact CD1-CE2 4.32Å; L535-F577 HydrophobicContact CD1-CZ 4.11Å; L535-F577 HydrophobicContact CD2-CB 4.18Å; L535-F577 HydrophobicContact CD2-CD1 4.38Å; L535-F577 HydrophobicContact CD2-CD2 4.09Å; L535-F577 HydrophobicContact CD2-CG 3.96Å; L535-F577 HydrophobicContact CG-CD1 4.5Å
536	A	84.7	Confident	86.4	Confident	85 Å²	85	56 Å²	56	70%	0.702	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-57	-33.1	173.6	0	0	0	0	0	113	P534 I538	P534-A536 PolarHBondContact O-N 2.91Å; P534-A536 VanDerWaalsContact O-N 3.13Å; A536-I538 PolarHBondContact O-N 3.39Å
537	D	85.2	Confident	87.7	Confident	77 Å²	77	54 Å²	54	41%	0.412	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-74.4	-13.2	-178.7	-73.5	-5.3	0	0	0	113.6	P534 L535	P534-D537 WeakPolarHBondContact O-CB 3.34Å; P534-D537 PolarHBondContact O-N 3.26Å; L535-D537 PolarHBondContact O-N 3.26Å
538	I	88.4	Confident	88.2	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-131.3	7	-171.7	66.2	159.9	0	0	0	114.2	L418 I503 I533 L535 A536 Q544 A575 F577	L418-I538 HydrophobicContact CD1-CD1 4.02Å; I503-I538 HydrophobicContact CD1-CD1 3.52Å; I533-I538 HydrophobicContact CG2-CG2 3.9Å; L535-I538 HydrophobicContact CD2-CD1 4.04Å; L535-I538 HydrophobicContact CD2-CG1 4.42Å; L535-I538 WeakPolarHBondContact O-CG1 3.4Å; L535-I538 PolarHBondContact O-N 3.1Å; L535-I538 VanDerWaalsContact O-N 3.15Å; A536-I538 PolarHBondContact O-N 3.39Å; I538-Q544 HydrophobicContact CG2-CB 4.16Å; I538-Q544 HydrophobicContact CG2-CG 4.46Å; I538-A575 HydrophobicContact CB-CB 4.43Å; I538-A575 HydrophobicContact CD1-CB 3.71Å; I538-A575 HydrophobicContact CG2-CB 4.23Å; I538-F577 HydrophobicContact CD1-CB 3.91Å; I538-F577 HydrophobicContact CG1-CB 3.92Å; I538-F577 PolarHBondContact O-N 2.95Å
539	R	85.1	Confident	88.6	Confident	160 Å²	160	56.9 Å²	56.9	60%	0.604	30%	0.3	S	S	*	.	B	Isolated β-bridge	trans	-72.9	128.9	179.9	-168.3	179.5	-175	-164.5	3.2	111.2	L535 F577 N579	L535-R539 PolarHBondContact O-N 2.97Å; R539-F577 CarbonylContact C-O 3.51Å; R539-F577 WeakPolarHBondContact CA-O 3.29Å; R539-F577 HydrophobicContact CG-CD1 4.33Å; R539-N579 PolarHBondContact NH2-OD1 3.35Å
540	G	79.1	Confident	88.8	Confident	30 Å²	30	57.4 Å²	57.4	31%	0.309	30%	0.302	S	S	.	.	S	Bend	trans	137.9	-165.7	170.6	0	0	0	0	0	115	R576 F577	G540-R576 VanDerWaalsContact O-CG 3.3Å; G540-R576 WeakPolarHBondContact O-CG 3.41Å; G540-F577 PolarHBondContact N-O 3.37Å
541	R	76.1	Confident	88.7	Confident	80 Å²	80	60.5 Å²	60.5	30%	0.302	32%	0.32	S	S	.	.	S	Bend	trans	-79.2	-30.8	179	-67.1	-168.4	-172.8	-85.9	-13.3	114	R576 G865 D869	R541-R576 VanDerWaalsContact O-CD 3.3Å; R541-R576 WeakPolarHBondContact O-CD 3.39Å; R541-G865 PolarHBondContact NH2-O 2.92Å; R541-G865 VanDerWaalsContact NH2-O 3.11Å; R541-D869 IonicContact CZ-OD2 3.78Å; R541-D869 IonicContact NE-OD2 2.9Å; R541-D869 PolarHBondContact NE-OD2 2.94Å; R541-D869 IonicContact NH2-OD2 2.68Å; R541-D869 PolarHBondContact NH2-OD2 3.07Å
542	T	82.3	Confident	88.3	Confident	89 Å²	89	63.4 Å²	63.4	55%	0.546	34%	0.339	S	S	.	.	S	Bend	trans	-87.4	131.2	-175	47.5	0	0	0	0	111.8	Q544	T542-Q544 PolarHBondContact O-N 3.37Å
543	Y	87.6	Confident	87.5	Confident	73 Å²	73	65.2 Å²	65.2	29%	0.286	34%	0.343	S	S	.	.			trans	-61.7	132.5	166.7	-74.8	-84.7	0	0	0	111.2	S419 K574 R576	S419-Y543 VanDerWaalsContact CB-OH 3.25Å; S419-Y543 WeakPolarHBondContact CB-OH 3.32Å; Y543-K574 HydrophobicContact CD1-CG 3.98Å; Y543-K574 HydrophobicContact CG-CG 4.3Å; Y543-R576 HydrophobicContact CD1-CB 3.62Å; Y543-R576 HydrophobicContact CE1-CB 3.74Å; Y543-R576 HydrophobicContact CG-CB 4.1Å
544	Q	91.9	Very high	86	Confident	74 Å²	74	74.5 Å²	74.5	35%	0.346	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	113	172.6	-61.5	-74.4	29.8	0	0	108.9	I538 T542 K574 A575	I538-Q544 HydrophobicContact CG2-CB 4.16Å; I538-Q544 HydrophobicContact CG2-CG 4.46Å; T542-Q544 PolarHBondContact O-N 3.37Å; Q544-K574 WeakPolarHBondContact O-CA 3.41Å; Q544-A575 PolarHBondContact N-O 3.26Å; Q544-A575 PolarHBondContact O-N 3.23Å
545	E	94.1	Very high	84.2	Confident	67 Å²	67	75.4 Å²	75.4	31%	0.313	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	122.5	174.3	-176	153.2	-166.2	0	0	110.7	N423 R572 I573 K574	N423-E545 PolarHBondContact ND2-OE1 3.44Å; E545-R572 IonicContact OE1-CZ 3.87Å; E545-R572 IonicContact OE1-NE 3.31Å; E545-R572 PolarHBondContact OE1-NE 3.18Å; E545-R572 IonicContact OE1-NH2 2.68Å; E545-R572 PolarHBondContact OE1-NH2 2.88Å; E545-I573 WeakPolarHBondContact CA-O 3.45Å; E545-K574 HydrophobicContact CB-CB 3.81Å; E545-K574 HydrophobicContact CB-CG 4.03Å; E545-K574 HydrophobicContact CG-CB 3.89Å; E545-K574 WeakPolarHBondContact OE2-CD 3.45Å
546	K	93.3	Very high	82	Confident	78 Å²	78	79.7 Å²	79.7	34%	0.339	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	152.2	-176.2	-61.7	175.3	-171.6	161.4	0	110.9	Y548 I573	K546-Y548 HydrophobicContact CB-CD2 4.25Å; K546-Y548 HydrophobicContact CB-CE2 3.65Å; K546-Y548 WeakPolarHBondContact O-CD2 3.22Å; K546-I573 PolarHBondContact N-O 2.89Å; K546-I573 PolarHBondContact O-N 3.11Å
547	W	94.4	Very high	79.9	Confident	70 Å²	70	80.8 Å²	80.8	27%	0.265	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	126.4	163.6	-77.4	107.6	0	0	0	109.4	D97 E424 K426 R572	D97-W547 PolarHBondContact OD1-NE1 3.21Å; E424-W547 HydrophobicContact CG-CH2 3.77Å; E424-W547 HydrophobicContact CG-CZ2 4.41Å; E424-W547 HydrophobicContact CG-CZ3 4.37Å; E424-W547 WeakPolarHBondContact OE1-CH2 3.43Å; E424-W547 VanDerWaalsContact OE1-CZ2 3.27Å; E424-W547 WeakPolarHBondContact OE1-CZ2 3.33Å; K426-W547 HydrophobicContact CB-CH2 4.25Å; K426-W547 HydrophobicContact CB-CZ3 4.32Å; K426-W547 HydrophobicContact CD-CE3 4.27Å; K426-W547 HydrophobicContact CD-CH2 3.6Å; K426-W547 HydrophobicContact CD-CZ2 3.98Å; K426-W547 HydrophobicContact CD-CZ3 3.75Å; K426-W547 HydrophobicContact CG-CE3 4.32Å; K426-W547 HydrophobicContact CG-CH2 3.85Å; K426-W547 HydrophobicContact CG-CZ3 3.63Å; W547-R572 HydrophobicContact CD2-CB 3.91Å; W547-R572 HydrophobicContact CD2-CG 3.71Å; W547-R572 HydrophobicContact CE3-CB 3.69Å; W547-R572 HydrophobicContact CE3-CG 4.06Å; W547-R572 HydrophobicContact CG-CG 4.13Å; W547-R572 HydrophobicContact CH2-CB 3.94Å; W547-R572 HydrophobicContact CH2-CG 4.35Å; W547-R572 HydrophobicContact CZ2-CB 4.15Å; W547-R572 HydrophobicContact CZ2-CG 4.05Å; W547-R572 HydrophobicContact CZ3-CB 3.71Å; W547-R572 HydrophobicContact CZ3-CG 4.36Å
548	Y	93.4	Very high	77.9	Confident	24 Å²	24	83.5 Å²	83.5	9%	0.094	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	132	176.8	-65.3	-93.8	0	0	0	110.6	V531 I533 K546 S570 L571 I573	V531-Y548 VanDerWaalsContact CG1-CB 3.45Å; V531-Y548 HydrophobicContact CG1-CD1 4.16Å; V531-Y548 HydrophobicContact CG1-CG 3.83Å; I533-Y548 HydrophobicContact CD1-CD1 4.41Å; I533-Y548 HydrophobicContact CD1-CD2 4.2Å; I533-Y548 HydrophobicContact CD1-CE1 3.99Å; I533-Y548 HydrophobicContact CD1-CE2 3.73Å; I533-Y548 HydrophobicContact CG1-CD1 4.1Å; I533-Y548 HydrophobicContact CG1-CE1 3.74Å; I533-Y548 HydrophobicContact CG1-CE2 4.4Å; I533-Y548 HydrophobicContact CG2-CE1 4.3Å; K546-Y548 HydrophobicContact CB-CD2 4.25Å; K546-Y548 HydrophobicContact CB-CE2 3.65Å; K546-Y548 WeakPolarHBondContact O-CD2 3.22Å; Y548-S570 CarbonylContact O-C 3.42Å; Y548-S570 WeakPolarHBondContact O-CA 3.48Å; Y548-S570 VanDerWaalsContact O-CB 3.29Å; Y548-S570 WeakPolarHBondContact O-CB 3.46Å; Y548-L571 PolarHBondContact N-O 3.49Å; Y548-L571 PolarHBondContact O-N 2.91Å; Y548-I573 HydrophobicContact CD2-CB 3.93Å; Y548-I573 HydrophobicContact CD2-CD1 3.91Å; Y548-I573 HydrophobicContact CD2-CG1 4.2Å; Y548-I573 HydrophobicContact CE2-CB 3.88Å; Y548-I573 HydrophobicContact CE2-CD1 4.43Å; Y548-I573 HydrophobicContact CG-CD1 4.48Å
549	P	92.1	Very high	75.6	Confident	97 Å²	97	87.3 Å²	87.3	63%	0.63	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	133.6	176	29.9	-33.8	0	0	0	110.8	T551	P549-T551 PolarHBondContact O-N 2.97Å
550	I	91.3	Very high	73.4	Confident	12 Å²	12	83.1 Å²	83.1	6%	0.062	50%	0.495	C	S	.	.			trans	-79.3	116.1	177.9	-62	161.7	0	0	0	108.1	L428 L507 V531 P552 L565 A569 L571	L428-I550 HydrophobicContact CD2-CD1 4.33Å; L507-I550 HydrophobicContact CD2-CD1 4.04Å; V531-I550 HydrophobicContact CG2-CB 4.45Å; V531-I550 HydrophobicContact CG2-CG1 3.89Å; I550-P552 WeakPolarHBondContact O-CD 3.47Å; I550-L565 HydrophobicContact CG2-CD1 3.8Å; I550-A569 HydrophobicContact CB-CB 4.43Å; I550-A569 WeakPolarHBondContact CB-O 3.4Å; I550-A569 HydrophobicContact CD1-CB 4.18Å; I550-A569 PolarHBondContact N-O 3.28Å; I550-L571 HydrophobicContact CD1-CB 4.26Å; I550-L571 HydrophobicContact CG1-CB 4.14Å
551	T	89.7	Confident	71.8	Confident	89 Å²	89	89.7 Å²	89.7	55%	0.546	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	112.7	176.4	-60.8	0	0	0	0	109.1	G529 S530 P549	G529-T551 CarbonylContact C-O 3.58Å; G529-T551 WeakPolarHBondContact CA-O 3.32Å; S530-T551 PolarHBondContact N-O 2.7Å; S530-T551 PolarHBondContact O-N 3.04Å; P549-T551 PolarHBondContact O-N 2.97Å
552	P	84.4	Confident	70.4	Confident	66 Å²	66	91.9 Å²	91.9	43%	0.429	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	141.3	-174.6	28.4	-35	0	0	0	111.8	L528 I550 L565	L528-P552 WeakPolarHBondContact O-CA 3.29Å; I550-P552 WeakPolarHBondContact O-CD 3.47Å; P552-L565 HydrophobicContact CB-CB 4.49Å
553	F	76.5	Confident	69	Low	122 Å²	122	92.3 Å²	92.3	54%	0.535	53%	0.53	S	S	.	.			trans	-74.5	131.7	176.3	-161.5	-93.8	0	0	0	110.2	P527 L528 A555	P527-F553 HydrophobicContact CG-CD2 4.42Å; P527-F553 VanDerWaalsContact O-CB 3.24Å; P527-F553 WeakPolarHBondContact O-CB 3.28Å; L528-F553 PolarHBondContact O-N 3.23Å; F553-A555 PolarHBondContact O-N 3.14Å; F553-A555 VanDerWaalsContact O-N 3.08Å
554	K	59.9	Low	67.6	Low	194 Å²	194	94.8 Å²	94.8	84%	0.843	55%	0.553	S	S	*	*			trans	-78.4	95.6	-179.4	-70.4	-176.1	-179.4	177.3	0	110.4
555	A	53	Low	66.4	Low	86 Å²	86	92 Å²	92	71%	0.711	54%	0.54	S	S	*	.			trans	-58	142.7	167.8	0	0	0	0	0	111	F553	F553-A555 PolarHBondContact O-N 3.14Å; F553-A555 VanDerWaalsContact O-N 3.08Å
556	S	40.5	Very low	64.9	Low	100 Å²	100	90.8 Å²	90.8	70%	0.699	54%	0.539	S	S	*	.			trans	-65.7	144.1	177.3	-167.4	0	0	0	0	111.3	T558	S556-T558 PolarHBondContact O-N 3.39Å
557	A	39.5	Very low	63.7	Low	109 Å²	109	93.6 Å²	93.6	90%	0.901	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	18.1	-159.9	0	0	0	0	0	116.2
558	T	42.9	Very low	63	Low	133 Å²	133	97.1 Å²	97.1	82%	0.816	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	-9.7	-176.8	43.2	0	0	0	0	114.6	S556	S556-T558 PolarHBondContact O-N 3.39Å
559	A	40.5	Very low	62.7	Low	80 Å²	80	96 Å²	96	66%	0.661	58%	0.584	S	S	*	*			trans	-93.7	100.1	177.3	0	0	0	0	0	112
560	G	39.1	Very low	62.7	Low	73 Å²	73	92 Å²	92	75%	0.753	56%	0.558	S	S	*	*			trans	-69.8	136.1	178.1	0	0	0	0	0	113.8
561	N	46	Very low	62.9	Low	167 Å²	167	91.6 Å²	91.6	89%	0.893	56%	0.556	S	S	*	*			trans	50.5	87.4	171.5	-82.8	-15.6	0	0	0	117.2
562	K	45.8	Very low	63.1	Low	127 Å²	127	88.4 Å²	88.4	55%	0.552	53%	0.534	S	S	*	.			trans	-152.9	111.9	153	-97	140.9	-179.4	-179.1	0	110.2	D521 V564	D521-K562 IonicContact OD2-NZ 3.43Å; D521-K562 PolarHBondContact OD2-NZ 3.28Å; K562-V564 PolarHBondContact O-N 2.85Å
563	E	53	Low	63.6	Low	97 Å²	97	85.3 Å²	85.3	45%	0.453	51%	0.513	S	S	.	.			trans	17.8	91.4	157.8	-59.6	156.2	156.9	0	0	117.4	R432 R509	R432-E563 IonicContact CZ-OE1 2.81Å; R432-E563 IonicContact CZ-OE2 2.79Å; R432-E563 IonicContact NE-OE1 2.57Å; R432-E563 PolarHBondContact NE-OE1 3.28Å; R432-E563 IonicContact NE-OE2 3.33Å; R432-E563 PolarHBondContact NE-OE2 3.39Å; R432-E563 IonicContact NH2-OE1 2.83Å; R432-E563 PolarHBondContact NH2-OE1 2.83Å; R432-E563 IonicContact NH2-OE2 3.49Å; R432-E563 PolarHBondContact NH2-OE2 3.15Å; R509-E563 IonicContact CZ-OE2 2.88Å; R509-E563 IonicContact NH1-OE2 3.52Å; R509-E563 PolarHBondContact NH1-OE2 3.29Å; R509-E563 IonicContact NH2-OE2 2.75Å
564	V	59.3	Low	64.5	Low	126 Å²	126	81.3 Å²	81.3	76%	0.764	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-69	141.2	164	-169.4	0	0	0	0	108.8	K562	K562-V564 PolarHBondContact O-N 2.85Å
565	L	64.8	Low	66.2	Low	14 Å²	14	72.1 Å²	72.1	7%	0.073	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-56	145.3	168.2	-78.2	177.5	0	0	0	110.1	L428 L528 I550 P552 A569	L428-L565 HydrophobicContact CD2-CD2 4.02Å; L528-L565 HydrophobicContact CB-CD1 3.74Å; L528-L565 HydrophobicContact CB-CG 4.09Å; L528-L565 HydrophobicContact CD1-CD2 4.17Å; I550-L565 HydrophobicContact CG2-CD1 3.8Å; P552-L565 HydrophobicContact CB-CB 4.49Å; L565-A569 HydrophobicContact CB-CB 4.45Å
566	S	64.1	Low	68.1	Low	43 Å²	43	69.6 Å²	69.6	30%	0.301	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-63.2	145	174	69.3	0	0	0	0	110	D427 Q568 A569	D427-S566 VanDerWaalsContact CB-OG 3.27Å; D427-S566 WeakPolarHBondContact CB-OG 3.41Å; D427-S566 PolarHBondContact O-OG 3.03Å; S566-Q568 PolarHBondContact O-N 2.91Å; S566-A569 VanDerWaalsContact O-CB 3.27Å; S566-A569 WeakPolarHBondContact O-CB 3.34Å; S566-A569 PolarHBondContact O-N 2.98Å; S566-A569 PolarHBondContact OG-N 3.34Å; S566-A569 VanDerWaalsContact OG-N 3.13Å
567	S	67.6	Low	70.5	Confident	136 Å²	136	65.4 Å²	65.4	95%	0.951	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	6.2	175.8	-49.2	0	0	0	0	113.7
568	Q	79.1	Confident	72.8	Confident	145 Å²	145	62.3 Å²	62.3	68%	0.678	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	-10.6	177.8	-60.9	177.8	-86	0	0	111.7	D427 S566 S570	D427-Q568 HydrophobicContact CB-CB 4.25Å; S566-Q568 PolarHBondContact O-N 2.91Å; Q568-S570 PolarHBondContact O-N 3.34Å; Q568-S570 PolarHBondContact O-OG 2.84Å
569	A	87.8	Confident	75	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.008	34%	0.34	C	S	.	.			trans	-51.8	121.7	178.5	0	0	0	0	0	110.5	K426 L428 I550 L565 S566	K426-A569 WeakPolarHBondContact O-CA 3.32Å; L428-A569 HydrophobicContact CD2-CB 4.35Å; I550-A569 HydrophobicContact CB-CB 4.43Å; I550-A569 WeakPolarHBondContact CB-O 3.4Å; I550-A569 HydrophobicContact CD1-CB 4.18Å; I550-A569 PolarHBondContact N-O 3.28Å; L565-A569 HydrophobicContact CB-CB 4.45Å; S566-A569 VanDerWaalsContact O-CB 3.27Å; S566-A569 WeakPolarHBondContact O-CB 3.34Å; S566-A569 PolarHBondContact O-N 2.98Å; S566-A569 PolarHBondContact OG-N 3.34Å; S566-A569 VanDerWaalsContact OG-N 3.13Å
570	S	92.5	Very high	77.3	Confident	13 Å²	13	57.1 Å²	57.1	9%	0.091	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	150	-172	42.9	0	0	0	0	111.4	A425 K426 Y548 Q568	A425-S570 CarbonylContact C-O 3.58Å; A425-S570 WeakPolarHBondContact CA-O 3.45Å; K426-S570 VanDerWaalsContact CE-OG 3.27Å; K426-S570 WeakPolarHBondContact CE-OG 3.42Å; K426-S570 WeakPolarHBondContact CG-OG 3.4Å; K426-S570 PolarHBondContact N-O 3.34Å; K426-S570 PolarHBondContact O-N 3.46Å; Y548-S570 CarbonylContact O-C 3.42Å; Y548-S570 WeakPolarHBondContact O-CA 3.48Å; Y548-S570 VanDerWaalsContact O-CB 3.29Å; Y548-S570 WeakPolarHBondContact O-CB 3.46Å; Q568-S570 PolarHBondContact O-N 3.34Å; Q568-S570 PolarHBondContact O-OG 2.84Å
571	L	93.9	Very high	79.7	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.016	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	123.7	-173.7	-172.8	63.8	0	0	0	108.7	V422 E424 A425 W488 L505 V531 Y548 I550 I573	V422-L571 HydrophobicContact CG1-CD1 4.11Å; E424-L571 CarbonylContact O-C 3.49Å; E424-L571 WeakPolarHBondContact O-CA 3.21Å; A425-L571 HydrophobicContact CB-CD1 3.92Å; W488-L571 HydrophobicContact CE3-CD1 4.42Å; W488-L571 HydrophobicContact CZ3-CD1 3.75Å; L505-L571 HydrophobicContact CB-CD2 4.27Å; L505-L571 HydrophobicContact CD2-CD2 4.16Å; V531-L571 HydrophobicContact CG2-CB 4.25Å; V531-L571 HydrophobicContact CG2-CD2 4.37Å; Y548-L571 PolarHBondContact N-O 3.49Å; Y548-L571 PolarHBondContact O-N 2.91Å; I550-L571 HydrophobicContact CD1-CB 4.26Å; I550-L571 HydrophobicContact CG1-CB 4.14Å; L571-I573 HydrophobicContact CD2-CD1 3.91Å; L571-I573 HydrophobicContact CD2-CG1 4.22Å; L571-I573 HydrophobicContact CG-CD1 4.06Å; L571-I573 HydrophobicContact CG-CG1 3.91Å
572	R	95.4	Very high	81.9	Confident	22 Å²	22	48.6 Å²	48.6	8%	0.083	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	118.2	176.7	-145.7	-177.9	90.9	-156.2	8.1	108.8	L94 N423 E424 E545 W547	L94-R572 PolarHBondContact O-NH2 3.48Å; N423-R572 HydrophobicContact CB-CB 4.38Å; N423-R572 PolarHBondContact N-O 2.67Å; N423-R572 VanDerWaalsContact N-O 3.09Å; E424-R572 VanDerWaalsContact CD-NH1 3.26Å; E424-R572 HydrophobicContact CG-CB 3.69Å; E424-R572 PolarHBondContact O-N 2.84Å; E424-R572 WeakPolarHBondContact OE1-CD 3.28Å; E424-R572 IonicContact OE1-CZ 3.87Å; E424-R572 IonicContact OE1-NE 2.76Å; E424-R572 IonicContact OE1-NH1 3.61Å; E424-R572 PolarHBondContact OE1-NH1 3.07Å; E424-R572 IonicContact OE2-NH1 2.76Å; E545-R572 IonicContact OE1-CZ 3.87Å; E545-R572 IonicContact OE1-NE 3.31Å; E545-R572 PolarHBondContact OE1-NE 3.18Å; E545-R572 IonicContact OE1-NH2 2.68Å; E545-R572 PolarHBondContact OE1-NH2 2.88Å; W547-R572 HydrophobicContact CD2-CB 3.91Å; W547-R572 HydrophobicContact CD2-CG 3.71Å; W547-R572 HydrophobicContact CE3-CB 3.69Å; W547-R572 HydrophobicContact CE3-CG 4.06Å; W547-R572 HydrophobicContact CG-CG 4.13Å; W547-R572 HydrophobicContact CH2-CB 3.94Å; W547-R572 HydrophobicContact CH2-CG 4.35Å; W547-R572 HydrophobicContact CZ2-CB 4.15Å; W547-R572 HydrophobicContact CZ2-CG 4.05Å; W547-R572 HydrophobicContact CZ3-CB 3.71Å; W547-R572 HydrophobicContact CZ3-CG 4.36Å
573	I	95.3	Very high	84.2	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	136.8	-174.2	-60	167.4	0	0	0	108.4	L420 W421 L505 V531 I533 E545 K546 Y548 L571 A575	L420-I573 HydrophobicContact CD1-CG2 3.51Å; W421-I573 WeakPolarHBondContact O-CA 3.12Å; L505-I573 HydrophobicContact CD1-CD1 3.81Å; L505-I573 HydrophobicContact CD2-CD1 3.89Å; L505-I573 HydrophobicContact CD2-CG1 4.4Å; L505-I573 HydrophobicContact CG-CD1 4.41Å; V531-I573 HydrophobicContact CG1-CD1 3.79Å; I533-I573 HydrophobicContact CD1-CB 4.38Å; I533-I573 HydrophobicContact CD1-CD1 3.8Å; I533-I573 HydrophobicContact CD1-CG2 3.94Å; E545-I573 WeakPolarHBondContact CA-O 3.45Å; K546-I573 PolarHBondContact N-O 2.89Å; K546-I573 PolarHBondContact O-N 3.11Å; Y548-I573 HydrophobicContact CD2-CB 3.93Å; Y548-I573 HydrophobicContact CD2-CD1 3.91Å; Y548-I573 HydrophobicContact CD2-CG1 4.2Å; Y548-I573 HydrophobicContact CE2-CB 3.88Å; Y548-I573 HydrophobicContact CE2-CD1 4.43Å; Y548-I573 HydrophobicContact CG-CD1 4.48Å; L571-I573 HydrophobicContact CD2-CD1 3.91Å; L571-I573 HydrophobicContact CD2-CG1 4.22Å; L571-I573 HydrophobicContact CG-CD1 4.06Å; L571-I573 HydrophobicContact CG-CG1 3.91Å; I573-A575 HydrophobicContact CG2-CB 4.37Å
574	K	95.3	Very high	86.1	Confident	39 Å²	39	39.4 Å²	39.4	17%	0.17	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	111	173.8	169.6	-170.3	-173.3	176.1	0	109.3	L94 W421 Y543 Q544 E545	L94-K574 VanDerWaalsContact CD2-NZ 3.34Å; W421-K574 HydrophobicContact CB-CB 3.96Å; W421-K574 WeakPolarHBondContact CB-O 3.28Å; W421-K574 HydrophobicContact CG-CD 4.37Å; W421-K574 PolarHBondContact N-O 3.13Å; W421-K574 PolarHBondContact O-N 3.47Å; W421-K574 VanDerWaalsContact O-N 3.08Å; Y543-K574 HydrophobicContact CD1-CG 3.98Å; Y543-K574 HydrophobicContact CG-CG 4.3Å; Q544-K574 WeakPolarHBondContact O-CA 3.41Å; E545-K574 HydrophobicContact CB-CB 3.81Å; E545-K574 HydrophobicContact CB-CG 4.03Å; E545-K574 HydrophobicContact CG-CB 3.89Å; E545-K574 WeakPolarHBondContact OE2-CD 3.45Å
575	A	94.3	Very high	87.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	153.5	-172.3	0	0	0	0	0	112.5	S419 L420 I538 Q544 I573	S419-A575 CarbonylContact O-C 3.51Å; S419-A575 WeakPolarHBondContact O-CA 3.36Å; L420-A575 HydrophobicContact CD1-CB 3.84Å; I538-A575 HydrophobicContact CB-CB 4.43Å; I538-A575 HydrophobicContact CD1-CB 3.71Å; I538-A575 HydrophobicContact CG2-CB 4.23Å; Q544-A575 PolarHBondContact N-O 3.26Å; Q544-A575 PolarHBondContact O-N 3.23Å; I573-A575 HydrophobicContact CG2-CB 4.37Å
576	R	92.9	Very high	88.9	Confident	34 Å²	34	41.1 Å²	41.1	13%	0.128	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	117.4	173.1	178.7	-171.9	68.9	168.3	0.5	108.3	S419 E493 G540 R541 Y543 Q578	S419-R576 PolarHBondContact N-O 3.09Å; S419-R576 PolarHBondContact O-N 3.12Å; S419-R576 PolarHBondContact OG-NH2 3.47Å; E493-R576 IonicContact OE1-NH2 2.67Å; G540-R576 VanDerWaalsContact O-CG 3.3Å; G540-R576 WeakPolarHBondContact O-CG 3.41Å; R541-R576 VanDerWaalsContact O-CD 3.3Å; R541-R576 WeakPolarHBondContact O-CD 3.39Å; Y543-R576 HydrophobicContact CD1-CB 3.62Å; Y543-R576 HydrophobicContact CE1-CB 3.74Å; Y543-R576 HydrophobicContact CG-CB 4.1Å; R576-Q578 HydrophobicContact CG-CG 4.1Å
577	F	91.6	Very high	90.3	Very high	12 Å²	12	44.3 Å²	44.3	5%	0.053	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	125.9	171.1	-178.8	-116	0	0	0	110	N416 S417 L418 I500 L535 I538 R539 G540 N579	N416-F577 HydrophobicContact CB-CE2 3.95Å; N416-F577 HydrophobicContact CB-CZ 4.03Å; S417-F577 WeakPolarHBondContact O-CA 3.43Å; S417-F577 VanDerWaalsContact O-CD2 3.28Å; S417-F577 WeakPolarHBondContact O-CD2 3.38Å; L418-F577 HydrophobicContact CB-CD2 4.45Å; I500-F577 HydrophobicContact CD1-CD2 4.29Å; I500-F577 HydrophobicContact CD1-CE2 3.79Å; I500-F577 HydrophobicContact CD1-CZ 4.46Å; I500-F577 HydrophobicContact CG1-CE2 3.95Å; I500-F577 HydrophobicContact CG1-CZ 4.18Å; L535-F577 HydrophobicContact CB-CD1 4.01Å; L535-F577 HydrophobicContact CB-CE1 4.36Å; L535-F577 HydrophobicContact CB-CG 4.41Å; L535-F577 HydrophobicContact CD1-CD1 4.39Å; L535-F577 HydrophobicContact CD1-CE1 4.14Å; L535-F577 HydrophobicContact CD1-CE2 4.32Å; L535-F577 HydrophobicContact CD1-CZ 4.11Å; L535-F577 HydrophobicContact CD2-CB 4.18Å; L535-F577 HydrophobicContact CD2-CD1 4.38Å; L535-F577 HydrophobicContact CD2-CD2 4.09Å; L535-F577 HydrophobicContact CD2-CG 3.96Å; L535-F577 HydrophobicContact CG-CD1 4.5Å; I538-F577 HydrophobicContact CD1-CB 3.91Å; I538-F577 HydrophobicContact CG1-CB 3.92Å; I538-F577 PolarHBondContact O-N 2.95Å; R539-F577 CarbonylContact C-O 3.51Å; R539-F577 WeakPolarHBondContact CA-O 3.29Å; R539-F577 HydrophobicContact CG-CD1 4.33Å; G540-F577 PolarHBondContact N-O 3.37Å; F577-N579 HydrophobicContact CE1-CB 3.89Å; F577-N579 HydrophobicContact CZ-CB 4.23Å
578	Q	88.6	Confident	91.6	Very high	43 Å²	43	37.9 Å²	37.9	20%	0.201	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	139.1	173.7	-54.9	-164.1	-35.8	0	0	109.1	N416 S417 R576	N416-Q578 CarbonylContact C-O 3.56Å; N416-Q578 WeakPolarHBondContact CA-O 3.49Å; S417-Q578 PolarHBondContact N-O 2.91Å; S417-Q578 PolarHBondContact O-N 3.42Å; R576-Q578 HydrophobicContact CG-CG 4.1Å
579	N	88.5	Confident	92.3	Very high	57 Å²	57	36.8 Å²	36.8	31%	0.305	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	107.3	179	161.4	-100.9	0	0	0	104.7	T414 E415 N416 R539 F577	T414-N579 WeakPolarHBondContact CG2-ND2 3.44Å; E415-N579 WeakPolarHBondContact O-CA 3.45Å; N416-N579 PolarHBondContact OD1-ND2 3.49Å; R539-N579 PolarHBondContact NH2-OD1 3.35Å; F577-N579 HydrophobicContact CE1-CB 3.89Å; F577-N579 HydrophobicContact CZ-CB 4.23Å
580	L	88.8	Confident	92.6	Very high	48 Å²	48	41.1 Å²	41.1	25%	0.251	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	123.3	-165	-179.6	60.5	0	0	0	109.8	T414 E415 V582 L858 A861 V862	T414-L580 WeakPolarHBondContact CA-O 3.34Å; E415-L580 PolarHBondContact N-O 2.89Å; E415-L580 PolarHBondContact O-N 3.43Å; L580-V582 PolarHBondContact O-N 3.08Å; L580-L858 HydrophobicContact CD2-CD1 3.88Å; L580-A861 HydrophobicContact CD1-CB 4.37Å; L580-A861 HydrophobicContact CD2-CB 3.91Å; L580-A861 HydrophobicContact CG-CB 4.13Å; L580-V862 HydrophobicContact CD2-CB 4.41Å; L580-V862 HydrophobicContact CD2-CG2 3.5Å; L580-V862 VanDerWaalsContact CD2-CG2 3.5Å
581	K	90.2	Very high	92.8	Very high	60 Å²	60	40.5 Å²	40.5	26%	0.261	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	114.9	173.6	172.8	169	160.9	151.5	0	109.3	E412 L583 L896	E412-K581 HydrophobicContact CG-CD 4.48Å; E412-K581 HydrophobicContact CG-CG 4.33Å; E412-K581 VanDerWaalsContact OE1-CE 3.24Å; E412-K581 WeakPolarHBondContact OE1-CE 3.38Å; E412-K581 IonicContact OE1-NZ 3.67Å; E412-K581 PolarHBondContact OE1-NZ 3.21Å; E412-K581 WeakPolarHBondContact OE2-CE 3.44Å; E412-K581 IonicContact OE2-NZ 3.16Å; E412-K581 PolarHBondContact OE2-NZ 3.1Å; K581-L583 HydrophobicContact CG-CD2 4.45Å; K581-L896 HydrophobicContact CB-CD2 4.05Å; K581-L896 HydrophobicContact CD-CD2 3.94Å; K581-L896 HydrophobicContact CG-CD2 3.75Å
582	V	92.1	Very high	92.8	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	127.9	173.7	-178.6	0	0	0	0	107.9	E412 R413 E415 L580 Y588 P857 L858 A861	E412-V582 WeakPolarHBondContact CA-O 3.44Å; R413-V582 HydrophobicContact CG-CB 3.92Å; R413-V582 HydrophobicContact CG-CG1 4.39Å; R413-V582 PolarHBondContact N-O 3.04Å; R413-V582 PolarHBondContact O-N 3.15Å; E415-V582 HydrophobicContact CG-CG2 3.76Å; L580-V582 PolarHBondContact O-N 3.08Å; V582-Y588 HydrophobicContact CG1-CE2 4.32Å; V582-P857 HydrophobicContact CG1-CB 3.66Å; V582-L858 HydrophobicContact CG2-CB 4.36Å; V582-L858 HydrophobicContact CG2-CD1 4.02Å; V582-A861 HydrophobicContact CG2-CB 4.01Å
583	L	93.1	Very high	92.8	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.016	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-90.2	162.8	178	-62.3	176.5	0	0	0	111.4	E412 K581 K587 Y588 I892 L896	E412-L583 HydrophobicContact CG-CD2 4.5Å; K581-L583 HydrophobicContact CG-CD2 4.45Å; L583-K587 HydrophobicContact CB-CB 3.95Å; L583-K587 HydrophobicContact CB-CG 4.12Å; L583-K587 HydrophobicContact CD1-CB 4.05Å; L583-K587 HydrophobicContact CD1-CG 4.31Å; L583-Y588 HydrophobicContact CB-CE2 3.78Å; L583-Y588 PolarHBondContact N-OH 2.96Å; L583-Y588 VanDerWaalsContact O-CE2 3.29Å; L583-Y588 WeakPolarHBondContact O-CE2 3.11Å; L583-I892 HydrophobicContact CD1-CG2 4.13Å; L583-L896 HydrophobicContact CD1-CD2 4.07Å; L583-L896 HydrophobicContact CD1-CG 4.27Å; L583-L896 HydrophobicContact CD2-CD2 4.05Å; L583-L896 HydrophobicContact CG-CD2 3.93Å
584	P	92.2	Very high	92.8	Very high	28 Å²	28	44.5 Å²	44.5	18%	0.182	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-52.2	141.1	166.7	-27.1	35.6	0	0	0	112.5	E586 K587	P584-E586 WeakPolarHBondContact CB-OE2 3.46Å; P584-E586 PolarHBondContact O-N 3.46Å; P584-E586 VanDerWaalsContact O-N 3.07Å; P584-K587 VanDerWaalsContact O-CB 3.27Å; P584-K587 WeakPolarHBondContact O-CB 3.42Å; P584-K587 PolarHBondContact O-N 3.34Å
585	M	91.8	Very high	92.7	Very high	46 Å²	46	42.6 Å²	42.6	23%	0.227	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-57	-28.1	-171.4	-177.3	56	-175	0	0	114.1	D409 K587 Y588 K589 A592 L856 P857 L860	D409-M585 WeakPolarHBondContact O-CB 3.37Å; D409-M585 PolarHBondContact O-N 3.25Å; M585-K587 PolarHBondContact O-N 3.1Å; M585-K587 VanDerWaalsContact O-N 3.16Å; M585-Y588 PolarHBondContact O-N 3.47Å; M585-K589 PolarHBondContact O-N 2.94Å; M585-A592 HydrophobicContact CE-CB 4.49Å; M585-L856 HydrophobicContact CE-CD2 3.56Å; M585-L856 HydrophobicContact CE-CG 4.01Å; M585-L856 HydrophobicContact SD-CG 4.49Å; M585-P857 HydrophobicContact CB-CG 4.38Å; M585-P857 HydrophobicContact SD-CG 4.08Å; M585-L860 HydrophobicContact CE-CD1 3.88Å; M585-L860 HydrophobicContact SD-CD1 3.9Å
586	E	91.9	Very high	92.6	Very high	131 Å²	131	44.2 Å²	44.2	61%	0.612	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-62.5	-24.8	176.7	-45.3	96.9	136.5	0	0	112.4	P584	P584-E586 WeakPolarHBondContact CB-OE2 3.46Å; P584-E586 PolarHBondContact O-N 3.46Å; P584-E586 VanDerWaalsContact O-N 3.07Å
587	K	93.3	Very high	92.5	Very high	109 Å²	109	48.1 Å²	48.1	47%	0.474	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-72.3	-27.9	175.7	-62.9	-63.3	-169.5	159.4	0	113.3	L583 P584 M585 S895	L583-K587 HydrophobicContact CB-CB 3.95Å; L583-K587 HydrophobicContact CB-CG 4.12Å; L583-K587 HydrophobicContact CD1-CB 4.05Å; L583-K587 HydrophobicContact CD1-CG 4.31Å; P584-K587 VanDerWaalsContact O-CB 3.27Å; P584-K587 WeakPolarHBondContact O-CB 3.42Å; P584-K587 PolarHBondContact O-N 3.34Å; M585-K587 PolarHBondContact O-N 3.1Å; M585-K587 VanDerWaalsContact O-N 3.16Å; K587-S895 PolarHBondContact NZ-OG 3.12Å
588	Y	95.4	Very high	92.5	Very high	1 Å²	1	51.4 Å²	51.4	0%	0.004	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-3.9	178.7	-58.2	-68.5	0	0	0	113.3	V582 L583 M585 E590 F591 A592 L860 A861 I892	V582-Y588 HydrophobicContact CG1-CE2 4.32Å; L583-Y588 HydrophobicContact CB-CE2 3.78Å; L583-Y588 PolarHBondContact N-OH 2.96Å; L583-Y588 VanDerWaalsContact O-CE2 3.29Å; L583-Y588 WeakPolarHBondContact O-CE2 3.11Å; M585-Y588 PolarHBondContact O-N 3.47Å; Y588-E590 PolarHBondContact O-N 3.35Å; Y588-F591 HydrophobicContact CD1-CD1 4.47Å; Y588-F591 CarbonylContact O-C 3.56Å; Y588-F591 WeakPolarHBondContact O-CA 3.46Å; Y588-F591 WeakPolarHBondContact O-CB 3.3Å; Y588-F591 PolarHBondContact O-N 2.96Å; Y588-A592 PolarHBondContact O-N 3.05Å; Y588-L860 HydrophobicContact CD1-CB 4.12Å; Y588-L860 HydrophobicContact CD2-CB 4.38Å; Y588-L860 HydrophobicContact CG-CB 3.99Å; Y588-L860 HydrophobicContact CG-CD1 4.37Å; Y588-A861 HydrophobicContact CE1-CB 4.46Å; Y588-A861 WeakPolarHBondContact OH-CB 3.34Å; Y588-I892 HydrophobicContact CD1-CD1 3.9Å; Y588-I892 HydrophobicContact CD1-CG1 4.31Å; Y588-I892 HydrophobicContact CD1-CG2 4.23Å; Y588-I892 HydrophobicContact CE1-CD1 4.46Å; Y588-I892 HydrophobicContact CE1-CG2 3.73Å
589	K	93.4	Very high	92.6	Very high	123 Å²	123	50.3 Å²	50.3	54%	0.535	24%	0.244	S	C	.	.	H	α-helix	trans	-55.7	-53.1	-172.6	-179.4	168.6	175.9	169.3	0	114.4	M585 F591 A592 E593	M585-K589 PolarHBondContact O-N 2.94Å; K589-F591 PolarHBondContact O-N 3.13Å; K589-A592 PolarHBondContact O-N 3.14Å; K589-E593 WeakPolarHBondContact CE-OE1 3.28Å; K589-E593 IonicContact NZ-OE1 2.73Å; K589-E593 WeakPolarHBondContact O-CG 3.36Å; K589-E593 PolarHBondContact O-N 3.21Å
590	E	94.8	Very high	92.7	Very high	91 Å²	91	51.3 Å²	51.3	43%	0.425	25%	0.252	S	S	.	.	H	α-helix	trans	-60.9	-31	178.7	-170.1	-174.7	-169.4	0	0	111.8	Y588 Y594 I888 Q891	Y588-E590 PolarHBondContact O-N 3.35Å; E590-Y594 WeakPolarHBondContact O-CB 3.38Å; E590-Y594 PolarHBondContact O-N 3.1Å; E590-I888 HydrophobicContact CB-CG2 4.2Å; E590-I888 HydrophobicContact CG-CD1 3.94Å; E590-I888 HydrophobicContact CG-CG1 4.05Å; E590-I888 HydrophobicContact CG-CG2 4.2Å; E590-Q891 PolarHBondContact OE2-NE2 3.27Å
591	F	96.2	Very high	92.7	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-75.5	-42.5	177.5	178	-130.5	0	0	0	112.6	Y588 K589 Y594 V595 L860 L863 H864 L867 L885 I888 L889 I892	Y588-F591 HydrophobicContact CD1-CD1 4.47Å; Y588-F591 CarbonylContact O-C 3.56Å; Y588-F591 WeakPolarHBondContact O-CA 3.46Å; Y588-F591 WeakPolarHBondContact O-CB 3.3Å; Y588-F591 PolarHBondContact O-N 2.96Å; K589-F591 PolarHBondContact O-N 3.13Å; F591-Y594 PolarHBondContact O-N 2.78Å; F591-V595 HydrophobicContact CD2-CG2 3.97Å; F591-V595 HydrophobicContact CE2-CG2 3.62Å; F591-V595 HydrophobicContact CZ-CG2 4.06Å; F591-V595 WeakPolarHBondContact O-CB 3.38Å; F591-V595 VanDerWaalsContact O-CG2 3.3Å; F591-V595 WeakPolarHBondContact O-CG2 3.41Å; F591-V595 PolarHBondContact O-N 2.98Å; F591-L860 HydrophobicContact CD1-CD2 3.88Å; F591-L860 HydrophobicContact CE1-CD2 4.01Å; F591-L863 HydrophobicContact CE1-CB 4.35Å; F591-L863 HydrophobicContact CE1-CD2 4.24Å; F591-L863 HydrophobicContact CE1-CG 4.39Å; F591-L863 HydrophobicContact CZ-CB 4.24Å; F591-L863 HydrophobicContact CZ-CD2 3.75Å; F591-L863 HydrophobicContact CZ-CG 3.83Å; F591-H864 HydrophobicContact CE1-CB 3.96Å; F591-H864 HydrophobicContact CZ-CB 4.44Å; F591-L867 HydrophobicContact CE2-CD1 3.76Å; F591-L867 HydrophobicContact CZ-CD1 3.82Å; F591-L885 HydrophobicContact CD2-CD1 4.03Å; F591-L885 HydrophobicContact CE2-CD1 3.83Å; F591-I888 HydrophobicContact CB-CG2 3.69Å; F591-L889 HydrophobicContact CD2-CD2 4.09Å; F591-L889 HydrophobicContact CE2-CD2 3.68Å; F591-L889 HydrophobicContact CZ-CD2 3.96Å; F591-I892 HydrophobicContact CB-CD1 3.7Å; F591-I892 HydrophobicContact CD1-CD1 3.97Å; F591-I892 HydrophobicContact CG-CD1 3.95Å
592	A	94.8	Very high	92.7	Very high	10 Å²	10	50.1 Å²	50.1	8%	0.083	25%	0.246	C	C	.	.	H	α-helix	trans	-62	-43.4	172.8	0	0	0	0	0	111.1	M585 Y588 K589 V595 T596 I629 L860	M585-A592 HydrophobicContact CE-CB 4.49Å; Y588-A592 PolarHBondContact O-N 3.05Å; K589-A592 PolarHBondContact O-N 3.14Å; A592-V595 PolarHBondContact O-N 3.02Å; A592-T596 VanDerWaalsContact O-CB 3.29Å; A592-T596 WeakPolarHBondContact O-CB 3.31Å; A592-T596 PolarHBondContact O-N 2.93Å; A592-T596 PolarHBondContact O-OG1 2.85Å; A592-I629 HydrophobicContact CB-CD1 4.49Å; A592-L860 HydrophobicContact CB-CD1 4.01Å; A592-L860 HydrophobicContact CB-CD2 4.09Å
593	E	94.6	Very high	92.7	Very high	87 Å²	87	50.4 Å²	50.4	41%	0.407	25%	0.248	S	C	.	.	H	α-helix	trans	-60.3	-45.6	174	-72.9	174	-175.8	0	0	111.7	K589 T596 V597	K589-E593 WeakPolarHBondContact CE-OE1 3.28Å; K589-E593 IonicContact NZ-OE1 2.73Å; K589-E593 WeakPolarHBondContact O-CG 3.36Å; K589-E593 PolarHBondContact O-N 3.21Å; E593-T596 PolarHBondContact O-N 3Å; E593-V597 WeakPolarHBondContact O-CG2 3.17Å; E593-V597 PolarHBondContact O-N 2.85Å; E593-V597 VanDerWaalsContact O-N 3.09Å
594	Y	94.4	Very high	92.5	Very high	12 Å²	12	52.6 Å²	52.6	5%	0.047	27%	0.272	C	S	.	.	H	α-helix	trans	-59.7	-49.8	174.6	178.7	-82.1	0	0	0	112.3	E590 F591 T596 V597 R598 M602 P884 L885 I888	E590-Y594 WeakPolarHBondContact O-CB 3.38Å; E590-Y594 PolarHBondContact O-N 3.1Å; F591-Y594 PolarHBondContact O-N 2.78Å; Y594-T596 VanDerWaalsContact C-N 3.27Å; Y594-T596 PolarHBondContact O-N 3.35Å; Y594-V597 PolarHBondContact O-N 2.87Å; Y594-R598 HydrophobicContact CE2-CB 4.31Å; Y594-R598 PolarHBondContact O-N 2.98Å; Y594-M602 HydrophobicContact CE1-CB 4.29Å; Y594-M602 HydrophobicContact CE1-SD 4Å; Y594-P884 HydrophobicContact CD2-CG 4.46Å; Y594-L885 HydrophobicContact CD1-CB 4.41Å; Y594-L885 HydrophobicContact CD1-CD1 3.89Å; Y594-L885 HydrophobicContact CE1-CB 3.9Å; Y594-L885 HydrophobicContact CE1-CD1 3.93Å; Y594-L885 HydrophobicContact CE1-CD2 3.99Å; Y594-L885 HydrophobicContact CE1-CG 4.15Å; Y594-L885 HydrophobicContact CE2-CB 4.06Å; Y594-I888 HydrophobicContact CD2-CD1 4.04Å; Y594-I888 HydrophobicContact CG-CD1 4.14Å
595	V	94.6	Very high	92.2	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-35.9	-179.1	170.5	0	0	0	0	111	F591 A592 Y599 M602 L622 V625 L626 L863	F591-V595 HydrophobicContact CD2-CG2 3.97Å; F591-V595 HydrophobicContact CE2-CG2 3.62Å; F591-V595 HydrophobicContact CZ-CG2 4.06Å; F591-V595 WeakPolarHBondContact O-CB 3.38Å; F591-V595 VanDerWaalsContact O-CG2 3.3Å; F591-V595 WeakPolarHBondContact O-CG2 3.41Å; F591-V595 PolarHBondContact O-N 2.98Å; A592-V595 PolarHBondContact O-N 3.02Å; V595-Y599 WeakPolarHBondContact O-CB 3.38Å; V595-Y599 WeakPolarHBondContact O-CD1 3.39Å; V595-Y599 PolarHBondContact O-N 3.01Å; V595-M602 HydrophobicContact CG2-CE 4.4Å; V595-L622 HydrophobicContact CG1-CD2 3.94Å; V595-V625 HydrophobicContact CG1-CG1 4.08Å; V595-L626 HydrophobicContact CG1-CD2 4.12Å; V595-L626 HydrophobicContact CG1-CG 4.36Å; V595-L863 HydrophobicContact CG1-CD2 4.18Å; V595-L863 HydrophobicContact CG2-CD2 3.89Å
596	T	92.3	Very high	92.2	Very high	33 Å²	33	51.9 Å²	51.9	20%	0.202	27%	0.267	C	S	.	.	H	α-helix	trans	-67.9	-38.9	177.8	-57.8	0	0	0	0	112.8	A592 E593 Y594 Y599 I629 K631	A592-T596 VanDerWaalsContact O-CB 3.29Å; A592-T596 WeakPolarHBondContact O-CB 3.31Å; A592-T596 PolarHBondContact O-N 2.93Å; A592-T596 PolarHBondContact O-OG1 2.85Å; E593-T596 PolarHBondContact O-N 3Å; Y594-T596 VanDerWaalsContact C-N 3.27Å; Y594-T596 PolarHBondContact O-N 3.35Å; T596-Y599 WeakPolarHBondContact O-CD1 3.44Å; T596-Y599 WeakPolarHBondContact O-CE1 3.47Å; T596-I629 HydrophobicContact CG2-CG2 4.11Å; T596-K631 HydrophobicContact CG2-CG 4.22Å
597	V	90.8	Very high	92.1	Very high	117 Å²	117	47.3 Å²	47.3	71%	0.709	25%	0.245	S	C	*	.	H	α-helix	trans	-97	-25.8	-171.3	179.7	0	0	0	0	113	E593 Y594	E593-V597 WeakPolarHBondContact O-CG2 3.17Å; E593-V597 PolarHBondContact O-N 2.85Å; E593-V597 VanDerWaalsContact O-N 3.09Å; Y594-V597 PolarHBondContact O-N 2.87Å
598	R	90.6	Very high	91.9	Very high	81 Å²	81	47.1 Å²	47.1	31%	0.306	26%	0.256	S	S	.	.	H	α-helix	trans	-131.5	31.4	-171.7	-64.6	-156.9	-78.7	149.7	-18.1	114.9	Y594 V600 E601 M602	Y594-R598 HydrophobicContact CE2-CB 4.31Å; Y594-R598 PolarHBondContact O-N 2.98Å; R598-V600 VanDerWaalsContact C-N 3.31Å; R598-V600 PolarHBondContact O-N 3.27Å; R598-E601 WeakPolarHBondContact CD-OE2 3.38Å; R598-E601 IonicContact CZ-OE2 3.08Å; R598-E601 IonicContact NE-OE2 3.04Å; R598-E601 IonicContact NH1-OE2 2.87Å; R598-E601 PolarHBondContact NH1-OE2 3.38Å; R598-M602 WeakPolarHBondContact O-CB 3.37Å; R598-M602 PolarHBondContact O-N 3.39Å
599	Y	91.8	Very high	91.5	Very high	19 Å²	19	50.2 Å²	50.2	8%	0.075	27%	0.272	C	S	.	.	H	α-helix	trans	-57.3	-40.4	170.4	55.4	-104	0	0	0	112.6	V595 T596 M602 C603 L626 F635 D638	V595-Y599 WeakPolarHBondContact O-CB 3.38Å; V595-Y599 WeakPolarHBondContact O-CD1 3.39Å; V595-Y599 PolarHBondContact O-N 3.01Å; T596-Y599 WeakPolarHBondContact O-CD1 3.44Å; T596-Y599 WeakPolarHBondContact O-CE1 3.47Å; Y599-M602 PolarHBondContact O-N 2.98Å; Y599-C603 VanDerWaalsContact O-CB 3.26Å; Y599-C603 WeakPolarHBondContact O-CB 3.25Å; Y599-C603 PolarHBondContact O-N 3.28Å; Y599-C603 PolarHBondContact O-SG 3.22Å; Y599-L626 HydrophobicContact CD1-CD1 4.35Å; Y599-L626 HydrophobicContact CD1-CD2 4.29Å; Y599-L626 HydrophobicContact CG-CD1 4.43Å; Y599-F635 HydrophobicContact CD2-CB 4.42Å; Y599-F635 AromaticContact CD2-CD2 3.47Å; Y599-F635 HydrophobicContact CD2-CD2 3.47Å; Y599-F635 VanDerWaalsContact CD2-CD2 3.47Å; Y599-F635 HydrophobicContact CD2-CE2 4.22Å; Y599-F635 HydrophobicContact CD2-CG 4.42Å; Y599-F635 HydrophobicContact CE2-CB 4.16Å; Y599-F635 AromaticContact CE2-CD2 3.98Å; Y599-F635 HydrophobicContact CE2-CD2 3.98Å; Y599-F635 AromaticContact CG-CD2 3.83Å; Y599-F635 HydrophobicContact CG-CD2 3.83Å; Y599-F635 HydrophobicContact CG-CE2 4.44Å; Y599-D638 HydrophobicContact CE2-CB 4.18Å; Y599-D638 WeakPolarHBondContact CE2-OD2 3.28Å; Y599-D638 VanDerWaalsContact CZ-OD2 3.27Å; Y599-D638 PolarHBondContact OH-OD2 3.33Å
600	V	90	Very high	91.4	Very high	79 Å²	79	45 Å²	45	48%	0.479	25%	0.25	S	C	.	.	H	α-helix	trans	-62.7	-50	-178.5	-172.2	0	0	0	0	111.6	R598 M602 C603 G604 D638	R598-V600 VanDerWaalsContact C-N 3.31Å; R598-V600 PolarHBondContact O-N 3.27Å; V600-M602 PolarHBondContact O-N 2.85Å; V600-C603 PolarHBondContact O-N 2.75Å; V600-G604 PolarHBondContact O-N 3.25Å; V600-D638 HydrophobicContact CG2-CB 4.2Å
601	E	88	Confident	91.2	Very high	83 Å²	83	44.7 Å²	44.7	39%	0.388	25%	0.251	S	S	.	.	H	α-helix	trans	-62.6	-42.8	177.9	-179.2	-179.9	-131.7	0	0	111.5	R598 N605	R598-E601 WeakPolarHBondContact CD-OE2 3.38Å; R598-E601 IonicContact CZ-OE2 3.08Å; R598-E601 IonicContact NE-OE2 3.04Å; R598-E601 IonicContact NH1-OE2 2.87Å; R598-E601 PolarHBondContact NH1-OE2 3.38Å; E601-N605 WeakPolarHBondContact CG-ND2 3.48Å; E601-N605 WeakPolarHBondContact O-CB 3.45Å; E601-N605 PolarHBondContact O-N 2.89Å; E601-N605 PolarHBondContact O-ND2 2.75Å
602	M	90	Very high	90.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.3	-47.1	177	178.6	175.5	61.4	0	0	111.7	Y594 V595 R598 Y599 V600 L606 L622 L867 L885	Y594-M602 HydrophobicContact CE1-CB 4.29Å; Y594-M602 HydrophobicContact CE1-SD 4Å; V595-M602 HydrophobicContact CG2-CE 4.4Å; R598-M602 WeakPolarHBondContact O-CB 3.37Å; R598-M602 PolarHBondContact O-N 3.39Å; Y599-M602 PolarHBondContact O-N 2.98Å; V600-M602 PolarHBondContact O-N 2.85Å; M602-L606 HydrophobicContact CG-CD1 3.66Å; M602-L606 HydrophobicContact CG-CG 4.39Å; M602-L606 VanDerWaalsContact O-CB 3.25Å; M602-L606 WeakPolarHBondContact O-CB 3.43Å; M602-L606 VanDerWaalsContact O-CG 3.27Å; M602-L606 WeakPolarHBondContact O-CG 3.44Å; M602-L606 PolarHBondContact O-N 3.2Å; M602-L606 HydrophobicContact SD-CD1 4.46Å; M602-L622 HydrophobicContact CE-CD1 4.27Å; M602-L622 HydrophobicContact CE-CD2 3.59Å; M602-L867 HydrophobicContact SD-CD1 3.96Å; M602-L867 HydrophobicContact SD-CD2 4.25Å; M602-L885 HydrophobicContact CG-CD2 4.15Å; M602-L885 HydrophobicContact SD-CD2 3.65Å
603	C	92.3	Very high	90.7	Very high	5 Å²	5	51.8 Å²	51.8	3%	0.034	29%	0.286	C	S	.	.	H	α-helix	trans	-64.8	-44.5	178.6	-73.8	0	0	0	0	111.8	Y599 V600 N605 L606 E607 L660	Y599-C603 VanDerWaalsContact O-CB 3.26Å; Y599-C603 WeakPolarHBondContact O-CB 3.25Å; Y599-C603 PolarHBondContact O-N 3.28Å; Y599-C603 PolarHBondContact O-SG 3.22Å; V600-C603 PolarHBondContact O-N 2.75Å; C603-N605 PolarHBondContact O-N 2.98Å; C603-L606 PolarHBondContact O-N 3.19Å; C603-E607 VanDerWaalsContact O-CB 3.24Å; C603-E607 WeakPolarHBondContact O-CB 3.36Å; C603-E607 PolarHBondContact O-N 2.67Å; C603-L660 HydrophobicContact CB-CD1 3.78Å
604	G	88.6	Confident	90.5	Very high	50 Å²	50	49.2 Å²	49.2	52%	0.515	27%	0.273	S	S	.	.	H	α-helix	trans	-62.9	-40.8	178.5	0	0	0	0	0	113.5	V600 P608	V600-G604 PolarHBondContact O-N 3.25Å; G604-P608 VanDerWaalsContact O-CD 3.28Å; G604-P608 WeakPolarHBondContact O-CD 3.46Å
605	N	87.8	Confident	90.5	Very high	58 Å²	58	50 Å²	50	31%	0.31	28%	0.277	S	S	.	.	H	α-helix	trans	-74.8	-37.1	176.5	-76.4	-58.7	0	0	0	113.1	E601 C603 L882	E601-N605 WeakPolarHBondContact CG-ND2 3.48Å; E601-N605 WeakPolarHBondContact O-CB 3.45Å; E601-N605 PolarHBondContact O-N 2.89Å; E601-N605 PolarHBondContact O-ND2 2.75Å; C603-N605 PolarHBondContact O-N 2.98Å; N605-L882 HydrophobicContact CB-CD2 3.9Å
606	L	90	Very high	90.4	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-77.7	-44	-179.3	-72.3	175.9	0	0	0	112.8	M602 C603 P608 L609 L610 L618 L867 I870 I871 L882	M602-L606 HydrophobicContact CG-CD1 3.66Å; M602-L606 HydrophobicContact CG-CG 4.39Å; M602-L606 VanDerWaalsContact O-CB 3.25Å; M602-L606 WeakPolarHBondContact O-CB 3.43Å; M602-L606 VanDerWaalsContact O-CG 3.27Å; M602-L606 WeakPolarHBondContact O-CG 3.44Å; M602-L606 PolarHBondContact O-N 3.2Å; M602-L606 HydrophobicContact SD-CD1 4.46Å; C603-L606 PolarHBondContact O-N 3.19Å; L606-P608 VanDerWaalsContact C-CD 3.45Å; L606-L609 WeakPolarHBondContact O-CA 3.39Å; L606-L609 WeakPolarHBondContact O-CB 3.45Å; L606-L609 PolarHBondContact O-N 3.39Å; L606-L610 HydrophobicContact CB-CD1 4.33Å; L606-L610 HydrophobicContact CB-CG 4.4Å; L606-L610 WeakPolarHBondContact O-CG 3.5Å; L606-L610 PolarHBondContact O-N 2.98Å; L606-L618 HydrophobicContact CD1-CD2 3.98Å; L606-L867 HydrophobicContact CD1-CD2 3.77Å; L606-I870 HydrophobicContact CD2-CG2 4.27Å; L606-I871 HydrophobicContact CD2-CG1 4.28Å; L606-L882 HydrophobicContact CD2-CD1 3.77Å; L606-L882 HydrophobicContact CD2-CD2 4.44Å; L606-L882 HydrophobicContact CG-CD1 4.47Å; L606-L882 HydrophobicContact CG-CD2 4.27Å
607	E	90.8	Very high	90.4	Very high	35 Å²	35	54.9 Å²	54.9	16%	0.164	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-51.9	-45.2	-165.9	-173.3	176.2	150.3	0	0	115	C603 L609 L610 K615 T659 L660	C603-E607 VanDerWaalsContact O-CB 3.24Å; C603-E607 WeakPolarHBondContact O-CB 3.36Å; C603-E607 PolarHBondContact O-N 2.67Å; E607-L609 PolarHBondContact O-N 2.9Å; E607-L610 PolarHBondContact O-N 3.13Å; E607-K615 HydrophobicContact CG-CD 3.99Å; E607-K615 WeakPolarHBondContact O-CE 3.37Å; E607-K615 IonicContact OE1-NZ 2.7Å; E607-K615 PolarHBondContact OE1-NZ 3.01Å; E607-T659 WeakPolarHBondContact OE1-CA 3.3Å; E607-T659 WeakPolarHBondContact OE1-CB 3.5Å; E607-T659 WeakPolarHBondContact OE1-CG2 3.5Å; E607-L660 HydrophobicContact CB-CD1 3.81Å; E607-L660 HydrophobicContact CB-CG 4.12Å; E607-L660 HydrophobicContact CG-CD1 4.27Å; E607-L660 HydrophobicContact CG-CG 4Å; E607-L660 VanDerWaalsContact OE2-CB 3.27Å; E607-L660 WeakPolarHBondContact OE2-CB 3.42Å; E607-L660 WeakPolarHBondContact OE2-CG 3.43Å; E607-L660 PolarHBondContact OE2-N 3.32Å
608	P	88.4	Confident	90.7	Very high	106 Å²	106	49.3 Å²	49.3	69%	0.688	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-59.5	-19.3	179.5	-24.3	35.6	0	0	0	113.8	G604 L606	G604-P608 VanDerWaalsContact O-CD 3.28Å; G604-P608 WeakPolarHBondContact O-CD 3.46Å; L606-P608 VanDerWaalsContact C-CD 3.45Å
609	L	87.3	Confident	90.9	Very high	65 Å²	65	45.5 Å²	45.5	34%	0.34	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-104.1	-3	-173.7	-49.1	177.1	0	0	0	113.1	L606 E607 K874 T878	L606-L609 WeakPolarHBondContact O-CA 3.39Å; L606-L609 WeakPolarHBondContact O-CB 3.45Å; L606-L609 PolarHBondContact O-N 3.39Å; E607-L609 PolarHBondContact O-N 2.9Å; L609-K874 HydrophobicContact CB-CD 4.31Å; L609-K874 PolarHBondContact O-NZ 3.27Å; L609-T878 HydrophobicContact CD1-CG2 3.36Å; L609-T878 WeakPolarHBondContact CD1-OG1 3.33Å
610	L	91.2	Very high	91	Very high	14 Å²	14	45 Å²	45	7%	0.073	25%	0.25	C	C	.	.			trans	-97.8	135.4	-177	-59.5	-172.6	0	0	0	112.3	L606 E607 E614 K615 L618 L660 I870	L606-L610 HydrophobicContact CB-CD1 4.33Å; L606-L610 HydrophobicContact CB-CG 4.4Å; L606-L610 WeakPolarHBondContact O-CG 3.5Å; L606-L610 PolarHBondContact O-N 2.98Å; E607-L610 PolarHBondContact O-N 3.13Å; L610-E614 HydrophobicContact CB-CB 4.03Å; L610-E614 HydrophobicContact CD2-CB 4.16Å; L610-E614 HydrophobicContact CG-CB 4.47Å; L610-K615 HydrophobicContact CB-CG 3.59Å; L610-K615 HydrophobicContact CD1-CG 4.16Å; L610-K615 HydrophobicContact CG-CG 4.5Å; L610-L618 HydrophobicContact CD1-CB 4.4Å; L610-L618 HydrophobicContact CD1-CD2 3.54Å; L610-L660 HydrophobicContact CD1-CD2 4.2Å; L610-I870 HydrophobicContact CD2-CD1 4.09Å; L610-I870 HydrophobicContact CD2-CG1 4.47Å; L610-I870 HydrophobicContact CD2-CG2 3.54Å
611	N	91	Very high	91.3	Very high	84 Å²	84	41.6 Å²	41.6	45%	0.449	23%	0.231	S	C	.	.			trans	-74	165.1	166.3	81.2	68.5	0	0	0	111.3	K613 E614 K615	N611-K613 PolarHBondContact O-N 3.4Å; N611-K613 VanDerWaalsContact O-N 3.15Å; N611-K613 WeakPolarHBondContact OD1-CB 3.44Å; N611-K613 PolarHBondContact OD1-N 2.93Å; N611-E614 PolarHBondContact N-OE2 3.29Å; N611-E614 VanDerWaalsContact ND2-CG 3.3Å; N611-E614 WeakPolarHBondContact ND2-CG 3.46Å; N611-E614 PolarHBondContact ND2-OE1 3.05Å; N611-E614 PolarHBondContact ND2-OE2 3.47Å; N611-E614 PolarHBondContact O-N 3.44Å; N611-E614 PolarHBondContact OD1-N 3.02Å; N611-K615 PolarHBondContact O-N 3.03Å
612	V	90.4	Very high	91.7	Very high	67 Å²	67	37.7 Å²	37.7	41%	0.406	21%	0.212	S	C	.	.	H	α-helix	trans	-56.6	-35.1	-173.7	179.7	0	0	0	0	113.3	E616 N658	V612-E616 PolarHBondContact O-N 2.86Å; V612-N658 HydrophobicContact CG1-CB 4.39Å; V612-N658 WeakPolarHBondContact CG1-ND2 3.49Å; V612-N658 HydrophobicContact CG2-CB 4.3Å
613	K	89.6	Confident	92	Very high	93 Å²	93	37.7 Å²	37.7	40%	0.404	21%	0.212	S	C	.	.	H	α-helix	trans	-74.4	-40.4	177.4	-177.7	178.3	178.1	-71.8	0	111.7	N611 K615 E616 E617	N611-K613 PolarHBondContact O-N 3.4Å; N611-K613 VanDerWaalsContact O-N 3.15Å; N611-K613 WeakPolarHBondContact OD1-CB 3.44Å; N611-K613 PolarHBondContact OD1-N 2.93Å; K613-K615 VanDerWaalsContact C-N 3.32Å; K613-K615 PolarHBondContact O-N 3.42Å; K613-E616 PolarHBondContact O-N 2.59Å; K613-E617 HydrophobicContact CG-CG 4.45Å; K613-E617 IonicContact NZ-OE1 2.71Å; K613-E617 PolarHBondContact NZ-OE1 2.9Å; K613-E617 IonicContact NZ-OE2 3.24Å; K613-E617 PolarHBondContact NZ-OE2 3.01Å; K613-E617 WeakPolarHBondContact O-CG 3.35Å; K613-E617 PolarHBondContact O-N 2.69Å
614	E	91.4	Very high	92.1	Very high	32 Å²	32	38.6 Å²	38.6	15%	0.15	22%	0.216	C	C	.	.	H	α-helix	trans	-63.1	-37.7	173.9	-72.7	166.6	162.5	0	0	111.7	L610 N611 L618 I870	L610-E614 HydrophobicContact CB-CB 4.03Å; L610-E614 HydrophobicContact CD2-CB 4.16Å; L610-E614 HydrophobicContact CG-CB 4.47Å; N611-E614 PolarHBondContact N-OE2 3.29Å; N611-E614 VanDerWaalsContact ND2-CG 3.3Å; N611-E614 WeakPolarHBondContact ND2-CG 3.46Å; N611-E614 PolarHBondContact ND2-OE1 3.05Å; N611-E614 PolarHBondContact ND2-OE2 3.47Å; N611-E614 PolarHBondContact O-N 3.44Å; N611-E614 PolarHBondContact OD1-N 3.02Å; E614-L618 WeakPolarHBondContact O-CB 3.49Å; E614-L618 PolarHBondContact O-N 3Å; E614-I870 HydrophobicContact CB-CD1 4.29Å; E614-I870 HydrophobicContact CG-CD1 4.45Å; E614-I870 HydrophobicContact CG-CG1 4.33Å
615	K	93.6	Very high	92.4	Very high	28 Å²	28	36.2 Å²	36.2	12%	0.122	19%	0.192	C	C	.	.	H	α-helix	trans	-62.8	-41.8	172.8	-68.4	-166.8	-171	-169.6	0	112.3	E607 L610 N611 K613 A619 N658 L660	E607-K615 HydrophobicContact CG-CD 3.99Å; E607-K615 WeakPolarHBondContact O-CE 3.37Å; E607-K615 IonicContact OE1-NZ 2.7Å; E607-K615 PolarHBondContact OE1-NZ 3.01Å; L610-K615 HydrophobicContact CB-CG 3.59Å; L610-K615 HydrophobicContact CD1-CG 4.16Å; L610-K615 HydrophobicContact CG-CG 4.5Å; N611-K615 PolarHBondContact O-N 3.03Å; K613-K615 VanDerWaalsContact C-N 3.32Å; K613-K615 PolarHBondContact O-N 3.42Å; K615-A619 WeakPolarHBondContact O-CB 3.44Å; K615-A619 PolarHBondContact O-N 3.47Å; K615-N658 WeakPolarHBondContact CD-O 3.29Å; K615-N658 PolarHBondContact NZ-O 3.41Å; K615-L660 HydrophobicContact CB-CD2 3.86Å; K615-L660 HydrophobicContact CG-CD2 4.07Å; K615-L660 WeakPolarHBondContact O-CD2 3.18Å
616	E	93.5	Very high	92.8	Very high	78 Å²	78	33.5 Å²	33.5	36%	0.364	18%	0.177	S	C	.	.	H	α-helix	trans	-67	-48.4	178.7	-173.2	164.3	110.1	0	0	111.9	V612 K613 G620 K663	V612-E616 PolarHBondContact O-N 2.86Å; K613-E616 PolarHBondContact O-N 2.59Å; E616-G620 PolarHBondContact O-N 2.99Å; E616-K663 HydrophobicContact CB-CD 3.93Å; E616-K663 HydrophobicContact CB-CG 4.41Å; E616-K663 HydrophobicContact CG-CD 3.99Å; E616-K663 WeakPolarHBondContact OE2-CE 3.38Å; E616-K663 IonicContact OE2-NZ 3.26Å; E616-K663 PolarHBondContact OE2-NZ 3.13Å
617	E	92.4	Very high	93	Very high	58 Å²	58	34.9 Å²	34.9	27%	0.271	18%	0.183	S	C	.	.	H	α-helix	trans	-68.9	-35.8	179.1	-66.7	177.2	137.5	0	0	112.5	K613 A621 L866	K613-E617 HydrophobicContact CG-CG 4.45Å; K613-E617 IonicContact NZ-OE1 2.71Å; K613-E617 PolarHBondContact NZ-OE1 2.9Å; K613-E617 IonicContact NZ-OE2 3.24Å; K613-E617 PolarHBondContact NZ-OE2 3.01Å; K613-E617 WeakPolarHBondContact O-CG 3.35Å; K613-E617 PolarHBondContact O-N 2.69Å; E617-A621 WeakPolarHBondContact O-CB 3.47Å; E617-A621 PolarHBondContact O-N 3.04Å; E617-L866 HydrophobicContact CB-CD1 3.56Å; E617-L866 WeakPolarHBondContact O-CD1 3.42Å
618	L	95.1	Very high	93	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-69.6	-50.4	174.7	178.2	60.9	0	0	0	111.7	L606 L610 E614 G620 A621 L622 L660 L863 L866 L867	L606-L618 HydrophobicContact CD1-CD2 3.98Å; L610-L618 HydrophobicContact CD1-CB 4.4Å; L610-L618 HydrophobicContact CD1-CD2 3.54Å; E614-L618 WeakPolarHBondContact O-CB 3.49Å; E614-L618 PolarHBondContact O-N 3Å; L618-G620 VanDerWaalsContact C-N 3.32Å; L618-G620 PolarHBondContact O-N 2.73Å; L618-A621 PolarHBondContact O-N 2.91Å; L618-L622 HydrophobicContact CD1-CD1 3.85Å; L618-L622 HydrophobicContact CD1-CG 3.94Å; L618-L622 HydrophobicContact CD2-CD1 4.43Å; L618-L622 HydrophobicContact CG-CD1 3.82Å; L618-L622 HydrophobicContact CG-CG 4.32Å; L618-L622 WeakPolarHBondContact O-CG 3.33Å; L618-L622 PolarHBondContact O-N 3.25Å; L618-L660 HydrophobicContact CB-CD2 4.43Å; L618-L660 HydrophobicContact CD2-CD1 4.25Å; L618-L660 HydrophobicContact CD2-CD2 4.21Å; L618-L660 HydrophobicContact CG-CD2 4.47Å; L618-L863 HydrophobicContact CD1-CD1 3.76Å; L618-L866 HydrophobicContact CB-CD2 3.9Å; L618-L866 HydrophobicContact CD1-CD2 3.54Å; L618-L866 HydrophobicContact CG-CD2 4.31Å; L618-L867 HydrophobicContact CD1-CD2 3.72Å; L618-L867 HydrophobicContact CD1-CG 4.39Å
619	A	95.9	Very high	93.1	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.008	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-42.1	-177	0	0	0	0	0	111.1	K615 L622 V623 L660 K663 A664	K615-A619 WeakPolarHBondContact O-CB 3.44Å; K615-A619 PolarHBondContact O-N 3.47Å; A619-L622 PolarHBondContact O-N 2.93Å; A619-V623 WeakPolarHBondContact O-CB 3.44Å; A619-V623 VanDerWaalsContact O-CG2 3.29Å; A619-V623 WeakPolarHBondContact O-CG2 2.79Å; A619-V623 PolarHBondContact O-N 3.26Å; A619-L660 HydrophobicContact CB-CD2 4.1Å; A619-K663 HydrophobicContact CB-CB 3.59Å; A619-A664 HydrophobicContact CB-CB 4.26Å
620	G	94.6	Very high	93.3	Very high	8 Å²	8	31.7 Å²	31.7	8%	0.082	18%	0.177	C	C	.	.	H	α-helix	trans	-60.2	-50.8	173.9	0	0	0	0	0	112.2	E616 L618 L622 V623 H624	E616-G620 PolarHBondContact O-N 2.99Å; L618-G620 VanDerWaalsContact C-N 3.32Å; L618-G620 PolarHBondContact O-N 2.73Å; G620-L622 VanDerWaalsContact C-N 3.29Å; G620-L622 PolarHBondContact O-N 3.07Å; G620-V623 PolarHBondContact O-N 2.63Å; G620-V623 VanDerWaalsContact O-N 3.16Å; G620-H624 PolarHBondContact O-CD2 3.25Å; G620-H624 PolarHBondContact O-N 2.9Å
621	A	95.1	Very high	93.4	Very high	9 Å²	9	34.1 Å²	34.1	7%	0.074	19%	0.186	C	C	.	.	H	α-helix	trans	-58.6	-38.7	178.6	0	0	0	0	0	112.9	E617 L618 V625 V862 L863	E617-A621 WeakPolarHBondContact O-CB 3.47Å; E617-A621 PolarHBondContact O-N 3.04Å; L618-A621 PolarHBondContact O-N 2.91Å; A621-V625 WeakPolarHBondContact O-CG2 3.39Å; A621-V625 PolarHBondContact O-N 3.1Å; A621-V625 VanDerWaalsContact O-N 3.13Å; A621-V862 HydrophobicContact CB-CG1 4.49Å; A621-L863 HydrophobicContact CB-CB 4.28Å; A621-L863 HydrophobicContact CB-CD1 3.66Å
622	L	96.7	Very high	93.5	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-67.3	-43.8	174.7	-70.8	172.6	0	0	0	112.6	V595 M602 L618 A619 G620 H624 V625 L626 F635 L863	V595-L622 HydrophobicContact CG1-CD2 3.94Å; M602-L622 HydrophobicContact CE-CD1 4.27Å; M602-L622 HydrophobicContact CE-CD2 3.59Å; L618-L622 HydrophobicContact CD1-CD1 3.85Å; L618-L622 HydrophobicContact CD1-CG 3.94Å; L618-L622 HydrophobicContact CD2-CD1 4.43Å; L618-L622 HydrophobicContact CG-CD1 3.82Å; L618-L622 HydrophobicContact CG-CG 4.32Å; L618-L622 WeakPolarHBondContact O-CG 3.33Å; L618-L622 PolarHBondContact O-N 3.25Å; A619-L622 PolarHBondContact O-N 2.93Å; G620-L622 VanDerWaalsContact C-N 3.29Å; G620-L622 PolarHBondContact O-N 3.07Å; L622-H624 PolarHBondContact O-N 3.12Å; L622-V625 PolarHBondContact O-N 3.28Å; L622-L626 HydrophobicContact CB-CD1 4.4Å; L622-L626 VanDerWaalsContact O-CB 3.29Å; L622-L626 WeakPolarHBondContact O-CB 3.4Å; L622-L626 WeakPolarHBondContact O-CG 3.46Å; L622-L626 PolarHBondContact O-N 3.16Å; L622-F635 HydrophobicContact CB-CE1 4.12Å; L622-F635 HydrophobicContact CB-CZ 3.76Å; L622-F635 HydrophobicContact CD1-CE2 4.4Å; L622-F635 HydrophobicContact CD1-CZ 4.05Å; L622-L863 HydrophobicContact CD2-CD1 3.84Å; L622-L863 HydrophobicContact CD2-CD2 3.77Å; L622-L863 HydrophobicContact CD2-CG 4.47Å; L622-L863 HydrophobicContact CG-CD1 4.03Å
623	V	96.3	Very high	93.7	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-57.4	-48.4	176.7	165.8	0	0	0	0	111.1	A619 G620 Q627 F635 A664 E667 Y668 L671	A619-V623 WeakPolarHBondContact O-CB 3.44Å; A619-V623 VanDerWaalsContact O-CG2 3.29Å; A619-V623 WeakPolarHBondContact O-CG2 2.79Å; A619-V623 PolarHBondContact O-N 3.26Å; G620-V623 PolarHBondContact O-N 2.63Å; G620-V623 VanDerWaalsContact O-N 3.16Å; V623-Q627 VanDerWaalsContact O-CB 3.28Å; V623-Q627 WeakPolarHBondContact O-CB 3.47Å; V623-Q627 PolarHBondContact O-N 3.45Å; V623-F635 HydrophobicContact CG2-CE1 3.92Å; V623-A664 HydrophobicContact CG2-CB 3.78Å; V623-A664 WeakPolarHBondContact CG2-O 3.44Å; V623-E667 HydrophobicContact CG1-CG 4.38Å; V623-Y668 HydrophobicContact CG1-CD2 3.63Å; V623-Y668 HydrophobicContact CG1-CG 4.33Å; V623-L671 HydrophobicContact CG1-CD2 4.15Å
624	H	94.2	Very high	93.9	Very high	24 Å²	24	29.8 Å²	29.8	11%	0.111	16%	0.16	C	C	.	.	H	α-helix	trans	-64.2	-45.9	179.3	-73.8	-81.2	0	0	0	111.9	G620 L622 Q627 S628 E667 V854 R859	G620-H624 PolarHBondContact O-CD2 3.25Å; G620-H624 PolarHBondContact O-N 2.9Å; L622-H624 PolarHBondContact O-N 3.12Å; H624-Q627 PolarHBondContact O-N 3.27Å; H624-S628 PolarHBondContact O-N 3.46Å; H624-S628 PolarHBondContact O-OG 2.71Å; H624-E667 IonicContact CD2-OE1 3.81Å; H624-E667 IonicContact NE2-OE1 3.85Å; H624-E667 PolarHBondContact NE2-OE1 2.87Å; H624-V854 HydrophobicContact CB-CG1 4.19Å; H624-V854 WeakPolarHBondContact O-CG1 3.33Å; H624-R859 HydrophobicContact CB-CB 4.49Å; H624-R859 HydrophobicContact CB-CG 3.87Å; H624-R859 PolarHBondContact ND1-NH2 3.44Å
625	V	95.8	Very high	94.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-60.3	-50.6	176.3	169.4	0	0	0	0	111.3	V595 A621 L622 Q627 S628 I629 L856 R859 L860 L863	V595-V625 HydrophobicContact CG1-CG1 4.08Å; A621-V625 WeakPolarHBondContact O-CG2 3.39Å; A621-V625 PolarHBondContact O-N 3.1Å; A621-V625 VanDerWaalsContact O-N 3.13Å; L622-V625 PolarHBondContact O-N 3.28Å; V625-Q627 VanDerWaalsContact C-N 3.32Å; V625-Q627 PolarHBondContact O-N 2.94Å; V625-S628 PolarHBondContact O-N 2.77Å; V625-S628 PolarHBondContact O-OG 3.48Å; V625-I629 HydrophobicContact CG1-CD1 3.76Å; V625-I629 WeakPolarHBondContact O-CG1 3.26Å; V625-I629 PolarHBondContact O-N 2.93Å; V625-L856 HydrophobicContact CG1-CD1 4.2Å; V625-R859 HydrophobicContact CG2-CB 3.61Å; V625-L860 HydrophobicContact CG1-CD2 3.8Å; V625-L860 HydrophobicContact CG1-CG 4.46Å; V625-L860 HydrophobicContact CG2-CD2 4.21Å; V625-L860 HydrophobicContact CG2-CG 4.39Å; V625-L863 HydrophobicContact CG2-CB 4.35Å; V625-L863 HydrophobicContact CG2-CD2 4.05Å
626	L	95.4	Very high	94.2	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-70.9	-26.7	-175.7	-67.5	166.1	0	0	0	112.3	V595 Y599 L622 I629 G630 K631 A632 F635	V595-L626 HydrophobicContact CG1-CD2 4.12Å; V595-L626 HydrophobicContact CG1-CG 4.36Å; Y599-L626 HydrophobicContact CD1-CD1 4.35Å; Y599-L626 HydrophobicContact CD1-CD2 4.29Å; Y599-L626 HydrophobicContact CG-CD1 4.43Å; L622-L626 HydrophobicContact CB-CD1 4.4Å; L622-L626 VanDerWaalsContact O-CB 3.29Å; L622-L626 WeakPolarHBondContact O-CB 3.4Å; L622-L626 WeakPolarHBondContact O-CG 3.46Å; L622-L626 PolarHBondContact O-N 3.16Å; L626-I629 PolarHBondContact O-N 2.88Å; L626-G630 PolarHBondContact O-N 2.91Å; L626-G630 VanDerWaalsContact O-N 3.13Å; L626-K631 HydrophobicContact CD2-CB 4.14Å; L626-K631 PolarHBondContact O-N 3Å; L626-A632 HydrophobicContact CB-CB 4.37Å; L626-A632 PolarHBondContact O-N 2.84Å; L626-A632 VanDerWaalsContact O-N 3.1Å; L626-F635 HydrophobicContact CD1-CB 3.85Å; L626-F635 HydrophobicContact CD1-CD1 3.66Å; L626-F635 HydrophobicContact CD1-CD2 3.65Å; L626-F635 HydrophobicContact CD1-CE1 4.01Å; L626-F635 HydrophobicContact CD1-CE2 3.99Å; L626-F635 HydrophobicContact CD1-CG 3.45Å; L626-F635 VanDerWaalsContact CD1-CG 3.45Å; L626-F635 HydrophobicContact CD1-CZ 4.16Å
627	Q	93.9	Very high	94.2	Very high	29 Å²	29	24.7 Å²	24.7	14%	0.136	14%	0.137	C	C	.	.	H	α-helix	trans	-67.1	-45.6	170.8	180	64.3	8.1	0	0	110.7	V623 H624 V625 I629 G630 A632 Y668 L671 F850	V623-Q627 VanDerWaalsContact O-CB 3.28Å; V623-Q627 WeakPolarHBondContact O-CB 3.47Å; V623-Q627 PolarHBondContact O-N 3.45Å; H624-Q627 PolarHBondContact O-N 3.27Å; V625-Q627 VanDerWaalsContact C-N 3.32Å; V625-Q627 PolarHBondContact O-N 2.94Å; Q627-I629 PolarHBondContact O-N 3.47Å; Q627-I629 VanDerWaalsContact O-N 3.14Å; Q627-G630 PolarHBondContact O-N 3.07Å; Q627-A632 HydrophobicContact CB-CB 4Å; Q627-Y668 HydrophobicContact CB-CE2 4.46Å; Q627-Y668 HydrophobicContact CG-CE2 4.43Å; Q627-Y668 VanDerWaalsContact OE1-CE2 3.3Å; Q627-Y668 PolarHBondContact OE1-OH 3.32Å; Q627-L671 HydrophobicContact CB-CD2 4.06Å; Q627-L671 HydrophobicContact CG-CD2 3.97Å; Q627-F850 HydrophobicContact CG-CD1 4.29Å; Q627-F850 HydrophobicContact CG-CE1 4.09Å
628	S	90.6	Very high	94.2	Very high	38 Å²	38	24.8 Å²	24.8	27%	0.266	14%	0.139	S	C	.	.	H	α-helix	trans	-65.1	-13.4	175	50.5	0	0	0	0	114.9	H624 V625 L856	H624-S628 PolarHBondContact O-N 3.46Å; H624-S628 PolarHBondContact O-OG 2.71Å; V625-S628 PolarHBondContact O-N 2.77Å; V625-S628 PolarHBondContact O-OG 3.48Å; S628-L856 WeakPolarHBondContact OG-CD1 3.49Å
629	I	91.8	Very high	94	Very high	51 Å²	51	25.7 Å²	25.7	26%	0.262	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-6	174	-62.7	170.1	0	0	0	111.4	A592 T596 V625 L626 Q627 K631 L856	A592-I629 HydrophobicContact CB-CD1 4.49Å; T596-I629 HydrophobicContact CG2-CG2 4.11Å; V625-I629 HydrophobicContact CG1-CD1 3.76Å; V625-I629 WeakPolarHBondContact O-CG1 3.26Å; V625-I629 PolarHBondContact O-N 2.93Å; L626-I629 PolarHBondContact O-N 2.88Å; Q627-I629 PolarHBondContact O-N 3.47Å; Q627-I629 VanDerWaalsContact O-N 3.14Å; I629-K631 VanDerWaalsContact C-N 3.33Å; I629-K631 HydrophobicContact CG2-CB 4.46Å; I629-K631 HydrophobicContact CG2-CG 4.08Å; I629-L856 HydrophobicContact CD1-CD1 4.05Å; I629-L856 HydrophobicContact CG1-CD1 3.94Å; I629-L856 HydrophobicContact CG1-CD2 4.25Å
630	G	90.9	Very high	93.7	Very high	51 Å²	51	25.7 Å²	25.7	53%	0.526	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.8	9.4	-176.6	0	0	0	0	0	115	L626 Q627	L626-G630 PolarHBondContact O-N 2.91Å; L626-G630 VanDerWaalsContact O-N 3.13Å; Q627-G630 PolarHBondContact O-N 3.07Å
631	K	93.4	Very high	93.4	Very high	64 Å²	64	27.4 Å²	27.4	28%	0.278	15%	0.151	S	C	.	.			trans	-106.4	-1.5	-172.5	-74	-68.9	-171.9	-177.8	0	115.6	T596 L626 I629 K633 E634 F635	T596-K631 HydrophobicContact CG2-CG 4.22Å; L626-K631 HydrophobicContact CD2-CB 4.14Å; L626-K631 PolarHBondContact O-N 3Å; I629-K631 VanDerWaalsContact C-N 3.33Å; I629-K631 HydrophobicContact CG2-CB 4.46Å; I629-K631 HydrophobicContact CG2-CG 4.08Å; K631-K633 PolarHBondContact O-N 3.29Å; K631-E634 VanDerWaalsContact CD-CD 3.47Å; K631-E634 WeakPolarHBondContact CD-OE1 3.39Å; K631-E634 VanDerWaalsContact CD-OE2 3.3Å; K631-E634 WeakPolarHBondContact CD-OE2 3.34Å; K631-E634 IonicContact NZ-OE1 2.67Å; K631-E634 PolarHBondContact NZ-OE1 3.13Å; K631-E634 IonicContact NZ-OE2 2.58Å; K631-E634 PolarHBondContact NZ-OE2 3.48Å; K631-E634 PolarHBondContact O-N 2.97Å; K631-F635 WeakPolarHBondContact O-CB 3.33Å; K631-F635 PolarHBondContact O-N 2.75Å; K631-F635 VanDerWaalsContact O-N 3.08Å
632	A	94	Very high	93.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58.1	-32.8	179.9	0	0	0	0	0	113.9	L626 Q627 L636 Y668	L626-A632 HydrophobicContact CB-CB 4.37Å; L626-A632 PolarHBondContact O-N 2.84Å; L626-A632 VanDerWaalsContact O-N 3.1Å; Q627-A632 HydrophobicContact CB-CB 4Å; A632-L636 WeakPolarHBondContact O-CB 3.39Å; A632-L636 WeakPolarHBondContact O-CD1 3.27Å; A632-L636 VanDerWaalsContact O-CG 3.28Å; A632-L636 WeakPolarHBondContact O-CG 3.43Å; A632-L636 PolarHBondContact O-N 3.42Å; A632-Y668 HydrophobicContact CB-CD2 4.32Å; A632-Y668 HydrophobicContact CB-CE2 3.64Å
633	K	93.1	Very high	92.6	Very high	66 Å²	66	29.5 Å²	29.5	29%	0.287	17%	0.168	S	C	.	.	H	α-helix	trans	-63.6	-53	177.6	-72	-177.6	-82	-156.4	0	111.9	K631 F635 L636 I637 E735 I739	K631-K633 PolarHBondContact O-N 3.29Å; K633-F635 PolarHBondContact O-N 3.46Å; K633-L636 PolarHBondContact O-N 3.26Å; K633-I637 VanDerWaalsContact O-CG1 3.31Å; K633-I637 WeakPolarHBondContact O-CG1 3.35Å; K633-I637 PolarHBondContact O-N 3.33Å; K633-E735 HydrophobicContact CD-CB 4Å; K633-E735 HydrophobicContact CD-CG 3.9Å; K633-E735 HydrophobicContact CG-CB 4.24Å; K633-E735 HydrophobicContact CG-CG 4.41Å; K633-I739 HydrophobicContact CB-CG1 4.48Å; K633-I739 HydrophobicContact CG-CD1 4.33Å; K633-I739 HydrophobicContact CG-CG1 4.39Å
634	E	94	Very high	92.1	Very high	88 Å²	88	30.4 Å²	30.4	41%	0.411	17%	0.173	S	C	.	.	H	α-helix	trans	-58	-47.9	175.6	-67	170.7	-138.8	0	0	111.2	K631 L636 I637 D638	K631-E634 VanDerWaalsContact CD-CD 3.47Å; K631-E634 WeakPolarHBondContact CD-OE1 3.39Å; K631-E634 VanDerWaalsContact CD-OE2 3.3Å; K631-E634 WeakPolarHBondContact CD-OE2 3.34Å; K631-E634 IonicContact NZ-OE1 2.67Å; K631-E634 PolarHBondContact NZ-OE1 3.13Å; K631-E634 IonicContact NZ-OE2 2.58Å; K631-E634 PolarHBondContact NZ-OE2 3.48Å; K631-E634 PolarHBondContact O-N 2.97Å; E634-L636 VanDerWaalsContact C-N 3.29Å; E634-L636 PolarHBondContact O-N 3.47Å; E634-I637 PolarHBondContact O-N 3.21Å; E634-I637 VanDerWaalsContact O-N 3.13Å; E634-D638 PolarHBondContact O-N 2.9Å
635	F	95.4	Very high	91.6	Very high	1 Å²	1	33.6 Å²	33.6	0%	0.004	19%	0.191	C	C	.	.	H	α-helix	trans	-54.2	-39.9	176.6	168.4	-120	0	0	0	114.1	Y599 L622 V623 L626 K631 K633 L639 A664	Y599-F635 HydrophobicContact CD2-CB 4.42Å; Y599-F635 AromaticContact CD2-CD2 3.47Å; Y599-F635 HydrophobicContact CD2-CD2 3.47Å; Y599-F635 VanDerWaalsContact CD2-CD2 3.47Å; Y599-F635 HydrophobicContact CD2-CE2 4.22Å; Y599-F635 HydrophobicContact CD2-CG 4.42Å; Y599-F635 HydrophobicContact CE2-CB 4.16Å; Y599-F635 AromaticContact CE2-CD2 3.98Å; Y599-F635 HydrophobicContact CE2-CD2 3.98Å; Y599-F635 AromaticContact CG-CD2 3.83Å; Y599-F635 HydrophobicContact CG-CD2 3.83Å; Y599-F635 HydrophobicContact CG-CE2 4.44Å; L622-F635 HydrophobicContact CB-CE1 4.12Å; L622-F635 HydrophobicContact CB-CZ 3.76Å; L622-F635 HydrophobicContact CD1-CE2 4.4Å; L622-F635 HydrophobicContact CD1-CZ 4.05Å; V623-F635 HydrophobicContact CG2-CE1 3.92Å; L626-F635 HydrophobicContact CD1-CB 3.85Å; L626-F635 HydrophobicContact CD1-CD1 3.66Å; L626-F635 HydrophobicContact CD1-CD2 3.65Å; L626-F635 HydrophobicContact CD1-CE1 4.01Å; L626-F635 HydrophobicContact CD1-CE2 3.99Å; L626-F635 HydrophobicContact CD1-CG 3.45Å; L626-F635 VanDerWaalsContact CD1-CG 3.45Å; L626-F635 HydrophobicContact CD1-CZ 4.16Å; K631-F635 WeakPolarHBondContact O-CB 3.33Å; K631-F635 PolarHBondContact O-N 2.75Å; K631-F635 VanDerWaalsContact O-N 3.08Å; K633-F635 PolarHBondContact O-N 3.46Å; F635-L639 HydrophobicContact CD1-CD1 4.36Å; F635-L639 HydrophobicContact CD2-CD1 3.85Å; F635-L639 HydrophobicContact CD2-CG 4.32Å; F635-L639 HydrophobicContact CE1-CD1 3.93Å; F635-L639 HydrophobicContact CE2-CD1 3.38Å; F635-L639 HydrophobicContact CE2-CG 4.13Å; F635-L639 HydrophobicContact CG-CD1 4.34Å; F635-L639 HydrophobicContact CZ-CD1 3.43Å; F635-L639 VanDerWaalsContact CZ-CD1 3.43Å; F635-L639 VanDerWaalsContact O-CB 3.29Å; F635-L639 WeakPolarHBondContact O-CB 3.29Å; F635-L639 VanDerWaalsContact O-CG 3.32Å; F635-L639 WeakPolarHBondContact O-CG 3.31Å; F635-L639 PolarHBondContact O-N 3.13Å; F635-L639 VanDerWaalsContact O-N 3.1Å; F635-A664 HydrophobicContact CE1-CB 3.92Å; F635-A664 HydrophobicContact CZ-CB 4.33Å
636	L	95.4	Very high	91	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-77.8	-36.5	178.4	-72.6	164.9	0	0	0	112.1	A632 K633 E634 L639 G640 A664 I665 Y668 I739 W743	A632-L636 WeakPolarHBondContact O-CB 3.39Å; A632-L636 WeakPolarHBondContact O-CD1 3.27Å; A632-L636 VanDerWaalsContact O-CG 3.28Å; A632-L636 WeakPolarHBondContact O-CG 3.43Å; A632-L636 PolarHBondContact O-N 3.42Å; K633-L636 PolarHBondContact O-N 3.26Å; E634-L636 VanDerWaalsContact C-N 3.29Å; E634-L636 PolarHBondContact O-N 3.47Å; L636-L639 PolarHBondContact O-N 2.9Å; L636-G640 PolarHBondContact O-N 3.29Å; L636-A664 HydrophobicContact CD2-CB 3.48Å; L636-A664 VanDerWaalsContact CD2-CB 3.48Å; L636-I665 HydrophobicContact CD1-CD1 4.37Å; L636-I665 HydrophobicContact CD2-CB 4.38Å; L636-I665 HydrophobicContact CD2-CD1 4.36Å; L636-Y668 HydrophobicContact CD1-CD1 3.24Å; L636-Y668 HydrophobicContact CD1-CD2 4.07Å; L636-Y668 HydrophobicContact CD1-CE1 3.78Å; L636-Y668 HydrophobicContact CD1-CG 3.38Å; L636-I739 HydrophobicContact CB-CD1 3.93Å; L636-I739 HydrophobicContact CB-CG1 4.44Å; L636-I739 HydrophobicContact CB-CG2 4.4Å; L636-I739 HydrophobicContact CD1-CD1 3.63Å; L636-I739 HydrophobicContact CG-CD1 4.43Å; L636-W743 VanDerWaalsContact O-CZ2 3.28Å; L636-W743 WeakPolarHBondContact O-CZ2 3.19Å; L636-W743 PolarHBondContact O-NE1 3.42Å
637	I	93.8	Very high	89.9	Confident	28 Å²	28	40 Å²	40	14%	0.144	22%	0.216	C	C	.	.	H	α-helix	trans	-59.7	-53.1	173	-68.5	162.7	0	0	0	109.6	K633 E634 L639 G640 D641 I739 N742 L746	K633-I637 VanDerWaalsContact O-CG1 3.31Å; K633-I637 WeakPolarHBondContact O-CG1 3.35Å; K633-I637 PolarHBondContact O-N 3.33Å; E634-I637 PolarHBondContact O-N 3.21Å; E634-I637 VanDerWaalsContact O-N 3.13Å; I637-L639 PolarHBondContact O-N 3.33Å; I637-G640 PolarHBondContact O-N 2.91Å; I637-G640 VanDerWaalsContact O-N 3.13Å; I637-D641 PolarHBondContact O-N 2.7Å; I637-I739 HydrophobicContact CG1-CG1 4.36Å; I637-N742 HydrophobicContact CD1-CB 3.82Å; I637-N742 HydrophobicContact CG1-CB 3.92Å; I637-N742 HydrophobicContact CG2-CB 4.3Å; I637-L746 HydrophobicContact CG2-CD1 3.82Å
638	D	93.2	Very high	88.8	Confident	61 Å²	61	40.5 Å²	40.5	33%	0.326	23%	0.23	S	C	.	.	H	α-helix	trans	-57.8	-43.2	177.6	-68.8	-26.8	0	0	0	112.8	Y599 V600 E634 D641 A642	Y599-D638 HydrophobicContact CE2-CB 4.18Å; Y599-D638 WeakPolarHBondContact CE2-OD2 3.28Å; Y599-D638 VanDerWaalsContact CZ-OD2 3.27Å; Y599-D638 PolarHBondContact OH-OD2 3.33Å; V600-D638 HydrophobicContact CG2-CB 4.2Å; E634-D638 PolarHBondContact O-N 2.9Å; D638-D641 PolarHBondContact O-N 2.9Å; D638-A642 WeakPolarHBondContact O-CB 3.43Å; D638-A642 PolarHBondContact O-N 3Å
639	L	91.4	Very high	87.5	Confident	18 Å²	18	48 Å²	48	9%	0.094	26%	0.26	C	S	.	.	H	α-helix	trans	-67.3	-35	177.6	-85.8	175.3	0	0	0	112.8	F635 L636 I637 E643 A661 A664	F635-L639 HydrophobicContact CD1-CD1 4.36Å; F635-L639 HydrophobicContact CD2-CD1 3.85Å; F635-L639 HydrophobicContact CD2-CG 4.32Å; F635-L639 HydrophobicContact CE1-CD1 3.93Å; F635-L639 HydrophobicContact CE2-CD1 3.38Å; F635-L639 HydrophobicContact CE2-CG 4.13Å; F635-L639 HydrophobicContact CG-CD1 4.34Å; F635-L639 HydrophobicContact CZ-CD1 3.43Å; F635-L639 VanDerWaalsContact CZ-CD1 3.43Å; F635-L639 VanDerWaalsContact O-CB 3.29Å; F635-L639 WeakPolarHBondContact O-CB 3.29Å; F635-L639 VanDerWaalsContact O-CG 3.32Å; F635-L639 WeakPolarHBondContact O-CG 3.31Å; F635-L639 PolarHBondContact O-N 3.13Å; F635-L639 VanDerWaalsContact O-N 3.1Å; L636-L639 PolarHBondContact O-N 2.9Å; I637-L639 PolarHBondContact O-N 3.33Å; L639-E643 WeakPolarHBondContact O-CB 3.43Å; L639-E643 PolarHBondContact O-N 3.4Å; L639-E643 VanDerWaalsContact O-N 3.12Å; L639-A661 HydrophobicContact CB-CB 3.84Å; L639-A661 HydrophobicContact CD2-CB 4.29Å; L639-A661 WeakPolarHBondContact O-CB 3.29Å; L639-A664 HydrophobicContact CD1-CB 3.89Å
640	G	89.3	Confident	86.6	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-68.4	-45	174.1	0	0	0	0	0	112	L636 I637 A642 E643 V644	L636-G640 PolarHBondContact O-N 3.29Å; I637-G640 PolarHBondContact O-N 2.91Å; I637-G640 VanDerWaalsContact O-N 3.13Å; G640-A642 PolarHBondContact O-N 3.04Å; G640-E643 PolarHBondContact O-N 3.38Å; G640-V644 WeakPolarHBondContact O-CG2 3.47Å; G640-V644 PolarHBondContact O-N 3.05Å
641	D	88.6	Confident	85.8	Confident	44 Å²	44	52.1 Å²	52.1	24%	0.235	26%	0.263	C	S	.	.	H	α-helix	trans	-59	-47.5	175	-174.1	69.8	0	0	0	111.8	I637 D638 E643 V644 N645 L746 K750	I637-D641 PolarHBondContact O-N 2.7Å; D638-D641 PolarHBondContact O-N 2.9Å; D641-E643 VanDerWaalsContact C-N 3.3Å; D641-E643 PolarHBondContact O-N 3.38Å; D641-V644 PolarHBondContact O-N 3.49Å; D641-N645 WeakPolarHBondContact O-CB 3.49Å; D641-N645 PolarHBondContact O-N 3.4Å; D641-N645 PolarHBondContact O-ND2 2.93Å; D641-N645 PolarHBondContact OD2-ND2 2.65Å; D641-L746 HydrophobicContact CB-CD1 4.5Å; D641-K750 IonicContact OD1-NZ 2.73Å; D641-K750 PolarHBondContact OD1-NZ 3.22Å
642	A	87.4	Confident	84.7	Confident	48 Å²	48	52 Å²	52	40%	0.397	27%	0.273	S	S	.	.	H	α-helix	trans	-58.7	-39	176.1	0	0	0	0	0	112.7	D638 G640 R646	D638-A642 WeakPolarHBondContact O-CB 3.43Å; D638-A642 PolarHBondContact O-N 3Å; G640-A642 PolarHBondContact O-N 3.04Å; A642-R646 WeakPolarHBondContact O-CB 3.49Å; A642-R646 PolarHBondContact O-N 2.88Å
643	E	86.5	Confident	83.6	Confident	6 Å²	6	55.1 Å²	55.1	3%	0.028	29%	0.29	C	S	.	.	H	α-helix	trans	-71.4	-39.1	177.2	179.4	69.5	169.3	0	0	112.6	L639 G640 D641 R646 L647 I654 F655 A661	L639-E643 WeakPolarHBondContact O-CB 3.43Å; L639-E643 PolarHBondContact O-N 3.4Å; L639-E643 VanDerWaalsContact O-N 3.12Å; G640-E643 PolarHBondContact O-N 3.38Å; D641-E643 VanDerWaalsContact C-N 3.3Å; D641-E643 PolarHBondContact O-N 3.38Å; E643-R646 IonicContact OE1-CZ 3.23Å; E643-R646 IonicContact OE1-NH2 3.8Å; E643-R646 PolarHBondContact OE1-NH2 3.38Å; E643-R646 IonicContact OE2-CZ 2.7Å; E643-R646 IonicContact OE2-NE 3.14Å; E643-R646 PolarHBondContact OE2-NE 3.38Å; E643-R646 IonicContact OE2-NH2 2.67Å; E643-R646 PolarHBondContact OE2-NH2 2.9Å; E643-L647 HydrophobicContact CG-CD1 4.31Å; E643-L647 WeakPolarHBondContact O-CD1 3.41Å; E643-L647 WeakPolarHBondContact O-CG 2.97Å; E643-L647 PolarHBondContact O-N 3.5Å; E643-I654 HydrophobicContact CG-CG1 4.5Å; E643-F655 HydrophobicContact CB-CD2 4.49Å; E643-F655 HydrophobicContact CB-CE2 3.92Å; E643-F655 HydrophobicContact CG-CD2 3.66Å; E643-F655 HydrophobicContact CG-CE2 3.58Å; E643-A661 HydrophobicContact CB-CB 4.11Å
644	V	85.3	Confident	82.8	Confident	19 Å²	19	52.3 Å²	52.3	12%	0.115	28%	0.278	C	S	.	.	H	α-helix	trans	-59.4	-50.2	171.4	170.1	0	0	0	0	110	G640 D641 R646 L647 I654 L759	G640-V644 WeakPolarHBondContact O-CG2 3.47Å; G640-V644 PolarHBondContact O-N 3.05Å; D641-V644 PolarHBondContact O-N 3.49Å; V644-R646 PolarHBondContact O-N 3.24Å; V644-L647 PolarHBondContact O-N 3.23Å; V644-I654 HydrophobicContact CB-CD1 4.47Å; V644-I654 HydrophobicContact CG2-CD1 3.72Å; V644-L759 HydrophobicContact CG2-CD1 3.87Å
645	N	84.4	Confident	81.8	Confident	91 Å²	91	48.1 Å²	48.1	49%	0.487	26%	0.258	S	S	.	.	H	α-helix	trans	-65.7	-37.5	-178.5	-63.5	-23.5	0	0	0	112.2	D641 L647 K750	D641-N645 WeakPolarHBondContact O-CB 3.49Å; D641-N645 PolarHBondContact O-N 3.4Å; D641-N645 PolarHBondContact O-ND2 2.93Å; D641-N645 PolarHBondContact OD2-ND2 2.65Å; N645-L647 VanDerWaalsContact C-N 3.29Å; N645-L647 PolarHBondContact O-N 3.28Å; N645-K750 PolarHBondContact OD1-NZ 3.13Å
646	R	82.3	Confident	80.9	Confident	120 Å²	120	53 Å²	53	45%	0.453	28%	0.277	S	S	.	.	H	α-helix	trans	-61.5	-33.5	179.3	-177.2	-175.8	70.8	89	-2.8	113.3	A642 E643 V644 E657	A642-R646 WeakPolarHBondContact O-CB 3.49Å; A642-R646 PolarHBondContact O-N 2.88Å; E643-R646 IonicContact OE1-CZ 3.23Å; E643-R646 IonicContact OE1-NH2 3.8Å; E643-R646 PolarHBondContact OE1-NH2 3.38Å; E643-R646 IonicContact OE2-CZ 2.7Å; E643-R646 IonicContact OE2-NE 3.14Å; E643-R646 PolarHBondContact OE2-NE 3.38Å; E643-R646 IonicContact OE2-NH2 2.67Å; E643-R646 PolarHBondContact OE2-NH2 2.9Å; V644-R646 PolarHBondContact O-N 3.24Å; R646-E657 IonicContact CZ-OE2 2.97Å; R646-E657 VanDerWaalsContact CZ-OE2 3.26Å; R646-E657 IonicContact NH1-OE2 3.41Å; R646-E657 PolarHBondContact NH1-OE2 2.88Å; R646-E657 IonicContact NH2-OE2 2.76Å; R646-E657 PolarHBondContact NH2-OE2 3.19Å
647	L	73	Confident	80.2	Confident	14 Å²	14	56.3 Å²	56.3	7%	0.073	29%	0.292	C	S	.	.	H	α-helix	trans	-88.5	-32.3	-169.1	-74.1	167.1	0	0	0	113.8	E643 V644 N645 E649 K650 L653 I654	E643-L647 HydrophobicContact CG-CD1 4.31Å; E643-L647 WeakPolarHBondContact O-CD1 3.41Å; E643-L647 WeakPolarHBondContact O-CG 2.97Å; E643-L647 PolarHBondContact O-N 3.5Å; V644-L647 PolarHBondContact O-N 3.23Å; N645-L647 VanDerWaalsContact C-N 3.29Å; N645-L647 PolarHBondContact O-N 3.28Å; L647-E649 PolarHBondContact O-N 2.8Å; L647-K650 HydrophobicContact CD2-CB 4.17Å; L647-K650 WeakPolarHBondContact O-CB 3.38Å; L647-K650 PolarHBondContact O-N 2.82Å; L647-L653 HydrophobicContact CD2-CB 4.24Å; L647-I654 VanDerWaalsContact CD1-CA 3.46Å; L647-I654 HydrophobicContact CD1-CB 3.75Å; L647-I654 HydrophobicContact CD1-CD1 4.41Å; L647-I654 HydrophobicContact CD1-CG1 3.77Å
648	G	72.1	Confident	79.9	Confident	41 Å²	41	58.4 Å²	58.4	42%	0.423	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	-108.7	178.4	0	0	0	0	0	112.7
649	E	62.5	Low	79.8	Confident	194 Å²	194	55.6 Å²	55.6	91%	0.907	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-15.3	177	-60.7	177.9	168.5	0	0	113.8	L647 E651	L647-E649 PolarHBondContact O-N 2.8Å; E649-E651 PolarHBondContact O-N 2.72Å
650	K	73.5	Confident	79.9	Confident	141 Å²	141	54.8 Å²	54.8	61%	0.613	29%	0.285	S	S	*	.			trans	-83.8	35.9	-175.1	-63.2	178.2	-177.1	167.1	0	113.3	L647 A652 L653	L647-K650 HydrophobicContact CD2-CB 4.17Å; L647-K650 WeakPolarHBondContact O-CB 3.38Å; L647-K650 PolarHBondContact O-N 2.82Å; K650-A652 PolarHBondContact O-N 3.48Å; K650-L653 HydrophobicContact CB-CD1 4.31Å; K650-L653 WeakPolarHBondContact O-CB 3Å; K650-L653 PolarHBondContact O-N 2.77Å
651	E	73.7	Confident	80.1	Confident	49 Å²	49	55 Å²	55	23%	0.229	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-54.4	-32.7	-171.9	-50.5	-174	175.9	0	0	113.8	E649 L653 I654 K752 I755 R758	E649-E651 PolarHBondContact O-N 2.72Å; E651-L653 PolarHBondContact O-N 3.28Å; E651-I654 WeakPolarHBondContact O-CB 3.43Å; E651-I654 VanDerWaalsContact O-CG2 3.28Å; E651-I654 WeakPolarHBondContact O-CG2 3.22Å; E651-I654 PolarHBondContact O-N 2.76Å; E651-K752 IonicContact OE1-NZ 2.76Å; E651-K752 PolarHBondContact OE1-NZ 3Å; E651-I755 HydrophobicContact CB-CD1 4.43Å; E651-I755 HydrophobicContact CG-CD1 3.81Å; E651-I755 HydrophobicContact CG-CG1 4.5Å; E651-I755 VanDerWaalsContact OE1-CD1 3.31Å; E651-I755 WeakPolarHBondContact OE1-CD1 3.23Å; E651-I755 WeakPolarHBondContact OE2-CG1 3.41Å; E651-R758 IonicContact OE2-CZ 3.83Å; E651-R758 IonicContact OE2-NH1 2.73Å; E651-R758 PolarHBondContact OE2-NH1 3.07Å; E651-R758 IonicContact OE2-NH2 2.78Å; E651-R758 PolarHBondContact OE2-NH2 3.38Å; E651-R758 VanDerWaalsContact OE2-NH2 3.08Å
652	A	69.6	Low	80.3	Confident	60 Å²	60	52.9 Å²	52.9	50%	0.496	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-62.6	-11	178.5	0	0	0	0	0	114.4	K650 R656	K650-A652 PolarHBondContact O-N 3.48Å; A652-R656 VanDerWaalsContact O-CD 3.29Å; A652-R656 WeakPolarHBondContact O-CD 3.33Å; A652-R656 PolarHBondContact O-NH1 3.36Å
653	L	71.8	Confident	80.6	Confident	66 Å²	66	52 Å²	52	35%	0.346	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-100.2	-3.5	175.3	-57.9	-179.1	0	0	0	113.7	L647 K650 E651 F655 R656 E657	L647-L653 HydrophobicContact CD2-CB 4.24Å; K650-L653 HydrophobicContact CB-CD1 4.31Å; K650-L653 WeakPolarHBondContact O-CB 3Å; K650-L653 PolarHBondContact O-N 2.77Å; E651-L653 PolarHBondContact O-N 3.28Å; L653-F655 PolarHBondContact O-N 2.88Å; L653-R656 WeakPolarHBondContact O-CB 3.29Å; L653-R656 PolarHBondContact O-N 2.73Å; L653-E657 HydrophobicContact CB-CG 4.32Å
654	I	74.6	Confident	81.1	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.041	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	131.3	-174.3	-161.6	162	0	0	0	112.2	E643 V644 L647 E651 R656 I755 L759	E643-I654 HydrophobicContact CG-CG1 4.5Å; V644-I654 HydrophobicContact CB-CD1 4.47Å; V644-I654 HydrophobicContact CG2-CD1 3.72Å; L647-I654 VanDerWaalsContact CD1-CA 3.46Å; L647-I654 HydrophobicContact CD1-CB 3.75Å; L647-I654 HydrophobicContact CD1-CD1 4.41Å; L647-I654 HydrophobicContact CD1-CG1 3.77Å; E651-I654 WeakPolarHBondContact O-CB 3.43Å; E651-I654 VanDerWaalsContact O-CG2 3.28Å; E651-I654 WeakPolarHBondContact O-CG2 3.22Å; E651-I654 PolarHBondContact O-N 2.76Å; I654-R656 PolarHBondContact O-N 2.76Å; I654-I755 HydrophobicContact CD1-CG2 3.48Å; I654-I755 VanDerWaalsContact CD1-CG2 3.48Å; I654-I755 HydrophobicContact CG2-CG2 4.37Å; I654-L759 HydrophobicContact CD1-CD1 3.85Å; I654-L759 HydrophobicContact CD1-CG 4.44Å; I654-L759 HydrophobicContact CG1-CD1 4.4Å
655	F	74.2	Confident	81.5	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	17.5	-174	-81.5	-133.1	0	0	0	114.2	E643 L653 T662 I665 W743 L759 A762 S763 R767	E643-F655 HydrophobicContact CB-CD2 4.49Å; E643-F655 HydrophobicContact CB-CE2 3.92Å; E643-F655 HydrophobicContact CG-CD2 3.66Å; E643-F655 HydrophobicContact CG-CE2 3.58Å; L653-F655 PolarHBondContact O-N 2.88Å; F655-T662 HydrophobicContact CB-CG2 4.04Å; F655-T662 HydrophobicContact CD1-CG2 4.16Å; F655-T662 HydrophobicContact CD2-CG2 4.4Å; F655-T662 HydrophobicContact CG-CG2 3.94Å; F655-I665 HydrophobicContact CD1-CG2 4.17Å; F655-I665 HydrophobicContact CE1-CG2 3.88Å; F655-W743 AromaticContact CE1-CH2 3.72Å; F655-W743 HydrophobicContact CE1-CH2 3.72Å; F655-W743 HydrophobicContact CE1-CZ2 4.33Å; F655-W743 HydrophobicContact CE1-CZ3 4.12Å; F655-W743 AromaticContact CZ-CH2 3.88Å; F655-W743 HydrophobicContact CZ-CH2 3.88Å; F655-W743 HydrophobicContact CZ-CZ2 4.02Å; F655-W743 HydrophobicContact CZ-CZ3 4.42Å; F655-L759 HydrophobicContact CD1-CD2 4.05Å; F655-L759 HydrophobicContact CD1-CG 4.29Å; F655-L759 HydrophobicContact CD2-CD1 4.12Å; F655-L759 HydrophobicContact CD2-CD2 4.3Å; F655-L759 HydrophobicContact CD2-CG 3.78Å; F655-L759 HydrophobicContact CE1-CD2 3.75Å; F655-L759 HydrophobicContact CE1-CG 4.29Å; F655-L759 HydrophobicContact CE2-CD1 3.77Å; F655-L759 HydrophobicContact CE2-CD2 4.01Å; F655-L759 HydrophobicContact CE2-CG 3.79Å; F655-L759 HydrophobicContact CG-CD2 4.33Å; F655-L759 HydrophobicContact CG-CG 4.05Å; F655-L759 HydrophobicContact CZ-CD1 4.22Å; F655-L759 HydrophobicContact CZ-CD2 3.74Å; F655-L759 HydrophobicContact CZ-CG 4.06Å; F655-A762 HydrophobicContact CB-CB 4.22Å; F655-S763 WeakPolarHBondContact CD1-OG 3.22Å; F655-R767 VanDerWaalsContact O-CZ 3.27Å; F655-R767 PolarHBondContact O-NE 2.83Å; F655-R767 PolarHBondContact O-NH2 3.17Å
656	R	76	Confident	81.9	Confident	103 Å²	103	47.4 Å²	47.4	39%	0.389	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-22.2	175.8	-73.2	167.6	168.5	176.1	-1.6	112.6	K83 A652 L653 I654 L766 N806	K83-R656 WeakPolarHBondContact CE-O 3.32Å; K83-R656 PolarHBondContact NZ-O 3.15Å; A652-R656 VanDerWaalsContact O-CD 3.29Å; A652-R656 WeakPolarHBondContact O-CD 3.33Å; A652-R656 PolarHBondContact O-NH1 3.36Å; L653-R656 WeakPolarHBondContact O-CB 3.29Å; L653-R656 PolarHBondContact O-N 2.73Å; I654-R656 PolarHBondContact O-N 2.76Å; R656-L766 HydrophobicContact CG-CD2 4.31Å; R656-N806 PolarHBondContact NH2-OD1 3.24Å
657	E	80.8	Confident	82.5	Confident	70 Å²	70	44 Å²	44	33%	0.327	23%	0.226	S	C	.	.	S	Bend	trans	-73.3	-178.3	170.6	-58.1	-162.9	135.2	0	0	112.3	R646 L653 T659 T662 R767	R646-E657 IonicContact CZ-OE2 2.97Å; R646-E657 VanDerWaalsContact CZ-OE2 3.26Å; R646-E657 IonicContact NH1-OE2 3.41Å; R646-E657 PolarHBondContact NH1-OE2 2.88Å; R646-E657 IonicContact NH2-OE2 2.76Å; R646-E657 PolarHBondContact NH2-OE2 3.19Å; L653-E657 HydrophobicContact CB-CG 4.32Å; E657-T659 HydrophobicContact CB-CG2 4.36Å; E657-T662 PolarHBondContact O-OG1 3.35Å; E657-R767 PolarHBondContact O-NH2 2.96Å; E657-R767 VanDerWaalsContact O-NH2 3.08Å
658	N	87.3	Confident	83.6	Confident	72 Å²	72	43.4 Å²	43.4	39%	0.385	22%	0.223	S	C	.	.			trans	-109.9	85.4	176.5	-71.8	-8.2	0	0	0	109.3	V612 K615	V612-N658 HydrophobicContact CG1-CB 4.39Å; V612-N658 WeakPolarHBondContact CG1-ND2 3.49Å; V612-N658 HydrophobicContact CG2-CB 4.3Å; K615-N658 WeakPolarHBondContact CD-O 3.29Å; K615-N658 PolarHBondContact NZ-O 3.41Å
659	T	91.3	Very high	84.6	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.018	20%	0.203	C	C	.	.			trans	-113.6	164.5	179.1	62.5	0	0	0	0	112	E607 E657 A661 T662 K663	E607-T659 WeakPolarHBondContact OE1-CA 3.3Å; E607-T659 WeakPolarHBondContact OE1-CB 3.5Å; E607-T659 WeakPolarHBondContact OE1-CG2 3.5Å; E657-T659 HydrophobicContact CB-CG2 4.36Å; T659-A661 VanDerWaalsContact C-N 3.29Å; T659-A661 PolarHBondContact O-N 3.27Å; T659-T662 PolarHBondContact N-OG1 3.48Å; T659-T662 PolarHBondContact O-N 2.88Å; T659-T662 PolarHBondContact O-OG1 2.84Å; T659-T662 WeakPolarHBondContact OG1-CG2 3.29Å; T659-T662 PolarHBondContact OG1-N 3.04Å; T659-T662 PolarHBondContact OG1-OG1 3.37Å; T659-K663 PolarHBondContact O-N 3.46Å
660	L	93.4	Very high	86	Confident	1 Å²	1	36 Å²	36	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-61.3	-40.2	174.5	-70.5	177.5	0	0	0	110.7	C603 E607 L610 K615 L618 A619 T662 K663 A664	C603-L660 HydrophobicContact CB-CD1 3.78Å; E607-L660 HydrophobicContact CB-CD1 3.81Å; E607-L660 HydrophobicContact CB-CG 4.12Å; E607-L660 HydrophobicContact CG-CD1 4.27Å; E607-L660 HydrophobicContact CG-CG 4Å; E607-L660 VanDerWaalsContact OE2-CB 3.27Å; E607-L660 WeakPolarHBondContact OE2-CB 3.42Å; E607-L660 WeakPolarHBondContact OE2-CG 3.43Å; E607-L660 PolarHBondContact OE2-N 3.32Å; L610-L660 HydrophobicContact CD1-CD2 4.2Å; K615-L660 HydrophobicContact CB-CD2 3.86Å; K615-L660 HydrophobicContact CG-CD2 4.07Å; K615-L660 WeakPolarHBondContact O-CD2 3.18Å; L618-L660 HydrophobicContact CB-CD2 4.43Å; L618-L660 HydrophobicContact CD2-CD1 4.25Å; L618-L660 HydrophobicContact CD2-CD2 4.21Å; L618-L660 HydrophobicContact CG-CD2 4.47Å; A619-L660 HydrophobicContact CB-CD2 4.1Å; L660-T662 VanDerWaalsContact C-N 3.33Å; L660-T662 PolarHBondContact O-N 3.16Å; L660-K663 CarbonylContact O-C 3.49Å; L660-K663 PolarHBondContact O-N 2.91Å; L660-A664 VanDerWaalsContact O-CB 3.31Å; L660-A664 WeakPolarHBondContact O-CB 3.49Å; L660-A664 PolarHBondContact O-N 3.13Å
661	A	92.9	Very high	86.7	Confident	5 Å²	5	31 Å²	31	4%	0.041	16%	0.156	C	C	.	.	H	α-helix	trans	-51.3	-51.9	171.8	0	0	0	0	0	111.7	L639 E643 T659 K663 A664 I665	L639-A661 HydrophobicContact CB-CB 3.84Å; L639-A661 HydrophobicContact CD2-CB 4.29Å; L639-A661 WeakPolarHBondContact O-CB 3.29Å; E643-A661 HydrophobicContact CB-CB 4.11Å; T659-A661 VanDerWaalsContact C-N 3.29Å; T659-A661 PolarHBondContact O-N 3.27Å; A661-K663 VanDerWaalsContact C-N 3.3Å; A661-K663 PolarHBondContact O-N 2.87Å; A661-A664 PolarHBondContact O-N 2.73Å; A661-I665 PolarHBondContact O-N 2.96Å; A661-I665 VanDerWaalsContact O-N 3.13Å
662	T	93	Very high	87.5	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-66.6	-29.9	178.6	62.8	0	0	0	0	114	F655 E657 T659 L660 I665 D666 R767	F655-T662 HydrophobicContact CB-CG2 4.04Å; F655-T662 HydrophobicContact CD1-CG2 4.16Å; F655-T662 HydrophobicContact CD2-CG2 4.4Å; F655-T662 HydrophobicContact CG-CG2 3.94Å; E657-T662 PolarHBondContact O-OG1 3.35Å; T659-T662 PolarHBondContact N-OG1 3.48Å; T659-T662 PolarHBondContact O-N 2.88Å; T659-T662 PolarHBondContact O-OG1 2.84Å; T659-T662 WeakPolarHBondContact OG1-CG2 3.29Å; T659-T662 PolarHBondContact OG1-N 3.04Å; T659-T662 PolarHBondContact OG1-OG1 3.37Å; L660-T662 VanDerWaalsContact C-N 3.33Å; L660-T662 PolarHBondContact O-N 3.16Å; T662-I665 WeakPolarHBondContact O-CG2 3.12Å; T662-D666 WeakPolarHBondContact O-CB 3.43Å; T662-D666 PolarHBondContact O-N 3.36Å; T662-D666 VanDerWaalsContact O-N 3.13Å; T662-D666 VanDerWaalsContact O-OD1 3.09Å; T662-R767 VanDerWaalsContact CB-CZ 3.45Å; T662-R767 VanDerWaalsContact CB-NH2 3.33Å
663	K	94.8	Very high	88.5	Confident	28 Å²	28	26.4 Å²	26.4	12%	0.122	13%	0.125	C	C	.	.	H	α-helix	trans	-83.5	-24.8	178.6	-73.7	-66.4	173	-166	0	113.8	E616 A619 T659 L660 A661 D666 E667	E616-K663 HydrophobicContact CB-CD 3.93Å; E616-K663 HydrophobicContact CB-CG 4.41Å; E616-K663 HydrophobicContact CG-CD 3.99Å; E616-K663 WeakPolarHBondContact OE2-CE 3.38Å; E616-K663 IonicContact OE2-NZ 3.26Å; E616-K663 PolarHBondContact OE2-NZ 3.13Å; A619-K663 HydrophobicContact CB-CB 3.59Å; T659-K663 PolarHBondContact O-N 3.46Å; L660-K663 CarbonylContact O-C 3.49Å; L660-K663 PolarHBondContact O-N 2.91Å; A661-K663 VanDerWaalsContact C-N 3.3Å; A661-K663 PolarHBondContact O-N 2.87Å; K663-D666 WeakPolarHBondContact CD-OD2 3.27Å; K663-D666 IonicContact NZ-OD2 3.17Å; K663-D666 PolarHBondContact NZ-OD2 2.96Å; K663-E667 PolarHBondContact O-N 3.49Å
664	A	95.8	Very high	89.2	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-72.1	-46.2	172.8	0	0	0	0	0	110.1	A619 V623 F635 L636 L639 L660 A661 E667 Y668	A619-A664 HydrophobicContact CB-CB 4.26Å; V623-A664 HydrophobicContact CG2-CB 3.78Å; V623-A664 WeakPolarHBondContact CG2-O 3.44Å; F635-A664 HydrophobicContact CE1-CB 3.92Å; F635-A664 HydrophobicContact CZ-CB 4.33Å; L636-A664 HydrophobicContact CD2-CB 3.48Å; L636-A664 VanDerWaalsContact CD2-CB 3.48Å; L639-A664 HydrophobicContact CD1-CB 3.89Å; L660-A664 VanDerWaalsContact O-CB 3.31Å; L660-A664 WeakPolarHBondContact O-CB 3.49Å; L660-A664 PolarHBondContact O-N 3.13Å; A661-A664 PolarHBondContact O-N 2.73Å; A664-E667 PolarHBondContact O-N 3.08Å; A664-Y668 WeakPolarHBondContact O-CB 3.21Å; A664-Y668 PolarHBondContact O-N 2.99Å
665	I	94.9	Very high	89.7	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-68.3	-37.2	175.8	-157.8	62.6	0	0	0	112.2	L636 F655 A661 T662 E667 Y668 M669 L736 W743	L636-I665 HydrophobicContact CD1-CD1 4.37Å; L636-I665 HydrophobicContact CD2-CB 4.38Å; L636-I665 HydrophobicContact CD2-CD1 4.36Å; F655-I665 HydrophobicContact CD1-CG2 4.17Å; F655-I665 HydrophobicContact CE1-CG2 3.88Å; A661-I665 PolarHBondContact O-N 2.96Å; A661-I665 VanDerWaalsContact O-N 3.13Å; T662-I665 WeakPolarHBondContact O-CG2 3.12Å; I665-E667 PolarHBondContact O-N 3.4Å; I665-Y668 PolarHBondContact O-N 3.37Å; I665-M669 HydrophobicContact CD1-CG 4.18Å; I665-M669 HydrophobicContact CG1-CE 4Å; I665-M669 HydrophobicContact CG1-CG 4.09Å; I665-M669 HydrophobicContact CG1-SD 4.07Å; I665-M669 HydrophobicContact CG2-CE 4.31Å; I665-M669 WeakPolarHBondContact O-CE 3.38Å; I665-M669 WeakPolarHBondContact O-CG 3.49Å; I665-M669 PolarHBondContact O-N 3.31Å; I665-L736 HydrophobicContact CD1-CD2 4.43Å; I665-W743 HydrophobicContact CB-CH2 4.29Å; I665-W743 HydrophobicContact CD1-CH2 3.77Å; I665-W743 HydrophobicContact CD1-CZ3 4.26Å; I665-W743 HydrophobicContact CG1-CH2 3.84Å; I665-W743 HydrophobicContact CG1-CZ3 4.26Å
666	D	93.4	Very high	90.5	Very high	21 Å²	21	29.6 Å²	29.6	11%	0.112	14%	0.137	C	C	.	.	H	α-helix	trans	-52	-40.3	172.6	-81	-1.7	0	0	0	111.3	T662 K663 K670 R767	T662-D666 WeakPolarHBondContact O-CB 3.43Å; T662-D666 PolarHBondContact O-N 3.36Å; T662-D666 VanDerWaalsContact O-N 3.13Å; T662-D666 VanDerWaalsContact O-OD1 3.09Å; K663-D666 WeakPolarHBondContact CD-OD2 3.27Å; K663-D666 IonicContact NZ-OD2 3.17Å; K663-D666 PolarHBondContact NZ-OD2 2.96Å; D666-K670 WeakPolarHBondContact O-CE 3.49Å; D666-R767 VanDerWaalsContact CG-NH1 3.25Å; D666-R767 WeakPolarHBondContact OD1-CB 3.34Å; D666-R767 VanDerWaalsContact OD1-CD 3.22Å; D666-R767 WeakPolarHBondContact OD1-CD 3.31Å; D666-R767 VanDerWaalsContact OD1-CG 3.29Å; D666-R767 WeakPolarHBondContact OD1-CG 3.17Å; D666-R767 IonicContact OD1-CZ 2.69Å; D666-R767 IonicContact OD1-NE 2.71Å; D666-R767 IonicContact OD1-NH1 3.91Å; D666-R767 PolarHBondContact OD1-NH1 2.81Å; D666-R767 IonicContact OD2-NH1 3.53Å; D666-R767 PolarHBondContact OD2-NH1 2.78Å; D666-R767 VanDerWaalsContact OD2-NH1 3.11Å
667	E	94.4	Very high	91.2	Very high	49 Å²	49	24.7 Å²	24.7	23%	0.229	12%	0.118	C	C	.	.	H	α-helix	trans	-83.5	-42.8	179	-171.1	74.4	167.6	0	0	112.5	V623 H624 K663 A664 I665 M669 K670 L671	V623-E667 HydrophobicContact CG1-CG 4.38Å; H624-E667 IonicContact CD2-OE1 3.81Å; H624-E667 IonicContact NE2-OE1 3.85Å; H624-E667 PolarHBondContact NE2-OE1 2.87Å; K663-E667 PolarHBondContact O-N 3.49Å; A664-E667 PolarHBondContact O-N 3.08Å; I665-E667 PolarHBondContact O-N 3.4Å; E667-M669 VanDerWaalsContact C-N 3.33Å; E667-M669 PolarHBondContact O-N 3Å; E667-K670 WeakPolarHBondContact O-CB 3.29Å; E667-K670 PolarHBondContact O-N 3.06Å; E667-K670 IonicContact OE2-NZ 2.7Å; E667-K670 PolarHBondContact OE2-NZ 3.34Å; E667-L671 PolarHBondContact O-N 3.01Å
668	Y	95.2	Very high	91.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-63.8	-38.8	-175.6	-164.1	-120.9	0	0	0	112.6	V623 Q627 A632 L636 A664 I665 K670 L671 V672 E735 L736 I739	V623-Y668 HydrophobicContact CG1-CD2 3.63Å; V623-Y668 HydrophobicContact CG1-CG 4.33Å; Q627-Y668 HydrophobicContact CB-CE2 4.46Å; Q627-Y668 HydrophobicContact CG-CE2 4.43Å; Q627-Y668 VanDerWaalsContact OE1-CE2 3.3Å; Q627-Y668 PolarHBondContact OE1-OH 3.32Å; A632-Y668 HydrophobicContact CB-CD2 4.32Å; A632-Y668 HydrophobicContact CB-CE2 3.64Å; L636-Y668 HydrophobicContact CD1-CD1 3.24Å; L636-Y668 HydrophobicContact CD1-CD2 4.07Å; L636-Y668 HydrophobicContact CD1-CE1 3.78Å; L636-Y668 HydrophobicContact CD1-CG 3.38Å; A664-Y668 WeakPolarHBondContact O-CB 3.21Å; A664-Y668 PolarHBondContact O-N 2.99Å; I665-Y668 PolarHBondContact O-N 3.37Å; Y668-K670 PolarHBondContact O-N 3.06Å; Y668-L671 HydrophobicContact CD2-CD2 4.33Å; Y668-L671 PolarHBondContact O-N 2.95Å; Y668-V672 HydrophobicContact CD1-CG2 4.28Å; Y668-V672 HydrophobicContact CD2-CG1 4.15Å; Y668-V672 HydrophobicContact CE1-CG1 4.09Å; Y668-V672 HydrophobicContact CE1-CG2 4.21Å; Y668-V672 HydrophobicContact CE2-CG1 3.72Å; Y668-V672 PolarHBondContact O-N 3.05Å; Y668-E735 HydrophobicContact CE1-CB 3.85Å; Y668-E735 WeakPolarHBondContact OH-CB 3.35Å; Y668-L736 HydrophobicContact CD1-CD2 3.86Å; Y668-L736 HydrophobicContact CE1-CD2 4.33Å; Y668-I739 HydrophobicContact CD1-CD1 3.82Å; Y668-I739 HydrophobicContact CE1-CD1 3.51Å
669	M	94.3	Very high	91.6	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62	-32	174.5	-66.9	-177.2	-64.5	0	0	112.3	I665 E667 G673 L736 F740 S763 R767 F768	I665-M669 HydrophobicContact CD1-CG 4.18Å; I665-M669 HydrophobicContact CG1-CE 4Å; I665-M669 HydrophobicContact CG1-CG 4.09Å; I665-M669 HydrophobicContact CG1-SD 4.07Å; I665-M669 HydrophobicContact CG2-CE 4.31Å; I665-M669 WeakPolarHBondContact O-CE 3.38Å; I665-M669 WeakPolarHBondContact O-CG 3.49Å; I665-M669 PolarHBondContact O-N 3.31Å; E667-M669 VanDerWaalsContact C-N 3.33Å; E667-M669 PolarHBondContact O-N 3Å; M669-G673 WeakPolarHBondContact O-CA 3.12Å; M669-G673 PolarHBondContact O-N 3.04Å; M669-L736 HydrophobicContact CB-CD1 4.48Å; M669-L736 HydrophobicContact CG-CD1 4.04Å; M669-L736 HydrophobicContact CG-CD2 3.85Å; M669-F740 HydrophobicContact SD-CZ 4.44Å; M669-S763 WeakPolarHBondContact CE-O 3.39Å; M669-R767 HydrophobicContact CE-CB 3.81Å; M669-F768 VanDerWaalsContact C-CE2 3.48Å; M669-F768 HydrophobicContact CB-CB 4.22Å; M669-F768 HydrophobicContact CB-CD1 4.4Å; M669-F768 HydrophobicContact CB-CD2 3.68Å; M669-F768 HydrophobicContact CB-CE2 4.08Å; M669-F768 HydrophobicContact CB-CG 3.87Å; M669-F768 HydrophobicContact CE-CB 3.94Å; M669-F768 WeakPolarHBondContact O-CE2 3.41Å; M669-F768 WeakPolarHBondContact O-CZ 3.28Å; M669-F768 HydrophobicContact SD-CB 3.88Å; M669-F768 HydrophobicContact SD-CG 4.42Å
670	K	90.5	Very high	91.7	Very high	81 Å²	81	23 Å²	23	35%	0.352	11%	0.111	S	C	.	.	H	α-helix	trans	-71.3	-39.1	170.8	-57.6	177.4	-143.7	143.1	0	112	D666 E667 Y668 Q674 F779	D666-K670 WeakPolarHBondContact O-CE 3.49Å; E667-K670 WeakPolarHBondContact O-CB 3.29Å; E667-K670 PolarHBondContact O-N 3.06Å; E667-K670 IonicContact OE2-NZ 2.7Å; E667-K670 PolarHBondContact OE2-NZ 3.34Å; Y668-K670 PolarHBondContact O-N 3.06Å; K670-Q674 WeakPolarHBondContact O-CB 3.24Å; K670-F779 HydrophobicContact CG-CE1 4.2Å
671	L	89.2	Confident	91.7	Very high	34 Å²	34	22.9 Å²	22.9	18%	0.178	11%	0.11	C	C	.	.	H	α-helix	trans	-66.3	-48.8	-177.2	-177.9	57.3	0	0	0	112	V623 Q627 E667 Y668 F850	V623-L671 HydrophobicContact CG1-CD2 4.15Å; Q627-L671 HydrophobicContact CB-CD2 4.06Å; Q627-L671 HydrophobicContact CG-CD2 3.97Å; E667-L671 PolarHBondContact O-N 3.01Å; Y668-L671 HydrophobicContact CD2-CD2 4.33Å; Y668-L671 PolarHBondContact O-N 2.95Å; L671-F850 HydrophobicContact CD1-CE2 3.62Å; L671-F850 HydrophobicContact CD1-CZ 3.73Å; L671-F850 HydrophobicContact CG-CD2 4.46Å; L671-F850 HydrophobicContact CG-CE2 3.84Å; L671-F850 HydrophobicContact CG-CZ 4.11Å; L671-F850 WeakPolarHBondContact O-CD2 3.48Å; L671-F850 VanDerWaalsContact O-CE2 3.29Å; L671-F850 WeakPolarHBondContact O-CE2 3.3Å
672	V	90	Very high	91.6	Very high	13 Å²	13	22.9 Å²	22.9	8%	0.079	11%	0.111	C	C	.	.	H	α-helix	trans	-98	-28.1	-176.7	-47.9	0	0	0	0	113.6	Y668 P733 E735 L736 F850	Y668-V672 HydrophobicContact CD1-CG2 4.28Å; Y668-V672 HydrophobicContact CD2-CG1 4.15Å; Y668-V672 HydrophobicContact CE1-CG1 4.09Å; Y668-V672 HydrophobicContact CE1-CG2 4.21Å; Y668-V672 HydrophobicContact CE2-CG1 3.72Å; Y668-V672 PolarHBondContact O-N 3.05Å; V672-P733 HydrophobicContact CG2-CB 4Å; V672-E735 HydrophobicContact CG2-CB 4.49Å; V672-L736 HydrophobicContact CG2-CD1 4.11Å; V672-L736 HydrophobicContact CG2-CD2 3.81Å; V672-L736 HydrophobicContact CG2-CG 3.63Å; V672-F850 HydrophobicContact CB-CB 4.23Å; V672-F850 HydrophobicContact CB-CD2 4.32Å; V672-F850 HydrophobicContact CG1-CB 3.85Å; V672-F850 HydrophobicContact CG1-CD2 3.94Å; V672-F850 HydrophobicContact CG1-CG 4.04Å
673	G	90	Very high	91.5	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-86.6	-1.9	-175.3	0	0	0	0	0	115.6	M669 K675 Y676 L677	M669-G673 WeakPolarHBondContact O-CA 3.12Å; M669-G673 PolarHBondContact O-N 3.04Å; G673-K675 VanDerWaalsContact C-N 3.29Å; G673-K675 PolarHBondContact O-N 3.11Å; G673-Y676 PolarHBondContact O-N 2.66Å; G673-L677 WeakPolarHBondContact O-CB 3.48Å; G673-L677 PolarHBondContact O-N 3.27Å
674	Q	87.1	Confident	91.4	Very high	47 Å²	47	26.9 Å²	26.9	22%	0.22	13%	0.133	C	C	.	.	H	α-helix	trans	-59.7	-36.7	-173.8	-172.1	60.7	32	0	0	113.1	K670 I678 F779	K670-Q674 WeakPolarHBondContact O-CB 3.24Å; Q674-I678 HydrophobicContact CG-CD1 4.03Å; Q674-I678 WeakPolarHBondContact O-CD1 3.48Å; Q674-I678 VanDerWaalsContact O-CG1 3.28Å; Q674-I678 WeakPolarHBondContact O-CG1 3.35Å; Q674-I678 PolarHBondContact O-N 3.23Å; Q674-I678 VanDerWaalsContact O-N 3.08Å; Q674-F779 PolarHBondContact NE2-O 2.7Å
675	K	85.6	Confident	91.3	Very high	94 Å²	94	26.9 Å²	26.9	41%	0.409	13%	0.133	S	C	.	.	H	α-helix	trans	-63.8	-59.1	175.1	174.6	167.2	168.9	49.6	0	111.2	G673 L677 I678 D679 T848	G673-K675 VanDerWaalsContact C-N 3.29Å; G673-K675 PolarHBondContact O-N 3.11Å; K675-L677 PolarHBondContact O-N 2.94Å; K675-L677 VanDerWaalsContact O-N 3.13Å; K675-I678 PolarHBondContact O-N 2.9Å; K675-D679 VanDerWaalsContact CG-OD2 3.31Å; K675-D679 WeakPolarHBondContact CG-OD2 3.38Å; K675-D679 IonicContact NZ-OD1 3.46Å; K675-D679 IonicContact NZ-OD2 2.66Å; K675-D679 PolarHBondContact NZ-OD2 3.22Å; K675-D679 VanDerWaalsContact O-CG 3.29Å; K675-D679 PolarHBondContact O-N 2.96Å; K675-T848 HydrophobicContact CD-CG2 4.48Å
676	Y	90.2	Very high	91.1	Very high	1 Å²	1	29.8 Å²	29.8	0%	0.004	15%	0.149	C	C	.	.	H	α-helix	trans	-48.8	-40.7	174.7	171	-108.9	0	0	0	112.7	G673 T680 S731 F732 F768 L769	G673-Y676 PolarHBondContact O-N 2.66Å; Y676-T680 WeakPolarHBondContact CD2-OG1 3.34Å; Y676-T680 VanDerWaalsContact CE2-OG1 3.26Å; Y676-T680 WeakPolarHBondContact CE2-OG1 3.44Å; Y676-T680 WeakPolarHBondContact O-CB 3.47Å; Y676-T680 PolarHBondContact O-N 2.96Å; Y676-T680 PolarHBondContact O-OG1 2.9Å; Y676-S731 WeakPolarHBondContact CB-O 3.3Å; Y676-S731 WeakPolarHBondContact CD2-O 3.24Å; Y676-F732 HydrophobicContact CD1-CD2 4.4Å; Y676-F732 HydrophobicContact CD2-CD2 4.12Å; Y676-F732 HydrophobicContact CE1-CD2 4.15Å; Y676-F732 HydrophobicContact CE1-CE2 4.12Å; Y676-F732 AromaticContact CE2-CD2 3.86Å; Y676-F732 HydrophobicContact CE2-CD2 3.86Å; Y676-F732 HydrophobicContact CG-CD2 4.39Å; Y676-F732 AromaticContact CZ-CD2 3.89Å; Y676-F768 HydrophobicContact CD1-CE1 4.36Å; Y676-L769 HydrophobicContact CE1-CD2 4.18Å
677	L	91.5	Very high	91	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-68	-40.6	179	-167.3	72	0	0	0	113.3	G673 K675 L681 F768 L769 A772 F779 L781	G673-L677 WeakPolarHBondContact O-CB 3.48Å; G673-L677 PolarHBondContact O-N 3.27Å; K675-L677 PolarHBondContact O-N 2.94Å; K675-L677 VanDerWaalsContact O-N 3.13Å; L677-L681 HydrophobicContact CD1-CD1 3.74Å; L677-L681 HydrophobicContact CD1-CG 4.46Å; L677-L681 WeakPolarHBondContact O-CB 3.3Å; L677-L681 PolarHBondContact O-N 3.41Å; L677-F768 HydrophobicContact CB-CE1 4.1Å; L677-F768 HydrophobicContact CB-CZ 3.78Å; L677-F768 HydrophobicContact CD1-CD1 4.25Å; L677-F768 HydrophobicContact CD1-CE1 3.8Å; L677-F768 HydrophobicContact CD1-CE2 4.49Å; L677-F768 HydrophobicContact CD1-CZ 3.94Å; L677-F768 HydrophobicContact CD2-CE2 3.95Å; L677-F768 HydrophobicContact CD2-CZ 3.82Å; L677-F768 HydrophobicContact CG-CE1 4.37Å; L677-F768 HydrophobicContact CG-CZ 4.07Å; L677-L769 HydrophobicContact CD1-CD2 3.69Å; L677-A772 HydrophobicContact CD1-CB 3.78Å; L677-A772 HydrophobicContact CD2-CB 3.93Å; L677-A772 HydrophobicContact CG-CB 4.3Å; L677-F779 HydrophobicContact CD2-CB 3.83Å; L677-F779 HydrophobicContact CD2-CD1 3.75Å; L677-F779 HydrophobicContact CD2-CG 4.19Å; L677-L781 HydrophobicContact CG-CD2 4.32Å
678	I	88.6	Confident	90.8	Very high	41 Å²	41	32.6 Å²	32.6	21%	0.21	16%	0.157	C	C	.	.	H	α-helix	trans	-67.4	-47.7	174.9	-70.1	161.6	0	0	0	110	Q674 K675 T680 G682 L781	Q674-I678 HydrophobicContact CG-CD1 4.03Å; Q674-I678 WeakPolarHBondContact O-CD1 3.48Å; Q674-I678 VanDerWaalsContact O-CG1 3.28Å; Q674-I678 WeakPolarHBondContact O-CG1 3.35Å; Q674-I678 PolarHBondContact O-N 3.23Å; Q674-I678 VanDerWaalsContact O-N 3.08Å; K675-I678 PolarHBondContact O-N 2.9Å; I678-T680 PolarHBondContact O-N 3.44Å; I678-G682 WeakPolarHBondContact O-CA 3.34Å; I678-G682 PolarHBondContact O-N 2.85Å; I678-L781 HydrophobicContact CB-CD2 4.47Å; I678-L781 HydrophobicContact CG1-CD2 3.88Å
679	D	88.6	Confident	90.5	Very high	65 Å²	65	35.2 Å²	35.2	35%	0.348	17%	0.167	S	C	.	.	H	α-helix	trans	-67.1	-37.7	-175.6	-61.3	-12	0	0	0	111.3	K675	K675-D679 VanDerWaalsContact CG-OD2 3.31Å; K675-D679 WeakPolarHBondContact CG-OD2 3.38Å; K675-D679 IonicContact NZ-OD1 3.46Å; K675-D679 IonicContact NZ-OD2 2.66Å; K675-D679 PolarHBondContact NZ-OD2 3.22Å; K675-D679 VanDerWaalsContact O-CG 3.29Å; K675-D679 PolarHBondContact O-N 2.96Å
680	T	91.6	Very high	90.2	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.012	20%	0.199	C	C	.	.	H	α-helix	trans	-79.1	-46.5	179	-53.2	0	0	0	0	113.2	Y676 I678 K724 I725	Y676-T680 WeakPolarHBondContact CD2-OG1 3.34Å; Y676-T680 VanDerWaalsContact CE2-OG1 3.26Å; Y676-T680 WeakPolarHBondContact CE2-OG1 3.44Å; Y676-T680 WeakPolarHBondContact O-CB 3.47Å; Y676-T680 PolarHBondContact O-N 2.96Å; Y676-T680 PolarHBondContact O-OG1 2.9Å; I678-T680 PolarHBondContact O-N 3.44Å; T680-K724 HydrophobicContact CG2-CB 4.39Å; T680-I725 HydrophobicContact CG2-CG1 4.03Å
681	L	93.3	Very high	90.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-110.8	-17.9	-169.3	-59.9	-176.9	0	0	0	114.8	L677 D683 F684 I685 V721 L769 A772 I773 L781	L677-L681 HydrophobicContact CD1-CD1 3.74Å; L677-L681 HydrophobicContact CD1-CG 4.46Å; L677-L681 WeakPolarHBondContact O-CB 3.3Å; L677-L681 PolarHBondContact O-N 3.41Å; L681-D683 PolarHBondContact O-N 3.13Å; L681-F684 PolarHBondContact O-N 3.42Å; L681-I685 WeakPolarHBondContact O-CG1 3.3Å; L681-I685 PolarHBondContact O-N 3.42Å; L681-V721 HydrophobicContact CD2-CG2 3.52Å; L681-L769 HydrophobicContact CD1-CD2 4.12Å; L681-A772 HydrophobicContact CD1-CB 4.35Å; L681-I773 HydrophobicContact CD1-CD1 4.46Å; L681-I773 HydrophobicContact CD1-CG1 3.84Å; L681-I773 HydrophobicContact CD2-CG1 4.45Å; L681-L781 HydrophobicContact CB-CD1 4.25Å
682	G	91	Very high	89.8	Confident	5 Å²	5	41.6 Å²	41.6	5%	0.052	22%	0.224	C	C	.	.	H	α-helix	trans	-55.7	-53.5	-171.2	0	0	0	0	0	112.8	I678 I685 N686	I678-G682 WeakPolarHBondContact O-CA 3.34Å; I678-G682 PolarHBondContact O-N 2.85Å; G682-I685 PolarHBondContact O-N 3.36Å; G682-N686 WeakPolarHBondContact O-CB 3.39Å; G682-N686 PolarHBondContact O-N 2.9Å; G682-N686 PolarHBondContact O-ND2 3.4Å
683	D	90.8	Very high	89.4	Confident	108 Å²	108	46.3 Å²	46.3	58%	0.578	25%	0.245	S	C	*	.	H	α-helix	trans	-69.3	-33.9	-179.9	-85.2	-5.8	0	0	0	113.9	L681 N686 R687	L681-D683 PolarHBondContact O-N 3.13Å; D683-N686 PolarHBondContact O-N 3Å; D683-N686 PolarHBondContact OD1-ND2 2.84Å; D683-R687 WeakPolarHBondContact O-CG 3.3Å; D683-R687 PolarHBondContact O-N 2.86Å
684	F	92.8	Very high	89.2	Confident	3 Å²	3	48.7 Å²	48.7	1%	0.013	26%	0.258	C	S	.	.	H	α-helix	trans	-61	-47.8	172.9	170.6	-103.6	0	0	0	111	L681 R687 L688 T717 D720 V721 T797	L681-F684 PolarHBondContact O-N 3.42Å; F684-R687 PolarHBondContact O-N 2.86Å; F684-L688 HydrophobicContact CD1-CD1 4.3Å; F684-L688 HydrophobicContact CE1-CD1 3.6Å; F684-L688 HydrophobicContact CE2-CD1 4.08Å; F684-L688 HydrophobicContact CE2-CG 4.37Å; F684-L688 HydrophobicContact CZ-CD1 3.47Å; F684-L688 VanDerWaalsContact CZ-CD1 3.47Å; F684-L688 HydrophobicContact CZ-CG 4.25Å; F684-L688 PolarHBondContact O-N 2.85Å; F684-T717 HydrophobicContact CE2-CG2 3.96Å; F684-T717 WeakPolarHBondContact CE2-O 3.24Å; F684-T717 HydrophobicContact CZ-CG2 3.76Å; F684-D720 HydrophobicContact CD2-CB 4.35Å; F684-D720 WeakPolarHBondContact CD2-OD2 3.5Å; F684-D720 HydrophobicContact CE2-CB 4.34Å; F684-V721 HydrophobicContact CD1-CB 4.18Å; F684-V721 HydrophobicContact CD1-CG2 3.98Å; F684-V721 HydrophobicContact CD2-CB 4.17Å; F684-V721 HydrophobicContact CE1-CB 3.86Å; F684-V721 HydrophobicContact CE1-CG1 4.36Å; F684-V721 HydrophobicContact CE1-CG2 3.87Å; F684-V721 HydrophobicContact CE2-CB 3.84Å; F684-V721 HydrophobicContact CE2-CG1 4.42Å; F684-V721 HydrophobicContact CG-CB 4.32Å; F684-V721 HydrophobicContact CG-CG2 4.41Å; F684-V721 HydrophobicContact CZ-CB 3.67Å; F684-V721 HydrophobicContact CZ-CG1 3.98Å; F684-V721 HydrophobicContact CZ-CG2 4.22Å; F684-T797 HydrophobicContact CE1-CG2 4.45Å; F684-T797 HydrophobicContact CZ-CG2 4.07Å
685	I	93.6	Very high	89.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.4	-43.1	174.6	-65.5	-56.9	0	0	0	111.3	L681 G682 R687 L688 Y689 P776 L781 T782 L794	L681-I685 WeakPolarHBondContact O-CG1 3.3Å; L681-I685 PolarHBondContact O-N 3.42Å; G682-I685 PolarHBondContact O-N 3.36Å; I685-R687 VanDerWaalsContact C-N 3.31Å; I685-R687 PolarHBondContact O-N 3.08Å; I685-L688 PolarHBondContact O-N 3.21Å; I685-Y689 HydrophobicContact CG2-CD2 3.83Å; I685-Y689 HydrophobicContact CG2-CE2 3.76Å; I685-Y689 VanDerWaalsContact O-CD2 3.31Å; I685-Y689 WeakPolarHBondContact O-CD2 3.4Å; I685-Y689 PolarHBondContact O-N 2.96Å; I685-P776 HydrophobicContact CD1-CG 3.82Å; I685-P776 HydrophobicContact CG1-CB 4.37Å; I685-P776 HydrophobicContact CG1-CG 4.21Å; I685-P776 HydrophobicContact CG2-CB 3.75Å; I685-P776 HydrophobicContact CG2-CG 3.88Å; I685-L781 HydrophobicContact CG1-CD1 4.06Å; I685-T782 HydrophobicContact CG2-CG2 4.12Å; I685-L794 HydrophobicContact CD1-CD2 3.45Å; I685-L794 VanDerWaalsContact CD1-CD2 3.45Å
686	N	90.9	Very high	89.6	Confident	62 Å²	62	43 Å²	43	33%	0.332	23%	0.233	S	C	.	.	H	α-helix	trans	-59.4	-41.4	177	-67.2	-34.1	0	0	0	111.6	G682 D683 Y689 A690	G682-N686 WeakPolarHBondContact O-CB 3.39Å; G682-N686 PolarHBondContact O-N 2.9Å; G682-N686 PolarHBondContact O-ND2 3.4Å; D683-N686 PolarHBondContact O-N 3Å; D683-N686 PolarHBondContact OD1-ND2 2.84Å; N686-Y689 PolarHBondContact O-N 2.95Å; N686-A690 PolarHBondContact O-N 3.47Å
687	R	91.1	Very high	89.7	Confident	109 Å²	109	43 Å²	43	41%	0.411	23%	0.233	S	C	.	.	H	α-helix	trans	-62.3	-48.3	173.5	-74.4	-168	-64.5	-89.4	13.1	111.9	D683 F684 I685 Y689 A690 S691 D720	D683-R687 WeakPolarHBondContact O-CG 3.3Å; D683-R687 PolarHBondContact O-N 2.86Å; F684-R687 PolarHBondContact O-N 2.86Å; I685-R687 VanDerWaalsContact C-N 3.31Å; I685-R687 PolarHBondContact O-N 3.08Å; R687-Y689 VanDerWaalsContact C-N 3.27Å; R687-Y689 PolarHBondContact O-N 3.39Å; R687-A690 CarbonylContact O-C 3.58Å; R687-A690 PolarHBondContact O-N 2.82Å; R687-S691 PolarHBondContact O-N 2.67Å; R687-D720 IonicContact CZ-OD2 2.66Å; R687-D720 IonicContact NE-OD2 3.88Å; R687-D720 PolarHBondContact NE-OD2 3.03Å; R687-D720 IonicContact NH2-OD1 3.08Å; R687-D720 PolarHBondContact NH2-OD1 2.94Å; R687-D720 IonicContact NH2-OD2 2.66Å; R687-D720 PolarHBondContact NH2-OD2 3.32Å
688	L	91.7	Very high	89.7	Confident	19 Å²	19	44 Å²	44	10%	0.099	24%	0.238	C	C	.	.	H	α-helix	trans	-63.7	-28.5	179.4	-73.7	-175.9	0	0	0	114	F684 I685 T717 T790 T793 L794	F684-L688 HydrophobicContact CD1-CD1 4.3Å; F684-L688 HydrophobicContact CE1-CD1 3.6Å; F684-L688 HydrophobicContact CE2-CD1 4.08Å; F684-L688 HydrophobicContact CE2-CG 4.37Å; F684-L688 HydrophobicContact CZ-CD1 3.47Å; F684-L688 VanDerWaalsContact CZ-CD1 3.47Å; F684-L688 HydrophobicContact CZ-CG 4.25Å; F684-L688 PolarHBondContact O-N 2.85Å; I685-L688 PolarHBondContact O-N 3.21Å; L688-T717 HydrophobicContact CD1-CG2 4.15Å; L688-T717 HydrophobicContact CD2-CG2 3.93Å; L688-T790 HydrophobicContact CB-CG2 4.45Å; L688-T790 WeakPolarHBondContact O-CG2 3.39Å; L688-T793 HydrophobicContact CD1-CG2 4.46Å; L688-T793 HydrophobicContact CD2-CG2 4.08Å; L688-L794 HydrophobicContact CD1-CD2 3.55Å; L688-L794 HydrophobicContact CD1-CG 4.45Å
689	Y	88.9	Confident	89.7	Confident	55 Å²	55	45.7 Å²	45.7	22%	0.216	25%	0.252	C	S	.	.	H	α-helix	trans	-78.3	-20.3	172.7	-89.5	-113.2	0	0	0	113.6	I685 N686 R687 P776 T782 A784 P786 T790 L794	I685-Y689 HydrophobicContact CG2-CD2 3.83Å; I685-Y689 HydrophobicContact CG2-CE2 3.76Å; I685-Y689 VanDerWaalsContact O-CD2 3.31Å; I685-Y689 WeakPolarHBondContact O-CD2 3.4Å; I685-Y689 PolarHBondContact O-N 2.96Å; N686-Y689 PolarHBondContact O-N 2.95Å; R687-Y689 VanDerWaalsContact C-N 3.27Å; R687-Y689 PolarHBondContact O-N 3.39Å; Y689-P776 HydrophobicContact CE2-CG 4.35Å; Y689-T782 HydrophobicContact CE1-CG2 3.9Å; Y689-T782 HydrophobicContact CE2-CG2 3.92Å; Y689-T782 WeakPolarHBondContact OH-CG2 3.32Å; Y689-A784 HydrophobicContact CE1-CB 4.28Å; Y689-A784 WeakPolarHBondContact CE1-O 3.41Å; Y689-A784 PolarHBondContact OH-O 3.4Å; Y689-P786 HydrophobicContact CE1-CB 4.3Å; Y689-P786 HydrophobicContact CE2-CB 4.15Å; Y689-P786 VanDerWaalsContact OH-CD 3.25Å; Y689-P786 WeakPolarHBondContact OH-CD 3.45Å; Y689-T790 HydrophobicContact CD2-CG2 3.86Å; Y689-T790 HydrophobicContact CE2-CG2 4.16Å; Y689-T790 HydrophobicContact CG-CG2 4.33Å; Y689-L794 HydrophobicContact CE2-CD1 4.09Å
690	A	88.3	Confident	89.7	Confident	82 Å²	82	50.4 Å²	50.4	68%	0.678	28%	0.276	S	S	*	.	H	α-helix	trans	-92.1	-23.3	175.2	0	0	0	0	0	113.2	N686 R687	N686-A690 PolarHBondContact O-N 3.47Å; R687-A690 CarbonylContact O-C 3.58Å; R687-A690 PolarHBondContact O-N 2.82Å
691	S	87.8	Confident	89.5	Confident	34 Å²	34	56.8 Å²	56.8	24%	0.238	30%	0.304	C	S	.	.			trans	-69.9	153	178	-178.8	0	0	0	0	112.9	R687 E693	R687-S691 PolarHBondContact O-N 2.67Å; S691-E693 WeakPolarHBondContact OG-CB 3.22Å; S691-E693 PolarHBondContact OG-N 2.89Å; S691-E693 PolarHBondContact OG-OE2 3.06Å
692	V	82.1	Confident	89.1	Confident	134 Å²	134	57.2 Å²	57.2	81%	0.812	31%	0.307	S	S	*	.			trans	-111	-1.9	173.9	-165.3	0	0	0	0	110.9
693	E	82.4	Confident	88.9	Confident	112 Å²	112	60.2 Å²	60.2	52%	0.523	33%	0.325	S	S	.	.			trans	-63	149.2	-178.9	-72.3	128.3	-165.6	0	0	112.5	S691 N789	S691-E693 WeakPolarHBondContact OG-CB 3.22Å; S691-E693 PolarHBondContact OG-N 2.89Å; S691-E693 PolarHBondContact OG-OE2 3.06Å; E693-N789 PolarHBondContact O-ND2 3.01Å
694	N	84.4	Confident	88.6	Confident	50 Å²	50	59.4 Å²	59.4	27%	0.267	33%	0.334	S	S	.	.			trans	-105.8	133.2	177.4	-172.6	6.8	0	0	0	109.3	E696 N710 H713 N789	N694-E696 VanDerWaalsContact OD1-CB 3.23Å; N694-E696 WeakPolarHBondContact OD1-CB 3.41Å; N694-E696 PolarHBondContact OD1-N 2.93Å; N694-N710 PolarHBondContact ND2-ND2 3.1Å; N694-N710 VanDerWaalsContact O-CG 3.26Å; N694-N710 PolarHBondContact O-OD1 2.72Å; N694-N710 VanDerWaalsContact O-OD1 3.09Å; N694-H713 PolarHBondContact O-ND1 3.43Å; N694-N789 PolarHBondContact OD1-OD1 3.48Å
695	C	89.3	Confident	88.3	Confident	2 Å²	2	63.8 Å²	63.8	1%	0.014	37%	0.371	C	S	.	.			trans	-115.4	19.5	173	-68.5	0	0	0	0	111.8	V697 L714 T793 L796	C695-V697 PolarHBondContact O-N 3.5Å; C695-V697 VanDerWaalsContact O-N 3.13Å; C695-L714 HydrophobicContact CB-CB 4.21Å; C695-L714 HydrophobicContact CB-CD1 4.27Å; C695-T793 HydrophobicContact CB-CG2 3.94Å; C695-T793 WeakPolarHBondContact CB-OG1 3.37Å; C695-L796 WeakPolarHBondContact O-CD1 3.18Å
696	E	92.7	Very high	88	Confident	20 Å²	20	68.4 Å²	68.4	9%	0.093	39%	0.393	C	S	.	.			trans	-68.5	109.5	172.8	-175.8	55.6	-84.1	0	0	110.3	N694 D698 K701 C702 N710 R792	N694-E696 VanDerWaalsContact OD1-CB 3.23Å; N694-E696 WeakPolarHBondContact OD1-CB 3.41Å; N694-E696 PolarHBondContact OD1-N 2.93Å; E696-D698 VanDerWaalsContact OE1-CB 3.29Å; E696-D698 WeakPolarHBondContact OE1-CB 3.38Å; E696-D698 PolarHBondContact OE1-N 3Å; E696-K701 HydrophobicContact CG-CB 3.74Å; E696-K701 WeakPolarHBondContact OE2-CD 3.34Å; E696-C702 HydrophobicContact CG-CB 4.41Å; E696-C702 WeakPolarHBondContact O-CB 3.26Å; E696-N710 WeakPolarHBondContact O-CB 3.41Å; E696-N710 PolarHBondContact O-ND2 2.81Å; E696-R792 VanDerWaalsContact CD-NE 3.32Å; E696-R792 IonicContact OE1-CZ 2.62Å; E696-R792 IonicContact OE1-NE 3.97Å; E696-R792 PolarHBondContact OE1-NE 3.35Å; E696-R792 IonicContact OE1-NH2 3.81Å; E696-R792 PolarHBondContact OE1-NH2 3.23Å; E696-R792 IonicContact OE2-CZ 2.66Å; E696-R792 IonicContact OE2-NE 2.85Å; E696-R792 PolarHBondContact OE2-NE 2.99Å; E696-R792 IonicContact OE2-NH2 2.71Å; E696-R792 PolarHBondContact OE2-NH2 3.39Å
697	V	92.6	Very high	88	Confident	0 Å²	0	67 Å²	67	0%	0	39%	0.385	C	S	.	.			trans	-110.9	5.1	-175.7	-68.6	0	0	0	0	113.1	C695 P699 L707 N710 Q711 L714 L796 Y816 M817 F819	C695-V697 PolarHBondContact O-N 3.5Å; C695-V697 VanDerWaalsContact O-N 3.13Å; V697-P699 WeakPolarHBondContact O-CD 3.49Å; V697-L707 HydrophobicContact CB-CD1 4.43Å; V697-L707 WeakPolarHBondContact O-CD1 3.38Å; V697-N710 HydrophobicContact CG1-CB 4.17Å; V697-Q711 HydrophobicContact CB-CG 4.21Å; V697-Q711 HydrophobicContact CG1-CB 4.32Å; V697-Q711 HydrophobicContact CG1-CG 3.67Å; V697-L714 HydrophobicContact CG1-CB 4.5Å; V697-L714 HydrophobicContact CG1-CD2 4.22Å; V697-L714 HydrophobicContact CG2-CD2 3.89Å; V697-L796 HydrophobicContact CG2-CD1 4.1Å; V697-L796 HydrophobicContact CG2-CD2 4.22Å; V697-Y816 HydrophobicContact CG2-CD2 4.13Å; V697-Y816 HydrophobicContact CG2-CE2 4.46Å; V697-M817 HydrophobicContact CG2-SD 4Å; V697-F819 HydrophobicContact CB-CE1 4.1Å; V697-F819 HydrophobicContact CB-CZ 4.26Å; V697-F819 HydrophobicContact CG1-CE1 4.3Å; V697-F819 HydrophobicContact CG1-CZ 3.97Å; V697-F819 HydrophobicContact CG2-CE1 4.2Å; V697-F819 HydrophobicContact CG2-CZ 4.39Å
698	D	90.4	Very high	88	Confident	20 Å²	20	65.6 Å²	65.6	11%	0.107	39%	0.392	C	S	.	.			trans	-76.5	116.5	169.2	-177.8	-15.9	0	0	0	110.7	E696 L700 K701 C702 Y816	E696-D698 VanDerWaalsContact OE1-CB 3.29Å; E696-D698 WeakPolarHBondContact OE1-CB 3.38Å; E696-D698 PolarHBondContact OE1-N 3Å; D698-L700 PolarHBondContact O-N 3Å; D698-L700 VanDerWaalsContact O-N 3.09Å; D698-L700 VanDerWaalsContact OD1-CB 3.3Å; D698-L700 WeakPolarHBondContact OD1-CB 3.21Å; D698-L700 PolarHBondContact OD1-N 3.04Å; D698-K701 HydrophobicContact CB-CB 4.28Å; D698-K701 HydrophobicContact CB-CG 4.26Å; D698-K701 PolarHBondContact O-N 3.5Å; D698-K701 IonicContact OD2-NZ 3.45Å; D698-K701 PolarHBondContact OD2-NZ 2.85Å; D698-C702 PolarHBondContact O-N 3.04Å; D698-Y816 HydrophobicContact CB-CD2 4.39Å
699	P	89.2	Confident	88	Confident	78 Å²	78	67.3 Å²	67.3	51%	0.506	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-15.4	179.6	-22.1	34.4	0	0	0	114.7	V697 K701 L707	V697-P699 WeakPolarHBondContact O-CD 3.49Å; P699-K701 VanDerWaalsContact C-N 3.33Å; P699-L707 HydrophobicContact CB-CD2 4.43Å; P699-L707 HydrophobicContact CG-CD2 4.09Å
700	L	89.2	Confident	88.2	Confident	163 Å²	163	65.1 Å²	65.1	85%	0.853	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-8.6	173.9	-56.8	176.1	0	0	0	112.9	D698	D698-L700 PolarHBondContact O-N 3Å; D698-L700 VanDerWaalsContact O-N 3.09Å; D698-L700 VanDerWaalsContact OD1-CB 3.3Å; D698-L700 WeakPolarHBondContact OD1-CB 3.21Å; D698-L700 PolarHBondContact OD1-N 3.04Å
701	K	86.5	Confident	88.5	Confident	136 Å²	136	63.6 Å²	63.6	59%	0.591	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.8	-23.2	-180	-58.7	-168.5	-173.6	78.9	0	113.9	E696 D698 P699	E696-K701 HydrophobicContact CG-CB 3.74Å; E696-K701 WeakPolarHBondContact OE2-CD 3.34Å; D698-K701 HydrophobicContact CB-CB 4.28Å; D698-K701 HydrophobicContact CB-CG 4.26Å; D698-K701 PolarHBondContact O-N 3.5Å; D698-K701 IonicContact OD2-NZ 3.45Å; D698-K701 PolarHBondContact OD2-NZ 2.85Å; P699-K701 VanDerWaalsContact C-N 3.33Å
702	C	86.5	Confident	88.8	Confident	9 Å²	9	66.4 Å²	66.4	6%	0.061	39%	0.386	C	S	.	.	S	Bend	trans	-103	138.7	179.7	-174.2	0	0	0	0	111.8	E696 D698 L707 N710	E696-C702 HydrophobicContact CG-CB 4.41Å; E696-C702 WeakPolarHBondContact O-CB 3.26Å; D698-C702 PolarHBondContact O-N 3.04Å; C702-L707 HydrophobicContact CB-CD1 4.42Å; C702-N710 PolarHBondContact SG-ND2 3.26Å
703	P	86.6	Confident	89.4	Confident	68 Å²	68	62.2 Å²	62.2	44%	0.442	36%	0.357	S	S	.	.			trans	-58.2	136.7	164.7	-21.7	33.8	0	0	0	111.2	A705 E706 L707	P703-A705 PolarHBondContact O-N 3.05Å; P703-A705 VanDerWaalsContact O-N 3.08Å; P703-E706 HydrophobicContact CB-CB 4.49Å; P703-E706 HydrophobicContact CB-CG 4.4Å; P703-E706 PolarHBondContact O-N 2.85Å; P703-L707 PolarHBondContact O-N 3.07Å; P703-L707 VanDerWaalsContact O-N 3.14Å
704	A	83.5	Confident	90	Very high	92 Å²	92	56.9 Å²	56.9	76%	0.76	33%	0.332	S	S	*	.	H	α-helix	trans	-60.2	-23.4	-177.7	0	0	0	0	0	114.3
705	A	86.1	Confident	90.5	Very high	95 Å²	95	57.4 Å²	57.4	79%	0.785	33%	0.33	S	S	*	.	H	α-helix	trans	-77.9	-19.9	175.5	0	0	0	0	0	114	P703	P703-A705 PolarHBondContact O-N 3.05Å; P703-A705 VanDerWaalsContact O-N 3.08Å
706	E	88.8	Confident	90.8	Very high	97 Å²	97	62.1 Å²	62.1	45%	0.453	35%	0.352	S	S	.	.	H	α-helix	trans	-98.7	-20.8	178.4	-67.8	172.5	-167.9	0	0	111.7	P703 S708 S709 N710	P703-E706 HydrophobicContact CB-CB 4.49Å; P703-E706 HydrophobicContact CB-CG 4.4Å; P703-E706 PolarHBondContact O-N 2.85Å; E706-S708 PolarHBondContact O-N 3.49Å; E706-S709 WeakPolarHBondContact O-CB 3.48Å; E706-S709 PolarHBondContact O-N 3Å; E706-N710 PolarHBondContact O-N 2.9Å; E706-N710 PolarHBondContact O-OD1 3.41Å
707	L	90.9	Very high	90.9	Very high	32 Å²	32	62 Å²	62	17%	0.168	35%	0.353	C	S	.	.	H	α-helix	trans	-54.3	-48.8	-172	178.3	66.2	0	0	0	113.2	V697 P699 C702 P703 S709 N710 Q711	V697-L707 HydrophobicContact CB-CD1 4.43Å; V697-L707 WeakPolarHBondContact O-CD1 3.38Å; P699-L707 HydrophobicContact CB-CD2 4.43Å; P699-L707 HydrophobicContact CG-CD2 4.09Å; C702-L707 HydrophobicContact CB-CD1 4.42Å; P703-L707 PolarHBondContact O-N 3.07Å; P703-L707 VanDerWaalsContact O-N 3.14Å; L707-S709 VanDerWaalsContact C-N 3.3Å; L707-S709 PolarHBondContact O-N 3.04Å; L707-N710 PolarHBondContact O-N 3.5Å; L707-Q711 HydrophobicContact CD1-CG 4.33Å; L707-Q711 HydrophobicContact CG-CG 4.48Å; L707-Q711 WeakPolarHBondContact O-CB 3.39Å; L707-Q711 VanDerWaalsContact O-CG 3.24Å; L707-Q711 WeakPolarHBondContact O-CG 3.33Å; L707-Q711 PolarHBondContact O-N 2.89Å
708	S	90.8	Very high	91.1	Very high	80 Å²	80	62 Å²	62	56%	0.559	35%	0.353	S	S	*	.	H	α-helix	trans	-65.6	-32	179.4	52.2	0	0	0	0	113	E706 Q712	E706-S708 PolarHBondContact O-N 3.49Å; S708-Q712 PolarHBondContact O-N 3.36Å
709	S	92.1	Very high	91.3	Very high	55 Å²	55	64.4 Å²	64.4	39%	0.385	36%	0.363	S	S	.	.	H	α-helix	trans	-68.4	-45.7	173.4	-156.5	0	0	0	0	110.7	E706 L707 Q711 Q712 H713	E706-S709 WeakPolarHBondContact O-CB 3.48Å; E706-S709 PolarHBondContact O-N 3Å; L707-S709 VanDerWaalsContact C-N 3.3Å; L707-S709 PolarHBondContact O-N 3.04Å; S709-Q711 VanDerWaalsContact C-N 3.3Å; S709-Q711 PolarHBondContact O-N 3.07Å; S709-Q712 PolarHBondContact O-N 2.92Å; S709-H713 PolarHBondContact O-N 2.98Å; S709-H713 PolarHBondContact O-ND1 3.47Å; S709-H713 VanDerWaalsContact O-ND1 3.16Å; S709-H713 PolarHBondContact OG-CE1 2.9Å; S709-H713 PolarHBondContact OG-NE2 3.33Å
710	N	93	Very high	91.5	Very high	8 Å²	8	63.2 Å²	63.2	4%	0.043	35%	0.353	C	S	.	.	H	α-helix	trans	-66.1	-32.8	178.4	-64.1	-1	0	0	0	112.2	N694 E696 V697 C702 E706 L707 L714	N694-N710 PolarHBondContact ND2-ND2 3.1Å; N694-N710 VanDerWaalsContact O-CG 3.26Å; N694-N710 PolarHBondContact O-OD1 2.72Å; N694-N710 VanDerWaalsContact O-OD1 3.09Å; E696-N710 WeakPolarHBondContact O-CB 3.41Å; E696-N710 PolarHBondContact O-ND2 2.81Å; V697-N710 HydrophobicContact CG1-CB 4.17Å; C702-N710 PolarHBondContact SG-ND2 3.26Å; E706-N710 PolarHBondContact O-N 2.9Å; E706-N710 PolarHBondContact O-OD1 3.41Å; L707-N710 PolarHBondContact O-N 3.5Å; N710-L714 WeakPolarHBondContact O-CB 3.38Å; N710-L714 PolarHBondContact O-N 3.02Å
711	Q	94.4	Very high	91.8	Very high	51 Å²	51	55.4 Å²	55.4	24%	0.238	31%	0.312	C	S	.	.	H	α-helix	trans	-64.7	-44.3	171.6	-74.5	178.3	-33	0	0	111.5	V697 L707 S709 L714 R715 F819	V697-Q711 HydrophobicContact CB-CG 4.21Å; V697-Q711 HydrophobicContact CG1-CB 4.32Å; V697-Q711 HydrophobicContact CG1-CG 3.67Å; L707-Q711 HydrophobicContact CD1-CG 4.33Å; L707-Q711 HydrophobicContact CG-CG 4.48Å; L707-Q711 WeakPolarHBondContact O-CB 3.39Å; L707-Q711 VanDerWaalsContact O-CG 3.24Å; L707-Q711 WeakPolarHBondContact O-CG 3.33Å; L707-Q711 PolarHBondContact O-N 2.89Å; S709-Q711 VanDerWaalsContact C-N 3.3Å; S709-Q711 PolarHBondContact O-N 3.07Å; Q711-L714 PolarHBondContact O-N 2.71Å; Q711-R715 PolarHBondContact O-N 3Å; Q711-F819 HydrophobicContact CB-CD2 3.96Å; Q711-F819 HydrophobicContact CB-CE2 3.53Å; Q711-F819 HydrophobicContact CB-CZ 3.88Å; Q711-F819 HydrophobicContact CG-CD1 4.12Å; Q711-F819 HydrophobicContact CG-CD2 4.02Å; Q711-F819 HydrophobicContact CG-CE1 3.81Å; Q711-F819 HydrophobicContact CG-CE2 3.69Å; Q711-F819 HydrophobicContact CG-CG 4.23Å; Q711-F819 HydrophobicContact CG-CZ 3.58Å
712	Q	93.9	Very high	92.1	Very high	93 Å²	93	49 Å²	49	44%	0.435	28%	0.284	S	S	.	.	H	α-helix	trans	-64	-48.8	175.3	-176.7	62.5	20.3	0	0	111.6	S708 S709 L714 R715 E716	S708-Q712 PolarHBondContact O-N 3.36Å; S709-Q712 PolarHBondContact O-N 2.92Å; Q712-L714 VanDerWaalsContact C-N 3.26Å; Q712-L714 PolarHBondContact O-N 2.77Å; Q712-R715 PolarHBondContact O-N 2.88Å; Q712-E716 HydrophobicContact CG-CG 4.5Å; Q712-E716 WeakPolarHBondContact CG-OE1 3.23Å; Q712-E716 PolarHBondContact NE2-OE1 3.42Å; Q712-E716 WeakPolarHBondContact O-CG 3.38Å; Q712-E716 PolarHBondContact O-N 3.06Å
713	H	93.4	Very high	92.4	Very high	46 Å²	46	52 Å²	52	21%	0.213	30%	0.297	C	S	.	.	H	α-helix	trans	-57.8	-38.5	176.2	-57.7	145.7	0	0	0	112	N694 S709 T717	N694-H713 PolarHBondContact O-ND1 3.43Å; S709-H713 PolarHBondContact O-N 2.98Å; S709-H713 PolarHBondContact O-ND1 3.47Å; S709-H713 VanDerWaalsContact O-ND1 3.16Å; S709-H713 PolarHBondContact OG-CE1 2.9Å; S709-H713 PolarHBondContact OG-NE2 3.33Å; H713-T717 VanDerWaalsContact O-CB 3.23Å; H713-T717 WeakPolarHBondContact O-CB 3.44Å; H713-T717 PolarHBondContact O-N 2.88Å; H713-T717 PolarHBondContact O-OG1 3.4Å
714	L	95.3	Very high	92.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-68.8	-39	176.1	-176.7	60.8	0	0	0	111.9	C695 V697 N710 Q711 Q712 T717 C718 L796 M817 F819	C695-L714 HydrophobicContact CB-CB 4.21Å; C695-L714 HydrophobicContact CB-CD1 4.27Å; V697-L714 HydrophobicContact CG1-CB 4.5Å; V697-L714 HydrophobicContact CG1-CD2 4.22Å; V697-L714 HydrophobicContact CG2-CD2 3.89Å; N710-L714 WeakPolarHBondContact O-CB 3.38Å; N710-L714 PolarHBondContact O-N 3.02Å; Q711-L714 PolarHBondContact O-N 2.71Å; Q712-L714 VanDerWaalsContact C-N 3.26Å; Q712-L714 PolarHBondContact O-N 2.77Å; L714-T717 PolarHBondContact O-N 3.4Å; L714-C718 WeakPolarHBondContact O-CB 3.36Å; L714-C718 PolarHBondContact O-N 3.42Å; L714-C718 PolarHBondContact O-SG 3.21Å; L714-L796 HydrophobicContact CD1-CB 3.82Å; L714-L796 HydrophobicContact CD2-CB 4.03Å; L714-L796 HydrophobicContact CD2-CD1 4.32Å; L714-M817 HydrophobicContact CD2-CE 4.24Å; L714-F819 HydrophobicContact CD2-CZ 4.19Å
715	R	96.1	Very high	93.1	Very high	60 Å²	60	46.1 Å²	46.1	23%	0.226	25%	0.248	C	C	.	.	H	α-helix	trans	-63.2	-47.9	175.3	-168.8	173.5	-178	159.1	-0.4	110.8	Q711 Q712 T717 C718 E719 M820 E822 F823	Q711-R715 PolarHBondContact O-N 3Å; Q712-R715 PolarHBondContact O-N 2.88Å; R715-T717 PolarHBondContact O-N 3.25Å; R715-C718 PolarHBondContact O-N 2.55Å; R715-C718 VanDerWaalsContact O-N 3.16Å; R715-E719 PolarHBondContact O-N 3.16Å; R715-M820 HydrophobicContact CB-SD 4.24Å; R715-E822 IonicContact CZ-OE1 3.48Å; R715-E822 IonicContact NH1-OE1 2.68Å; R715-E822 PolarHBondContact NH1-OE1 3.26Å; R715-E822 VanDerWaalsContact NH1-OE1 3.14Å; R715-E822 IonicContact NH1-OE2 3.46Å; R715-E822 PolarHBondContact NH1-OE2 2.9Å; R715-E822 IonicContact NH2-OE1 2.65Å; R715-E822 PolarHBondContact NH2-OE1 3.19Å; R715-F823 HydrophobicContact CG-CD2 3.89Å
716	E	95.1	Very high	93.2	Very high	101 Å²	101	43.5 Å²	43.5	47%	0.472	22%	0.22	S	C	.	.	H	α-helix	trans	-61	-41.9	175.9	-69.7	168.1	175.8	0	0	112.4	Q712 C718 E719 D720	Q712-E716 HydrophobicContact CG-CG 4.5Å; Q712-E716 WeakPolarHBondContact CG-OE1 3.23Å; Q712-E716 PolarHBondContact NE2-OE1 3.42Å; Q712-E716 WeakPolarHBondContact O-CG 3.38Å; Q712-E716 PolarHBondContact O-N 3.06Å; E716-C718 VanDerWaalsContact C-N 3.31Å; E716-C718 PolarHBondContact O-N 3.47Å; E716-E719 PolarHBondContact O-N 2.95Å; E716-D720 PolarHBondContact O-N 2.98Å; E716-D720 VanDerWaalsContact O-N 3.12Å
717	T	95	Very high	93	Very high	19 Å²	19	44 Å²	44	12%	0.117	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-35.5	174.9	-61.5	0	0	0	0	112.2	F684 L688 H713 L714 R715 T793 T797	F684-T717 HydrophobicContact CE2-CG2 3.96Å; F684-T717 WeakPolarHBondContact CE2-O 3.24Å; F684-T717 HydrophobicContact CZ-CG2 3.76Å; L688-T717 HydrophobicContact CD1-CG2 4.15Å; L688-T717 HydrophobicContact CD2-CG2 3.93Å; H713-T717 VanDerWaalsContact O-CB 3.23Å; H713-T717 WeakPolarHBondContact O-CB 3.44Å; H713-T717 PolarHBondContact O-N 2.88Å; H713-T717 PolarHBondContact O-OG1 3.4Å; L714-T717 PolarHBondContact O-N 3.4Å; R715-T717 PolarHBondContact O-N 3.25Å; T717-T793 HydrophobicContact CG2-CG2 4.1Å; T717-T797 HydrophobicContact CG2-CG2 4.33Å
718	C	96.3	Very high	92.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-74.6	-35.3	175.5	-65.7	0	0	0	0	111.6	L714 R715 E716 V721 V722 V800 M820 F823	L714-C718 WeakPolarHBondContact O-CB 3.36Å; L714-C718 PolarHBondContact O-N 3.42Å; L714-C718 PolarHBondContact O-SG 3.21Å; R715-C718 PolarHBondContact O-N 2.55Å; R715-C718 VanDerWaalsContact O-N 3.16Å; E716-C718 VanDerWaalsContact C-N 3.31Å; E716-C718 PolarHBondContact O-N 3.47Å; C718-V721 WeakPolarHBondContact O-CG1 3.46Å; C718-V722 WeakPolarHBondContact O-CB 3.26Å; C718-V722 VanDerWaalsContact O-CG2 3.25Å; C718-V722 WeakPolarHBondContact O-CG2 3.34Å; C718-V722 PolarHBondContact O-N 3.46Å; C718-V800 HydrophobicContact CB-CG1 4.2Å; C718-M820 HydrophobicContact CB-CE 4.07Å; C718-F823 HydrophobicContact CB-CE1 3.93Å; C718-F823 HydrophobicContact CB-CE2 3.93Å; C718-F823 HydrophobicContact CB-CZ 3.43Å; C718-F823 VanDerWaalsContact CB-CZ 3.43Å
719	E	95.7	Very high	90.5	Very high	69 Å²	69	44.6 Å²	44.6	32%	0.322	22%	0.216	S	C	.	.	H	α-helix	trans	-62.6	-50.9	177.5	-161.7	72.4	-146.3	0	0	111.6	R715 E716 V721 V722 Q723 F823 H827	R715-E719 PolarHBondContact O-N 3.16Å; E716-E719 PolarHBondContact O-N 2.95Å; E719-V721 VanDerWaalsContact C-N 3.31Å; E719-V721 PolarHBondContact O-N 3.03Å; E719-V722 PolarHBondContact O-N 3.31Å; E719-Q723 WeakPolarHBondContact O-CB 3.36Å; E719-Q723 PolarHBondContact O-N 3.38Å; E719-F823 HydrophobicContact CB-CE2 4.32Å; E719-F823 WeakPolarHBondContact OE2-CE2 3.41Å; E719-H827 VanDerWaalsContact CD-NE2 3.31Å; E719-H827 IonicContact OE1-CE1 2.66Å; E719-H827 PolarHBondContact OE1-CE1 3.39Å; E719-H827 IonicContact OE1-NE2 2.9Å; E719-H827 PolarHBondContact OE1-NE2 2.96Å; E719-H827 IonicContact OE2-CE1 2.82Å; E719-H827 IonicContact OE2-NE2 3.85Å; E719-H827 PolarHBondContact OE2-NE2 3.17Å
720	D	93.3	Very high	89.2	Confident	53 Å²	53	42.7 Å²	42.7	28%	0.283	21%	0.205	S	C	.	.	H	α-helix	trans	-53.7	-44.6	178.2	-178.3	9.8	0	0	0	111.9	F684 R687 E716 K724	F684-D720 HydrophobicContact CD2-CB 4.35Å; F684-D720 WeakPolarHBondContact CD2-OD2 3.5Å; F684-D720 HydrophobicContact CE2-CB 4.34Å; R687-D720 IonicContact CZ-OD2 2.66Å; R687-D720 IonicContact NE-OD2 3.88Å; R687-D720 PolarHBondContact NE-OD2 3.03Å; R687-D720 IonicContact NH2-OD1 3.08Å; R687-D720 PolarHBondContact NH2-OD1 2.94Å; R687-D720 IonicContact NH2-OD2 2.66Å; R687-D720 PolarHBondContact NH2-OD2 3.32Å; E716-D720 PolarHBondContact O-N 2.98Å; E716-D720 VanDerWaalsContact O-N 3.12Å; D720-K724 WeakPolarHBondContact O-CB 3.23Å; D720-K724 VanDerWaalsContact O-CG 3.26Å; D720-K724 WeakPolarHBondContact O-CG 3.22Å; D720-K724 PolarHBondContact O-N 2.97Å; D720-K724 WeakPolarHBondContact OD1-CE 3.27Å
721	V	93.9	Very high	88.7	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-81.1	-29.5	-179.9	74.1	0	0	0	0	113.9	L681 F684 C718 E719 I725 I773 T797 I801	L681-V721 HydrophobicContact CD2-CG2 3.52Å; F684-V721 HydrophobicContact CD1-CB 4.18Å; F684-V721 HydrophobicContact CD1-CG2 3.98Å; F684-V721 HydrophobicContact CD2-CB 4.17Å; F684-V721 HydrophobicContact CE1-CB 3.86Å; F684-V721 HydrophobicContact CE1-CG1 4.36Å; F684-V721 HydrophobicContact CE1-CG2 3.87Å; F684-V721 HydrophobicContact CE2-CB 3.84Å; F684-V721 HydrophobicContact CE2-CG1 4.42Å; F684-V721 HydrophobicContact CG-CB 4.32Å; F684-V721 HydrophobicContact CG-CG2 4.41Å; F684-V721 HydrophobicContact CZ-CB 3.67Å; F684-V721 HydrophobicContact CZ-CG1 3.98Å; F684-V721 HydrophobicContact CZ-CG2 4.22Å; C718-V721 WeakPolarHBondContact O-CG1 3.46Å; E719-V721 VanDerWaalsContact C-N 3.31Å; E719-V721 PolarHBondContact O-N 3.03Å; V721-I725 HydrophobicContact CG2-CD1 4.13Å; V721-I725 WeakPolarHBondContact O-CD1 3.25Å; V721-I725 VanDerWaalsContact O-CG1 3.25Å; V721-I725 WeakPolarHBondContact O-CG1 3.28Å; V721-I725 PolarHBondContact O-N 2.92Å; V721-I773 HydrophobicContact CG2-CD1 4.13Å; V721-T797 HydrophobicContact CG1-CG2 3.74Å; V721-I801 HydrophobicContact CG1-CD1 3.71Å; V721-I801 HydrophobicContact CG1-CG1 3.99Å
722	V	94.6	Very high	88.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.7	-49.5	171.7	165.9	0	0	0	0	110	C718 E719 K724 I725 I726 I801 L804 F823 H827	C718-V722 WeakPolarHBondContact O-CB 3.26Å; C718-V722 VanDerWaalsContact O-CG2 3.25Å; C718-V722 WeakPolarHBondContact O-CG2 3.34Å; C718-V722 PolarHBondContact O-N 3.46Å; E719-V722 PolarHBondContact O-N 3.31Å; V722-K724 VanDerWaalsContact C-N 3.33Å; V722-K724 PolarHBondContact O-N 3.31Å; V722-I725 PolarHBondContact O-N 3.19Å; V722-I725 VanDerWaalsContact O-N 3.1Å; V722-I726 HydrophobicContact CG1-CD1 3.49Å; V722-I726 VanDerWaalsContact CG1-CD1 3.49Å; V722-I726 HydrophobicContact CG1-CG1 4.22Å; V722-I726 WeakPolarHBondContact O-CG1 3.14Å; V722-I726 PolarHBondContact O-N 2.78Å; V722-I801 HydrophobicContact CG2-CD1 3.32Å; V722-L804 HydrophobicContact CG1-CD2 4.19Å; V722-L804 HydrophobicContact CG2-CD2 3.6Å; V722-F823 HydrophobicContact CB-CZ 4.41Å; V722-F823 HydrophobicContact CG2-CE1 4.19Å; V722-F823 HydrophobicContact CG2-CZ 3.74Å; V722-H827 HydrophobicContact CG1-CB 4.31Å
723	Q	93.1	Very high	88.3	Confident	73 Å²	73	36.9 Å²	36.9	34%	0.341	18%	0.181	S	C	.	.	H	α-helix	trans	-59.6	-45.4	-178.6	-161.8	67	9	0	0	110.7	E719 I725 I726 E727	E719-Q723 WeakPolarHBondContact O-CB 3.36Å; E719-Q723 PolarHBondContact O-N 3.38Å; Q723-I725 VanDerWaalsContact C-N 3.28Å; Q723-I725 PolarHBondContact O-N 3.49Å; Q723-I726 PolarHBondContact O-N 3.42Å; Q723-E727 HydrophobicContact CG-CG 4.08Å; Q723-E727 VanDerWaalsContact NE2-CD 3.26Å; Q723-E727 PolarHBondContact NE2-OE1 3.4Å; Q723-E727 WeakPolarHBondContact O-CB 3.37Å; Q723-E727 WeakPolarHBondContact O-CG 3.47Å; Q723-E727 PolarHBondContact O-N 3.03Å
724	K	91.1	Very high	88.1	Confident	37 Å²	37	37.4 Å²	37.4	16%	0.161	18%	0.183	C	C	.	.	H	α-helix	trans	-60.4	-31.3	176.1	-78.5	-174.9	169.6	-57.7	0	115.2	T680 D720 V722 H729	T680-K724 HydrophobicContact CG2-CB 4.39Å; D720-K724 WeakPolarHBondContact O-CB 3.23Å; D720-K724 VanDerWaalsContact O-CG 3.26Å; D720-K724 WeakPolarHBondContact O-CG 3.22Å; D720-K724 PolarHBondContact O-N 2.97Å; D720-K724 WeakPolarHBondContact OD1-CE 3.27Å; V722-K724 VanDerWaalsContact C-N 3.33Å; V722-K724 PolarHBondContact O-N 3.31Å; K724-H729 HydrophobicContact CB-CB 4.45Å; K724-H729 HydrophobicContact CG-CB 4.46Å; K724-H729 WeakPolarHBondContact O-CB 3.31Å; K724-H729 PolarHBondContact O-N 2.89Å
725	I	92.3	Very high	87.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-78.9	-47.8	176.2	-68.4	166.8	0	0	0	109.9	T680 V721 V722 Q723 I728 F765 L769 I801 F834	T680-I725 HydrophobicContact CG2-CG1 4.03Å; V721-I725 HydrophobicContact CG2-CD1 4.13Å; V721-I725 WeakPolarHBondContact O-CD1 3.25Å; V721-I725 VanDerWaalsContact O-CG1 3.25Å; V721-I725 WeakPolarHBondContact O-CG1 3.28Å; V721-I725 PolarHBondContact O-N 2.92Å; V722-I725 PolarHBondContact O-N 3.19Å; V722-I725 VanDerWaalsContact O-N 3.1Å; Q723-I725 VanDerWaalsContact C-N 3.28Å; Q723-I725 PolarHBondContact O-N 3.49Å; I725-I728 PolarHBondContact O-N 3.25Å; I725-F765 HydrophobicContact CD1-CE1 4.25Å; I725-F765 HydrophobicContact CG2-CE1 4.09Å; I725-F765 HydrophobicContact CG2-CZ 3.89Å; I725-L769 HydrophobicContact CD1-CD1 4.22Å; I725-L769 HydrophobicContact CG1-CD1 4.48Å; I725-L769 HydrophobicContact CG2-CD1 4.38Å; I725-I801 HydrophobicContact CD1-CG2 4.41Å; I725-F834 HydrophobicContact CG2-CD1 4.12Å; I725-F834 HydrophobicContact CG2-CD2 4.45Å; I725-F834 HydrophobicContact CG2-CE1 3.7Å; I725-F834 HydrophobicContact CG2-CE2 4.06Å; I725-F834 HydrophobicContact CG2-CG 4.49Å; I725-F834 HydrophobicContact CG2-CZ 3.66Å; I725-F834 WeakPolarHBondContact O-CD2 3.46Å; I725-F834 WeakPolarHBondContact O-CE2 3.24Å
726	I	89.3	Confident	87.8	Confident	39 Å²	39	35 Å²	35	20%	0.2	18%	0.175	C	C	.	.	H	α-helix	trans	-71	-38.5	-174.4	-66.3	177.7	0	0	0	112.5	V722 Q723 I728 F834	V722-I726 HydrophobicContact CG1-CD1 3.49Å; V722-I726 VanDerWaalsContact CG1-CD1 3.49Å; V722-I726 HydrophobicContact CG1-CG1 4.22Å; V722-I726 WeakPolarHBondContact O-CG1 3.14Å; V722-I726 PolarHBondContact O-N 2.78Å; Q723-I726 PolarHBondContact O-N 3.42Å; I726-I728 PolarHBondContact O-N 2.62Å; I726-F834 HydrophobicContact CG1-CB 4.3Å
727	E	83	Confident	87.7	Confident	107 Å²	107	30.5 Å²	30.5	50%	0.5	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-4.3	176.5	-68.2	-177.6	152.2	0	0	113.6	Q723 H729	Q723-E727 HydrophobicContact CG-CG 4.08Å; Q723-E727 VanDerWaalsContact NE2-CD 3.26Å; Q723-E727 PolarHBondContact NE2-OE1 3.4Å; Q723-E727 WeakPolarHBondContact O-CB 3.37Å; Q723-E727 WeakPolarHBondContact O-CG 3.47Å; Q723-E727 PolarHBondContact O-N 3.03Å; E727-H729 IonicContact OE2-CD2 3.91Å
728	I	71.9	Confident	87.5	Confident	25 Å²	25	33.2 Å²	33.2	13%	0.128	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	58.6	-176.5	-42.6	-172	0	0	0	110.6	I725 I726 G730 F732 F834 T837 V838 I845	I725-I728 PolarHBondContact O-N 3.25Å; I726-I728 PolarHBondContact O-N 2.62Å; I728-G730 PolarHBondContact O-N 3.45Å; I728-F732 HydrophobicContact CG2-CB 4.41Å; I728-F834 HydrophobicContact CD1-CD2 4.22Å; I728-F834 HydrophobicContact CD1-CE2 4.34Å; I728-F834 HydrophobicContact CG1-CD2 3.95Å; I728-F834 HydrophobicContact CG1-CE2 4.02Å; I728-T837 HydrophobicContact CD1-CG2 3.48Å; I728-T837 VanDerWaalsContact CD1-CG2 3.48Å; I728-V838 HydrophobicContact CD1-CG1 4.2Å; I728-I845 HydrophobicContact CD1-CD1 4.35Å; I728-I845 HydrophobicContact CD1-CG1 4.5Å; I728-I845 HydrophobicContact CD1-CG2 4.21Å; I728-I845 HydrophobicContact CG2-CG2 3.93Å
729	H	59.1	Low	87.5	Confident	100 Å²	100	33.2 Å²	33.2	46%	0.463	16%	0.164	S	C	.	.			trans	-71.8	10.5	-164.6	-143.3	-50	0	0	0	115	K724 E727	K724-H729 HydrophobicContact CB-CB 4.45Å; K724-H729 HydrophobicContact CG-CB 4.46Å; K724-H729 WeakPolarHBondContact O-CB 3.31Å; K724-H729 PolarHBondContact O-N 2.89Å; E727-H729 IonicContact OE2-CD2 3.91Å
730	G	63.8	Low	87.4	Confident	16 Å²	16	29.9 Å²	29.9	17%	0.165	15%	0.149	C	C	.	.	S	Bend	trans	-167.7	158.4	175.6	0	0	0	0	0	110.2	I728 F732	I728-G730 PolarHBondContact O-N 3.45Å; G730-F732 PolarHBondContact O-N 3.45Å
731	S	82.1	Confident	87.4	Confident	29 Å²	29	27.8 Å²	27.8	20%	0.203	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-59.5	133.7	-168	-54	0	0	0	0	114.1	Y676 P846	Y676-S731 WeakPolarHBondContact CB-O 3.3Å; Y676-S731 WeakPolarHBondContact CD2-O 3.24Å; S731-P846 CarbonylContact C-O 3.33Å; S731-P846 WeakPolarHBondContact CA-O 3.34Å; S731-P846 WeakPolarHBondContact CB-O 3.37Å
732	F	89.7	Confident	87.4	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	146.8	179.7	-166.1	-100	0	0	0	111.4	Y676 I728 G730 E734 L736 N737 F740 L764 V838 I845 P846 M847 T848	Y676-F732 HydrophobicContact CD1-CD2 4.4Å; Y676-F732 HydrophobicContact CD2-CD2 4.12Å; Y676-F732 HydrophobicContact CE1-CD2 4.15Å; Y676-F732 HydrophobicContact CE1-CE2 4.12Å; Y676-F732 AromaticContact CE2-CD2 3.86Å; Y676-F732 HydrophobicContact CE2-CD2 3.86Å; Y676-F732 HydrophobicContact CG-CD2 4.39Å; Y676-F732 AromaticContact CZ-CD2 3.89Å; I728-F732 HydrophobicContact CG2-CB 4.41Å; G730-F732 PolarHBondContact O-N 3.45Å; F732-E734 PolarHBondContact O-N 3.21Å; F732-L736 HydrophobicContact CE1-CB 4Å; F732-L736 HydrophobicContact CZ-CB 4.19Å; F732-N737 HydrophobicContact CD1-CB 4.05Å; F732-N737 HydrophobicContact CE1-CB 3.99Å; F732-F740 HydrophobicContact CZ-CD2 4.31Å; F732-F740 HydrophobicContact CZ-CE2 4.04Å; F732-L764 HydrophobicContact CE2-CD1 4.46Å; F732-L764 HydrophobicContact CE2-CD2 4.45Å; F732-V838 HydrophobicContact CD1-CB 4.42Å; F732-V838 HydrophobicContact CD2-CG1 4.01Å; F732-V838 HydrophobicContact CE1-CB 3.96Å; F732-V838 HydrophobicContact CE1-CG1 4.43Å; F732-V838 HydrophobicContact CE2-CB 4.09Å; F732-V838 HydrophobicContact CE2-CG1 3.9Å; F732-V838 HydrophobicContact CG-CG1 4.33Å; F732-V838 HydrophobicContact CZ-CB 3.79Å; F732-V838 HydrophobicContact CZ-CG1 4.13Å; F732-V838 HydrophobicContact CZ-CG2 4.39Å; F732-I845 HydrophobicContact CB-CG2 4.18Å; F732-P846 PolarHBondContact N-O 3.01Å; F732-M847 HydrophobicContact CB-SD 3.92Å; F732-M847 HydrophobicContact CD1-CE 4.29Å; F732-M847 HydrophobicContact CD1-SD 4.41Å; F732-M847 WeakPolarHBondContact O-CA 3.33Å; F732-T848 PolarHBondContact O-N 3.2Å
733	P	90.7	Very high	87.3	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	123.9	-178.2	-19.4	34.3	0	0	0	112.3	V672 E735 L736 N737 T848	V672-P733 HydrophobicContact CG2-CB 4Å; P733-E735 VanDerWaalsContact C-N 3.27Å; P733-E735 PolarHBondContact O-N 3.43Å; P733-L736 HydrophobicContact CB-CB 4.29Å; P733-L736 HydrophobicContact CB-CD1 4.11Å; P733-L736 HydrophobicContact CB-CG 4.01Å; P733-L736 HydrophobicContact CG-CD1 3.93Å; P733-L736 HydrophobicContact CG-CG 4.39Å; P733-L736 PolarHBondContact O-N 3.42Å; P733-L736 VanDerWaalsContact O-N 3.13Å; P733-N737 PolarHBondContact O-N 3.5Å; P733-T848 WeakPolarHBondContact CA-O 3.39Å
734	E	89.5	Confident	87.2	Confident	56 Å²	56	27.8 Å²	27.8	26%	0.262	14%	0.14	S	C	.	.	H	α-helix	trans	-59.5	-38.6	-176.9	-163.7	-153.6	136.2	0	0	112.1	F732 L736 K738 T848	F732-E734 PolarHBondContact O-N 3.21Å; E734-L736 VanDerWaalsContact C-N 3.35Å; E734-L736 PolarHBondContact O-N 3.26Å; E734-K738 HydrophobicContact CG-CD 4.42Å; E734-K738 WeakPolarHBondContact O-CG 3.27Å; E734-K738 PolarHBondContact O-N 3.28Å; E734-K738 VanDerWaalsContact O-N 3.14Å; E734-K738 WeakPolarHBondContact OE1-CE 3.39Å; E734-K738 IonicContact OE1-NZ 3.14Å; E734-K738 PolarHBondContact OE1-NZ 3.06Å; E734-T848 PolarHBondContact N-O 3.25Å
735	E	91.1	Very high	87.3	Confident	10 Å²	10	31 Å²	31	5%	0.047	16%	0.155	C	C	.	.	H	α-helix	trans	-67.5	-33.6	179.5	-60.7	80.8	-177.2	0	0	112.9	K633 Y668 V672 P733 I739 F850	K633-E735 HydrophobicContact CD-CB 4Å; K633-E735 HydrophobicContact CD-CG 3.9Å; K633-E735 HydrophobicContact CG-CB 4.24Å; K633-E735 HydrophobicContact CG-CG 4.41Å; Y668-E735 HydrophobicContact CE1-CB 3.85Å; Y668-E735 WeakPolarHBondContact OH-CB 3.35Å; V672-E735 HydrophobicContact CG2-CB 4.49Å; P733-E735 VanDerWaalsContact C-N 3.27Å; P733-E735 PolarHBondContact O-N 3.43Å; E735-I739 WeakPolarHBondContact O-CD1 3.42Å; E735-I739 VanDerWaalsContact O-CG1 3.26Å; E735-I739 WeakPolarHBondContact O-CG1 3.36Å; E735-I739 PolarHBondContact O-N 2.85Å; E735-F850 PolarHBondContact OE1-N 2.94Å; E735-F850 PolarHBondContact OE2-N 2.89Å
736	L	93.4	Very high	87.1	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-73.9	-42.4	178.1	-64.3	-176	0	0	0	111.4	I665 Y668 M669 V672 F732 P733 E734 K738 I739 F740	I665-L736 HydrophobicContact CD1-CD2 4.43Å; Y668-L736 HydrophobicContact CD1-CD2 3.86Å; Y668-L736 HydrophobicContact CE1-CD2 4.33Å; M669-L736 HydrophobicContact CB-CD1 4.48Å; M669-L736 HydrophobicContact CG-CD1 4.04Å; M669-L736 HydrophobicContact CG-CD2 3.85Å; V672-L736 HydrophobicContact CG2-CD1 4.11Å; V672-L736 HydrophobicContact CG2-CD2 3.81Å; V672-L736 HydrophobicContact CG2-CG 3.63Å; F732-L736 HydrophobicContact CE1-CB 4Å; F732-L736 HydrophobicContact CZ-CB 4.19Å; P733-L736 HydrophobicContact CB-CB 4.29Å; P733-L736 HydrophobicContact CB-CD1 4.11Å; P733-L736 HydrophobicContact CB-CG 4.01Å; P733-L736 HydrophobicContact CG-CD1 3.93Å; P733-L736 HydrophobicContact CG-CG 4.39Å; P733-L736 PolarHBondContact O-N 3.42Å; P733-L736 VanDerWaalsContact O-N 3.13Å; E734-L736 VanDerWaalsContact C-N 3.35Å; E734-L736 PolarHBondContact O-N 3.26Å; L736-K738 VanDerWaalsContact C-N 3.31Å; L736-K738 PolarHBondContact O-N 3.05Å; L736-I739 PolarHBondContact O-N 3.18Å; L736-F740 HydrophobicContact CB-CE2 4.3Å; L736-F740 HydrophobicContact CB-CZ 4.37Å; L736-F740 WeakPolarHBondContact O-CB 3.12Å; L736-F740 WeakPolarHBondContact O-CD1 3.35Å; L736-F740 WeakPolarHBondContact O-CG 3.13Å; L736-F740 PolarHBondContact O-N 2.87Å
737	N	93	Very high	87.1	Confident	7 Å²	7	31.7 Å²	31.7	4%	0.037	16%	0.159	C	C	.	.	H	α-helix	trans	-59	-43.5	175.7	168.3	-92.5	0	0	0	111.5	F732 P733 I739 F740 S741 V838 N840 M847	F732-N737 HydrophobicContact CD1-CB 4.05Å; F732-N737 HydrophobicContact CE1-CB 3.99Å; P733-N737 PolarHBondContact O-N 3.5Å; N737-I739 PolarHBondContact O-N 3.07Å; N737-F740 PolarHBondContact O-N 3.16Å; N737-S741 WeakPolarHBondContact O-CB 3.47Å; N737-S741 PolarHBondContact O-N 3.42Å; N737-S741 PolarHBondContact O-OG 2.87Å; N737-V838 PolarHBondContact ND2-O 3.19Å; N737-N840 PolarHBondContact ND2-O 3.23Å; N737-M847 HydrophobicContact CB-CE 3.3Å
738	K	91.7	Very high	87.5	Confident	75 Å²	75	31.9 Å²	31.9	33%	0.326	16%	0.16	S	C	.	.	H	α-helix	trans	-64.5	-41.5	178.8	-73.7	178.8	173.5	177.8	0	112.2	E734 L736 N742	E734-K738 HydrophobicContact CG-CD 4.42Å; E734-K738 WeakPolarHBondContact O-CG 3.27Å; E734-K738 PolarHBondContact O-N 3.28Å; E734-K738 VanDerWaalsContact O-N 3.14Å; E734-K738 WeakPolarHBondContact OE1-CE 3.39Å; E734-K738 IonicContact OE1-NZ 3.14Å; E734-K738 PolarHBondContact OE1-NZ 3.06Å; L736-K738 VanDerWaalsContact C-N 3.31Å; L736-K738 PolarHBondContact O-N 3.05Å; K738-N742 WeakPolarHBondContact O-CB 3.39Å; K738-N742 PolarHBondContact O-N 2.83Å; K738-N742 VanDerWaalsContact O-N 3.09Å; K738-N742 PolarHBondContact O-ND2 2.91Å
739	I	94.4	Very high	88.3	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-64.4	-46.4	173.6	-67.2	164.2	0	0	0	111.1	K633 L636 I637 Y668 E735 L736 N737 S741 N742 W743	K633-I739 HydrophobicContact CB-CG1 4.48Å; K633-I739 HydrophobicContact CG-CD1 4.33Å; K633-I739 HydrophobicContact CG-CG1 4.39Å; L636-I739 HydrophobicContact CB-CD1 3.93Å; L636-I739 HydrophobicContact CB-CG1 4.44Å; L636-I739 HydrophobicContact CB-CG2 4.4Å; L636-I739 HydrophobicContact CD1-CD1 3.63Å; L636-I739 HydrophobicContact CG-CD1 4.43Å; I637-I739 HydrophobicContact CG1-CG1 4.36Å; Y668-I739 HydrophobicContact CD1-CD1 3.82Å; Y668-I739 HydrophobicContact CE1-CD1 3.51Å; E735-I739 WeakPolarHBondContact O-CD1 3.42Å; E735-I739 VanDerWaalsContact O-CG1 3.26Å; E735-I739 WeakPolarHBondContact O-CG1 3.36Å; E735-I739 PolarHBondContact O-N 2.85Å; L736-I739 PolarHBondContact O-N 3.18Å; N737-I739 PolarHBondContact O-N 3.07Å; I739-S741 PolarHBondContact O-N 3.03Å; I739-N742 PolarHBondContact O-N 3.38Å; I739-W743 HydrophobicContact CG2-CD2 3.71Å; I739-W743 HydrophobicContact CG2-CE3 3.81Å; I739-W743 HydrophobicContact CG2-CG 4.48Å; I739-W743 HydrophobicContact CG2-CH2 3.74Å; I739-W743 HydrophobicContact CG2-CZ2 3.6Å; I739-W743 HydrophobicContact CG2-CZ3 3.84Å; I739-W743 WeakPolarHBondContact O-CB 3.38Å; I739-W743 PolarHBondContact O-N 2.95Å
740	F	94.2	Very high	89.6	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.8	-38.5	-178.6	-66.8	-8.9	0	0	0	112.2	M669 F732 L736 N737 W743 M744 I760 L764	M669-F740 HydrophobicContact SD-CZ 4.44Å; F732-F740 HydrophobicContact CZ-CD2 4.31Å; F732-F740 HydrophobicContact CZ-CE2 4.04Å; L736-F740 HydrophobicContact CB-CE2 4.3Å; L736-F740 HydrophobicContact CB-CZ 4.37Å; L736-F740 WeakPolarHBondContact O-CB 3.12Å; L736-F740 WeakPolarHBondContact O-CD1 3.35Å; L736-F740 WeakPolarHBondContact O-CG 3.13Å; L736-F740 PolarHBondContact O-N 2.87Å; N737-F740 PolarHBondContact O-N 3.16Å; F740-W743 AromaticContact CD1-CE3 3.76Å; F740-W743 HydrophobicContact CD1-CE3 3.76Å; F740-W743 AromaticContact CD1-CZ3 3.84Å; F740-W743 HydrophobicContact CD1-CZ3 3.84Å; F740-W743 HydrophobicContact CE1-CE3 4.24Å; F740-W743 AromaticContact CE1-CZ3 3.84Å; F740-W743 HydrophobicContact CE1-CZ3 3.84Å; F740-W743 PolarHBondContact O-N 3.27Å; F740-M744 PolarHBondContact O-N 2.98Å; F740-I760 HydrophobicContact CB-CD1 4.02Å; F740-I760 HydrophobicContact CB-CG1 3.94Å; F740-I760 HydrophobicContact CB-CG2 4.48Å; F740-I760 HydrophobicContact CD1-CG1 4.19Å; F740-I760 HydrophobicContact CD2-CG2 3.74Å; F740-I760 HydrophobicContact CE2-CG2 4.03Å; F740-I760 HydrophobicContact CG-CG1 3.99Å; F740-I760 HydrophobicContact CG-CG2 4.03Å; F740-L764 HydrophobicContact CE2-CB 4.41Å; F740-L764 HydrophobicContact CE2-CD2 4.5Å
741	S	93.3	Very high	90.6	Very high	8 Å²	8	38.9 Å²	38.9	6%	0.056	21%	0.211	C	C	.	.	H	α-helix	trans	-65.7	-45.9	175.2	-52	0	0	0	0	111.6	N737 I739 W743 M744 E745 S839 N840 Q841	N737-S741 WeakPolarHBondContact O-CB 3.47Å; N737-S741 PolarHBondContact O-N 3.42Å; N737-S741 PolarHBondContact O-OG 2.87Å; I739-S741 PolarHBondContact O-N 3.03Å; S741-W743 VanDerWaalsContact C-N 3.28Å; S741-W743 PolarHBondContact O-N 3.42Å; S741-M744 WeakPolarHBondContact O-CB 3.31Å; S741-M744 PolarHBondContact O-N 3.48Å; S741-M744 VanDerWaalsContact O-N 3.09Å; S741-E745 WeakPolarHBondContact O-CB 3.42Å; S741-E745 PolarHBondContact O-N 3.24Å; S741-S839 WeakPolarHBondContact CA-O 3.1Å; S741-S839 PolarHBondContact OG-O 3.28Å; S741-N840 PolarHBondContact OG-N 3.29Å; S741-Q841 WeakPolarHBondContact OG-CG 3.34Å
742	N	93.6	Very high	90.7	Very high	45 Å²	45	40.7 Å²	40.7	24%	0.241	22%	0.216	C	C	.	.	H	α-helix	trans	-60.5	-38	174.2	-84.5	-111.6	0	0	0	111.3	I637 K738 I739 L746	I637-N742 HydrophobicContact CD1-CB 3.82Å; I637-N742 HydrophobicContact CG1-CB 3.92Å; I637-N742 HydrophobicContact CG2-CB 4.3Å; K738-N742 WeakPolarHBondContact O-CB 3.39Å; K738-N742 PolarHBondContact O-N 2.83Å; K738-N742 VanDerWaalsContact O-N 3.09Å; K738-N742 PolarHBondContact O-ND2 2.91Å; I739-N742 PolarHBondContact O-N 3.38Å; N742-L746 VanDerWaalsContact O-CB 3.25Å; N742-L746 WeakPolarHBondContact O-CB 3.13Å; N742-L746 WeakPolarHBondContact O-CD1 3.2Å; N742-L746 WeakPolarHBondContact O-CG 3.3Å; N742-L746 PolarHBondContact O-N 2.71Å
743	W	92.4	Very high	90.5	Very high	5 Å²	5	42.6 Å²	42.6	2%	0.019	23%	0.231	C	C	.	.	H	α-helix	trans	-70.8	-27.1	174.9	-72	-17.1	0	0	0	114	L636 F655 I665 I739 F740 S741 C747 L759	L636-W743 VanDerWaalsContact O-CZ2 3.28Å; L636-W743 WeakPolarHBondContact O-CZ2 3.19Å; L636-W743 PolarHBondContact O-NE1 3.42Å; F655-W743 AromaticContact CE1-CH2 3.72Å; F655-W743 HydrophobicContact CE1-CH2 3.72Å; F655-W743 HydrophobicContact CE1-CZ2 4.33Å; F655-W743 HydrophobicContact CE1-CZ3 4.12Å; F655-W743 AromaticContact CZ-CH2 3.88Å; F655-W743 HydrophobicContact CZ-CH2 3.88Å; F655-W743 HydrophobicContact CZ-CZ2 4.02Å; F655-W743 HydrophobicContact CZ-CZ3 4.42Å; I665-W743 HydrophobicContact CB-CH2 4.29Å; I665-W743 HydrophobicContact CD1-CH2 3.77Å; I665-W743 HydrophobicContact CD1-CZ3 4.26Å; I665-W743 HydrophobicContact CG1-CH2 3.84Å; I665-W743 HydrophobicContact CG1-CZ3 4.26Å; I739-W743 HydrophobicContact CG2-CD2 3.71Å; I739-W743 HydrophobicContact CG2-CE3 3.81Å; I739-W743 HydrophobicContact CG2-CG 4.48Å; I739-W743 HydrophobicContact CG2-CH2 3.74Å; I739-W743 HydrophobicContact CG2-CZ2 3.6Å; I739-W743 HydrophobicContact CG2-CZ3 3.84Å; I739-W743 WeakPolarHBondContact O-CB 3.38Å; I739-W743 PolarHBondContact O-N 2.95Å; F740-W743 AromaticContact CD1-CE3 3.76Å; F740-W743 HydrophobicContact CD1-CE3 3.76Å; F740-W743 AromaticContact CD1-CZ3 3.84Å; F740-W743 HydrophobicContact CD1-CZ3 3.84Å; F740-W743 HydrophobicContact CE1-CE3 4.24Å; F740-W743 AromaticContact CE1-CZ3 3.84Å; F740-W743 HydrophobicContact CE1-CZ3 3.84Å; F740-W743 PolarHBondContact O-N 3.27Å; S741-W743 VanDerWaalsContact C-N 3.28Å; S741-W743 PolarHBondContact O-N 3.42Å; W743-C747 WeakPolarHBondContact O-CB 3.33Å; W743-C747 PolarHBondContact O-N 2.85Å; W743-C747 PolarHBondContact O-SG 3.4Å; W743-L759 HydrophobicContact CD2-CD2 3.8Å; W743-L759 HydrophobicContact CE3-CD2 3.22Å; W743-L759 HydrophobicContact CG-CD2 4.48Å; W743-L759 HydrophobicContact CH2-CD2 4.17Å; W743-L759 HydrophobicContact CZ3-CD2 3.43Å; W743-L759 VanDerWaalsContact CZ3-CD2 3.43Å
744	M	92.4	Very high	90.2	Very high	24 Å²	24	49.1 Å²	49.1	12%	0.118	26%	0.261	C	S	.	.	H	α-helix	trans	-68.9	-55.1	168.5	-78.9	-57.5	-59	0	0	110.4	F740 S741 L746 C747 E748 G756 Q757 I760	F740-M744 PolarHBondContact O-N 2.98Å; S741-M744 WeakPolarHBondContact O-CB 3.31Å; S741-M744 PolarHBondContact O-N 3.48Å; S741-M744 VanDerWaalsContact O-N 3.09Å; M744-L746 PolarHBondContact O-N 2.91Å; M744-C747 CarbonylContact O-C 3.57Å; M744-C747 WeakPolarHBondContact O-CA 3.43Å; M744-C747 WeakPolarHBondContact O-CB 3.11Å; M744-C747 PolarHBondContact O-N 3Å; M744-E748 HydrophobicContact CE-CG 4.37Å; M744-E748 WeakPolarHBondContact CE-OE1 3.49Å; M744-E748 WeakPolarHBondContact O-CG 3.41Å; M744-E748 PolarHBondContact O-N 3.28Å; M744-G756 VanDerWaalsContact SD-C 3.51Å; M744-Q757 HydrophobicContact SD-CB 4.38Å; M744-Q757 PolarHBondContact SD-N 2.75Å; M744-Q757 VanDerWaalsContact SD-N 3.39Å; M744-I760 HydrophobicContact CG-CD1 3.6Å; M744-I760 HydrophobicContact SD-CD1 3.73Å
745	E	91.8	Very high	90	Very high	103 Å²	103	46.7 Å²	46.7	48%	0.481	25%	0.25	S	S	.	.	H	α-helix	trans	-53.3	-51.8	-179.6	-172	175.4	-169	0	0	111.5	S741 C747 E748 D749	S741-E745 WeakPolarHBondContact O-CB 3.42Å; S741-E745 PolarHBondContact O-N 3.24Å; E745-C747 PolarHBondContact O-N 2.93Å; E745-C747 VanDerWaalsContact O-N 3.14Å; E745-E748 PolarHBondContact O-N 2.88Å; E745-D749 PolarHBondContact O-N 3.02Å
746	L	89.6	Confident	89.9	Confident	52 Å²	52	46.2 Å²	46.2	27%	0.272	25%	0.248	S	C	.	.	H	α-helix	trans	-62.8	-19.5	175.5	-71.3	169.3	0	0	0	114.5	I637 D641 N742 M744 K750	I637-L746 HydrophobicContact CG2-CD1 3.82Å; D641-L746 HydrophobicContact CB-CD1 4.5Å; N742-L746 VanDerWaalsContact O-CB 3.25Å; N742-L746 WeakPolarHBondContact O-CB 3.13Å; N742-L746 WeakPolarHBondContact O-CD1 3.2Å; N742-L746 WeakPolarHBondContact O-CG 3.3Å; N742-L746 PolarHBondContact O-N 2.71Å; M744-L746 PolarHBondContact O-N 2.91Å; L746-K750 WeakPolarHBondContact O-CD 3.48Å; L746-K750 VanDerWaalsContact O-CE 3.29Å; L746-K750 WeakPolarHBondContact O-CE 3.33Å; L746-K750 VanDerWaalsContact O-CG 3.28Å; L746-K750 WeakPolarHBondContact O-CG 3.43Å
747	C	89.3	Confident	89.6	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.014	26%	0.26	C	S	.	.	H	α-helix	trans	-90.2	-34.7	171.9	-72.4	0	0	0	0	111.9	W743 M744 E745 K750 G751 K752	W743-C747 WeakPolarHBondContact O-CB 3.33Å; W743-C747 PolarHBondContact O-N 2.85Å; W743-C747 PolarHBondContact O-SG 3.4Å; M744-C747 CarbonylContact O-C 3.57Å; M744-C747 WeakPolarHBondContact O-CA 3.43Å; M744-C747 WeakPolarHBondContact O-CB 3.11Å; M744-C747 PolarHBondContact O-N 3Å; E745-C747 PolarHBondContact O-N 2.93Å; E745-C747 VanDerWaalsContact O-N 3.14Å; C747-K750 CarbonylContact O-C 3.57Å; C747-K750 PolarHBondContact O-N 3.12Å; C747-G751 PolarHBondContact O-N 3.18Å; C747-K752 CarbonylContact O-C 3.57Å; C747-K752 VanDerWaalsContact O-CA 3.26Å; C747-K752 WeakPolarHBondContact O-CA 3.42Å; C747-K752 WeakPolarHBondContact O-CB 3.49Å; C747-K752 PolarHBondContact O-N 3.05Å
748	E	90.3	Very high	89.4	Confident	111 Å²	111	52.7 Å²	52.7	52%	0.519	27%	0.274	S	S	.	.	H	α-helix	trans	-69.3	-44.2	178.4	-73.9	-177.6	175.1	0	0	111.6	M744 E745 K750 G751 A753	M744-E748 HydrophobicContact CE-CG 4.37Å; M744-E748 WeakPolarHBondContact CE-OE1 3.49Å; M744-E748 WeakPolarHBondContact O-CG 3.41Å; M744-E748 PolarHBondContact O-N 3.28Å; E745-E748 PolarHBondContact O-N 2.88Å; E748-K750 PolarHBondContact O-N 2.72Å; E748-K750 VanDerWaalsContact O-N 3.11Å; E748-G751 PolarHBondContact O-N 3.17Å; E748-A753 HydrophobicContact CG-CB 3.69Å
749	D	88.9	Confident	89.3	Confident	137 Å²	137	49.2 Å²	49.2	73%	0.733	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-31.5	169.7	-88.7	-9.7	0	0	0	113	E745 G751	E745-D749 PolarHBondContact O-N 3.02Å; D749-G751 VanDerWaalsContact C-N 3.34Å
750	K	85.8	Confident	89.1	Confident	77 Å²	77	49.2 Å²	49.2	34%	0.335	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	9.4	179.5	-62.2	178.5	-166.8	176.6	0	113.2	D641 N645 L746 C747 E748 K752	D641-K750 IonicContact OD1-NZ 2.73Å; D641-K750 PolarHBondContact OD1-NZ 3.22Å; N645-K750 PolarHBondContact OD1-NZ 3.13Å; L746-K750 WeakPolarHBondContact O-CD 3.48Å; L746-K750 VanDerWaalsContact O-CE 3.29Å; L746-K750 WeakPolarHBondContact O-CE 3.33Å; L746-K750 VanDerWaalsContact O-CG 3.28Å; L746-K750 WeakPolarHBondContact O-CG 3.43Å; C747-K750 CarbonylContact O-C 3.57Å; C747-K750 PolarHBondContact O-N 3.12Å; E748-K750 PolarHBondContact O-N 2.72Å; E748-K750 VanDerWaalsContact O-N 3.11Å; K750-K752 VanDerWaalsContact C-N 3.28Å; K750-K752 HydrophobicContact CB-CB 4.43Å; K750-K752 HydrophobicContact CB-CD 4.27Å; K750-K752 WeakPolarHBondContact O-CG 3.42Å; K750-K752 PolarHBondContact O-N 2.9Å
751	G	84.4	Confident	89	Confident	75 Å²	75	49.5 Å²	49.5	77%	0.773	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	27.7	-178.3	0	0	0	0	0	113.8	C747 E748 D749	C747-G751 PolarHBondContact O-N 3.18Å; E748-G751 PolarHBondContact O-N 3.17Å; D749-G751 VanDerWaalsContact C-N 3.34Å
752	K	84.8	Confident	88.9	Confident	67 Å²	67	49.4 Å²	49.4	29%	0.291	26%	0.261	S	S	.	.			trans	-132.5	32	-163	-83.8	168.5	170	-81.7	0	113	E651 C747 K750 E754 I755	E651-K752 IonicContact OE1-NZ 2.76Å; E651-K752 PolarHBondContact OE1-NZ 3Å; C747-K752 CarbonylContact O-C 3.57Å; C747-K752 VanDerWaalsContact O-CA 3.26Å; C747-K752 WeakPolarHBondContact O-CA 3.42Å; C747-K752 WeakPolarHBondContact O-CB 3.49Å; C747-K752 PolarHBondContact O-N 3.05Å; K750-K752 VanDerWaalsContact C-N 3.28Å; K750-K752 HydrophobicContact CB-CB 4.43Å; K750-K752 HydrophobicContact CB-CD 4.27Å; K750-K752 WeakPolarHBondContact O-CG 3.42Å; K750-K752 PolarHBondContact O-N 2.9Å; K752-E754 VanDerWaalsContact C-N 3.27Å; K752-E754 PolarHBondContact O-N 3.33Å; K752-E754 VanDerWaalsContact O-N 3.1Å; K752-I755 HydrophobicContact CB-CB 4.42Å; K752-I755 HydrophobicContact CB-CD1 3.69Å; K752-I755 HydrophobicContact CB-CG1 3.99Å; K752-I755 HydrophobicContact CD-CD1 3.67Å; K752-I755 HydrophobicContact CG-CD1 3.64Å; K752-I755 HydrophobicContact CG-CG1 4.33Å; K752-I755 WeakPolarHBondContact O-CA 3.29Å; K752-I755 VanDerWaalsContact O-CB 3.26Å; K752-I755 WeakPolarHBondContact O-CB 3.43Å; K752-I755 WeakPolarHBondContact O-CG1 3.33Å; K752-I755 PolarHBondContact O-N 2.94Å
753	A	85.9	Confident	88.9	Confident	39 Å²	39	47.3 Å²	47.3	32%	0.322	25%	0.25	S	C	.	.	H	α-helix	trans	-44.5	-44.8	-178.6	0	0	0	0	0	114.5	E748 I755 G756 Q757	E748-A753 HydrophobicContact CG-CB 3.69Å; A753-I755 PolarHBondContact O-N 2.62Å; A753-I755 VanDerWaalsContact O-N 3.16Å; A753-G756 PolarHBondContact O-N 3.04Å; A753-Q757 PolarHBondContact O-N 3.28Å
754	E	84.8	Confident	88.9	Confident	138 Å²	138	47 Å²	47	65%	0.645	25%	0.249	S	C	*	.	H	α-helix	trans	-57.5	-29.9	176.9	-65.5	-173	178.4	0	0	113.9	K752 R758	K752-E754 VanDerWaalsContact C-N 3.27Å; K752-E754 PolarHBondContact O-N 3.33Å; K752-E754 VanDerWaalsContact O-N 3.1Å; E754-R758 VanDerWaalsContact O-CB 3.26Å; E754-R758 WeakPolarHBondContact O-CB 3.04Å; E754-R758 WeakPolarHBondContact O-CG 3.25Å; E754-R758 PolarHBondContact O-N 2.95Å; E754-R758 PolarHBondContact O-NE 2.68Å; E754-R758 VanDerWaalsContact O-NE 3.15Å; E754-R758 IonicContact OE2-CZ 3.3Å; E754-R758 IonicContact OE2-NH2 3.1Å; E754-R758 PolarHBondContact OE2-NH2 2.9Å
755	I	85.8	Confident	89	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-69.4	-42.7	177	-53.8	-174	0	0	0	109.8	E651 I654 K752 A753 R758 L759	E651-I755 HydrophobicContact CB-CD1 4.43Å; E651-I755 HydrophobicContact CG-CD1 3.81Å; E651-I755 HydrophobicContact CG-CG1 4.5Å; E651-I755 VanDerWaalsContact OE1-CD1 3.31Å; E651-I755 WeakPolarHBondContact OE1-CD1 3.23Å; E651-I755 WeakPolarHBondContact OE2-CG1 3.41Å; I654-I755 HydrophobicContact CD1-CG2 3.48Å; I654-I755 VanDerWaalsContact CD1-CG2 3.48Å; I654-I755 HydrophobicContact CG2-CG2 4.37Å; K752-I755 HydrophobicContact CB-CB 4.42Å; K752-I755 HydrophobicContact CB-CD1 3.69Å; K752-I755 HydrophobicContact CB-CG1 3.99Å; K752-I755 HydrophobicContact CD-CD1 3.67Å; K752-I755 HydrophobicContact CG-CD1 3.64Å; K752-I755 HydrophobicContact CG-CG1 4.33Å; K752-I755 WeakPolarHBondContact O-CA 3.29Å; K752-I755 VanDerWaalsContact O-CB 3.26Å; K752-I755 WeakPolarHBondContact O-CB 3.43Å; K752-I755 WeakPolarHBondContact O-CG1 3.33Å; K752-I755 PolarHBondContact O-N 2.94Å; A753-I755 PolarHBondContact O-N 2.62Å; A753-I755 VanDerWaalsContact O-N 3.16Å; I755-R758 PolarHBondContact O-N 2.67Å; I755-L759 WeakPolarHBondContact O-CB 3.37Å; I755-L759 PolarHBondContact O-N 3.43Å
756	G	87.9	Confident	89	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-57.1	-52.2	176.4	0	0	0	0	0	111.1	M744 A753 R758 L759 I760	M744-G756 VanDerWaalsContact SD-C 3.51Å; A753-G756 PolarHBondContact O-N 3.04Å; G756-R758 PolarHBondContact O-N 3.12Å; G756-L759 WeakPolarHBondContact O-CB 3.47Å; G756-L759 PolarHBondContact O-N 3.11Å; G756-L759 VanDerWaalsContact O-N 3.09Å; G756-I760 WeakPolarHBondContact O-CD1 3.46Å; G756-I760 WeakPolarHBondContact O-CG1 3.26Å; G756-I760 PolarHBondContact O-N 3.42Å
757	Q	88.1	Confident	89.2	Confident	52 Å²	52	41.5 Å²	41.5	24%	0.243	22%	0.221	C	C	.	.	H	α-helix	trans	-62.7	-39.8	177.9	-170.6	171.2	62.4	0	0	112.4	M744 A753 L759 S761 L835	M744-Q757 HydrophobicContact SD-CB 4.38Å; M744-Q757 PolarHBondContact SD-N 2.75Å; M744-Q757 VanDerWaalsContact SD-N 3.39Å; A753-Q757 PolarHBondContact O-N 3.28Å; Q757-L759 VanDerWaalsContact C-N 3.35Å; Q757-L759 PolarHBondContact O-N 2.88Å; Q757-S761 WeakPolarHBondContact O-CB 3.39Å; Q757-S761 PolarHBondContact O-N 2.75Å; Q757-L835 HydrophobicContact CG-CB 4.38Å; Q757-L835 HydrophobicContact CG-CD1 4.25Å
758	R	87.9	Confident	89.4	Confident	91 Å²	91	41.4 Å²	41.4	34%	0.343	22%	0.221	S	C	.	.	H	α-helix	trans	-62.3	-38	172.8	-79.2	-179.1	-96.8	146.6	-16.7	112.5	E651 E754 I755 G756 A762	E651-R758 IonicContact OE2-CZ 3.83Å; E651-R758 IonicContact OE2-NH1 2.73Å; E651-R758 PolarHBondContact OE2-NH1 3.07Å; E651-R758 IonicContact OE2-NH2 2.78Å; E651-R758 PolarHBondContact OE2-NH2 3.38Å; E651-R758 VanDerWaalsContact OE2-NH2 3.08Å; E754-R758 VanDerWaalsContact O-CB 3.26Å; E754-R758 WeakPolarHBondContact O-CB 3.04Å; E754-R758 WeakPolarHBondContact O-CG 3.25Å; E754-R758 PolarHBondContact O-N 2.95Å; E754-R758 PolarHBondContact O-NE 2.68Å; E754-R758 VanDerWaalsContact O-NE 3.15Å; E754-R758 IonicContact OE2-CZ 3.3Å; E754-R758 IonicContact OE2-NH2 3.1Å; E754-R758 PolarHBondContact OE2-NH2 2.9Å; I755-R758 PolarHBondContact O-N 2.67Å; G756-R758 PolarHBondContact O-N 3.12Å; R758-A762 WeakPolarHBondContact O-CB 3.42Å; R758-A762 PolarHBondContact O-N 3.16Å
759	L	88.9	Confident	89.6	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-70.8	-43.5	-179.5	-172	169.6	0	0	0	111	V644 I654 F655 W743 I755 G756 Q757 A762 S763	V644-L759 HydrophobicContact CG2-CD1 3.87Å; I654-L759 HydrophobicContact CD1-CD1 3.85Å; I654-L759 HydrophobicContact CD1-CG 4.44Å; I654-L759 HydrophobicContact CG1-CD1 4.4Å; F655-L759 HydrophobicContact CD1-CD2 4.05Å; F655-L759 HydrophobicContact CD1-CG 4.29Å; F655-L759 HydrophobicContact CD2-CD1 4.12Å; F655-L759 HydrophobicContact CD2-CD2 4.3Å; F655-L759 HydrophobicContact CD2-CG 3.78Å; F655-L759 HydrophobicContact CE1-CD2 3.75Å; F655-L759 HydrophobicContact CE1-CG 4.29Å; F655-L759 HydrophobicContact CE2-CD1 3.77Å; F655-L759 HydrophobicContact CE2-CD2 4.01Å; F655-L759 HydrophobicContact CE2-CG 3.79Å; F655-L759 HydrophobicContact CG-CD2 4.33Å; F655-L759 HydrophobicContact CG-CG 4.05Å; F655-L759 HydrophobicContact CZ-CD1 4.22Å; F655-L759 HydrophobicContact CZ-CD2 3.74Å; F655-L759 HydrophobicContact CZ-CG 4.06Å; W743-L759 HydrophobicContact CD2-CD2 3.8Å; W743-L759 HydrophobicContact CE3-CD2 3.22Å; W743-L759 HydrophobicContact CG-CD2 4.48Å; W743-L759 HydrophobicContact CH2-CD2 4.17Å; W743-L759 HydrophobicContact CZ3-CD2 3.43Å; W743-L759 VanDerWaalsContact CZ3-CD2 3.43Å; I755-L759 WeakPolarHBondContact O-CB 3.37Å; I755-L759 PolarHBondContact O-N 3.43Å; G756-L759 WeakPolarHBondContact O-CB 3.47Å; G756-L759 PolarHBondContact O-N 3.11Å; G756-L759 VanDerWaalsContact O-N 3.09Å; Q757-L759 VanDerWaalsContact C-N 3.35Å; Q757-L759 PolarHBondContact O-N 2.88Å; L759-A762 PolarHBondContact O-N 3.48Å; L759-S763 WeakPolarHBondContact O-CB 3.49Å; L759-S763 PolarHBondContact O-N 3.12Å; L759-S763 PolarHBondContact O-OG 3.49Å
760	I	91.9	Very high	90	Very high	1 Å²	1	30 Å²	30	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-63.6	-49.2	175	-66	157	0	0	0	110.4	F740 M744 G756 A762 S763 L764 L835	F740-I760 HydrophobicContact CB-CD1 4.02Å; F740-I760 HydrophobicContact CB-CG1 3.94Å; F740-I760 HydrophobicContact CB-CG2 4.48Å; F740-I760 HydrophobicContact CD1-CG1 4.19Å; F740-I760 HydrophobicContact CD2-CG2 3.74Å; F740-I760 HydrophobicContact CE2-CG2 4.03Å; F740-I760 HydrophobicContact CG-CG1 3.99Å; F740-I760 HydrophobicContact CG-CG2 4.03Å; M744-I760 HydrophobicContact CG-CD1 3.6Å; M744-I760 HydrophobicContact SD-CD1 3.73Å; G756-I760 WeakPolarHBondContact O-CD1 3.46Å; G756-I760 WeakPolarHBondContact O-CG1 3.26Å; G756-I760 PolarHBondContact O-N 3.42Å; I760-A762 VanDerWaalsContact C-N 3.33Å; I760-A762 PolarHBondContact O-N 3Å; I760-S763 CarbonylContact O-C 3.45Å; I760-S763 WeakPolarHBondContact O-CA 3.27Å; I760-S763 WeakPolarHBondContact O-CB 3.16Å; I760-S763 PolarHBondContact O-N 2.86Å; I760-L764 PolarHBondContact O-N 3.29Å; I760-L835 HydrophobicContact CG2-CD2 3.99Å
761	S	92.2	Very high	90.4	Very high	5 Å²	5	27.8 Å²	27.8	4%	0.035	16%	0.157	C	C	.	.	H	α-helix	trans	-59.1	-42.7	175.4	172.9	0	0	0	0	112.4	Q757 S763 F765 A805	Q757-S761 WeakPolarHBondContact O-CB 3.39Å; Q757-S761 PolarHBondContact O-N 2.75Å; S761-S763 PolarHBondContact O-N 3.16Å; S761-F765 WeakPolarHBondContact O-CB 3.43Å; S761-F765 PolarHBondContact O-N 3.18Å; S761-A805 PolarHBondContact OG-O 2.77Å
762	A	90.8	Very high	90.9	Very high	7 Å²	7	24.2 Å²	24.2	6%	0.058	12%	0.12	C	C	.	.	H	α-helix	trans	-66.3	-19.8	175.7	0	0	0	0	0	113.9	F655 R758 L759 I760 L766 R767	F655-A762 HydrophobicContact CB-CB 4.22Å; R758-A762 WeakPolarHBondContact O-CB 3.42Å; R758-A762 PolarHBondContact O-N 3.16Å; L759-A762 PolarHBondContact O-N 3.48Å; I760-A762 VanDerWaalsContact C-N 3.33Å; I760-A762 PolarHBondContact O-N 3Å; A762-L766 WeakPolarHBondContact O-CB 3.23Å; A762-R767 WeakPolarHBondContact O-CD 3.17Å; A762-R767 WeakPolarHBondContact O-CG 3.42Å
763	S	92.4	Very high	91.5	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-87.3	-63.4	172.8	-56.2	0	0	0	0	110.1	F655 M669 L759 I760 S761 F765 R767 F768	F655-S763 WeakPolarHBondContact CD1-OG 3.22Å; M669-S763 WeakPolarHBondContact CE-O 3.39Å; L759-S763 WeakPolarHBondContact O-CB 3.49Å; L759-S763 PolarHBondContact O-N 3.12Å; L759-S763 PolarHBondContact O-OG 3.49Å; I760-S763 CarbonylContact O-C 3.45Å; I760-S763 WeakPolarHBondContact O-CA 3.27Å; I760-S763 WeakPolarHBondContact O-CB 3.16Å; I760-S763 PolarHBondContact O-N 2.86Å; S761-S763 PolarHBondContact O-N 3.16Å; S763-F765 PolarHBondContact O-N 3.1Å; S763-R767 VanDerWaalsContact O-CB 3.29Å; S763-R767 WeakPolarHBondContact O-CB 3.45Å; S763-R767 PolarHBondContact O-N 3.37Å; S763-F768 PolarHBondContact O-N 2.82Å
764	L	93.7	Very high	91.8	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	9%	0.093	C	C	.	.	I	π-helix	trans	-63.5	-42.6	-172.3	-172.4	57.4	0	0	0	113	F732 F740 I760 F768 L769 F834 V838	F732-L764 HydrophobicContact CE2-CD1 4.46Å; F732-L764 HydrophobicContact CE2-CD2 4.45Å; F740-L764 HydrophobicContact CE2-CB 4.41Å; F740-L764 HydrophobicContact CE2-CD2 4.5Å; I760-L764 PolarHBondContact O-N 3.29Å; L764-F768 HydrophobicContact CD1-CD1 4.26Å; L764-F768 WeakPolarHBondContact O-CB 3.32Å; L764-L769 HydrophobicContact CD1-CD1 4.12Å; L764-L769 HydrophobicContact CD1-CG 4.23Å; L764-L769 HydrophobicContact CG-CD1 3.93Å; L764-L769 HydrophobicContact CG-CG 4.42Å; L764-L769 WeakPolarHBondContact O-CB 3.46Å; L764-L769 WeakPolarHBondContact O-CG 3.48Å; L764-L769 PolarHBondContact O-N 3.26Å; L764-F834 HydrophobicContact CD2-CE1 3.66Å; L764-F834 HydrophobicContact CD2-CZ 3.82Å; L764-V838 HydrophobicContact CD2-CG2 4.18Å
765	F	94.3	Very high	92.1	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.07	C	C	.	.	I	π-helix	trans	-91.9	-56.9	-178.4	-69.1	-84.2	0	0	0	113	I725 S761 S763 R767 L769 C770 P771 I801 A805 M831 F834 L835	I725-F765 HydrophobicContact CD1-CE1 4.25Å; I725-F765 HydrophobicContact CG2-CE1 4.09Å; I725-F765 HydrophobicContact CG2-CZ 3.89Å; S761-F765 WeakPolarHBondContact O-CB 3.43Å; S761-F765 PolarHBondContact O-N 3.18Å; S763-F765 PolarHBondContact O-N 3.1Å; F765-R767 VanDerWaalsContact C-N 3.27Å; F765-R767 PolarHBondContact O-N 2.64Å; F765-L769 HydrophobicContact CD1-CB 4.36Å; F765-L769 HydrophobicContact CD1-CD1 4.03Å; F765-L769 HydrophobicContact CE1-CD1 3.78Å; F765-L769 HydrophobicContact CZ-CD1 4.18Å; F765-C770 WeakPolarHBondContact O-CB 3.17Å; F765-C770 PolarHBondContact O-N 3.24Å; F765-P771 VanDerWaalsContact O-CD 3.27Å; F765-P771 WeakPolarHBondContact O-CD 3.01Å; F765-I801 HydrophobicContact CD1-CG2 3.79Å; F765-I801 HydrophobicContact CE1-CG2 3.89Å; F765-A805 HydrophobicContact CB-CB 3.66Å; F765-A805 HydrophobicContact CD1-CB 3.83Å; F765-A805 HydrophobicContact CD2-CB 3.51Å; F765-A805 HydrophobicContact CE1-CB 4.36Å; F765-A805 HydrophobicContact CE2-CB 4.09Å; F765-A805 HydrophobicContact CG-CB 3.36Å; F765-A805 HydrophobicContact CZ-CB 4.48Å; F765-M831 HydrophobicContact CE1-CE 3.93Å; F765-M831 HydrophobicContact CE1-SD 4.19Å; F765-M831 HydrophobicContact CE2-CE 4.42Å; F765-M831 HydrophobicContact CE2-SD 3.6Å; F765-M831 HydrophobicContact CZ-CE 3.61Å; F765-M831 HydrophobicContact CZ-SD 3.36Å; F765-M831 WeakPolarHBondContact CZ-SD 3.39Å; F765-F834 HydrophobicContact CE2-CD1 4.29Å; F765-F834 AromaticContact CE2-CE1 3.88Å; F765-F834 HydrophobicContact CE2-CE1 3.88Å; F765-F834 HydrophobicContact CZ-CD1 4.07Å; F765-F834 AromaticContact CZ-CE1 3.66Å; F765-F834 HydrophobicContact CZ-CE1 3.66Å; F765-L835 HydrophobicContact CE2-CD2 4.03Å
766	L	92.1	Very high	92.4	Very high	39 Å²	39	13.8 Å²	13.8	20%	0.204	7%	0.068	C	C	.	.	I	π-helix	trans	-70.2	-20	-172.9	173	65.1	0	0	0	113.8	R656 A762 P771 Q802	R656-L766 HydrophobicContact CG-CD2 4.31Å; A762-L766 WeakPolarHBondContact O-CB 3.23Å; L766-P771 WeakPolarHBondContact O-CG 3.15Å; L766-Q802 VanDerWaalsContact CB-OE1 3.28Å
767	R	92.1	Very high	92.3	Very high	23 Å²	23	15.1 Å²	15.1	9%	0.087	8%	0.078	C	C	.	.	I	π-helix	trans	-118.3	-22.1	-175	-67.4	169.9	171	-76.1	0.2	114.5	F655 E657 T662 D666 M669 A762 S763 F765	F655-R767 VanDerWaalsContact O-CZ 3.27Å; F655-R767 PolarHBondContact O-NE 2.83Å; F655-R767 PolarHBondContact O-NH2 3.17Å; E657-R767 PolarHBondContact O-NH2 2.96Å; E657-R767 VanDerWaalsContact O-NH2 3.08Å; T662-R767 VanDerWaalsContact CB-CZ 3.45Å; T662-R767 VanDerWaalsContact CB-NH2 3.33Å; D666-R767 VanDerWaalsContact CG-NH1 3.25Å; D666-R767 WeakPolarHBondContact OD1-CB 3.34Å; D666-R767 VanDerWaalsContact OD1-CD 3.22Å; D666-R767 WeakPolarHBondContact OD1-CD 3.31Å; D666-R767 VanDerWaalsContact OD1-CG 3.29Å; D666-R767 WeakPolarHBondContact OD1-CG 3.17Å; D666-R767 IonicContact OD1-CZ 2.69Å; D666-R767 IonicContact OD1-NE 2.71Å; D666-R767 IonicContact OD1-NH1 3.91Å; D666-R767 PolarHBondContact OD1-NH1 2.81Å; D666-R767 IonicContact OD2-NH1 3.53Å; D666-R767 PolarHBondContact OD2-NH1 2.78Å; D666-R767 VanDerWaalsContact OD2-NH1 3.11Å; M669-R767 HydrophobicContact CE-CB 3.81Å; A762-R767 WeakPolarHBondContact O-CD 3.17Å; A762-R767 WeakPolarHBondContact O-CG 3.42Å; S763-R767 VanDerWaalsContact O-CB 3.29Å; S763-R767 WeakPolarHBondContact O-CB 3.45Å; S763-R767 PolarHBondContact O-N 3.37Å; F765-R767 VanDerWaalsContact C-N 3.27Å; F765-R767 PolarHBondContact O-N 2.64Å
768	F	94.4	Very high	92.2	Very high	1 Å²	1	17.4 Å²	17.4	0%	0.004	9%	0.091	C	C	.	.	I	π-helix	trans	-116.4	-74.6	179.5	-167.6	-124.3	0	0	0	113.4	M669 Y676 L677 S763 L764 P771 A772 F779	M669-F768 VanDerWaalsContact C-CE2 3.48Å; M669-F768 HydrophobicContact CB-CB 4.22Å; M669-F768 HydrophobicContact CB-CD1 4.4Å; M669-F768 HydrophobicContact CB-CD2 3.68Å; M669-F768 HydrophobicContact CB-CE2 4.08Å; M669-F768 HydrophobicContact CB-CG 3.87Å; M669-F768 HydrophobicContact CE-CB 3.94Å; M669-F768 WeakPolarHBondContact O-CE2 3.41Å; M669-F768 WeakPolarHBondContact O-CZ 3.28Å; M669-F768 HydrophobicContact SD-CB 3.88Å; M669-F768 HydrophobicContact SD-CG 4.42Å; Y676-F768 HydrophobicContact CD1-CE1 4.36Å; L677-F768 HydrophobicContact CB-CE1 4.1Å; L677-F768 HydrophobicContact CB-CZ 3.78Å; L677-F768 HydrophobicContact CD1-CD1 4.25Å; L677-F768 HydrophobicContact CD1-CE1 3.8Å; L677-F768 HydrophobicContact CD1-CE2 4.49Å; L677-F768 HydrophobicContact CD1-CZ 3.94Å; L677-F768 HydrophobicContact CD2-CE2 3.95Å; L677-F768 HydrophobicContact CD2-CZ 3.82Å; L677-F768 HydrophobicContact CG-CE1 4.37Å; L677-F768 HydrophobicContact CG-CZ 4.07Å; S763-F768 PolarHBondContact O-N 2.82Å; L764-F768 HydrophobicContact CD1-CD1 4.26Å; L764-F768 WeakPolarHBondContact O-CB 3.32Å; F768-P771 WeakPolarHBondContact O-CD 3.34Å; F768-A772 WeakPolarHBondContact O-CB 3.37Å; F768-A772 PolarHBondContact O-N 2.86Å; F768-F779 HydrophobicContact CD2-CD1 4.46Å; F768-F779 AromaticContact CD2-CE1 3.99Å; F768-F779 HydrophobicContact CD2-CE1 3.99Å; F768-F779 HydrophobicContact CE2-CD1 4.34Å; F768-F779 HydrophobicContact CE2-CE1 4.29Å
769	L	95.3	Very high	92.3	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.079	C	C	.	.	I	π-helix	trans	-64.6	-50.9	-170.8	-63.7	175.8	0	0	0	113.8	Y676 L677 L681 I725 L764 F765 A772 I773	Y676-L769 HydrophobicContact CE1-CD2 4.18Å; L677-L769 HydrophobicContact CD1-CD2 3.69Å; L681-L769 HydrophobicContact CD1-CD2 4.12Å; I725-L769 HydrophobicContact CD1-CD1 4.22Å; I725-L769 HydrophobicContact CG1-CD1 4.48Å; I725-L769 HydrophobicContact CG2-CD1 4.38Å; L764-L769 HydrophobicContact CD1-CD1 4.12Å; L764-L769 HydrophobicContact CD1-CG 4.23Å; L764-L769 HydrophobicContact CG-CD1 3.93Å; L764-L769 HydrophobicContact CG-CG 4.42Å; L764-L769 WeakPolarHBondContact O-CB 3.46Å; L764-L769 WeakPolarHBondContact O-CG 3.48Å; L764-L769 PolarHBondContact O-N 3.26Å; F765-L769 HydrophobicContact CD1-CB 4.36Å; F765-L769 HydrophobicContact CD1-CD1 4.03Å; F765-L769 HydrophobicContact CE1-CD1 3.78Å; F765-L769 HydrophobicContact CZ-CD1 4.18Å; L769-A772 WeakPolarHBondContact O-CB 3.47Å; L769-A772 PolarHBondContact O-N 2.92Å; L769-I773 WeakPolarHBondContact O-CG1 3.25Å; L769-I773 PolarHBondContact O-N 3.38Å
770	C	96.1	Very high	92.1	Very high	7 Å²	7	16.4 Å²	16.4	5%	0.047	10%	0.103	C	C	.	.	H	α-helix	trans	-68	-38.8	-178.4	-60.4	0	0	0	0	112.9	F765 I773 L774 A798	F765-C770 WeakPolarHBondContact O-CB 3.17Å; F765-C770 PolarHBondContact O-N 3.24Å; C770-I773 PolarHBondContact O-N 3.35Å; C770-L774 VanDerWaalsContact O-CB 3.24Å; C770-L774 WeakPolarHBondContact O-CB 3.41Å; C770-L774 PolarHBondContact O-N 3.06Å; C770-A798 HydrophobicContact CB-CB 4.43Å
771	P	95.3	Very high	92	Very high	32 Å²	32	16.4 Å²	16.4	21%	0.208	10%	0.103	C	C	.	.	H	α-helix	trans	-58.4	-40.2	167.2	-31.1	39.7	0	0	0	114.3	F765 L766 F768 L774 S775 F779	F765-P771 VanDerWaalsContact O-CD 3.27Å; F765-P771 WeakPolarHBondContact O-CD 3.01Å; L766-P771 WeakPolarHBondContact O-CG 3.15Å; F768-P771 WeakPolarHBondContact O-CD 3.34Å; P771-L774 PolarHBondContact O-N 3.41Å; P771-S775 PolarHBondContact O-N 3.02Å; P771-F779 HydrophobicContact CB-CE2 3.81Å; P771-F779 HydrophobicContact CB-CZ 3.72Å
772	A	95.1	Very high	91.7	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.1	-45.8	176.1	0	0	0	0	0	112.2	L677 L681 F768 L769 L774 S775 P776 F779 L781	L677-A772 HydrophobicContact CD1-CB 3.78Å; L677-A772 HydrophobicContact CD2-CB 3.93Å; L677-A772 HydrophobicContact CG-CB 4.3Å; L681-A772 HydrophobicContact CD1-CB 4.35Å; F768-A772 WeakPolarHBondContact O-CB 3.37Å; F768-A772 PolarHBondContact O-N 2.86Å; L769-A772 WeakPolarHBondContact O-CB 3.47Å; L769-A772 PolarHBondContact O-N 2.92Å; A772-L774 VanDerWaalsContact C-N 3.32Å; A772-L774 PolarHBondContact O-N 3.25Å; A772-S775 CarbonylContact O-C 3.49Å; A772-S775 PolarHBondContact O-N 3.09Å; A772-P776 WeakPolarHBondContact O-CA 3.49Å; A772-P776 WeakPolarHBondContact O-CD 3.21Å; A772-P776 WeakPolarHBondContact O-CG 3.32Å; A772-P776 VanDerWaalsContact O-N 3.14Å; A772-F779 HydrophobicContact CB-CB 4.04Å; A772-F779 HydrophobicContact CB-CD1 3.93Å; A772-F779 HydrophobicContact CB-CD2 3.98Å; A772-F779 HydrophobicContact CB-CE1 4.36Å; A772-F779 HydrophobicContact CB-CE2 4.41Å; A772-F779 HydrophobicContact CB-CG 3.71Å; A772-L781 HydrophobicContact CB-CD1 4.47Å
773	I	95.6	Very high	91.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-59.6	-44.7	173.2	-62.7	167.4	0	0	0	110.3	L681 V721 L769 C770 S775 L794 T797 A798	L681-I773 HydrophobicContact CD1-CD1 4.46Å; L681-I773 HydrophobicContact CD1-CG1 3.84Å; L681-I773 HydrophobicContact CD2-CG1 4.45Å; V721-I773 HydrophobicContact CG2-CD1 4.13Å; L769-I773 WeakPolarHBondContact O-CG1 3.25Å; L769-I773 PolarHBondContact O-N 3.38Å; C770-I773 PolarHBondContact O-N 3.35Å; I773-S775 PolarHBondContact O-N 2.97Å; I773-L794 HydrophobicContact CG2-CD2 3.97Å; I773-L794 WeakPolarHBondContact O-CB 3.41Å; I773-L794 WeakPolarHBondContact O-CD2 3.43Å; I773-T797 HydrophobicContact CG2-CG2 4.44Å; I773-A798 HydrophobicContact CB-CB 4.15Å; I773-A798 HydrophobicContact CG2-CB 3.93Å
774	L	92.6	Very high	91.1	Very high	9 Å²	9	20.9 Å²	20.9	5%	0.047	13%	0.128	C	C	.	.	H	α-helix	trans	-71.3	-25.4	-175.1	-179.8	62.4	0	0	0	114.1	M87 R91 C770 P771 A772 T795 A798	M87-L774 HydrophobicContact CE-CD2 3.28Å; M87-L774 HydrophobicContact CG-CD2 4.48Å; M87-L774 HydrophobicContact SD-CD2 3.43Å; M87-L774 WeakPolarHBondContact SD-CD2 3.4Å; R91-L774 PolarHBondContact NH2-O 2.82Å; C770-L774 VanDerWaalsContact O-CB 3.24Å; C770-L774 WeakPolarHBondContact O-CB 3.41Å; C770-L774 PolarHBondContact O-N 3.06Å; P771-L774 PolarHBondContact O-N 3.41Å; A772-L774 VanDerWaalsContact C-N 3.32Å; A772-L774 PolarHBondContact O-N 3.25Å; L774-T795 HydrophobicContact CD1-CG2 4.23Å; L774-T795 WeakPolarHBondContact CD1-OG1 3.41Å; L774-A798 HydrophobicContact CB-CB 4.24Å
775	S	90.9	Very high	90.7	Very high	21 Å²	21	23.3 Å²	23.3	15%	0.147	14%	0.137	C	C	.	.			trans	-149.9	71.1	-179.7	-66.6	0	0	0	0	111.5	R91 P771 A772 I773 S777 L778	R91-S775 PolarHBondContact NH2-OG 3.32Å; P771-S775 PolarHBondContact O-N 3.02Å; A772-S775 CarbonylContact O-C 3.49Å; A772-S775 PolarHBondContact O-N 3.09Å; I773-S775 PolarHBondContact O-N 2.97Å; S775-S777 PolarHBondContact O-N 3.42Å; S775-S777 VanDerWaalsContact O-N 3.09Å; S775-L778 PolarHBondContact O-N 3.45Å
776	P	92.1	Very high	90.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-62.6	-23.7	-167.4	-25	35.5	0	0	0	115.3	I685 Y689 A772 F779 G780 L781 T782 L794	I685-P776 HydrophobicContact CD1-CG 3.82Å; I685-P776 HydrophobicContact CG1-CB 4.37Å; I685-P776 HydrophobicContact CG1-CG 4.21Å; I685-P776 HydrophobicContact CG2-CB 3.75Å; I685-P776 HydrophobicContact CG2-CG 3.88Å; Y689-P776 HydrophobicContact CE2-CG 4.35Å; A772-P776 WeakPolarHBondContact O-CA 3.49Å; A772-P776 WeakPolarHBondContact O-CD 3.21Å; A772-P776 WeakPolarHBondContact O-CG 3.32Å; A772-P776 VanDerWaalsContact O-N 3.14Å; P776-F779 CarbonylContact O-C 3.6Å; P776-F779 PolarHBondContact O-N 2.86Å; P776-G780 PolarHBondContact O-N 3.17Å; P776-L781 HydrophobicContact CB-CB 4.03Å; P776-L781 HydrophobicContact CB-CD1 4.15Å; P776-L781 PolarHBondContact O-N 3.15Å; P776-L781 VanDerWaalsContact O-N 3.12Å; P776-T782 HydrophobicContact CB-CG2 4.04Å; P776-L794 HydrophobicContact CG-CD1 4.05Å
777	S	86.9	Confident	90	Very high	28 Å²	28	26.4 Å²	26.4	20%	0.196	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-73.6	-23.1	176.5	56.6	0	0	0	0	114.3	S775 F779 T782	S775-S777 PolarHBondContact O-N 3.42Å; S775-S777 VanDerWaalsContact O-N 3.09Å; S777-F779 PolarHBondContact O-N 2.63Å; S777-T782 WeakPolarHBondContact CA-O 3.38Å; S777-T782 WeakPolarHBondContact CB-O 3.35Å
778	L	86.4	Confident	89.8	Confident	100 Å²	100	30 Å²	30	52%	0.524	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-75.6	-10.1	171	-70.8	175.7	0	0	0	113	W421 S775	W421-L778 HydrophobicContact CH2-CD2 3.71Å; W421-L778 HydrophobicContact CZ2-CD2 3.91Å; S775-L778 PolarHBondContact O-N 3.45Å
779	F	89.6	Confident	89.5	Confident	23 Å²	23	32.6 Å²	32.6	10%	0.101	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-120.6	19.4	-178.8	-71.8	-97.1	0	0	0	112	K670 Q674 L677 F768 P771 A772 P776 S777 L781	K670-F779 HydrophobicContact CG-CE1 4.2Å; Q674-F779 PolarHBondContact NE2-O 2.7Å; L677-F779 HydrophobicContact CD2-CB 3.83Å; L677-F779 HydrophobicContact CD2-CD1 3.75Å; L677-F779 HydrophobicContact CD2-CG 4.19Å; F768-F779 HydrophobicContact CD2-CD1 4.46Å; F768-F779 AromaticContact CD2-CE1 3.99Å; F768-F779 HydrophobicContact CD2-CE1 3.99Å; F768-F779 HydrophobicContact CE2-CD1 4.34Å; F768-F779 HydrophobicContact CE2-CE1 4.29Å; P771-F779 HydrophobicContact CB-CE2 3.81Å; P771-F779 HydrophobicContact CB-CZ 3.72Å; A772-F779 HydrophobicContact CB-CB 4.04Å; A772-F779 HydrophobicContact CB-CD1 3.93Å; A772-F779 HydrophobicContact CB-CD2 3.98Å; A772-F779 HydrophobicContact CB-CE1 4.36Å; A772-F779 HydrophobicContact CB-CE2 4.41Å; A772-F779 HydrophobicContact CB-CG 3.71Å; P776-F779 CarbonylContact O-C 3.6Å; P776-F779 PolarHBondContact O-N 2.86Å; S777-F779 PolarHBondContact O-N 2.63Å; F779-L781 PolarHBondContact O-N 2.64Å
780	G	85.5	Confident	89.4	Confident	48 Å²	48	33.4 Å²	33.4	50%	0.495	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	6.3	172.6	0	0	0	0	0	116.5	P776	P776-G780 PolarHBondContact O-N 3.17Å
781	L	87.9	Confident	89.2	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.01	20%	0.201	C	C	.	.	S	Bend	trans	-70.2	-38.5	-176.7	-61	177.9	0	0	0	111.6	K371 L677 I678 L681 I685 A772 P776 F779	K371-L781 PolarHBondContact NZ-O 3.4Å; L677-L781 HydrophobicContact CG-CD2 4.32Å; I678-L781 HydrophobicContact CB-CD2 4.47Å; I678-L781 HydrophobicContact CG1-CD2 3.88Å; L681-L781 HydrophobicContact CB-CD1 4.25Å; I685-L781 HydrophobicContact CG1-CD1 4.06Å; A772-L781 HydrophobicContact CB-CD1 4.47Å; P776-L781 HydrophobicContact CB-CB 4.03Å; P776-L781 HydrophobicContact CB-CD1 4.15Å; P776-L781 PolarHBondContact O-N 3.15Å; P776-L781 VanDerWaalsContact O-N 3.12Å; F779-L781 PolarHBondContact O-N 2.64Å
782	T	86.8	Confident	89	Confident	30 Å²	30	35.2 Å²	35.2	18%	0.184	20%	0.2	C	C	.	.			trans	-151.4	146	176.9	179.5	0	0	0	0	111.2	I685 Y689 P776 S777	I685-T782 HydrophobicContact CG2-CG2 4.12Å; Y689-T782 HydrophobicContact CE1-CG2 3.9Å; Y689-T782 HydrophobicContact CE2-CG2 3.92Å; Y689-T782 WeakPolarHBondContact OH-CG2 3.32Å; P776-T782 HydrophobicContact CB-CG2 4.04Å; S777-T782 WeakPolarHBondContact CA-O 3.38Å; S777-T782 WeakPolarHBondContact CB-O 3.35Å
783	Q	84.5	Confident	89	Confident	55 Å²	55	35.5 Å²	35.5	26%	0.257	20%	0.202	S	C	.	.	S	Bend	trans	-73.2	-35.2	179.2	-176.1	60.3	20.1	0	0	112.6	F491	F491-Q783 PolarHBondContact O-NE2 2.89Å
784	A	85.2	Confident	89	Confident	21 Å²	21	35.5 Å²	35.5	17%	0.174	20%	0.202	C	C	.	.	S	Bend	trans	-77.9	136.1	-172.1	0	0	0	0	0	111.8	Y689	Y689-A784 HydrophobicContact CE1-CB 4.28Å; Y689-A784 WeakPolarHBondContact CE1-O 3.41Å; Y689-A784 PolarHBondContact OH-O 3.4Å
785	Y	86	Confident	89.1	Confident	51 Å²	51	36 Å²	36	20%	0.2	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-63.2	142.1	167.5	-167.3	-90.8	0	0	0	110.7	R451 F487 W488 L791	R451-Y785 PolarHBondContact NH2-O 3.12Å; F487-Y785 HydrophobicContact CD1-CD1 4.29Å; F487-Y785 AromaticContact CE1-CD1 3.85Å; F487-Y785 HydrophobicContact CE1-CD1 3.85Å; F487-Y785 HydrophobicContact CE1-CD2 4.12Å; F487-Y785 HydrophobicContact CE1-CE1 4.05Å; F487-Y785 HydrophobicContact CE1-CE2 4.31Å; F487-Y785 AromaticContact CE1-CG 3.91Å; F487-Y785 HydrophobicContact CE1-CG 3.91Å; W488-Y785 WeakPolarHBondContact O-CB 3.42Å; Y785-L791 HydrophobicContact CE1-CD2 4.04Å
786	P	87.3	Confident	89.3	Confident	3 Å²	3	35 Å²	35	2%	0.019	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-69.3	138.3	-178.1	27.7	-34.3	0	0	0	111.8	Y689 T790 L791 L794	Y689-P786 HydrophobicContact CE1-CB 4.3Å; Y689-P786 HydrophobicContact CE2-CB 4.15Å; Y689-P786 VanDerWaalsContact OH-CD 3.25Å; Y689-P786 WeakPolarHBondContact OH-CD 3.45Å; P786-T790 HydrophobicContact CB-CG2 4.19Å; P786-L791 HydrophobicContact CB-CB 4.04Å; P786-L791 HydrophobicContact CG-CB 3.94Å; P786-L791 HydrophobicContact CG-CD1 3.83Å; P786-L791 HydrophobicContact CG-CG 4.34Å; P786-L794 HydrophobicContact CB-CD1 4.01Å; P786-L794 HydrophobicContact CG-CD1 4.37Å
787	E	85.4	Confident	89.5	Confident	100 Å²	100	35 Å²	35	47%	0.467	20%	0.198	S	C	.	.	P	Polyproline II helix	trans	-63.6	157.2	171.9	-73.3	-57.6	126.7	0	0	111.3	R451 N789 T790 L791	R451-E787 IonicContact CZ-OE1 3.91Å; R451-E787 IonicContact NH1-OE1 2.63Å; R451-E787 PolarHBondContact NH1-OE1 2.89Å; R451-E787 IonicContact NH2-OE1 2.86Å; E787-N789 PolarHBondContact O-N 2.94Å; E787-T790 PolarHBondContact O-N 3.44Å; E787-T790 VanDerWaalsContact O-N 3.1Å; E787-L791 WeakPolarHBondContact O-CB 3.36Å; E787-L791 PolarHBondContact O-N 3.27Å
788	P	86.9	Confident	90	Very high	100 Å²	100	33.9 Å²	33.9	65%	0.649	19%	0.191	S	C	*	.	H	α-helix	trans	-54.2	-33.4	-171	-29.8	36.3	0	0	0	115.8	R792	P788-R792 PolarHBondContact O-N 3.24Å; P788-R792 VanDerWaalsContact O-N 3.16Å
789	N	88.8	Confident	90.4	Very high	55 Å²	55	29.8 Å²	29.8	29%	0.294	17%	0.169	S	C	.	.	H	α-helix	trans	-70.9	-56.8	174.3	-177.1	29	0	0	0	111.5	E693 N694 E787 L791 R792 T793	E693-N789 PolarHBondContact O-ND2 3.01Å; N694-N789 PolarHBondContact OD1-OD1 3.48Å; E787-N789 PolarHBondContact O-N 2.94Å; N789-L791 PolarHBondContact O-N 2.81Å; N789-R792 WeakPolarHBondContact O-CA 3.48Å; N789-R792 WeakPolarHBondContact O-CB 3.28Å; N789-R792 PolarHBondContact O-N 3.37Å; N789-T793 PolarHBondContact O-N 2.87Å; N789-T793 PolarHBondContact O-OG1 3.26Å
790	T	91.8	Very high	90.8	Very high	16 Å²	16	28.7 Å²	28.7	10%	0.098	16%	0.164	C	C	.	.	H	α-helix	trans	-52.8	-42	175.4	-48	0	0	0	0	111.7	L688 Y689 P786 E787 R792 T793 L794	L688-T790 HydrophobicContact CB-CG2 4.45Å; L688-T790 WeakPolarHBondContact O-CG2 3.39Å; Y689-T790 HydrophobicContact CD2-CG2 3.86Å; Y689-T790 HydrophobicContact CE2-CG2 4.16Å; Y689-T790 HydrophobicContact CG-CG2 4.33Å; P786-T790 HydrophobicContact CB-CG2 4.19Å; E787-T790 PolarHBondContact O-N 3.44Å; E787-T790 VanDerWaalsContact O-N 3.1Å; T790-R792 VanDerWaalsContact C-N 3.33Å; T790-R792 PolarHBondContact O-N 3.18Å; T790-T793 PolarHBondContact O-N 2.95Å; T790-L794 HydrophobicContact CG2-CD1 4.08Å; T790-L794 HydrophobicContact CG2-CG 4.4Å; T790-L794 WeakPolarHBondContact O-CB 3.36Å; T790-L794 VanDerWaalsContact O-CG 3.25Å; T790-L794 WeakPolarHBondContact O-CG 3.32Å; T790-L794 PolarHBondContact O-N 3.43Å
791	L	91.7	Very high	91.3	Very high	29 Å²	29	26.4 Å²	26.4	15%	0.152	14%	0.14	C	C	.	.	H	α-helix	trans	-62.6	-37	175.2	179.6	57.1	0	0	0	112.3	Y785 P786 E787 N789 T795	Y785-L791 HydrophobicContact CE1-CD2 4.04Å; P786-L791 HydrophobicContact CB-CB 4.04Å; P786-L791 HydrophobicContact CG-CB 3.94Å; P786-L791 HydrophobicContact CG-CD1 3.83Å; P786-L791 HydrophobicContact CG-CG 4.34Å; E787-L791 WeakPolarHBondContact O-CB 3.36Å; E787-L791 PolarHBondContact O-N 3.27Å; N789-L791 PolarHBondContact O-N 2.81Å; L791-T795 WeakPolarHBondContact O-CB 3.29Å; L791-T795 PolarHBondContact O-N 2.97Å; L791-T795 PolarHBondContact O-OG1 3.18Å
792	R	92.9	Very high	91.6	Very high	48 Å²	48	27.8 Å²	27.8	18%	0.181	15%	0.147	C	C	.	.	H	α-helix	trans	-66.8	-45.7	174.4	-178.4	55.1	167.4	143.5	2.8	111	E696 P788 N789 T790 T795 L796	E696-R792 VanDerWaalsContact CD-NE 3.32Å; E696-R792 IonicContact OE1-CZ 2.62Å; E696-R792 IonicContact OE1-NE 3.97Å; E696-R792 PolarHBondContact OE1-NE 3.35Å; E696-R792 IonicContact OE1-NH2 3.81Å; E696-R792 PolarHBondContact OE1-NH2 3.23Å; E696-R792 IonicContact OE2-CZ 2.66Å; E696-R792 IonicContact OE2-NE 2.85Å; E696-R792 PolarHBondContact OE2-NE 2.99Å; E696-R792 IonicContact OE2-NH2 2.71Å; E696-R792 PolarHBondContact OE2-NH2 3.39Å; P788-R792 PolarHBondContact O-N 3.24Å; P788-R792 VanDerWaalsContact O-N 3.16Å; N789-R792 WeakPolarHBondContact O-CA 3.48Å; N789-R792 WeakPolarHBondContact O-CB 3.28Å; N789-R792 PolarHBondContact O-N 3.37Å; T790-R792 VanDerWaalsContact C-N 3.33Å; T790-R792 PolarHBondContact O-N 3.18Å; R792-T795 PolarHBondContact O-N 3.13Å; R792-L796 HydrophobicContact CG-CD1 4.07Å; R792-L796 VanDerWaalsContact NH1-CD2 3.32Å; R792-L796 WeakPolarHBondContact O-CG 3.49Å; R792-L796 PolarHBondContact O-N 3.13Å
793	T	94.3	Very high	92	Very high	6 Å²	6	27.7 Å²	27.7	4%	0.037	15%	0.145	C	C	.	.	H	α-helix	trans	-58.4	-51	174.8	-55.8	0	0	0	0	111.9	L688 C695 T717 N789 T790 T795 L796 T797	L688-T793 HydrophobicContact CD1-CG2 4.46Å; L688-T793 HydrophobicContact CD2-CG2 4.08Å; C695-T793 HydrophobicContact CB-CG2 3.94Å; C695-T793 WeakPolarHBondContact CB-OG1 3.37Å; T717-T793 HydrophobicContact CG2-CG2 4.1Å; N789-T793 PolarHBondContact O-N 2.87Å; N789-T793 PolarHBondContact O-OG1 3.26Å; T790-T793 PolarHBondContact O-N 2.95Å; T793-T795 VanDerWaalsContact C-N 3.31Å; T793-T795 PolarHBondContact O-N 3.04Å; T793-L796 PolarHBondContact O-N 2.97Å; T793-T797 WeakPolarHBondContact O-CB 3.37Å; T793-T797 PolarHBondContact O-N 3.4Å; T793-T797 PolarHBondContact O-OG1 3.19Å
794	L	95.2	Very high	92.5	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-59.9	-40	176.1	-68.7	172.1	0	0	0	112.1	I685 L688 Y689 I773 P776 P786 T790 L796 A798	I685-L794 HydrophobicContact CD1-CD2 3.45Å; I685-L794 VanDerWaalsContact CD1-CD2 3.45Å; L688-L794 HydrophobicContact CD1-CD2 3.55Å; L688-L794 HydrophobicContact CD1-CG 4.45Å; Y689-L794 HydrophobicContact CE2-CD1 4.09Å; I773-L794 HydrophobicContact CG2-CD2 3.97Å; I773-L794 WeakPolarHBondContact O-CB 3.41Å; I773-L794 WeakPolarHBondContact O-CD2 3.43Å; P776-L794 HydrophobicContact CG-CD1 4.05Å; P786-L794 HydrophobicContact CB-CD1 4.01Å; P786-L794 HydrophobicContact CG-CD1 4.37Å; T790-L794 HydrophobicContact CG2-CD1 4.08Å; T790-L794 HydrophobicContact CG2-CG 4.4Å; T790-L794 WeakPolarHBondContact O-CB 3.36Å; T790-L794 VanDerWaalsContact O-CG 3.25Å; T790-L794 WeakPolarHBondContact O-CG 3.32Å; T790-L794 PolarHBondContact O-N 3.43Å; L794-L796 VanDerWaalsContact C-N 3.34Å; L794-L796 PolarHBondContact O-N 3.29Å; L794-A798 VanDerWaalsContact O-CB 3.22Å; L794-A798 WeakPolarHBondContact O-CB 3.46Å; L794-A798 PolarHBondContact O-N 3.47Å
795	T	95.1	Very high	92.9	Very high	19 Å²	19	24.3 Å²	24.3	12%	0.117	13%	0.127	C	C	.	.	H	α-helix	trans	-66.5	-33.7	177.5	-61.6	0	0	0	0	112.5	W84 L774 L791 R792 T793 K799	W84-T795 HydrophobicContact CH2-CG2 3.52Å; W84-T795 HydrophobicContact CZ2-CG2 3.46Å; W84-T795 VanDerWaalsContact CZ2-CG2 3.46Å; L774-T795 HydrophobicContact CD1-CG2 4.23Å; L774-T795 WeakPolarHBondContact CD1-OG1 3.41Å; L791-T795 WeakPolarHBondContact O-CB 3.29Å; L791-T795 PolarHBondContact O-N 2.97Å; L791-T795 PolarHBondContact O-OG1 3.18Å; R792-T795 PolarHBondContact O-N 3.13Å; T793-T795 VanDerWaalsContact C-N 3.31Å; T793-T795 PolarHBondContact O-N 3.04Å; T795-K799 WeakPolarHBondContact O-CB 3.45Å; T795-K799 PolarHBondContact O-N 3.3Å
796	L	95.6	Very high	93.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-77.3	-47.6	176.1	-75	165	0	0	0	111.4	C695 V697 L714 R792 T793 L794 A798 K799 V800 Y816 M817	C695-L796 WeakPolarHBondContact O-CD1 3.18Å; V697-L796 HydrophobicContact CG2-CD1 4.1Å; V697-L796 HydrophobicContact CG2-CD2 4.22Å; L714-L796 HydrophobicContact CD1-CB 3.82Å; L714-L796 HydrophobicContact CD2-CB 4.03Å; L714-L796 HydrophobicContact CD2-CD1 4.32Å; R792-L796 HydrophobicContact CG-CD1 4.07Å; R792-L796 VanDerWaalsContact NH1-CD2 3.32Å; R792-L796 WeakPolarHBondContact O-CG 3.49Å; R792-L796 PolarHBondContact O-N 3.13Å; T793-L796 PolarHBondContact O-N 2.97Å; L794-L796 VanDerWaalsContact C-N 3.34Å; L794-L796 PolarHBondContact O-N 3.29Å; L796-A798 PolarHBondContact O-N 3Å; L796-K799 WeakPolarHBondContact O-CA 3.27Å; L796-K799 WeakPolarHBondContact O-CB 3.39Å; L796-K799 PolarHBondContact O-N 2.89Å; L796-V800 PolarHBondContact O-N 2.94Å; L796-Y816 HydrophobicContact CD2-CE2 4.12Å; L796-M817 HydrophobicContact CD2-CE 4.3Å; L796-M817 HydrophobicContact CD2-SD 3.63Å
797	T	96.3	Very high	93.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-54.7	-56	176.2	-51.6	0	0	0	0	110.6	F684 T717 V721 I773 T793 K799 V800 I801	F684-T797 HydrophobicContact CE1-CG2 4.45Å; F684-T797 HydrophobicContact CZ-CG2 4.07Å; T717-T797 HydrophobicContact CG2-CG2 4.33Å; V721-T797 HydrophobicContact CG1-CG2 3.74Å; I773-T797 HydrophobicContact CG2-CG2 4.44Å; T793-T797 WeakPolarHBondContact O-CB 3.37Å; T793-T797 PolarHBondContact O-N 3.4Å; T793-T797 PolarHBondContact O-OG1 3.19Å; T797-K799 PolarHBondContact O-N 3.47Å; T797-V800 PolarHBondContact O-N 3.46Å; T797-I801 HydrophobicContact CG2-CG1 4.36Å; T797-I801 WeakPolarHBondContact O-CG1 3.42Å; T797-I801 PolarHBondContact O-N 3.23Å
798	A	96.6	Very high	93.6	Very high	6 Å²	6	26 Å²	26	5%	0.05	15%	0.15	C	C	.	.	H	α-helix	trans	-57.1	-27.4	178.4	0	0	0	0	0	113.2	C770 I773 L774 L794 L796 Q802	C770-A798 HydrophobicContact CB-CB 4.43Å; I773-A798 HydrophobicContact CB-CB 4.15Å; I773-A798 HydrophobicContact CG2-CB 3.93Å; L774-A798 HydrophobicContact CB-CB 4.24Å; L794-A798 VanDerWaalsContact O-CB 3.22Å; L794-A798 WeakPolarHBondContact O-CB 3.46Å; L794-A798 PolarHBondContact O-N 3.47Å; L796-A798 PolarHBondContact O-N 3Å; A798-Q802 WeakPolarHBondContact O-CB 3.5Å; A798-Q802 PolarHBondContact O-N 2.88Å
799	K	95.5	Very high	93.9	Very high	13 Å²	13	24.5 Å²	24.5	6%	0.057	14%	0.137	C	C	.	.	H	α-helix	trans	-76.9	-39.5	175.3	-175.2	-173.3	-65.9	-168.4	0	112.8	W84 T795 L796 T797 Q802 N803 F810 E814 Y816	W84-K799 HydrophobicContact CH2-CB 4.23Å; W84-K799 VanDerWaalsContact CH2-CE 3.49Å; W84-K799 HydrophobicContact CZ3-CB 4.41Å; T795-K799 WeakPolarHBondContact O-CB 3.45Å; T795-K799 PolarHBondContact O-N 3.3Å; L796-K799 WeakPolarHBondContact O-CA 3.27Å; L796-K799 WeakPolarHBondContact O-CB 3.39Å; L796-K799 PolarHBondContact O-N 2.89Å; T797-K799 PolarHBondContact O-N 3.47Å; K799-Q802 PolarHBondContact O-N 2.77Å; K799-N803 PolarHBondContact O-N 3Å; K799-N803 PolarHBondContact O-ND2 3.09Å; K799-F810 HydrophobicContact CD-CE1 3.8Å; K799-F810 HydrophobicContact CD-CZ 4.41Å; K799-F810 HydrophobicContact CG-CE1 3.95Å; K799-F810 HydrophobicContact CG-CZ 4.24Å; K799-E814 WeakPolarHBondContact CD-OE2 3.28Å; K799-E814 WeakPolarHBondContact CE-OE2 3.29Å; K799-E814 IonicContact NZ-OE1 2.68Å; K799-E814 PolarHBondContact NZ-OE1 3.09Å; K799-E814 IonicContact NZ-OE2 2.74Å; K799-E814 PolarHBondContact NZ-OE2 3.4Å; K799-Y816 PolarHBondContact NZ-OH 2.78Å
800	V	96.6	Very high	94.2	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.3	-51.9	174.4	175.7	0	0	0	0	109.5	C718 L796 T797 Q802 N803 L804 F810 M817 M820 F823 L824	C718-V800 HydrophobicContact CB-CG1 4.2Å; L796-V800 PolarHBondContact O-N 2.94Å; T797-V800 PolarHBondContact O-N 3.46Å; V800-Q802 VanDerWaalsContact C-N 3.27Å; V800-Q802 PolarHBondContact O-N 2.79Å; V800-N803 PolarHBondContact O-N 3.44Å; V800-L804 PolarHBondContact O-N 2.94Å; V800-F810 HydrophobicContact CG2-CE2 4.3Å; V800-F810 HydrophobicContact CG2-CZ 4.17Å; V800-M817 HydrophobicContact CG2-CE 3.59Å; V800-M820 HydrophobicContact CG1-CE 3.78Å; V800-M820 HydrophobicContact CG2-CE 4.1Å; V800-M820 HydrophobicContact CG2-CG 4.21Å; V800-F823 HydrophobicContact CG1-CD1 3.87Å; V800-F823 HydrophobicContact CG1-CE1 3.55Å; V800-L824 HydrophobicContact CG1-CD2 4Å
801	I	96.4	Very high	94.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.6	-39.6	177.4	-53.4	-52.4	0	0	0	111.4	V721 V722 I725 F765 T797 N803 L804 A805	V721-I801 HydrophobicContact CG1-CD1 3.71Å; V721-I801 HydrophobicContact CG1-CG1 3.99Å; V722-I801 HydrophobicContact CG2-CD1 3.32Å; I725-I801 HydrophobicContact CD1-CG2 4.41Å; F765-I801 HydrophobicContact CD1-CG2 3.79Å; F765-I801 HydrophobicContact CE1-CG2 3.89Å; T797-I801 HydrophobicContact CG2-CG1 4.36Å; T797-I801 WeakPolarHBondContact O-CG1 3.42Å; T797-I801 PolarHBondContact O-N 3.23Å; I801-N803 VanDerWaalsContact C-N 3.35Å; I801-N803 PolarHBondContact O-N 3.14Å; I801-L804 PolarHBondContact O-N 3.08Å; I801-A805 WeakPolarHBondContact O-CB 3.43Å; I801-A805 PolarHBondContact O-N 2.91Å
802	Q	94.8	Very high	93.7	Very high	32 Å²	32	31 Å²	31	15%	0.15	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-36.9	176.1	-177.2	65.7	99.5	0	0	113	L766 A798 K799 V800 N806	L766-Q802 VanDerWaalsContact CB-OE1 3.28Å; A798-Q802 WeakPolarHBondContact O-CB 3.5Å; A798-Q802 PolarHBondContact O-N 2.88Å; K799-Q802 PolarHBondContact O-N 2.77Å; V800-Q802 VanDerWaalsContact C-N 3.27Å; V800-Q802 PolarHBondContact O-N 2.79Å; Q802-N806 PolarHBondContact NE2-ND2 3.04Å; Q802-N806 PolarHBondContact O-N 3.28Å; Q802-N806 PolarHBondContact O-ND2 2.98Å
803	N	94.6	Very high	93.3	Very high	27 Å²	27	35.7 Å²	35.7	14%	0.144	20%	0.195	C	C	.	.	H	α-helix	trans	-71.7	-41	177	-86.1	-78	0	0	0	111.6	K799 V800 I801 A805 N806 S807 T808 F810 L824	K799-N803 PolarHBondContact O-N 3Å; K799-N803 PolarHBondContact O-ND2 3.09Å; V800-N803 PolarHBondContact O-N 3.44Å; I801-N803 VanDerWaalsContact C-N 3.35Å; I801-N803 PolarHBondContact O-N 3.14Å; N803-A805 PolarHBondContact O-N 3.46Å; N803-N806 PolarHBondContact O-N 3.03Å; N803-S807 PolarHBondContact O-N 2.76Å; N803-S807 VanDerWaalsContact O-N 3.07Å; N803-T808 WeakPolarHBondContact CB-O 3.29Å; N803-T808 PolarHBondContact O-N 3.24Å; N803-T808 PolarHBondContact OD1-O 3.01Å; N803-T808 PolarHBondContact OD1-OG1 3.41Å; N803-F810 HydrophobicContact CB-CZ 4.31Å; N803-F810 WeakPolarHBondContact ND2-CE1 3.39Å; N803-L824 HydrophobicContact CB-CD1 4.06Å; N803-L824 HydrophobicContact CB-CD2 4.32Å
804	L	95.6	Very high	93.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-55.3	-50.1	173.2	-176.1	62.9	0	0	0	111.3	V722 V800 I801 N806 S807 L824 H827 M831	V722-L804 HydrophobicContact CG1-CD2 4.19Å; V722-L804 HydrophobicContact CG2-CD2 3.6Å; V800-L804 PolarHBondContact O-N 2.94Å; I801-L804 PolarHBondContact O-N 3.08Å; L804-N806 VanDerWaalsContact C-N 3.33Å; L804-N806 PolarHBondContact O-N 3.47Å; L804-S807 PolarHBondContact O-N 2.73Å; L804-L824 HydrophobicContact CB-CD2 3.71Å; L804-L824 HydrophobicContact CD1-CD2 4.26Å; L804-H827 HydrophobicContact CD1-CB 3.64Å; L804-H827 HydrophobicContact CD2-CB 3.98Å; L804-H827 HydrophobicContact CG-CB 4.48Å; L804-M831 HydrophobicContact CD1-CB 4.36Å; L804-M831 HydrophobicContact CD2-CE 3.69Å; L804-M831 HydrophobicContact CG-CB 4.12Å; L804-M831 HydrophobicContact CG-CE 3.98Å; L804-M831 HydrophobicContact CG-CG 4.16Å
805	A	92.8	Very high	92.8	Very high	6 Å²	6	45 Å²	45	5%	0.05	24%	0.238	C	C	.	.	H	α-helix	trans	-69.3	-22.2	179.5	0	0	0	0	0	114.8	S761 F765 I801 N803 M831	S761-A805 PolarHBondContact OG-O 2.77Å; F765-A805 HydrophobicContact CB-CB 3.66Å; F765-A805 HydrophobicContact CD1-CB 3.83Å; F765-A805 HydrophobicContact CD2-CB 3.51Å; F765-A805 HydrophobicContact CE1-CB 4.36Å; F765-A805 HydrophobicContact CE2-CB 4.09Å; F765-A805 HydrophobicContact CG-CB 3.36Å; F765-A805 HydrophobicContact CZ-CB 4.48Å; I801-A805 WeakPolarHBondContact O-CB 3.43Å; I801-A805 PolarHBondContact O-N 2.91Å; N803-A805 PolarHBondContact O-N 3.46Å; A805-M831 HydrophobicContact CB-SD 4.43Å
806	N	90.8	Very high	92.7	Very high	54 Å²	54	46.5 Å²	46.5	29%	0.289	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-4.2	169.9	-75.9	-85.6	0	0	0	112.6	R656 Q802 N803 L804 T808	R656-N806 PolarHBondContact NH2-OD1 3.24Å; Q802-N806 PolarHBondContact NE2-ND2 3.04Å; Q802-N806 PolarHBondContact O-N 3.28Å; Q802-N806 PolarHBondContact O-ND2 2.98Å; N803-N806 PolarHBondContact O-N 3.03Å; L804-N806 VanDerWaalsContact C-N 3.33Å; L804-N806 PolarHBondContact O-N 3.47Å; N806-T808 VanDerWaalsContact C-N 3.27Å; N806-T808 HydrophobicContact CB-CG2 4.05Å; N806-T808 PolarHBondContact O-N 3.37Å
807	S	90.6	Very high	92.6	Very high	71 Å²	71	46.5 Å²	46.5	50%	0.497	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.6	42.9	-167.5	-53.9	0	0	0	0	113.1	N803 L804	N803-S807 PolarHBondContact O-N 2.76Å; N803-S807 VanDerWaalsContact O-N 3.07Å; L804-S807 PolarHBondContact O-N 2.73Å
808	T	92.3	Very high	92.5	Very high	63 Å²	63	49.7 Å²	49.7	39%	0.387	26%	0.259	S	S	.	.			trans	-118.4	136.5	-179.4	53.3	0	0	0	0	112.5	N803 N806	N803-T808 WeakPolarHBondContact CB-O 3.29Å; N803-T808 PolarHBondContact O-N 3.24Å; N803-T808 PolarHBondContact OD1-O 3.01Å; N803-T808 PolarHBondContact OD1-OG1 3.41Å; N806-T808 VanDerWaalsContact C-N 3.27Å; N806-T808 HydrophobicContact CB-CG2 4.05Å; N806-T808 PolarHBondContact O-N 3.37Å
809	L	93.7	Very high	92.4	Very high	70 Å²	70	52.1 Å²	52.1	37%	0.366	27%	0.268	S	S	.	.			trans	-80.9	158	172.1	-66.4	-179.2	0	0	0	112.8	N821 L824 E825 W828	L809-N821 HydrophobicContact CD2-CB 3.83Å; L809-L824 HydrophobicContact CD2-CB 4.11Å; L809-L824 HydrophobicContact CD2-CD1 4.2Å; L809-E825 HydrophobicContact CD2-CG 4.16Å; L809-W828 HydrophobicContact CD1-CH2 4.28Å; L809-W828 HydrophobicContact CD2-CH2 3.71Å; L809-W828 HydrophobicContact CD2-CZ2 3.44Å; L809-W828 VanDerWaalsContact CD2-CZ2 3.44Å; L809-W828 HydrophobicContact CG-CH2 3.96Å; L809-W828 HydrophobicContact CG-CZ2 3.82Å
810	F	95	Very high	92.4	Very high	12 Å²	12	51.5 Å²	51.5	5%	0.053	27%	0.265	C	S	.	.			trans	-70.3	147.4	162.7	-62.2	-76.4	0	0	0	110.4	K799 V800 N803 E814 M817 L818 M820 N821 L824	K799-F810 HydrophobicContact CD-CE1 3.8Å; K799-F810 HydrophobicContact CD-CZ 4.41Å; K799-F810 HydrophobicContact CG-CE1 3.95Å; K799-F810 HydrophobicContact CG-CZ 4.24Å; V800-F810 HydrophobicContact CG2-CE2 4.3Å; V800-F810 HydrophobicContact CG2-CZ 4.17Å; N803-F810 HydrophobicContact CB-CZ 4.31Å; N803-F810 WeakPolarHBondContact ND2-CE1 3.39Å; F810-E814 HydrophobicContact CD1-CB 4.42Å; F810-M817 HydrophobicContact CB-CB 4.02Å; F810-M817 HydrophobicContact CD1-CB 3.51Å; F810-M817 HydrophobicContact CD1-CG 4.04Å; F810-M817 HydrophobicContact CD2-CB 3.77Å; F810-M817 HydrophobicContact CE1-CB 3.83Å; F810-M817 HydrophobicContact CE1-CE 4.18Å; F810-M817 HydrophobicContact CE1-CG 3.96Å; F810-M817 HydrophobicContact CE2-CB 4.07Å; F810-M817 HydrophobicContact CE2-CE 3.93Å; F810-M817 HydrophobicContact CG-CB 3.48Å; F810-M817 VanDerWaalsContact CG-CB 3.48Å; F810-M817 HydrophobicContact CG-CG 4.47Å; F810-M817 HydrophobicContact CZ-CB 4.1Å; F810-M817 HydrophobicContact CZ-CE 3.62Å; F810-M817 HydrophobicContact CZ-CG 4.33Å; F810-L818 HydrophobicContact CB-CD2 4.37Å; F810-L818 VanDerWaalsContact O-CD2 3.28Å; F810-L818 WeakPolarHBondContact O-CD2 3.47Å; F810-M820 HydrophobicContact CD2-CB 4.22Å; F810-M820 HydrophobicContact CE2-CB 3.94Å; F810-N821 WeakPolarHBondContact CB-OD1 3.38Å; F810-N821 WeakPolarHBondContact CD2-OD1 3.44Å; F810-N821 PolarHBondContact N-OD1 2.8Å; F810-N821 PolarHBondContact O-ND2 2.83Å; F810-L824 HydrophobicContact CD2-CD1 3.86Å; F810-L824 HydrophobicContact CE2-CD1 3.82Å
811	G	90.6	Very high	92.4	Very high	38 Å²	38	52.8 Å²	52.8	39%	0.392	27%	0.272	S	S	.	.			trans	-141	-174.8	177.3	0	0	0	0	0	111.3	K813 E814	G811-K813 PolarHBondContact O-N 3.41Å; G811-E814 CarbonylContact O-C 3.59Å; G811-E814 PolarHBondContact O-N 3.25Å
812	E	83.1	Confident	92.4	Very high	185 Å²	185	57.3 Å²	57.3	86%	0.864	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-42.5	-35.6	-168.9	-59.7	178.2	172.1	0	0	116.1	E814 E815	E812-E814 PolarHBondContact O-N 2.76Å; E812-E814 VanDerWaalsContact O-N 3.15Å; E812-E815 PolarHBondContact O-N 3.13Å
813	K	84.1	Confident	92.4	Very high	148 Å²	148	55.8 Å²	55.8	64%	0.643	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-61.1	-23.5	179	-57.4	-170.8	-171.9	-170.4	0	113.7	H77 G811	H77-K813 PolarHBondContact O-NZ 3.35Å; G811-K813 PolarHBondContact O-N 3.41Å
814	E	89.4	Confident	92.5	Very high	57 Å²	57	54.5 Å²	54.5	27%	0.266	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-135	47.9	179.3	-54.8	-139.8	79.7	0	0	110.3	K799 F810 G811 E812 Y816 M817	K799-E814 WeakPolarHBondContact CD-OE2 3.28Å; K799-E814 WeakPolarHBondContact CE-OE2 3.29Å; K799-E814 IonicContact NZ-OE1 2.68Å; K799-E814 PolarHBondContact NZ-OE1 3.09Å; K799-E814 IonicContact NZ-OE2 2.74Å; K799-E814 PolarHBondContact NZ-OE2 3.4Å; F810-E814 HydrophobicContact CD1-CB 4.42Å; G811-E814 CarbonylContact O-C 3.59Å; G811-E814 PolarHBondContact O-N 3.25Å; E812-E814 PolarHBondContact O-N 2.76Å; E812-E814 VanDerWaalsContact O-N 3.15Å; E814-Y816 HydrophobicContact CB-CD1 4.43Å; E814-Y816 HydrophobicContact CB-CE1 3.88Å; E814-Y816 HydrophobicContact CG-CE1 4.39Å; E814-Y816 PolarHBondContact O-N 3.12Å; E814-Y816 PolarHBondContact OE1-OH 3.16Å; E814-M817 HydrophobicContact CB-CG 4.37Å; E814-M817 WeakPolarHBondContact O-CB 3.5Å; E814-M817 PolarHBondContact O-N 2.81Å
815	E	89.9	Confident	92.5	Very high	145 Å²	145	59.6 Å²	59.6	68%	0.678	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-45.2	-38.7	-177.5	-168.4	-177.6	-178.6	0	0	114	E812 M817 L818	E812-E815 PolarHBondContact O-N 3.13Å; E815-M817 PolarHBondContact O-N 3.25Å; E815-L818 HydrophobicContact CB-CD1 4.39Å; E815-L818 HydrophobicContact CG-CD1 3.8Å; E815-L818 WeakPolarHBondContact O-CB 3.16Å; E815-L818 VanDerWaalsContact O-CG 3.26Å; E815-L818 WeakPolarHBondContact O-CG 3.38Å; E815-L818 PolarHBondContact O-N 3.5Å
816	Y	91.9	Very high	92.7	Very high	50 Å²	50	64.5 Å²	64.5	20%	0.196	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-60.6	-15.1	176.8	72.6	-81.4	0	0	0	114.9	V697 D698 L796 K799 E814 F819	V697-Y816 HydrophobicContact CG2-CD2 4.13Å; V697-Y816 HydrophobicContact CG2-CE2 4.46Å; D698-Y816 HydrophobicContact CB-CD2 4.39Å; L796-Y816 HydrophobicContact CD2-CE2 4.12Å; K799-Y816 PolarHBondContact NZ-OH 2.78Å; E814-Y816 HydrophobicContact CB-CD1 4.43Å; E814-Y816 HydrophobicContact CB-CE1 3.88Å; E814-Y816 HydrophobicContact CG-CE1 4.39Å; E814-Y816 PolarHBondContact O-N 3.12Å; E814-Y816 PolarHBondContact OE1-OH 3.16Å; Y816-F819 WeakPolarHBondContact O-CD1 3.5Å; Y816-F819 WeakPolarHBondContact O-CE1 3.42Å
817	M	94.4	Very high	92.9	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-98	-5.3	176.7	-65.3	-61.6	-61.4	0	0	113.9	V697 L714 L796 V800 F810 E814 E815 F819 M820	V697-M817 HydrophobicContact CG2-SD 4Å; L714-M817 HydrophobicContact CD2-CE 4.24Å; L796-M817 HydrophobicContact CD2-CE 4.3Å; L796-M817 HydrophobicContact CD2-SD 3.63Å; V800-M817 HydrophobicContact CG2-CE 3.59Å; F810-M817 HydrophobicContact CB-CB 4.02Å; F810-M817 HydrophobicContact CD1-CB 3.51Å; F810-M817 HydrophobicContact CD1-CG 4.04Å; F810-M817 HydrophobicContact CD2-CB 3.77Å; F810-M817 HydrophobicContact CE1-CB 3.83Å; F810-M817 HydrophobicContact CE1-CE 4.18Å; F810-M817 HydrophobicContact CE1-CG 3.96Å; F810-M817 HydrophobicContact CE2-CB 4.07Å; F810-M817 HydrophobicContact CE2-CE 3.93Å; F810-M817 HydrophobicContact CG-CB 3.48Å; F810-M817 VanDerWaalsContact CG-CB 3.48Å; F810-M817 HydrophobicContact CG-CG 4.47Å; F810-M817 HydrophobicContact CZ-CB 4.1Å; F810-M817 HydrophobicContact CZ-CE 3.62Å; F810-M817 HydrophobicContact CZ-CG 4.33Å; E814-M817 HydrophobicContact CB-CG 4.37Å; E814-M817 WeakPolarHBondContact O-CB 3.5Å; E814-M817 PolarHBondContact O-N 2.81Å; E815-M817 PolarHBondContact O-N 3.25Å; M817-F819 PolarHBondContact O-N 3.37Å; M817-F819 VanDerWaalsContact O-N 3.07Å; M817-M820 HydrophobicContact CE-CG 4.02Å; M817-M820 WeakPolarHBondContact O-CB 3.33Å; M817-M820 PolarHBondContact O-N 3.08Å
818	L	94.1	Very high	93	Very high	67 Å²	67	62.3 Å²	62.3	35%	0.351	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-57.7	-28.6	-173	-72.6	171.9	0	0	0	113.8	F810 E815 M820 N821	F810-L818 HydrophobicContact CB-CD2 4.37Å; F810-L818 VanDerWaalsContact O-CD2 3.28Å; F810-L818 WeakPolarHBondContact O-CD2 3.47Å; E815-L818 HydrophobicContact CB-CD1 4.39Å; E815-L818 HydrophobicContact CG-CD1 3.8Å; E815-L818 WeakPolarHBondContact O-CB 3.16Å; E815-L818 VanDerWaalsContact O-CG 3.26Å; E815-L818 WeakPolarHBondContact O-CG 3.38Å; E815-L818 PolarHBondContact O-N 3.5Å; L818-M820 PolarHBondContact O-N 3.06Å; L818-N821 VanDerWaalsContact O-CB 3.26Å; L818-N821 WeakPolarHBondContact O-CB 3.38Å; L818-N821 PolarHBondContact O-N 2.69Å
819	F	94.6	Very high	93.1	Very high	57 Å²	57	64.3 Å²	64.3	25%	0.25	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-63.4	-22.2	176.1	78.7	-81.6	0	0	0	113.5	V697 Q711 L714 Y816 M817 N821	V697-F819 HydrophobicContact CB-CE1 4.1Å; V697-F819 HydrophobicContact CB-CZ 4.26Å; V697-F819 HydrophobicContact CG1-CE1 4.3Å; V697-F819 HydrophobicContact CG1-CZ 3.97Å; V697-F819 HydrophobicContact CG2-CE1 4.2Å; V697-F819 HydrophobicContact CG2-CZ 4.39Å; Q711-F819 HydrophobicContact CB-CD2 3.96Å; Q711-F819 HydrophobicContact CB-CE2 3.53Å; Q711-F819 HydrophobicContact CB-CZ 3.88Å; Q711-F819 HydrophobicContact CG-CD1 4.12Å; Q711-F819 HydrophobicContact CG-CD2 4.02Å; Q711-F819 HydrophobicContact CG-CE1 3.81Å; Q711-F819 HydrophobicContact CG-CE2 3.69Å; Q711-F819 HydrophobicContact CG-CG 4.23Å; Q711-F819 HydrophobicContact CG-CZ 3.58Å; L714-F819 HydrophobicContact CD2-CZ 4.19Å; Y816-F819 WeakPolarHBondContact O-CD1 3.5Å; Y816-F819 WeakPolarHBondContact O-CE1 3.42Å; M817-F819 PolarHBondContact O-N 3.37Å; M817-F819 VanDerWaalsContact O-N 3.07Å; F819-N821 VanDerWaalsContact C-N 3.29Å
820	M	95.9	Very high	93	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-80.1	-7.4	174.3	-68.6	-58.4	-64.6	0	0	113.1	R715 C718 V800 F810 M817 L818 E822 F823 L824	R715-M820 HydrophobicContact CB-SD 4.24Å; C718-M820 HydrophobicContact CB-CE 4.07Å; V800-M820 HydrophobicContact CG1-CE 3.78Å; V800-M820 HydrophobicContact CG2-CE 4.1Å; V800-M820 HydrophobicContact CG2-CG 4.21Å; F810-M820 HydrophobicContact CD2-CB 4.22Å; F810-M820 HydrophobicContact CE2-CB 3.94Å; M817-M820 HydrophobicContact CE-CG 4.02Å; M817-M820 WeakPolarHBondContact O-CB 3.33Å; M817-M820 PolarHBondContact O-N 3.08Å; L818-M820 PolarHBondContact O-N 3.06Å; M820-E822 PolarHBondContact O-N 3.4Å; M820-F823 HydrophobicContact CE-CB 3.99Å; M820-F823 HydrophobicContact CE-CD1 3.58Å; M820-F823 HydrophobicContact CE-CD2 4.14Å; M820-F823 HydrophobicContact CE-CE1 4.08Å; M820-F823 HydrophobicContact CE-CG 3.64Å; M820-F823 WeakPolarHBondContact O-CB 3.47Å; M820-F823 PolarHBondContact O-N 3.37Å; M820-L824 WeakPolarHBondContact O-CG 3.22Å; M820-L824 PolarHBondContact O-N 3.33Å
821	N	95.8	Very high	93	Very high	27 Å²	27	61.8 Å²	61.8	14%	0.144	31%	0.305	C	S	.	.	H	α-helix	trans	-60.1	-45.7	-179.7	-77.9	-7.7	0	0	0	111.4	L809 F810 L818 F819 F823 L824 E825	L809-N821 HydrophobicContact CD2-CB 3.83Å; F810-N821 WeakPolarHBondContact CB-OD1 3.38Å; F810-N821 WeakPolarHBondContact CD2-OD1 3.44Å; F810-N821 PolarHBondContact N-OD1 2.8Å; F810-N821 PolarHBondContact O-ND2 2.83Å; L818-N821 VanDerWaalsContact O-CB 3.26Å; L818-N821 WeakPolarHBondContact O-CB 3.38Å; L818-N821 PolarHBondContact O-N 2.69Å; F819-N821 VanDerWaalsContact C-N 3.29Å; N821-F823 VanDerWaalsContact C-N 3.28Å; N821-F823 PolarHBondContact O-N 2.91Å; N821-L824 WeakPolarHBondContact O-CA 3.45Å; N821-L824 WeakPolarHBondContact O-CB 3.18Å; N821-L824 PolarHBondContact O-N 3.24Å; N821-E825 WeakPolarHBondContact O-CG 3.49Å; N821-E825 PolarHBondContact O-N 2.93Å
822	E	95.7	Very high	93	Very high	95 Å²	95	64.9 Å²	64.9	44%	0.444	31%	0.305	S	S	.	.	H	α-helix	trans	-53.6	-42.1	176.7	-169	-146.1	123.6	0	0	112.8	R715 M820 E825 Q826	R715-E822 IonicContact CZ-OE1 3.48Å; R715-E822 IonicContact NH1-OE1 2.68Å; R715-E822 PolarHBondContact NH1-OE1 3.26Å; R715-E822 VanDerWaalsContact NH1-OE1 3.14Å; R715-E822 IonicContact NH1-OE2 3.46Å; R715-E822 PolarHBondContact NH1-OE2 2.9Å; R715-E822 IonicContact NH2-OE1 2.65Å; R715-E822 PolarHBondContact NH2-OE1 3.19Å; M820-E822 PolarHBondContact O-N 3.4Å; E822-E825 PolarHBondContact O-N 3.21Å; E822-Q826 VanDerWaalsContact O-CG 3.28Å; E822-Q826 WeakPolarHBondContact O-CG 3.26Å; E822-Q826 PolarHBondContact O-N 2.89Å; E822-Q826 VanDerWaalsContact O-N 3.14Å; E822-Q826 PolarHBondContact OE1-NE2 3.45Å
823	F	96.3	Very high	93.4	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-66.2	-38	175	167.1	-79.9	0	0	0	112.1	R715 C718 E719 V722 V800 M820 N821 H827	R715-F823 HydrophobicContact CG-CD2 3.89Å; C718-F823 HydrophobicContact CB-CE1 3.93Å; C718-F823 HydrophobicContact CB-CE2 3.93Å; C718-F823 HydrophobicContact CB-CZ 3.43Å; C718-F823 VanDerWaalsContact CB-CZ 3.43Å; E719-F823 HydrophobicContact CB-CE2 4.32Å; E719-F823 WeakPolarHBondContact OE2-CE2 3.41Å; V722-F823 HydrophobicContact CB-CZ 4.41Å; V722-F823 HydrophobicContact CG2-CE1 4.19Å; V722-F823 HydrophobicContact CG2-CZ 3.74Å; V800-F823 HydrophobicContact CG1-CD1 3.87Å; V800-F823 HydrophobicContact CG1-CE1 3.55Å; M820-F823 HydrophobicContact CE-CB 3.99Å; M820-F823 HydrophobicContact CE-CD1 3.58Å; M820-F823 HydrophobicContact CE-CD2 4.14Å; M820-F823 HydrophobicContact CE-CE1 4.08Å; M820-F823 HydrophobicContact CE-CG 3.64Å; M820-F823 WeakPolarHBondContact O-CB 3.47Å; M820-F823 PolarHBondContact O-N 3.37Å; N821-F823 VanDerWaalsContact C-N 3.28Å; N821-F823 PolarHBondContact O-N 2.91Å; F823-H827 AromaticContact CD2-CD2 3.83Å; F823-H827 AromaticContact CE2-CD2 3.64Å; F823-H827 AromaticContact CE2-NE2 3.74Å; F823-H827 AromaticContact CZ-CD2 3.76Å; F823-H827 PolarHBondContact O-CD2 3.36Å; F823-H827 PolarHBondContact O-N 2.89Å
824	L	96.1	Very high	93.8	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.9	-40.7	175.1	-64.5	174.6	0	0	0	111.2	V800 N803 L804 L809 F810 M820 N821 H827 W828	V800-L824 HydrophobicContact CG1-CD2 4Å; N803-L824 HydrophobicContact CB-CD1 4.06Å; N803-L824 HydrophobicContact CB-CD2 4.32Å; L804-L824 HydrophobicContact CB-CD2 3.71Å; L804-L824 HydrophobicContact CD1-CD2 4.26Å; L809-L824 HydrophobicContact CD2-CB 4.11Å; L809-L824 HydrophobicContact CD2-CD1 4.2Å; F810-L824 HydrophobicContact CD2-CD1 3.86Å; F810-L824 HydrophobicContact CE2-CD1 3.82Å; M820-L824 WeakPolarHBondContact O-CG 3.22Å; M820-L824 PolarHBondContact O-N 3.33Å; N821-L824 WeakPolarHBondContact O-CA 3.45Å; N821-L824 WeakPolarHBondContact O-CB 3.18Å; N821-L824 PolarHBondContact O-N 3.24Å; L824-H827 PolarHBondContact O-N 2.73Å; L824-W828 VanDerWaalsContact O-CD1 3.28Å; L824-W828 VanDerWaalsContact O-CG 3.26Å; L824-W828 PolarHBondContact O-N 2.93Å; L824-W828 PolarHBondContact O-NE1 2.83Å
825	E	95.8	Very high	93.9	Very high	107 Å²	107	50.1 Å²	50.1	50%	0.5	25%	0.245	S	C	.	.	H	α-helix	trans	-65.8	-39.7	179.8	-44	-151.7	123.9	0	0	111.8	L809 N821 E822 H827 W828	L809-E825 HydrophobicContact CD2-CG 4.16Å; N821-E825 WeakPolarHBondContact O-CG 3.49Å; N821-E825 PolarHBondContact O-N 2.93Å; E822-E825 PolarHBondContact O-N 3.21Å; E825-H827 VanDerWaalsContact C-N 3.32Å; E825-H827 PolarHBondContact O-N 3.02Å; E825-W828 HydrophobicContact CB-CE3 4.08Å; E825-W828 HydrophobicContact CB-CH2 4.13Å; E825-W828 HydrophobicContact CB-CZ3 3.74Å; E825-W828 HydrophobicContact CG-CE3 4.49Å; E825-W828 HydrophobicContact CG-CH2 3.63Å; E825-W828 HydrophobicContact CG-CZ2 4.33Å; E825-W828 HydrophobicContact CG-CZ3 3.73Å; E825-W828 WeakPolarHBondContact OE1-CH2 3.13Å
826	Q	96.2	Very high	93.9	Very high	109 Å²	109	48.4 Å²	48.4	51%	0.509	24%	0.237	S	C	.	.	H	α-helix	trans	-63.1	-33.7	178.1	-74.8	161.1	1.2	0	0	113.4	E822	E822-Q826 VanDerWaalsContact O-CG 3.28Å; E822-Q826 WeakPolarHBondContact O-CG 3.26Å; E822-Q826 PolarHBondContact O-N 2.89Å; E822-Q826 VanDerWaalsContact O-N 3.14Å; E822-Q826 PolarHBondContact OE1-NE2 3.45Å
827	H	95.4	Very high	93.9	Very high	23 Å²	23	47.6 Å²	47.6	11%	0.106	24%	0.237	C	C	.	.	H	α-helix	trans	-101.3	-3.2	-172.3	-77.1	-66.1	0	0	0	115	E719 V722 L804 F823 L824 E825 D829 G830 M831	E719-H827 VanDerWaalsContact CD-NE2 3.31Å; E719-H827 IonicContact OE1-CE1 2.66Å; E719-H827 PolarHBondContact OE1-CE1 3.39Å; E719-H827 IonicContact OE1-NE2 2.9Å; E719-H827 PolarHBondContact OE1-NE2 2.96Å; E719-H827 IonicContact OE2-CE1 2.82Å; E719-H827 IonicContact OE2-NE2 3.85Å; E719-H827 PolarHBondContact OE2-NE2 3.17Å; V722-H827 HydrophobicContact CG1-CB 4.31Å; L804-H827 HydrophobicContact CD1-CB 3.64Å; L804-H827 HydrophobicContact CD2-CB 3.98Å; L804-H827 HydrophobicContact CG-CB 4.48Å; F823-H827 AromaticContact CD2-CD2 3.83Å; F823-H827 AromaticContact CE2-CD2 3.64Å; F823-H827 AromaticContact CE2-NE2 3.74Å; F823-H827 AromaticContact CZ-CD2 3.76Å; F823-H827 PolarHBondContact O-CD2 3.36Å; F823-H827 PolarHBondContact O-N 2.89Å; L824-H827 PolarHBondContact O-N 2.73Å; E825-H827 VanDerWaalsContact C-N 3.32Å; E825-H827 PolarHBondContact O-N 3.02Å; H827-D829 PolarHBondContact O-N 3.42Å; H827-G830 PolarHBondContact O-N 3.29Å; H827-M831 WeakPolarHBondContact O-CB 3.46Å; H827-M831 PolarHBondContact O-N 3.12Å
828	W	93.5	Very high	93.7	Very high	56 Å²	56	47.6 Å²	47.6	21%	0.212	24%	0.237	C	C	.	.	H	α-helix	trans	-60.3	-43.8	-176.5	-79.1	-32.8	0	0	0	114.4	L809 L824 E825 M831 R832	L809-W828 HydrophobicContact CD1-CH2 4.28Å; L809-W828 HydrophobicContact CD2-CH2 3.71Å; L809-W828 HydrophobicContact CD2-CZ2 3.44Å; L809-W828 VanDerWaalsContact CD2-CZ2 3.44Å; L809-W828 HydrophobicContact CG-CH2 3.96Å; L809-W828 HydrophobicContact CG-CZ2 3.82Å; L824-W828 VanDerWaalsContact O-CD1 3.28Å; L824-W828 VanDerWaalsContact O-CG 3.26Å; L824-W828 PolarHBondContact O-N 2.93Å; L824-W828 PolarHBondContact O-NE1 2.83Å; E825-W828 HydrophobicContact CB-CE3 4.08Å; E825-W828 HydrophobicContact CB-CH2 4.13Å; E825-W828 HydrophobicContact CB-CZ3 3.74Å; E825-W828 HydrophobicContact CG-CE3 4.49Å; E825-W828 HydrophobicContact CG-CH2 3.63Å; E825-W828 HydrophobicContact CG-CZ2 4.33Å; E825-W828 HydrophobicContact CG-CZ3 3.73Å; E825-W828 WeakPolarHBondContact OE1-CH2 3.13Å; W828-M831 PolarHBondContact O-N 2.91Å; W828-R832 PolarHBondContact O-N 3.48Å
829	D	93.1	Very high	93.5	Very high	104 Å²	104	45 Å²	45	56%	0.556	23%	0.225	S	C	*	.	H	α-helix	trans	-74.3	-33.8	-176.2	-67.9	-28.5	0	0	0	111.6	H827 R832 C833	H827-D829 PolarHBondContact O-N 3.42Å; D829-R832 PolarHBondContact O-N 2.96Å; D829-R832 IonicContact OD1-CZ 3.84Å; D829-R832 IonicContact OD1-NH1 3.18Å; D829-R832 PolarHBondContact OD1-NH1 3.29Å; D829-R832 IonicContact OD1-NH2 3.76Å; D829-R832 PolarHBondContact OD1-NH2 3.05Å; D829-C833 WeakPolarHBondContact O-CB 3.34Å; D829-C833 PolarHBondContact O-N 3.15Å
830	G	93	Very high	93.2	Very high	27 Å²	27	45.5 Å²	45.5	28%	0.278	23%	0.23	S	C	.	.	H	α-helix	trans	-63	-43.5	169.4	0	0	0	0	0	112.2	H827 R832 C833 F834	H827-G830 PolarHBondContact O-N 3.29Å; G830-R832 PolarHBondContact O-N 2.91Å; G830-C833 PolarHBondContact O-N 3.36Å; G830-F834 WeakPolarHBondContact O-CB 3.27Å; G830-F834 PolarHBondContact O-N 2.82Å
831	M	94.2	Very high	92.3	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.015	25%	0.252	C	S	.	.	H	α-helix	trans	-63.1	-38.6	173.7	-179.4	56.2	58.7	0	0	112.4	F765 L804 A805 H827 W828 F834 L835	F765-M831 HydrophobicContact CE1-CE 3.93Å; F765-M831 HydrophobicContact CE1-SD 4.19Å; F765-M831 HydrophobicContact CE2-CE 4.42Å; F765-M831 HydrophobicContact CE2-SD 3.6Å; F765-M831 HydrophobicContact CZ-CE 3.61Å; F765-M831 HydrophobicContact CZ-SD 3.36Å; F765-M831 WeakPolarHBondContact CZ-SD 3.39Å; L804-M831 HydrophobicContact CD1-CB 4.36Å; L804-M831 HydrophobicContact CD2-CE 3.69Å; L804-M831 HydrophobicContact CG-CB 4.12Å; L804-M831 HydrophobicContact CG-CE 3.98Å; L804-M831 HydrophobicContact CG-CG 4.16Å; A805-M831 HydrophobicContact CB-SD 4.43Å; H827-M831 WeakPolarHBondContact O-CB 3.46Å; H827-M831 PolarHBondContact O-N 3.12Å; W828-M831 PolarHBondContact O-N 2.91Å; M831-F834 HydrophobicContact SD-CD1 4.19Å; M831-L835 HydrophobicContact CG-CD1 4.41Å; M831-L835 WeakPolarHBondContact O-CB 3.49Å; M831-L835 WeakPolarHBondContact O-CG 3.47Å; M831-L835 PolarHBondContact O-N 2.76Å; M831-L835 HydrophobicContact SD-CD1 4.46Å; M831-L835 HydrophobicContact SD-CG 4.44Å
832	R	91.1	Very high	91.3	Very high	102 Å²	102	55.9 Å²	55.9	39%	0.385	28%	0.283	S	S	.	.	H	α-helix	trans	-66.7	-43.8	175.7	-162.5	-174.3	-53.3	110.6	16.5	111.5	W828 D829 G830 L835 Q836	W828-R832 PolarHBondContact O-N 3.48Å; D829-R832 PolarHBondContact O-N 2.96Å; D829-R832 IonicContact OD1-CZ 3.84Å; D829-R832 IonicContact OD1-NH1 3.18Å; D829-R832 PolarHBondContact OD1-NH1 3.29Å; D829-R832 IonicContact OD1-NH2 3.76Å; D829-R832 PolarHBondContact OD1-NH2 3.05Å; G830-R832 PolarHBondContact O-N 2.91Å; R832-L835 PolarHBondContact O-N 2.76Å; R832-Q836 WeakPolarHBondContact O-CG 3.45Å; R832-Q836 PolarHBondContact O-N 3.24Å; R832-Q836 PolarHBondContact O-OE1 3.22Å
833	C	91.7	Very high	90.3	Very high	69 Å²	69	53.7 Å²	53.7	47%	0.466	28%	0.276	S	S	.	.	H	α-helix	trans	-60.7	-48.9	175.8	-174.7	0	0	0	0	111.4	D829 G830 L835 Q836 T837	D829-C833 WeakPolarHBondContact O-CB 3.34Å; D829-C833 PolarHBondContact O-N 3.15Å; G830-C833 PolarHBondContact O-N 3.36Å; C833-L835 VanDerWaalsContact C-N 3.33Å; C833-L835 PolarHBondContact O-N 2.92Å; C833-Q836 PolarHBondContact O-N 3.17Å; C833-Q836 VanDerWaalsContact O-N 3.15Å; C833-T837 WeakPolarHBondContact O-CB 3.19Å; C833-T837 PolarHBondContact O-N 2.82Å; C833-T837 PolarHBondContact O-OG1 3.46Å; C833-T837 VanDerWaalsContact O-OG1 3.09Å
834	F	92.1	Very high	89	Confident	3 Å²	3	63.3 Å²	63.3	1%	0.013	32%	0.321	C	S	.	.	H	α-helix	trans	-54.4	-47.6	174	168.6	-101.7	0	0	0	112.1	I725 I726 I728 L764 F765 G830 M831 Q836 T837 V838	I725-F834 HydrophobicContact CG2-CD1 4.12Å; I725-F834 HydrophobicContact CG2-CD2 4.45Å; I725-F834 HydrophobicContact CG2-CE1 3.7Å; I725-F834 HydrophobicContact CG2-CE2 4.06Å; I725-F834 HydrophobicContact CG2-CG 4.49Å; I725-F834 HydrophobicContact CG2-CZ 3.66Å; I725-F834 WeakPolarHBondContact O-CD2 3.46Å; I725-F834 WeakPolarHBondContact O-CE2 3.24Å; I726-F834 HydrophobicContact CG1-CB 4.3Å; I728-F834 HydrophobicContact CD1-CD2 4.22Å; I728-F834 HydrophobicContact CD1-CE2 4.34Å; I728-F834 HydrophobicContact CG1-CD2 3.95Å; I728-F834 HydrophobicContact CG1-CE2 4.02Å; L764-F834 HydrophobicContact CD2-CE1 3.66Å; L764-F834 HydrophobicContact CD2-CZ 3.82Å; F765-F834 HydrophobicContact CE2-CD1 4.29Å; F765-F834 AromaticContact CE2-CE1 3.88Å; F765-F834 HydrophobicContact CE2-CE1 3.88Å; F765-F834 HydrophobicContact CZ-CD1 4.07Å; F765-F834 AromaticContact CZ-CE1 3.66Å; F765-F834 HydrophobicContact CZ-CE1 3.66Å; G830-F834 WeakPolarHBondContact O-CB 3.27Å; G830-F834 PolarHBondContact O-N 2.82Å; M831-F834 HydrophobicContact SD-CD1 4.19Å; F834-Q836 VanDerWaalsContact C-N 3.31Å; F834-Q836 PolarHBondContact O-N 2.88Å; F834-T837 PolarHBondContact O-N 3.05Å; F834-V838 HydrophobicContact CD2-CG1 4.05Å; F834-V838 HydrophobicContact CE2-CG1 3.56Å; F834-V838 HydrophobicContact CZ-CG1 3.83Å; F834-V838 WeakPolarHBondContact O-CG2 3.25Å; F834-V838 PolarHBondContact O-N 3.23Å
835	L	91.8	Very high	88	Confident	9 Å²	9	64.3 Å²	64.3	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-62	-35.2	178.4	-78.5	169.9	0	0	0	113.3	Q757 I760 F765 M831 R832 C833 S839	Q757-L835 HydrophobicContact CG-CB 4.38Å; Q757-L835 HydrophobicContact CG-CD1 4.25Å; I760-L835 HydrophobicContact CG2-CD2 3.99Å; F765-L835 HydrophobicContact CE2-CD2 4.03Å; M831-L835 HydrophobicContact CG-CD1 4.41Å; M831-L835 WeakPolarHBondContact O-CB 3.49Å; M831-L835 WeakPolarHBondContact O-CG 3.47Å; M831-L835 PolarHBondContact O-N 2.76Å; M831-L835 HydrophobicContact SD-CD1 4.46Å; M831-L835 HydrophobicContact SD-CG 4.44Å; R832-L835 PolarHBondContact O-N 2.76Å; C833-L835 VanDerWaalsContact C-N 3.33Å; C833-L835 PolarHBondContact O-N 2.92Å; L835-S839 WeakPolarHBondContact O-CB 2.98Å; L835-S839 PolarHBondContact O-OG 2.82Å; L835-S839 VanDerWaalsContact O-OG 3.05Å
836	Q	90.3	Very high	87	Confident	108 Å²	108	63.2 Å²	63.2	51%	0.505	33%	0.328	S	S	.	.	H	α-helix	trans	-72.6	-44.3	175.4	-71	170.6	-52	0	0	111.6	R832 C833 F834 S839 N840	R832-Q836 WeakPolarHBondContact O-CG 3.45Å; R832-Q836 PolarHBondContact O-N 3.24Å; R832-Q836 PolarHBondContact O-OE1 3.22Å; C833-Q836 PolarHBondContact O-N 3.17Å; C833-Q836 VanDerWaalsContact O-N 3.15Å; F834-Q836 VanDerWaalsContact C-N 3.31Å; F834-Q836 PolarHBondContact O-N 2.88Å; Q836-S839 CarbonylContact O-C 3.58Å; Q836-S839 PolarHBondContact O-N 2.75Å; Q836-S839 VanDerWaalsContact O-N 3.15Å; Q836-S839 PolarHBondContact O-OG 3.14Å; Q836-N840 PolarHBondContact O-N 3.33Å
837	T	90.2	Very high	86.3	Confident	33 Å²	33	61.1 Å²	61.1	20%	0.202	32%	0.319	C	S	.	.	H	α-helix	trans	-56	-52.7	177	-69.5	0	0	0	0	111.3	I728 C833 F834 S839 N840 T843 I845	I728-T837 HydrophobicContact CD1-CG2 3.48Å; I728-T837 VanDerWaalsContact CD1-CG2 3.48Å; C833-T837 WeakPolarHBondContact O-CB 3.19Å; C833-T837 PolarHBondContact O-N 2.82Å; C833-T837 PolarHBondContact O-OG1 3.46Å; C833-T837 VanDerWaalsContact O-OG1 3.09Å; F834-T837 PolarHBondContact O-N 3.05Å; T837-S839 PolarHBondContact O-N 3.47Å; T837-S839 VanDerWaalsContact O-N 3.13Å; T837-N840 PolarHBondContact O-N 2.93Å; T837-T843 HydrophobicContact CG2-CG2 4.02Å; T837-I845 HydrophobicContact CG2-CD1 3.5Å; T837-I845 HydrophobicContact CG2-CG1 3.84Å; T837-I845 WeakPolarHBondContact O-CD1 3.16Å
838	V	91.1	Very high	85.6	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-6.9	-179.6	-56.6	0	0	0	0	114.4	I728 F732 N737 L764 F834	I728-V838 HydrophobicContact CD1-CG1 4.2Å; F732-V838 HydrophobicContact CD1-CB 4.42Å; F732-V838 HydrophobicContact CD2-CG1 4.01Å; F732-V838 HydrophobicContact CE1-CB 3.96Å; F732-V838 HydrophobicContact CE1-CG1 4.43Å; F732-V838 HydrophobicContact CE2-CB 4.09Å; F732-V838 HydrophobicContact CE2-CG1 3.9Å; F732-V838 HydrophobicContact CG-CG1 4.33Å; F732-V838 HydrophobicContact CZ-CB 3.79Å; F732-V838 HydrophobicContact CZ-CG1 4.13Å; F732-V838 HydrophobicContact CZ-CG2 4.39Å; N737-V838 PolarHBondContact ND2-O 3.19Å; L764-V838 HydrophobicContact CD2-CG2 4.18Å; F834-V838 HydrophobicContact CD2-CG1 4.05Å; F834-V838 HydrophobicContact CE2-CG1 3.56Å; F834-V838 HydrophobicContact CZ-CG1 3.83Å; F834-V838 WeakPolarHBondContact O-CG2 3.25Å; F834-V838 PolarHBondContact O-N 3.23Å
839	S	90.5	Very high	85	Confident	13 Å²	13	62.4 Å²	62.4	9%	0.091	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.9	21.4	178.9	78.9	0	0	0	0	114	S741 L835 Q836 T837	S741-S839 WeakPolarHBondContact CA-O 3.1Å; S741-S839 PolarHBondContact OG-O 3.28Å; L835-S839 WeakPolarHBondContact O-CB 2.98Å; L835-S839 PolarHBondContact O-OG 2.82Å; L835-S839 VanDerWaalsContact O-OG 3.05Å; Q836-S839 CarbonylContact O-C 3.58Å; Q836-S839 PolarHBondContact O-N 2.75Å; Q836-S839 VanDerWaalsContact O-N 3.15Å; Q836-S839 PolarHBondContact O-OG 3.14Å; T837-S839 PolarHBondContact O-N 3.47Å; T837-S839 VanDerWaalsContact O-N 3.13Å
840	N	86.7	Confident	84.4	Confident	68 Å²	68	59.6 Å²	59.6	36%	0.364	32%	0.32	S	S	.	.			trans	-123.5	136.6	172.8	-179.3	15.3	0	0	0	109.6	N737 S741 Q836 T837 D842 T843	N737-N840 PolarHBondContact ND2-O 3.23Å; S741-N840 PolarHBondContact OG-N 3.29Å; Q836-N840 PolarHBondContact O-N 3.33Å; T837-N840 PolarHBondContact O-N 2.93Å; N840-D842 PolarHBondContact OD1-N 2.9Å; N840-D842 VanDerWaalsContact OD1-N 3.11Å; N840-T843 WeakPolarHBondContact CB-OG1 3.19Å; N840-T843 PolarHBondContact ND2-OG1 2.88Å
841	Q	78.2	Confident	83.3	Confident	97 Å²	97	61.9 Å²	61.9	45%	0.453	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-24.9	179.2	-59.5	-172.9	73.3	0	0	112.3	S741 T843	S741-Q841 WeakPolarHBondContact OG-CG 3.34Å; Q841-T843 VanDerWaalsContact C-N 3.28Å; Q841-T843 PolarHBondContact O-N 3.4Å
842	D	75	Confident	82.2	Confident	147 Å²	147	62.8 Å²	62.8	79%	0.786	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	6.7	-174.8	-61	-32	0	0	0	113.8	N840	N840-D842 PolarHBondContact OD1-N 2.9Å; N840-D842 VanDerWaalsContact OD1-N 3.11Å
843	T	73.2	Confident	81.5	Confident	50 Å²	50	62 Å²	62	31%	0.307	33%	0.334	S	S	.	.	S	Bend	trans	-97	127.4	-174.8	-41.9	0	0	0	0	111.8	T837 N840 Q841 I845	T837-T843 HydrophobicContact CG2-CG2 4.02Å; N840-T843 WeakPolarHBondContact CB-OG1 3.19Å; N840-T843 PolarHBondContact ND2-OG1 2.88Å; Q841-T843 VanDerWaalsContact C-N 3.28Å; Q841-T843 PolarHBondContact O-N 3.4Å; T843-I845 HydrophobicContact CG2-CD1 4.5Å; T843-I845 HydrophobicContact CG2-CG1 4.01Å; T843-I845 PolarHBondContact O-N 3.32Å
844	E	69.8	Low	81.1	Confident	201 Å²	201	59.3 Å²	59.3	94%	0.939	32%	0.315	S	S	*	.			trans	-71.8	69.7	178.5	-63.7	-175.9	170.4	0	0	112.6
845	I	75.3	Confident	80.8	Confident	22 Å²	22	59.8 Å²	59.8	11%	0.113	32%	0.318	C	S	.	.			trans	-92.6	145.6	173.1	-50.3	169.9	0	0	0	108.6	I728 F732 T837 T843 M847	I728-I845 HydrophobicContact CD1-CD1 4.35Å; I728-I845 HydrophobicContact CD1-CG1 4.5Å; I728-I845 HydrophobicContact CD1-CG2 4.21Å; I728-I845 HydrophobicContact CG2-CG2 3.93Å; F732-I845 HydrophobicContact CB-CG2 4.18Å; T837-I845 HydrophobicContact CG2-CD1 3.5Å; T837-I845 HydrophobicContact CG2-CG1 3.84Å; T837-I845 WeakPolarHBondContact O-CD1 3.16Å; T843-I845 HydrophobicContact CG2-CD1 4.5Å; T843-I845 HydrophobicContact CG2-CG1 4.01Å; T843-I845 PolarHBondContact O-N 3.32Å; I845-M847 HydrophobicContact CB-CG 4.46Å; I845-M847 HydrophobicContact CB-SD 3.94Å; I845-M847 HydrophobicContact CG2-SD 4.06Å; I845-M847 WeakPolarHBondContact O-CG 3.42Å; I845-M847 PolarHBondContact O-N 2.73Å; I845-M847 VanDerWaalsContact O-N 3.09Å
846	P	75.6	Confident	80.8	Confident	84 Å²	84	61 Å²	61	55%	0.545	33%	0.325	S	S	.	.			trans	-61.5	110.5	162.8	-21.8	34.1	0	0	0	110.3	S731 F732	S731-P846 CarbonylContact C-O 3.33Å; S731-P846 WeakPolarHBondContact CA-O 3.34Å; S731-P846 WeakPolarHBondContact CB-O 3.37Å; F732-P846 PolarHBondContact N-O 3.01Å
847	M	81.3	Confident	80.8	Confident	65 Å²	65	56 Å²	56	32%	0.32	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	148.7	-177.3	-62	-59.9	-103.4	0	0	112	F732 N737 I845	F732-M847 HydrophobicContact CB-SD 3.92Å; F732-M847 HydrophobicContact CD1-CE 4.29Å; F732-M847 HydrophobicContact CD1-SD 4.41Å; F732-M847 WeakPolarHBondContact O-CA 3.33Å; N737-M847 HydrophobicContact CB-CE 3.3Å; I845-M847 HydrophobicContact CB-CG 4.46Å; I845-M847 HydrophobicContact CB-SD 3.94Å; I845-M847 HydrophobicContact CG2-SD 4.06Å; I845-M847 WeakPolarHBondContact O-CG 3.42Å; I845-M847 PolarHBondContact O-N 2.73Å; I845-M847 VanDerWaalsContact O-N 3.09Å
848	T	80.8	Confident	80.9	Confident	40 Å²	40	55.6 Å²	55.6	25%	0.245	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	127.3	167.1	45	0	0	0	0	110.3	K675 F732 P733 E734	K675-T848 HydrophobicContact CD-CG2 4.48Å; F732-T848 PolarHBondContact O-N 3.2Å; P733-T848 WeakPolarHBondContact CA-O 3.39Å; E734-T848 PolarHBondContact N-O 3.25Å
849	S	80.4	Confident	81	Confident	66 Å²	66	59.2 Å²	59.2	46%	0.462	31%	0.312	S	S	.	.			trans	-71.6	156.5	167.3	57.4	0	0	0	0	111.4	D851	S849-D851 PolarHBondContact O-N 3.06Å
850	F	81.1	Confident	81.2	Confident	44 Å²	44	58.6 Å²	58.6	19%	0.193	31%	0.308	C	S	.	.			trans	-63.3	119.1	170.1	174.5	-101.4	0	0	0	111.5	Q627 L671 V672 E735 G852 V854	Q627-F850 HydrophobicContact CG-CD1 4.29Å; Q627-F850 HydrophobicContact CG-CE1 4.09Å; L671-F850 HydrophobicContact CD1-CE2 3.62Å; L671-F850 HydrophobicContact CD1-CZ 3.73Å; L671-F850 HydrophobicContact CG-CD2 4.46Å; L671-F850 HydrophobicContact CG-CE2 3.84Å; L671-F850 HydrophobicContact CG-CZ 4.11Å; L671-F850 WeakPolarHBondContact O-CD2 3.48Å; L671-F850 VanDerWaalsContact O-CE2 3.29Å; L671-F850 WeakPolarHBondContact O-CE2 3.3Å; V672-F850 HydrophobicContact CB-CB 4.23Å; V672-F850 HydrophobicContact CB-CD2 4.32Å; V672-F850 HydrophobicContact CG1-CB 3.85Å; V672-F850 HydrophobicContact CG1-CD2 3.94Å; V672-F850 HydrophobicContact CG1-CG 4.04Å; E735-F850 PolarHBondContact OE1-N 2.94Å; E735-F850 PolarHBondContact OE2-N 2.89Å; F850-G852 WeakPolarHBondContact CE1-O 3.29Å; F850-G852 WeakPolarHBondContact CZ-O 3.23Å; F850-V854 HydrophobicContact CE1-CG2 4.27Å; F850-V854 HydrophobicContact CZ-CG2 4.06Å
851	D	68.3	Low	81.6	Confident	76 Å²	76	55.5 Å²	55.5	41%	0.406	29%	0.291	S	S	.	.			trans	-107.9	-0.6	-173.6	70.6	-30.8	0	0	0	113.5	A391 R395 S849	A391-D851 VanDerWaalsContact CB-OD1 3.3Å; A391-D851 WeakPolarHBondContact CB-OD1 3.47Å; R395-D851 IonicContact CZ-OD2 3.95Å; R395-D851 PolarHBondContact NE-O 2.87Å; R395-D851 VanDerWaalsContact NH2-CB 3.3Å; R395-D851 PolarHBondContact NH2-O 2.9Å; R395-D851 IonicContact NH2-OD1 2.63Å; R395-D851 IonicContact NH2-OD2 3.09Å; R395-D851 PolarHBondContact NH2-OD2 3.29Å; S849-D851 PolarHBondContact O-N 3.06Å
852	G	71.8	Confident	82.2	Confident	22 Å²	22	52.7 Å²	52.7	23%	0.227	28%	0.281	C	S	.	.			trans	-78.6	161.1	-179.7	0	0	0	0	0	113.9	F850	F850-G852 WeakPolarHBondContact CE1-O 3.29Å; F850-G852 WeakPolarHBondContact CZ-O 3.23Å
853	Y	77	Confident	83.2	Confident	85 Å²	85	45.7 Å²	45.7	33%	0.333	24%	0.243	S	C	.	.			trans	-98.2	148.5	172.7	177.9	-101.1	0	0	0	112.3	E398 R402 D855	E398-Y853 HydrophobicContact CB-CD1 4.12Å; E398-Y853 HydrophobicContact CG-CD1 3.53Å; E398-Y853 HydrophobicContact CG-CE1 3.55Å; E398-Y853 HydrophobicContact CG-CG 4.19Å; E398-Y853 WeakPolarHBondContact OE1-CE1 3.44Å; R402-Y853 PolarHBondContact NH2-OH 2.67Å; Y853-D855 HydrophobicContact CE1-CB 3.86Å
854	V	83.3	Confident	84.2	Confident	12 Å²	12	43.6 Å²	43.6	7%	0.073	23%	0.23	C	C	.	.			trans	-133.9	117	174.4	-179.6	0	0	0	0	110.4	H624 F850 L856 R859	H624-V854 HydrophobicContact CB-CG1 4.19Å; H624-V854 WeakPolarHBondContact O-CG1 3.33Å; F850-V854 HydrophobicContact CE1-CG2 4.27Å; F850-V854 HydrophobicContact CZ-CG2 4.06Å; V854-L856 PolarHBondContact O-N 2.62Å; V854-R859 HydrophobicContact CG1-CG 3.63Å
855	D	85.8	Confident	85.3	Confident	14 Å²	14	34.7 Å²	34.7	8%	0.075	19%	0.192	C	C	.	.			trans	-70.2	92.1	-176.6	-171.5	-36.9	0	0	0	112.1	K408 R413 Y853 P857 L858 R859	K408-D855 IonicContact NZ-OD2 3.86Å; K408-D855 PolarHBondContact NZ-OD2 2.93Å; R413-D855 IonicContact CZ-OD1 3.46Å; R413-D855 IonicContact CZ-OD2 2.83Å; R413-D855 IonicContact NH2-OD1 3.78Å; R413-D855 PolarHBondContact NH2-OD1 2.93Å; R413-D855 IonicContact NH2-OD2 3.66Å; R413-D855 PolarHBondContact NH2-OD2 2.65Å; Y853-D855 HydrophobicContact CE1-CB 3.86Å; D855-P857 WeakPolarHBondContact OD1-CD 3.29Å; D855-L858 HydrophobicContact CB-CB 3.98Å; D855-L858 HydrophobicContact CB-CD2 4.41Å; D855-L858 PolarHBondContact O-N 2.86Å; D855-L858 VanDerWaalsContact OD1-CB 3.31Å; D855-L858 WeakPolarHBondContact OD1-CB 3.25Å; D855-L858 PolarHBondContact OD1-N 3.49Å; D855-L858 VanDerWaalsContact OD1-N 3.12Å; D855-R859 WeakPolarHBondContact O-CG 3.44Å; D855-R859 PolarHBondContact O-N 2.93Å
856	L	90.8	Very high	86	Confident	34 Å²	34	34.1 Å²	34.1	18%	0.178	19%	0.189	C	C	.	.	H	α-helix	trans	-57.2	-48.5	-173.1	175.1	62	0	0	0	113.5	M585 V625 S628 I629 V854 L858 R859 L860	M585-L856 HydrophobicContact CE-CD2 3.56Å; M585-L856 HydrophobicContact CE-CG 4.01Å; M585-L856 HydrophobicContact SD-CG 4.49Å; V625-L856 HydrophobicContact CG1-CD1 4.2Å; S628-L856 WeakPolarHBondContact OG-CD1 3.49Å; I629-L856 HydrophobicContact CD1-CD1 4.05Å; I629-L856 HydrophobicContact CG1-CD1 3.94Å; I629-L856 HydrophobicContact CG1-CD2 4.25Å; V854-L856 PolarHBondContact O-N 2.62Å; L856-L858 VanDerWaalsContact C-N 3.35Å; L856-L858 PolarHBondContact O-N 2.57Å; L856-R859 PolarHBondContact O-N 2.94Å; L856-L860 HydrophobicContact CD1-CD1 3.58Å; L856-L860 HydrophobicContact CD1-CD2 4.42Å; L856-L860 HydrophobicContact CD1-CG 3.79Å; L856-L860 HydrophobicContact CG-CD1 3.73Å; L856-L860 HydrophobicContact CG-CG 4.37Å; L856-L860 WeakPolarHBondContact O-CB 3.46Å; L856-L860 VanDerWaalsContact O-CG 3.27Å; L856-L860 WeakPolarHBondContact O-CG 3.31Å; L856-L860 PolarHBondContact O-N 2.82Å
857	P	91.7	Very high	86.8	Confident	4 Å²	4	30.1 Å²	30.1	3%	0.026	16%	0.163	C	C	.	.	H	α-helix	trans	-58.7	-41.3	175.6	-26.8	37	0	0	0	113.6	D409 V582 M585 D855 L860 A861	D409-P857 HydrophobicContact CB-CG 3.91Å; V582-P857 HydrophobicContact CG1-CB 3.66Å; M585-P857 HydrophobicContact CB-CG 4.38Å; M585-P857 HydrophobicContact SD-CG 4.08Å; D855-P857 WeakPolarHBondContact OD1-CD 3.29Å; P857-L860 PolarHBondContact O-N 2.83Å; P857-A861 WeakPolarHBondContact O-CB 3.49Å; P857-A861 PolarHBondContact O-N 2.87Å
858	L	90.8	Very high	87.3	Confident	24 Å²	24	27 Å²	27	13%	0.126	15%	0.148	C	C	.	.	H	α-helix	trans	-64.7	-46.8	175.4	171.5	53.8	0	0	0	111.6	E415 L580 V582 D855 L856 L860 A861 V862	E415-L858 HydrophobicContact CB-CD1 4.08Å; E415-L858 HydrophobicContact CG-CD1 4Å; E415-L858 HydrophobicContact CG-CD2 4.28Å; L580-L858 HydrophobicContact CD2-CD1 3.88Å; V582-L858 HydrophobicContact CG2-CB 4.36Å; V582-L858 HydrophobicContact CG2-CD1 4.02Å; D855-L858 HydrophobicContact CB-CB 3.98Å; D855-L858 HydrophobicContact CB-CD2 4.41Å; D855-L858 PolarHBondContact O-N 2.86Å; D855-L858 VanDerWaalsContact OD1-CB 3.31Å; D855-L858 WeakPolarHBondContact OD1-CB 3.25Å; D855-L858 PolarHBondContact OD1-N 3.49Å; D855-L858 VanDerWaalsContact OD1-N 3.12Å; L856-L858 VanDerWaalsContact C-N 3.35Å; L856-L858 PolarHBondContact O-N 2.57Å; L858-L860 VanDerWaalsContact C-N 3.32Å; L858-L860 PolarHBondContact O-N 3.21Å; L858-A861 WeakPolarHBondContact O-CB 3.39Å; L858-A861 PolarHBondContact O-N 3.04Å; L858-V862 HydrophobicContact CD1-CG2 4.2Å; L858-V862 WeakPolarHBondContact O-CG2 3.25Å; L858-V862 PolarHBondContact O-N 3.16Å
859	R	93.8	Very high	87.7	Confident	76 Å²	76	27.8 Å²	27.8	29%	0.287	15%	0.15	S	C	.	.	H	α-helix	trans	-64.2	-36.9	178.7	-62.2	-55.3	-163.8	-147.7	3.3	111.8	H624 V625 V854 D855 L856 V862 L863	H624-R859 HydrophobicContact CB-CB 4.49Å; H624-R859 HydrophobicContact CB-CG 3.87Å; H624-R859 PolarHBondContact ND1-NH2 3.44Å; V625-R859 HydrophobicContact CG2-CB 3.61Å; V854-R859 HydrophobicContact CG1-CG 3.63Å; D855-R859 WeakPolarHBondContact O-CG 3.44Å; D855-R859 PolarHBondContact O-N 2.93Å; L856-R859 PolarHBondContact O-N 2.94Å; R859-V862 PolarHBondContact O-N 3.43Å; R859-L863 WeakPolarHBondContact O-CB 3.5Å; R859-L863 PolarHBondContact O-N 3.13Å
860	L	95.2	Very high	88.1	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.2	-39.7	172.2	-71.7	166.2	0	0	0	112.1	M585 Y588 F591 A592 V625 L856 P857 L858 L863 H864	M585-L860 HydrophobicContact CE-CD1 3.88Å; M585-L860 HydrophobicContact SD-CD1 3.9Å; Y588-L860 HydrophobicContact CD1-CB 4.12Å; Y588-L860 HydrophobicContact CD2-CB 4.38Å; Y588-L860 HydrophobicContact CG-CB 3.99Å; Y588-L860 HydrophobicContact CG-CD1 4.37Å; F591-L860 HydrophobicContact CD1-CD2 3.88Å; F591-L860 HydrophobicContact CE1-CD2 4.01Å; A592-L860 HydrophobicContact CB-CD1 4.01Å; A592-L860 HydrophobicContact CB-CD2 4.09Å; V625-L860 HydrophobicContact CG1-CD2 3.8Å; V625-L860 HydrophobicContact CG1-CG 4.46Å; V625-L860 HydrophobicContact CG2-CD2 4.21Å; V625-L860 HydrophobicContact CG2-CG 4.39Å; L856-L860 HydrophobicContact CD1-CD1 3.58Å; L856-L860 HydrophobicContact CD1-CD2 4.42Å; L856-L860 HydrophobicContact CD1-CG 3.79Å; L856-L860 HydrophobicContact CG-CD1 3.73Å; L856-L860 HydrophobicContact CG-CG 4.37Å; L856-L860 WeakPolarHBondContact O-CB 3.46Å; L856-L860 VanDerWaalsContact O-CG 3.27Å; L856-L860 WeakPolarHBondContact O-CG 3.31Å; L856-L860 PolarHBondContact O-N 2.82Å; P857-L860 PolarHBondContact O-N 2.83Å; L858-L860 VanDerWaalsContact C-N 3.32Å; L858-L860 PolarHBondContact O-N 3.21Å; L860-L863 PolarHBondContact O-N 2.8Å; L860-H864 VanDerWaalsContact O-CB 3.28Å; L860-H864 WeakPolarHBondContact O-CB 3.38Å; L860-H864 PolarHBondContact O-N 3.4Å
861	A	93.6	Very high	88.4	Confident	2 Å²	2	22.9 Å²	22.9	2%	0.017	12%	0.121	C	C	.	.	H	α-helix	trans	-63.4	-40.9	174	0	0	0	0	0	112.5	L580 V582 Y588 P857 L858 G865	L580-A861 HydrophobicContact CD1-CB 4.37Å; L580-A861 HydrophobicContact CD2-CB 3.91Å; L580-A861 HydrophobicContact CG-CB 4.13Å; V582-A861 HydrophobicContact CG2-CB 4.01Å; Y588-A861 HydrophobicContact CE1-CB 4.46Å; Y588-A861 WeakPolarHBondContact OH-CB 3.34Å; P857-A861 WeakPolarHBondContact O-CB 3.49Å; P857-A861 PolarHBondContact O-N 2.87Å; L858-A861 WeakPolarHBondContact O-CB 3.39Å; L858-A861 PolarHBondContact O-N 3.04Å; A861-G865 PolarHBondContact O-N 3.1Å
862	V	92.8	Very high	89.3	Confident	39 Å²	39	25.8 Å²	25.8	24%	0.236	13%	0.127	C	C	.	.	H	α-helix	trans	-62.7	-48	175.2	171.8	0	0	0	0	110.9	L580 A621 L858 R859 L866	L580-V862 HydrophobicContact CD2-CB 4.41Å; L580-V862 HydrophobicContact CD2-CG2 3.5Å; L580-V862 VanDerWaalsContact CD2-CG2 3.5Å; A621-V862 HydrophobicContact CB-CG1 4.49Å; L858-V862 HydrophobicContact CD1-CG2 4.2Å; L858-V862 WeakPolarHBondContact O-CG2 3.25Å; L858-V862 PolarHBondContact O-N 3.16Å; R859-V862 PolarHBondContact O-N 3.43Å; V862-L866 VanDerWaalsContact O-CB 3.29Å; V862-L866 WeakPolarHBondContact O-CB 3.44Å; V862-L866 PolarHBondContact O-N 2.68Å; V862-L866 VanDerWaalsContact O-N 3.12Å
863	L	95.3	Very high	89.8	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-67.2	-41.4	-179	-174.5	69.8	0	0	0	112.1	F591 V595 L618 A621 L622 V625 R859 L860 L866 L867	F591-L863 HydrophobicContact CE1-CB 4.35Å; F591-L863 HydrophobicContact CE1-CD2 4.24Å; F591-L863 HydrophobicContact CE1-CG 4.39Å; F591-L863 HydrophobicContact CZ-CB 4.24Å; F591-L863 HydrophobicContact CZ-CD2 3.75Å; F591-L863 HydrophobicContact CZ-CG 3.83Å; V595-L863 HydrophobicContact CG1-CD2 4.18Å; V595-L863 HydrophobicContact CG2-CD2 3.89Å; L618-L863 HydrophobicContact CD1-CD1 3.76Å; A621-L863 HydrophobicContact CB-CB 4.28Å; A621-L863 HydrophobicContact CB-CD1 3.66Å; L622-L863 HydrophobicContact CD2-CD1 3.84Å; L622-L863 HydrophobicContact CD2-CD2 3.77Å; L622-L863 HydrophobicContact CD2-CG 4.47Å; L622-L863 HydrophobicContact CG-CD1 4.03Å; V625-L863 HydrophobicContact CG2-CB 4.35Å; V625-L863 HydrophobicContact CG2-CD2 4.05Å; R859-L863 WeakPolarHBondContact O-CB 3.5Å; R859-L863 PolarHBondContact O-N 3.13Å; L860-L863 PolarHBondContact O-N 2.8Å; L863-L866 HydrophobicContact CD1-CD2 4.49Å; L863-L866 PolarHBondContact O-N 2.77Å; L863-L867 HydrophobicContact CD1-CD1 4.3Å; L863-L867 HydrophobicContact CD1-CG 4.35Å; L863-L867 HydrophobicContact CG-CD1 4.03Å; L863-L867 HydrophobicContact CG-CG 4.43Å; L863-L867 WeakPolarHBondContact O-CB 3.4Å; L863-L867 WeakPolarHBondContact O-CG 3.31Å; L863-L867 PolarHBondContact O-N 2.86Å
864	H	94.8	Very high	90.2	Very high	6 Å²	6	29.2 Å²	29.2	3%	0.028	14%	0.137	C	C	.	.	H	α-helix	trans	-53.2	-59.4	175.1	162.7	-93.8	0	0	0	110.8	F591 L860 L866 L867 V868 L889 I892 S893	F591-H864 HydrophobicContact CE1-CB 3.96Å; F591-H864 HydrophobicContact CZ-CB 4.44Å; L860-H864 VanDerWaalsContact O-CB 3.28Å; L860-H864 WeakPolarHBondContact O-CB 3.38Å; L860-H864 PolarHBondContact O-N 3.4Å; H864-L866 PolarHBondContact O-N 3.21Å; H864-L867 PolarHBondContact O-N 2.92Å; H864-V868 WeakPolarHBondContact O-CG2 3.45Å; H864-V868 PolarHBondContact O-N 3.09Å; H864-L889 HydrophobicContact CB-CD2 4.37Å; H864-L889 PolarHBondContact NE2-O 3.39Å; H864-I892 HydrophobicContact CB-CG2 4.48Å; H864-I892 WeakPolarHBondContact CD2-CG2 3.38Å; H864-I892 WeakPolarHBondContact NE2-CG2 3.41Å; H864-S893 PolarHBondContact CE1-OG 3.38Å; H864-S893 PolarHBondContact NE2-OG 2.95Å
865	G	91.4	Very high	90.2	Very high	13 Å²	13	32.4 Å²	32.4	13%	0.134	15%	0.154	C	C	.	.	H	α-helix	trans	-65.2	-30.5	-176.5	0	0	0	0	0	112.3	R541 A861 D869	R541-G865 PolarHBondContact NH2-O 2.92Å; R541-G865 VanDerWaalsContact NH2-O 3.11Å; A861-G865 PolarHBondContact O-N 3.1Å; G865-D869 WeakPolarHBondContact O-CB 3.42Å; G865-D869 PolarHBondContact O-N 3.05Å
866	L	91.3	Very high	90.2	Very high	10 Å²	10	34.4 Å²	34.4	5%	0.052	16%	0.163	C	C	.	.	H	α-helix	trans	-68.1	-45.1	176.4	176.8	142	0	0	0	111.3	E617 L618 V862 L863 H864 D869 I870	E617-L866 HydrophobicContact CB-CD1 3.56Å; E617-L866 WeakPolarHBondContact O-CD1 3.42Å; L618-L866 HydrophobicContact CB-CD2 3.9Å; L618-L866 HydrophobicContact CD1-CD2 3.54Å; L618-L866 HydrophobicContact CG-CD2 4.31Å; V862-L866 VanDerWaalsContact O-CB 3.29Å; V862-L866 WeakPolarHBondContact O-CB 3.44Å; V862-L866 PolarHBondContact O-N 2.68Å; V862-L866 VanDerWaalsContact O-N 3.12Å; L863-L866 HydrophobicContact CD1-CD2 4.49Å; L863-L866 PolarHBondContact O-N 2.77Å; H864-L866 PolarHBondContact O-N 3.21Å; L866-D869 PolarHBondContact O-N 3.37Å; L866-I870 HydrophobicContact CD2-CD1 3.58Å; L866-I870 HydrophobicContact CG-CD1 4.03Å; L866-I870 WeakPolarHBondContact O-CB 3.43Å; L866-I870 VanDerWaalsContact O-CG1 3.31Å; L866-I870 WeakPolarHBondContact O-CG1 3.3Å; L866-I870 PolarHBondContact O-N 3.36Å
867	L	92.4	Very high	89.8	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-67.2	-38.1	176.2	-71.2	173.8	0	0	0	111.6	F591 M602 L606 L618 L863 H864 I870 I871 L885 L889	F591-L867 HydrophobicContact CE2-CD1 3.76Å; F591-L867 HydrophobicContact CZ-CD1 3.82Å; M602-L867 HydrophobicContact SD-CD1 3.96Å; M602-L867 HydrophobicContact SD-CD2 4.25Å; L606-L867 HydrophobicContact CD1-CD2 3.77Å; L618-L867 HydrophobicContact CD1-CD2 3.72Å; L618-L867 HydrophobicContact CD1-CG 4.39Å; L863-L867 HydrophobicContact CD1-CD1 4.3Å; L863-L867 HydrophobicContact CD1-CG 4.35Å; L863-L867 HydrophobicContact CG-CD1 4.03Å; L863-L867 HydrophobicContact CG-CG 4.43Å; L863-L867 WeakPolarHBondContact O-CB 3.4Å; L863-L867 WeakPolarHBondContact O-CG 3.31Å; L863-L867 PolarHBondContact O-N 2.86Å; H864-L867 PolarHBondContact O-N 2.92Å; L867-I870 PolarHBondContact O-N 2.82Å; L867-I871 HydrophobicContact CB-CD1 4.18Å; L867-I871 VanDerWaalsContact O-CB 3.25Å; L867-I871 WeakPolarHBondContact O-CB 3.37Å; L867-I871 WeakPolarHBondContact O-CD1 2.95Å; L867-I871 WeakPolarHBondContact O-CG1 3.48Å; L867-I871 PolarHBondContact O-N 3.1Å; L867-L885 HydrophobicContact CD1-CD1 4.29Å; L867-L885 HydrophobicContact CD1-CD2 4.38Å; L867-L889 HydrophobicContact CB-CD1 3.71Å; L867-L889 HydrophobicContact CB-CD2 4.19Å; L867-L889 HydrophobicContact CD1-CD2 4.48Å
868	V	91.6	Very high	89.3	Confident	1 Å²	1	37.6 Å²	37.6	1%	0.006	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-50.9	171.8	173.3	0	0	0	0	110.9	H864 I870 I871 Y872 L889 P901 I903	H864-V868 WeakPolarHBondContact O-CG2 3.45Å; H864-V868 PolarHBondContact O-N 3.09Å; V868-I870 VanDerWaalsContact C-N 3.26Å; V868-I870 PolarHBondContact O-N 2.73Å; V868-I871 PolarHBondContact O-N 2.78Å; V868-Y872 WeakPolarHBondContact O-CB 3.34Å; V868-Y872 PolarHBondContact O-N 3.2Å; V868-L889 HydrophobicContact CG2-CB 3.89Å; V868-L889 HydrophobicContact CG2-CD1 4.32Å; V868-L889 HydrophobicContact CG2-CD2 4.48Å; V868-L889 HydrophobicContact CG2-CG 4.46Å; V868-P901 HydrophobicContact CG1-CB 3.97Å; V868-P901 HydrophobicContact CG1-CG 3.82Å; V868-I903 HydrophobicContact CG2-CD1 4.39Å
869	D	88.2	Confident	89	Confident	56 Å²	56	36.9 Å²	36.9	30%	0.299	18%	0.177	S	C	.	.	H	α-helix	trans	-63.7	-29.4	179.6	-82.8	-32.5	0	0	0	113.1	R541 G865 L866 K873	R541-D869 IonicContact CZ-OD2 3.78Å; R541-D869 IonicContact NE-OD2 2.9Å; R541-D869 PolarHBondContact NE-OD2 2.94Å; R541-D869 IonicContact NH2-OD2 2.68Å; R541-D869 PolarHBondContact NH2-OD2 3.07Å; G865-D869 WeakPolarHBondContact O-CB 3.42Å; G865-D869 PolarHBondContact O-N 3.05Å; L866-D869 PolarHBondContact O-N 3.37Å; D869-K873 WeakPolarHBondContact O-CG 3.49Å; D869-K873 PolarHBondContact O-NZ 2.75Å
870	I	88.9	Confident	88.5	Confident	6 Å²	6	36.8 Å²	36.8	3%	0.031	18%	0.182	C	C	.	.	H	α-helix	trans	-76.4	-54	174.9	-74	171.7	0	0	0	110.8	L606 L610 E614 L866 L867 V868 K873 K874	L606-I870 HydrophobicContact CD2-CG2 4.27Å; L610-I870 HydrophobicContact CD2-CD1 4.09Å; L610-I870 HydrophobicContact CD2-CG1 4.47Å; L610-I870 HydrophobicContact CD2-CG2 3.54Å; E614-I870 HydrophobicContact CB-CD1 4.29Å; E614-I870 HydrophobicContact CG-CD1 4.45Å; E614-I870 HydrophobicContact CG-CG1 4.33Å; L866-I870 HydrophobicContact CD2-CD1 3.58Å; L866-I870 HydrophobicContact CG-CD1 4.03Å; L866-I870 WeakPolarHBondContact O-CB 3.43Å; L866-I870 VanDerWaalsContact O-CG1 3.31Å; L866-I870 WeakPolarHBondContact O-CG1 3.3Å; L866-I870 PolarHBondContact O-N 3.36Å; L867-I870 PolarHBondContact O-N 2.82Å; V868-I870 VanDerWaalsContact C-N 3.26Å; V868-I870 PolarHBondContact O-N 2.73Å; I870-K873 PolarHBondContact O-N 2.89Å; I870-K874 WeakPolarHBondContact O-CE 3.12Å
871	I	89	Confident	88	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-72.1	-34.5	-170	-62.9	167.1	0	0	0	111.3	L606 L867 V868 K873 K874 I879 L882 L885 P886 L889 I903	L606-I871 HydrophobicContact CD2-CG1 4.28Å; L867-I871 HydrophobicContact CB-CD1 4.18Å; L867-I871 VanDerWaalsContact O-CB 3.25Å; L867-I871 WeakPolarHBondContact O-CB 3.37Å; L867-I871 WeakPolarHBondContact O-CD1 2.95Å; L867-I871 WeakPolarHBondContact O-CG1 3.48Å; L867-I871 PolarHBondContact O-N 3.1Å; V868-I871 PolarHBondContact O-N 2.78Å; I871-K873 PolarHBondContact O-N 2.95Å; I871-K874 PolarHBondContact O-N 3.23Å; I871-I879 HydrophobicContact CG2-CG1 3.84Å; I871-L882 HydrophobicContact CD1-CD1 4.06Å; I871-L882 HydrophobicContact CG1-CD1 4.04Å; I871-L882 HydrophobicContact CG2-CD1 4.42Å; I871-L885 HydrophobicContact CD1-CD2 3.85Å; I871-L885 HydrophobicContact CD1-CG 4.31Å; I871-P886 HydrophobicContact CG2-CG 4.5Å; I871-L889 HydrophobicContact CD1-CD1 3.78Å; I871-I903 HydrophobicContact CB-CD1 3.93Å; I871-I903 HydrophobicContact CB-CG1 4.37Å; I871-I903 HydrophobicContact CD1-CD1 4.46Å; I871-I903 HydrophobicContact CG2-CD1 3.82Å; I871-I903 HydrophobicContact CG2-CG1 4.19Å; I871-I903 HydrophobicContact CG2-CG2 3.87Å
872	Y	85.6	Confident	87.6	Confident	137 Å²	137	41.8 Å²	41.8	54%	0.537	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-22.8	174	180	-96	0	0	0	113.6	V868 R902	V868-Y872 WeakPolarHBondContact O-CB 3.34Å; V868-Y872 PolarHBondContact O-N 3.2Å; Y872-R902 VanDerWaalsContact CD2-O 3.31Å; Y872-R902 WeakPolarHBondContact CD2-O 3.4Å
873	K	83.6	Confident	87.2	Confident	134 Å²	134	44.4 Å²	44.4	58%	0.583	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.1	2.9	179.1	-55.7	-173.3	-171.3	90.1	0	114.1	D869 I870 I871	D869-K873 WeakPolarHBondContact O-CG 3.49Å; D869-K873 PolarHBondContact O-NZ 2.75Å; I870-K873 PolarHBondContact O-N 2.89Å; I871-K873 PolarHBondContact O-N 2.95Å
874	K	84.6	Confident	87	Confident	45 Å²	45	45.8 Å²	45.8	20%	0.196	22%	0.222	C	C	.	.	S	Bend	trans	-97.6	166.8	-178.2	-52	-55	174.3	-172.3	0	111.5	L609 I870 I871 T878	L609-K874 HydrophobicContact CB-CD 4.31Å; L609-K874 PolarHBondContact O-NZ 3.27Å; I870-K874 WeakPolarHBondContact O-CE 3.12Å; I871-K874 PolarHBondContact O-N 3.23Å; K874-T878 HydrophobicContact CB-CG2 3.85Å; K874-T878 HydrophobicContact CG-CG2 4.13Å
875	D	83.3	Confident	86.8	Confident	80 Å²	80	45.5 Å²	45.5	43%	0.428	22%	0.22	S	C	.	.			trans	-74.5	163.3	174.3	65.4	-76.1	0	0	0	112.1	D877 T878 I879	D875-D877 PolarHBondContact O-N 2.92Å; D875-D877 WeakPolarHBondContact OD2-CB 3.31Å; D875-D877 PolarHBondContact OD2-N 2.78Å; D875-D877 VanDerWaalsContact OD2-N 3.13Å; D875-T878 PolarHBondContact O-N 3.16Å; D875-T878 WeakPolarHBondContact OD1-CB 3.38Å; D875-T878 PolarHBondContact OD1-OG1 3.46Å; D875-T878 PolarHBondContact OD2-N 3.25Å; D875-T878 PolarHBondContact OD2-OG1 3.28Å; D875-I879 VanDerWaalsContact O-CG1 3.31Å; D875-I879 WeakPolarHBondContact O-CG1 3.43Å; D875-I879 PolarHBondContact O-N 2.83Å
876	Q	85.3	Confident	86.9	Confident	55 Å²	55	45 Å²	45	26%	0.257	22%	0.215	S	C	.	.	H	α-helix	trans	-68.7	-30	-174.8	-164.1	66.7	55.4	0	0	113.6	I879 D880 I904 N906	Q876-I879 PolarHBondContact O-N 3.43Å; Q876-D880 PolarHBondContact NE2-OD1 2.99Å; Q876-D880 WeakPolarHBondContact O-CB 3.44Å; Q876-D880 PolarHBondContact O-N 3.29Å; Q876-I904 PolarHBondContact NE2-O 2.88Å; Q876-I904 PolarHBondContact OE1-O 3.29Å; Q876-N906 HydrophobicContact CG-CB 4.43Å; Q876-N906 WeakPolarHBondContact CG-ND2 3.47Å
877	D	82.4	Confident	86.9	Confident	93 Å²	93	47 Å²	47	50%	0.497	23%	0.23	S	C	.	.	H	α-helix	trans	-68.9	-40.6	178.2	167.8	75.6	0	0	0	110.6	D875 K881	D875-D877 PolarHBondContact O-N 2.92Å; D875-D877 WeakPolarHBondContact OD2-CB 3.31Å; D875-D877 PolarHBondContact OD2-N 2.78Å; D875-D877 VanDerWaalsContact OD2-N 3.13Å; D877-K881 WeakPolarHBondContact O-CB 3.3Å; D877-K881 WeakPolarHBondContact O-CD 3.46Å; D877-K881 VanDerWaalsContact O-CG 3.23Å; D877-K881 WeakPolarHBondContact O-CG 3.49Å; D877-K881 PolarHBondContact O-N 2.83Å; D877-K881 WeakPolarHBondContact OD1-CE 3.31Å; D877-K881 IonicContact OD1-NZ 3.64Å; D877-K881 PolarHBondContact OD1-NZ 3.13Å; D877-K881 WeakPolarHBondContact OD2-CE 3.38Å; D877-K881 IonicContact OD2-NZ 2.93Å; D877-K881 PolarHBondContact OD2-NZ 2.98Å
878	T	80.9	Confident	87	Confident	13 Å²	13	47.3 Å²	47.3	8%	0.08	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-46.8	166.7	-63.7	0	0	0	0	112.4	L609 K874 D875 D880 K881 L882	L609-T878 HydrophobicContact CD1-CG2 3.36Å; L609-T878 WeakPolarHBondContact CD1-OG1 3.33Å; K874-T878 HydrophobicContact CB-CG2 3.85Å; K874-T878 HydrophobicContact CG-CG2 4.13Å; D875-T878 PolarHBondContact O-N 3.16Å; D875-T878 WeakPolarHBondContact OD1-CB 3.38Å; D875-T878 PolarHBondContact OD1-OG1 3.46Å; D875-T878 PolarHBondContact OD2-N 3.25Å; D875-T878 PolarHBondContact OD2-OG1 3.28Å; T878-D880 PolarHBondContact O-N 3.18Å; T878-K881 PolarHBondContact O-N 3.35Å; T878-L882 HydrophobicContact CG2-CD1 4.13Å; T878-L882 WeakPolarHBondContact O-CG 3.25Å; T878-L882 PolarHBondContact O-N 3.32Å
879	I	85.1	Confident	87.1	Confident	9 Å²	9	47.3 Å²	47.3	5%	0.046	23%	0.231	C	C	.	.	H	α-helix	trans	-63.2	-43.7	-178.6	-68.1	166.3	0	0	0	110.8	I871 D875 Q876 L882 P886 I903	I871-I879 HydrophobicContact CG2-CG1 3.84Å; D875-I879 VanDerWaalsContact O-CG1 3.31Å; D875-I879 WeakPolarHBondContact O-CG1 3.43Å; D875-I879 PolarHBondContact O-N 2.83Å; Q876-I879 PolarHBondContact O-N 3.43Å; I879-L882 PolarHBondContact O-N 3.38Å; I879-P886 HydrophobicContact CG2-CB 4.15Å; I879-P886 HydrophobicContact CG2-CG 3.83Å; I879-I903 HydrophobicContact CD1-CG2 4.11Å; I879-I903 HydrophobicContact CG1-CG2 4.33Å; I879-I903 HydrophobicContact CG2-CG2 3.9Å
880	D	84.4	Confident	87.3	Confident	73 Å²	73	45.8 Å²	45.8	39%	0.39	22%	0.223	S	C	.	.	H	α-helix	trans	-70.4	-33.7	-178.1	-67.3	-6.7	0	0	0	111.2	Q876 T878 L882 H883	Q876-D880 PolarHBondContact NE2-OD1 2.99Å; Q876-D880 WeakPolarHBondContact O-CB 3.44Å; Q876-D880 PolarHBondContact O-N 3.29Å; T878-D880 PolarHBondContact O-N 3.18Å; D880-L882 VanDerWaalsContact C-N 3.29Å; D880-L882 PolarHBondContact O-N 3.27Å; D880-H883 VanDerWaalsContact O-CB 3.26Å; D880-H883 WeakPolarHBondContact O-CB 3.46Å; D880-H883 PolarHBondContact O-N 3.38Å
881	K	84.3	Confident	87.5	Confident	107 Å²	107	50.3 Å²	50.3	47%	0.465	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-28.5	170.5	-77.6	166	-179.1	166.5	0	114.2	D877 T878 H883	D877-K881 WeakPolarHBondContact O-CB 3.3Å; D877-K881 WeakPolarHBondContact O-CD 3.46Å; D877-K881 VanDerWaalsContact O-CG 3.23Å; D877-K881 WeakPolarHBondContact O-CG 3.49Å; D877-K881 PolarHBondContact O-N 2.83Å; D877-K881 WeakPolarHBondContact OD1-CE 3.31Å; D877-K881 IonicContact OD1-NZ 3.64Å; D877-K881 PolarHBondContact OD1-NZ 3.13Å; D877-K881 WeakPolarHBondContact OD2-CE 3.38Å; D877-K881 IonicContact OD2-NZ 2.93Å; D877-K881 PolarHBondContact OD2-NZ 2.98Å; T878-K881 PolarHBondContact O-N 3.35Å; K881-H883 VanDerWaalsContact C-N 3.27Å; K881-H883 PolarHBondContact O-N 3.39Å
882	L	84.8	Confident	87.7	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	3.6	178.5	-67.3	167.4	0	0	0	113.1	N605 L606 I871 T878 I879 D880 L885 P886	N605-L882 HydrophobicContact CB-CD2 3.9Å; L606-L882 HydrophobicContact CD2-CD1 3.77Å; L606-L882 HydrophobicContact CD2-CD2 4.44Å; L606-L882 HydrophobicContact CG-CD1 4.47Å; L606-L882 HydrophobicContact CG-CD2 4.27Å; I871-L882 HydrophobicContact CD1-CD1 4.06Å; I871-L882 HydrophobicContact CG1-CD1 4.04Å; I871-L882 HydrophobicContact CG2-CD1 4.42Å; T878-L882 HydrophobicContact CG2-CD1 4.13Å; T878-L882 WeakPolarHBondContact O-CG 3.25Å; T878-L882 PolarHBondContact O-N 3.32Å; I879-L882 PolarHBondContact O-N 3.38Å; D880-L882 VanDerWaalsContact C-N 3.29Å; D880-L882 PolarHBondContact O-N 3.27Å; L882-L885 VanDerWaalsContact O-CB 3.22Å; L882-L885 WeakPolarHBondContact O-CB 3.46Å; L882-L885 PolarHBondContact O-N 2.98Å; L882-P886 HydrophobicContact CB-CG 4.29Å; L882-P886 VanDerWaalsContact O-CD 3.31Å; L882-P886 WeakPolarHBondContact O-CD 3.17Å
883	H	84.3	Confident	88	Confident	93 Å²	93	44 Å²	44	43%	0.431	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	133.4	-176.2	-173.9	-83	0	0	0	112.7	D880 K881	D880-H883 VanDerWaalsContact O-CB 3.26Å; D880-H883 WeakPolarHBondContact O-CB 3.46Å; D880-H883 PolarHBondContact O-N 3.38Å; K881-H883 VanDerWaalsContact C-N 3.27Å; K881-H883 PolarHBondContact O-N 3.39Å
884	P	90.7	Very high	88.3	Confident	29 Å²	29	42.1 Å²	42.1	19%	0.188	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	cis	-95.6	7.7	10.4	38.9	-37.3	0	0	0	115.4	Y594 P886 S887 I888	Y594-P884 HydrophobicContact CD2-CG 4.46Å; P884-P886 VanDerWaalsContact C-N 3.35Å; P884-P886 VanDerWaalsContact O-N 3.16Å; P884-S887 WeakPolarHBondContact O-CA 3.29Å; P884-S887 VanDerWaalsContact O-CB 3.28Å; P884-S887 WeakPolarHBondContact O-CB 3.21Å; P884-S887 PolarHBondContact O-N 2.85Å; P884-I888 HydrophobicContact CB-CD1 4.48Å; P884-I888 HydrophobicContact CB-CG1 4.47Å; P884-I888 HydrophobicContact CG-CD1 3.92Å; P884-I888 HydrophobicContact CG-CG1 4.43Å; P884-I888 PolarHBondContact O-N 2.99Å; P884-I888 VanDerWaalsContact O-N 3.09Å
885	L	91.6	Very high	88.5	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-48.2	-45.9	-173.8	173.9	66.6	0	0	0	113.7	F591 Y594 M602 L867 I871 L882 S887 I888 L889	F591-L885 HydrophobicContact CD2-CD1 4.03Å; F591-L885 HydrophobicContact CE2-CD1 3.83Å; Y594-L885 HydrophobicContact CD1-CB 4.41Å; Y594-L885 HydrophobicContact CD1-CD1 3.89Å; Y594-L885 HydrophobicContact CE1-CB 3.9Å; Y594-L885 HydrophobicContact CE1-CD1 3.93Å; Y594-L885 HydrophobicContact CE1-CD2 3.99Å; Y594-L885 HydrophobicContact CE1-CG 4.15Å; Y594-L885 HydrophobicContact CE2-CB 4.06Å; M602-L885 HydrophobicContact CG-CD2 4.15Å; M602-L885 HydrophobicContact SD-CD2 3.65Å; L867-L885 HydrophobicContact CD1-CD1 4.29Å; L867-L885 HydrophobicContact CD1-CD2 4.38Å; I871-L885 HydrophobicContact CD1-CD2 3.85Å; I871-L885 HydrophobicContact CD1-CG 4.31Å; L882-L885 VanDerWaalsContact O-CB 3.22Å; L882-L885 WeakPolarHBondContact O-CB 3.46Å; L882-L885 PolarHBondContact O-N 2.98Å; L885-S887 VanDerWaalsContact C-N 3.26Å; L885-S887 PolarHBondContact O-N 2.87Å; L885-I888 PolarHBondContact O-N 3.41Å; L885-I888 VanDerWaalsContact O-N 3.16Å; L885-L889 HydrophobicContact CD1-CD1 3.86Å; L885-L889 HydrophobicContact CD1-CD2 4.15Å; L885-L889 HydrophobicContact CD1-CG 3.78Å; L885-L889 HydrophobicContact CD2-CD1 4.5Å; L885-L889 HydrophobicContact CG-CD1 3.81Å; L885-L889 HydrophobicContact CG-CG 4.18Å; L885-L889 VanDerWaalsContact O-CG 3.29Å; L885-L889 WeakPolarHBondContact O-CG 3.37Å; L885-L889 PolarHBondContact O-N 2.97Å
886	P	92.1	Very high	88.7	Confident	2 Å²	2	40.3 Å²	40.3	1%	0.013	21%	0.211	C	C	.	.	H	α-helix	trans	-56.3	-35.5	174.1	-28.8	37.2	0	0	0	114.8	I871 I879 L882 P884 N890 I903 V905	I871-P886 HydrophobicContact CG2-CG 4.5Å; I879-P886 HydrophobicContact CG2-CB 4.15Å; I879-P886 HydrophobicContact CG2-CG 3.83Å; L882-P886 HydrophobicContact CB-CG 4.29Å; L882-P886 VanDerWaalsContact O-CD 3.31Å; L882-P886 WeakPolarHBondContact O-CD 3.17Å; P884-P886 VanDerWaalsContact C-N 3.35Å; P884-P886 VanDerWaalsContact O-N 3.16Å; P886-N890 WeakPolarHBondContact O-CB 3.2Å; P886-N890 VanDerWaalsContact O-CG 3.23Å; P886-N890 PolarHBondContact O-N 3.39Å; P886-N890 VanDerWaalsContact O-N 3.08Å; P886-N890 PolarHBondContact O-ND2 3.42Å; P886-I903 HydrophobicContact CB-CB 4.37Å; P886-I903 HydrophobicContact CB-CD1 4.2Å; P886-I903 HydrophobicContact CB-CG2 3.96Å; P886-V905 HydrophobicContact CB-CG2 3.6Å
887	S	91.9	Very high	88.7	Confident	53 Å²	53	38.6 Å²	38.6	37%	0.371	21%	0.209	S	C	.	.	H	α-helix	trans	-72.2	-40.6	177.2	-166.7	0	0	0	0	111.6	P884 L885 N890 Q891	P884-S887 WeakPolarHBondContact O-CA 3.29Å; P884-S887 VanDerWaalsContact O-CB 3.28Å; P884-S887 WeakPolarHBondContact O-CB 3.21Å; P884-S887 PolarHBondContact O-N 2.85Å; L885-S887 VanDerWaalsContact C-N 3.26Å; L885-S887 PolarHBondContact O-N 2.87Å; S887-N890 PolarHBondContact O-N 2.93Å; S887-Q891 WeakPolarHBondContact O-CG 3.1Å; S887-Q891 PolarHBondContact O-N 3.04Å; S887-Q891 VanDerWaalsContact O-N 3.12Å
888	I	93.6	Very high	88.3	Confident	7 Å²	7	39.3 Å²	39.3	4%	0.036	22%	0.218	C	C	.	.	H	α-helix	trans	-64.5	-47.6	176.6	-55.9	172.3	0	0	0	110.3	E590 F591 Y594 P884 L885 N890 Q891 I892	E590-I888 HydrophobicContact CB-CG2 4.2Å; E590-I888 HydrophobicContact CG-CD1 3.94Å; E590-I888 HydrophobicContact CG-CG1 4.05Å; E590-I888 HydrophobicContact CG-CG2 4.2Å; F591-I888 HydrophobicContact CB-CG2 3.69Å; Y594-I888 HydrophobicContact CD2-CD1 4.04Å; Y594-I888 HydrophobicContact CG-CD1 4.14Å; P884-I888 HydrophobicContact CB-CD1 4.48Å; P884-I888 HydrophobicContact CB-CG1 4.47Å; P884-I888 HydrophobicContact CG-CD1 3.92Å; P884-I888 HydrophobicContact CG-CG1 4.43Å; P884-I888 PolarHBondContact O-N 2.99Å; P884-I888 VanDerWaalsContact O-N 3.09Å; L885-I888 PolarHBondContact O-N 3.41Å; L885-I888 VanDerWaalsContact O-N 3.16Å; I888-N890 VanDerWaalsContact C-N 3.3Å; I888-N890 PolarHBondContact O-N 2.83Å; I888-Q891 PolarHBondContact O-N 3.26Å; I888-I892 PolarHBondContact O-N 3.04Å
889	L	93.9	Very high	87.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61	-37.8	177.2	-66.3	173	0	0	0	112.2	F591 H864 L867 V868 I871 L885 I892 S893 I903	F591-L889 HydrophobicContact CD2-CD2 4.09Å; F591-L889 HydrophobicContact CE2-CD2 3.68Å; F591-L889 HydrophobicContact CZ-CD2 3.96Å; H864-L889 HydrophobicContact CB-CD2 4.37Å; H864-L889 PolarHBondContact NE2-O 3.39Å; L867-L889 HydrophobicContact CB-CD1 3.71Å; L867-L889 HydrophobicContact CB-CD2 4.19Å; L867-L889 HydrophobicContact CD1-CD2 4.48Å; V868-L889 HydrophobicContact CG2-CB 3.89Å; V868-L889 HydrophobicContact CG2-CD1 4.32Å; V868-L889 HydrophobicContact CG2-CD2 4.48Å; V868-L889 HydrophobicContact CG2-CG 4.46Å; I871-L889 HydrophobicContact CD1-CD1 3.78Å; L885-L889 HydrophobicContact CD1-CD1 3.86Å; L885-L889 HydrophobicContact CD1-CD2 4.15Å; L885-L889 HydrophobicContact CD1-CG 3.78Å; L885-L889 HydrophobicContact CD2-CD1 4.5Å; L885-L889 HydrophobicContact CG-CD1 3.81Å; L885-L889 HydrophobicContact CG-CG 4.18Å; L885-L889 VanDerWaalsContact O-CG 3.29Å; L885-L889 WeakPolarHBondContact O-CG 3.37Å; L885-L889 PolarHBondContact O-N 2.97Å; L889-I892 PolarHBondContact O-N 3.29Å; L889-S893 PolarHBondContact O-N 2.96Å; L889-S893 PolarHBondContact O-OG 2.73Å; L889-I903 HydrophobicContact CB-CD1 4.11Å; L889-I903 HydrophobicContact CD1-CD1 3.75Å
890	N	93.1	Very high	87.7	Confident	24 Å²	24	47.8 Å²	47.8	13%	0.128	26%	0.259	C	S	.	.	H	α-helix	trans	-66.8	-39.4	176.3	-80.8	-17	0	0	0	112.8	P886 S887 I888 I892 S893 D894 R902 I903	P886-N890 WeakPolarHBondContact O-CB 3.2Å; P886-N890 VanDerWaalsContact O-CG 3.23Å; P886-N890 PolarHBondContact O-N 3.39Å; P886-N890 VanDerWaalsContact O-N 3.08Å; P886-N890 PolarHBondContact O-ND2 3.42Å; S887-N890 PolarHBondContact O-N 2.93Å; I888-N890 VanDerWaalsContact C-N 3.3Å; I888-N890 PolarHBondContact O-N 2.83Å; N890-I892 PolarHBondContact O-N 3.35Å; N890-S893 PolarHBondContact O-N 2.69Å; N890-S893 VanDerWaalsContact O-N 3.13Å; N890-D894 PolarHBondContact O-N 3.48Å; N890-R902 WeakPolarHBondContact OD1-CA 3.49Å; N890-I903 PolarHBondContact ND2-O 2.91Å; N890-I903 PolarHBondContact OD1-N 3.11Å
891	Q	92.3	Very high	87.4	Confident	102 Å²	102	47.3 Å²	47.3	48%	0.477	26%	0.26	S	S	.	.	H	α-helix	trans	-58.4	-37.4	174.8	-71	178.3	95.5	0	0	112.1	E590 S887 I888 S895	E590-Q891 PolarHBondContact OE2-NE2 3.27Å; S887-Q891 WeakPolarHBondContact O-CG 3.1Å; S887-Q891 PolarHBondContact O-N 3.04Å; S887-Q891 VanDerWaalsContact O-N 3.12Å; I888-Q891 PolarHBondContact O-N 3.26Å; Q891-S895 PolarHBondContact O-N 2.84Å; Q891-S895 PolarHBondContact O-OG 2.66Å
892	I	93.4	Very high	87.4	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.015	25%	0.254	C	S	.	.	H	α-helix	trans	-70.2	-46.3	174.8	-65	161.9	0	0	0	109.9	L583 Y588 F591 H864 I888 L889 N890 D894 S895 L896	L583-I892 HydrophobicContact CD1-CG2 4.13Å; Y588-I892 HydrophobicContact CD1-CD1 3.9Å; Y588-I892 HydrophobicContact CD1-CG1 4.31Å; Y588-I892 HydrophobicContact CD1-CG2 4.23Å; Y588-I892 HydrophobicContact CE1-CD1 4.46Å; Y588-I892 HydrophobicContact CE1-CG2 3.73Å; F591-I892 HydrophobicContact CB-CD1 3.7Å; F591-I892 HydrophobicContact CD1-CD1 3.97Å; F591-I892 HydrophobicContact CG-CD1 3.95Å; H864-I892 HydrophobicContact CB-CG2 4.48Å; H864-I892 WeakPolarHBondContact CD2-CG2 3.38Å; H864-I892 WeakPolarHBondContact NE2-CG2 3.41Å; I888-I892 PolarHBondContact O-N 3.04Å; L889-I892 PolarHBondContact O-N 3.29Å; N890-I892 PolarHBondContact O-N 3.35Å; I892-D894 VanDerWaalsContact C-N 3.31Å; I892-D894 PolarHBondContact O-N 2.68Å; I892-S895 CarbonylContact O-C 3.42Å; I892-S895 WeakPolarHBondContact O-CA 3.47Å; I892-S895 WeakPolarHBondContact O-CB 3.36Å; I892-S895 PolarHBondContact O-N 3.46Å; I892-L896 PolarHBondContact O-N 2.66Å
893	S	92.7	Very high	87.6	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-57.9	-39.8	175.3	-71.4	0	0	0	0	112.8	H864 L889 N890 S895 L896 G897 A900 P901	H864-S893 PolarHBondContact CE1-OG 3.38Å; H864-S893 PolarHBondContact NE2-OG 2.95Å; L889-S893 PolarHBondContact O-N 2.96Å; L889-S893 PolarHBondContact O-OG 2.73Å; N890-S893 PolarHBondContact O-N 2.69Å; N890-S893 VanDerWaalsContact O-N 3.13Å; S893-S895 VanDerWaalsContact C-N 3.26Å; S893-S895 PolarHBondContact O-N 2.89Å; S893-L896 WeakPolarHBondContact O-CB 3.11Å; S893-L896 PolarHBondContact O-N 2.91Å; S893-G897 PolarHBondContact O-N 2.93Å; S893-G897 VanDerWaalsContact O-N 3.11Å; S893-A900 WeakPolarHBondContact O-CB 3.22Å; S893-P901 WeakPolarHBondContact CB-O 3.39Å; S893-P901 PolarHBondContact OG-O 3.29Å
894	D	90.6	Very high	87.5	Confident	95 Å²	95	48 Å²	48	51%	0.508	26%	0.264	S	S	.	.	H	α-helix	trans	-65.5	-27.7	174.9	-76	-31.5	0	0	0	112.9	N890 I892 R902	N890-D894 PolarHBondContact O-N 3.48Å; I892-D894 VanDerWaalsContact C-N 3.31Å; I892-D894 PolarHBondContact O-N 2.68Å; D894-R902 IonicContact OD1-CZ 3.87Å; D894-R902 IonicContact OD1-NE 3.85Å; D894-R902 PolarHBondContact OD1-NE 2.93Å; D894-R902 IonicContact OD1-NH2 2.76Å; D894-R902 PolarHBondContact OD1-NH2 3.05Å
895	S	88.9	Confident	86.9	Confident	37 Å²	37	48.6 Å²	48.6	26%	0.259	27%	0.267	S	S	.	.	H	α-helix	trans	-79.8	-18.6	171.2	-60	0	0	0	0	113.1	K587 Q891 I892 S893	K587-S895 PolarHBondContact NZ-OG 3.12Å; Q891-S895 PolarHBondContact O-N 2.84Å; Q891-S895 PolarHBondContact O-OG 2.66Å; I892-S895 CarbonylContact O-C 3.42Å; I892-S895 WeakPolarHBondContact O-CA 3.47Å; I892-S895 WeakPolarHBondContact O-CB 3.36Å; I892-S895 PolarHBondContact O-N 3.46Å; S893-S895 VanDerWaalsContact C-N 3.26Å; S893-S895 PolarHBondContact O-N 2.89Å
896	L	87.5	Confident	85.7	Confident	49 Å²	49	52 Å²	52	26%	0.257	29%	0.286	S	S	.	.	H	α-helix	trans	-81.5	-37.4	174.5	-68.6	172.7	0	0	0	112.4	K581 L583 I892 S893 A900	K581-L896 HydrophobicContact CB-CD2 4.05Å; K581-L896 HydrophobicContact CD-CD2 3.94Å; K581-L896 HydrophobicContact CG-CD2 3.75Å; L583-L896 HydrophobicContact CD1-CD2 4.07Å; L583-L896 HydrophobicContact CD1-CG 4.27Å; L583-L896 HydrophobicContact CD2-CD2 4.05Å; L583-L896 HydrophobicContact CG-CD2 3.93Å; I892-L896 PolarHBondContact O-N 2.66Å; S893-L896 WeakPolarHBondContact O-CB 3.11Å; S893-L896 PolarHBondContact O-N 2.91Å; L896-A900 HydrophobicContact CB-CB 4.1Å
897	G	84.6	Confident	83.6	Confident	20 Å²	20	55.6 Å²	55.6	21%	0.206	31%	0.311	C	S	.	.			trans	146.5	-173.7	171.1	0	0	0	0	0	115.6	S893 R902	S893-G897 PolarHBondContact O-N 2.93Å; S893-G897 VanDerWaalsContact O-N 3.11Å; G897-R902 PolarHBondContact O-NH2 2.88Å
898	P	74	Confident	81.3	Confident	107 Å²	107	61.4 Å²	61.4	70%	0.695	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-39.1	177.8	26.4	-32.9	0	0	0	112.3	A900 R902	P898-A900 PolarHBondContact O-N 2.81Å; P898-R902 PolarHBondContact O-NH1 3.44Å
899	E	73.4	Confident	78.9	Confident	183 Å²	183	65.6 Å²	65.6	86%	0.855	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-9	-179.4	-56.4	-57.5	129.5	0	0	114.5
900	A	79.1	Confident	75.9	Confident	17 Å²	17	73.3 Å²	73.3	14%	0.14	39%	0.391	C	S	.	.	S	Bend	trans	-72.2	134.6	-179.2	0	0	0	0	0	111.4	S893 L896 P898 R902	S893-A900 WeakPolarHBondContact O-CB 3.22Å; L896-A900 HydrophobicContact CB-CB 4.1Å; P898-A900 PolarHBondContact O-N 2.81Å; A900-R902 PolarHBondContact O-NH1 2.89Å; A900-R902 VanDerWaalsContact O-NH1 3.12Å
901	P	79.4	Confident	73.3	Confident	63 Å²	63	78 Å²	78	41%	0.409	42%	0.423	S	S	.	.			trans	-62.5	141.1	174	23.9	-31.2	0	0	0	111.1	V868 S893	V868-P901 HydrophobicContact CG1-CB 3.97Å; V868-P901 HydrophobicContact CG1-CG 3.82Å; S893-P901 WeakPolarHBondContact CB-O 3.39Å; S893-P901 PolarHBondContact OG-O 3.29Å
902	R	84.6	Confident	70.6	Confident	90 Å²	90	78.1 Å²	78.1	34%	0.34	44%	0.435	S	S	.	.			trans	-123.6	134.8	-179	-68.3	175.7	179.2	73	7.3	109.9	Y872 N890 D894 G897 P898 A900	Y872-R902 VanDerWaalsContact CD2-O 3.31Å; Y872-R902 WeakPolarHBondContact CD2-O 3.4Å; N890-R902 WeakPolarHBondContact OD1-CA 3.49Å; D894-R902 IonicContact OD1-CZ 3.87Å; D894-R902 IonicContact OD1-NE 3.85Å; D894-R902 PolarHBondContact OD1-NE 2.93Å; D894-R902 IonicContact OD1-NH2 2.76Å; D894-R902 PolarHBondContact OD1-NH2 3.05Å; G897-R902 PolarHBondContact O-NH2 2.88Å; P898-R902 PolarHBondContact O-NH1 3.44Å; A900-R902 PolarHBondContact O-NH1 2.89Å; A900-R902 VanDerWaalsContact O-NH1 3.12Å
903	I	87.6	Confident	67.7	Low	5 Å²	5	86.9 Å²	86.9	3%	0.026	47%	0.473	C	S	.	.			trans	-75.7	134.1	173.5	-58.2	159.3	0	0	0	108.1	V868 I871 I879 P886 L889 N890 V905	V868-I903 HydrophobicContact CG2-CD1 4.39Å; I871-I903 HydrophobicContact CB-CD1 3.93Å; I871-I903 HydrophobicContact CB-CG1 4.37Å; I871-I903 HydrophobicContact CD1-CD1 4.46Å; I871-I903 HydrophobicContact CG2-CD1 3.82Å; I871-I903 HydrophobicContact CG2-CG1 4.19Å; I871-I903 HydrophobicContact CG2-CG2 3.87Å; I879-I903 HydrophobicContact CD1-CG2 4.11Å; I879-I903 HydrophobicContact CG1-CG2 4.33Å; I879-I903 HydrophobicContact CG2-CG2 3.9Å; P886-I903 HydrophobicContact CB-CB 4.37Å; P886-I903 HydrophobicContact CB-CD1 4.2Å; P886-I903 HydrophobicContact CB-CG2 3.96Å; L889-I903 HydrophobicContact CB-CD1 4.11Å; L889-I903 HydrophobicContact CD1-CD1 3.75Å; N890-I903 PolarHBondContact ND2-O 2.91Å; N890-I903 PolarHBondContact OD1-N 3.11Å; I903-V905 PolarHBondContact O-N 2.59Å
904	I	82.6	Confident	65.4	Low	120 Å²	120	93.1 Å²	93.1	62%	0.615	51%	0.513	S	S	*	.			trans	-75.3	112.5	175.2	-58.8	177.7	0	0	0	108.3	Q876	Q876-I904 PolarHBondContact NE2-O 2.88Å; Q876-I904 PolarHBondContact OE1-O 3.29Å
905	V	79.1	Confident	63.3	Low	43 Å²	43	94.2 Å²	94.2	26%	0.261	52%	0.523	S	S	.	.			trans	-105.3	126.5	176.7	-176.6	0	0	0	0	108.9	P886 I903 S907	P886-V905 HydrophobicContact CB-CG2 3.6Å; I903-V905 PolarHBondContact O-N 2.59Å; V905-S907 PolarHBondContact O-N 3.25Å; V905-S907 VanDerWaalsContact O-N 3.16Å
906	N	66.4	Low	61.6	Low	71 Å²	71	101.4 Å²	101.4	38%	0.38	55%	0.546	S	S	.	.			trans	-68.6	112.5	-174.1	-121.2	-11.7	0	0	0	111	Q876 H908	Q876-N906 HydrophobicContact CG-CB 4.43Å; Q876-N906 WeakPolarHBondContact CG-ND2 3.47Å; N906-H908 PolarHBondContact O-N 3.19Å
907	S	47.3	Very low	60.2	Low	77 Å²	77	101.6 Å²	101.6	54%	0.538	55%	0.549	S	S	.	.	G	3₁₀ helix	trans	-73.8	29.1	-168.3	73	0	0	0	0	116.3	V905 K910	V905-S907 PolarHBondContact O-N 3.25Å; V905-S907 VanDerWaalsContact O-N 3.16Å; S907-K910 WeakPolarHBondContact O-CG 3.46Å; S907-K910 PolarHBondContact O-N 3.4Å
908	H	43.9	Very low	59	Low	176 Å²	176	103.5 Å²	103.5	82%	0.815	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-69.7	-22.8	168.8	-72.2	-66.4	0	0	0	112.3	N906	N906-H908 PolarHBondContact O-N 3.19Å
909	T	42.4	Very low	57.8	Low	95 Å²	95	103 Å²	103	58%	0.583	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-95.8	42.6	169	48.6	0	0	0	0	112.7	P911	T909-P911 WeakPolarHBondContact O-CD 3.37Å
910	K	30.2	Very low	56.8	Low	161 Å²	161	105.7 Å²	105.7	70%	0.7	56%	0.557	S	S	*	*			trans	-54.1	123	167.9	-92.8	172.3	-175.9	171.8	0	109.9	S907 S912	S907-K910 WeakPolarHBondContact O-CG 3.46Å; S907-K910 PolarHBondContact O-N 3.4Å; K910-S912 PolarHBondContact O-N 2.79Å
911	P	40.4	Very low	55.4	Low	123 Å²	123	108.5 Å²	108.5	80%	0.799	57%	0.567	S	S	*	*			trans	-63.6	111.9	164.6	26.7	-31.8	0	0	0	107.6	T909 K913	T909-P911 WeakPolarHBondContact O-CD 3.37Å; P911-K913 PolarHBondContact O-N 3.36Å
912	S	34.4	Very low	54.1	Low	104 Å²	104	110.5 Å²	110.5	73%	0.727	57%	0.574	S	S	*	*			trans	-54.5	134	166.9	54.8	0	0	0	0	108.3	K910	K910-S912 PolarHBondContact O-N 2.79Å
913	K	33.6	Very low	52.4	Low	188 Å²	188	116.8 Å²	116.8	82%	0.817	60%	0.597	S	S	*	*			trans	-35.5	131.4	-179.5	-69.1	-179.8	176.6	-179.4	0	110.7	P911 V915	P911-K913 PolarHBondContact O-N 3.36Å; K913-V915 PolarHBondContact O-N 2.82Å
914	P	42.5	Very low	50.6	Low	131 Å²	131	123.4 Å²	123.4	85%	0.851	63%	0.626	S	S	*	*			trans	-58.4	100.5	-172.8	23.1	-33.8	0	0	0	110.7	Y916	P914-Y916 PolarHBondContact O-N 2.84Å
915	V	47.5	Very low	49	Very low	119 Å²	119	125.3 Å²	125.3	72%	0.721	63%	0.627	S	S	*	*			trans	-68.1	129.4	167.9	178.6	0	0	0	0	105.8	K913 V917	K913-V915 PolarHBondContact O-N 2.82Å; V915-V917 WeakPolarHBondContact O-CG2 3.31Å; V915-V917 PolarHBondContact O-N 3.35Å
916	Y	54	Low	47.3	Very low	188 Å²	188	126.3 Å²	126.3	74%	0.737	64%	0.636	S	S	*	*			trans	-58.7	105.2	-179.6	173.4	-96	0	0	0	110.5	P914 P918	P914-Y916 PolarHBondContact O-N 2.84Å; Y916-P918 HydrophobicContact CE1-CG 4.4Å; Y916-P918 WeakPolarHBondContact O-CD 3.09Å
917	V	56.2	Low	46.2	Very low	53 Å²	53	129 Å²	129	32%	0.321	66%	0.657	S	S	.	*			trans	-83.6	118.5	175.4	-178.8	0	0	0	0	108.2	V915 E921 Y925	V915-V917 WeakPolarHBondContact O-CG2 3.31Å; V915-V917 PolarHBondContact O-N 3.35Å; V917-E921 HydrophobicContact CG1-CB 3.77Å; V917-Y925 HydrophobicContact CG1-CD2 4.06Å; V917-Y925 HydrophobicContact CG1-CE2 4.44Å; V917-Y925 HydrophobicContact CG2-CD2 4.47Å
918	P	59.4	Low	45.8	Very low	60 Å²	60	131.9 Å²	131.9	39%	0.39	67%	0.666	S	S	.	*			trans	-62.6	147.8	177.6	-22.9	34.9	0	0	0	111.4	Y916 R920 E921	Y916-P918 HydrophobicContact CE1-CG 4.4Å; Y916-P918 WeakPolarHBondContact O-CD 3.09Å; P918-R920 PolarHBondContact O-N 2.96Å; P918-E921 PolarHBondContact O-N 3.04Å
919	P	50.4	Low	45.8	Very low	95 Å²	95	130.6 Å²	130.6	62%	0.617	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	-18.1	-173	-30.2	36	0	0	0	116.8	E921 L922	P919-E921 VanDerWaalsContact C-N 3.3Å; P919-E921 PolarHBondContact O-N 3.23Å; P919-L922 HydrophobicContact CB-CD1 4.44Å
920	R	51.8	Low	45.5	Very low	241 Å²	241	131.9 Å²	131.9	91%	0.909	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	-15.4	176	-65.4	-174	177.1	-164.4	-2.8	114.1	P918	P918-R920 PolarHBondContact O-N 2.96Å
921	E	49.3	Very low	45.9	Very low	75 Å²	75	129.5 Å²	129.5	35%	0.35	68%	0.677	S	S	.	*	S	Bend	trans	-110.2	-1.8	-176	-57.4	-150	109.1	0	0	114	V917 P918 P919 R923 K924	V917-E921 HydrophobicContact CG1-CB 3.77Å; P918-E921 PolarHBondContact O-N 3.04Å; P919-E921 VanDerWaalsContact C-N 3.3Å; P919-E921 PolarHBondContact O-N 3.23Å; E921-R923 PolarHBondContact O-N 2.86Å; E921-R923 VanDerWaalsContact O-N 3.13Å; E921-K924 WeakPolarHBondContact O-CB 3.24Å; E921-K924 PolarHBondContact O-N 2.8Å; E921-K924 IonicContact OE1-NZ 3.58Å; E921-K924 PolarHBondContact OE1-NZ 2.66Å
922	L	51.7	Low	45.7	Very low	105 Å²	105	131.8 Å²	131.8	55%	0.55	68%	0.681	S	S	.	*	G	3₁₀ helix	trans	-54.1	-33.3	175.9	-72.3	168.5	0	0	0	113.2	P919 K924 Y925 S926	P919-L922 HydrophobicContact CB-CD1 4.44Å; L922-K924 PolarHBondContact O-N 3.37Å; L922-K924 VanDerWaalsContact O-N 3.11Å; L922-Y925 PolarHBondContact O-N 2.78Å; L922-S926 PolarHBondContact O-N 2.87Å
923	R	50.4	Low	45.9	Very low	222 Å²	222	135.5 Å²	135.5	84%	0.838	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-62.1	-14.1	174.5	-67.7	-171.8	-179.1	-172.3	-0.5	114.5	E921	E921-R923 PolarHBondContact O-N 2.86Å; E921-R923 VanDerWaalsContact O-N 3.13Å
924	K	50.1	Low	45.8	Very low	145 Å²	145	138.3 Å²	138.3	63%	0.63	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-96.7	-8.5	176.4	-57.7	177.3	-177.8	173.6	0	113.5	E921 L922	E921-K924 WeakPolarHBondContact O-CB 3.24Å; E921-K924 PolarHBondContact O-N 2.8Å; E921-K924 IonicContact OE1-NZ 3.58Å; E921-K924 PolarHBondContact OE1-NZ 2.66Å; L922-K924 PolarHBondContact O-N 3.37Å; L922-K924 VanDerWaalsContact O-N 3.11Å
925	Y	48.6	Very low	45.1	Very low	160 Å²	160	140 Å²	140	63%	0.627	69%	0.693	S	S	*	*	S	Bend	trans	-130.6	12.8	-171.5	-66.9	-74.8	0	0	0	113.2	V917 L922 P927	V917-Y925 HydrophobicContact CG1-CD2 4.06Å; V917-Y925 HydrophobicContact CG1-CE2 4.44Å; V917-Y925 HydrophobicContact CG2-CD2 4.47Å; L922-Y925 PolarHBondContact O-N 2.78Å; Y925-P927 WeakPolarHBondContact O-CD 3.13Å
926	S	42	Very low	44.5	Very low	64 Å²	64	139.8 Å²	139.8	45%	0.448	70%	0.695	S	S	.	*			trans	-77.3	120.4	168.2	-177.5	0	0	0	0	109.8	L922 L928	L922-S926 PolarHBondContact O-N 2.87Å; S926-L928 PolarHBondContact O-N 2.94Å; S926-L928 VanDerWaalsContact O-N 3.12Å
927	P	43.6	Very low	43.3	Very low	127 Å²	127	138.2 Å²	138.2	83%	0.825	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	-13	-173.3	-23.7	35	0	0	0	116	Y925	Y925-P927 WeakPolarHBondContact O-CD 3.13Å
928	L	40.1	Very low	41.9	Very low	138 Å²	138	142.4 Å²	142.4	72%	0.723	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.3	1.9	-166.5	-64.9	175.2	0	0	0	115	S926 S930	S926-L928 PolarHBondContact O-N 2.94Å; S926-L928 VanDerWaalsContact O-N 3.12Å; L928-S930 PolarHBondContact O-N 2.73Å
929	Q	43.6	Very low	40.5	Very low	148 Å²	148	143.7 Å²	143.7	69%	0.692	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.5	36.5	-171.2	-152.9	163.9	26.4	0	0	114.6
930	S	35.7	Very low	39.5	Very low	122 Å²	122	149.2 Å²	149.2	85%	0.853	75%	0.75	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.9	5.7	-178.1	-164.8	0	0	0	0	115.9	L928	L928-S930 PolarHBondContact O-N 2.73Å
931	S	38.4	Very low	38.3	Very low	112 Å²	112	141.5 Å²	141.5	78%	0.783	75%	0.745	S	S	*	*	S	Bend	trans	-131.7	3.6	-179.2	-160.7	0	0	0	0	115.6
932	L	36.8	Very low	37.3	Very low	170 Å²	170	145.4 Å²	145.4	89%	0.89	77%	0.767	S	S	*	*	S	Bend	trans	-112.8	59.8	174.5	-77.3	174.4	0	0	0	111.4
933	Q	38.4	Very low	36.2	Very low	182 Å²	182	148.5 Å²	148.5	85%	0.85	78%	0.779	S	S	*	*			trans	-165.8	91.7	160.3	-115.9	175.7	20.2	0	0	111.8
934	R	32	Very low	35.1	Very low	248 Å²	248	144.8 Å²	144.8	94%	0.936	78%	0.776	S	S	*	*			trans	173.3	115.4	140.8	-94.8	151.9	-164.8	-109.9	-0.7	111.5
935	L	26.5	Very low	33.9	Very low	165 Å²	165	142 Å²	142	86%	0.864	78%	0.775	S	S	*	*			trans	-88.3	161.4	140.9	-77.3	171.1	0	0	0	108.2
936	P	35.8	Very low	32.9	Very low	116 Å²	116	142.9 Å²	142.9	75%	0.753	78%	0.784	S	S	*	*			trans	-91.5	151.8	-160.1	34.9	-36	0	0	0	115.1
937	V	28.7	Very low	32.3	Very low	154 Å²	154	145.3 Å²	145.3	93%	0.933	80%	0.801	S	S	*	*			trans	-143.4	157.1	159.4	-176.3	0	0	0	0	108.1
938	D	26.9	Very low	31.5	Very low	142 Å²	142	150.7 Å²	150.7	76%	0.759	81%	0.805	S	S	*	*			trans	-86.5	144.8	-150.8	-111.6	-62.9	0	0	0	119.9
939	S	29.6	Very low	31.9	Very low	87 Å²	87	148.7 Å²	148.7	61%	0.608	80%	0.8	S	S	*	*				42.3	130.8	129.8	-68.4	0	0	0	0	125.5
940	K	28.9	Very low	31	Very low	211 Å²	211	152 Å²	152	92%	0.917	81%	0.807	S	S	*	*			trans	81.6	140.5	148.3	-64.9	163.8	-177.5	171.4	0	120.9
941	G	28.2	Very low	30.6	Very low	78 Å²	78	154.2 Å²	154.2	80%	0.804	80%	0.801	S	S	*	*			trans	141	95.7	152.3	0	0	0	0	0	117.4
942	L	27.3	Very low	30.1	Very low	158 Å²	158	155 Å²	155	83%	0.827	80%	0.796	S	S	*	*			trans	-62.4	170	-178.3	-98.7	68.6	0	0	0	117.8
943	Q	28.2	Very low	29.7	Very low	170 Å²	170	153.9 Å²	153.9	79%	0.794	79%	0.788	S	S	*	*			trans	77	145.6	154.5	-84	169.9	4.8	0	0	118.4
944	D	27.7	Very low	29.4	Very low	144 Å²	144	154.3 Å²	154.3	77%	0.77	78%	0.782	S	S	*	*			cis	-155.7	169.8	-9.8	-149.9	-8	0	0	0	113.3
945	S	25.8	Very low	29.4	Very low	87 Å²	87	148.3 Å²	148.3	61%	0.608	77%	0.765	S	S	*	*			trans	51.5	124	148.7	-146.6	0	0	0	0	125.1
946	E	27.5	Very low	29.6	Very low	177 Å²	177	152.3 Å²	152.3	83%	0.827	77%	0.768	S	S	*	*			trans	59.1	144	137.7	-73.3	-160.7	126.7	0	0	127.2
947	S	28.5	Very low	29.3	Very low	116 Å²	116	156.2 Å²	156.2	81%	0.811	77%	0.774	S	S	*	*			trans	90.4	103.1	143.7	75.7	0	0	0	0	122.2
948	R	26.2	Very low	30	Very low	239 Å²	239	154.7 Å²	154.7	90%	0.902	77%	0.767	S	S	*	*			trans	-74.1	-177.9	161.2	-89	178.5	171.3	-178.6	-0.8	112.4
949	P	50.1	Low	30.2	Very low	96 Å²	96	154.4 Å²	154.4	62%	0.623	77%	0.77	S	S	*	*			cis	-141.6	-166.7	-33.2	34.6	-13.2	0	0	0	114.6
950	R	24.9	Very low	30.5	Very low	218 Å²	218	154.3 Å²	154.3	82%	0.823	77%	0.774	S	S	*	*			trans	96.6	152	160.5	-61.7	162.3	172.4	176.6	-0.2	116.2
951	K	27.1	Very low	30.6	Very low	169 Å²	169	154.7 Å²	154.7	74%	0.735	77%	0.77	S	S	*	*			cis	-159.4	137.9	-0.3	-126.9	172.7	179.4	-175.6	0	114.4
952	N	27.8	Very low	30.9	Very low	127 Å²	127	155.7 Å²	155.7	68%	0.679	76%	0.76	S	S	*	*			trans	41.7	125.9	134.7	-64.8	27.9	0	0	0	125.9
953	M	27.8	Very low	31.3	Very low	148 Å²	148	156 Å²	156	73%	0.729	76%	0.757	S	S	*	*			trans	73.7	165	131.5	-61.9	-175.7	99.7	0	0	118.9
954	R	31.5	Very low	31.5	Very low	191 Å²	191	153.3 Å²	153.3	72%	0.721	76%	0.758	S	S	*	*			cis	-158.7	148.6	23.4	-157.3	159.1	-177.4	-165.4	-8.5	117.2
955	E	33.1	Very low	31.7	Very low	122 Å²	122	150.9 Å²	150.9	57%	0.57	76%	0.758	S	S	*	*			trans	14	149.4	153.3	-58.8	159.6	-154.6	0	0	124
956	R	30.7	Very low	32.6	Very low	248 Å²	248	152.4 Å²	152.4	94%	0.936	77%	0.765	S	S	*	*				-165.6	168	111.4	-103.2	161.8	-178.1	-164.4	-1.8	115.8
957	K	28.8	Very low	32.8	Very low	199 Å²	199	152.8 Å²	152.8	87%	0.865	77%	0.767	S	S	*	*			trans	-120.6	-179.3	-177.3	-82.1	-174.3	178.1	-179.4	0	108.8
958	P	44.2	Very low	32.8	Very low	122 Å²	122	159 Å²	159	79%	0.792	77%	0.773	S	S	*	*			cis	-143.6	-141.5	21.2	44.4	-20.7	0	0	0	116.7
959	V	31	Very low	33	Very low	136 Å²	136	159 Å²	159	82%	0.824	77%	0.773	S	S	*	*			trans	-146.4	170.8	-152.9	-126.3	0	0	0	0	109.9
960	A	34.8	Very low	33.2	Very low	85 Å²	85	160.8 Å²	160.8	70%	0.702	78%	0.784	S	S	*	*			cis	-164.1	-165.1	10.7	0	0	0	0	0	110.7
961	R	31.6	Very low	33.4	Very low	219 Å²	219	154 Å²	154	83%	0.826	78%	0.782	S	S	*	*			trans	87	149.5	163.6	-73.4	-173.8	128.4	103.2	-2.8	117.8
962	T	35.5	Very low	33.7	Very low	98 Å²	98	156 Å²	156	60%	0.601	79%	0.793	S	S	*	*			cis	-151.4	148.2	4.9	-6.4	0	0	0	0	113.4
963	Q	34.2	Very low	33.8	Very low	164 Å²	164	153.6 Å²	153.6	77%	0.766	80%	0.799	S	S	*	*			trans	34	149.5	133.9	-71.2	167.8	-9.8	0	0	121.9
964	S	32.6	Very low	34	Very low	114 Å²	114	156.1 Å²	156.1	80%	0.797	81%	0.806	S	S	*	*			cis	-167.5	166	-1.3	40.1	0	0	0	0	111.8
965	A	31.9	Very low	33.9	Very low	94 Å²	94	155.6 Å²	155.6	78%	0.777	81%	0.812	S	S	*	*			trans	-84.9	-177.2	177.1	0	0	0	0	0	112.7
966	P	46	Very low	33.7	Very low	118 Å²	118	154 Å²	154	77%	0.766	82%	0.819	S	S	*	*			cis	-153.3	171.4	43.7	44.7	-22.8	0	0	0	120.8
967	H	30.8	Very low	33.7	Very low	185 Å²	185	149.1 Å²	149.1	86%	0.856	81%	0.811	S	S	*	*			trans	30.3	124.9	145.8	-87.4	51.7	0	0	0	123.3
968	R	28.7	Very low	33.8	Very low	247 Å²	247	146.9 Å²	146.9	93%	0.932	80%	0.801	S	S	*	*				-176.5	170.3	99.9	-116.7	-172.2	176.1	-156.3	0.5	115.7
969	R	29.8	Very low	33.2	Very low	240 Å²	240	150.4 Å²	150.4	91%	0.906	80%	0.799	S	S	*	*			trans	-58.9	171.5	-171	-88	-173.6	-179	-160.2	0.3	119
970	P	55.3	Low	33.4	Very low	133 Å²	133	150.2 Å²	150.2	86%	0.864	79%	0.789	S	S	*	*			trans	-92.9	173.5	-165.5	38.5	-39.1	0	0	0	116.5
971	G	29.1	Very low	33.1	Very low	75 Å²	75	152.4 Å²	152.4	77%	0.773	79%	0.787	S	S	*	*			trans	-166	160.9	172.5	0	0	0	0	0	114.1
972	H	32.5	Very low	33.5	Very low	210 Å²	210	146.7 Å²	146.7	97%	0.972	78%	0.781	S	S	*	*			trans	-84.5	160.5	-174.6	-56	-93.8	0	0	0	114.6
973	G	29.8	Very low	33.5	Very low	78 Å²	78	146.5 Å²	146.5	80%	0.804	78%	0.783	S	S	*	*			trans	-169.9	143.2	164.5	0	0	0	0	0	113
974	K	31.6	Very low	33.3	Very low	200 Å²	200	147.3 Å²	147.3	87%	0.87	79%	0.787	S	S	*	*			trans	-116.6	167.6	-179.5	-68.3	-178.8	177	178.9	0	111.7
975	Q	29.4	Very low	33.3	Very low	181 Å²	181	145.7 Å²	145.7	85%	0.846	78%	0.781	S	S	*	*			trans	74.7	130.9	169.6	-59.4	169.8	-43	0	0	114.9
976	A	29.8	Very low	33	Very low	87 Å²	87	149.4 Å²	149.4	72%	0.719	79%	0.787	S	S	*	*			cis	92.6	150.7	18	0	0	0	0	0	116.6
977	L	31.3	Very low	32.6	Very low	147 Å²	147	148.7 Å²	148.7	77%	0.77	78%	0.782	S	S	*	*			trans	82.1	149.8	179.8	-52.2	170.5	0	0	0	114.2
978	K	29.6	Very low	32.4	Very low	151 Å²	151	145.6 Å²	145.6	66%	0.657	78%	0.777	S	S	*	*			cis	-164.8	148.2	11	-137	163.9	-175	171.1	0	114.6
979	R	32.3	Very low	32.3	Very low	196 Å²	196	137.8 Å²	137.8	74%	0.74	76%	0.759	S	S	*	*			trans	67.7	155.1	140.1	-92.1	175.4	173.4	-165.2	-11.5	120.3
980	Q	34.2	Very low	32.1	Very low	132 Å²	132	132.6 Å²	132.6	62%	0.617	75%	0.75	S	S	*	*			cis	-164.1	-176.7	-12.8	-142.2	174.1	-103.7	0	0	106.5
981	I	29.6	Very low	30.8	Very low	132 Å²	132	133.2 Å²	133.2	68%	0.677	74%	0.741	S	S	*	*			cis	-154.7	163.8	11	-24.7	152.9	0	0	0	110.1
982	S	38.9	Very low	30.7	Very low	99 Å²	99	137 Å²	137	69%	0.692	74%	0.738	S	S	*	*			trans	63.6	143.7	146.5	50	0	0	0	0	121.5
983	S	36	Very low	30.5	Very low	93 Å²	93	134.9 Å²	134.9	65%	0.65	73%	0.729	S	S	*	*			cis	-166.9	156.2	-10.8	45.5	0	0	0	0	113.4
984	E	31.1	Very low	30.2	Very low	181 Å²	181	139 Å²	139	85%	0.846	73%	0.728	S	S	*	*			trans	63.7	149.5	154.2	-68.1	160	141.9	0	0	121.1
985	A	31.7	Very low	29.9	Very low	81 Å²	81	137.5 Å²	137.5	67%	0.669	72%	0.724	S	S	*	*			cis	-170.1	122.3	-28.2	0	0	0	0	0	113.3
986	L	25.3	Very low	29.8	Very low	172 Å²	172	133.3 Å²	133.3	90%	0.901	72%	0.719	S	S	*	*			trans	56.3	166.9	145.1	-66.7	173.8	0	0	0	121
987	P	38.3	Very low	29.7	Very low	102 Å²	102	138.1 Å²	138.1	66%	0.662	73%	0.727	S	S	*	*			cis	-129.3	177	-1.6	45.2	-30.3	0	0	0	116.4
988	T	26.1	Very low	29.5	Very low	121 Å²	121	137.1 Å²	137.1	74%	0.742	73%	0.727	S	S	*	*			trans	14.3	157.8	145.6	56.9	0	0	0	0	124
989	S	27	Very low	29.5	Very low	82 Å²	82	136.9 Å²	136.9	57%	0.573	73%	0.733	S	S	*	*			cis	178.7	173.2	-25.2	56	0	0	0	0	110.2
990	D	25.9	Very low	29.4	Very low	132 Å²	132	135.8 Å²	135.8	71%	0.706	74%	0.736	S	S	*	*			trans	70.1	133.6	148.1	-53.2	-33.5	0	0	0	124.3
991	H	27.8	Very low	29.5	Very low	146 Å²	146	135.1 Å²	135.1	68%	0.676	74%	0.743	S	S	*	*			trans	61.3	122.5	136.8	-77.8	-103.9	0	0	0	124.7
992	E	27	Very low	29.8	Very low	153 Å²	153	134.1 Å²	134.1	72%	0.715	74%	0.743	S	S	*	*				61.9	143.9	127.9	-73.2	160.9	178.9	0	0	124.7
993	E	27.1	Very low	29.3	Very low	167 Å²	167	137.1 Å²	137.1	78%	0.78	75%	0.75	S	S	*	*			trans	38.3	119.5	151.1	-57.9	-178.3	177.7	0	0	122.1
994	Q	24.1	Very low	28.9	Very low	165 Å²	165	137.9 Å²	137.9	77%	0.771	75%	0.75	S	S	*	*				179.7	143.4	100.3	-101.1	175.9	-13.1	0	0	116.4
995	E	25.3	Very low	29.2	Very low	168 Å²	168	138.5 Å²	138.5	79%	0.785	75%	0.745	S	S	*	*			trans	27.6	127.7	140.7	-64	-179	165.3	0	0	124.5
996	A	28.5	Very low	29.4	Very low	92 Å²	92	140.7 Å²	140.7	76%	0.76	75%	0.753	S	S	*	*				75.5	113.8	122.1	0	0	0	0	0	124.5
997	E	27.3	Very low	29.6	Very low	188 Å²	188	137.5 Å²	137.5	88%	0.879	74%	0.736	S	S	*	*				83.6	155.3	124.1	-146.2	179.3	-126.6	0	0	122.7
998	V	26.6	Very low	29.1	Very low	126 Å²	126	138.9 Å²	138.9	76%	0.764	74%	0.743	S	S	*	*			trans	89	144.9	164.6	-167.5	0	0	0	0	118.1
999	N	28.6	Very low	29.2	Very low	147 Å²	147	140.7 Å²	140.7	79%	0.786	75%	0.747	S	S	*	*			trans	-97.5	157.1	-164.4	-62	-66.4	0	0	0	115.6
1000	E	30.5	Very low	29.8	Very low	172 Å²	172	145.3 Å²	145.3	80%	0.804	76%	0.759	S	S	*	*			trans	67.2	163.9	149.7	-87.6	-162.3	168.1	0	0	118.3
1001	P	37.8	Very low	29.9	Very low	118 Å²	118	145 Å²	145	77%	0.766	77%	0.767	S	S	*	*			cis	-132.3	176.2	19.2	43.2	-26.5	0	0	0	118.4
1002	V	35.6	Very low	30	Very low	112 Å²	112	144.7 Å²	144.7	68%	0.679	77%	0.77	S	S	*	*			trans	-66.1	145.9	170.9	172.7	0	0	0	0	113
1003	I	27.2	Very low	29.9	Very low	162 Å²	162	148.6 Å²	148.6	83%	0.831	78%	0.778	S	S	*	*			trans	-163.8	149.9	137.4	-102.9	153.2	0	0	0	113.3
1004	T	27.7	Very low	30	Very low	108 Å²	108	152 Å²	152	66%	0.663	78%	0.784	S	S	*	*			trans	-77.5	174.1	-176.8	45.4	0	0	0	0	113.5
1005	R	37.1	Very low	31.6	Very low	195 Å²	195	149.5 Å²	149.5	74%	0.736	78%	0.782	S	S	*	*			cis	-163.9	176.3	-4	-119.8	176.5	-157.6	-158.3	13.5	107.6	D1007	R1005-D1007 WeakPolarHBondContact CD-OD2 3.44Å; R1005-D1007 IonicContact CZ-OD2 3.21Å; R1005-D1007 IonicContact NE-OD2 2.77Å; R1005-D1007 IonicContact NH1-OD2 2.68Å; R1005-D1007 PolarHBondContact NH1-OD2 2.76Å
1006	P	37.3	Very low	32.1	Very low	127 Å²	127	147.9 Å²	147.9	83%	0.825	79%	0.786	S	S	*	*				-144.8	158.2	104	36.9	-21.9	0	0	0	115.6
1007	D	29.5	Very low	32.2	Very low	104 Å²	104	148 Å²	148	56%	0.556	79%	0.787	S	S	*	*			trans	-119.2	176.1	173.2	-81.7	-67	0	0	0	111	R1005	R1005-D1007 WeakPolarHBondContact CD-OD2 3.44Å; R1005-D1007 IonicContact CZ-OD2 3.21Å; R1005-D1007 IonicContact NE-OD2 2.77Å; R1005-D1007 IonicContact NH1-OD2 2.68Å; R1005-D1007 PolarHBondContact NH1-OD2 2.76Å
1008	T	27.7	Very low	33.1	Very low	131 Å²	131	144.8 Å²	144.8	80%	0.804	78%	0.782	S	S	*	*			trans	77.8	155.3	166	78.3	0	0	0	0	116.1
1009	I	27.9	Very low	33.9	Very low	160 Å²	160	145.1 Å²	145.1	82%	0.821	78%	0.784	S	S	*	*			cis	-135.1	154.9	16	-58.2	169.8	0	0	0	111.2
1010	E	38.8	Very low	34.4	Very low	179 Å²	179	143.6 Å²	143.6	84%	0.836	78%	0.783	S	S	*	*			trans	-69.5	164.1	174.3	-53.1	173.6	108.3	0	0	115.4
1011	S	29.3	Very low	34.7	Very low	124 Å²	124	146.8 Å²	146.8	87%	0.867	79%	0.787	S	S	*	*			trans	-148.9	173.1	157.6	77.1	0	0	0	0	112.8
1012	N	29.1	Very low	34.9	Very low	140 Å²	140	148.3 Å²	148.3	75%	0.749	79%	0.788	S	S	*	*			trans	-141.4	152.3	-142.6	-140.2	-61.3	0	0	0	115.5
1013	R	25.7	Very low	34.6	Very low	235 Å²	235	149.8 Å²	149.8	89%	0.887	80%	0.796	S	S	*	*			trans	90.6	160.9	161.6	-58.1	-174.6	172.6	-164	-2.7	121.7
1014	R	29.5	Very low	35	Very low	240 Å²	240	149.1 Å²	149.1	91%	0.906	80%	0.795	S	S	*	*			trans	-107.8	-167.2	-171.4	-40.8	172.9	177.5	166.2	-4.6	110.8
1015	P	56.9	Low	35.1	Very low	112 Å²	112	149.3 Å²	149.3	73%	0.727	80%	0.801	S	S	*	*			cis	-134.7	-170.8	-8.8	41.8	-22.9	0	0	0	114.5
1016	P	35.5	Very low	35.2	Very low	133 Å²	133	147.8 Å²	147.8	86%	0.864	81%	0.807	S	S	*	*				-138.1	-171.5	113.6	39.2	-27.7	0	0	0	114.5
1017	A	29.6	Very low	34.8	Very low	94 Å²	94	153.5 Å²	153.5	78%	0.777	81%	0.812	S	S	*	*			trans	-149.4	-167.2	-171.1	0	0	0	0	0	110.7
1018	P	48.1	Very low	35.3	Very low	121 Å²	121	156.9 Å²	156.9	79%	0.786	83%	0.825	S	S	*	*			cis	-125.3	175.7	-25.2	36.2	-19.6	0	0	0	113.8
1019	V	42.2	Very low	36	Very low	133 Å²	133	156 Å²	156	81%	0.806	82%	0.824	S	S	*	*			trans	-104.1	140.7	173	-176.8	0	0	0	0	111.1
1020	P	40.5	Very low	36.7	Very low	115 Å²	115	153.7 Å²	153.7	75%	0.747	82%	0.822	S	S	*	*			trans	-127.5	82.5	-179.9	40.2	-25.7	0	0	0	115.6
1021	W	36	Very low	36.9	Very low	239 Å²	239	154.3 Å²	154.3	91%	0.905	83%	0.825	S	S	*	*			trans	-156.3	140.9	142	44.9	-73	0	0	0	112.2
1022	I	40.8	Very low	37.5	Very low	151 Å²	151	157.3 Å²	157.3	77%	0.774	83%	0.827	S	S	*	*			trans	-138.9	133.9	-179.1	-62.2	171.1	0	0	0	107.5
1023	V	29.3	Very low	38.2	Very low	142 Å²	142	159.1 Å²	159.1	86%	0.861	83%	0.829	S	S	*	*			trans	-140.2	123.8	156.1	-178.9	0	0	0	0	108.7
1024	N	36.4	Very low	39.2	Very low	148 Å²	148	151.2 Å²	151.2	79%	0.791	81%	0.813	S	S	*	*			trans	-83	142.9	168	-75.6	-17.7	0	0	0	110.2
1025	S	30.2	Very low	40.1	Very low	113 Å²	113	147.5 Å²	147.5	79%	0.79	81%	0.806	S	S	*	*				-162.1	138.4	128.1	-165.4	0	0	0	0	111.4
1026	N	38.7	Very low	39.7	Very low	162 Å²	162	148 Å²	148	87%	0.866	80%	0.803	S	S	*	*			trans	-63.6	137.5	154	-75.2	-14	0	0	0	109
1027	R	28.6	Very low	40.5	Very low	248 Å²	248	148.9 Å²	148.9	94%	0.936	80%	0.796	S	S	*	*			trans	-155	147.6	142.9	-160.5	165.9	-178	174.2	-1.1	109
1028	E	40.1	Very low	41.5	Very low	175 Å²	175	150.7 Å²	150.7	82%	0.818	79%	0.788	S	S	*	*			trans	-83	153.8	-164.9	-63.5	160	116.9	0	0	114.4
1029	S	43.2	Very low	41.7	Very low	112 Å²	112	152 Å²	152	78%	0.783	78%	0.782	S	S	*	*			trans	73.4	133.8	155.9	71.2	0	0	0	0	120
1030	S	42.9	Very low	42.5	Very low	112 Å²	112	148.8 Å²	148.8	78%	0.783	77%	0.765	S	S	*	*			trans	90.7	55.4	156.5	-44.6	0	0	0	0	119.6
1031	E	41.5	Very low	43.7	Very low	191 Å²	191	146.7 Å²	146.7	89%	0.893	75%	0.747	S	S	*	*			trans	-151.5	114.7	150.6	-119.9	157	-142.7	0	0	110.6
1032	M	42.4	Very low	45.4	Very low	188 Å²	188	140.8 Å²	140.8	93%	0.926	73%	0.733	S	S	*	*			trans	-151.3	42.2	-173.7	-158.5	173.6	-171	0	0	110.8
1033	K	44.2	Very low	47.1	Very low	178 Å²	178	139.2 Å²	139.2	77%	0.774	73%	0.726	S	S	*	*	S	Bend	trans	-143.9	-19.1	-177.2	-82.4	-164.1	169.2	-166.1	0	115.5
1034	A	46.9	Very low	49.2	Very low	69 Å²	69	138.2 Å²	138.2	57%	0.57	71%	0.707	S	S	*	*	H	α-helix	trans	-78.6	-27.9	-174.6	0	0	0	0	0	113.7
1035	E	47.6	Very low	51.3	Low	162 Å²	162	135.9 Å²	135.9	76%	0.757	69%	0.69	S	S	*	*	H	α-helix	trans	-79.3	-35.4	-172.9	-59	-171	144.8	0	0	112.7	Q1038 F1039	E1035-Q1038 PolarHBondContact O-N 2.86Å; E1035-F1039 PolarHBondContact O-N 3.04Å
1036	D	50.1	Low	54	Low	123 Å²	123	133.1 Å²	133.1	66%	0.658	68%	0.675	S	S	*	*	H	α-helix	trans	-65.5	-40.7	178.2	-71.1	-34.8	0	0	0	112.8	Q1038 F1039 S1040	D1036-Q1038 VanDerWaalsContact C-N 3.3Å; D1036-Q1038 PolarHBondContact O-N 2.85Å; D1036-F1039 PolarHBondContact O-N 3.15Å; D1036-S1040 WeakPolarHBondContact O-CB 3.3Å; D1036-S1040 PolarHBondContact O-N 2.51Å
1037	E	51	Low	56	Low	151 Å²	151	131.1 Å²	131.1	71%	0.706	66%	0.66	S	S	*	*	H	α-helix	trans	-65.7	-34.8	178.1	-68.6	-171.4	169.9	0	0	111.7	L1041	E1037-L1041 PolarHBondContact O-N 2.84Å
1038	Q	52	Low	58.6	Low	131 Å²	131	123.8 Å²	123.8	61%	0.612	64%	0.637	S	S	*	*	H	α-helix	trans	-68	-39.4	176.8	-157.7	79.4	68.5	0	0	111.6	E1035 D1036 L1042	E1035-Q1038 PolarHBondContact O-N 2.86Å; D1036-Q1038 VanDerWaalsContact C-N 3.3Å; D1036-Q1038 PolarHBondContact O-N 2.85Å; Q1038-L1042 PolarHBondContact O-N 2.87Å
1039	F	51.3	Low	60.7	Low	150 Å²	150	120.1 Å²	120.1	66%	0.658	62%	0.622	S	S	*	*	H	α-helix	trans	-67.2	-46.2	174	-106	-87.4	0	0	0	112.3	E1035 D1036 L1041 L1042 D1043	E1035-F1039 PolarHBondContact O-N 3.04Å; D1036-F1039 PolarHBondContact O-N 3.15Å; F1039-L1041 PolarHBondContact O-N 2.84Å; F1039-L1041 VanDerWaalsContact O-N 3.17Å; F1039-L1042 PolarHBondContact O-N 3.11Å; F1039-D1043 PolarHBondContact O-N 2.85Å
1040	S	58.7	Low	62.6	Low	65 Å²	65	118.2 Å²	118.2	46%	0.455	61%	0.609	S	S	.	*	H	α-helix	trans	-59.4	-28	178.8	-177.6	0	0	0	0	113.6	D1036 R1044	D1036-S1040 WeakPolarHBondContact O-CB 3.3Å; D1036-S1040 PolarHBondContact O-N 2.51Å; S1040-R1044 PolarHBondContact O-N 3.49Å; S1040-R1044 PolarHBondContact O-NH2 3.09Å; S1040-R1044 PolarHBondContact OG-NH2 2.77Å
1041	L	66.8	Low	64.6	Low	71 Å²	71	118.3 Å²	118.3	37%	0.372	60%	0.597	S	S	.	*	H	α-helix	trans	-75.2	-40.4	175.5	-135.3	175	0	0	0	111.8	E1037 F1039 R1044 H1045	E1037-L1041 PolarHBondContact O-N 2.84Å; F1039-L1041 PolarHBondContact O-N 2.84Å; F1039-L1041 VanDerWaalsContact O-N 3.17Å; L1041-R1044 PolarHBondContact O-N 3.09Å; L1041-H1045 VanDerWaalsContact CD2-CD2 3.5Å; L1041-H1045 WeakPolarHBondContact CD2-CD2 3.3Å; L1041-H1045 VanDerWaalsContact CD2-NE2 3.27Å; L1041-H1045 WeakPolarHBondContact CD2-NE2 3.42Å; L1041-H1045 PolarHBondContact O-CD2 2.71Å; L1041-H1045 PolarHBondContact O-N 3.36Å
1042	L	71.6	Confident	66.7	Low	115 Å²	115	114.6 Å²	114.6	60%	0.602	58%	0.583	S	S	*	*	H	α-helix	trans	-68.3	-41.8	178.8	-72.3	170.2	0	0	0	112.6	Q1038 F1039 R1044 H1045 A1046	Q1038-L1042 PolarHBondContact O-N 2.87Å; F1039-L1042 PolarHBondContact O-N 3.11Å; L1042-R1044 VanDerWaalsContact C-N 3.29Å; L1042-R1044 PolarHBondContact O-N 3.44Å; L1042-H1045 PolarHBondContact O-N 2.7Å; L1042-A1046 PolarHBondContact O-N 3.39Å
1043	D	75.9	Confident	68.9	Low	118 Å²	118	114.1 Å²	114.1	63%	0.631	57%	0.571	S	S	*	*	H	α-helix	trans	-60.4	-39.8	175.8	-105.7	-1	0	0	0	111.8	F1039 A1046 Q1047	F1039-D1043 PolarHBondContact O-N 2.85Å; D1043-A1046 WeakPolarHBondContact O-CB 3.24Å; D1043-A1046 PolarHBondContact O-N 2.95Å; D1043-Q1047 PolarHBondContact O-N 3.16Å
1044	R	72.8	Confident	71	Confident	121 Å²	121	110 Å²	110	46%	0.457	56%	0.557	S	S	.	*	H	α-helix	trans	-62.7	-45.1	177	-163.8	-177	-48.9	128.5	18.4	112.1	S1040 L1041 L1042 A1046 Q1047 E1048	S1040-R1044 PolarHBondContact O-N 3.49Å; S1040-R1044 PolarHBondContact O-NH2 3.09Å; S1040-R1044 PolarHBondContact OG-NH2 2.77Å; L1041-R1044 PolarHBondContact O-N 3.09Å; L1042-R1044 VanDerWaalsContact C-N 3.29Å; L1042-R1044 PolarHBondContact O-N 3.44Å; R1044-A1046 VanDerWaalsContact C-N 3.29Å; R1044-A1046 PolarHBondContact O-N 3.12Å; R1044-Q1047 PolarHBondContact O-N 3.06Å; R1044-E1048 WeakPolarHBondContact O-CG 3.34Å; R1044-E1048 PolarHBondContact O-N 3.36Å
1045	H	81.8	Confident	73	Confident	98 Å²	98	108.4 Å²	108.4	45%	0.454	55%	0.546	S	S	.	.	H	α-helix	trans	-65.5	-32.4	174.9	-77.8	-128.6	0	0	0	112.1	L1041 L1042 L1049	L1041-H1045 VanDerWaalsContact CD2-CD2 3.5Å; L1041-H1045 WeakPolarHBondContact CD2-CD2 3.3Å; L1041-H1045 VanDerWaalsContact CD2-NE2 3.27Å; L1041-H1045 WeakPolarHBondContact CD2-NE2 3.42Å; L1041-H1045 PolarHBondContact O-CD2 2.71Å; L1041-H1045 PolarHBondContact O-N 3.36Å; L1042-H1045 PolarHBondContact O-N 2.7Å; H1045-L1049 WeakPolarHBondContact O-CB 3.28Å; H1045-L1049 WeakPolarHBondContact O-CD1 3.34Å; H1045-L1049 VanDerWaalsContact O-CG 3.25Å; H1045-L1049 WeakPolarHBondContact O-CG 3.47Å; H1045-L1049 PolarHBondContact O-N 3.31Å; H1045-L1049 VanDerWaalsContact O-N 3.09Å
1046	A	85.2	Confident	74.9	Confident	56 Å²	56	105.9 Å²	105.9	46%	0.463	54%	0.537	S	S	.	.	H	α-helix	trans	-68.6	-38.9	173.5	0	0	0	0	0	112	L1042 D1043 R1044 L1049 S1050	L1042-A1046 PolarHBondContact O-N 3.39Å; D1043-A1046 WeakPolarHBondContact O-CB 3.24Å; D1043-A1046 PolarHBondContact O-N 2.95Å; R1044-A1046 VanDerWaalsContact C-N 3.29Å; R1044-A1046 PolarHBondContact O-N 3.12Å; A1046-L1049 PolarHBondContact O-N 3.45Å; A1046-S1050 PolarHBondContact O-N 2.74Å
1047	Q	81.4	Confident	76.8	Confident	120 Å²	120	106 Å²	106	56%	0.561	53%	0.534	S	S	*	.	H	α-helix	trans	-66	-48.2	174.1	-175.5	177.2	-20.7	0	0	111.8	D1043 R1044 L1049 S1050 E1051	D1043-Q1047 PolarHBondContact O-N 3.16Å; R1044-Q1047 PolarHBondContact O-N 3.06Å; Q1047-L1049 VanDerWaalsContact C-N 3.26Å; Q1047-L1049 PolarHBondContact O-N 2.84Å; Q1047-S1050 CarbonylContact O-C 3.6Å; Q1047-S1050 WeakPolarHBondContact O-CA 3.43Å; Q1047-S1050 WeakPolarHBondContact O-CB 3.5Å; Q1047-S1050 PolarHBondContact O-N 3.11Å; Q1047-E1051 WeakPolarHBondContact CG-OE1 3.43Å; Q1047-E1051 PolarHBondContact NE2-OE1 2.98Å; Q1047-E1051 PolarHBondContact O-N 3.18Å
1048	E	82.8	Confident	78.6	Confident	94 Å²	94	102.4 Å²	102.4	44%	0.439	52%	0.517	S	S	.	.	H	α-helix	trans	-55.6	-40.9	175.1	-72.9	169.7	-156.3	0	0	111.8	R1044 S1050 E1051 L1052	R1044-E1048 WeakPolarHBondContact O-CG 3.34Å; R1044-E1048 PolarHBondContact O-N 3.36Å; E1048-S1050 VanDerWaalsContact C-N 3.32Å; E1048-S1050 PolarHBondContact O-N 3.04Å; E1048-E1051 PolarHBondContact O-N 2.68Å; E1048-L1052 WeakPolarHBondContact O-CB 3.38Å; E1048-L1052 PolarHBondContact O-N 2.86Å
1049	L	84.8	Confident	80.2	Confident	97 Å²	97	99.6 Å²	99.6	51%	0.508	51%	0.508	S	S	.	.	H	α-helix	trans	-68.4	-27.4	174.1	-75.6	170.2	0	0	0	113.5	H1045 A1046 Q1047 R1053	H1045-L1049 WeakPolarHBondContact O-CB 3.28Å; H1045-L1049 WeakPolarHBondContact O-CD1 3.34Å; H1045-L1049 VanDerWaalsContact O-CG 3.25Å; H1045-L1049 WeakPolarHBondContact O-CG 3.47Å; H1045-L1049 PolarHBondContact O-N 3.31Å; H1045-L1049 VanDerWaalsContact O-N 3.09Å; A1046-L1049 PolarHBondContact O-N 3.45Å; Q1047-L1049 VanDerWaalsContact C-N 3.26Å; Q1047-L1049 PolarHBondContact O-N 2.84Å; L1049-R1053 WeakPolarHBondContact O-CD 3.49Å; L1049-R1053 WeakPolarHBondContact O-CG 3.42Å; L1049-R1053 PolarHBondContact O-N 2.74Å
1050	S	83.2	Confident	82	Confident	73 Å²	73	95.8 Å²	95.8	51%	0.51	50%	0.497	S	S	.	.	H	α-helix	trans	-76.3	-41.6	174.7	-162.5	0	0	0	0	111.6	A1046 Q1047 E1048 R1053 L1054	A1046-S1050 PolarHBondContact O-N 2.74Å; Q1047-S1050 CarbonylContact O-C 3.6Å; Q1047-S1050 WeakPolarHBondContact O-CA 3.43Å; Q1047-S1050 WeakPolarHBondContact O-CB 3.5Å; Q1047-S1050 PolarHBondContact O-N 3.11Å; E1048-S1050 VanDerWaalsContact C-N 3.32Å; E1048-S1050 PolarHBondContact O-N 3.04Å; S1050-R1053 PolarHBondContact O-N 3.12Å; S1050-L1054 PolarHBondContact O-N 2.86Å
1051	E	84.5	Confident	83.5	Confident	114 Å²	114	99.2 Å²	99.2	53%	0.533	51%	0.506	S	S	.	.	H	α-helix	trans	-65.5	-40.6	175.9	-69.9	174.6	-163.5	0	0	111.2	Q1047 E1048 R1053 L1054 G1055	Q1047-E1051 WeakPolarHBondContact CG-OE1 3.43Å; Q1047-E1051 PolarHBondContact NE2-OE1 2.98Å; Q1047-E1051 PolarHBondContact O-N 3.18Å; E1048-E1051 PolarHBondContact O-N 2.68Å; E1051-R1053 PolarHBondContact O-N 2.89Å; E1051-L1054 PolarHBondContact O-N 2.99Å; E1051-G1055 PolarHBondContact O-N 2.92Å
1052	L	85.4	Confident	84.6	Confident	113 Å²	113	102.6 Å²	102.6	59%	0.592	51%	0.514	S	S	*	.	H	α-helix	trans	-61.9	-38.5	171.7	-86.8	162.7	0	0	0	113.1	E1048 G1055 I1056	E1048-L1052 WeakPolarHBondContact O-CB 3.38Å; E1048-L1052 PolarHBondContact O-N 2.86Å; L1052-G1055 PolarHBondContact O-N 2.79Å; L1052-I1056 WeakPolarHBondContact O-CD1 3.18Å; L1052-I1056 VanDerWaalsContact O-CG1 3.3Å; L1052-I1056 WeakPolarHBondContact O-CG1 3.47Å; L1052-I1056 PolarHBondContact O-N 2.92Å
1053	R	88.4	Confident	85.2	Confident	178 Å²	178	102.5 Å²	102.5	67%	0.672	51%	0.511	S	S	*	.	H	α-helix	trans	-66	-47.2	176	-77.8	167.6	-178.1	-179.4	1.6	111.8	L1049 S1050 E1051 G1055 I1056 E1057	L1049-R1053 WeakPolarHBondContact O-CD 3.49Å; L1049-R1053 WeakPolarHBondContact O-CG 3.42Å; L1049-R1053 PolarHBondContact O-N 2.74Å; S1050-R1053 PolarHBondContact O-N 3.12Å; E1051-R1053 PolarHBondContact O-N 2.89Å; R1053-G1055 VanDerWaalsContact C-N 3.28Å; R1053-G1055 PolarHBondContact O-N 2.83Å; R1053-I1056 PolarHBondContact O-N 2.91Å; R1053-E1057 WeakPolarHBondContact O-CB 3.47Å; R1053-E1057 PolarHBondContact O-N 2.77Å
1054	L	89.9	Confident	86	Confident	92 Å²	92	102.8 Å²	102.8	48%	0.482	51%	0.512	S	S	.	.	H	α-helix	trans	-61.3	-38.3	176	-174.1	63.5	0	0	0	111.5	S1050 E1051 E1057 Q1058	S1050-L1054 PolarHBondContact O-N 2.86Å; E1051-L1054 PolarHBondContact O-N 2.99Å; L1054-E1057 PolarHBondContact O-N 2.84Å; L1054-Q1058 WeakPolarHBondContact O-CG 3.36Å; L1054-Q1058 PolarHBondContact O-N 3.43Å
1055	G	87.4	Confident	86.8	Confident	34 Å²	34	100.5 Å²	100.5	35%	0.351	51%	0.508	S	S	.	.	H	α-helix	trans	-61.9	-43.2	173.4	0	0	0	0	0	113.1	E1051 L1052 R1053 V1059	E1051-G1055 PolarHBondContact O-N 2.92Å; L1052-G1055 PolarHBondContact O-N 2.79Å; R1053-G1055 VanDerWaalsContact C-N 3.28Å; R1053-G1055 PolarHBondContact O-N 2.83Å; G1055-V1059 WeakPolarHBondContact O-CG2 3.04Å; G1055-V1059 PolarHBondContact O-N 3.44Å; G1055-V1059 VanDerWaalsContact O-N 3.12Å
1056	I	88.5	Confident	86.9	Confident	109 Å²	109	101.1 Å²	101.1	56%	0.559	51%	0.513	S	S	*	.	H	α-helix	trans	-64.5	-46.2	174.6	-69.9	162.7	0	0	0	110.8	L1052 R1053 Q1058 V1059 T1060	L1052-I1056 WeakPolarHBondContact O-CD1 3.18Å; L1052-I1056 VanDerWaalsContact O-CG1 3.3Å; L1052-I1056 WeakPolarHBondContact O-CG1 3.47Å; L1052-I1056 PolarHBondContact O-N 2.92Å; R1053-I1056 PolarHBondContact O-N 2.91Å; I1056-Q1058 PolarHBondContact O-N 3.27Å; I1056-V1059 WeakPolarHBondContact O-CA 3.4Å; I1056-V1059 WeakPolarHBondContact O-CB 3.25Å; I1056-V1059 PolarHBondContact O-N 3.07Å; I1056-T1060 PolarHBondContact O-N 2.92Å; I1056-T1060 PolarHBondContact O-OG1 2.8Å
1057	E	90.3	Very high	87	Confident	127 Å²	127	100.8 Å²	100.8	59%	0.593	51%	0.51	S	S	*	.	H	α-helix	trans	-58.7	-48	-179.2	-170	163.7	-147.1	0	0	111.4	R1053 L1054 V1059 T1060 E1061	R1053-E1057 WeakPolarHBondContact O-CB 3.47Å; R1053-E1057 PolarHBondContact O-N 2.77Å; L1054-E1057 PolarHBondContact O-N 2.84Å; E1057-V1059 VanDerWaalsContact C-N 3.29Å; E1057-V1059 PolarHBondContact O-N 2.61Å; E1057-T1060 WeakPolarHBondContact CA-OG1 3.4Å; E1057-T1060 PolarHBondContact O-N 2.88Å; E1057-T1060 PolarHBondContact O-OG1 3.08Å; E1057-E1061 WeakPolarHBondContact O-CB 3.42Å; E1057-E1061 PolarHBondContact O-N 2.75Å
1058	Q	88.2	Confident	87.5	Confident	74 Å²	74	100.4 Å²	100.4	35%	0.346	51%	0.506	S	S	.	.	H	α-helix	trans	-66.2	-24.2	173.7	-66.1	-179	22.6	0	0	114.1	L1054 I1056 R1062	L1054-Q1058 WeakPolarHBondContact O-CG 3.36Å; L1054-Q1058 PolarHBondContact O-N 3.43Å; I1056-Q1058 PolarHBondContact O-N 3.27Å; Q1058-R1062 VanDerWaalsContact C-NH1 3.32Å; Q1058-R1062 VanDerWaalsContact CB-NH1 3.33Å; Q1058-R1062 VanDerWaalsContact O-CG 3.28Å; Q1058-R1062 WeakPolarHBondContact O-CG 3.47Å; Q1058-R1062 PolarHBondContact O-N 2.87Å; Q1058-R1062 PolarHBondContact O-NH1 3.15Å
1059	V	86.5	Confident	87.8	Confident	72 Å²	72	103.6 Å²	103.6	44%	0.436	51%	0.514	S	S	.	.	H	α-helix	trans	-73.6	-47	172.1	167.1	0	0	0	0	109.4	G1055 I1056 E1057 E1061 R1062 E1063	G1055-V1059 WeakPolarHBondContact O-CG2 3.04Å; G1055-V1059 PolarHBondContact O-N 3.44Å; G1055-V1059 VanDerWaalsContact O-N 3.12Å; I1056-V1059 WeakPolarHBondContact O-CA 3.4Å; I1056-V1059 WeakPolarHBondContact O-CB 3.25Å; I1056-V1059 PolarHBondContact O-N 3.07Å; E1057-V1059 VanDerWaalsContact C-N 3.29Å; E1057-V1059 PolarHBondContact O-N 2.61Å; V1059-E1061 VanDerWaalsContact C-N 3.29Å; V1059-E1061 PolarHBondContact O-N 3.28Å; V1059-R1062 PolarHBondContact O-N 3.48Å; V1059-R1062 VanDerWaalsContact O-N 3.15Å; V1059-E1063 HydrophobicContact CG1-CG 4.39Å; V1059-E1063 WeakPolarHBondContact O-CG 3.5Å; V1059-E1063 PolarHBondContact O-N 3.26Å
1060	T	87.4	Confident	88	Confident	70 Å²	70	103.8 Å²	103.8	43%	0.429	52%	0.515	S	S	.	.	H	α-helix	trans	-62.9	-33.5	177.1	50.6	0	0	0	0	113	I1056 E1057 E1063 L1064	I1056-T1060 PolarHBondContact O-N 2.92Å; I1056-T1060 PolarHBondContact O-OG1 2.8Å; E1057-T1060 WeakPolarHBondContact CA-OG1 3.4Å; E1057-T1060 PolarHBondContact O-N 2.88Å; E1057-T1060 PolarHBondContact O-OG1 3.08Å; T1060-E1063 PolarHBondContact O-N 2.97Å; T1060-L1064 VanDerWaalsContact O-CB 3.29Å; T1060-L1064 WeakPolarHBondContact O-CB 3.43Å; T1060-L1064 PolarHBondContact O-N 2.89Å
1061	E	91.2	Very high	88.2	Confident	137 Å²	137	106.5 Å²	106.5	64%	0.64	52%	0.52	S	S	*	.	H	α-helix	trans	-64.5	-43.3	173.3	-173.7	177.7	-147.4	0	0	111.9	E1057 V1059 L1064 D1065	E1057-E1061 WeakPolarHBondContact O-CB 3.42Å; E1057-E1061 PolarHBondContact O-N 2.75Å; V1059-E1061 VanDerWaalsContact C-N 3.29Å; V1059-E1061 PolarHBondContact O-N 3.28Å; E1061-L1064 PolarHBondContact O-N 2.91Å; E1061-D1065 PolarHBondContact O-N 2.91Å
1062	R	88.8	Confident	88.5	Confident	142 Å²	142	105 Å²	105	54%	0.536	52%	0.515	S	S	.	.	H	α-helix	trans	-69.6	-35.9	176.1	-68.8	176.7	-163.8	104.3	-0.3	112.7	Q1058 V1059 L1064 M1066	Q1058-R1062 VanDerWaalsContact C-NH1 3.32Å; Q1058-R1062 VanDerWaalsContact CB-NH1 3.33Å; Q1058-R1062 VanDerWaalsContact O-CG 3.28Å; Q1058-R1062 WeakPolarHBondContact O-CG 3.47Å; Q1058-R1062 PolarHBondContact O-N 2.87Å; Q1058-R1062 PolarHBondContact O-NH1 3.15Å; V1059-R1062 PolarHBondContact O-N 3.48Å; V1059-R1062 VanDerWaalsContact O-N 3.15Å; R1062-L1064 VanDerWaalsContact C-N 3.31Å; R1062-M1066 WeakPolarHBondContact O-CB 3.42Å; R1062-M1066 PolarHBondContact O-N 3.21Å
1063	E	85.8	Confident	88.8	Confident	114 Å²	114	106 Å²	106	53%	0.533	52%	0.515	S	S	.	.	H	α-helix	trans	-64.2	-37.5	172.5	-73	179.5	158	0	0	111.4	V1059 T1060 A1067	V1059-E1063 HydrophobicContact CG1-CG 4.39Å; V1059-E1063 WeakPolarHBondContact O-CG 3.5Å; V1059-E1063 PolarHBondContact O-N 3.26Å; T1060-E1063 PolarHBondContact O-N 2.97Å; E1063-A1067 WeakPolarHBondContact O-CB 3.45Å; E1063-A1067 PolarHBondContact O-N 2.85Å
1064	L	91.4	Very high	88.8	Confident	124 Å²	124	101.8 Å²	101.8	65%	0.649	51%	0.505	S	S	*	.	H	α-helix	trans	-75.4	-39.9	179.5	-164.8	159.6	0	0	0	112.4	T1060 E1061 R1062 M1066 A1067 K1068	T1060-L1064 VanDerWaalsContact O-CB 3.29Å; T1060-L1064 WeakPolarHBondContact O-CB 3.43Å; T1060-L1064 PolarHBondContact O-N 2.89Å; E1061-L1064 PolarHBondContact O-N 2.91Å; R1062-L1064 VanDerWaalsContact C-N 3.31Å; L1064-M1066 VanDerWaalsContact C-N 3.34Å; L1064-A1067 PolarHBondContact O-N 3.49Å; L1064-K1068 WeakPolarHBondContact O-CB 3.22Å; L1064-K1068 PolarHBondContact O-N 2.9Å
1065	D	89.6	Confident	88.8	Confident	72 Å²	72	101.8 Å²	101.8	39%	0.385	51%	0.505	S	S	.	.	H	α-helix	trans	-63.2	-39.9	170.8	-176.1	62.4	0	0	0	111.7	E1061 K1068 R1069	E1061-D1065 PolarHBondContact O-N 2.91Å; D1065-K1068 PolarHBondContact O-N 3.29Å; D1065-R1069 VanDerWaalsContact O-CG 3.29Å; D1065-R1069 WeakPolarHBondContact O-CG 3.35Å; D1065-R1069 PolarHBondContact O-N 2.7Å; D1065-R1069 IonicContact OD1-NE 2.89Å; D1065-R1069 IonicContact OD1-NH2 2.73Å; D1065-R1069 IonicContact OD2-CZ 2.68Å; D1065-R1069 IonicContact OD2-NE 3.5Å; D1065-R1069 PolarHBondContact OD2-NE 3.16Å; D1065-R1069 IonicContact OD2-NH2 3.71Å; D1065-R1069 PolarHBondContact OD2-NH2 2.73Å
1066	M	84.1	Confident	88.9	Confident	112 Å²	112	105.7 Å²	105.7	55%	0.552	51%	0.514	S	S	*	.	H	α-helix	trans	-66.2	-40.2	174.2	178.3	165.6	48.9	0	0	112.6	R1062 L1064 R1069 L1070	R1062-M1066 WeakPolarHBondContact O-CB 3.42Å; R1062-M1066 PolarHBondContact O-N 3.21Å; L1064-M1066 VanDerWaalsContact C-N 3.34Å; M1066-R1069 PolarHBondContact O-N 2.6Å; M1066-L1070 HydrophobicContact CG-CD1 4.49Å; M1066-L1070 WeakPolarHBondContact O-CG 3.4Å; M1066-L1070 PolarHBondContact O-N 2.71Å; M1066-L1070 VanDerWaalsContact O-N 3.14Å
1067	A	87.8	Confident	88.8	Confident	48 Å²	48	102.7 Å²	102.7	40%	0.397	50%	0.503	S	S	.	.	H	α-helix	trans	-62.1	-44.9	173.4	0	0	0	0	0	111.4	E1063 L1064 R1069 L1070 E1071	E1063-A1067 WeakPolarHBondContact O-CB 3.45Å; E1063-A1067 PolarHBondContact O-N 2.85Å; L1064-A1067 PolarHBondContact O-N 3.49Å; A1067-R1069 PolarHBondContact O-N 2.9Å; A1067-L1070 WeakPolarHBondContact O-CB 3.4Å; A1067-L1070 PolarHBondContact O-N 3.24Å; A1067-L1070 VanDerWaalsContact O-N 3.14Å; A1067-E1071 PolarHBondContact O-N 2.85Å
1068	K	91.1	Very high	88.7	Confident	113 Å²	113	102.7 Å²	102.7	49%	0.491	50%	0.503	S	S	.	.	H	α-helix	trans	-61	-45.7	176.7	-171.6	-170.8	170.1	-169.1	0	112.1	L1064 D1065 L1070 E1071 D1072	L1064-K1068 WeakPolarHBondContact O-CB 3.22Å; L1064-K1068 PolarHBondContact O-N 2.9Å; D1065-K1068 PolarHBondContact O-N 3.29Å; K1068-L1070 PolarHBondContact O-N 3.23Å; K1068-E1071 WeakPolarHBondContact O-CB 3.18Å; K1068-E1071 PolarHBondContact O-N 2.75Å; K1068-D1072 PolarHBondContact O-N 3.24Å
1069	R	89.8	Confident	88.7	Confident	160 Å²	160	103.7 Å²	103.7	60%	0.604	51%	0.511	S	S	*	.	H	α-helix	trans	-59.2	-32.2	175.5	-70.6	170.2	-164.8	-107.7	2.1	112.8	D1065 M1066 A1067 F1073	D1065-R1069 VanDerWaalsContact O-CG 3.29Å; D1065-R1069 WeakPolarHBondContact O-CG 3.35Å; D1065-R1069 PolarHBondContact O-N 2.7Å; D1065-R1069 IonicContact OD1-NE 2.89Å; D1065-R1069 IonicContact OD1-NH2 2.73Å; D1065-R1069 IonicContact OD2-CZ 2.68Å; D1065-R1069 IonicContact OD2-NE 3.5Å; D1065-R1069 PolarHBondContact OD2-NE 3.16Å; D1065-R1069 IonicContact OD2-NH2 3.71Å; D1065-R1069 PolarHBondContact OD2-NH2 2.73Å; M1066-R1069 PolarHBondContact O-N 2.6Å; A1067-R1069 PolarHBondContact O-N 2.9Å; R1069-F1073 VanDerWaalsContact O-CB 3.28Å; R1069-F1073 WeakPolarHBondContact O-CB 3.38Å; R1069-F1073 PolarHBondContact O-N 2.97Å
1070	L	87.9	Confident	88.7	Confident	102 Å²	102	106 Å²	106	53%	0.534	52%	0.516	S	S	.	.	H	α-helix	trans	-71.6	-39.2	174.2	-72.2	165.3	0	0	0	111.7	M1066 A1067 K1068 F1073 I1074	M1066-L1070 HydrophobicContact CG-CD1 4.49Å; M1066-L1070 WeakPolarHBondContact O-CG 3.4Å; M1066-L1070 PolarHBondContact O-N 2.71Å; M1066-L1070 VanDerWaalsContact O-N 3.14Å; A1067-L1070 WeakPolarHBondContact O-CB 3.4Å; A1067-L1070 PolarHBondContact O-N 3.24Å; A1067-L1070 VanDerWaalsContact O-N 3.14Å; K1068-L1070 PolarHBondContact O-N 3.23Å; L1070-F1073 PolarHBondContact O-N 3.4Å; L1070-I1074 WeakPolarHBondContact O-CB 3.4Å; L1070-I1074 WeakPolarHBondContact O-CD1 3.46Å; L1070-I1074 WeakPolarHBondContact O-CG1 3.38Å; L1070-I1074 PolarHBondContact O-N 2.94Å
1071	E	88.9	Confident	88.5	Confident	129 Å²	129	106.6 Å²	106.6	60%	0.603	52%	0.517	S	S	*	.	H	α-helix	trans	-64	-47.7	172.5	-68.1	-179.8	160.7	0	0	111.6	A1067 K1068 F1073 I1074 I1075	A1067-E1071 PolarHBondContact O-N 2.85Å; K1068-E1071 WeakPolarHBondContact O-CB 3.18Å; K1068-E1071 PolarHBondContact O-N 2.75Å; E1071-F1073 VanDerWaalsContact C-N 3.31Å; E1071-F1073 PolarHBondContact O-N 2.9Å; E1071-I1074 PolarHBondContact O-N 3.12Å; E1071-I1074 VanDerWaalsContact O-N 3.15Å; E1071-I1075 WeakPolarHBondContact O-CG1 3.2Å; E1071-I1075 PolarHBondContact O-N 3.37Å
1072	D	89.5	Confident	88.5	Confident	82 Å²	82	102.3 Å²	102.3	44%	0.439	51%	0.505	S	S	.	.	H	α-helix	trans	-57.1	-42.5	175.8	-68.6	-32.7	0	0	0	111.3	K1068 I1075 Q1076	K1068-D1072 PolarHBondContact O-N 3.24Å; D1072-I1075 PolarHBondContact O-N 3.39Å; D1072-Q1076 WeakPolarHBondContact O-CB 3.44Å; D1072-Q1076 PolarHBondContact O-N 3.09Å
1073	F	91.6	Very high	88.4	Confident	134 Å²	134	102.2 Å²	102.2	59%	0.588	51%	0.512	S	S	*	.	H	α-helix	trans	-69.1	-36.8	176.3	-178.1	-98.5	0	0	0	113.2	R1069 L1070 E1071 Q1076 S1077	R1069-F1073 VanDerWaalsContact O-CB 3.28Å; R1069-F1073 WeakPolarHBondContact O-CB 3.38Å; R1069-F1073 PolarHBondContact O-N 2.97Å; L1070-F1073 PolarHBondContact O-N 3.4Å; E1071-F1073 VanDerWaalsContact C-N 3.31Å; E1071-F1073 PolarHBondContact O-N 2.9Å; F1073-Q1076 PolarHBondContact O-N 3.2Å; F1073-S1077 WeakPolarHBondContact O-CB 3.33Å; F1073-S1077 PolarHBondContact O-N 3.35Å
1074	I	89.3	Confident	88.4	Confident	91 Å²	91	101.4 Å²	101.4	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-64.5	-41.8	175.1	-74	164	0	0	0	110.4	L1070 E1071 S1077 Q1078	L1070-I1074 WeakPolarHBondContact O-CB 3.4Å; L1070-I1074 WeakPolarHBondContact O-CD1 3.46Å; L1070-I1074 WeakPolarHBondContact O-CG1 3.38Å; L1070-I1074 PolarHBondContact O-N 2.94Å; E1071-I1074 PolarHBondContact O-N 3.12Å; E1071-I1074 VanDerWaalsContact O-N 3.15Å; I1074-S1077 PolarHBondContact O-N 3.26Å; I1074-Q1078 WeakPolarHBondContact O-CG 3.4Å; I1074-Q1078 PolarHBondContact O-N 3.13Å
1075	I	90.1	Very high	88.2	Confident	91 Å²	91	102 Å²	102	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-62.8	-51.7	175.7	-66.3	162.7	0	0	0	110	E1071 D1072 S1077 Q1078 D1079	E1071-I1075 WeakPolarHBondContact O-CG1 3.2Å; E1071-I1075 PolarHBondContact O-N 3.37Å; D1072-I1075 PolarHBondContact O-N 3.39Å; I1075-S1077 VanDerWaalsContact C-N 3.25Å; I1075-S1077 PolarHBondContact O-N 3.1Å; I1075-Q1078 PolarHBondContact O-N 2.94Å; I1075-D1079 PolarHBondContact O-N 2.92Å
1076	Q	90	Very high	88.2	Confident	116 Å²	116	104 Å²	104	54%	0.542	52%	0.521	S	S	.	.	H	α-helix	trans	-56.4	-39	177.8	-172.5	179.6	22.6	0	0	112.6	D1072 F1073 Q1080	D1072-Q1076 WeakPolarHBondContact O-CB 3.44Å; D1072-Q1076 PolarHBondContact O-N 3.09Å; F1073-Q1076 PolarHBondContact O-N 3.2Å; Q1076-Q1080 PolarHBondContact O-N 2.73Å
1077	S	85.8	Confident	88.4	Confident	47 Å²	47	104 Å²	104	33%	0.329	52%	0.52	S	S	.	.	H	α-helix	trans	-68.8	-36.2	176.2	-170.5	0	0	0	0	112.5	F1073 I1074 I1075 N1081	F1073-S1077 WeakPolarHBondContact O-CB 3.33Å; F1073-S1077 PolarHBondContact O-N 3.35Å; I1074-S1077 PolarHBondContact O-N 3.26Å; I1075-S1077 VanDerWaalsContact C-N 3.25Å; I1075-S1077 PolarHBondContact O-N 3.1Å; S1077-N1081 PolarHBondContact O-N 3.04Å; S1077-N1081 VanDerWaalsContact O-N 3.09Å; S1077-N1081 PolarHBondContact O-ND2 2.98Å
1078	Q	87.4	Confident	88.4	Confident	126 Å²	126	104.9 Å²	104.9	59%	0.589	52%	0.52	S	S	*	.	H	α-helix	trans	-68.2	-42.3	174.8	-72.7	176	25.9	0	0	111.7	I1074 I1075 N1081 A1082	I1074-Q1078 WeakPolarHBondContact O-CG 3.4Å; I1074-Q1078 PolarHBondContact O-N 3.13Å; I1075-Q1078 PolarHBondContact O-N 2.94Å; Q1078-N1081 PolarHBondContact O-N 2.93Å; Q1078-A1082 PolarHBondContact O-N 3.05Å
1079	D	89	Confident	88.3	Confident	96 Å²	96	106.7 Å²	106.7	51%	0.513	53%	0.525	S	S	.	.	H	α-helix	trans	-62.9	-43	176.5	-71.2	-24.7	0	0	0	112.1	I1075 N1081 A1082 M1083	I1075-D1079 PolarHBondContact O-N 2.92Å; D1079-N1081 PolarHBondContact O-N 2.86Å; D1079-A1082 PolarHBondContact O-N 3.5Å; D1079-M1083 PolarHBondContact O-N 2.87Å
1080	Q	87.1	Confident	88.3	Confident	120 Å²	120	105.9 Å²	105.9	56%	0.561	53%	0.528	S	S	*	.	H	α-helix	trans	-60.9	-42.2	173	-79.2	-169.8	-37.6	0	0	112.3	Q1076 A1082 M1083 L1084	Q1076-Q1080 PolarHBondContact O-N 2.73Å; Q1080-A1082 VanDerWaalsContact C-N 3.31Å; Q1080-A1082 PolarHBondContact O-N 2.73Å; Q1080-M1083 PolarHBondContact O-N 3.08Å; Q1080-L1084 WeakPolarHBondContact O-CG 3.27Å; Q1080-L1084 PolarHBondContact O-N 2.83Å
1081	N	83.1	Confident	88.3	Confident	83 Å²	83	105.9 Å²	105.9	44%	0.444	53%	0.528	S	S	.	.	H	α-helix	trans	-64.6	-35.1	176	-83.7	-75	0	0	0	112.2	S1077 Q1078 D1079 Q1085	S1077-N1081 PolarHBondContact O-N 3.04Å; S1077-N1081 VanDerWaalsContact O-N 3.09Å; S1077-N1081 PolarHBondContact O-ND2 2.98Å; Q1078-N1081 PolarHBondContact O-N 2.93Å; D1079-N1081 PolarHBondContact O-N 2.86Å; N1081-Q1085 WeakPolarHBondContact O-CB 3.3Å; N1081-Q1085 VanDerWaalsContact O-CG 3.27Å; N1081-Q1085 WeakPolarHBondContact O-CG 3.36Å; N1081-Q1085 PolarHBondContact O-N 2.99Å
1082	A	90.4	Very high	88	Confident	47 Å²	47	106.2 Å²	106.2	39%	0.388	53%	0.528	S	S	.	.	H	α-helix	trans	-67.8	-41.9	175	0	0	0	0	0	112.2	Q1078 D1079 Q1080 Q1085 N1086	Q1078-A1082 PolarHBondContact O-N 3.05Å; D1079-A1082 PolarHBondContact O-N 3.5Å; Q1080-A1082 VanDerWaalsContact C-N 3.31Å; Q1080-A1082 PolarHBondContact O-N 2.73Å; A1082-Q1085 PolarHBondContact O-N 2.76Å; A1082-N1086 PolarHBondContact O-N 2.77Å; A1082-N1086 VanDerWaalsContact O-N 3.13Å
1083	M	87.8	Confident	88	Confident	140 Å²	140	105.9 Å²	105.9	69%	0.69	53%	0.526	S	S	*	.	H	α-helix	trans	-60.7	-48.9	173.6	-72.7	-173.5	171	0	0	111.8	D1079 Q1080 Q1085 N1086 E1087	D1079-M1083 PolarHBondContact O-N 2.87Å; Q1080-M1083 PolarHBondContact O-N 3.08Å; M1083-Q1085 VanDerWaalsContact C-N 3.29Å; M1083-Q1085 PolarHBondContact O-N 2.99Å; M1083-N1086 PolarHBondContact O-N 2.86Å; M1083-N1086 VanDerWaalsContact O-N 3.14Å; M1083-E1087 PolarHBondContact O-N 3.44Å
1084	L	84.6	Confident	87.9	Confident	96 Å²	96	104.2 Å²	104.2	50%	0.503	52%	0.523	S	S	.	.	H	α-helix	trans	-62.1	-34.3	178	-70.7	168.9	0	0	0	112.6	Q1080 V1088	Q1080-L1084 WeakPolarHBondContact O-CG 3.27Å; Q1080-L1084 PolarHBondContact O-N 2.83Å; L1084-V1088 VanDerWaalsContact O-CB 3.31Å; L1084-V1088 WeakPolarHBondContact O-CB 3.46Å; L1084-V1088 VanDerWaalsContact O-CG2 3.24Å; L1084-V1088 WeakPolarHBondContact O-CG2 3.49Å; L1084-V1088 PolarHBondContact O-N 3.26Å
1085	Q	86.6	Confident	87.7	Confident	137 Å²	137	104.1 Å²	104.1	64%	0.64	52%	0.523	S	S	*	.	H	α-helix	trans	-67.9	-36.7	174.8	-77.3	177.2	30.9	0	0	112.8	N1081 A1082 M1083 Y1089	N1081-Q1085 WeakPolarHBondContact O-CB 3.3Å; N1081-Q1085 VanDerWaalsContact O-CG 3.27Å; N1081-Q1085 WeakPolarHBondContact O-CG 3.36Å; N1081-Q1085 PolarHBondContact O-N 2.99Å; A1082-Q1085 PolarHBondContact O-N 2.76Å; M1083-Q1085 VanDerWaalsContact C-N 3.29Å; M1083-Q1085 PolarHBondContact O-N 2.99Å; Q1085-Y1089 WeakPolarHBondContact O-CB 3.48Å; Q1085-Y1089 PolarHBondContact O-N 2.93Å; Q1085-Y1089 VanDerWaalsContact O-N 3.07Å
1086	N	91.1	Very high	87.6	Confident	113 Å²	113	102.5 Å²	102.5	60%	0.604	52%	0.523	S	S	*	.	H	α-helix	trans	-68	-45.4	173.6	-74.9	-22	0	0	0	111.6	A1082 M1083 V1088 Y1089 E1090	A1082-N1086 PolarHBondContact O-N 2.77Å; A1082-N1086 VanDerWaalsContact O-N 3.13Å; M1083-N1086 PolarHBondContact O-N 2.86Å; M1083-N1086 VanDerWaalsContact O-N 3.14Å; N1086-V1088 PolarHBondContact O-N 2.99Å; N1086-Y1089 WeakPolarHBondContact O-CA 3.06Å; N1086-Y1089 WeakPolarHBondContact O-CB 3.44Å; N1086-Y1089 PolarHBondContact O-N 3.09Å; N1086-E1090 PolarHBondContact O-N 2.71Å
1087	E	88.6	Confident	87.7	Confident	112 Å²	112	100.5 Å²	100.5	52%	0.523	52%	0.518	S	S	.	.	H	α-helix	trans	-60.4	-44.1	176.9	-173.9	174.5	-160.2	0	0	111.6	M1083 Y1089 E1090 L1091	M1083-E1087 PolarHBondContact O-N 3.44Å; E1087-Y1089 PolarHBondContact O-N 2.83Å; E1087-E1090 PolarHBondContact O-N 2.88Å; E1087-L1091 HydrophobicContact CG-CD1 4.11Å; E1087-L1091 WeakPolarHBondContact O-CB 3.5Å; E1087-L1091 VanDerWaalsContact O-CG 3.3Å; E1087-L1091 WeakPolarHBondContact O-CG 3.31Å; E1087-L1091 PolarHBondContact O-N 2.76Å
1088	V	87.5	Confident	87.7	Confident	68 Å²	68	105.5 Å²	105.5	41%	0.412	53%	0.53	S	S	.	.	H	α-helix	trans	-62.8	-28	173.1	166.2	0	0	0	0	112.6	L1084 N1086 K1092	L1084-V1088 VanDerWaalsContact O-CB 3.31Å; L1084-V1088 WeakPolarHBondContact O-CB 3.46Å; L1084-V1088 VanDerWaalsContact O-CG2 3.24Å; L1084-V1088 WeakPolarHBondContact O-CG2 3.49Å; L1084-V1088 PolarHBondContact O-N 3.26Å; N1086-V1088 PolarHBondContact O-N 2.99Å; V1088-K1092 HydrophobicContact CG1-CD 4.27Å; V1088-K1092 VanDerWaalsContact O-CD 3.3Å; V1088-K1092 WeakPolarHBondContact O-CD 3.1Å; V1088-K1092 WeakPolarHBondContact O-CG 3.25Å; V1088-K1092 PolarHBondContact O-N 2.86Å
1089	Y	88.3	Confident	87.6	Confident	150 Å²	150	103.9 Å²	103.9	59%	0.588	53%	0.526	S	S	*	.	H	α-helix	trans	-75	-44.3	174	-178.8	-103.7	0	0	0	111.8	Q1085 N1086 E1087 K1092 N1093	Q1085-Y1089 WeakPolarHBondContact O-CB 3.48Å; Q1085-Y1089 PolarHBondContact O-N 2.93Å; Q1085-Y1089 VanDerWaalsContact O-N 3.07Å; N1086-Y1089 WeakPolarHBondContact O-CA 3.06Å; N1086-Y1089 WeakPolarHBondContact O-CB 3.44Å; N1086-Y1089 PolarHBondContact O-N 3.09Å; E1087-Y1089 PolarHBondContact O-N 2.83Å; Y1089-K1092 PolarHBondContact O-N 2.83Å; Y1089-N1093 WeakPolarHBondContact CD1-ND2 3.13Å; Y1089-N1093 WeakPolarHBondContact CE1-ND2 3.28Å; Y1089-N1093 PolarHBondContact O-N 2.9Å; Y1089-N1093 VanDerWaalsContact O-N 3.12Å; Y1089-N1093 PolarHBondContact O-ND2 2.92Å; Y1089-N1093 VanDerWaalsContact O-ND2 3.15Å
1090	E	89.6	Confident	87.6	Confident	143 Å²	143	106.3 Å²	106.3	67%	0.668	53%	0.534	S	S	*	.	H	α-helix	trans	-63.5	-44.6	175.5	-66.1	-157.4	146.5	0	0	112.2	N1086 E1087 K1092 N1093 L1094	N1086-E1090 PolarHBondContact O-N 2.71Å; E1087-E1090 PolarHBondContact O-N 2.88Å; E1090-K1092 VanDerWaalsContact C-N 3.3Å; E1090-K1092 PolarHBondContact O-N 2.82Å; E1090-N1093 PolarHBondContact O-N 2.86Å; E1090-N1093 VanDerWaalsContact O-N 3.13Å; E1090-L1094 WeakPolarHBondContact O-CB 3.4Å; E1090-L1094 PolarHBondContact O-N 2.73Å
1091	L	87.3	Confident	87.6	Confident	102 Å²	102	105.3 Å²	105.3	53%	0.534	53%	0.529	S	S	.	.	H	α-helix	trans	-59	-38.8	175.9	-72.1	170.5	0	0	0	112.4	E1087 L1094 L1095	E1087-L1091 HydrophobicContact CG-CD1 4.11Å; E1087-L1091 WeakPolarHBondContact O-CB 3.5Å; E1087-L1091 VanDerWaalsContact O-CG 3.3Å; E1087-L1091 WeakPolarHBondContact O-CG 3.31Å; E1087-L1091 PolarHBondContact O-N 2.76Å; L1091-L1094 PolarHBondContact O-N 3.03Å; L1091-L1095 VanDerWaalsContact O-CB 3.32Å; L1091-L1095 WeakPolarHBondContact O-CB 3.43Å; L1091-L1095 PolarHBondContact O-N 3.09Å
1092	K	84	Confident	87.7	Confident	136 Å²	136	106.4 Å²	106.4	59%	0.591	53%	0.534	S	S	*	.	H	α-helix	trans	-65.3	-40.6	174.6	-78	167.7	-175.2	167.2	0	112.7	V1088 Y1089 E1090 A1096	V1088-K1092 HydrophobicContact CG1-CD 4.27Å; V1088-K1092 VanDerWaalsContact O-CD 3.3Å; V1088-K1092 WeakPolarHBondContact O-CD 3.1Å; V1088-K1092 WeakPolarHBondContact O-CG 3.25Å; V1088-K1092 PolarHBondContact O-N 2.86Å; Y1089-K1092 PolarHBondContact O-N 2.83Å; E1090-K1092 VanDerWaalsContact C-N 3.3Å; E1090-K1092 PolarHBondContact O-N 2.82Å; K1092-A1096 PolarHBondContact O-N 2.94Å
1093	N	87.9	Confident	87.6	Confident	76 Å²	76	107.1 Å²	107.1	41%	0.406	54%	0.54	S	S	.	.	H	α-helix	trans	-66.5	-39.9	176.1	-66	-35.7	0	0	0	111.2	Y1089 E1090 A1096 V1097	Y1089-N1093 WeakPolarHBondContact CD1-ND2 3.13Å; Y1089-N1093 WeakPolarHBondContact CE1-ND2 3.28Å; Y1089-N1093 PolarHBondContact O-N 2.9Å; Y1089-N1093 VanDerWaalsContact O-N 3.12Å; Y1089-N1093 PolarHBondContact O-ND2 2.92Å; Y1089-N1093 VanDerWaalsContact O-ND2 3.15Å; E1090-N1093 PolarHBondContact O-N 2.86Å; E1090-N1093 VanDerWaalsContact O-N 3.13Å; N1093-A1096 PolarHBondContact O-N 2.84Å; N1093-V1097 WeakPolarHBondContact O-CG2 3.4Å; N1093-V1097 PolarHBondContact O-N 3.24Å
1094	L	91	Very high	87.7	Confident	99 Å²	99	103.2 Å²	103.2	52%	0.518	53%	0.526	S	S	.	.	H	α-helix	trans	-67.4	-42.1	178.4	-154.4	158.9	0	0	0	111.1	E1090 L1091 V1097 R1098	E1090-L1094 WeakPolarHBondContact O-CB 3.4Å; E1090-L1094 PolarHBondContact O-N 2.73Å; L1091-L1094 PolarHBondContact O-N 3.03Å; L1094-V1097 PolarHBondContact O-N 2.95Å; L1094-R1098 HydrophobicContact CD2-CG 4.19Å; L1094-R1098 WeakPolarHBondContact O-CG 3.32Å; L1094-R1098 PolarHBondContact O-N 3.23Å
1095	L	84.7	Confident	87.8	Confident	89 Å²	89	100.7 Å²	100.7	47%	0.466	52%	0.519	S	S	.	.	H	α-helix	trans	-61	-44.7	174.3	-173.3	147.5	0	0	0	111.8	L1091 V1097 R1098 D1099	L1091-L1095 VanDerWaalsContact O-CB 3.32Å; L1091-L1095 WeakPolarHBondContact O-CB 3.43Å; L1091-L1095 PolarHBondContact O-N 3.09Å; L1095-V1097 VanDerWaalsContact C-N 3.27Å; L1095-V1097 PolarHBondContact O-N 3.18Å; L1095-R1098 CarbonylContact O-C 3.5Å; L1095-R1098 WeakPolarHBondContact O-CA 3.2Å; L1095-R1098 WeakPolarHBondContact O-CB 3.39Å; L1095-R1098 PolarHBondContact O-N 3.22Å; L1095-D1099 WeakPolarHBondContact CD2-OD2 3.49Å; L1095-D1099 PolarHBondContact O-N 2.98Å
1096	A	88.8	Confident	87.8	Confident	56 Å²	56	98.2 Å²	98.2	46%	0.463	51%	0.514	S	S	.	.	H	α-helix	trans	-59.8	-35.3	176.1	0	0	0	0	0	113.2	K1092 N1093 E1100	K1092-A1096 PolarHBondContact O-N 2.94Å; N1093-A1096 PolarHBondContact O-N 2.84Å; A1096-E1100 PolarHBondContact O-N 3.36Å
1097	V	90.2	Very high	87.8	Confident	75 Å²	75	100 Å²	100	46%	0.455	52%	0.516	S	S	.	.	H	α-helix	trans	-70.2	-31.8	173.1	171.4	0	0	0	0	111.8	N1093 L1094 L1095 Q1101	N1093-V1097 WeakPolarHBondContact O-CG2 3.4Å; N1093-V1097 PolarHBondContact O-N 3.24Å; L1094-V1097 PolarHBondContact O-N 2.95Å; L1095-V1097 VanDerWaalsContact C-N 3.27Å; L1095-V1097 PolarHBondContact O-N 3.18Å; V1097-Q1101 VanDerWaalsContact O-CG 3.3Å; V1097-Q1101 WeakPolarHBondContact O-CG 3.5Å; V1097-Q1101 PolarHBondContact O-N 3.08Å
1098	R	85.8	Confident	87.8	Confident	151 Å²	151	101.5 Å²	101.5	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-70.9	-41.8	173.5	-65.7	-60.5	-173.8	160.6	7.1	111.9	L1094 L1095 E1100 Q1101 L1102	L1094-R1098 HydrophobicContact CD2-CG 4.19Å; L1094-R1098 WeakPolarHBondContact O-CG 3.32Å; L1094-R1098 PolarHBondContact O-N 3.23Å; L1095-R1098 CarbonylContact O-C 3.5Å; L1095-R1098 WeakPolarHBondContact O-CA 3.2Å; L1095-R1098 WeakPolarHBondContact O-CB 3.39Å; L1095-R1098 PolarHBondContact O-N 3.22Å; R1098-E1100 VanDerWaalsContact C-N 3.33Å; R1098-E1100 PolarHBondContact O-N 3.42Å; R1098-Q1101 WeakPolarHBondContact O-CB 3.44Å; R1098-Q1101 PolarHBondContact O-N 2.7Å; R1098-Q1101 VanDerWaalsContact O-N 3.15Å; R1098-L1102 WeakPolarHBondContact O-CB 3.45Å; R1098-L1102 PolarHBondContact O-N 2.88Å
1099	D	85.3	Confident	87.8	Confident	93 Å²	93	103.2 Å²	103.2	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-56.2	-44.6	174.7	-79.7	-28.8	0	0	0	112	L1095 L1102 A1103	L1095-D1099 WeakPolarHBondContact CD2-OD2 3.49Å; L1095-D1099 PolarHBondContact O-N 2.98Å; D1099-L1102 PolarHBondContact O-N 2.76Å; D1099-A1103 WeakPolarHBondContact O-CB 3.37Å; D1099-A1103 PolarHBondContact O-N 3.49Å
1100	E	90.4	Very high	87.8	Confident	147 Å²	147	97.7 Å²	97.7	69%	0.687	51%	0.512	S	S	*	.	H	α-helix	trans	-64.6	-40.4	176.8	-172.3	175.3	-158.9	0	0	112.1	A1096 R1098 S1104	A1096-E1100 PolarHBondContact O-N 3.36Å; R1098-E1100 VanDerWaalsContact C-N 3.33Å; R1098-E1100 PolarHBondContact O-N 3.42Å; E1100-S1104 VanDerWaalsContact O-CB 3.27Å; E1100-S1104 WeakPolarHBondContact O-CB 3.42Å; E1100-S1104 PolarHBondContact O-N 3.04Å
1101	Q	86.6	Confident	87.9	Confident	99 Å²	99	93.8 Å²	93.8	46%	0.463	50%	0.498	S	S	.	.	H	α-helix	trans	-64	-39.4	174.3	-71.4	173.7	20	0	0	112.2	V1097 R1098 S1104 A1105	V1097-Q1101 VanDerWaalsContact O-CG 3.3Å; V1097-Q1101 WeakPolarHBondContact O-CG 3.5Å; V1097-Q1101 PolarHBondContact O-N 3.08Å; R1098-Q1101 WeakPolarHBondContact O-CB 3.44Å; R1098-Q1101 PolarHBondContact O-N 2.7Å; R1098-Q1101 VanDerWaalsContact O-N 3.15Å; Q1101-S1104 PolarHBondContact O-N 3.37Å; Q1101-A1105 WeakPolarHBondContact O-CB 3.44Å; Q1101-A1105 PolarHBondContact O-N 2.97Å
1102	L	85.3	Confident	87.9	Confident	106 Å²	106	93.2 Å²	93.2	56%	0.555	50%	0.495	S	S	*	.	H	α-helix	trans	-69.9	-46.5	179.5	-147.1	173.3	0	0	0	110.4	R1098 D1099 S1104 A1105 T1106	R1098-L1102 WeakPolarHBondContact O-CB 3.45Å; R1098-L1102 PolarHBondContact O-N 2.88Å; D1099-L1102 PolarHBondContact O-N 2.76Å; L1102-S1104 VanDerWaalsContact C-N 3.29Å; L1102-S1104 PolarHBondContact O-N 3.4Å; L1102-A1105 WeakPolarHBondContact O-CA 3.46Å; L1102-A1105 WeakPolarHBondContact O-CB 3.33Å; L1102-A1105 PolarHBondContact O-N 3.11Å; L1102-T1106 PolarHBondContact O-N 3.25Å; L1102-T1106 PolarHBondContact O-OG1 3.13Å; L1102-T1106 VanDerWaalsContact O-OG1 3.13Å
1103	A	87.8	Confident	88	Confident	61 Å²	61	92.1 Å²	92.1	50%	0.504	49%	0.492	S	S	.	.	H	α-helix	trans	-57	-42.4	172.8	0	0	0	0	0	112.1	D1099 T1106 F1107	D1099-A1103 WeakPolarHBondContact O-CB 3.37Å; D1099-A1103 PolarHBondContact O-N 3.49Å; A1103-T1106 PolarHBondContact O-N 3.44Å; A1103-F1107 WeakPolarHBondContact O-CB 3.34Å; A1103-F1107 PolarHBondContact O-N 3.33Å
1104	S	90.5	Very high	88	Confident	58 Å²	58	94.9 Å²	94.9	41%	0.406	50%	0.502	S	S	.	.	H	α-helix	trans	-64.8	-35.4	173.8	175.1	0	0	0	0	113.1	E1100 Q1101 L1102 R1108	E1100-S1104 VanDerWaalsContact O-CB 3.27Å; E1100-S1104 WeakPolarHBondContact O-CB 3.42Å; E1100-S1104 PolarHBondContact O-N 3.04Å; Q1101-S1104 PolarHBondContact O-N 3.37Å; L1102-S1104 VanDerWaalsContact C-N 3.29Å; L1102-S1104 PolarHBondContact O-N 3.4Å; S1104-R1108 WeakPolarHBondContact O-CG 3.34Å; S1104-R1108 PolarHBondContact O-N 2.94Å; S1104-R1108 PolarHBondContact O-NE 3.02Å; S1104-R1108 PolarHBondContact OG-NH2 3.31Å
1105	A	86.4	Confident	87.8	Confident	43 Å²	43	96.4 Å²	96.4	36%	0.355	51%	0.507	S	S	.	.	H	α-helix	trans	-69.4	-48.4	174.2	0	0	0	0	0	111.7	Q1101 L1102 F1107 R1108 L1109	Q1101-A1105 WeakPolarHBondContact O-CB 3.44Å; Q1101-A1105 PolarHBondContact O-N 2.97Å; L1102-A1105 WeakPolarHBondContact O-CA 3.46Å; L1102-A1105 WeakPolarHBondContact O-CB 3.33Å; L1102-A1105 PolarHBondContact O-N 3.11Å; A1105-F1107 PolarHBondContact O-N 3.33Å; A1105-R1108 PolarHBondContact O-N 3.05Å; A1105-R1108 VanDerWaalsContact O-N 3.13Å; A1105-L1109 PolarHBondContact O-N 3.34Å
1106	T	87.6	Confident	88	Confident	85 Å²	85	100 Å²	100	52%	0.521	51%	0.514	S	S	.	.	H	α-helix	trans	-60.2	-41.8	178.4	-59.9	0	0	0	0	112.1	L1102 A1103 R1108 L1109 G1110	L1102-T1106 PolarHBondContact O-N 3.25Å; L1102-T1106 PolarHBondContact O-OG1 3.13Å; L1102-T1106 VanDerWaalsContact O-OG1 3.13Å; A1103-T1106 PolarHBondContact O-N 3.44Å; T1106-R1108 PolarHBondContact O-N 3.17Å; T1106-L1109 PolarHBondContact O-N 2.86Å; T1106-G1110 PolarHBondContact O-N 3.3Å
1107	F	90.8	Very high	88	Confident	151 Å²	151	102.1 Å²	102.1	66%	0.662	51%	0.514	S	S	*	.	H	α-helix	trans	-60	-44.5	174	-179.5	-97.4	0	0	0	112.1	A1103 A1105 L1109 G1110 V1111	A1103-F1107 WeakPolarHBondContact O-CB 3.34Å; A1103-F1107 PolarHBondContact O-N 3.33Å; A1105-F1107 PolarHBondContact O-N 3.33Å; F1107-L1109 VanDerWaalsContact C-N 3.32Å; F1107-L1109 PolarHBondContact O-N 2.97Å; F1107-G1110 PolarHBondContact O-N 3.15Å; F1107-V1111 HydrophobicContact CE1-CG2 4.2Å; F1107-V1111 HydrophobicContact CZ-CG2 4.28Å; F1107-V1111 WeakPolarHBondContact O-CG2 3.4Å; F1107-V1111 PolarHBondContact O-N 3.28Å
1108	R	88.6	Confident	88	Confident	143 Å²	143	101.7 Å²	101.7	54%	0.54	51%	0.507	S	S	.	.	H	α-helix	trans	-65.7	-33.9	176.3	-75.2	175.3	-73.8	161.3	-1.2	112.4	S1104 A1105 T1106 I1112	S1104-R1108 WeakPolarHBondContact O-CG 3.34Å; S1104-R1108 PolarHBondContact O-N 2.94Å; S1104-R1108 PolarHBondContact O-NE 3.02Å; S1104-R1108 PolarHBondContact OG-NH2 3.31Å; A1105-R1108 PolarHBondContact O-N 3.05Å; A1105-R1108 VanDerWaalsContact O-N 3.13Å; T1106-R1108 PolarHBondContact O-N 3.17Å; R1108-I1112 WeakPolarHBondContact O-CD1 3.22Å; R1108-I1112 WeakPolarHBondContact O-CG1 3.27Å; R1108-I1112 PolarHBondContact O-N 2.63Å
1109	L	87.1	Confident	88.1	Confident	105 Å²	105	99 Å²	99	55%	0.55	50%	0.504	S	S	.	.	H	α-helix	trans	-66.2	-47.1	176.1	-144.5	80.3	0	0	0	111.2	A1105 T1106 F1107 V1111 I1112 E1113	A1105-L1109 PolarHBondContact O-N 3.34Å; T1106-L1109 PolarHBondContact O-N 2.86Å; F1107-L1109 VanDerWaalsContact C-N 3.32Å; F1107-L1109 PolarHBondContact O-N 2.97Å; L1109-V1111 VanDerWaalsContact C-N 3.3Å; L1109-V1111 PolarHBondContact O-N 3.13Å; L1109-I1112 WeakPolarHBondContact O-CB 3.35Å; L1109-I1112 PolarHBondContact O-N 3.43Å; L1109-E1113 PolarHBondContact O-N 2.82Å
1110	G	88.5	Confident	88.3	Confident	34 Å²	34	100.3 Å²	100.3	35%	0.351	51%	0.507	S	S	.	.	H	α-helix	trans	-59.9	-36.5	178.8	0	0	0	0	0	113.7	T1106 F1107 E1113 E1114	T1106-G1110 PolarHBondContact O-N 3.3Å; F1107-G1110 PolarHBondContact O-N 3.15Å; G1110-E1113 PolarHBondContact O-N 2.71Å; G1110-E1114 PolarHBondContact O-N 2.83Å
1111	V	91.2	Very high	88.3	Confident	61 Å²	61	98.5 Å²	98.5	37%	0.37	49%	0.494	S	S	.	.	H	α-helix	trans	-64.1	-41.3	173.1	173.6	0	0	0	0	111.5	F1107 L1109 E1113 E1114 E1115	F1107-V1111 HydrophobicContact CE1-CG2 4.2Å; F1107-V1111 HydrophobicContact CZ-CG2 4.28Å; F1107-V1111 WeakPolarHBondContact O-CG2 3.4Å; F1107-V1111 PolarHBondContact O-N 3.28Å; L1109-V1111 VanDerWaalsContact C-N 3.3Å; L1109-V1111 PolarHBondContact O-N 3.13Å; V1111-E1113 VanDerWaalsContact C-N 3.3Å; V1111-E1113 PolarHBondContact O-N 2.83Å; V1111-E1114 PolarHBondContact O-N 2.74Å; V1111-E1115 PolarHBondContact O-N 2.88Å
1112	I	87.9	Confident	88.5	Confident	90 Å²	90	100.2 Å²	100.2	46%	0.462	50%	0.496	S	S	.	.	H	α-helix	trans	-68.4	-30.9	177.3	-66.3	165.3	0	0	0	111.3	R1108 L1109 R1116	R1108-I1112 WeakPolarHBondContact O-CD1 3.22Å; R1108-I1112 WeakPolarHBondContact O-CG1 3.27Å; R1108-I1112 PolarHBondContact O-N 2.63Å; L1109-I1112 WeakPolarHBondContact O-CB 3.35Å; L1109-I1112 PolarHBondContact O-N 3.43Å; I1112-R1116 WeakPolarHBondContact O-CB 3.44Å; I1112-R1116 PolarHBondContact O-N 2.91Å
1113	E	84.9	Confident	88.7	Confident	112 Å²	112	98.4 Å²	98.4	52%	0.523	49%	0.487	S	S	.	.	H	α-helix	trans	-73.6	-39.2	174.1	-69.6	-178.3	154.6	0	0	112.4	L1109 G1110 V1111 R1116 E1117	L1109-E1113 PolarHBondContact O-N 2.82Å; G1110-E1113 PolarHBondContact O-N 2.71Å; V1111-E1113 VanDerWaalsContact C-N 3.3Å; V1111-E1113 PolarHBondContact O-N 2.83Å; E1113-R1116 WeakPolarHBondContact O-CB 3.46Å; E1113-R1116 PolarHBondContact O-N 2.87Å; E1113-E1117 PolarHBondContact O-N 3.39Å
1114	E	88.1	Confident	88.7	Confident	134 Å²	134	100.5 Å²	100.5	63%	0.626	49%	0.49	S	S	*	.	H	α-helix	trans	-64.5	-43.3	172.9	-173.2	171.3	-157.6	0	0	111.6	G1110 V1111 R1116 E1117 E1118	G1110-E1114 PolarHBondContact O-N 2.83Å; V1111-E1114 PolarHBondContact O-N 2.74Å; E1114-R1116 VanDerWaalsContact C-N 3.33Å; E1114-R1116 PolarHBondContact O-N 2.93Å; E1114-E1117 PolarHBondContact O-N 3.49Å; E1114-E1118 WeakPolarHBondContact O-CB 3.35Å; E1114-E1118 PolarHBondContact O-N 2.84Å
1115	E	87.9	Confident	88.8	Confident	131 Å²	131	102.6 Å²	102.6	61%	0.612	50%	0.5	S	S	*	.	H	α-helix	trans	-61	-40.2	172.4	-75	-169.2	149.4	0	0	112.2	V1111 D1119	V1111-E1115 PolarHBondContact O-N 2.88Å; E1115-D1119 PolarHBondContact O-N 2.97Å
1116	R	89.4	Confident	88.9	Confident	165 Å²	165	103.2 Å²	103.2	62%	0.623	51%	0.505	S	S	*	.	H	α-helix	trans	-63.9	-49.4	176.7	178.3	-164.5	-60.7	-81.7	-0.7	112	I1112 E1113 E1114 E1118 D1119 E1120	I1112-R1116 WeakPolarHBondContact O-CB 3.44Å; I1112-R1116 PolarHBondContact O-N 2.91Å; E1113-R1116 WeakPolarHBondContact O-CB 3.46Å; E1113-R1116 PolarHBondContact O-N 2.87Å; E1114-R1116 VanDerWaalsContact C-N 3.33Å; E1114-R1116 PolarHBondContact O-N 2.93Å; R1116-E1118 VanDerWaalsContact C-N 3.26Å; R1116-E1118 PolarHBondContact O-N 2.81Å; R1116-D1119 PolarHBondContact O-N 2.98Å; R1116-E1120 PolarHBondContact O-N 2.9Å
1117	E	87.8	Confident	88.9	Confident	101 Å²	101	102.1 Å²	102.1	47%	0.472	50%	0.496	S	S	.	.	H	α-helix	trans	-64.1	-38.2	-178.2	-154.6	-148.4	132.6	0	0	110.3	E1113 E1114 E1120 R1121	E1113-E1117 PolarHBondContact O-N 3.39Å; E1114-E1117 PolarHBondContact O-N 3.49Å; E1117-E1120 PolarHBondContact O-N 3.22Å; E1117-R1121 VanDerWaalsContact O-CG 3.25Å; E1117-R1121 WeakPolarHBondContact O-CG 3.4Å; E1117-R1121 PolarHBondContact O-N 2.68Å; E1117-R1121 IonicContact OE1-CZ 3.17Å; E1117-R1121 VanDerWaalsContact OE1-CZ 3.3Å; E1117-R1121 IonicContact OE1-NE 2.75Å; E1117-R1121 PolarHBondContact OE1-NE 3.45Å; E1117-R1121 VanDerWaalsContact OE1-NE 3.1Å; E1117-R1121 IonicContact OE1-NH2 2.72Å; E1117-R1121 PolarHBondContact OE1-NH2 3.33Å; E1117-R1121 IonicContact OE2-CZ 2.7Å; E1117-R1121 IonicContact OE2-NH2 3.86Å; E1117-R1121 PolarHBondContact OE2-NH2 3Å
1118	E	89.6	Confident	88.8	Confident	66 Å²	66	96.7 Å²	96.7	31%	0.308	48%	0.479	S	S	.	.	H	α-helix	trans	-65.3	-37.7	174.9	176.8	62	-167.2	0	0	113	E1114 R1116 R1121 R1122	E1114-E1118 WeakPolarHBondContact O-CB 3.35Å; E1114-E1118 PolarHBondContact O-N 2.84Å; R1116-E1118 VanDerWaalsContact C-N 3.26Å; R1116-E1118 PolarHBondContact O-N 2.81Å; E1118-R1121 IonicContact OE2-CZ 2.62Å; E1118-R1121 IonicContact OE2-NH1 2.95Å; E1118-R1121 PolarHBondContact OE2-NH1 3.31Å; E1118-R1122 VanDerWaalsContact CG-CZ 3.41Å; E1118-R1122 WeakPolarHBondContact O-CD 3.5Å; E1118-R1122 VanDerWaalsContact O-CG 3.29Å; E1118-R1122 WeakPolarHBondContact O-CG 3.38Å; E1118-R1122 PolarHBondContact O-N 2.86Å; E1118-R1122 IonicContact OE1-CZ 2.8Å; E1118-R1122 IonicContact OE1-NE 2.88Å; E1118-R1122 PolarHBondContact OE1-NE 2.96Å; E1118-R1122 IonicContact OE1-NH2 3.19Å; E1118-R1122 PolarHBondContact OE1-NH2 3.44Å
1119	D	89.2	Confident	88.7	Confident	94 Å²	94	92 Å²	92	50%	0.503	47%	0.47	S	S	.	.	H	α-helix	trans	-72.8	-30.1	171.5	-92.8	2.2	0	0	0	113.5	E1115 R1116 R1122 L1123	E1115-D1119 PolarHBondContact O-N 2.97Å; R1116-D1119 PolarHBondContact O-N 2.98Å; D1119-R1122 WeakPolarHBondContact O-CB 3.37Å; D1119-R1122 PolarHBondContact O-N 3.41Å; D1119-R1122 WeakPolarHBondContact OD1-CD 3.36Å; D1119-R1122 IonicContact OD1-CZ 3.86Å; D1119-R1122 IonicContact OD1-NE 2.76Å; D1119-R1122 IonicContact OD1-NH1 2.72Å; D1119-R1122 PolarHBondContact OD1-NH1 3.33Å; D1119-L1123 PolarHBondContact O-N 3.17Å
1120	E	88.8	Confident	88.8	Confident	121 Å²	121	88.9 Å²	88.9	57%	0.565	46%	0.46	S	S	*	.	H	α-helix	trans	-66.7	-43.2	172	-172.8	162.1	-152.5	0	0	111.2	R1116 E1117 R1122 L1123 D1124	R1116-E1120 PolarHBondContact O-N 2.9Å; E1117-E1120 PolarHBondContact O-N 3.22Å; E1120-R1122 VanDerWaalsContact C-N 3.26Å; E1120-R1122 PolarHBondContact O-N 3.44Å; E1120-L1123 WeakPolarHBondContact O-CB 3.29Å; E1120-L1123 PolarHBondContact O-N 3.27Å; E1120-L1123 VanDerWaalsContact O-N 3.12Å; E1120-D1124 PolarHBondContact O-N 3.04Å
1121	R	91	Very high	88.8	Confident	108 Å²	108	92.3 Å²	92.3	41%	0.408	47%	0.467	S	S	.	.	H	α-helix	trans	-56.2	-39.9	170.5	-65.3	165.7	-158.6	150.1	-2.8	111.8	E1117 E1118 V1125	E1117-R1121 VanDerWaalsContact O-CG 3.25Å; E1117-R1121 WeakPolarHBondContact O-CG 3.4Å; E1117-R1121 PolarHBondContact O-N 2.68Å; E1117-R1121 IonicContact OE1-CZ 3.17Å; E1117-R1121 VanDerWaalsContact OE1-CZ 3.3Å; E1117-R1121 IonicContact OE1-NE 2.75Å; E1117-R1121 PolarHBondContact OE1-NE 3.45Å; E1117-R1121 VanDerWaalsContact OE1-NE 3.1Å; E1117-R1121 IonicContact OE1-NH2 2.72Å; E1117-R1121 PolarHBondContact OE1-NH2 3.33Å; E1117-R1121 IonicContact OE2-CZ 2.7Å; E1117-R1121 IonicContact OE2-NH2 3.86Å; E1117-R1121 PolarHBondContact OE2-NH2 3Å; E1118-R1121 IonicContact OE2-CZ 2.62Å; E1118-R1121 IonicContact OE2-NH1 2.95Å; E1118-R1121 PolarHBondContact OE2-NH1 3.31Å; R1121-V1125 WeakPolarHBondContact O-CG2 3.29Å; R1121-V1125 PolarHBondContact O-N 3.28Å; R1121-V1125 VanDerWaalsContact O-N 3.16Å
1122	R	89.9	Confident	88.7	Confident	135 Å²	135	96.4 Å²	96.4	51%	0.509	48%	0.476	S	S	.	.	H	α-helix	trans	-68.5	-38.9	176.6	-68.7	164.1	-169.1	161.6	-0.2	112.1	E1118 D1119 E1120 V1125 A1126	E1118-R1122 VanDerWaalsContact CG-CZ 3.41Å; E1118-R1122 WeakPolarHBondContact O-CD 3.5Å; E1118-R1122 VanDerWaalsContact O-CG 3.29Å; E1118-R1122 WeakPolarHBondContact O-CG 3.38Å; E1118-R1122 PolarHBondContact O-N 2.86Å; E1118-R1122 IonicContact OE1-CZ 2.8Å; E1118-R1122 IonicContact OE1-NE 2.88Å; E1118-R1122 PolarHBondContact OE1-NE 2.96Å; E1118-R1122 IonicContact OE1-NH2 3.19Å; E1118-R1122 PolarHBondContact OE1-NH2 3.44Å; D1119-R1122 WeakPolarHBondContact O-CB 3.37Å; D1119-R1122 PolarHBondContact O-N 3.41Å; D1119-R1122 WeakPolarHBondContact OD1-CD 3.36Å; D1119-R1122 IonicContact OD1-CZ 3.86Å; D1119-R1122 IonicContact OD1-NE 2.76Å; D1119-R1122 IonicContact OD1-NH1 2.72Å; D1119-R1122 PolarHBondContact OD1-NH1 3.33Å; E1120-R1122 VanDerWaalsContact C-N 3.26Å; E1120-R1122 PolarHBondContact O-N 3.44Å; R1122-V1125 PolarHBondContact O-N 3.44Å; R1122-A1126 PolarHBondContact O-N 2.99Å
1123	L	90.1	Very high	88.8	Confident	68 Å²	68	97.1 Å²	97.1	36%	0.356	48%	0.478	S	S	.	.	H	α-helix	trans	-63.9	-43.3	175.8	-177.8	61.5	0	0	0	111.7	L326 D1119 E1120 A1126 L1127	L326-L1123 HydrophobicContact CD2-CD1 4.36Å; D1119-L1123 PolarHBondContact O-N 3.17Å; E1120-L1123 WeakPolarHBondContact O-CB 3.29Å; E1120-L1123 PolarHBondContact O-N 3.27Å; E1120-L1123 VanDerWaalsContact O-N 3.12Å; L1123-A1126 WeakPolarHBondContact O-CB 3.33Å; L1123-A1126 PolarHBondContact O-N 3Å; L1123-L1127 HydrophobicContact CD1-CG 4.5Å; L1123-L1127 HydrophobicContact CG-CD1 4.17Å; L1123-L1127 WeakPolarHBondContact O-CG 3.49Å; L1123-L1127 PolarHBondContact O-N 3.44Å
1124	D	87.8	Confident	88.9	Confident	106 Å²	106	96 Å²	96	57%	0.567	48%	0.476	S	S	*	.	H	α-helix	trans	-63	-41.9	176.1	-99.8	5.9	0	0	0	112.5	E1120 A1126 L1127 A1128	E1120-D1124 PolarHBondContact O-N 3.04Å; D1124-A1126 VanDerWaalsContact C-N 3.28Å; D1124-A1126 PolarHBondContact O-N 3.24Å; D1124-L1127 PolarHBondContact O-N 2.9Å; D1124-A1128 WeakPolarHBondContact O-CB 3.19Å; D1124-A1128 PolarHBondContact O-N 2.94Å
1125	V	91.9	Very high	88.9	Confident	101 Å²	101	93.4 Å²	93.4	61%	0.612	47%	0.469	S	S	*	.	H	α-helix	trans	-61.6	-37.8	174	169.7	0	0	0	0	111.5	R1121 R1122 A1129	R1121-V1125 WeakPolarHBondContact O-CG2 3.29Å; R1121-V1125 PolarHBondContact O-N 3.28Å; R1121-V1125 VanDerWaalsContact O-N 3.16Å; R1122-V1125 PolarHBondContact O-N 3.44Å; V1125-A1129 PolarHBondContact O-N 3.16Å; V1125-A1129 VanDerWaalsContact O-N 3.12Å
1126	A	88.1	Confident	88.9	Confident	57 Å²	57	93.1 Å²	93.1	47%	0.471	47%	0.471	S	S	.	.	H	α-helix	trans	-71	-42.3	176.2	0	0	0	0	0	112.7	R1122 L1123 D1124 A1129 A1130	R1122-A1126 PolarHBondContact O-N 2.99Å; L1123-A1126 WeakPolarHBondContact O-CB 3.33Å; L1123-A1126 PolarHBondContact O-N 3Å; D1124-A1126 VanDerWaalsContact C-N 3.28Å; D1124-A1126 PolarHBondContact O-N 3.24Å; A1126-A1129 WeakPolarHBondContact O-CB 2.99Å; A1126-A1129 PolarHBondContact O-N 3.4Å; A1126-A1129 VanDerWaalsContact O-N 3.13Å; A1126-A1130 PolarHBondContact O-N 2.85Å
1127	L	87.4	Confident	88.7	Confident	62 Å²	62	90.9 Å²	90.9	33%	0.325	47%	0.468	S	S	.	.	H	α-helix	trans	-61.4	-46	174.7	-74.3	169.5	0	0	0	111.1	P328 L1123 D1124 A1129 A1130 E1131	P328-L1127 HydrophobicContact CB-CD2 4.25Å; P328-L1127 HydrophobicContact CG-CD2 4.3Å; L1123-L1127 HydrophobicContact CD1-CG 4.5Å; L1123-L1127 HydrophobicContact CG-CD1 4.17Å; L1123-L1127 WeakPolarHBondContact O-CG 3.49Å; L1123-L1127 PolarHBondContact O-N 3.44Å; D1124-L1127 PolarHBondContact O-N 2.9Å; L1127-A1129 PolarHBondContact O-N 3.4Å; L1127-A1130 PolarHBondContact O-N 3.43Å; L1127-A1130 VanDerWaalsContact O-N 3.1Å; L1127-E1131 PolarHBondContact O-N 2.85Å
1128	A	88.6	Confident	88.6	Confident	36 Å²	36	92.8 Å²	92.8	30%	0.298	48%	0.477	S	S	.	.	H	α-helix	trans	-62.7	-28	175	0	0	0	0	0	112.7	D1124 R1132	D1124-A1128 WeakPolarHBondContact O-CB 3.19Å; D1124-A1128 PolarHBondContact O-N 2.94Å; A1128-R1132 WeakPolarHBondContact O-CG 3.27Å; A1128-R1132 PolarHBondContact O-N 3.41Å; A1128-R1132 PolarHBondContact O-NH1 2.82Å
1129	A	88.4	Confident	88.5	Confident	44 Å²	44	96 Å²	96	36%	0.364	49%	0.492	S	S	.	.	H	α-helix	trans	-73.3	-40.7	171.8	0	0	0	0	0	112.4	V1125 A1126 L1127 R1132 M1133	V1125-A1129 PolarHBondContact O-N 3.16Å; V1125-A1129 VanDerWaalsContact O-N 3.12Å; A1126-A1129 WeakPolarHBondContact O-CB 2.99Å; A1126-A1129 PolarHBondContact O-N 3.4Å; A1126-A1129 VanDerWaalsContact O-N 3.13Å; L1127-A1129 PolarHBondContact O-N 3.4Å; A1129-R1132 PolarHBondContact O-N 3.48Å; A1129-M1133 PolarHBondContact O-N 2.82Å; A1129-M1133 VanDerWaalsContact O-N 3.09Å
1130	A	88.3	Confident	88.3	Confident	41 Å²	41	98.3 Å²	98.3	34%	0.339	50%	0.497	S	S	.	.	H	α-helix	trans	-64.1	-41.1	175.1	0	0	0	0	0	112.3	A1126 L1127 R1132 M1133 N1134	A1126-A1130 PolarHBondContact O-N 2.85Å; L1127-A1130 PolarHBondContact O-N 3.43Å; L1127-A1130 VanDerWaalsContact O-N 3.1Å; A1130-R1132 VanDerWaalsContact C-N 3.34Å; A1130-R1132 PolarHBondContact O-N 3.05Å; A1130-M1133 WeakPolarHBondContact O-CB 3.23Å; A1130-M1133 PolarHBondContact O-N 3.24Å; A1130-M1133 VanDerWaalsContact O-N 3.11Å; A1130-N1134 PolarHBondContact O-N 2.83Å; A1130-N1134 PolarHBondContact O-OD1 3.17Å
1131	E	87.8	Confident	88.1	Confident	105 Å²	105	94.9 Å²	94.9	49%	0.491	49%	0.49	S	S	.	.	H	α-helix	trans	-60.6	-41.5	174.2	-71.8	-164.4	147.7	0	0	112.2	L1127 M1133 N1134 V1135	L1127-E1131 PolarHBondContact O-N 2.85Å; E1131-M1133 VanDerWaalsContact C-N 3.28Å; E1131-M1133 PolarHBondContact O-N 3.02Å; E1131-N1134 PolarHBondContact O-N 2.92Å; E1131-V1135 WeakPolarHBondContact O-CG2 3.27Å; E1131-V1135 PolarHBondContact O-N 2.86Å
1132	R	90.4	Very high	87.8	Confident	147 Å²	147	91.1 Å²	91.1	56%	0.555	48%	0.484	S	S	*	.	H	α-helix	trans	-62.4	-35.1	174.3	-71.9	-175.8	-61.7	-92.4	7.6	112.3	A1128 A1129 A1130 L1136	A1128-R1132 WeakPolarHBondContact O-CG 3.27Å; A1128-R1132 PolarHBondContact O-N 3.41Å; A1128-R1132 PolarHBondContact O-NH1 2.82Å; A1129-R1132 PolarHBondContact O-N 3.48Å; A1130-R1132 VanDerWaalsContact C-N 3.34Å; A1130-R1132 PolarHBondContact O-N 3.05Å; R1132-L1136 WeakPolarHBondContact O-CG 3.27Å; R1132-L1136 PolarHBondContact O-N 3.13Å
1133	M	89.3	Confident	87.5	Confident	106 Å²	106	90.1 Å²	90.1	52%	0.522	49%	0.489	S	S	.	.	H	α-helix	trans	-68.1	-48.4	175.7	-169.2	172.4	72	0	0	111.4	A1129 A1130 E1131 V1135 L1136 E1137	A1129-M1133 PolarHBondContact O-N 2.82Å; A1129-M1133 VanDerWaalsContact O-N 3.09Å; A1130-M1133 WeakPolarHBondContact O-CB 3.23Å; A1130-M1133 PolarHBondContact O-N 3.24Å; A1130-M1133 VanDerWaalsContact O-N 3.11Å; E1131-M1133 VanDerWaalsContact C-N 3.28Å; E1131-M1133 PolarHBondContact O-N 3.02Å; M1133-V1135 VanDerWaalsContact C-N 3.29Å; M1133-V1135 PolarHBondContact O-N 3.23Å; M1133-L1136 WeakPolarHBondContact O-CA 3.24Å; M1133-L1136 WeakPolarHBondContact O-CB 3.47Å; M1133-L1136 PolarHBondContact O-N 2.79Å; M1133-E1137 PolarHBondContact O-N 2.81Å
1134	N	86.7	Confident	87.2	Confident	88 Å²	88	91.7 Å²	91.7	47%	0.471	50%	0.495	S	S	.	.	H	α-helix	trans	-57.9	-40.6	176.7	-70.7	6.2	0	0	0	112.1	A1130 E1131 L1136 E1137 E1138	A1130-N1134 PolarHBondContact O-N 2.83Å; A1130-N1134 PolarHBondContact O-OD1 3.17Å; E1131-N1134 PolarHBondContact O-N 2.92Å; N1134-L1136 VanDerWaalsContact C-N 3.32Å; N1134-L1136 PolarHBondContact O-N 3.19Å; N1134-E1137 PolarHBondContact O-N 2.95Å; N1134-E1138 PolarHBondContact O-N 3.33Å
1135	V	89.3	Confident	87	Confident	80 Å²	80	93.2 Å²	93.2	49%	0.485	50%	0.497	S	S	.	.	H	α-helix	trans	-62.4	-39	175.3	170.5	0	0	0	0	111.6	E1131 M1133 E1138 Q1139	E1131-V1135 WeakPolarHBondContact O-CG2 3.27Å; E1131-V1135 PolarHBondContact O-N 2.86Å; M1133-V1135 VanDerWaalsContact C-N 3.29Å; M1133-V1135 PolarHBondContact O-N 3.23Å; V1135-E1138 PolarHBondContact O-N 2.92Å; V1135-Q1139 VanDerWaalsContact O-CG 3.29Å; V1135-Q1139 WeakPolarHBondContact O-CG 3.48Å; V1135-Q1139 PolarHBondContact O-N 3.46Å
1136	L	88.1	Confident	86.5	Confident	124 Å²	124	93.1 Å²	93.1	65%	0.649	49%	0.493	S	S	*	.	H	α-helix	trans	-67.3	-37.4	175.3	-69.8	168.3	0	0	0	112	R1132 M1133 N1134 Q1139 F1140	R1132-L1136 WeakPolarHBondContact O-CG 3.27Å; R1132-L1136 PolarHBondContact O-N 3.13Å; M1133-L1136 WeakPolarHBondContact O-CA 3.24Å; M1133-L1136 WeakPolarHBondContact O-CB 3.47Å; M1133-L1136 PolarHBondContact O-N 2.79Å; N1134-L1136 VanDerWaalsContact C-N 3.32Å; N1134-L1136 PolarHBondContact O-N 3.19Å; L1136-Q1139 PolarHBondContact O-N 3.06Å; L1136-F1140 WeakPolarHBondContact O-CB 3.43Å; L1136-F1140 PolarHBondContact O-N 3.3Å
1137	E	84.9	Confident	86	Confident	118 Å²	118	95.7 Å²	95.7	55%	0.551	50%	0.498	S	S	*	.	H	α-helix	trans	-65.2	-42	173.5	-68.2	-173.6	173.3	0	0	112.2	M1133 N1134 F1140 A1141	M1133-E1137 PolarHBondContact O-N 2.81Å; N1134-E1137 PolarHBondContact O-N 2.95Å; E1137-F1140 PolarHBondContact O-N 2.91Å; E1137-A1141 WeakPolarHBondContact O-CB 3.47Å; E1137-A1141 PolarHBondContact O-N 3.5Å
1138	E	85.7	Confident	85.4	Confident	142 Å²	142	98.4 Å²	98.4	66%	0.664	51%	0.509	S	S	*	.	H	α-helix	trans	-62.3	-43.1	173.8	-75.2	-167.9	160.9	0	0	112.3	N1134 V1135 F1140 A1141 G1142	N1134-E1138 PolarHBondContact O-N 3.33Å; V1135-E1138 PolarHBondContact O-N 2.92Å; E1138-F1140 VanDerWaalsContact C-N 3.35Å; E1138-A1141 PolarHBondContact O-N 3.34Å; E1138-G1142 PolarHBondContact O-N 2.99Å
1139	Q	86.3	Confident	84.7	Confident	133 Å²	133	102.5 Å²	102.5	62%	0.621	52%	0.522	S	S	*	.	H	α-helix	trans	-60.9	-44.2	174.3	-69.6	-60.6	-56.6	0	0	111.2	V1135 L1136 G1142 L1143	V1135-Q1139 VanDerWaalsContact O-CG 3.29Å; V1135-Q1139 WeakPolarHBondContact O-CG 3.48Å; V1135-Q1139 PolarHBondContact O-N 3.46Å; L1136-Q1139 PolarHBondContact O-N 3.06Å; Q1139-G1142 PolarHBondContact O-N 3.25Å; Q1139-L1143 WeakPolarHBondContact O-CB 3.45Å; Q1139-L1143 PolarHBondContact O-N 2.99Å
1140	F	86.1	Confident	84	Confident	142 Å²	142	106.5 Å²	106.5	62%	0.623	54%	0.537	S	S	*	.	H	α-helix	trans	-64.2	-43.3	178	-168.5	-95	0	0	0	112.1	L1136 E1137 E1138 G1142 L1143 M1144	L1136-F1140 WeakPolarHBondContact O-CB 3.43Å; L1136-F1140 PolarHBondContact O-N 3.3Å; E1137-F1140 PolarHBondContact O-N 2.91Å; E1138-F1140 VanDerWaalsContact C-N 3.35Å; F1140-G1142 VanDerWaalsContact C-N 3.34Å; F1140-G1142 PolarHBondContact O-N 2.94Å; F1140-L1143 WeakPolarHBondContact O-CB 3.38Å; F1140-L1143 PolarHBondContact O-N 3.08Å; F1140-M1144 HydrophobicContact CD1-CG 4.16Å; F1140-M1144 HydrophobicContact CE1-CG 3.92Å; F1140-M1144 HydrophobicContact CE1-SD 4.39Å; F1140-M1144 WeakPolarHBondContact O-CG 3.47Å; F1140-M1144 PolarHBondContact O-N 3.48Å
1141	A	83.7	Confident	83.2	Confident	50 Å²	50	110 Å²	110	41%	0.413	55%	0.55	S	S	.	.	H	α-helix	trans	-64.4	-36.2	175.6	0	0	0	0	0	112.7	E1137 E1138 K1145	E1137-A1141 WeakPolarHBondContact O-CB 3.47Å; E1137-A1141 PolarHBondContact O-N 3.5Å; E1138-A1141 PolarHBondContact O-N 3.34Å; A1141-K1145 WeakPolarHBondContact O-CG 3.49Å; A1141-K1145 PolarHBondContact O-N 3.26Å
1142	G	84.2	Confident	82.2	Confident	28 Å²	28	110.3 Å²	110.3	29%	0.289	55%	0.552	S	S	.	*	H	α-helix	trans	-63.4	-43.4	170.6	0	0	0	0	0	112.4	E1138 Q1139 F1140 M1144 K1145 N1146	E1138-G1142 PolarHBondContact O-N 2.99Å; Q1139-G1142 PolarHBondContact O-N 3.25Å; F1140-G1142 VanDerWaalsContact C-N 3.34Å; F1140-G1142 PolarHBondContact O-N 2.94Å; G1142-M1144 PolarHBondContact O-N 3.49Å; G1142-K1145 PolarHBondContact O-N 3.49Å; G1142-N1146 VanDerWaalsContact O-CG 3.25Å; G1142-N1146 PolarHBondContact O-N 3.36Å; G1142-N1146 PolarHBondContact O-ND2 3Å; G1142-N1146 PolarHBondContact O-OD1 3.16Å
1143	L	84.4	Confident	81.1	Confident	114 Å²	114	106 Å²	106	60%	0.597	55%	0.547	S	S	*	.	H	α-helix	trans	-64.3	-40.2	178	-140.1	158.4	0	0	0	111.7	Q1139 F1140 N1146 L1147	Q1139-L1143 WeakPolarHBondContact O-CB 3.45Å; Q1139-L1143 PolarHBondContact O-N 2.99Å; F1140-L1143 WeakPolarHBondContact O-CB 3.38Å; F1140-L1143 PolarHBondContact O-N 3.08Å; L1143-N1146 PolarHBondContact O-N 3.15Å; L1143-L1147 PolarHBondContact O-N 3.4Å
1144	M	84.4	Confident	79.8	Confident	101 Å²	101	108.9 Å²	108.9	50%	0.498	55%	0.553	S	S	.	*	H	α-helix	trans	-63.1	-42.1	172.5	-72.5	-63	-66.2	0	0	112.7	F1140 G1142 L1147 Q1148	F1140-M1144 HydrophobicContact CD1-CG 4.16Å; F1140-M1144 HydrophobicContact CE1-CG 3.92Å; F1140-M1144 HydrophobicContact CE1-SD 4.39Å; F1140-M1144 WeakPolarHBondContact O-CG 3.47Å; F1140-M1144 PolarHBondContact O-N 3.48Å; G1142-M1144 PolarHBondContact O-N 3.49Å; M1144-L1147 WeakPolarHBondContact O-CB 3.43Å; M1144-L1147 PolarHBondContact O-N 2.97Å; M1144-Q1148 WeakPolarHBondContact O-CB 3.47Å; M1144-Q1148 PolarHBondContact O-N 2.93Å
1145	K	82	Confident	78.5	Confident	138 Å²	138	107.5 Å²	107.5	60%	0.6	55%	0.55	S	S	*	*	H	α-helix	trans	-62.2	-41.7	173.9	-77.7	177.1	178.7	174.2	0	112.2	A1141 G1142 L1147 Q1148 Q1149	A1141-K1145 WeakPolarHBondContact O-CG 3.49Å; A1141-K1145 PolarHBondContact O-N 3.26Å; G1142-K1145 PolarHBondContact O-N 3.49Å; K1145-L1147 VanDerWaalsContact C-N 3.34Å; K1145-L1147 PolarHBondContact O-N 3.47Å; K1145-Q1148 PolarHBondContact O-N 3.48Å; K1145-Q1149 WeakPolarHBondContact O-CG 3.5Å; K1145-Q1149 PolarHBondContact O-N 3.17Å
1146	N	82.6	Confident	77	Confident	100 Å²	100	107.8 Å²	107.8	54%	0.535	56%	0.556	S	S	.	*	H	α-helix	trans	-62.9	-41.2	176.3	-66.6	-16.2	0	0	0	111.4	G1142 L1143 Q1148 Q1149 L1150	G1142-N1146 VanDerWaalsContact O-CG 3.25Å; G1142-N1146 PolarHBondContact O-N 3.36Å; G1142-N1146 PolarHBondContact O-ND2 3Å; G1142-N1146 PolarHBondContact O-OD1 3.16Å; L1143-N1146 PolarHBondContact O-N 3.15Å; N1146-Q1148 VanDerWaalsContact C-N 3.33Å; N1146-Q1148 PolarHBondContact O-N 2.87Å; N1146-Q1149 PolarHBondContact O-N 3.45Å; N1146-L1150 WeakPolarHBondContact O-CB 3.43Å; N1146-L1150 PolarHBondContact O-N 2.98Å
1147	L	77.1	Confident	75.4	Confident	110 Å²	110	106.3 Å²	106.3	58%	0.576	56%	0.556	S	S	*	*	H	α-helix	trans	-61.4	-41.8	175	-160.3	88.3	0	0	0	111.8	L1143 M1144 K1145 L1150 N1151	L1143-L1147 PolarHBondContact O-N 3.4Å; M1144-L1147 WeakPolarHBondContact O-CB 3.43Å; M1144-L1147 PolarHBondContact O-N 2.97Å; K1145-L1147 VanDerWaalsContact C-N 3.34Å; K1145-L1147 PolarHBondContact O-N 3.47Å; L1147-L1150 WeakPolarHBondContact O-CB 3.44Å; L1147-L1150 PolarHBondContact O-N 3.4Å; L1147-N1151 PolarHBondContact O-N 3.33Å; L1147-N1151 VanDerWaalsContact O-N 3.17Å
1148	Q	74.6	Confident	74	Confident	119 Å²	119	107.9 Å²	107.9	56%	0.556	56%	0.563	S	S	*	*	H	α-helix	trans	-67.3	-44.6	179.2	-169.2	167.7	-2.8	0	0	111.9	M1144 K1145 N1146 L1150 N1151 E1152	M1144-Q1148 WeakPolarHBondContact O-CB 3.47Å; M1144-Q1148 PolarHBondContact O-N 2.93Å; K1145-Q1148 PolarHBondContact O-N 3.48Å; N1146-Q1148 VanDerWaalsContact C-N 3.33Å; N1146-Q1148 PolarHBondContact O-N 2.87Å; Q1148-L1150 VanDerWaalsContact C-N 3.3Å; Q1148-L1150 PolarHBondContact O-N 3.47Å; Q1148-N1151 WeakPolarHBondContact O-CB 3.45Å; Q1148-N1151 PolarHBondContact O-N 2.91Å; Q1148-N1151 VanDerWaalsContact O-N 3.16Å; Q1148-E1152 WeakPolarHBondContact O-CG 3.46Å; Q1148-E1152 PolarHBondContact O-N 3.39Å
1149	Q	75.1	Confident	72.4	Confident	122 Å²	122	108.1 Å²	108.1	57%	0.57	57%	0.569	S	S	*	*	H	α-helix	trans	-61.8	-35.8	172.9	-73	179.6	-4	0	0	112.6	K1145 N1146 N1151 E1152 A1153	K1145-Q1149 WeakPolarHBondContact O-CG 3.5Å; K1145-Q1149 PolarHBondContact O-N 3.17Å; N1146-Q1149 PolarHBondContact O-N 3.45Å; Q1149-N1151 VanDerWaalsContact C-N 3.31Å; Q1149-N1151 PolarHBondContact O-N 2.99Å; Q1149-E1152 PolarHBondContact O-N 2.97Å; Q1149-A1153 WeakPolarHBondContact O-CB 3.39Å; Q1149-A1153 PolarHBondContact O-N 2.82Å
1150	L	73.1	Confident	70.4	Confident	128 Å²	128	110.6 Å²	110.6	67%	0.67	58%	0.578	S	S	*	*	H	α-helix	trans	-63.5	-38.7	175.4	-150.7	80.5	0	0	0	111.5	N1146 L1147 Q1148 A1153 Y1154	N1146-L1150 WeakPolarHBondContact O-CB 3.43Å; N1146-L1150 PolarHBondContact O-N 2.98Å; L1147-L1150 WeakPolarHBondContact O-CB 3.44Å; L1147-L1150 PolarHBondContact O-N 3.4Å; Q1148-L1150 VanDerWaalsContact C-N 3.3Å; Q1148-L1150 PolarHBondContact O-N 3.47Å; L1150-A1153 PolarHBondContact O-N 2.77Å; L1150-Y1154 WeakPolarHBondContact O-CB 3.5Å; L1150-Y1154 PolarHBondContact O-N 3.13Å
1151	N	70.9	Confident	68.2	Low	114 Å²	114	110.5 Å²	110.5	61%	0.61	59%	0.589	S	S	*	*	H	α-helix	trans	-71.1	-37	177.8	-160.3	18.9	0	0	0	112.3	L1147 Q1148 Q1149 Y1154 S1155	L1147-N1151 PolarHBondContact O-N 3.33Å; L1147-N1151 VanDerWaalsContact O-N 3.17Å; Q1148-N1151 WeakPolarHBondContact O-CB 3.45Å; Q1148-N1151 PolarHBondContact O-N 2.91Å; Q1148-N1151 VanDerWaalsContact O-N 3.16Å; Q1149-N1151 VanDerWaalsContact C-N 3.31Å; Q1149-N1151 PolarHBondContact O-N 2.99Å; N1151-Y1154 PolarHBondContact O-N 3.39Å; N1151-S1155 PolarHBondContact O-N 3.19Å; N1151-S1155 PolarHBondContact O-OG 2.9Å
1152	E	68.1	Low	66	Low	113 Å²	113	116.6 Å²	116.6	53%	0.528	61%	0.609	S	S	.	*	H	α-helix	trans	-65.5	-40.5	171.5	-71.8	170.1	-170.2	0	0	111.8	Q1148 Q1149 S1155 S1156	Q1148-E1152 WeakPolarHBondContact O-CG 3.46Å; Q1148-E1152 PolarHBondContact O-N 3.39Å; Q1149-E1152 PolarHBondContact O-N 2.97Å; E1152-S1155 WeakPolarHBondContact CA-OG 3.24Å; E1152-S1155 PolarHBondContact O-OG 3.36Å; E1152-S1155 VanDerWaalsContact O-OG 3.13Å; E1152-S1156 VanDerWaalsContact O-CB 3.24Å; E1152-S1156 WeakPolarHBondContact O-CB 3.01Å; E1152-S1156 PolarHBondContact O-N 2.79Å
1153	A	66.2	Low	64.1	Low	55 Å²	55	122.7 Å²	122.7	46%	0.455	63%	0.63	S	S	.	*	H	α-helix	trans	-65.5	-37.9	173.3	0	0	0	0	0	112.7	Q1149 L1150 S1157	Q1149-A1153 WeakPolarHBondContact O-CB 3.39Å; Q1149-A1153 PolarHBondContact O-N 2.82Å; L1150-A1153 PolarHBondContact O-N 2.77Å; A1153-S1157 PolarHBondContact O-N 3.24Å; A1153-S1157 PolarHBondContact O-OG 3.26Å
1154	Y	63.5	Low	62.2	Low	168 Å²	168	122.4 Å²	122.4	66%	0.659	63%	0.634	S	S	*	*	H	α-helix	trans	-67.4	-46	178.4	-149.9	-94.9	0	0	0	111.7	L1150 N1151 S1157	L1150-Y1154 WeakPolarHBondContact O-CB 3.5Å; L1150-Y1154 PolarHBondContact O-N 3.13Å; N1151-Y1154 PolarHBondContact O-N 3.39Å; Y1154-S1157 WeakPolarHBondContact O-CB 3.23Å; Y1154-S1157 PolarHBondContact O-N 3.06Å; Y1154-S1157 VanDerWaalsContact O-N 3.13Å
1155	S	59.4	Low	60.3	Low	59 Å²	59	124.8 Å²	124.8	41%	0.413	64%	0.644	S	S	.	*	H	α-helix	trans	-68.6	-35.4	176.1	51	0	0	0	0	112.8	N1151 E1152 S1157 Q1158	N1151-S1155 PolarHBondContact O-N 3.19Å; N1151-S1155 PolarHBondContact O-OG 2.9Å; E1152-S1155 WeakPolarHBondContact CA-OG 3.24Å; E1152-S1155 PolarHBondContact O-OG 3.36Å; E1152-S1155 VanDerWaalsContact O-OG 3.13Å; S1155-S1157 PolarHBondContact O-N 2.78Å; S1155-Q1158 PolarHBondContact O-N 3.13Å
1156	S	56	Low	58.3	Low	85 Å²	85	126 Å²	126	59%	0.594	65%	0.65	S	S	*	*	H	α-helix	trans	-60	-23.4	169.7	-178.2	0	0	0	0	113.4	E1152	E1152-S1156 VanDerWaalsContact O-CB 3.24Å; E1152-S1156 WeakPolarHBondContact O-CB 3.01Å; E1152-S1156 PolarHBondContact O-N 2.79Å
1157	S	55.2	Low	57.2	Low	93 Å²	93	125.8 Å²	125.8	65%	0.65	65%	0.654	S	S	*	*	H	α-helix	trans	-85.8	-18.4	-175.7	-60.4	0	0	0	0	113.6	A1153 Y1154 S1155	A1153-S1157 PolarHBondContact O-N 3.24Å; A1153-S1157 PolarHBondContact O-OG 3.26Å; Y1154-S1157 WeakPolarHBondContact O-CB 3.23Å; Y1154-S1157 PolarHBondContact O-N 3.06Å; Y1154-S1157 VanDerWaalsContact O-N 3.13Å; S1155-S1157 PolarHBondContact O-N 2.78Å
1158	Q	55.2	Low	55.4	Low	151 Å²	151	129.3 Å²	129.3	71%	0.706	67%	0.667	S	S	*	*	H	α-helix	trans	-85.1	-26.9	-179.7	-69.7	-171.9	-37.1	0	0	113.9	S1155 K1160	S1155-Q1158 PolarHBondContact O-N 3.13Å; Q1158-K1160 VanDerWaalsContact C-N 3.25Å; Q1158-K1160 PolarHBondContact O-N 2.82Å
1159	N	51.8	Low	54.2	Low	148 Å²	148	130.5 Å²	130.5	79%	0.791	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	28	-172	-77.8	-32.6	0	0	0	115.2
1160	K	45.3	Very low	52.6	Low	185 Å²	185	132.1 Å²	132.1	80%	0.804	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135	11.9	-172.9	-93.2	-172	177.4	178.4	0	119.1	Q1158	Q1158-K1160 VanDerWaalsContact C-N 3.25Å; Q1158-K1160 PolarHBondContact O-N 2.82Å
1161	T	38.7	Very low	51.1	Low	139 Å²	139	131 Å²	131	85%	0.853	69%	0.691	S	S	*	*			trans	-157.1	96.5	166.6	10.9	0	0	0	0	115.8
1162	Q	39	Very low	50.3	Low	179 Å²	179	131.2 Å²	131.2	84%	0.836	70%	0.701	S	S	*	*			trans	-151.4	145.1	150.2	-71.4	-168.7	-7.1	0	0	106.2
1163	H	44.2	Very low	49.2	Very low	156 Å²	156	136.1 Å²	136.1	72%	0.722	74%	0.739	S	S	*	*			cis	-144.2	175.4	8	-125.2	-66.4	0	0	0	109.4
1164	P	44.9	Very low	48.4	Very low	107 Å²	107	140.2 Å²	140.2	70%	0.695	75%	0.753	S	S	*	*				-146.9	153.6	112.8	37.2	-22.3	0	0	0	116.1
1165	E	43.8	Very low	47.6	Very low	151 Å²	151	138.7 Å²	138.7	71%	0.706	76%	0.758	S	S	*	*			trans	46.7	152.8	137.3	-62.4	-150.1	151.6	0	0	123
1166	K	39.3	Very low	46.9	Very low	164 Å²	164	143.1 Å²	143.1	71%	0.713	78%	0.778	S	S	*	*			cis	-179.2	-170.6	-15.4	-109.3	-179.3	-172.9	159.1	0	107.1
1167	P	60.9	Low	46.4	Very low	95 Å²	95	146.5 Å²	146.5	62%	0.617	79%	0.788	S	S	*	*			cis	-133.4	178	-42.6	38.3	-22.9	0	0	0	113.2
1168	H	38.3	Very low	45.8	Very low	185 Å²	185	149.9 Å²	149.9	86%	0.856	80%	0.797	S	S	*	*				-168	166.4	122.8	-112.5	-76.8	0	0	0	111.8
1169	I	49.4	Very low	45.2	Very low	144 Å²	144	149.8 Å²	149.8	74%	0.738	80%	0.803	S	S	*	*			trans	-143.5	136.9	-162.9	-59.9	172.7	0	0	0	111.8
1170	N	42.1	Very low	44.7	Very low	155 Å²	155	149.9 Å²	149.9	83%	0.829	80%	0.804	S	S	*	*			trans	179	151.4	145.3	-97.3	-16.9	0	0	0	109
1171	S	42.1	Very low	44.7	Very low	106 Å²	106	147.2 Å²	147.2	74%	0.741	80%	0.804	S	S	*	*			cis	-153.1	161	-13.6	49.2	0	0	0	0	108.9
1172	S	53.7	Low	45.2	Very low	117 Å²	117	147.9 Å²	147.9	82%	0.818	80%	0.8	S	S	*	*			trans	-76.8	127.2	-159.3	54.9	0	0	0	0	117.5
1173	T	44.8	Very low	45.8	Very low	216 Å²	216	145.1 Å²	145.1	100%	1.325	80%	0.796	S	S	*	*				-138.4	0	122.7	48.2	0	0	0	0	108.2

Retrieved 1,173 of 1,173 residues in 2847 ms (Link to these results)

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