A0A3Q0KVK6_SCHMA Loading...

Putative dystrobrevin

AlphaFold DB , UniProt , Accession A0A3Q0KVK6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,151 aa.

						>A0A3Q0KVK6_SCHMA|A0A3Q0KVK6
MRAQQIDSQSTTWTRPNLCGPPVLMDQNTSQVVPPHLTNSGHPQQIMLQHQQQRGSNPVFQSPLNIIQAGPIRSGLQNPSLISPNPASLGFRRLLAEMRTKQFDSIRFAAYRTASKLRFIQQRTLFNIMDLWRVVETFREFGLHQLNDPQASLDYGSTFRLLSRIYSHIPTTNMNVTTTTDETTSTNAINRPAVIIAAEILLGWLGYALDLCATGRLSVTGLKITLSTLTNARPADKFRYHFTLLSDPSGALIFSKFEAYLQDLLKLPISVFEGTNFYYTPQASQTMFTGRSKNVVLEEFLDRMLSDQGPQVLVWLTIFHRLISVANVRHNVRCEGCKREPICGLRYKCTRCPHYNLCQDCFWIGVTTDQHTNAHDVKEYSAASKSHSRQFGHSLRKSFQFGRAITNSTTPNVVTTSFTSSFSERQKFSGMNVSRRPHVGSIFEWNSDPSVPTGIMSCVNGIAPSVPNDIATGISAGCHPGQPAPNQRFMAPVNTICSPLPNRRLQQLNPLFLATRPNTNLSNITYVPPQSAQVQPSPNSLNESNQGSSGVARSLVAVTSYTNVMQQQDLITADYTRAGHSILYSEKPPGSHMTNLSGANHQPLPISCYSRPTTEFYSVGGNQQYQLATTLTGLPAIQSTPIVSVINSDNLNNSSMGASFSLKTHNLDQKSNEEHNLIARYAAQLAAASALNQEFDKFGDFVESTQTQKQLIAQLQEKNRKILKEIERLRVEQQKQAAFIAAAGSLKHDSSELQDVCDEGAGTLSPTNLKQYLKSDNLLASGVGNSVNAENPRLVADLQALRQRKDELESRMSNLQRSRTDLMLQLEALVRLLSVSTGATNARDNNPSALLDLNDVRRTGHNSRLNQKVPDYPPRRSTSLCDPSVGRGYQDNFASESRHNGTNGVHPKPGSSDNMGKIFSPLKTITIEEKGGQWNFKFPDDKKHELHSPSSIPYRHSPEVGQQRPSDTLIEKYKDLLYKGTNTQIGASKSLRVHFGGRRPDIGTLSADEKTEFFSHNSVNVNRLSSNHSSQHTNHSDSGSDAYLYSDPELCFTVITSTCGSSQSSTSAPQRTLQLPQFHSITPSAAKSSNKSKDFLDLLNDKIITTTTIVDNYEYAGLQSSSISPLSYSSNEHTKNVRTNVISNIPATTNP
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.4	Very low	30.8	Very low	247 Å²	247	165.3 Å²	165.3	100%	1.217	87%	0.867	S	S	*	*				0	-177.7	0	-67.1	-172.7	-176.1	0	0	108.8
2	R	28.2	Very low	30.5	Very low	249 Å²	249	160 Å²	160	94%	0.94	85%	0.847	S	S	*	*			trans	-58.5	146.2	-167.3	-73.9	179.9	170.6	132	-3.2	114.1
3	A	28	Very low	30.4	Very low	96 Å²	96	167.2 Å²	167.2	79%	0.793	86%	0.856	S	S	*	*			trans	-98	159.1	157.1	0	0	0	0	0	109.8
4	Q	34.7	Very low	30.4	Very low	190 Å²	190	163.8 Å²	163.8	89%	0.888	85%	0.847	S	S	*	*			trans	-135.2	127.7	159.7	-75.5	-172.3	-73.4	0	0	109.2
5	Q	27.9	Very low	30.2	Very low	180 Å²	180	166.3 Å²	166.3	84%	0.841	84%	0.841	S	S	*	*			trans	-78.6	147	162.2	-66.2	160.6	-106.8	0	0	108.8
6	I	34.9	Very low	30.2	Very low	166 Å²	166	163.6 Å²	163.6	85%	0.851	84%	0.838	S	S	*	*			trans	-133.7	141.2	150.1	-63.6	-174.6	0	0	0	107.1
7	D	32	Very low	30.1	Very low	131 Å²	131	160.5 Å²	160.5	70%	0.701	82%	0.824	S	S	*	*			trans	-65.9	142.9	-170.2	-80.9	-68.1	0	0	0	114.6
8	S	27.7	Very low	30.2	Very low	99 Å²	99	161.6 Å²	161.6	69%	0.692	83%	0.831	S	S	*	*				72.2	85.1	64.3	-42	0	0	0	0	114
9	Q	31.2	Very low	30.1	Very low	206 Å²	206	160.1 Å²	160.1	96%	0.963	83%	0.834	S	S	*	*			trans	-137.5	124	145.9	-75.5	-157.9	4.6	0	0	110.7
10	S	27.4	Very low	30	Very low	107 Å²	107	155.4 Å²	155.4	75%	0.748	83%	0.826	S	S	*	*			trans	-103.6	137.7	173.9	52.1	0	0	0	0	110.3
11	T	31.5	Very low	30.3	Very low	147 Å²	147	153.7 Å²	153.7	90%	0.902	82%	0.824	S	S	*	*			trans	-105.6	101.8	165.4	22.9	0	0	0	0	109.8
12	T	27	Very low	30.7	Very low	102 Å²	102	146 Å²	146	63%	0.626	79%	0.793	S	S	*	*			trans	-73	144.5	174.2	48.2	0	0	0	0	112
13	W	29.2	Very low	31	Very low	254 Å²	254	137.4 Å²	137.4	96%	0.962	77%	0.768	S	S	*	*			trans	-125.3	124	146.8	-84	97.4	0	0	0	109.2
14	T	30.4	Very low	31.3	Very low	119 Å²	119	139.3 Å²	139.3	73%	0.73	76%	0.764	S	S	*	*			trans	-96.9	145.1	-159.2	-8.6	0	0	0	0	112.7
15	R	26.9	Very low	31.2	Very low	201 Å²	201	137 Å²	137	76%	0.758	76%	0.755	S	S	*	*			trans	-69.1	158.1	156	-131.5	-178.4	-173.7	173.3	2.5	109.1	N17	R15-N17 PolarHBondContact NE-OD1 2.89Å
16	P	30.8	Very low	31.5	Very low	123 Å²	123	133.9 Å²	133.9	80%	0.799	74%	0.744	S	S	*	*				-132.1	136.5	121.5	34.9	-27.1	0	0	0	113.2
17	N	28.1	Very low	31.4	Very low	111 Å²	111	133.2 Å²	133.2	59%	0.594	74%	0.737	S	S	*	*			trans	-93.8	154.6	149.3	-64.8	-9.4	0	0	0	107.2	R15	R15-N17 PolarHBondContact NE-OD1 2.89Å
18	L	31.5	Very low	31.4	Very low	181 Å²	181	132.6 Å²	132.6	95%	0.948	73%	0.734	S	S	*	*			trans	-168.9	173.6	141.8	-105.3	159.5	0	0	0	110.4
19	C	28.9	Very low	31.5	Very low	132 Å²	132	133 Å²	133	89%	0.892	73%	0.732	S	S	*	*			trans	-140.7	145.7	-158.1	-173.4	0	0	0	0	112.7
20	G	28.2	Very low	31.5	Very low	66 Å²	66	127.9 Å²	127.9	68%	0.68	72%	0.719	S	S	*	*			trans	168.8	137.8	175.7	0	0	0	0	0	113.1
21	P	36.8	Very low	31.6	Very low	120 Å²	120	130.6 Å²	130.6	78%	0.779	72%	0.72	S	S	*	*			trans	-119.7	-158.8	-172.2	50.3	-38.6	0	0	0	112.6
22	P	44	Very low	31.5	Very low	87 Å²	87	129.1 Å²	129.1	57%	0.565	71%	0.71	S	S	*	*				-129	-170.9	-125	32.9	-7.5	0	0	0	115.8
23	V	33.2	Very low	31.8	Very low	68 Å²	68	130.6 Å²	130.6	41%	0.412	72%	0.719	S	S	.	*			trans	173.3	165.4	130.7	156	0	0	0	0	112.5	D649	V23-D649 WeakPolarHBondContact CG1-O 3.44Å
24	L	34.5	Very low	32.2	Very low	135 Å²	135	123.9 Å²	123.9	71%	0.707	71%	0.708	S	S	*	*			trans	-44.3	175.7	-176.1	-59.7	165.1	0	0	0	118.5
25	M	32.7	Very low	32.9	Very low	142 Å²	142	122.9 Å²	122.9	70%	0.7	70%	0.704	S	S	*	*			cis	-158.8	158.8	13.4	-142.9	162.7	175.3	0	0	113.8
26	D	33.7	Very low	33.4	Very low	114 Å²	114	121.2 Å²	121.2	61%	0.61	70%	0.704	S	S	*	*			trans	30.7	152.2	141	-71.1	26.2	0	0	0	122.9
27	Q	34.6	Very low	33.4	Very low	152 Å²	152	122.8 Å²	122.8	71%	0.71	71%	0.705	S	S	*	*			cis	-173.1	172.9	1.2	-115.8	-169.5	79.2	0	0	108.2
28	N	30.9	Very low	33.7	Very low	118 Å²	118	122.8 Å²	122.8	63%	0.631	71%	0.709	S	S	*	*			cis	-164.8	-179.4	-15.7	-153.2	-20.8	0	0	0	110.2
29	T	30.8	Very low	33.7	Very low	107 Å²	107	121 Å²	121	66%	0.656	70%	0.701	S	S	*	*			trans	63.6	115.6	150.4	42.2	0	0	0	0	123.4
30	S	30.1	Very low	33.9	Very low	99 Å²	99	119.2 Å²	119.2	69%	0.692	69%	0.69	S	S	*	*				73.1	154.8	127.6	-62.7	0	0	0	0	120.1
31	Q	29.2	Very low	34.2	Very low	165 Å²	165	119.6 Å²	119.6	77%	0.771	69%	0.694	S	S	*	*			cis	-161.5	172.9	-3	-125.8	-179.9	63.2	0	0	111.5
32	V	30.8	Very low	34.2	Very low	115 Å²	115	122.9 Å²	122.9	70%	0.697	70%	0.698	S	S	*	*			trans	60.4	106.3	154.1	171	0	0	0	0	117.4
33	V	32.4	Very low	33.9	Very low	133 Å²	133	123.1 Å²	123.1	81%	0.806	70%	0.7	S	S	*	*				92.5	138.9	68.9	162.8	0	0	0	0	114.4
34	P	38	Very low	33.8	Very low	113 Å²	113	127.5 Å²	127.5	73%	0.734	72%	0.716	S	S	*	*			trans	-121.1	-144.5	-162.6	45.9	-29.4	0	0	0	112.1
35	P	45.6	Very low	33.5	Very low	99 Å²	99	128.3 Å²	128.3	64%	0.643	72%	0.716	S	S	*	*			cis	-130.5	-160.6	-24.1	41.8	-23.5	0	0	0	113.1
36	H	35.6	Very low	33.4	Very low	166 Å²	166	127.9 Å²	127.9	77%	0.769	72%	0.715	S	S	*	*			trans	171.5	118.7	134.2	-92.3	-65.3	0	0	0	117.5
37	L	31.5	Very low	33.1	Very low	156 Å²	156	130.2 Å²	130.2	82%	0.817	72%	0.724	S	S	*	*			trans	58.2	-177.8	148.1	-49.1	179.9	0	0	0	119.6
38	T	34.5	Very low	32.9	Very low	111 Å²	111	129.8 Å²	129.8	68%	0.681	73%	0.726	S	S	*	*			cis	-148.2	169	8.8	50.2	0	0	0	0	115.1
39	N	32.6	Very low	33.1	Very low	143 Å²	143	131.1 Å²	131.1	77%	0.765	73%	0.729	S	S	*	*			trans	2.5	162.7	150.7	-79.8	7.9	0	0	0	124.4
40	S	32.3	Very low	33.4	Very low	95 Å²	95	132.4 Å²	132.4	66%	0.664	73%	0.727	S	S	*	*			cis	179.5	149.3	-16.5	55.7	0	0	0	0	112
41	G	35.4	Very low	33.6	Very low	74 Å²	74	136.5 Å²	136.5	76%	0.763	74%	0.735	S	S	*	*			trans	160.5	153.8	163.1	0	0	0	0	0	119.9
42	H	36.5	Very low	33.9	Very low	189 Å²	189	134.3 Å²	134.3	88%	0.875	73%	0.725	S	S	*	*			trans	-148.2	174.7	176.3	-142.4	35.5	0	0	0	107.8
43	P	37.7	Very low	34.2	Very low	91 Å²	91	136.2 Å²	136.2	59%	0.591	73%	0.726	S	S	*	*			cis	-148.2	-159.2	14.9	44.4	-21.1	0	0	0	116.6
44	Q	29.8	Very low	34.1	Very low	161 Å²	161	139.2 Å²	139.2	75%	0.752	72%	0.723	S	S	*	*			trans	74.3	138.9	145.1	-80	177.5	10.4	0	0	126
45	Q	29.7	Very low	33.8	Very low	152 Å²	152	137 Å²	137	71%	0.71	72%	0.72	S	S	*	*			trans	72.8	109.1	137.4	-74.9	-167.3	-25.6	0	0	126.3
46	I	29	Very low	33.1	Very low	132 Å²	132	137.7 Å²	137.7	68%	0.677	73%	0.728	S	S	*	*				68.7	141.4	111	-67.8	176.3	0	0	0	122.7
47	M	28.4	Very low	33	Very low	163 Å²	163	137.6 Å²	137.6	80%	0.803	73%	0.733	S	S	*	*			trans	73.9	150	160.8	-83	159.4	58.2	0	0	120.1
48	L	30.9	Very low	33	Very low	144 Å²	144	136 Å²	136	75%	0.754	73%	0.732	S	S	*	*			cis	-171.7	170.2	-37.4	-133.5	137.8	0	0	0	111.2
49	Q	35.2	Very low	32.9	Very low	146 Å²	146	136.8 Å²	136.8	68%	0.682	74%	0.736	S	S	*	*			trans	100.3	107.1	153.3	-58.7	-137.8	12.9	0	0	121.5
50	H	36	Very low	32.5	Very low	134 Å²	134	138.6 Å²	138.6	62%	0.62	74%	0.738	S	S	*	*			trans	68.8	152.2	135.1	-60.4	123.9	0	0	0	120.5
51	Q	35.6	Very low	32.2	Very low	185 Å²	185	141.7 Å²	141.7	86%	0.864	74%	0.742	S	S	*	*			cis	-136.6	164.2	15.3	-152.2	169.4	18.9	0	0	114.9
52	Q	35.1	Very low	31.9	Very low	119 Å²	119	143.7 Å²	143.7	56%	0.556	74%	0.744	S	S	*	*			trans	-73	169.5	-167.7	-57.4	168.1	7.3	0	0	113.3
53	Q	35.9	Very low	31.5	Very low	154 Å²	154	140.8 Å²	140.8	72%	0.72	74%	0.742	S	S	*	*				-166.5	167.8	52.4	-68.6	-175.5	93.8	0	0	111.5
54	R	31.6	Very low	30.9	Very low	197 Å²	197	143.8 Å²	143.8	74%	0.743	75%	0.752	S	S	*	*			cis	-169.7	176.2	-20.8	-98.4	172.2	-165.5	172.4	3.8	107.1
55	G	32	Very low	30.7	Very low	66 Å²	66	142.8 Å²	142.8	68%	0.68	75%	0.752	S	S	*	*			trans	114.5	42.5	160.9	0	0	0	0	0	117.8
56	S	29.3	Very low	30.5	Very low	114 Å²	114	142.7 Å²	142.7	80%	0.797	76%	0.755	S	S	*	*				69.1	98.3	89.3	72	0	0	0	0	116.9
57	N	34.4	Very low	30.4	Very low	163 Å²	163	143.3 Å²	143.3	87%	0.872	76%	0.758	S	S	*	*			trans	-69.2	165.6	157.4	-73.2	-21.7	0	0	0	111.5
58	P	31.8	Very low	30.3	Very low	123 Å²	123	144.7 Å²	144.7	80%	0.799	76%	0.762	S	S	*	*			trans	-123.7	141.2	141.8	35.8	-26.7	0	0	0	113.4
59	V	31.6	Very low	30.2	Very low	128 Å²	128	142.9 Å²	142.9	78%	0.776	77%	0.768	S	S	*	*			trans	-79.1	150.1	159.7	172.4	0	0	0	0	108.2
60	F	24.7	Very low	29.9	Very low	181 Å²	181	139.4 Å²	139.4	79%	0.794	77%	0.771	S	S	*	*			trans	-162.8	157.3	141.6	-109.7	-72.6	0	0	0	114.3
61	Q	25.3	Very low	29.7	Very low	160 Å²	160	139.1 Å²	139.1	75%	0.748	78%	0.782	S	S	*	*			trans	-57.4	166.5	-164.8	-64.3	153.8	-27.7	0	0	119
62	S	29.6	Very low	29.4	Very low	116 Å²	116	138 Å²	138	81%	0.811	78%	0.78	S	S	*	*			trans	-61.3	158	162.6	-42.1	0	0	0	0	113.3
63	P	28.7	Very low	29	Very low	128 Å²	128	144 Å²	144	83%	0.831	80%	0.797	S	S	*	*			trans	-126.6	160.2	135	36.6	-29.1	0	0	0	113.4
64	L	25.2	Very low	28.5	Very low	154 Å²	154	142.6 Å²	142.6	81%	0.806	80%	0.804	S	S	*	*			trans	-97.4	158.6	173.6	-82.8	163.2	0	0	0	111.5
65	N	25.2	Very low	28.3	Very low	140 Å²	140	136.1 Å²	136.1	75%	0.749	80%	0.798	S	S	*	*			trans	77	155.7	151.6	-68.1	-16.4	0	0	0	121.6
66	I	26	Very low	28.2	Very low	149 Å²	149	140.8 Å²	140.8	76%	0.764	81%	0.807	S	S	*	*			trans	80.5	87.1	164.2	-61.5	149.5	0	0	0	117.4
67	I	25.3	Very low	28.3	Very low	145 Å²	145	144.6 Å²	144.6	74%	0.744	81%	0.812	S	S	*	*				37	115.7	115.3	-53.1	158.2	0	0	0	116.9
68	Q	26.7	Very low	28	Very low	193 Å²	193	143.3 Å²	143.3	90%	0.902	81%	0.806	S	S	*	*				-168.2	167.9	95.9	-148.1	145.3	-6.8	0	0	111.1
69	A	30	Very low	27.9	Very low	105 Å²	105	143.4 Å²	143.4	87%	0.868	81%	0.806	S	S	*	*			trans	-113.2	154.3	-166.6	0	0	0	0	0	114.8
70	G	27.3	Very low	27.6	Very low	73 Å²	73	141.3 Å²	141.3	75%	0.753	80%	0.797	S	S	*	*			trans	-149.9	127.2	170.5	0	0	0	0	0	110.6
71	P	32.6	Very low	27.8	Very low	129 Å²	129	140.9 Å²	140.9	84%	0.838	80%	0.802	S	S	*	*			trans	-109.2	121.4	-162.7	36.7	-30.3	0	0	0	115.3
72	I	28.4	Very low	28.1	Very low	160 Å²	160	140.5 Å²	140.5	82%	0.821	80%	0.804	S	S	*	*			trans	-136.8	106.9	166.9	-56.4	-177.4	0	0	0	111.9
73	R	27.1	Very low	28.4	Very low	247 Å²	247	139.8 Å²	139.8	93%	0.932	80%	0.799	S	S	*	*			trans	34.6	83.9	156.1	-63.4	-172.9	173.8	-158.8	-2.5	118.7	G75	R73-G75 PolarHBondContact O-N 2.9Å
74	S	26.3	Very low	29.3	Very low	124 Å²	124	138 Å²	138	87%	0.867	79%	0.787	S	S	*	*			trans	-82.3	99.8	168.6	-51.9	0	0	0	0	112.7
75	G	26.8	Very low	31	Very low	60 Å²	60	133.8 Å²	133.8	62%	0.619	77%	0.765	S	S	*	*			trans	-93.9	4.6	173.6	0	0	0	0	0	115.4	R73	R73-G75 PolarHBondContact O-N 2.9Å
76	L	29.4	Very low	32.8	Very low	165 Å²	165	129.8 Å²	129.8	86%	0.864	75%	0.747	S	S	*	*	S	Bend	trans	-99.8	121.4	-176.3	-73.5	161.5	0	0	0	110.1
77	Q	32.7	Very low	34.9	Very low	193 Å²	193	123.1 Å²	123.1	90%	0.902	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-74.9	140.2	179.6	-71.2	177.6	-26.9	0	0	111.5
78	N	28	Very low	37.2	Very low	137 Å²	137	118.4 Å²	118.4	73%	0.733	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-59.4	131.7	-177.3	-80.5	-28.5	0	0	0	112.7	S80	N78-S80 PolarHBondContact O-N 3.2Å; N78-S80 VanDerWaalsContact O-N 3.15Å
79	P	29.6	Very low	39.8	Very low	124 Å²	124	113.8 Å²	113.8	81%	0.805	68%	0.675	S	S	*	*	S	Bend	trans	-68.5	-2.3	168.4	-20.4	33.6	0	0	0	114.7
80	S	24.6	Very low	42.5	Very low	84 Å²	84	108.9 Å²	108.9	59%	0.587	63%	0.634	S	S	*	*			trans	-112.4	57	-161.7	46.5	0	0	0	0	113.9	N78	N78-S80 PolarHBondContact O-N 3.2Å; N78-S80 VanDerWaalsContact O-N 3.15Å
81	L	29.6	Very low	45.5	Very low	172 Å²	172	106.9 Å²	106.9	90%	0.901	61%	0.605	S	S	*	*			trans	-168.2	60.4	163.7	-111	167.6	0	0	0	112.4
82	I	32	Very low	48.2	Very low	152 Å²	152	106.7 Å²	106.7	78%	0.779	59%	0.588	S	S	*	*			trans	-121.4	101.4	176.7	-55.4	-179.3	0	0	0	110.2
83	S	34.7	Very low	51.3	Low	101 Å²	101	103.8 Å²	103.8	71%	0.706	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-62.4	140.6	165.9	-175.8	0	0	0	0	109.8	N85	S83-N85 PolarHBondContact O-N 3.35Å; S83-N85 VanDerWaalsContact O-N 3.12Å
84	P	47.3	Very low	54.4	Low	90 Å²	90	92 Å²	92	58%	0.584	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-57.7	120.6	178.3	23.8	-34.2	0	0	0	110.6
85	N	61	Low	57.5	Low	66 Å²	66	88 Å²	88	35%	0.353	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-49.8	124.9	179.9	171.9	-3.7	0	0	0	109.8	S83 A87 S88 L89 Y155	S83-N85 PolarHBondContact O-N 3.35Å; S83-N85 VanDerWaalsContact O-N 3.12Å; N85-A87 PolarHBondContact O-N 3.3Å; N85-A87 VanDerWaalsContact O-N 3.07Å; N85-A87 WeakPolarHBondContact OD1-CB 3.48Å; N85-A87 PolarHBondContact OD1-N 2.93Å; N85-S88 WeakPolarHBondContact O-CA 3.46Å; N85-S88 WeakPolarHBondContact O-CB 3.15Å; N85-S88 PolarHBondContact O-N 2.87Å; N85-S88 PolarHBondContact O-OG 2.89Å; N85-L89 PolarHBondContact O-N 3.16Å; N85-Y155 WeakPolarHBondContact ND2-CD2 3.48Å
86	P	62.6	Low	60.6	Low	57 Å²	57	87.6 Å²	87.6	37%	0.37	48%	0.481	S	S	.	.	H	α-helix	trans	-56.8	-29.3	-174.9	20.7	-33.4	0	0	0	113.3	S88 L89 G90 L202	P86-S88 VanDerWaalsContact C-N 3.29Å; P86-S88 PolarHBondContact O-N 3.47Å; P86-L89 PolarHBondContact O-N 3.3Å; P86-G90 PolarHBondContact O-N 3.36Å; P86-L202 HydrophobicContact CG-CD2 4.47Å
87	A	70	Confident	63.5	Low	8 Å²	8	81.4 Å²	81.4	7%	0.066	45%	0.448	C	S	.	.	H	α-helix	trans	-57.2	-41.4	171.8	0	0	0	0	0	112.3	N85 L89 F91 L202 G203	N85-A87 PolarHBondContact O-N 3.3Å; N85-A87 VanDerWaalsContact O-N 3.07Å; N85-A87 WeakPolarHBondContact OD1-CB 3.48Å; N85-A87 PolarHBondContact OD1-N 2.93Å; A87-L89 VanDerWaalsContact C-N 3.33Å; A87-L89 PolarHBondContact O-N 3.36Å; A87-F91 WeakPolarHBondContact O-CB 3.41Å; A87-F91 PolarHBondContact O-N 3.36Å; A87-F91 VanDerWaalsContact O-N 3.15Å; A87-L202 HydrophobicContact CB-CD2 4.28Å; A87-L202 HydrophobicContact CB-CG 4.11Å; A87-G203 WeakPolarHBondContact O-CA 3.4Å
88	S	75.3	Confident	66.3	Low	46 Å²	46	73.1 Å²	73.1	32%	0.322	41%	0.409	S	S	.	.	H	α-helix	trans	-69.1	-30.1	179.3	75.7	0	0	0	0	113.1	N85 P86 R92	N85-S88 WeakPolarHBondContact O-CA 3.46Å; N85-S88 WeakPolarHBondContact O-CB 3.15Å; N85-S88 PolarHBondContact O-N 2.87Å; N85-S88 PolarHBondContact O-OG 2.89Å; P86-S88 VanDerWaalsContact C-N 3.29Å; P86-S88 PolarHBondContact O-N 3.47Å; S88-R92 WeakPolarHBondContact O-CD 3.22Å; S88-R92 WeakPolarHBondContact O-CG 3.44Å; S88-R92 PolarHBondContact O-N 3.26Å; S88-R92 PolarHBondContact O-NE 3.04Å
89	L	81.6	Confident	69.2	Low	97 Å²	97	74.7 Å²	74.7	51%	0.508	41%	0.405	S	S	.	.	H	α-helix	trans	-77.4	-49.2	177.7	-176	63.3	0	0	0	111.3	N85 P86 A87 F91 R92 R93	N85-L89 PolarHBondContact O-N 3.16Å; P86-L89 PolarHBondContact O-N 3.3Å; A87-L89 VanDerWaalsContact C-N 3.33Å; A87-L89 PolarHBondContact O-N 3.36Å; L89-F91 VanDerWaalsContact C-N 3.32Å; L89-F91 PolarHBondContact O-N 2.6Å; L89-R92 PolarHBondContact O-N 3.01Å; L89-R93 PolarHBondContact O-N 3.48Å
90	G	86.3	Confident	72.2	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.01	40%	0.398	C	S	.	.	H	α-helix	trans	-59.1	-40.3	178.6	0	0	0	0	0	113.1	P86 R93 L94	P86-G90 PolarHBondContact O-N 3.36Å; G90-R93 PolarHBondContact O-N 2.96Å; G90-L94 PolarHBondContact O-N 2.9Å
91	F	89.8	Confident	75.3	Confident	32 Å²	32	73.7 Å²	73.7	14%	0.14	39%	0.387	C	S	.	.	H	α-helix	trans	-67.9	-40.4	176.7	-174.6	-121.5	0	0	0	113	A87 L89 R93 L94 L95 W204 Y207	A87-F91 WeakPolarHBondContact O-CB 3.41Å; A87-F91 PolarHBondContact O-N 3.36Å; A87-F91 VanDerWaalsContact O-N 3.15Å; L89-F91 VanDerWaalsContact C-N 3.32Å; L89-F91 PolarHBondContact O-N 2.6Å; F91-R93 VanDerWaalsContact C-N 3.34Å; F91-R93 PolarHBondContact O-N 3.44Å; F91-L94 HydrophobicContact CD2-CD2 4.44Å; F91-L94 PolarHBondContact O-N 2.79Å; F91-L95 HydrophobicContact CD1-CD1 4.17Å; F91-L95 HydrophobicContact CD2-CG 4.46Å; F91-L95 HydrophobicContact CE1-CD1 3.58Å; F91-L95 HydrophobicContact CE1-CG 4.15Å; F91-L95 HydrophobicContact CE2-CD1 4.33Å; F91-L95 HydrophobicContact CE2-CD2 4.03Å; F91-L95 HydrophobicContact CE2-CG 4.03Å; F91-L95 HydrophobicContact CZ-CD1 3.66Å; F91-L95 HydrophobicContact CZ-CD2 3.91Å; F91-L95 HydrophobicContact CZ-CG 3.85Å; F91-L95 WeakPolarHBondContact O-CG 3.49Å; F91-L95 PolarHBondContact O-N 3.09Å; F91-W204 HydrophobicContact CD2-CB 4.45Å; F91-Y207 HydrophobicContact CD1-CG 4.43Å; F91-Y207 HydrophobicContact CD2-CG 4.39Å; F91-Y207 HydrophobicContact CE1-CD1 4.11Å; F91-Y207 AromaticContact CE1-CD2 3.81Å; F91-Y207 HydrophobicContact CE1-CD2 3.81Å; F91-Y207 HydrophobicContact CE1-CE2 4.33Å; F91-Y207 AromaticContact CE1-CG 3.7Å; F91-Y207 HydrophobicContact CE1-CG 3.7Å; F91-Y207 AromaticContact CE2-CD1 3.48Å; F91-Y207 HydrophobicContact CE2-CD1 3.48Å; F91-Y207 VanDerWaalsContact CE2-CD1 3.48Å; F91-Y207 HydrophobicContact CE2-CE1 4.24Å; F91-Y207 AromaticContact CE2-CG 3.67Å; F91-Y207 HydrophobicContact CE2-CG 3.67Å; F91-Y207 AromaticContact CZ-CD1 3.22Å; F91-Y207 HydrophobicContact CZ-CD1 3.22Å; F91-Y207 AromaticContact CZ-CD2 3.76Å; F91-Y207 HydrophobicContact CZ-CD2 3.76Å; F91-Y207 AromaticContact CZ-CE1 3.68Å; F91-Y207 HydrophobicContact CZ-CE1 3.68Å; F91-Y207 HydrophobicContact CZ-CE2 4.19Å; F91-Y207 AromaticContact CZ-CG 3.27Å; F91-Y207 HydrophobicContact CZ-CG 3.27Å
92	R	89.8	Confident	78.2	Confident	125 Å²	125	72.1 Å²	72.1	47%	0.472	38%	0.375	S	S	.	.	H	α-helix	trans	-60.6	-44.2	174.2	-73.4	165.5	-170.9	-116.2	-3.1	111.6	S88 L89 L95 A96	S88-R92 WeakPolarHBondContact O-CD 3.22Å; S88-R92 WeakPolarHBondContact O-CG 3.44Å; S88-R92 PolarHBondContact O-N 3.26Å; S88-R92 PolarHBondContact O-NE 3.04Å; L89-R92 PolarHBondContact O-N 3.01Å; R92-L95 PolarHBondContact O-N 3.3Å; R92-A96 WeakPolarHBondContact O-CB 3.38Å; R92-A96 PolarHBondContact O-N 3.14Å
93	R	91.8	Very high	81.1	Confident	98 Å²	98	66.4 Å²	66.4	37%	0.37	34%	0.344	S	S	.	.	H	α-helix	trans	-58.5	-48.2	175.7	-178.5	171.8	-176.2	154.9	8	111	L89 G90 F91 L95 A96 E97 I200	L89-R93 PolarHBondContact O-N 3.48Å; G90-R93 PolarHBondContact O-N 2.96Å; F91-R93 VanDerWaalsContact C-N 3.34Å; F91-R93 PolarHBondContact O-N 3.44Å; R93-L95 PolarHBondContact O-N 2.85Å; R93-A96 PolarHBondContact O-N 3.3Å; R93-E97 HydrophobicContact CG-CG 4.38Å; R93-E97 WeakPolarHBondContact CG-OE1 3.43Å; R93-E97 IonicContact CZ-OE1 3.66Å; R93-E97 IonicContact NE-OE1 2.82Å; R93-E97 PolarHBondContact NE-OE1 3.45Å; R93-E97 IonicContact NH2-OE1 3.61Å; R93-E97 WeakPolarHBondContact O-CB 3.27Å; R93-E97 VanDerWaalsContact O-CG 3.31Å; R93-E97 WeakPolarHBondContact O-CG 3.44Å; R93-E97 PolarHBondContact O-N 3.19Å; R93-I200 HydrophobicContact CG-CD1 4.3Å
94	L	93.3	Very high	83.8	Confident	1 Å²	1	66.7 Å²	66.7	1%	0.005	34%	0.338	C	S	.	.	H	α-helix	trans	-57.3	-47.9	176.6	178.9	62.9	0	0	0	112.6	G90 F91 A96 E97 M98 F119 I120 I200 W204	G90-L94 PolarHBondContact O-N 2.9Å; F91-L94 HydrophobicContact CD2-CD2 4.44Å; F91-L94 PolarHBondContact O-N 2.79Å; L94-A96 PolarHBondContact O-N 3.34Å; L94-E97 PolarHBondContact O-N 3.35Å; L94-M98 HydrophobicContact CD1-CG 4.04Å; L94-M98 HydrophobicContact CD1-SD 3.94Å; L94-M98 HydrophobicContact CD2-SD 4.41Å; L94-M98 HydrophobicContact CG-CG 4.36Å; L94-M98 HydrophobicContact CG-SD 3.87Å; L94-M98 WeakPolarHBondContact O-CB 3.35Å; L94-M98 VanDerWaalsContact O-CG 3.28Å; L94-M98 WeakPolarHBondContact O-CG 3.4Å; L94-M98 PolarHBondContact O-N 2.93Å; L94-F119 HydrophobicContact CD1-CD1 4.36Å; L94-F119 HydrophobicContact CD1-CE1 4.18Å; L94-I120 HydrophobicContact CD1-CG1 3.91Å; L94-I120 HydrophobicContact CD2-CD1 4.37Å; L94-I120 HydrophobicContact CD2-CG1 4Å; L94-I120 HydrophobicContact CG-CG1 4.47Å; L94-I200 HydrophobicContact CB-CG2 4.15Å; L94-I200 HydrophobicContact CD1-CG2 4.18Å; L94-I200 HydrophobicContact CD2-CG2 4.41Å; L94-I200 HydrophobicContact CG-CG2 4.47Å; L94-W204 HydrophobicContact CD2-CB 3.73Å; L94-W204 HydrophobicContact CD2-CG 3.88Å
95	L	91.7	Very high	86	Confident	38 Å²	38	64.9 Å²	64.9	20%	0.199	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-40.4	179.4	-69.7	-175.6	0	0	0	112.6	F91 R92 R93 R99 F272	F91-L95 HydrophobicContact CD1-CD1 4.17Å; F91-L95 HydrophobicContact CD2-CG 4.46Å; F91-L95 HydrophobicContact CE1-CD1 3.58Å; F91-L95 HydrophobicContact CE1-CG 4.15Å; F91-L95 HydrophobicContact CE2-CD1 4.33Å; F91-L95 HydrophobicContact CE2-CD2 4.03Å; F91-L95 HydrophobicContact CE2-CG 4.03Å; F91-L95 HydrophobicContact CZ-CD1 3.66Å; F91-L95 HydrophobicContact CZ-CD2 3.91Å; F91-L95 HydrophobicContact CZ-CG 3.85Å; F91-L95 WeakPolarHBondContact O-CG 3.49Å; F91-L95 PolarHBondContact O-N 3.09Å; R92-L95 PolarHBondContact O-N 3.3Å; R93-L95 PolarHBondContact O-N 2.85Å; L95-R99 VanDerWaalsContact O-CG 3.3Å; L95-R99 WeakPolarHBondContact O-CG 3.31Å; L95-R99 PolarHBondContact O-N 3.43Å; L95-R99 VanDerWaalsContact O-N 3.11Å; L95-F272 HydrophobicContact CD2-CE2 3.74Å; L95-F272 HydrophobicContact CD2-CZ 4.11Å
96	A	90.8	Very high	87.6	Confident	52 Å²	52	62.2 Å²	62.2	43%	0.43	31%	0.313	S	S	.	.	H	α-helix	trans	-61.8	-49.7	174.8	0	0	0	0	0	111.2	R92 R93 L94 M98 R99 T100	R92-A96 WeakPolarHBondContact O-CB 3.38Å; R92-A96 PolarHBondContact O-N 3.14Å; R93-A96 PolarHBondContact O-N 3.3Å; L94-A96 PolarHBondContact O-N 3.34Å; A96-M98 PolarHBondContact O-N 3.41Å; A96-R99 PolarHBondContact O-N 3.32Å; A96-T100 PolarHBondContact O-N 2.88Å
97	E	91.8	Very high	89.1	Confident	36 Å²	36	64.4 Å²	64.4	17%	0.168	31%	0.314	C	S	.	.	H	α-helix	trans	-61.8	-43.5	178.2	-69.3	176.3	-178.3	0	0	111.9	R93 L94 R99 T100 F119 R123	R93-E97 HydrophobicContact CG-CG 4.38Å; R93-E97 WeakPolarHBondContact CG-OE1 3.43Å; R93-E97 IonicContact CZ-OE1 3.66Å; R93-E97 IonicContact NE-OE1 2.82Å; R93-E97 PolarHBondContact NE-OE1 3.45Å; R93-E97 IonicContact NH2-OE1 3.61Å; R93-E97 WeakPolarHBondContact O-CB 3.27Å; R93-E97 VanDerWaalsContact O-CG 3.31Å; R93-E97 WeakPolarHBondContact O-CG 3.44Å; R93-E97 PolarHBondContact O-N 3.19Å; L94-E97 PolarHBondContact O-N 3.35Å; E97-R99 PolarHBondContact O-N 3.25Å; E97-T100 PolarHBondContact O-N 3.13Å; E97-T100 PolarHBondContact O-OG1 2.92Å; E97-F119 HydrophobicContact CB-CE1 4.2Å; E97-F119 HydrophobicContact CB-CZ 4.02Å; E97-R123 VanDerWaalsContact CD-NH2 3.27Å; E97-R123 IonicContact OE1-CZ 2.73Å; E97-R123 IonicContact OE1-NH2 2.73Å; E97-R123 PolarHBondContact OE1-NH2 2.97Å; E97-R123 IonicContact OE2-CZ 3.52Å; E97-R123 VanDerWaalsContact OE2-CZ 3.28Å; E97-R123 IonicContact OE2-NE 3.43Å; E97-R123 PolarHBondContact OE2-NE 3.38Å; E97-R123 IonicContact OE2-NH2 3.49Å; E97-R123 PolarHBondContact OE2-NH2 3.45Å
98	M	90.8	Very high	90.2	Very high	18 Å²	18	65.6 Å²	65.6	9%	0.089	32%	0.317	C	S	.	.	H	α-helix	trans	-60.9	-39.7	177	-77.9	179.8	69.1	0	0	113.2	L94 A96 T100 K101 K116 F119 I120 V271	L94-M98 HydrophobicContact CD1-CG 4.04Å; L94-M98 HydrophobicContact CD1-SD 3.94Å; L94-M98 HydrophobicContact CD2-SD 4.41Å; L94-M98 HydrophobicContact CG-CG 4.36Å; L94-M98 HydrophobicContact CG-SD 3.87Å; L94-M98 WeakPolarHBondContact O-CB 3.35Å; L94-M98 VanDerWaalsContact O-CG 3.28Å; L94-M98 WeakPolarHBondContact O-CG 3.4Å; L94-M98 PolarHBondContact O-N 2.93Å; A96-M98 PolarHBondContact O-N 3.41Å; M98-T100 VanDerWaalsContact C-N 3.29Å; M98-T100 PolarHBondContact O-N 2.96Å; M98-K101 PolarHBondContact O-N 2.89Å; M98-K116 HydrophobicContact CE-CB 3.72Å; M98-K116 HydrophobicContact CE-CD 4.05Å; M98-K116 HydrophobicContact CE-CG 3.72Å; M98-F119 HydrophobicContact CB-CE1 4.46Å; M98-F119 HydrophobicContact CG-CD1 3.51Å; M98-F119 HydrophobicContact CG-CE1 3.58Å; M98-I120 HydrophobicContact SD-CD1 4.19Å; M98-I120 HydrophobicContact SD-CG1 4.21Å; M98-V271 HydrophobicContact CE-CG1 4.48Å
99	R	89.7	Confident	91.1	Very high	170 Å²	170	64 Å²	64	64%	0.642	31%	0.308	S	S	*	.	H	α-helix	trans	-59.8	-38.3	176.5	-75.5	166.5	176.2	170.8	-5.2	111.8	L95 A96 E97 K101 Q102	L95-R99 VanDerWaalsContact O-CG 3.3Å; L95-R99 WeakPolarHBondContact O-CG 3.31Å; L95-R99 PolarHBondContact O-N 3.43Å; L95-R99 VanDerWaalsContact O-N 3.11Å; A96-R99 PolarHBondContact O-N 3.32Å; E97-R99 PolarHBondContact O-N 3.25Å; R99-K101 VanDerWaalsContact C-N 3.27Å; R99-K101 PolarHBondContact O-N 2.89Å; R99-Q102 PolarHBondContact O-N 2.96Å
100	T	91.6	Very high	91.7	Very high	106 Å²	106	59.9 Å²	59.9	65%	0.65	29%	0.287	S	S	*	.	H	α-helix	trans	-63.7	-29.8	179.5	71.4	0	0	0	0	113.7	A96 E97 M98 Q102	A96-T100 PolarHBondContact O-N 2.88Å; E97-T100 PolarHBondContact O-N 3.13Å; E97-T100 PolarHBondContact O-OG1 2.92Å; M98-T100 VanDerWaalsContact C-N 3.29Å; M98-T100 PolarHBondContact O-N 2.96Å; T100-Q102 VanDerWaalsContact C-N 3.34Å
101	K	90.1	Very high	92.2	Very high	82 Å²	82	60.4 Å²	60.4	36%	0.357	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-0.7	179.8	-65.2	-66	-172	-176	0	113.6	M98 R99 F103 F119 D574	M98-K101 PolarHBondContact O-N 2.89Å; R99-K101 VanDerWaalsContact C-N 3.27Å; R99-K101 PolarHBondContact O-N 2.89Å; K101-F103 VanDerWaalsContact C-N 3.3Å; K101-F103 HydrophobicContact CB-CD2 4.15Å; K101-F103 HydrophobicContact CB-CE1 4.25Å; K101-F103 HydrophobicContact CB-CE2 3.58Å; K101-F103 HydrophobicContact CB-CZ 3.62Å; K101-F103 HydrophobicContact CG-CE2 4.34Å; K101-F103 HydrophobicContact CG-CZ 4.24Å; K101-F103 PolarHBondContact O-N 3.19Å; K101-F103 VanDerWaalsContact O-N 3.16Å; K101-F119 HydrophobicContact CG-CD2 4.4Å; K101-F119 HydrophobicContact CG-CE2 3.93Å; K101-F119 HydrophobicContact CG-CZ 4.43Å; K101-D574 IonicContact NZ-OD1 3Å; K101-D574 PolarHBondContact NZ-OD1 2.95Å; K101-D574 IonicContact NZ-OD2 3.29Å; K101-D574 PolarHBondContact NZ-OD2 3.46Å
102	Q	89.5	Confident	92.5	Very high	138 Å²	138	60.6 Å²	60.6	65%	0.645	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	38.3	170.5	-60.6	-173.1	-19.3	0	0	115.5	R99 T100 D104 S105	R99-Q102 PolarHBondContact O-N 2.96Å; T100-Q102 VanDerWaalsContact C-N 3.34Å; Q102-D104 PolarHBondContact O-N 2.92Å; Q102-S105 WeakPolarHBondContact O-CB 3.3Å; Q102-S105 PolarHBondContact O-N 3.4Å; Q102-S105 PolarHBondContact O-OG 3.42Å
103	F	93	Very high	92.9	Very high	32 Å²	32	54.6 Å²	54.6	14%	0.14	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-56.4	-27.5	-177.5	-66.2	-63.1	0	0	0	113.9	K101 S105 I106 R112 K116 F119	K101-F103 VanDerWaalsContact C-N 3.3Å; K101-F103 HydrophobicContact CB-CD2 4.15Å; K101-F103 HydrophobicContact CB-CE1 4.25Å; K101-F103 HydrophobicContact CB-CE2 3.58Å; K101-F103 HydrophobicContact CB-CZ 3.62Å; K101-F103 HydrophobicContact CG-CE2 4.34Å; K101-F103 HydrophobicContact CG-CZ 4.24Å; K101-F103 PolarHBondContact O-N 3.19Å; K101-F103 VanDerWaalsContact O-N 3.16Å; F103-S105 PolarHBondContact O-N 2.96Å; F103-S105 VanDerWaalsContact O-N 3.17Å; F103-I106 HydrophobicContact CD1-CD1 4.28Å; F103-I106 VanDerWaalsContact O-CB 3.29Å; F103-I106 WeakPolarHBondContact O-CB 3.27Å; F103-I106 WeakPolarHBondContact O-CG1 3.45Å; F103-I106 PolarHBondContact O-N 3Å; F103-R112 WeakPolarHBondContact O-CG 3.48Å; F103-K116 HydrophobicContact CB-CD 4.46Å; F103-K116 HydrophobicContact CB-CG 3.73Å; F103-K116 HydrophobicContact CD2-CG 4.03Å; F103-K116 HydrophobicContact CG-CG 3.94Å; F103-F119 HydrophobicContact CE2-CB 3.81Å; F103-F119 HydrophobicContact CE2-CD1 4.09Å; F103-F119 HydrophobicContact CE2-CD2 4.16Å; F103-F119 AromaticContact CE2-CG 3.75Å; F103-F119 HydrophobicContact CE2-CG 3.75Å; F103-F119 HydrophobicContact CZ-CB 3.57Å; F103-F119 AromaticContact CZ-CD2 3.87Å; F103-F119 HydrophobicContact CZ-CD2 3.87Å; F103-F119 AromaticContact CZ-CG 3.74Å; F103-F119 HydrophobicContact CZ-CG 3.74Å
104	D	92.1	Very high	93.2	Very high	107 Å²	107	50 Å²	50	57%	0.572	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-68.5	-9.5	179.5	-52.9	-68.3	0	0	0	114.1	Q102 I106 K116	Q102-D104 PolarHBondContact O-N 2.92Å; D104-I106 PolarHBondContact O-N 3.29Å; D104-K116 WeakPolarHBondContact OD1-CE 3.47Å; D104-K116 IonicContact OD1-NZ 3.4Å; D104-K116 PolarHBondContact OD1-NZ 3.35Å
105	S	93.5	Very high	93.3	Very high	52 Å²	52	50.4 Å²	50.4	36%	0.364	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-71.2	-14.2	166.1	65.5	0	0	0	0	114.1	Q102 F103 R107	Q102-S105 WeakPolarHBondContact O-CB 3.3Å; Q102-S105 PolarHBondContact O-N 3.4Å; Q102-S105 PolarHBondContact O-OG 3.42Å; F103-S105 PolarHBondContact O-N 2.96Å; F103-S105 VanDerWaalsContact O-N 3.17Å; S105-R107 PolarHBondContact O-N 3.49Å
106	I	94.9	Very high	93.6	Very high	10 Å²	10	48.8 Å²	48.8	5%	0.051	24%	0.243	C	C	.	.			trans	-74.9	111.8	176.3	-63.8	168.2	0	0	0	108.9	F103 D104 F108 R112 W363	F103-I106 HydrophobicContact CD1-CD1 4.28Å; F103-I106 VanDerWaalsContact O-CB 3.29Å; F103-I106 WeakPolarHBondContact O-CB 3.27Å; F103-I106 WeakPolarHBondContact O-CG1 3.45Å; F103-I106 PolarHBondContact O-N 3Å; D104-I106 PolarHBondContact O-N 3.29Å; I106-F108 PolarHBondContact O-N 2.88Å; I106-R112 HydrophobicContact CB-CB 3.89Å; I106-R112 HydrophobicContact CB-CG 4.2Å; I106-R112 HydrophobicContact CG2-CB 3.77Å; I106-R112 PolarHBondContact O-NH1 2.85Å; I106-W363 HydrophobicContact CB-CB 4.49Å; I106-W363 HydrophobicContact CD1-CE3 3.81Å; I106-W363 HydrophobicContact CD1-CZ3 4.25Å; I106-W363 HydrophobicContact CG1-CB 4.21Å; I106-W363 HydrophobicContact CG1-CE3 4.14Å; I106-W363 HydrophobicContact CG2-CB 4.02Å; I106-W363 HydrophobicContact CG2-CG 4.3Å
107	R	93.3	Very high	94	Very high	104 Å²	104	46.5 Å²	46.5	39%	0.392	22%	0.224	S	C	.	.	S	Bend	trans	-61.3	-41.4	-177.2	-59.4	177	-61.6	164.2	-2.1	112.8	S105 A109 R112 F362 W363 I364 N373	S105-R107 PolarHBondContact O-N 3.49Å; R107-A109 PolarHBondContact O-N 3.29Å; R107-R112 PolarHBondContact O-NH1 2.9Å; R107-F362 PolarHBondContact NH2-O 2.7Å; R107-W363 WeakPolarHBondContact CB-O 3.15Å; R107-W363 WeakPolarHBondContact CG-O 3.47Å; R107-W363 PolarHBondContact N-O 2.89Å; R107-W363 PolarHBondContact NE-O 3.23Å; R107-I364 VanDerWaalsContact CD-O 3.31Å; R107-I364 WeakPolarHBondContact CD-O 3.49Å; R107-I364 PolarHBondContact NE-O 2.86Å; R107-N373 VanDerWaalsContact CZ-OD1 3.31Å; R107-N373 VanDerWaalsContact NH1-CG 3.31Å; R107-N373 PolarHBondContact NH1-OD1 3.11Å; R107-N373 PolarHBondContact NH2-OD1 2.86Å
108	F	93.4	Very high	94.2	Very high	32 Å²	32	46.4 Å²	46.4	14%	0.14	22%	0.222	C	C	.	.	S	Bend	trans	-83.5	113.7	-173.6	-52.2	-70.2	0	0	0	111.9	I106 A110 Y111 R112 F362	I106-F108 PolarHBondContact O-N 2.88Å; F108-A110 VanDerWaalsContact C-N 3.34Å; F108-A110 PolarHBondContact O-N 2.96Å; F108-Y111 HydrophobicContact CB-CD2 3.7Å; F108-Y111 HydrophobicContact CB-CG 4.46Å; F108-Y111 HydrophobicContact CD2-CD2 4.31Å; F108-Y111 HydrophobicContact CG-CD2 4.24Å; F108-Y111 PolarHBondContact O-N 2.68Å; F108-Y111 VanDerWaalsContact O-N 3.14Å; F108-R112 PolarHBondContact O-N 3.33Å; F108-F362 HydrophobicContact CD2-CE1 4.4Å; F108-F362 HydrophobicContact CE2-CD1 4.06Å; F108-F362 AromaticContact CE2-CE1 3.58Å; F108-F362 HydrophobicContact CE2-CE1 3.58Å; F108-F362 AromaticContact CE2-CZ 3.93Å; F108-F362 HydrophobicContact CE2-CZ 3.93Å; F108-F362 AromaticContact CZ-CE1 3.99Å; F108-F362 HydrophobicContact CZ-CE1 3.99Å; F108-F362 AromaticContact CZ-CZ 3.88Å; F108-F362 HydrophobicContact CZ-CZ 3.88Å
109	A	94.3	Very high	94.5	Very high	14 Å²	14	46.7 Å²	46.7	12%	0.116	22%	0.222	C	C	.	.	H	α-helix	trans	-54	-44	-174.4	0	0	0	0	0	114.1	R107 Y111 R112 T113 N276 F277	R107-A109 PolarHBondContact O-N 3.29Å; A109-Y111 PolarHBondContact O-N 3.46Å; A109-R112 PolarHBondContact O-N 3.21Å; A109-T113 WeakPolarHBondContact O-CB 3.36Å; A109-T113 PolarHBondContact O-N 3.48Å; A109-T113 PolarHBondContact O-OG1 3.45Å; A109-N276 HydrophobicContact CB-CB 3.8Å; A109-F277 HydrophobicContact CB-CE2 4.03Å; A109-F277 HydrophobicContact CB-CZ 4.15Å
110	A	94.9	Very high	94.8	Very high	9 Å²	9	38.6 Å²	38.6	7%	0.074	19%	0.192	C	C	.	.	H	α-helix	trans	-63.9	-40.4	-179.6	0	0	0	0	0	112.9	F108 A114 F277 V314 I318	F108-A110 VanDerWaalsContact C-N 3.34Å; F108-A110 PolarHBondContact O-N 2.96Å; A110-A114 VanDerWaalsContact O-CB 3.24Å; A110-A114 WeakPolarHBondContact O-CB 3.31Å; A110-A114 PolarHBondContact O-N 2.81Å; A110-F277 HydrophobicContact CB-CZ 3.92Å; A110-V314 HydrophobicContact CB-CG1 3.84Å; A110-I318 HydrophobicContact CB-CD1 3.62Å
111	Y	95.8	Very high	95.1	Very high	13 Å²	13	33.5 Å²	33.5	5%	0.051	16%	0.161	C	C	.	.	H	α-helix	trans	-72.5	-35.4	175.1	-71	-88.4	0	0	0	112.2	F108 A109 S115 I318 R321 L345 Y347 W363 E379 I442	F108-Y111 HydrophobicContact CB-CD2 3.7Å; F108-Y111 HydrophobicContact CB-CG 4.46Å; F108-Y111 HydrophobicContact CD2-CD2 4.31Å; F108-Y111 HydrophobicContact CG-CD2 4.24Å; F108-Y111 PolarHBondContact O-N 2.68Å; F108-Y111 VanDerWaalsContact O-N 3.14Å; A109-Y111 PolarHBondContact O-N 3.46Å; Y111-S115 VanDerWaalsContact O-CB 3.27Å; Y111-S115 WeakPolarHBondContact O-CB 3.41Å; Y111-S115 PolarHBondContact O-N 2.87Å; Y111-S115 PolarHBondContact O-OG 2.99Å; Y111-I318 HydrophobicContact CD1-CD1 4.14Å; Y111-I318 HydrophobicContact CD1-CG2 3.53Å; Y111-I318 HydrophobicContact CD2-CD1 3.78Å; Y111-I318 HydrophobicContact CE1-CD1 4.13Å; Y111-I318 HydrophobicContact CE1-CG2 3.86Å; Y111-I318 HydrophobicContact CE2-CD1 3.75Å; Y111-I318 HydrophobicContact CG-CD1 4.01Å; Y111-I318 HydrophobicContact CG-CG2 4.11Å; Y111-R321 VanDerWaalsContact CZ-NH2 3.26Å; Y111-R321 PolarHBondContact OH-NH2 2.96Å; Y111-L345 HydrophobicContact CE1-CD1 4.08Å; Y111-Y347 VanDerWaalsContact CE1-OH 3.26Å; Y111-Y347 WeakPolarHBondContact CE1-OH 3.47Å; Y111-Y347 PolarHBondContact OH-OH 2.91Å; Y111-W363 HydrophobicContact CD1-CD2 4.48Å; Y111-W363 AromaticContact CD1-CE2 3.42Å; Y111-W363 VanDerWaalsContact CD1-CE2 3.42Å; Y111-W363 AromaticContact CD1-CZ2 3.45Å; Y111-W363 HydrophobicContact CD1-CZ2 3.45Å; Y111-W363 VanDerWaalsContact CD1-CZ2 3.45Å; Y111-W363 AromaticContact CD1-NE1 3.21Å; Y111-W363 HydrophobicContact CE1-CZ2 4.04Å; Y111-W363 AromaticContact CE1-NE1 3.51Å; Y111-W363 AromaticContact CG-CE2 3.95Å; Y111-W363 HydrophobicContact CG-CZ2 4.32Å; Y111-W363 AromaticContact CG-NE1 3.61Å; Y111-E379 PolarHBondContact OH-OE2 3.45Å; Y111-I442 WeakPolarHBondContact OH-CD1 3.42Å
112	R	97.1	Very high	95.3	Very high	35 Å²	35	32.6 Å²	32.6	13%	0.132	16%	0.158	C	C	.	.	H	α-helix	trans	-62.5	-50.9	175.2	-173.6	170.9	57.9	-117.7	1	110.9	F103 I106 R107 F108 A109 S115 K116 E273 N276	F103-R112 WeakPolarHBondContact O-CG 3.48Å; I106-R112 HydrophobicContact CB-CB 3.89Å; I106-R112 HydrophobicContact CB-CG 4.2Å; I106-R112 HydrophobicContact CG2-CB 3.77Å; I106-R112 PolarHBondContact O-NH1 2.85Å; R107-R112 PolarHBondContact O-NH1 2.9Å; F108-R112 PolarHBondContact O-N 3.33Å; A109-R112 PolarHBondContact O-N 3.21Å; R112-S115 PolarHBondContact O-N 3.48Å; R112-K116 HydrophobicContact CG-CD 4.42Å; R112-K116 WeakPolarHBondContact O-CG 3.48Å; R112-K116 PolarHBondContact O-N 3.46Å; R112-E273 VanDerWaalsContact CD-OE1 3.28Å; R112-E273 WeakPolarHBondContact CD-OE1 3.43Å; R112-E273 WeakPolarHBondContact CG-OE1 3.32Å; R112-E273 IonicContact CZ-OE1 2.71Å; R112-E273 IonicContact CZ-OE2 2.7Å; R112-E273 VanDerWaalsContact NE-CD 3.31Å; R112-E273 IonicContact NE-OE1 3.22Å; R112-E273 PolarHBondContact NE-OE1 3.4Å; R112-E273 IonicContact NE-OE2 2.7Å; R112-E273 PolarHBondContact NE-OE2 3.44Å; R112-E273 VanDerWaalsContact NE-OE2 3.15Å; R112-E273 IonicContact NH2-OE1 2.7Å; R112-E273 IonicContact NH2-OE2 3.59Å; R112-E273 PolarHBondContact NH2-OE2 2.82Å; R112-N276 PolarHBondContact NH2-ND2 2.68Å
113	T	97.6	Very high	95.5	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-54.7	-52.9	173.7	-52.2	0	0	0	0	111.5	A109 S115 K116 L117 P268 V271 E273 F277 W315	A109-T113 WeakPolarHBondContact O-CB 3.36Å; A109-T113 PolarHBondContact O-N 3.48Å; A109-T113 PolarHBondContact O-OG1 3.45Å; T113-S115 VanDerWaalsContact C-N 3.29Å; T113-S115 PolarHBondContact O-N 3.07Å; T113-K116 PolarHBondContact O-N 3.27Å; T113-L117 HydrophobicContact CG2-CD1 4.02Å; T113-L117 WeakPolarHBondContact O-CB 3.47Å; T113-L117 WeakPolarHBondContact O-CG 3.24Å; T113-L117 PolarHBondContact O-N 3.23Å; T113-P268 HydrophobicContact CG2-CB 3.76Å; T113-V271 HydrophobicContact CG2-CG2 4.14Å; T113-E273 HydrophobicContact CG2-CB 4.3Å; T113-E273 HydrophobicContact CG2-CG 4.31Å; T113-E273 WeakPolarHBondContact OG1-CB 3.29Å; T113-E273 VanDerWaalsContact OG1-CG 3.24Å; T113-E273 WeakPolarHBondContact OG1-CG 3.39Å; T113-F277 HydrophobicContact CG2-CD2 4.39Å; T113-F277 VanDerWaalsContact OG1-CE2 3.25Å; T113-F277 WeakPolarHBondContact OG1-CE2 3.5Å; T113-W315 HydrophobicContact CG2-CB 3.62Å; T113-W315 HydrophobicContact CG2-CD2 4.17Å; T113-W315 HydrophobicContact CG2-CE3 4.36Å; T113-W315 HydrophobicContact CG2-CG 3.85Å
114	A	97.4	Very high	95.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.2	-36.2	179.5	0	0	0	0	0	112.8	A110 R118 I318 F319 L322	A110-A114 VanDerWaalsContact O-CB 3.24Å; A110-A114 WeakPolarHBondContact O-CB 3.31Å; A110-A114 PolarHBondContact O-N 2.81Å; A114-R118 WeakPolarHBondContact O-CB 3.28Å; A114-R118 PolarHBondContact O-N 2.94Å; A114-I318 HydrophobicContact CB-CB 3.97Å; A114-I318 HydrophobicContact CB-CG2 3.64Å; A114-F319 HydrophobicContact CB-CB 4.08Å; A114-L322 HydrophobicContact CB-CD1 3.84Å
115	S	97.1	Very high	95.8	Very high	11 Å²	11	24 Å²	24	8%	0.077	11%	0.112	C	C	.	.	H	α-helix	trans	-71.9	-44.5	177.9	-59.3	0	0	0	0	112.1	Y111 R112 T113 L117 R118 F119 W363	Y111-S115 VanDerWaalsContact O-CB 3.27Å; Y111-S115 WeakPolarHBondContact O-CB 3.41Å; Y111-S115 PolarHBondContact O-N 2.87Å; Y111-S115 PolarHBondContact O-OG 2.99Å; R112-S115 PolarHBondContact O-N 3.48Å; T113-S115 VanDerWaalsContact C-N 3.29Å; T113-S115 PolarHBondContact O-N 3.07Å; S115-L117 PolarHBondContact O-N 2.87Å; S115-R118 PolarHBondContact O-N 3.22Å; S115-F119 WeakPolarHBondContact O-CB 3.49Å; S115-F119 PolarHBondContact O-N 3.02Å; S115-W363 WeakPolarHBondContact OG-CZ3 3.49Å
116	K	97.5	Very high	95.8	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.017	10%	0.095	C	C	.	.	H	α-helix	trans	-58.3	-46.3	173.4	-71.3	178.1	179.8	175	0	111.2	M98 F103 D104 R112 T113 F119 I120 V271 E273	M98-K116 HydrophobicContact CE-CB 3.72Å; M98-K116 HydrophobicContact CE-CD 4.05Å; M98-K116 HydrophobicContact CE-CG 3.72Å; F103-K116 HydrophobicContact CB-CD 4.46Å; F103-K116 HydrophobicContact CB-CG 3.73Å; F103-K116 HydrophobicContact CD2-CG 4.03Å; F103-K116 HydrophobicContact CG-CG 3.94Å; D104-K116 WeakPolarHBondContact OD1-CE 3.47Å; D104-K116 IonicContact OD1-NZ 3.4Å; D104-K116 PolarHBondContact OD1-NZ 3.35Å; R112-K116 HydrophobicContact CG-CD 4.42Å; R112-K116 WeakPolarHBondContact O-CG 3.48Å; R112-K116 PolarHBondContact O-N 3.46Å; T113-K116 PolarHBondContact O-N 3.27Å; K116-F119 WeakPolarHBondContact O-CB 3.33Å; K116-F119 PolarHBondContact O-N 3.47Å; K116-I120 WeakPolarHBondContact O-CG1 3.45Å; K116-I120 PolarHBondContact O-N 3.11Å; K116-V271 HydrophobicContact CB-CB 3.92Å; K116-V271 HydrophobicContact CB-CG1 4.06Å; K116-V271 HydrophobicContact CB-CG2 4.28Å; K116-V271 HydrophobicContact CD-CB 3.9Å; K116-V271 HydrophobicContact CD-CG2 4.35Å; K116-V271 VanDerWaalsContact CD-O 3.31Å; K116-V271 WeakPolarHBondContact CD-O 3.17Å; K116-V271 PolarHBondContact NZ-O 3.34Å; K116-E273 IonicContact NZ-OE1 3.71Å; K116-E273 PolarHBondContact NZ-OE1 3.27Å
117	L	97.7	Very high	95.7	Very high	3 Å²	3	22.9 Å²	22.9	2%	0.016	10%	0.103	C	C	.	.	H	α-helix	trans	-69.6	-35.2	177.5	-69.6	172.3	0	0	0	113.1	T113 S115 I120 Q121 W204 L267 V271 W315 F319	T113-L117 HydrophobicContact CG2-CD1 4.02Å; T113-L117 WeakPolarHBondContact O-CB 3.47Å; T113-L117 WeakPolarHBondContact O-CG 3.24Å; T113-L117 PolarHBondContact O-N 3.23Å; S115-L117 PolarHBondContact O-N 2.87Å; L117-I120 HydrophobicContact CD2-CD1 4.28Å; L117-I120 PolarHBondContact O-N 3.44Å; L117-Q121 WeakPolarHBondContact O-CB 3.23Å; L117-Q121 PolarHBondContact O-N 3.13Å; L117-W204 HydrophobicContact CD2-CH2 4.46Å; L117-W204 HydrophobicContact CD2-CZ2 3.86Å; L117-L267 HydrophobicContact CD1-CB 4.35Å; L117-L267 HydrophobicContact CD2-CB 4.34Å; L117-V271 HydrophobicContact CD2-CG1 3.76Å; L117-V271 HydrophobicContact CD2-CG2 4.46Å; L117-V271 HydrophobicContact CG-CG1 4.2Å; L117-V271 HydrophobicContact CG-CG2 4.27Å; L117-W315 HydrophobicContact CD1-CD2 4.47Å; L117-W315 HydrophobicContact CD1-CE3 3.51Å; L117-W315 HydrophobicContact CD1-CH2 4.39Å; L117-W315 HydrophobicContact CD1-CZ3 3.47Å; L117-W315 VanDerWaalsContact CD1-CZ3 3.47Å; L117-F319 HydrophobicContact CB-CD2 4.05Å; L117-F319 HydrophobicContact CB-CE2 4.16Å
118	R	96.8	Very high	95.6	Very high	35 Å²	35	21 Å²	21	13%	0.132	10%	0.1	C	C	.	.	H	α-helix	trans	-65.6	-38	172.6	178.8	55.9	170	174.6	-3.4	111.7	A114 S115 Q121 Q122 F319	A114-R118 WeakPolarHBondContact O-CB 3.28Å; A114-R118 PolarHBondContact O-N 2.94Å; S115-R118 PolarHBondContact O-N 3.22Å; R118-Q121 WeakPolarHBondContact O-CB 3.49Å; R118-Q121 PolarHBondContact O-N 3.35Å; R118-Q122 WeakPolarHBondContact O-CG 3.46Å; R118-Q122 PolarHBondContact O-N 3.16Å; R118-Q122 PolarHBondContact O-OE1 3.35Å; R118-F319 HydrophobicContact CB-CD2 4.29Å; R118-F319 HydrophobicContact CB-CE2 4.35Å
119	F	96.8	Very high	95.5	Very high	23 Å²	23	19.8 Å²	19.8	10%	0.101	9%	0.094	C	C	.	.	H	α-helix	trans	-62.3	-47.3	172.6	-178.2	-100.3	0	0	0	111.7	L94 E97 M98 K101 F103 S115 K116 Q121 Q122 R123	L94-F119 HydrophobicContact CD1-CD1 4.36Å; L94-F119 HydrophobicContact CD1-CE1 4.18Å; E97-F119 HydrophobicContact CB-CE1 4.2Å; E97-F119 HydrophobicContact CB-CZ 4.02Å; M98-F119 HydrophobicContact CB-CE1 4.46Å; M98-F119 HydrophobicContact CG-CD1 3.51Å; M98-F119 HydrophobicContact CG-CE1 3.58Å; K101-F119 HydrophobicContact CG-CD2 4.4Å; K101-F119 HydrophobicContact CG-CE2 3.93Å; K101-F119 HydrophobicContact CG-CZ 4.43Å; F103-F119 HydrophobicContact CE2-CB 3.81Å; F103-F119 HydrophobicContact CE2-CD1 4.09Å; F103-F119 HydrophobicContact CE2-CD2 4.16Å; F103-F119 AromaticContact CE2-CG 3.75Å; F103-F119 HydrophobicContact CE2-CG 3.75Å; F103-F119 HydrophobicContact CZ-CB 3.57Å; F103-F119 AromaticContact CZ-CD2 3.87Å; F103-F119 HydrophobicContact CZ-CD2 3.87Å; F103-F119 AromaticContact CZ-CG 3.74Å; F103-F119 HydrophobicContact CZ-CG 3.74Å; S115-F119 WeakPolarHBondContact O-CB 3.49Å; S115-F119 PolarHBondContact O-N 3.02Å; K116-F119 WeakPolarHBondContact O-CB 3.33Å; K116-F119 PolarHBondContact O-N 3.47Å; F119-Q121 VanDerWaalsContact C-N 3.32Å; F119-Q121 PolarHBondContact O-N 3.32Å; F119-Q122 PolarHBondContact O-N 3.28Å; F119-Q122 VanDerWaalsContact O-N 3.09Å; F119-R123 HydrophobicContact CD1-CG 4.03Å; F119-R123 HydrophobicContact CD2-CG 4.34Å; F119-R123 HydrophobicContact CE1-CG 3.61Å; F119-R123 HydrophobicContact CE2-CG 3.94Å; F119-R123 HydrophobicContact CG-CG 4.39Å; F119-R123 HydrophobicContact CZ-CG 3.55Å; F119-R123 WeakPolarHBondContact O-CG 3.29Å; F119-R123 PolarHBondContact O-N 3.13Å
120	I	97.1	Very high	95.4	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-57.5	-45.6	173.8	-69.6	159.9	0	0	0	111	L94 M98 K116 L117 Q122 R123 T124 W204 L229 V271	L94-I120 HydrophobicContact CD1-CG1 3.91Å; L94-I120 HydrophobicContact CD2-CD1 4.37Å; L94-I120 HydrophobicContact CD2-CG1 4Å; L94-I120 HydrophobicContact CG-CG1 4.47Å; M98-I120 HydrophobicContact SD-CD1 4.19Å; M98-I120 HydrophobicContact SD-CG1 4.21Å; K116-I120 WeakPolarHBondContact O-CG1 3.45Å; K116-I120 PolarHBondContact O-N 3.11Å; L117-I120 HydrophobicContact CD2-CD1 4.28Å; L117-I120 PolarHBondContact O-N 3.44Å; I120-Q122 PolarHBondContact O-N 2.94Å; I120-R123 PolarHBondContact O-N 2.68Å; I120-T124 HydrophobicContact CG2-CG2 4.24Å; I120-T124 WeakPolarHBondContact O-CB 3.39Å; I120-T124 WeakPolarHBondContact O-CG2 3.07Å; I120-T124 PolarHBondContact O-N 2.81Å; I120-T124 PolarHBondContact O-OG1 2.93Å; I120-W204 HydrophobicContact CD1-CZ2 4.29Å; I120-W204 HydrophobicContact CG2-CD2 3.92Å; I120-W204 HydrophobicContact CG2-CE3 3.98Å; I120-W204 HydrophobicContact CG2-CG 4.46Å; I120-W204 HydrophobicContact CG2-CH2 4.29Å; I120-W204 HydrophobicContact CG2-CZ2 4.27Å; I120-W204 HydrophobicContact CG2-CZ3 4.18Å; I120-L229 HydrophobicContact CG2-CD1 4.48Å; I120-V271 HydrophobicContact CD1-CG1 3.43Å; I120-V271 VanDerWaalsContact CD1-CG1 3.43Å
121	Q	96.9	Very high	95.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-56.7	-36.2	176.3	-160.1	-159.2	11.7	0	0	112.7	L117 R118 F119 T124 L125 F126 N127 L229 T230 F319	L117-Q121 WeakPolarHBondContact O-CB 3.23Å; L117-Q121 PolarHBondContact O-N 3.13Å; R118-Q121 WeakPolarHBondContact O-CB 3.49Å; R118-Q121 PolarHBondContact O-N 3.35Å; F119-Q121 VanDerWaalsContact C-N 3.32Å; F119-Q121 PolarHBondContact O-N 3.32Å; Q121-T124 PolarHBondContact O-OG1 3.09Å; Q121-L125 PolarHBondContact O-N 3.2Å; Q121-F126 HydrophobicContact CG-CB 4.18Å; Q121-F126 PolarHBondContact O-N 3.14Å; Q121-N127 HydrophobicContact CG-CB 4.29Å; Q121-N127 PolarHBondContact O-N 2.84Å; Q121-N127 PolarHBondContact O-OD1 3.24Å; Q121-L229 HydrophobicContact CB-CD2 4.21Å; Q121-L229 HydrophobicContact CG-CD2 4.28Å; Q121-L229 WeakPolarHBondContact CG-O 3.38Å; Q121-L229 PolarHBondContact NE2-O 3.49Å; Q121-T230 PolarHBondContact NE2-O 3.2Å; Q121-F319 HydrophobicContact CB-CE2 4.24Å; Q121-F319 HydrophobicContact CB-CZ 4.37Å; Q121-F319 HydrophobicContact CG-CE2 4.49Å; Q121-F319 HydrophobicContact CG-CZ 4.16Å
122	Q	94.6	Very high	95.4	Very high	63 Å²	63	30.1 Å²	30.1	29%	0.294	14%	0.136	S	C	.	.	H	α-helix	trans	-78.2	-45.4	177.8	-69.9	171.4	-77.3	0	0	112.4	R118 F119 I120 T124 L125 N127	R118-Q122 WeakPolarHBondContact O-CG 3.46Å; R118-Q122 PolarHBondContact O-N 3.16Å; R118-Q122 PolarHBondContact O-OE1 3.35Å; F119-Q122 PolarHBondContact O-N 3.28Å; F119-Q122 VanDerWaalsContact O-N 3.09Å; I120-Q122 PolarHBondContact O-N 2.94Å; Q122-T124 VanDerWaalsContact C-N 3.28Å; Q122-T124 PolarHBondContact O-N 3.21Å; Q122-L125 PolarHBondContact O-N 3.02Å; Q122-L125 VanDerWaalsContact O-N 3.07Å; Q122-N127 WeakPolarHBondContact CA-OD1 3.36Å; Q122-N127 HydrophobicContact CG-CB 4.19Å
123	R	94.4	Very high	95.2	Very high	69 Å²	69	28.9 Å²	28.9	26%	0.26	13%	0.131	S	C	.	.	H	α-helix	trans	-68.2	-25.6	179.5	-64.1	-58.3	-66.7	144.8	-4	113.6	E97 F119 I120	E97-R123 VanDerWaalsContact CD-NH2 3.27Å; E97-R123 IonicContact OE1-CZ 2.73Å; E97-R123 IonicContact OE1-NH2 2.73Å; E97-R123 PolarHBondContact OE1-NH2 2.97Å; E97-R123 IonicContact OE2-CZ 3.52Å; E97-R123 VanDerWaalsContact OE2-CZ 3.28Å; E97-R123 IonicContact OE2-NE 3.43Å; E97-R123 PolarHBondContact OE2-NE 3.38Å; E97-R123 IonicContact OE2-NH2 3.49Å; E97-R123 PolarHBondContact OE2-NH2 3.45Å; F119-R123 HydrophobicContact CD1-CG 4.03Å; F119-R123 HydrophobicContact CD2-CG 4.34Å; F119-R123 HydrophobicContact CE1-CG 3.61Å; F119-R123 HydrophobicContact CE2-CG 3.94Å; F119-R123 HydrophobicContact CG-CG 4.39Å; F119-R123 HydrophobicContact CZ-CG 3.55Å; F119-R123 WeakPolarHBondContact O-CG 3.29Å; F119-R123 PolarHBondContact O-N 3.13Å; I120-R123 PolarHBondContact O-N 2.68Å
124	T	95.1	Very high	95.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	0.4	172.9	59	0	0	0	0	113.3	I120 Q121 Q122 F126 Y166 I200 L201	I120-T124 HydrophobicContact CG2-CG2 4.24Å; I120-T124 WeakPolarHBondContact O-CB 3.39Å; I120-T124 WeakPolarHBondContact O-CG2 3.07Å; I120-T124 PolarHBondContact O-N 2.81Å; I120-T124 PolarHBondContact O-OG1 2.93Å; Q121-T124 PolarHBondContact O-OG1 3.09Å; Q122-T124 VanDerWaalsContact C-N 3.28Å; Q122-T124 PolarHBondContact O-N 3.21Å; T124-F126 PolarHBondContact O-N 3.49Å; T124-F126 VanDerWaalsContact O-N 3.14Å; T124-Y166 WeakPolarHBondContact O-CE1 3.4Å; T124-Y166 PolarHBondContact O-OH 3.47Å; T124-I200 HydrophobicContact CG2-CG2 3.9Å; T124-L201 HydrophobicContact CG2-CB 3.7Å; T124-L201 HydrophobicContact CG2-CD1 3.97Å; T124-L201 HydrophobicContact CG2-CG 4.34Å
125	L	94.8	Very high	95	Very high	27 Å²	27	31 Å²	31	14%	0.141	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	9	-177	-44.1	169.7	0	0	0	114.5	Q121 Q122 N127 I128 Y166 I169 M174 V194 A197	Q121-L125 PolarHBondContact O-N 3.2Å; Q122-L125 PolarHBondContact O-N 3.02Å; Q122-L125 VanDerWaalsContact O-N 3.07Å; L125-N127 WeakPolarHBondContact CA-OD1 3.39Å; L125-N127 PolarHBondContact O-N 2.83Å; L125-I128 VanDerWaalsContact O-CG1 3.23Å; L125-I128 WeakPolarHBondContact O-CG1 3.21Å; L125-I128 PolarHBondContact O-N 3.34Å; L125-I128 VanDerWaalsContact O-N 3.11Å; L125-Y166 HydrophobicContact CB-CE1 4.39Å; L125-Y166 HydrophobicContact CD1-CE1 4.41Å; L125-I169 HydrophobicContact CB-CD1 4.5Å; L125-M174 HydrophobicContact CB-CE 4.28Å; L125-M174 HydrophobicContact CD1-CE 3.64Å; L125-M174 HydrophobicContact CD2-CE 3.81Å; L125-M174 HydrophobicContact CG-CE 4.1Å; L125-V194 HydrophobicContact CD1-CG2 4.15Å; L125-A197 HydrophobicContact CD1-CB 3.56Å; L125-A197 HydrophobicContact CG-CB 3.67Å
126	F	94.7	Very high	94.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-68.1	-13.2	177.7	-95.1	-112.6	0	0	0	113.4	Q121 T124 I128 M129 V134 I165 L201 L226 L229 T230 N231	Q121-F126 HydrophobicContact CG-CB 4.18Å; Q121-F126 PolarHBondContact O-N 3.14Å; T124-F126 PolarHBondContact O-N 3.49Å; T124-F126 VanDerWaalsContact O-N 3.14Å; F126-I128 PolarHBondContact O-N 3.15Å; F126-M129 HydrophobicContact CB-CB 4.39Å; F126-M129 HydrophobicContact CD1-CB 4.1Å; F126-M129 HydrophobicContact CD1-CG 4.2Å; F126-M129 HydrophobicContact CD2-CB 4.5Å; F126-M129 HydrophobicContact CE1-CB 4.46Å; F126-M129 HydrophobicContact CE1-CG 4.06Å; F126-M129 HydrophobicContact CE2-CE 4.33Å; F126-M129 HydrophobicContact CG-CB 4.11Å; F126-M129 HydrophobicContact CZ-CG 4.24Å; F126-M129 PolarHBondContact O-N 3.41Å; F126-M129 VanDerWaalsContact O-N 3.14Å; F126-V134 HydrophobicContact CE1-CG2 3.91Å; F126-V134 HydrophobicContact CZ-CG2 4.39Å; F126-I165 HydrophobicContact CZ-CG2 4.18Å; F126-L201 HydrophobicContact CD2-CD2 3.94Å; F126-L201 HydrophobicContact CE2-CD2 3.34Å; F126-L201 HydrophobicContact CZ-CD2 3.96Å; F126-L226 HydrophobicContact CE1-CB 4.07Å; F126-L226 HydrophobicContact CE1-CD2 3.93Å; F126-L226 WeakPolarHBondContact CE1-O 3.35Å; F126-L226 HydrophobicContact CZ-CD2 3.77Å; F126-L229 HydrophobicContact CB-CB 3.9Å; F126-L229 HydrophobicContact CD1-CB 3.72Å; F126-L229 HydrophobicContact CG-CB 4.08Å; F126-T230 HydrophobicContact CD1-CG2 4.23Å; F126-T230 HydrophobicContact CE1-CG2 4.37Å; F126-N231 PolarHBondContact O-N 3.5Å
127	N	92.7	Very high	94.8	Very high	39 Å²	39	32.5 Å²	32.5	21%	0.209	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-67.3	-11.6	169.7	70.3	-69.5	0	0	0	114.4	Q121 Q122 L125 N231	Q121-N127 HydrophobicContact CG-CB 4.29Å; Q121-N127 PolarHBondContact O-N 2.84Å; Q121-N127 PolarHBondContact O-OD1 3.24Å; Q122-N127 WeakPolarHBondContact CA-OD1 3.36Å; Q122-N127 HydrophobicContact CG-CB 4.19Å; L125-N127 WeakPolarHBondContact CA-OD1 3.39Å; L125-N127 PolarHBondContact O-N 2.83Å; N127-N231 WeakPolarHBondContact O-CB 3.12Å; N127-N231 PolarHBondContact O-ND2 3.09Å; N127-N231 PolarHBondContact O-OD1 2.84Å
128	I	91	Very high	94.7	Very high	65 Å²	65	32.4 Å²	32.4	33%	0.333	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-115.9	3.4	168.2	64.6	162.1	0	0	0	112.9	L125 F126 I169 M174	L125-I128 VanDerWaalsContact O-CG1 3.23Å; L125-I128 WeakPolarHBondContact O-CG1 3.21Å; L125-I128 PolarHBondContact O-N 3.34Å; L125-I128 VanDerWaalsContact O-N 3.11Å; F126-I128 PolarHBondContact O-N 3.15Å; I128-I169 HydrophobicContact CD1-CD1 4.38Å; I128-I169 HydrophobicContact CD1-CG2 3.79Å; I128-M174 HydrophobicContact CD1-CE 3.5Å; I128-M174 HydrophobicContact CD1-SD 3.84Å
129	M	92	Very high	94.6	Very high	5 Å²	5	37.6 Å²	37.6	3%	0.025	17%	0.169	C	C	.	.			trans	-86.3	127.1	-176.1	-167.4	66.2	63.5	0	0	111.1	F126 R133 V134 I165 Y166 I169 T230 N231	F126-M129 HydrophobicContact CB-CB 4.39Å; F126-M129 HydrophobicContact CD1-CB 4.1Å; F126-M129 HydrophobicContact CD1-CG 4.2Å; F126-M129 HydrophobicContact CD2-CB 4.5Å; F126-M129 HydrophobicContact CE1-CB 4.46Å; F126-M129 HydrophobicContact CE1-CG 4.06Å; F126-M129 HydrophobicContact CE2-CE 4.33Å; F126-M129 HydrophobicContact CG-CB 4.11Å; F126-M129 HydrophobicContact CZ-CG 4.24Å; F126-M129 PolarHBondContact O-N 3.41Å; F126-M129 VanDerWaalsContact O-N 3.14Å; M129-R133 HydrophobicContact SD-CB 4.49Å; M129-R133 HydrophobicContact SD-CG 4.29Å; M129-V134 HydrophobicContact CG-CG2 3.89Å; M129-I165 HydrophobicContact CE-CG2 3.58Å; M129-I165 HydrophobicContact CG-CG2 4.19Å; M129-I165 HydrophobicContact SD-CG2 3.49Å; M129-I165 WeakPolarHBondContact SD-CG2 3.5Å; M129-Y166 HydrophobicContact CE-CD1 4.2Å; M129-Y166 HydrophobicContact CE-CE1 4.33Å; M129-I169 HydrophobicContact CE-CD1 3.74Å; M129-I169 HydrophobicContact CE-CG1 3.86Å; M129-T230 HydrophobicContact CG-CG2 4.45Å; M129-T230 VanDerWaalsContact O-CB 3.28Å; M129-T230 WeakPolarHBondContact O-CB 3.37Å; M129-N231 PolarHBondContact O-N 3.36Å
130	D	91.9	Very high	94.5	Very high	84 Å²	84	40 Å²	40	45%	0.449	18%	0.181	S	C	.	.			trans	-77.1	144.3	174.3	-80.4	-30.8	0	0	0	112.6	W132 R133 V134	D130-W132 VanDerWaalsContact C-N 3.31Å; D130-W132 HydrophobicContact CB-CG 4.19Å; D130-W132 PolarHBondContact O-N 2.72Å; D130-W132 PolarHBondContact OD2-NE1 2.88Å; D130-R133 HydrophobicContact CB-CB 4.49Å; D130-R133 PolarHBondContact O-N 3.4Å; D130-V134 PolarHBondContact O-N 2.91Å
131	L	95.2	Very high	94.3	Very high	18 Å²	18	43.6 Å²	43.6	9%	0.094	20%	0.196	C	C	.	.	H	α-helix	trans	-60.3	-38.9	172	-179.6	60.8	0	0	0	112.4	R133 V134 V135 S227 A232 D236 K237 Y240	L131-R133 VanDerWaalsContact C-N 3.28Å; L131-R133 PolarHBondContact O-N 3.12Å; L131-V134 PolarHBondContact O-N 3.45Å; L131-V135 HydrophobicContact CD1-CG2 4.03Å; L131-V135 HydrophobicContact CG-CG2 4.3Å; L131-V135 WeakPolarHBondContact O-CG2 3.39Å; L131-V135 PolarHBondContact O-N 2.83Å; L131-S227 VanDerWaalsContact CD1-CB 3.5Å; L131-A232 HydrophobicContact CB-CB 3.55Å; L131-A232 HydrophobicContact CD2-CB 4.11Å; L131-A232 HydrophobicContact CG-CB 4.48Å; L131-D236 HydrophobicContact CD2-CB 4.16Å; L131-D236 WeakPolarHBondContact CD2-O 3.46Å; L131-K237 HydrophobicContact CD2-CG 4.46Å; L131-Y240 HydrophobicContact CD1-CD1 4.07Å; L131-Y240 HydrophobicContact CD1-CG 4.3Å
132	W	94.5	Very high	94.2	Very high	151 Å²	151	45.6 Å²	45.6	57%	0.572	22%	0.217	S	C	*	.	H	α-helix	trans	-60.4	-38.9	178.9	81.1	-98.7	0	0	0	111.4	D130 V135 E136	D130-W132 VanDerWaalsContact C-N 3.31Å; D130-W132 HydrophobicContact CB-CG 4.19Å; D130-W132 PolarHBondContact O-N 2.72Å; D130-W132 PolarHBondContact OD2-NE1 2.88Å; W132-V135 PolarHBondContact O-N 2.83Å; W132-E136 HydrophobicContact CE3-CB 4.1Å; W132-E136 HydrophobicContact CZ3-CB 4.23Å; W132-E136 HydrophobicContact CZ3-CG 4.38Å; W132-E136 WeakPolarHBondContact O-CB 3.29Å; W132-E136 PolarHBondContact O-N 2.92Å
133	R	93.2	Very high	94.1	Very high	9 Å²	9	43.3 Å²	43.3	3%	0.034	21%	0.207	C	C	.	.	H	α-helix	trans	-69.5	-37.7	-177.2	-177.4	63.8	-147.3	141.2	9.2	112	M129 D130 L131 T137 E140 R164 H168	M129-R133 HydrophobicContact SD-CB 4.49Å; M129-R133 HydrophobicContact SD-CG 4.29Å; D130-R133 HydrophobicContact CB-CB 4.49Å; D130-R133 PolarHBondContact O-N 3.4Å; L131-R133 VanDerWaalsContact C-N 3.28Å; L131-R133 PolarHBondContact O-N 3.12Å; R133-T137 VanDerWaalsContact CZ-OG1 3.28Å; R133-T137 PolarHBondContact NH2-OG1 2.59Å; R133-T137 WeakPolarHBondContact O-CB 3.37Å; R133-T137 PolarHBondContact O-N 3.37Å; R133-T137 PolarHBondContact O-OG1 3.14Å; R133-E140 IonicContact CZ-OE1 3.69Å; R133-E140 IonicContact CZ-OE2 2.8Å; R133-E140 IonicContact NH1-OE1 3.92Å; R133-E140 PolarHBondContact NH1-OE1 3.1Å; R133-E140 IonicContact NH1-OE2 2.72Å; R133-E140 IonicContact NH2-OE1 3.45Å; R133-E140 PolarHBondContact NH2-OE1 2.83Å; R133-E140 IonicContact NH2-OE2 3.16Å; R133-E140 PolarHBondContact NH2-OE2 2.72Å; R133-R164 PolarHBondContact NH2-O 3.4Å; R133-H168 HydrophobicContact CG-CB 4.27Å; R133-H168 PolarHBondContact NE-CD2 2.71Å; R133-H168 VanDerWaalsContact NE-CG 3.3Å; R133-H168 PolarHBondContact NH2-CD2 3.42Å; R133-H168 VanDerWaalsContact NH2-CD2 3.31Å; R133-H168 PolarHBondContact NH2-NE2 2.86Å
134	V	95.4	Very high	93.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.1	-50.9	173.3	176.7	0	0	0	0	110.4	F126 M129 D130 L131 E136 T137 F138 I165 L226 T230	F126-V134 HydrophobicContact CE1-CG2 3.91Å; F126-V134 HydrophobicContact CZ-CG2 4.39Å; M129-V134 HydrophobicContact CG-CG2 3.89Å; D130-V134 PolarHBondContact O-N 2.91Å; L131-V134 PolarHBondContact O-N 3.45Å; V134-E136 PolarHBondContact O-N 3.37Å; V134-T137 PolarHBondContact O-N 3.33Å; V134-F138 HydrophobicContact CG1-CD2 3.99Å; V134-F138 HydrophobicContact CG1-CE2 3.73Å; V134-F138 VanDerWaalsContact O-CD2 3.27Å; V134-F138 WeakPolarHBondContact O-CD2 3.4Å; V134-F138 PolarHBondContact O-N 3.02Å; V134-F138 VanDerWaalsContact O-N 3.1Å; V134-I165 HydrophobicContact CG1-CD1 4.49Å; V134-I165 HydrophobicContact CG2-CD1 4.5Å; V134-I165 HydrophobicContact CG2-CG2 4.35Å; V134-L226 HydrophobicContact CG1-CB 3.83Å; V134-T230 HydrophobicContact CB-CG2 4.41Å; V134-T230 HydrophobicContact CG2-CG2 3.64Å
135	V	95.2	Very high	93.3	Very high	46 Å²	46	50.9 Å²	50.9	28%	0.279	25%	0.245	S	C	.	.	H	α-helix	trans	-62.7	-41.9	-179.8	176	0	0	0	0	111.7	L131 W132 T137 F138 R139 Y240	L131-V135 HydrophobicContact CD1-CG2 4.03Å; L131-V135 HydrophobicContact CG-CG2 4.3Å; L131-V135 WeakPolarHBondContact O-CG2 3.39Å; L131-V135 PolarHBondContact O-N 2.83Å; W132-V135 PolarHBondContact O-N 2.83Å; V135-T137 VanDerWaalsContact C-N 3.34Å; V135-T137 PolarHBondContact O-N 2.76Å; V135-F138 PolarHBondContact O-N 3.47Å; V135-R139 PolarHBondContact O-N 2.63Å; V135-Y240 HydrophobicContact CB-CE2 4.42Å; V135-Y240 HydrophobicContact CG1-CD2 4.44Å; V135-Y240 HydrophobicContact CG1-CE2 4.09Å; V135-Y240 HydrophobicContact CG2-CD1 4.37Å; V135-Y240 HydrophobicContact CG2-CD2 3.59Å; V135-Y240 HydrophobicContact CG2-CE1 4.26Å; V135-Y240 HydrophobicContact CG2-CE2 3.48Å; V135-Y240 VanDerWaalsContact CG2-CE2 3.48Å; V135-Y240 HydrophobicContact CG2-CG 4.04Å
136	E	94.6	Very high	92.7	Very high	46 Å²	46	53.4 Å²	53.4	22%	0.215	26%	0.258	C	S	.	.	H	α-helix	trans	-63.1	-40.2	175.9	-173.7	55.6	-139.7	0	0	111.4	W132 V134 F138 R139 E140	W132-E136 HydrophobicContact CE3-CB 4.1Å; W132-E136 HydrophobicContact CZ3-CB 4.23Å; W132-E136 HydrophobicContact CZ3-CG 4.38Å; W132-E136 WeakPolarHBondContact O-CB 3.29Å; W132-E136 PolarHBondContact O-N 2.92Å; V134-E136 PolarHBondContact O-N 3.37Å; E136-F138 VanDerWaalsContact C-N 3.34Å; E136-F138 PolarHBondContact O-N 2.96Å; E136-R139 VanDerWaalsContact CD-NE 3.31Å; E136-R139 CarbonylContact O-C 3.47Å; E136-R139 WeakPolarHBondContact O-CA 3.27Å; E136-R139 VanDerWaalsContact O-CB 3.27Å; E136-R139 WeakPolarHBondContact O-CB 3.44Å; E136-R139 PolarHBondContact O-N 3.46Å; E136-R139 IonicContact OE1-CZ 2.61Å; E136-R139 IonicContact OE1-NE 3.99Å; E136-R139 PolarHBondContact OE1-NE 3.44Å; E136-R139 IonicContact OE1-NH2 2.69Å; E136-R139 PolarHBondContact OE1-NH2 3.17Å; E136-R139 IonicContact OE2-CZ 2.69Å; E136-R139 IonicContact OE2-NE 3.29Å; E136-R139 PolarHBondContact OE2-NE 3.41Å; E136-R139 IonicContact OE2-NH2 3.46Å; E136-R139 PolarHBondContact OE2-NH2 3.47Å; E136-E140 HydrophobicContact CG-CG 4.46Å; E136-E140 WeakPolarHBondContact O-CG 3.4Å; E136-E140 PolarHBondContact O-N 3.45Å
137	T	95.7	Very high	91.8	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-66.6	-35.9	177.4	-49.2	0	0	0	0	111.9	R133 V134 V135 R139 E140 F141 L161 R164 I165	R133-T137 VanDerWaalsContact CZ-OG1 3.28Å; R133-T137 PolarHBondContact NH2-OG1 2.59Å; R133-T137 WeakPolarHBondContact O-CB 3.37Å; R133-T137 PolarHBondContact O-N 3.37Å; R133-T137 PolarHBondContact O-OG1 3.14Å; V134-T137 PolarHBondContact O-N 3.33Å; V135-T137 VanDerWaalsContact C-N 3.34Å; V135-T137 PolarHBondContact O-N 2.76Å; T137-R139 PolarHBondContact O-N 2.95Å; T137-E140 PolarHBondContact O-N 3.03Å; T137-F141 HydrophobicContact CG2-CD2 4.02Å; T137-F141 HydrophobicContact CG2-CE2 3.98Å; T137-F141 WeakPolarHBondContact O-CD2 3.48Å; T137-F141 PolarHBondContact O-N 2.98Å; T137-F141 VanDerWaalsContact O-N 3.12Å; T137-L161 HydrophobicContact CG2-CD1 3.93Å; T137-R164 HydrophobicContact CG2-CB 3.87Å; T137-R164 HydrophobicContact CG2-CG 3.67Å; T137-I165 HydrophobicContact CG2-CG1 3.75Å
138	F	95.9	Very high	91	Very high	1 Å²	1	58.3 Å²	58.3	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-65.7	-25.4	168.7	-77.1	-71.6	0	0	0	113	V134 V135 E136 L143 H144 L161 L222 K223 L226	V134-F138 HydrophobicContact CG1-CD2 3.99Å; V134-F138 HydrophobicContact CG1-CE2 3.73Å; V134-F138 VanDerWaalsContact O-CD2 3.27Å; V134-F138 WeakPolarHBondContact O-CD2 3.4Å; V134-F138 PolarHBondContact O-N 3.02Å; V134-F138 VanDerWaalsContact O-N 3.1Å; V135-F138 PolarHBondContact O-N 3.47Å; E136-F138 VanDerWaalsContact C-N 3.34Å; E136-F138 PolarHBondContact O-N 2.96Å; F138-L143 HydrophobicContact CD1-CB 3.92Å; F138-L143 HydrophobicContact CD1-CD1 3.93Å; F138-L143 HydrophobicContact CE1-CD1 4.3Å; F138-L143 CarbonylContact O-C 3.6Å; F138-L143 PolarHBondContact O-N 3.02Å; F138-H144 PolarHBondContact O-N 2.95Å; F138-L161 HydrophobicContact CD1-CD2 4.3Å; F138-L161 HydrophobicContact CE1-CD2 3.71Å; F138-L161 HydrophobicContact CZ-CD2 4.01Å; F138-L222 HydrophobicContact CE1-CB 4.35Å; F138-L222 HydrophobicContact CZ-CB 4.05Å; F138-K223 HydrophobicContact CD1-CG 4.05Å; F138-K223 HydrophobicContact CD2-CG 4.16Å; F138-K223 HydrophobicContact CE1-CG 3.82Å; F138-K223 HydrophobicContact CE2-CB 4.45Å; F138-K223 HydrophobicContact CE2-CG 3.94Å; F138-K223 HydrophobicContact CG-CG 4.22Å; F138-K223 HydrophobicContact CZ-CB 4.35Å; F138-K223 HydrophobicContact CZ-CG 3.77Å; F138-L226 HydrophobicContact CE2-CD1 4.2Å; F138-L226 HydrophobicContact CZ-CD1 4.03Å
139	R	94.8	Very high	90.1	Very high	143 Å²	143	59.9 Å²	59.9	54%	0.54	30%	0.299	S	S	.	.	H	α-helix	trans	-75.1	-48	172.4	-166.6	177.6	72.4	156.3	1.2	111.6	V135 E136 T137 F141 G142 H144	V135-R139 PolarHBondContact O-N 2.63Å; E136-R139 VanDerWaalsContact CD-NE 3.31Å; E136-R139 CarbonylContact O-C 3.47Å; E136-R139 WeakPolarHBondContact O-CA 3.27Å; E136-R139 VanDerWaalsContact O-CB 3.27Å; E136-R139 WeakPolarHBondContact O-CB 3.44Å; E136-R139 PolarHBondContact O-N 3.46Å; E136-R139 IonicContact OE1-CZ 2.61Å; E136-R139 IonicContact OE1-NE 3.99Å; E136-R139 PolarHBondContact OE1-NE 3.44Å; E136-R139 IonicContact OE1-NH2 2.69Å; E136-R139 PolarHBondContact OE1-NH2 3.17Å; E136-R139 IonicContact OE2-CZ 2.69Å; E136-R139 IonicContact OE2-NE 3.29Å; E136-R139 PolarHBondContact OE2-NE 3.41Å; E136-R139 IonicContact OE2-NH2 3.46Å; E136-R139 PolarHBondContact OE2-NH2 3.47Å; T137-R139 PolarHBondContact O-N 2.95Å; R139-F141 VanDerWaalsContact C-N 3.26Å; R139-F141 PolarHBondContact O-N 3.08Å; R139-G142 PolarHBondContact O-N 2.88Å; R139-H144 HydrophobicContact CB-CB 4.4Å
140	E	94.2	Very high	89.4	Confident	73 Å²	73	66.5 Å²	66.5	34%	0.341	33%	0.33	S	S	.	.	H	α-helix	trans	-52.4	-41.3	175.3	-70.9	173.1	163.9	0	0	112	R133 E136 T137 G142 R164	R133-E140 IonicContact CZ-OE1 3.69Å; R133-E140 IonicContact CZ-OE2 2.8Å; R133-E140 IonicContact NH1-OE1 3.92Å; R133-E140 PolarHBondContact NH1-OE1 3.1Å; R133-E140 IonicContact NH1-OE2 2.72Å; R133-E140 IonicContact NH2-OE1 3.45Å; R133-E140 PolarHBondContact NH2-OE1 2.83Å; R133-E140 IonicContact NH2-OE2 3.16Å; R133-E140 PolarHBondContact NH2-OE2 2.72Å; E136-E140 HydrophobicContact CG-CG 4.46Å; E136-E140 WeakPolarHBondContact O-CG 3.4Å; E136-E140 PolarHBondContact O-N 3.45Å; T137-E140 PolarHBondContact O-N 3.03Å; E140-G142 VanDerWaalsContact C-N 3.32Å; E140-G142 PolarHBondContact O-N 3.4Å; E140-R164 IonicContact OE1-CZ 2.76Å; E140-R164 IonicContact OE1-NE 2.69Å; E140-R164 PolarHBondContact OE1-NE 2.99Å; E140-R164 IonicContact OE1-NH2 3.37Å; E140-R164 PolarHBondContact OE1-NH2 2.97Å; E140-R164 WeakPolarHBondContact OE2-CG 3.45Å; E140-R164 IonicContact OE2-CZ 2.72Å; E140-R164 IonicContact OE2-NE 3.18Å; E140-R164 PolarHBondContact OE2-NE 3.29Å; E140-R164 IonicContact OE2-NH2 2.83Å
141	F	94	Very high	89.4	Confident	76 Å²	76	63.3 Å²	63.3	33%	0.333	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	4.1	178	-81.3	-113.7	0	0	0	114.3	T137 R139 L143 R160 L161 R164	T137-F141 HydrophobicContact CG2-CD2 4.02Å; T137-F141 HydrophobicContact CG2-CE2 3.98Å; T137-F141 WeakPolarHBondContact O-CD2 3.48Å; T137-F141 PolarHBondContact O-N 2.98Å; T137-F141 VanDerWaalsContact O-N 3.12Å; R139-F141 VanDerWaalsContact C-N 3.26Å; R139-F141 PolarHBondContact O-N 3.08Å; F141-L143 HydrophobicContact CB-CD1 3.93Å; F141-L143 HydrophobicContact CB-CG 3.88Å; F141-L143 PolarHBondContact O-N 3.41Å; F141-L143 VanDerWaalsContact O-N 3.1Å; F141-R160 HydrophobicContact CE1-CB 4.36Å; F141-R160 HydrophobicContact CZ-CB 4.4Å; F141-L161 HydrophobicContact CB-CD1 4.1Å; F141-L161 HydrophobicContact CD1-CD1 3.98Å; F141-L161 HydrophobicContact CD2-CD1 3.7Å; F141-L161 HydrophobicContact CE1-CB 4.35Å; F141-L161 HydrophobicContact CE1-CD1 4.31Å; F141-L161 HydrophobicContact CE2-CD1 4.04Å; F141-L161 HydrophobicContact CG-CD1 3.66Å; F141-L161 HydrophobicContact CZ-CB 4.41Å; F141-L161 HydrophobicContact CZ-CD1 4.34Å; F141-R164 HydrophobicContact CE2-CB 3.81Å; F141-R164 HydrophobicContact CE2-CG 3.92Å; F141-R164 HydrophobicContact CZ-CB 4.28Å
142	G	93.4	Very high	89.3	Confident	42 Å²	42	64.6 Å²	64.6	43%	0.433	33%	0.325	S	S	.	.	S	Bend	trans	73.9	-9.9	-177.1	0	0	0	0	0	115.5	R139 E140 H144	R139-G142 PolarHBondContact O-N 2.88Å; E140-G142 VanDerWaalsContact C-N 3.32Å; E140-G142 PolarHBondContact O-N 3.4Å; G142-H144 VanDerWaalsContact C-N 3.26Å; G142-H144 PolarHBondContact O-N 3.29Å; G142-H144 PolarHBondContact O-ND1 3.12Å
143	L	93.3	Very high	89.3	Confident	16 Å²	16	58.5 Å²	58.5	8%	0.084	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-67.6	-17.3	-174.4	-56.9	176.5	0	0	0	114.7	F138 F141 Q145 L146 L153 L161 V219 K223	F138-L143 HydrophobicContact CD1-CB 3.92Å; F138-L143 HydrophobicContact CD1-CD1 3.93Å; F138-L143 HydrophobicContact CE1-CD1 4.3Å; F138-L143 CarbonylContact O-C 3.6Å; F138-L143 PolarHBondContact O-N 3.02Å; F141-L143 HydrophobicContact CB-CD1 3.93Å; F141-L143 HydrophobicContact CB-CG 3.88Å; F141-L143 PolarHBondContact O-N 3.41Å; F141-L143 VanDerWaalsContact O-N 3.1Å; L143-Q145 VanDerWaalsContact C-N 3.27Å; L143-Q145 PolarHBondContact O-N 2.91Å; L143-L146 HydrophobicContact CD2-CD1 3.88Å; L143-L146 PolarHBondContact O-N 3.28Å; L143-L153 HydrophobicContact CD1-CD1 3.89Å; L143-L153 HydrophobicContact CD1-CD2 4.37Å; L143-L153 HydrophobicContact CD2-CD2 4.24Å; L143-L161 HydrophobicContact CD1-CD1 4.1Å; L143-V219 HydrophobicContact CB-CG1 4.14Å; L143-V219 HydrophobicContact CD2-CG2 4.3Å; L143-K223 VanDerWaalsContact O-CE 3.3Å; L143-K223 WeakPolarHBondContact O-CE 3.2Å; L143-K223 PolarHBondContact O-NZ 3.23Å
144	H	87.8	Confident	89.3	Confident	75 Å²	75	61 Å²	61	35%	0.347	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-51.1	-40.7	-176.8	65.5	-65.3	0	0	0	113.9	F138 R139 G142 K223	F138-H144 PolarHBondContact O-N 2.95Å; R139-H144 HydrophobicContact CB-CB 4.4Å; G142-H144 VanDerWaalsContact C-N 3.26Å; G142-H144 PolarHBondContact O-N 3.29Å; G142-H144 PolarHBondContact O-ND1 3.12Å; H144-K223 PolarHBondContact O-NZ 2.81Å; H144-K223 VanDerWaalsContact O-NZ 3.12Å
145	Q	85	Confident	89.2	Confident	152 Å²	152	63.2 Å²	63.2	71%	0.71	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-81.5	-16.7	178.1	-71.7	170	52.1	0	0	114.2	L143 N147	L143-Q145 VanDerWaalsContact C-N 3.27Å; L143-Q145 PolarHBondContact O-N 2.91Å; Q145-N147 PolarHBondContact O-N 3.45Å
146	L	82	Confident	89.1	Confident	81 Å²	81	62.7 Å²	62.7	42%	0.424	33%	0.33	S	S	.	.			trans	-78	90.7	-178.9	-60.5	-176.9	0	0	0	110.9	L143 A151 V219 K223	L143-L146 HydrophobicContact CD2-CD1 3.88Å; L143-L146 PolarHBondContact O-N 3.28Å; L146-A151 HydrophobicContact CB-CB 4.14Å; L146-A151 HydrophobicContact CD1-CB 4.47Å; L146-V219 HydrophobicContact CB-CG1 4.41Å; L146-K223 PolarHBondContact O-NZ 3.45Å
147	N	75.4	Confident	89.1	Confident	52 Å²	52	61.6 Å²	61.6	28%	0.278	33%	0.328	S	S	.	.			trans	-108.2	14.5	173.7	-63.4	-16.2	0	0	0	112.1	Q145 K223	Q145-N147 PolarHBondContact O-N 3.45Å; N147-K223 PolarHBondContact OD1-NZ 2.95Å
148	D	75.8	Confident	89.1	Confident	89 Å²	89	61.6 Å²	61.6	48%	0.476	33%	0.328	S	S	.	.			trans	-70.2	127.2	171	176.6	-2.7	0	0	0	110.1	Q150 A151	D148-Q150 PolarHBondContact O-N 3.43Å; D148-Q150 VanDerWaalsContact O-N 3.16Å; D148-Q150 WeakPolarHBondContact OD1-CB 3.48Å; D148-Q150 PolarHBondContact OD1-N 3.38Å; D148-A151 HydrophobicContact CB-CB 4.34Å; D148-A151 WeakPolarHBondContact O-CB 3.18Å; D148-A151 PolarHBondContact O-N 3.32Å; D148-A151 VanDerWaalsContact O-N 3.08Å
149	P	72.9	Confident	89	Confident	98 Å²	98	65.2 Å²	65.2	64%	0.636	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-28.7	173.8	-27.6	36.1	0	0	0	115.1
150	Q	78.2	Confident	89	Confident	145 Å²	145	65 Å²	65	68%	0.678	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-16	-179.8	-56.2	-59.2	-25.8	0	0	113.4	D148 S152	D148-Q150 PolarHBondContact O-N 3.43Å; D148-Q150 VanDerWaalsContact O-N 3.16Å; D148-Q150 WeakPolarHBondContact OD1-CB 3.48Å; D148-Q150 PolarHBondContact OD1-N 3.38Å; Q150-S152 PolarHBondContact O-N 3.05Å; Q150-S152 VanDerWaalsContact O-N 3.14Å
151	A	91	Very high	89.1	Confident	16 Å²	16	61.5 Å²	61.5	13%	0.132	33%	0.326	C	S	.	.			trans	-66.3	114.6	179.5	0	0	0	0	0	110.2	L146 D148 V219	L146-A151 HydrophobicContact CB-CB 4.14Å; L146-A151 HydrophobicContact CD1-CB 4.47Å; D148-A151 HydrophobicContact CB-CB 4.34Å; D148-A151 WeakPolarHBondContact O-CB 3.18Å; D148-A151 PolarHBondContact O-N 3.32Å; D148-A151 VanDerWaalsContact O-N 3.08Å; A151-V219 HydrophobicContact CB-CB 4.19Å; A151-V219 HydrophobicContact CB-CG2 4.11Å; A151-V219 WeakPolarHBondContact O-CG2 3.45Å; A151-V219 PolarHBondContact O-N 2.88Å
152	S	93.6	Very high	89.1	Confident	45 Å²	45	57.9 Å²	57.9	32%	0.315	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	147	-174.3	57.3	0	0	0	0	113.3	Q150 R216 L217	Q150-S152 PolarHBondContact O-N 3.05Å; Q150-S152 VanDerWaalsContact O-N 3.14Å; S152-R216 PolarHBondContact OG-NH1 3.41Å; S152-R216 VanDerWaalsContact OG-NH1 3.09Å; S152-L217 CarbonylContact C-O 3.57Å; S152-L217 VanDerWaalsContact CA-O 3.25Å; S152-L217 WeakPolarHBondContact CA-O 3.16Å
153	L	94.3	Very high	89.1	Confident	23 Å²	23	58.1 Å²	58.1	12%	0.12	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	143.5	171.4	-61.6	-175.3	0	0	0	110	L143 L161 R216 L217 V219 L222	L143-L153 HydrophobicContact CD1-CD1 3.89Å; L143-L153 HydrophobicContact CD1-CD2 4.37Å; L143-L153 HydrophobicContact CD2-CD2 4.24Å; L153-L161 HydrophobicContact CD1-CD2 4.2Å; L153-R216 CarbonylContact O-C 3.59Å; L153-R216 VanDerWaalsContact O-CA 3.25Å; L153-R216 WeakPolarHBondContact O-CA 3.27Å; L153-L217 PolarHBondContact N-O 3.38Å; L153-L217 PolarHBondContact O-N 2.93Å; L153-V219 HydrophobicContact CD2-CG2 4.5Å; L153-V219 HydrophobicContact CG-CG2 4.13Å; L153-L222 HydrophobicContact CB-CD1 4.42Å; L153-L222 HydrophobicContact CD1-CD1 3.92Å; L153-L222 HydrophobicContact CG-CD1 4.36Å
154	D	93.8	Very high	89.1	Confident	62 Å²	62	62.1 Å²	62.1	33%	0.332	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	165.7	163.1	71.1	-57.7	0	0	0	110.9	G156 S157 T158	D154-G156 PolarHBondContact O-N 2.78Å; D154-G156 WeakPolarHBondContact OD2-CA 3.48Å; D154-G156 PolarHBondContact OD2-N 2.61Å; D154-S157 PolarHBondContact O-N 2.96Å; D154-S157 WeakPolarHBondContact OD1-CB 3.28Å; D154-S157 PolarHBondContact OD1-N 3Å; D154-S157 PolarHBondContact OD1-OG 3.18Å; D154-S157 PolarHBondContact OD2-N 2.9Å; D154-T158 WeakPolarHBondContact O-CB 3.43Å; D154-T158 PolarHBondContact O-N 3.41Å; D154-T158 PolarHBondContact O-OG1 2.9Å
155	Y	92.9	Very high	89.4	Confident	47 Å²	47	58.6 Å²	58.6	18%	0.184	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-30.5	175.7	-56.4	-29	0	0	0	112.9	N85 T158 F159 D210 L217	N85-Y155 WeakPolarHBondContact ND2-CD2 3.48Å; Y155-T158 PolarHBondContact O-N 3.29Å; Y155-F159 WeakPolarHBondContact O-CB 3.21Å; Y155-F159 PolarHBondContact O-N 3.02Å; Y155-D210 PolarHBondContact OH-OD2 3.35Å; Y155-L217 HydrophobicContact CD1-CD1 3.9Å; Y155-L217 HydrophobicContact CD1-CG 4.13Å; Y155-L217 HydrophobicContact CE1-CD1 4.19Å; Y155-L217 HydrophobicContact CE1-CD2 4.3Å; Y155-L217 HydrophobicContact CE1-CG 4.05Å
156	G	92.7	Very high	89.8	Confident	34 Å²	34	51.7 Å²	51.7	35%	0.351	27%	0.271	S	S	.	.	H	α-helix	trans	-72.1	-39.2	177.7	0	0	0	0	0	113.8	D154 R160	D154-G156 PolarHBondContact O-N 2.78Å; D154-G156 WeakPolarHBondContact OD2-CA 3.48Å; D154-G156 PolarHBondContact OD2-N 2.61Å; G156-R160 PolarHBondContact O-N 3.13Å; G156-R160 PolarHBondContact O-NE 2.98Å
157	S	94.7	Very high	90.1	Very high	23 Å²	23	51.4 Å²	51.4	16%	0.161	28%	0.276	C	S	.	.	H	α-helix	trans	-69.4	-36	168.9	-58.9	0	0	0	0	112.1	D154 R160 L161	D154-S157 PolarHBondContact O-N 2.96Å; D154-S157 WeakPolarHBondContact OD1-CB 3.28Å; D154-S157 PolarHBondContact OD1-N 3Å; D154-S157 PolarHBondContact OD1-OG 3.18Å; D154-S157 PolarHBondContact OD2-N 2.9Å; S157-R160 VanDerWaalsContact CA-NH2 3.32Å; S157-R160 PolarHBondContact O-N 3.31Å; S157-R160 PolarHBondContact OG-NH2 3.27Å; S157-L161 PolarHBondContact O-N 2.83Å
158	T	95.5	Very high	90.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.1	-44	175.7	-54	0	0	0	0	111.3	D154 Y155 R160 L161 L162 L202 L217 L222	D154-T158 WeakPolarHBondContact O-CB 3.43Å; D154-T158 PolarHBondContact O-N 3.41Å; D154-T158 PolarHBondContact O-OG1 2.9Å; Y155-T158 PolarHBondContact O-N 3.29Å; T158-R160 VanDerWaalsContact C-N 3.31Å; T158-R160 PolarHBondContact O-N 2.81Å; T158-L161 WeakPolarHBondContact O-CB 3.39Å; T158-L161 PolarHBondContact O-N 2.85Å; T158-L161 VanDerWaalsContact O-N 3.14Å; T158-L162 HydrophobicContact CG2-CD1 4.5Å; T158-L162 HydrophobicContact CG2-CG 4.43Å; T158-L162 WeakPolarHBondContact O-CG 3.38Å; T158-L162 PolarHBondContact O-N 2.94Å; T158-L202 HydrophobicContact CG2-CD1 3.73Å; T158-L217 HydrophobicContact CG2-CD1 3.77Å; T158-L222 HydrophobicContact CG2-CD1 4.39Å; T158-L222 HydrophobicContact CG2-CD2 4.05Å
159	F	94.2	Very high	90.3	Very high	77 Å²	77	49.8 Å²	49.8	34%	0.338	26%	0.264	S	S	.	.	H	α-helix	trans	-61.9	-37.5	175.8	-173.7	-103.6	0	0	0	112.6	Y155 S163 A198 L202	Y155-F159 WeakPolarHBondContact O-CB 3.21Å; Y155-F159 PolarHBondContact O-N 3.02Å; F159-S163 VanDerWaalsContact O-CB 3.28Å; F159-S163 WeakPolarHBondContact O-CB 3.43Å; F159-S163 PolarHBondContact O-N 3.46Å; F159-S163 PolarHBondContact O-OG 3.27Å; F159-A198 HydrophobicContact CE2-CB 4.3Å; F159-L202 HydrophobicContact CB-CD2 4.14Å; F159-L202 HydrophobicContact CD2-CD2 4.06Å; F159-L202 HydrophobicContact CG-CD2 4.5Å
160	R	94.3	Very high	89.8	Confident	138 Å²	138	48.3 Å²	48.3	52%	0.521	25%	0.254	S	S	.	.	H	α-helix	trans	-64.3	-42.4	172	-77.8	179.4	-79.5	125.8	-4.1	112.3	F141 G156 S157 T158 S163 R164	F141-R160 HydrophobicContact CE1-CB 4.36Å; F141-R160 HydrophobicContact CZ-CB 4.4Å; G156-R160 PolarHBondContact O-N 3.13Å; G156-R160 PolarHBondContact O-NE 2.98Å; S157-R160 VanDerWaalsContact CA-NH2 3.32Å; S157-R160 PolarHBondContact O-N 3.31Å; S157-R160 PolarHBondContact OG-NH2 3.27Å; T158-R160 VanDerWaalsContact C-N 3.31Å; T158-R160 PolarHBondContact O-N 2.81Å; R160-S163 PolarHBondContact O-N 2.93Å; R160-R164 PolarHBondContact O-N 2.86Å; R160-R164 VanDerWaalsContact O-N 3.11Å
161	L	95.6	Very high	88.7	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-50.6	174.8	-173.6	78.7	0	0	0	111.1	T137 F138 F141 L143 L153 S157 T158 S163 R164 I165	T137-L161 HydrophobicContact CG2-CD1 3.93Å; F138-L161 HydrophobicContact CD1-CD2 4.3Å; F138-L161 HydrophobicContact CE1-CD2 3.71Å; F138-L161 HydrophobicContact CZ-CD2 4.01Å; F141-L161 HydrophobicContact CB-CD1 4.1Å; F141-L161 HydrophobicContact CD1-CD1 3.98Å; F141-L161 HydrophobicContact CD2-CD1 3.7Å; F141-L161 HydrophobicContact CE1-CB 4.35Å; F141-L161 HydrophobicContact CE1-CD1 4.31Å; F141-L161 HydrophobicContact CE2-CD1 4.04Å; F141-L161 HydrophobicContact CG-CD1 3.66Å; F141-L161 HydrophobicContact CZ-CB 4.41Å; F141-L161 HydrophobicContact CZ-CD1 4.34Å; L143-L161 HydrophobicContact CD1-CD1 4.1Å; L153-L161 HydrophobicContact CD1-CD2 4.2Å; S157-L161 PolarHBondContact O-N 2.83Å; T158-L161 WeakPolarHBondContact O-CB 3.39Å; T158-L161 PolarHBondContact O-N 2.85Å; T158-L161 VanDerWaalsContact O-N 3.14Å; L161-S163 PolarHBondContact O-N 3.32Å; L161-R164 PolarHBondContact O-N 3.37Å; L161-I165 WeakPolarHBondContact O-CG1 3.44Å; L161-I165 PolarHBondContact O-N 3.48Å
162	L	95.2	Very high	86.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.6	-46.7	177.2	-67.1	-176.3	0	0	0	111.3	T158 R164 I165 Y166 L201 L202 L205 L226	T158-L162 HydrophobicContact CG2-CD1 4.5Å; T158-L162 HydrophobicContact CG2-CG 4.43Å; T158-L162 WeakPolarHBondContact O-CG 3.38Å; T158-L162 PolarHBondContact O-N 2.94Å; L162-R164 PolarHBondContact O-N 2.86Å; L162-I165 HydrophobicContact CD2-CD1 4.39Å; L162-I165 WeakPolarHBondContact O-CA 3.48Å; L162-I165 WeakPolarHBondContact O-CB 3.41Å; L162-I165 PolarHBondContact O-N 3.27Å; L162-Y166 HydrophobicContact CB-CD2 4.29Å; L162-Y166 HydrophobicContact CB-CE2 4.25Å; L162-Y166 WeakPolarHBondContact O-CD2 3.25Å; L162-Y166 PolarHBondContact O-N 2.96Å; L162-L201 HydrophobicContact CD1-CB 4.32Å; L162-L201 HydrophobicContact CD1-CD2 4.07Å; L162-L201 HydrophobicContact CD1-CG 3.98Å; L162-L201 HydrophobicContact CD2-CD2 3.59Å; L162-L201 HydrophobicContact CD2-CG 4.22Å; L162-L201 HydrophobicContact CG-CD2 4.42Å; L162-L202 HydrophobicContact CD1-CB 4.07Å; L162-L202 HydrophobicContact CD1-CD1 4.41Å; L162-L205 HydrophobicContact CD1-CD1 4.17Å; L162-L205 HydrophobicContact CD2-CD1 4.3Å; L162-L226 HydrophobicContact CD2-CD1 4.13Å; L162-L226 HydrophobicContact CD2-CD2 4.14Å
163	S	92.8	Very high	84.7	Confident	48 Å²	48	51.5 Å²	51.5	34%	0.336	28%	0.277	S	S	.	.	H	α-helix	trans	-55.3	-39.1	177.4	-63.1	0	0	0	0	112.2	F159 R160 L161 S167	F159-S163 VanDerWaalsContact O-CB 3.28Å; F159-S163 WeakPolarHBondContact O-CB 3.43Å; F159-S163 PolarHBondContact O-N 3.46Å; F159-S163 PolarHBondContact O-OG 3.27Å; R160-S163 PolarHBondContact O-N 2.93Å; L161-S163 PolarHBondContact O-N 3.32Å; S163-S167 WeakPolarHBondContact O-CB 3.45Å; S163-S167 PolarHBondContact O-N 3.26Å
164	R	94	Very high	82.7	Confident	100 Å²	100	52.9 Å²	52.9	38%	0.377	28%	0.283	S	S	.	.	H	α-helix	trans	-75.8	-26.5	176.4	-178.2	57.7	179.6	-176	1.9	113.7	R133 T137 E140 F141 R160 L161 L162 S167 H168	R133-R164 PolarHBondContact NH2-O 3.4Å; T137-R164 HydrophobicContact CG2-CB 3.87Å; T137-R164 HydrophobicContact CG2-CG 3.67Å; E140-R164 IonicContact OE1-CZ 2.76Å; E140-R164 IonicContact OE1-NE 2.69Å; E140-R164 PolarHBondContact OE1-NE 2.99Å; E140-R164 IonicContact OE1-NH2 3.37Å; E140-R164 PolarHBondContact OE1-NH2 2.97Å; E140-R164 WeakPolarHBondContact OE2-CG 3.45Å; E140-R164 IonicContact OE2-CZ 2.72Å; E140-R164 IonicContact OE2-NE 3.18Å; E140-R164 PolarHBondContact OE2-NE 3.29Å; E140-R164 IonicContact OE2-NH2 2.83Å; F141-R164 HydrophobicContact CE2-CB 3.81Å; F141-R164 HydrophobicContact CE2-CG 3.92Å; F141-R164 HydrophobicContact CZ-CB 4.28Å; R160-R164 PolarHBondContact O-N 2.86Å; R160-R164 VanDerWaalsContact O-N 3.11Å; L161-R164 PolarHBondContact O-N 3.37Å; L162-R164 PolarHBondContact O-N 2.86Å; R164-S167 PolarHBondContact O-OG 3.38Å; R164-H168 VanDerWaalsContact CZ-NE2 3.26Å; R164-H168 PolarHBondContact NH1-NE2 2.91Å; R164-H168 PolarHBondContact NH2-NE2 2.89Å
165	I	94.3	Very high	80.1	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-66.1	-53.1	167.9	-66.4	172.4	0	0	0	109	F126 M129 V134 T137 L161 L162 S167 L226	F126-I165 HydrophobicContact CZ-CG2 4.18Å; M129-I165 HydrophobicContact CE-CG2 3.58Å; M129-I165 HydrophobicContact CG-CG2 4.19Å; M129-I165 HydrophobicContact SD-CG2 3.49Å; M129-I165 WeakPolarHBondContact SD-CG2 3.5Å; V134-I165 HydrophobicContact CG1-CD1 4.49Å; V134-I165 HydrophobicContact CG2-CD1 4.5Å; V134-I165 HydrophobicContact CG2-CG2 4.35Å; T137-I165 HydrophobicContact CG2-CG1 3.75Å; L161-I165 WeakPolarHBondContact O-CG1 3.44Å; L161-I165 PolarHBondContact O-N 3.48Å; L162-I165 HydrophobicContact CD2-CD1 4.39Å; L162-I165 WeakPolarHBondContact O-CA 3.48Å; L162-I165 WeakPolarHBondContact O-CB 3.41Å; L162-I165 PolarHBondContact O-N 3.27Å; I165-S167 VanDerWaalsContact C-N 3.35Å; I165-S167 PolarHBondContact O-N 3.36Å; I165-L226 HydrophobicContact CD1-CD1 3.97Å
166	Y	93	Very high	77.9	Confident	8 Å²	8	57.8 Å²	57.8	3%	0.031	32%	0.316	C	S	.	.	H	α-helix	trans	-63.9	-31.6	-178	-76.5	-66.5	0	0	0	114.3	T124 L125 M129 L162 H168 I169 V194 A197 A198 L201	T124-Y166 WeakPolarHBondContact O-CE1 3.4Å; T124-Y166 PolarHBondContact O-OH 3.47Å; L125-Y166 HydrophobicContact CB-CE1 4.39Å; L125-Y166 HydrophobicContact CD1-CE1 4.41Å; M129-Y166 HydrophobicContact CE-CD1 4.2Å; M129-Y166 HydrophobicContact CE-CE1 4.33Å; L162-Y166 HydrophobicContact CB-CD2 4.29Å; L162-Y166 HydrophobicContact CB-CE2 4.25Å; L162-Y166 WeakPolarHBondContact O-CD2 3.25Å; L162-Y166 PolarHBondContact O-N 2.96Å; Y166-H168 PolarHBondContact O-N 2.93Å; Y166-I169 HydrophobicContact CD1-CD1 3.69Å; Y166-I169 HydrophobicContact CE1-CD1 4.27Å; Y166-I169 PolarHBondContact O-N 2.8Å; Y166-I169 VanDerWaalsContact O-N 3.07Å; Y166-V194 HydrophobicContact CD1-CG1 4.03Å; Y166-V194 HydrophobicContact CG-CG1 3.96Å; Y166-A197 HydrophobicContact CE1-CB 4.26Å; Y166-A197 PolarHBondContact OH-O 2.99Å; Y166-A198 HydrophobicContact CD2-CB 3.8Å; Y166-A198 HydrophobicContact CE2-CB 3.61Å; Y166-L201 HydrophobicContact CE2-CD2 4.14Å; Y166-L201 VanDerWaalsContact OH-CD2 3.29Å; Y166-L201 WeakPolarHBondContact OH-CD2 3.39Å
167	S	88.8	Confident	75.1	Confident	75 Å²	75	59.6 Å²	59.6	52%	0.524	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	2.6	-177	77.5	0	0	0	0	115.3	S163 R164 I165	S163-S167 WeakPolarHBondContact O-CB 3.45Å; S163-S167 PolarHBondContact O-N 3.26Å; R164-S167 PolarHBondContact O-OG 3.38Å; I165-S167 VanDerWaalsContact C-N 3.35Å; I165-S167 PolarHBondContact O-N 3.36Å
168	H	77.1	Confident	72.2	Confident	80 Å²	80	65 Å²	65	37%	0.37	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	6.1	176.4	-72.1	-112.9	0	0	0	113.3	R133 R164 Y166 P170	R133-H168 HydrophobicContact CG-CB 4.27Å; R133-H168 PolarHBondContact NE-CD2 2.71Å; R133-H168 VanDerWaalsContact NE-CG 3.3Å; R133-H168 PolarHBondContact NH2-CD2 3.42Å; R133-H168 VanDerWaalsContact NH2-CD2 3.31Å; R133-H168 PolarHBondContact NH2-NE2 2.86Å; R164-H168 VanDerWaalsContact CZ-NE2 3.26Å; R164-H168 PolarHBondContact NH1-NE2 2.91Å; R164-H168 PolarHBondContact NH2-NE2 2.89Å; Y166-H168 PolarHBondContact O-N 2.93Å; H168-P170 VanDerWaalsContact O-CD 3.3Å; H168-P170 WeakPolarHBondContact O-CD 3.47Å
169	I	76.9	Confident	69.3	Low	26 Å²	26	70.3 Å²	70.3	13%	0.133	39%	0.385	C	S	.	.	S	Bend	trans	-66.1	122.2	169.3	-65	-175.8	0	0	0	108.3	L125 I128 M129 Y166 T171 M174	L125-I169 HydrophobicContact CB-CD1 4.5Å; I128-I169 HydrophobicContact CD1-CD1 4.38Å; I128-I169 HydrophobicContact CD1-CG2 3.79Å; M129-I169 HydrophobicContact CE-CD1 3.74Å; M129-I169 HydrophobicContact CE-CG1 3.86Å; Y166-I169 HydrophobicContact CD1-CD1 3.69Å; Y166-I169 HydrophobicContact CE1-CD1 4.27Å; Y166-I169 PolarHBondContact O-N 2.8Å; Y166-I169 VanDerWaalsContact O-N 3.07Å; I169-T171 PolarHBondContact O-N 2.56Å; I169-M174 HydrophobicContact CG2-CE 4.25Å
170	P	62.4	Low	66.4	Low	67 Å²	67	72.5 Å²	72.5	44%	0.435	41%	0.405	S	S	.	.			trans	-65.3	126.1	176.1	-20	33.2	0	0	0	110.5	H168 T172 N173	H168-P170 VanDerWaalsContact O-CD 3.3Å; H168-P170 WeakPolarHBondContact O-CD 3.47Å; P170-T172 PolarHBondContact O-N 3.14Å; P170-N173 PolarHBondContact O-N 3.35Å; P170-N173 VanDerWaalsContact O-N 3.1Å
171	T	56.5	Low	63.5	Low	64 Å²	64	72.9 Å²	72.9	39%	0.393	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-61.2	-18.2	178.3	52.3	0	0	0	0	113	I169 N187	I169-T171 PolarHBondContact O-N 2.56Å; T171-N187 WeakPolarHBondContact CB-OD1 3.19Å; T171-N187 PolarHBondContact OG1-OD1 2.98Å
172	T	50.6	Low	60.6	Low	102 Å²	102	82.1 Å²	82.1	63%	0.626	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-73.2	-21	176.4	51.5	0	0	0	0	114.9	P170	P170-T172 PolarHBondContact O-N 3.14Å
173	N	49.5	Very low	58.1	Low	108 Å²	108	88.8 Å²	88.8	58%	0.578	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-91.8	-1.8	-172.7	-91.9	-12.3	0	0	0	114.8	P170	P170-N173 PolarHBondContact O-N 3.35Å; P170-N173 VanDerWaalsContact O-N 3.1Å
174	M	52.2	Low	55.6	Low	52 Å²	52	91.8 Å²	91.8	26%	0.256	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-93.5	-2.5	178.8	-70.8	-56.2	-160.5	0	0	114.4	L125 I128 I169 V176 N190	L125-M174 HydrophobicContact CB-CE 4.28Å; L125-M174 HydrophobicContact CD1-CE 3.64Å; L125-M174 HydrophobicContact CD2-CE 3.81Å; L125-M174 HydrophobicContact CG-CE 4.1Å; I128-M174 HydrophobicContact CD1-CE 3.5Å; I128-M174 HydrophobicContact CD1-SD 3.84Å; I169-M174 HydrophobicContact CG2-CE 4.25Å; M174-V176 PolarHBondContact O-N 2.86Å; M174-N190 WeakPolarHBondContact CB-OD1 3.34Å
175	N	39.7	Very low	52.9	Low	109 Å²	109	91 Å²	91	58%	0.583	53%	0.528	S	S	*	.			trans	-75.9	40.2	-172.7	-62.9	9.7	0	0	0	113.7	T177	N175-T177 VanDerWaalsContact C-N 3.28Å; N175-T177 PolarHBondContact O-N 3.08Å
176	V	45.7	Very low	50.5	Low	102 Å²	102	95.4 Å²	95.4	62%	0.618	56%	0.555	S	S	*	*	S	Bend	trans	-78.8	84.1	170	-178.2	0	0	0	0	108.5	M174 I571	M174-V176 PolarHBondContact O-N 2.86Å; V176-I571 HydrophobicContact CG1-CG2 4.2Å; V176-I571 VanDerWaalsContact O-CG2 3.31Å; V176-I571 WeakPolarHBondContact O-CG2 3.36Å
177	T	33.4	Very low	48.2	Very low	73 Å²	73	100 Å²	100	45%	0.448	58%	0.58	S	S	.	*			trans	66.4	100.6	168.5	-30	0	0	0	0	116.2	N175 I571	N175-T177 VanDerWaalsContact C-N 3.28Å; N175-T177 PolarHBondContact O-N 3.08Å; T177-I571 HydrophobicContact CG2-CD1 3.78Å; T177-I571 HydrophobicContact CG2-CG1 4.07Å; T177-I571 VanDerWaalsContact O-CD1 3.25Å; T177-I571 WeakPolarHBondContact O-CD1 3.34Å
178	T	34.9	Very low	46	Very low	135 Å²	135	99.3 Å²	99.3	83%	0.828	58%	0.578	S	S	*	*			trans	-129	122.3	132.3	15.2	0	0	0	0	106.6
179	T	33.5	Very low	44.7	Very low	112 Å²	112	101.5 Å²	101.5	69%	0.687	59%	0.592	S	S	*	*			trans	-82.3	138.7	170.8	46.7	0	0	0	0	108.7
180	T	33.4	Very low	44.2	Very low	124 Å²	124	101.8 Å²	101.8	76%	0.761	59%	0.593	S	S	*	*	S	Bend	trans	53.4	104.7	170.5	54.9	0	0	0	0	114
181	D	34.6	Very low	44.9	Very low	146 Å²	146	107.6 Å²	107.6	78%	0.781	61%	0.607	S	S	*	*			cis	-148.3	151.8	45.3	-68.4	-43.1	0	0	0	114.5
182	E	34.7	Very low	46.2	Very low	194 Å²	194	108 Å²	108	91%	0.907	61%	0.611	S	S	*	*			trans	-86.3	109.2	172.2	-64.5	-168.2	141.7	0	0	111.3
183	T	43.1	Very low	47.9	Very low	140 Å²	140	105.5 Å²	105.5	86%	0.859	60%	0.6	S	S	*	*			trans	-174.6	-28.4	156.8	10.7	0	0	0	0	113.8
184	T	38.6	Very low	49.9	Very low	110 Å²	110	102.1 Å²	102.1	68%	0.675	58%	0.583	S	S	*	*	S	Bend	trans	-88.8	145.1	-173.4	-59.8	0	0	0	0	113	T186	T184-T186 PolarHBondContact O-N 2.8Å; T184-T186 VanDerWaalsContact O-N 3.15Å
185	S	38	Very low	51.6	Low	84 Å²	84	103.3 Å²	103.3	59%	0.587	59%	0.59	S	S	*	*			trans	-65.1	107.6	-169	52.7	0	0	0	0	114.8	N187 A188	S185-N187 PolarHBondContact O-N 3.21Å; S185-A188 PolarHBondContact O-N 3.45Å; S185-A188 VanDerWaalsContact O-N 3.13Å
186	T	43.6	Very low	54	Low	93 Å²	93	100.2 Å²	100.2	57%	0.571	57%	0.573	S	S	*	*	H	α-helix	trans	-58	-17.4	-172.8	50.3	0	0	0	0	116.4	T184 N190	T184-T186 PolarHBondContact O-N 2.8Å; T184-T186 VanDerWaalsContact O-N 3.15Å; T186-N190 PolarHBondContact O-ND2 3.26Å
187	N	45.3	Very low	56.2	Low	105 Å²	105	95.4 Å²	95.4	56%	0.561	54%	0.544	S	S	*	.	H	α-helix	trans	-80.4	-18.8	178.4	-72.4	-42	0	0	0	114	T171 S185	T171-N187 WeakPolarHBondContact CB-OD1 3.19Å; T171-N187 PolarHBondContact OG1-OD1 2.98Å; S185-N187 PolarHBondContact O-N 3.21Å
188	A	43.4	Very low	59.1	Low	59 Å²	59	92.1 Å²	92.1	49%	0.488	52%	0.524	S	S	.	.	H	α-helix	trans	-77.6	-46.8	-176	0	0	0	0	0	112.9	S185 N190 R191	S185-A188 PolarHBondContact O-N 3.45Å; S185-A188 VanDerWaalsContact O-N 3.13Å; A188-N190 VanDerWaalsContact C-N 3.25Å; A188-N190 PolarHBondContact O-N 3.32Å; A188-R191 PolarHBondContact O-N 3.26Å
189	I	48.6	Very low	61.7	Low	127 Å²	127	88 Å²	88	65%	0.651	50%	0.496	S	S	*	.	H	α-helix	trans	-64.5	-28	-169.9	-60.1	170.3	0	0	0	112.4	R191 P192	I189-R191 PolarHBondContact O-N 3.28Å; I189-P192 WeakPolarHBondContact O-CD 3.46Å
190	N	66.1	Low	64.7	Low	32 Å²	32	82.8 Å²	82.8	17%	0.171	46%	0.463	C	S	.	.	H	α-helix	trans	-76.3	-18.8	-179.4	-75.4	-60.7	0	0	0	114.2	M174 T186 A188 V194	M174-N190 WeakPolarHBondContact CB-OD1 3.34Å; T186-N190 PolarHBondContact O-ND2 3.26Å; A188-N190 VanDerWaalsContact C-N 3.25Å; A188-N190 PolarHBondContact O-N 3.32Å; N190-V194 PolarHBondContact O-N 2.95Å
191	R	77.6	Confident	67.7	Low	188 Å²	188	76.9 Å²	76.9	71%	0.709	43%	0.427	S	S	*	.	H	α-helix	trans	-70.8	-42.9	-173.3	-169.8	176.8	-178.6	-179.2	0.1	114	A188 I189 A193 V194 I195	A188-R191 PolarHBondContact O-N 3.26Å; I189-R191 PolarHBondContact O-N 3.28Å; R191-A193 PolarHBondContact O-N 3.47Å; R191-V194 PolarHBondContact O-N 3.47Å; R191-I195 HydrophobicContact CG-CD1 4.19Å; R191-I195 WeakPolarHBondContact O-CG1 3.44Å; R191-I195 PolarHBondContact O-N 2.88Å; R191-I195 VanDerWaalsContact O-N 3.17Å
192	P	84.6	Confident	70.5	Confident	74 Å²	74	70 Å²	70	48%	0.481	39%	0.39	S	S	.	.	H	α-helix	trans	-59	-42.4	175.3	-25.9	35.8	0	0	0	113.4	I189 V194 I195 I196	I189-P192 WeakPolarHBondContact O-CD 3.46Å; P192-V194 VanDerWaalsContact C-N 3.32Å; P192-V194 PolarHBondContact O-N 3.5Å; P192-I195 PolarHBondContact O-N 3.21Å; P192-I196 WeakPolarHBondContact O-CG1 3.49Å; P192-I196 PolarHBondContact O-N 3.4Å
193	A	86.2	Confident	73.3	Confident	48 Å²	48	60.9 Å²	60.9	40%	0.397	35%	0.349	S	S	.	.	H	α-helix	trans	-60.3	-40.4	179.1	0	0	0	0	0	112.3	R191 A197	R191-A193 PolarHBondContact O-N 3.47Å; A193-A197 VanDerWaalsContact O-CB 3.29Å; A193-A197 WeakPolarHBondContact O-CB 3.47Å; A193-A197 PolarHBondContact O-N 2.97Å
194	V	89.9	Confident	75.8	Confident	37 Å²	37	54.3 Å²	54.3	22%	0.224	31%	0.308	C	S	.	.	H	α-helix	trans	-67	-39.3	175.9	171.2	0	0	0	0	112.3	L125 Y166 N190 R191 P192 A197 A198	L125-V194 HydrophobicContact CD1-CG2 4.15Å; Y166-V194 HydrophobicContact CD1-CG1 4.03Å; Y166-V194 HydrophobicContact CG-CG1 3.96Å; N190-V194 PolarHBondContact O-N 2.95Å; R191-V194 PolarHBondContact O-N 3.47Å; P192-V194 VanDerWaalsContact C-N 3.32Å; P192-V194 PolarHBondContact O-N 3.5Å; V194-A197 PolarHBondContact O-N 2.91Å; V194-A198 WeakPolarHBondContact O-CB 3.36Å; V194-A198 PolarHBondContact O-N 3.37Å
195	I	88.5	Confident	78.6	Confident	78 Å²	78	49 Å²	49	40%	0.4	28%	0.276	S	S	.	.	H	α-helix	trans	-63.6	-50.2	176.1	-66.7	165.3	0	0	0	110.1	R191 P192 A197 A198 E199	R191-I195 HydrophobicContact CG-CD1 4.19Å; R191-I195 WeakPolarHBondContact O-CG1 3.44Å; R191-I195 PolarHBondContact O-N 2.88Å; R191-I195 VanDerWaalsContact O-N 3.17Å; P192-I195 PolarHBondContact O-N 3.21Å; I195-A197 VanDerWaalsContact C-N 3.31Å; I195-A197 PolarHBondContact O-N 3.35Å; I195-A198 PolarHBondContact O-N 3.38Å; I195-A198 VanDerWaalsContact O-N 3.11Å; I195-E199 WeakPolarHBondContact O-CG 3.45Å; I195-E199 PolarHBondContact O-N 3.39Å
196	I	89.8	Confident	81.2	Confident	43 Å²	43	45.5 Å²	45.5	22%	0.221	25%	0.252	C	S	.	.	H	α-helix	trans	-58.7	-42.5	178	-69	162.7	0	0	0	111.1	P192 A198 E199 I200	P192-I196 WeakPolarHBondContact O-CG1 3.49Å; P192-I196 PolarHBondContact O-N 3.4Å; I196-A198 PolarHBondContact O-N 2.95Å; I196-E199 PolarHBondContact O-N 3.28Å; I196-I200 HydrophobicContact CG2-CD1 3.75Å; I196-I200 HydrophobicContact CG2-CG1 4.45Å; I196-I200 WeakPolarHBondContact O-CB 3.26Å; I196-I200 VanDerWaalsContact O-CG1 3.29Å; I196-I200 WeakPolarHBondContact O-CG1 3.39Å; I196-I200 PolarHBondContact O-N 2.92Å
197	A	93.2	Very high	83.4	Confident	1 Å²	1	44 Å²	44	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-62.8	-40.2	176.4	0	0	0	0	0	112.5	L125 Y166 A193 V194 I195 L201	L125-A197 HydrophobicContact CD1-CB 3.56Å; L125-A197 HydrophobicContact CG-CB 3.67Å; Y166-A197 HydrophobicContact CE1-CB 4.26Å; Y166-A197 PolarHBondContact OH-O 2.99Å; A193-A197 VanDerWaalsContact O-CB 3.29Å; A193-A197 WeakPolarHBondContact O-CB 3.47Å; A193-A197 PolarHBondContact O-N 2.97Å; V194-A197 PolarHBondContact O-N 2.91Å; I195-A197 VanDerWaalsContact C-N 3.31Å; I195-A197 PolarHBondContact O-N 3.35Å; A197-L201 VanDerWaalsContact O-CB 3.22Å; A197-L201 WeakPolarHBondContact O-CB 3.32Å; A197-L201 PolarHBondContact O-N 3.1Å
198	A	92.7	Very high	85.7	Confident	5 Å²	5	39 Å²	39	4%	0.041	21%	0.21	C	C	.	.	H	α-helix	trans	-69.2	-37.7	177.1	0	0	0	0	0	112.9	F159 Y166 V194 I195 I196 L202	F159-A198 HydrophobicContact CE2-CB 4.3Å; Y166-A198 HydrophobicContact CD2-CB 3.8Å; Y166-A198 HydrophobicContact CE2-CB 3.61Å; V194-A198 WeakPolarHBondContact O-CB 3.36Å; V194-A198 PolarHBondContact O-N 3.37Å; I195-A198 PolarHBondContact O-N 3.38Å; I195-A198 VanDerWaalsContact O-N 3.11Å; I196-A198 PolarHBondContact O-N 2.95Å; A198-L202 WeakPolarHBondContact O-CB 3.28Å; A198-L202 PolarHBondContact O-N 2.79Å
199	E	91.2	Very high	88	Confident	49 Å²	49	36.8 Å²	36.8	23%	0.229	19%	0.19	C	C	.	.	H	α-helix	trans	-64.7	-49.6	173	-71.1	174.7	168.3	0	0	111.7	I195 I196 L201 L202 G203	I195-E199 WeakPolarHBondContact O-CG 3.45Å; I195-E199 PolarHBondContact O-N 3.39Å; I196-E199 PolarHBondContact O-N 3.28Å; E199-L201 VanDerWaalsContact C-N 3.31Å; E199-L201 PolarHBondContact O-N 3.33Å; E199-L202 PolarHBondContact O-N 3.4Å; E199-G203 PolarHBondContact O-N 3.34Å
200	I	94.7	Very high	89.9	Confident	1 Å²	1	31.3 Å²	31.3	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-56.7	-46.5	175.5	-74	171.2	0	0	0	110.4	R93 L94 T124 I196 G203 W204	R93-I200 HydrophobicContact CG-CD1 4.3Å; L94-I200 HydrophobicContact CB-CG2 4.15Å; L94-I200 HydrophobicContact CD1-CG2 4.18Å; L94-I200 HydrophobicContact CD2-CG2 4.41Å; L94-I200 HydrophobicContact CG-CG2 4.47Å; T124-I200 HydrophobicContact CG2-CG2 3.9Å; I196-I200 HydrophobicContact CG2-CD1 3.75Å; I196-I200 HydrophobicContact CG2-CG1 4.45Å; I196-I200 WeakPolarHBondContact O-CB 3.26Å; I196-I200 VanDerWaalsContact O-CG1 3.29Å; I196-I200 WeakPolarHBondContact O-CG1 3.39Å; I196-I200 PolarHBondContact O-N 2.92Å; I200-G203 PolarHBondContact O-N 3.36Å; I200-W204 WeakPolarHBondContact O-CB 3.44Å; I200-W204 PolarHBondContact O-N 3.19Å
201	L	96.2	Very high	90.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.3	-47.9	179.6	-179	56.8	0	0	0	111.9	T124 F126 L162 Y166 A197 E199 G203 W204 L205 L226 L229	T124-L201 HydrophobicContact CG2-CB 3.7Å; T124-L201 HydrophobicContact CG2-CD1 3.97Å; T124-L201 HydrophobicContact CG2-CG 4.34Å; F126-L201 HydrophobicContact CD2-CD2 3.94Å; F126-L201 HydrophobicContact CE2-CD2 3.34Å; F126-L201 HydrophobicContact CZ-CD2 3.96Å; L162-L201 HydrophobicContact CD1-CB 4.32Å; L162-L201 HydrophobicContact CD1-CD2 4.07Å; L162-L201 HydrophobicContact CD1-CG 3.98Å; L162-L201 HydrophobicContact CD2-CD2 3.59Å; L162-L201 HydrophobicContact CD2-CG 4.22Å; L162-L201 HydrophobicContact CG-CD2 4.42Å; Y166-L201 HydrophobicContact CE2-CD2 4.14Å; Y166-L201 VanDerWaalsContact OH-CD2 3.29Å; Y166-L201 WeakPolarHBondContact OH-CD2 3.39Å; A197-L201 VanDerWaalsContact O-CB 3.22Å; A197-L201 WeakPolarHBondContact O-CB 3.32Å; A197-L201 PolarHBondContact O-N 3.1Å; E199-L201 VanDerWaalsContact C-N 3.31Å; E199-L201 PolarHBondContact O-N 3.33Å; L201-G203 VanDerWaalsContact C-N 3.29Å; L201-G203 PolarHBondContact O-N 3.22Å; L201-W204 HydrophobicContact CD1-CE3 4.12Å; L201-W204 HydrophobicContact CD1-CZ3 4.4Å; L201-W204 PolarHBondContact O-N 2.69Å; L201-L205 HydrophobicContact CD1-CD1 3.89Å; L201-L205 HydrophobicContact CD1-CD2 4.42Å; L201-L205 HydrophobicContact CD1-CG 3.89Å; L201-L205 HydrophobicContact CG-CD1 3.81Å; L201-L205 HydrophobicContact CG-CG 4.28Å; L201-L205 WeakPolarHBondContact O-CB 3.3Å; L201-L205 WeakPolarHBondContact O-CG 3.42Å; L201-L205 PolarHBondContact O-N 3.45Å; L201-L226 HydrophobicContact CD1-CD2 4.23Å; L201-L226 HydrophobicContact CD2-CD2 4.06Å; L201-L229 HydrophobicContact CD1-CD1 4.42Å
202	L	95.4	Very high	90.8	Very high	2 Å²	2	31 Å²	31	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-59.5	-42.1	177.6	-177.2	69.2	0	0	0	111.3	P86 A87 T158 F159 L162 A198 E199 G206	P86-L202 HydrophobicContact CG-CD2 4.47Å; A87-L202 HydrophobicContact CB-CD2 4.28Å; A87-L202 HydrophobicContact CB-CG 4.11Å; T158-L202 HydrophobicContact CG2-CD1 3.73Å; F159-L202 HydrophobicContact CB-CD2 4.14Å; F159-L202 HydrophobicContact CD2-CD2 4.06Å; F159-L202 HydrophobicContact CG-CD2 4.5Å; L162-L202 HydrophobicContact CD1-CB 4.07Å; L162-L202 HydrophobicContact CD1-CD1 4.41Å; A198-L202 WeakPolarHBondContact O-CB 3.28Å; A198-L202 PolarHBondContact O-N 2.79Å; E199-L202 PolarHBondContact O-N 3.4Å; L202-G206 PolarHBondContact O-N 2.9Å
203	G	93.1	Very high	90.7	Very high	3 Å²	3	31.5 Å²	31.5	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-62.6	-48	177.7	0	0	0	0	0	113.6	A87 E199 I200 L201 G206 Y207	A87-G203 WeakPolarHBondContact O-CA 3.4Å; E199-G203 PolarHBondContact O-N 3.34Å; I200-G203 PolarHBondContact O-N 3.36Å; L201-G203 VanDerWaalsContact C-N 3.29Å; L201-G203 PolarHBondContact O-N 3.22Å; G203-G206 PolarHBondContact O-N 3.46Å; G203-Y207 PolarHBondContact O-N 2.93Å
204	W	95.5	Very high	90.7	Very high	1 Å²	1	33.5 Å²	33.5	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-69.2	-36.1	177.7	176.7	71.8	0	0	0	112.8	F91 L94 L117 I120 I200 L201 G206 Y207 A208 T225 L229 L267 S270	F91-W204 HydrophobicContact CD2-CB 4.45Å; L94-W204 HydrophobicContact CD2-CB 3.73Å; L94-W204 HydrophobicContact CD2-CG 3.88Å; L117-W204 HydrophobicContact CD2-CH2 4.46Å; L117-W204 HydrophobicContact CD2-CZ2 3.86Å; I120-W204 HydrophobicContact CD1-CZ2 4.29Å; I120-W204 HydrophobicContact CG2-CD2 3.92Å; I120-W204 HydrophobicContact CG2-CE3 3.98Å; I120-W204 HydrophobicContact CG2-CG 4.46Å; I120-W204 HydrophobicContact CG2-CH2 4.29Å; I120-W204 HydrophobicContact CG2-CZ2 4.27Å; I120-W204 HydrophobicContact CG2-CZ3 4.18Å; I200-W204 WeakPolarHBondContact O-CB 3.44Å; I200-W204 PolarHBondContact O-N 3.19Å; L201-W204 HydrophobicContact CD1-CE3 4.12Å; L201-W204 HydrophobicContact CD1-CZ3 4.4Å; L201-W204 PolarHBondContact O-N 2.69Å; W204-G206 VanDerWaalsContact C-N 3.34Å; W204-Y207 PolarHBondContact O-N 3.43Å; W204-A208 WeakPolarHBondContact O-CB 3.45Å; W204-A208 PolarHBondContact O-N 2.8Å; W204-T225 HydrophobicContact CH2-CG2 3.76Å; W204-T225 HydrophobicContact CZ3-CG2 3.55Å; W204-L229 HydrophobicContact CE3-CD1 4.46Å; W204-L229 HydrophobicContact CH2-CD1 3.94Å; W204-L229 HydrophobicContact CH2-CG 4.43Å; W204-L229 HydrophobicContact CZ3-CD1 3.52Å; W204-L229 HydrophobicContact CZ3-CG 4.43Å; W204-L267 HydrophobicContact CH2-CD2 3.82Å; W204-L267 HydrophobicContact CZ2-CD2 4.13Å; W204-S270 WeakPolarHBondContact CZ2-OG 3.47Å; W204-S270 PolarHBondContact NE1-OG 2.89Å
205	L	96	Very high	90.5	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.4	-40.9	171.6	-72.3	170.1	0	0	0	111.9	L162 L201 A208 L209 L217 L222 T225 L226	L162-L205 HydrophobicContact CD1-CD1 4.17Å; L162-L205 HydrophobicContact CD2-CD1 4.3Å; L201-L205 HydrophobicContact CD1-CD1 3.89Å; L201-L205 HydrophobicContact CD1-CD2 4.42Å; L201-L205 HydrophobicContact CD1-CG 3.89Å; L201-L205 HydrophobicContact CG-CD1 3.81Å; L201-L205 HydrophobicContact CG-CG 4.28Å; L201-L205 WeakPolarHBondContact O-CB 3.3Å; L201-L205 WeakPolarHBondContact O-CG 3.42Å; L201-L205 PolarHBondContact O-N 3.45Å; L205-A208 PolarHBondContact O-N 2.72Å; L205-L209 HydrophobicContact CD2-CD1 3.99Å; L205-L209 WeakPolarHBondContact O-CB 3.5Å; L205-L209 PolarHBondContact O-N 3.43Å; L205-L217 HydrophobicContact CB-CD1 4.38Å; L205-L217 WeakPolarHBondContact O-CD2 3.28Å; L205-L222 HydrophobicContact CD1-CD2 3.98Å; L205-L222 HydrophobicContact CD2-CD2 4.24Å; L205-T225 HydrophobicContact CD2-CG2 3.54Å; L205-L226 HydrophobicContact CD1-CD2 4.11Å; L205-L226 HydrophobicContact CD2-CD2 4.41Å
206	G	92.7	Very high	90.7	Very high	9 Å²	9	35.6 Å²	35.6	9%	0.093	21%	0.206	C	C	.	.	H	α-helix	trans	-53.1	-55.5	170.2	0	0	0	0	0	111.4	L202 G203 W204 A208 D210	L202-G206 PolarHBondContact O-N 2.9Å; G203-G206 PolarHBondContact O-N 3.46Å; W204-G206 VanDerWaalsContact C-N 3.34Å; G206-A208 PolarHBondContact O-N 3.48Å; G206-D210 WeakPolarHBondContact O-CB 3.31Å; G206-D210 PolarHBondContact O-N 2.85Å; G206-D210 VanDerWaalsContact O-N 3.11Å
207	Y	90.9	Very high	90.8	Very high	61 Å²	61	33.6 Å²	33.6	24%	0.239	20%	0.195	C	C	.	.	H	α-helix	trans	-63.6	-39.6	179.5	-177.9	-113.5	0	0	0	114	F91 G203 W204 S270 F272	F91-Y207 HydrophobicContact CD1-CG 4.43Å; F91-Y207 HydrophobicContact CD2-CG 4.39Å; F91-Y207 HydrophobicContact CE1-CD1 4.11Å; F91-Y207 AromaticContact CE1-CD2 3.81Å; F91-Y207 HydrophobicContact CE1-CD2 3.81Å; F91-Y207 HydrophobicContact CE1-CE2 4.33Å; F91-Y207 AromaticContact CE1-CG 3.7Å; F91-Y207 HydrophobicContact CE1-CG 3.7Å; F91-Y207 AromaticContact CE2-CD1 3.48Å; F91-Y207 HydrophobicContact CE2-CD1 3.48Å; F91-Y207 VanDerWaalsContact CE2-CD1 3.48Å; F91-Y207 HydrophobicContact CE2-CE1 4.24Å; F91-Y207 AromaticContact CE2-CG 3.67Å; F91-Y207 HydrophobicContact CE2-CG 3.67Å; F91-Y207 AromaticContact CZ-CD1 3.22Å; F91-Y207 HydrophobicContact CZ-CD1 3.22Å; F91-Y207 AromaticContact CZ-CD2 3.76Å; F91-Y207 HydrophobicContact CZ-CD2 3.76Å; F91-Y207 AromaticContact CZ-CE1 3.68Å; F91-Y207 HydrophobicContact CZ-CE1 3.68Å; F91-Y207 HydrophobicContact CZ-CE2 4.19Å; F91-Y207 AromaticContact CZ-CG 3.27Å; F91-Y207 HydrophobicContact CZ-CG 3.27Å; G203-Y207 PolarHBondContact O-N 2.93Å; W204-Y207 PolarHBondContact O-N 3.43Å; Y207-S270 WeakPolarHBondContact CE1-O 3.42Å; Y207-F272 HydrophobicContact CE1-CE1 4.4Å; Y207-F272 HydrophobicContact CE1-CZ 4.28Å; Y207-F272 VanDerWaalsContact OH-CE1 3.25Å; Y207-F272 WeakPolarHBondContact OH-CE1 3.45Å
208	A	93	Very high	90.8	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.008	20%	0.203	C	C	.	.	H	α-helix	trans	-77	-40.8	-174.4	0	0	0	0	0	113.4	W204 L205 G206 K266 S270	W204-A208 WeakPolarHBondContact O-CB 3.45Å; W204-A208 PolarHBondContact O-N 2.8Å; L205-A208 PolarHBondContact O-N 2.72Å; G206-A208 PolarHBondContact O-N 3.48Å; A208-K266 WeakPolarHBondContact O-CB 3.31Å; A208-S270 VanDerWaalsContact CB-CB 3.48Å
209	L	92.3	Very high	90.9	Very high	12 Å²	12	34.6 Å²	34.6	6%	0.063	20%	0.202	C	C	.	.	H	α-helix	trans	-105.7	-28.5	-169	-61.3	177.3	0	0	0	113.8	L205 L211 L217 L222 K266	L205-L209 HydrophobicContact CD2-CD1 3.99Å; L205-L209 WeakPolarHBondContact O-CB 3.5Å; L205-L209 PolarHBondContact O-N 3.43Å; L209-L211 PolarHBondContact O-N 2.94Å; L209-L217 HydrophobicContact CB-CD2 3.74Å; L209-L222 HydrophobicContact CD1-CD2 4.11Å; L209-L222 HydrophobicContact CD1-CG 4.3Å; L209-K266 HydrophobicContact CD2-CB 4.42Å; L209-K266 HydrophobicContact CD2-CD 3.88Å
210	D	89	Confident	91	Very high	13 Å²	13	33.3 Å²	33.3	7%	0.07	20%	0.198	C	C	.	.			trans	-100.4	55.9	-179.5	-169.2	15.6	0	0	0	111.5	Y155 G206 C212 A213 T214 G215 R216 L217	Y155-D210 PolarHBondContact OH-OD2 3.35Å; G206-D210 WeakPolarHBondContact O-CB 3.31Å; G206-D210 PolarHBondContact O-N 2.85Å; G206-D210 VanDerWaalsContact O-N 3.11Å; D210-C212 PolarHBondContact O-N 2.84Å; D210-A213 PolarHBondContact O-N 3.33Å; D210-A213 PolarHBondContact OD1-N 2.91Å; D210-T214 VanDerWaalsContact CG-N 3.3Å; D210-T214 WeakPolarHBondContact OD1-CB 3.43Å; D210-T214 PolarHBondContact OD1-N 3.04Å; D210-T214 PolarHBondContact OD1-OG1 2.87Å; D210-T214 PolarHBondContact OD2-N 3.13Å; D210-T214 VanDerWaalsContact OD2-N 3.13Å; D210-G215 WeakPolarHBondContact OD2-CA 3.22Å; D210-G215 PolarHBondContact OD2-N 3.24Å; D210-R216 WeakPolarHBondContact CB-O 3.32Å; D210-R216 PolarHBondContact OD2-N 2.84Å; D210-L217 HydrophobicContact CB-CD2 3.82Å
211	L	82.8	Confident	90.9	Very high	104 Å²	104	33.2 Å²	33.2	55%	0.545	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-19.5	-177.8	-63	174.5	0	0	0	113.7	L209 K266	L209-L211 PolarHBondContact O-N 2.94Å; L211-K266 HydrophobicContact CD1-CD 4.5Å; L211-K266 HydrophobicContact CD1-CG 4.38Å
212	C	79.6	Confident	90.9	Very high	110 Å²	110	33.2 Å²	33.2	74%	0.743	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.2	6.2	176.7	-61.2	0	0	0	0	113.6	D210 T214	D210-C212 PolarHBondContact O-N 2.84Å; C212-T214 VanDerWaalsContact C-N 3.26Å; C212-T214 HydrophobicContact CB-CG2 3.89Å; C212-T214 PolarHBondContact O-N 3.07Å
213	A	81	Confident	91	Very high	84 Å²	84	33.1 Å²	33.1	69%	0.694	20%	0.197	S	C	*	.			trans	51.8	39.7	179.9	0	0	0	0	0	114.3	D210 G215	D210-A213 PolarHBondContact O-N 3.33Å; D210-A213 PolarHBondContact OD1-N 2.91Å; A213-G215 PolarHBondContact O-N 2.67Å
214	T	86.8	Confident	91.1	Very high	89 Å²	89	33 Å²	33	55%	0.546	20%	0.195	S	C	.	.			trans	-71.5	-11.7	-178.7	66.5	0	0	0	0	113.9	D210 C212 R216	D210-T214 VanDerWaalsContact CG-N 3.3Å; D210-T214 WeakPolarHBondContact OD1-CB 3.43Å; D210-T214 PolarHBondContact OD1-N 3.04Å; D210-T214 PolarHBondContact OD1-OG1 2.87Å; D210-T214 PolarHBondContact OD2-N 3.13Å; D210-T214 VanDerWaalsContact OD2-N 3.13Å; C212-T214 VanDerWaalsContact C-N 3.26Å; C212-T214 HydrophobicContact CB-CG2 3.89Å; C212-T214 PolarHBondContact O-N 3.07Å; T214-R216 PolarHBondContact OG1-N 2.86Å; T214-R216 PolarHBondContact OG1-O 3.26Å
215	G	86.8	Confident	91.2	Very high	26 Å²	26	33 Å²	33	27%	0.268	20%	0.195	S	C	.	.	S	Bend	trans	77.3	10.7	-171	0	0	0	0	0	113.3	D210 A213	D210-G215 WeakPolarHBondContact OD2-CA 3.22Å; D210-G215 PolarHBondContact OD2-N 3.24Å; A213-G215 PolarHBondContact O-N 2.67Å
216	R	91.5	Very high	91.3	Very high	133 Å²	133	33 Å²	33	50%	0.502	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148.6	-169.6	-72.6	177.1	169.7	-101.9	-1.9	112	S152 L153 D210 T214	S152-R216 PolarHBondContact OG-NH1 3.41Å; S152-R216 VanDerWaalsContact OG-NH1 3.09Å; L153-R216 CarbonylContact O-C 3.59Å; L153-R216 VanDerWaalsContact O-CA 3.25Å; L153-R216 WeakPolarHBondContact O-CA 3.27Å; D210-R216 WeakPolarHBondContact CB-O 3.32Å; D210-R216 PolarHBondContact OD2-N 2.84Å; T214-R216 PolarHBondContact OG1-N 2.86Å; T214-R216 PolarHBondContact OG1-O 3.26Å
217	L	92.6	Very high	91.5	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	129.5	-175.9	-61.7	168.9	0	0	0	109.1	S152 L153 Y155 T158 L205 L209 D210 L222	S152-L217 CarbonylContact C-O 3.57Å; S152-L217 VanDerWaalsContact CA-O 3.25Å; S152-L217 WeakPolarHBondContact CA-O 3.16Å; L153-L217 PolarHBondContact N-O 3.38Å; L153-L217 PolarHBondContact O-N 2.93Å; Y155-L217 HydrophobicContact CD1-CD1 3.9Å; Y155-L217 HydrophobicContact CD1-CG 4.13Å; Y155-L217 HydrophobicContact CE1-CD1 4.19Å; Y155-L217 HydrophobicContact CE1-CD2 4.3Å; Y155-L217 HydrophobicContact CE1-CG 4.05Å; T158-L217 HydrophobicContact CG2-CD1 3.77Å; L205-L217 HydrophobicContact CB-CD1 4.38Å; L205-L217 WeakPolarHBondContact O-CD2 3.28Å; L209-L217 HydrophobicContact CB-CD2 3.74Å; D210-L217 HydrophobicContact CB-CD2 3.82Å; L217-L222 HydrophobicContact CB-CD1 3.9Å; L217-L222 HydrophobicContact CB-CD2 4.31Å; L217-L222 HydrophobicContact CB-CG 4.05Å; L217-L222 HydrophobicContact CD1-CD2 4.26Å
218	S	92.3	Very high	91.8	Very high	25 Å²	25	29.8 Å²	29.8	18%	0.175	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66	137.1	178.6	66.7	0	0	0	0	110.6	T220 G221 L222	S218-T220 PolarHBondContact O-N 2.88Å; S218-G221 PolarHBondContact O-N 2.97Å; S218-G221 WeakPolarHBondContact OG-CA 3.4Å; S218-G221 PolarHBondContact OG-N 3.01Å; S218-L222 WeakPolarHBondContact O-CB 3.31Å; S218-L222 WeakPolarHBondContact O-CG 3.48Å; S218-L222 PolarHBondContact O-N 3.12Å
219	V	95.1	Very high	92	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.012	18%	0.18	C	C	.	.	H	α-helix	trans	-62.8	-36	178.1	171.6	0	0	0	0	110.3	L143 L146 A151 L153 K223	L143-V219 HydrophobicContact CB-CG1 4.14Å; L143-V219 HydrophobicContact CD2-CG2 4.3Å; L146-V219 HydrophobicContact CB-CG1 4.41Å; A151-V219 HydrophobicContact CB-CB 4.19Å; A151-V219 HydrophobicContact CB-CG2 4.11Å; A151-V219 WeakPolarHBondContact O-CG2 3.45Å; A151-V219 PolarHBondContact O-N 2.88Å; L153-V219 HydrophobicContact CD2-CG2 4.5Å; L153-V219 HydrophobicContact CG-CG2 4.13Å; V219-K223 HydrophobicContact CG1-CD 4.19Å; V219-K223 WeakPolarHBondContact O-CB 3.29Å; V219-K223 VanDerWaalsContact O-CG 3.22Å; V219-K223 WeakPolarHBondContact O-CG 3.41Å; V219-K223 PolarHBondContact O-N 3.39Å
220	T	93.2	Very high	92.2	Very high	22 Å²	22	29.2 Å²	29.2	14%	0.135	18%	0.177	C	C	.	.	H	α-helix	trans	-65	-48.3	174.4	-57.8	0	0	0	0	112	S218 L222 K223 I224	S218-T220 PolarHBondContact O-N 2.88Å; T220-L222 PolarHBondContact O-N 2.76Å; T220-K223 WeakPolarHBondContact O-CB 3.34Å; T220-K223 PolarHBondContact O-N 2.81Å; T220-I224 HydrophobicContact CG2-CD1 3.81Å; T220-I224 VanDerWaalsContact O-CG1 3.3Å; T220-I224 WeakPolarHBondContact O-CG1 3.33Å; T220-I224 PolarHBondContact O-N 2.99Å
221	G	93.8	Very high	92.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-42.8	176.8	0	0	0	0	0	112.1	S218 K223 I224 T225 D263	S218-G221 PolarHBondContact O-N 2.97Å; S218-G221 WeakPolarHBondContact OG-CA 3.4Å; S218-G221 PolarHBondContact OG-N 3.01Å; G221-K223 PolarHBondContact O-N 3.42Å; G221-I224 PolarHBondContact O-N 3.37Å; G221-T225 WeakPolarHBondContact O-CB 3.18Å; G221-T225 PolarHBondContact O-N 2.82Å; G221-T225 PolarHBondContact O-OG1 3.19Å; G221-D263 VanDerWaalsContact CA-OD2 3.3Å; G221-D263 WeakPolarHBondContact CA-OD2 3.37Å; G221-D263 PolarHBondContact N-OD2 3.37Å
222	L	96.3	Very high	92.9	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.9	-46.4	172.8	-75.2	171.7	0	0	0	112.2	F138 L153 T158 L205 L209 L217 S218 T220 I224 L226	F138-L222 HydrophobicContact CE1-CB 4.35Å; F138-L222 HydrophobicContact CZ-CB 4.05Å; L153-L222 HydrophobicContact CB-CD1 4.42Å; L153-L222 HydrophobicContact CD1-CD1 3.92Å; L153-L222 HydrophobicContact CG-CD1 4.36Å; T158-L222 HydrophobicContact CG2-CD1 4.39Å; T158-L222 HydrophobicContact CG2-CD2 4.05Å; L205-L222 HydrophobicContact CD1-CD2 3.98Å; L205-L222 HydrophobicContact CD2-CD2 4.24Å; L209-L222 HydrophobicContact CD1-CD2 4.11Å; L209-L222 HydrophobicContact CD1-CG 4.3Å; L217-L222 HydrophobicContact CB-CD1 3.9Å; L217-L222 HydrophobicContact CB-CD2 4.31Å; L217-L222 HydrophobicContact CB-CG 4.05Å; L217-L222 HydrophobicContact CD1-CD2 4.26Å; S218-L222 WeakPolarHBondContact O-CB 3.31Å; S218-L222 WeakPolarHBondContact O-CG 3.48Å; S218-L222 PolarHBondContact O-N 3.12Å; T220-L222 PolarHBondContact O-N 2.76Å; L222-I224 PolarHBondContact O-N 2.92Å; L222-L226 VanDerWaalsContact O-CB 3.3Å; L222-L226 WeakPolarHBondContact O-CB 3.18Å; L222-L226 VanDerWaalsContact O-CG 3.26Å; L222-L226 WeakPolarHBondContact O-CG 3.41Å; L222-L226 PolarHBondContact O-N 3.08Å
223	K	96.4	Very high	93.6	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58	-47.8	175.6	-76.9	167.9	175.1	172.8	0	111.3	F138 L143 H144 L146 N147 V219 T220 G221 S227 Y240 L244	F138-K223 HydrophobicContact CD1-CG 4.05Å; F138-K223 HydrophobicContact CD2-CG 4.16Å; F138-K223 HydrophobicContact CE1-CG 3.82Å; F138-K223 HydrophobicContact CE2-CB 4.45Å; F138-K223 HydrophobicContact CE2-CG 3.94Å; F138-K223 HydrophobicContact CG-CG 4.22Å; F138-K223 HydrophobicContact CZ-CB 4.35Å; F138-K223 HydrophobicContact CZ-CG 3.77Å; L143-K223 VanDerWaalsContact O-CE 3.3Å; L143-K223 WeakPolarHBondContact O-CE 3.2Å; L143-K223 PolarHBondContact O-NZ 3.23Å; H144-K223 PolarHBondContact O-NZ 2.81Å; H144-K223 VanDerWaalsContact O-NZ 3.12Å; L146-K223 PolarHBondContact O-NZ 3.45Å; N147-K223 PolarHBondContact OD1-NZ 2.95Å; V219-K223 HydrophobicContact CG1-CD 4.19Å; V219-K223 WeakPolarHBondContact O-CB 3.29Å; V219-K223 VanDerWaalsContact O-CG 3.22Å; V219-K223 WeakPolarHBondContact O-CG 3.41Å; V219-K223 PolarHBondContact O-N 3.39Å; T220-K223 WeakPolarHBondContact O-CB 3.34Å; T220-K223 PolarHBondContact O-N 2.81Å; G221-K223 PolarHBondContact O-N 3.42Å; K223-S227 VanDerWaalsContact O-CB 3.25Å; K223-S227 WeakPolarHBondContact O-CB 3.48Å; K223-S227 PolarHBondContact O-N 3.14Å; K223-S227 PolarHBondContact O-OG 3.4Å; K223-Y240 WeakPolarHBondContact CG-OH 3.41Å; K223-L244 HydrophobicContact CB-CD1 4.06Å; K223-L244 HydrophobicContact CD-CD1 4.42Å; K223-L244 HydrophobicContact CD-CD2 4.06Å
224	I	95.9	Very high	94.3	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.2	-52.1	-179	-66.7	164.7	0	0	0	110.7	T220 G221 L222 S227 T228 L244 Y260 D263 L264	T220-I224 HydrophobicContact CG2-CD1 3.81Å; T220-I224 VanDerWaalsContact O-CG1 3.3Å; T220-I224 WeakPolarHBondContact O-CG1 3.33Å; T220-I224 PolarHBondContact O-N 2.99Å; G221-I224 PolarHBondContact O-N 3.37Å; L222-I224 PolarHBondContact O-N 2.92Å; I224-S227 PolarHBondContact O-OG 3.17Å; I224-S227 VanDerWaalsContact O-OG 3.06Å; I224-T228 VanDerWaalsContact O-CB 3.23Å; I224-T228 WeakPolarHBondContact O-CB 3.42Å; I224-T228 PolarHBondContact O-N 3.49Å; I224-T228 PolarHBondContact O-OG1 2.95Å; I224-L244 HydrophobicContact CG1-CD1 4.46Å; I224-Y260 HydrophobicContact CD1-CD2 3.6Å; I224-Y260 HydrophobicContact CD1-CE2 4.42Å; I224-Y260 HydrophobicContact CD1-CG 4.34Å; I224-Y260 HydrophobicContact CG1-CD2 3.79Å; I224-Y260 HydrophobicContact CG1-CE2 4.18Å; I224-Y260 HydrophobicContact CG2-CD2 4.34Å; I224-Y260 HydrophobicContact CG2-CE2 4.18Å; I224-D263 HydrophobicContact CD1-CB 3.66Å; I224-L264 HydrophobicContact CG2-CB 4.21Å; I224-L264 HydrophobicContact CG2-CD1 4.12Å
225	T	97.3	Very high	94.7	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-51.8	-176.8	-58.7	0	0	0	0	112.3	W204 L205 G221 S227 T228 L229 L267	W204-T225 HydrophobicContact CH2-CG2 3.76Å; W204-T225 HydrophobicContact CZ3-CG2 3.55Å; L205-T225 HydrophobicContact CD2-CG2 3.54Å; G221-T225 WeakPolarHBondContact O-CB 3.18Å; G221-T225 PolarHBondContact O-N 2.82Å; G221-T225 PolarHBondContact O-OG1 3.19Å; T225-S227 PolarHBondContact O-N 3.33Å; T225-T228 PolarHBondContact O-N 3.21Å; T225-L229 PolarHBondContact O-N 2.82Å; T225-L267 HydrophobicContact CG2-CD2 3.67Å
226	L	97.8	Very high	95.2	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-65.4	-42.3	-175.7	-64.8	-179.6	0	0	0	111.6	F126 V134 F138 L162 I165 L201 L205 L222 L229 T230	F126-L226 HydrophobicContact CE1-CB 4.07Å; F126-L226 HydrophobicContact CE1-CD2 3.93Å; F126-L226 WeakPolarHBondContact CE1-O 3.35Å; F126-L226 HydrophobicContact CZ-CD2 3.77Å; V134-L226 HydrophobicContact CG1-CB 3.83Å; F138-L226 HydrophobicContact CE2-CD1 4.2Å; F138-L226 HydrophobicContact CZ-CD1 4.03Å; L162-L226 HydrophobicContact CD2-CD1 4.13Å; L162-L226 HydrophobicContact CD2-CD2 4.14Å; I165-L226 HydrophobicContact CD1-CD1 3.97Å; L201-L226 HydrophobicContact CD1-CD2 4.23Å; L201-L226 HydrophobicContact CD2-CD2 4.06Å; L205-L226 HydrophobicContact CD1-CD2 4.11Å; L205-L226 HydrophobicContact CD2-CD2 4.41Å; L222-L226 VanDerWaalsContact O-CB 3.3Å; L222-L226 WeakPolarHBondContact O-CB 3.18Å; L222-L226 VanDerWaalsContact O-CG 3.26Å; L222-L226 WeakPolarHBondContact O-CG 3.41Å; L222-L226 PolarHBondContact O-N 3.08Å; L226-L229 PolarHBondContact O-N 3.16Å; L226-T230 WeakPolarHBondContact O-CG2 2.91Å; L226-T230 PolarHBondContact O-N 3.21Å
227	S	97.2	Very high	95.5	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-65.3	-39.2	175.5	59.8	0	0	0	0	112.5	L131 K223 I224 T225 L229 T230 H241	L131-S227 VanDerWaalsContact CD1-CB 3.5Å; K223-S227 VanDerWaalsContact O-CB 3.25Å; K223-S227 WeakPolarHBondContact O-CB 3.48Å; K223-S227 PolarHBondContact O-N 3.14Å; K223-S227 PolarHBondContact O-OG 3.4Å; I224-S227 PolarHBondContact O-OG 3.17Å; I224-S227 VanDerWaalsContact O-OG 3.06Å; T225-S227 PolarHBondContact O-N 3.33Å; S227-L229 VanDerWaalsContact C-N 3.32Å; S227-L229 PolarHBondContact O-N 3.37Å; S227-T230 PolarHBondContact O-N 2.98Å; S227-T230 PolarHBondContact O-OG1 3.33Å; S227-H241 PolarHBondContact OG-CD2 3.37Å; S227-H241 PolarHBondContact OG-NE2 3.48Å
228	T	97.5	Very high	95.7	Very high	3 Å²	3	20.7 Å²	20.7	2%	0.018	11%	0.109	C	C	.	.	H	α-helix	trans	-62.8	-37.2	176.8	-60	0	0	0	0	112	I224 T225 K237 H241 L264 L267 L316	I224-T228 VanDerWaalsContact O-CB 3.23Å; I224-T228 WeakPolarHBondContact O-CB 3.42Å; I224-T228 PolarHBondContact O-N 3.49Å; I224-T228 PolarHBondContact O-OG1 2.95Å; T225-T228 PolarHBondContact O-N 3.21Å; T228-K237 WeakPolarHBondContact O-CE 3.03Å; T228-K237 PolarHBondContact O-NZ 3.24Å; T228-H241 PolarHBondContact OG1-CE1 3.46Å; T228-L264 HydrophobicContact CG2-CD1 4.21Å; T228-L267 HydrophobicContact CG2-CD1 3.93Å; T228-L316 HydrophobicContact CG2-CD1 3.85Å
229	L	97.1	Very high	95.9	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-75.1	-17	176.8	-74.3	-173.1	0	0	0	115	I120 Q121 F126 L201 W204 T225 L226 S227 F319	I120-L229 HydrophobicContact CG2-CD1 4.48Å; Q121-L229 HydrophobicContact CB-CD2 4.21Å; Q121-L229 HydrophobicContact CG-CD2 4.28Å; Q121-L229 WeakPolarHBondContact CG-O 3.38Å; Q121-L229 PolarHBondContact NE2-O 3.49Å; F126-L229 HydrophobicContact CB-CB 3.9Å; F126-L229 HydrophobicContact CD1-CB 3.72Å; F126-L229 HydrophobicContact CG-CB 4.08Å; L201-L229 HydrophobicContact CD1-CD1 4.42Å; W204-L229 HydrophobicContact CE3-CD1 4.46Å; W204-L229 HydrophobicContact CH2-CD1 3.94Å; W204-L229 HydrophobicContact CH2-CG 4.43Å; W204-L229 HydrophobicContact CZ3-CD1 3.52Å; W204-L229 HydrophobicContact CZ3-CG 4.43Å; T225-L229 PolarHBondContact O-N 2.82Å; L226-L229 PolarHBondContact O-N 3.16Å; S227-L229 VanDerWaalsContact C-N 3.32Å; S227-L229 PolarHBondContact O-N 3.37Å; L229-F319 HydrophobicContact CD2-CZ 4.19Å
230	T	96.3	Very high	96	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	-59.9	164.1	-179.1	61.8	0	0	0	0	113.9	Q121 F126 M129 V134 L226 S227 A232 K237	Q121-T230 PolarHBondContact NE2-O 3.2Å; F126-T230 HydrophobicContact CD1-CG2 4.23Å; F126-T230 HydrophobicContact CE1-CG2 4.37Å; M129-T230 HydrophobicContact CG-CG2 4.45Å; M129-T230 VanDerWaalsContact O-CB 3.28Å; M129-T230 WeakPolarHBondContact O-CB 3.37Å; V134-T230 HydrophobicContact CB-CG2 4.41Å; V134-T230 HydrophobicContact CG2-CG2 3.64Å; L226-T230 WeakPolarHBondContact O-CG2 2.91Å; L226-T230 PolarHBondContact O-N 3.21Å; S227-T230 PolarHBondContact O-N 2.98Å; S227-T230 PolarHBondContact O-OG1 3.33Å; T230-A232 PolarHBondContact O-N 3.46Å; T230-K237 WeakPolarHBondContact O-CE 3.46Å; T230-K237 PolarHBondContact O-NZ 2.93Å; T230-K237 WeakPolarHBondContact OG1-CE 3.3Å
231	N	92	Very high	96.1	Very high	73 Å²	73	24.3 Å²	24.3	39%	0.39	12%	0.116	S	C	.	.	S	Bend	trans	-83	7.2	176.8	-158.5	47.2	0	0	0	113.9	F126 N127 M129 I323	F126-N231 PolarHBondContact O-N 3.5Å; N127-N231 WeakPolarHBondContact O-CB 3.12Å; N127-N231 PolarHBondContact O-ND2 3.09Å; N127-N231 PolarHBondContact O-OD1 2.84Å; M129-N231 PolarHBondContact O-N 3.36Å; N231-I323 WeakPolarHBondContact OD1-CG2 3.31Å
232	A	94.5	Very high	96.2	Very high	20 Å²	20	24.8 Å²	24.8	17%	0.165	12%	0.119	C	C	.	.	S	Bend	trans	-66.6	159.5	179.6	0	0	0	0	0	113.1	L131 T230 D236 K237	L131-A232 HydrophobicContact CB-CB 3.55Å; L131-A232 HydrophobicContact CD2-CB 4.11Å; L131-A232 HydrophobicContact CG-CB 4.48Å; T230-A232 PolarHBondContact O-N 3.46Å; A232-D236 HydrophobicContact CB-CB 4.38Å; A232-K237 HydrophobicContact CB-CG 4.24Å; A232-K237 VanDerWaalsContact O-CE 3.25Å; A232-K237 WeakPolarHBondContact O-CE 3.48Å
233	R	95.1	Very high	96.1	Very high	171 Å²	171	28.9 Å²	28.9	65%	0.645	14%	0.144	S	C	*	.			trans	-66.1	149.8	-179.9	-51.1	172.9	-64.3	-174.6	4.2	109.8	A235 D236 K237	R233-A235 VanDerWaalsContact C-N 3.27Å; R233-A235 PolarHBondContact O-N 3.12Å; R233-D236 VanDerWaalsContact CB-OD2 3.27Å; R233-D236 WeakPolarHBondContact CB-OD2 3.45Å; R233-D236 WeakPolarHBondContact CG-OD2 3.46Å; R233-D236 IonicContact CZ-OD1 3.42Å; R233-D236 IonicContact CZ-OD2 3.39Å; R233-D236 PolarHBondContact N-OD2 3.33Å; R233-D236 IonicContact NE-OD1 3.26Å; R233-D236 PolarHBondContact NE-OD1 3.2Å; R233-D236 IonicContact NE-OD2 3.63Å; R233-D236 PolarHBondContact NE-OD2 3.07Å; R233-D236 IonicContact NH2-OD1 3.48Å; R233-D236 PolarHBondContact NH2-OD1 3.41Å; R233-D236 IonicContact NH2-OD2 2.92Å; R233-D236 PolarHBondContact NH2-OD2 2.71Å; R233-D236 WeakPolarHBondContact O-CB 3.48Å; R233-D236 PolarHBondContact O-N 3.5Å; R233-K237 PolarHBondContact O-N 3.05Å; R233-K237 VanDerWaalsContact O-N 3.15Å
234	P	94.7	Very high	96	Very high	42 Å²	42	29.4 Å²	29.4	27%	0.273	15%	0.146	S	C	.	.	H	α-helix	trans	-54	-42	-178.2	-29.3	37.8	0	0	0	113.4	D236 K237 F238 L305 H320	P234-D236 VanDerWaalsContact C-N 3.3Å; P234-D236 PolarHBondContact O-N 2.95Å; P234-K237 PolarHBondContact O-N 2.85Å; P234-F238 HydrophobicContact CB-CE2 4.49Å; P234-F238 VanDerWaalsContact O-CD2 3.28Å; P234-F238 WeakPolarHBondContact O-CD2 3.25Å; P234-F238 WeakPolarHBondContact O-CG 3.21Å; P234-F238 PolarHBondContact O-N 3.44Å; P234-L305 HydrophobicContact CB-CD2 3.63Å; P234-H320 HydrophobicContact CG-CB 3.71Å
235	A	95.7	Very high	96	Very high	25 Å²	25	29.6 Å²	29.6	21%	0.207	15%	0.147	C	C	.	.	H	α-helix	trans	-65.5	-27.3	177.3	0	0	0	0	0	114	R233 R239 L305	R233-A235 VanDerWaalsContact C-N 3.27Å; R233-A235 PolarHBondContact O-N 3.12Å; A235-R239 VanDerWaalsContact O-CB 3.25Å; A235-R239 WeakPolarHBondContact O-CB 3.28Å; A235-R239 WeakPolarHBondContact O-CG 3.47Å; A235-R239 PolarHBondContact O-N 3.4Å; A235-L305 HydrophobicContact CB-CD1 3.79Å
236	D	97	Very high	95.8	Very high	43 Å²	43	30.6 Å²	30.6	23%	0.23	15%	0.154	C	C	.	.	H	α-helix	trans	-77.2	-40.6	176.4	-54.3	-36.8	0	0	0	110.4	L131 A232 R233 P234 R239 Y240	L131-D236 HydrophobicContact CD2-CB 4.16Å; L131-D236 WeakPolarHBondContact CD2-O 3.46Å; A232-D236 HydrophobicContact CB-CB 4.38Å; R233-D236 VanDerWaalsContact CB-OD2 3.27Å; R233-D236 WeakPolarHBondContact CB-OD2 3.45Å; R233-D236 WeakPolarHBondContact CG-OD2 3.46Å; R233-D236 IonicContact CZ-OD1 3.42Å; R233-D236 IonicContact CZ-OD2 3.39Å; R233-D236 PolarHBondContact N-OD2 3.33Å; R233-D236 IonicContact NE-OD1 3.26Å; R233-D236 PolarHBondContact NE-OD1 3.2Å; R233-D236 IonicContact NE-OD2 3.63Å; R233-D236 PolarHBondContact NE-OD2 3.07Å; R233-D236 IonicContact NH2-OD1 3.48Å; R233-D236 PolarHBondContact NH2-OD1 3.41Å; R233-D236 IonicContact NH2-OD2 2.92Å; R233-D236 PolarHBondContact NH2-OD2 2.71Å; R233-D236 WeakPolarHBondContact O-CB 3.48Å; R233-D236 PolarHBondContact O-N 3.5Å; P234-D236 VanDerWaalsContact C-N 3.3Å; P234-D236 PolarHBondContact O-N 2.95Å; D236-R239 PolarHBondContact O-N 3.39Å; D236-Y240 PolarHBondContact O-N 2.99Å
237	K	97.1	Very high	95.5	Very high	1 Å²	1	33 Å²	33	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-60.3	-50.4	174	-66	177.5	177.1	179.2	0	111.3	L131 T228 T230 A232 R233 P234 Y240 H241 H320	L131-K237 HydrophobicContact CD2-CG 4.46Å; T228-K237 WeakPolarHBondContact O-CE 3.03Å; T228-K237 PolarHBondContact O-NZ 3.24Å; T230-K237 WeakPolarHBondContact O-CE 3.46Å; T230-K237 PolarHBondContact O-NZ 2.93Å; T230-K237 WeakPolarHBondContact OG1-CE 3.3Å; A232-K237 HydrophobicContact CB-CG 4.24Å; A232-K237 VanDerWaalsContact O-CE 3.25Å; A232-K237 WeakPolarHBondContact O-CE 3.48Å; R233-K237 PolarHBondContact O-N 3.05Å; R233-K237 VanDerWaalsContact O-N 3.15Å; P234-K237 PolarHBondContact O-N 2.85Å; K237-Y240 WeakPolarHBondContact O-CB 3.39Å; K237-Y240 PolarHBondContact O-N 3.29Å; K237-Y240 VanDerWaalsContact O-N 3.17Å; K237-H241 VanDerWaalsContact O-CG 3.25Å; K237-H241 PolarHBondContact O-N 3.39Å; K237-H320 PolarHBondContact NZ-NE2 2.94Å
238	F	96.4	Very high	95.2	Very high	6 Å²	6	39.4 Å²	39.4	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-68.4	-33	178.4	-66.1	-42.3	0	0	0	112.6	P234 H241 F242 F300 L301 M304 L305 L316	P234-F238 HydrophobicContact CB-CE2 4.49Å; P234-F238 VanDerWaalsContact O-CD2 3.28Å; P234-F238 WeakPolarHBondContact O-CD2 3.25Å; P234-F238 WeakPolarHBondContact O-CG 3.21Å; P234-F238 PolarHBondContact O-N 3.44Å; F238-H241 AromaticContact CD1-ND1 3.61Å; F238-H241 PolarHBondContact O-N 3.3Å; F238-F242 WeakPolarHBondContact O-CB 3.22Å; F238-F242 PolarHBondContact O-N 3.02Å; F238-F300 HydrophobicContact CB-CE1 4.01Å; F238-F300 WeakPolarHBondContact O-CE1 3.29Å; F238-L301 HydrophobicContact CB-CD2 3.6Å; F238-M304 HydrophobicContact CD1-CE 3.85Å; F238-M304 HydrophobicContact CD2-CB 3.98Å; F238-M304 HydrophobicContact CE1-CE 3.4Å; F238-M304 HydrophobicContact CE2-CB 4.02Å; F238-M304 HydrophobicContact CG-CB 4.3Å; F238-M304 HydrophobicContact CZ-CB 4.37Å; F238-M304 HydrophobicContact CZ-CE 3.82Å; F238-L305 HydrophobicContact CD2-CD2 3.69Å; F238-L305 HydrophobicContact CD2-CG 4.05Å; F238-L305 HydrophobicContact CE2-CD2 3.73Å; F238-L305 HydrophobicContact CE2-CG 4.37Å; F238-L316 HydrophobicContact CE1-CD2 3.94Å; F238-L316 HydrophobicContact CZ-CD2 3.76Å; F238-L316 HydrophobicContact CZ-CG 4.43Å
239	R	97.4	Very high	94.9	Very high	96 Å²	96	43.9 Å²	43.9	36%	0.362	24%	0.24	S	C	.	.	H	α-helix	trans	-59.5	-44.6	167.9	-84.7	-178.9	168.2	94.4	6.1	112	A235 D236 L297 E298 L301	A235-R239 VanDerWaalsContact O-CB 3.25Å; A235-R239 WeakPolarHBondContact O-CB 3.28Å; A235-R239 WeakPolarHBondContact O-CG 3.47Å; A235-R239 PolarHBondContact O-N 3.4Å; D236-R239 PolarHBondContact O-N 3.39Å; R239-L297 HydrophobicContact CG-CD1 4.02Å; R239-L297 HydrophobicContact CG-CD2 4.24Å; R239-E298 IonicContact CZ-OE1 2.7Å; R239-E298 IonicContact CZ-OE2 2.7Å; R239-E298 IonicContact NE-OE1 3.74Å; R239-E298 IonicContact NH2-OE1 3.8Å; R239-E298 PolarHBondContact NH2-OE1 3.05Å; R239-E298 IonicContact NH2-OE2 3.1Å; R239-E298 PolarHBondContact NH2-OE2 3.36Å; R239-L301 HydrophobicContact CG-CD1 3.82Å; R239-L301 HydrophobicContact CG-CD2 4.19Å; R239-L301 VanDerWaalsContact NH2-CD1 3.31Å
240	Y	97	Very high	94.7	Very high	27 Å²	27	45.1 Å²	45.1	11%	0.106	25%	0.254	C	S	.	.	H	α-helix	trans	-62.7	-49.1	173.9	170.1	-111.8	0	0	0	111.7	L131 V135 K223 D236 K237 F242 T243 L244	L131-Y240 HydrophobicContact CD1-CD1 4.07Å; L131-Y240 HydrophobicContact CD1-CG 4.3Å; V135-Y240 HydrophobicContact CB-CE2 4.42Å; V135-Y240 HydrophobicContact CG1-CD2 4.44Å; V135-Y240 HydrophobicContact CG1-CE2 4.09Å; V135-Y240 HydrophobicContact CG2-CD1 4.37Å; V135-Y240 HydrophobicContact CG2-CD2 3.59Å; V135-Y240 HydrophobicContact CG2-CE1 4.26Å; V135-Y240 HydrophobicContact CG2-CE2 3.48Å; V135-Y240 VanDerWaalsContact CG2-CE2 3.48Å; V135-Y240 HydrophobicContact CG2-CG 4.04Å; K223-Y240 WeakPolarHBondContact CG-OH 3.41Å; D236-Y240 PolarHBondContact O-N 2.99Å; K237-Y240 WeakPolarHBondContact O-CB 3.39Å; K237-Y240 PolarHBondContact O-N 3.29Å; K237-Y240 VanDerWaalsContact O-N 3.17Å; Y240-F242 VanDerWaalsContact C-N 3.31Å; Y240-F242 PolarHBondContact O-N 2.95Å; Y240-T243 PolarHBondContact O-N 3.01Å; Y240-T243 PolarHBondContact O-OG1 3.36Å; Y240-L244 HydrophobicContact CE1-CD1 4.2Å; Y240-L244 HydrophobicContact CE2-CD2 4.3Å
241	H	96.1	Very high	94.6	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-54.2	-46.5	178.1	-64.7	163.9	0	0	0	111.5	S227 T228 K237 F238 T243 L244 L245 Y260	S227-H241 PolarHBondContact OG-CD2 3.37Å; S227-H241 PolarHBondContact OG-NE2 3.48Å; T228-H241 PolarHBondContact OG1-CE1 3.46Å; K237-H241 VanDerWaalsContact O-CG 3.25Å; K237-H241 PolarHBondContact O-N 3.39Å; F238-H241 AromaticContact CD1-ND1 3.61Å; F238-H241 PolarHBondContact O-N 3.3Å; H241-T243 PolarHBondContact O-N 3.39Å; H241-T243 VanDerWaalsContact O-N 3.13Å; H241-L244 VanDerWaalsContact O-CB 3.29Å; H241-L244 WeakPolarHBondContact O-CB 3.3Å; H241-L244 PolarHBondContact O-N 2.83Å; H241-L245 WeakPolarHBondContact O-CG 3.48Å; H241-L245 PolarHBondContact O-N 2.9Å; H241-Y260 HydrophobicContact CB-CE2 3.75Å; H241-Y260 AromaticContact CG-CE2 3.61Å; H241-Y260 AromaticContact ND1-CE2 3.6Å; H241-Y260 AromaticContact ND1-CZ 3.64Å; H241-Y260 PolarHBondContact ND1-OH 2.69Å
242	F	96	Very high	94.7	Very high	11 Å²	11	42.7 Å²	42.7	5%	0.048	24%	0.242	C	C	.	.	H	α-helix	trans	-54.1	-35.1	178	-168.7	-94.2	0	0	0	113.3	F238 Y240 L244 L245 S246 G250 L252 L297 F300	F238-F242 WeakPolarHBondContact O-CB 3.22Å; F238-F242 PolarHBondContact O-N 3.02Å; Y240-F242 VanDerWaalsContact C-N 3.31Å; Y240-F242 PolarHBondContact O-N 2.95Å; F242-L244 PolarHBondContact O-N 3.41Å; F242-L245 PolarHBondContact O-N 3.01Å; F242-L245 VanDerWaalsContact O-N 3.07Å; F242-S246 WeakPolarHBondContact O-CB 3.26Å; F242-S246 PolarHBondContact O-N 3.44Å; F242-S246 PolarHBondContact O-OG 2.96Å; F242-G250 WeakPolarHBondContact CZ-O 3.44Å; F242-L252 HydrophobicContact CD2-CD1 4.02Å; F242-L252 HydrophobicContact CE2-CB 4.03Å; F242-L252 HydrophobicContact CE2-CD1 3.98Å; F242-L297 HydrophobicContact CB-CD1 3.6Å; F242-L297 HydrophobicContact CD1-CB 3.97Å; F242-L297 HydrophobicContact CD1-CD1 3.66Å; F242-L297 HydrophobicContact CD1-CG 4.35Å; F242-L297 HydrophobicContact CD2-CD1 4.13Å; F242-L297 HydrophobicContact CE1-CB 3.8Å; F242-L297 HydrophobicContact CE1-CD1 4.37Å; F242-L297 HydrophobicContact CG-CB 4.41Å; F242-L297 HydrophobicContact CG-CD1 3.52Å; F242-L297 HydrophobicContact CZ-CB 4.12Å; F242-L297 VanDerWaalsContact CZ-N 3.31Å; F242-F300 HydrophobicContact CB-CD1 4.07Å; F242-F300 HydrophobicContact CB-CE1 4.06Å; F242-F300 HydrophobicContact CD2-CB 3.75Å; F242-F300 AromaticContact CD2-CD1 3.56Å; F242-F300 HydrophobicContact CD2-CD1 3.56Å; F242-F300 HydrophobicContact CD2-CD2 4.21Å; F242-F300 HydrophobicContact CD2-CE1 4.16Å; F242-F300 AromaticContact CD2-CG 3.58Å; F242-F300 HydrophobicContact CD2-CG 3.58Å; F242-F300 HydrophobicContact CE2-CB 3.79Å; F242-F300 HydrophobicContact CE2-CD1 4.45Å; F242-F300 HydrophobicContact CE2-CG 4.09Å; F242-F300 HydrophobicContact CG-CD1 4.23Å
243	T	94.6	Very high	94.6	Very high	86 Å²	86	44.3 Å²	44.3	53%	0.528	25%	0.248	S	C	.	.	H	α-helix	trans	-68.3	-16.8	177.1	70	0	0	0	0	114.3	Y240 H241	Y240-T243 PolarHBondContact O-N 3.01Å; Y240-T243 PolarHBondContact O-OG1 3.36Å; H241-T243 PolarHBondContact O-N 3.39Å; H241-T243 VanDerWaalsContact O-N 3.13Å
244	L	93.8	Very high	94.5	Very high	10 Å²	10	39.7 Å²	39.7	5%	0.052	23%	0.232	C	C	.	.	H	α-helix	trans	-80.9	-38.4	170.7	-49	-179.8	0	0	0	110.7	K223 I224 Y240 H241 F242 K256	K223-L244 HydrophobicContact CB-CD1 4.06Å; K223-L244 HydrophobicContact CD-CD1 4.42Å; K223-L244 HydrophobicContact CD-CD2 4.06Å; I224-L244 HydrophobicContact CG1-CD1 4.46Å; Y240-L244 HydrophobicContact CE1-CD1 4.2Å; Y240-L244 HydrophobicContact CE2-CD2 4.3Å; H241-L244 VanDerWaalsContact O-CB 3.29Å; H241-L244 WeakPolarHBondContact O-CB 3.3Å; H241-L244 PolarHBondContact O-N 2.83Å; F242-L244 PolarHBondContact O-N 3.41Å; L244-K256 WeakPolarHBondContact O-CD 3.44Å; L244-K256 PolarHBondContact O-NZ 3.01Å
245	L	94.4	Very high	94.4	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-95.1	-18.6	-166.5	-46.8	-176.4	0	0	0	114.6	H241 F242 L252 I253 K256 F257 Y260 F300	H241-L245 WeakPolarHBondContact O-CG 3.48Å; H241-L245 PolarHBondContact O-N 2.9Å; F242-L245 PolarHBondContact O-N 3.01Å; F242-L245 VanDerWaalsContact O-N 3.07Å; L245-L252 HydrophobicContact CB-CD1 3.47Å; L245-L252 VanDerWaalsContact CB-CD1 3.47Å; L245-L252 HydrophobicContact CD1-CD1 4.16Å; L245-L252 HydrophobicContact CG-CD1 4.46Å; L245-I253 PolarHBondContact O-N 3.32Å; L245-K256 HydrophobicContact CB-CB 4.38Å; L245-K256 HydrophobicContact CD2-CB 4.25Å; L245-K256 WeakPolarHBondContact O-CD 3.44Å; L245-F257 HydrophobicContact CD1-CD2 3.92Å; L245-Y260 HydrophobicContact CD1-CD1 3.72Å; L245-Y260 HydrophobicContact CD1-CD2 3.82Å; L245-Y260 HydrophobicContact CD1-CE1 4.21Å; L245-Y260 HydrophobicContact CD1-CE2 4.31Å; L245-Y260 HydrophobicContact CD1-CG 3.5Å; L245-Y260 HydrophobicContact CD2-CD2 4.05Å; L245-Y260 HydrophobicContact CD2-CG 3.95Å; L245-Y260 HydrophobicContact CG-CD2 4.4Å; L245-Y260 HydrophobicContact CG-CG 4.32Å; L245-F300 HydrophobicContact CD1-CZ 4.5Å
246	S	94	Very high	94.3	Very high	20 Å²	20	43.3 Å²	43.3	14%	0.14	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-77.4	165.4	177.5	69.4	0	0	0	0	112.6	F242 A251 K256	F242-S246 WeakPolarHBondContact O-CB 3.26Å; F242-S246 PolarHBondContact O-N 3.44Å; F242-S246 PolarHBondContact O-OG 2.96Å; S246-A251 CarbonylContact C-O 3.5Å; S246-A251 WeakPolarHBondContact CA-O 3.43Å; S246-A251 WeakPolarHBondContact CB-O 3.32Å; S246-K256 PolarHBondContact O-NZ 3.47Å
247	D	91.5	Very high	94.1	Very high	50 Å²	50	41.3 Å²	41.3	27%	0.267	24%	0.238	S	C	.	.			trans	-85.2	-178.3	161.3	80.3	-23.5	0	0	0	110.8	S249 G250 A251 I253	D247-S249 VanDerWaalsContact C-N 3.26Å; D247-S249 VanDerWaalsContact CG-N 3.28Å; D247-S249 PolarHBondContact O-N 3.17Å; D247-S249 WeakPolarHBondContact OD1-CA 3.4Å; D247-S249 PolarHBondContact OD1-N 3.32Å; D247-S249 PolarHBondContact OD1-OG 3.36Å; D247-S249 VanDerWaalsContact OD2-CB 3.27Å; D247-S249 WeakPolarHBondContact OD2-CB 3.39Å; D247-S249 PolarHBondContact OD2-N 2.94Å; D247-S249 PolarHBondContact OD2-OG 2.91Å; D247-G250 PolarHBondContact O-N 3.33Å; D247-G250 PolarHBondContact OD1-N 3.24Å; D247-A251 PolarHBondContact N-O 2.84Å; D247-A251 PolarHBondContact OD1-N 3.01Å; D247-I253 HydrophobicContact CB-CD1 3.81Å; D247-I253 HydrophobicContact CB-CG1 4.01Å
248	P	90.9	Very high	94	Very high	135 Å²	135	43.9 Å²	43.9	88%	0.877	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-10.4	172.1	-21.4	35.2	0	0	0	115.7
249	S	91.8	Very high	93.8	Very high	98 Å²	98	45.5 Å²	45.5	69%	0.685	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-18	174.7	80.5	0	0	0	0	113.2	D247	D247-S249 VanDerWaalsContact C-N 3.26Å; D247-S249 VanDerWaalsContact CG-N 3.28Å; D247-S249 PolarHBondContact O-N 3.17Å; D247-S249 WeakPolarHBondContact OD1-CA 3.4Å; D247-S249 PolarHBondContact OD1-N 3.32Å; D247-S249 PolarHBondContact OD1-OG 3.36Å; D247-S249 VanDerWaalsContact OD2-CB 3.27Å; D247-S249 WeakPolarHBondContact OD2-CB 3.39Å; D247-S249 PolarHBondContact OD2-N 2.94Å; D247-S249 PolarHBondContact OD2-OG 2.91Å
250	G	92.2	Very high	93.7	Very high	28 Å²	28	41 Å²	41	29%	0.289	25%	0.247	S	C	.	.	S	Bend	trans	97.9	16.6	-178.2	0	0	0	0	0	114	F242 D247	F242-G250 WeakPolarHBondContact CZ-O 3.44Å; D247-G250 PolarHBondContact O-N 3.33Å; D247-G250 PolarHBondContact OD1-N 3.24Å
251	A	93.3	Very high	93.6	Very high	12 Å²	12	39.8 Å²	39.8	10%	0.099	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-98.4	142.1	174	0	0	0	0	0	111.4	S246 D247 N294	S246-A251 CarbonylContact C-O 3.5Å; S246-A251 WeakPolarHBondContact CA-O 3.43Å; S246-A251 WeakPolarHBondContact CB-O 3.32Å; D247-A251 PolarHBondContact N-O 2.84Å; D247-A251 PolarHBondContact OD1-N 3.01Å; A251-N294 HydrophobicContact CB-CB 4.12Å
252	L	94.1	Very high	93.4	Very high	10 Å²	10	43.8 Å²	43.8	5%	0.052	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-70.3	127.1	177.6	-169.4	68.2	0	0	0	111.4	F242 L245 F257 F288 V295 F300	F242-L252 HydrophobicContact CD2-CD1 4.02Å; F242-L252 HydrophobicContact CE2-CB 4.03Å; F242-L252 HydrophobicContact CE2-CD1 3.98Å; L245-L252 HydrophobicContact CB-CD1 3.47Å; L245-L252 VanDerWaalsContact CB-CD1 3.47Å; L245-L252 HydrophobicContact CD1-CD1 4.16Å; L245-L252 HydrophobicContact CG-CD1 4.46Å; L252-F257 HydrophobicContact CD1-CB 4.43Å; L252-F257 HydrophobicContact CD1-CD2 4.49Å; L252-F257 HydrophobicContact CD2-CB 4.22Å; L252-F257 HydrophobicContact CD2-CD2 4.12Å; L252-F257 HydrophobicContact CD2-CG 4.15Å; L252-F257 HydrophobicContact CG-CB 4.25Å; L252-F288 HydrophobicContact CB-CE1 4.41Å; L252-F288 HydrophobicContact CB-CZ 4.17Å; L252-F288 HydrophobicContact CD2-CE1 4.37Å; L252-F288 HydrophobicContact CD2-CE2 3.94Å; L252-F288 HydrophobicContact CD2-CZ 3.6Å; L252-F288 HydrophobicContact CG-CE1 4.49Å; L252-F288 HydrophobicContact CG-CZ 3.77Å; L252-V295 HydrophobicContact CB-CB 4.05Å; L252-V295 WeakPolarHBondContact CB-O 3.35Å; L252-V295 HydrophobicContact CD2-CB 4.26Å; L252-V295 HydrophobicContact CD2-CG1 4.4Å; L252-V295 PolarHBondContact N-O 2.84Å; L252-F300 HydrophobicContact CD1-CD2 4.27Å; L252-F300 HydrophobicContact CD1-CE2 4.39Å; L252-F300 HydrophobicContact CD2-CD2 3.84Å; L252-F300 HydrophobicContact CD2-CE2 4.36Å
253	I	93.1	Very high	93.3	Very high	54 Å²	54	44 Å²	44	28%	0.277	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-87	124.9	176.2	-62	164.4	0	0	0	109.5	L245 D247 S255 K256 F257	L245-I253 PolarHBondContact O-N 3.32Å; D247-I253 HydrophobicContact CB-CD1 3.81Å; D247-I253 HydrophobicContact CB-CG1 4.01Å; I253-S255 PolarHBondContact O-N 2.72Å; I253-K256 HydrophobicContact CB-CB 4.14Å; I253-K256 HydrophobicContact CB-CD 4.18Å; I253-K256 HydrophobicContact CB-CG 4.05Å; I253-K256 HydrophobicContact CD1-CD 3.89Å; I253-K256 HydrophobicContact CD1-CG 4.42Å; I253-K256 HydrophobicContact CG2-CB 4.36Å; I253-K256 HydrophobicContact CG2-CG 4.06Å; I253-K256 PolarHBondContact O-N 3.21Å; I253-F257 PolarHBondContact O-N 2.88Å
254	F	93	Very high	93.4	Very high	74 Å²	74	40 Å²	40	33%	0.325	24%	0.238	S	C	.	.	H	α-helix	trans	-53.4	-55.3	-177.8	-177.2	-88	0	0	0	113.3	K256 F257 E258 S284 Q285 F288	F254-K256 VanDerWaalsContact C-N 3.28Å; F254-K256 PolarHBondContact O-N 3.42Å; F254-F257 WeakPolarHBondContact O-CA 3.4Å; F254-F257 WeakPolarHBondContact O-CB 3.44Å; F254-F257 PolarHBondContact O-N 2.85Å; F254-E258 HydrophobicContact CE1-CB 4.39Å; F254-E258 PolarHBondContact O-N 2.83Å; F254-S284 WeakPolarHBondContact CZ-OG 3.34Å; F254-Q285 HydrophobicContact CE2-CG 4.39Å; F254-Q285 HydrophobicContact CZ-CG 4.28Å; F254-F288 HydrophobicContact CB-CE1 4.31Å; F254-F288 HydrophobicContact CB-CE2 4.32Å; F254-F288 HydrophobicContact CB-CZ 4.04Å; F254-F288 HydrophobicContact CD2-CD1 4.41Å; F254-F288 AromaticContact CD2-CD2 3.51Å; F254-F288 HydrophobicContact CD2-CD2 3.51Å; F254-F288 AromaticContact CD2-CE2 3.65Å; F254-F288 HydrophobicContact CD2-CE2 3.65Å; F254-F288 AromaticContact CD2-CG 3.92Å; F254-F288 HydrophobicContact CD2-CG 3.92Å; F254-F288 HydrophobicContact CD2-CZ 4.16Å; F254-F288 AromaticContact CE2-CD2 3.99Å; F254-F288 HydrophobicContact CE2-CD2 3.99Å; F254-F288 HydrophobicContact CE2-CE2 4.38Å; F254-F288 HydrophobicContact CG-CE2 4.38Å
255	S	92.5	Very high	93.4	Very high	75 Å²	75	39.5 Å²	39.5	52%	0.524	24%	0.236	S	C	.	.	H	α-helix	trans	-63.5	-31.7	-177.2	53.5	0	0	0	0	113.3	I253 A259	I253-S255 PolarHBondContact O-N 2.72Å; S255-A259 WeakPolarHBondContact O-CB 3.35Å; S255-A259 PolarHBondContact O-N 3.18Å; S255-A259 VanDerWaalsContact O-N 3.08Å
256	K	93.7	Very high	93.4	Very high	68 Å²	68	41.3 Å²	41.3	30%	0.296	24%	0.243	S	C	.	.	H	α-helix	trans	-69.3	-40.9	170.7	-69	-168.3	-177.9	178.5	0	111.7	L244 L245 S246 I253 F254 A259 Y260	L244-K256 WeakPolarHBondContact O-CD 3.44Å; L244-K256 PolarHBondContact O-NZ 3.01Å; L245-K256 HydrophobicContact CB-CB 4.38Å; L245-K256 HydrophobicContact CD2-CB 4.25Å; L245-K256 WeakPolarHBondContact O-CD 3.44Å; S246-K256 PolarHBondContact O-NZ 3.47Å; I253-K256 HydrophobicContact CB-CB 4.14Å; I253-K256 HydrophobicContact CB-CD 4.18Å; I253-K256 HydrophobicContact CB-CG 4.05Å; I253-K256 HydrophobicContact CD1-CD 3.89Å; I253-K256 HydrophobicContact CD1-CG 4.42Å; I253-K256 HydrophobicContact CG2-CB 4.36Å; I253-K256 HydrophobicContact CG2-CG 4.06Å; I253-K256 PolarHBondContact O-N 3.21Å; F254-K256 VanDerWaalsContact C-N 3.28Å; F254-K256 PolarHBondContact O-N 3.42Å; K256-A259 PolarHBondContact O-N 2.9Å; K256-Y260 VanDerWaalsContact O-CB 3.26Å; K256-Y260 WeakPolarHBondContact O-CB 3.3Å; K256-Y260 PolarHBondContact O-N 3.1Å
257	F	93.7	Very high	93.6	Very high	1 Å²	1	40.4 Å²	40.4	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-66.4	-40.1	177.6	-178.2	-99.3	0	0	0	112.1	L245 L252 I253 F254 Y260 L261 M287 F288 F300 M304	L245-F257 HydrophobicContact CD1-CD2 3.92Å; L252-F257 HydrophobicContact CD1-CB 4.43Å; L252-F257 HydrophobicContact CD1-CD2 4.49Å; L252-F257 HydrophobicContact CD2-CB 4.22Å; L252-F257 HydrophobicContact CD2-CD2 4.12Å; L252-F257 HydrophobicContact CD2-CG 4.15Å; L252-F257 HydrophobicContact CG-CB 4.25Å; I253-F257 PolarHBondContact O-N 2.88Å; F254-F257 WeakPolarHBondContact O-CA 3.4Å; F254-F257 WeakPolarHBondContact O-CB 3.44Å; F254-F257 PolarHBondContact O-N 2.85Å; F257-Y260 AromaticContact CD2-CD1 3.93Å; F257-Y260 HydrophobicContact CD2-CD1 3.93Å; F257-Y260 HydrophobicContact CD2-CE1 4.43Å; F257-Y260 AromaticContact CE2-CD1 3.76Å; F257-Y260 HydrophobicContact CE2-CD1 3.76Å; F257-Y260 AromaticContact CE2-CE1 3.9Å; F257-Y260 HydrophobicContact CE2-CE1 3.9Å; F257-Y260 PolarHBondContact O-N 3.39Å; F257-L261 HydrophobicContact CE1-CD2 4.11Å; F257-L261 HydrophobicContact CZ-CD2 4.4Å; F257-L261 WeakPolarHBondContact O-CB 3.37Å; F257-L261 PolarHBondContact O-N 3.18Å; F257-M287 HydrophobicContact CD1-CB 4.07Å; F257-M287 HydrophobicContact CE1-CB 3.51Å; F257-M287 HydrophobicContact CE1-CG 3.57Å; F257-M287 HydrophobicContact CE2-CE 4Å; F257-M287 HydrophobicContact CE2-CG 4.48Å; F257-M287 HydrophobicContact CZ-CB 3.95Å; F257-M287 HydrophobicContact CZ-CE 3.96Å; F257-M287 HydrophobicContact CZ-CG 3.55Å; F257-M287 HydrophobicContact CZ-SD 4.49Å; F257-F288 HydrophobicContact CB-CE2 4.03Å; F257-F288 HydrophobicContact CB-CZ 4.35Å; F257-F288 AromaticContact CD1-CE2 3.99Å; F257-F288 HydrophobicContact CD1-CE2 3.99Å; F257-F288 HydrophobicContact CG-CE2 4.17Å; F257-F300 HydrophobicContact CD2-CE2 4.01Å; F257-F300 AromaticContact CE2-CE2 3.82Å; F257-F300 HydrophobicContact CE2-CE2 3.82Å; F257-M304 HydrophobicContact CE2-SD 4.45Å
258	E	93.6	Very high	93.8	Very high	55 Å²	55	38 Å²	38	26%	0.257	22%	0.224	S	C	.	.	H	α-helix	trans	-57.6	-53.4	171.1	164.1	158.9	-130.2	0	0	111.7	F254 Y260 L261 Q262 Y279	F254-E258 HydrophobicContact CE1-CB 4.39Å; F254-E258 PolarHBondContact O-N 2.83Å; E258-Y260 VanDerWaalsContact C-N 3.3Å; E258-Y260 PolarHBondContact O-N 2.85Å; E258-L261 PolarHBondContact O-N 3.09Å; E258-L261 VanDerWaalsContact O-N 3.14Å; E258-Q262 WeakPolarHBondContact O-CG 3.25Å; E258-Q262 PolarHBondContact O-N 2.78Å; E258-Y279 VanDerWaalsContact CG-OH 3.28Å; E258-Y279 WeakPolarHBondContact CG-OH 3.46Å; E258-Y279 PolarHBondContact OE1-OH 3.13Å
259	A	93.1	Very high	93.9	Very high	40 Å²	40	34.7 Å²	34.7	33%	0.331	20%	0.198	S	C	.	.	H	α-helix	trans	-60.8	-38	177.4	0	0	0	0	0	112.6	S255 K256 Q262 D263	S255-A259 WeakPolarHBondContact O-CB 3.35Å; S255-A259 PolarHBondContact O-N 3.18Å; S255-A259 VanDerWaalsContact O-N 3.08Å; K256-A259 PolarHBondContact O-N 2.9Å; A259-Q262 PolarHBondContact O-N 3.29Å; A259-D263 PolarHBondContact O-N 3.2Å
260	Y	94.6	Very high	94	Very high	1 Å²	1	30.2 Å²	30.2	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-63.6	-42	173.4	162.1	-91.8	0	0	0	112.8	I224 H241 L245 K256 F257 E258 Q262 D263 L264 M304	I224-Y260 HydrophobicContact CD1-CD2 3.6Å; I224-Y260 HydrophobicContact CD1-CE2 4.42Å; I224-Y260 HydrophobicContact CD1-CG 4.34Å; I224-Y260 HydrophobicContact CG1-CD2 3.79Å; I224-Y260 HydrophobicContact CG1-CE2 4.18Å; I224-Y260 HydrophobicContact CG2-CD2 4.34Å; I224-Y260 HydrophobicContact CG2-CE2 4.18Å; H241-Y260 HydrophobicContact CB-CE2 3.75Å; H241-Y260 AromaticContact CG-CE2 3.61Å; H241-Y260 AromaticContact ND1-CE2 3.6Å; H241-Y260 AromaticContact ND1-CZ 3.64Å; H241-Y260 PolarHBondContact ND1-OH 2.69Å; L245-Y260 HydrophobicContact CD1-CD1 3.72Å; L245-Y260 HydrophobicContact CD1-CD2 3.82Å; L245-Y260 HydrophobicContact CD1-CE1 4.21Å; L245-Y260 HydrophobicContact CD1-CE2 4.31Å; L245-Y260 HydrophobicContact CD1-CG 3.5Å; L245-Y260 HydrophobicContact CD2-CD2 4.05Å; L245-Y260 HydrophobicContact CD2-CG 3.95Å; L245-Y260 HydrophobicContact CG-CD2 4.4Å; L245-Y260 HydrophobicContact CG-CG 4.32Å; K256-Y260 VanDerWaalsContact O-CB 3.26Å; K256-Y260 WeakPolarHBondContact O-CB 3.3Å; K256-Y260 PolarHBondContact O-N 3.1Å; F257-Y260 AromaticContact CD2-CD1 3.93Å; F257-Y260 HydrophobicContact CD2-CD1 3.93Å; F257-Y260 HydrophobicContact CD2-CE1 4.43Å; F257-Y260 AromaticContact CE2-CD1 3.76Å; F257-Y260 HydrophobicContact CE2-CD1 3.76Å; F257-Y260 AromaticContact CE2-CE1 3.9Å; F257-Y260 HydrophobicContact CE2-CE1 3.9Å; F257-Y260 PolarHBondContact O-N 3.39Å; E258-Y260 VanDerWaalsContact C-N 3.3Å; E258-Y260 PolarHBondContact O-N 2.85Å; Y260-Q262 VanDerWaalsContact C-N 3.33Å; Y260-D263 PolarHBondContact O-N 3.48Å; Y260-L264 HydrophobicContact CE1-CD2 3.94Å; Y260-L264 WeakPolarHBondContact O-CB 3.28Å; Y260-L264 PolarHBondContact O-N 2.93Å; Y260-M304 HydrophobicContact CE1-CE 4.28Å
261	L	94.6	Very high	94.1	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	15%	0.153	C	C	.	.	H	α-helix	trans	-67.6	-37.8	179.3	-173.5	54.5	0	0	0	110.6	F257 E258 L265 Y279 A283 V312 L313	F257-L261 HydrophobicContact CE1-CD2 4.11Å; F257-L261 HydrophobicContact CZ-CD2 4.4Å; F257-L261 WeakPolarHBondContact O-CB 3.37Å; F257-L261 PolarHBondContact O-N 3.18Å; E258-L261 PolarHBondContact O-N 3.09Å; E258-L261 VanDerWaalsContact O-N 3.14Å; L261-L265 HydrophobicContact CD1-CD1 3.96Å; L261-L265 HydrophobicContact CD1-CG 4.25Å; L261-L265 HydrophobicContact CG-CD1 3.96Å; L261-L265 WeakPolarHBondContact O-CB 3.25Å; L261-L265 WeakPolarHBondContact O-CD1 3.45Å; L261-L265 WeakPolarHBondContact O-CG 3.43Å; L261-L265 PolarHBondContact O-N 3.49Å; L261-Y279 HydrophobicContact CB-CD2 4.45Å; L261-Y279 HydrophobicContact CB-CE2 4.37Å; L261-Y279 HydrophobicContact CD2-CD2 4.21Å; L261-Y279 HydrophobicContact CD2-CE2 4.02Å; L261-Y279 HydrophobicContact CG-CD2 4.07Å; L261-Y279 HydrophobicContact CG-CE2 4.23Å; L261-A283 HydrophobicContact CD2-CB 3.89Å; L261-V312 HydrophobicContact CD1-CG2 4.1Å; L261-L313 HydrophobicContact CD1-CD1 4.16Å; L261-L313 HydrophobicContact CD1-CD2 3.8Å; L261-L313 HydrophobicContact CD1-CG 4.14Å
262	Q	93.6	Very high	94.1	Very high	84 Å²	84	33.8 Å²	33.8	39%	0.393	17%	0.173	S	C	.	.	H	α-helix	trans	-62.4	-49	170.9	-67.8	172	7.2	0	0	112.2	E258 A259 Y260 L264 L265 K266 Y279	E258-Q262 WeakPolarHBondContact O-CG 3.25Å; E258-Q262 PolarHBondContact O-N 2.78Å; A259-Q262 PolarHBondContact O-N 3.29Å; Y260-Q262 VanDerWaalsContact C-N 3.33Å; Q262-L264 PolarHBondContact O-N 3.48Å; Q262-L265 PolarHBondContact O-N 3.06Å; Q262-K266 PolarHBondContact O-N 3.22Å; Q262-Y279 HydrophobicContact CG-CD1 3.82Å; Q262-Y279 HydrophobicContact CG-CD2 3.83Å; Q262-Y279 HydrophobicContact CG-CE1 4.13Å; Q262-Y279 HydrophobicContact CG-CE2 4.16Å; Q262-Y279 HydrophobicContact CG-CG 3.67Å; Q262-Y279 VanDerWaalsContact NE2-CE1 3.32Å
263	D	93.7	Very high	94.1	Very high	17 Å²	17	33.5 Å²	33.5	9%	0.091	17%	0.171	C	C	.	.	H	α-helix	trans	-63.6	-38.4	176.9	-98.8	-11.6	0	0	0	112.4	G221 I224 A259 Y260 K266	G221-D263 VanDerWaalsContact CA-OD2 3.3Å; G221-D263 WeakPolarHBondContact CA-OD2 3.37Å; G221-D263 PolarHBondContact N-OD2 3.37Å; I224-D263 HydrophobicContact CD1-CB 3.66Å; A259-D263 PolarHBondContact O-N 3.2Å; Y260-D263 PolarHBondContact O-N 3.48Å; D263-K266 WeakPolarHBondContact O-CB 3.42Å; D263-K266 PolarHBondContact O-N 2.94Å; D263-K266 WeakPolarHBondContact OD1-CE 3.4Å; D263-K266 IonicContact OD1-NZ 3.62Å; D263-K266 PolarHBondContact OD1-NZ 3.45Å
264	L	95.4	Very high	93.9	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-69.1	-35.3	178.2	-178	61.5	0	0	0	112.2	I224 T228 Y260 Q262 K266 L267 L313 W315 L316	I224-L264 HydrophobicContact CG2-CB 4.21Å; I224-L264 HydrophobicContact CG2-CD1 4.12Å; T228-L264 HydrophobicContact CG2-CD1 4.21Å; Y260-L264 HydrophobicContact CE1-CD2 3.94Å; Y260-L264 WeakPolarHBondContact O-CB 3.28Å; Y260-L264 PolarHBondContact O-N 2.93Å; Q262-L264 PolarHBondContact O-N 3.48Å; L264-K266 PolarHBondContact O-N 3.29Å; L264-L267 HydrophobicContact CD1-CD1 4.15Å; L264-L267 WeakPolarHBondContact O-CB 3.28Å; L264-L267 WeakPolarHBondContact O-CG 3.32Å; L264-L267 PolarHBondContact O-N 3.08Å; L264-L313 HydrophobicContact CD2-CD1 4.17Å; L264-L313 HydrophobicContact CD2-CD2 3.69Å; L264-L313 HydrophobicContact CG-CD2 4.22Å; L264-W315 HydrophobicContact CD1-CH2 4.06Å; L264-W315 HydrophobicContact CD1-CZ2 4.37Å; L264-W315 HydrophobicContact CG-CH2 4.42Å; L264-W315 HydrophobicContact CG-CZ2 4.22Å; L264-L316 HydrophobicContact CD1-CD2 4.43Å; L264-L316 HydrophobicContact CD2-CD2 4.09Å
265	L	95.3	Very high	93.8	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-75.6	-9	176.8	-71	167.6	0	0	0	113.5	L261 Q262 L267 P268 I269 F277 Y279 V312 L313	L261-L265 HydrophobicContact CD1-CD1 3.96Å; L261-L265 HydrophobicContact CD1-CG 4.25Å; L261-L265 HydrophobicContact CG-CD1 3.96Å; L261-L265 WeakPolarHBondContact O-CB 3.25Å; L261-L265 WeakPolarHBondContact O-CD1 3.45Å; L261-L265 WeakPolarHBondContact O-CG 3.43Å; L261-L265 PolarHBondContact O-N 3.49Å; Q262-L265 PolarHBondContact O-N 3.06Å; L265-L267 PolarHBondContact O-N 2.97Å; L265-P268 HydrophobicContact CD2-CG 4.08Å; L265-P268 VanDerWaalsContact O-CD 3.24Å; L265-P268 WeakPolarHBondContact O-CD 3.23Å; L265-P268 VanDerWaalsContact O-CG 3.25Å; L265-P268 WeakPolarHBondContact O-CG 3.26Å; L265-I269 WeakPolarHBondContact O-CD1 3.48Å; L265-I269 VanDerWaalsContact O-CG1 3.28Å; L265-I269 WeakPolarHBondContact O-CG1 3.41Å; L265-I269 PolarHBondContact O-N 3.38Å; L265-F277 HydrophobicContact CD2-CB 4.36Å; L265-Y279 HydrophobicContact CD1-CD2 4.33Å; L265-V312 HydrophobicContact CD1-CB 4.44Å; L265-V312 HydrophobicContact CD1-CG2 4.23Å; L265-V312 HydrophobicContact CD2-CB 4.26Å; L265-V312 HydrophobicContact CD2-CG2 4.45Å; L265-V312 WeakPolarHBondContact CD2-O 3.26Å; L265-L313 HydrophobicContact CD2-CD2 4.24Å
266	K	94.6	Very high	93.7	Very high	43 Å²	43	33.7 Å²	33.7	19%	0.187	18%	0.18	C	C	.	.	H	α-helix	trans	-61.6	-25	164.9	-65.7	175.5	-177.1	171.5	0	112.5	A208 L209 L211 Q262 D263 L264 I269 S270	A208-K266 WeakPolarHBondContact O-CB 3.31Å; L209-K266 HydrophobicContact CD2-CB 4.42Å; L209-K266 HydrophobicContact CD2-CD 3.88Å; L211-K266 HydrophobicContact CD1-CD 4.5Å; L211-K266 HydrophobicContact CD1-CG 4.38Å; Q262-K266 PolarHBondContact O-N 3.22Å; D263-K266 WeakPolarHBondContact O-CB 3.42Å; D263-K266 PolarHBondContact O-N 2.94Å; D263-K266 WeakPolarHBondContact OD1-CE 3.4Å; D263-K266 IonicContact OD1-NZ 3.62Å; D263-K266 PolarHBondContact OD1-NZ 3.45Å; L264-K266 PolarHBondContact O-N 3.29Å; K266-I269 PolarHBondContact O-N 3.33Å; K266-S270 WeakPolarHBondContact O-CB 3.36Å; K266-S270 PolarHBondContact O-N 3.02Å
267	L	96.2	Very high	93.7	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-65.9	-54.4	179.9	-54.4	-168.9	0	0	0	113.2	L117 W204 T225 T228 L264 L265 I269 S270 W315	L117-L267 HydrophobicContact CD1-CB 4.35Å; L117-L267 HydrophobicContact CD2-CB 4.34Å; W204-L267 HydrophobicContact CH2-CD2 3.82Å; W204-L267 HydrophobicContact CZ2-CD2 4.13Å; T225-L267 HydrophobicContact CG2-CD2 3.67Å; T228-L267 HydrophobicContact CG2-CD1 3.93Å; L264-L267 HydrophobicContact CD1-CD1 4.15Å; L264-L267 WeakPolarHBondContact O-CB 3.28Å; L264-L267 WeakPolarHBondContact O-CG 3.32Å; L264-L267 PolarHBondContact O-N 3.08Å; L265-L267 PolarHBondContact O-N 2.97Å; L267-I269 VanDerWaalsContact C-N 3.32Å; L267-I269 PolarHBondContact O-N 3.24Å; L267-S270 PolarHBondContact O-N 3.05Å; L267-S270 PolarHBondContact O-OG 3.4Å; L267-W315 HydrophobicContact CB-CH2 4.05Å; L267-W315 HydrophobicContact CD1-CH2 4.19Å
268	P	96.2	Very high	93.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-36.6	172.1	21.9	-32.7	0	0	0	113.1	T113 L265 S270 V271 E273 F277 W315	T113-P268 HydrophobicContact CG2-CB 3.76Å; L265-P268 HydrophobicContact CD2-CG 4.08Å; L265-P268 VanDerWaalsContact O-CD 3.24Å; L265-P268 WeakPolarHBondContact O-CD 3.23Å; L265-P268 VanDerWaalsContact O-CG 3.25Å; L265-P268 WeakPolarHBondContact O-CG 3.26Å; P268-S270 VanDerWaalsContact C-N 3.33Å; P268-S270 PolarHBondContact O-N 3.29Å; P268-V271 VanDerWaalsContact O-CG2 3.26Å; P268-V271 WeakPolarHBondContact O-CG2 3.44Å; P268-V271 PolarHBondContact O-N 3.48Å; P268-E273 HydrophobicContact CB-CB 4.25Å; P268-E273 WeakPolarHBondContact O-CA 3.36Å; P268-E273 WeakPolarHBondContact O-CB 3.41Å; P268-E273 PolarHBondContact O-N 2.68Å; P268-F277 HydrophobicContact CB-CB 3.83Å; P268-F277 HydrophobicContact CB-CD2 4.14Å; P268-F277 HydrophobicContact CB-CG 4.36Å; P268-F277 HydrophobicContact CG-CB 3.82Å; P268-W315 HydrophobicContact CG-CZ2 4.23Å
269	I	93.6	Very high	93.4	Very high	64 Å²	64	37.2 Å²	37.2	33%	0.328	19%	0.191	S	C	.	.	H	α-helix	trans	-57.9	-46.1	174.5	-66.3	167.2	0	0	0	110.6	L265 K266 L267 V271 F272	L265-I269 WeakPolarHBondContact O-CD1 3.48Å; L265-I269 VanDerWaalsContact O-CG1 3.28Å; L265-I269 WeakPolarHBondContact O-CG1 3.41Å; L265-I269 PolarHBondContact O-N 3.38Å; K266-I269 PolarHBondContact O-N 3.33Å; L267-I269 VanDerWaalsContact C-N 3.32Å; L267-I269 PolarHBondContact O-N 3.24Å; I269-V271 PolarHBondContact O-N 3.04Å; I269-F272 PolarHBondContact O-N 2.92Å
270	S	94.1	Very high	93.3	Very high	4 Å²	4	37 Å²	37	3%	0.028	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-9.7	-179.5	78.6	0	0	0	0	115.6	W204 Y207 A208 K266 L267 P268	W204-S270 WeakPolarHBondContact CZ2-OG 3.47Å; W204-S270 PolarHBondContact NE1-OG 2.89Å; Y207-S270 WeakPolarHBondContact CE1-O 3.42Å; A208-S270 VanDerWaalsContact CB-CB 3.48Å; K266-S270 WeakPolarHBondContact O-CB 3.36Å; K266-S270 PolarHBondContact O-N 3.02Å; L267-S270 PolarHBondContact O-N 3.05Å; L267-S270 PolarHBondContact O-OG 3.4Å; P268-S270 VanDerWaalsContact C-N 3.33Å; P268-S270 PolarHBondContact O-N 3.29Å
271	V	94.2	Very high	93	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	17.8	175.2	-62.5	0	0	0	0	112.9	M98 T113 K116 L117 I120 P268 I269 E273	M98-V271 HydrophobicContact CE-CG1 4.48Å; T113-V271 HydrophobicContact CG2-CG2 4.14Å; K116-V271 HydrophobicContact CB-CB 3.92Å; K116-V271 HydrophobicContact CB-CG1 4.06Å; K116-V271 HydrophobicContact CB-CG2 4.28Å; K116-V271 HydrophobicContact CD-CB 3.9Å; K116-V271 HydrophobicContact CD-CG2 4.35Å; K116-V271 VanDerWaalsContact CD-O 3.31Å; K116-V271 WeakPolarHBondContact CD-O 3.17Å; K116-V271 PolarHBondContact NZ-O 3.34Å; L117-V271 HydrophobicContact CD2-CG1 3.76Å; L117-V271 HydrophobicContact CD2-CG2 4.46Å; L117-V271 HydrophobicContact CG-CG1 4.2Å; L117-V271 HydrophobicContact CG-CG2 4.27Å; I120-V271 HydrophobicContact CD1-CG1 3.43Å; I120-V271 VanDerWaalsContact CD1-CG1 3.43Å; P268-V271 VanDerWaalsContact O-CG2 3.26Å; P268-V271 WeakPolarHBondContact O-CG2 3.44Å; P268-V271 PolarHBondContact O-N 3.48Å; I269-V271 PolarHBondContact O-N 3.04Å; V271-E273 HydrophobicContact CG2-CB 4.39Å; V271-E273 HydrophobicContact CG2-CG 3.9Å
272	F	93.3	Very high	92.7	Very high	115 Å²	115	43 Å²	43	50%	0.504	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	31.6	179.3	-47.2	-80.1	0	0	0	114.6	L95 Y207 I269	L95-F272 HydrophobicContact CD2-CE2 3.74Å; L95-F272 HydrophobicContact CD2-CZ 4.11Å; Y207-F272 HydrophobicContact CE1-CE1 4.4Å; Y207-F272 HydrophobicContact CE1-CZ 4.28Å; Y207-F272 VanDerWaalsContact OH-CE1 3.25Å; Y207-F272 WeakPolarHBondContact OH-CE1 3.45Å; I269-F272 PolarHBondContact O-N 2.92Å
273	E	94.6	Very high	92.4	Very high	3 Å²	3	39.4 Å²	39.4	1%	0.014	20%	0.201	C	C	.	.			trans	-112.9	10.2	-179.1	-56.5	-69.4	164.9	0	0	112.9	R112 T113 K116 P268 V271 T275 N276 F277	R112-E273 VanDerWaalsContact CD-OE1 3.28Å; R112-E273 WeakPolarHBondContact CD-OE1 3.43Å; R112-E273 WeakPolarHBondContact CG-OE1 3.32Å; R112-E273 IonicContact CZ-OE1 2.71Å; R112-E273 IonicContact CZ-OE2 2.7Å; R112-E273 VanDerWaalsContact NE-CD 3.31Å; R112-E273 IonicContact NE-OE1 3.22Å; R112-E273 PolarHBondContact NE-OE1 3.4Å; R112-E273 IonicContact NE-OE2 2.7Å; R112-E273 PolarHBondContact NE-OE2 3.44Å; R112-E273 VanDerWaalsContact NE-OE2 3.15Å; R112-E273 IonicContact NH2-OE1 2.7Å; R112-E273 IonicContact NH2-OE2 3.59Å; R112-E273 PolarHBondContact NH2-OE2 2.82Å; T113-E273 HydrophobicContact CG2-CB 4.3Å; T113-E273 HydrophobicContact CG2-CG 4.31Å; T113-E273 WeakPolarHBondContact OG1-CB 3.29Å; T113-E273 VanDerWaalsContact OG1-CG 3.24Å; T113-E273 WeakPolarHBondContact OG1-CG 3.39Å; K116-E273 IonicContact NZ-OE1 3.71Å; K116-E273 PolarHBondContact NZ-OE1 3.27Å; P268-E273 HydrophobicContact CB-CB 4.25Å; P268-E273 WeakPolarHBondContact O-CA 3.36Å; P268-E273 WeakPolarHBondContact O-CB 3.41Å; P268-E273 PolarHBondContact O-N 2.68Å; V271-E273 HydrophobicContact CG2-CB 4.39Å; V271-E273 HydrophobicContact CG2-CG 3.9Å; E273-T275 PolarHBondContact O-N 3.09Å; E273-T275 VanDerWaalsContact O-N 3.15Å; E273-N276 WeakPolarHBondContact O-CB 3.26Å; E273-N276 PolarHBondContact O-N 3.03Å; E273-N276 PolarHBondContact OE2-ND2 3.3Å; E273-F277 HydrophobicContact CB-CD2 4.22Å; E273-F277 PolarHBondContact O-N 2.76Å
274	G	88.6	Confident	92.2	Very high	24 Å²	24	38.6 Å²	38.6	25%	0.247	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-19.5	-177.6	0	0	0	0	0	115.3	N276	G274-N276 VanDerWaalsContact C-N 3.32Å
275	T	90.1	Very high	91.8	Very high	112 Å²	112	43.4 Å²	43.4	69%	0.687	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-23.3	170.8	48.5	0	0	0	0	113.1	E273	E273-T275 PolarHBondContact O-N 3.09Å; E273-T275 VanDerWaalsContact O-N 3.15Å
276	N	91.1	Very high	91.4	Very high	71 Å²	71	47 Å²	47	38%	0.38	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-30.6	178	-56.1	-67.1	0	0	0	111.8	A109 R112 E273 G274	A109-N276 HydrophobicContact CB-CB 3.8Å; R112-N276 PolarHBondContact NH2-ND2 2.68Å; E273-N276 WeakPolarHBondContact O-CB 3.26Å; E273-N276 PolarHBondContact O-N 3.03Å; E273-N276 PolarHBondContact OE2-ND2 3.3Å; G274-N276 VanDerWaalsContact C-N 3.32Å
277	F	92.8	Very high	90.9	Very high	15 Å²	15	45.1 Å²	45.1	7%	0.066	23%	0.233	C	C	.	.	S	Bend	trans	-135.2	95.4	-176.5	-51.7	-69.8	0	0	0	110.8	A109 A110 T113 L265 P268 E273 V314 W315	A109-F277 HydrophobicContact CB-CE2 4.03Å; A109-F277 HydrophobicContact CB-CZ 4.15Å; A110-F277 HydrophobicContact CB-CZ 3.92Å; T113-F277 HydrophobicContact CG2-CD2 4.39Å; T113-F277 VanDerWaalsContact OG1-CE2 3.25Å; T113-F277 WeakPolarHBondContact OG1-CE2 3.5Å; L265-F277 HydrophobicContact CD2-CB 4.36Å; P268-F277 HydrophobicContact CB-CB 3.83Å; P268-F277 HydrophobicContact CB-CD2 4.14Å; P268-F277 HydrophobicContact CB-CG 4.36Å; P268-F277 HydrophobicContact CG-CB 3.82Å; E273-F277 HydrophobicContact CB-CD2 4.22Å; E273-F277 PolarHBondContact O-N 2.76Å; F277-V314 HydrophobicContact CE1-CG1 3.61Å; F277-V314 HydrophobicContact CZ-CG1 4.19Å; F277-W315 AromaticContact CD1-CD1 3.76Å; F277-W315 HydrophobicContact CE2-CB 4.38Å; F277-W315 AromaticContact CG-CD1 3.65Å; F277-W315 HydrophobicContact CZ-CB 4.48Å
278	Y	89	Confident	90.5	Very high	131 Å²	131	47 Å²	47	51%	0.514	24%	0.241	S	C	.	.			trans	-125.3	165.4	178.7	56.3	-84.3	0	0	0	111.3	T280	Y278-T280 HydrophobicContact CD2-CG2 3.82Å; Y278-T280 HydrophobicContact CE2-CG2 3.49Å; Y278-T280 VanDerWaalsContact CE2-CG2 3.49Å
279	Y	92.7	Very high	89.6	Confident	52 Å²	52	51.6 Å²	51.6	20%	0.204	27%	0.27	C	S	.	.			trans	-77.9	135.5	177.1	179.4	-109	0	0	0	111.3	E258 L261 Q262 L265 P281 S284	E258-Y279 VanDerWaalsContact CG-OH 3.28Å; E258-Y279 WeakPolarHBondContact CG-OH 3.46Å; E258-Y279 PolarHBondContact OE1-OH 3.13Å; L261-Y279 HydrophobicContact CB-CD2 4.45Å; L261-Y279 HydrophobicContact CB-CE2 4.37Å; L261-Y279 HydrophobicContact CD2-CD2 4.21Å; L261-Y279 HydrophobicContact CD2-CE2 4.02Å; L261-Y279 HydrophobicContact CG-CD2 4.07Å; L261-Y279 HydrophobicContact CG-CE2 4.23Å; Q262-Y279 HydrophobicContact CG-CD1 3.82Å; Q262-Y279 HydrophobicContact CG-CD2 3.83Å; Q262-Y279 HydrophobicContact CG-CE1 4.13Å; Q262-Y279 HydrophobicContact CG-CE2 4.16Å; Q262-Y279 HydrophobicContact CG-CG 3.67Å; Q262-Y279 VanDerWaalsContact NE2-CE1 3.32Å; L265-Y279 HydrophobicContact CD1-CD2 4.33Å; Y279-P281 HydrophobicContact CE1-CG 4.26Å; Y279-S284 WeakPolarHBondContact OH-CB 3.47Å; Y279-S284 PolarHBondContact OH-OG 3.41Å
280	T	90.5	Very high	88.6	Confident	36 Å²	36	51.4 Å²	51.4	22%	0.221	28%	0.284	C	S	.	.			trans	-130.9	143.7	165.7	64.5	0	0	0	0	109.2	Y278 Q282 A283	Y278-T280 HydrophobicContact CD2-CG2 3.82Å; Y278-T280 HydrophobicContact CE2-CG2 3.49Å; Y278-T280 VanDerWaalsContact CE2-CG2 3.49Å; T280-Q282 PolarHBondContact O-N 3.32Å; T280-A283 WeakPolarHBondContact O-CB 3.27Å; T280-A283 PolarHBondContact O-N 2.69Å; T280-A283 PolarHBondContact OG1-N 2.73Å
281	P	89.6	Confident	87.1	Confident	38 Å²	38	63.7 Å²	63.7	25%	0.247	33%	0.329	C	S	.	.	H	α-helix	trans	-59.8	-27.2	176.2	-29	39.6	0	0	0	113.7	Y279 A283 S284 Q285 P1048	Y279-P281 HydrophobicContact CE1-CG 4.26Å; P281-A283 VanDerWaalsContact C-N 3.25Å; P281-A283 PolarHBondContact O-N 3.09Å; P281-S284 PolarHBondContact O-N 3.43Å; P281-S284 PolarHBondContact O-OG 3.26Å; P281-Q285 WeakPolarHBondContact O-CB 3.5Å; P281-Q285 WeakPolarHBondContact O-CG 3.28Å; P281-Q285 PolarHBondContact O-N 2.83Å; P281-P1048 HydrophobicContact CG-CB 3.97Å
282	Q	87.7	Confident	85.8	Confident	92 Å²	92	64.9 Å²	64.9	43%	0.43	34%	0.338	S	S	.	.	H	α-helix	trans	-63.9	-31	172.8	-62.3	81.8	-3.4	0	0	111.9	T280 Q285 T286	T280-Q282 PolarHBondContact O-N 3.32Å; Q282-Q285 PolarHBondContact O-N 2.89Å; Q282-T286 WeakPolarHBondContact O-CB 3.32Å; Q282-T286 VanDerWaalsContact O-CG2 3.32Å; Q282-T286 WeakPolarHBondContact O-CG2 3.2Å; Q282-T286 PolarHBondContact O-N 2.89Å; Q282-T286 PolarHBondContact O-OG1 3.4Å
283	A	87.5	Confident	84.8	Confident	7 Å²	7	68.8 Å²	68.8	6%	0.058	35%	0.354	C	S	.	.	H	α-helix	trans	-72.8	-26	177.5	0	0	0	0	0	113.2	L261 T280 P281 T286 V312	L261-A283 HydrophobicContact CD2-CB 3.89Å; T280-A283 WeakPolarHBondContact O-CB 3.27Å; T280-A283 PolarHBondContact O-N 2.69Å; T280-A283 PolarHBondContact OG1-N 2.73Å; P281-A283 VanDerWaalsContact C-N 3.25Å; P281-A283 PolarHBondContact O-N 3.09Å; A283-T286 PolarHBondContact O-OG1 3.18Å; A283-V312 HydrophobicContact CB-CG1 3.98Å; A283-V312 HydrophobicContact CB-CG2 3.94Å
284	S	89.2	Confident	84.3	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.007	38%	0.382	C	S	.	.	H	α-helix	trans	-81.7	-40.9	169.1	59.4	0	0	0	0	111.6	F254 Y279 P281 T286 M287	F254-S284 WeakPolarHBondContact CZ-OG 3.34Å; Y279-S284 WeakPolarHBondContact OH-CB 3.47Å; Y279-S284 PolarHBondContact OH-OG 3.41Å; P281-S284 PolarHBondContact O-N 3.43Å; P281-S284 PolarHBondContact O-OG 3.26Å; S284-T286 PolarHBondContact O-N 2.95Å; S284-M287 PolarHBondContact O-N 2.99Å
285	Q	87.6	Confident	84.4	Confident	101 Å²	101	72.8 Å²	72.8	47%	0.472	37%	0.37	S	S	.	.	H	α-helix	trans	-61	-41.2	177.4	-69.6	166.9	10.4	0	0	113.6	F254 P281 Q282 M287 F288 T289	F254-Q285 HydrophobicContact CE2-CG 4.39Å; F254-Q285 HydrophobicContact CZ-CG 4.28Å; P281-Q285 WeakPolarHBondContact O-CB 3.5Å; P281-Q285 WeakPolarHBondContact O-CG 3.28Å; P281-Q285 PolarHBondContact O-N 2.83Å; Q282-Q285 PolarHBondContact O-N 2.89Å; Q285-M287 PolarHBondContact O-N 3.28Å; Q285-F288 CarbonylContact O-C 3.54Å; Q285-F288 WeakPolarHBondContact O-CA 3.27Å; Q285-F288 PolarHBondContact O-N 2.75Å; Q285-T289 PolarHBondContact O-N 2.81Å; Q285-T289 VanDerWaalsContact O-N 3.08Å
286	T	85.4	Confident	84.6	Confident	76 Å²	76	70.6 Å²	70.6	47%	0.466	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-22	178.8	43.1	0	0	0	0	113.8	Q282 A283 S284 F288 T289	Q282-T286 WeakPolarHBondContact O-CB 3.32Å; Q282-T286 VanDerWaalsContact O-CG2 3.32Å; Q282-T286 WeakPolarHBondContact O-CG2 3.2Å; Q282-T286 PolarHBondContact O-N 2.89Å; Q282-T286 PolarHBondContact O-OG1 3.4Å; A283-T286 PolarHBondContact O-OG1 3.18Å; S284-T286 PolarHBondContact O-N 2.95Å; T286-F288 VanDerWaalsContact C-N 3.25Å; T286-F288 PolarHBondContact O-N 3.17Å; T286-T289 PolarHBondContact O-OG1 3.06Å
287	M	84.8	Confident	84.8	Confident	3 Å²	3	69.6 Å²	69.6	2%	0.015	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-10.6	171.9	-82.8	-73.9	-68.4	0	0	113.9	F257 S284 Q285 F300 R303 M304 P310	F257-M287 HydrophobicContact CD1-CB 4.07Å; F257-M287 HydrophobicContact CE1-CB 3.51Å; F257-M287 HydrophobicContact CE1-CG 3.57Å; F257-M287 HydrophobicContact CE2-CE 4Å; F257-M287 HydrophobicContact CE2-CG 4.48Å; F257-M287 HydrophobicContact CZ-CB 3.95Å; F257-M287 HydrophobicContact CZ-CE 3.96Å; F257-M287 HydrophobicContact CZ-CG 3.55Å; F257-M287 HydrophobicContact CZ-SD 4.49Å; S284-M287 PolarHBondContact O-N 2.99Å; Q285-M287 PolarHBondContact O-N 3.28Å; M287-F300 HydrophobicContact CE-CD2 3.52Å; M287-F300 HydrophobicContact CE-CE2 3.8Å; M287-R303 HydrophobicContact CE-CB 4.13Å; M287-R303 PolarHBondContact O-NH1 3.48Å; M287-R303 HydrophobicContact SD-CB 3.6Å; M287-R303 VanDerWaalsContact SD-CB 3.6Å; M287-R303 HydrophobicContact SD-CG 4.43Å; M287-M304 HydrophobicContact CE-CG 3.73Å; M287-M304 HydrophobicContact CE-SD 3.68Å; M287-M304 HydrophobicContact SD-SD 4.13Å; M287-P310 HydrophobicContact CG-CG 4.21Å; M287-P310 HydrophobicContact SD-CG 3.99Å
288	F	86.9	Confident	84.8	Confident	40 Å²	40	73.5 Å²	73.5	18%	0.175	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-6.7	176.3	-71.2	-99.4	0	0	0	113.8	L252 F254 F257 Q285 T286 G290 V295	L252-F288 HydrophobicContact CB-CE1 4.41Å; L252-F288 HydrophobicContact CB-CZ 4.17Å; L252-F288 HydrophobicContact CD2-CE1 4.37Å; L252-F288 HydrophobicContact CD2-CE2 3.94Å; L252-F288 HydrophobicContact CD2-CZ 3.6Å; L252-F288 HydrophobicContact CG-CE1 4.49Å; L252-F288 HydrophobicContact CG-CZ 3.77Å; F254-F288 HydrophobicContact CB-CE1 4.31Å; F254-F288 HydrophobicContact CB-CE2 4.32Å; F254-F288 HydrophobicContact CB-CZ 4.04Å; F254-F288 HydrophobicContact CD2-CD1 4.41Å; F254-F288 AromaticContact CD2-CD2 3.51Å; F254-F288 HydrophobicContact CD2-CD2 3.51Å; F254-F288 AromaticContact CD2-CE2 3.65Å; F254-F288 HydrophobicContact CD2-CE2 3.65Å; F254-F288 AromaticContact CD2-CG 3.92Å; F254-F288 HydrophobicContact CD2-CG 3.92Å; F254-F288 HydrophobicContact CD2-CZ 4.16Å; F254-F288 AromaticContact CE2-CD2 3.99Å; F254-F288 HydrophobicContact CE2-CD2 3.99Å; F254-F288 HydrophobicContact CE2-CE2 4.38Å; F254-F288 HydrophobicContact CG-CE2 4.38Å; F257-F288 HydrophobicContact CB-CE2 4.03Å; F257-F288 HydrophobicContact CB-CZ 4.35Å; F257-F288 AromaticContact CD1-CE2 3.99Å; F257-F288 HydrophobicContact CD1-CE2 3.99Å; F257-F288 HydrophobicContact CG-CE2 4.17Å; Q285-F288 CarbonylContact O-C 3.54Å; Q285-F288 WeakPolarHBondContact O-CA 3.27Å; Q285-F288 PolarHBondContact O-N 2.75Å; T286-F288 VanDerWaalsContact C-N 3.25Å; T286-F288 PolarHBondContact O-N 3.17Å; F288-G290 PolarHBondContact O-N 3.1Å; F288-V295 HydrophobicContact CD1-CG2 3.92Å; F288-V295 HydrophobicContact CE1-CG2 4.15Å; F288-V295 HydrophobicContact CG-CG2 4.43Å
289	T	78.9	Confident	85	Confident	97 Å²	97	70.2 Å²	70.2	60%	0.595	36%	0.359	S	S	*	.			trans	-66	123.7	169.6	51.3	0	0	0	0	110.6	Q285 T286	Q285-T289 PolarHBondContact O-N 2.81Å; Q285-T289 VanDerWaalsContact O-N 3.08Å; T286-T289 PolarHBondContact O-OG1 3.06Å
290	G	71	Confident	85	Confident	60 Å²	60	67.8 Å²	67.8	62%	0.619	35%	0.349	S	S	*	.	S	Bend	trans	161.7	-172.3	-178	0	0	0	0	0	112.9	F288	F288-G290 PolarHBondContact O-N 3.1Å
291	R	63.3	Low	85.2	Confident	262 Å²	262	66.2 Å²	66.2	99%	0.989	34%	0.34	S	S	*	.	S	Bend	trans	-78.8	-21.2	176	-65.8	179.5	-179.6	154.6	0.2	113.1
292	S	67.1	Low	85.2	Confident	26 Å²	26	70 Å²	70	18%	0.182	36%	0.358	C	S	.	.			trans	-99.3	113.7	-177.8	40.1	0	0	0	0	110.5	N294 E299 R303	S292-N294 PolarHBondContact O-N 3.38Å; S292-E299 WeakPolarHBondContact CB-OE2 3.25Å; S292-E299 PolarHBondContact OG-OE1 3.39Å; S292-E299 PolarHBondContact OG-OE2 2.91Å; S292-R303 PolarHBondContact OG-NH2 3.02Å; S292-R303 VanDerWaalsContact OG-NH2 3.1Å
293	K	71.8	Confident	85.3	Confident	197 Å²	197	68 Å²	68	86%	0.857	35%	0.347	S	S	*	.	S	Bend	trans	-66.3	-27.6	166.7	-67.5	-169.8	177.4	-173.1	0	111.9
294	N	85.4	Confident	85.4	Confident	111 Å²	111	68 Å²	68	59%	0.594	35%	0.345	S	S	*	.	S	Bend	trans	-108.5	99.4	-178.6	-59.3	-9.8	0	0	0	109.1	A251 S292 V296	A251-N294 HydrophobicContact CB-CB 4.12Å; S292-N294 PolarHBondContact O-N 3.38Å; N294-V296 PolarHBondContact O-N 3.41Å
295	V	90.8	Very high	85.4	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.364	C	S	.	.			trans	-77.9	117.8	179.1	-172.6	0	0	0	0	109.3	L252 F288 E299 F300	L252-V295 HydrophobicContact CB-CB 4.05Å; L252-V295 WeakPolarHBondContact CB-O 3.35Å; L252-V295 HydrophobicContact CD2-CB 4.26Å; L252-V295 HydrophobicContact CD2-CG1 4.4Å; L252-V295 PolarHBondContact N-O 2.84Å; F288-V295 HydrophobicContact CD1-CG2 3.92Å; F288-V295 HydrophobicContact CE1-CG2 4.15Å; F288-V295 HydrophobicContact CG-CG2 4.43Å; V295-E299 HydrophobicContact CG1-CB 3.88Å; V295-F300 HydrophobicContact CG1-CB 4.18Å
296	V	93.9	Very high	85.3	Confident	67 Å²	67	68.9 Å²	68.9	41%	0.406	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-93.3	170	178.4	-63.6	0	0	0	0	111.9	N294 E298 E299 F300	N294-V296 PolarHBondContact O-N 3.41Å; V296-E298 PolarHBondContact O-N 2.89Å; V296-E299 HydrophobicContact CG2-CB 4.33Å; V296-E299 HydrophobicContact CG2-CG 3.94Å; V296-E299 PolarHBondContact O-N 2.98Å; V296-E299 VanDerWaalsContact O-N 3.13Å; V296-F300 PolarHBondContact O-N 2.97Å
297	L	94.9	Very high	84.6	Confident	49 Å²	49	71.6 Å²	71.6	26%	0.257	37%	0.368	S	S	.	.	H	α-helix	trans	-50.7	-50	-173.2	176.1	62.1	0	0	0	114.2	R239 F242 F300 L301	R239-L297 HydrophobicContact CG-CD1 4.02Å; R239-L297 HydrophobicContact CG-CD2 4.24Å; F242-L297 HydrophobicContact CB-CD1 3.6Å; F242-L297 HydrophobicContact CD1-CB 3.97Å; F242-L297 HydrophobicContact CD1-CD1 3.66Å; F242-L297 HydrophobicContact CD1-CG 4.35Å; F242-L297 HydrophobicContact CD2-CD1 4.13Å; F242-L297 HydrophobicContact CE1-CB 3.8Å; F242-L297 HydrophobicContact CE1-CD1 4.37Å; F242-L297 HydrophobicContact CG-CB 4.41Å; F242-L297 HydrophobicContact CG-CD1 3.52Å; F242-L297 HydrophobicContact CZ-CB 4.12Å; F242-L297 VanDerWaalsContact CZ-N 3.31Å; L297-F300 WeakPolarHBondContact O-CB 3.27Å; L297-F300 PolarHBondContact O-N 3.41Å; L297-L301 HydrophobicContact CD1-CD1 3.92Å; L297-L301 HydrophobicContact CD1-CG 4.09Å; L297-L301 HydrophobicContact CG-CD1 3.92Å; L297-L301 HydrophobicContact CG-CG 4.49Å; L297-L301 VanDerWaalsContact O-CG 3.27Å; L297-L301 WeakPolarHBondContact O-CG 3.29Å; L297-L301 PolarHBondContact O-N 2.86Å
298	E	93	Very high	83.9	Confident	97 Å²	97	79.5 Å²	79.5	45%	0.453	41%	0.405	S	S	.	.	H	α-helix	trans	-70.8	-34.4	-176.7	-56.1	-56.1	129.3	0	0	111.6	R239 V296 L301 D302	R239-E298 IonicContact CZ-OE1 2.7Å; R239-E298 IonicContact CZ-OE2 2.7Å; R239-E298 IonicContact NE-OE1 3.74Å; R239-E298 IonicContact NH2-OE1 3.8Å; R239-E298 PolarHBondContact NH2-OE1 3.05Å; R239-E298 IonicContact NH2-OE2 3.1Å; R239-E298 PolarHBondContact NH2-OE2 3.36Å; V296-E298 PolarHBondContact O-N 2.89Å; E298-L301 PolarHBondContact O-N 3.49Å; E298-D302 WeakPolarHBondContact O-CB 3.23Å; E298-D302 PolarHBondContact O-N 2.97Å
299	E	92.5	Very high	83.1	Confident	63 Å²	63	77.9 Å²	77.9	29%	0.294	40%	0.4	S	S	.	.	H	α-helix	trans	-65.9	-37.8	171.5	-67.8	-171	-164.7	0	0	112.4	S292 V295 V296 R303	S292-E299 WeakPolarHBondContact CB-OE2 3.25Å; S292-E299 PolarHBondContact OG-OE1 3.39Å; S292-E299 PolarHBondContact OG-OE2 2.91Å; V295-E299 HydrophobicContact CG1-CB 3.88Å; V296-E299 HydrophobicContact CG2-CB 4.33Å; V296-E299 HydrophobicContact CG2-CG 3.94Å; V296-E299 PolarHBondContact O-N 2.98Å; V296-E299 VanDerWaalsContact O-N 3.13Å; E299-R303 WeakPolarHBondContact O-CB 3.4Å; E299-R303 WeakPolarHBondContact O-CG 3.42Å; E299-R303 PolarHBondContact O-N 3.18Å; E299-R303 IonicContact OE2-CZ 2.97Å; E299-R303 IonicContact OE2-NH2 2.72Å; E299-R303 PolarHBondContact OE2-NH2 3.29Å
300	F	93.2	Very high	83.2	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-64.3	-43.1	174.4	170.6	-99	0	0	0	111.2	F238 F242 L245 L252 F257 M287 V295 V296 L297 R303 M304	F238-F300 HydrophobicContact CB-CE1 4.01Å; F238-F300 WeakPolarHBondContact O-CE1 3.29Å; F242-F300 HydrophobicContact CB-CD1 4.07Å; F242-F300 HydrophobicContact CB-CE1 4.06Å; F242-F300 HydrophobicContact CD2-CB 3.75Å; F242-F300 AromaticContact CD2-CD1 3.56Å; F242-F300 HydrophobicContact CD2-CD1 3.56Å; F242-F300 HydrophobicContact CD2-CD2 4.21Å; F242-F300 HydrophobicContact CD2-CE1 4.16Å; F242-F300 AromaticContact CD2-CG 3.58Å; F242-F300 HydrophobicContact CD2-CG 3.58Å; F242-F300 HydrophobicContact CE2-CB 3.79Å; F242-F300 HydrophobicContact CE2-CD1 4.45Å; F242-F300 HydrophobicContact CE2-CG 4.09Å; F242-F300 HydrophobicContact CG-CD1 4.23Å; L245-F300 HydrophobicContact CD1-CZ 4.5Å; L252-F300 HydrophobicContact CD1-CD2 4.27Å; L252-F300 HydrophobicContact CD1-CE2 4.39Å; L252-F300 HydrophobicContact CD2-CD2 3.84Å; L252-F300 HydrophobicContact CD2-CE2 4.36Å; F257-F300 HydrophobicContact CD2-CE2 4.01Å; F257-F300 AromaticContact CE2-CE2 3.82Å; F257-F300 HydrophobicContact CE2-CE2 3.82Å; M287-F300 HydrophobicContact CE-CD2 3.52Å; M287-F300 HydrophobicContact CE-CE2 3.8Å; V295-F300 HydrophobicContact CG1-CB 4.18Å; V296-F300 PolarHBondContact O-N 2.97Å; L297-F300 WeakPolarHBondContact O-CB 3.27Å; L297-F300 PolarHBondContact O-N 3.41Å; F300-R303 PolarHBondContact O-N 3.18Å; F300-M304 HydrophobicContact CD1-CG 4.44Å; F300-M304 HydrophobicContact CD2-CG 4.05Å; F300-M304 HydrophobicContact CE1-CG 4.18Å; F300-M304 HydrophobicContact CE2-CG 3.76Å; F300-M304 HydrophobicContact CE2-SD 4.25Å; F300-M304 HydrophobicContact CG-CG 4.39Å; F300-M304 HydrophobicContact CZ-CE 4.41Å; F300-M304 HydrophobicContact CZ-CG 3.84Å; F300-M304 HydrophobicContact CZ-SD 4.48Å; F300-M304 VanDerWaalsContact O-CB 3.31Å; F300-M304 WeakPolarHBondContact O-CB 3.44Å; F300-M304 WeakPolarHBondContact O-CG 3.24Å; F300-M304 PolarHBondContact O-N 2.73Å
301	L	94.1	Very high	83.8	Confident	4 Å²	4	76.5 Å²	76.5	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-65.5	-45.5	176.3	-70.5	168.6	0	0	0	111.8	F238 R239 L297 E298 R303 M304 L305	F238-L301 HydrophobicContact CB-CD2 3.6Å; R239-L301 HydrophobicContact CG-CD1 3.82Å; R239-L301 HydrophobicContact CG-CD2 4.19Å; R239-L301 VanDerWaalsContact NH2-CD1 3.31Å; L297-L301 HydrophobicContact CD1-CD1 3.92Å; L297-L301 HydrophobicContact CD1-CG 4.09Å; L297-L301 HydrophobicContact CG-CD1 3.92Å; L297-L301 HydrophobicContact CG-CG 4.49Å; L297-L301 VanDerWaalsContact O-CG 3.27Å; L297-L301 WeakPolarHBondContact O-CG 3.29Å; L297-L301 PolarHBondContact O-N 2.86Å; E298-L301 PolarHBondContact O-N 3.49Å; L301-R303 VanDerWaalsContact C-N 3.33Å; L301-R303 PolarHBondContact O-N 3.03Å; L301-M304 PolarHBondContact O-N 2.64Å; L301-L305 HydrophobicContact CB-CD1 4.3Å; L301-L305 HydrophobicContact CD2-CD1 4.23Å; L301-L305 WeakPolarHBondContact O-CB 3.36Å; L301-L305 WeakPolarHBondContact O-CG 3.33Å; L301-L305 PolarHBondContact O-N 3.4Å
302	D	90.9	Very high	85	Confident	117 Å²	117	65.2 Å²	65.2	63%	0.626	33%	0.333	S	S	*	.	H	α-helix	trans	-58.9	-43.8	176.6	-79.6	-17.5	0	0	0	111.1	E298 S306	E298-D302 WeakPolarHBondContact O-CB 3.23Å; E298-D302 PolarHBondContact O-N 2.97Å; D302-S306 WeakPolarHBondContact O-CA 3.3Å; D302-S306 WeakPolarHBondContact O-CB 3.26Å; D302-S306 PolarHBondContact O-N 3.27Å
303	R	89.3	Confident	86.2	Confident	51 Å²	51	64.4 Å²	64.4	19%	0.192	33%	0.326	C	S	.	.	H	α-helix	trans	-65	-49.6	176.4	-66.1	168.8	-153.2	-148.8	1	111.6	M287 S292 E299 F300 L301 L305 S306	M287-R303 HydrophobicContact CE-CB 4.13Å; M287-R303 PolarHBondContact O-NH1 3.48Å; M287-R303 HydrophobicContact SD-CB 3.6Å; M287-R303 VanDerWaalsContact SD-CB 3.6Å; M287-R303 HydrophobicContact SD-CG 4.43Å; S292-R303 PolarHBondContact OG-NH2 3.02Å; S292-R303 VanDerWaalsContact OG-NH2 3.1Å; E299-R303 WeakPolarHBondContact O-CB 3.4Å; E299-R303 WeakPolarHBondContact O-CG 3.42Å; E299-R303 PolarHBondContact O-N 3.18Å; E299-R303 IonicContact OE2-CZ 2.97Å; E299-R303 IonicContact OE2-NH2 2.72Å; E299-R303 PolarHBondContact OE2-NH2 3.29Å; F300-R303 PolarHBondContact O-N 3.18Å; L301-R303 VanDerWaalsContact C-N 3.33Å; L301-R303 PolarHBondContact O-N 3.03Å; R303-L305 VanDerWaalsContact C-N 3.34Å; R303-L305 PolarHBondContact O-N 3.23Å; R303-S306 PolarHBondContact O-OG 3.45Å
304	M	90.2	Very high	87.2	Confident	6 Å²	6	55.7 Å²	55.7	3%	0.03	29%	0.29	C	S	.	.	H	α-helix	trans	-72.8	-18.6	-177.2	-66	-70.5	-71.8	0	0	114.8	F238 F257 Y260 M287 F300 L301 L313	F238-M304 HydrophobicContact CD1-CE 3.85Å; F238-M304 HydrophobicContact CD2-CB 3.98Å; F238-M304 HydrophobicContact CE1-CE 3.4Å; F238-M304 HydrophobicContact CE2-CB 4.02Å; F238-M304 HydrophobicContact CG-CB 4.3Å; F238-M304 HydrophobicContact CZ-CB 4.37Å; F238-M304 HydrophobicContact CZ-CE 3.82Å; F257-M304 HydrophobicContact CE2-SD 4.45Å; Y260-M304 HydrophobicContact CE1-CE 4.28Å; M287-M304 HydrophobicContact CE-CG 3.73Å; M287-M304 HydrophobicContact CE-SD 3.68Å; M287-M304 HydrophobicContact SD-SD 4.13Å; F300-M304 HydrophobicContact CD1-CG 4.44Å; F300-M304 HydrophobicContact CD2-CG 4.05Å; F300-M304 HydrophobicContact CE1-CG 4.18Å; F300-M304 HydrophobicContact CE2-CG 3.76Å; F300-M304 HydrophobicContact CE2-SD 4.25Å; F300-M304 HydrophobicContact CG-CG 4.39Å; F300-M304 HydrophobicContact CZ-CE 4.41Å; F300-M304 HydrophobicContact CZ-CG 3.84Å; F300-M304 HydrophobicContact CZ-SD 4.48Å; F300-M304 VanDerWaalsContact O-CB 3.31Å; F300-M304 WeakPolarHBondContact O-CB 3.44Å; F300-M304 WeakPolarHBondContact O-CG 3.24Å; F300-M304 PolarHBondContact O-N 2.73Å; L301-M304 PolarHBondContact O-N 2.64Å; M304-L313 HydrophobicContact CE-CD1 3.62Å; M304-L313 HydrophobicContact SD-CD1 4.06Å
305	L	89.6	Confident	87.7	Confident	75 Å²	75	50.5 Å²	50.5	39%	0.393	26%	0.262	S	S	.	.	H	α-helix	trans	-111.9	-2.3	179.6	-62.4	169.8	0	0	0	113.7	P234 A235 F238 L301 R303	P234-L305 HydrophobicContact CB-CD2 3.63Å; A235-L305 HydrophobicContact CB-CD1 3.79Å; F238-L305 HydrophobicContact CD2-CD2 3.69Å; F238-L305 HydrophobicContact CD2-CG 4.05Å; F238-L305 HydrophobicContact CE2-CD2 3.73Å; F238-L305 HydrophobicContact CE2-CG 4.37Å; L301-L305 HydrophobicContact CB-CD1 4.3Å; L301-L305 HydrophobicContact CD2-CD1 4.23Å; L301-L305 WeakPolarHBondContact O-CB 3.36Å; L301-L305 WeakPolarHBondContact O-CG 3.33Å; L301-L305 PolarHBondContact O-N 3.4Å; R303-L305 VanDerWaalsContact C-N 3.34Å; R303-L305 PolarHBondContact O-N 3.23Å
306	S	85.2	Confident	87.9	Confident	46 Å²	46	50.6 Å²	50.6	32%	0.322	26%	0.263	S	S	.	.	S	Bend	trans	-59	148.9	173.9	61.9	0	0	0	0	111.3	D302 R303 Q308 G309	D302-S306 WeakPolarHBondContact O-CA 3.3Å; D302-S306 WeakPolarHBondContact O-CB 3.26Å; D302-S306 PolarHBondContact O-N 3.27Å; R303-S306 PolarHBondContact O-OG 3.45Å; S306-Q308 PolarHBondContact O-N 2.97Å; S306-G309 PolarHBondContact O-N 3.01Å; S306-G309 WeakPolarHBondContact OG-CA 3.03Å; S306-G309 PolarHBondContact OG-N 2.73Å
307	D	70.5	Confident	87.9	Confident	132 Å²	132	50.2 Å²	50.2	71%	0.706	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-43.5	175.5	-69	-53	0	0	0	110.2	G309 W445	D307-G309 PolarHBondContact O-N 3.49Å; D307-W445 WeakPolarHBondContact O-CH2 3.44Å; D307-W445 WeakPolarHBondContact O-CZ3 3.25Å
308	Q	70.2	Confident	87.9	Confident	169 Å²	169	48.2 Å²	48.2	79%	0.79	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	34.7	174	-63	-177.6	-15.1	0	0	113.3	S306 W445	S306-Q308 PolarHBondContact O-N 2.97Å; Q308-W445 HydrophobicContact CG-CH2 4.43Å
309	G	70.1	Confident	88	Confident	7 Å²	7	43.7 Å²	43.7	7%	0.072	23%	0.229	C	C	.	.			trans	-56.7	160.7	179.8	0	0	0	0	0	113.2	S306 D307 Q311	S306-G309 PolarHBondContact O-N 3.01Å; S306-G309 WeakPolarHBondContact OG-CA 3.03Å; S306-G309 PolarHBondContact OG-N 2.73Å; D307-G309 PolarHBondContact O-N 3.49Å; G309-Q311 PolarHBondContact O-N 2.72Å
310	P	80.1	Confident	88.1	Confident	28 Å²	28	41.6 Å²	41.6	18%	0.182	22%	0.219	C	C	.	.			trans	-48	122.5	-170.8	-29.4	34.7	0	0	0	112.8	M287 V312 L313	M287-P310 HydrophobicContact CG-CG 4.21Å; M287-P310 HydrophobicContact SD-CG 3.99Å; P310-V312 PolarHBondContact O-N 2.85Å; P310-V312 VanDerWaalsContact O-N 3.09Å; P310-L313 HydrophobicContact CB-CD1 4.49Å; P310-L313 WeakPolarHBondContact O-CA 3.48Å; P310-L313 WeakPolarHBondContact O-CB 3.39Å; P310-L313 PolarHBondContact O-N 2.83Å
311	Q	83.7	Confident	88.1	Confident	99 Å²	99	44.9 Å²	44.9	46%	0.463	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-57.5	-34	-166.6	-67.7	-70.9	13.2	0	0	113.4	G309 L313 V314	G309-Q311 PolarHBondContact O-N 2.72Å; Q311-L313 PolarHBondContact O-N 3.19Å; Q311-V314 WeakPolarHBondContact O-CB 3.22Å; Q311-V314 VanDerWaalsContact O-CG1 3.26Å; Q311-V314 WeakPolarHBondContact O-CG1 3.43Å; Q311-V314 PolarHBondContact O-N 3.03Å; Q311-V314 VanDerWaalsContact O-N 3.08Å
312	V	89.5	Confident	88.1	Confident	26 Å²	26	45.2 Å²	45.2	16%	0.158	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-62.3	-14.5	174.9	-53.9	0	0	0	0	113.8	L261 L265 A283 P310 W315	L261-V312 HydrophobicContact CD1-CG2 4.1Å; L265-V312 HydrophobicContact CD1-CB 4.44Å; L265-V312 HydrophobicContact CD1-CG2 4.23Å; L265-V312 HydrophobicContact CD2-CB 4.26Å; L265-V312 HydrophobicContact CD2-CG2 4.45Å; L265-V312 WeakPolarHBondContact CD2-O 3.26Å; A283-V312 HydrophobicContact CB-CG1 3.98Å; A283-V312 HydrophobicContact CB-CG2 3.94Å; P310-V312 PolarHBondContact O-N 2.85Å; P310-V312 VanDerWaalsContact O-N 3.09Å; V312-W315 VanDerWaalsContact O-CD1 3.23Å; V312-W315 PolarHBondContact O-NE1 3.31Å
313	L	92.4	Very high	88.2	Confident	8 Å²	8	41 Å²	41	4%	0.042	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-109.4	9.4	178.3	-57	-175.6	0	0	0	113.6	L261 L264 L265 M304 P310 Q311 W315 L316 T317	L261-L313 HydrophobicContact CD1-CD1 4.16Å; L261-L313 HydrophobicContact CD1-CD2 3.8Å; L261-L313 HydrophobicContact CD1-CG 4.14Å; L264-L313 HydrophobicContact CD2-CD1 4.17Å; L264-L313 HydrophobicContact CD2-CD2 3.69Å; L264-L313 HydrophobicContact CG-CD2 4.22Å; L265-L313 HydrophobicContact CD2-CD2 4.24Å; M304-L313 HydrophobicContact CE-CD1 3.62Å; M304-L313 HydrophobicContact SD-CD1 4.06Å; P310-L313 HydrophobicContact CB-CD1 4.49Å; P310-L313 WeakPolarHBondContact O-CA 3.48Å; P310-L313 WeakPolarHBondContact O-CB 3.39Å; P310-L313 PolarHBondContact O-N 2.83Å; Q311-L313 PolarHBondContact O-N 3.19Å; L313-W315 HydrophobicContact CD2-CZ2 4.31Å; L313-W315 PolarHBondContact O-N 3.15Å; L313-L316 WeakPolarHBondContact O-CA 3.5Å; L313-L316 VanDerWaalsContact O-CB 3.28Å; L313-L316 WeakPolarHBondContact O-CB 3.32Å; L313-L316 PolarHBondContact O-N 3.36Å; L313-T317 PolarHBondContact O-N 2.92Å
314	V	92.6	Very high	88.3	Confident	14 Å²	14	43.2 Å²	43.2	9%	0.085	23%	0.233	C	C	.	.	H	α-helix	trans	-58	-32.4	178.3	68.6	0	0	0	0	112.2	A110 F277 Q311 L316 T317 I318 W445	A110-V314 HydrophobicContact CB-CG1 3.84Å; F277-V314 HydrophobicContact CE1-CG1 3.61Å; F277-V314 HydrophobicContact CZ-CG1 4.19Å; Q311-V314 WeakPolarHBondContact O-CB 3.22Å; Q311-V314 VanDerWaalsContact O-CG1 3.26Å; Q311-V314 WeakPolarHBondContact O-CG1 3.43Å; Q311-V314 PolarHBondContact O-N 3.03Å; Q311-V314 VanDerWaalsContact O-N 3.08Å; V314-L316 PolarHBondContact O-N 3.39Å; V314-T317 PolarHBondContact O-N 3.48Å; V314-T317 PolarHBondContact O-OG1 3.46Å; V314-I318 WeakPolarHBondContact O-CG1 3.43Å; V314-I318 PolarHBondContact O-N 2.8Å; V314-I318 VanDerWaalsContact O-N 3.12Å; V314-W445 HydrophobicContact CG2-CE3 4.09Å
315	W	95.4	Very high	88.5	Confident	2 Å²	2	43 Å²	43	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-59.6	-30.3	172.3	64.2	-93.5	0	0	0	113.2	T113 L117 L264 L267 P268 F277 V312 L313 F319	T113-W315 HydrophobicContact CG2-CB 3.62Å; T113-W315 HydrophobicContact CG2-CD2 4.17Å; T113-W315 HydrophobicContact CG2-CE3 4.36Å; T113-W315 HydrophobicContact CG2-CG 3.85Å; L117-W315 HydrophobicContact CD1-CD2 4.47Å; L117-W315 HydrophobicContact CD1-CE3 3.51Å; L117-W315 HydrophobicContact CD1-CH2 4.39Å; L117-W315 HydrophobicContact CD1-CZ3 3.47Å; L117-W315 VanDerWaalsContact CD1-CZ3 3.47Å; L264-W315 HydrophobicContact CD1-CH2 4.06Å; L264-W315 HydrophobicContact CD1-CZ2 4.37Å; L264-W315 HydrophobicContact CG-CH2 4.42Å; L264-W315 HydrophobicContact CG-CZ2 4.22Å; L267-W315 HydrophobicContact CB-CH2 4.05Å; L267-W315 HydrophobicContact CD1-CH2 4.19Å; P268-W315 HydrophobicContact CG-CZ2 4.23Å; F277-W315 AromaticContact CD1-CD1 3.76Å; F277-W315 HydrophobicContact CE2-CB 4.38Å; F277-W315 AromaticContact CG-CD1 3.65Å; F277-W315 HydrophobicContact CZ-CB 4.48Å; V312-W315 VanDerWaalsContact O-CD1 3.23Å; V312-W315 PolarHBondContact O-NE1 3.31Å; L313-W315 HydrophobicContact CD2-CZ2 4.31Å; L313-W315 PolarHBondContact O-N 3.15Å; W315-F319 VanDerWaalsContact O-CB 3.29Å; W315-F319 WeakPolarHBondContact O-CB 3.38Å; W315-F319 PolarHBondContact O-N 3.34Å
316	L	95.6	Very high	88.6	Confident	3 Å²	3	41.1 Å²	41.1	2%	0.016	23%	0.227	C	C	.	.	H	α-helix	trans	-78.6	-37.8	-177.8	-177.8	57.8	0	0	0	111.4	T228 F238 L264 L313 V314 I318 F319 H320	T228-L316 HydrophobicContact CG2-CD1 3.85Å; F238-L316 HydrophobicContact CE1-CD2 3.94Å; F238-L316 HydrophobicContact CZ-CD2 3.76Å; F238-L316 HydrophobicContact CZ-CG 4.43Å; L264-L316 HydrophobicContact CD1-CD2 4.43Å; L264-L316 HydrophobicContact CD2-CD2 4.09Å; L313-L316 WeakPolarHBondContact O-CA 3.5Å; L313-L316 VanDerWaalsContact O-CB 3.28Å; L313-L316 WeakPolarHBondContact O-CB 3.32Å; L313-L316 PolarHBondContact O-N 3.36Å; V314-L316 PolarHBondContact O-N 3.39Å; L316-I318 VanDerWaalsContact C-N 3.34Å; L316-F319 HydrophobicContact CD1-CD1 4.01Å; L316-F319 PolarHBondContact O-N 3.34Å; L316-H320 VanDerWaalsContact O-CG 3.32Å; L316-H320 PolarHBondContact O-N 3.28Å; L316-H320 PolarHBondContact O-ND1 3.29Å
317	T	93.4	Very high	88.8	Confident	58 Å²	58	46.4 Å²	46.4	36%	0.356	25%	0.252	S	S	.	.	H	α-helix	trans	-65.9	-39.9	172.4	68.4	0	0	0	0	110.5	L313 V314 H320 R321	L313-T317 PolarHBondContact O-N 2.92Å; V314-T317 PolarHBondContact O-N 3.48Å; V314-T317 PolarHBondContact O-OG1 3.46Å; T317-H320 PolarHBondContact O-N 3.02Å; T317-R321 WeakPolarHBondContact O-CB 3.25Å; T317-R321 PolarHBondContact O-N 3.21Å
318	I	94	Very high	89.9	Confident	7 Å²	7	41.3 Å²	41.3	4%	0.036	23%	0.226	C	C	.	.	H	α-helix	trans	-65.4	-44.1	173.1	-58.9	-169.2	0	0	0	111.6	A110 Y111 A114 V314 L316 H320 R321 L322	A110-I318 HydrophobicContact CB-CD1 3.62Å; Y111-I318 HydrophobicContact CD1-CD1 4.14Å; Y111-I318 HydrophobicContact CD1-CG2 3.53Å; Y111-I318 HydrophobicContact CD2-CD1 3.78Å; Y111-I318 HydrophobicContact CE1-CD1 4.13Å; Y111-I318 HydrophobicContact CE1-CG2 3.86Å; Y111-I318 HydrophobicContact CE2-CD1 3.75Å; Y111-I318 HydrophobicContact CG-CD1 4.01Å; Y111-I318 HydrophobicContact CG-CG2 4.11Å; A114-I318 HydrophobicContact CB-CB 3.97Å; A114-I318 HydrophobicContact CB-CG2 3.64Å; V314-I318 WeakPolarHBondContact O-CG1 3.43Å; V314-I318 PolarHBondContact O-N 2.8Å; V314-I318 VanDerWaalsContact O-N 3.12Å; L316-I318 VanDerWaalsContact C-N 3.34Å; I318-H320 VanDerWaalsContact C-N 3.35Å; I318-H320 PolarHBondContact O-N 3.03Å; I318-R321 CarbonylContact O-C 3.55Å; I318-R321 WeakPolarHBondContact O-CA 3.45Å; I318-R321 WeakPolarHBondContact O-CB 3.42Å; I318-R321 PolarHBondContact O-N 2.94Å; I318-R321 VanDerWaalsContact O-N 3.1Å; I318-L322 HydrophobicContact CG2-CD1 4.41Å; I318-L322 HydrophobicContact CG2-CG 4.24Å; I318-L322 WeakPolarHBondContact O-CG 3.34Å; I318-L322 PolarHBondContact O-N 3.47Å
319	F	96.3	Very high	91	Very high	3 Å²	3	40.6 Å²	40.6	1%	0.013	22%	0.216	C	C	.	.	H	α-helix	trans	-55.7	-47.9	175.5	169.5	-102.9	0	0	0	111.6	A114 L117 R118 Q121 L229 W315 L316 R321 L322 I323	A114-F319 HydrophobicContact CB-CB 4.08Å; L117-F319 HydrophobicContact CB-CD2 4.05Å; L117-F319 HydrophobicContact CB-CE2 4.16Å; R118-F319 HydrophobicContact CB-CD2 4.29Å; R118-F319 HydrophobicContact CB-CE2 4.35Å; Q121-F319 HydrophobicContact CB-CE2 4.24Å; Q121-F319 HydrophobicContact CB-CZ 4.37Å; Q121-F319 HydrophobicContact CG-CE2 4.49Å; Q121-F319 HydrophobicContact CG-CZ 4.16Å; L229-F319 HydrophobicContact CD2-CZ 4.19Å; W315-F319 VanDerWaalsContact O-CB 3.29Å; W315-F319 WeakPolarHBondContact O-CB 3.38Å; W315-F319 PolarHBondContact O-N 3.34Å; L316-F319 HydrophobicContact CD1-CD1 4.01Å; L316-F319 PolarHBondContact O-N 3.34Å; F319-R321 VanDerWaalsContact C-N 3.34Å; F319-R321 PolarHBondContact O-N 3.39Å; F319-L322 PolarHBondContact O-N 3.23Å; F319-I323 HydrophobicContact CD1-CD1 4.12Å; F319-I323 HydrophobicContact CE1-CD1 3.73Å; F319-I323 HydrophobicContact CE2-CD1 4.4Å; F319-I323 HydrophobicContact CZ-CD1 3.89Å; F319-I323 WeakPolarHBondContact O-CG1 3.3Å; F319-I323 PolarHBondContact O-N 3.06Å; F319-I323 VanDerWaalsContact O-N 3.09Å
320	H	94.4	Very high	92.1	Very high	19 Å²	19	40.3 Å²	40.3	9%	0.088	21%	0.213	C	C	.	.	H	α-helix	trans	-62.4	-38.1	174.6	-68	148.9	0	0	0	113.3	P234 K237 L316 T317 I318 I323 S324	P234-H320 HydrophobicContact CG-CB 3.71Å; K237-H320 PolarHBondContact NZ-NE2 2.94Å; L316-H320 VanDerWaalsContact O-CG 3.32Å; L316-H320 PolarHBondContact O-N 3.28Å; L316-H320 PolarHBondContact O-ND1 3.29Å; T317-H320 PolarHBondContact O-N 3.02Å; I318-H320 VanDerWaalsContact C-N 3.35Å; I318-H320 PolarHBondContact O-N 3.03Å; H320-I323 PolarHBondContact O-N 2.81Å; H320-S324 PolarHBondContact O-N 3.43Å
321	R	92.3	Very high	92.8	Very high	68 Å²	68	45.8 Å²	45.8	26%	0.257	24%	0.241	S	C	.	.	H	α-helix	trans	-63.9	-42.9	173.6	-177	172.1	59	177.9	-7.1	111.9	Y111 T317 I318 F319 I323 S324 V325 L345 E379	Y111-R321 VanDerWaalsContact CZ-NH2 3.26Å; Y111-R321 PolarHBondContact OH-NH2 2.96Å; T317-R321 WeakPolarHBondContact O-CB 3.25Å; T317-R321 PolarHBondContact O-N 3.21Å; I318-R321 CarbonylContact O-C 3.55Å; I318-R321 WeakPolarHBondContact O-CA 3.45Å; I318-R321 WeakPolarHBondContact O-CB 3.42Å; I318-R321 PolarHBondContact O-N 2.94Å; I318-R321 VanDerWaalsContact O-N 3.1Å; F319-R321 VanDerWaalsContact C-N 3.34Å; F319-R321 PolarHBondContact O-N 3.39Å; R321-I323 VanDerWaalsContact C-N 3.31Å; R321-I323 PolarHBondContact O-N 3.43Å; R321-S324 PolarHBondContact O-N 3.12Å; R321-S324 VanDerWaalsContact O-N 3.12Å; R321-V325 HydrophobicContact CG-CG1 4.46Å; R321-V325 WeakPolarHBondContact O-CG1 3.38Å; R321-V325 VanDerWaalsContact O-CG2 3.27Å; R321-V325 WeakPolarHBondContact O-CG2 3.49Å; R321-V325 PolarHBondContact O-N 2.73Å; R321-L345 HydrophobicContact CG-CD2 4.25Å; R321-E379 WeakPolarHBondContact CD-OE1 3.24Å; R321-E379 IonicContact CZ-OE1 3.38Å; R321-E379 VanDerWaalsContact CZ-OE1 3.26Å; R321-E379 IonicContact CZ-OE2 2.72Å; R321-E379 VanDerWaalsContact CZ-OE2 3.29Å; R321-E379 IonicContact NE-OE1 3.15Å; R321-E379 PolarHBondContact NE-OE1 3.28Å; R321-E379 IonicContact NE-OE2 2.72Å; R321-E379 IonicContact NH1-OE1 2.75Å; R321-E379 PolarHBondContact NH1-OE1 2.97Å; R321-E379 IonicContact NH1-OE2 3.82Å; R321-E379 PolarHBondContact NH1-OE2 3.26Å; R321-E379 IonicContact NH2-OE2 3.72Å
322	L	94.6	Very high	93.3	Very high	11 Å²	11	42.4 Å²	42.4	6%	0.058	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-35.9	176.1	-67.5	-176.2	0	0	0	112.6	A114 I318 F319 A326 L345 W363	A114-L322 HydrophobicContact CB-CD1 3.84Å; I318-L322 HydrophobicContact CG2-CD1 4.41Å; I318-L322 HydrophobicContact CG2-CG 4.24Å; I318-L322 WeakPolarHBondContact O-CG 3.34Å; I318-L322 PolarHBondContact O-N 3.47Å; F319-L322 PolarHBondContact O-N 3.23Å; L322-A326 PolarHBondContact O-N 3.37Å; L322-L345 HydrophobicContact CD2-CD1 3.89Å; L322-W363 HydrophobicContact CD1-CH2 4.24Å; L322-W363 HydrophobicContact CD2-CH2 3.71Å; L322-W363 HydrophobicContact CD2-CZ2 3.85Å
323	I	93.5	Very high	93.6	Very high	29 Å²	29	47.1 Å²	47.1	15%	0.149	24%	0.241	C	C	.	.	H	α-helix	trans	-62.7	-50.5	170.5	-62.2	168.5	0	0	0	110	N231 F319 H320 R321 V325 A326	N231-I323 WeakPolarHBondContact OD1-CG2 3.31Å; F319-I323 HydrophobicContact CD1-CD1 4.12Å; F319-I323 HydrophobicContact CE1-CD1 3.73Å; F319-I323 HydrophobicContact CE2-CD1 4.4Å; F319-I323 HydrophobicContact CZ-CD1 3.89Å; F319-I323 WeakPolarHBondContact O-CG1 3.3Å; F319-I323 PolarHBondContact O-N 3.06Å; F319-I323 VanDerWaalsContact O-N 3.09Å; H320-I323 PolarHBondContact O-N 2.81Å; R321-I323 VanDerWaalsContact C-N 3.31Å; R321-I323 PolarHBondContact O-N 3.43Å; I323-V325 VanDerWaalsContact C-N 3.26Å; I323-V325 PolarHBondContact O-N 3.24Å; I323-A326 PolarHBondContact O-N 2.6Å
324	S	92	Very high	93.8	Very high	97 Å²	97	46.7 Å²	46.7	68%	0.678	24%	0.239	S	C	*	.	H	α-helix	trans	-64.8	-24.2	-175.2	-172.5	0	0	0	0	114.7	H320 R321	H320-S324 PolarHBondContact O-N 3.43Å; R321-S324 PolarHBondContact O-N 3.12Å; R321-S324 VanDerWaalsContact O-N 3.12Å
325	V	93.4	Very high	94	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-105.1	-2.4	-176.2	-55.9	0	0	0	0	114.3	R321 I323 N327 V328 L345 S381	R321-V325 HydrophobicContact CG-CG1 4.46Å; R321-V325 WeakPolarHBondContact O-CG1 3.38Å; R321-V325 VanDerWaalsContact O-CG2 3.27Å; R321-V325 WeakPolarHBondContact O-CG2 3.49Å; R321-V325 PolarHBondContact O-N 2.73Å; I323-V325 VanDerWaalsContact C-N 3.26Å; I323-V325 PolarHBondContact O-N 3.24Å; V325-N327 PolarHBondContact O-N 3.43Å; V325-V328 HydrophobicContact CB-CB 4.36Å; V325-V328 HydrophobicContact CB-CG2 4.27Å; V325-V328 WeakPolarHBondContact O-CB 3.44Å; V325-V328 PolarHBondContact O-N 3.48Å; V325-L345 HydrophobicContact CB-CD2 4.17Å; V325-L345 HydrophobicContact CG1-CD2 3.78Å; V325-L345 HydrophobicContact CG2-CD2 3.81Å; V325-L345 HydrophobicContact CG2-CG 3.85Å; V325-S381 WeakPolarHBondContact CG1-O 3.42Å
326	A	90.8	Very high	93.9	Very high	34 Å²	34	49.3 Å²	49.3	28%	0.281	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-34.4	-174.5	0	0	0	0	0	113.9	L322 I323	L322-A326 PolarHBondContact O-N 3.37Å; I323-A326 PolarHBondContact O-N 2.6Å
327	N	89.9	Confident	93.9	Very high	157 Å²	157	51.2 Å²	51.2	84%	0.84	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	8.2	179.3	-62.7	-11.3	0	0	0	113.3	V325	V325-N327 PolarHBondContact O-N 3.43Å
328	V	93.1	Very high	94	Very high	26 Å²	26	53.7 Å²	53.7	16%	0.158	28%	0.275	C	S	.	.			trans	-81.3	126.7	178.6	174.4	0	0	0	0	109.5	V325 C343 G344 A383	V325-V328 HydrophobicContact CB-CB 4.36Å; V325-V328 HydrophobicContact CB-CG2 4.27Å; V325-V328 WeakPolarHBondContact O-CB 3.44Å; V325-V328 PolarHBondContact O-N 3.48Å; V328-C343 WeakPolarHBondContact O-CA 3.22Å; V328-G344 PolarHBondContact O-N 3.01Å; V328-A383 HydrophobicContact CG1-CB 4.16Å; V328-A383 VanDerWaalsContact CG1-N 3.33Å
329	R	94.4	Very high	94	Very high	154 Å²	154	56.7 Å²	56.7	58%	0.581	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	129.7	174.4	-62.7	-177.8	174.6	153.4	-1.5	109.8	A383 Y575	R329-A383 VanDerWaalsContact O-CB 3.27Å; R329-A383 WeakPolarHBondContact O-CB 3.2Å; R329-Y575 PolarHBondContact NE-OH 3.2Å; R329-Y575 PolarHBondContact NH2-OH 3.1Å
330	H	93.7	Very high	93.9	Very high	1 Å²	1	60.9 Å²	60.9	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	119	172.1	-56.9	-97	0	0	0	108.7	V332 P341 I342 G344 R346 Y380 A382	H330-V332 HydrophobicContact CB-CG2 4.02Å; H330-V332 PolarHBondContact O-N 3.11Å; H330-P341 WeakPolarHBondContact O-CA 3.28Å; H330-P341 WeakPolarHBondContact O-CB 3.41Å; H330-I342 HydrophobicContact CB-CB 4.37Å; H330-I342 PolarHBondContact N-O 3.12Å; H330-I342 PolarHBondContact O-N 2.99Å; H330-G344 PolarHBondContact CD2-O 2.82Å; H330-G344 PolarHBondContact NE2-O 2.91Å; H330-R346 HydrophobicContact CB-CB 4.37Å; H330-Y380 PolarHBondContact CE1-O 3.08Å; H330-Y380 VanDerWaalsContact CE1-O 3.31Å; H330-Y380 PolarHBondContact NE2-O 3.26Å; H330-A382 VanDerWaalsContact CE1-C 3.43Å; H330-A382 PolarHBondContact CE1-O 3.32Å; H330-A382 PolarHBondContact ND1-O 3.03Å
331	N	94.5	Very high	93.9	Very high	143 Å²	143	62.4 Å²	62.4	77%	0.765	32%	0.318	S	S	*	.	S	Bend	trans	-75.9	72	-179.2	-161.5	80.5	0	0	0	111.8
332	V	93.9	Very high	94.1	Very high	27 Å²	27	59.3 Å²	59.3	16%	0.164	31%	0.306	C	S	.	.	S	Bend	trans	-152.8	156.5	174.9	-74.5	0	0	0	0	109.7	H330 E340 I342	H330-V332 HydrophobicContact CB-CG2 4.02Å; H330-V332 PolarHBondContact O-N 3.11Å; V332-E340 VanDerWaalsContact C-OE1 3.3Å; V332-I342 HydrophobicContact CG2-CD1 3.97Å; V332-I342 HydrophobicContact CG2-CG1 4.39Å; V332-I342 PolarHBondContact O-N 3.03Å; V332-I342 VanDerWaalsContact O-N 3.12Å
333	R	95.8	Very high	94.1	Very high	125 Å²	125	59.8 Å²	59.8	47%	0.472	31%	0.31	S	S	.	.			trans	-76.3	149.2	169.8	-159.5	164.5	-62.9	179.5	2.1	113	R339 E340	R333-R339 CarbonylContact C-O 3.58Å; R333-R339 WeakPolarHBondContact CA-O 3.38Å; R333-E340 HydrophobicContact CB-CB 4.25Å; R333-E340 HydrophobicContact CB-CG 4.46Å; R333-E340 HydrophobicContact CG-CB 4.3Å; R333-E340 IonicContact CZ-OE2 3.2Å; R333-E340 PolarHBondContact N-OE1 3.39Å; R333-E340 IonicContact NE-OE2 2.81Å; R333-E340 PolarHBondContact NE-OE2 2.67Å; R333-E340 IonicContact NH2-OE2 2.73Å; R333-E340 PolarHBondContact NH2-OE2 3.27Å
334	C	97	Very high	94.1	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.305	C	S	.	.			trans	-89.4	124.3	163.1	173.7	0	0	0	0	110	G336 K338 R339 I342 N356 C358 C361	C334-G336 VanDerWaalsContact C-N 3.32Å; C334-G336 PolarHBondContact O-N 2.98Å; C334-K338 WeakPolarHBondContact O-CA 3.43Å; C334-K338 PolarHBondContact O-N 3.37Å; C334-R339 PolarHBondContact N-O 3.12Å; C334-I342 HydrophobicContact CB-CD1 4.01Å; C334-I342 HydrophobicContact CB-CG1 3.95Å; C334-N356 CarbonylContact C-O 3.52Å; C334-N356 WeakPolarHBondContact CA-O 3.42Å; C334-C358 HydrophobicContact CB-CB 4.14Å; C334-C358 PolarHBondContact SG-N 2.95Å; C334-C358 VanDerWaalsContact SG-SG 3.62Å; C334-C361 VanDerWaalsContact SG-SG 3.62Å
335	E	96	Very high	94.2	Very high	48 Å²	48	54 Å²	54	22%	0.224	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-23.2	-179	-64.2	-47.3	139.7	0	0	114.1	K338 Y355 N356	E335-K338 WeakPolarHBondContact O-CD 3.28Å; E335-K338 VanDerWaalsContact O-CE 3.26Å; E335-K338 WeakPolarHBondContact O-CE 3.29Å; E335-K338 PolarHBondContact O-NZ 3.24Å; E335-K338 IonicContact OE2-NZ 3.38Å; E335-K338 PolarHBondContact OE2-NZ 3.39Å; E335-Y355 HydrophobicContact CB-CD2 4.12Å; E335-Y355 HydrophobicContact CB-CE1 4.47Å; E335-Y355 HydrophobicContact CB-CE2 3.75Å; E335-Y355 HydrophobicContact CG-CD2 4.04Å; E335-Y355 HydrophobicContact CG-CE2 4.19Å; E335-Y355 HydrophobicContact CG-CG 4.42Å; E335-N356 PolarHBondContact N-O 2.69Å
336	G	94	Very high	94.4	Very high	22 Å²	22	55.5 Å²	55.5	23%	0.227	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-63.7	173.7	0	0	0	0	0	113.1	C334	C334-G336 VanDerWaalsContact C-N 3.32Å; C334-G336 PolarHBondContact O-N 2.98Å
337	C	95.5	Very high	94.6	Very high	44 Å²	44	54 Å²	54	30%	0.297	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	6.5	-173.4	67.9	0	0	0	0	114.9	R339 C361	C337-R339 PolarHBondContact O-N 2.86Å; C337-C361 VanDerWaalsContact CB-SG 3.55Å; C337-C361 PolarHBondContact N-SG 3.31Å; C337-C361 VanDerWaalsContact N-SG 3.43Å; C337-C361 VanDerWaalsContact SG-SG 3.68Å
338	K	95.7	Very high	94.9	Very high	109 Å²	109	50 Å²	50	47%	0.474	24%	0.241	S	C	.	.			trans	52.4	9.2	-178.8	-53.2	-49.6	-168.1	-164.3	0	116.6	C334 E335	C334-K338 WeakPolarHBondContact O-CA 3.43Å; C334-K338 PolarHBondContact O-N 3.37Å; E335-K338 WeakPolarHBondContact O-CD 3.28Å; E335-K338 VanDerWaalsContact O-CE 3.26Å; E335-K338 WeakPolarHBondContact O-CE 3.29Å; E335-K338 PolarHBondContact O-NZ 3.24Å; E335-K338 IonicContact OE2-NZ 3.38Å; E335-K338 PolarHBondContact OE2-NZ 3.39Å
339	R	94	Very high	95	Very high	70 Å²	70	48.9 Å²	48.9	26%	0.264	23%	0.234	S	C	.	.			trans	-64.4	140.3	172.8	-65.7	-172	-133.6	132.7	15.8	111.3	R333 C334 C337 D360 Y575	R333-R339 CarbonylContact C-O 3.58Å; R333-R339 WeakPolarHBondContact CA-O 3.38Å; C334-R339 PolarHBondContact N-O 3.12Å; C337-R339 PolarHBondContact O-N 2.86Å; R339-D360 IonicContact CZ-OD2 3.84Å; R339-D360 IonicContact NH1-OD2 2.85Å; R339-D360 PolarHBondContact NH1-OD2 3.28Å; R339-D360 IonicContact NH2-OD2 3.28Å; R339-D360 PolarHBondContact NH2-OD2 2.9Å; R339-Y575 PolarHBondContact NH1-O 2.72Å
340	E	94.1	Very high	95	Very high	91 Å²	91	45.8 Å²	45.8	43%	0.425	23%	0.232	S	C	.	.	S	Bend	trans	-149.3	131	178.1	-177.1	155.1	-137.6	0	0	108.1	V332 R333	V332-E340 VanDerWaalsContact C-OE1 3.3Å; R333-E340 HydrophobicContact CB-CB 4.25Å; R333-E340 HydrophobicContact CB-CG 4.46Å; R333-E340 HydrophobicContact CG-CB 4.3Å; R333-E340 IonicContact CZ-OE2 3.2Å; R333-E340 PolarHBondContact N-OE1 3.39Å; R333-E340 IonicContact NE-OE2 2.81Å; R333-E340 PolarHBondContact NE-OE2 2.67Å; R333-E340 IonicContact NH2-OE2 2.73Å; R333-E340 PolarHBondContact NH2-OE2 3.27Å
341	P	94.2	Very high	94.9	Very high	52 Å²	52	52.4 Å²	52.4	34%	0.338	26%	0.257	S	S	.	.	S	Bend	cis	-68	156.7	-7.6	31.1	-36.6	0	0	0	113.1	H330 C343	H330-P341 WeakPolarHBondContact O-CA 3.28Å; H330-P341 WeakPolarHBondContact O-CB 3.41Å; P341-C343 PolarHBondContact O-N 2.86Å
342	I	95.6	Very high	94.9	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	122.4	164.8	-68.7	174.2	0	0	0	108.8	H330 V332 C334 R346 N356 C358	H330-I342 HydrophobicContact CB-CB 4.37Å; H330-I342 PolarHBondContact N-O 3.12Å; H330-I342 PolarHBondContact O-N 2.99Å; V332-I342 HydrophobicContact CG2-CD1 3.97Å; V332-I342 HydrophobicContact CG2-CG1 4.39Å; V332-I342 PolarHBondContact O-N 3.03Å; V332-I342 VanDerWaalsContact O-N 3.12Å; C334-I342 HydrophobicContact CB-CD1 4.01Å; C334-I342 HydrophobicContact CB-CG1 3.95Å; I342-R346 HydrophobicContact CD1-CG 4.34Å; I342-R346 HydrophobicContact CG2-CB 4.12Å; I342-N356 HydrophobicContact CD1-CB 4.06Å; I342-C358 HydrophobicContact CG1-CB 4.19Å; I342-C358 HydrophobicContact CG2-CB 3.93Å
343	C	94	Very high	94.8	Very high	21 Å²	21	50.5 Å²	50.5	14%	0.142	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	151.3	170.2	-59.1	0	0	0	0	110.4	V328 P341 Y575	V328-C343 WeakPolarHBondContact O-CA 3.22Å; P341-C343 PolarHBondContact O-N 2.86Å; C343-Y575 HydrophobicContact CB-CD1 4.07Å; C343-Y575 HydrophobicContact CB-CD2 4.18Å; C343-Y575 HydrophobicContact CB-CE1 4.22Å; C343-Y575 HydrophobicContact CB-CE2 4.3Å; C343-Y575 HydrophobicContact CB-CG 4.06Å; C343-Y575 WeakPolarHBondContact SG-CE1 3.41Å; C343-Y575 VanDerWaalsContact SG-CZ 3.57Å
344	G	94.4	Very high	94.4	Very high	5 Å²	5	52.4 Å²	52.4	5%	0.052	27%	0.267	C	S	.	.	S	Bend	trans	78	-138.5	-176.6	0	0	0	0	0	112.4	V328 H330	V328-G344 PolarHBondContact O-N 3.01Å; H330-G344 PolarHBondContact CD2-O 2.82Å; H330-G344 PolarHBondContact NE2-O 2.91Å
345	L	94.9	Very high	94.3	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.27	C	S	.	.			trans	-80.6	129.6	179.6	-62.4	172.1	0	0	0	111.8	Y111 R321 L322 V325 Y347 Q359 W363 E379	Y111-L345 HydrophobicContact CE1-CD1 4.08Å; R321-L345 HydrophobicContact CG-CD2 4.25Å; L322-L345 HydrophobicContact CD2-CD1 3.89Å; V325-L345 HydrophobicContact CB-CD2 4.17Å; V325-L345 HydrophobicContact CG1-CD2 3.78Å; V325-L345 HydrophobicContact CG2-CD2 3.81Å; V325-L345 HydrophobicContact CG2-CG 3.85Å; L345-Y347 HydrophobicContact CB-CD2 4.43Å; L345-Y347 HydrophobicContact CB-CE2 3.59Å; L345-Y347 VanDerWaalsContact CD1-OH 3.29Å; L345-Y347 WeakPolarHBondContact CD1-OH 3.43Å; L345-Q359 HydrophobicContact CB-CB 4.14Å; L345-Q359 PolarHBondContact O-N 2.89Å; L345-W363 HydrophobicContact CD1-CZ2 4.38Å; L345-E379 HydrophobicContact CB-CG 4.37Å; L345-E379 HydrophobicContact CD2-CG 4.16Å
346	R	96.1	Very high	94.3	Very high	35 Å²	35	51.3 Å²	51.3	13%	0.132	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	134.6	170.6	169.5	-176.2	174.6	178	3.2	110.6	H330 I342 N356 E379 Y380	H330-R346 HydrophobicContact CB-CB 4.37Å; I342-R346 HydrophobicContact CD1-CG 4.34Å; I342-R346 HydrophobicContact CG2-CB 4.12Å; R346-N356 VanDerWaalsContact CZ-OD1 3.25Å; R346-N356 PolarHBondContact NE-OD1 3.46Å; R346-N356 PolarHBondContact NH2-OD1 3.43Å; R346-E379 CarbonylContact O-C 3.59Å; R346-E379 WeakPolarHBondContact O-CA 3.38Å; R346-Y380 PolarHBondContact N-O 2.96Å; R346-Y380 PolarHBondContact O-N 3.47Å
347	Y	96.1	Very high	94.4	Very high	1 Å²	1	50.5 Å²	50.5	0%	0.004	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	114.4	179.3	-70.7	-79.6	0	0	0	109.6	Y111 L345 N356 L357 Q359 F362 W363 V377 E379 I442	Y111-Y347 VanDerWaalsContact CE1-OH 3.26Å; Y111-Y347 WeakPolarHBondContact CE1-OH 3.47Å; Y111-Y347 PolarHBondContact OH-OH 2.91Å; L345-Y347 HydrophobicContact CB-CD2 4.43Å; L345-Y347 HydrophobicContact CB-CE2 3.59Å; L345-Y347 VanDerWaalsContact CD1-OH 3.29Å; L345-Y347 WeakPolarHBondContact CD1-OH 3.43Å; Y347-N356 CarbonylContact O-C 2.7Å; Y347-N356 VanDerWaalsContact O-CA 3.26Å; Y347-N356 WeakPolarHBondContact O-CA 3.33Å; Y347-L357 PolarHBondContact N-O 3.29Å; Y347-L357 PolarHBondContact O-N 3.11Å; Y347-Q359 HydrophobicContact CD2-CB 4.45Å; Y347-Q359 HydrophobicContact CE2-CB 3.81Å; Y347-F362 HydrophobicContact CD1-CB 4.37Å; Y347-F362 AromaticContact CD1-CD1 3.4Å; Y347-F362 HydrophobicContact CD1-CD1 3.4Å; Y347-F362 VanDerWaalsContact CD1-CD1 3.4Å; Y347-F362 HydrophobicContact CD1-CD2 4.19Å; Y347-F362 AromaticContact CD1-CE1 3.67Å; Y347-F362 HydrophobicContact CD1-CE1 3.67Å; Y347-F362 HydrophobicContact CD1-CE2 4.4Å; Y347-F362 AromaticContact CD1-CG 3.7Å; Y347-F362 HydrophobicContact CD1-CG 3.7Å; Y347-F362 HydrophobicContact CD1-CZ 4.18Å; Y347-F362 HydrophobicContact CD2-CB 3.6Å; Y347-F362 AromaticContact CD2-CD1 3.82Å; Y347-F362 HydrophobicContact CD2-CD1 3.82Å; Y347-F362 AromaticContact CD2-CG 3.84Å; Y347-F362 HydrophobicContact CD2-CG 3.84Å; Y347-F362 AromaticContact CE1-CD1 3.41Å; Y347-F362 HydrophobicContact CE1-CD1 3.41Å; Y347-F362 VanDerWaalsContact CE1-CD1 3.41Å; Y347-F362 AromaticContact CE1-CE1 3.54Å; Y347-F362 HydrophobicContact CE1-CE1 3.54Å; Y347-F362 HydrophobicContact CE1-CG 4.18Å; Y347-F362 HydrophobicContact CE1-CZ 4.39Å; Y347-F362 HydrophobicContact CE2-CB 4.2Å; Y347-F362 AromaticContact CE2-CD1 3.81Å; Y347-F362 HydrophobicContact CE2-CD1 3.81Å; Y347-F362 HydrophobicContact CE2-CG 4.29Å; Y347-F362 HydrophobicContact CG-CB 3.7Å; Y347-F362 AromaticContact CG-CD1 3.62Å; Y347-F362 HydrophobicContact CG-CD1 3.62Å; Y347-F362 HydrophobicContact CG-CD2 4.14Å; Y347-F362 HydrophobicContact CG-CE1 4.34Å; Y347-F362 AromaticContact CG-CG 3.52Å; Y347-F362 HydrophobicContact CG-CG 3.52Å; Y347-F362 AromaticContact CZ-CD1 3.62Å; Y347-W363 AromaticContact CZ-NE1 3.97Å; Y347-W363 PolarHBondContact OH-NE1 3.23Å; Y347-V377 HydrophobicContact CD1-CG1 3.96Å; Y347-V377 HydrophobicContact CG-CG1 4.29Å; Y347-E379 HydrophobicContact CD1-CB 4.11Å; Y347-E379 HydrophobicContact CD1-CG 4.15Å; Y347-E379 HydrophobicContact CE1-CB 3.76Å; Y347-E379 HydrophobicContact CE1-CG 3.53Å; Y347-E379 WeakPolarHBondContact CE1-OE2 3.27Å; Y347-E379 PolarHBondContact OH-OE2 3.03Å; Y347-I442 HydrophobicContact CD1-CD1 4.32Å; Y347-I442 HydrophobicContact CE1-CD1 3.62Å
348	K	95.5	Very high	94.4	Very high	74 Å²	74	48.6 Å²	48.6	32%	0.322	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	130.9	178.3	-169.6	-162.1	169.3	-170.9	0	110.3	Y355 N356 V377 K378 Y380	K348-Y355 WeakPolarHBondContact CA-O 3.25Å; K348-Y355 WeakPolarHBondContact CG-O 3.48Å; K348-N356 WeakPolarHBondContact CG-OD1 3.49Å; K348-V377 WeakPolarHBondContact O-CA 3.39Å; K348-K378 PolarHBondContact N-O 3.39Å; K348-K378 PolarHBondContact O-N 2.92Å; K348-Y380 HydrophobicContact CB-CD2 4.25Å; K348-Y380 HydrophobicContact CB-CE2 3.71Å
349	C	95.5	Very high	94.4	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.02	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	141.3	170.7	-167.4	0	0	0	0	111	R351 C352 Y355 H371	C349-R351 PolarHBondContact SG-N 3.06Å; C349-C352 HydrophobicContact CB-CB 3.86Å; C349-C352 PolarHBondContact SG-N 2.87Å; C349-Y355 HydrophobicContact CB-CD1 4.12Å; C349-Y355 HydrophobicContact CB-CG 4.42Å; C349-Y355 PolarHBondContact N-O 2.54Å; C349-Y355 VanDerWaalsContact N-O 3.07Å; C349-H371 PolarHBondContact SG-ND1 2.81Å; C349-H371 VanDerWaalsContact SG-ND1 3.42Å
350	T	93.7	Very high	94.4	Very high	88 Å²	88	43.2 Å²	43.2	54%	0.54	22%	0.22	S	C	.	.	S	Bend	trans	-80.7	-35.1	171.5	61.6	0	0	0	0	111.8	D376	T350-D376 HydrophobicContact CG2-CB 4.29Å; T350-D376 PolarHBondContact N-O 2.96Å; T350-D376 PolarHBondContact OG1-O 3.48Å
351	R	93.2	Very high	94.5	Very high	141 Å²	141	39.2 Å²	39.2	53%	0.532	20%	0.202	S	C	.	.	S	Bend	trans	-90.1	-33.5	-173.2	-50.4	-170.4	-170.2	-179.7	4	113.8	C349 H375 D376	C349-R351 PolarHBondContact SG-N 3.06Å; R351-H375 HydrophobicContact CB-CB 4.35Å; R351-H375 HydrophobicContact CG-CB 4.24Å; R351-D376 IonicContact CZ-OD2 2.68Å; R351-D376 IonicContact NE-OD2 2.64Å; R351-D376 PolarHBondContact NE-OD2 3.24Å; R351-D376 IonicContact NH2-OD1 3.73Å; R351-D376 PolarHBondContact NH2-OD1 3.42Å; R351-D376 IonicContact NH2-OD2 2.69Å; R351-D376 PolarHBondContact NH2-OD2 3.26Å
352	C	93.7	Very high	94.6	Very high	17 Å²	17	37.1 Å²	37.1	12%	0.115	19%	0.188	C	C	.	.	S	Bend	trans	-95.7	116.3	-178.9	-55	0	0	0	0	109.6	C349 Y355 H375	C349-C352 HydrophobicContact CB-CB 3.86Å; C349-C352 PolarHBondContact SG-N 2.87Å; C352-Y355 HydrophobicContact CB-CG 4.16Å; C352-H375 PolarHBondContact SG-ND1 2.89Å
353	P	91	Very high	94.6	Very high	113 Å²	113	37.6 Å²	37.6	73%	0.734	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	141.9	176.2	-25.4	35.3	0	0	0	111.8	Y355	P353-Y355 PolarHBondContact O-N 3.47Å
354	H	88.7	Confident	94.6	Very high	164 Å²	164	40.7 Å²	40.7	76%	0.759	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	-8.3	178.2	-61.3	-92.7	0	0	0	117.8	N356	H354-N356 PolarHBondContact O-N 3.45Å; H354-N356 PolarHBondContact O-ND2 2.82Å
355	Y	94.5	Very high	94.6	Very high	15 Å²	15	41 Å²	41	6%	0.059	21%	0.207	C	C	.	.			trans	-67.3	119.6	-175.6	-162.4	-83.6	0	0	0	112.7	E335 K348 C349 C352 P353 L357 T368 H371	E335-Y355 HydrophobicContact CB-CD2 4.12Å; E335-Y355 HydrophobicContact CB-CE1 4.47Å; E335-Y355 HydrophobicContact CB-CE2 3.75Å; E335-Y355 HydrophobicContact CG-CD2 4.04Å; E335-Y355 HydrophobicContact CG-CE2 4.19Å; E335-Y355 HydrophobicContact CG-CG 4.42Å; K348-Y355 WeakPolarHBondContact CA-O 3.25Å; K348-Y355 WeakPolarHBondContact CG-O 3.48Å; C349-Y355 HydrophobicContact CB-CD1 4.12Å; C349-Y355 HydrophobicContact CB-CG 4.42Å; C349-Y355 PolarHBondContact N-O 2.54Å; C349-Y355 VanDerWaalsContact N-O 3.07Å; C352-Y355 HydrophobicContact CB-CG 4.16Å; P353-Y355 PolarHBondContact O-N 3.47Å; Y355-L357 HydrophobicContact CD1-CG 4.46Å; Y355-L357 HydrophobicContact CE1-CD1 4.14Å; Y355-L357 HydrophobicContact CE1-CD2 3.71Å; Y355-L357 HydrophobicContact CE1-CG 3.74Å; Y355-T368 WeakPolarHBondContact CE2-OG1 3.21Å; Y355-T368 PolarHBondContact OH-N 3.21Å; Y355-T368 PolarHBondContact OH-OG1 2.95Å; Y355-H371 HydrophobicContact CD1-CB 4.1Å; Y355-H371 AromaticContact CD1-CD2 3.98Å; Y355-H371 AromaticContact CD1-CG 3.76Å; Y355-H371 HydrophobicContact CD2-CB 3.88Å; Y355-H371 HydrophobicContact CE1-CB 3.72Å; Y355-H371 AromaticContact CE1-CD2 3.19Å; Y355-H371 WeakPolarHBondContact CE1-CD2 3.49Å; Y355-H371 AromaticContact CE1-CG 3.35Å; Y355-H371 AromaticContact CE1-NE2 3.78Å; Y355-H371 HydrophobicContact CE2-CB 3.46Å; Y355-H371 VanDerWaalsContact CE2-CB 3.46Å; Y355-H371 HydrophobicContact CG-CB 4.18Å; Y355-H371 AromaticContact CZ-CD2 3.48Å; Y355-H371 VanDerWaalsContact CZ-CD2 3.48Å; Y355-H371 AromaticContact CZ-CG 3.55Å; Y355-H371 PolarHBondContact OH-CD2 3.4Å
356	N	95.7	Very high	94.5	Very high	11 Å²	11	43.3 Å²	43.3	6%	0.059	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	145	176.5	-51.4	-81.6	0	0	0	111	C334 E335 I342 R346 Y347 K348 H354	C334-N356 CarbonylContact C-O 3.52Å; C334-N356 WeakPolarHBondContact CA-O 3.42Å; E335-N356 PolarHBondContact N-O 2.69Å; I342-N356 HydrophobicContact CD1-CB 4.06Å; R346-N356 VanDerWaalsContact CZ-OD1 3.25Å; R346-N356 PolarHBondContact NE-OD1 3.46Å; R346-N356 PolarHBondContact NH2-OD1 3.43Å; Y347-N356 CarbonylContact O-C 2.7Å; Y347-N356 VanDerWaalsContact O-CA 3.26Å; Y347-N356 WeakPolarHBondContact O-CA 3.33Å; K348-N356 WeakPolarHBondContact CG-OD1 3.49Å; H354-N356 PolarHBondContact O-N 3.45Å; H354-N356 PolarHBondContact O-ND2 2.82Å
357	L	96.3	Very high	94.3	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.021	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	146.4	168.5	-61.2	178.7	0	0	0	109.9	Y347 Y355 C361 F362 V366	Y347-L357 PolarHBondContact N-O 3.29Å; Y347-L357 PolarHBondContact O-N 3.11Å; Y355-L357 HydrophobicContact CD1-CG 4.46Å; Y355-L357 HydrophobicContact CE1-CD1 4.14Å; Y355-L357 HydrophobicContact CE1-CD2 3.71Å; Y355-L357 HydrophobicContact CE1-CG 3.74Å; L357-C361 HydrophobicContact CB-CB 4.17Å; L357-C361 HydrophobicContact CD2-CB 4.05Å; L357-C361 HydrophobicContact CG-CB 4.5Å; L357-F362 HydrophobicContact CB-CB 4.14Å; L357-F362 HydrophobicContact CD1-CB 4.24Å; L357-F362 HydrophobicContact CD1-CD2 4.46Å; L357-V366 WeakPolarHBondContact CD1-O 3.02Å
358	C	96.3	Very high	94.1	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.034	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	166.6	159.1	70	0	0	0	0	109.8	C334 I342 D360 C361 F362	C334-C358 HydrophobicContact CB-CB 4.14Å; C334-C358 PolarHBondContact SG-N 2.95Å; C334-C358 VanDerWaalsContact SG-SG 3.62Å; I342-C358 HydrophobicContact CG1-CB 4.19Å; I342-C358 HydrophobicContact CG2-CB 3.93Å; C358-D360 PolarHBondContact O-N 3.29Å; C358-C361 PolarHBondContact O-N 3.23Å; C358-F362 PolarHBondContact O-N 2.63Å
359	Q	94.8	Very high	93.5	Very high	38 Å²	38	49.3 Å²	49.3	18%	0.178	26%	0.263	C	S	.	.	H	α-helix	trans	-54.9	-47.8	-179.9	70.9	-170.8	32.7	0	0	113.7	L345 Y347 C361 F362 W363	L345-Q359 HydrophobicContact CB-CB 4.14Å; L345-Q359 PolarHBondContact O-N 2.89Å; Y347-Q359 HydrophobicContact CD2-CB 4.45Å; Y347-Q359 HydrophobicContact CE2-CB 3.81Å; Q359-C361 PolarHBondContact O-N 3.15Å; Q359-F362 PolarHBondContact O-N 2.7Å; Q359-W363 HydrophobicContact CB-CD2 4.17Å; Q359-W363 HydrophobicContact CB-CE3 4.42Å; Q359-W363 HydrophobicContact CB-CH2 3.97Å; Q359-W363 HydrophobicContact CB-CZ2 3.66Å; Q359-W363 HydrophobicContact CB-CZ3 4.34Å; Q359-W363 HydrophobicContact CG-CE3 4.39Å; Q359-W363 HydrophobicContact CG-CH2 3.84Å; Q359-W363 HydrophobicContact CG-CZ2 4.08Å; Q359-W363 HydrophobicContact CG-CZ3 4.01Å; Q359-W363 VanDerWaalsContact O-CB 3.28Å; Q359-W363 WeakPolarHBondContact O-CB 3.28Å; Q359-W363 PolarHBondContact O-N 2.88Å
360	D	94.4	Very high	93.1	Very high	28 Å²	28	57.5 Å²	57.5	15%	0.15	30%	0.301	C	S	.	.	H	α-helix	trans	-59.2	-45.4	-179.5	-9.6	-44.5	0	0	0	112.1	R339 C358 W363 I364	R339-D360 IonicContact CZ-OD2 3.84Å; R339-D360 IonicContact NH1-OD2 2.85Å; R339-D360 PolarHBondContact NH1-OD2 3.28Å; R339-D360 IonicContact NH2-OD2 3.28Å; R339-D360 PolarHBondContact NH2-OD2 2.9Å; C358-D360 PolarHBondContact O-N 3.29Å; D360-W363 PolarHBondContact O-N 3.33Å; D360-I364 WeakPolarHBondContact O-CB 3.44Å; D360-I364 VanDerWaalsContact O-CG1 3.3Å; D360-I364 WeakPolarHBondContact O-CG1 3.45Å; D360-I364 PolarHBondContact O-N 2.79Å
361	C	96	Very high	93	Very high	7 Å²	7	53.8 Å²	53.8	5%	0.047	28%	0.277	C	S	.	.	H	α-helix	trans	-65.1	-41.8	178.3	-73	0	0	0	0	112.3	C334 C337 L357 C358 Q359 G365 V366	C334-C361 VanDerWaalsContact SG-SG 3.62Å; C337-C361 VanDerWaalsContact CB-SG 3.55Å; C337-C361 PolarHBondContact N-SG 3.31Å; C337-C361 VanDerWaalsContact N-SG 3.43Å; C337-C361 VanDerWaalsContact SG-SG 3.68Å; L357-C361 HydrophobicContact CB-CB 4.17Å; L357-C361 HydrophobicContact CD2-CB 4.05Å; L357-C361 HydrophobicContact CG-CB 4.5Å; C358-C361 PolarHBondContact O-N 3.23Å; Q359-C361 PolarHBondContact O-N 3.15Å; C361-G365 WeakPolarHBondContact O-CA 3.33Å; C361-G365 PolarHBondContact O-N 3Å; C361-V366 HydrophobicContact CB-CB 4.03Å; C361-V366 HydrophobicContact CB-CG2 4.2Å; C361-V366 PolarHBondContact O-N 2.82Å
362	F	96.2	Very high	93	Very high	8 Å²	8	49.5 Å²	49.5	4%	0.035	27%	0.267	C	S	.	.	H	α-helix	trans	-67.3	-40.9	177	177.5	-106.6	0	0	0	112.2	R107 F108 Y347 L357 C358 Q359 G365 V377 I442	R107-F362 PolarHBondContact NH2-O 2.7Å; F108-F362 HydrophobicContact CD2-CE1 4.4Å; F108-F362 HydrophobicContact CE2-CD1 4.06Å; F108-F362 AromaticContact CE2-CE1 3.58Å; F108-F362 HydrophobicContact CE2-CE1 3.58Å; F108-F362 AromaticContact CE2-CZ 3.93Å; F108-F362 HydrophobicContact CE2-CZ 3.93Å; F108-F362 AromaticContact CZ-CE1 3.99Å; F108-F362 HydrophobicContact CZ-CE1 3.99Å; F108-F362 AromaticContact CZ-CZ 3.88Å; F108-F362 HydrophobicContact CZ-CZ 3.88Å; Y347-F362 HydrophobicContact CD1-CB 4.37Å; Y347-F362 AromaticContact CD1-CD1 3.4Å; Y347-F362 HydrophobicContact CD1-CD1 3.4Å; Y347-F362 VanDerWaalsContact CD1-CD1 3.4Å; Y347-F362 HydrophobicContact CD1-CD2 4.19Å; Y347-F362 AromaticContact CD1-CE1 3.67Å; Y347-F362 HydrophobicContact CD1-CE1 3.67Å; Y347-F362 HydrophobicContact CD1-CE2 4.4Å; Y347-F362 AromaticContact CD1-CG 3.7Å; Y347-F362 HydrophobicContact CD1-CG 3.7Å; Y347-F362 HydrophobicContact CD1-CZ 4.18Å; Y347-F362 HydrophobicContact CD2-CB 3.6Å; Y347-F362 AromaticContact CD2-CD1 3.82Å; Y347-F362 HydrophobicContact CD2-CD1 3.82Å; Y347-F362 AromaticContact CD2-CG 3.84Å; Y347-F362 HydrophobicContact CD2-CG 3.84Å; Y347-F362 AromaticContact CE1-CD1 3.41Å; Y347-F362 HydrophobicContact CE1-CD1 3.41Å; Y347-F362 VanDerWaalsContact CE1-CD1 3.41Å; Y347-F362 AromaticContact CE1-CE1 3.54Å; Y347-F362 HydrophobicContact CE1-CE1 3.54Å; Y347-F362 HydrophobicContact CE1-CG 4.18Å; Y347-F362 HydrophobicContact CE1-CZ 4.39Å; Y347-F362 HydrophobicContact CE2-CB 4.2Å; Y347-F362 AromaticContact CE2-CD1 3.81Å; Y347-F362 HydrophobicContact CE2-CD1 3.81Å; Y347-F362 HydrophobicContact CE2-CG 4.29Å; Y347-F362 HydrophobicContact CG-CB 3.7Å; Y347-F362 AromaticContact CG-CD1 3.62Å; Y347-F362 HydrophobicContact CG-CD1 3.62Å; Y347-F362 HydrophobicContact CG-CD2 4.14Å; Y347-F362 HydrophobicContact CG-CE1 4.34Å; Y347-F362 AromaticContact CG-CG 3.52Å; Y347-F362 HydrophobicContact CG-CG 3.52Å; Y347-F362 AromaticContact CZ-CD1 3.62Å; L357-F362 HydrophobicContact CB-CB 4.14Å; L357-F362 HydrophobicContact CD1-CB 4.24Å; L357-F362 HydrophobicContact CD1-CD2 4.46Å; C358-F362 PolarHBondContact O-N 2.63Å; Q359-F362 PolarHBondContact O-N 2.7Å; F362-G365 PolarHBondContact O-N 2.97Å; F362-V377 HydrophobicContact CD2-CG1 4.05Å; F362-V377 HydrophobicContact CD2-CG2 4.5Å; F362-V377 HydrophobicContact CE2-CB 3.89Å; F362-V377 HydrophobicContact CE2-CG1 3.81Å; F362-V377 HydrophobicContact CE2-CG2 4.04Å; F362-V377 HydrophobicContact CZ-CG1 4.44Å; F362-I442 HydrophobicContact CE1-CD1 4.2Å; F362-I442 HydrophobicContact CZ-CD1 4.48Å; F362-I442 HydrophobicContact CZ-CG2 4.06Å
363	W	95.4	Very high	92.9	Very high	12 Å²	12	51.1 Å²	51.1	5%	0.045	27%	0.274	C	S	.	.	H	α-helix	trans	-67.6	-45.1	-179.3	-68.7	-11.1	0	0	0	113	I106 R107 Y111 S115 L322 L345 Y347 Q359 D360 G365	I106-W363 HydrophobicContact CB-CB 4.49Å; I106-W363 HydrophobicContact CD1-CE3 3.81Å; I106-W363 HydrophobicContact CD1-CZ3 4.25Å; I106-W363 HydrophobicContact CG1-CB 4.21Å; I106-W363 HydrophobicContact CG1-CE3 4.14Å; I106-W363 HydrophobicContact CG2-CB 4.02Å; I106-W363 HydrophobicContact CG2-CG 4.3Å; R107-W363 WeakPolarHBondContact CB-O 3.15Å; R107-W363 WeakPolarHBondContact CG-O 3.47Å; R107-W363 PolarHBondContact N-O 2.89Å; R107-W363 PolarHBondContact NE-O 3.23Å; Y111-W363 HydrophobicContact CD1-CD2 4.48Å; Y111-W363 AromaticContact CD1-CE2 3.42Å; Y111-W363 VanDerWaalsContact CD1-CE2 3.42Å; Y111-W363 AromaticContact CD1-CZ2 3.45Å; Y111-W363 HydrophobicContact CD1-CZ2 3.45Å; Y111-W363 VanDerWaalsContact CD1-CZ2 3.45Å; Y111-W363 AromaticContact CD1-NE1 3.21Å; Y111-W363 HydrophobicContact CE1-CZ2 4.04Å; Y111-W363 AromaticContact CE1-NE1 3.51Å; Y111-W363 AromaticContact CG-CE2 3.95Å; Y111-W363 HydrophobicContact CG-CZ2 4.32Å; Y111-W363 AromaticContact CG-NE1 3.61Å; S115-W363 WeakPolarHBondContact OG-CZ3 3.49Å; L322-W363 HydrophobicContact CD1-CH2 4.24Å; L322-W363 HydrophobicContact CD2-CH2 3.71Å; L322-W363 HydrophobicContact CD2-CZ2 3.85Å; L345-W363 HydrophobicContact CD1-CZ2 4.38Å; Y347-W363 AromaticContact CZ-NE1 3.97Å; Y347-W363 PolarHBondContact OH-NE1 3.23Å; Q359-W363 HydrophobicContact CB-CD2 4.17Å; Q359-W363 HydrophobicContact CB-CE3 4.42Å; Q359-W363 HydrophobicContact CB-CH2 3.97Å; Q359-W363 HydrophobicContact CB-CZ2 3.66Å; Q359-W363 HydrophobicContact CB-CZ3 4.34Å; Q359-W363 HydrophobicContact CG-CE3 4.39Å; Q359-W363 HydrophobicContact CG-CH2 3.84Å; Q359-W363 HydrophobicContact CG-CZ2 4.08Å; Q359-W363 HydrophobicContact CG-CZ3 4.01Å; Q359-W363 VanDerWaalsContact O-CB 3.28Å; Q359-W363 WeakPolarHBondContact O-CB 3.28Å; Q359-W363 PolarHBondContact O-N 2.88Å; D360-W363 PolarHBondContact O-N 3.33Å; W363-G365 VanDerWaalsContact C-N 3.32Å
364	I	94	Very high	93	Very high	85 Å²	85	46.4 Å²	46.4	44%	0.436	25%	0.245	S	C	.	.	H	α-helix	trans	-72	-29.1	175.5	-62.2	169.7	0	0	0	110.8	R107 D360	R107-I364 VanDerWaalsContact CD-O 3.31Å; R107-I364 WeakPolarHBondContact CD-O 3.49Å; R107-I364 PolarHBondContact NE-O 2.86Å; D360-I364 WeakPolarHBondContact O-CB 3.44Å; D360-I364 VanDerWaalsContact O-CG1 3.3Å; D360-I364 WeakPolarHBondContact O-CG1 3.45Å; D360-I364 PolarHBondContact O-N 2.79Å
365	G	93.9	Very high	93.2	Very high	12 Å²	12	40.5 Å²	40.5	12%	0.124	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.6	33.3	177.4	0	0	0	0	0	114.8	C361 F362 W363 T367 N373	C361-G365 WeakPolarHBondContact O-CA 3.33Å; C361-G365 PolarHBondContact O-N 3Å; F362-G365 PolarHBondContact O-N 2.97Å; W363-G365 VanDerWaalsContact C-N 3.32Å; G365-T367 PolarHBondContact O-N 3.48Å; G365-N373 WeakPolarHBondContact CA-OD1 3.39Å; G365-N373 PolarHBondContact O-ND2 3.36Å
366	V	93.7	Very high	93.1	Very high	49 Å²	49	42.8 Å²	42.8	30%	0.297	23%	0.231	S	C	.	.			trans	-65	121.2	175.5	-178.1	0	0	0	0	110.3	L357 C361	L357-V366 WeakPolarHBondContact CD1-O 3.02Å; C361-V366 HydrophobicContact CB-CB 4.03Å; C361-V366 HydrophobicContact CB-CG2 4.2Å; C361-V366 PolarHBondContact O-N 2.82Å
367	T	92.9	Very high	93	Very high	65 Å²	65	43 Å²	43	40%	0.399	23%	0.233	S	C	.	.			trans	-114.6	139.6	175.1	43.9	0	0	0	0	110.4	G365 H371 N373	G365-T367 PolarHBondContact O-N 3.48Å; T367-H371 VanDerWaalsContact CB-O 3.27Å; T367-H371 WeakPolarHBondContact CB-O 3.43Å; T367-H371 WeakPolarHBondContact CG2-O 3.32Å; T367-N373 HydrophobicContact CG2-CB 4.42Å; T367-N373 WeakPolarHBondContact CG2-ND2 3.26Å
368	T	90.9	Very high	92.8	Very high	33 Å²	33	46 Å²	46	20%	0.202	25%	0.246	C	C	.	.			trans	-131.8	156.2	170.7	72.4	0	0	0	0	110.2	Y355 Q370 H371	Y355-T368 WeakPolarHBondContact CE2-OG1 3.21Å; Y355-T368 PolarHBondContact OH-N 3.21Å; Y355-T368 PolarHBondContact OH-OG1 2.95Å; T368-Q370 PolarHBondContact O-N 3.34Å; T368-H371 WeakPolarHBondContact O-CB 3.41Å; T368-H371 PolarHBondContact O-N 2.9Å
369	D	83.3	Confident	92.7	Very high	138 Å²	138	46.2 Å²	46.2	74%	0.738	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.1	-130	171.5	-40.2	-68.4	0	0	0	112.1	H371	D369-H371 VanDerWaalsContact C-N 3.32Å
370	Q	86.7	Confident	92.6	Very high	175 Å²	175	48.2 Å²	48.2	82%	0.818	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	2.7	177.4	-59.1	177.6	8	0	0	113.6	T368 H375	T368-Q370 PolarHBondContact O-N 3.34Å; Q370-H375 PolarHBondContact O-CE1 2.82Å; Q370-H375 VanDerWaalsContact O-CE1 3.24Å
371	H	91.7	Very high	92.4	Very high	9 Å²	9	49.4 Å²	49.4	4%	0.042	26%	0.263	C	S	.	.			trans	-84.1	128	179.1	179.4	66.4	0	0	0	111.1	C349 Y355 T367 T368 D369 H375	C349-H371 PolarHBondContact SG-ND1 2.81Å; C349-H371 VanDerWaalsContact SG-ND1 3.42Å; Y355-H371 HydrophobicContact CD1-CB 4.1Å; Y355-H371 AromaticContact CD1-CD2 3.98Å; Y355-H371 AromaticContact CD1-CG 3.76Å; Y355-H371 HydrophobicContact CD2-CB 3.88Å; Y355-H371 HydrophobicContact CE1-CB 3.72Å; Y355-H371 AromaticContact CE1-CD2 3.19Å; Y355-H371 WeakPolarHBondContact CE1-CD2 3.49Å; Y355-H371 AromaticContact CE1-CG 3.35Å; Y355-H371 AromaticContact CE1-NE2 3.78Å; Y355-H371 HydrophobicContact CE2-CB 3.46Å; Y355-H371 VanDerWaalsContact CE2-CB 3.46Å; Y355-H371 HydrophobicContact CG-CB 4.18Å; Y355-H371 AromaticContact CZ-CD2 3.48Å; Y355-H371 VanDerWaalsContact CZ-CD2 3.48Å; Y355-H371 AromaticContact CZ-CG 3.55Å; Y355-H371 PolarHBondContact OH-CD2 3.4Å; T367-H371 VanDerWaalsContact CB-O 3.27Å; T367-H371 WeakPolarHBondContact CB-O 3.43Å; T367-H371 WeakPolarHBondContact CG2-O 3.32Å; T368-H371 WeakPolarHBondContact O-CB 3.41Å; T368-H371 PolarHBondContact O-N 2.9Å; D369-H371 VanDerWaalsContact C-N 3.32Å; H371-H375 AromaticContact ND1-ND1 3.95Å
372	T	93.2	Very high	91.9	Very high	51 Å²	51	52.2 Å²	52.2	31%	0.313	29%	0.287	S	S	.	.			trans	-114.9	154.5	172.7	70.7	0	0	0	0	110.6	A374 H375	T372-A374 PolarHBondContact O-N 3.48Å; T372-A374 PolarHBondContact OG1-N 3.15Å; T372-H375 PolarHBondContact O-N 3.33Å; T372-H375 PolarHBondContact OG1-CD2 2.89Å; T372-H375 PolarHBondContact OG1-NE2 3.02Å
373	N	91.4	Very high	90.7	Very high	51 Å²	51	54.1 Å²	54.1	27%	0.273	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-8.3	170.8	-83.7	-69.4	0	0	0	113.8	R107 G365 T367	R107-N373 VanDerWaalsContact CZ-OD1 3.31Å; R107-N373 VanDerWaalsContact NH1-CG 3.31Å; R107-N373 PolarHBondContact NH1-OD1 3.11Å; R107-N373 PolarHBondContact NH2-OD1 2.86Å; G365-N373 WeakPolarHBondContact CA-OD1 3.39Å; G365-N373 PolarHBondContact O-ND2 3.36Å; T367-N373 HydrophobicContact CG2-CB 4.42Å; T367-N373 WeakPolarHBondContact CG2-ND2 3.26Å
374	A	92.3	Very high	88.9	Confident	15 Å²	15	57.5 Å²	57.5	12%	0.124	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-1.9	176.2	0	0	0	0	0	114	T372 N502	T372-A374 PolarHBondContact O-N 3.48Å; T372-A374 PolarHBondContact OG1-N 3.15Å; A374-N502 WeakPolarHBondContact CA-ND2 3.32Å; A374-N502 HydrophobicContact CB-CB 3.58Å; A374-N502 VanDerWaalsContact CB-CG 3.42Å; A374-N502 WeakPolarHBondContact CB-ND2 3.36Å
375	H	93.9	Very high	86.8	Confident	39 Å²	39	62.9 Å²	62.9	18%	0.181	35%	0.35	C	S	.	.	S	Bend	trans	-88.4	140.1	175.5	-63.8	-179.2	0	0	0	110.2	R351 C352 Q370 H371 T372	R351-H375 HydrophobicContact CB-CB 4.35Å; R351-H375 HydrophobicContact CG-CB 4.24Å; C352-H375 PolarHBondContact SG-ND1 2.89Å; Q370-H375 PolarHBondContact O-CE1 2.82Å; Q370-H375 VanDerWaalsContact O-CE1 3.24Å; H371-H375 AromaticContact ND1-ND1 3.95Å; T372-H375 PolarHBondContact O-N 3.33Å; T372-H375 PolarHBondContact OG1-CD2 2.89Å; T372-H375 PolarHBondContact OG1-NE2 3.02Å
376	D	92.8	Very high	84.1	Confident	64 Å²	64	66.4 Å²	66.4	34%	0.342	37%	0.373	S	S	.	.			trans	-69.6	140.7	-178.6	-32.3	-86.6	0	0	0	110.4	T350 R351	T350-D376 HydrophobicContact CG2-CB 4.29Å; T350-D376 PolarHBondContact N-O 2.96Å; T350-D376 PolarHBondContact OG1-O 3.48Å; R351-D376 IonicContact CZ-OD2 2.68Å; R351-D376 IonicContact NE-OD2 2.64Å; R351-D376 PolarHBondContact NE-OD2 3.24Å; R351-D376 IonicContact NH2-OD1 3.73Å; R351-D376 PolarHBondContact NH2-OD1 3.42Å; R351-D376 IonicContact NH2-OD2 2.69Å; R351-D376 PolarHBondContact NH2-OD2 3.26Å
377	V	92.5	Very high	81.4	Confident	16 Å²	16	71.1 Å²	71.1	10%	0.097	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	131.8	-173.3	173.9	0	0	0	0	109.2	Y347 K348 F362	Y347-V377 HydrophobicContact CD1-CG1 3.96Å; Y347-V377 HydrophobicContact CG-CG1 4.29Å; K348-V377 WeakPolarHBondContact O-CA 3.39Å; F362-V377 HydrophobicContact CD2-CG1 4.05Å; F362-V377 HydrophobicContact CD2-CG2 4.5Å; F362-V377 HydrophobicContact CE2-CB 3.89Å; F362-V377 HydrophobicContact CE2-CG1 3.81Å; F362-V377 HydrophobicContact CE2-CG2 4.04Å; F362-V377 HydrophobicContact CZ-CG1 4.44Å
378	K	93.5	Very high	78.8	Confident	65 Å²	65	71.5 Å²	71.5	28%	0.283	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	127.2	176.6	-177.7	167.6	177.4	174.3	0	110.5	K348 Y380 H438	K348-K378 PolarHBondContact N-O 3.39Å; K348-K378 PolarHBondContact O-N 2.92Å; K378-Y380 HydrophobicContact CB-CE2 4Å; K378-Y380 HydrophobicContact CD-CE2 4.21Å; K378-Y380 HydrophobicContact CG-CD2 4.46Å; K378-Y380 HydrophobicContact CG-CE2 3.78Å; K378-Y380 WeakPolarHBondContact O-CD2 3.44Å; K378-Y380 WeakPolarHBondContact O-CE2 3.48Å; K378-H438 PolarHBondContact NZ-CE1 3.36Å; K378-H438 PolarHBondContact NZ-NE2 3.42Å
379	E	93	Very high	76.5	Confident	10 Å²	10	80.6 Å²	80.6	5%	0.047	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	146.1	173.2	-165.9	-172.5	97.1	0	0	111.5	Y111 R321 L345 R346 Y347 S381 I442	Y111-E379 PolarHBondContact OH-OE2 3.45Å; R321-E379 WeakPolarHBondContact CD-OE1 3.24Å; R321-E379 IonicContact CZ-OE1 3.38Å; R321-E379 VanDerWaalsContact CZ-OE1 3.26Å; R321-E379 IonicContact CZ-OE2 2.72Å; R321-E379 VanDerWaalsContact CZ-OE2 3.29Å; R321-E379 IonicContact NE-OE1 3.15Å; R321-E379 PolarHBondContact NE-OE1 3.28Å; R321-E379 IonicContact NE-OE2 2.72Å; R321-E379 IonicContact NH1-OE1 2.75Å; R321-E379 PolarHBondContact NH1-OE1 2.97Å; R321-E379 IonicContact NH1-OE2 3.82Å; R321-E379 PolarHBondContact NH1-OE2 3.26Å; R321-E379 IonicContact NH2-OE2 3.72Å; L345-E379 HydrophobicContact CB-CG 4.37Å; L345-E379 HydrophobicContact CD2-CG 4.16Å; R346-E379 CarbonylContact O-C 3.59Å; R346-E379 WeakPolarHBondContact O-CA 3.38Å; Y347-E379 HydrophobicContact CD1-CB 4.11Å; Y347-E379 HydrophobicContact CD1-CG 4.15Å; Y347-E379 HydrophobicContact CE1-CB 3.76Å; Y347-E379 HydrophobicContact CE1-CG 3.53Å; Y347-E379 WeakPolarHBondContact CE1-OE2 3.27Å; Y347-E379 PolarHBondContact OH-OE2 3.03Å; E379-S381 PolarHBondContact OE1-OG 3.2Å; E379-I442 HydrophobicContact CB-CD1 4.14Å
380	Y	92.8	Very high	74.9	Confident	81 Å²	81	79.7 Å²	79.7	32%	0.318	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	114.4	172.9	-66.7	-102.6	0	0	0	108.7	H330 R346 K348 K378	H330-Y380 PolarHBondContact CE1-O 3.08Å; H330-Y380 VanDerWaalsContact CE1-O 3.31Å; H330-Y380 PolarHBondContact NE2-O 3.26Å; R346-Y380 PolarHBondContact N-O 2.96Å; R346-Y380 PolarHBondContact O-N 3.47Å; K348-Y380 HydrophobicContact CB-CD2 4.25Å; K348-Y380 HydrophobicContact CB-CE2 3.71Å; K378-Y380 HydrophobicContact CB-CE2 4Å; K378-Y380 HydrophobicContact CD-CE2 4.21Å; K378-Y380 HydrophobicContact CG-CD2 4.46Å; K378-Y380 HydrophobicContact CG-CE2 3.78Å; K378-Y380 WeakPolarHBondContact O-CD2 3.44Å; K378-Y380 WeakPolarHBondContact O-CE2 3.48Å
381	S	89.9	Confident	72.5	Confident	52 Å²	52	78.5 Å²	78.5	36%	0.364	41%	0.411	S	S	.	.			trans	-98.8	2.4	-177.1	-25.4	0	0	0	0	113.4	V325 E379	V325-S381 WeakPolarHBondContact CG1-O 3.42Å; E379-S381 PolarHBondContact OE1-OG 3.2Å
382	A	86.8	Confident	70	Confident	66 Å²	66	80.9 Å²	80.9	55%	0.545	44%	0.438	S	S	.	.	S	Bend	trans	-132.7	136.4	-176.1	0	0	0	0	0	111.7	H330 S384	H330-A382 VanDerWaalsContact CE1-C 3.43Å; H330-A382 PolarHBondContact CE1-O 3.32Å; H330-A382 PolarHBondContact ND1-O 3.03Å; A382-S384 PolarHBondContact O-N 3.03Å
383	A	71.1	Confident	67.5	Low	48 Å²	48	86.1 Å²	86.1	40%	0.397	46%	0.459	S	S	.	.			trans	-53.7	124.2	169.5	0	0	0	0	0	108.9	V328 R329 K385	V328-A383 HydrophobicContact CG1-CB 4.16Å; V328-A383 VanDerWaalsContact CG1-N 3.33Å; R329-A383 VanDerWaalsContact O-CB 3.27Å; R329-A383 WeakPolarHBondContact O-CB 3.2Å; A383-K385 PolarHBondContact O-N 3.19Å
384	S	57.7	Low	65.4	Low	84 Å²	84	87.7 Å²	87.7	59%	0.587	47%	0.473	S	S	*	.			trans	-71.8	90	-172.7	50.2	0	0	0	0	110.5	A382 S386	A382-S384 PolarHBondContact O-N 3.03Å; S384-S386 PolarHBondContact O-N 3.41Å
385	K	48.2	Very low	63	Low	197 Å²	197	91.3 Å²	91.3	86%	0.857	49%	0.49	S	S	*	.			trans	-50.3	136.4	165.2	-66.2	-171.3	178.3	-174.9	0	108.3	A383	A383-K385 PolarHBondContact O-N 3.19Å
386	S	37.3	Very low	60.8	Low	86 Å²	86	100.1 Å²	100.1	60%	0.601	52%	0.522	S	S	*	.			trans	-55.2	155.5	-168.3	65.4	0	0	0	0	112.9	S384 S388	S384-S386 PolarHBondContact O-N 3.41Å; S386-S388 PolarHBondContact O-N 2.81Å; S386-S388 PolarHBondContact O-OG 3.38Å; S386-S388 PolarHBondContact OG-OG 2.87Å
387	H	37.9	Very low	58.5	Low	148 Å²	148	104.8 Å²	104.8	69%	0.685	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-55.4	-14.8	-176.4	-138.6	-105.1	0	0	0	114.3	R389 Q390	H387-R389 VanDerWaalsContact C-N 3.28Å; H387-R389 PolarHBondContact O-N 3.4Å; H387-R389 VanDerWaalsContact O-N 3.15Å; H387-Q390 PolarHBondContact O-N 3.37Å
388	S	38	Very low	56.2	Low	74 Å²	74	107.4 Å²	107.4	52%	0.517	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-43.6	-41.2	177.4	59.6	0	0	0	0	115.5	S386	S386-S388 PolarHBondContact O-N 2.81Å; S386-S388 PolarHBondContact O-OG 3.38Å; S386-S388 PolarHBondContact OG-OG 2.87Å
389	R	43	Very low	53.7	Low	223 Å²	223	112.3 Å²	112.3	84%	0.842	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-88.9	3.6	-173.8	-66.2	-163.5	-179.8	-140.7	0.3	115.6	H387	H387-R389 VanDerWaalsContact C-N 3.28Å; H387-R389 PolarHBondContact O-N 3.4Å; H387-R389 VanDerWaalsContact O-N 3.15Å
390	Q	48.7	Very low	51.2	Low	120 Å²	120	120.3 Å²	120.3	56%	0.561	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-93.4	-16.7	177.2	-69.3	-165.9	-6.5	0	0	114.8	H387 G392 H393 S394	H387-Q390 PolarHBondContact O-N 3.37Å; Q390-G392 VanDerWaalsContact C-N 3.28Å; Q390-G392 PolarHBondContact O-N 3.43Å; Q390-H393 PolarHBondContact O-N 3.26Å; Q390-S394 PolarHBondContact O-N 3.06Å
391	F	37	Very low	48.2	Very low	149 Å²	149	126.4 Å²	126.4	65%	0.654	65%	0.646	S	S	*	*	H	α-helix	trans	-51.7	-42.9	-179.9	-95.9	-86.6	0	0	0	113.5	H393 L395	F391-H393 VanDerWaalsContact C-N 3.3Å; F391-H393 PolarHBondContact O-N 3.41Å; F391-L395 WeakPolarHBondContact O-CG 3.35Å
392	G	39.8	Very low	45.4	Very low	59 Å²	59	127.3 Å²	127.3	61%	0.608	66%	0.663	S	S	*	*	H	α-helix	trans	-67.5	-22.3	-179.8	0	0	0	0	0	115.4	Q390	Q390-G392 VanDerWaalsContact C-N 3.28Å; Q390-G392 PolarHBondContact O-N 3.43Å
393	H	40.4	Very low	42.7	Very low	162 Å²	162	135.4 Å²	135.4	75%	0.75	68%	0.68	S	S	*	*	H	α-helix	trans	-94.4	-26.8	-177.2	-91.6	-64.6	0	0	0	114.2	Q390 F391	Q390-H393 PolarHBondContact O-N 3.26Å; F391-H393 VanDerWaalsContact C-N 3.3Å; F391-H393 PolarHBondContact O-N 3.41Å
394	S	46.6	Very low	40.7	Very low	83 Å²	83	138.2 Å²	138.2	58%	0.58	70%	0.703	S	S	*	*	H	α-helix	trans	-75.4	-41.6	174.6	-62.3	0	0	0	0	112.1	Q390 R396 K397	Q390-S394 PolarHBondContact O-N 3.06Å; S394-R396 VanDerWaalsContact C-N 3.26Å; S394-R396 PolarHBondContact O-N 3.36Å; S394-K397 PolarHBondContact O-N 2.72Å
395	L	43.3	Very low	39.6	Very low	92 Å²	92	140.9 Å²	140.9	48%	0.482	71%	0.709	S	S	.	*	H	α-helix	trans	-61	-31.7	-177.5	-69.4	171.9	0	0	0	113.2	F391 K397 S398 F399	F391-L395 WeakPolarHBondContact O-CG 3.35Å; L395-K397 PolarHBondContact O-N 2.74Å; L395-S398 PolarHBondContact O-N 3.47Å; L395-S398 PolarHBondContact O-OG 2.78Å; L395-F399 VanDerWaalsContact O-CD2 3.26Å; L395-F399 WeakPolarHBondContact O-CD2 3.18Å
396	R	45.8	Very low	39	Very low	224 Å²	224	136.9 Å²	136.9	85%	0.845	70%	0.702	S	S	*	*	H	α-helix	trans	-75.2	3.2	176.9	-117.6	-176.1	-170.9	-137.8	1.8	115	S394	S394-R396 VanDerWaalsContact C-N 3.26Å; S394-R396 PolarHBondContact O-N 3.36Å
397	K	44.7	Very low	38.7	Very low	162 Å²	162	140.2 Å²	140.2	70%	0.704	71%	0.712	S	S	*	*	H	α-helix	trans	-106.2	-16.8	167.9	-80.9	-171.5	172.3	-174.5	0	114.3	S394 L395	S394-K397 PolarHBondContact O-N 2.72Å; L395-K397 PolarHBondContact O-N 2.74Å
398	S	45.8	Very low	38.5	Very low	71 Å²	71	138.5 Å²	138.5	50%	0.497	72%	0.717	S	S	.	*	H	α-helix	trans	-85.7	-14.7	179.4	48.4	0	0	0	0	114	L395	L395-S398 PolarHBondContact O-N 3.47Å; L395-S398 PolarHBondContact O-OG 2.78Å
399	F	40	Very low	38.3	Very low	168 Å²	168	141 Å²	141	74%	0.737	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	38.3	-178	-67	-66.6	0	0	0	114.5	L395	L395-F399 VanDerWaalsContact O-CD2 3.26Å; L395-F399 WeakPolarHBondContact O-CD2 3.18Å
400	Q	40.6	Very low	38	Very low	177 Å²	177	136.6 Å²	136.6	83%	0.827	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.8	10.5	168.5	-86.8	-173.3	-45.2	0	0	114.1
401	F	30.7	Very low	37.5	Very low	210 Å²	210	136.1 Å²	136.1	92%	0.921	74%	0.735	S	S	*	*			trans	-103.6	111.2	159.8	-90.2	-92.6	0	0	0	109.4
402	G	29.9	Very low	37.4	Very low	71 Å²	71	136.2 Å²	136.2	73%	0.732	74%	0.742	S	S	*	*			trans	165.7	122.6	175.7	0	0	0	0	0	113.2
403	R	29.9	Very low	37.1	Very low	235 Å²	235	138.8 Å²	138.8	89%	0.887	75%	0.746	S	S	*	*			trans	65.1	87.9	174.3	-58	-178	177	-172.2	-2.1	116.9
404	A	29.2	Very low	36.8	Very low	107 Å²	107	137.2 Å²	137.2	88%	0.884	75%	0.747	S	S	*	*				-123.1	133.5	104.2	0	0	0	0	0	107.6
405	I	35.4	Very low	36.1	Very low	140 Å²	140	138.3 Å²	138.3	72%	0.718	75%	0.751	S	S	*	*			trans	-136.3	164.3	177.7	-43	179.3	0	0	0	106.7
406	T	35.1	Very low	35.7	Very low	114 Å²	114	139 Å²	139	70%	0.699	76%	0.759	S	S	*	*			trans	76.9	101	169.2	63.5	0	0	0	0	118.3
407	N	31.5	Very low	35.2	Very low	155 Å²	155	132.4 Å²	132.4	83%	0.829	75%	0.747	S	S	*	*				62.8	115.6	121.8	-57	8.4	0	0	0	120.5
408	S	33.2	Very low	34.7	Very low	112 Å²	112	133.6 Å²	133.6	78%	0.783	75%	0.753	S	S	*	*			trans	-70.2	130.7	149.2	50.6	0	0	0	0	111.6
409	T	34.8	Very low	34	Very low	126 Å²	126	136.1 Å²	136.1	77%	0.773	77%	0.765	S	S	*	*			trans	-165.2	93.9	143.4	-74.4	0	0	0	0	110.3
410	T	36.2	Very low	33.6	Very low	131 Å²	131	132.8 Å²	132.8	80%	0.804	76%	0.763	S	S	*	*			trans	65	154.1	150.5	53.9	0	0	0	0	121.5
411	P	37.7	Very low	33.3	Very low	110 Å²	110	129.4 Å²	129.4	71%	0.714	76%	0.758	S	S	*	*			trans	-119.1	176.7	-155.7	43.1	-31.7	0	0	0	114.5
412	N	34.9	Very low	33.3	Very low	151 Å²	151	128.6 Å²	128.6	81%	0.807	76%	0.755	S	S	*	*			trans	-169.3	148.9	139.8	-108.2	-28.1	0	0	0	115
413	V	34.3	Very low	33.3	Very low	114 Å²	114	130.1 Å²	130.1	69%	0.691	76%	0.755	S	S	*	*			trans	67.1	112.4	135.6	169.1	0	0	0	0	120.6
414	V	33.4	Very low	33.2	Very low	129 Å²	129	125.4 Å²	125.4	78%	0.782	74%	0.743	S	S	*	*			trans	71.3	143.4	132.3	160.7	0	0	0	0	119.9
415	T	32.6	Very low	33.1	Very low	106 Å²	106	129.6 Å²	129.6	65%	0.65	74%	0.735	S	S	*	*			cis	-167.8	167.2	-18.7	-156.7	0	0	0	0	112.7
416	T	34.2	Very low	32.8	Very low	106 Å²	106	129.5 Å²	129.5	65%	0.65	73%	0.732	S	S	*	*			trans	43.1	116.9	160.2	63	0	0	0	0	120.8
417	S	36.2	Very low	32.4	Very low	86 Å²	86	131.9 Å²	131.9	60%	0.601	73%	0.733	S	S	*	*				97.3	165.1	98.8	75.1	0	0	0	0	115
418	F	33.7	Very low	32.2	Very low	187 Å²	187	134.2 Å²	134.2	82%	0.82	74%	0.736	S	S	*	*			cis	-133.2	176.7	5.5	-97.1	-67.7	0	0	0	112.7
419	T	30.9	Very low	32	Very low	123 Å²	123	135 Å²	135	76%	0.755	74%	0.742	S	S	*	*			trans	-51.3	171.7	168.2	56.7	0	0	0	0	114.3
420	S	32.3	Very low	31.7	Very low	99 Å²	99	132.5 Å²	132.5	69%	0.692	74%	0.74	S	S	*	*			cis	-168.9	153.2	32.5	57.7	0	0	0	0	115.5
421	S	33.2	Very low	31.3	Very low	105 Å²	105	134.7 Å²	134.7	73%	0.734	74%	0.743	S	S	*	*			trans	61.6	128.3	136	-59.7	0	0	0	0	124.6
422	F	30.7	Very low	30.9	Very low	194 Å²	194	137.2 Å²	137.2	85%	0.851	75%	0.751	S	S	*	*			trans	64.7	105.6	136.7	-88.9	-105.8	0	0	0	123
423	S	29	Very low	30.6	Very low	103 Å²	103	135.8 Å²	135.8	72%	0.72	75%	0.748	S	S	*	*				86.5	141.5	119.7	-146.4	0	0	0	0	122.9
424	E	28.8	Very low	30.2	Very low	136 Å²	136	136 Å²	136	64%	0.636	75%	0.754	S	S	*	*			trans	85.3	97.1	145.9	-152.5	149.8	-170.2	0	0	122.6
425	R	27.1	Very low	29.8	Very low	194 Å²	194	139.9 Å²	139.9	73%	0.732	76%	0.755	S	S	*	*				83.4	131.1	129.7	-173.3	-179.6	-58.5	-109.8	6.9	120.6
426	Q	28.7	Very low	29.5	Very low	139 Å²	139	146.3 Å²	146.3	65%	0.65	77%	0.767	S	S	*	*			trans	84.3	108.7	160.1	-81.8	-176.8	75.3	0	0	121.8
427	K	27.7	Very low	29.1	Very low	164 Å²	164	146.3 Å²	146.3	71%	0.713	77%	0.769	S	S	*	*				80.1	116.4	126.9	-71.8	175.5	178.8	160.7	0	122.1
428	F	26.2	Very low	28.7	Very low	203 Å²	203	148.9 Å²	148.9	89%	0.89	77%	0.771	S	S	*	*			trans	62.7	103.8	132	-88.5	-94	0	0	0	121
429	S	29.2	Very low	28.7	Very low	130 Å²	130	144.1 Å²	144.1	91%	0.909	76%	0.757	S	S	*	*			trans	-165.6	170.9	133.7	37.3	0	0	0	0	108.9
430	G	28.7	Very low	28.5	Very low	72 Å²	72	140.3 Å²	140.3	74%	0.742	74%	0.743	S	S	*	*			trans	113.7	42.9	168.5	0	0	0	0	0	119.2
431	M	27.3	Very low	28.5	Very low	177 Å²	177	138.2 Å²	138.2	87%	0.872	73%	0.728	S	S	*	*			trans	24	115.6	144.2	-61.9	159.7	69.1	0	0	119.2
432	N	29.5	Very low	28.8	Very low	163 Å²	163	134.2 Å²	134.2	87%	0.872	70%	0.698	S	S	*	*			trans	-128.6	132.3	152.4	-130.8	-41.8	0	0	0	109.9	S434	N432-S434 PolarHBondContact O-N 2.92Å
433	V	28.7	Very low	28.9	Very low	122 Å²	122	129.1 Å²	129.1	74%	0.739	68%	0.676	S	S	*	*			trans	-87.8	111.2	-166.4	178.4	0	0	0	0	110.8	R435	V433-R435 PolarHBondContact O-N 3.39Å
434	S	26.2	Very low	29	Very low	119 Å²	119	129.8 Å²	129.8	83%	0.832	67%	0.667	S	S	*	*			trans	-57	101.5	177.9	-54.7	0	0	0	0	112.2	N432	N432-S434 PolarHBondContact O-N 2.92Å
435	R	25.4	Very low	29	Very low	209 Å²	209	126.9 Å²	126.9	79%	0.789	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-72.7	133.7	166.5	-61	-179.3	-176.4	-179	3.4	107.8	V433 P437	V433-R435 PolarHBondContact O-N 3.39Å; R435-P437 WeakPolarHBondContact O-CD 3.41Å
436	R	24.8	Very low	29.2	Very low	242 Å²	242	122.8 Å²	122.8	91%	0.913	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-60	130.7	166.2	-67.8	-173.6	-179.4	-154.4	-1.6	108.8
437	P	26.5	Very low	29.1	Very low	105 Å²	105	120.7 Å²	120.7	68%	0.682	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-56.3	158.1	165.2	-24.5	35.6	0	0	0	111.4	R435	R435-P437 WeakPolarHBondContact O-CD 3.41Å
438	H	28.3	Very low	29.1	Very low	141 Å²	141	119.5 Å²	119.5	65%	0.653	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-78.5	149.7	172.8	-174.8	-85.7	0	0	0	109.5	K378 G440	K378-H438 PolarHBondContact NZ-CE1 3.36Å; K378-H438 PolarHBondContact NZ-NE2 3.42Å; H438-G440 PolarHBondContact O-N 3.39Å; H438-G440 VanDerWaalsContact O-N 3.12Å
439	V	32.9	Very low	29.3	Very low	86 Å²	86	115.8 Å²	115.8	52%	0.521	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-52.5	120	172.6	-173.3	0	0	0	0	108.8
440	G	28.1	Very low	29.3	Very low	44 Å²	44	114.4 Å²	114.4	45%	0.454	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-61.9	164.8	-178.4	0	0	0	0	0	112.8	H438	H438-G440 PolarHBondContact O-N 3.39Å; H438-G440 VanDerWaalsContact O-N 3.12Å
441	S	31.9	Very low	29.4	Very low	54 Å²	54	116.4 Å²	116.4	38%	0.378	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-69.6	140.5	177.4	-170.5	0	0	0	0	109.7	F443 E444 W445	S441-F443 PolarHBondContact O-N 3.31Å; S441-F443 VanDerWaalsContact O-N 3.11Å; S441-E444 VanDerWaalsContact CB-OE2 3.29Å; S441-E444 WeakPolarHBondContact CB-OE2 3.44Å; S441-E444 PolarHBondContact N-OE2 3.01Å; S441-E444 PolarHBondContact O-N 2.84Å; S441-W445 PolarHBondContact O-NE1 2.69Å; S441-W445 VanDerWaalsContact O-NE1 3.08Å
442	I	38.6	Very low	29.4	Very low	22 Å²	22	114.2 Å²	114.2	11%	0.113	63%	0.628	C	S	.	*	T	Hydrogen-bonded Turn	trans	-70.6	-8.6	-177.6	-123.4	167.6	0	0	0	112.9	Y111 Y347 F362 E379	Y111-I442 WeakPolarHBondContact OH-CD1 3.42Å; Y347-I442 HydrophobicContact CD1-CD1 4.32Å; Y347-I442 HydrophobicContact CE1-CD1 3.62Å; F362-I442 HydrophobicContact CE1-CD1 4.2Å; F362-I442 HydrophobicContact CZ-CD1 4.48Å; F362-I442 HydrophobicContact CZ-CG2 4.06Å; E379-I442 HydrophobicContact CB-CD1 4.14Å
443	F	32.9	Very low	29.5	Very low	86 Å²	86	112.3 Å²	112.3	38%	0.377	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.3	-11.9	-178	-63.3	-77.8	0	0	0	114.5	S441 W445	S441-F443 PolarHBondContact O-N 3.31Å; S441-F443 VanDerWaalsContact O-N 3.11Å; F443-W445 PolarHBondContact O-N 3.23Å
444	E	31.5	Very low	29.4	Very low	118 Å²	118	109.6 Å²	109.6	55%	0.551	62%	0.62	S	S	*	*	G	3₁₀ helix	trans	-70.8	-14.1	178	-70.7	169.2	106.5	0	0	113	S441 N446	S441-E444 VanDerWaalsContact CB-OE2 3.29Å; S441-E444 WeakPolarHBondContact CB-OE2 3.44Å; S441-E444 PolarHBondContact N-OE2 3.01Å; S441-E444 PolarHBondContact O-N 2.84Å; E444-N446 PolarHBondContact O-N 3.46Å
445	W	29.4	Very low	29.6	Very low	74 Å²	74	111.8 Å²	111.8	28%	0.28	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-86.9	1.4	-172.4	-53	94.3	0	0	0	115.4	D307 Q308 V314 S441 F443	D307-W445 WeakPolarHBondContact O-CH2 3.44Å; D307-W445 WeakPolarHBondContact O-CZ3 3.25Å; Q308-W445 HydrophobicContact CG-CH2 4.43Å; V314-W445 HydrophobicContact CG2-CE3 4.09Å; S441-W445 PolarHBondContact O-NE1 2.69Å; S441-W445 VanDerWaalsContact O-NE1 3.08Å; F443-W445 PolarHBondContact O-N 3.23Å
446	N	30.5	Very low	29.5	Very low	108 Å²	108	111.1 Å²	111.1	58%	0.578	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-123.8	25.7	-175.8	-60.7	-43.2	0	0	0	112.8	E444	E444-N446 PolarHBondContact O-N 3.46Å
447	S	27.2	Very low	29.8	Very low	95 Å²	95	104.7 Å²	104.7	66%	0.664	62%	0.621	S	S	*	*			trans	-97.1	134.4	175.3	-60.8	0	0	0	0	111.2
448	D	27.4	Very low	29.7	Very low	140 Å²	140	105.1 Å²	105.1	75%	0.749	63%	0.625	S	S	*	*			trans	-58.5	144.4	177.8	-87.5	-54.9	0	0	0	112.7	S450	D448-S450 PolarHBondContact O-N 2.83Å
449	P	29.6	Very low	29.8	Very low	124 Å²	124	105.2 Å²	105.2	81%	0.805	64%	0.635	S	S	*	*			trans	-75.3	58.3	175.4	34.6	-36.9	0	0	0	111.9
450	S	31.1	Very low	29.7	Very low	101 Å²	101	108.7 Å²	108.7	71%	0.706	65%	0.651	S	S	*	*			trans	-78.5	133.4	169.6	52.4	0	0	0	0	110.2	D448 P452	D448-S450 PolarHBondContact O-N 2.83Å; S450-P452 WeakPolarHBondContact O-CD 3.28Å
451	V	30.1	Very low	29.8	Very low	115 Å²	115	110 Å²	110	70%	0.697	66%	0.664	S	S	*	*			trans	-73.9	124.2	-159.3	-171.4	0	0	0	0	112.8	T453	V451-T453 VanDerWaalsContact C-N 3.29Å; V451-T453 WeakPolarHBondContact CG1-OG1 3.43Å; V451-T453 PolarHBondContact O-N 3.25Å
452	P	28	Very low	29.8	Very low	130 Å²	130	115.8 Å²	115.8	84%	0.844	69%	0.689	S	S	*	*			trans	-81.6	72.1	169.6	33.8	-33.7	0	0	0	110.9	S450 G454	S450-P452 WeakPolarHBondContact O-CD 3.28Å; P452-G454 PolarHBondContact O-N 3.1Å; P452-G454 VanDerWaalsContact O-N 3.11Å
453	T	29.8	Very low	29.3	Very low	124 Å²	124	119 Å²	119	76%	0.761	72%	0.718	S	S	*	*			trans	-72	101.4	174.7	-53.5	0	0	0	0	109.9	V451	V451-T453 VanDerWaalsContact C-N 3.29Å; V451-T453 WeakPolarHBondContact CG1-OG1 3.43Å; V451-T453 PolarHBondContact O-N 3.25Å
454	G	27.4	Very low	29.5	Very low	65 Å²	65	120.1 Å²	120.1	67%	0.67	74%	0.735	S	S	*	*			trans	-160.2	35.4	-170.4	0	0	0	0	0	116	P452 M456	P452-G454 PolarHBondContact O-N 3.1Å; P452-G454 VanDerWaalsContact O-N 3.11Å; G454-M456 PolarHBondContact O-N 3.43Å; G454-M456 VanDerWaalsContact O-N 3.13Å
455	I	30.1	Very low	29.6	Very low	164 Å²	164	119.5 Å²	119.5	84%	0.841	74%	0.744	S	S	*	*			trans	-80.4	90.9	174.4	-54.7	178.8	0	0	0	109.6	S457	I455-S457 PolarHBondContact O-N 3.05Å
456	M	24.3	Very low	30	Very low	196 Å²	196	122.5 Å²	122.5	97%	0.966	77%	0.77	S	S	*	*			trans	-79.7	108.6	153.5	-78.2	-168.7	73.8	0	0	108.7	G454	G454-M456 PolarHBondContact O-N 3.43Å; G454-M456 VanDerWaalsContact O-N 3.13Å
457	S	29.5	Very low	30.3	Very low	106 Å²	106	122.5 Å²	122.5	74%	0.741	78%	0.775	S	S	*	*			trans	-117.8	140.5	161.8	-166.9	0	0	0	0	108.6	I455	I455-S457 PolarHBondContact O-N 3.05Å
458	C	24.7	Very low	30.8	Very low	114 Å²	114	124.7 Å²	124.7	77%	0.77	78%	0.78	S	S	*	*			trans	-84.8	142.2	-165.3	47.4	0	0	0	0	114
459	V	31.1	Very low	31	Very low	143 Å²	143	124.9 Å²	124.9	87%	0.867	78%	0.781	S	S	*	*			trans	-135.9	138	158.8	-175.4	0	0	0	0	107.2
460	N	30.2	Very low	31.2	Very low	159 Å²	159	126 Å²	126	85%	0.85	78%	0.778	S	S	*	*			trans	-87.9	147.9	-178	-62.2	-33.4	0	0	0	111.2
461	G	31.3	Very low	31.4	Very low	71 Å²	71	125.4 Å²	125.4	73%	0.732	78%	0.779	S	S	*	*			trans	171.3	84.2	166.7	0	0	0	0	0	118.7
462	I	32.2	Very low	31.6	Very low	176 Å²	176	126.4 Å²	126.4	90%	0.903	79%	0.786	S	S	*	*			trans	63.5	142.9	143.9	-54.3	172.1	0	0	0	118.6
463	A	27.9	Very low	32	Very low	89 Å²	89	123.6 Å²	123.6	74%	0.736	78%	0.781	S	S	*	*			trans	-142.9	151.6	176.8	0	0	0	0	0	113.1
464	P	35.4	Very low	32.3	Very low	110 Å²	110	125.4 Å²	125.4	71%	0.714	78%	0.784	S	S	*	*			trans	-125.4	140.3	139.4	9	13.5	0	0	0	110.5
465	S	34	Very low	32.6	Very low	106 Å²	106	127.9 Å²	127.9	74%	0.741	79%	0.791	S	S	*	*				59.6	136	68.2	81	0	0	0	0	113.6
466	V	37.5	Very low	32.9	Very low	137 Å²	137	125 Å²	125	83%	0.83	79%	0.792	S	S	*	*			cis	-149	-173.2	22.7	-117.5	0	0	0	0	111
467	P	37.9	Very low	33.4	Very low	107 Å²	107	118.9 Å²	118.9	70%	0.695	78%	0.779	S	S	*	*			trans	-131	-145.2	-147.7	41.5	-18.4	0	0	0	116.7
468	N	36.5	Very low	33.6	Very low	142 Å²	142	119 Å²	119	76%	0.759	78%	0.779	S	S	*	*			trans	95.7	154.1	171.2	-63.7	14.8	0	0	0	118
469	D	32.2	Very low	34.4	Very low	143 Å²	143	122 Å²	122	77%	0.765	78%	0.781	S	S	*	*			cis	-170.1	-170	-41.7	-136.1	-44.8	0	0	0	110.9
470	I	34.7	Very low	34.8	Very low	148 Å²	148	121 Å²	121	76%	0.759	78%	0.778	S	S	*	*			trans	83.4	108.9	170.9	-50.2	168.4	0	0	0	113.8
471	A	34.1	Very low	35	Very low	88 Å²	88	116.8 Å²	116.8	73%	0.727	77%	0.771	S	S	*	*				80.5	145.9	58.8	0	0	0	0	0	114.1
472	T	35.8	Very low	35.2	Very low	137 Å²	137	123 Å²	123	84%	0.84	78%	0.782	S	S	*	*			cis	-163.5	148.9	31.9	-41.6	0	0	0	0	114.3
473	G	36.1	Very low	35.3	Very low	71 Å²	71	120.6 Å²	120.6	73%	0.732	78%	0.777	S	S	*	*			trans	78.9	158.8	145.7	0	0	0	0	0	119.9
474	I	35.2	Very low	35.6	Very low	161 Å²	161	120.9 Å²	120.9	83%	0.826	78%	0.78	S	S	*	*			cis	-152.5	124.4	-2.4	-75	166	0	0	0	105.1
475	S	33.6	Very low	35.7	Very low	118 Å²	118	121.6 Å²	121.6	83%	0.825	78%	0.784	S	S	*	*				65.8	142.9	70.4	-81.2	0	0	0	0	116.3
476	A	36.6	Very low	35.5	Very low	103 Å²	103	123.2 Å²	123.2	85%	0.851	79%	0.785	S	S	*	*			cis	-155.7	169.9	5.7	0	0	0	0	0	114.4
477	G	35.5	Very low	35.1	Very low	68 Å²	68	124.7 Å²	124.7	70%	0.701	78%	0.783	S	S	*	*			trans	97.1	177.6	165.1	0	0	0	0	0	116
478	C	32.8	Very low	34.7	Very low	109 Å²	109	130.8 Å²	130.8	74%	0.736	79%	0.792	S	S	*	*			cis	-174.3	155.7	-23.7	-96	0	0	0	0	107
479	H	41	Very low	34.2	Very low	175 Å²	175	133.8 Å²	133.8	81%	0.81	80%	0.799	S	S	*	*			cis	-155.3	171.9	-10.9	-115	2.7	0	0	0	108.8
480	P	41.3	Very low	34.1	Very low	124 Å²	124	135 Å²	135	81%	0.805	80%	0.802	S	S	*	*			trans	-122.9	174.7	-148.9	43.2	-34	0	0	0	118.5
481	G	34.3	Very low	33.8	Very low	69 Å²	69	132.1 Å²	132.1	71%	0.711	80%	0.799	S	S	*	*			trans	-155.9	126.9	166	0	0	0	0	0	115.3
482	Q	34.7	Very low	33.6	Very low	202 Å²	202	133.6 Å²	133.6	94%	0.944	80%	0.802	S	S	*	*			trans	68.9	156.5	165.6	-69.6	-164.8	-21.6	0	0	120.9
483	P	34.1	Very low	33.3	Very low	125 Å²	125	133.2 Å²	133.2	81%	0.812	80%	0.799	S	S	*	*			trans	-129.6	166.4	-150.2	42	-26.3	0	0	0	117.6
484	A	33.9	Very low	32.8	Very low	96 Å²	96	137.1 Å²	137.1	79%	0.793	80%	0.803	S	S	*	*			trans	-147.9	144.4	162.8	0	0	0	0	0	111.5
485	P	38	Very low	32.4	Very low	124 Å²	124	135.2 Å²	135.2	81%	0.805	80%	0.799	S	S	*	*			trans	-101.6	127.8	-163.8	36.2	-34.4	0	0	0	117.7
486	N	30.5	Very low	32.1	Very low	140 Å²	140	137 Å²	137	75%	0.749	80%	0.798	S	S	*	*				55.6	134.6	129	-87.3	-24	0	0	0	124.6
487	Q	29.6	Very low	31.5	Very low	169 Å²	169	137.9 Å²	137.9	79%	0.79	80%	0.796	S	S	*	*			trans	65.9	127.1	151.8	-59	170.6	25.3	0	0	116.6
488	R	29.1	Very low	31	Very low	234 Å²	234	139.1 Å²	139.1	88%	0.883	80%	0.795	S	S	*	*			cis	-157.9	135.8	34.9	-159.7	177.3	-162.3	153	2.3	109.7	M490	R488-M490 PolarHBondContact O-N 3.39Å
489	F	25.4	Very low	31	Very low	206 Å²	206	139.4 Å²	139.4	90%	0.904	80%	0.795	S	S	*	*			trans	-72.9	125.8	-179.6	-92.3	-97.2	0	0	0	112.5
490	M	29.7	Very low	30.3	Very low	169 Å²	169	138.9 Å²	138.9	83%	0.833	80%	0.797	S	S	*	*			trans	-139.1	152.3	162.2	-73.7	-85.8	82.3	0	0	107.9	R488	R488-M490 PolarHBondContact O-N 3.39Å
491	A	27.9	Very low	29.7	Very low	86 Å²	86	137.9 Å²	137.9	71%	0.711	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-64.4	147.2	-166.9	0	0	0	0	0	114	V493	A491-V493 PolarHBondContact O-N 3Å
492	P	30.3	Very low	29.5	Very low	120 Å²	120	138.9 Å²	138.9	78%	0.779	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-69.9	123.6	178.7	28.9	-34.2	0	0	0	111.2	N494	P492-N494 PolarHBondContact O-N 3.42Å
493	V	30	Very low	29.5	Very low	128 Å²	128	139.3 Å²	139.3	78%	0.776	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-74.2	122.9	168.6	178	0	0	0	0	108.5	A491 T495	A491-V493 PolarHBondContact O-N 3Å; V493-T495 PolarHBondContact O-N 2.74Å; V493-T495 PolarHBondContact O-OG1 3.42Å
494	N	25.8	Very low	29.2	Very low	154 Å²	154	139.4 Å²	139.4	82%	0.824	76%	0.757	S	S	*	*			trans	-51.1	96.8	-173.9	-74.6	-17.3	0	0	0	113.1	P492	P492-N494 PolarHBondContact O-N 3.42Å
495	T	26.3	Very low	29.2	Very low	121 Å²	121	142 Å²	142	74%	0.742	76%	0.756	S	S	*	*			trans	-104.4	87.8	177.1	-56.3	0	0	0	0	108.1	V493 C497	V493-T495 PolarHBondContact O-N 2.74Å; V493-T495 PolarHBondContact O-OG1 3.42Å; T495-C497 PolarHBondContact O-N 2.75Å
496	I	27.3	Very low	28.9	Very low	154 Å²	154	141.3 Å²	141.3	79%	0.79	74%	0.743	S	S	*	*			trans	-73.1	94.7	177.3	-60.7	178.8	0	0	0	108.4
497	C	23.7	Very low	28.9	Very low	122 Å²	122	141.6 Å²	141.6	82%	0.824	74%	0.74	S	S	*	*			trans	-103.3	94	175.4	-179.4	0	0	0	0	109.4	T495	T495-C497 PolarHBondContact O-N 2.75Å
498	S	26	Very low	28.9	Very low	95 Å²	95	139.2 Å²	139.2	66%	0.664	73%	0.731	S	S	*	*			trans	-145.6	147.1	176.1	52.3	0	0	0	0	112
499	P	32	Very low	28.9	Very low	115 Å²	115	133.4 Å²	133.4	75%	0.747	72%	0.718	S	S	*	*			trans	-128	154.5	-145.6	38.4	-22.5	0	0	0	116
500	L	27	Very low	29	Very low	164 Å²	164	129.7 Å²	129.7	86%	0.859	72%	0.715	S	S	*	*			trans	-136.4	121.6	150.3	-80.6	-179.8	0	0	0	110.6
501	P	27.4	Very low	28.9	Very low	103 Å²	103	126.8 Å²	126.8	67%	0.669	70%	0.702	S	S	*	*			trans	-81.4	157.7	179.9	32.7	-34.7	0	0	0	112.7	R503	P501-R503 PolarHBondContact O-N 2.92Å
502	N	31.5	Very low	28.9	Very low	89 Å²	89	131.4 Å²	131.4	48%	0.476	71%	0.706	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.2	34.3	-165.8	-133.4	-38.2	0	0	0	115.8	A374	A374-N502 WeakPolarHBondContact CA-ND2 3.32Å; A374-N502 HydrophobicContact CB-CB 3.58Å; A374-N502 VanDerWaalsContact CB-CG 3.42Å; A374-N502 WeakPolarHBondContact CB-ND2 3.36Å
503	R	33.8	Very low	28.8	Very low	211 Å²	211	132.5 Å²	132.5	80%	0.796	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.5	-24.1	-170.2	-88.1	-172.9	170.4	-178.3	-2.7	116.5	P501	P501-R503 PolarHBondContact O-N 2.92Å
504	R	29	Very low	28.7	Very low	127 Å²	127	130.9 Å²	130.9	48%	0.479	71%	0.705	S	S	.	*	G	3₁₀ helix	trans	-84.7	-23.8	-175.5	-103	-174.1	169.9	-140.1	-14.9	115.5	Q506 E674 H675	R504-Q506 PolarHBondContact O-N 3.34Å; R504-E674 IonicContact CZ-OE2 2.78Å; R504-E674 IonicContact NH1-OE2 2.74Å; R504-E674 PolarHBondContact NH1-OE2 3.22Å; R504-H675 PolarHBondContact NH2-NE2 3.43Å
505	L	32.8	Very low	28.8	Very low	150 Å²	150	128.6 Å²	128.6	79%	0.785	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-81	8.6	176.1	-76.4	171.3	0	0	0	114.7
506	Q	32.6	Very low	28.9	Very low	111 Å²	111	132.6 Å²	132.6	52%	0.519	70%	0.698	S	S	.	*	G	3₁₀ helix	trans	-117.7	3.8	175.8	-64.3	-177	5	0	0	113.4	R504	R504-Q506 PolarHBondContact O-N 3.34Å
507	Q	30.2	Very low	28.9	Very low	146 Å²	146	130.7 Å²	130.7	68%	0.682	70%	0.696	S	S	*	*			trans	-101.3	-3.8	177.3	-71	-170.8	-42	0	0	114.3	N509	Q507-N509 VanDerWaalsContact C-N 3.3Å; Q507-N509 PolarHBondContact O-N 2.76Å
508	L	29.3	Very low	29	Very low	118 Å²	118	131.1 Å²	131.1	62%	0.618	69%	0.69	S	S	*	*	S	Bend	trans	-78.1	86.7	167.9	-66.7	-178.4	0	0	0	109.4	I678	L508-I678 HydrophobicContact CD2-CG2 4.13Å
509	N	29.1	Very low	29.3	Very low	113 Å²	113	132.2 Å²	132.2	60%	0.604	69%	0.693	S	S	*	*			trans	-63.3	127	-172.1	-127	-28.9	0	0	0	112	Q507 L511	Q507-N509 VanDerWaalsContact C-N 3.3Å; Q507-N509 PolarHBondContact O-N 2.76Å; N509-L511 HydrophobicContact CB-CB 4.41Å; N509-L511 HydrophobicContact CB-CD1 3.91Å; N509-L511 HydrophobicContact CB-CG 3.81Å; N509-L511 VanDerWaalsContact CG-CD1 3.46Å; N509-L511 WeakPolarHBondContact ND2-CD1 3.24Å; N509-L511 PolarHBondContact O-N 3.38Å
510	P	27.8	Very low	29	Very low	128 Å²	128	133.7 Å²	133.7	83%	0.831	69%	0.694	S	S	*	*			trans	-79.3	57.3	172.8	34.8	-35.8	0	0	0	110.7
511	L	27	Very low	29.1	Very low	108 Å²	108	133.4 Å²	133.4	57%	0.565	69%	0.693	S	S	*	*			trans	-97.6	114.5	-174	-71.5	-178.9	0	0	0	112.3	N509	N509-L511 HydrophobicContact CB-CB 4.41Å; N509-L511 HydrophobicContact CB-CD1 3.91Å; N509-L511 HydrophobicContact CB-CG 3.81Å; N509-L511 VanDerWaalsContact CG-CD1 3.46Å; N509-L511 WeakPolarHBondContact ND2-CD1 3.24Å; N509-L511 PolarHBondContact O-N 3.38Å
512	F	27.3	Very low	29	Very low	182 Å²	182	133.2 Å²	133.2	80%	0.798	69%	0.694	S	S	*	*			trans	45.8	104.5	152.5	-64.6	-89.7	0	0	0	118.1
513	L	29.7	Very low	28.7	Very low	143 Å²	143	136.1 Å²	136.1	75%	0.749	71%	0.709	S	S	*	*				-154.2	66.6	107.9	-106	168.5	0	0	0	111.3	T515	L513-T515 HydrophobicContact CD2-CG2 3.6Å; L513-T515 PolarHBondContact O-N 2.97Å
514	A	27.5	Very low	28.5	Very low	95 Å²	95	134.2 Å²	134.2	79%	0.785	71%	0.713	S	S	*	*			trans	-77.2	67.5	159.7	0	0	0	0	0	109.4	R516	A514-R516 PolarHBondContact O-N 2.88Å
515	T	27	Very low	28.5	Very low	105 Å²	105	134.3 Å²	134.3	64%	0.644	73%	0.728	S	S	*	*			trans	-66.2	85.2	168.5	15.6	0	0	0	0	109.2	L513	L513-T515 HydrophobicContact CD2-CG2 3.6Å; L513-T515 PolarHBondContact O-N 2.97Å
516	R	28.3	Very low	28.1	Very low	206 Å²	206	136.5 Å²	136.5	78%	0.777	73%	0.727	S	S	*	*			trans	-52.1	130.3	151.9	-72.5	-178.7	171.6	-174.6	-2.5	107.1	A514 N518	A514-R516 PolarHBondContact O-N 2.88Å; R516-N518 PolarHBondContact O-N 2.84Å
517	P	27.6	Very low	28.1	Very low	114 Å²	114	137 Å²	137	74%	0.74	74%	0.737	S	S	*	*			trans	-66.9	91.3	166.2	28	-32.2	0	0	0	107.6	T519	P517-T519 HydrophobicContact CB-CG2 4.43Å; P517-T519 PolarHBondContact O-N 3.04Å
518	N	26.4	Very low	28	Very low	131 Å²	131	133.8 Å²	133.8	70%	0.701	73%	0.729	S	S	*	*			trans	-83.9	60.6	-178.3	-149.7	48	0	0	0	109.2	R516 N520	R516-N518 PolarHBondContact O-N 2.84Å; N518-N520 VanDerWaalsContact C-N 3.28Å; N518-N520 PolarHBondContact O-N 2.76Å
519	T	31.2	Very low	28.3	Very low	117 Å²	117	134.1 Å²	134.1	72%	0.718	74%	0.739	S	S	*	*			trans	-72.8	79.3	-177	49.9	0	0	0	0	110.7	P517 L521	P517-T519 HydrophobicContact CB-CG2 4.43Å; P517-T519 PolarHBondContact O-N 3.04Å; T519-L521 PolarHBondContact O-N 2.74Å
520	N	25.9	Very low	28.4	Very low	146 Å²	146	138 Å²	138	78%	0.781	75%	0.753	S	S	*	*			trans	-68.9	75.4	160.2	-92.5	-27.5	0	0	0	109.4	N518	N518-N520 VanDerWaalsContact C-N 3.28Å; N518-N520 PolarHBondContact O-N 2.76Å
521	L	28.9	Very low	28.4	Very low	159 Å²	159	137.6 Å²	137.6	83%	0.832	75%	0.753	S	S	*	*			trans	-102.1	85.1	158.1	-112.4	73.9	0	0	0	108.2	T519	T519-L521 PolarHBondContact O-N 2.74Å
522	S	26.2	Very low	28.7	Very low	98 Å²	98	137 Å²	137	69%	0.685	76%	0.764	S	S	*	*			trans	-64.3	142.9	160.2	49.9	0	0	0	0	109.6
523	N	26.1	Very low	28.7	Very low	150 Å²	150	136.9 Å²	136.9	80%	0.802	77%	0.766	S	S	*	*			trans	75.3	94.4	-179.2	-51.6	-15.4	0	0	0	115.7
524	I	29.5	Very low	28.7	Very low	172 Å²	172	135.5 Å²	135.5	88%	0.882	76%	0.764	S	S	*	*				-154.8	140.4	122.3	-99.5	152.8	0	0	0	107.7
525	T	27.3	Very low	28.7	Very low	128 Å²	128	139.6 Å²	139.6	79%	0.785	77%	0.766	S	S	*	*			trans	-77.6	133.3	-167	-53.3	0	0	0	0	112.9	V527	T525-V527 HydrophobicContact CG2-CG2 4.42Å
526	Y	24.9	Very low	28.8	Very low	196 Å²	196	140.6 Å²	140.6	77%	0.769	78%	0.775	S	S	*	*			trans	-93.7	131.2	169.4	-172.8	-99.8	0	0	0	110.5	P528	Y526-P528 HydrophobicContact CE1-CB 3.99Å
527	V	31.9	Very low	28.8	Very low	121 Å²	121	136.5 Å²	136.5	73%	0.733	78%	0.778	S	S	*	*			trans	-118.9	111.3	174.5	-179.5	0	0	0	0	108.8	T525	T525-V527 HydrophobicContact CG2-CG2 4.42Å
528	P	28.9	Very low	29.1	Very low	79 Å²	79	136.5 Å²	136.5	51%	0.513	78%	0.777	S	S	.	*	P	Polyproline II helix	trans	-82.7	139.6	178.3	31	-32.1	0	0	0	112	Y526	Y526-P528 HydrophobicContact CE1-CB 3.99Å
529	P	35.5	Very low	29.2	Very low	126 Å²	126	137.6 Å²	137.6	82%	0.818	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-64.9	137	158.6	-15.5	30.5	0	0	0	110
530	Q	32.2	Very low	29.1	Very low	194 Å²	194	136.9 Å²	136.9	91%	0.907	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-82.6	146.5	-178.1	-67	176.5	-9.9	0	0	112.2
531	S	26.5	Very low	29.1	Very low	119 Å²	119	137.5 Å²	137.5	83%	0.832	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-85.7	124	171.8	55.4	0	0	0	0	111.6
532	A	34.5	Very low	29.1	Very low	97 Å²	97	136.4 Å²	136.4	80%	0.802	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-97.5	138.2	164.1	0	0	0	0	0	110.4
533	Q	26.3	Very low	29	Very low	179 Å²	179	140.1 Å²	140.1	84%	0.836	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-83.6	169	167.6	-59.9	-170	-12.1	0	0	109.1
534	V	30	Very low	29.2	Very low	114 Å²	114	138.4 Å²	138.4	69%	0.691	79%	0.787	S	S	*	*				-170	138.8	73	154.8	0	0	0	0	111.1
535	Q	27.3	Very low	29.1	Very low	180 Å²	180	137.1 Å²	137.1	84%	0.841	78%	0.782	S	S	*	*			trans	43.2	135.5	156.8	-69.4	172.6	-30.5	0	0	122.9
536	P	29.3	Very low	29.2	Very low	127 Å²	127	140.7 Å²	140.7	83%	0.825	79%	0.79	S	S	*	*			trans	-100.9	156.6	164.6	38.8	-32.1	0	0	0	113.7
537	S	29	Very low	29.5	Very low	120 Å²	120	134.9 Å²	134.9	84%	0.839	79%	0.79	S	S	*	*			trans	-142	137.3	163.6	-75.4	0	0	0	0	110.3
538	P	33.1	Very low	29.4	Very low	113 Å²	113	134.6 Å²	134.6	73%	0.734	79%	0.793	S	S	*	*			trans	-100	-172.6	-174.7	40	-37.2	0	0	0	114.3
539	N	29.4	Very low	29.4	Very low	155 Å²	155	136.9 Å²	136.9	83%	0.829	81%	0.811	S	S	*	*			trans	85.7	143.2	177.5	-54.6	-22.7	0	0	0	115.1
540	S	28.6	Very low	29.1	Very low	102 Å²	102	134 Å²	134	71%	0.713	80%	0.804	S	S	*	*			cis	-166.5	149.9	-11	45.4	0	0	0	0	112.7
541	L	24.9	Very low	28.8	Very low	158 Å²	158	131.4 Å²	131.4	83%	0.827	80%	0.801	S	S	*	*			trans	28.5	111.9	144.6	-64.5	168.7	0	0	0	120.8
542	N	29.3	Very low	28.7	Very low	137 Å²	137	128.8 Å²	128.8	73%	0.733	79%	0.787	S	S	*	*				162.3	123.5	121.1	-84.7	0.7	0	0	0	109.6
543	E	25.3	Very low	28.4	Very low	175 Å²	175	131.4 Å²	131.4	82%	0.818	78%	0.776	S	S	*	*				57	100.6	83.8	-73.2	-147.4	108.8	0	0	115.3
544	S	29.9	Very low	28.4	Very low	115 Å²	115	125.3 Å²	125.3	80%	0.804	75%	0.753	S	S	*	*				-179.4	125.3	115	44.5	0	0	0	0	114.9
545	N	27.1	Very low	28.2	Very low	145 Å²	145	124.5 Å²	124.5	78%	0.775	74%	0.744	S	S	*	*			trans	21.9	113.8	142.9	-68.7	-29.6	0	0	0	121.5
546	Q	29.7	Very low	28.1	Very low	202 Å²	202	119.3 Å²	119.3	94%	0.944	72%	0.724	S	S	*	*				168.8	162.3	108.7	-92.5	154.4	100.7	0	0	112.4
547	G	30.5	Very low	28	Very low	75 Å²	75	118.2 Å²	118.2	77%	0.773	73%	0.726	S	S	*	*			trans	124.6	67.7	158.6	0	0	0	0	0	118.3
548	S	29.1	Very low	27.8	Very low	114 Å²	114	116.3 Å²	116.3	80%	0.797	71%	0.709	S	S	*	*			trans	-12.2	142.4	159.5	-51.2	0	0	0	0	121.4
549	S	30.4	Very low	27.5	Very low	128 Å²	128	117.1 Å²	117.1	90%	0.895	71%	0.713	S	S	*	*			trans	67.2	154.9	158.3	81.9	0	0	0	0	118.7
550	G	27.6	Very low	27.3	Very low	64 Å²	64	114.4 Å²	114.4	66%	0.66	71%	0.705	S	S	*	*			cis	160.6	154.4	-12	0	0	0	0	0	114.3
551	V	26.2	Very low	27.2	Very low	141 Å²	141	118.4 Å²	118.4	86%	0.855	71%	0.706	S	S	*	*			trans	73	91.2	167.5	-166.2	0	0	0	0	118.1
552	A	26	Very low	27.4	Very low	64 Å²	64	117.1 Å²	117.1	53%	0.529	71%	0.705	S	S	.	*			trans	67.1	-179	149.8	0	0	0	0	0	116.1
553	R	26.6	Very low	27.3	Very low	152 Å²	152	117.5 Å²	117.5	57%	0.574	71%	0.707	S	S	*	*			cis	-166.4	165	33.1	-130	171.9	174.6	175.4	1.5	107.1	S848 A849 L850	R553-S848 VanDerWaalsContact C-C 3.47Å; R553-S848 CarbonylContact O-C 3.58Å; R553-S848 WeakPolarHBondContact O-CA 3.38Å; R553-S848 WeakPolarHBondContact O-CB 3.49Å; R553-S848 PolarHBondContact O-OG 2.9Å; R553-A849 HydrophobicContact CB-CB 4.11Å; R553-A849 HydrophobicContact CG-CB 3.76Å; R553-L850 HydrophobicContact CG-CB 3.63Å; R553-L850 HydrophobicContact CG-CD1 4.01Å; R553-L850 HydrophobicContact CG-CG 4Å
554	S	27.5	Very low	27.4	Very low	50 Å²	50	114 Å²	114	35%	0.35	70%	0.697	S	S	.	*			trans	-121.6	133.8	-167.4	-39.6	0	0	0	0	119.3	A849 L850 L851	S554-A849 VanDerWaalsContact N-C 3.27Å; S554-A849 CarbonylContact O-C 3.52Å; S554-A849 WeakPolarHBondContact O-CA 3.44Å; S554-A849 PolarHBondContact O-N 3.32Å; S554-L850 VanDerWaalsContact N-CA 3.28Å; S554-L850 PolarHBondContact O-N 2.95Å; S554-L850 VanDerWaalsContact O-N 3.16Å; S554-L850 VanDerWaalsContact OG-C 3.25Å; S554-L850 PolarHBondContact OG-O 3.12Å; S554-L851 PolarHBondContact OG-N 2.87Å
555	L	25.7	Very low	27.4	Very low	98 Å²	98	115.3 Å²	115.3	51%	0.513	69%	0.692	S	S	.	*			trans	-146.7	-179.5	170.7	-93	151.6	0	0	0	113.2	N846 P847 A849	L555-N846 WeakPolarHBondContact CB-O 3.34Å; L555-N846 WeakPolarHBondContact CD1-O 3.36Å; L555-P847 VanDerWaalsContact CB-CA 3.44Å; L555-P847 PolarHBondContact N-O 3.48Å; L555-P847 WeakPolarHBondContact O-CA 3.25Å; L555-P847 WeakPolarHBondContact O-CB 3.41Å; L555-A849 HydrophobicContact CD1-CB 4.26Å
556	V	25.3	Very low	27.6	Very low	70 Å²	70	116.8 Å²	116.8	42%	0.424	70%	0.695	S	S	.	*			trans	-0.8	105.3	159.9	-175.4	0	0	0	0	118.9	V558 P847	V556-V558 HydrophobicContact CG1-CB 4.02Å; V556-V558 HydrophobicContact CG1-CG2 3.89Å; V556-P847 WeakPolarHBondContact O-CB 3.18Å
557	A	26.3	Very low	27.6	Very low	105 Å²	105	115.8 Å²	115.8	87%	0.868	69%	0.69	S	S	*	*			trans	-116.7	68.2	153.7	0	0	0	0	0	110.3
558	V	25.3	Very low	27.4	Very low	80 Å²	80	120 Å²	120	49%	0.485	69%	0.689	S	S	.	*			trans	-82.6	145.7	174.9	167.6	0	0	0	0	109.8	V556	V556-V558 HydrophobicContact CG1-CB 4.02Å; V556-V558 HydrophobicContact CG1-CG2 3.89Å
559	T	26	Very low	27.4	Very low	130 Å²	130	122.2 Å²	122.2	80%	0.798	69%	0.693	S	S	*	*	S	Bend	trans	52	85	171.2	50.2	0	0	0	0	117.6
560	S	25.6	Very low	27.2	Very low	97 Å²	97	123.4 Å²	123.4	68%	0.678	69%	0.688	S	S	*	*			trans	-176.7	27.4	149.7	40.2	0	0	0	0	117.1
561	Y	26.9	Very low	27.2	Very low	187 Å²	187	123.4 Å²	123.4	73%	0.733	67%	0.672	S	S	*	*			trans	-115.7	60.3	-179.8	-92.3	-85.2	0	0	0	115.3	V564	Y561-V564 HydrophobicContact CE1-CB 4.37Å
562	T	29.7	Very low	27.2	Very low	131 Å²	131	121.6 Å²	121.6	80%	0.804	66%	0.662	S	S	*	*	S	Bend	trans	-132.4	35.6	169.6	53.1	0	0	0	0	112.7
563	N	27.3	Very low	27.3	Very low	145 Å²	145	121.9 Å²	121.9	78%	0.775	66%	0.664	S	S	*	*	S	Bend	trans	-155.9	-4.2	170.6	-101.4	-29.6	0	0	0	116.5
564	V	27.5	Very low	27.3	Very low	100 Å²	100	119.6 Å²	119.6	61%	0.606	66%	0.663	S	S	*	*	S	Bend	trans	-121.7	57.3	-173.9	-163.3	0	0	0	0	112.2	Y561	Y561-V564 HydrophobicContact CE1-CB 4.37Å
565	M	29.9	Very low	27.4	Very low	143 Å²	143	123 Å²	123	70%	0.704	67%	0.669	S	S	*	*			trans	-148.1	28.3	168.2	-91.1	-64.8	102.8	0	0	111.6
566	Q	31.2	Very low	27.5	Very low	177 Å²	177	121.5 Å²	121.5	83%	0.827	66%	0.664	S	S	*	*	S	Bend	trans	-98.7	2.9	-176.8	-149.4	167.4	30.9	0	0	113.8
567	Q	28	Very low	27.6	Very low	180 Å²	180	129.5 Å²	129.5	84%	0.841	69%	0.687	S	S	*	*	S	Bend	trans	-145.4	56.4	179.2	-69.9	-173.1	-16.8	0	0	112.3
568	Q	27.8	Very low	27.8	Very low	163 Å²	163	129 Å²	129	76%	0.762	68%	0.682	S	S	*	*	S	Bend	trans	176	85.3	157.5	-100.3	155.9	15.6	0	0	110
569	D	28.7	Very low	27.9	Very low	162 Å²	162	128.5 Å²	128.5	87%	0.866	69%	0.694	S	S	*	*			trans	-168.8	61.5	154.2	-113.4	-6.1	0	0	0	108
570	L	26.7	Very low	28.1	Very low	153 Å²	153	131.4 Å²	131.4	80%	0.801	70%	0.698	S	S	*	*			trans	-73.9	147.9	167.6	-135.5	80.7	0	0	0	108.2
571	I	26.4	Very low	28.2	Very low	64 Å²	64	132 Å²	132	33%	0.328	70%	0.703	S	S	.	*			trans	72.2	91.9	176	-46.5	109	0	0	0	116.3	V176 T177	V176-I571 HydrophobicContact CG1-CG2 4.2Å; V176-I571 VanDerWaalsContact O-CG2 3.31Å; V176-I571 WeakPolarHBondContact O-CG2 3.36Å; T177-I571 HydrophobicContact CG2-CD1 3.78Å; T177-I571 HydrophobicContact CG2-CG1 4.07Å; T177-I571 VanDerWaalsContact O-CD1 3.25Å; T177-I571 WeakPolarHBondContact O-CD1 3.34Å
572	T	27.5	Very low	28.3	Very low	103 Å²	103	130.1 Å²	130.1	63%	0.632	70%	0.703	S	S	*	*	S	Bend	trans	-139.3	82.3	135.7	-65.7	0	0	0	0	109.4	D574	T572-D574 PolarHBondContact O-N 3.14Å; T572-D574 VanDerWaalsContact O-N 3.14Å
573	A	26.8	Very low	28.2	Very low	70 Å²	70	131.1 Å²	131.1	58%	0.579	70%	0.703	S	S	*	*			trans	47.7	43.5	165	0	0	0	0	0	117.5	Y575	A573-Y575 PolarHBondContact O-N 3.45Å; A573-Y575 VanDerWaalsContact O-N 3.1Å
574	D	27.9	Very low	28.2	Very low	103 Å²	103	134.7 Å²	134.7	55%	0.551	71%	0.707	S	S	*	*			trans	-71.6	102.9	172.9	-94.1	-50.4	0	0	0	111.6	K101 T572 T576	K101-D574 IonicContact NZ-OD1 3Å; K101-D574 PolarHBondContact NZ-OD1 2.95Å; K101-D574 IonicContact NZ-OD2 3.29Å; K101-D574 PolarHBondContact NZ-OD2 3.46Å; T572-D574 PolarHBondContact O-N 3.14Å; T572-D574 VanDerWaalsContact O-N 3.14Å; D574-T576 VanDerWaalsContact C-N 3.34Å
575	Y	28.1	Very low	28.3	Very low	122 Å²	122	135 Å²	135	48%	0.478	71%	0.714	S	S	.	*			trans	-95.6	19.4	165.2	-93.1	-59.2	0	0	0	113.3	R329 R339 C343 A573	R329-Y575 PolarHBondContact NE-OH 3.2Å; R329-Y575 PolarHBondContact NH2-OH 3.1Å; R339-Y575 PolarHBondContact NH1-O 2.72Å; C343-Y575 HydrophobicContact CB-CD1 4.07Å; C343-Y575 HydrophobicContact CB-CD2 4.18Å; C343-Y575 HydrophobicContact CB-CE1 4.22Å; C343-Y575 HydrophobicContact CB-CE2 4.3Å; C343-Y575 HydrophobicContact CB-CG 4.06Å; C343-Y575 WeakPolarHBondContact SG-CE1 3.41Å; C343-Y575 VanDerWaalsContact SG-CZ 3.57Å; A573-Y575 PolarHBondContact O-N 3.45Å; A573-Y575 VanDerWaalsContact O-N 3.1Å
576	T	28	Very low	28.3	Very low	66 Å²	66	137.3 Å²	137.3	41%	0.405	72%	0.723	S	S	.	*	S	Bend	trans	-123.7	120.6	173.3	44.4	0	0	0	0	111.7	D574	D574-T576 VanDerWaalsContact C-N 3.34Å
577	R	28.8	Very low	28.4	Very low	238 Å²	238	138 Å²	138	90%	0.898	72%	0.723	S	S	*	*			trans	83.9	95.5	171.3	-160.9	-172.9	-158.9	163.5	4.9	117.1
578	A	29.8	Very low	28.8	Very low	94 Å²	94	135 Å²	135	78%	0.777	72%	0.719	S	S	*	*			trans	-139.6	139	149.9	0	0	0	0	0	107.5
579	G	27.3	Very low	29	Very low	71 Å²	71	133.8 Å²	133.8	73%	0.732	73%	0.725	S	S	*	*			trans	174.9	32.3	-168	0	0	0	0	0	116.6
580	H	30.6	Very low	29.3	Very low	191 Å²	191	129.3 Å²	129.3	88%	0.884	72%	0.718	S	S	*	*			trans	-157.6	116.4	159.9	-106.8	-80.1	0	0	0	107.2
581	S	26.5	Very low	29.7	Very low	110 Å²	110	127.2 Å²	127.2	77%	0.769	72%	0.716	S	S	*	*			trans	-92.9	138	178.6	-56.1	0	0	0	0	110.3
582	I	30.3	Very low	30	Very low	146 Å²	146	131.8 Å²	131.8	75%	0.749	74%	0.735	S	S	*	*			trans	-125.2	123.9	159.2	-61.2	179.5	0	0	0	105.9	Y584	I582-Y584 HydrophobicContact CG2-CD2 4.08Å; I582-Y584 HydrophobicContact CG2-CE2 3.68Å
583	L	26.6	Very low	30.2	Very low	152 Å²	152	134 Å²	134	80%	0.796	74%	0.74	S	S	*	*			trans	-82.9	134.7	174.3	-76.8	76.6	0	0	0	109
584	Y	28.3	Very low	30.6	Very low	221 Å²	221	135.9 Å²	135.9	87%	0.867	75%	0.745	S	S	*	*			trans	-124.6	128.3	149.4	-79	-81.1	0	0	0	107.9	I582	I582-Y584 HydrophobicContact CG2-CD2 4.08Å; I582-Y584 HydrophobicContact CG2-CE2 3.68Å
585	S	29.5	Very low	30.7	Very low	107 Å²	107	137.7 Å²	137.7	75%	0.748	75%	0.754	S	S	*	*			trans	-120.3	110.5	176.9	179.6	0	0	0	0	107.4
586	E	30	Very low	30.9	Very low	190 Å²	190	139.6 Å²	139.6	89%	0.888	77%	0.772	S	S	*	*			trans	-74.6	149	168.6	-62.4	-168.7	139.7	0	0	110.1
587	K	33.3	Very low	31	Very low	193 Å²	193	142 Å²	142	84%	0.839	79%	0.792	S	S	*	*			trans	-146.5	137.3	171.9	-118	-172.2	176.2	-174.7	0	108.5
588	P	35.1	Very low	31.2	Very low	117 Å²	117	134.5 Å²	134.5	76%	0.76	79%	0.788	S	S	*	*			trans	-72	158.2	-178.9	30	-35.4	0	0	0	112.1
589	P	33.1	Very low	31.4	Very low	136 Å²	136	134.8 Å²	134.8	88%	0.883	79%	0.79	S	S	*	*			trans	-78.3	147.7	-175.5	31.9	-35.8	0	0	0	113.3
590	G	34.1	Very low	31.6	Very low	69 Å²	69	138.1 Å²	138.1	71%	0.711	79%	0.791	S	S	*	*			trans	-176.3	89.9	177.9	0	0	0	0	0	116
591	S	35.2	Very low	31.8	Very low	108 Å²	108	137.6 Å²	137.6	76%	0.755	79%	0.789	S	S	*	*			trans	47.7	117.4	147.9	60.4	0	0	0	0	123.3
592	H	33.9	Very low	32.1	Very low	160 Å²	160	140 Å²	140	74%	0.741	79%	0.788	S	S	*	*			trans	76	121.4	130.8	-80.8	-103.7	0	0	0	123.8
593	M	30.6	Very low	32	Very low	150 Å²	150	138.8 Å²	138.8	74%	0.739	79%	0.79	S	S	*	*			trans	69.7	140.7	135.1	-53.1	-83.9	126	0	0	118.8
594	T	35.4	Very low	32.2	Very low	110 Å²	110	138.1 Å²	138.1	68%	0.675	79%	0.786	S	S	*	*			cis	-158.3	147.1	-7.8	5.2	0	0	0	0	112.5
595	N	29.8	Very low	32.4	Very low	140 Å²	140	133 Å²	133	75%	0.749	78%	0.781	S	S	*	*			trans	11.7	132.4	151.1	-56.3	-17.4	0	0	0	122.1
596	L	33	Very low	32.3	Very low	162 Å²	162	135.6 Å²	135.6	85%	0.848	78%	0.784	S	S	*	*				164.3	100.2	118.2	-85.6	157.4	0	0	0	108.5
597	S	30.1	Very low	32.1	Very low	118 Å²	118	131.6 Å²	131.6	83%	0.825	78%	0.777	S	S	*	*				90.2	107.6	79.1	-73.8	0	0	0	0	114.2
598	G	32	Very low	31.6	Very low	79 Å²	79	127 Å²	127	81%	0.814	77%	0.768	S	S	*	*			trans	174.5	105.2	172.3	0	0	0	0	0	116.4
599	A	35.5	Very low	31.2	Very low	100 Å²	100	132.3 Å²	132.3	83%	0.826	78%	0.775	S	S	*	*			trans	52.8	96.6	156.1	0	0	0	0	0	121.4
600	N	31.8	Very low	31.1	Very low	141 Å²	141	132 Å²	132	75%	0.754	78%	0.776	S	S	*	*			trans	-3.5	125.7	143.3	-51.8	-18.8	0	0	0	118.9
601	H	34.4	Very low	30.8	Very low	180 Å²	180	139.6 Å²	139.6	83%	0.833	78%	0.783	S	S	*	*				-169.3	165.5	89.6	-99.5	-78	0	0	0	111.4
602	Q	31.7	Very low	30.7	Very low	160 Å²	160	140.4 Å²	140.4	75%	0.748	79%	0.786	S	S	*	*			trans	-78.6	142.6	-164.4	-67.5	179.6	-23	0	0	115.4
603	P	27.9	Very low	30.5	Very low	122 Å²	122	139 Å²	139	79%	0.792	79%	0.789	S	S	*	*			trans	-96.2	126.2	147.7	33.6	-25.8	0	0	0	110.8
604	L	31.7	Very low	30.5	Very low	137 Å²	137	138.3 Å²	138.3	72%	0.717	79%	0.793	S	S	*	*			trans	-126.2	143.7	167.3	-80.4	175.5	0	0	0	110.8
605	P	32.4	Very low	30.2	Very low	115 Å²	115	140.8 Å²	140.8	75%	0.747	80%	0.797	S	S	*	*			trans	-102.8	124.8	-164.3	36.4	-31.8	0	0	0	114.5
606	I	27	Very low	30	Very low	160 Å²	160	141.5 Å²	141.5	82%	0.821	79%	0.794	S	S	*	*			trans	-147.4	125.5	164.3	-84.8	105.7	0	0	0	111
607	S	25.7	Very low	29.8	Very low	106 Å²	106	143.9 Å²	143.9	74%	0.741	79%	0.793	S	S	*	*			trans	42.5	163.9	138.2	-149	0	0	0	0	124.9
608	C	24.1	Very low	29.7	Very low	97 Å²	97	142.9 Å²	142.9	66%	0.655	79%	0.786	S	S	*	*			trans	64.6	119.9	153.7	42.4	0	0	0	0	124.1
609	Y	26.5	Very low	29.6	Very low	228 Å²	228	145.7 Å²	145.7	89%	0.894	79%	0.787	S	S	*	*			trans	39.9	112	139.2	-64.5	-80.6	0	0	0	121
610	S	30.4	Very low	29.3	Very low	131 Å²	131	144.5 Å²	144.5	92%	0.916	78%	0.784	S	S	*	*			trans	-89.8	128.2	158.1	-47.7	0	0	0	0	111.5
611	R	29	Very low	29.3	Very low	228 Å²	228	141.5 Å²	141.5	86%	0.86	79%	0.787	S	S	*	*			trans	-116.1	145.6	175	-175.8	-177.2	-178.1	-172.2	0.4	109
612	P	31.8	Very low	29	Very low	125 Å²	125	140.2 Å²	140.2	81%	0.812	79%	0.786	S	S	*	*			trans	-63.5	148.6	173.9	-20.9	33.4	0	0	0	112.5
613	T	30.7	Very low	29.1	Very low	130 Å²	130	140.7 Å²	140.7	80%	0.798	79%	0.789	S	S	*	*			trans	-100.7	131.5	-174.4	48.3	0	0	0	0	113.2
614	T	30.8	Very low	29	Very low	136 Å²	136	141.7 Å²	141.7	83%	0.834	78%	0.783	S	S	*	*			trans	-150.4	106.5	148	-25	0	0	0	0	111.5
615	E	28.2	Very low	28.7	Very low	161 Å²	161	144 Å²	144	75%	0.752	78%	0.783	S	S	*	*			trans	47.9	110.7	141.3	-57.8	-147.8	140.6	0	0	123.9
616	F	25.5	Very low	28.5	Very low	156 Å²	156	146.1 Å²	146.1	68%	0.684	78%	0.783	S	S	*	*				81.1	130.7	122.5	-80	-65.8	0	0	0	125.1
617	Y	29.2	Very low	28.5	Very low	211 Å²	211	146.8 Å²	146.8	83%	0.827	79%	0.787	S	S	*	*			trans	60.4	153.4	163.8	-61.9	-76.1	0	0	0	121.2
618	S	27.7	Very low	28.5	Very low	97 Å²	97	146 Å²	146	68%	0.678	79%	0.787	S	S	*	*				-168.2	160	-54.5	-163.8	0	0	0	0	109.8
619	V	29.4	Very low	28.7	Very low	139 Å²	139	147.4 Å²	147.4	84%	0.842	79%	0.793	S	S	*	*			trans	65.2	137.6	171	-165.4	0	0	0	0	115.2
620	G	28.9	Very low	28.8	Very low	74 Å²	74	142 Å²	142	76%	0.763	78%	0.784	S	S	*	*			cis	150.1	123.1	-7.7	0	0	0	0	0	112.1
621	G	33.3	Very low	28.8	Very low	79 Å²	79	143 Å²	143	81%	0.814	78%	0.778	S	S	*	*			trans	167.1	128.6	177.5	0	0	0	0	0	112.2
622	N	28.1	Very low	28.8	Very low	153 Å²	153	137.1 Å²	137.1	82%	0.818	77%	0.768	S	S	*	*			trans	-122	171.4	-175.4	-81.2	-41.1	0	0	0	111.5
623	Q	32.1	Very low	28.8	Very low	170 Å²	170	134.5 Å²	134.5	79%	0.794	76%	0.763	S	S	*	*			trans	87.7	144.1	163.2	-53.6	173.7	108.7	0	0	116.9
624	Q	27.4	Very low	28.7	Very low	142 Å²	142	136.4 Å²	136.4	66%	0.664	77%	0.768	S	S	*	*			cis	-163.7	151	-23.5	-119.2	178.5	7.8	0	0	110.7
625	Y	25.2	Very low	28.8	Very low	186 Å²	186	135.4 Å²	135.4	73%	0.729	76%	0.764	S	S	*	*			trans	61.2	141.2	151	-77.1	-61.3	0	0	0	125.2
626	Q	28.8	Very low	28.7	Very low	159 Å²	159	131.9 Å²	131.9	74%	0.743	76%	0.762	S	S	*	*			trans	78.3	93.8	143.2	-71.4	168.6	28.1	0	0	122.8
627	L	25.4	Very low	28.8	Very low	174 Å²	174	131.9 Å²	131.9	91%	0.911	77%	0.767	S	S	*	*				53.9	151.4	113.2	-67.7	167.4	0	0	0	123.4
628	A	27.2	Very low	28.6	Very low	89 Å²	89	129.7 Å²	129.7	74%	0.736	76%	0.764	S	S	*	*			trans	95	69.6	157.4	0	0	0	0	0	121.4
629	T	28.1	Very low	28.5	Very low	127 Å²	127	130 Å²	130	78%	0.779	77%	0.766	S	S	*	*				31.6	126.8	123.9	-20.1	0	0	0	0	123.5
630	T	28	Very low	28.4	Very low	115 Å²	115	129.2 Å²	129.2	71%	0.706	76%	0.762	S	S	*	*			trans	80	117	142.9	35.6	0	0	0	0	125.8
631	L	30.3	Very low	28.4	Very low	152 Å²	152	130.8 Å²	130.8	80%	0.796	76%	0.759	S	S	*	*			trans	65	119.7	131	-71.5	166.9	0	0	0	123.4
632	T	29.1	Very low	27.9	Very low	105 Å²	105	133.7 Å²	133.7	64%	0.644	76%	0.755	S	S	*	*				171.8	150.6	102.1	33.9	0	0	0	0	112.5
633	G	31.3	Very low	27.7	Very low	69 Å²	69	132.7 Å²	132.7	71%	0.711	75%	0.754	S	S	*	*			trans	166.4	146.4	176.7	0	0	0	0	0	113.1
634	L	29.2	Very low	27.5	Very low	170 Å²	170	129.7 Å²	129.7	89%	0.89	75%	0.751	S	S	*	*			trans	-131.6	170.2	-169	-89.2	164.9	0	0	0	110.9
635	P	32.7	Very low	27.4	Very low	116 Å²	116	128.9 Å²	128.9	75%	0.753	76%	0.756	S	S	*	*			cis	-139.2	-167.7	26.4	43.8	-24	0	0	0	117.3
636	A	26.9	Very low	27.6	Very low	86 Å²	86	127.3 Å²	127.3	71%	0.711	76%	0.759	S	S	*	*			trans	1.4	146.3	159.3	0	0	0	0	0	119.8
637	I	27.6	Very low	27.6	Very low	156 Å²	156	126.4 Å²	126.4	80%	0.8	76%	0.759	S	S	*	*				-144.9	148.1	56.3	-78.1	172.3	0	0	0	114.7
638	Q	24.9	Very low	27.7	Very low	165 Å²	165	121 Å²	121	77%	0.771	74%	0.736	S	S	*	*			trans	-27.6	152.1	163.2	-72	166.2	-39.9	0	0	121.1
639	S	24.6	Very low	27.9	Very low	103 Å²	103	123 Å²	123	72%	0.72	73%	0.734	S	S	*	*			trans	69.5	131.5	132	-59.1	0	0	0	0	123.7
640	T	27.5	Very low	27.9	Very low	123 Å²	123	121.7 Å²	121.7	76%	0.755	72%	0.722	S	S	*	*			trans	-28	171.2	131.5	51.4	0	0	0	0	117.2
641	P	28.5	Very low	28.1	Very low	108 Å²	108	124.4 Å²	124.4	70%	0.701	73%	0.731	S	S	*	*			cis	-129.4	-137.1	-13.7	26.6	-0.1	0	0	0	110.5
642	I	24	Very low	28	Very low	140 Å²	140	123.1 Å²	123.1	72%	0.718	73%	0.726	S	S	*	*			trans	73.8	125.7	161.1	-60.3	161.8	0	0	0	114.2
643	V	23.9	Very low	28	Very low	132 Å²	132	125.2 Å²	125.2	80%	0.8	73%	0.733	S	S	*	*			cis	82.4	79.4	39.4	-173.2	0	0	0	0	115
644	S	26.3	Very low	27.9	Very low	106 Å²	106	127 Å²	127	74%	0.741	73%	0.734	S	S	*	*			trans	-155	141.1	154.7	-53.9	0	0	0	0	106.7
645	V	25.8	Very low	27.8	Very low	125 Å²	125	124 Å²	124	76%	0.758	73%	0.727	S	S	*	*			cis	66.8	124.8	43	-168.8	0	0	0	0	109.2
646	I	30.5	Very low	27.7	Very low	154 Å²	154	127.4 Å²	127.4	79%	0.79	74%	0.735	S	S	*	*				-138.9	168.1	56.7	-61	150.3	0	0	0	112.7
647	N	26.8	Very low	27.8	Very low	140 Å²	140	127 Å²	127	75%	0.749	74%	0.739	S	S	*	*			trans	-76.8	-166.2	175.8	-60.5	-23.4	0	0	0	111.7
648	S	28.2	Very low	28.1	Very low	60 Å²	60	124 Å²	124	42%	0.42	74%	0.738	S	S	.	*			cis	-168.4	168.6	31.2	-44.8	0	0	0	0	117.4
649	D	31.5	Very low	28.4	Very low	130 Å²	130	121.9 Å²	121.9	70%	0.695	74%	0.742	S	S	*	*			trans	99.2	94.9	139.4	-63.3	-32.7	0	0	0	122	V23	V23-D649 WeakPolarHBondContact CG1-O 3.44Å
650	N	27.5	Very low	28.8	Very low	100 Å²	100	126.9 Å²	126.9	54%	0.535	75%	0.751	S	S	.	*			trans	-55.3	157.2	152.1	-68.2	-78.1	0	0	0	112.7
651	L	33.3	Very low	28.8	Very low	172 Å²	172	126.7 Å²	126.7	90%	0.901	75%	0.754	S	S	*	*			trans	-142.5	132.6	140.2	-109.5	171.5	0	0	0	111.3
652	N	28.7	Very low	29.1	Very low	126 Å²	126	129.2 Å²	129.2	67%	0.674	76%	0.761	S	S	*	*			trans	-70.1	159.5	169.8	-56.8	-60.6	0	0	0	109
653	N	27.9	Very low	29.4	Very low	149 Å²	149	132.2 Å²	132.2	80%	0.797	77%	0.769	S	S	*	*				-177.5	163	68.8	-119.7	-21.9	0	0	0	114.1
654	S	29.3	Very low	30	Very low	105 Å²	105	131.8 Å²	131.8	73%	0.734	77%	0.767	S	S	*	*			trans	61.1	113.8	148.1	-58	0	0	0	0	121.3
655	S	28.3	Very low	30.6	Very low	108 Å²	108	134.4 Å²	134.4	76%	0.755	77%	0.767	S	S	*	*				137.6	126.1	106.9	-156.6	0	0	0	0	116.4
656	M	29	Very low	31.6	Very low	187 Å²	187	134.3 Å²	134.3	92%	0.921	76%	0.762	S	S	*	*			trans	56.9	107.5	148	-61.9	-90.8	-91.5	0	0	120.4
657	G	30.1	Very low	32.3	Very low	77 Å²	77	133.5 Å²	133.5	79%	0.794	76%	0.759	S	S	*	*			trans	176.7	116.2	161.9	0	0	0	0	0	114.7
658	A	32.9	Very low	33.1	Very low	94 Å²	94	132.1 Å²	132.1	78%	0.777	75%	0.751	S	S	*	*			trans	-67.5	125	178.8	0	0	0	0	0	111.6
659	S	31.5	Very low	34.1	Very low	120 Å²	120	135.4 Å²	135.4	84%	0.839	76%	0.76	S	S	*	*				70	93.3	73.4	-61.2	0	0	0	0	115.9
660	F	32.4	Very low	34.7	Very low	209 Å²	209	135.8 Å²	135.8	92%	0.917	76%	0.756	S	S	*	*			trans	-139.5	137.8	140.3	55.1	-92.3	0	0	0	108.5
661	S	28.8	Very low	35.9	Very low	118 Å²	118	132.8 Å²	132.8	83%	0.825	74%	0.742	S	S	*	*			trans	-139.6	125.9	-171.1	-179.8	0	0	0	0	111.9
662	L	34.6	Very low	37	Very low	162 Å²	162	128.9 Å²	128.9	85%	0.848	72%	0.723	S	S	*	*			trans	-148.8	76.7	-179.7	-104.6	162.8	0	0	0	112.3
663	K	30.3	Very low	38.4	Very low	202 Å²	202	129 Å²	129	88%	0.878	72%	0.719	S	S	*	*			trans	40.5	80.6	152	-62.5	-178.2	178.3	178.8	0	118
664	T	35.8	Very low	40.1	Very low	123 Å²	123	126 Å²	126	76%	0.755	70%	0.7	S	S	*	*			trans	-108.1	82.2	166.6	52.3	0	0	0	0	111.5
665	H	39.4	Very low	41.9	Very low	161 Å²	161	125.1 Å²	125.1	75%	0.745	68%	0.684	S	S	*	*			trans	-150	46.5	177.7	-158.4	-69.6	0	0	0	112.8
666	N	46.4	Very low	43.6	Very low	123 Å²	123	124.8 Å²	124.8	66%	0.658	67%	0.674	S	S	*	*	S	Bend	trans	-150	-28.4	179	-158.8	-103.6	0	0	0	113.8	K670	N666-K670 PolarHBondContact O-N 3.45Å
667	L	45	Very low	45.4	Very low	138 Å²	138	121.4 Å²	121.4	72%	0.723	66%	0.659	S	S	*	*	H	α-helix	trans	-67.2	-46.2	-178.2	-75.7	162.1	0	0	0	113.2	Q669 K670 S671	L667-Q669 VanDerWaalsContact C-N 3.32Å; L667-Q669 PolarHBondContact O-N 2.89Å; L667-K670 PolarHBondContact O-N 2.76Å; L667-S671 PolarHBondContact O-N 3.01Å
668	D	44.5	Very low	47.1	Very low	110 Å²	110	121.2 Å²	121.2	59%	0.588	64%	0.639	S	S	*	*	H	α-helix	trans	-62.4	-40.7	-176.5	-55.9	-49.9	0	0	0	112	K670 S671 N672	D668-K670 PolarHBondContact O-N 3.46Å; D668-S671 PolarHBondContact O-N 3.01Å; D668-S671 PolarHBondContact O-OG 3.35Å; D668-N672 PolarHBondContact O-N 3.34Å; D668-N672 PolarHBondContact O-ND2 2.72Å
669	Q	48.4	Very low	48.7	Very low	129 Å²	129	119.5 Å²	119.5	60%	0.603	63%	0.625	S	S	*	*	H	α-helix	trans	-64	-43.8	-179.4	-154.2	147.7	11.9	0	0	111.6	L667 S671 N672 E673	L667-Q669 VanDerWaalsContact C-N 3.32Å; L667-Q669 PolarHBondContact O-N 2.89Å; Q669-S671 PolarHBondContact O-N 2.95Å; Q669-N672 PolarHBondContact O-N 3.39Å; Q669-E673 PolarHBondContact O-N 3.37Å
670	K	44.6	Very low	50	Low	138 Å²	138	119.9 Å²	119.9	60%	0.6	61%	0.608	S	S	*	*	H	α-helix	trans	-66.4	-35.1	174.1	-170.4	165.1	-174	165.9	0	112.8	N666 L667 D668 N672 E673 E674	N666-K670 PolarHBondContact O-N 3.45Å; L667-K670 PolarHBondContact O-N 2.76Å; D668-K670 PolarHBondContact O-N 3.46Å; K670-N672 VanDerWaalsContact C-N 3.31Å; K670-N672 PolarHBondContact O-N 2.86Å; K670-E673 PolarHBondContact O-N 3.38Å; K670-E674 PolarHBondContact O-N 3.14Å
671	S	52.5	Low	51.2	Low	37 Å²	37	117 Å²	117	26%	0.259	59%	0.592	S	S	.	*	H	α-helix	trans	-65.9	-34.4	173.7	85.4	0	0	0	0	112.4	L667 D668 Q669 E674 H675	L667-S671 PolarHBondContact O-N 3.01Å; D668-S671 PolarHBondContact O-N 3.01Å; D668-S671 PolarHBondContact O-OG 3.35Å; Q669-S671 PolarHBondContact O-N 2.95Å; S671-E674 PolarHBondContact O-N 3.27Å; S671-H675 PolarHBondContact O-N 3.26Å; S671-H675 VanDerWaalsContact O-N 3.09Å; S671-H675 PolarHBondContact O-ND1 3.48Å
672	N	56.4	Low	52.9	Low	91 Å²	91	114 Å²	114	49%	0.487	57%	0.574	S	S	.	*	H	α-helix	trans	-72.4	-31	178.1	-73.3	-27.1	0	0	0	112	D668 Q669 K670 N676	D668-N672 PolarHBondContact O-N 3.34Å; D668-N672 PolarHBondContact O-ND2 2.72Å; Q669-N672 PolarHBondContact O-N 3.39Å; K670-N672 VanDerWaalsContact C-N 3.31Å; K670-N672 PolarHBondContact O-N 2.86Å; N672-N676 WeakPolarHBondContact O-CB 3.27Å; N672-N676 PolarHBondContact O-N 2.93Å; N672-N676 PolarHBondContact O-ND2 3.32Å
673	E	58.2	Low	54.3	Low	128 Å²	128	109.1 Å²	109.1	60%	0.598	56%	0.557	S	S	*	*	H	α-helix	trans	-65.9	-46.5	169.1	-69.8	-173.8	121.5	0	0	112.2	Q669 K670 H675 N676 L677	Q669-E673 PolarHBondContact O-N 3.37Å; K670-E673 PolarHBondContact O-N 3.38Å; E673-H675 PolarHBondContact O-N 3.48Å; E673-N676 PolarHBondContact O-N 3.33Å; E673-L677 WeakPolarHBondContact O-CD1 3.39Å; E673-L677 PolarHBondContact O-N 2.75Å
674	E	64	Low	55.8	Low	86 Å²	86	105.7 Å²	105.7	40%	0.402	54%	0.544	S	S	.	.	H	α-helix	trans	-56	-49.7	175.6	-77.5	-166.2	168.6	0	0	111.8	R504 K670 S671 N676 L677 I678	R504-E674 IonicContact CZ-OE2 2.78Å; R504-E674 IonicContact NH1-OE2 2.74Å; R504-E674 PolarHBondContact NH1-OE2 3.22Å; K670-E674 PolarHBondContact O-N 3.14Å; S671-E674 PolarHBondContact O-N 3.27Å; E674-N676 VanDerWaalsContact C-N 3.31Å; E674-N676 PolarHBondContact O-N 2.84Å; E674-L677 PolarHBondContact O-N 3.15Å; E674-I678 VanDerWaalsContact O-CG1 3.28Å; E674-I678 WeakPolarHBondContact O-CG1 3.21Å; E674-I678 PolarHBondContact O-N 3.42Å
675	H	66.3	Low	57.2	Low	87 Å²	87	104.2 Å²	104.2	40%	0.403	53%	0.532	S	S	.	.	H	α-helix	trans	-64.5	-34.9	179.4	-63.7	118.7	0	0	0	112.2	R504 S671 E673 A679	R504-H675 PolarHBondContact NH2-NE2 3.43Å; S671-H675 PolarHBondContact O-N 3.26Å; S671-H675 VanDerWaalsContact O-N 3.09Å; S671-H675 PolarHBondContact O-ND1 3.48Å; E673-H675 PolarHBondContact O-N 3.48Å; H675-A679 WeakPolarHBondContact O-CB 3.29Å; H675-A679 PolarHBondContact O-N 2.7Å
676	N	65.5	Low	58.2	Low	100 Å²	100	99.1 Å²	99.1	54%	0.535	52%	0.517	S	S	.	.	H	α-helix	trans	-68.3	-39.3	174.2	-88.7	-75.2	0	0	0	113	N672 E673 E674 R680	N672-N676 WeakPolarHBondContact O-CB 3.27Å; N672-N676 PolarHBondContact O-N 2.93Å; N672-N676 PolarHBondContact O-ND2 3.32Å; E673-N676 PolarHBondContact O-N 3.33Å; E674-N676 VanDerWaalsContact C-N 3.31Å; E674-N676 PolarHBondContact O-N 2.84Å; N676-R680 WeakPolarHBondContact O-CB 3.43Å; N676-R680 VanDerWaalsContact O-CG 3.26Å; N676-R680 WeakPolarHBondContact O-CG 3.38Å; N676-R680 PolarHBondContact O-N 3.4Å
677	L	66	Low	58.5	Low	117 Å²	117	95.5 Å²	95.5	61%	0.613	50%	0.504	S	S	*	.	H	α-helix	trans	-63.6	-46.8	173.2	-97.2	81.3	0	0	0	111.2	E673 E674 R680 Y681	E673-L677 WeakPolarHBondContact O-CD1 3.39Å; E673-L677 PolarHBondContact O-N 2.75Å; E674-L677 PolarHBondContact O-N 3.15Å; L677-R680 PolarHBondContact O-N 2.97Å; L677-Y681 WeakPolarHBondContact O-CB 3.36Å; L677-Y681 PolarHBondContact O-N 3.01Å
678	I	66.7	Low	58.6	Low	73 Å²	73	91.1 Å²	91.1	37%	0.374	49%	0.488	S	S	.	.	H	α-helix	trans	-62.4	-46.2	179.4	-67	164.9	0	0	0	110.6	L508 E674 R680 Y681 A682	L508-I678 HydrophobicContact CD2-CG2 4.13Å; E674-I678 VanDerWaalsContact O-CG1 3.28Å; E674-I678 WeakPolarHBondContact O-CG1 3.21Å; E674-I678 PolarHBondContact O-N 3.42Å; I678-R680 PolarHBondContact O-N 2.88Å; I678-Y681 PolarHBondContact O-N 3.29Å; I678-A682 VanDerWaalsContact O-CB 3.3Å; I678-A682 WeakPolarHBondContact O-CB 3.48Å; I678-A682 PolarHBondContact O-N 3.28Å
679	A	66.5	Low	59.1	Low	58 Å²	58	88.6 Å²	88.6	48%	0.479	48%	0.479	S	S	.	.	H	α-helix	trans	-62.1	-42	177.5	0	0	0	0	0	112.2	H675 A683	H675-A679 WeakPolarHBondContact O-CB 3.29Å; H675-A679 PolarHBondContact O-N 2.7Å; A679-A683 VanDerWaalsContact O-CB 3.28Å; A679-A683 WeakPolarHBondContact O-CB 3.32Å; A679-A683 PolarHBondContact O-N 2.72Å
680	R	57.5	Low	59.3	Low	127 Å²	127	84.6 Å²	84.6	48%	0.479	47%	0.468	S	S	.	.	H	α-helix	trans	-64.8	-43.2	175.2	-77.3	171.9	55.4	-169.8	-9.8	112.3	N676 L677 I678 A683 Q684	N676-R680 WeakPolarHBondContact O-CB 3.43Å; N676-R680 VanDerWaalsContact O-CG 3.26Å; N676-R680 WeakPolarHBondContact O-CG 3.38Å; N676-R680 PolarHBondContact O-N 3.4Å; L677-R680 PolarHBondContact O-N 2.97Å; I678-R680 PolarHBondContact O-N 2.88Å; R680-A683 PolarHBondContact O-N 2.72Å; R680-Q684 VanDerWaalsContact O-CB 3.31Å; R680-Q684 WeakPolarHBondContact O-CB 3.47Å; R680-Q684 PolarHBondContact O-N 3.06Å
681	Y	58.3	Low	59.6	Low	149 Å²	149	80.8 Å²	80.8	58%	0.584	45%	0.454	S	S	*	.	H	α-helix	trans	-66.6	-41.5	177.8	-176.6	-111.4	0	0	0	111.9	L677 I678 Q684 L685	L677-Y681 WeakPolarHBondContact O-CB 3.36Å; L677-Y681 PolarHBondContact O-N 3.01Å; I678-Y681 PolarHBondContact O-N 3.29Å; Y681-Q684 PolarHBondContact O-N 3.06Å; Y681-L685 HydrophobicContact CD1-CD1 3.93Å; Y681-L685 HydrophobicContact CE1-CD1 3.43Å; Y681-L685 VanDerWaalsContact CE1-CD1 3.43Å; Y681-L685 HydrophobicContact CE1-CG 4.31Å; Y681-L685 HydrophobicContact CE2-CD1 4.49Å; Y681-L685 PolarHBondContact O-N 3.34Å
682	A	65	Low	59.6	Low	54 Å²	54	83.2 Å²	83.2	45%	0.446	46%	0.464	S	S	.	.	H	α-helix	trans	-62.8	-43.3	173.6	0	0	0	0	0	112	I678 Q684 L685 A686	I678-A682 VanDerWaalsContact O-CB 3.3Å; I678-A682 WeakPolarHBondContact O-CB 3.48Å; I678-A682 PolarHBondContact O-N 3.28Å; A682-Q684 VanDerWaalsContact C-N 3.33Å; A682-Q684 PolarHBondContact O-N 2.97Å; A682-L685 PolarHBondContact O-N 2.7Å; A682-A686 VanDerWaalsContact O-CB 3.29Å; A682-A686 WeakPolarHBondContact O-CB 3.23Å; A682-A686 PolarHBondContact O-N 2.95Å
683	A	63.4	Low	59.4	Low	60 Å²	60	84.2 Å²	84.2	50%	0.496	47%	0.466	S	S	.	.	H	α-helix	trans	-64.2	-35.9	174.6	0	0	0	0	0	112.5	A679 R680 A686 A687	A679-A683 VanDerWaalsContact O-CB 3.28Å; A679-A683 WeakPolarHBondContact O-CB 3.32Å; A679-A683 PolarHBondContact O-N 2.72Å; R680-A683 PolarHBondContact O-N 2.72Å; A683-A686 PolarHBondContact O-N 3.27Å; A683-A687 VanDerWaalsContact O-CB 3.32Å; A683-A687 WeakPolarHBondContact O-CB 3.32Å; A683-A687 PolarHBondContact O-N 2.96Å
684	Q	60.7	Low	58.7	Low	130 Å²	130	83.2 Å²	83.2	61%	0.607	46%	0.461	S	S	*	.	H	α-helix	trans	-73.5	-36.9	178.3	-164	168.1	13.9	0	0	112.2	R680 Y681 A682 A688	R680-Q684 VanDerWaalsContact O-CB 3.31Å; R680-Q684 WeakPolarHBondContact O-CB 3.47Å; R680-Q684 PolarHBondContact O-N 3.06Å; Y681-Q684 PolarHBondContact O-N 3.06Å; A682-Q684 VanDerWaalsContact C-N 3.33Å; A682-Q684 PolarHBondContact O-N 2.97Å; Q684-A688 WeakPolarHBondContact O-CB 3.45Å; Q684-A688 PolarHBondContact O-N 3.02Å
685	L	65.9	Low	57.7	Low	93 Å²	93	83.7 Å²	83.7	49%	0.487	46%	0.462	S	S	.	.	H	α-helix	trans	-64.4	-43.8	167.6	-85.3	169.2	0	0	0	111.8	Y681 A682 A688 S689	Y681-L685 HydrophobicContact CD1-CD1 3.93Å; Y681-L685 HydrophobicContact CE1-CD1 3.43Å; Y681-L685 VanDerWaalsContact CE1-CD1 3.43Å; Y681-L685 HydrophobicContact CE1-CG 4.31Å; Y681-L685 HydrophobicContact CE2-CD1 4.49Å; Y681-L685 PolarHBondContact O-N 3.34Å; A682-L685 PolarHBondContact O-N 2.7Å; L685-A688 PolarHBondContact O-N 3.46Å; L685-S689 WeakPolarHBondContact O-CB 3.41Å; L685-S689 PolarHBondContact O-N 3.28Å; L685-S689 PolarHBondContact O-OG 2.89Å
686	A	60.1	Low	56.8	Low	53 Å²	53	86.1 Å²	86.1	44%	0.438	48%	0.478	S	S	.	.	H	α-helix	trans	-59.9	-48.8	176.1	0	0	0	0	0	110.8	A682 A683 A688 S689 A690	A682-A686 VanDerWaalsContact O-CB 3.29Å; A682-A686 WeakPolarHBondContact O-CB 3.23Å; A682-A686 PolarHBondContact O-N 2.95Å; A683-A686 PolarHBondContact O-N 3.27Å; A686-A688 PolarHBondContact O-N 2.95Å; A686-S689 CarbonylContact O-C 3.56Å; A686-S689 PolarHBondContact O-N 3.41Å; A686-S689 VanDerWaalsContact O-N 3.15Å; A686-S689 PolarHBondContact O-OG 2.97Å; A686-A690 WeakPolarHBondContact O-CB 3.33Å; A686-A690 PolarHBondContact O-N 3.44Å
687	A	52.4	Low	55.9	Low	47 Å²	47	88.8 Å²	88.8	39%	0.388	49%	0.485	S	S	.	.	H	α-helix	trans	-60.2	-43.1	176	0	0	0	0	0	112.7	A683 S689 A690 L691	A683-A687 VanDerWaalsContact O-CB 3.32Å; A683-A687 WeakPolarHBondContact O-CB 3.32Å; A683-A687 PolarHBondContact O-N 2.96Å; A687-S689 VanDerWaalsContact C-N 3.35Å; A687-S689 PolarHBondContact O-N 3.46Å; A687-A690 PolarHBondContact O-N 3.47Å; A687-L691 WeakPolarHBondContact O-CB 3.36Å; A687-L691 PolarHBondContact O-N 3.35Å
688	A	47.8	Very low	54.7	Low	46 Å²	46	89 Å²	89	38%	0.38	48%	0.481	S	S	.	.	H	α-helix	trans	-64.5	-37.5	174.4	0	0	0	0	0	112.3	Q684 L685 A686 N692	Q684-A688 WeakPolarHBondContact O-CB 3.45Å; Q684-A688 PolarHBondContact O-N 3.02Å; L685-A688 PolarHBondContact O-N 3.46Å; A686-A688 PolarHBondContact O-N 2.95Å; A688-N692 PolarHBondContact O-N 3.49Å; A688-N692 VanDerWaalsContact O-N 3.16Å; A688-N692 PolarHBondContact O-ND2 2.84Å
689	S	54.2	Low	53.6	Low	58 Å²	58	88.1 Å²	88.1	41%	0.406	49%	0.49	S	S	.	.	H	α-helix	trans	-71.4	-36.1	175.6	74.6	0	0	0	0	112.7	L685 A686 A687 N692 Q693	L685-S689 WeakPolarHBondContact O-CB 3.41Å; L685-S689 PolarHBondContact O-N 3.28Å; L685-S689 PolarHBondContact O-OG 2.89Å; A686-S689 CarbonylContact O-C 3.56Å; A686-S689 PolarHBondContact O-N 3.41Å; A686-S689 VanDerWaalsContact O-N 3.15Å; A686-S689 PolarHBondContact O-OG 2.97Å; A687-S689 VanDerWaalsContact C-N 3.35Å; A687-S689 PolarHBondContact O-N 3.46Å; S689-N692 PolarHBondContact O-N 3.37Å; S689-Q693 WeakPolarHBondContact O-CG 3.32Å; S689-Q693 PolarHBondContact O-N 3.35Å
690	A	53.2	Low	52.5	Low	44 Å²	44	93 Å²	93	36%	0.364	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-44.7	174.5	0	0	0	0	0	110.9	A686 A687 N692 Q693 E694	A686-A690 WeakPolarHBondContact O-CB 3.33Å; A686-A690 PolarHBondContact O-N 3.44Å; A687-A690 PolarHBondContact O-N 3.47Å; A690-N692 VanDerWaalsContact C-N 3.29Å; A690-N692 PolarHBondContact O-N 2.83Å; A690-Q693 CarbonylContact O-C 3.56Å; A690-Q693 PolarHBondContact O-N 2.89Å; A690-Q693 VanDerWaalsContact O-N 3.15Å; A690-E694 WeakPolarHBondContact O-CB 3.48Å; A690-E694 PolarHBondContact O-N 3.02Å
691	L	51.1	Low	51.6	Low	59 Å²	59	92.2 Å²	92.2	31%	0.309	51%	0.509	S	S	.	.	H	α-helix	trans	-56.7	-40.2	172.1	-98.4	163.9	0	0	0	112.4	A687 F695	A687-L691 WeakPolarHBondContact O-CB 3.36Å; A687-L691 PolarHBondContact O-N 3.35Å; L691-F695 WeakPolarHBondContact O-CB 3.23Å; L691-F695 WeakPolarHBondContact O-CD2 3.32Å; L691-F695 PolarHBondContact O-N 2.97Å
692	N	52	Low	50.7	Low	87 Å²	87	91.3 Å²	91.3	47%	0.465	52%	0.518	S	S	.	.	H	α-helix	trans	-69	-42.4	174.9	-71.9	-57.8	0	0	0	112.1	A688 S689 A690 E694 F695 D696	A688-N692 PolarHBondContact O-N 3.49Å; A688-N692 VanDerWaalsContact O-N 3.16Å; A688-N692 PolarHBondContact O-ND2 2.84Å; S689-N692 PolarHBondContact O-N 3.37Å; A690-N692 VanDerWaalsContact C-N 3.29Å; A690-N692 PolarHBondContact O-N 2.83Å; N692-E694 VanDerWaalsContact C-N 3.33Å; N692-E694 PolarHBondContact O-N 3.42Å; N692-F695 WeakPolarHBondContact O-CB 3.48Å; N692-F695 PolarHBondContact O-N 3.36Å; N692-D696 PolarHBondContact O-N 3.03Å
693	Q	53.5	Low	49.7	Very low	113 Å²	113	94.8 Å²	94.8	53%	0.528	53%	0.525	S	S	.	.	H	α-helix	trans	-67.4	-31	176.2	-72.6	-176.3	17.3	0	0	113.3	S689 A690 K697	S689-Q693 WeakPolarHBondContact O-CG 3.32Å; S689-Q693 PolarHBondContact O-N 3.35Å; A690-Q693 CarbonylContact O-C 3.56Å; A690-Q693 PolarHBondContact O-N 2.89Å; A690-Q693 VanDerWaalsContact O-N 3.15Å; Q693-K697 WeakPolarHBondContact O-CB 3.27Å; Q693-K697 VanDerWaalsContact O-CG 3.32Å; Q693-K697 WeakPolarHBondContact O-CG 3.43Å; Q693-K697 PolarHBondContact O-N 3.07Å; Q693-K697 VanDerWaalsContact O-N 3.1Å
694	E	42.7	Very low	49	Very low	107 Å²	107	94.9 Å²	94.9	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-70.3	-42.2	169.6	-77.2	-170.4	168.5	0	0	110.8	A690 N692 D696 K697 F698	A690-E694 WeakPolarHBondContact O-CB 3.48Å; A690-E694 PolarHBondContact O-N 3.02Å; N692-E694 VanDerWaalsContact C-N 3.33Å; N692-E694 PolarHBondContact O-N 3.42Å; E694-D696 VanDerWaalsContact C-N 3.31Å; E694-D696 PolarHBondContact O-N 2.98Å; E694-K697 PolarHBondContact O-N 3.46Å; E694-K697 VanDerWaalsContact O-N 3.12Å; E694-F698 HydrophobicContact CB-CD2 3.95Å; E694-F698 HydrophobicContact CB-CE2 4.03Å; E694-F698 HydrophobicContact CG-CE2 4.2Å; E694-F698 WeakPolarHBondContact O-CB 3.4Å; E694-F698 VanDerWaalsContact O-CD2 3.23Å; E694-F698 WeakPolarHBondContact O-CD2 3.41Å; E694-F698 PolarHBondContact O-N 2.88Å
695	F	43.2	Very low	49	Very low	96 Å²	96	92 Å²	92	42%	0.421	51%	0.514	S	S	.	.	H	α-helix	trans	-57.9	-40.9	173.7	-105.7	-93.5	0	0	0	112.9	L691 N692 A828 L832	L691-F695 WeakPolarHBondContact O-CB 3.23Å; L691-F695 WeakPolarHBondContact O-CD2 3.32Å; L691-F695 PolarHBondContact O-N 2.97Å; N692-F695 WeakPolarHBondContact O-CB 3.48Å; N692-F695 PolarHBondContact O-N 3.36Å; F695-A828 HydrophobicContact CE2-CB 4.15Å; F695-A828 HydrophobicContact CZ-CB 4.44Å; F695-L832 HydrophobicContact CD1-CD2 4.45Å; F695-L832 HydrophobicContact CE1-CD1 4.35Å; F695-L832 HydrophobicContact CE1-CD2 3.74Å; F695-L832 HydrophobicContact CE1-CG 4.07Å; F695-L832 HydrophobicContact CE2-CD1 4.26Å; F695-L832 HydrophobicContact CZ-CD1 3.88Å; F695-L832 HydrophobicContact CZ-CD2 4.07Å; F695-L832 HydrophobicContact CZ-CG 3.87Å
696	D	46.8	Very low	48.8	Very low	137 Å²	137	94.1 Å²	94.1	73%	0.733	52%	0.521	S	S	*	.	H	α-helix	trans	-72.3	-28.8	176.1	-72.1	-25.8	0	0	0	112.6	N692 E694	N692-D696 PolarHBondContact O-N 3.03Å; E694-D696 VanDerWaalsContact C-N 3.31Å; E694-D696 PolarHBondContact O-N 2.98Å
697	K	46.1	Very low	49.1	Very low	156 Å²	156	95.1 Å²	95.1	68%	0.678	52%	0.522	S	S	*	.	H	α-helix	trans	-85	-33	178	-78	178.9	176.3	179.3	0	114.6	Q693 E694 G699	Q693-K697 WeakPolarHBondContact O-CB 3.27Å; Q693-K697 VanDerWaalsContact O-CG 3.32Å; Q693-K697 WeakPolarHBondContact O-CG 3.43Å; Q693-K697 PolarHBondContact O-N 3.07Å; Q693-K697 VanDerWaalsContact O-N 3.1Å; E694-K697 PolarHBondContact O-N 3.46Å; E694-K697 VanDerWaalsContact O-N 3.12Å; K697-G699 PolarHBondContact O-N 3.3Å
698	F	41.6	Very low	49.4	Very low	121 Å²	121	94.6 Å²	94.6	53%	0.531	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-76.3	-5.9	178.2	-80.4	-65.7	0	0	0	113.2	E694 D700	E694-F698 HydrophobicContact CB-CD2 3.95Å; E694-F698 HydrophobicContact CB-CE2 4.03Å; E694-F698 HydrophobicContact CG-CE2 4.2Å; E694-F698 WeakPolarHBondContact O-CB 3.4Å; E694-F698 VanDerWaalsContact O-CD2 3.23Å; E694-F698 WeakPolarHBondContact O-CD2 3.41Å; E694-F698 PolarHBondContact O-N 2.88Å; F698-D700 VanDerWaalsContact C-N 3.27Å; F698-D700 PolarHBondContact O-N 3.46Å
699	G	43.9	Very low	50.4	Low	56 Å²	56	98.5 Å²	98.5	58%	0.577	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-60.2	-33.8	170.6	0	0	0	0	0	113.8	K697	K697-G699 PolarHBondContact O-N 3.3Å
700	D	43.5	Very low	51.4	Low	159 Å²	159	101.5 Å²	101.5	85%	0.85	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-101.9	4	-176.5	-78	-35.1	0	0	0	114.2	F698	F698-D700 VanDerWaalsContact C-N 3.27Å; F698-D700 PolarHBondContact O-N 3.46Å
701	F	37.4	Very low	52.1	Low	112 Å²	112	103 Å²	103	49%	0.491	53%	0.529	S	S	.	.			trans	-121.7	72.4	-174	-156.8	-109.1	0	0	0	113.6	E703	F701-E703 HydrophobicContact CD1-CB 3.8Å; F701-E703 HydrophobicContact CE1-CB 3.36Å; F701-E703 HydrophobicContact CE1-CG 4.16Å; F701-E703 HydrophobicContact CE2-CB 4.37Å; F701-E703 HydrophobicContact CG-CB 4.48Å; F701-E703 HydrophobicContact CZ-CB 3.69Å; F701-E703 HydrophobicContact CZ-CG 4.14Å; F701-E703 WeakPolarHBondContact CZ-OE2 3.49Å; F701-E703 PolarHBondContact O-N 2.96Å
702	V	40.3	Very low	53.1	Low	130 Å²	130	100.9 Å²	100.9	79%	0.788	52%	0.518	S	S	*	.			trans	-79.8	56	177	-167.5	0	0	0	0	111.3	S704	V702-S704 PolarHBondContact O-N 3.08Å
703	E	43.5	Very low	54.3	Low	126 Å²	126	99.2 Å²	99.2	59%	0.589	52%	0.516	S	S	*	.			trans	-90.1	81.6	-178.7	-159.3	169.1	-102.9	0	0	112.6	F701 T707	F701-E703 HydrophobicContact CD1-CB 3.8Å; F701-E703 HydrophobicContact CE1-CB 3.36Å; F701-E703 HydrophobicContact CE1-CG 4.16Å; F701-E703 HydrophobicContact CE2-CB 4.37Å; F701-E703 HydrophobicContact CG-CB 4.48Å; F701-E703 HydrophobicContact CZ-CB 3.69Å; F701-E703 HydrophobicContact CZ-CG 4.14Å; F701-E703 WeakPolarHBondContact CZ-OE2 3.49Å; F701-E703 PolarHBondContact O-N 2.96Å; E703-T707 PolarHBondContact O-OG1 3.21Å
704	S	50.1	Low	55.3	Low	62 Å²	62	100.1 Å²	100.1	43%	0.434	52%	0.52	S	S	.	.			trans	63.2	119.9	173.1	-174.5	0	0	0	0	117	V702 Q706 T707	V702-S704 PolarHBondContact O-N 3.08Å; S704-Q706 PolarHBondContact O-N 3.14Å; S704-Q706 VanDerWaalsContact OG-CB 3.31Å; S704-Q706 WeakPolarHBondContact OG-CB 3.29Å; S704-Q706 PolarHBondContact OG-N 3.03Å; S704-T707 PolarHBondContact O-N 3.39Å; S704-T707 VanDerWaalsContact O-N 3.09Å; S704-T707 PolarHBondContact O-OG1 3.15Å
705	T	59.7	Low	56.6	Low	71 Å²	71	95.9 Å²	95.9	44%	0.436	50%	0.501	S	S	.	.	H	α-helix	trans	-57.2	-5.9	169.8	-26.2	0	0	0	0	114.1	K709 L833	T705-K709 VanDerWaalsContact O-CD 3.32Å; T705-K709 WeakPolarHBondContact O-CD 3.36Å; T705-K709 VanDerWaalsContact O-CG 3.23Å; T705-K709 WeakPolarHBondContact O-CG 3.2Å; T705-L833 HydrophobicContact CG2-CD2 3.94Å
706	Q	61.2	Low	58	Low	137 Å²	137	96.6 Å²	96.6	64%	0.64	51%	0.506	S	S	*	.	H	α-helix	trans	-87.9	-33.3	178.3	-159.9	163.7	-7.2	0	0	112.6	S704 K709 Q710	S704-Q706 PolarHBondContact O-N 3.14Å; S704-Q706 VanDerWaalsContact OG-CB 3.31Å; S704-Q706 WeakPolarHBondContact OG-CB 3.29Å; S704-Q706 PolarHBondContact OG-N 3.03Å; Q706-K709 PolarHBondContact O-N 3.06Å; Q706-Q710 PolarHBondContact O-N 3.46Å; Q706-Q710 VanDerWaalsContact O-N 3.14Å
707	T	66.7	Low	59.6	Low	74 Å²	74	93 Å²	93	45%	0.454	48%	0.484	S	S	.	.	H	α-helix	trans	-67.5	-47.5	176.4	60.7	0	0	0	0	110.3	E703 S704 K709 Q710 L711	E703-T707 PolarHBondContact O-OG1 3.21Å; S704-T707 PolarHBondContact O-N 3.39Å; S704-T707 VanDerWaalsContact O-N 3.09Å; S704-T707 PolarHBondContact O-OG1 3.15Å; T707-K709 VanDerWaalsContact C-N 3.28Å; T707-K709 PolarHBondContact O-N 3.38Å; T707-Q710 WeakPolarHBondContact O-CB 3.37Å; T707-Q710 PolarHBondContact O-N 3.36Å; T707-Q710 VanDerWaalsContact O-N 3.08Å; T707-L711 PolarHBondContact O-N 2.91Å
708	Q	59.7	Low	60.9	Low	36 Å²	36	90 Å²	90	17%	0.168	47%	0.472	C	S	.	.	H	α-helix	trans	-60.3	-35	177	-166.2	177.3	10.7	0	0	112.6	I712 L829 L833	Q708-I712 HydrophobicContact CG-CD1 4.46Å; Q708-I712 WeakPolarHBondContact O-CG1 3.34Å; Q708-I712 PolarHBondContact O-N 2.9Å; Q708-I712 VanDerWaalsContact O-N 3.07Å; Q708-L829 HydrophobicContact CG-CD2 4.31Å; Q708-L833 HydrophobicContact CB-CD2 4.46Å; Q708-L833 HydrophobicContact CG-CD2 4.11Å; Q708-L833 HydrophobicContact CG-CG 4.19Å; Q708-L833 VanDerWaalsContact OE1-CD2 3.29Å
709	K	69	Low	62.3	Low	128 Å²	128	85.4 Å²	85.4	56%	0.557	45%	0.452	S	S	*	.	H	α-helix	trans	-68	-41.1	173.3	-77.3	173.7	-176	178.5	0	112.4	T705 Q706 T707 I712 A713 L833	T705-K709 VanDerWaalsContact O-CD 3.32Å; T705-K709 WeakPolarHBondContact O-CD 3.36Å; T705-K709 VanDerWaalsContact O-CG 3.23Å; T705-K709 WeakPolarHBondContact O-CG 3.2Å; Q706-K709 PolarHBondContact O-N 3.06Å; T707-K709 VanDerWaalsContact C-N 3.28Å; T707-K709 PolarHBondContact O-N 3.38Å; K709-I712 PolarHBondContact O-N 3.18Å; K709-A713 PolarHBondContact O-N 2.78Å; K709-L833 HydrophobicContact CG-CD1 4.48Å
710	Q	73.4	Confident	64	Low	121 Å²	121	90.1 Å²	90.1	57%	0.565	45%	0.453	S	S	*	.	H	α-helix	trans	-63.4	-42.3	174.3	-74.5	179.1	-23.9	0	0	111.6	Q706 T707 A713 Q714	Q706-Q710 PolarHBondContact O-N 3.46Å; Q706-Q710 VanDerWaalsContact O-N 3.14Å; T707-Q710 WeakPolarHBondContact O-CB 3.37Å; T707-Q710 PolarHBondContact O-N 3.36Å; T707-Q710 VanDerWaalsContact O-N 3.08Å; Q710-A713 PolarHBondContact O-N 3.05Å; Q710-Q714 WeakPolarHBondContact O-CG 3.38Å; Q710-Q714 PolarHBondContact O-N 3.12Å
711	L	69.6	Low	65.7	Low	76 Å²	76	88.7 Å²	88.7	40%	0.398	44%	0.439	S	S	.	.	H	α-helix	trans	-61.1	-45.3	176.7	-176.5	61.1	0	0	0	111.9	T707 A713 Q714 L715 L829	T707-L711 PolarHBondContact O-N 2.91Å; L711-A713 VanDerWaalsContact C-N 3.35Å; L711-A713 PolarHBondContact O-N 3.24Å; L711-Q714 PolarHBondContact O-N 3.36Å; L711-L715 HydrophobicContact CD1-CD1 4.29Å; L711-L715 HydrophobicContact CD1-CG 4.44Å; L711-L715 HydrophobicContact CG-CD1 4.05Å; L711-L715 VanDerWaalsContact O-CG 3.29Å; L711-L715 WeakPolarHBondContact O-CG 3.29Å; L711-L715 PolarHBondContact O-N 3.41Å; L711-L829 HydrophobicContact CD2-CD1 3.75Å; L711-L829 HydrophobicContact CD2-CD2 4.09Å; L711-L829 HydrophobicContact CG-CD1 3.97Å
712	I	71.5	Confident	67.3	Low	14 Å²	14	84 Å²	84	7%	0.072	42%	0.419	C	S	.	.	H	α-helix	trans	-61.7	-42.2	175.8	-71	166.3	0	0	0	111.3	Q708 K709 Q714 L715 Q716 L826 L829 L833	Q708-I712 HydrophobicContact CG-CD1 4.46Å; Q708-I712 WeakPolarHBondContact O-CG1 3.34Å; Q708-I712 PolarHBondContact O-N 2.9Å; Q708-I712 VanDerWaalsContact O-N 3.07Å; K709-I712 PolarHBondContact O-N 3.18Å; I712-Q714 PolarHBondContact O-N 3.29Å; I712-L715 PolarHBondContact O-N 3.42Å; I712-Q716 HydrophobicContact CG2-CG 4.29Å; I712-Q716 WeakPolarHBondContact O-CB 3.42Å; I712-Q716 VanDerWaalsContact O-CG 3.29Å; I712-Q716 WeakPolarHBondContact O-CG 3.13Å; I712-Q716 PolarHBondContact O-N 3.09Å; I712-L826 HydrophobicContact CG2-CD2 4.42Å; I712-L829 HydrophobicContact CD1-CB 3.98Å; I712-L829 HydrophobicContact CG1-CB 3.76Å; I712-L829 HydrophobicContact CG1-CD1 4.4Å; I712-L833 HydrophobicContact CD1-CD1 3.37Å; I712-L833 HydrophobicContact CD1-CG 3.94Å
713	A	76.4	Confident	68.8	Low	52 Å²	52	81.5 Å²	81.5	43%	0.43	40%	0.401	S	S	.	.	H	α-helix	trans	-62.2	-40.6	176.2	0	0	0	0	0	112.5	K709 Q710 L711 Q716 E717	K709-A713 PolarHBondContact O-N 2.78Å; Q710-A713 PolarHBondContact O-N 3.05Å; L711-A713 VanDerWaalsContact C-N 3.35Å; L711-A713 PolarHBondContact O-N 3.24Å; A713-Q716 PolarHBondContact O-N 3.34Å; A713-E717 WeakPolarHBondContact O-CB 3.28Å; A713-E717 PolarHBondContact O-N 3.4Å
714	Q	75.4	Confident	70.6	Confident	131 Å²	131	80.3 Å²	80.3	61%	0.612	39%	0.393	S	S	*	.	H	α-helix	trans	-64.6	-40.9	174.8	-71.2	178.8	11.4	0	0	112.4	Q710 L711 I712 E717 K718	Q710-Q714 WeakPolarHBondContact O-CG 3.38Å; Q710-Q714 PolarHBondContact O-N 3.12Å; L711-Q714 PolarHBondContact O-N 3.36Å; I712-Q714 PolarHBondContact O-N 3.29Å; Q714-E717 PolarHBondContact O-N 3.14Å; Q714-K718 WeakPolarHBondContact O-CB 3.28Å; Q714-K718 PolarHBondContact O-N 3.18Å
715	L	68.8	Low	71.7	Confident	19 Å²	19	80.5 Å²	80.5	10%	0.099	39%	0.387	C	S	.	.	H	α-helix	trans	-71.1	-36.9	178.4	-65.2	167.9	0	0	0	111.9	L711 I712 K718 N719 L822 L826 L829	L711-L715 HydrophobicContact CD1-CD1 4.29Å; L711-L715 HydrophobicContact CD1-CG 4.44Å; L711-L715 HydrophobicContact CG-CD1 4.05Å; L711-L715 VanDerWaalsContact O-CG 3.29Å; L711-L715 WeakPolarHBondContact O-CG 3.29Å; L711-L715 PolarHBondContact O-N 3.41Å; I712-L715 PolarHBondContact O-N 3.42Å; L715-K718 PolarHBondContact O-N 3.05Å; L715-N719 WeakPolarHBondContact O-CB 3.44Å; L715-N719 PolarHBondContact O-N 3.38Å; L715-L822 HydrophobicContact CB-CD1 4.24Å; L715-L822 HydrophobicContact CD2-CD1 3.48Å; L715-L822 VanDerWaalsContact CD2-CD1 3.48Å; L715-L822 HydrophobicContact CG-CD1 4.45Å; L715-L826 HydrophobicContact CB-CD2 3.61Å; L715-L826 HydrophobicContact CB-CG 3.94Å; L715-L829 HydrophobicContact CD1-CD1 3.27Å
716	Q	73.6	Confident	72.3	Confident	111 Å²	111	77.5 Å²	77.5	52%	0.519	37%	0.369	S	S	.	.	H	α-helix	trans	-62.1	-43.7	171.1	-75	174.3	-23.8	0	0	111.4	I712 A713 N719 R720 L826	I712-Q716 HydrophobicContact CG2-CG 4.29Å; I712-Q716 WeakPolarHBondContact O-CB 3.42Å; I712-Q716 VanDerWaalsContact O-CG 3.29Å; I712-Q716 WeakPolarHBondContact O-CG 3.13Å; I712-Q716 PolarHBondContact O-N 3.09Å; A713-Q716 PolarHBondContact O-N 3.34Å; Q716-N719 WeakPolarHBondContact O-CB 3.49Å; Q716-N719 PolarHBondContact O-N 2.93Å; Q716-R720 PolarHBondContact O-N 2.88Å; Q716-L826 HydrophobicContact CG-CD2 3.82Å
717	E	79.3	Confident	73	Confident	61 Å²	61	75.5 Å²	75.5	29%	0.285	36%	0.359	S	S	.	.	H	α-helix	trans	-63.9	-41.3	175.3	172	62.4	174.8	0	0	112.3	A713 Q714 N719 R720 K721	A713-E717 WeakPolarHBondContact O-CB 3.28Å; A713-E717 PolarHBondContact O-N 3.4Å; Q714-E717 PolarHBondContact O-N 3.14Å; E717-N719 VanDerWaalsContact C-N 3.27Å; E717-N719 PolarHBondContact O-N 3.3Å; E717-R720 PolarHBondContact O-N 3Å; E717-R720 IonicContact OE2-CZ 3.76Å; E717-R720 IonicContact OE2-NE 2.72Å; E717-R720 PolarHBondContact OE2-NE 3.03Å; E717-R720 IonicContact OE2-NH2 3.06Å; E717-R720 PolarHBondContact OE2-NH2 3.11Å; E717-K721 PolarHBondContact O-N 3.32Å; E717-K721 WeakPolarHBondContact OE1-CE 3.42Å; E717-K721 IonicContact OE1-NZ 2.88Å; E717-K721 PolarHBondContact OE1-NZ 3.21Å
718	K	73.5	Confident	73.8	Confident	94 Å²	94	80.4 Å²	80.4	41%	0.409	37%	0.37	S	S	.	.	H	α-helix	trans	-61.7	-36	173.4	-173.3	174.9	167.8	-169.5	0	111.5	Q714 L715 K721 I722 L822	Q714-K718 WeakPolarHBondContact O-CB 3.28Å; Q714-K718 PolarHBondContact O-N 3.18Å; L715-K718 PolarHBondContact O-N 3.05Å; K718-K721 PolarHBondContact O-N 3.11Å; K718-I722 HydrophobicContact CG-CD1 4.21Å; K718-I722 WeakPolarHBondContact O-CG1 3.48Å; K718-I722 PolarHBondContact O-N 3.23Å; K718-L822 HydrophobicContact CB-CD1 4.32Å; K718-L822 HydrophobicContact CB-CD2 3.97Å; K718-L822 HydrophobicContact CD-CD1 3.77Å; K718-L822 HydrophobicContact CD-CD2 4.37Å; K718-L822 HydrophobicContact CG-CD1 4.18Å; K718-L822 HydrophobicContact CG-CD2 3.89Å
719	N	72.3	Confident	74.4	Confident	23 Å²	23	79.2 Å²	79.2	12%	0.123	36%	0.364	C	S	.	.	H	α-helix	trans	-68.8	-43	177.2	-155.7	-15.9	0	0	0	110.8	L715 Q716 E717 K721 I722 L723 L822 L826	L715-N719 WeakPolarHBondContact O-CB 3.44Å; L715-N719 PolarHBondContact O-N 3.38Å; Q716-N719 WeakPolarHBondContact O-CB 3.49Å; Q716-N719 PolarHBondContact O-N 2.93Å; E717-N719 VanDerWaalsContact C-N 3.27Å; E717-N719 PolarHBondContact O-N 3.3Å; N719-K721 VanDerWaalsContact C-N 3.33Å; N719-K721 PolarHBondContact O-N 3.23Å; N719-I722 PolarHBondContact O-N 3.45Å; N719-L723 WeakPolarHBondContact O-CB 3.33Å; N719-L723 WeakPolarHBondContact O-CG 3.22Å; N719-L723 PolarHBondContact O-N 3.07Å; N719-L822 VanDerWaalsContact CA-CD2 3.45Å; N719-L822 HydrophobicContact CB-CD2 3.58Å; N719-L822 VanDerWaalsContact N-CD2 3.3Å; N719-L826 HydrophobicContact CB-CD1 4.22Å; N719-L826 WeakPolarHBondContact ND2-CD1 3.47Å
720	R	79.4	Confident	74.7	Confident	155 Å²	155	77.8 Å²	77.8	59%	0.585	36%	0.355	S	S	*	.	H	α-helix	trans	-57.6	-41	172.6	179.7	162.4	65.1	168.3	-1.8	112.6	Q716 E717 K724	Q716-R720 PolarHBondContact O-N 2.88Å; E717-R720 PolarHBondContact O-N 3Å; E717-R720 IonicContact OE2-CZ 3.76Å; E717-R720 IonicContact OE2-NE 2.72Å; E717-R720 PolarHBondContact OE2-NE 3.03Å; E717-R720 IonicContact OE2-NH2 3.06Å; E717-R720 PolarHBondContact OE2-NH2 3.11Å; R720-K724 PolarHBondContact O-N 3.02Å
721	K	78.8	Confident	75	Confident	129 Å²	129	75.1 Å²	75.1	56%	0.561	35%	0.347	S	S	*	.	H	α-helix	trans	-67.1	-46.1	175.4	-70.4	-178.7	-172.3	175.4	0	112.8	E717 K718 N719 L723 K724 E725	E717-K721 PolarHBondContact O-N 3.32Å; E717-K721 WeakPolarHBondContact OE1-CE 3.42Å; E717-K721 IonicContact OE1-NZ 2.88Å; E717-K721 PolarHBondContact OE1-NZ 3.21Å; K718-K721 PolarHBondContact O-N 3.11Å; N719-K721 VanDerWaalsContact C-N 3.33Å; N719-K721 PolarHBondContact O-N 3.23Å; K721-L723 VanDerWaalsContact C-N 3.32Å; K721-L723 PolarHBondContact O-N 2.9Å; K721-K724 PolarHBondContact O-N 3.09Å; K721-E725 PolarHBondContact O-N 3.29Å; K721-E725 VanDerWaalsContact O-N 3.1Å
722	I	70.9	Confident	75.3	Confident	15 Å²	15	74.1 Å²	74.1	8%	0.077	34%	0.341	C	S	.	.	H	α-helix	trans	-63.7	-38.4	178.9	-68	169.7	0	0	0	111.2	K718 N719 E725 I726 L815 R819 L822	K718-I722 HydrophobicContact CG-CD1 4.21Å; K718-I722 WeakPolarHBondContact O-CG1 3.48Å; K718-I722 PolarHBondContact O-N 3.23Å; N719-I722 PolarHBondContact O-N 3.45Å; I722-E725 PolarHBondContact O-N 3.42Å; I722-I726 HydrophobicContact CG2-CD1 3.75Å; I722-I726 HydrophobicContact CG2-CG1 4.29Å; I722-I726 VanDerWaalsContact O-CG1 3.31Å; I722-I726 WeakPolarHBondContact O-CG1 3.32Å; I722-I726 PolarHBondContact O-N 3.33Å; I722-L815 HydrophobicContact CG1-CD2 4.46Å; I722-L815 HydrophobicContact CG2-CB 4.46Å; I722-L815 HydrophobicContact CG2-CD2 4.23Å; I722-R819 HydrophobicContact CG2-CB 3.93Å; I722-L822 HydrophobicContact CD1-CD2 4.03Å
723	L	72.5	Confident	75.5	Confident	77 Å²	77	75.9 Å²	75.9	40%	0.403	35%	0.348	S	S	.	.	H	α-helix	trans	-61.3	-47.6	175	-77.8	167.3	0	0	0	112.5	N719 K721 E725 I726 E727	N719-L723 WeakPolarHBondContact O-CB 3.33Å; N719-L723 WeakPolarHBondContact O-CG 3.22Å; N719-L723 PolarHBondContact O-N 3.07Å; K721-L723 VanDerWaalsContact C-N 3.32Å; K721-L723 PolarHBondContact O-N 2.9Å; L723-E725 VanDerWaalsContact C-N 3.31Å; L723-E725 PolarHBondContact O-N 3.47Å; L723-I726 PolarHBondContact O-N 2.95Å; L723-E727 PolarHBondContact O-N 3.49Å
724	K	80.3	Confident	75.5	Confident	100 Å²	100	80.3 Å²	80.3	44%	0.435	36%	0.36	S	S	.	.	H	α-helix	trans	-60.5	-38.1	176.7	-74.6	173.4	178.7	-80.7	0	112.4	R720 K721 R728 D1111	R720-K724 PolarHBondContact O-N 3.02Å; K721-K724 PolarHBondContact O-N 3.09Å; K724-R728 WeakPolarHBondContact O-CB 3.49Å; K724-R728 PolarHBondContact O-N 2.66Å; K724-D1111 IonicContact NZ-OD1 3.92Å; K724-D1111 PolarHBondContact NZ-OD1 3.26Å; K724-D1111 IonicContact NZ-OD2 2.85Å; K724-D1111 PolarHBondContact NZ-OD2 3.31Å
725	E	73	Confident	75.6	Confident	66 Å²	66	80.2 Å²	80.2	31%	0.308	36%	0.358	S	S	.	.	H	α-helix	trans	-74.8	-37.2	178.2	-171.4	63.4	-171.2	0	0	112.8	K721 I722 L723 E727 R728 L729 L815	K721-E725 PolarHBondContact O-N 3.29Å; K721-E725 VanDerWaalsContact O-N 3.1Å; I722-E725 PolarHBondContact O-N 3.42Å; L723-E725 VanDerWaalsContact C-N 3.31Å; L723-E725 PolarHBondContact O-N 3.47Å; E725-E727 VanDerWaalsContact C-N 3.29Å; E725-E727 PolarHBondContact O-N 2.68Å; E725-R728 PolarHBondContact O-N 3.49Å; E725-R728 WeakPolarHBondContact OE2-CD 3.36Å; E725-L729 HydrophobicContact CG-CD1 4.07Å; E725-L729 WeakPolarHBondContact O-CB 3.31Å; E725-L729 VanDerWaalsContact O-CG 3.25Å; E725-L729 WeakPolarHBondContact O-CG 3.48Å; E725-L729 PolarHBondContact O-N 2.74Å; E725-L815 HydrophobicContact CB-CD1 4.37Å; E725-L815 HydrophobicContact CG-CD1 3.71Å
726	I	72.1	Confident	75.9	Confident	8 Å²	8	79.7 Å²	79.7	4%	0.041	36%	0.355	C	S	.	.	H	α-helix	trans	-58.7	-44	171.5	-72.8	169	0	0	0	110.2	I722 L723 L729 R730 L815 Q816	I722-I726 HydrophobicContact CG2-CD1 3.75Å; I722-I726 HydrophobicContact CG2-CG1 4.29Å; I722-I726 VanDerWaalsContact O-CG1 3.31Å; I722-I726 WeakPolarHBondContact O-CG1 3.32Å; I722-I726 PolarHBondContact O-N 3.33Å; L723-I726 PolarHBondContact O-N 2.95Å; I726-L729 PolarHBondContact O-N 3.14Å; I726-R730 WeakPolarHBondContact O-CG 3.39Å; I726-R730 PolarHBondContact O-N 2.87Å; I726-L815 HydrophobicContact CD1-CB 4.29Å; I726-L815 HydrophobicContact CG1-CB 3.86Å; I726-Q816 HydrophobicContact CD1-CG 4.2Å
727	E	76.7	Confident	75.8	Confident	95 Å²	95	76.7 Å²	76.7	44%	0.444	35%	0.349	S	S	.	.	H	α-helix	trans	-70.2	-39.9	-179.2	-155.6	55.1	-138.1	0	0	112.4	L723 E725 L729 R730 V731	L723-E727 PolarHBondContact O-N 3.49Å; E725-E727 VanDerWaalsContact C-N 3.29Å; E725-E727 PolarHBondContact O-N 2.68Å; E727-L729 VanDerWaalsContact C-N 3.3Å; E727-L729 PolarHBondContact O-N 3.47Å; E727-R730 WeakPolarHBondContact O-CB 3.32Å; E727-R730 PolarHBondContact O-N 3.18Å; E727-R730 VanDerWaalsContact OE2-CD 3.28Å; E727-R730 WeakPolarHBondContact OE2-CD 3.29Å; E727-R730 IonicContact OE2-CZ 2.71Å; E727-R730 IonicContact OE2-NE 3.74Å; E727-R730 IonicContact OE2-NH1 3.71Å; E727-R730 PolarHBondContact OE2-NH1 3.24Å; E727-V731 PolarHBondContact O-N 3.07Å; E727-V731 VanDerWaalsContact O-N 3.12Å
728	R	82.9	Confident	75.5	Confident	178 Å²	178	76.7 Å²	76.7	67%	0.672	36%	0.359	S	S	*	.	H	α-helix	trans	-54.6	-46.8	169.8	-178.3	-172.2	-179.9	144.9	5.8	111.8	K724 E725 V731 E732	K724-R728 WeakPolarHBondContact O-CB 3.49Å; K724-R728 PolarHBondContact O-N 2.66Å; E725-R728 PolarHBondContact O-N 3.49Å; E725-R728 WeakPolarHBondContact OE2-CD 3.36Å; R728-V731 PolarHBondContact O-N 3.25Å; R728-E732 PolarHBondContact O-N 3.43Å; R728-E732 VanDerWaalsContact O-N 3.15Å
729	L	73.8	Confident	75.5	Confident	11 Å²	11	78.1 Å²	78.1	6%	0.058	37%	0.366	C	S	.	.	H	α-helix	trans	-71.5	-31.4	-177.8	-69.1	168	0	0	0	112.4	E725 I726 E727 E732 Q733 L808 R811 M812 L815	E725-L729 HydrophobicContact CG-CD1 4.07Å; E725-L729 WeakPolarHBondContact O-CB 3.31Å; E725-L729 VanDerWaalsContact O-CG 3.25Å; E725-L729 WeakPolarHBondContact O-CG 3.48Å; E725-L729 PolarHBondContact O-N 2.74Å; I726-L729 PolarHBondContact O-N 3.14Å; E727-L729 VanDerWaalsContact C-N 3.3Å; E727-L729 PolarHBondContact O-N 3.47Å; L729-E732 PolarHBondContact O-N 2.82Å; L729-Q733 VanDerWaalsContact O-CB 3.29Å; L729-Q733 WeakPolarHBondContact O-CB 3.31Å; L729-Q733 PolarHBondContact O-N 2.79Å; L729-L808 HydrophobicContact CD2-CD2 3.54Å; L729-R811 HydrophobicContact CD1-CB 4.28Å; L729-M812 HydrophobicContact CB-CE 4.07Å; L729-L815 HydrophobicContact CD1-CD1 3.26Å
730	R	75.1	Confident	75.5	Confident	98 Å²	98	78.5 Å²	78.5	37%	0.37	37%	0.367	S	S	.	.	H	α-helix	trans	-61.1	-49.1	170.5	-77.9	167.2	164.6	176.9	-10.4	111.9	I726 E727 E732 Q733 Q734 M812	I726-R730 WeakPolarHBondContact O-CG 3.39Å; I726-R730 PolarHBondContact O-N 2.87Å; E727-R730 WeakPolarHBondContact O-CB 3.32Å; E727-R730 PolarHBondContact O-N 3.18Å; E727-R730 VanDerWaalsContact OE2-CD 3.28Å; E727-R730 WeakPolarHBondContact OE2-CD 3.29Å; E727-R730 IonicContact OE2-CZ 2.71Å; E727-R730 IonicContact OE2-NE 3.74Å; E727-R730 IonicContact OE2-NH1 3.71Å; E727-R730 PolarHBondContact OE2-NH1 3.24Å; R730-E732 VanDerWaalsContact C-N 3.26Å; R730-E732 PolarHBondContact O-N 3.38Å; R730-Q733 PolarHBondContact O-N 2.92Å; R730-Q734 WeakPolarHBondContact O-CB 3.28Å; R730-Q734 PolarHBondContact O-N 2.9Å; R730-M812 HydrophobicContact CB-CE 4.29Å; R730-M812 HydrophobicContact CG-CE 3.63Å; R730-M812 HydrophobicContact CG-SD 4.04Å
731	V	79.3	Confident	75.2	Confident	65 Å²	65	74.1 Å²	74.1	39%	0.394	36%	0.364	S	S	.	.	H	α-helix	trans	-61.6	-36.1	178.4	174	0	0	0	0	111.4	E727 R728 K735	E727-V731 PolarHBondContact O-N 3.07Å; E727-V731 VanDerWaalsContact O-N 3.12Å; R728-V731 PolarHBondContact O-N 3.25Å; V731-K735 HydrophobicContact CG1-CD 4.4Å; V731-K735 WeakPolarHBondContact O-CD 3.15Å; V731-K735 VanDerWaalsContact O-CG 3.23Å; V731-K735 WeakPolarHBondContact O-CG 2.96Å; V731-K735 PolarHBondContact O-N 3.31Å
732	E	76.3	Confident	74.9	Confident	55 Å²	55	70.8 Å²	70.8	26%	0.257	36%	0.361	S	S	.	.	H	α-helix	trans	-72.7	-41.9	175	-173.7	65.5	-167	0	0	112.6	R728 L729 R730 K735 Q736 R804 L808	R728-E732 PolarHBondContact O-N 3.43Å; R728-E732 VanDerWaalsContact O-N 3.15Å; L729-E732 PolarHBondContact O-N 2.82Å; R730-E732 VanDerWaalsContact C-N 3.26Å; R730-E732 PolarHBondContact O-N 3.38Å; E732-K735 PolarHBondContact O-N 3.23Å; E732-Q736 WeakPolarHBondContact O-CG 3.48Å; E732-Q736 PolarHBondContact O-N 2.87Å; E732-Q736 PolarHBondContact OE1-NE2 3.38Å; E732-R804 IonicContact OE1-CZ 2.81Å; E732-R804 IonicContact OE1-NH1 2.6Å; E732-R804 PolarHBondContact OE1-NH1 3.15Å; E732-R804 IonicContact OE1-NH2 3.37Å; E732-R804 PolarHBondContact OE1-NH2 2.76Å; E732-L808 HydrophobicContact CB-CD1 4.42Å; E732-L808 HydrophobicContact CG-CD1 3.83Å; E732-L808 HydrophobicContact CG-CD2 4.33Å
733	Q	75.9	Confident	74.7	Confident	50 Å²	50	71.6 Å²	71.6	23%	0.234	37%	0.37	C	S	.	.	H	α-helix	trans	-63.2	-43.2	176.2	-171.1	-170.3	7.1	0	0	111.1	L729 R730 K735 Q736 A737 E809 M812	L729-Q733 VanDerWaalsContact O-CB 3.29Å; L729-Q733 WeakPolarHBondContact O-CB 3.31Å; L729-Q733 PolarHBondContact O-N 2.79Å; R730-Q733 PolarHBondContact O-N 2.92Å; Q733-K735 PolarHBondContact O-N 2.88Å; Q733-Q736 PolarHBondContact O-N 3.41Å; Q733-A737 WeakPolarHBondContact O-CB 3.45Å; Q733-A737 PolarHBondContact O-N 3.06Å; Q733-E809 PolarHBondContact NE2-OE1 2.89Å; Q733-M812 HydrophobicContact CB-CE 4.47Å
734	Q	75.6	Confident	74	Confident	146 Å²	146	70 Å²	70	68%	0.682	37%	0.372	S	S	*	.	H	α-helix	trans	-62.3	-41	177.1	-169.5	178.9	13.2	0	0	111.7	R730 A738	R730-Q734 WeakPolarHBondContact O-CB 3.28Å; R730-Q734 PolarHBondContact O-N 2.9Å; Q734-A738 VanDerWaalsContact O-CB 3.31Å; Q734-A738 WeakPolarHBondContact O-CB 3.22Å; Q734-A738 PolarHBondContact O-N 2.94Å
735	K	77.6	Confident	72.8	Confident	128 Å²	128	69.9 Å²	69.9	56%	0.557	38%	0.384	S	S	*	.	H	α-helix	trans	-62.1	-43.1	173.3	-74.9	167.7	-175.9	174	0	112.3	V731 E732 Q733 F739	V731-K735 HydrophobicContact CG1-CD 4.4Å; V731-K735 WeakPolarHBondContact O-CD 3.15Å; V731-K735 VanDerWaalsContact O-CG 3.23Å; V731-K735 WeakPolarHBondContact O-CG 2.96Å; V731-K735 PolarHBondContact O-N 3.31Å; E732-K735 PolarHBondContact O-N 3.23Å; Q733-K735 PolarHBondContact O-N 2.88Å; K735-F739 WeakPolarHBondContact O-CB 3.19Å; K735-F739 PolarHBondContact O-N 3.32Å
736	Q	74.9	Confident	71.7	Confident	8 Å²	8	74.1 Å²	74.1	4%	0.037	41%	0.408	C	S	.	.	H	α-helix	trans	-73.2	-38	-179.8	-69.6	-177.8	34.1	0	0	112.5	E732 Q733 F739 I740 L808	E732-Q736 WeakPolarHBondContact O-CG 3.48Å; E732-Q736 PolarHBondContact O-N 2.87Å; E732-Q736 PolarHBondContact OE1-NE2 3.38Å; Q733-Q736 PolarHBondContact O-N 3.41Å; Q736-F739 PolarHBondContact O-N 3.39Å; Q736-I740 WeakPolarHBondContact O-CB 3.37Å; Q736-I740 VanDerWaalsContact O-CG1 3.29Å; Q736-I740 WeakPolarHBondContact O-CG1 3.48Å; Q736-I740 PolarHBondContact O-N 2.9Å; Q736-L808 VanDerWaalsContact NE2-CD1 3.32Å
737	A	71.3	Confident	70.7	Confident	49 Å²	49	80.4 Å²	80.4	41%	0.405	44%	0.435	S	S	.	.	H	α-helix	trans	-61.3	-45.2	172.2	0	0	0	0	0	111.5	Q733 F739 I740 A741	Q733-A737 WeakPolarHBondContact O-CB 3.45Å; Q733-A737 PolarHBondContact O-N 3.06Å; A737-F739 VanDerWaalsContact C-N 3.34Å; A737-F739 PolarHBondContact O-N 3.36Å; A737-I740 PolarHBondContact O-N 2.91Å; A737-A741 WeakPolarHBondContact O-CB 3.35Å; A737-A741 PolarHBondContact O-N 3.43Å
738	A	73.8	Confident	68.9	Low	60 Å²	60	83 Å²	83	50%	0.496	45%	0.447	S	S	.	.	H	α-helix	trans	-61.4	-40.3	174.5	0	0	0	0	0	112.4	Q734 A741 A742	Q734-A738 VanDerWaalsContact O-CB 3.31Å; Q734-A738 WeakPolarHBondContact O-CB 3.22Å; Q734-A738 PolarHBondContact O-N 2.94Å; A738-A741 PolarHBondContact O-N 3.38Å; A738-A742 WeakPolarHBondContact O-CB 3.41Å; A738-A742 PolarHBondContact O-N 2.95Å
739	F	73.9	Confident	66.7	Low	124 Å²	124	81.5 Å²	81.5	54%	0.544	45%	0.452	S	S	.	.	H	α-helix	trans	-65.5	-43.5	175.8	-166.7	-79.5	0	0	0	112.2	K735 Q736 A737 A741 A742 A743 L801	K735-F739 WeakPolarHBondContact O-CB 3.19Å; K735-F739 PolarHBondContact O-N 3.32Å; Q736-F739 PolarHBondContact O-N 3.39Å; A737-F739 VanDerWaalsContact C-N 3.34Å; A737-F739 PolarHBondContact O-N 3.36Å; F739-A741 VanDerWaalsContact C-N 3.34Å; F739-A742 PolarHBondContact O-N 3Å; F739-A743 WeakPolarHBondContact O-CB 3.4Å; F739-A743 PolarHBondContact O-N 2.86Å; F739-L801 HydrophobicContact CD1-CD1 3.66Å; F739-L801 HydrophobicContact CD1-CD2 4.15Å; F739-L801 HydrophobicContact CE1-CD1 3.5Å; F739-L801 VanDerWaalsContact CE1-CD1 3.5Å; F739-L801 HydrophobicContact CE1-CD2 4.45Å
740	I	72.2	Confident	64.8	Low	31 Å²	31	86.7 Å²	86.7	16%	0.159	49%	0.49	C	S	.	.	H	α-helix	trans	-65.3	-37.8	176.9	-68.6	166.2	0	0	0	110.9	Q736 A737 G744 L801 K805	Q736-I740 WeakPolarHBondContact O-CB 3.37Å; Q736-I740 VanDerWaalsContact O-CG1 3.29Å; Q736-I740 WeakPolarHBondContact O-CG1 3.48Å; Q736-I740 PolarHBondContact O-N 2.9Å; A737-I740 PolarHBondContact O-N 2.91Å; I740-G744 PolarHBondContact O-N 2.99Å; I740-L801 HydrophobicContact CD1-CB 4.29Å; I740-L801 HydrophobicContact CG1-CB 4.1Å; I740-K805 HydrophobicContact CD1-CB 4.23Å; I740-K805 HydrophobicContact CD1-CD 4.21Å
741	A	72.3	Confident	62.9	Low	63 Å²	63	87.7 Å²	87.7	52%	0.521	51%	0.512	S	S	.	.	H	α-helix	trans	-64.6	-47.8	174.5	0	0	0	0	0	111.9	A737 A738 F739 A743 G744 S745	A737-A741 WeakPolarHBondContact O-CB 3.35Å; A737-A741 PolarHBondContact O-N 3.43Å; A738-A741 PolarHBondContact O-N 3.38Å; F739-A741 VanDerWaalsContact C-N 3.34Å; A741-A743 PolarHBondContact O-N 3.4Å; A741-G744 PolarHBondContact O-N 3.21Å; A741-G744 VanDerWaalsContact O-N 3.13Å; A741-S745 PolarHBondContact O-N 2.83Å
742	A	72.1	Confident	61	Low	60 Å²	60	93.2 Å²	93.2	50%	0.496	53%	0.533	S	S	.	.	H	α-helix	trans	-60.4	-43.5	176.5	0	0	0	0	0	112.3	A738 F739 G744 S745	A738-A742 WeakPolarHBondContact O-CB 3.41Å; A738-A742 PolarHBondContact O-N 2.95Å; F739-A742 PolarHBondContact O-N 3Å; A742-G744 VanDerWaalsContact C-N 3.3Å; A742-G744 PolarHBondContact O-N 2.83Å; A742-S745 PolarHBondContact O-N 3.45Å
743	A	66.6	Low	59	Low	31 Å²	31	97 Å²	97	26%	0.256	55%	0.554	S	S	.	*	H	α-helix	trans	-69.7	-24.8	176.1	0	0	0	0	0	113.3	F739 A741 L798	F739-A743 WeakPolarHBondContact O-CB 3.4Å; F739-A743 PolarHBondContact O-N 2.86Å; A741-A743 PolarHBondContact O-N 3.4Å; A743-L798 HydrophobicContact CB-CD2 3.85Å
744	G	57.9	Low	56.9	Low	44 Å²	44	103.8 Å²	103.8	45%	0.454	59%	0.586	S	S	.	*	H	α-helix	trans	-76.3	-34.9	172.6	0	0	0	0	0	113.5	I740 A741 A742 L746	I740-G744 PolarHBondContact O-N 2.99Å; A741-G744 PolarHBondContact O-N 3.21Å; A741-G744 VanDerWaalsContact O-N 3.13Å; A742-G744 VanDerWaalsContact C-N 3.3Å; A742-G744 PolarHBondContact O-N 2.83Å; G744-L746 VanDerWaalsContact C-N 3.28Å; G744-L746 PolarHBondContact O-N 3.27Å
745	S	55.5	Low	55	Low	98 Å²	98	103.1 Å²	103.1	69%	0.685	59%	0.587	S	S	*	*	H	α-helix	trans	-70.8	-19.8	-177.1	-157.8	0	0	0	0	114	A741 A742 K747	A741-S745 PolarHBondContact O-N 2.83Å; A742-S745 PolarHBondContact O-N 3.45Å; S745-K747 PolarHBondContact O-N 2.98Å; S745-K747 VanDerWaalsContact O-N 3.16Å
746	L	50.4	Low	52.9	Low	155 Å²	155	103.2 Å²	103.2	81%	0.812	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	17.9	177.8	-72.5	168.5	0	0	0	114.2	G744	G744-L746 VanDerWaalsContact C-N 3.28Å; G744-L746 PolarHBondContact O-N 3.27Å
747	K	50.4	Low	50.9	Low	139 Å²	139	108.1 Å²	108.1	60%	0.604	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.1	4.2	177.8	-85	-163.4	165.1	-164.3	0	114.8	S745 E790	S745-K747 PolarHBondContact O-N 2.98Å; S745-K747 VanDerWaalsContact O-N 3.16Å; K747-E790 IonicContact NZ-OE1 3.14Å; K747-E790 PolarHBondContact NZ-OE1 3.04Å
748	H	39.7	Very low	49.1	Very low	151 Å²	151	112.8 Å²	112.8	70%	0.699	65%	0.65	S	S	*	*	S	Bend	trans	-136.4	166.7	170.9	-112.9	-101	0	0	0	110.5
749	D	35.2	Very low	47.2	Very low	145 Å²	145	119 Å²	119	78%	0.775	67%	0.669	S	S	*	*			trans	64.2	68.7	167.2	-47.2	-21.5	0	0	0	115.4
750	S	34.4	Very low	45.2	Very low	121 Å²	121	116.1 Å²	116.1	85%	0.846	68%	0.675	S	S	*	*			trans	-105.4	50.1	167.5	-62.5	0	0	0	0	112.4
751	S	36.1	Very low	43.4	Very low	119 Å²	119	120 Å²	120	83%	0.832	71%	0.711	S	S	*	*	S	Bend	trans	-177.4	73.2	160.4	-80.6	0	0	0	0	112.1
752	E	38.8	Very low	41.5	Very low	181 Å²	181	120.4 Å²	120.4	85%	0.846	72%	0.722	S	S	*	*			trans	-147.8	164.4	152.6	-117.7	177.4	172.5	0	0	110.7
753	L	34.8	Very low	39.5	Very low	134 Å²	134	124.1 Å²	124.1	70%	0.702	74%	0.739	S	S	*	*			trans	-47.7	140.8	-161.6	-70.5	65	0	0	0	113.9	D755	L753-D755 HydrophobicContact CB-CB 4.49Å; L753-D755 HydrophobicContact CD2-CB 4.36Å
754	Q	31.7	Very low	38	Very low	193 Å²	193	131.2 Å²	131.2	90%	0.902	77%	0.771	S	S	*	*			cis	61.3	31.5	21.2	-157.2	60.2	69.4	0	0	115.1
755	D	34.9	Very low	36.8	Very low	132 Å²	132	133.1 Å²	133.1	71%	0.706	78%	0.778	S	S	*	*			trans	-152.9	169	155.1	-148	-18.3	0	0	0	110.9	L753	L753-D755 HydrophobicContact CB-CB 4.49Å; L753-D755 HydrophobicContact CD2-CB 4.36Å
756	V	34.8	Very low	35.6	Very low	129 Å²	129	134.9 Å²	134.9	78%	0.782	79%	0.787	S	S	*	*			trans	63.9	77.8	-180	-163.6	0	0	0	0	114.9
757	C	31.2	Very low	34.9	Very low	112 Å²	112	131.9 Å²	131.9	76%	0.757	78%	0.775	S	S	*	*			trans	-81.5	176.9	144.8	-67.1	0	0	0	0	110.7
758	D	33.8	Very low	34.3	Very low	147 Å²	147	131.2 Å²	131.2	79%	0.786	78%	0.778	S	S	*	*			trans	67.8	94.9	166.9	-54.3	-20.1	0	0	0	118.3
759	E	35.6	Very low	34.1	Very low	189 Å²	189	131.2 Å²	131.2	88%	0.883	78%	0.782	S	S	*	*				176.9	148.1	108.6	-97.1	-67.7	96	0	0	113.5
760	G	31.2	Very low	34.1	Very low	65 Å²	65	133.3 Å²	133.3	67%	0.67	78%	0.784	S	S	*	*			trans	55	75.5	160.2	0	0	0	0	0	119
761	A	34.1	Very low	34.2	Very low	111 Å²	111	134.8 Å²	134.8	92%	0.917	78%	0.778	S	S	*	*				65.6	107.8	76.3	0	0	0	0	0	116.2
762	G	32.1	Very low	34.1	Very low	73 Å²	73	139.8 Å²	139.8	75%	0.753	78%	0.78	S	S	*	*			trans	-161.2	22.4	-177.5	0	0	0	0	0	117.4
763	T	30.7	Very low	34	Very low	138 Å²	138	138.5 Å²	138.5	85%	0.847	78%	0.779	S	S	*	*			trans	34.1	102.3	165.1	51.3	0	0	0	0	121.1
764	L	35.7	Very low	33.9	Very low	180 Å²	180	140.2 Å²	140.2	94%	0.942	78%	0.78	S	S	*	*			trans	-143.2	79.6	134.8	-100.1	-176	0	0	0	112.2
765	S	31.2	Very low	34	Very low	84 Å²	84	136.1 Å²	136.1	59%	0.587	77%	0.773	S	S	*	*			trans	30.9	98.8	162.6	-150.9	0	0	0	0	120.3	T767	S765-T767 VanDerWaalsContact C-N 3.25Å; S765-T767 PolarHBondContact O-N 3.45Å; S765-T767 PolarHBondContact OG-OG1 3.17Å
766	P	30.8	Very low	33.9	Very low	135 Å²	135	136.5 Å²	136.5	88%	0.877	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	62.2	172.9	34.7	-36.5	0	0	0	113
767	T	36.7	Very low	33.8	Very low	92 Å²	92	138.1 Å²	138.1	56%	0.564	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	-34.3	-176.2	-44.9	0	0	0	0	113.6	S765 L769	S765-T767 VanDerWaalsContact C-N 3.25Å; S765-T767 PolarHBondContact O-N 3.45Å; S765-T767 PolarHBondContact OG-OG1 3.17Å; T767-L769 PolarHBondContact O-N 2.93Å
768	N	37.7	Very low	34	Very low	125 Å²	125	141 Å²	141	67%	0.668	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-79.8	-17.6	-170.6	-66.4	-38	0	0	0	114.7	K770 Q771	N768-K770 VanDerWaalsContact C-N 3.31Å; N768-K770 PolarHBondContact O-N 3.07Å; N768-Q771 PolarHBondContact O-N 3.06Å
769	L	34	Very low	33.9	Very low	150 Å²	150	142.6 Å²	142.6	79%	0.785	79%	0.794	S	S	*	*	G	3₁₀ helix	trans	-72	-21.9	-174.8	-138.3	76.7	0	0	0	113.9	T767	T767-L769 PolarHBondContact O-N 2.93Å
770	K	36.1	Very low	34	Very low	189 Å²	189	137.8 Å²	137.8	82%	0.822	79%	0.787	S	S	*	*	G	3₁₀ helix	trans	-85.4	-3.3	177.5	-76.1	-173.6	175.4	179.1	0	114.2	N768	N768-K770 VanDerWaalsContact C-N 3.31Å; N768-K770 PolarHBondContact O-N 3.07Å
771	Q	37.1	Very low	34.1	Very low	153 Å²	153	141 Å²	141	72%	0.715	80%	0.798	S	S	*	*	S	Bend	trans	-95.2	-16.9	-174.3	-151.4	166.8	13.2	0	0	114	N768	N768-Q771 PolarHBondContact O-N 3.06Å
772	Y	34	Very low	34	Very low	224 Å²	224	138.9 Å²	138.9	88%	0.878	79%	0.788	S	S	*	*	S	Bend	trans	-94.6	-1.4	175	-96.4	-95	0	0	0	114.6
773	L	35.6	Very low	34.2	Very low	154 Å²	154	142.6 Å²	142.6	81%	0.806	80%	0.796	S	S	*	*	S	Bend	trans	-104.4	24.3	179.4	-78.6	163.9	0	0	0	113.3
774	K	32.3	Very low	34.2	Very low	169 Å²	169	139.1 Å²	139.1	74%	0.735	79%	0.787	S	S	*	*			trans	-121.7	96.4	171.5	-85.8	-164.7	168	-168.7	0	111.4
775	S	35	Very low	34	Very low	108 Å²	108	138.4 Å²	138.4	76%	0.755	78%	0.784	S	S	*	*			trans	-161.7	69.4	167.3	-75.5	0	0	0	0	107.9	N777	S775-N777 PolarHBondContact O-N 3.2Å
776	D	32	Very low	33.9	Very low	140 Å²	140	139.8 Å²	139.8	75%	0.749	79%	0.794	S	S	*	*			trans	-62.9	118.7	-178.5	-56.3	-84.2	0	0	0	111.4
777	N	32.9	Very low	33.9	Very low	162 Å²	162	139 Å²	139	87%	0.866	79%	0.786	S	S	*	*			trans	-172.8	153.6	150	-102.1	-48	0	0	0	110.8	S775	S775-N777 PolarHBondContact O-N 3.2Å
778	L	34.5	Very low	33.6	Very low	173 Å²	173	142.3 Å²	142.3	91%	0.906	80%	0.801	S	S	*	*			trans	77.6	56.2	-177.2	-55.7	172.9	0	0	0	116.8
779	L	33	Very low	33.5	Very low	181 Å²	181	140.8 Å²	140.8	95%	0.948	81%	0.806	S	S	*	*			trans	-86.7	105.8	146.3	-80.2	168.4	0	0	0	109.5
780	A	37	Very low	34.4	Very low	88 Å²	88	139.7 Å²	139.7	73%	0.727	80%	0.796	S	S	*	*			trans	-175.9	127.5	154.6	0	0	0	0	0	110.9
781	S	33.9	Very low	35.2	Very low	131 Å²	131	135.3 Å²	135.3	92%	0.916	78%	0.782	S	S	*	*			trans	54.5	132.4	167.1	-57.6	0	0	0	0	118.3
782	G	32.6	Very low	36.7	Very low	68 Å²	68	132.9 Å²	132.9	70%	0.701	78%	0.779	S	S	*	*			cis	138.8	138.3	1.6	0	0	0	0	0	110.9
783	V	35.9	Very low	38.3	Very low	151 Å²	151	130.7 Å²	130.7	92%	0.915	77%	0.769	S	S	*	*			trans	65.7	97.3	172.9	-168.2	0	0	0	0	116.5
784	G	30.3	Very low	39.5	Very low	65 Å²	65	128.4 Å²	128.4	67%	0.67	76%	0.758	S	S	*	*				92.3	138.9	117.1	0	0	0	0	0	120.4
785	N	31.6	Very low	41.4	Very low	165 Å²	165	122.4 Å²	122.4	88%	0.882	74%	0.735	S	S	*	*			trans	71	97.3	151.2	-60.5	-5.3	0	0	0	120.4
786	S	29.2	Very low	43.3	Very low	112 Å²	112	119.6 Å²	119.6	78%	0.783	72%	0.718	S	S	*	*				85.3	145.3	120.5	-147.7	0	0	0	0	120.7
787	V	30.3	Very low	45.1	Very low	118 Å²	118	116.6 Å²	116.6	72%	0.715	70%	0.702	S	S	*	*			trans	64.1	123.3	166.8	-155.1	0	0	0	0	118.5	A789	V787-A789 PolarHBondContact O-N 3.37Å
788	N	30.6	Very low	46.9	Very low	163 Å²	163	110.9 Å²	110.9	87%	0.872	67%	0.671	S	S	*	*			trans	4	104.7	155.3	-52	-16.6	0	0	0	118.2
789	A	35.8	Very low	49	Very low	93 Å²	93	108 Å²	108	77%	0.769	65%	0.653	S	S	*	*			trans	-140	129.1	154.3	0	0	0	0	0	109.4	V787 N791	V787-A789 PolarHBondContact O-N 3.37Å; A789-N791 PolarHBondContact O-N 2.96Å
790	E	52.6	Low	51.1	Low	126 Å²	126	102 Å²	102	59%	0.589	63%	0.629	S	S	*	*			trans	-66.1	123.6	171.3	-65.5	-163.2	100.7	0	0	109.1	K747 P792 V795	K747-E790 IonicContact NZ-OE1 3.14Å; K747-E790 PolarHBondContact NZ-OE1 3.04Å; E790-P792 WeakPolarHBondContact O-CD 3.39Å; E790-V795 HydrophobicContact CB-CG2 3.94Å
791	N	53.2	Low	52.8	Low	98 Å²	98	99.4 Å²	99.4	52%	0.524	60%	0.603	S	S	.	*			trans	-62.8	108.8	-177	-171.5	-22.9	0	0	0	109.6	A789 R793 L794 V795	A789-N791 PolarHBondContact O-N 2.96Å; N791-R793 PolarHBondContact O-N 3.06Å; N791-R793 VanDerWaalsContact O-N 3.09Å; N791-L794 HydrophobicContact CB-CD1 4.23Å; N791-L794 HydrophobicContact CB-CG 4.41Å; N791-L794 PolarHBondContact O-N 2.99Å; N791-V795 PolarHBondContact O-N 3.47Å
792	P	68.9	Low	54.8	Low	101 Å²	101	100.5 Å²	100.5	66%	0.656	59%	0.587	S	S	*	*	H	α-helix	trans	-67.5	-23.7	-160.5	25.2	-34.7	0	0	0	112.7	E790 V795 A796	E790-P792 WeakPolarHBondContact O-CD 3.39Å; P792-V795 PolarHBondContact O-N 3.44Å; P792-A796 WeakPolarHBondContact O-CB 3.37Å; P792-A796 PolarHBondContact O-N 3.15Å
793	R	66.4	Low	57	Low	179 Å²	179	103.8 Å²	103.8	68%	0.675	58%	0.584	S	S	*	*	H	α-helix	trans	-65.3	-45.7	173.7	-169.7	174.3	-179.1	175.6	1.1	111.7	N791 V795 A796 D797	N791-R793 PolarHBondContact O-N 3.06Å; N791-R793 VanDerWaalsContact O-N 3.09Å; R793-V795 VanDerWaalsContact C-N 3.29Å; R793-V795 PolarHBondContact O-N 3.23Å; R793-A796 PolarHBondContact O-N 3.46Å; R793-D797 PolarHBondContact O-N 3.44Å
794	L	61.5	Low	58.9	Low	106 Å²	106	102.4 Å²	102.4	56%	0.555	56%	0.563	S	S	*	*	H	α-helix	trans	-66.4	-32.3	176.5	-64	179.1	0	0	0	112.2	N791 L798	N791-L794 HydrophobicContact CB-CD1 4.23Å; N791-L794 HydrophobicContact CB-CG 4.41Å; N791-L794 PolarHBondContact O-N 2.99Å; L794-L798 VanDerWaalsContact O-CB 3.3Å; L794-L798 WeakPolarHBondContact O-CB 3.27Å; L794-L798 WeakPolarHBondContact O-CG 3.44Å; L794-L798 PolarHBondContact O-N 3.5Å
795	V	71.7	Confident	61	Low	42 Å²	42	102 Å²	102	26%	0.255	54%	0.543	S	S	.	.	H	α-helix	trans	-66.9	-43.7	172.8	-179.8	0	0	0	0	110.8	E790 N791 P792 R793 L798 Q799	E790-V795 HydrophobicContact CB-CG2 3.94Å; N791-V795 PolarHBondContact O-N 3.47Å; P792-V795 PolarHBondContact O-N 3.44Å; R793-V795 VanDerWaalsContact C-N 3.29Å; R793-V795 PolarHBondContact O-N 3.23Å; V795-L798 PolarHBondContact O-N 2.68Å; V795-Q799 WeakPolarHBondContact O-CB 3.44Å; V795-Q799 VanDerWaalsContact O-CG 3.27Å; V795-Q799 WeakPolarHBondContact O-CG 3.31Å; V795-Q799 PolarHBondContact O-N 3.37Å
796	A	75.1	Confident	63	Low	49 Å²	49	98.3 Å²	98.3	41%	0.405	52%	0.523	S	S	.	.	H	α-helix	trans	-64.1	-43.2	175.3	0	0	0	0	0	112.4	P792 R793 Q799 A800	P792-A796 WeakPolarHBondContact O-CB 3.37Å; P792-A796 PolarHBondContact O-N 3.15Å; R793-A796 PolarHBondContact O-N 3.46Å; A796-Q799 PolarHBondContact O-N 2.81Å; A796-A800 WeakPolarHBondContact O-CB 2.99Å; A796-A800 PolarHBondContact O-N 2.89Å
797	D	70.6	Confident	65.3	Low	78 Å²	78	97.7 Å²	97.7	42%	0.417	51%	0.508	S	S	.	.	H	α-helix	trans	-63.2	-43.3	176.9	-66.2	-32.5	0	0	0	111.1	R793 Q799 A800 L801	R793-D797 PolarHBondContact O-N 3.44Å; D797-Q799 PolarHBondContact O-N 3.12Å; D797-A800 PolarHBondContact O-N 3.37Å; D797-L801 WeakPolarHBondContact O-CB 3.3Å; D797-L801 WeakPolarHBondContact O-CD1 3.45Å; D797-L801 VanDerWaalsContact O-CG 3.28Å; D797-L801 WeakPolarHBondContact O-CG 3.45Å; D797-L801 PolarHBondContact O-N 2.84Å
798	L	70.6	Confident	67.2	Low	42 Å²	42	92.9 Å²	92.9	22%	0.22	48%	0.478	C	S	.	.	H	α-helix	trans	-64	-35.8	173.1	-81.9	169.1	0	0	0	113.1	A743 L794 V795 R802	A743-L798 HydrophobicContact CB-CD2 3.85Å; L794-L798 VanDerWaalsContact O-CB 3.3Å; L794-L798 WeakPolarHBondContact O-CB 3.27Å; L794-L798 WeakPolarHBondContact O-CG 3.44Å; L794-L798 PolarHBondContact O-N 3.5Å; V795-L798 PolarHBondContact O-N 2.68Å; L798-R802 VanDerWaalsContact O-CG 3.31Å; L798-R802 WeakPolarHBondContact O-CG 3.41Å; L798-R802 PolarHBondContact O-N 3.34Å
799	Q	77.1	Confident	69.1	Low	112 Å²	112	87.9 Å²	87.9	52%	0.523	45%	0.449	S	S	.	.	H	α-helix	trans	-68	-43.2	174.3	-76.2	173.9	1.9	0	0	111.5	V795 A796 D797 L801 R802 Q803	V795-Q799 WeakPolarHBondContact O-CB 3.44Å; V795-Q799 VanDerWaalsContact O-CG 3.27Å; V795-Q799 WeakPolarHBondContact O-CG 3.31Å; V795-Q799 PolarHBondContact O-N 3.37Å; A796-Q799 PolarHBondContact O-N 2.81Å; D797-Q799 PolarHBondContact O-N 3.12Å; Q799-L801 VanDerWaalsContact C-N 3.34Å; Q799-L801 PolarHBondContact O-N 2.82Å; Q799-R802 PolarHBondContact O-N 3.33Å; Q799-Q803 WeakPolarHBondContact O-CG 3.46Å; Q799-Q803 PolarHBondContact O-N 2.99Å
800	A	78.4	Confident	71	Confident	54 Å²	54	86.5 Å²	86.5	45%	0.446	43%	0.434	S	S	.	.	H	α-helix	trans	-63	-39.4	175.7	0	0	0	0	0	112.1	A796 D797 Q803 R804	A796-A800 WeakPolarHBondContact O-CB 2.99Å; A796-A800 PolarHBondContact O-N 2.89Å; D797-A800 PolarHBondContact O-N 3.37Å; A800-Q803 PolarHBondContact O-N 3.38Å; A800-R804 WeakPolarHBondContact O-CB 3.36Å; A800-R804 PolarHBondContact O-N 3.29Å
801	L	72.6	Confident	72.1	Confident	34 Å²	34	86.4 Å²	86.4	18%	0.178	43%	0.428	C	S	.	.	H	α-helix	trans	-64.9	-39.9	174.7	-74.4	161.4	0	0	0	112.4	F739 I740 D797 Q799 R804 K805	F739-L801 HydrophobicContact CD1-CD1 3.66Å; F739-L801 HydrophobicContact CD1-CD2 4.15Å; F739-L801 HydrophobicContact CE1-CD1 3.5Å; F739-L801 VanDerWaalsContact CE1-CD1 3.5Å; F739-L801 HydrophobicContact CE1-CD2 4.45Å; I740-L801 HydrophobicContact CD1-CB 4.29Å; I740-L801 HydrophobicContact CG1-CB 4.1Å; D797-L801 WeakPolarHBondContact O-CB 3.3Å; D797-L801 WeakPolarHBondContact O-CD1 3.45Å; D797-L801 VanDerWaalsContact O-CG 3.28Å; D797-L801 WeakPolarHBondContact O-CG 3.45Å; D797-L801 PolarHBondContact O-N 2.84Å; Q799-L801 VanDerWaalsContact C-N 3.34Å; Q799-L801 PolarHBondContact O-N 2.82Å; L801-R804 PolarHBondContact O-N 3.47Å; L801-K805 PolarHBondContact O-N 3.16Å
802	R	74.9	Confident	72.9	Confident	154 Å²	154	82.2 Å²	82.2	58%	0.581	41%	0.406	S	S	*	.	H	α-helix	trans	-63.8	-49.2	173.3	-72.9	172.3	-177.1	-147.9	-0.5	111.4	L798 Q799 R804 K805 D806	L798-R802 VanDerWaalsContact O-CG 3.31Å; L798-R802 WeakPolarHBondContact O-CG 3.41Å; L798-R802 PolarHBondContact O-N 3.34Å; Q799-R802 PolarHBondContact O-N 3.33Å; R802-R804 PolarHBondContact O-N 3.12Å; R802-K805 WeakPolarHBondContact O-CB 3.38Å; R802-K805 PolarHBondContact O-N 3.48Å; R802-K805 VanDerWaalsContact O-N 3.09Å; R802-D806 PolarHBondContact O-N 3.15Å
803	Q	79.4	Confident	73	Confident	137 Å²	137	79.6 Å²	79.6	64%	0.64	39%	0.389	S	S	*	.	H	α-helix	trans	-56.1	-37.1	175.2	-71.7	174.6	-0.1	0	0	112.6	Q799 A800 D806 E807	Q799-Q803 WeakPolarHBondContact O-CG 3.46Å; Q799-Q803 PolarHBondContact O-N 2.99Å; A800-Q803 PolarHBondContact O-N 3.38Å; Q803-D806 PolarHBondContact O-N 2.77Å; Q803-E807 PolarHBondContact O-N 2.93Å
804	R	75.7	Confident	73.4	Confident	123 Å²	123	74.7 Å²	74.7	46%	0.464	38%	0.376	S	S	.	.	H	α-helix	trans	-71.2	-37.4	177.6	-162.7	178.3	178.5	-128.4	-17.5	112.8	E732 A800 L801 R802 E807 L808	E732-R804 IonicContact OE1-CZ 2.81Å; E732-R804 IonicContact OE1-NH1 2.6Å; E732-R804 PolarHBondContact OE1-NH1 3.15Å; E732-R804 IonicContact OE1-NH2 3.37Å; E732-R804 PolarHBondContact OE1-NH2 2.76Å; A800-R804 WeakPolarHBondContact O-CB 3.36Å; A800-R804 PolarHBondContact O-N 3.29Å; L801-R804 PolarHBondContact O-N 3.47Å; R802-R804 PolarHBondContact O-N 3.12Å; R804-E807 PolarHBondContact O-N 2.96Å; R804-L808 WeakPolarHBondContact O-CG 3.26Å; R804-L808 PolarHBondContact O-N 3.32Å; R804-L808 VanDerWaalsContact O-N 3.14Å
805	K	75.5	Confident	73.9	Confident	57 Å²	57	71.4 Å²	71.4	25%	0.248	36%	0.359	C	S	.	.	H	α-helix	trans	-59.2	-48.2	168.5	171.9	-171.5	173.2	-63	0	110.6	I740 L801 R802 E807 L808 E809	I740-K805 HydrophobicContact CD1-CB 4.23Å; I740-K805 HydrophobicContact CD1-CD 4.21Å; L801-K805 PolarHBondContact O-N 3.16Å; R802-K805 WeakPolarHBondContact O-CB 3.38Å; R802-K805 PolarHBondContact O-N 3.48Å; R802-K805 VanDerWaalsContact O-N 3.09Å; K805-E807 VanDerWaalsContact C-N 3.33Å; K805-E807 PolarHBondContact O-N 3.14Å; K805-L808 WeakPolarHBondContact O-CB 3.33Å; K805-L808 PolarHBondContact O-N 2.95Å; K805-L808 VanDerWaalsContact O-N 3.12Å; K805-E809 WeakPolarHBondContact CE-OE1 3.45Å; K805-E809 WeakPolarHBondContact CG-OE1 3.29Å; K805-E809 IonicContact NZ-OE1 2.68Å; K805-E809 PolarHBondContact NZ-OE1 2.79Å; K805-E809 IonicContact NZ-OE2 3.35Å; K805-E809 PolarHBondContact NZ-OE2 3.15Å; K805-E809 PolarHBondContact O-N 3.24Å
806	D	73.6	Confident	73.9	Confident	87 Å²	87	71.3 Å²	71.3	47%	0.465	36%	0.356	S	S	.	.	H	α-helix	trans	-64.2	-36.3	-178.3	-54.6	-25	0	0	0	111.7	R802 Q803 S810	R802-D806 PolarHBondContact O-N 3.15Å; Q803-D806 PolarHBondContact O-N 2.77Å; D806-S810 WeakPolarHBondContact O-CB 3.19Å; D806-S810 PolarHBondContact O-N 2.93Å
807	E	76.3	Confident	73.6	Confident	99 Å²	99	72.8 Å²	72.8	46%	0.463	35%	0.351	S	S	.	.	H	α-helix	trans	-64	-43.2	171.9	-162.4	-157.8	149.1	0	0	111.9	Q803 R804 K805 S810 R811	Q803-E807 PolarHBondContact O-N 2.93Å; R804-E807 PolarHBondContact O-N 2.96Å; K805-E807 VanDerWaalsContact C-N 3.33Å; K805-E807 PolarHBondContact O-N 3.14Å; E807-S810 PolarHBondContact O-N 3.32Å; E807-R811 WeakPolarHBondContact O-CG 3.42Å; E807-R811 PolarHBondContact O-N 3.1Å; E807-R811 IonicContact OE1-CZ 3.19Å; E807-R811 VanDerWaalsContact OE1-CZ 3.24Å; E807-R811 IonicContact OE1-NE 3.01Å; E807-R811 PolarHBondContact OE1-NE 3.21Å; E807-R811 IonicContact OE1-NH2 2.72Å; E807-R811 PolarHBondContact OE1-NH2 2.99Å
808	L	71	Confident	73.6	Confident	16 Å²	16	71 Å²	71	8%	0.084	35%	0.345	C	S	.	.	H	α-helix	trans	-64.9	-41	178.3	-72.5	176.1	0	0	0	112.4	L729 E732 Q736 R804 K805 R811 M812	L729-L808 HydrophobicContact CD2-CD2 3.54Å; E732-L808 HydrophobicContact CB-CD1 4.42Å; E732-L808 HydrophobicContact CG-CD1 3.83Å; E732-L808 HydrophobicContact CG-CD2 4.33Å; Q736-L808 VanDerWaalsContact NE2-CD1 3.32Å; R804-L808 WeakPolarHBondContact O-CG 3.26Å; R804-L808 PolarHBondContact O-N 3.32Å; R804-L808 VanDerWaalsContact O-N 3.14Å; K805-L808 WeakPolarHBondContact O-CB 3.33Å; K805-L808 PolarHBondContact O-N 2.95Å; K805-L808 VanDerWaalsContact O-N 3.12Å; L808-R811 PolarHBondContact O-N 2.87Å; L808-M812 WeakPolarHBondContact O-CB 3.5Å; L808-M812 PolarHBondContact O-N 3.09Å
809	E	71.1	Confident	73.7	Confident	59 Å²	59	73.3 Å²	73.3	28%	0.276	35%	0.351	S	S	.	.	H	α-helix	trans	-67.3	-40.7	177.9	-78.9	161.9	-165.3	0	0	111.4	Q733 K805 M812 S813	Q733-E809 PolarHBondContact NE2-OE1 2.89Å; K805-E809 WeakPolarHBondContact CE-OE1 3.45Å; K805-E809 WeakPolarHBondContact CG-OE1 3.29Å; K805-E809 IonicContact NZ-OE1 2.68Å; K805-E809 PolarHBondContact NZ-OE1 2.79Å; K805-E809 IonicContact NZ-OE2 3.35Å; K805-E809 PolarHBondContact NZ-OE2 3.15Å; K805-E809 PolarHBondContact O-N 3.24Å; E809-M812 PolarHBondContact O-N 2.83Å; E809-S813 VanDerWaalsContact O-CB 3.3Å; E809-S813 WeakPolarHBondContact O-CB 3.3Å; E809-S813 PolarHBondContact O-N 2.7Å
810	S	75.2	Confident	73.5	Confident	64 Å²	64	72 Å²	72	45%	0.448	35%	0.35	S	S	.	.	H	α-helix	trans	-57.8	-48.9	169.3	-177	0	0	0	0	111.8	D806 E807 M812 S813 N814	D806-S810 WeakPolarHBondContact O-CB 3.19Å; D806-S810 PolarHBondContact O-N 2.93Å; E807-S810 PolarHBondContact O-N 3.32Å; S810-M812 PolarHBondContact O-N 3.22Å; S810-S813 PolarHBondContact O-N 2.85Å; S810-N814 WeakPolarHBondContact O-CB 3.5Å; S810-N814 PolarHBondContact O-N 3.42Å; S810-N814 PolarHBondContact O-ND2 2.85Å
811	R	74.9	Confident	73.2	Confident	124 Å²	124	72.5 Å²	72.5	47%	0.468	35%	0.345	S	S	.	.	H	α-helix	trans	-60	-45.5	175.9	-76.9	-176.7	-176.8	-138.5	4.2	112.6	L729 E807 L808 N814 L815	L729-R811 HydrophobicContact CD1-CB 4.28Å; E807-R811 WeakPolarHBondContact O-CG 3.42Å; E807-R811 PolarHBondContact O-N 3.1Å; E807-R811 IonicContact OE1-CZ 3.19Å; E807-R811 VanDerWaalsContact OE1-CZ 3.24Å; E807-R811 IonicContact OE1-NE 3.01Å; E807-R811 PolarHBondContact OE1-NE 3.21Å; E807-R811 IonicContact OE1-NH2 2.72Å; E807-R811 PolarHBondContact OE1-NH2 2.99Å; L808-R811 PolarHBondContact O-N 2.87Å; R811-N814 PolarHBondContact O-N 3.21Å; R811-L815 PolarHBondContact O-N 3.31Å
812	M	69.7	Low	73.2	Confident	10 Å²	10	70.9 Å²	70.9	5%	0.049	34%	0.337	C	S	.	.	H	α-helix	trans	-66	-44	-178.7	-164.1	-176.8	-60.6	0	0	111.1	L729 R730 Q733 L808 E809 S810 N814 L815 Q816	L729-M812 HydrophobicContact CB-CE 4.07Å; R730-M812 HydrophobicContact CB-CE 4.29Å; R730-M812 HydrophobicContact CG-CE 3.63Å; R730-M812 HydrophobicContact CG-SD 4.04Å; Q733-M812 HydrophobicContact CB-CE 4.47Å; L808-M812 WeakPolarHBondContact O-CB 3.5Å; L808-M812 PolarHBondContact O-N 3.09Å; E809-M812 PolarHBondContact O-N 2.83Å; S810-M812 PolarHBondContact O-N 3.22Å; M812-N814 VanDerWaalsContact C-N 3.31Å; M812-N814 PolarHBondContact O-N 2.89Å; M812-L815 PolarHBondContact O-N 3.07Å; M812-Q816 HydrophobicContact CG-CG 4.47Å; M812-Q816 WeakPolarHBondContact O-CB 3.4Å; M812-Q816 VanDerWaalsContact O-CG 3.28Å; M812-Q816 WeakPolarHBondContact O-CG 3.38Å; M812-Q816 PolarHBondContact O-N 3.34Å
813	S	70.8	Confident	72.8	Confident	45 Å²	45	66.8 Å²	66.8	32%	0.315	33%	0.325	S	S	.	.	H	α-helix	trans	-61.1	-38.5	174.4	-174.3	0	0	0	0	112.1	E809 S810 R817	E809-S813 VanDerWaalsContact O-CB 3.3Å; E809-S813 WeakPolarHBondContact O-CB 3.3Å; E809-S813 PolarHBondContact O-N 2.7Å; S810-S813 PolarHBondContact O-N 2.85Å; S813-R817 VanDerWaalsContact O-CG 3.31Å; S813-R817 WeakPolarHBondContact O-CG 3.29Å; S813-R817 PolarHBondContact O-N 3.32Å; S813-R817 VanDerWaalsContact O-N 3.12Å; S813-R817 PolarHBondContact O-NE 3.07Å; S813-R817 VanDerWaalsContact O-NE 3.09Å; S813-R817 PolarHBondContact OG-NE 3.37Å; S813-R817 PolarHBondContact OG-NH2 3.07Å
814	N	75.2	Confident	72.4	Confident	76 Å²	76	65.2 Å²	65.2	41%	0.406	32%	0.321	S	S	.	.	H	α-helix	trans	-64.6	-42.9	174.1	-70	-34.6	0	0	0	112.2	S810 R811 M812 R817 S818	S810-N814 WeakPolarHBondContact O-CB 3.5Å; S810-N814 PolarHBondContact O-N 3.42Å; S810-N814 PolarHBondContact O-ND2 2.85Å; R811-N814 PolarHBondContact O-N 3.21Å; M812-N814 VanDerWaalsContact C-N 3.31Å; M812-N814 PolarHBondContact O-N 2.89Å; N814-R817 PolarHBondContact O-N 2.78Å; N814-R817 PolarHBondContact OD1-NH1 3.17Å; N814-R817 PolarHBondContact OD1-NH2 3.19Å; N814-R817 VanDerWaalsContact OD1-NH2 3.07Å; N814-S818 PolarHBondContact O-N 2.76Å
815	L	73.1	Confident	72.1	Confident	37 Å²	37	61.7 Å²	61.7	19%	0.194	31%	0.31	C	S	.	.	H	α-helix	trans	-69.4	-39.5	178.3	-78.2	161.4	0	0	0	112.9	I722 E725 I726 L729 R811 M812 R817 S818 R819	I722-L815 HydrophobicContact CG1-CD2 4.46Å; I722-L815 HydrophobicContact CG2-CB 4.46Å; I722-L815 HydrophobicContact CG2-CD2 4.23Å; E725-L815 HydrophobicContact CB-CD1 4.37Å; E725-L815 HydrophobicContact CG-CD1 3.71Å; I726-L815 HydrophobicContact CD1-CB 4.29Å; I726-L815 HydrophobicContact CG1-CB 3.86Å; L729-L815 HydrophobicContact CD1-CD1 3.26Å; R811-L815 PolarHBondContact O-N 3.31Å; M812-L815 PolarHBondContact O-N 3.07Å; L815-R817 VanDerWaalsContact C-N 3.34Å; L815-R817 PolarHBondContact O-N 2.78Å; L815-S818 PolarHBondContact O-N 2.93Å; L815-R819 PolarHBondContact O-N 2.75Å
816	Q	70.9	Confident	71.7	Confident	41 Å²	41	60 Å²	60	19%	0.192	30%	0.303	C	S	.	.	H	α-helix	trans	-61.9	-42.3	174.3	-71.5	171.8	9.9	0	0	111.5	I726 M812 R819 T820	I726-Q816 HydrophobicContact CD1-CG 4.2Å; M812-Q816 HydrophobicContact CG-CG 4.47Å; M812-Q816 WeakPolarHBondContact O-CB 3.4Å; M812-Q816 VanDerWaalsContact O-CG 3.28Å; M812-Q816 WeakPolarHBondContact O-CG 3.38Å; M812-Q816 PolarHBondContact O-N 3.34Å; Q816-R819 WeakPolarHBondContact O-CB 3.44Å; Q816-R819 PolarHBondContact O-N 3.22Å; Q816-T820 PolarHBondContact O-N 3.48Å; Q816-T820 PolarHBondContact O-OG1 2.98Å
817	R	70.1	Confident	71.3	Confident	80 Å²	80	59.4 Å²	59.4	30%	0.302	30%	0.297	S	S	.	.	H	α-helix	trans	-58.9	-46.9	172	-75.7	176.9	-106.9	142.3	-1.3	111.9	S813 N814 L815 R819 T820 D821	S813-R817 VanDerWaalsContact O-CG 3.31Å; S813-R817 WeakPolarHBondContact O-CG 3.29Å; S813-R817 PolarHBondContact O-N 3.32Å; S813-R817 VanDerWaalsContact O-N 3.12Å; S813-R817 PolarHBondContact O-NE 3.07Å; S813-R817 VanDerWaalsContact O-NE 3.09Å; S813-R817 PolarHBondContact OG-NE 3.37Å; S813-R817 PolarHBondContact OG-NH2 3.07Å; N814-R817 PolarHBondContact O-N 2.78Å; N814-R817 PolarHBondContact OD1-NH1 3.17Å; N814-R817 PolarHBondContact OD1-NH2 3.19Å; N814-R817 VanDerWaalsContact OD1-NH2 3.07Å; L815-R817 VanDerWaalsContact C-N 3.34Å; L815-R817 PolarHBondContact O-N 2.78Å; R817-R819 VanDerWaalsContact C-N 3.29Å; R817-R819 PolarHBondContact O-N 3.2Å; R817-T820 WeakPolarHBondContact CA-OG1 3.46Å; R817-T820 PolarHBondContact O-N 3.02Å; R817-T820 PolarHBondContact O-OG1 3.04Å; R817-D821 PolarHBondContact O-N 3.18Å; R817-D821 VanDerWaalsContact O-N 3.1Å
818	S	70.1	Confident	70.9	Confident	41 Å²	41	55.5 Å²	55.5	29%	0.287	28%	0.283	S	S	.	.	H	α-helix	trans	-62.2	-35.3	176	-170.3	0	0	0	0	112.6	N814 L815 L822	N814-S818 PolarHBondContact O-N 2.76Å; L815-S818 PolarHBondContact O-N 2.93Å; S818-L822 VanDerWaalsContact O-CB 3.23Å; S818-L822 WeakPolarHBondContact O-CB 3.4Å; S818-L822 PolarHBondContact O-N 3.02Å
819	R	72.8	Confident	70.5	Confident	90 Å²	90	56.1 Å²	56.1	34%	0.34	29%	0.286	S	S	.	.	H	α-helix	trans	-65	-42.4	172.6	-173.6	177.1	173	-116.8	-0.5	112.4	I722 L815 Q816 R817 L822 M823	I722-R819 HydrophobicContact CG2-CB 3.93Å; L815-R819 PolarHBondContact O-N 2.75Å; Q816-R819 WeakPolarHBondContact O-CB 3.44Å; Q816-R819 PolarHBondContact O-N 3.22Å; R817-R819 VanDerWaalsContact C-N 3.29Å; R817-R819 PolarHBondContact O-N 3.2Å; R819-L822 PolarHBondContact O-N 3.47Å; R819-M823 HydrophobicContact CG-SD 4.11Å; R819-M823 WeakPolarHBondContact O-CB 3.27Å; R819-M823 WeakPolarHBondContact O-CG 3.35Å; R819-M823 PolarHBondContact O-N 3.48Å
820	T	72.5	Confident	70.1	Confident	83 Å²	83	56.6 Å²	56.6	51%	0.509	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-43	179.2	49.4	0	0	0	0	112.6	Q816 R817 M823 L824	Q816-T820 PolarHBondContact O-N 3.48Å; Q816-T820 PolarHBondContact O-OG1 2.98Å; R817-T820 WeakPolarHBondContact CA-OG1 3.46Å; R817-T820 PolarHBondContact O-N 3.02Å; R817-T820 PolarHBondContact O-OG1 3.04Å; T820-M823 PolarHBondContact O-N 3.22Å; T820-L824 WeakPolarHBondContact O-CG 3.34Å; T820-L824 PolarHBondContact O-N 3.01Å; T820-L824 VanDerWaalsContact O-N 3.11Å
821	D	72.8	Confident	69.3	Low	65 Å²	65	59.6 Å²	59.6	35%	0.348	29%	0.294	S	S	.	.	H	α-helix	trans	-60.2	-47.5	173.3	171.3	48.4	0	0	0	111.5	R817 M823 L824 Q825	R817-D821 PolarHBondContact O-N 3.18Å; R817-D821 VanDerWaalsContact O-N 3.1Å; D821-M823 VanDerWaalsContact C-N 3.33Å; D821-M823 PolarHBondContact O-N 2.95Å; D821-L824 WeakPolarHBondContact O-CB 3.46Å; D821-L824 PolarHBondContact O-N 3.4Å; D821-L824 VanDerWaalsContact O-N 3.15Å; D821-Q825 WeakPolarHBondContact O-CG 3.38Å; D821-Q825 PolarHBondContact O-N 3.21Å; D821-Q825 PolarHBondContact OD1-NE2 2.99Å; D821-Q825 PolarHBondContact OD2-NE2 2.87Å
822	L	71	Confident	68.2	Low	0 Å²	0	56 Å²	56	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-63.1	-35.4	178	-168.3	72.7	0	0	0	113.5	L715 K718 N719 I722 S818 R819 Q825 L826	L715-L822 HydrophobicContact CB-CD1 4.24Å; L715-L822 HydrophobicContact CD2-CD1 3.48Å; L715-L822 VanDerWaalsContact CD2-CD1 3.48Å; L715-L822 HydrophobicContact CG-CD1 4.45Å; K718-L822 HydrophobicContact CB-CD1 4.32Å; K718-L822 HydrophobicContact CB-CD2 3.97Å; K718-L822 HydrophobicContact CD-CD1 3.77Å; K718-L822 HydrophobicContact CD-CD2 4.37Å; K718-L822 HydrophobicContact CG-CD1 4.18Å; K718-L822 HydrophobicContact CG-CD2 3.89Å; N719-L822 VanDerWaalsContact CA-CD2 3.45Å; N719-L822 HydrophobicContact CB-CD2 3.58Å; N719-L822 VanDerWaalsContact N-CD2 3.3Å; I722-L822 HydrophobicContact CD1-CD2 4.03Å; S818-L822 VanDerWaalsContact O-CB 3.23Å; S818-L822 WeakPolarHBondContact O-CB 3.4Å; S818-L822 PolarHBondContact O-N 3.02Å; R819-L822 PolarHBondContact O-N 3.47Å; L822-Q825 PolarHBondContact O-N 3.35Å; L822-L826 HydrophobicContact CG-CD1 4.41Å; L822-L826 WeakPolarHBondContact O-CB 3.3Å; L822-L826 WeakPolarHBondContact O-CG 3.48Å; L822-L826 PolarHBondContact O-N 2.88Å
823	M	66.7	Low	67.3	Low	68 Å²	68	57.1 Å²	57.1	34%	0.335	29%	0.29	S	S	.	.	H	α-helix	trans	-66.3	-40.6	173.9	-80.5	174.3	50.1	0	0	111.9	R819 T820 D821 L826 E827	R819-M823 HydrophobicContact CG-SD 4.11Å; R819-M823 WeakPolarHBondContact O-CB 3.27Å; R819-M823 WeakPolarHBondContact O-CG 3.35Å; R819-M823 PolarHBondContact O-N 3.48Å; T820-M823 PolarHBondContact O-N 3.22Å; D821-M823 VanDerWaalsContact C-N 3.33Å; D821-M823 PolarHBondContact O-N 2.95Å; M823-L826 PolarHBondContact O-N 3.31Å; M823-E827 WeakPolarHBondContact O-CB 3.44Å; M823-E827 PolarHBondContact O-N 2.94Å
824	L	72.3	Confident	66.5	Low	104 Å²	104	58.9 Å²	58.9	55%	0.545	30%	0.302	S	S	.	.	H	α-helix	trans	-63.8	-40.9	175.3	-68.1	167.5	0	0	0	111.6	T820 D821 E827 A828	T820-L824 WeakPolarHBondContact O-CG 3.34Å; T820-L824 PolarHBondContact O-N 3.01Å; T820-L824 VanDerWaalsContact O-N 3.11Å; D821-L824 WeakPolarHBondContact O-CB 3.46Å; D821-L824 PolarHBondContact O-N 3.4Å; D821-L824 VanDerWaalsContact O-N 3.15Å; L824-E827 PolarHBondContact O-N 3.4Å; L824-A828 WeakPolarHBondContact O-CB 3.47Å; L824-A828 PolarHBondContact O-N 3.11Å
825	Q	69.3	Low	65.3	Low	50 Å²	50	58 Å²	58	23%	0.234	30%	0.299	C	S	.	.	H	α-helix	trans	-63.1	-44.2	174.2	-67.5	165.1	20	0	0	112	D821 L822 A828 L829	D821-Q825 WeakPolarHBondContact O-CG 3.38Å; D821-Q825 PolarHBondContact O-N 3.21Å; D821-Q825 PolarHBondContact OD1-NE2 2.99Å; D821-Q825 PolarHBondContact OD2-NE2 2.87Å; L822-Q825 PolarHBondContact O-N 3.35Å; Q825-A828 PolarHBondContact O-N 2.95Å; Q825-L829 PolarHBondContact O-N 2.69Å
826	L	66.7	Low	63.9	Low	21 Å²	21	58.7 Å²	58.7	11%	0.11	31%	0.307	C	S	.	.	H	α-helix	trans	-62.8	-46.4	175.4	-80.9	165.7	0	0	0	112.2	I712 L715 Q716 N719 L822 M823 A828 L829 V830	I712-L826 HydrophobicContact CG2-CD2 4.42Å; L715-L826 HydrophobicContact CB-CD2 3.61Å; L715-L826 HydrophobicContact CB-CG 3.94Å; Q716-L826 HydrophobicContact CG-CD2 3.82Å; N719-L826 HydrophobicContact CB-CD1 4.22Å; N719-L826 WeakPolarHBondContact ND2-CD1 3.47Å; L822-L826 HydrophobicContact CG-CD1 4.41Å; L822-L826 WeakPolarHBondContact O-CB 3.3Å; L822-L826 WeakPolarHBondContact O-CG 3.48Å; L822-L826 PolarHBondContact O-N 2.88Å; M823-L826 PolarHBondContact O-N 3.31Å; L826-A828 VanDerWaalsContact C-N 3.34Å; L826-A828 PolarHBondContact O-N 3.39Å; L826-L829 PolarHBondContact O-N 2.71Å; L826-V830 WeakPolarHBondContact O-CB 3.4Å; L826-V830 VanDerWaalsContact O-CG2 3.28Å; L826-V830 WeakPolarHBondContact O-CG2 3.38Å; L826-V830 PolarHBondContact O-N 3.37Å
827	E	64.6	Low	62.6	Low	74 Å²	74	61.6 Å²	61.6	35%	0.346	33%	0.328	S	S	.	.	H	α-helix	trans	-60.2	-42	175.8	-85.1	-171.9	-136.5	0	0	112.2	M823 L824 R831	M823-E827 WeakPolarHBondContact O-CB 3.44Å; M823-E827 PolarHBondContact O-N 2.94Å; L824-E827 PolarHBondContact O-N 3.4Å; E827-R831 VanDerWaalsContact O-CB 3.27Å; E827-R831 WeakPolarHBondContact O-CB 3.34Å; E827-R831 WeakPolarHBondContact O-CG 3.46Å; E827-R831 PolarHBondContact O-N 2.84Å; E827-R831 IonicContact OE2-CZ 3.04Å; E827-R831 IonicContact OE2-NH1 3.56Å; E827-R831 PolarHBondContact OE2-NH1 3.49Å; E827-R831 IonicContact OE2-NH2 3.93Å; E827-R831 PolarHBondContact OE2-NH2 2.94Å
828	A	67.2	Low	61.2	Low	18 Å²	18	61.2 Å²	61.2	15%	0.149	35%	0.349	C	S	.	.	H	α-helix	trans	-62	-48.8	176.9	0	0	0	0	0	111.8	F695 L824 Q825 L826 R831 L832	F695-A828 HydrophobicContact CE2-CB 4.15Å; F695-A828 HydrophobicContact CZ-CB 4.44Å; L824-A828 WeakPolarHBondContact O-CB 3.47Å; L824-A828 PolarHBondContact O-N 3.11Å; Q825-A828 PolarHBondContact O-N 2.95Å; L826-A828 VanDerWaalsContact C-N 3.34Å; L826-A828 PolarHBondContact O-N 3.39Å; A828-R831 PolarHBondContact O-N 2.68Å; A828-L832 WeakPolarHBondContact O-CG 3.23Å; A828-L832 PolarHBondContact O-N 3.34Å
829	L	62.6	Low	59.6	Low	28 Å²	28	63 Å²	63	15%	0.147	37%	0.366	C	S	.	.	H	α-helix	trans	-70.4	-36.1	-178.3	-75.1	164.8	0	0	0	113.4	Q708 L711 I712 L715 Q825 L826 L832 L833	Q708-L829 HydrophobicContact CG-CD2 4.31Å; L711-L829 HydrophobicContact CD2-CD1 3.75Å; L711-L829 HydrophobicContact CD2-CD2 4.09Å; L711-L829 HydrophobicContact CG-CD1 3.97Å; I712-L829 HydrophobicContact CD1-CB 3.98Å; I712-L829 HydrophobicContact CG1-CB 3.76Å; I712-L829 HydrophobicContact CG1-CD1 4.4Å; L715-L829 HydrophobicContact CD1-CD1 3.27Å; Q825-L829 PolarHBondContact O-N 2.69Å; L826-L829 PolarHBondContact O-N 2.71Å; L829-L832 HydrophobicContact CD2-CD1 4.28Å; L829-L832 PolarHBondContact O-N 3.5Å; L829-L833 PolarHBondContact O-N 3.16Å
830	V	63.7	Low	57.8	Low	69 Å²	69	63.2 Å²	63.2	42%	0.418	38%	0.377	S	S	.	.	H	α-helix	trans	-66.8	-41.4	172.8	171	0	0	0	0	110.7	L826 L832 L833 S834	L826-V830 WeakPolarHBondContact O-CB 3.4Å; L826-V830 VanDerWaalsContact O-CG2 3.28Å; L826-V830 WeakPolarHBondContact O-CG2 3.38Å; L826-V830 PolarHBondContact O-N 3.37Å; V830-L832 VanDerWaalsContact C-N 3.34Å; V830-L832 PolarHBondContact O-N 3.24Å; V830-L833 PolarHBondContact O-N 3.38Å; V830-S834 WeakPolarHBondContact O-CB 3.32Å; V830-S834 PolarHBondContact O-N 3.48Å; V830-S834 PolarHBondContact O-OG 3.11Å
831	R	58	Low	55.8	Low	127 Å²	127	67.3 Å²	67.3	48%	0.479	40%	0.396	S	S	.	.	H	α-helix	trans	-64.4	-35.9	173.6	-75	175.5	-176.3	125.9	11.5	112.5	E827 A828 S834 V835	E827-R831 VanDerWaalsContact O-CB 3.27Å; E827-R831 WeakPolarHBondContact O-CB 3.34Å; E827-R831 WeakPolarHBondContact O-CG 3.46Å; E827-R831 PolarHBondContact O-N 2.84Å; E827-R831 IonicContact OE2-CZ 3.04Å; E827-R831 IonicContact OE2-NH1 3.56Å; E827-R831 PolarHBondContact OE2-NH1 3.49Å; E827-R831 IonicContact OE2-NH2 3.93Å; E827-R831 PolarHBondContact OE2-NH2 2.94Å; A828-R831 PolarHBondContact O-N 2.68Å; R831-S834 PolarHBondContact O-N 3.42Å; R831-V835 WeakPolarHBondContact O-CG2 3.46Å; R831-V835 PolarHBondContact O-N 3.21Å
832	L	52.8	Low	53.9	Low	50 Å²	50	67.8 Å²	67.8	26%	0.262	41%	0.409	S	S	.	.	H	α-helix	trans	-63.9	-49.8	172.8	-78.4	163.8	0	0	0	111.4	F695 A828 L829 V830 S834 V835 S836	F695-L832 HydrophobicContact CD1-CD2 4.45Å; F695-L832 HydrophobicContact CE1-CD1 4.35Å; F695-L832 HydrophobicContact CE1-CD2 3.74Å; F695-L832 HydrophobicContact CE1-CG 4.07Å; F695-L832 HydrophobicContact CE2-CD1 4.26Å; F695-L832 HydrophobicContact CZ-CD1 3.88Å; F695-L832 HydrophobicContact CZ-CD2 4.07Å; F695-L832 HydrophobicContact CZ-CG 3.87Å; A828-L832 WeakPolarHBondContact O-CG 3.23Å; A828-L832 PolarHBondContact O-N 3.34Å; L829-L832 HydrophobicContact CD2-CD1 4.28Å; L829-L832 PolarHBondContact O-N 3.5Å; V830-L832 VanDerWaalsContact C-N 3.34Å; V830-L832 PolarHBondContact O-N 3.24Å; L832-S834 VanDerWaalsContact C-N 3.29Å; L832-S834 PolarHBondContact O-N 3.33Å; L832-V835 WeakPolarHBondContact O-CB 3.44Å; L832-V835 PolarHBondContact O-N 2.94Å; L832-S836 PolarHBondContact O-N 3.38Å; L832-S836 PolarHBondContact O-OG 3.29Å
833	L	49.7	Very low	51.9	Low	32 Å²	32	79.2 Å²	79.2	17%	0.168	45%	0.452	C	S	.	.	H	α-helix	trans	-56.4	-43.1	174.7	-84.7	-174.1	0	0	0	112.2	T705 Q708 K709 I712 L829 V830 V835 S836 T837	T705-L833 HydrophobicContact CG2-CD2 3.94Å; Q708-L833 HydrophobicContact CB-CD2 4.46Å; Q708-L833 HydrophobicContact CG-CD2 4.11Å; Q708-L833 HydrophobicContact CG-CG 4.19Å; Q708-L833 VanDerWaalsContact OE1-CD2 3.29Å; K709-L833 HydrophobicContact CG-CD1 4.48Å; I712-L833 HydrophobicContact CD1-CD1 3.37Å; I712-L833 HydrophobicContact CD1-CG 3.94Å; L829-L833 PolarHBondContact O-N 3.16Å; V830-L833 PolarHBondContact O-N 3.38Å; L833-V835 PolarHBondContact O-N 3.44Å; L833-V835 VanDerWaalsContact O-N 3.12Å; L833-S836 PolarHBondContact O-N 3Å; L833-T837 PolarHBondContact O-N 3.43Å; L833-T837 VanDerWaalsContact O-N 3.14Å; L833-T837 PolarHBondContact O-OG1 3.19Å; L833-T837 VanDerWaalsContact O-OG1 3.1Å
834	S	53.6	Low	50.4	Low	82 Å²	82	82.5 Å²	82.5	57%	0.573	47%	0.471	S	S	*	.	H	α-helix	trans	-66.3	-6.6	176.7	-60.5	0	0	0	0	114.6	V830 R831 L832	V830-S834 WeakPolarHBondContact O-CB 3.32Å; V830-S834 PolarHBondContact O-N 3.48Å; V830-S834 PolarHBondContact O-OG 3.11Å; R831-S834 PolarHBondContact O-N 3.42Å; L832-S834 VanDerWaalsContact C-N 3.29Å; L832-S834 PolarHBondContact O-N 3.33Å
835	V	51	Low	48.7	Very low	58 Å²	58	83.9 Å²	83.9	35%	0.352	48%	0.479	S	S	.	.	H	α-helix	trans	-99.7	-49.8	170.3	172.9	0	0	0	0	110.4	R831 L832 L833 T837 G838 A839	R831-V835 WeakPolarHBondContact O-CG2 3.46Å; R831-V835 PolarHBondContact O-N 3.21Å; L832-V835 WeakPolarHBondContact O-CB 3.44Å; L832-V835 PolarHBondContact O-N 2.94Å; L833-V835 PolarHBondContact O-N 3.44Å; L833-V835 VanDerWaalsContact O-N 3.12Å; V835-T837 VanDerWaalsContact C-N 3.29Å; V835-T837 PolarHBondContact O-N 3.32Å; V835-G838 PolarHBondContact O-N 2.98Å; V835-A839 PolarHBondContact O-N 3.45Å
836	S	43.6	Very low	46.9	Very low	51 Å²	51	86.9 Å²	86.9	36%	0.357	50%	0.497	S	S	.	.	H	α-helix	trans	-58.8	-39.6	-176.1	-53.9	0	0	0	0	112.4	L832 L833 G838 A839 T840	L832-S836 PolarHBondContact O-N 3.38Å; L832-S836 PolarHBondContact O-OG 3.29Å; L833-S836 PolarHBondContact O-N 3Å; S836-G838 PolarHBondContact O-N 3.01Å; S836-A839 PolarHBondContact O-N 3.29Å; S836-A839 VanDerWaalsContact O-N 3.12Å; S836-T840 PolarHBondContact O-N 3.35Å
837	T	44.3	Very low	45.1	Very low	103 Å²	103	89.2 Å²	89.2	63%	0.632	51%	0.513	S	S	*	.	H	α-helix	trans	-68.7	-11	177.1	56.5	0	0	0	0	114.4	L833 V835	L833-T837 PolarHBondContact O-N 3.43Å; L833-T837 VanDerWaalsContact O-N 3.14Å; L833-T837 PolarHBondContact O-OG1 3.19Å; L833-T837 VanDerWaalsContact O-OG1 3.1Å; V835-T837 VanDerWaalsContact C-N 3.29Å; V835-T837 PolarHBondContact O-N 3.32Å
838	G	39.5	Very low	43.4	Very low	71 Å²	71	89.4 Å²	89.4	73%	0.732	52%	0.523	S	S	*	.	H	α-helix	trans	-98.6	-9.9	172.5	0	0	0	0	0	114.3	V835 S836	V835-G838 PolarHBondContact O-N 2.98Å; S836-G838 PolarHBondContact O-N 3.01Å
839	A	36.9	Very low	41.7	Very low	78 Å²	78	91 Å²	91	65%	0.645	54%	0.536	S	S	*	.	H	α-helix	trans	-98	-29.4	-175.4	0	0	0	0	0	113.4	V835 S836	V835-A839 PolarHBondContact O-N 3.45Å; S836-A839 PolarHBondContact O-N 3.29Å; S836-A839 VanDerWaalsContact O-N 3.12Å
840	T	34.5	Very low	40.1	Very low	95 Å²	95	94.3 Å²	94.3	58%	0.583	55%	0.553	S	S	*	*	S	Bend	trans	-102.9	82.6	-178.2	59.2	0	0	0	0	111.5	S836	S836-T840 PolarHBondContact O-N 3.35Å
841	N	30.5	Very low	38.4	Very low	169 Å²	169	97.4 Å²	97.4	90%	0.904	57%	0.567	S	S	*	*	S	Bend	trans	165.7	63.9	153.1	-84.9	-20.5	0	0	0	112.4
842	A	33.6	Very low	37	Very low	75 Å²	75	98 Å²	98	62%	0.62	58%	0.579	S	S	*	*			trans	-160.2	71.6	169.9	0	0	0	0	0	112.9
843	R	29.3	Very low	36.1	Very low	240 Å²	240	102.8 Å²	102.8	91%	0.906	60%	0.604	S	S	*	*			trans	-91.7	164.2	147.7	-87.1	-177.8	168.5	156	-2.7	108.3
844	D	35.6	Very low	35.1	Very low	137 Å²	137	108.1 Å²	108.1	73%	0.733	63%	0.633	S	S	*	*			trans	80.7	80	171.8	-51.3	-36.4	0	0	0	119.1
845	N	35.4	Very low	33.9	Very low	133 Å²	133	110.8 Å²	110.8	71%	0.711	64%	0.641	S	S	*	*				85.3	113.8	120.5	-56.9	-39.6	0	0	0	123.4
846	N	32.6	Very low	33.2	Very low	114 Å²	114	115.1 Å²	115.1	61%	0.61	67%	0.667	S	S	*	*				101.4	115.3	129.3	-158.4	1.8	0	0	0	120.4	L555 S848	L555-N846 WeakPolarHBondContact CB-O 3.34Å; L555-N846 WeakPolarHBondContact CD1-O 3.36Å; N846-S848 PolarHBondContact O-N 3.36Å
847	P	27.2	Very low	32.5	Very low	69 Å²	69	122.7 Å²	122.7	45%	0.448	69%	0.688	S	S	.	*			trans	-82.1	46.9	-171.4	31.8	-38.2	0	0	0	122.5	L555 V556	L555-P847 VanDerWaalsContact CB-CA 3.44Å; L555-P847 PolarHBondContact N-O 3.48Å; L555-P847 WeakPolarHBondContact O-CA 3.25Å; L555-P847 WeakPolarHBondContact O-CB 3.41Å; V556-P847 WeakPolarHBondContact O-CB 3.18Å
848	S	29.5	Very low	32	Very low	79 Å²	79	128.4 Å²	128.4	55%	0.552	70%	0.698	S	S	*	*			trans	-139.6	76.8	167.6	-60	0	0	0	0	122.3	R553 N846	R553-S848 VanDerWaalsContact C-C 3.47Å; R553-S848 CarbonylContact O-C 3.58Å; R553-S848 WeakPolarHBondContact O-CA 3.38Å; R553-S848 WeakPolarHBondContact O-CB 3.49Å; R553-S848 PolarHBondContact O-OG 2.9Å; N846-S848 PolarHBondContact O-N 3.36Å
849	A	31.5	Very low	31.7	Very low	51 Å²	51	131.9 Å²	131.9	42%	0.421	71%	0.705	S	S	.	*			trans	-162.5	108.6	144.4	0	0	0	0	0	119	R553 S554 L555	R553-A849 HydrophobicContact CB-CB 4.11Å; R553-A849 HydrophobicContact CG-CB 3.76Å; S554-A849 VanDerWaalsContact N-C 3.27Å; S554-A849 CarbonylContact O-C 3.52Å; S554-A849 WeakPolarHBondContact O-CA 3.44Å; S554-A849 PolarHBondContact O-N 3.32Å; L555-A849 HydrophobicContact CD1-CB 4.26Å
850	L	29.6	Very low	31.3	Very low	97 Å²	97	131.1 Å²	131.1	51%	0.508	71%	0.705	S	S	.	*			cis	-163.1	155.9	31.1	173.3	141.5	0	0	0	114.8	R553 S554 D852	R553-L850 HydrophobicContact CG-CB 3.63Å; R553-L850 HydrophobicContact CG-CD1 4.01Å; R553-L850 HydrophobicContact CG-CG 4Å; S554-L850 VanDerWaalsContact N-CA 3.28Å; S554-L850 PolarHBondContact O-N 2.95Å; S554-L850 VanDerWaalsContact O-N 3.16Å; S554-L850 VanDerWaalsContact OG-C 3.25Å; S554-L850 PolarHBondContact OG-O 3.12Å; L850-D852 WeakPolarHBondContact CD2-O 3.42Å
851	L	28.1	Very low	31.3	Very low	135 Å²	135	134.9 Å²	134.9	71%	0.707	72%	0.715	S	S	*	*			trans	-141.9	153.7	158.2	-102.8	179.8	0	0	0	110.3	S554	S554-L851 PolarHBondContact OG-N 2.87Å
852	D	29.2	Very low	31.2	Very low	138 Å²	138	133.3 Å²	133.3	74%	0.738	71%	0.707	S	S	*	*			trans	55.6	138.5	-161.9	-85.6	-34.8	0	0	0	113.7	L850	L850-D852 WeakPolarHBondContact CD2-O 3.42Å
853	L	32.4	Very low	31.2	Very low	151 Å²	151	134.8 Å²	134.8	79%	0.791	71%	0.713	S	S	*	*				-157	149.2	53.8	174.8	66.7	0	0	0	111.5
854	N	29.2	Very low	31.2	Very low	145 Å²	145	134.4 Å²	134.4	78%	0.775	71%	0.711	S	S	*	*			trans	-96.2	147.1	160.6	-86.3	-42.1	0	0	0	110.7
855	D	29	Very low	31.1	Very low	138 Å²	138	135 Å²	135	74%	0.738	71%	0.714	S	S	*	*			trans	63.2	124.3	172.2	-73.7	-58.7	0	0	0	119.5
856	V	34.9	Very low	30.9	Very low	148 Å²	148	134.8 Å²	134.8	90%	0.897	71%	0.713	S	S	*	*				-161.5	151.2	124.9	140.5	0	0	0	0	107.7
857	R	30.5	Very low	30.8	Very low	211 Å²	211	136.8 Å²	136.8	80%	0.796	72%	0.718	S	S	*	*			trans	-136.9	155.2	-164.9	-133.9	-178.7	-173.5	-166.5	4	112.3
858	R	32.2	Very low	30.9	Very low	222 Å²	222	141.9 Å²	141.9	84%	0.838	73%	0.733	S	S	*	*			trans	72.4	149.9	176.3	-59.4	-176.2	176.8	-169.7	1.7	114.2
859	T	34.4	Very low	31.1	Very low	145 Å²	145	143.2 Å²	143.2	89%	0.89	74%	0.738	S	S	*	*			cis	-90.6	-145.9	12.2	64.2	0	0	0	0	112.5
860	G	27.7	Very low	31.1	Very low	62 Å²	62	146.8 Å²	146.8	64%	0.639	76%	0.757	S	S	*	*			cis	-168.9	-142.6	10	0	0	0	0	0	115
861	H	34.3	Very low	31.1	Very low	173 Å²	173	148.7 Å²	148.7	80%	0.801	77%	0.768	S	S	*	*			trans	-97.9	136.2	-155.8	-75.3	-77.7	0	0	0	117.1
862	N	29	Very low	31.1	Very low	136 Å²	136	153.4 Å²	153.4	73%	0.727	78%	0.777	S	S	*	*				37	135.1	125.1	-48.1	-23.1	0	0	0	119.3
863	S	34.5	Very low	31.2	Very low	106 Å²	106	151.8 Å²	151.8	74%	0.741	77%	0.774	S	S	*	*			cis	-159.3	148	40.5	-59.5	0	0	0	0	115.3
864	R	29	Very low	31.3	Very low	233 Å²	233	150.6 Å²	150.6	88%	0.879	78%	0.776	S	S	*	*				22.1	140.1	125.6	-52.8	-179.8	174	-170.2	-3.1	118.7
865	L	32.5	Very low	31.4	Very low	150 Å²	150	155.7 Å²	155.7	79%	0.785	78%	0.784	S	S	*	*				-159.9	125.6	59.9	-142.4	59.3	0	0	0	109.4
866	N	30.8	Very low	31.3	Very low	128 Å²	128	160.5 Å²	160.5	68%	0.684	79%	0.792	S	S	*	*				57.8	116.6	94.3	-149.2	12.2	0	0	0	114.8
867	Q	31.3	Very low	31.1	Very low	155 Å²	155	158.6 Å²	158.6	72%	0.724	79%	0.785	S	S	*	*				176.6	164.1	81.3	-87.2	-168.9	44.1	0	0	109.2
868	K	29.4	Very low	30.9	Very low	177 Å²	177	154.2 Å²	154.2	77%	0.77	78%	0.782	S	S	*	*			cis	-169.2	150.6	-11.9	170.6	177.9	-179.2	-175.2	0	108.8
869	V	32.8	Very low	30.7	Very low	107 Å²	107	148.4 Å²	148.4	65%	0.648	78%	0.775	S	S	*	*			trans	-106.2	161.3	-176	179.5	0	0	0	0	111.6
870	P	33.2	Very low	30.3	Very low	125 Å²	125	149.2 Å²	149.2	81%	0.812	77%	0.774	S	S	*	*				-138.1	137.4	129.7	35.7	-22.5	0	0	0	115.2
871	D	28.6	Very low	30.5	Very low	138 Å²	138	152.1 Å²	152.1	74%	0.738	78%	0.783	S	S	*	*			trans	-82.2	165.3	177.3	-45.9	-101.7	0	0	0	113.8
872	Y	28.8	Very low	30.2	Very low	233 Å²	233	149.7 Å²	149.7	91%	0.914	78%	0.776	S	S	*	*			trans	-149	151.5	144.9	-119.9	-95.5	0	0	0	110.8
873	P	31	Very low	30.6	Very low	104 Å²	104	149 Å²	149	68%	0.675	78%	0.778	S	S	*	*			trans	-110.4	175.7	-153.2	41.1	-31.6	0	0	0	115.7
874	P	35.1	Very low	30.4	Very low	126 Å²	126	148.1 Å²	148.1	82%	0.818	77%	0.772	S	S	*	*			trans	-93.2	167	-159.9	36.9	-37.2	0	0	0	116.2
875	R	31.4	Very low	30.6	Very low	252 Å²	252	143.6 Å²	143.6	95%	0.951	77%	0.77	S	S	*	*			trans	-138.1	158	170.2	-76.3	-170.5	176.4	-108.2	-1.1	113.6
876	R	25.8	Very low	30.5	Very low	239 Å²	239	139.2 Å²	139.2	90%	0.902	76%	0.762	S	S	*	*			trans	-87.9	154.2	172.9	-55.2	175.1	178.6	-171.6	-1.1	111.5
877	S	30.7	Very low	30.7	Very low	108 Å²	108	145.2 Å²	145.2	76%	0.755	78%	0.775	S	S	*	*			trans	-179.2	133	134.3	-82.3	0	0	0	0	106.7
878	T	27.2	Very low	30.7	Very low	119 Å²	119	140.9 Å²	140.9	73%	0.73	77%	0.772	S	S	*	*				68.2	116.2	50.6	66.4	0	0	0	0	116
879	S	26.9	Very low	30.9	Very low	100 Å²	100	143 Å²	143	70%	0.699	78%	0.776	S	S	*	*			trans	71.8	127	140.4	62.9	0	0	0	0	123.7
880	L	26.8	Very low	30.8	Very low	163 Å²	163	144.6 Å²	144.6	85%	0.853	78%	0.777	S	S	*	*				71.9	109.9	129	-68.6	169.2	0	0	0	123.1
881	C	31.8	Very low	30.8	Very low	122 Å²	122	144.1 Å²	144.1	82%	0.824	77%	0.767	S	S	*	*			trans	-169.9	125.9	131.8	44.8	0	0	0	0	106.9
882	D	28.7	Very low	30.9	Very low	123 Å²	123	142.8 Å²	142.8	66%	0.658	76%	0.76	S	S	*	*			cis	76	127.5	34	-154.9	37.9	0	0	0	113.6	S884	D882-S884 PolarHBondContact OD1-N 3.18Å; D882-S884 PolarHBondContact OD2-OG 3.12Å
883	P	35.6	Very low	31	Very low	120 Å²	120	141.1 Å²	141.1	78%	0.779	76%	0.758	S	S	*	*				-140.3	130.7	88.3	36.1	-19.9	0	0	0	117.2
884	S	30.6	Very low	31	Very low	88 Å²	88	140 Å²	140	62%	0.615	76%	0.757	S	S	*	*				30.4	138	110.9	-67.9	0	0	0	0	118.6	D882	D882-S884 PolarHBondContact OD1-N 3.18Å; D882-S884 PolarHBondContact OD2-OG 3.12Å
885	V	34.6	Very low	30.9	Very low	138 Å²	138	139.9 Å²	139.9	84%	0.836	76%	0.76	S	S	*	*			cis	-156.2	163.6	31	-179.3	0	0	0	0	108.3
886	G	30.5	Very low	30.9	Very low	59 Å²	59	134.7 Å²	134.7	61%	0.608	75%	0.746	S	S	*	*			cis	136.7	144.6	-5.7	0	0	0	0	0	114.6
887	R	34.6	Very low	31.2	Very low	254 Å²	254	127.3 Å²	127.3	96%	0.958	73%	0.731	S	S	*	*			trans	74.7	151.4	-179.1	-46.2	-178.8	-165.4	-91.2	2	116.4
888	G	30.5	Very low	31.2	Very low	64 Å²	64	131.2 Å²	131.2	66%	0.66	73%	0.729	S	S	*	*			cis	169.6	170.6	-8.8	0	0	0	0	0	114.7
889	Y	33.6	Very low	31.6	Very low	221 Å²	221	134.9 Å²	134.9	87%	0.867	74%	0.738	S	S	*	*			trans	72.7	165.7	174.9	-59.7	-81.9	0	0	0	119.9
890	Q	31	Very low	31.8	Very low	140 Å²	140	138 Å²	138	65%	0.654	75%	0.747	S	S	*	*				-167.6	166.8	-66.3	-130.8	-178.2	-79.5	0	0	111.7
891	D	32.5	Very low	32.2	Very low	115 Å²	115	132.9 Å²	132.9	62%	0.615	73%	0.733	S	S	*	*			trans	65.5	159.2	153.9	-60.2	-15.1	0	0	0	120.2
892	N	31.3	Very low	32.3	Very low	111 Å²	111	133.2 Å²	133.2	59%	0.594	73%	0.731	S	S	*	*			cis	-166	174.3	-31	-95.9	-30.5	0	0	0	110.6
893	F	29.9	Very low	32.5	Very low	197 Å²	197	135.1 Å²	135.1	86%	0.864	74%	0.742	S	S	*	*			trans	73.5	150.3	161.7	-57.6	-62.8	0	0	0	119
894	A	32.6	Very low	32.4	Very low	80 Å²	80	132.9 Å²	132.9	66%	0.661	74%	0.74	S	S	*	*			cis	-162.8	165.7	-14.9	0	0	0	0	0	113.7
895	S	31.8	Very low	32.7	Very low	124 Å²	124	135.6 Å²	135.6	87%	0.867	75%	0.753	S	S	*	*			trans	9.5	172.5	148.7	-49.1	0	0	0	0	123.6
896	E	31	Very low	32.5	Very low	144 Å²	144	135.6 Å²	135.6	67%	0.673	74%	0.743	S	S	*	*			cis	-160.9	-170.5	-48	-145.8	-143.4	122	0	0	103.9	R898	E896-R898 WeakPolarHBondContact OE1-CG 3.13Å; E896-R898 IonicContact OE1-CZ 3.8Å; E896-R898 IonicContact OE1-NE 2.89Å; E896-R898 PolarHBondContact OE1-NE 3.1Å; E896-R898 IonicContact OE1-NH2 3.85Å; E896-R898 IonicContact OE2-NE 3.82Å; E896-R898 IonicContact OE2-NH2 3.66Å
897	S	33.9	Very low	32.9	Very low	83 Å²	83	138.3 Å²	138.3	58%	0.58	75%	0.75	S	S	*	*			cis	-160.1	151.5	6	68.4	0	0	0	0	112.4
898	R	29.5	Very low	32.7	Very low	191 Å²	191	134.1 Å²	134.1	72%	0.721	74%	0.739	S	S	*	*			trans	39	135.5	136.3	-55.6	161	-163.1	-150.7	-0.3	122.5	E896	E896-R898 WeakPolarHBondContact OE1-CG 3.13Å; E896-R898 IonicContact OE1-CZ 3.8Å; E896-R898 IonicContact OE1-NE 2.89Å; E896-R898 PolarHBondContact OE1-NE 3.1Å; E896-R898 IonicContact OE1-NH2 3.85Å; E896-R898 IonicContact OE2-NE 3.82Å; E896-R898 IonicContact OE2-NH2 3.66Å
899	H	36	Very low	32.9	Very low	196 Å²	196	137.2 Å²	137.2	91%	0.907	75%	0.748	S	S	*	*				-164.1	178	115.2	-105.4	-57.1	0	0	0	113.2
900	N	30.5	Very low	32.8	Very low	166 Å²	166	130.1 Å²	130.1	89%	0.888	74%	0.741	S	S	*	*			trans	-160.1	157.3	-151.6	-167.4	16	0	0	0	115.4
901	G	34.8	Very low	32.9	Very low	55 Å²	55	129.3 Å²	129.3	57%	0.567	75%	0.751	S	S	*	*			trans	114.2	162.1	165.3	0	0	0	0	0	117.5
902	T	35.2	Very low	32.9	Very low	128 Å²	128	128.1 Å²	128.1	79%	0.785	75%	0.752	S	S	*	*			cis	-168.5	141.7	-13.1	6.3	0	0	0	0	114.2
903	N	32.2	Very low	32.7	Very low	164 Å²	164	129.5 Å²	129.5	88%	0.877	76%	0.759	S	S	*	*			trans	71.7	125.8	144.4	-60.9	-15.8	0	0	0	125.8
904	G	34.2	Very low	32.8	Very low	72 Å²	72	127.1 Å²	127.1	74%	0.742	76%	0.756	S	S	*	*			trans	152.6	159.4	163.7	0	0	0	0	0	112.9
905	V	36.1	Very low	32.6	Very low	145 Å²	145	131 Å²	131	88%	0.879	76%	0.762	S	S	*	*			cis	-154.2	-170.6	-18.1	-150.5	0	0	0	0	108.4
906	H	31.7	Very low	32.3	Very low	139 Å²	139	129 Å²	129	64%	0.644	76%	0.76	S	S	*	*			trans	-151.8	175.5	178	-111.7	-23.4	0	0	0	111.4
907	P	37.4	Very low	32.1	Very low	116 Å²	116	131.1 Å²	131.1	75%	0.753	77%	0.767	S	S	*	*			cis	-114.2	171	11.5	41.9	-29.8	0	0	0	114.3
908	K	30.3	Very low	31.9	Very low	165 Å²	165	135 Å²	135	72%	0.717	78%	0.78	S	S	*	*			cis	74.7	146.9	39.4	-95.9	-178.5	178.1	170.7	0	115.2
909	P	35.5	Very low	31.7	Very low	130 Å²	130	135.8 Å²	135.8	84%	0.844	79%	0.789	S	S	*	*			cis	-132.6	177.7	7.9	42.9	-26.4	0	0	0	117.4
910	G	31	Very low	31.2	Very low	71 Å²	71	131 Å²	131	73%	0.732	78%	0.777	S	S	*	*			trans	137.1	80.4	171.3	0	0	0	0	0	113
911	S	32.5	Very low	31.1	Very low	123 Å²	123	128.9 Å²	128.9	86%	0.86	77%	0.772	S	S	*	*				61.9	116.4	81.4	-160.4	0	0	0	0	113.4
912	S	32.3	Very low	30.7	Very low	90 Å²	90	133.7 Å²	133.7	63%	0.629	79%	0.785	S	S	*	*			cis	-156.2	141.6	0.8	55	0	0	0	0	112.5
913	D	28.5	Very low	30.6	Very low	140 Å²	140	135.6 Å²	135.6	75%	0.749	78%	0.782	S	S	*	*			trans	33.2	117.9	139.7	-42.1	-37.6	0	0	0	120.4
914	N	31.8	Very low	30.5	Very low	148 Å²	148	133.4 Å²	133.4	79%	0.791	77%	0.774	S	S	*	*				-173.1	131	99.9	-105.7	-80.4	0	0	0	115.5
915	M	27.9	Very low	30.5	Very low	162 Å²	162	134.1 Å²	134.1	80%	0.798	76%	0.761	S	S	*	*			trans	38.9	116.6	135.3	-63.4	-68	-111.4	0	0	120.4
916	G	25.8	Very low	30.4	Very low	80 Å²	80	130.9 Å²	130.9	83%	0.825	74%	0.741	S	S	*	*			trans	-65.9	132.3	172	0	0	0	0	0	114.1
917	K	27.6	Very low	30.5	Very low	189 Å²	189	128.9 Å²	128.9	82%	0.822	73%	0.734	S	S	*	*			trans	-165.8	55.8	176.6	-112	167.4	-173	173.5	0	112.2
918	I	28.5	Very low	30.5	Very low	164 Å²	164	127.2 Å²	127.2	84%	0.841	72%	0.716	S	S	*	*			trans	-128.3	51.2	-179.2	-36.3	-178.7	0	0	0	112.8
919	F	25.3	Very low	30.9	Very low	209 Å²	209	125.3 Å²	125.3	92%	0.917	71%	0.71	S	S	*	*			trans	-93	129.8	138.6	-88.7	-88.3	0	0	0	107
920	S	26	Very low	31.1	Very low	94 Å²	94	125 Å²	125	66%	0.657	70%	0.696	S	S	*	*			trans	-143.9	107.5	174.5	-74.8	0	0	0	0	108.2
921	P	27.3	Very low	31.4	Very low	122 Å²	122	126 Å²	126	79%	0.792	71%	0.706	S	S	*	*			trans	-64.8	160.1	174.9	29	-34.4	0	0	0	110.4	K923	P921-K923 PolarHBondContact O-N 3.37Å
922	L	28.2	Very low	31.6	Very low	157 Å²	157	122.9 Å²	122.9	82%	0.822	69%	0.693	S	S	*	*			trans	-34	116.7	178	-65.7	161.9	0	0	0	112.3	T924	L922-T924 PolarHBondContact O-N 3.21Å
923	K	32.7	Very low	31.4	Very low	168 Å²	168	125.2 Å²	125.2	73%	0.73	69%	0.694	S	S	*	*			trans	-65	98	175.9	-76.2	-178.1	178.6	175	0	109.4	P921 I925	P921-K923 PolarHBondContact O-N 3.37Å; K923-I925 PolarHBondContact O-N 2.98Å
924	T	30.4	Very low	31.9	Very low	117 Å²	117	126.2 Å²	126.2	72%	0.718	69%	0.687	S	S	*	*			trans	-57.1	130.8	-178.2	-54.3	0	0	0	0	111.8	L922 T926	L922-T924 PolarHBondContact O-N 3.21Å; T924-T926 PolarHBondContact O-N 2.79Å
925	I	33.6	Very low	32.1	Very low	88 Å²	88	122.7 Å²	122.7	45%	0.451	67%	0.668	S	S	.	*			trans	-65.9	114.8	167.4	-61.5	173.8	0	0	0	107.6	K923 I927 F936 F938	K923-I925 PolarHBondContact O-N 2.98Å; I925-I927 PolarHBondContact O-N 3.47Å; I925-F936 HydrophobicContact CG2-CD1 4.49Å; I925-F938 HydrophobicContact CD1-CE1 4.19Å
926	T	33.4	Very low	32.7	Very low	77 Å²	77	120.8 Å²	120.8	47%	0.472	66%	0.656	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.6	119.9	175.2	42.3	0	0	0	0	109.6	T924 K937	T924-T926 PolarHBondContact O-N 2.79Å; T926-K937 PolarHBondContact O-N 3.49Å; T926-K937 PolarHBondContact OG1-O 3.06Å
927	I	34	Very low	33.2	Very low	96 Å²	96	123 Å²	123	49%	0.492	64%	0.642	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100	111.2	172.6	-61.1	174.9	0	0	0	106	I925 W934 F936	I925-I927 PolarHBondContact O-N 3.47Å; I927-W934 HydrophobicContact CG2-CD2 4.32Å; I927-W934 HydrophobicContact CG2-CE3 3.32Å; I927-W934 HydrophobicContact CG2-CZ3 3.69Å; I927-F936 HydrophobicContact CD1-CE1 4.07Å; I927-F936 HydrophobicContact CG1-CD1 4.04Å; I927-F936 HydrophobicContact CG1-CE1 4.03Å
928	E	38.6	Very low	33.9	Very low	82 Å²	82	120.3 Å²	120.3	38%	0.383	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.3	126.6	171.1	-72.6	-171.1	146.5	0	0	109.8	K930 N935	E928-K930 VanDerWaalsContact CD-NZ 3.3Å; E928-K930 IonicContact OE1-NZ 2.78Å; E928-K930 PolarHBondContact OE1-NZ 2.78Å; E928-K930 WeakPolarHBondContact OE2-CE 3.48Å; E928-K930 IonicContact OE2-NZ 3.24Å; E928-K930 PolarHBondContact OE2-NZ 3.48Å; E928-N935 PolarHBondContact N-O 3.33Å; E928-N935 PolarHBondContact O-N 3.06Å
929	E	38.7	Very low	34.5	Very low	124 Å²	124	116.5 Å²	116.5	58%	0.579	62%	0.617	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85.2	124.9	163.4	-169.6	-171.2	162.2	0	0	109.2	W934	E929-W934 HydrophobicContact CB-CE3 4.06Å; E929-W934 HydrophobicContact CB-CZ3 3.98Å
930	K	39.9	Very low	35.2	Very low	125 Å²	125	113.5 Å²	113.5	54%	0.543	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-135.4	119.2	171	-78.2	175	176.3	153.3	0	109.2	E928 G932 Q933	E928-K930 VanDerWaalsContact CD-NZ 3.3Å; E928-K930 IonicContact OE1-NZ 2.78Å; E928-K930 PolarHBondContact OE1-NZ 2.78Å; E928-K930 WeakPolarHBondContact OE2-CE 3.48Å; E928-K930 IonicContact OE2-NZ 3.24Å; E928-K930 PolarHBondContact OE2-NZ 3.48Å; K930-G932 VanDerWaalsContact C-N 3.33Å; K930-G932 PolarHBondContact O-N 2.95Å; K930-Q933 PolarHBondContact N-O 3.41Å; K930-Q933 WeakPolarHBondContact O-CB 3.04Å; K930-Q933 PolarHBondContact O-N 3.17Å
931	G	37.2	Very low	35.8	Very low	92 Å²	92	116.3 Å²	116.3	95%	0.948	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	60.9	35.5	179.6	0	0	0	0	0	114.4	Q933	G931-Q933 PolarHBondContact O-N 3.1Å
932	G	35.2	Very low	36.2	Very low	57 Å²	57	119.9 Å²	119.9	59%	0.588	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.1	7.3	-174	0	0	0	0	0	114.6	K930	K930-G932 VanDerWaalsContact C-N 3.33Å; K930-G932 PolarHBondContact O-N 2.95Å
933	Q	28.7	Very low	36.4	Very low	139 Å²	139	121.8 Å²	121.8	65%	0.65	62%	0.623	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113	123.9	-179.3	-153.9	175.3	41.2	0	0	111.5	K930 G931 N935	K930-Q933 PolarHBondContact N-O 3.41Å; K930-Q933 WeakPolarHBondContact O-CB 3.04Å; K930-Q933 PolarHBondContact O-N 3.17Å; G931-Q933 PolarHBondContact O-N 3.1Å; Q933-N935 PolarHBondContact O-N 2.99Å; Q933-N935 PolarHBondContact O-ND2 3.05Å
934	W	39.9	Very low	36.4	Very low	161 Å²	161	123 Å²	123	61%	0.61	63%	0.631	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76.3	114.2	178.9	-62.8	108.4	0	0	0	111.5	I927 E929 F936	I927-W934 HydrophobicContact CG2-CD2 4.32Å; I927-W934 HydrophobicContact CG2-CE3 3.32Å; I927-W934 HydrophobicContact CG2-CZ3 3.69Å; E929-W934 HydrophobicContact CB-CE3 4.06Å; E929-W934 HydrophobicContact CB-CZ3 3.98Å; W934-F936 HydrophobicContact CB-CE2 4.22Å
935	N	35.1	Very low	36.3	Very low	73 Å²	73	125.2 Å²	125.2	39%	0.39	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103	114	175.9	-77.1	-91.6	0	0	0	110.2	E928 Q933 K937	E928-N935 PolarHBondContact N-O 3.33Å; E928-N935 PolarHBondContact O-N 3.06Å; Q933-N935 PolarHBondContact O-N 2.99Å; Q933-N935 PolarHBondContact O-ND2 3.05Å; N935-K937 PolarHBondContact O-N 3.12Å
936	F	40.7	Very low	36.2	Very low	123 Å²	123	129.4 Å²	129.4	54%	0.539	66%	0.655	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-87	104	175.8	-63.6	-87.9	0	0	0	109.8	I925 I927 W934 F938	I925-F936 HydrophobicContact CG2-CD1 4.49Å; I927-F936 HydrophobicContact CD1-CE1 4.07Å; I927-F936 HydrophobicContact CG1-CD1 4.04Å; I927-F936 HydrophobicContact CG1-CE1 4.03Å; W934-F936 HydrophobicContact CB-CE2 4.22Å; F936-F938 HydrophobicContact CB-CE2 4.07Å
937	K	35.8	Very low	36.1	Very low	125 Å²	125	133.9 Å²	133.9	54%	0.543	67%	0.671	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.8	101.9	-179.1	-163.5	171.1	-174.7	176.7	0	111	T926 N935	T926-K937 PolarHBondContact O-N 3.49Å; T926-K937 PolarHBondContact OG1-O 3.06Å; N935-K937 PolarHBondContact O-N 3.12Å
938	F	43.8	Very low	35.9	Very low	134 Å²	134	134.7 Å²	134.7	59%	0.588	69%	0.685	S	S	*	*			trans	-75.7	150.7	168.9	-62.2	-86.3	0	0	0	110.4	I925 F936 D940	I925-F938 HydrophobicContact CD1-CE1 4.19Å; F936-F938 HydrophobicContact CB-CE2 4.07Å; F938-D940 PolarHBondContact O-N 2.8Å
939	P	39.2	Very low	35.7	Very low	83 Å²	83	136.7 Å²	136.7	54%	0.539	71%	0.705	S	S	.	*			trans	-69.5	126.2	171.1	-16.7	31.4	0	0	0	111.1	D941	P939-D941 PolarHBondContact O-N 3.38Å
940	D	41.1	Very low	35.4	Very low	146 Å²	146	135.9 Å²	135.9	78%	0.781	71%	0.713	S	S	*	*			trans	-74	112.4	173.4	-65.3	-66.2	0	0	0	111.2	F938 K942	F938-D940 PolarHBondContact O-N 2.8Å; D940-K942 PolarHBondContact O-N 2.78Å
941	D	38.5	Very low	34.8	Very low	153 Å²	153	135.2 Å²	135.2	82%	0.818	72%	0.724	S	S	*	*			trans	-74.2	115.3	168.4	-83.8	-33.4	0	0	0	110.3	P939 K943	P939-D941 PolarHBondContact O-N 3.38Å; D941-K943 PolarHBondContact O-N 2.7Å
942	K	35.3	Very low	34.5	Very low	198 Å²	198	138.8 Å²	138.8	86%	0.861	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-67.6	125.2	-176.4	-64.7	-177.1	179.6	-177.5	0	111.2	D940	D940-K942 PolarHBondContact O-N 2.78Å
943	K	32.7	Very low	34.3	Very low	197 Å²	197	141.4 Å²	141.4	86%	0.857	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-71.6	138.9	164.9	-64.7	177.5	-178.7	174.5	0	109.8	D941	D941-K943 PolarHBondContact O-N 2.7Å
944	H	33.8	Very low	34.3	Very low	192 Å²	192	144.3 Å²	144.3	89%	0.889	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-84.7	136.4	157.7	-88.6	-96.3	0	0	0	109.6
945	E	27	Very low	33.8	Very low	164 Å²	164	146.8 Å²	146.8	77%	0.766	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-91.1	149.9	174.7	-60.6	-176.3	118.1	0	0	111.2
946	L	31.7	Very low	33.5	Very low	177 Å²	177	152.2 Å²	152.2	93%	0.927	76%	0.764	S	S	*	*			trans	-138.3	146.1	154.1	-84.8	175.2	0	0	0	108.1
947	H	32.2	Very low	32.9	Very low	171 Å²	171	152.1 Å²	152.1	79%	0.792	78%	0.779	S	S	*	*			trans	-87.3	157.2	-150.4	-77.8	-108.5	0	0	0	116.9
948	S	29.3	Very low	32.8	Very low	113 Å²	113	151.7 Å²	151.7	79%	0.79	79%	0.789	S	S	*	*			trans	-73.1	161.7	173.8	-47.8	0	0	0	0	114.3
949	P	33.3	Very low	32.2	Very low	123 Å²	123	153.9 Å²	153.9	80%	0.799	80%	0.801	S	S	*	*				-134.5	169.9	107.1	10.7	11.8	0	0	0	113.2
950	S	32.8	Very low	31.9	Very low	107 Å²	107	156.1 Å²	156.1	75%	0.748	81%	0.813	S	S	*	*			cis	-163.7	142.6	-15.6	48.8	0	0	0	0	112.6
951	S	28.3	Very low	31.3	Very low	111 Å²	111	152.2 Å²	152.2	78%	0.776	81%	0.807	S	S	*	*			trans	6.4	133.7	148.2	-46.5	0	0	0	0	123.3
952	I	30.6	Very low	31.1	Very low	168 Å²	168	154.6 Å²	154.6	86%	0.862	81%	0.813	S	S	*	*				-176.7	127	128.1	-92.4	152.9	0	0	0	109.6
953	P	29.9	Very low	30.9	Very low	112 Å²	112	152.8 Å²	152.8	73%	0.727	81%	0.808	S	S	*	*			trans	-137.2	128.5	178.5	37.9	-20.9	0	0	0	117.2
954	Y	29.6	Very low	30.7	Very low	200 Å²	200	153.5 Å²	153.5	78%	0.784	81%	0.805	S	S	*	*			trans	-155.9	152.5	170.3	-99.9	-104	0	0	0	108.2
955	R	29.6	Very low	30.9	Very low	212 Å²	212	149.1 Å²	149.1	80%	0.8	79%	0.794	S	S	*	*			cis	-157.4	168.7	-18.4	-133.1	-169.1	-159	-173.4	6.8	107.9
956	H	27.5	Very low	31	Very low	187 Å²	187	146 Å²	146	87%	0.866	79%	0.79	S	S	*	*			trans	-86.8	151.5	172.2	-81.2	-84.7	0	0	0	113.3
957	S	28.1	Very low	31.1	Very low	121 Å²	121	144 Å²	144	85%	0.846	78%	0.781	S	S	*	*			trans	-160.7	146.7	134.3	-93.1	0	0	0	0	110.9
958	P	34.2	Very low	31.4	Very low	117 Å²	117	141.2 Å²	141.2	76%	0.76	78%	0.776	S	S	*	*			trans	-114.1	167.4	176.9	41.1	-32.5	0	0	0	113.6
959	E	31.2	Very low	31.4	Very low	179 Å²	179	143.3 Å²	143.3	84%	0.836	78%	0.777	S	S	*	*			trans	-173.6	166.6	133.7	-111.2	-166.6	125.3	0	0	114.6
960	V	33	Very low	31.2	Very low	130 Å²	130	145 Å²	145	79%	0.788	78%	0.778	S	S	*	*			trans	27.3	133.4	156.5	-176.1	0	0	0	0	120.2
961	G	29.4	Very low	31	Very low	64 Å²	64	149.3 Å²	149.3	66%	0.66	79%	0.786	S	S	*	*			cis	133.3	117.4	-6	0	0	0	0	0	114.3
962	Q	34.5	Very low	31.1	Very low	203 Å²	203	153.1 Å²	153.1	95%	0.949	79%	0.789	S	S	*	*			trans	-153.3	155.7	162.5	-114.1	164.2	13.2	0	0	112.4
963	Q	29.6	Very low	31	Very low	160 Å²	160	155.8 Å²	155.8	75%	0.748	79%	0.79	S	S	*	*			trans	-105.8	171.8	-169.1	-62	179.6	5.6	0	0	109.2
964	R	30	Very low	30.9	Very low	212 Å²	212	159.7 Å²	159.7	80%	0.8	80%	0.795	S	S	*	*			cis	-178.1	-170.8	-7.2	-111.3	-179.6	-169.8	-173	7.6	105.2
965	P	36.6	Very low	30.9	Very low	101 Å²	101	157.9 Å²	157.9	66%	0.656	80%	0.799	S	S	*	*			cis	-128.4	-175.3	-40.9	32.8	-13.3	0	0	0	112.2
966	S	30.4	Very low	30.8	Very low	98 Å²	98	155.3 Å²	155.3	69%	0.685	80%	0.8	S	S	*	*			trans	55.3	139.7	150.7	42.9	0	0	0	0	120.5
967	D	33.5	Very low	30.9	Very low	136 Å²	136	154.5 Å²	154.5	73%	0.727	80%	0.802	S	S	*	*			cis	-135.6	146.2	26.3	-105.6	-53.2	0	0	0	117
968	T	37.8	Very low	30.9	Very low	112 Å²	112	159.4 Å²	159.4	69%	0.687	80%	0.803	S	S	*	*			trans	8.3	148.7	147.1	56.8	0	0	0	0	121.6
969	L	28.6	Very low	30.7	Very low	156 Å²	156	163.7 Å²	163.7	82%	0.817	81%	0.81	S	S	*	*			cis	-160.3	173.1	-0.3	-119.5	167.9	0	0	0	111.6
970	I	29.8	Very low	30.6	Very low	160 Å²	160	158.5 Å²	158.5	82%	0.821	80%	0.804	S	S	*	*			trans	64.9	71.3	173.1	-35.7	-176.1	0	0	0	117.7
971	E	29.4	Very low	30.6	Very low	197 Å²	197	158.6 Å²	158.6	92%	0.921	81%	0.806	S	S	*	*			trans	-146	78.7	146.8	-166.7	172.6	-130.9	0	0	110.8
972	K	28.9	Very low	30.6	Very low	191 Å²	191	162.2 Å²	162.2	83%	0.83	81%	0.81	S	S	*	*			trans	-157.4	56.2	-176.4	-146.2	177.8	-173	-177.8	0	117
973	Y	28.6	Very low	30.3	Very low	223 Å²	223	158 Å²	158	88%	0.875	80%	0.798	S	S	*	*			trans	-145.5	71.9	161.6	-94.2	-64.2	0	0	0	112.8
974	K	29.7	Very low	30.4	Very low	195 Å²	195	158.2 Å²	158.2	85%	0.848	80%	0.799	S	S	*	*			trans	-138.3	159.7	156.1	-74.1	-173.4	176.5	167.5	0	108.5
975	D	29.6	Very low	30.3	Very low	162 Å²	162	155.8 Å²	155.8	87%	0.866	80%	0.8	S	S	*	*	S	Bend	trans	71.6	39.6	174.7	-53.3	-10.5	0	0	0	116.8
976	L	27.6	Very low	29.9	Very low	157 Å²	157	154.3 Å²	154.3	82%	0.822	80%	0.804	S	S	*	*			trans	-126.1	161.3	151.5	-81.2	172.6	0	0	0	110
977	L	28.9	Very low	29.7	Very low	171 Å²	171	154.2 Å²	154.2	90%	0.895	81%	0.809	S	S	*	*	S	Bend	trans	72.9	53.3	-173.3	-52.7	-179.2	0	0	0	116.3
978	Y	27.7	Very low	29.4	Very low	223 Å²	223	152.6 Å²	152.6	88%	0.875	81%	0.808	S	S	*	*			trans	-140.2	134.8	150.9	-133.6	-93.9	0	0	0	110.4
979	K	29.7	Very low	29	Very low	207 Å²	207	156.7 Å²	156.7	90%	0.9	82%	0.816	S	S	*	*			trans	88.7	132.2	-177.1	-55.7	177.5	178.2	179.9	0	117.5
980	G	29.7	Very low	28.7	Very low	70 Å²	70	154.6 Å²	154.6	72%	0.722	82%	0.815	S	S	*	*			trans	102.6	131.5	166.1	0	0	0	0	0	114.5
981	T	33.8	Very low	28.5	Very low	133 Å²	133	155.2 Å²	155.2	82%	0.816	82%	0.819	S	S	*	*			cis	-156.9	147.2	-8.7	32.3	0	0	0	0	111.1
982	N	28.6	Very low	28.1	Very low	140 Å²	140	156.4 Å²	156.4	75%	0.749	82%	0.815	S	S	*	*			trans	26.8	108.1	147	-69.7	1.9	0	0	0	119.4
983	T	28.2	Very low	27.8	Very low	115 Å²	115	153.2 Å²	153.2	71%	0.706	81%	0.811	S	S	*	*				62.7	120.9	86	64.9	0	0	0	0	116.6
984	Q	31	Very low	27.6	Very low	164 Å²	164	150.2 Å²	150.2	77%	0.766	81%	0.805	S	S	*	*				172.9	145.1	108.2	-95	-173.5	36.8	0	0	112.9
985	I	28.8	Very low	27.4	Very low	160 Å²	160	150.3 Å²	150.3	82%	0.821	81%	0.806	S	S	*	*			trans	60.9	139.9	152.7	-59.1	164.1	0	0	0	117.1
986	G	28.7	Very low	27.2	Very low	71 Å²	71	146.5 Å²	146.5	73%	0.732	81%	0.805	S	S	*	*			cis	-164.9	166.4	0.2	0	0	0	0	0	111.9
987	A	26.3	Very low	27	Very low	96 Å²	96	142.7 Å²	142.7	79%	0.793	80%	0.803	S	S	*	*			trans	-86.2	151.5	-169.6	0	0	0	0	0	114.4
988	S	26.8	Very low	27	Very low	102 Å²	102	146.5 Å²	146.5	71%	0.713	81%	0.806	S	S	*	*				178.7	140.7	117.9	-86.3	0	0	0	0	116.7
989	K	29.4	Very low	27.3	Very low	197 Å²	197	144.9 Å²	144.9	86%	0.857	80%	0.798	S	S	*	*			trans	57.6	109.2	140.3	-63.6	173	-177.2	175.6	0	120.1
990	S	21.9	Very low	27.4	Very low	113 Å²	113	141 Å²	141	79%	0.79	79%	0.794	S	S	*	*			trans	-51.4	141.4	154.3	172.9	0	0	0	0	113.2
991	L	24.3	Very low	27.3	Very low	172 Å²	172	142.9 Å²	142.9	90%	0.901	79%	0.788	S	S	*	*			trans	-140.8	151.9	141.9	-144.6	80.3	0	0	0	110.4
992	R	22	Very low	27	Very low	223 Å²	223	144.7 Å²	144.7	84%	0.842	79%	0.79	S	S	*	*			trans	-107.4	138.7	176.8	170	-162.3	-65.6	160.7	-3.1	107.8
993	V	23.4	Very low	27.1	Very low	124 Å²	124	140.7 Å²	140.7	75%	0.752	78%	0.782	S	S	*	*			trans	174.1	131.5	143.2	145.3	0	0	0	0	113
994	H	24.7	Very low	27.1	Very low	160 Å²	160	141.3 Å²	141.3	74%	0.741	79%	0.786	S	S	*	*			trans	41	133	152.7	-71.8	-113.2	0	0	0	125.5
995	F	24.6	Very low	26.9	Very low	197 Å²	197	141.3 Å²	141.3	86%	0.864	79%	0.79	S	S	*	*			trans	4.8	131.6	141.6	-64.5	-89.7	0	0	0	121
996	G	24.8	Very low	26.9	Very low	82 Å²	82	138.4 Å²	138.4	85%	0.845	78%	0.784	S	S	*	*			trans	143.6	120.8	168.1	0	0	0	0	0	109.3
997	G	24.8	Very low	26.9	Very low	77 Å²	77	138.4 Å²	138.4	79%	0.794	78%	0.777	S	S	*	*			cis	122	68.6	5.9	0	0	0	0	0	111.5
998	R	27.3	Very low	27	Very low	250 Å²	250	141 Å²	141	94%	0.943	78%	0.778	S	S	*	*			trans	-165.9	132.8	165.8	-105.9	164.2	-141.3	-112.4	3.7	110.7
999	R	33.9	Very low	27.2	Very low	190 Å²	190	142.3 Å²	142.3	72%	0.717	77%	0.773	S	S	*	*			trans	-83.4	162.4	156.2	-104.2	-163.9	178.9	-178.1	-3.4	109.5	D1001	R999-D1001 VanDerWaalsContact CD-CG 3.45Å; R999-D1001 WeakPolarHBondContact CD-OD1 3.43Å; R999-D1001 IonicContact CZ-OD1 2.83Å; R999-D1001 IonicContact NE-OD1 2.69Å; R999-D1001 IonicContact NH1-OD1 2.68Å; R999-D1001 PolarHBondContact NH1-OD1 3.39Å
1000	P	31.9	Very low	27.2	Very low	124 Å²	124	140.5 Å²	140.5	81%	0.805	77%	0.765	S	S	*	*				-100	171.7	104.2	-22.8	36.7	0	0	0	115.5
1001	D	28.5	Very low	27.5	Very low	111 Å²	111	140.1 Å²	140.1	59%	0.594	76%	0.758	S	S	*	*			trans	-112.6	-122.3	-168.4	-60	-103.9	0	0	0	111.7	R999	R999-D1001 VanDerWaalsContact CD-CG 3.45Å; R999-D1001 WeakPolarHBondContact CD-OD1 3.43Å; R999-D1001 IonicContact CZ-OD1 2.83Å; R999-D1001 IonicContact NE-OD1 2.69Å; R999-D1001 IonicContact NH1-OD1 2.68Å; R999-D1001 PolarHBondContact NH1-OD1 3.39Å
1002	I	28.2	Very low	27.6	Very low	171 Å²	171	139.1 Å²	139.1	88%	0.877	75%	0.749	S	S	*	*			cis	-151.4	155.1	4.4	-161.9	167.8	0	0	0	110.6
1003	G	30.5	Very low	27.9	Very low	55 Å²	55	136.6 Å²	136.6	57%	0.567	74%	0.744	S	S	*	*			trans	129.2	76.4	-178.4	0	0	0	0	0	111.4
1004	T	27.1	Very low	28.1	Very low	128 Å²	128	138 Å²	138	79%	0.785	74%	0.74	S	S	*	*				55.2	108.7	94.9	63.6	0	0	0	0	113.6
1005	L	26.8	Very low	28.2	Very low	165 Å²	165	133.3 Å²	133.3	86%	0.864	73%	0.725	S	S	*	*			cis	-132.6	-161.1	-5.7	-71.5	169.5	0	0	0	107.6
1006	S	29.8	Very low	28.6	Very low	99 Å²	99	129.9 Å²	129.9	69%	0.692	71%	0.712	S	S	*	*			cis	-160.2	164.8	10.2	-143.6	0	0	0	0	106.8
1007	A	27.1	Very low	29	Very low	71 Å²	71	131.6 Å²	131.6	59%	0.587	70%	0.701	S	S	*	*			cis	65.2	113.2	29.7	0	0	0	0	0	113.9
1008	D	29.2	Very low	29.1	Very low	150 Å²	150	132 Å²	132	80%	0.802	69%	0.692	S	S	*	*			cis	-152.8	167.7	7.2	-88.4	-41.7	0	0	0	108.8
1009	E	30.8	Very low	29.4	Very low	130 Å²	130	127 Å²	127	61%	0.607	69%	0.69	S	S	*	*			cis	-159.1	158.9	5.2	-128.8	-176.3	160.4	0	0	110.6
1010	K	28.9	Very low	29.1	Very low	159 Å²	159	123.7 Å²	123.7	69%	0.691	69%	0.686	S	S	*	*			trans	21.2	141.1	143.1	-62.8	163.9	-164.9	163.2	0	120.4
1011	T	28.7	Very low	29.1	Very low	105 Å²	105	124.4 Å²	124.4	64%	0.644	69%	0.687	S	S	*	*			cis	-168.5	-162	4.4	20.3	0	0	0	0	108.3
1012	E	27.7	Very low	29.2	Very low	151 Å²	151	125.1 Å²	125.1	71%	0.706	69%	0.691	S	S	*	*			cis	-168.5	166.3	4.7	-120.6	152.7	-84.3	0	0	107.2
1013	F	26.3	Very low	29.2	Very low	170 Å²	170	128.6 Å²	128.6	75%	0.746	69%	0.693	S	S	*	*			cis	-153.1	-79.6	-13.5	-144.7	-172.1	0	0	0	115.5
1014	F	27.7	Very low	29.2	Very low	152 Å²	152	134.4 Å²	134.4	67%	0.667	71%	0.711	S	S	*	*			trans	-146.6	163.7	-169.8	-77	-91	0	0	0	110.1
1015	S	28	Very low	29.2	Very low	62 Å²	62	133 Å²	133	43%	0.434	71%	0.706	S	S	.	*			cis	-162.6	147.3	41.2	165.5	0	0	0	0	115.7	R1071	S1015-R1071 VanDerWaalsContact OG-CZ 3.24Å; S1015-R1071 PolarHBondContact OG-NE 3.43Å; S1015-R1071 PolarHBondContact OG-NH2 2.83Å
1016	H	31.6	Very low	29.3	Very low	126 Å²	126	129.5 Å²	129.5	58%	0.583	70%	0.695	S	S	*	*			trans	-10.8	149.8	147.3	-69.6	-113.4	0	0	0	120.1	Q1070	H1016-Q1070 PolarHBondContact O-NE2 3.46Å
1017	N	33.4	Very low	29.4	Very low	117 Å²	117	131.2 Å²	131.2	63%	0.626	70%	0.697	S	S	*	*				-134.4	163.5	119.5	-152	-3.6	0	0	0	111.5	Q1070	N1017-Q1070 VanDerWaalsContact CB-NE2 3.29Å; N1017-Q1070 VanDerWaalsContact CG-CD 3.43Å; N1017-Q1070 VanDerWaalsContact ND2-CD 3.28Å; N1017-Q1070 PolarHBondContact ND2-NE2 3.49Å; N1017-Q1070 PolarHBondContact ND2-OE1 2.77Å; N1017-Q1070 PolarHBondContact OD1-NE2 3.19Å
1018	S	28.6	Very low	29.5	Very low	86 Å²	86	135.9 Å²	135.9	60%	0.601	71%	0.706	S	S	*	*			trans	-142.3	147.2	-179.3	-55.8	0	0	0	0	110.9
1019	V	33	Very low	29.5	Very low	146 Å²	146	133.9 Å²	133.9	89%	0.885	70%	0.704	S	S	*	*			trans	-114.2	134.2	168.5	180	0	0	0	0	108.1
1020	N	26.8	Very low	29.4	Very low	120 Å²	120	132.8 Å²	132.8	64%	0.642	71%	0.71	S	S	*	*			trans	-134.9	134.4	-172.4	-177.1	20.7	0	0	0	110.2	N1022	N1020-N1022 PolarHBondContact ND2-OD1 2.87Å; N1020-N1022 VanDerWaalsContact ND2-OD1 3.14Å; N1020-N1022 PolarHBondContact OD1-OD1 2.88Å
1021	V	33	Very low	29.4	Very low	138 Å²	138	133.4 Å²	133.4	84%	0.836	72%	0.716	S	S	*	*			trans	-134.8	111.3	168.8	-175.7	0	0	0	0	107.6
1022	N	31.1	Very low	29.5	Very low	126 Å²	126	136.2 Å²	136.2	67%	0.674	72%	0.721	S	S	*	*			trans	-75.6	146.2	-169.9	-70.2	-40.3	0	0	0	112.8	N1020	N1020-N1022 PolarHBondContact ND2-OD1 2.87Å; N1020-N1022 VanDerWaalsContact ND2-OD1 3.14Å; N1020-N1022 PolarHBondContact OD1-OD1 2.88Å
1023	R	26.2	Very low	29.5	Very low	245 Å²	245	134 Å²	134	93%	0.925	72%	0.718	S	S	*	*			trans	-77.1	138.6	151.7	-70.6	179.9	174.5	-178	-2.3	109.4
1024	L	30.9	Very low	29.5	Very low	177 Å²	177	132.1 Å²	132.1	93%	0.927	72%	0.716	S	S	*	*			trans	-133.6	162.7	153.5	-86.5	173.4	0	0	0	109.2
1025	S	28.2	Very low	29.7	Very low	98 Å²	98	133 Å²	133	69%	0.685	72%	0.722	S	S	*	*			trans	-132.7	154.5	-165.4	172.7	0	0	0	0	110.9
1026	S	29	Very low	29.7	Very low	91 Å²	91	134.2 Å²	134.2	64%	0.636	73%	0.73	S	S	*	*			trans	54.9	117.9	153.5	49.9	0	0	0	0	116.8
1027	N	30.5	Very low	29.5	Very low	136 Å²	136	134.9 Å²	134.9	73%	0.727	74%	0.738	S	S	*	*				-173.5	157.3	69.2	-95.9	-38.2	0	0	0	111.7
1028	H	31	Very low	29.3	Very low	168 Å²	168	134.5 Å²	134.5	78%	0.778	74%	0.744	S	S	*	*			trans	42.6	144.8	151.6	-71.5	-84.6	0	0	0	121
1029	S	29.1	Very low	29.2	Very low	108 Å²	108	134.1 Å²	134.1	76%	0.755	75%	0.754	S	S	*	*			cis	-151.6	170	7.5	-132.7	0	0	0	0	111.4
1030	S	27.8	Very low	29	Very low	107 Å²	107	133 Å²	133	75%	0.748	75%	0.752	S	S	*	*			trans	-71.1	155	178.2	-44.4	0	0	0	0	113.5
1031	Q	29	Very low	28.9	Very low	173 Å²	173	134.3 Å²	134.3	81%	0.808	76%	0.76	S	S	*	*				-179.8	139.8	111.7	-93.6	177.6	15.8	0	0	112.4
1032	H	30.1	Very low	28.8	Very low	164 Å²	164	132.1 Å²	132.1	76%	0.759	76%	0.756	S	S	*	*			trans	40.6	142.1	134.4	-67.1	-115.4	0	0	0	120.9
1033	T	28.6	Very low	28.4	Very low	104 Å²	104	136.1 Å²	136.1	64%	0.638	76%	0.763	S	S	*	*			cis	-165	159.7	3.9	8.9	0	0	0	0	113.2
1034	N	27	Very low	28.6	Very low	130 Å²	130	132 Å²	132	70%	0.695	76%	0.758	S	S	*	*			trans	30	131.1	142.4	-53.2	-5.4	0	0	0	122
1035	H	31.3	Very low	28.3	Very low	171 Å²	171	134 Å²	134	79%	0.792	76%	0.755	S	S	*	*				-164.8	143.5	104	-97.7	-60.8	0	0	0	108.5
1036	S	27.2	Very low	28.3	Very low	88 Å²	88	134.4 Å²	134.4	62%	0.615	76%	0.758	S	S	*	*				57.3	131.5	79.2	-64.9	0	0	0	0	113.2
1037	D	28.9	Very low	28.2	Very low	140 Å²	140	136.9 Å²	136.9	75%	0.749	76%	0.764	S	S	*	*			cis	-158.4	179	5	-123.9	-53.6	0	0	0	115.2
1038	S	27.3	Very low	28.2	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	75%	0.751	S	S	*	*			trans	-4.9	146.9	166	63.5	0	0	0	0	124.1
1039	G	28.2	Very low	28.1	Very low	78 Å²	78	132.9 Å²	132.9	80%	0.804	75%	0.748	S	S	*	*			trans	103.7	152.1	150.8	0	0	0	0	0	116.1
1040	S	28.6	Very low	28.1	Very low	122 Å²	122	131.7 Å²	131.7	85%	0.853	73%	0.732	S	S	*	*			cis	-159.5	164.8	-18	45.8	0	0	0	0	109
1041	D	24.8	Very low	28	Very low	148 Å²	148	132.6 Å²	132.6	79%	0.791	74%	0.737	S	S	*	*			trans	-67.8	137.9	-173.1	-65.9	-80.2	0	0	0	114.6
1042	A	29.2	Very low	27.9	Very low	92 Å²	92	133.9 Å²	133.9	76%	0.76	74%	0.74	S	S	*	*			trans	-142.6	88.4	168.7	0	0	0	0	0	110.5	L1044	A1042-L1044 PolarHBondContact O-N 2.71Å
1043	Y	24.5	Very low	27.7	Very low	211 Å²	211	132 Å²	132	83%	0.827	74%	0.74	S	S	*	*			trans	-75.2	111	172.3	-86	-97.8	0	0	0	110.4
1044	L	29.1	Very low	27.6	Very low	157 Å²	157	132.2 Å²	132.2	82%	0.822	74%	0.741	S	S	*	*			trans	-113.7	114	165.5	-75.8	174.6	0	0	0	110.6	A1042	A1042-L1044 PolarHBondContact O-N 2.71Å
1045	Y	24.2	Very low	27.6	Very low	220 Å²	220	132.7 Å²	132.7	86%	0.863	74%	0.742	S	S	*	*			trans	-67.4	131.1	166.3	-111	-104.3	0	0	0	109.2
1046	S	29.6	Very low	27.3	Very low	106 Å²	106	130 Å²	130	74%	0.741	74%	0.738	S	S	*	*			trans	-153.7	134.4	171.1	-70.9	0	0	0	0	109.9
1047	D	27.2	Very low	27.3	Very low	143 Å²	143	130.9 Å²	130.9	77%	0.765	75%	0.745	S	S	*	*			trans	-70.5	137	-170.3	-70.1	-65.1	0	0	0	113.6
1048	P	29.1	Very low	27.2	Very low	68 Å²	68	130.8 Å²	130.8	44%	0.442	75%	0.749	S	S	.	*			trans	-103.1	58.6	173	38	-31.7	0	0	0	112.8	P281	P281-P1048 HydrophobicContact CG-CB 3.97Å
1049	E	28.7	Very low	27.2	Very low	153 Å²	153	131.7 Å²	131.7	72%	0.715	75%	0.754	S	S	*	*			trans	-97.8	140.4	158.9	-74.2	-141.5	145.8	0	0	111.1
1050	L	29.8	Very low	27.2	Very low	83 Å²	83	131.3 Å²	131.3	44%	0.435	75%	0.75	S	S	.	*			trans	70	64.9	161.4	-57.8	141.9	0	0	0	118.7
1051	C	26.6	Very low	27.2	Very low	125 Å²	125	131.3 Å²	131.3	85%	0.845	75%	0.75	S	S	*	*			trans	-106	74	157.4	-76.2	0	0	0	0	113
1052	F	25.6	Very low	27.5	Very low	201 Å²	201	130.2 Å²	130.2	88%	0.882	75%	0.754	S	S	*	*			trans	-97.7	81.1	160.9	-88.2	-81.5	0	0	0	109.9	V1054	F1052-V1054 PolarHBondContact O-N 3.1Å
1053	T	26.1	Very low	27.6	Very low	123 Å²	123	133.7 Å²	133.7	76%	0.755	76%	0.755	S	S	*	*			trans	-76.2	111.3	175.7	-56	0	0	0	0	110.2	I1055	T1053-I1055 PolarHBondContact O-N 3.14Å
1054	V	25.9	Very low	27.8	Very low	109 Å²	109	129.5 Å²	129.5	66%	0.661	76%	0.756	S	S	*	*			trans	-81.3	113.5	176.3	-177	0	0	0	0	109.3	F1052 T1056	F1052-V1054 PolarHBondContact O-N 3.1Å; V1054-T1056 HydrophobicContact CG1-CG2 3.89Å; V1054-T1056 PolarHBondContact O-N 2.94Å
1055	I	26.9	Very low	27.9	Very low	140 Å²	140	127.4 Å²	127.4	72%	0.718	76%	0.755	S	S	*	*			trans	-82.7	97.3	170.9	-58.4	178.7	0	0	0	108.7	T1053 S1057	T1053-I1055 PolarHBondContact O-N 3.14Å; I1055-S1057 PolarHBondContact O-N 3.35Å
1056	T	24.9	Very low	28.1	Very low	115 Å²	115	123 Å²	123	71%	0.706	75%	0.751	S	S	*	*			trans	-83.9	90.1	172.9	52.3	0	0	0	0	111	V1054 T1058	V1054-T1056 HydrophobicContact CG1-CG2 3.89Å; V1054-T1056 PolarHBondContact O-N 2.94Å; T1056-T1058 PolarHBondContact O-N 3.37Å
1057	S	27.8	Very low	28.2	Very low	107 Å²	107	122.9 Å²	122.9	75%	0.748	75%	0.75	S	S	*	*			trans	-78.5	100.6	170.5	59.8	0	0	0	0	110.9	I1055 C1059	I1055-S1057 PolarHBondContact O-N 3.35Å; S1057-C1059 PolarHBondContact O-N 3.43Å
1058	T	27.8	Very low	28.4	Very low	138 Å²	138	120.5 Å²	120.5	85%	0.847	75%	0.75	S	S	*	*			trans	-67.8	117.9	174.4	48.2	0	0	0	0	111.2	T1056	T1056-T1058 PolarHBondContact O-N 3.37Å
1059	C	26.1	Very low	28.6	Very low	127 Å²	127	122.2 Å²	122.2	86%	0.858	76%	0.761	S	S	*	*			trans	-87.5	109.2	176.7	-161.3	0	0	0	0	110.4	S1057	S1057-C1059 PolarHBondContact O-N 3.43Å
1060	G	29.5	Very low	28.8	Very low	70 Å²	70	119.6 Å²	119.6	72%	0.722	75%	0.749	S	S	*	*			trans	-82	122	178.2	0	0	0	0	0	112.4
1061	S	27.7	Very low	28.8	Very low	122 Å²	122	123.4 Å²	123.4	85%	0.853	76%	0.758	S	S	*	*			trans	-71.9	128.5	179.8	-57.6	0	0	0	0	112.5
1062	S	32.1	Very low	29	Very low	124 Å²	124	123 Å²	123	87%	0.867	75%	0.751	S	S	*	*			trans	-153.2	130.7	165.9	-71.5	0	0	0	0	109.1
1063	Q	29.4	Very low	29.1	Very low	166 Å²	166	120.6 Å²	120.6	78%	0.776	75%	0.747	S	S	*	*			trans	-109.6	137.3	-170	-67.9	-174.4	-6.5	0	0	113
1064	S	29.5	Very low	29.1	Very low	122 Å²	122	122.5 Å²	122.5	85%	0.853	75%	0.747	S	S	*	*			trans	67.2	152.1	161	78.2	0	0	0	0	117.1
1065	S	31.5	Very low	29.2	Very low	114 Å²	114	124.1 Å²	124.1	80%	0.797	75%	0.751	S	S	*	*			cis	-147.6	175.9	7.4	58.6	0	0	0	0	113.7
1066	T	28.9	Very low	29.3	Very low	127 Å²	127	122.6 Å²	122.6	78%	0.779	75%	0.75	S	S	*	*			trans	-69	162	179.2	43.9	0	0	0	0	115.6
1067	S	30.2	Very low	29.6	Very low	103 Å²	103	124.3 Å²	124.3	72%	0.72	75%	0.75	S	S	*	*			cis	179.1	149.4	-12.9	55	0	0	0	0	114.2
1068	A	31.9	Very low	29.6	Very low	93 Å²	93	127.6 Å²	127.6	77%	0.769	75%	0.752	S	S	*	*			trans	81.5	171.1	147	0	0	0	0	0	120.6
1069	P	33.8	Very low	29.7	Very low	105 Å²	105	128.8 Å²	128.8	68%	0.682	75%	0.747	S	S	*	*				-147.6	166.1	-106.4	40.4	-17.4	0	0	0	122.1
1070	Q	32.3	Very low	29.7	Very low	97 Å²	97	127.1 Å²	127.1	45%	0.453	74%	0.737	S	S	.	*			trans	65	134.8	141.2	-80.3	175.1	-108.3	0	0	127	H1016 N1017	H1016-Q1070 PolarHBondContact O-NE2 3.46Å; N1017-Q1070 VanDerWaalsContact CB-NE2 3.29Å; N1017-Q1070 VanDerWaalsContact CG-CD 3.43Å; N1017-Q1070 VanDerWaalsContact ND2-CD 3.28Å; N1017-Q1070 PolarHBondContact ND2-NE2 3.49Å; N1017-Q1070 PolarHBondContact ND2-OE1 2.77Å; N1017-Q1070 PolarHBondContact OD1-NE2 3.19Å
1071	R	31	Very low	29.7	Very low	164 Å²	164	131.2 Å²	131.2	62%	0.619	74%	0.741	S	S	*	*				-168	-173	111.3	-112.7	-175	178.1	-163.3	-2.9	113.7	S1015	S1015-R1071 VanDerWaalsContact OG-CZ 3.24Å; S1015-R1071 PolarHBondContact OG-NE 3.43Å; S1015-R1071 PolarHBondContact OG-NH2 2.83Å
1072	T	29.4	Very low	29.7	Very low	116 Å²	116	131.3 Å²	131.3	71%	0.712	74%	0.737	S	S	*	*			trans	-148.5	152.8	-149.8	-49	0	0	0	0	115.4
1073	L	27.9	Very low	29.8	Very low	150 Å²	150	130.8 Å²	130.8	79%	0.785	73%	0.73	S	S	*	*			trans	156.5	160.7	149.8	-89.7	175.4	0	0	0	111.1
1074	Q	26.1	Very low	29.8	Very low	163 Å²	163	128.4 Å²	128.4	76%	0.762	73%	0.732	S	S	*	*			cis	-147.6	-138.8	-8.4	-159	163.8	-39	0	0	111.3
1075	L	27.4	Very low	29.9	Very low	143 Å²	143	126.9 Å²	126.9	75%	0.749	73%	0.727	S	S	*	*			trans	-150.3	179.5	-172.7	-119.7	83.9	0	0	0	109.6
1076	P	30.8	Very low	29.8	Very low	108 Å²	108	126.3 Å²	126.3	70%	0.701	73%	0.728	S	S	*	*			cis	-144.3	163.4	25.3	42.9	-22.5	0	0	0	120.9
1077	Q	29.7	Very low	29.8	Very low	151 Å²	151	129.9 Å²	129.9	71%	0.706	73%	0.733	S	S	*	*			trans	25.1	142.8	141.4	-60.8	179.9	-27	0	0	124.6
1078	F	28.4	Very low	29.8	Very low	177 Å²	177	130.2 Å²	130.2	78%	0.776	74%	0.736	S	S	*	*				-165.6	175	106	-107.4	-72.6	0	0	0	114.4
1079	H	29.8	Very low	29.8	Very low	162 Å²	162	130.6 Å²	130.6	75%	0.75	73%	0.733	S	S	*	*			trans	-54.6	171.8	-171.3	-68.5	-9.8	0	0	0	119.4
1080	S	26.4	Very low	29.7	Very low	93 Å²	93	132.9 Å²	132.9	65%	0.65	74%	0.739	S	S	*	*			cis	-178.5	-176.3	-18.7	58.5	0	0	0	0	111.4
1081	I	28.9	Very low	29.9	Very low	156 Å²	156	135.9 Å²	135.9	80%	0.8	75%	0.751	S	S	*	*			trans	101.8	141.6	163.9	-60	156.3	0	0	0	117.3
1082	T	27.6	Very low	30.1	Very low	124 Å²	124	132.8 Å²	132.8	76%	0.761	75%	0.754	S	S	*	*			trans	-139.4	-161.8	-178	59.6	0	0	0	0	107.6
1083	P	34.6	Very low	30.4	Very low	112 Å²	112	134.1 Å²	134.1	73%	0.727	75%	0.75	S	S	*	*			cis	-137.1	-168.7	-10.8	38.8	-18.2	0	0	0	115.2
1084	S	30	Very low	31	Very low	117 Å²	117	131.8 Å²	131.8	82%	0.818	74%	0.739	S	S	*	*			trans	79.2	154.3	146.3	-147	0	0	0	0	119.9
1085	A	31	Very low	31.4	Very low	90 Å²	90	130.8 Å²	130.8	74%	0.744	73%	0.732	S	S	*	*			cis	-171.1	138.6	-45.4	0	0	0	0	0	110
1086	A	29.8	Very low	32.1	Very low	101 Å²	101	129 Å²	129	84%	0.835	72%	0.722	S	S	*	*			trans	-159.4	134.8	161.4	0	0	0	0	0	115.1
1087	K	29.6	Very low	32.5	Very low	202 Å²	202	127.3 Å²	127.3	88%	0.878	71%	0.707	S	S	*	*			trans	-17.9	158.8	150.2	-58.2	171	-174	177.7	0	118
1088	S	28.8	Very low	33	Very low	110 Å²	110	124.4 Å²	124.4	77%	0.769	70%	0.696	S	S	*	*			cis	178.8	133.1	-19.5	52.6	0	0	0	0	110.3
1089	S	32.6	Very low	33.5	Very low	102 Å²	102	119.6 Å²	119.6	71%	0.713	68%	0.678	S	S	*	*			trans	-160.7	160.3	154.1	68	0	0	0	0	112.2	K1091	S1089-K1091 PolarHBondContact O-N 2.68Å
1090	N	32.6	Very low	34	Very low	152 Å²	152	115.8 Å²	115.8	81%	0.813	66%	0.663	S	S	*	*			trans	-80.7	108.5	-167.3	-60.3	-26.1	0	0	0	111.8
1091	K	36	Very low	34.5	Very low	161 Å²	161	116.3 Å²	116.3	70%	0.7	66%	0.659	S	S	*	*			trans	-136.6	8.2	171	-71.8	-164.5	172.6	-173	0	115	S1089	S1089-K1091 PolarHBondContact O-N 2.68Å
1092	S	34.2	Very low	34.8	Very low	98 Å²	98	114.9 Å²	114.9	69%	0.685	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-10.8	177	50.7	0	0	0	0	114.1
1093	K	36.6	Very low	35.3	Very low	144 Å²	144	114.2 Å²	114.2	63%	0.626	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87	-54.1	177.9	-155.6	179.5	176.5	-175.6	0	111	F1095 L1096 D1097	K1093-F1095 PolarHBondContact O-N 2.69Å; K1093-L1096 WeakPolarHBondContact O-CA 3.26Å; K1093-L1096 WeakPolarHBondContact O-CB 3.43Å; K1093-L1096 PolarHBondContact O-N 3.38Å; K1093-D1097 PolarHBondContact O-N 2.85Å
1094	D	39.3	Very low	35.3	Very low	102 Å²	102	114.3 Å²	114.3	55%	0.545	63%	0.631	S	S	.	*	H	α-helix	trans	-52.1	-34.6	179.1	-41.2	-10.4	0	0	0	113.5	L1098	D1094-L1098 WeakPolarHBondContact O-CB 3.33Å; D1094-L1098 PolarHBondContact O-N 3Å
1095	F	34.2	Very low	35.5	Very low	142 Å²	142	112.2 Å²	112.2	62%	0.623	61%	0.613	S	S	*	*	H	α-helix	trans	-77.6	-26.9	178.7	-161.7	-92.2	0	0	0	113.5	K1093 L1099	K1093-F1095 PolarHBondContact O-N 2.69Å; F1095-L1099 HydrophobicContact CD1-CD1 3.99Å; F1095-L1099 HydrophobicContact CE1-CD1 3.88Å; F1095-L1099 WeakPolarHBondContact O-CB 3.31Å; F1095-L1099 WeakPolarHBondContact O-CG 3.31Å; F1095-L1099 PolarHBondContact O-N 3.3Å
1096	L	42.2	Very low	35.5	Very low	104 Å²	104	113.3 Å²	113.3	55%	0.545	61%	0.611	S	S	.	*	H	α-helix	trans	-77.6	-39.2	170.9	-87.7	166	0	0	0	111	K1093 L1099 N1100	K1093-L1096 WeakPolarHBondContact O-CA 3.26Å; K1093-L1096 WeakPolarHBondContact O-CB 3.43Å; K1093-L1096 PolarHBondContact O-N 3.38Å; L1096-L1099 WeakPolarHBondContact O-CB 3.41Å; L1096-L1099 PolarHBondContact O-N 2.82Å; L1096-L1099 VanDerWaalsContact O-N 3.14Å; L1096-N1100 PolarHBondContact O-N 3.39Å; L1096-N1100 PolarHBondContact O-ND2 2.93Å
1097	D	40.5	Very low	35.6	Very low	73 Å²	73	114.2 Å²	114.2	39%	0.39	61%	0.606	S	S	.	*	H	α-helix	trans	-69.7	-39.3	177.1	-64.4	-29.3	0	0	0	111.1	K1093 L1099 N1100 D1101	K1093-D1097 PolarHBondContact O-N 2.85Å; D1097-L1099 PolarHBondContact O-N 3.02Å; D1097-N1100 PolarHBondContact O-N 3.36Å; D1097-D1101 PolarHBondContact O-N 2.78Å
1098	L	40.5	Very low	35.7	Very low	90 Å²	90	109.9 Å²	109.9	47%	0.471	60%	0.597	S	S	.	*	H	α-helix	trans	-66.7	-18.6	170.6	-161.5	75.5	0	0	0	113.5	D1094 K1102	D1094-L1098 WeakPolarHBondContact O-CB 3.33Å; D1094-L1098 PolarHBondContact O-N 3Å; L1098-K1102 WeakPolarHBondContact O-CB 3.47Å; L1098-K1102 WeakPolarHBondContact O-CD 3.41Å; L1098-K1102 VanDerWaalsContact O-CG 3.27Å; L1098-K1102 WeakPolarHBondContact O-CG 3.14Å
1099	L	39.1	Very low	35.7	Very low	77 Å²	77	110.3 Å²	110.3	40%	0.403	59%	0.589	S	S	.	*	H	α-helix	trans	-82.7	-43.9	169.5	-89.2	166.9	0	0	0	111.3	F1095 L1096 D1097 K1102 I1103	F1095-L1099 HydrophobicContact CD1-CD1 3.99Å; F1095-L1099 HydrophobicContact CE1-CD1 3.88Å; F1095-L1099 WeakPolarHBondContact O-CB 3.31Å; F1095-L1099 WeakPolarHBondContact O-CG 3.31Å; F1095-L1099 PolarHBondContact O-N 3.3Å; L1096-L1099 WeakPolarHBondContact O-CB 3.41Å; L1096-L1099 PolarHBondContact O-N 2.82Å; L1096-L1099 VanDerWaalsContact O-N 3.14Å; D1097-L1099 PolarHBondContact O-N 3.02Å; L1099-K1102 PolarHBondContact O-N 3.01Å; L1099-I1103 WeakPolarHBondContact O-CB 3.25Å; L1099-I1103 WeakPolarHBondContact O-CD1 3.17Å; L1099-I1103 VanDerWaalsContact O-CG1 3.24Å; L1099-I1103 WeakPolarHBondContact O-CG1 3.14Å; L1099-I1103 PolarHBondContact O-N 3.22Å
1100	N	39.2	Very low	35.6	Very low	81 Å²	81	112 Å²	112	43%	0.433	60%	0.595	S	S	.	*	H	α-helix	trans	-60.4	-49.1	176.5	-72	-32.6	0	0	0	111.4	L1096 D1097 K1102 I1103 I1104	L1096-N1100 PolarHBondContact O-N 3.39Å; L1096-N1100 PolarHBondContact O-ND2 2.93Å; D1097-N1100 PolarHBondContact O-N 3.36Å; N1100-K1102 VanDerWaalsContact C-N 3.29Å; N1100-K1102 PolarHBondContact O-N 2.99Å; N1100-I1103 PolarHBondContact O-N 3.22Å; N1100-I1104 WeakPolarHBondContact O-CB 3.21Å; N1100-I1104 VanDerWaalsContact O-CG1 3.32Å; N1100-I1104 WeakPolarHBondContact O-CG1 3.2Å; N1100-I1104 PolarHBondContact O-N 2.87Å
1101	D	36.1	Very low	35.3	Very low	105 Å²	105	110.2 Å²	110.2	56%	0.561	59%	0.585	S	S	*	*	H	α-helix	trans	-60.8	-37.3	176.9	-87.2	-8.7	0	0	0	112.3	D1097 T1105	D1097-D1101 PolarHBondContact O-N 2.78Å; D1101-T1105 WeakPolarHBondContact O-CB 3.41Å; D1101-T1105 PolarHBondContact O-N 3.01Å; D1101-T1105 PolarHBondContact O-OG1 3.15Å
1102	K	37.2	Very low	35	Very low	126 Å²	126	109.2 Å²	109.2	55%	0.548	59%	0.587	S	S	.	*	H	α-helix	trans	-72.6	-38.4	177.1	-76.4	178.3	-179.1	173.3	0	112.5	L1098 L1099 N1100 T1105 T1106	L1098-K1102 WeakPolarHBondContact O-CB 3.47Å; L1098-K1102 WeakPolarHBondContact O-CD 3.41Å; L1098-K1102 VanDerWaalsContact O-CG 3.27Å; L1098-K1102 WeakPolarHBondContact O-CG 3.14Å; L1099-K1102 PolarHBondContact O-N 3.01Å; N1100-K1102 VanDerWaalsContact C-N 3.29Å; N1100-K1102 PolarHBondContact O-N 2.99Å; K1102-T1105 PolarHBondContact O-N 2.83Å; K1102-T1106 WeakPolarHBondContact O-CB 3.39Å; K1102-T1106 PolarHBondContact O-N 2.73Å; K1102-T1106 PolarHBondContact O-OG1 2.81Å
1103	I	36.3	Very low	34.7	Very low	110 Å²	110	116 Å²	116	56%	0.564	60%	0.6	S	S	*	*	H	α-helix	trans	-65.1	-41.1	175.2	-71.2	165.1	0	0	0	110.7	L1099 N1100 T1107	L1099-I1103 WeakPolarHBondContact O-CB 3.25Å; L1099-I1103 WeakPolarHBondContact O-CD1 3.17Å; L1099-I1103 VanDerWaalsContact O-CG1 3.24Å; L1099-I1103 WeakPolarHBondContact O-CG1 3.14Å; L1099-I1103 PolarHBondContact O-N 3.22Å; N1100-I1103 PolarHBondContact O-N 3.22Å; I1103-T1107 PolarHBondContact O-OG1 3.13Å
1104	I	35.1	Very low	34.3	Very low	114 Å²	114	116.9 Å²	116.9	59%	0.585	61%	0.606	S	S	*	*	H	α-helix	trans	-67.4	-47.2	175.8	-67.8	167.7	0	0	0	110.5	N1100 T1106 T1107	N1100-I1104 WeakPolarHBondContact O-CB 3.21Å; N1100-I1104 VanDerWaalsContact O-CG1 3.32Å; N1100-I1104 WeakPolarHBondContact O-CG1 3.2Å; N1100-I1104 PolarHBondContact O-N 2.87Å; I1104-T1106 VanDerWaalsContact C-N 3.31Å; I1104-T1106 PolarHBondContact O-N 3.46Å; I1104-T1107 PolarHBondContact O-N 3.16Å; I1104-T1107 VanDerWaalsContact O-N 3.13Å
1105	T	34.2	Very low	33.8	Very low	72 Å²	72	122.8 Å²	122.8	44%	0.442	62%	0.622	S	S	.	*	H	α-helix	trans	-62.9	-32.9	-179.9	-59.8	0	0	0	0	113.1	D1101 K1102 T1107 T1108 I1109	D1101-T1105 WeakPolarHBondContact O-CB 3.41Å; D1101-T1105 PolarHBondContact O-N 3.01Å; D1101-T1105 PolarHBondContact O-OG1 3.15Å; K1102-T1105 PolarHBondContact O-N 2.83Å; T1105-T1107 PolarHBondContact O-N 3.37Å; T1105-T1108 PolarHBondContact O-N 2.83Å; T1105-T1108 PolarHBondContact O-OG1 2.82Å; T1105-I1109 HydrophobicContact CG2-CD1 3.84Å
1106	T	31.7	Very low	33.5	Very low	113 Å²	113	120.8 Å²	120.8	69%	0.693	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	-16.8	177.4	-62.5	0	0	0	0	113.5	K1102 I1104	K1102-T1106 WeakPolarHBondContact O-CB 3.39Å; K1102-T1106 PolarHBondContact O-N 2.73Å; K1102-T1106 PolarHBondContact O-OG1 2.81Å; I1104-T1106 VanDerWaalsContact C-N 3.31Å; I1104-T1106 PolarHBondContact O-N 3.46Å
1107	T	31.7	Very low	32.8	Very low	121 Å²	121	118.1 Å²	118.1	74%	0.742	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-7.4	180	-49.6	0	0	0	0	113.2	I1103 I1104 T1105	I1103-T1107 PolarHBondContact O-OG1 3.13Å; I1104-T1107 PolarHBondContact O-N 3.16Å; I1104-T1107 VanDerWaalsContact O-N 3.13Å; T1105-T1107 PolarHBondContact O-N 3.37Å
1108	T	30.9	Very low	32.3	Very low	111 Å²	111	122.7 Å²	122.7	68%	0.681	65%	0.653	S	S	*	*	S	Bend	trans	-120.8	13.1	-171.5	44.2	0	0	0	0	115.7	T1105	T1105-T1108 PolarHBondContact O-N 2.83Å; T1105-T1108 PolarHBondContact O-OG1 2.82Å
1109	I	29.4	Very low	31.6	Very low	119 Å²	119	127.8 Å²	127.8	61%	0.61	68%	0.675	S	S	*	*			trans	-119.7	61.6	-178.1	-48.1	177.8	0	0	0	111.9	T1105	T1105-I1109 HydrophobicContact CG2-CD1 3.84Å
1110	V	29.7	Very low	31.1	Very low	137 Å²	137	128.9 Å²	128.9	83%	0.83	69%	0.689	S	S	*	*	S	Bend	trans	-139.4	37.6	164.7	-157	0	0	0	0	111.8
1111	D	28	Very low	30.7	Very low	114 Å²	114	130.3 Å²	130.3	61%	0.61	71%	0.705	S	S	*	*	S	Bend	trans	-154.6	48.3	176.1	-109.3	-35	0	0	0	110.8	K724	K724-D1111 IonicContact NZ-OD1 3.92Å; K724-D1111 PolarHBondContact NZ-OD1 3.26Å; K724-D1111 IonicContact NZ-OD2 2.85Å; K724-D1111 PolarHBondContact NZ-OD2 3.31Å
1112	N	28.4	Very low	30.1	Very low	140 Å²	140	130.9 Å²	130.9	75%	0.749	72%	0.718	S	S	*	*			trans	-155.3	43	176.2	-112.2	-11.7	0	0	0	114.3
1113	Y	28.5	Very low	29.8	Very low	240 Å²	240	132.8 Å²	132.8	94%	0.941	73%	0.732	S	S	*	*			trans	-109.5	91.5	153.6	-102.6	-78.2	0	0	0	107.9
1114	E	29.1	Very low	29.3	Very low	164 Å²	164	132.6 Å²	132.6	77%	0.766	74%	0.74	S	S	*	*			trans	-62.4	135.7	175.4	-66.5	-176.5	104.8	0	0	110.4	A1116	E1114-A1116 PolarHBondContact O-N 2.95Å
1115	Y	27.4	Very low	29.2	Very low	225 Å²	225	132.2 Å²	132.2	88%	0.882	75%	0.745	S	S	*	*			trans	-79.8	67.3	170.8	-156	-87.1	0	0	0	109.4	G1117	Y1115-G1117 PolarHBondContact O-N 2.88Å
1116	A	27.8	Very low	28.8	Very low	101 Å²	101	136.3 Å²	136.3	84%	0.835	76%	0.764	S	S	*	*			trans	-71.1	67.4	174.6	0	0	0	0	0	110.3	E1114	E1114-A1116 PolarHBondContact O-N 2.95Å
1117	G	28.7	Very low	28.6	Very low	48 Å²	48	135.6 Å²	135.6	50%	0.495	76%	0.763	S	S	.	*			trans	-141.6	48	-169.2	0	0	0	0	0	112.5	Y1115	Y1115-G1117 PolarHBondContact O-N 2.88Å
1118	L	29.4	Very low	28.3	Very low	168 Å²	168	140.8 Å²	140.8	88%	0.88	77%	0.771	S	S	*	*			trans	23.2	123.8	166.1	-73.6	165.6	0	0	0	119.7
1119	Q	26	Very low	28.2	Very low	198 Å²	198	140.3 Å²	140.3	93%	0.925	77%	0.772	S	S	*	*			trans	-68.4	126.6	159.4	-63.9	174.5	-16	0	0	111.1
1120	S	28.9	Very low	28.4	Very low	99 Å²	99	139 Å²	139	69%	0.692	77%	0.773	S	S	*	*			trans	-167.1	93.6	148.7	54.8	0	0	0	0	108.5
1121	S	29.3	Very low	28.5	Very low	112 Å²	112	139.4 Å²	139.4	78%	0.783	77%	0.771	S	S	*	*				64.3	102.6	87.8	71.5	0	0	0	0	113.3	I1123	S1121-I1123 PolarHBondContact O-N 2.88Å
1122	S	25.3	Very low	28.6	Very low	117 Å²	117	141 Å²	141	82%	0.818	78%	0.775	S	S	*	*			trans	-70.9	119.4	170.3	52.1	0	0	0	0	111.5
1123	I	30.1	Very low	29	Very low	166 Å²	166	141.5 Å²	141.5	85%	0.851	77%	0.772	S	S	*	*			trans	-157.7	142.8	159.2	-100.8	146.3	0	0	0	108.3	S1121	S1121-I1123 PolarHBondContact O-N 2.88Å
1124	S	26.5	Very low	29.2	Very low	105 Å²	105	135.6 Å²	135.6	73%	0.734	76%	0.761	S	S	*	*			trans	-100.8	-172.4	179.1	-35.1	0	0	0	0	110.4
1125	P	32.4	Very low	29.6	Very low	106 Å²	106	137.7 Å²	137.7	69%	0.688	77%	0.768	S	S	*	*			cis	-119.4	-148.6	-41.9	27.2	-4.9	0	0	0	108.9
1126	L	26	Very low	29.9	Very low	159 Å²	159	134.5 Å²	134.5	83%	0.832	77%	0.766	S	S	*	*			trans	72.6	155	168.5	-49.1	171.1	0	0	0	114.9
1127	S	27.3	Very low	30.1	Very low	98 Å²	98	135.7 Å²	135.7	69%	0.685	76%	0.763	S	S	*	*			cis	-165.3	127.2	-25.3	50.2	0	0	0	0	112.1
1128	Y	25.1	Very low	30.2	Very low	230 Å²	230	144.1 Å²	144.1	90%	0.902	78%	0.78	S	S	*	*			trans	58.1	149.2	134.6	-125	-94.4	0	0	0	123.7
1129	S	29.2	Very low	30.3	Very low	101 Å²	101	141.9 Å²	141.9	71%	0.706	77%	0.773	S	S	*	*			trans	75.5	142	163.7	-120.3	0	0	0	0	117.4
1130	S	32.5	Very low	30.4	Very low	91 Å²	91	139 Å²	139	64%	0.636	76%	0.764	S	S	*	*			cis	-143.6	162.5	6.5	-60.8	0	0	0	0	113.4
1131	N	32.1	Very low	30.3	Very low	146 Å²	146	140.1 Å²	140.1	78%	0.781	77%	0.767	S	S	*	*			trans	80.8	127.8	166.4	-55	1	0	0	0	116.8
1132	E	30.8	Very low	30.4	Very low	148 Å²	148	142 Å²	142	69%	0.692	77%	0.766	S	S	*	*			cis	-155.7	163.5	-3.8	-120.8	-170.7	113.4	0	0	112.9
1133	H	36.7	Very low	30.6	Very low	150 Å²	150	140.4 Å²	140.4	69%	0.694	76%	0.755	S	S	*	*			trans	46	102.2	158.7	-79.5	93.4	0	0	0	122.1
1134	T	32.7	Very low	30.5	Very low	116 Å²	116	139.3 Å²	139.3	71%	0.712	75%	0.751	S	S	*	*				22.8	137.5	128.8	61.1	0	0	0	0	120.1
1135	K	37.7	Very low	30.9	Very low	207 Å²	207	142 Å²	142	90%	0.9	76%	0.756	S	S	*	*			cis	-159.7	175.2	47	-130.7	152.5	-172.5	173.7	0	112.4
1136	N	33.7	Very low	31.1	Very low	159 Å²	159	143 Å²	143	85%	0.85	76%	0.762	S	S	*	*			trans	-100.9	177.4	-160.6	-109.8	-34.2	0	0	0	116.2
1137	V	31.9	Very low	31.6	Very low	126 Å²	126	139.7 Å²	139.7	76%	0.764	76%	0.758	S	S	*	*			trans	87.3	105.9	166.5	-166.7	0	0	0	0	114.3
1138	R	30.5	Very low	31.9	Very low	225 Å²	225	141.2 Å²	141.2	85%	0.849	76%	0.763	S	S	*	*			cis	97.7	147.3	36.3	-168	-168.4	-165.3	-176.5	6.7	111.8
1139	T	30.7	Very low	32.4	Very low	120 Å²	120	137.3 Å²	137.3	74%	0.736	76%	0.763	S	S	*	*			trans	75.5	151.7	176.4	67.3	0	0	0	0	117
1140	N	28.6	Very low	32.5	Very low	138 Å²	138	139.5 Å²	139.5	74%	0.738	77%	0.767	S	S	*	*			cis	-168.5	132.6	-42	-126	15.4	0	0	0	111
1141	V	28.2	Very low	33.1	Very low	123 Å²	123	143.7 Å²	143.7	75%	0.745	79%	0.792	S	S	*	*			trans	62.6	170.9	154.2	-163	0	0	0	0	116.4
1142	I	29.7	Very low	33.1	Very low	150 Å²	150	143.6 Å²	143.6	77%	0.769	79%	0.793	S	S	*	*			trans	73.1	133.8	166.2	-48.1	-178.7	0	0	0	115.5
1143	S	29.9	Very low	33.2	Very low	85 Å²	85	143.4 Å²	143.4	59%	0.594	80%	0.798	S	S	*	*			cis	-168.5	163.2	-29.3	63.8	0	0	0	0	108.9
1144	N	29.1	Very low	33	Very low	143 Å²	143	143 Å²	143	77%	0.765	80%	0.804	S	S	*	*			trans	43.8	121.6	147.9	-56.6	-15.3	0	0	0	120.6
1145	I	33.9	Very low	33.1	Very low	161 Å²	161	144.6 Å²	144.6	83%	0.826	81%	0.809	S	S	*	*				178.9	128.4	109.8	-89.3	152.9	0	0	0	108.9
1146	P	36.1	Very low	32.8	Very low	126 Å²	126	140.7 Å²	140.7	82%	0.818	80%	0.804	S	S	*	*			trans	-98.4	144.6	173.1	36.2	-31.1	0	0	0	112.6
1147	A	37.5	Very low	32.7	Very low	91 Å²	91	139.5 Å²	139.5	75%	0.752	80%	0.801	S	S	*	*			trans	-141	88.8	170.9	0	0	0	0	0	112.1
1148	T	32.7	Very low	32.8	Very low	130 Å²	130	140.4 Å²	140.4	80%	0.798	80%	0.803	S	S	*	*			trans	19.3	121.1	138.9	55.3	0	0	0	0	120.2
1149	T	36.4	Very low	33	Very low	148 Å²	148	133.9 Å²	133.9	91%	0.908	80%	0.8	S	S	*	*				-159.7	153.5	116.2	7.8	0	0	0	0	110.5
1150	N	31.5	Very low	33.1	Very low	147 Å²	147	135.1 Å²	135.1	79%	0.786	81%	0.805	S	S	*	*			trans	-119.2	176.5	-167.8	-129.7	48.2	0	0	0	109.9
1151	P	44.2	Very low	33.6	Very low	179 Å²	179	134.8 Å²	134.8	100%	1.162	81%	0.811	S	S	*	*			cis	-102.1	0	31.3	38.3	-35.7	0	0	0	117.2

Retrieved 1,151 of 1,151 residues in 577.6 ms (Link to these results)

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