A0A087YM39_POEFO Loading...

Zinc fingers and homeoboxes protein 1

AlphaFold DB , UniProt , Accession A0A087YM39, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 841 aa.

						>A0A087YM39_POEFO|A0A087YM39
MSSRRKSTTPCMVLPSDVVEQEPKLNRPQMKISAEHYYYFPPADEAGVSSADDLKVVGSTLKSRPKDSPEDPSCDQTAQEPQSDSAGAGGADSAAASAISLSKTPIMRMKTKSEPKRIAVSLKSSPIEAPLGPMTPVEKLLHNSMKFGGGGLLVSPPSEQLRKSSILNPTVLPAGLAQVLSAFQAQQSAAAAAAAVSQSQLLIPLSSIPSYSAAMDSNPLLINTYRKFPYPSLAEISSLASQTQFTEEQIKVWFSAQRLKHGVSWTPEEVEEARRKQFNGTVHTVPQTITVIPAHQLSAAANGLQSILQTCQIVGQPGLVFTQVGPGGNLPVTSPITLTVAGLPSQSQSSSRVSCQSTPTNSELKRATTVQPPSLSPQENSALSADSFSLRPKKSKEQLAELKASYLKNHFASDAEIARLMKLTNLTKGEIKKWFSDTRYNQRNSKNSHVIVFHDGGGRGGSSSSSAANTPIVIDSSDETPASPHPPSTSPVKEKEKETRVKTWNPFPDFTLQKFKEKTPEQLVVLEESFEKSSMPSDEELSRLRTETKLTRREIDAWFNERRKVPAASTSSPESSEGASSSRKGSQTPPGGRSKQLSGGGCSKKDLKEKSKKTPEQLHILKSAFVRTQWPTPEEYDQLAEESGLPRHYIVSWFGDSRYSWKNGNLKWFFQYQSGNVEGPSEGGGGGGKTGGGGRKRRGRNRGWGRSKTRKQPKRSSSSSSADVKRSPPSKKFKTGREILKEYYLKHHFLSEQDLDELVTKTNMSYEQVREWFAEVQRRLDLGLDPFLEPGAAGRTGGDKAARDDEEETHGERSENTEEPAGSEVWEPSRSVRKSLSLSED
					

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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	44.3	Very low	40.3	Very low	240 Å²	240	158.1 Å²	158.1	100%	1.182	84%	0.841	S	S	*	*				0	148.4	0	-61.9	159.7	87.1	0	0	107
2	S	34.4	Very low	39.7	Very low	120 Å²	120	159.3 Å²	159.3	84%	0.839	84%	0.842	S	S	*	*			cis	-133.5	163.3	22.4	-63.9	0	0	0	0	114.1
3	S	36.9	Very low	39.2	Very low	92 Å²	92	157.2 Å²	157.2	64%	0.643	84%	0.839	S	S	*	*			trans	-80.2	149	-178.3	180	0	0	0	0	113.3	R5	S3-R5 PolarHBondContact OG-N 3.42Å
4	R	44.3	Very low	39.1	Very low	249 Å²	249	155.9 Å²	155.9	94%	0.94	83%	0.831	S	S	*	*			trans	-138.2	62	156.1	-83	-164.1	163.4	-164.8	-6.7	111.3	K6	R4-K6 PolarHBondContact O-N 3.25Å
5	R	51.6	Low	38.9	Very low	236 Å²	236	153.9 Å²	153.9	89%	0.891	83%	0.83	S	S	*	*			trans	-60.8	129.1	157.8	-71.9	-175.8	176.2	-173.2	-1.8	108.4	S3	S3-R5 PolarHBondContact OG-N 3.42Å
6	K	46.8	Very low	38.5	Very low	209 Å²	209	151 Å²	151	91%	0.909	83%	0.825	S	S	*	*			trans	-92.2	105.4	166.9	-66.9	-177	-180	-177.6	0	107.4	R4	R4-K6 PolarHBondContact O-N 3.25Å
7	S	31.8	Very low	38.2	Very low	112 Å²	112	151.8 Å²	151.8	78%	0.783	83%	0.828	S	S	*	*			trans	-70	144.4	162.8	-165.8	0	0	0	0	108.5
8	T	40.8	Very low	37.8	Very low	133 Å²	133	151.2 Å²	151.2	82%	0.816	83%	0.83	S	S	*	*			trans	-126.9	112.7	165.1	-163.4	0	0	0	0	107.7
9	T	39.7	Very low	37.5	Very low	113 Å²	113	150.2 Å²	150.2	69%	0.693	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-78	134.5	178.3	-44.2	0	0	0	0	108.6
10	P	38.8	Very low	37.2	Very low	116 Å²	116	151.8 Å²	151.8	75%	0.753	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-70.6	128.2	166	29.6	-32	0	0	0	109.1
11	C	34.4	Very low	36.8	Very low	119 Å²	119	153.3 Å²	153.3	80%	0.804	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-76.6	124.9	175.4	-63.1	0	0	0	0	110
12	M	33.1	Very low	36.2	Very low	172 Å²	172	150 Å²	150	85%	0.847	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-66.8	131.3	163.1	-71.8	-69.6	-76.4	0	0	108.8
13	V	32.9	Very low	36.3	Very low	133 Å²	133	150.1 Å²	150.1	81%	0.806	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-95.5	118.7	167.5	177.9	0	0	0	0	107.2
14	L	37.4	Very low	35.8	Very low	139 Å²	139	154.5 Å²	154.5	73%	0.728	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-87.8	145.2	166.2	-68.5	172.8	0	0	0	108.9
15	P	35.8	Very low	35.1	Very low	126 Å²	126	150.3 Å²	150.3	82%	0.818	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-60.3	152.6	166.5	-18.5	32.2	0	0	0	110.8
16	S	33.6	Very low	33.9	Very low	107 Å²	107	146.7 Å²	146.7	75%	0.748	81%	0.811	S	S	*	*			trans	-119.9	141.3	165.4	-57.9	0	0	0	0	108.3
17	D	32.2	Very low	33.3	Very low	164 Å²	164	144.7 Å²	144.7	88%	0.877	80%	0.798	S	S	*	*			trans	-61.6	141.7	-174.1	-52.4	-85.3	0	0	0	112.3
18	V	31.6	Very low	33.4	Very low	141 Å²	141	145 Å²	145	86%	0.855	80%	0.798	S	S	*	*			trans	-121.6	123.2	166.7	176.2	0	0	0	0	107.8
19	V	31.7	Very low	32.8	Very low	132 Å²	132	146.7 Å²	146.7	80%	0.8	80%	0.796	S	S	*	*			trans	-63.9	150	-172.5	169.1	0	0	0	0	112.4
20	E	31.5	Very low	32.3	Very low	182 Å²	182	147.6 Å²	147.6	85%	0.85	79%	0.794	S	S	*	*			trans	-55.5	146.9	174.1	-58.6	178.3	115.2	0	0	113.3
21	Q	28.9	Very low	31.9	Very low	185 Å²	185	152 Å²	152	86%	0.864	80%	0.801	S	S	*	*			trans	-148.8	102.4	157.3	-164.1	156.4	102.5	0	0	109.9
22	E	31.5	Very low	31.7	Very low	171 Å²	171	152.8 Å²	152.8	80%	0.799	80%	0.796	S	S	*	*			trans	-59.6	149.4	172.8	-74.6	-156.1	135.5	0	0	111.8
23	P	36.3	Very low	31.5	Very low	121 Å²	121	150 Å²	150	79%	0.786	79%	0.794	S	S	*	*				-133.8	103.9	125.9	34.5	-23.8	0	0	0	113.7
24	K	27.7	Very low	31.4	Very low	185 Å²	185	148 Å²	148	80%	0.804	79%	0.791	S	S	*	*			trans	46.6	102.8	138.8	-64.1	-179.3	178.5	177.7	0	118.4
25	L	28.7	Very low	31	Very low	160 Å²	160	149.4 Å²	149.4	84%	0.838	79%	0.794	S	S	*	*			trans	-37.4	136.4	158.3	-171.7	81	0	0	0	114.1
26	N	27.6	Very low	30.8	Very low	160 Å²	160	150.9 Å²	150.9	86%	0.856	79%	0.79	S	S	*	*			trans	-139.3	131.1	154.5	-163.3	-2.6	0	0	0	109.7
27	R	32.7	Very low	30.7	Very low	168 Å²	168	156 Å²	156	63%	0.634	79%	0.794	S	S	*	*			trans	-148.2	117.7	-167.6	-179.1	-169.1	-173.7	-141.7	4.4	112.9
28	P	34.4	Very low	30.5	Very low	119 Å²	119	157.3 Å²	157.3	77%	0.773	79%	0.788	S	S	*	*			trans	-100.8	98.4	146.1	31.8	-21.8	0	0	0	108.3
29	Q	28	Very low	30.2	Very low	167 Å²	167	160.5 Å²	160.5	78%	0.78	79%	0.786	S	S	*	*				75.3	118.9	84.4	-163.9	-178.2	50.5	0	0	112.1
30	M	30.3	Very low	30	Very low	132 Å²	132	163.1 Å²	163.1	65%	0.65	79%	0.787	S	S	*	*			trans	-72.4	152.1	-178	-68.3	161	128.5	0	0	112	I32	M30-I32 HydrophobicContact CE-CD1 4.21Å; M30-I32 HydrophobicContact SD-CD1 4.47Å
31	K	28.8	Very low	31.4	Very low	209 Å²	209	159.6 Å²	159.6	91%	0.909	78%	0.78	S	S	*	*			trans	-124	129	141	-73.3	-170.4	176.2	-177	0	108.6
32	I	32.1	Very low	32.3	Very low	135 Å²	135	156 Å²	156	69%	0.692	77%	0.773	S	S	*	*			trans	-110	137.8	172	-64.3	172.4	0	0	0	106.5	M30	M30-I32 HydrophobicContact CE-CD1 4.21Å; M30-I32 HydrophobicContact SD-CD1 4.47Å
33	S	27.6	Very low	32.3	Very low	114 Å²	114	151.6 Å²	151.6	80%	0.797	77%	0.766	S	S	*	*			trans	-147.3	105	162.5	-62.7	0	0	0	0	105
34	A	30.5	Very low	32.2	Very low	91 Å²	91	152.7 Å²	152.7	75%	0.752	77%	0.765	S	S	*	*				100.7	111.2	68.3	0	0	0	0	0	108.8
35	E	30.5	Very low	32.5	Very low	168 Å²	168	152.3 Å²	152.3	79%	0.785	77%	0.766	S	S	*	*			trans	-32.3	147.1	178	-49.1	173.6	160.9	0	0	117.3
36	H	30.2	Very low	32.8	Very low	158 Å²	158	148.7 Å²	148.7	73%	0.731	76%	0.759	S	S	*	*				-162.3	154.8	96.4	-114.1	61.6	0	0	0	114.9
37	Y	32.1	Very low	32.9	Very low	213 Å²	213	144.4 Å²	144.4	84%	0.835	75%	0.753	S	S	*	*			trans	-78.1	160	168.5	-109.7	-114.5	0	0	0	111
38	Y	27.9	Very low	32.9	Very low	192 Å²	192	143 Å²	143	75%	0.753	76%	0.762	S	S	*	*				178.9	151.2	113.6	-102.2	-64	0	0	0	116
39	Y	24.6	Very low	32.8	Very low	209 Å²	209	142.3 Å²	142.3	82%	0.82	76%	0.761	S	S	*	*			trans	76	157.1	156.3	-95.3	-87.8	0	0	0	122.6
40	F	29	Very low	32.9	Very low	186 Å²	186	139.2 Å²	139.2	82%	0.816	76%	0.757	S	S	*	*			trans	-163.1	174.9	-158.5	-138.5	-88.8	0	0	0	107.5
41	P	60.4	Low	33.1	Very low	108 Å²	108	136.6 Å²	136.6	70%	0.701	76%	0.756	S	S	*	*				-76.9	-129.1	-96.5	43.4	-23.9	0	0	0	111.6
42	P	46.9	Very low	33.4	Very low	110 Å²	110	134.1 Å²	134.1	71%	0.714	75%	0.753	S	S	*	*			cis	-133.3	-179	17.4	44	-24.8	0	0	0	117.2
43	A	33.3	Very low	33.5	Very low	79 Å²	79	133.4 Å²	133.4	65%	0.653	75%	0.751	S	S	*	*			trans	60.7	148.3	136.1	0	0	0	0	0	122.4
44	D	32.1	Very low	33.9	Very low	144 Å²	144	133.9 Å²	133.9	77%	0.77	74%	0.744	S	S	*	*			cis	-169.3	170.8	-13.6	-112.1	-33.9	0	0	0	113.4
45	E	34.6	Very low	34.2	Very low	177 Å²	177	137.3 Å²	137.3	83%	0.827	74%	0.742	S	S	*	*			trans	62.2	150.5	153.4	-66	-84.8	105.2	0	0	120.6
46	A	35.8	Very low	34.3	Very low	84 Å²	84	135.4 Å²	135.4	69%	0.694	74%	0.741	S	S	*	*			cis	-170.8	164.8	-20.5	0	0	0	0	0	113.6
47	G	29.7	Very low	34.4	Very low	70 Å²	70	134 Å²	134	72%	0.722	74%	0.744	S	S	*	*			trans	117.4	152.1	151	0	0	0	0	0	118.6
48	V	32.5	Very low	34.3	Very low	138 Å²	138	126.9 Å²	126.9	84%	0.836	73%	0.734	S	S	*	*			cis	-156.9	134.9	-9.3	170	0	0	0	0	110.5
49	S	32.7	Very low	34.4	Very low	105 Å²	105	122.8 Å²	122.8	73%	0.734	73%	0.734	S	S	*	*			trans	63.2	158.1	164.1	-102.8	0	0	0	0	120.7
50	S	30.3	Very low	34.6	Very low	102 Å²	102	118.8 Å²	118.8	71%	0.713	73%	0.732	S	S	*	*			cis	-155	149.1	1.2	-132.3	0	0	0	0	114.1
51	A	34.8	Very low	34.7	Very low	76 Å²	76	117 Å²	117	63%	0.628	73%	0.73	S	S	*	*			trans	46.4	143.7	145.5	0	0	0	0	0	122.7
52	D	33.2	Very low	33.2	Very low	157 Å²	157	120.3 Å²	120.3	84%	0.84	73%	0.733	S	S	*	*			cis	-178.7	170.5	-13.7	-93.8	-26.2	0	0	0	106.1
53	D	34.7	Very low	32.3	Very low	120 Å²	120	119.8 Å²	119.8	64%	0.642	73%	0.732	S	S	*	*			cis	-163.7	-177.3	-32.8	176.1	33.8	0	0	0	105.4
54	L	36.3	Very low	32	Very low	125 Å²	125	125.9 Å²	125.9	65%	0.654	74%	0.738	S	S	*	*			trans	80.2	126.9	159.9	-52.4	163.8	0	0	0	117.8
55	K	36.9	Very low	32.7	Very low	163 Å²	163	123.6 Å²	123.6	71%	0.709	73%	0.731	S	S	*	*			cis	-169.3	144.4	-17	-132.7	-179.3	-164.2	137.6	0	112.6
56	V	33.6	Very low	32.5	Very low	127 Å²	127	121.8 Å²	121.8	77%	0.77	72%	0.72	S	S	*	*			trans	50	136.3	136.1	158.7	0	0	0	0	119.6
57	V	31.8	Very low	32	Very low	130 Å²	130	123.4 Å²	123.4	79%	0.788	72%	0.718	S	S	*	*			cis	-136.5	177	33.5	-140.5	0	0	0	0	109.4
58	G	29.8	Very low	31.9	Very low	62 Å²	62	125.4 Å²	125.4	64%	0.639	72%	0.721	S	S	*	*			cis	104.8	149.4	3.9	0	0	0	0	0	114.5
59	S	29.8	Very low	33	Very low	106 Å²	106	123.6 Å²	123.6	74%	0.741	71%	0.711	S	S	*	*			cis	-168.5	129.7	-1.2	-73.5	0	0	0	0	114.9
60	T	29.3	Very low	32.9	Very low	126 Å²	126	126.7 Å²	126.7	77%	0.773	72%	0.715	S	S	*	*			trans	78.2	159.3	142.6	-38.7	0	0	0	0	122.3
61	L	29.6	Very low	32.8	Very low	149 Å²	149	128.8 Å²	128.8	78%	0.78	72%	0.718	S	S	*	*			trans	91.8	153.4	159.7	-54.5	174.3	0	0	0	119.6
62	K	29.4	Very low	33.8	Very low	177 Å²	177	130.4 Å²	130.4	77%	0.77	72%	0.722	S	S	*	*			cis	-172.6	134.1	-28.7	179.2	160.4	174.6	179	0	113.2
63	S	28.2	Very low	33.5	Very low	99 Å²	99	128.1 Å²	128.1	69%	0.692	72%	0.718	S	S	*	*			trans	45.4	131.4	154.6	70.7	0	0	0	0	125.7
64	R	26.5	Very low	33.2	Very low	206 Å²	206	128.1 Å²	128.1	78%	0.777	73%	0.726	S	S	*	*				39	168.6	120.6	-108.6	-154.1	150.6	-162.1	-0.5	121.6
65	P	46.8	Very low	32.9	Very low	96 Å²	96	127.9 Å²	127.9	62%	0.623	73%	0.725	S	S	*	*			cis	-143.3	171.4	7.8	44	-25.2	0	0	0	120.2
66	K	31.1	Very low	33	Very low	139 Å²	139	127.5 Å²	127.5	60%	0.604	73%	0.726	S	S	*	*			trans	58.2	161	141.7	-78.2	-178.8	148.2	-74.8	0	120.3
67	D	25.2	Very low	32.8	Very low	119 Å²	119	127.7 Å²	127.7	64%	0.636	73%	0.728	S	S	*	*			cis	-156	-173.9	-1	-112.4	-18.7	0	0	0	111.6
68	S	28.1	Very low	33	Very low	112 Å²	112	126 Å²	126	78%	0.783	73%	0.727	S	S	*	*			trans	-123.4	-160.2	171.5	-50.4	0	0	0	0	109.9
69	P	54.5	Low	32.9	Very low	99 Å²	99	132 Å²	132	64%	0.643	74%	0.739	S	S	*	*			cis	-144.2	-163.6	-1	45.5	-24.4	0	0	0	117.3
70	E	30.5	Very low	32.8	Very low	171 Å²	171	135 Å²	135	80%	0.799	74%	0.741	S	S	*	*			trans	69.5	153.8	153.1	-71.8	158	-130.7	0	0	123.4
71	D	29.3	Very low	33.9	Very low	145 Å²	145	133.1 Å²	133.1	78%	0.775	73%	0.731	S	S	*	*			cis	-152.4	-89.7	-42.7	-132.1	75.6	0	0	0	119
72	P	54.6	Low	33.8	Very low	110 Å²	110	134.4 Å²	134.4	71%	0.714	73%	0.733	S	S	*	*			trans	-136.3	156.4	-132	42.2	-25	0	0	0	123.5
73	S	27.7	Very low	33.7	Very low	109 Å²	109	130 Å²	130	76%	0.762	72%	0.724	S	S	*	*			trans	67.3	143.9	139.1	-147.1	0	0	0	0	127.8
74	C	27.6	Very low	33.5	Very low	120 Å²	120	132.6 Å²	132.6	81%	0.811	73%	0.731	S	S	*	*			trans	67.8	164.4	156.1	-70.1	0	0	0	0	122.9
75	D	31.2	Very low	33.6	Very low	120 Å²	120	127.7 Å²	127.7	64%	0.642	73%	0.728	S	S	*	*			cis	-174.5	153	-37.7	-174.5	-137.9	0	0	0	113.2
76	Q	37.9	Very low	32.8	Very low	156 Å²	156	128 Å²	128	73%	0.729	74%	0.739	S	S	*	*			trans	56	168.7	161.7	-88.2	-179.8	92.3	0	0	122.3
77	T	30.9	Very low	32.6	Very low	130 Å²	130	125 Å²	125	80%	0.798	75%	0.748	S	S	*	*			cis	-136	-159.6	16.2	-24.5	0	0	0	0	113.8
78	A	35.1	Very low	32.8	Very low	94 Å²	94	124.4 Å²	124.4	78%	0.777	76%	0.759	S	S	*	*			trans	-153.2	162.2	-169.7	0	0	0	0	0	117.6
79	Q	27.1	Very low	32.7	Very low	188 Å²	188	123 Å²	123	88%	0.879	76%	0.762	S	S	*	*			trans	-151.1	129.7	164.3	-93.7	179.9	-21.9	0	0	107.4
80	E	28.5	Very low	31.5	Very low	169 Å²	169	121.9 Å²	121.9	79%	0.79	77%	0.769	S	S	*	*			cis	101.7	145.2	36.5	-86.6	-76.3	80.9	0	0	113.4
81	P	52.2	Low	31.4	Very low	87 Å²	87	118.5 Å²	118.5	57%	0.565	77%	0.77	S	S	*	*			cis	-139	173.1	-9.9	42.8	-26	0	0	0	117.6
82	Q	28.4	Very low	31.3	Very low	176 Å²	176	119.1 Å²	119.1	82%	0.822	77%	0.773	S	S	*	*			trans	61.7	152.1	147.2	-89.1	-179.5	-56.5	0	0	122.1
83	S	25.6	Very low	30.1	Very low	84 Å²	84	119.3 Å²	119.3	59%	0.587	78%	0.777	S	S	*	*			cis	-153.6	159.9	3.7	-77.8	0	0	0	0	112.9
84	D	25.3	Very low	30.1	Very low	154 Å²	154	118.4 Å²	118.4	82%	0.824	78%	0.776	S	S	*	*			trans	52.5	147.3	147.3	-76.9	-52.9	0	0	0	123
85	S	27.1	Very low	30.3	Very low	104 Å²	104	117.3 Å²	117.3	73%	0.727	78%	0.775	S	S	*	*			cis	-160.5	-172.8	-8.6	63.1	0	0	0	0	112.1
86	A	30.1	Very low	30.2	Very low	102 Å²	102	116 Å²	116	84%	0.843	78%	0.782	S	S	*	*			trans	-35	166.6	178.6	0	0	0	0	0	119.7
87	G	27.2	Very low	29.8	Very low	77 Å²	77	114.3 Å²	114.3	79%	0.794	79%	0.787	S	S	*	*			cis	177.8	-172.1	6.8	0	0	0	0	0	112.6
88	A	29.7	Very low	29.8	Very low	106 Å²	106	112.5 Å²	112.5	88%	0.876	79%	0.785	S	S	*	*			trans	-114.3	145.3	-169	0	0	0	0	0	115.2
89	G	25.6	Very low	29.5	Very low	82 Å²	82	116.2 Å²	116.2	85%	0.845	79%	0.79	S	S	*	*			trans	77.7	100.2	134.5	0	0	0	0	0	121.1
90	G	29.1	Very low	29.9	Very low	76 Å²	76	112.2 Å²	112.2	78%	0.784	78%	0.783	S	S	*	*				93.2	157.1	126.8	0	0	0	0	0	119.9
91	A	29.1	Very low	30.5	Very low	99 Å²	99	111.9 Å²	111.9	82%	0.818	79%	0.786	S	S	*	*			trans	66.5	156.4	174.6	0	0	0	0	0	115.3
92	D	27.9	Very low	29.7	Very low	158 Å²	158	111.4 Å²	111.4	85%	0.845	79%	0.785	S	S	*	*			cis	-156.7	177.7	-2.6	-144.8	-22.8	0	0	0	112.7
93	S	29.8	Very low	30	Very low	115 Å²	115	112.9 Å²	112.9	80%	0.804	79%	0.788	S	S	*	*			trans	76.8	174	151.5	-154.2	0	0	0	0	119
94	A	28	Very low	31	Very low	90 Å²	90	114.6 Å²	114.6	74%	0.744	80%	0.795	S	S	*	*			trans	-144.6	162.3	-162.1	0	0	0	0	0	112.5
95	A	30.4	Very low	32.2	Very low	96 Å²	96	112.8 Å²	112.8	79%	0.793	79%	0.792	S	S	*	*			trans	162.2	142.9	130	0	0	0	0	0	114.7
96	A	29.1	Very low	32.6	Very low	93 Å²	93	115.1 Å²	115.1	77%	0.769	80%	0.795	S	S	*	*			trans	67.8	151.8	140.3	0	0	0	0	0	123.5
97	S	30.5	Very low	32.6	Very low	121 Å²	121	116.8 Å²	116.8	85%	0.846	79%	0.787	S	S	*	*			trans	77	108.7	151.9	-62.9	0	0	0	0	120.9
98	A	29.2	Very low	33.1	Very low	92 Å²	92	122.8 Å²	122.8	76%	0.76	79%	0.785	S	S	*	*			trans	-50.8	164.1	167	0	0	0	0	0	117.2
99	I	30.2	Very low	33.4	Very low	171 Å²	171	125.1 Å²	125.1	88%	0.877	78%	0.78	S	S	*	*				-165.9	161.3	119.2	-98	154.8	0	0	0	111
100	S	35.3	Very low	33.7	Very low	104 Å²	104	130 Å²	130	73%	0.727	78%	0.778	S	S	*	*			trans	-86.9	178.7	-166.9	-52.1	0	0	0	0	116
101	L	39.9	Very low	34.1	Very low	162 Å²	162	132.3 Å²	132.3	85%	0.848	78%	0.777	S	S	*	*			trans	120.6	136.6	152.2	-64.4	171.5	0	0	0	113.3
102	S	36.2	Very low	34.2	Very low	78 Å²	78	137 Å²	137	55%	0.545	78%	0.779	S	S	.	*			cis	157.6	133.7	-23.6	53.6	0	0	0	0	107.2
103	K	35.5	Very low	34.5	Very low	206 Å²	206	134.9 Å²	134.9	90%	0.896	78%	0.777	S	S	*	*				165.7	157.9	128	-90.7	158.9	-176.7	171.7	0	114
104	T	45	Very low	34.5	Very low	120 Å²	120	136.3 Å²	136.3	74%	0.736	77%	0.771	S	S	*	*			trans	-127.3	164.7	-175.4	52.9	0	0	0	0	111.4
105	P	50.8	Low	35.3	Very low	116 Å²	116	136.9 Å²	136.9	75%	0.753	77%	0.767	S	S	*	*				-130.5	142.8	126	6.5	16	0	0	0	112.1
106	I	36.6	Very low	36	Very low	153 Å²	153	140.3 Å²	140.3	79%	0.785	76%	0.764	S	S	*	*				72.8	143.1	66	-61.5	165.8	0	0	0	113.4
107	M	29.6	Very low	36.5	Very low	138 Å²	138	147.2 Å²	147.2	68%	0.68	77%	0.77	S	S	*	*			cis	178.2	125.1	-49.1	173.7	-177.1	68.1	0	0	111.1
108	R	38.4	Very low	36.6	Very low	202 Å²	202	149.6 Å²	149.6	76%	0.762	77%	0.771	S	S	*	*			trans	66.2	122.8	152.4	-71.9	174.7	-177.5	174.3	1.5	125.1
109	M	34.3	Very low	36.6	Very low	155 Å²	155	149.1 Å²	149.1	76%	0.764	77%	0.767	S	S	*	*				83.9	150.4	119.4	-67.1	175	74.3	0	0	125.4
110	K	32.7	Very low	36.5	Very low	186 Å²	186	147.8 Å²	147.8	81%	0.809	77%	0.767	S	S	*	*			trans	75.6	155.9	162.2	-83.2	-177.9	170.6	-179.8	0	116.9
111	T	37.7	Very low	36.3	Very low	123 Å²	123	147.3 Å²	147.3	76%	0.755	76%	0.764	S	S	*	*			cis	-146.3	-171.1	10	-18.4	0	0	0	0	114.5
112	K	31.7	Very low	35.7	Very low	199 Å²	199	147.3 Å²	147.3	87%	0.865	76%	0.763	S	S	*	*			trans	-75.9	-178.4	176.4	-46.4	171	-178.8	178.3	0	111.6
113	S	33.3	Very low	35.3	Very low	113 Å²	113	152.1 Å²	152.1	79%	0.79	78%	0.775	S	S	*	*			cis	-164.7	173.2	20	54.9	0	0	0	0	115.2
114	E	30.8	Very low	35	Very low	145 Å²	145	147.3 Å²	147.3	68%	0.678	77%	0.767	S	S	*	*			trans	-62.3	-178.7	157.3	-121	-158.2	101.5	0	0	112.8
115	P	43.9	Very low	34.2	Very low	102 Å²	102	146.8 Å²	146.8	66%	0.662	77%	0.768	S	S	*	*			cis	-147.4	164.4	14.5	40.7	-18.8	0	0	0	121.9
116	K	44.8	Very low	34.1	Very low	168 Å²	168	146.3 Å²	146.3	73%	0.73	77%	0.765	S	S	*	*			trans	62.8	135.2	137.2	-70.1	165.1	-168.9	167.8	0	127.3
117	R	39.4	Very low	33.8	Very low	237 Å²	237	146 Å²	146	89%	0.894	76%	0.764	S	S	*	*			trans	75.9	150.2	150.5	-73.5	177	160.4	172.7	-7.6	117.5
118	I	33.1	Very low	33.8	Very low	172 Å²	172	148.2 Å²	148.2	88%	0.882	77%	0.772	S	S	*	*			cis	-137	177.1	44.7	-75.7	168.8	0	0	0	113.4
119	A	29.1	Very low	33.4	Very low	82 Å²	82	142.5 Å²	142.5	68%	0.678	77%	0.768	S	S	*	*			trans	-91.6	170.3	-174.4	0	0	0	0	0	115.3
120	V	28.3	Very low	34	Very low	142 Å²	142	140.4 Å²	140.4	86%	0.861	77%	0.766	S	S	*	*				170.1	163.3	93.9	148.4	0	0	0	0	109.5
121	S	30.2	Very low	33.8	Very low	95 Å²	95	139.7 Å²	139.7	66%	0.664	77%	0.77	S	S	*	*			cis	-178.5	146.2	-42.9	-162.3	0	0	0	0	111.1
122	L	28.5	Very low	33.4	Very low	161 Å²	161	137.2 Å²	137.2	84%	0.843	77%	0.769	S	S	*	*			trans	64.4	161.4	171.9	-62.7	160.4	0	0	0	116.2
123	K	27.9	Very low	33.9	Very low	179 Å²	179	133.1 Å²	133.1	78%	0.778	76%	0.763	S	S	*	*			cis	-156.4	155.2	10.9	-151.2	179.3	-178.6	179.9	0	113
124	S	29.6	Very low	33.7	Very low	105 Å²	105	136.2 Å²	136.2	73%	0.734	77%	0.767	S	S	*	*			trans	53.2	132.4	148.2	52.1	0	0	0	0	124.5
125	S	28.3	Very low	34.1	Very low	109 Å²	109	135.3 Å²	135.3	76%	0.762	77%	0.771	S	S	*	*			trans	-95.5	-170.7	148.4	61.8	0	0	0	0	110.3
126	P	47.9	Very low	34.1	Very low	106 Å²	106	136.4 Å²	136.4	69%	0.688	78%	0.779	S	S	*	*			cis	-129.7	-155.6	-7.7	37.4	-15.7	0	0	0	112.8
127	I	30.7	Very low	33.5	Very low	147 Å²	147	134.5 Å²	134.5	75%	0.754	78%	0.781	S	S	*	*			trans	134	117.3	148.1	-70.6	168.5	0	0	0	115.9
128	E	28.4	Very low	33	Very low	184 Å²	184	130.2 Å²	130.2	86%	0.86	77%	0.771	S	S	*	*			trans	65.7	172.8	143.2	-148.3	152.4	-162.1	0	0	122.7
129	A	30.2	Very low	32.8	Very low	82 Å²	82	129.4 Å²	129.4	68%	0.678	76%	0.761	S	S	*	*			trans	-145.9	-160.4	-171.5	0	0	0	0	0	108.3
130	P	47.5	Very low	32.8	Very low	111 Å²	111	131.9 Å²	131.9	72%	0.721	76%	0.762	S	S	*	*			cis	-126.3	-139.9	-17.6	40.7	-21.4	0	0	0	111.5
131	L	29.6	Very low	32.8	Very low	172 Å²	172	132.2 Å²	132.2	90%	0.901	76%	0.758	S	S	*	*			trans	74.7	143.8	-178.9	-43.4	174.8	0	0	0	113.5
132	G	28.5	Very low	32.8	Very low	70 Å²	70	134.6 Å²	134.6	72%	0.722	76%	0.758	S	S	*	*			cis	126.2	161	8	0	0	0	0	0	110.5
133	P	42.8	Very low	32.8	Very low	113 Å²	113	133.9 Å²	133.9	73%	0.734	76%	0.756	S	S	*	*			cis	-141.9	-169	-14.9	38.3	-16.2	0	0	0	115.2
134	M	27.9	Very low	33	Very low	178 Å²	178	130.4 Å²	130.4	88%	0.877	75%	0.754	S	S	*	*			trans	76.8	154.8	156.8	-56.9	-48.8	172	0	0	123.4
135	T	39.1	Very low	33.2	Very low	126 Å²	126	133.9 Å²	133.9	77%	0.773	76%	0.761	S	S	*	*			trans	-98.6	175.8	175.2	56.5	0	0	0	0	111.6
136	P	43.9	Very low	33.5	Very low	126 Å²	126	136.7 Å²	136.7	82%	0.818	76%	0.759	S	S	*	*				-146.9	-163.5	101	40.7	-24.3	0	0	0	114.8
137	V	31.9	Very low	32.7	Very low	128 Å²	128	140 Å²	140	78%	0.776	76%	0.763	S	S	*	*			trans	-118.4	174.7	-177.1	179.9	0	0	0	0	109.5
138	E	29	Very low	32.5	Very low	147 Å²	147	136.6 Å²	136.6	69%	0.687	76%	0.764	S	S	*	*			trans	93.7	156.9	165.1	-52.3	-155	153.1	0	0	118.3
139	K	29.6	Very low	32.6	Very low	154 Å²	154	131.9 Å²	131.9	67%	0.67	77%	0.765	S	S	*	*			cis	-170.8	176.6	-26.4	-101.3	174.7	-172.5	158.9	0	109.1
140	L	28.6	Very low	32.4	Very low	135 Å²	135	132.2 Å²	132.2	71%	0.707	78%	0.777	S	S	*	*			trans	69.4	159.9	164.5	-73.2	127.7	0	0	0	116.1	H142	L140-H142 VanDerWaalsContact CD2-CE1 3.45Å; L140-H142 WeakPolarHBondContact CD2-CE1 3.48Å
141	L	29	Very low	31.5	Very low	149 Å²	149	130.2 Å²	130.2	78%	0.78	78%	0.776	S	S	*	*			cis	-137.3	132.8	19.4	-59.3	150.7	0	0	0	109.5
142	H	30.9	Very low	31.4	Very low	144 Å²	144	130.1 Å²	130.1	67%	0.667	78%	0.775	S	S	*	*				98.2	143.2	88.1	-81	124.5	0	0	0	119	L140	L140-H142 VanDerWaalsContact CD2-CE1 3.45Å; L140-H142 WeakPolarHBondContact CD2-CE1 3.48Å
143	N	26.5	Very low	31.5	Very low	147 Å²	147	133.9 Å²	133.9	79%	0.786	78%	0.778	S	S	*	*			trans	68.6	123.9	163.8	-63.3	-3.8	0	0	0	118.7
144	S	34.1	Very low	30.7	Very low	106 Å²	106	134.1 Å²	134.1	74%	0.741	78%	0.777	S	S	*	*				84.4	129.6	59.8	-165.7	0	0	0	0	111.5
145	M	31.8	Very low	31	Very low	177 Å²	177	131.2 Å²	131.2	87%	0.872	78%	0.775	S	S	*	*				-153.9	142.3	51.3	-6.1	177.7	-168.7	0	0	109.5
146	K	35.4	Very low	31.5	Very low	168 Å²	168	130.6 Å²	130.6	73%	0.73	77%	0.773	S	S	*	*				70.3	136.6	72.3	-137.9	-175.8	-175.2	-173.2	0	114.5
147	F	31.9	Very low	31.7	Very low	176 Å²	176	129.9 Å²	129.9	77%	0.772	77%	0.768	S	S	*	*			cis	-112.5	-165.1	4.3	-90.2	-91.2	0	0	0	111.5
148	G	26.5	Very low	31.7	Very low	75 Å²	75	129 Å²	129	77%	0.773	77%	0.767	S	S	*	*			cis	104.3	143.4	3	0	0	0	0	0	114.5
149	G	29.8	Very low	31.5	Very low	86 Å²	86	131.3 Å²	131.3	89%	0.887	78%	0.779	S	S	*	*			cis	164.4	178.4	-1.1	0	0	0	0	0	114.6
150	G	27	Very low	31.6	Very low	89 Å²	89	132.4 Å²	132.4	92%	0.918	79%	0.786	S	S	*	*			trans	115.5	144.2	168.8	0	0	0	0	0	116.4
151	G	28.2	Very low	31.6	Very low	69 Å²	69	131.4 Å²	131.4	71%	0.711	78%	0.781	S	S	*	*			cis	162.9	134.1	-17	0	0	0	0	0	116.4
152	L	27.6	Very low	31.6	Very low	169 Å²	169	133.9 Å²	133.9	89%	0.885	78%	0.78	S	S	*	*			trans	63.2	154.8	155.8	-59.7	157.4	0	0	0	117.7
153	L	29.3	Very low	31.6	Very low	150 Å²	150	136.2 Å²	136.2	79%	0.785	79%	0.788	S	S	*	*			cis	-159.5	-175.6	3.3	-134.1	174.5	0	0	0	111.1
154	V	27	Very low	31.7	Very low	117 Å²	117	134.6 Å²	134.6	71%	0.709	79%	0.788	S	S	*	*			trans	90.5	116.4	159.8	-164.7	0	0	0	0	120.2
155	S	33.9	Very low	31.3	Very low	118 Å²	118	135.3 Å²	135.3	83%	0.825	79%	0.793	S	S	*	*			trans	-167	129.3	146.9	-77.4	0	0	0	0	109.7
156	P	50.7	Low	31.3	Very low	112 Å²	112	134 Å²	134	73%	0.727	79%	0.788	S	S	*	*			trans	-149.6	-165.4	130.4	40.2	-23.7	0	0	0	111.1
157	P	47.2	Very low	31.1	Very low	111 Å²	111	133.7 Å²	133.7	72%	0.721	79%	0.793	S	S	*	*			cis	-114.4	145.3	-18.3	8.4	17	0	0	0	112.4
158	S	31.4	Very low	31.4	Very low	109 Å²	109	132.8 Å²	132.8	76%	0.762	80%	0.797	S	S	*	*				90.1	121.6	76.4	-58.2	0	0	0	0	115.8
159	E	25.7	Very low	32.1	Very low	197 Å²	197	134.6 Å²	134.6	92%	0.921	80%	0.795	S	S	*	*			trans	-123.5	160.9	140.1	-79.7	-158	122.9	0	0	109.4
160	Q	31.1	Very low	32.1	Very low	177 Å²	177	136.8 Å²	136.8	83%	0.827	79%	0.791	S	S	*	*			trans	-108.3	176.5	178.3	-54	-177.8	-50.9	0	0	108.8
161	L	27.7	Very low	32.3	Very low	113 Å²	113	139 Å²	139	59%	0.592	79%	0.786	S	S	*	*			cis	-165	121	24.8	-166.9	116.5	0	0	0	112.6
162	R	29.6	Very low	33.1	Very low	202 Å²	202	143 Å²	143	76%	0.762	79%	0.79	S	S	*	*			trans	70.5	137.9	147.3	-78.6	176.7	-166.7	168.6	0.5	124
163	K	30.6	Very low	33.8	Very low	193 Å²	193	141 Å²	141	84%	0.839	79%	0.788	S	S	*	*			trans	90.3	155.7	132.7	-81.6	178.1	176.8	-170.3	0	120
164	S	29.8	Very low	34.4	Very low	113 Å²	113	138.7 Å²	138.7	79%	0.79	79%	0.791	S	S	*	*			trans	-119.9	147.5	-159.4	53.1	0	0	0	0	112.9
165	S	24.1	Very low	35.1	Very low	120 Å²	120	136 Å²	136	84%	0.839	79%	0.786	S	S	*	*			trans	-163.3	175.5	132.8	-153.2	0	0	0	0	112
166	I	33.8	Very low	35.5	Very low	149 Å²	149	137.4 Å²	137.4	76%	0.764	78%	0.784	S	S	*	*			trans	-87.3	150	176.2	-61.6	158.1	0	0	0	109.6
167	L	29.8	Very low	35	Very low	163 Å²	163	135.6 Å²	135.6	85%	0.853	78%	0.778	S	S	*	*			trans	152.9	139	139.2	-81	166.9	0	0	0	112.1
168	N	37.6	Very low	35	Very low	157 Å²	157	138.3 Å²	138.3	84%	0.84	78%	0.781	S	S	*	*			trans	-81.5	147.6	163.6	-67.3	-40.3	0	0	0	108.9
169	P	41.4	Very low	35.7	Very low	113 Å²	113	138.2 Å²	138.2	73%	0.734	78%	0.776	S	S	*	*				-157.8	140.7	91.3	37.1	-16.1	0	0	0	119.1
170	T	30.3	Very low	36.7	Very low	132 Å²	132	135.1 Å²	135.1	81%	0.81	77%	0.765	S	S	*	*			trans	64	151.1	132.9	-35.9	0	0	0	0	123.6
171	V	32.4	Very low	37.7	Very low	134 Å²	134	130.4 Å²	130.4	81%	0.812	75%	0.751	S	S	*	*			trans	94	140.8	162.7	-163	0	0	0	0	117.4
172	L	44.4	Very low	38.5	Very low	153 Å²	153	127.8 Å²	127.8	80%	0.801	75%	0.746	S	S	*	*			trans	-102.7	178.5	-175.9	-58.5	165.3	0	0	0	110.9
173	P	41.6	Very low	39.3	Very low	128 Å²	128	125 Å²	125	83%	0.831	74%	0.74	S	S	*	*				-136.1	155.4	86.6	35.5	-22.9	0	0	0	114.4
174	A	43.1	Very low	40.1	Very low	102 Å²	102	122.6 Å²	122.6	84%	0.843	73%	0.732	S	S	*	*			trans	-83.4	137.9	173.9	0	0	0	0	0	111.1
175	G	40.6	Very low	40.9	Very low	60 Å²	60	120 Å²	120	62%	0.619	72%	0.717	S	S	*	*			trans	-162.1	-33	176.4	0	0	0	0	0	116
176	L	41.8	Very low	42	Very low	147 Å²	147	121.6 Å²	121.6	77%	0.77	71%	0.711	S	S	*	*	S	Bend	trans	-96.4	-12.6	-170.7	-65.7	173	0	0	0	115.6	Q178	L176-Q178 PolarHBondContact O-N 3.43Å
177	A	42.1	Very low	42.8	Very low	74 Å²	74	120.4 Å²	120.4	61%	0.612	70%	0.702	S	S	*	*	H	α-helix	trans	-66.9	-32.1	-173.2	0	0	0	0	0	114.1	S181	A177-S181 PolarHBondContact O-N 3.01Å; A177-S181 PolarHBondContact O-OG 3Å
178	Q	47.1	Very low	43.6	Very low	168 Å²	168	116 Å²	116	79%	0.785	69%	0.686	S	S	*	*	H	α-helix	trans	-70.4	-34	-174.8	-73.1	178	-28.7	0	0	113.3	L176 S181 A182	L176-Q178 PolarHBondContact O-N 3.43Å; Q178-S181 PolarHBondContact O-N 3.37Å; Q178-A182 WeakPolarHBondContact O-CB 3.35Å; Q178-A182 PolarHBondContact O-N 3.36Å
179	V	44.9	Very low	43.8	Very low	107 Å²	107	111.6 Å²	111.6	65%	0.648	67%	0.671	S	S	*	*	H	α-helix	trans	-67.3	-41.3	-178.3	-176.5	0	0	0	0	111.2	A182 F183	V179-A182 PolarHBondContact O-N 3.39Å; V179-F183 PolarHBondContact O-N 3.15Å
180	L	46.7	Very low	43.9	Very low	132 Å²	132	109.4 Å²	109.4	69%	0.691	66%	0.662	S	S	*	*	H	α-helix	trans	-66.4	-41.4	176.8	-78.5	157.6	0	0	0	112.1	Q184	L180-Q184 PolarHBondContact O-N 3.37Å
181	S	52.1	Low	44.5	Very low	78 Å²	78	106.1 Å²	106.1	55%	0.545	65%	0.648	S	S	.	*	H	α-helix	trans	-66.2	-36.9	175.5	-61.8	0	0	0	0	113.1	A177 Q178 A185	A177-S181 PolarHBondContact O-N 3.01Å; A177-S181 PolarHBondContact O-OG 3Å; Q178-S181 PolarHBondContact O-N 3.37Å; S181-A185 WeakPolarHBondContact O-CB 3.34Å; S181-A185 PolarHBondContact O-N 3.47Å
182	A	44.1	Very low	44.9	Very low	59 Å²	59	102.3 Å²	102.3	49%	0.488	63%	0.631	S	S	.	*	H	α-helix	trans	-63.4	-45.9	178	0	0	0	0	0	112.2	Q178 V179 Q184 A185 Q186	Q178-A182 WeakPolarHBondContact O-CB 3.35Å; Q178-A182 PolarHBondContact O-N 3.36Å; V179-A182 PolarHBondContact O-N 3.39Å; A182-Q184 PolarHBondContact O-N 3.27Å; A182-A185 PolarHBondContact O-N 2.96Å; A182-Q186 PolarHBondContact O-N 3.23Å; A182-Q186 VanDerWaalsContact O-N 3.15Å
183	F	46.4	Very low	44.7	Very low	144 Å²	144	98.2 Å²	98.2	63%	0.632	62%	0.619	S	S	*	*	H	α-helix	trans	-64.2	-40.8	179.3	-168.9	-107.9	0	0	0	112.4	V179 Q186 Q187	V179-F183 PolarHBondContact O-N 3.15Å; F183-Q186 PolarHBondContact O-N 2.99Å; F183-Q187 PolarHBondContact O-N 3.39Å
184	Q	47.8	Very low	44.7	Very low	142 Å²	142	95 Å²	95	66%	0.664	60%	0.603	S	S	*	*	H	α-helix	trans	-70.8	-33.9	178.5	-165.8	170.2	36	0	0	113	L180 A182 Q186 S188	L180-Q184 PolarHBondContact O-N 3.37Å; A182-Q184 PolarHBondContact O-N 3.27Å; Q184-Q186 VanDerWaalsContact C-N 3.34Å; Q184-S188 PolarHBondContact O-N 3.49Å; Q184-S188 VanDerWaalsContact O-N 3.14Å; Q184-S188 PolarHBondContact O-OG 3.35Å
185	A	46.3	Very low	44.5	Very low	58 Å²	58	93.4 Å²	93.4	48%	0.479	59%	0.59	S	S	.	*	H	α-helix	trans	-63.1	-40	173	0	0	0	0	0	111.8	S181 A182 Q187 S188 A189	S181-A185 WeakPolarHBondContact O-CB 3.34Å; S181-A185 PolarHBondContact O-N 3.47Å; A182-A185 PolarHBondContact O-N 2.96Å; A185-Q187 PolarHBondContact O-N 3.36Å; A185-S188 PolarHBondContact O-N 3.14Å; A185-A189 PolarHBondContact O-N 3.2Å
186	Q	48.7	Very low	44.5	Very low	154 Å²	154	96.7 Å²	96.7	72%	0.72	60%	0.598	S	S	*	*	H	α-helix	trans	-69.7	-32.9	-177.4	-156.4	156.1	-71.3	0	0	112.9	A182 F183 Q184	A182-Q186 PolarHBondContact O-N 3.23Å; A182-Q186 VanDerWaalsContact O-N 3.15Å; F183-Q186 PolarHBondContact O-N 2.99Å; Q184-Q186 VanDerWaalsContact C-N 3.34Å
187	Q	49.8	Very low	44.3	Very low	123 Å²	123	94.7 Å²	94.7	58%	0.575	60%	0.596	S	S	*	*	H	α-helix	trans	-71.4	-38	169.9	-67.3	-171.4	0	0	0	112.5	F183 A185 A189 A190 A191	F183-Q187 PolarHBondContact O-N 3.39Å; A185-Q187 PolarHBondContact O-N 3.36Å; Q187-A189 VanDerWaalsContact C-N 3.34Å; Q187-A189 PolarHBondContact O-N 3.41Å; Q187-A190 PolarHBondContact O-N 2.82Å; Q187-A191 PolarHBondContact O-N 3.1Å; Q187-A191 VanDerWaalsContact O-N 3.15Å
188	S	45.6	Very low	44.1	Very low	72 Å²	72	96.8 Å²	96.8	50%	0.503	59%	0.593	S	S	.	*	H	α-helix	trans	-64.5	-35.8	175.8	-67.2	0	0	0	0	112.9	Q184 A185 A191 A192	Q184-S188 PolarHBondContact O-N 3.49Å; Q184-S188 VanDerWaalsContact O-N 3.14Å; Q184-S188 PolarHBondContact O-OG 3.35Å; A185-S188 PolarHBondContact O-N 3.14Å; S188-A191 PolarHBondContact O-N 3.45Å; S188-A192 WeakPolarHBondContact O-CB 3.46Å; S188-A192 PolarHBondContact O-N 2.9Å
189	A	42.4	Very low	43.4	Very low	63 Å²	63	94.6 Å²	94.6	52%	0.521	60%	0.596	S	S	.	*	H	α-helix	trans	-63.5	-42.3	176.7	0	0	0	0	0	112.4	A185 Q187 A192 A193	A185-A189 PolarHBondContact O-N 3.2Å; Q187-A189 VanDerWaalsContact C-N 3.34Å; Q187-A189 PolarHBondContact O-N 3.41Å; A189-A192 PolarHBondContact O-N 3.15Å; A189-A193 PolarHBondContact O-N 3.38Å
190	A	44.3	Very low	43.2	Very low	67 Å²	67	94.6 Å²	94.6	55%	0.554	59%	0.589	S	S	*	*	H	α-helix	trans	-65.2	-42.4	175.9	0	0	0	0	0	112.2	Q187 A193 A194	Q187-A190 PolarHBondContact O-N 2.82Å; A190-A193 PolarHBondContact O-N 3.48Å; A190-A194 PolarHBondContact O-N 3.16Å; A190-A194 VanDerWaalsContact O-N 3.16Å
191	A	43	Very low	42.7	Very low	63 Å²	63	96 Å²	96	52%	0.521	60%	0.597	S	S	.	*	H	α-helix	trans	-64.3	-39	175.4	0	0	0	0	0	112.5	Q187 S188 A194 A195	Q187-A191 PolarHBondContact O-N 3.1Å; Q187-A191 VanDerWaalsContact O-N 3.15Å; S188-A191 PolarHBondContact O-N 3.45Å; A191-A194 PolarHBondContact O-N 3.06Å; A191-A195 PolarHBondContact O-N 3.44Å
192	A	40.4	Very low	42.4	Very low	55 Å²	55	99.7 Å²	99.7	46%	0.455	61%	0.61	S	S	.	*	H	α-helix	trans	-66.4	-41.1	176	0	0	0	0	0	112.4	S188 A189 A194 A195 V196	S188-A192 WeakPolarHBondContact O-CB 3.46Å; S188-A192 PolarHBondContact O-N 2.9Å; A189-A192 PolarHBondContact O-N 3.15Å; A192-A194 VanDerWaalsContact C-N 3.33Å; A192-A194 PolarHBondContact O-N 3.45Å; A192-A195 PolarHBondContact O-N 3.16Å; A192-A195 VanDerWaalsContact O-N 3.16Å; A192-V196 WeakPolarHBondContact O-CG2 3.35Å; A192-V196 PolarHBondContact O-N 3.4Å; A192-V196 VanDerWaalsContact O-N 3.1Å
193	A	40.8	Very low	42.5	Very low	66 Å²	66	102.1 Å²	102.1	55%	0.545	61%	0.613	S	S	.	*	H	α-helix	trans	-61.5	-40	175.8	0	0	0	0	0	112.3	A189 A190	A189-A193 PolarHBondContact O-N 3.38Å; A190-A193 PolarHBondContact O-N 3.48Å
194	A	41.6	Very low	42.3	Very low	61 Å²	61	99.1 Å²	99.1	50%	0.504	61%	0.608	S	S	.	*	H	α-helix	trans	-64.4	-39.6	172.9	0	0	0	0	0	112.5	A190 A191 A192 V196 S197	A190-A194 PolarHBondContact O-N 3.16Å; A190-A194 VanDerWaalsContact O-N 3.16Å; A191-A194 PolarHBondContact O-N 3.06Å; A192-A194 VanDerWaalsContact C-N 3.33Å; A192-A194 PolarHBondContact O-N 3.45Å; A194-V196 PolarHBondContact O-N 2.8Å; A194-S197 PolarHBondContact O-N 3.1Å
195	A	38.8	Very low	42.3	Very low	68 Å²	68	95.4 Å²	95.4	56%	0.562	59%	0.592	S	S	*	*	H	α-helix	trans	-67.9	-31.3	-179.5	0	0	0	0	0	113.9	A191 A192 S197 Q198	A191-A195 PolarHBondContact O-N 3.44Å; A192-A195 PolarHBondContact O-N 3.16Å; A192-A195 VanDerWaalsContact O-N 3.16Å; A195-S197 PolarHBondContact O-N 3.36Å; A195-Q198 PolarHBondContact O-N 2.88Å
196	V	39.5	Very low	42.2	Very low	129 Å²	129	98 Å²	98	78%	0.782	61%	0.607	S	S	*	*	H	α-helix	trans	-63.3	-21.9	177.2	169.8	0	0	0	0	112.6	A192 A194	A192-V196 WeakPolarHBondContact O-CG2 3.35Å; A192-V196 PolarHBondContact O-N 3.4Å; A192-V196 VanDerWaalsContact O-N 3.1Å; A194-V196 PolarHBondContact O-N 2.8Å
197	S	38.3	Very low	41.9	Very low	105 Å²	105	95 Å²	95	73%	0.734	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	7.3	179.8	-58.5	0	0	0	0	114.2	A194 A195	A194-S197 PolarHBondContact O-N 3.1Å; A195-S197 PolarHBondContact O-N 3.36Å
198	Q	38.2	Very low	42.1	Very low	119 Å²	119	92.1 Å²	92.1	56%	0.556	59%	0.591	S	S	*	*			trans	-137	71.4	-173.3	-67.8	-164.3	5.1	0	0	113.9	A195 Q200	A195-Q198 PolarHBondContact O-N 2.88Å; Q198-Q200 HydrophobicContact CB-CG 4.08Å; Q198-Q200 HydrophobicContact CG-CG 4.38Å; Q198-Q200 PolarHBondContact O-N 3.09Å
199	S	31.8	Very low	42.3	Very low	121 Å²	121	94.9 Å²	94.9	85%	0.846	61%	0.607	S	S	*	*			trans	-74.5	53	157.5	63.5	0	0	0	0	111.2	L201	S199-L201 PolarHBondContact O-N 3.24Å
200	Q	40	Very low	42.8	Very low	107 Å²	107	94.7 Å²	94.7	50%	0.5	60%	0.602	S	S	.	*			trans	-73.7	120.5	-176.6	-72.9	-173.2	6.8	0	0	111.3	Q198 L202	Q198-Q200 HydrophobicContact CB-CG 4.08Å; Q198-Q200 HydrophobicContact CG-CG 4.38Å; Q198-Q200 PolarHBondContact O-N 3.09Å; Q200-L202 HydrophobicContact CB-CD1 4.35Å; Q200-L202 PolarHBondContact O-N 3.07Å
201	L	37.5	Very low	43.5	Very low	161 Å²	161	93.3 Å²	93.3	84%	0.843	58%	0.583	S	S	*	*			trans	-72.5	107.2	154.5	-74.2	170.4	0	0	0	107.7	S199 I203	S199-L201 PolarHBondContact O-N 3.24Å; L201-I203 PolarHBondContact O-N 3.23Å
202	L	44.9	Very low	44.7	Very low	157 Å²	157	92.3 Å²	92.3	82%	0.822	57%	0.572	S	S	*	*			trans	-65.7	97.1	173.7	-89.6	79.6	0	0	0	110.3	Q200	Q200-L202 HydrophobicContact CB-CD1 4.35Å; Q200-L202 PolarHBondContact O-N 3.07Å
203	I	46.8	Very low	46.1	Very low	110 Å²	110	93 Å²	93	56%	0.564	58%	0.578	S	S	*	*			trans	-107.8	123.1	153.3	-58	177.2	0	0	0	105.5	L201 L205	L201-I203 PolarHBondContact O-N 3.23Å; I203-L205 PolarHBondContact O-N 2.63Å
204	P	40.8	Very low	47.4	Very low	81 Å²	81	92.6 Å²	92.6	53%	0.526	58%	0.575	S	S	.	*			trans	-58.2	114.2	178.2	-25.9	35.5	0	0	0	111.5	S206 S207	P204-S206 PolarHBondContact O-N 3.09Å; P204-S207 WeakPolarHBondContact O-CB 3.25Å; P204-S207 PolarHBondContact O-N 3.05Å; P204-S207 PolarHBondContact O-OG 3.42Å
205	L	48.7	Very low	49	Very low	63 Å²	63	89.7 Å²	89.7	33%	0.33	55%	0.551	S	S	.	*	G	3₁₀ helix	trans	-66.5	-16.6	-179.3	-63.9	172.1	0	0	0	112.6	I203 S207 I208 Y211	I203-L205 PolarHBondContact O-N 2.63Å; L205-S207 PolarHBondContact O-N 3.3Å; L205-I208 PolarHBondContact O-N 3.39Å; L205-Y211 HydrophobicContact CB-CD1 4.08Å; L205-Y211 HydrophobicContact CB-CE1 4.15Å; L205-Y211 HydrophobicContact CD1-CE1 4.08Å
206	S	44.2	Very low	50.9	Low	113 Å²	113	89.2 Å²	89.2	79%	0.79	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-64.5	-11.7	168.5	50.3	0	0	0	0	114.4	P204	P204-S206 PolarHBondContact O-N 3.09Å
207	S	42.7	Very low	52.7	Low	90 Å²	90	87.4 Å²	87.4	63%	0.629	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-87.4	0.1	176.6	-56.1	0	0	0	0	114.4	P204 L205	P204-S207 WeakPolarHBondContact O-CB 3.25Å; P204-S207 PolarHBondContact O-N 3.05Å; P204-S207 PolarHBondContact O-OG 3.42Å; L205-S207 PolarHBondContact O-N 3.3Å
208	I	54.5	Low	54.9	Low	64 Å²	64	83.8 Å²	83.8	33%	0.328	50%	0.504	S	S	.	.	S	Bend	trans	-100.1	113.3	172.7	-54.2	175.1	0	0	0	108	L205 S210 Y211 V252	L205-I208 PolarHBondContact O-N 3.39Å; I208-S210 PolarHBondContact O-N 2.93Å; I208-Y211 PolarHBondContact O-N 3.36Å; I208-V252 HydrophobicContact CG2-CG1 3.75Å
209	P	48.9	Very low	56.8	Low	130 Å²	130	82 Å²	82	84%	0.844	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	9.9	-172	-25.6	35.8	0	0	0	117.6
210	S	53.5	Low	59.2	Low	59 Å²	59	79.5 Å²	79.5	41%	0.413	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148	14.2	-178.4	-47.8	0	0	0	0	113.5	I208 S212	I208-S210 PolarHBondContact O-N 2.93Å; S210-S212 PolarHBondContact O-N 2.87Å
211	Y	59.4	Low	61.2	Low	37 Å²	37	74.4 Å²	74.4	15%	0.145	46%	0.456	C	S	.	.			trans	-82.8	110.7	176.1	-175.7	-88	0	0	0	111	L205 I208 A213 D216 V252 A256 K260	L205-Y211 HydrophobicContact CB-CD1 4.08Å; L205-Y211 HydrophobicContact CB-CE1 4.15Å; L205-Y211 HydrophobicContact CD1-CE1 4.08Å; I208-Y211 PolarHBondContact O-N 3.36Å; Y211-A213 HydrophobicContact CE1-CB 4.49Å; Y211-D216 VanDerWaalsContact OH-CG 3.27Å; Y211-D216 PolarHBondContact OH-OD1 2.95Å; Y211-D216 PolarHBondContact OH-OD2 3.15Å; Y211-V252 HydrophobicContact CD2-CG1 4.32Å; Y211-A256 HydrophobicContact CD2-CB 4.05Å; Y211-A256 HydrophobicContact CE2-CB 3.72Å; Y211-K260 PolarHBondContact OH-NZ 3.35Å
212	S	68	Low	63.5	Low	42 Å²	42	68.6 Å²	68.6	29%	0.294	43%	0.425	S	S	.	.			trans	-97.8	121.9	171.3	-179.8	0	0	0	0	110.9	S210 A214 M215	S210-S212 PolarHBondContact O-N 2.87Å; S212-A214 PolarHBondContact O-N 3.07Å; S212-A214 PolarHBondContact OG-N 3.19Å; S212-M215 WeakPolarHBondContact O-CB 3.4Å; S212-M215 WeakPolarHBondContact O-CG 3.43Å; S212-M215 PolarHBondContact O-N 3.38Å; S212-M215 VanDerWaalsContact O-N 3.1Å
213	A	69.4	Low	65.4	Low	71 Å²	71	65.2 Å²	65.2	59%	0.587	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-63.8	-20	176	0	0	0	0	0	113	Y211 M215 D216	Y211-A213 HydrophobicContact CE1-CB 4.49Å; A213-M215 PolarHBondContact O-N 3.5Å; A213-M215 VanDerWaalsContact O-N 3.17Å; A213-D216 PolarHBondContact O-N 3.23Å; A213-D216 VanDerWaalsContact O-N 3.17Å
214	A	67.3	Low	67.1	Low	57 Å²	57	61.7 Å²	61.7	47%	0.471	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-67.3	-9.3	174	0	0	0	0	0	113.7	S212 S217	S212-A214 PolarHBondContact O-N 3.07Å; S212-A214 PolarHBondContact OG-N 3.19Å; A214-S217 PolarHBondContact O-OG 3.3Å; A214-S217 VanDerWaalsContact O-OG 3.13Å
215	M	76	Confident	69.1	Low	0 Å²	0	58.9 Å²	58.9	0%	0	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-79.5	-27.3	173.4	-57.9	-175.3	74.8	0	0	112.3	S212 A213 S217 N218 L221 F245 Q249 I250 W253	S212-M215 WeakPolarHBondContact O-CB 3.4Å; S212-M215 WeakPolarHBondContact O-CG 3.43Å; S212-M215 PolarHBondContact O-N 3.38Å; S212-M215 VanDerWaalsContact O-N 3.1Å; A213-M215 PolarHBondContact O-N 3.5Å; A213-M215 VanDerWaalsContact O-N 3.17Å; M215-S217 PolarHBondContact O-N 3.3Å; M215-N218 PolarHBondContact O-N 3.01Å; M215-L221 HydrophobicContact CB-CD1 3.92Å; M215-L221 HydrophobicContact CE-CD1 3.63Å; M215-L221 HydrophobicContact CG-CD1 4.43Å; M215-F245 HydrophobicContact CB-CE2 4.29Å; M215-F245 HydrophobicContact CB-CZ 4.43Å; M215-F245 HydrophobicContact CE-CB 3.86Å; M215-F245 HydrophobicContact CE-CD1 4.47Å; M215-F245 HydrophobicContact CE-CD2 3.72Å; M215-F245 HydrophobicContact CE-CE2 4.39Å; M215-F245 HydrophobicContact CE-CG 3.78Å; M215-F245 HydrophobicContact CG-CD1 4.01Å; M215-F245 HydrophobicContact CG-CD2 3.94Å; M215-F245 HydrophobicContact CG-CE1 3.81Å; M215-F245 HydrophobicContact CG-CE2 3.74Å; M215-F245 HydrophobicContact CG-CG 4.08Å; M215-F245 HydrophobicContact CG-CZ 3.68Å; M215-F245 HydrophobicContact SD-CD1 4.38Å; M215-F245 HydrophobicContact SD-CD2 4.48Å; M215-F245 HydrophobicContact SD-CG 4.26Å; M215-Q249 HydrophobicContact CE-CB 4.05Å; M215-Q249 WeakPolarHBondContact CE-O 3.38Å; M215-Q249 HydrophobicContact SD-CB 3.87Å; M215-I250 HydrophobicContact CE-CB 4.37Å; M215-I250 HydrophobicContact CE-CG1 3.73Å; M215-W253 HydrophobicContact CB-CB 4.39Å; M215-W253 VanDerWaalsContact CB-CD1 3.41Å; M215-W253 HydrophobicContact CB-CG 3.85Å; M215-W253 HydrophobicContact CE-CB 3.71Å; M215-W253 HydrophobicContact CE-CG 4.22Å; M215-W253 HydrophobicContact SD-CB 3.93Å; M215-W253 HydrophobicContact SD-CG 4.41Å
216	D	77.4	Confident	70.6	Confident	57 Å²	57	64.4 Å²	64.4	31%	0.305	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-13.2	179.8	-77.1	-35.9	0	0	0	113.2	Y211 A213 W253 K260	Y211-D216 VanDerWaalsContact OH-CG 3.27Å; Y211-D216 PolarHBondContact OH-OD1 2.95Å; Y211-D216 PolarHBondContact OH-OD2 3.15Å; A213-D216 PolarHBondContact O-N 3.23Å; A213-D216 VanDerWaalsContact O-N 3.17Å; D216-W253 PolarHBondContact OD1-NE1 3.26Å; D216-K260 IonicContact OD1-NZ 2.67Å; D216-K260 PolarHBondContact OD1-NZ 2.61Å; D216-K260 IonicContact OD2-NZ 2.85Å; D216-K260 PolarHBondContact OD2-NZ 3.3Å
217	S	78.6	Confident	72.2	Confident	92 Å²	92	65 Å²	65	64%	0.643	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-6.2	176.8	57.5	0	0	0	0	114.5	A214 M215 P219	A214-S217 PolarHBondContact O-OG 3.3Å; A214-S217 VanDerWaalsContact O-OG 3.13Å; M215-S217 PolarHBondContact O-N 3.3Å; S217-P219 WeakPolarHBondContact O-CD 3.22Å
218	N	83.3	Confident	73.9	Confident	28 Å²	28	61.1 Å²	61.1	15%	0.15	35%	0.348	C	S	.	.			trans	-78.6	118.3	-175.3	-173.4	-55.1	0	0	0	111.5	M215 L220 L221 I222 F245	M215-N218 PolarHBondContact O-N 3.01Å; N218-L220 VanDerWaalsContact C-N 3.31Å; N218-L220 PolarHBondContact O-N 2.7Å; N218-L220 WeakPolarHBondContact OD1-CB 3.36Å; N218-L220 PolarHBondContact OD1-N 2.76Å; N218-L221 HydrophobicContact CB-CB 4.31Å; N218-L221 HydrophobicContact CB-CD1 4.03Å; N218-L221 HydrophobicContact CB-CG 4.07Å; N218-L221 PolarHBondContact O-N 3.2Å; N218-L221 PolarHBondContact OD1-N 3.21Å; N218-I222 WeakPolarHBondContact O-CD1 3.31Å; N218-I222 VanDerWaalsContact O-CG1 3.26Å; N218-I222 WeakPolarHBondContact O-CG1 3.23Å; N218-I222 PolarHBondContact O-N 3.2Å; N218-I222 VanDerWaalsContact O-N 3.13Å; N218-F245 HydrophobicContact CB-CE2 4.26Å
219	P	79.8	Confident	75.2	Confident	82 Å²	82	59.2 Å²	59.2	53%	0.532	34%	0.339	S	S	.	.	H	α-helix	trans	-66.6	-28.2	-174.1	27.2	-35	0	0	0	113.6	S217 N223	S217-P219 WeakPolarHBondContact O-CD 3.22Å; P219-N223 WeakPolarHBondContact O-CB 3.49Å; P219-N223 PolarHBondContact O-N 3.28Å; P219-N223 PolarHBondContact O-ND2 2.85Å
220	L	80.6	Confident	76.7	Confident	69 Å²	69	55.1 Å²	55.1	36%	0.361	31%	0.307	S	S	.	.	H	α-helix	trans	-70.3	-42.9	179	-59.9	178.7	0	0	0	111.1	N218 N223 T224 L239 Q242 T243	N218-L220 VanDerWaalsContact C-N 3.31Å; N218-L220 PolarHBondContact O-N 2.7Å; N218-L220 WeakPolarHBondContact OD1-CB 3.36Å; N218-L220 PolarHBondContact OD1-N 2.76Å; L220-N223 PolarHBondContact O-N 2.81Å; L220-T224 WeakPolarHBondContact O-CB 3.33Å; L220-T224 PolarHBondContact O-N 2.84Å; L220-T224 PolarHBondContact O-OG1 2.72Å; L220-L239 HydrophobicContact CB-CD2 4.09Å; L220-Q242 HydrophobicContact CD1-CB 3.9Å; L220-T243 HydrophobicContact CB-CG2 4.05Å; L220-T243 HydrophobicContact CD1-CG2 4.1Å
221	L	83.8	Confident	78.2	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-63.8	-44.1	174.7	-62.7	-176.1	0	0	0	111.5	M215 N218 T224 Y225 L239 T243 F245 I250 W253 F254	M215-L221 HydrophobicContact CB-CD1 3.92Å; M215-L221 HydrophobicContact CE-CD1 3.63Å; M215-L221 HydrophobicContact CG-CD1 4.43Å; N218-L221 HydrophobicContact CB-CB 4.31Å; N218-L221 HydrophobicContact CB-CD1 4.03Å; N218-L221 HydrophobicContact CB-CG 4.07Å; N218-L221 PolarHBondContact O-N 3.2Å; N218-L221 PolarHBondContact OD1-N 3.21Å; L221-T224 PolarHBondContact O-OG1 3.33Å; L221-Y225 VanDerWaalsContact O-CB 3.27Å; L221-Y225 WeakPolarHBondContact O-CB 3.17Å; L221-Y225 PolarHBondContact O-N 3.12Å; L221-L239 HydrophobicContact CD2-CB 4.3Å; L221-L239 HydrophobicContact CD2-CD1 4.14Å; L221-L239 HydrophobicContact CD2-CD2 4.22Å; L221-L239 HydrophobicContact CD2-CG 4.46Å; L221-T243 HydrophobicContact CD2-CG2 4.2Å; L221-T243 HydrophobicContact CG-CG2 4.25Å; L221-F245 HydrophobicContact CD1-CD2 3.95Å; L221-F245 HydrophobicContact CD1-CE2 4.03Å; L221-I250 HydrophobicContact CD2-CD1 4.43Å; L221-I250 HydrophobicContact CD2-CG1 4.18Å; L221-I250 HydrophobicContact CD2-CG2 4.01Å; L221-W253 HydrophobicContact CB-CE3 4.03Å; L221-W253 HydrophobicContact CB-CH2 3.82Å; L221-W253 HydrophobicContact CB-CZ2 4.32Å; L221-W253 HydrophobicContact CB-CZ3 3.67Å; L221-W253 HydrophobicContact CD1-CD2 4.32Å; L221-W253 HydrophobicContact CD1-CE3 4.35Å; L221-W253 WeakPolarHBondContact O-CH2 3.41Å; L221-W253 WeakPolarHBondContact O-CZ3 3.31Å; L221-F254 HydrophobicContact CD2-CE2 4.25Å
222	I	84.4	Confident	79.3	Confident	38 Å²	38	53 Å²	53	20%	0.195	30%	0.297	C	S	.	.	H	α-helix	trans	-66.8	-41.8	179.1	-57	160	0	0	0	111.1	N218 Y225 R226 W253	N218-I222 WeakPolarHBondContact O-CD1 3.31Å; N218-I222 VanDerWaalsContact O-CG1 3.26Å; N218-I222 WeakPolarHBondContact O-CG1 3.23Å; N218-I222 PolarHBondContact O-N 3.2Å; N218-I222 VanDerWaalsContact O-N 3.13Å; I222-Y225 PolarHBondContact O-N 3.33Å; I222-R226 VanDerWaalsContact CG2-CZ 3.44Å; I222-R226 VanDerWaalsContact O-CG 3.31Å; I222-R226 WeakPolarHBondContact O-CG 3.45Å; I222-R226 PolarHBondContact O-N 3.02Å; I222-W253 HydrophobicContact CG1-CH2 4.44Å; I222-W253 HydrophobicContact CG1-CZ2 4.4Å
223	N	85	Confident	80.1	Confident	86 Å²	86	56.3 Å²	56.3	46%	0.46	31%	0.311	S	S	.	.	H	α-helix	trans	-72.3	-36.9	-178.9	-71.7	-16.9	0	0	0	112.6	P219 L220 R226 K227	P219-N223 WeakPolarHBondContact O-CB 3.49Å; P219-N223 PolarHBondContact O-N 3.28Å; P219-N223 PolarHBondContact O-ND2 2.85Å; L220-N223 PolarHBondContact O-N 2.81Å; N223-R226 PolarHBondContact O-N 3.04Å; N223-R226 PolarHBondContact OD1-NH1 3.43Å; N223-K227 PolarHBondContact O-N 3.1Å
224	T	82.6	Confident	80.8	Confident	36 Å²	36	56.5 Å²	56.5	22%	0.221	31%	0.312	C	S	.	.	H	α-helix	trans	-67.9	-38.3	171	47.5	0	0	0	0	111.8	L220 L221 R226 K227 F228 L239	L220-T224 WeakPolarHBondContact O-CB 3.33Å; L220-T224 PolarHBondContact O-N 2.84Å; L220-T224 PolarHBondContact O-OG1 2.72Å; L221-T224 PolarHBondContact O-OG1 3.33Å; T224-R226 PolarHBondContact O-N 3.21Å; T224-K227 PolarHBondContact O-N 2.99Å; T224-F228 PolarHBondContact O-N 3.09Å; T224-L239 HydrophobicContact CG2-CD1 4.14Å; T224-L239 HydrophobicContact CG2-CD2 3.99Å; T224-L239 HydrophobicContact CG2-CG 4.44Å; T224-L239 WeakPolarHBondContact OG1-CD1 3.42Å
225	Y	83	Confident	81.7	Confident	22 Å²	22	56.3 Å²	56.3	9%	0.086	30%	0.302	C	S	.	.	H	α-helix	trans	-60.1	-41.5	171.1	-175.6	-90.3	0	0	0	113.2	L221 I222 F228 P229 W253 F254 Q257 R258 H261 V263	L221-Y225 VanDerWaalsContact O-CB 3.27Å; L221-Y225 WeakPolarHBondContact O-CB 3.17Å; L221-Y225 PolarHBondContact O-N 3.12Å; I222-Y225 PolarHBondContact O-N 3.33Å; Y225-F228 CarbonylContact O-C 3.58Å; Y225-P229 HydrophobicContact CD2-CB 4.3Å; Y225-P229 HydrophobicContact CE2-CB 3.82Å; Y225-P229 HydrophobicContact CE2-CG 4.46Å; Y225-W253 HydrophobicContact CD2-CZ3 4.45Å; Y225-W253 HydrophobicContact CG-CH2 4.43Å; Y225-F254 AromaticContact CD2-CD1 3.75Å; Y225-F254 HydrophobicContact CD2-CD1 3.75Å; Y225-F254 AromaticContact CD2-CE1 3.91Å; Y225-F254 HydrophobicContact CD2-CE1 3.91Å; Y225-F254 HydrophobicContact CG-CE1 4.4Å; Y225-Q257 HydrophobicContact CD1-CG 3.99Å; Y225-Q257 HydrophobicContact CD2-CB 4.02Å; Y225-Q257 HydrophobicContact CD2-CG 3.67Å; Y225-Q257 HydrophobicContact CE1-CG 3.83Å; Y225-Q257 HydrophobicContact CE2-CB 3.72Å; Y225-Q257 HydrophobicContact CE2-CG 3.5Å; Y225-Q257 VanDerWaalsContact CE2-CG 3.5Å; Y225-Q257 HydrophobicContact CG-CG 3.93Å; Y225-Q257 PolarHBondContact OH-O 3.25Å; Y225-R258 HydrophobicContact CE2-CG 4.07Å; Y225-H261 AromaticContact CE1-CD2 3.76Å; Y225-H261 AromaticContact CZ-CD2 3.86Å; Y225-H261 PolarHBondContact OH-CD2 3.03Å; Y225-V263 WeakPolarHBondContact OH-CG2 3.49Å
226	R	80.4	Confident	82.3	Confident	179 Å²	179	57.1 Å²	57.1	68%	0.675	31%	0.306	S	S	*	.	H	α-helix	trans	-63.2	-37.6	173.6	-74.3	169	177.7	143.7	-1.3	112.7	I222 N223 T224	I222-R226 VanDerWaalsContact CG2-CZ 3.44Å; I222-R226 VanDerWaalsContact O-CG 3.31Å; I222-R226 WeakPolarHBondContact O-CG 3.45Å; I222-R226 PolarHBondContact O-N 3.02Å; N223-R226 PolarHBondContact O-N 3.04Å; N223-R226 PolarHBondContact OD1-NH1 3.43Å; T224-R226 PolarHBondContact O-N 3.21Å
227	K	78.5	Confident	82.7	Confident	126 Å²	126	56.3 Å²	56.3	55%	0.548	31%	0.305	S	S	.	.	H	α-helix	trans	-71.4	-46.2	177.1	-176.7	-165.3	170.4	-154.1	0	111.8	N223 T224 E235 Q277	N223-K227 PolarHBondContact O-N 3.1Å; T224-K227 PolarHBondContact O-N 2.99Å; K227-E235 IonicContact NZ-OE1 3.04Å; K227-Q277 PolarHBondContact O-NE2 2.93Å
228	F	76.9	Confident	83.1	Confident	9 Å²	9	54.8 Å²	54.8	4%	0.039	29%	0.294	C	S	.	.			trans	-158.2	116.5	176.8	-159.9	-128	0	0	0	112.4	T224 Y225 Y230 W265 V270 A273 R274	T224-F228 PolarHBondContact O-N 3.09Å; Y225-F228 CarbonylContact O-C 3.58Å; F228-Y230 WeakPolarHBondContact CD1-O 3.23Å; F228-Y230 WeakPolarHBondContact CE1-O 3.45Å; F228-Y230 PolarHBondContact O-N 2.84Å; F228-W265 HydrophobicContact CE2-CH2 4.4Å; F228-W265 HydrophobicContact CE2-CZ3 4.21Å; F228-V270 HydrophobicContact CE1-CG1 4.12Å; F228-V270 HydrophobicContact CZ-CG1 4.02Å; F228-A273 HydrophobicContact CE2-CB 3.56Å; F228-A273 HydrophobicContact CZ-CB 4Å; F228-R274 HydrophobicContact CE1-CB 4.43Å
229	P	81.8	Confident	83.2	Confident	23 Å²	23	53.7 Å²	53.7	15%	0.149	29%	0.289	C	S	.	.	S	Bend	trans	-65.9	-5.2	-179.9	-25.9	35.8	0	0	0	116.1	Y225 R258 V263	Y225-P229 HydrophobicContact CD2-CB 4.3Å; Y225-P229 HydrophobicContact CE2-CB 3.82Å; Y225-P229 HydrophobicContact CE2-CG 4.46Å; P229-R258 HydrophobicContact CB-CG 4.01Å; P229-R258 VanDerWaalsContact O-CD 3.3Å; P229-R258 WeakPolarHBondContact O-CD 3.23Å; P229-R258 PolarHBondContact O-NH1 3.34Å; P229-V263 HydrophobicContact CB-CG1 4.16Å; P229-V263 HydrophobicContact CG-CG1 4.36Å
230	Y	80.7	Confident	83.6	Confident	45 Å²	45	50.9 Å²	50.9	18%	0.176	27%	0.272	C	S	.	.	S	Bend	trans	-128.2	66.4	-177.2	-69.8	-100.9	0	0	0	111.5	F228 R258 V263 W265 V270	F228-Y230 WeakPolarHBondContact CD1-O 3.23Å; F228-Y230 WeakPolarHBondContact CE1-O 3.45Å; F228-Y230 PolarHBondContact O-N 2.84Å; Y230-R258 VanDerWaalsContact CE2-CD 3.42Å; Y230-R258 HydrophobicContact CE2-CG 4.47Å; Y230-V263 HydrophobicContact CE2-CG1 4.02Å; Y230-V263 PolarHBondContact OH-O 2.9Å; Y230-W265 HydrophobicContact CE2-CB 3.67Å; Y230-W265 HydrophobicContact CE2-CD2 4.45Å; Y230-W265 AromaticContact CE2-CG 3.85Å; Y230-W265 HydrophobicContact CE2-CG 3.85Å; Y230-W265 PolarHBondContact OH-N 2.9Å; Y230-W265 PolarHBondContact OH-O 3.28Å; Y230-V270 HydrophobicContact CD1-CG1 4.19Å; Y230-V270 HydrophobicContact CD1-CG2 3.65Å; Y230-V270 HydrophobicContact CD2-CG2 3.66Å; Y230-V270 HydrophobicContact CE1-CG2 3.76Å; Y230-V270 HydrophobicContact CE2-CG2 3.79Å; Y230-V270 HydrophobicContact CG-CB 4.45Å; Y230-V270 HydrophobicContact CG-CG1 3.94Å; Y230-V270 HydrophobicContact CG-CG2 3.58Å
231	P	84.7	Confident	83.9	Confident	17 Å²	17	52.4 Å²	52.4	11%	0.11	29%	0.288	C	S	.	.			trans	-56.8	143.6	-176.7	26.5	-37.3	0	0	0	111.7	E235 I236 F254	P231-E235 HydrophobicContact CB-CB 4.02Å; P231-I236 HydrophobicContact CB-CG1 3.89Å; P231-I236 HydrophobicContact CG-CD1 4.19Å; P231-I236 HydrophobicContact CG-CG1 3.73Å; P231-F254 HydrophobicContact CB-CE1 4.38Å; P231-F254 HydrophobicContact CB-CZ 4.43Å; P231-F254 VanDerWaalsContact CD-CE1 3.44Å; P231-F254 HydrophobicContact CG-CD1 3.6Å; P231-F254 HydrophobicContact CG-CD2 4.03Å; P231-F254 HydrophobicContact CG-CE1 3.58Å; P231-F254 HydrophobicContact CG-CE2 4.03Å; P231-F254 HydrophobicContact CG-CG 3.82Å; P231-F254 HydrophobicContact CG-CZ 3.81Å
232	S	83.8	Confident	83.9	Confident	33 Å²	33	57.6 Å²	57.6	23%	0.231	31%	0.313	C	S	.	.			trans	-69.2	160.3	172.7	62.7	0	0	0	0	111.5	A234 E235 I236	S232-A234 VanDerWaalsContact C-N 3.26Å; S232-A234 PolarHBondContact O-N 3.04Å; S232-E235 WeakPolarHBondContact CB-OE2 3.49Å; S232-E235 PolarHBondContact N-OE2 3.16Å; S232-E235 WeakPolarHBondContact O-CB 3.42Å; S232-E235 PolarHBondContact O-N 3.46Å; S232-E235 WeakPolarHBondContact OG-CG 3.49Å; S232-E235 PolarHBondContact OG-N 3.23Å; S232-E235 PolarHBondContact OG-OE2 3.41Å; S232-I236 WeakPolarHBondContact O-CG1 3.44Å; S232-I236 PolarHBondContact O-N 3.12Å
233	L	83.3	Confident	83.6	Confident	112 Å²	112	56.1 Å²	56.1	59%	0.586	31%	0.306	S	S	*	.	H	α-helix	trans	-53.4	-45.1	-179.6	-169.9	65.8	0	0	0	111.8	E235 I236 S237 E247	L233-E235 PolarHBondContact O-N 3.04Å; L233-I236 PolarHBondContact O-N 3.01Å; L233-I236 VanDerWaalsContact O-N 3.1Å; L233-S237 PolarHBondContact O-N 3.08Å; L233-S237 PolarHBondContact O-OG 2.87Å; L233-E247 VanDerWaalsContact CD1-OE1 3.28Å; L233-E247 WeakPolarHBondContact CD1-OE1 3.37Å
234	A	85.1	Confident	83.4	Confident	75 Å²	75	60.5 Å²	60.5	62%	0.62	32%	0.323	S	S	*	.	H	α-helix	trans	-62.1	-36.7	176.5	0	0	0	0	0	113.7	S232 S238	S232-A234 VanDerWaalsContact C-N 3.26Å; S232-A234 PolarHBondContact O-N 3.04Å; A234-S238 WeakPolarHBondContact O-CB 3.24Å; A234-S238 PolarHBondContact O-N 3.15Å
235	E	86.4	Confident	83.4	Confident	53 Å²	53	60.6 Å²	60.6	25%	0.248	32%	0.32	C	S	.	.	H	α-helix	trans	-68.6	-36	173.1	-73.2	166.3	124.5	0	0	111.5	K227 P231 S232 L233 L239	K227-E235 IonicContact NZ-OE1 3.04Å; P231-E235 HydrophobicContact CB-CB 4.02Å; S232-E235 WeakPolarHBondContact CB-OE2 3.49Å; S232-E235 PolarHBondContact N-OE2 3.16Å; S232-E235 WeakPolarHBondContact O-CB 3.42Å; S232-E235 PolarHBondContact O-N 3.46Å; S232-E235 WeakPolarHBondContact OG-CG 3.49Å; S232-E235 PolarHBondContact OG-N 3.23Å; S232-E235 PolarHBondContact OG-OE2 3.41Å; L233-E235 PolarHBondContact O-N 3.04Å; E235-L239 WeakPolarHBondContact O-CB 3.5Å; E235-L239 WeakPolarHBondContact O-CG 3.14Å; E235-L239 PolarHBondContact O-N 2.87Å
236	I	88.2	Confident	83.5	Confident	17 Å²	17	62.7 Å²	62.7	9%	0.087	34%	0.336	C	S	.	.	H	α-helix	trans	-69.1	-45.9	176.7	-55.3	166.8	0	0	0	110.5	P231 S232 L233 S238 L239 A240 E247 I250 K251	P231-I236 HydrophobicContact CB-CG1 3.89Å; P231-I236 HydrophobicContact CG-CD1 4.19Å; P231-I236 HydrophobicContact CG-CG1 3.73Å; S232-I236 WeakPolarHBondContact O-CG1 3.44Å; S232-I236 PolarHBondContact O-N 3.12Å; L233-I236 PolarHBondContact O-N 3.01Å; L233-I236 VanDerWaalsContact O-N 3.1Å; I236-S238 VanDerWaalsContact C-N 3.34Å; I236-S238 PolarHBondContact O-N 3.47Å; I236-L239 PolarHBondContact O-N 3.18Å; I236-A240 PolarHBondContact O-N 2.93Å; I236-E247 HydrophobicContact CB-CG 4.15Å; I236-E247 HydrophobicContact CG2-CB 4.45Å; I236-E247 HydrophobicContact CG2-CG 3.43Å; I236-E247 VanDerWaalsContact CG2-CG 3.43Å; I236-I250 HydrophobicContact CG2-CB 3.91Å; I236-I250 HydrophobicContact CG2-CG2 3.74Å; I236-K251 HydrophobicContact CD1-CG 4.07Å; I236-K251 HydrophobicContact CG2-CG 4.25Å
237	S	84.9	Confident	83.7	Confident	41 Å²	41	56.3 Å²	56.3	29%	0.287	31%	0.313	S	S	.	.	H	α-helix	trans	-63.2	-40.7	175.6	-42.5	0	0	0	0	111.5	L233 L239 A240 S241 E247	L233-S237 PolarHBondContact O-N 3.08Å; L233-S237 PolarHBondContact O-OG 2.87Å; S237-L239 VanDerWaalsContact C-N 3.35Å; S237-L239 PolarHBondContact O-N 3.02Å; S237-A240 WeakPolarHBondContact O-CB 3.35Å; S237-A240 PolarHBondContact O-N 3.32Å; S237-S241 PolarHBondContact O-N 2.78Å; S237-S241 VanDerWaalsContact O-N 3.08Å; S237-S241 PolarHBondContact O-OG 2.95Å; S237-E247 WeakPolarHBondContact CB-OE2 3.47Å; S237-E247 PolarHBondContact OG-OE2 3.42Å
238	S	87.1	Confident	84	Confident	60 Å²	60	54.8 Å²	54.8	42%	0.42	31%	0.309	S	S	.	.	H	α-helix	trans	-64	-37.8	175.2	-176.6	0	0	0	0	112.4	A234 I236 Q242	A234-S238 WeakPolarHBondContact O-CB 3.24Å; A234-S238 PolarHBondContact O-N 3.15Å; I236-S238 VanDerWaalsContact C-N 3.34Å; I236-S238 PolarHBondContact O-N 3.47Å; S238-Q242 WeakPolarHBondContact O-CG 3.19Å; S238-Q242 PolarHBondContact O-N 3.49Å; S238-Q242 PolarHBondContact O-NE2 3.2Å; S238-Q242 PolarHBondContact OG-NE2 3.47Å; S238-Q242 VanDerWaalsContact OG-NE2 3.11Å
239	L	86.8	Confident	84.4	Confident	5 Å²	5	57 Å²	57	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-67	-41	171.6	-75.6	167.1	0	0	0	111.4	L220 L221 T224 E235 I236 S237 S241 Q242 T243 I250 F254	L220-L239 HydrophobicContact CB-CD2 4.09Å; L221-L239 HydrophobicContact CD2-CB 4.3Å; L221-L239 HydrophobicContact CD2-CD1 4.14Å; L221-L239 HydrophobicContact CD2-CD2 4.22Å; L221-L239 HydrophobicContact CD2-CG 4.46Å; T224-L239 HydrophobicContact CG2-CD1 4.14Å; T224-L239 HydrophobicContact CG2-CD2 3.99Å; T224-L239 HydrophobicContact CG2-CG 4.44Å; T224-L239 WeakPolarHBondContact OG1-CD1 3.42Å; E235-L239 WeakPolarHBondContact O-CB 3.5Å; E235-L239 WeakPolarHBondContact O-CG 3.14Å; E235-L239 PolarHBondContact O-N 2.87Å; I236-L239 PolarHBondContact O-N 3.18Å; S237-L239 VanDerWaalsContact C-N 3.35Å; S237-L239 PolarHBondContact O-N 3.02Å; L239-S241 VanDerWaalsContact C-N 3.34Å; L239-S241 PolarHBondContact O-N 3.45Å; L239-Q242 CarbonylContact O-C 3.54Å; L239-Q242 PolarHBondContact O-N 3.39Å; L239-T243 HydrophobicContact CD2-CG2 4.43Å; L239-T243 WeakPolarHBondContact O-CB 3.26Å; L239-T243 WeakPolarHBondContact O-CG2 3.41Å; L239-T243 PolarHBondContact O-N 2.91Å; L239-T243 PolarHBondContact O-OG1 2.93Å; L239-I250 HydrophobicContact CB-CD1 3.95Å; L239-I250 HydrophobicContact CD1-CG2 4.45Å; L239-F254 HydrophobicContact CD1-CE2 3.98Å; L239-F254 HydrophobicContact CD1-CZ 4.19Å
240	A	87.4	Confident	84.6	Confident	22 Å²	22	55.9 Å²	55.9	18%	0.182	31%	0.312	C	S	.	.	H	α-helix	trans	-56.1	-47.8	176.6	0	0	0	0	0	111.7	I236 S237 Q242 T243 Q244 F245 I250	I236-A240 PolarHBondContact O-N 2.93Å; S237-A240 WeakPolarHBondContact O-CB 3.35Å; S237-A240 PolarHBondContact O-N 3.32Å; A240-Q242 PolarHBondContact O-N 3.39Å; A240-T243 PolarHBondContact O-N 3.4Å; A240-Q244 PolarHBondContact O-N 2.7Å; A240-F245 WeakPolarHBondContact CA-O 3.32Å; A240-F245 WeakPolarHBondContact CB-O 3.41Å; A240-I250 VanDerWaalsContact CA-CD1 3.47Å; A240-I250 HydrophobicContact CB-CD1 3.89Å; A240-I250 VanDerWaalsContact N-CD1 3.33Å
241	S	86.3	Confident	84.8	Confident	101 Å²	101	57.4 Å²	57.4	71%	0.706	32%	0.319	S	S	*	.	H	α-helix	trans	-60.5	-29.2	174.6	-53.7	0	0	0	0	114	S237 L239	S237-S241 PolarHBondContact O-N 2.78Å; S237-S241 VanDerWaalsContact O-N 3.08Å; S237-S241 PolarHBondContact O-OG 2.95Å; L239-S241 VanDerWaalsContact C-N 3.34Å; L239-S241 PolarHBondContact O-N 3.45Å
242	Q	84.1	Confident	84.9	Confident	109 Å²	109	58.1 Å²	58.1	51%	0.509	32%	0.323	S	S	.	.	H	α-helix	trans	-91.7	-27.4	-178.4	-74.4	171.7	80.6	0	0	114.2	L220 S238 L239 A240	L220-Q242 HydrophobicContact CD1-CB 3.9Å; S238-Q242 WeakPolarHBondContact O-CG 3.19Å; S238-Q242 PolarHBondContact O-N 3.49Å; S238-Q242 PolarHBondContact O-NE2 3.2Å; S238-Q242 PolarHBondContact OG-NE2 3.47Å; S238-Q242 VanDerWaalsContact OG-NE2 3.11Å; L239-Q242 CarbonylContact O-C 3.54Å; L239-Q242 PolarHBondContact O-N 3.39Å; A240-Q242 PolarHBondContact O-N 3.39Å
243	T	79.5	Confident	85.1	Confident	8 Å²	8	56.6 Å²	56.6	5%	0.049	31%	0.312	C	S	.	.	H	α-helix	trans	-112.5	1.4	-167.1	66.3	0	0	0	0	115	L220 L221 L239 A240 F245	L220-T243 HydrophobicContact CB-CG2 4.05Å; L220-T243 HydrophobicContact CD1-CG2 4.1Å; L221-T243 HydrophobicContact CD2-CG2 4.2Å; L221-T243 HydrophobicContact CG-CG2 4.25Å; L239-T243 HydrophobicContact CD2-CG2 4.43Å; L239-T243 WeakPolarHBondContact O-CB 3.26Å; L239-T243 WeakPolarHBondContact O-CG2 3.41Å; L239-T243 PolarHBondContact O-N 2.91Å; L239-T243 PolarHBondContact O-OG1 2.93Å; A240-T243 PolarHBondContact O-N 3.4Å; T243-F245 VanDerWaalsContact O-CD2 3.29Å; T243-F245 WeakPolarHBondContact O-CD2 3.23Å; T243-F245 PolarHBondContact O-N 2.96Å; T243-F245 VanDerWaalsContact O-N 3.14Å; T243-F245 WeakPolarHBondContact OG1-CD2 3.38Å
244	Q	80.2	Confident	85.3	Confident	177 Å²	177	51.3 Å²	51.3	83%	0.827	29%	0.285	S	S	*	.	S	Bend	trans	59.7	18.1	-178.5	-54.9	-66.7	-28.2	0	0	114.4	A240	A240-Q244 PolarHBondContact O-N 2.7Å
245	F	82.3	Confident	85.1	Confident	38 Å²	38	50.2 Å²	50.2	17%	0.167	27%	0.272	C	S	.	.			trans	-108.2	148.4	175.9	-59.7	-55.6	0	0	0	109.4	M215 N218 L221 A240 T243 Q249 I250	M215-F245 HydrophobicContact CB-CE2 4.29Å; M215-F245 HydrophobicContact CB-CZ 4.43Å; M215-F245 HydrophobicContact CE-CB 3.86Å; M215-F245 HydrophobicContact CE-CD1 4.47Å; M215-F245 HydrophobicContact CE-CD2 3.72Å; M215-F245 HydrophobicContact CE-CE2 4.39Å; M215-F245 HydrophobicContact CE-CG 3.78Å; M215-F245 HydrophobicContact CG-CD1 4.01Å; M215-F245 HydrophobicContact CG-CD2 3.94Å; M215-F245 HydrophobicContact CG-CE1 3.81Å; M215-F245 HydrophobicContact CG-CE2 3.74Å; M215-F245 HydrophobicContact CG-CG 4.08Å; M215-F245 HydrophobicContact CG-CZ 3.68Å; M215-F245 HydrophobicContact SD-CD1 4.38Å; M215-F245 HydrophobicContact SD-CD2 4.48Å; M215-F245 HydrophobicContact SD-CG 4.26Å; N218-F245 HydrophobicContact CB-CE2 4.26Å; L221-F245 HydrophobicContact CD1-CD2 3.95Å; L221-F245 HydrophobicContact CD1-CE2 4.03Å; A240-F245 WeakPolarHBondContact CA-O 3.32Å; A240-F245 WeakPolarHBondContact CB-O 3.41Å; T243-F245 VanDerWaalsContact O-CD2 3.29Å; T243-F245 WeakPolarHBondContact O-CD2 3.23Å; T243-F245 PolarHBondContact O-N 2.96Å; T243-F245 VanDerWaalsContact O-N 3.14Å; T243-F245 WeakPolarHBondContact OG1-CD2 3.38Å; F245-Q249 HydrophobicContact CB-CB 4.29Å; F245-I250 HydrophobicContact CB-CD1 4.21Å; F245-I250 HydrophobicContact CB-CG1 3.96Å
246	T	85.9	Confident	84.9	Confident	66 Å²	66	47.9 Å²	47.9	41%	0.405	26%	0.262	S	S	.	.			trans	-70.5	159.8	177.8	91.2	0	0	0	0	111.4	E248 Q249 I250	T246-E248 PolarHBondContact O-N 3.5Å; T246-E248 PolarHBondContact OG1-N 3.33Å; T246-E248 PolarHBondContact OG1-OE2 2.95Å; T246-Q249 HydrophobicContact CG2-CG 4.41Å; T246-Q249 WeakPolarHBondContact O-CB 3.1Å; T246-Q249 PolarHBondContact O-N 2.9Å; T246-Q249 VanDerWaalsContact O-N 3.16Å; T246-Q249 PolarHBondContact OG1-N 3.41Å; T246-I250 WeakPolarHBondContact O-CG1 3.2Å; T246-I250 PolarHBondContact O-N 3.18Å
247	E	84.9	Confident	84.7	Confident	45 Å²	45	48.2 Å²	48.2	21%	0.21	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-31.7	179	-148	-173.2	89	0	0	111.5	L233 I236 S237 I250 K251	L233-E247 VanDerWaalsContact CD1-OE1 3.28Å; L233-E247 WeakPolarHBondContact CD1-OE1 3.37Å; I236-E247 HydrophobicContact CB-CG 4.15Å; I236-E247 HydrophobicContact CG2-CB 4.45Å; I236-E247 HydrophobicContact CG2-CG 3.43Å; I236-E247 VanDerWaalsContact CG2-CG 3.43Å; S237-E247 WeakPolarHBondContact CB-OE2 3.47Å; S237-E247 PolarHBondContact OG-OE2 3.42Å; E247-I250 PolarHBondContact O-N 3.17Å; E247-K251 WeakPolarHBondContact O-CB 3.4Å; E247-K251 WeakPolarHBondContact O-CD 3.31Å; E247-K251 WeakPolarHBondContact O-CG 3.14Å; E247-K251 PolarHBondContact O-N 2.6Å; E247-K251 WeakPolarHBondContact OE1-CE 3.49Å; E247-K251 IonicContact OE1-NZ 2.74Å; E247-K251 PolarHBondContact OE1-NZ 3.13Å
248	E	84.1	Confident	84.6	Confident	95 Å²	95	48.8 Å²	48.8	44%	0.444	26%	0.259	S	S	.	.	H	α-helix	trans	-71.7	-45.5	177.8	-62.8	54.7	-113.4	0	0	110.9	T246 I250 K251 V252	T246-E248 PolarHBondContact O-N 3.5Å; T246-E248 PolarHBondContact OG1-N 3.33Å; T246-E248 PolarHBondContact OG1-OE2 2.95Å; E248-I250 PolarHBondContact O-N 3.23Å; E248-K251 PolarHBondContact O-N 3.04Å; E248-K251 IonicContact OE1-NZ 2.62Å; E248-K251 PolarHBondContact OE1-NZ 2.82Å; E248-V252 VanDerWaalsContact O-CB 3.3Å; E248-V252 WeakPolarHBondContact O-CB 3.2Å; E248-V252 VanDerWaalsContact O-CG2 3.26Å; E248-V252 WeakPolarHBondContact O-CG2 3.46Å; E248-V252 PolarHBondContact O-N 3.13Å
249	Q	84.1	Confident	84.2	Confident	54 Å²	54	51.8 Å²	51.8	25%	0.252	27%	0.27	S	S	.	.	H	α-helix	trans	-58.7	-40.8	174	-69.2	175.7	-20.7	0	0	110.5	M215 F245 T246 V252 W253	M215-Q249 HydrophobicContact CE-CB 4.05Å; M215-Q249 WeakPolarHBondContact CE-O 3.38Å; M215-Q249 HydrophobicContact SD-CB 3.87Å; F245-Q249 HydrophobicContact CB-CB 4.29Å; T246-Q249 HydrophobicContact CG2-CG 4.41Å; T246-Q249 WeakPolarHBondContact O-CB 3.1Å; T246-Q249 PolarHBondContact O-N 2.9Å; T246-Q249 VanDerWaalsContact O-N 3.16Å; T246-Q249 PolarHBondContact OG1-N 3.41Å; Q249-V252 PolarHBondContact O-N 3.28Å; Q249-W253 WeakPolarHBondContact O-CB 3.41Å; Q249-W253 PolarHBondContact O-N 3.17Å
250	I	86.6	Confident	83.2	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-71.3	-44.5	178.6	-61.5	167.6	0	0	0	111	M215 L221 I236 L239 A240 F245 T246 E247 E248 V252 W253 F254	M215-I250 HydrophobicContact CE-CB 4.37Å; M215-I250 HydrophobicContact CE-CG1 3.73Å; L221-I250 HydrophobicContact CD2-CD1 4.43Å; L221-I250 HydrophobicContact CD2-CG1 4.18Å; L221-I250 HydrophobicContact CD2-CG2 4.01Å; I236-I250 HydrophobicContact CG2-CB 3.91Å; I236-I250 HydrophobicContact CG2-CG2 3.74Å; L239-I250 HydrophobicContact CB-CD1 3.95Å; L239-I250 HydrophobicContact CD1-CG2 4.45Å; A240-I250 VanDerWaalsContact CA-CD1 3.47Å; A240-I250 HydrophobicContact CB-CD1 3.89Å; A240-I250 VanDerWaalsContact N-CD1 3.33Å; F245-I250 HydrophobicContact CB-CD1 4.21Å; F245-I250 HydrophobicContact CB-CG1 3.96Å; T246-I250 WeakPolarHBondContact O-CG1 3.2Å; T246-I250 PolarHBondContact O-N 3.18Å; E247-I250 PolarHBondContact O-N 3.17Å; E248-I250 PolarHBondContact O-N 3.23Å; I250-V252 VanDerWaalsContact C-N 3.3Å; I250-V252 PolarHBondContact O-N 3.05Å; I250-W253 PolarHBondContact O-N 3.26Å; I250-F254 HydrophobicContact CG2-CD2 3.66Å; I250-F254 HydrophobicContact CG2-CE2 3.78Å; I250-F254 WeakPolarHBondContact O-CD2 3.43Å; I250-F254 PolarHBondContact O-N 2.79Å
251	K	86.2	Confident	82.3	Confident	77 Å²	77	59.6 Å²	59.6	34%	0.335	30%	0.301	S	S	.	.	H	α-helix	trans	-53.6	-47.7	171.3	-71.9	157.8	-162.7	157.5	0	111.2	I236 E247 E248 S255	I236-K251 HydrophobicContact CD1-CG 4.07Å; I236-K251 HydrophobicContact CG2-CG 4.25Å; E247-K251 WeakPolarHBondContact O-CB 3.4Å; E247-K251 WeakPolarHBondContact O-CD 3.31Å; E247-K251 WeakPolarHBondContact O-CG 3.14Å; E247-K251 PolarHBondContact O-N 2.6Å; E247-K251 WeakPolarHBondContact OE1-CE 3.49Å; E247-K251 IonicContact OE1-NZ 2.74Å; E247-K251 PolarHBondContact OE1-NZ 3.13Å; E248-K251 PolarHBondContact O-N 3.04Å; E248-K251 IonicContact OE1-NZ 2.62Å; E248-K251 PolarHBondContact OE1-NZ 2.82Å; K251-S255 WeakPolarHBondContact O-CB 3.09Å; K251-S255 PolarHBondContact O-N 3.46Å; K251-S255 PolarHBondContact O-OG 3.27Å
252	V	86.8	Confident	81.2	Confident	32 Å²	32	57.4 Å²	57.4	19%	0.194	30%	0.295	C	S	.	.	H	α-helix	trans	-61.6	-51.2	177.5	164.3	0	0	0	0	110.7	I208 Y211 E248 Q249 I250 F254 S255 A256	I208-V252 HydrophobicContact CG2-CG1 3.75Å; Y211-V252 HydrophobicContact CD2-CG1 4.32Å; E248-V252 VanDerWaalsContact O-CB 3.3Å; E248-V252 WeakPolarHBondContact O-CB 3.2Å; E248-V252 VanDerWaalsContact O-CG2 3.26Å; E248-V252 WeakPolarHBondContact O-CG2 3.46Å; E248-V252 PolarHBondContact O-N 3.13Å; Q249-V252 PolarHBondContact O-N 3.28Å; I250-V252 VanDerWaalsContact C-N 3.3Å; I250-V252 PolarHBondContact O-N 3.05Å; V252-F254 PolarHBondContact O-N 3.47Å; V252-S255 WeakPolarHBondContact CA-OG 3.26Å; V252-S255 PolarHBondContact O-N 3.05Å; V252-S255 VanDerWaalsContact O-N 3.13Å; V252-S255 PolarHBondContact O-OG 3.05Å; V252-A256 WeakPolarHBondContact O-CB 3.45Å; V252-A256 PolarHBondContact O-N 3.26Å
253	W	87.5	Confident	80.2	Confident	1 Å²	1	53.8 Å²	53.8	0%	0.004	28%	0.28	C	S	.	.	H	α-helix	trans	-59.2	-48.2	179.3	-177.6	82	0	0	0	112.3	M215 D216 L221 I222 Y225 Q249 I250 S255 A256 Q257	M215-W253 HydrophobicContact CB-CB 4.39Å; M215-W253 VanDerWaalsContact CB-CD1 3.41Å; M215-W253 HydrophobicContact CB-CG 3.85Å; M215-W253 HydrophobicContact CE-CB 3.71Å; M215-W253 HydrophobicContact CE-CG 4.22Å; M215-W253 HydrophobicContact SD-CB 3.93Å; M215-W253 HydrophobicContact SD-CG 4.41Å; D216-W253 PolarHBondContact OD1-NE1 3.26Å; L221-W253 HydrophobicContact CB-CE3 4.03Å; L221-W253 HydrophobicContact CB-CH2 3.82Å; L221-W253 HydrophobicContact CB-CZ2 4.32Å; L221-W253 HydrophobicContact CB-CZ3 3.67Å; L221-W253 HydrophobicContact CD1-CD2 4.32Å; L221-W253 HydrophobicContact CD1-CE3 4.35Å; L221-W253 WeakPolarHBondContact O-CH2 3.41Å; L221-W253 WeakPolarHBondContact O-CZ3 3.31Å; I222-W253 HydrophobicContact CG1-CH2 4.44Å; I222-W253 HydrophobicContact CG1-CZ2 4.4Å; Y225-W253 HydrophobicContact CD2-CZ3 4.45Å; Y225-W253 HydrophobicContact CG-CH2 4.43Å; Q249-W253 WeakPolarHBondContact O-CB 3.41Å; Q249-W253 PolarHBondContact O-N 3.17Å; I250-W253 PolarHBondContact O-N 3.26Å; W253-S255 VanDerWaalsContact C-N 3.29Å; W253-S255 PolarHBondContact O-N 3.31Å; W253-A256 PolarHBondContact O-N 3.09Å; W253-Q257 HydrophobicContact CH2-CG 4.12Å; W253-Q257 HydrophobicContact CZ2-CG 4.13Å; W253-Q257 VanDerWaalsContact O-CB 3.27Å; W253-Q257 WeakPolarHBondContact O-CB 3.38Å; W253-Q257 PolarHBondContact O-N 2.94Å
254	F	87.3	Confident	79	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.009	31%	0.314	C	S	.	.	H	α-helix	trans	-60.6	-37.1	175.4	-91.4	-93	0	0	0	112.4	L221 Y225 P231 L239 I250 V252 R258	L221-F254 HydrophobicContact CD2-CE2 4.25Å; Y225-F254 AromaticContact CD2-CD1 3.75Å; Y225-F254 HydrophobicContact CD2-CD1 3.75Å; Y225-F254 AromaticContact CD2-CE1 3.91Å; Y225-F254 HydrophobicContact CD2-CE1 3.91Å; Y225-F254 HydrophobicContact CG-CE1 4.4Å; P231-F254 HydrophobicContact CB-CE1 4.38Å; P231-F254 HydrophobicContact CB-CZ 4.43Å; P231-F254 VanDerWaalsContact CD-CE1 3.44Å; P231-F254 HydrophobicContact CG-CD1 3.6Å; P231-F254 HydrophobicContact CG-CD2 4.03Å; P231-F254 HydrophobicContact CG-CE1 3.58Å; P231-F254 HydrophobicContact CG-CE2 4.03Å; P231-F254 HydrophobicContact CG-CG 3.82Å; P231-F254 HydrophobicContact CG-CZ 3.81Å; L239-F254 HydrophobicContact CD1-CE2 3.98Å; L239-F254 HydrophobicContact CD1-CZ 4.19Å; I250-F254 HydrophobicContact CG2-CD2 3.66Å; I250-F254 HydrophobicContact CG2-CE2 3.78Å; I250-F254 WeakPolarHBondContact O-CD2 3.43Å; I250-F254 PolarHBondContact O-N 2.79Å; V252-F254 PolarHBondContact O-N 3.47Å; F254-R258 WeakPolarHBondContact O-CB 3.43Å; F254-R258 WeakPolarHBondContact O-CG 3.43Å; F254-R258 PolarHBondContact O-N 3.38Å
255	S	81.7	Confident	78.3	Confident	51 Å²	51	55.3 Å²	55.3	36%	0.357	29%	0.294	S	S	.	.	H	α-helix	trans	-68.2	-42.3	175.8	73.8	0	0	0	0	113.1	K251 V252 W253 Q257 L259	K251-S255 WeakPolarHBondContact O-CB 3.09Å; K251-S255 PolarHBondContact O-N 3.46Å; K251-S255 PolarHBondContact O-OG 3.27Å; V252-S255 WeakPolarHBondContact CA-OG 3.26Å; V252-S255 PolarHBondContact O-N 3.05Å; V252-S255 VanDerWaalsContact O-N 3.13Å; V252-S255 PolarHBondContact O-OG 3.05Å; W253-S255 VanDerWaalsContact C-N 3.29Å; W253-S255 PolarHBondContact O-N 3.31Å; S255-Q257 VanDerWaalsContact C-N 3.34Å; S255-L259 WeakPolarHBondContact O-CB 3.27Å; S255-L259 PolarHBondContact O-N 3.5Å
256	A	82.3	Confident	77	Confident	5 Å²	5	56.4 Å²	56.4	4%	0.041	30%	0.304	C	S	.	.	H	α-helix	trans	-66.2	-37.7	175.1	0	0	0	0	0	111.3	Y211 V252 W253 L259 K260	Y211-A256 HydrophobicContact CD2-CB 4.05Å; Y211-A256 HydrophobicContact CE2-CB 3.72Å; V252-A256 WeakPolarHBondContact O-CB 3.45Å; V252-A256 PolarHBondContact O-N 3.26Å; W253-A256 PolarHBondContact O-N 3.09Å; A256-L259 WeakPolarHBondContact O-CB 3Å; A256-L259 PolarHBondContact O-N 3.31Å; A256-K260 WeakPolarHBondContact O-CB 3.39Å; A256-K260 WeakPolarHBondContact O-CG 3.42Å; A256-K260 PolarHBondContact O-N 3.18Å
257	Q	82.5	Confident	75.5	Confident	23 Å²	23	58.1 Å²	58.1	11%	0.107	32%	0.317	C	S	.	.	H	α-helix	trans	-70.4	-42.6	178.4	-164.6	69.1	-25.5	0	0	111.3	Y225 W253 S255 L259 K260 H261	Y225-Q257 HydrophobicContact CD1-CG 3.99Å; Y225-Q257 HydrophobicContact CD2-CB 4.02Å; Y225-Q257 HydrophobicContact CD2-CG 3.67Å; Y225-Q257 HydrophobicContact CE1-CG 3.83Å; Y225-Q257 HydrophobicContact CE2-CB 3.72Å; Y225-Q257 HydrophobicContact CE2-CG 3.5Å; Y225-Q257 VanDerWaalsContact CE2-CG 3.5Å; Y225-Q257 HydrophobicContact CG-CG 3.93Å; Y225-Q257 PolarHBondContact OH-O 3.25Å; W253-Q257 HydrophobicContact CH2-CG 4.12Å; W253-Q257 HydrophobicContact CZ2-CG 4.13Å; W253-Q257 VanDerWaalsContact O-CB 3.27Å; W253-Q257 WeakPolarHBondContact O-CB 3.38Å; W253-Q257 PolarHBondContact O-N 2.94Å; S255-Q257 VanDerWaalsContact C-N 3.34Å; Q257-L259 VanDerWaalsContact C-N 3.27Å; Q257-L259 PolarHBondContact O-N 2.93Å; Q257-K260 PolarHBondContact O-N 3.34Å; Q257-H261 PolarHBondContact NE2-NE2 2.92Å; Q257-H261 PolarHBondContact O-CD2 3.35Å; Q257-H261 PolarHBondContact O-N 2.9Å
258	R	82.9	Confident	73.9	Confident	54 Å²	54	62.3 Å²	62.3	20%	0.204	34%	0.336	C	S	.	.	H	α-helix	trans	-56.9	-40.5	169	-76	-170.7	-62.4	-95.9	3.4	112.2	Y225 P229 Y230 F254 G262 V263	Y225-R258 HydrophobicContact CE2-CG 4.07Å; P229-R258 HydrophobicContact CB-CG 4.01Å; P229-R258 VanDerWaalsContact O-CD 3.3Å; P229-R258 WeakPolarHBondContact O-CD 3.23Å; P229-R258 PolarHBondContact O-NH1 3.34Å; Y230-R258 VanDerWaalsContact CE2-CD 3.42Å; Y230-R258 HydrophobicContact CE2-CG 4.47Å; F254-R258 WeakPolarHBondContact O-CB 3.43Å; F254-R258 WeakPolarHBondContact O-CG 3.43Å; F254-R258 PolarHBondContact O-N 3.38Å; R258-G262 PolarHBondContact O-N 3.31Å; R258-G262 VanDerWaalsContact O-N 3.15Å; R258-V263 HydrophobicContact CB-CB 4.25Å; R258-V263 HydrophobicContact CG-CB 4.3Å; R258-V263 HydrophobicContact CG-CG1 4.48Å; R258-V263 PolarHBondContact O-N 3.28Å
259	L	78.1	Confident	73.3	Confident	123 Å²	123	61.8 Å²	61.8	64%	0.644	33%	0.334	S	S	*	.	H	α-helix	trans	-68	-43.5	178.1	-173.1	64.4	0	0	0	112.4	S255 A256 Q257 H261 G262	S255-L259 WeakPolarHBondContact O-CB 3.27Å; S255-L259 PolarHBondContact O-N 3.5Å; A256-L259 WeakPolarHBondContact O-CB 3Å; A256-L259 PolarHBondContact O-N 3.31Å; Q257-L259 VanDerWaalsContact C-N 3.27Å; Q257-L259 PolarHBondContact O-N 2.93Å; L259-H261 VanDerWaalsContact C-N 3.35Å; L259-H261 PolarHBondContact O-N 3.5Å; L259-G262 PolarHBondContact O-N 3.14Å
260	K	67	Low	72.4	Confident	74 Å²	74	59.8 Å²	59.8	32%	0.322	33%	0.325	S	S	.	.	H	α-helix	trans	-58.5	-41.9	175	-78.3	168.8	175.5	179.7	0	112.4	Y211 D216 A256 Q257	Y211-K260 PolarHBondContact OH-NZ 3.35Å; D216-K260 IonicContact OD1-NZ 2.67Å; D216-K260 PolarHBondContact OD1-NZ 2.61Å; D216-K260 IonicContact OD2-NZ 2.85Å; D216-K260 PolarHBondContact OD2-NZ 3.3Å; A256-K260 WeakPolarHBondContact O-CB 3.39Å; A256-K260 WeakPolarHBondContact O-CG 3.42Å; A256-K260 PolarHBondContact O-N 3.18Å; Q257-K260 PolarHBondContact O-N 3.34Å
261	H	68.3	Low	71.4	Confident	116 Å²	116	63.9 Å²	63.9	54%	0.537	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	5.8	-177.4	-67.3	-72.3	0	0	0	114.4	Y225 Q257 L259 V263	Y225-H261 AromaticContact CE1-CD2 3.76Å; Y225-H261 AromaticContact CZ-CD2 3.86Å; Y225-H261 PolarHBondContact OH-CD2 3.03Å; Q257-H261 PolarHBondContact NE2-NE2 2.92Å; Q257-H261 PolarHBondContact O-CD2 3.35Å; Q257-H261 PolarHBondContact O-N 2.9Å; L259-H261 VanDerWaalsContact C-N 3.35Å; L259-H261 PolarHBondContact O-N 3.5Å; H261-V263 VanDerWaalsContact C-N 3.27Å; H261-V263 HydrophobicContact CB-CG2 3.83Å; H261-V263 PolarHBondContact O-N 3.13Å
262	G	62.3	Low	70.3	Confident	56 Å²	56	64.3 Å²	64.3	58%	0.577	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	25.1	178.2	0	0	0	0	0	114.9	R258 L259 S264	R258-G262 PolarHBondContact O-N 3.31Å; R258-G262 VanDerWaalsContact O-N 3.15Å; L259-G262 PolarHBondContact O-N 3.14Å; G262-S264 PolarHBondContact O-N 2.94Å
263	V	64.6	Low	69.2	Low	32 Å²	32	63.7 Å²	63.7	19%	0.194	35%	0.345	C	S	.	.			trans	-77.4	86.5	-172.6	-177.5	0	0	0	0	110.5	Y225 P229 Y230 R258 H261 W265	Y225-V263 WeakPolarHBondContact OH-CG2 3.49Å; P229-V263 HydrophobicContact CB-CG1 4.16Å; P229-V263 HydrophobicContact CG-CG1 4.36Å; Y230-V263 HydrophobicContact CE2-CG1 4.02Å; Y230-V263 PolarHBondContact OH-O 2.9Å; R258-V263 HydrophobicContact CB-CB 4.25Å; R258-V263 HydrophobicContact CG-CB 4.3Å; R258-V263 HydrophobicContact CG-CG1 4.48Å; R258-V263 PolarHBondContact O-N 3.28Å; H261-V263 VanDerWaalsContact C-N 3.27Å; H261-V263 HydrophobicContact CB-CG2 3.83Å; H261-V263 PolarHBondContact O-N 3.13Å; V263-W265 HydrophobicContact CG1-CG 4.31Å; V263-W265 PolarHBondContact O-N 3.16Å
264	S	54.4	Low	68	Low	110 Å²	110	67.1 Å²	67.1	77%	0.769	36%	0.358	S	S	*	.			trans	-95.2	74.6	178.5	66.2	0	0	0	0	112.2	G262	G262-S264 PolarHBondContact O-N 2.94Å
265	W	65.2	Low	66.8	Low	107 Å²	107	73.2 Å²	73.2	41%	0.405	38%	0.381	S	S	.	.			trans	-90.8	141.9	170.2	-66.7	39.3	0	0	0	110.4	F228 Y230 V263 E269 V270 A273	F228-W265 HydrophobicContact CE2-CH2 4.4Å; F228-W265 HydrophobicContact CE2-CZ3 4.21Å; Y230-W265 HydrophobicContact CE2-CB 3.67Å; Y230-W265 HydrophobicContact CE2-CD2 4.45Å; Y230-W265 AromaticContact CE2-CG 3.85Å; Y230-W265 HydrophobicContact CE2-CG 3.85Å; Y230-W265 PolarHBondContact OH-N 2.9Å; Y230-W265 PolarHBondContact OH-O 3.28Å; V263-W265 HydrophobicContact CG1-CG 4.31Å; V263-W265 PolarHBondContact O-N 3.16Å; W265-E269 HydrophobicContact CE3-CB 3.95Å; W265-V270 HydrophobicContact CB-CG2 3.8Å; W265-V270 HydrophobicContact CE3-CG2 4.17Å; W265-A273 HydrophobicContact CH2-CB 3.81Å; W265-A273 HydrophobicContact CZ3-CB 3.42Å; W265-A273 VanDerWaalsContact CZ3-CB 3.42Å
266	T	54.3	Low	65.7	Low	62 Å²	62	77.5 Å²	77.5	38%	0.38	39%	0.394	S	S	.	.			trans	-74.9	153.7	168.9	60.1	0	0	0	0	111.1	E268 E269 V270	T266-E268 PolarHBondContact O-N 2.63Å; T266-E268 VanDerWaalsContact O-N 3.17Å; T266-E269 WeakPolarHBondContact CB-OE2 3.21Å; T266-E269 WeakPolarHBondContact CG2-OE2 3.5Å; T266-E269 PolarHBondContact N-OE2 2.8Å; T266-E269 PolarHBondContact O-N 3.11Å; T266-E269 VanDerWaalsContact O-N 3.1Å; T266-E269 VanDerWaalsContact OG1-CG 3.26Å; T266-E269 WeakPolarHBondContact OG1-CG 3.35Å; T266-E269 PolarHBondContact OG1-N 3.4Å; T266-E269 PolarHBondContact OG1-OE2 2.86Å; T266-V270 WeakPolarHBondContact O-CG2 3.47Å; T266-V270 PolarHBondContact O-N 2.75Å
267	P	54.5	Low	64.5	Low	102 Å²	102	81.5 Å²	81.5	66%	0.662	41%	0.411	S	S	*	.	H	α-helix	trans	-52.8	-35.4	175.9	-27.3	35.8	0	0	0	113.3	V270 E271	P267-V270 PolarHBondContact O-N 3.08Å; P267-E271 PolarHBondContact O-N 3.12Å
268	E	51.1	Low	62.7	Low	133 Å²	133	89 Å²	89	62%	0.621	44%	0.444	S	S	*	.	H	α-helix	trans	-67.7	-40.5	178.3	-62.4	87.1	163.1	0	0	112.8	T266 E271 E272	T266-E268 PolarHBondContact O-N 2.63Å; T266-E268 VanDerWaalsContact O-N 3.17Å; E268-E271 PolarHBondContact O-N 2.82Å; E268-E272 PolarHBondContact O-N 3.47Å
269	E	71	Confident	60.7	Low	84 Å²	84	92.1 Å²	92.1	39%	0.393	47%	0.465	S	S	.	.	H	α-helix	trans	-69.1	-37.1	175.4	-72.1	158	154.7	0	0	111.5	W265 T266 E272 A273	W265-E269 HydrophobicContact CE3-CB 3.95Å; T266-E269 WeakPolarHBondContact CB-OE2 3.21Å; T266-E269 WeakPolarHBondContact CG2-OE2 3.5Å; T266-E269 PolarHBondContact N-OE2 2.8Å; T266-E269 PolarHBondContact O-N 3.11Å; T266-E269 VanDerWaalsContact O-N 3.1Å; T266-E269 VanDerWaalsContact OG1-CG 3.26Å; T266-E269 WeakPolarHBondContact OG1-CG 3.35Å; T266-E269 PolarHBondContact OG1-N 3.4Å; T266-E269 PolarHBondContact OG1-OE2 2.86Å; E269-E272 PolarHBondContact O-N 3.01Å; E269-A273 PolarHBondContact O-N 3.03Å
270	V	66.1	Low	59.1	Low	11 Å²	11	89.1 Å²	89.1	7%	0.067	46%	0.463	C	S	.	.	H	α-helix	trans	-60.9	-45.5	173.2	172.4	0	0	0	0	110.5	F228 Y230 W265 T266 P267 E272 A273 R274	F228-V270 HydrophobicContact CE1-CG1 4.12Å; F228-V270 HydrophobicContact CZ-CG1 4.02Å; Y230-V270 HydrophobicContact CD1-CG1 4.19Å; Y230-V270 HydrophobicContact CD1-CG2 3.65Å; Y230-V270 HydrophobicContact CD2-CG2 3.66Å; Y230-V270 HydrophobicContact CE1-CG2 3.76Å; Y230-V270 HydrophobicContact CE2-CG2 3.79Å; Y230-V270 HydrophobicContact CG-CB 4.45Å; Y230-V270 HydrophobicContact CG-CG1 3.94Å; Y230-V270 HydrophobicContact CG-CG2 3.58Å; W265-V270 HydrophobicContact CB-CG2 3.8Å; W265-V270 HydrophobicContact CE3-CG2 4.17Å; T266-V270 WeakPolarHBondContact O-CG2 3.47Å; T266-V270 PolarHBondContact O-N 2.75Å; P267-V270 PolarHBondContact O-N 3.08Å; V270-E272 VanDerWaalsContact C-N 3.32Å; V270-E272 PolarHBondContact O-N 3.48Å; V270-A273 PolarHBondContact O-N 2.93Å; V270-R274 WeakPolarHBondContact O-CB 3.44Å; V270-R274 PolarHBondContact O-N 3.26Å
271	E	65.4	Low	58	Low	86 Å²	86	92 Å²	92	40%	0.402	49%	0.487	S	S	.	.	H	α-helix	trans	-70.2	-27.5	177.3	-153.7	61.3	-108.5	0	0	112.8	P267 E268 R274 R275	P267-E271 PolarHBondContact O-N 3.12Å; E268-E271 PolarHBondContact O-N 2.82Å; E271-R274 IonicContact OE1-CZ 2.65Å; E271-R274 IonicContact OE1-NH1 3.31Å; E271-R274 PolarHBondContact OE1-NH1 3.04Å; E271-R274 IonicContact OE2-CZ 2.65Å; E271-R274 IonicContact OE2-NH1 3.26Å; E271-R274 PolarHBondContact OE2-NH1 2.66Å; E271-R275 WeakPolarHBondContact O-CB 3.27Å; E271-R275 VanDerWaalsContact O-CG 3.31Å; E271-R275 WeakPolarHBondContact O-CG 3.33Å; E271-R275 PolarHBondContact O-N 3.08Å; E271-R275 VanDerWaalsContact O-N 3.12Å; E271-R275 PolarHBondContact O-NE 3.15Å
272	E	62.5	Low	56.4	Low	87 Å²	87	92.2 Å²	92.2	41%	0.407	50%	0.496	S	S	.	.	H	α-helix	trans	-72.2	-43.4	173.6	-161.3	-175.8	120.6	0	0	112.8	E268 E269 V270 R275 K276	E268-E272 PolarHBondContact O-N 3.47Å; E269-E272 PolarHBondContact O-N 3.01Å; V270-E272 VanDerWaalsContact C-N 3.32Å; V270-E272 PolarHBondContact O-N 3.48Å; E272-R275 PolarHBondContact O-N 3.49Å; E272-K276 HydrophobicContact CG-CD 4.45Å; E272-K276 WeakPolarHBondContact O-CG 3.24Å; E272-K276 PolarHBondContact O-N 3.38Å; E272-K276 WeakPolarHBondContact OE1-CE 3.37Å; E272-K276 IonicContact OE1-NZ 2.81Å; E272-K276 PolarHBondContact OE1-NZ 3.25Å
273	A	64.1	Low	55	Low	18 Å²	18	97.8 Å²	97.8	15%	0.149	51%	0.507	C	S	.	.	H	α-helix	trans	-70.8	-34.1	175	0	0	0	0	0	112.7	F228 W265 E269 V270 K276 Q277	F228-A273 HydrophobicContact CE2-CB 3.56Å; F228-A273 HydrophobicContact CZ-CB 4Å; W265-A273 HydrophobicContact CH2-CB 3.81Å; W265-A273 HydrophobicContact CZ3-CB 3.42Å; W265-A273 VanDerWaalsContact CZ3-CB 3.42Å; E269-A273 PolarHBondContact O-N 3.03Å; V270-A273 PolarHBondContact O-N 2.93Å; A273-K276 CarbonylContact O-C 3.55Å; A273-K276 PolarHBondContact O-N 3.19Å; A273-Q277 WeakPolarHBondContact O-CG 3.43Å; A273-Q277 PolarHBondContact O-N 2.84Å
274	R	63.4	Low	53.6	Low	74 Å²	74	101.7 Å²	101.7	28%	0.279	53%	0.531	S	S	.	.	H	α-helix	trans	-62.2	-43.8	172.4	-164.7	-175.8	-60.8	124.6	-0.2	111.2	F228 V270 E271 K276 Q277 F278	F228-R274 HydrophobicContact CE1-CB 4.43Å; V270-R274 WeakPolarHBondContact O-CB 3.44Å; V270-R274 PolarHBondContact O-N 3.26Å; E271-R274 IonicContact OE1-CZ 2.65Å; E271-R274 IonicContact OE1-NH1 3.31Å; E271-R274 PolarHBondContact OE1-NH1 3.04Å; E271-R274 IonicContact OE2-CZ 2.65Å; E271-R274 IonicContact OE2-NH1 3.26Å; E271-R274 PolarHBondContact OE2-NH1 2.66Å; R274-K276 PolarHBondContact O-N 3.36Å; R274-Q277 PolarHBondContact O-N 2.95Å; R274-F278 WeakPolarHBondContact O-CB 3.3Å; R274-F278 PolarHBondContact O-N 2.96Å
275	R	60.4	Low	52.5	Low	129 Å²	129	101.2 Å²	101.2	49%	0.487	52%	0.523	S	S	.	.	H	α-helix	trans	-58.7	-45.3	170.3	-77	175.2	-70.8	142.8	-3	112	E271 E272 Q277 F278 N279	E271-R275 WeakPolarHBondContact O-CB 3.27Å; E271-R275 VanDerWaalsContact O-CG 3.31Å; E271-R275 WeakPolarHBondContact O-CG 3.33Å; E271-R275 PolarHBondContact O-N 3.08Å; E271-R275 VanDerWaalsContact O-N 3.12Å; E271-R275 PolarHBondContact O-NE 3.15Å; E272-R275 PolarHBondContact O-N 3.49Å; R275-Q277 VanDerWaalsContact C-N 3.31Å; R275-Q277 PolarHBondContact O-N 3.3Å; R275-F278 PolarHBondContact O-N 2.83Å; R275-F278 VanDerWaalsContact O-N 3.16Å; R275-N279 WeakPolarHBondContact O-CB 3.21Å; R275-N279 PolarHBondContact O-N 3.03Å; R275-N279 PolarHBondContact O-OD1 2.84Å; R275-N279 VanDerWaalsContact O-OD1 3.04Å
276	K	60.2	Low	50.8	Low	142 Å²	142	101.2 Å²	101.2	62%	0.617	54%	0.537	S	S	*	.	H	α-helix	trans	-63.4	-31.2	176.5	-75.2	167	169.9	169.2	0	113.8	E272 A273 R274	E272-K276 HydrophobicContact CG-CD 4.45Å; E272-K276 WeakPolarHBondContact O-CG 3.24Å; E272-K276 PolarHBondContact O-N 3.38Å; E272-K276 WeakPolarHBondContact OE1-CE 3.37Å; E272-K276 IonicContact OE1-NZ 2.81Å; E272-K276 PolarHBondContact OE1-NZ 3.25Å; A273-K276 CarbonylContact O-C 3.55Å; A273-K276 PolarHBondContact O-N 3.19Å; R274-K276 PolarHBondContact O-N 3.36Å
277	Q	56.4	Low	49.9	Very low	88 Å²	88	107 Å²	107	41%	0.411	56%	0.56	S	S	.	*	H	α-helix	trans	-78	-31	172.7	-72	-170.9	-9.9	0	0	112.8	K227 A273 R274 R275	K227-Q277 PolarHBondContact O-NE2 2.93Å; A273-Q277 WeakPolarHBondContact O-CG 3.43Å; A273-Q277 PolarHBondContact O-N 2.84Å; R274-Q277 PolarHBondContact O-N 2.95Å; R275-Q277 VanDerWaalsContact C-N 3.31Å; R275-Q277 PolarHBondContact O-N 3.3Å
278	F	44.1	Very low	49	Very low	181 Å²	181	107.5 Å²	107.5	79%	0.794	56%	0.561	S	S	*	*	H	α-helix	trans	-80.3	-35.6	179.3	-171	-108.4	0	0	0	113.3	R274 R275 G280	R274-F278 WeakPolarHBondContact O-CB 3.3Å; R274-F278 PolarHBondContact O-N 2.96Å; R275-F278 PolarHBondContact O-N 2.83Å; R275-F278 VanDerWaalsContact O-N 3.16Å; F278-G280 PolarHBondContact O-N 3.26Å
279	N	41.1	Very low	48.3	Very low	120 Å²	120	108.2 Å²	108.2	64%	0.642	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-79.1	13	178.4	-76.3	93.4	0	0	0	114.3	R275 T281	R275-N279 WeakPolarHBondContact O-CB 3.21Å; R275-N279 PolarHBondContact O-N 3.03Å; R275-N279 PolarHBondContact O-OD1 2.84Å; R275-N279 VanDerWaalsContact O-OD1 3.04Å; N279-T281 PolarHBondContact O-N 3.15Å
280	G	45.7	Very low	46.4	Very low	59 Å²	59	109.5 Å²	109.5	61%	0.608	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-70.7	-19.7	-172.9	0	0	0	0	0	116.4	F278	F278-G280 PolarHBondContact O-N 3.26Å
281	T	43.4	Very low	44.8	Very low	136 Å²	136	115 Å²	115	83%	0.834	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-142.9	58.9	-171.2	-40.9	0	0	0	0	114.3	N279	N279-T281 PolarHBondContact O-N 3.15Å
282	V	35	Very low	43.2	Very low	119 Å²	119	117.7 Å²	117.7	72%	0.721	63%	0.63	S	S	*	*			trans	-147.8	110.8	135.7	-163.7	0	0	0	0	108.8	T284	V282-T284 VanDerWaalsContact C-N 3.3Å; V282-T284 HydrophobicContact CB-CG2 4.27Å; V282-T284 HydrophobicContact CG1-CG2 3.48Å; V282-T284 VanDerWaalsContact CG1-CG2 3.48Å; V282-T284 PolarHBondContact O-N 3.36Å; V282-T284 VanDerWaalsContact O-N 3.15Å
283	H	32.1	Very low	41.9	Very low	174 Å²	174	118.6 Å²	118.6	81%	0.806	64%	0.643	S	S	*	*			trans	-87	71.6	171.7	-166.1	-71.6	0	0	0	109.6	V285	H283-V285 VanDerWaalsContact C-N 3.31Å; H283-V285 PolarHBondContact O-N 3.06Å
284	T	35.6	Very low	40.3	Very low	114 Å²	114	122.3 Å²	122.3	70%	0.699	67%	0.674	S	S	*	*			trans	-66.4	89.7	176.6	53.9	0	0	0	0	110.2	V282 P286	V282-T284 VanDerWaalsContact C-N 3.3Å; V282-T284 HydrophobicContact CB-CG2 4.27Å; V282-T284 HydrophobicContact CG1-CG2 3.48Å; V282-T284 VanDerWaalsContact CG1-CG2 3.48Å; V282-T284 PolarHBondContact O-N 3.36Å; V282-T284 VanDerWaalsContact O-N 3.15Å; T284-P286 WeakPolarHBondContact O-CD 3.13Å
285	V	30.6	Very low	38.7	Very low	100 Å²	100	126.6 Å²	126.6	61%	0.606	70%	0.697	S	S	*	*			trans	-59.7	121.4	165.6	-179.8	0	0	0	0	107.1	H283 Q287	H283-V285 VanDerWaalsContact C-N 3.31Å; H283-V285 PolarHBondContact O-N 3.06Å; V285-Q287 PolarHBondContact O-N 3.45Å; V285-Q287 VanDerWaalsContact O-N 3.08Å
286	P	30.1	Very low	37.4	Very low	106 Å²	106	129.3 Å²	129.3	69%	0.688	72%	0.715	S	S	*	*			trans	-66.4	112.7	172.7	27.3	-32	0	0	0	108.1	T284 T288	T284-P286 WeakPolarHBondContact O-CD 3.13Å; P286-T288 VanDerWaalsContact C-N 3.26Å; P286-T288 PolarHBondContact O-N 3.3Å
287	Q	34.7	Very low	36	Very low	184 Å²	184	131.2 Å²	131.2	86%	0.86	73%	0.731	S	S	*	*			trans	-72.8	86.7	170.1	-71.8	-170.9	-5.1	0	0	108.7	V285 I289	V285-Q287 PolarHBondContact O-N 3.45Å; V285-Q287 VanDerWaalsContact O-N 3.08Å; Q287-I289 PolarHBondContact O-N 2.84Å
288	T	35.3	Very low	34.8	Very low	112 Å²	112	132.7 Å²	132.7	69%	0.687	75%	0.751	S	S	*	*			trans	-64.6	104	171.3	-55.4	0	0	0	0	109	P286 T290	P286-T288 VanDerWaalsContact C-N 3.26Å; P286-T288 PolarHBondContact O-N 3.3Å; T288-T290 HydrophobicContact CG2-CG2 4.25Å; T288-T290 PolarHBondContact O-N 2.94Å
289	I	37.4	Very low	34.1	Very low	149 Å²	149	128.9 Å²	128.9	76%	0.764	75%	0.754	S	S	*	*			trans	-72.5	90	176.4	-57.5	175.9	0	0	0	108.5	Q287 V291	Q287-I289 PolarHBondContact O-N 2.84Å; I289-V291 HydrophobicContact CG2-CG2 4.19Å; I289-V291 PolarHBondContact O-N 3.35Å
290	T	30.3	Very low	33.6	Very low	111 Å²	111	128.1 Å²	128.1	68%	0.681	76%	0.763	S	S	*	*			trans	-84.9	99.4	169.5	40.6	0	0	0	0	110.4	T288	T288-T290 HydrophobicContact CG2-CG2 4.25Å; T288-T290 PolarHBondContact O-N 2.94Å
291	V	33.4	Very low	32.8	Very low	125 Å²	125	129.7 Å²	129.7	76%	0.758	77%	0.771	S	S	*	*			trans	-77.5	120.4	164	-179.6	0	0	0	0	108.7	I289	I289-V291 HydrophobicContact CG2-CG2 4.19Å; I289-V291 PolarHBondContact O-N 3.35Å
292	I	32	Very low	32.5	Very low	143 Å²	143	131.4 Å²	131.4	73%	0.733	78%	0.775	S	S	*	*			trans	-121.9	120.2	169	-60.7	-179.6	0	0	0	107.6	A294	I292-A294 PolarHBondContact O-N 3.29Å
293	P	33.9	Very low	32.3	Very low	106 Å²	106	129.3 Å²	129.3	69%	0.688	78%	0.777	S	S	*	*			trans	-63.5	132.4	175.8	-22.9	34.4	0	0	0	112.1	H295	P293-H295 PolarHBondContact O-N 2.93Å
294	A	30.4	Very low	32.2	Very low	96 Å²	96	129.7 Å²	129.7	79%	0.793	78%	0.784	S	S	*	*			trans	-93.9	97.5	-176.9	0	0	0	0	0	111.9	I292	I292-A294 PolarHBondContact O-N 3.29Å
295	H	30.9	Very low	32.2	Very low	165 Å²	165	132.9 Å²	132.9	76%	0.764	79%	0.791	S	S	*	*			trans	-132.3	126.8	166.5	-71.5	-60.2	0	0	0	111.9	P293	P293-H295 PolarHBondContact O-N 2.93Å
296	Q	33.4	Very low	32.5	Very low	186 Å²	186	132.7 Å²	132.7	87%	0.869	79%	0.794	S	S	*	*			trans	56.5	102.2	157.8	-57.2	177.4	9.9	0	0	117.9
297	L	30	Very low	32.7	Very low	182 Å²	182	134.6 Å²	134.6	95%	0.953	80%	0.797	S	S	*	*				-161.8	145.1	117.8	-104.4	173.3	0	0	0	109.9
298	S	31.2	Very low	32.6	Very low	118 Å²	118	133.8 Å²	133.8	83%	0.825	80%	0.798	S	S	*	*			trans	-144.1	121.5	179.1	179.3	0	0	0	0	110.2
299	A	29.3	Very low	32.6	Very low	102 Å²	102	136.9 Å²	136.9	84%	0.843	80%	0.804	S	S	*	*			trans	-162.7	140.6	162.5	0	0	0	0	0	110.1
300	A	29.9	Very low	32.4	Very low	103 Å²	103	135.7 Å²	135.7	85%	0.851	80%	0.804	S	S	*	*			trans	-68.5	148.6	-168.4	0	0	0	0	0	116.4
301	A	28.8	Very low	32.3	Very low	93 Å²	93	136.5 Å²	136.5	77%	0.769	81%	0.813	S	S	*	*				-164.9	116.2	119.8	0	0	0	0	0	112.7
302	N	38.1	Very low	32.3	Very low	172 Å²	172	138.6 Å²	138.6	92%	0.92	82%	0.815	S	S	*	*			trans	27.4	104.1	151.2	-54.3	-15	0	0	0	119.7
303	G	31.1	Very low	32.3	Very low	74 Å²	74	139.8 Å²	139.8	76%	0.763	82%	0.821	S	S	*	*			trans	179.9	66.6	170	0	0	0	0	0	118.8
304	L	30.6	Very low	32.3	Very low	182 Å²	182	141.9 Å²	141.9	95%	0.953	83%	0.831	S	S	*	*			trans	58.5	147.9	166.4	-63.6	174.9	0	0	0	118.8
305	Q	35.3	Very low	32.3	Very low	182 Å²	182	140.8 Å²	140.8	85%	0.85	83%	0.829	S	S	*	*			trans	-101	159.2	-176.7	-84.5	-70.4	-2.4	0	0	113.3
306	S	35.8	Very low	32.5	Very low	95 Å²	95	141.8 Å²	141.8	66%	0.664	83%	0.834	S	S	*	*			trans	-61	134.1	-175.5	-178.2	0	0	0	0	114.6
307	I	34.9	Very low	33.3	Very low	146 Å²	146	138.8 Å²	138.8	75%	0.749	83%	0.831	S	S	*	*			trans	-135	102.9	148.3	-55.7	-179.9	0	0	0	108.2
308	L	31.7	Very low	33.2	Very low	168 Å²	168	133.3 Å²	133.3	88%	0.88	82%	0.818	S	S	*	*			trans	-114.8	99.7	161.3	-75.3	177.6	0	0	0	108.3
309	Q	36.6	Very low	33.3	Very low	176 Å²	176	136.1 Å²	136.1	82%	0.822	82%	0.823	S	S	*	*			trans	-93.7	143.8	169.8	-93.4	-175.5	-37.5	0	0	111.3
310	T	32.8	Very low	33.4	Very low	124 Å²	124	137.2 Å²	137.2	76%	0.761	82%	0.819	S	S	*	*			trans	-59.4	137.5	179.1	120.9	0	0	0	0	111.3
311	C	28.3	Very low	33.6	Very low	128 Å²	128	141.3 Å²	141.3	87%	0.865	82%	0.818	S	S	*	*			trans	-150.5	132	140.3	-124.8	0	0	0	0	113.2
312	Q	33.3	Very low	33.6	Very low	170 Å²	170	143.3 Å²	143.3	79%	0.794	82%	0.821	S	S	*	*			trans	-54.6	158.3	-178.2	-57.3	155.7	6	0	0	115.3
313	I	32.2	Very low	33.2	Very low	168 Å²	168	143.3 Å²	143.3	86%	0.862	82%	0.815	S	S	*	*			trans	-158.6	133.3	130.6	-97.6	148.2	0	0	0	108.9
314	V	34	Very low	33.2	Very low	150 Å²	150	147 Å²	147	91%	0.909	82%	0.823	S	S	*	*			trans	-132	138.2	164.5	167.7	0	0	0	0	106.4
315	G	29.4	Very low	33.2	Very low	72 Å²	72	141.6 Å²	141.6	74%	0.742	81%	0.81	S	S	*	*			trans	-157.7	60.2	-167.6	0	0	0	0	0	115.2
316	Q	36.6	Very low	33.3	Very low	186 Å²	186	139.6 Å²	139.6	87%	0.869	81%	0.814	S	S	*	*			trans	-102.6	129.1	159.9	-81.2	-83.6	21	0	0	108.5
317	P	49.1	Very low	33.1	Very low	124 Å²	124	139 Å²	139	81%	0.805	82%	0.822	S	S	*	*			trans	-107.1	118.2	171.7	34.3	-25.5	0	0	0	112.2
318	G	29.3	Very low	32.9	Very low	67 Å²	67	135.4 Å²	135.4	69%	0.691	82%	0.821	S	S	*	*			trans	164.5	101.9	166.8	0	0	0	0	0	116.2
319	L	32.7	Very low	32.8	Very low	176 Å²	176	134.8 Å²	134.8	92%	0.921	82%	0.819	S	S	*	*	S	Bend	trans	66.7	127.9	159.1	-53.7	173.9	0	0	0	116.6
320	V	31.8	Very low	32.8	Very low	125 Å²	125	134.4 Å²	134.4	76%	0.758	82%	0.821	S	S	*	*			cis	-144.5	150.2	-10.5	-172.1	0	0	0	0	107.4
321	F	32.4	Very low	33.4	Very low	190 Å²	190	133.8 Å²	133.8	83%	0.833	82%	0.82	S	S	*	*			trans	-105.3	139.2	170.9	-123.3	-85.4	0	0	0	111.2
322	T	30.3	Very low	33.4	Very low	135 Å²	135	134.2 Å²	134.2	83%	0.828	82%	0.818	S	S	*	*			trans	-132.4	152.3	156	69.4	0	0	0	0	108.9
323	Q	30	Very low	33.2	Very low	172 Å²	172	132.7 Å²	132.7	80%	0.804	82%	0.82	S	S	*	*			trans	-143.1	117.1	-160.8	175.5	-170.9	-26.5	0	0	112.8
324	V	29.1	Very low	33.4	Very low	152 Å²	152	128.9 Å²	128.9	92%	0.921	81%	0.809	S	S	*	*			trans	-156.1	154.7	155.3	-73.9	0	0	0	0	106.5
325	G	30.6	Very low	33.6	Very low	67 Å²	67	128 Å²	128	69%	0.691	81%	0.807	S	S	*	*			cis	173.6	135	-5.1	0	0	0	0	0	107
326	P	38	Very low	33.9	Very low	141 Å²	141	131.6 Å²	131.6	92%	0.916	81%	0.807	S	S	*	*			trans	-89.3	133.4	-162.3	32.6	-34.9	0	0	0	114.9
327	G	31.4	Very low	33.5	Very low	82 Å²	82	128.4 Å²	128.4	85%	0.845	80%	0.8	S	S	*	*			trans	159.3	135.8	159.8	0	0	0	0	0	116.4
328	G	31.2	Very low	32.6	Very low	71 Å²	71	130.8 Å²	130.8	73%	0.732	81%	0.805	S	S	*	*			trans	95.4	94	148.6	0	0	0	0	0	119.9
329	N	30.8	Very low	32.7	Very low	155 Å²	155	133.5 Å²	133.5	83%	0.829	81%	0.809	S	S	*	*			trans	66.1	120.6	131.5	-61.3	0.2	0	0	0	122.9
330	L	35.3	Very low	32.7	Very low	167 Å²	167	132.1 Å²	132.1	87%	0.874	81%	0.807	S	S	*	*			trans	81.4	158.9	141.6	-65	179.4	0	0	0	118.9
331	P	45.4	Very low	32.5	Very low	111 Å²	111	130.9 Å²	130.9	72%	0.721	81%	0.81	S	S	*	*			trans	-115.7	-168.8	-137.6	43.1	-36.3	0	0	0	116.5
332	V	28.6	Very low	32.2	Very low	138 Å²	138	125.3 Å²	125.3	84%	0.836	81%	0.806	S	S	*	*			trans	86.2	97.6	173.9	-170	0	0	0	0	115.9
333	T	30	Very low	32.1	Very low	137 Å²	137	127.2 Å²	127.2	84%	0.84	81%	0.81	S	S	*	*				-173.1	149.5	115	-175.2	0	0	0	0	110.6
334	S	35.3	Very low	32.8	Very low	89 Å²	89	124.8 Å²	124.8	62%	0.622	81%	0.809	S	S	*	*			trans	-123.4	115.7	-179	56.6	0	0	0	0	111.2
335	P	37.6	Very low	32.7	Very low	132 Å²	132	122.8 Å²	122.8	86%	0.857	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-73.1	135.6	167.7	30.3	-31.9	0	0	0	110.2
336	I	35.5	Very low	32.7	Very low	147 Å²	147	128.5 Å²	128.5	75%	0.754	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-97	147.6	-167.2	-71.9	169.7	0	0	0	112.1
337	T	28.2	Very low	32.2	Very low	119 Å²	119	126 Å²	126	73%	0.73	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-59.9	142	173.8	-19.5	0	0	0	0	112.6
338	L	30.8	Very low	32.2	Very low	173 Å²	173	131.7 Å²	131.7	91%	0.906	80%	0.801	S	S	*	*			trans	-114.2	116.1	162.3	-71	178.9	0	0	0	110.6
339	T	32.5	Very low	32	Very low	125 Å²	125	133.4 Å²	133.4	77%	0.767	80%	0.802	S	S	*	*			trans	-112.7	145.3	173.3	-58.3	0	0	0	0	108.3
340	V	32.8	Very low	31.8	Very low	147 Å²	147	131.3 Å²	131.3	89%	0.891	80%	0.8	S	S	*	*			trans	-129.4	118.2	178	175.6	0	0	0	0	110.4
341	A	26.4	Very low	31.2	Very low	98 Å²	98	127.8 Å²	127.8	81%	0.81	79%	0.789	S	S	*	*			trans	-159.1	124	167.1	0	0	0	0	0	112
342	G	25.7	Very low	30.2	Very low	73 Å²	73	133.8 Å²	133.8	75%	0.753	80%	0.798	S	S	*	*			trans	81.7	110.2	145.8	0	0	0	0	0	122.3
343	L	29.5	Very low	30	Very low	175 Å²	175	133.5 Å²	133.5	92%	0.916	80%	0.796	S	S	*	*			trans	63.8	173.7	142.9	-108.6	41.3	0	0	0	117.7
344	P	44.3	Very low	29.7	Very low	121 Å²	121	132.3 Å²	132.3	79%	0.786	79%	0.793	S	S	*	*			cis	-130.6	-162.8	2	42.7	-24	0	0	0	116.7
345	S	26.7	Very low	29.1	Very low	110 Å²	110	133.1 Å²	133.1	77%	0.769	80%	0.797	S	S	*	*			trans	-80.5	156.9	-170.7	-35.5	0	0	0	0	116.8
346	Q	30.2	Very low	28.4	Very low	187 Å²	187	135.4 Å²	135.4	87%	0.874	80%	0.797	S	S	*	*				-170.3	163.9	109.1	-121.7	-168.6	5.9	0	0	116.1
347	S	28.5	Very low	27.7	Very low	90 Å²	90	133.7 Å²	133.7	63%	0.629	80%	0.798	S	S	*	*			trans	-59.9	154.6	-175.9	49.4	0	0	0	0	120.3
348	Q	31.9	Very low	27.7	Very low	200 Å²	200	134.2 Å²	134.2	94%	0.935	80%	0.801	S	S	*	*				-143	171.6	128.7	-72	-153.8	13.2	0	0	110.2
349	S	26.4	Very low	28.1	Very low	107 Å²	107	131 Å²	131	75%	0.748	79%	0.791	S	S	*	*			trans	-140.8	177.7	-158.1	63.8	0	0	0	0	116.4
350	S	25.5	Very low	27.6	Very low	112 Å²	112	131 Å²	131	78%	0.783	79%	0.791	S	S	*	*			trans	85.9	147.4	166.3	-54.7	0	0	0	0	118.3
351	S	22.9	Very low	27.1	Very low	93 Å²	93	131 Å²	131	65%	0.65	79%	0.785	S	S	*	*			cis	-170.5	146.2	-24.8	64.5	0	0	0	0	112.9
352	R	24.4	Very low	27.2	Very low	236 Å²	236	130.9 Å²	130.9	89%	0.891	78%	0.779	S	S	*	*			trans	65.5	166.5	166	-44.7	178.1	-179.5	178.1	-0.8	115.3
353	V	25.3	Very low	27.3	Very low	133 Å²	133	135.8 Å²	135.8	81%	0.806	78%	0.782	S	S	*	*			cis	-148.8	160	3.3	-142.2	0	0	0	0	112.3
354	S	23.7	Very low	27.3	Very low	111 Å²	111	133.7 Å²	133.7	78%	0.776	77%	0.771	S	S	*	*			trans	78.8	173.2	144.4	-145.4	0	0	0	0	121.8
355	C	21.6	Very low	26.7	Very low	106 Å²	106	136.4 Å²	136.4	72%	0.716	77%	0.771	S	S	*	*			trans	-147.7	165.5	-145.9	-53.9	0	0	0	0	115.7
356	Q	23.9	Very low	26.9	Very low	180 Å²	180	142.4 Å²	142.4	84%	0.841	78%	0.776	S	S	*	*			trans	74.9	149.6	151.8	-74	-174.6	45.4	0	0	122.6
357	S	21.5	Very low	26.9	Very low	112 Å²	112	137.1 Å²	137.1	78%	0.783	77%	0.765	S	S	*	*			trans	69.7	132.3	151.1	47.3	0	0	0	0	122.1
358	T	28.2	Very low	26.9	Very low	130 Å²	130	139.4 Å²	139.4	80%	0.798	78%	0.775	S	S	*	*			trans	-78.3	170.2	157.4	56.7	0	0	0	0	111
359	P	38.9	Very low	26.7	Very low	105 Å²	105	135.6 Å²	135.6	68%	0.682	77%	0.766	S	S	*	*			cis	-138.3	-162.3	8	40.8	-19.9	0	0	0	115.1
360	T	22.2	Very low	26.8	Very low	126 Å²	126	136.5 Å²	136.5	77%	0.773	77%	0.767	S	S	*	*			trans	68.8	110.2	152.8	47.6	0	0	0	0	123.2
361	N	22.3	Very low	26.8	Very low	145 Å²	145	139.4 Å²	139.4	78%	0.775	77%	0.768	S	S	*	*				79.8	145	122.3	-154.2	21.7	0	0	0	122.8
362	S	28.6	Very low	28.2	Very low	96 Å²	96	140 Å²	140	67%	0.671	77%	0.769	S	S	*	*			trans	64.4	147.2	155.7	50.3	0	0	0	0	120.7
363	E	26	Very low	29.3	Very low	176 Å²	176	134 Å²	134	82%	0.822	76%	0.761	S	S	*	*			cis	-167.7	-149.1	-25.6	-151.6	-174.7	74.5	0	0	109.2
364	L	30.9	Very low	29.4	Very low	132 Å²	132	132.7 Å²	132.7	69%	0.691	76%	0.758	S	S	*	*			trans	77.4	132.1	178	-47	-173.5	0	0	0	115.4
365	K	32.3	Very low	29.6	Very low	177 Å²	177	134.6 Å²	134.6	77%	0.77	76%	0.759	S	S	*	*			cis	-152.7	150.4	-4.2	-101.6	156.8	-177.4	172.7	0	105.1
366	R	30.3	Very low	29.9	Very low	236 Å²	236	135.1 Å²	135.1	89%	0.891	76%	0.764	S	S	*	*				176.5	155	54.8	-173.2	-173	-59.4	177.8	1.8	107.1
367	A	29.7	Very low	30.8	Very low	76 Å²	76	132.2 Å²	132.2	63%	0.628	76%	0.76	S	S	*	*			cis	-171.1	168.6	-34.4	0	0	0	0	0	107.5
368	T	28.7	Very low	31	Very low	139 Å²	139	135.1 Å²	135.1	85%	0.853	76%	0.761	S	S	*	*			trans	72.1	134.2	162.7	-52.3	0	0	0	0	116.2
369	T	27.3	Very low	30.9	Very low	119 Å²	119	136.2 Å²	136.2	73%	0.73	76%	0.758	S	S	*	*			cis	-173	166.3	-17.5	-164	0	0	0	0	107.1
370	V	28.4	Very low	30.5	Very low	127 Å²	127	138.5 Å²	138.5	77%	0.77	76%	0.764	S	S	*	*			cis	-128.2	-133.4	5.6	-154.7	0	0	0	0	110.5
371	Q	25.7	Very low	30.7	Very low	172 Å²	172	137.9 Å²	137.9	80%	0.804	76%	0.764	S	S	*	*			trans	-170.3	-168.7	-173.1	-112.6	-159.2	32.8	0	0	110.1
372	P	53.5	Low	31.1	Very low	105 Å²	105	135.1 Å²	135.1	68%	0.682	76%	0.762	S	S	*	*			cis	-117.1	-40.5	-8.9	34.9	-31.1	0	0	0	125
373	P	47.5	Very low	31.2	Very low	112 Å²	112	138.4 Å²	138.4	73%	0.727	77%	0.771	S	S	*	*			trans	-124.7	172.6	-130.4	39.2	-23.9	0	0	0	117.4
374	S	25.5	Very low	31.2	Very low	105 Å²	105	135.6 Å²	135.6	73%	0.734	77%	0.771	S	S	*	*			cis	-172.8	164	-34.7	-168.5	0	0	0	0	110.5
375	L	29.3	Very low	31	Very low	151 Å²	151	133.9 Å²	133.9	79%	0.791	78%	0.776	S	S	*	*			trans	79.1	115.2	163.4	-55.2	-175.8	0	0	0	122.5
376	S	28.2	Very low	30.7	Very low	117 Å²	117	131.6 Å²	131.6	82%	0.818	77%	0.772	S	S	*	*			trans	84.3	155.9	132.6	76.3	0	0	0	0	121.6
377	P	42	Very low	30.8	Very low	119 Å²	119	125.8 Å²	125.8	77%	0.773	77%	0.768	S	S	*	*			trans	-133.3	118.5	-161.9	36.2	-14.9	0	0	0	116
378	Q	26.5	Very low	31.2	Very low	172 Å²	172	131.4 Å²	131.4	80%	0.804	78%	0.778	S	S	*	*			trans	-156.1	157.8	171.2	-146.3	161.4	-103.6	0	0	117.2
379	E	26.2	Very low	31.6	Very low	154 Å²	154	130.4 Å²	130.4	72%	0.72	78%	0.777	S	S	*	*			trans	64.4	173.1	154.7	63.1	-148.6	110	0	0	123.5
380	N	29.1	Very low	32.2	Very low	153 Å²	153	132.2 Å²	132.2	82%	0.818	78%	0.781	S	S	*	*			trans	-133.5	145.9	-151.4	-52.2	-100.6	0	0	0	113
381	S	27	Very low	32.5	Very low	112 Å²	112	136 Å²	136	78%	0.783	78%	0.781	S	S	*	*			trans	163.7	128.5	134.6	-74.1	0	0	0	0	108.5
382	A	31.4	Very low	33.6	Very low	87 Å²	87	132 Å²	132	72%	0.719	77%	0.771	S	S	*	*				57.7	125.8	69.2	0	0	0	0	0	111.5
383	L	30.9	Very low	33.4	Very low	165 Å²	165	136.9 Å²	136.9	86%	0.864	78%	0.781	S	S	*	*			cis	-136.1	171.1	31.6	-64.5	161.7	0	0	0	110.3
384	S	24.8	Very low	34.4	Very low	117 Å²	117	133.6 Å²	133.6	82%	0.818	76%	0.755	S	S	*	*				-162.5	-176.5	50.2	-68.5	0	0	0	0	114.1
385	A	26.9	Very low	37	Very low	96 Å²	96	131 Å²	131	79%	0.793	74%	0.738	S	S	*	*			trans	-65.7	171.2	-179.1	0	0	0	0	0	114.2
386	D	25.8	Very low	39.3	Very low	130 Å²	130	133 Å²	133	70%	0.695	74%	0.74	S	S	*	*			cis	-146.9	157.4	14.3	-161.7	-13.8	0	0	0	112	F388	D386-F388 PolarHBondContact OD1-N 3.14Å
387	S	31.8	Very low	41.8	Very low	114 Å²	114	134.7 Å²	134.7	80%	0.797	74%	0.735	S	S	*	*			trans	-156.9	33.8	174.5	-138	0	0	0	0	115.3	S389	S387-S389 PolarHBondContact O-N 2.82Å
388	F	39.1	Very low	43.8	Very low	194 Å²	194	131.1 Å²	131.1	85%	0.851	71%	0.708	S	S	*	*			trans	-80.4	77.7	175.4	-84.5	-83.6	0	0	0	113.9	D386	D386-F388 PolarHBondContact OD1-N 3.14Å
389	S	37.6	Very low	46.5	Very low	118 Å²	118	125.5 Å²	125.5	83%	0.825	68%	0.683	S	S	*	*	S	Bend	trans	-151.5	-42.4	164.8	-83	0	0	0	0	115.2	S387 R391	S387-S389 PolarHBondContact O-N 2.82Å; S389-R391 PolarHBondContact O-N 2.91Å
390	L	38.6	Very low	49.5	Very low	156 Å²	156	120.9 Å²	120.9	82%	0.817	67%	0.671	S	S	*	*			trans	-95.2	103.5	-177.5	-62.4	-179	0	0	0	111.2	P392	L390-P392 WeakPolarHBondContact O-CD 3.29Å; L390-P392 VanDerWaalsContact O-N 3.13Å
391	R	36.1	Very low	52.3	Low	206 Å²	206	115.8 Å²	115.8	78%	0.777	64%	0.643	S	S	*	*			trans	-56.9	111.6	169	-94.6	-90.3	-73.9	149.5	2.3	109.7	S389 K393	S389-R391 PolarHBondContact O-N 2.91Å; R391-K393 PolarHBondContact O-N 3.11Å
392	P	47.3	Very low	55.3	Low	89 Å²	89	110.5 Å²	110.5	58%	0.578	61%	0.605	S	S	*	*			trans	-64.1	125.5	179.6	-21.6	35	0	0	0	109.6	L390 K394	L390-P392 WeakPolarHBondContact O-CD 3.29Å; L390-P392 VanDerWaalsContact O-N 3.13Å; P392-K394 VanDerWaalsContact C-N 3.34Å; P392-K394 PolarHBondContact O-N 2.89Å
393	K	51.1	Low	58	Low	207 Å²	207	112 Å²	112	90%	0.9	60%	0.596	S	S	*	*			trans	-63.7	103	159.8	-73.6	174.9	-179.5	169.9	0	105.4	R391 S395	R391-K393 PolarHBondContact O-N 3.11Å; K393-S395 PolarHBondContact O-N 2.8Å; K393-S395 VanDerWaalsContact O-N 3.13Å
394	K	67.1	Low	60.7	Low	43 Å²	43	106.7 Å²	106.7	19%	0.187	58%	0.576	C	S	.	*			trans	-45.3	123.2	179.9	-69.6	-171.3	173.3	-166.3	0	109	P392 Q398 L399 L402 L426 E430	P392-K394 VanDerWaalsContact C-N 3.34Å; P392-K394 PolarHBondContact O-N 2.89Å; K394-Q398 VanDerWaalsContact CA-OE1 3.24Å; K394-L399 HydrophobicContact CB-CD1 3.38Å; K394-L399 HydrophobicContact CD-CD1 4.09Å; K394-L399 HydrophobicContact CG-CD1 4.37Å; K394-L402 HydrophobicContact CD-CD1 4.29Å; K394-L426 HydrophobicContact CD-CD1 3.77Å; K394-L426 HydrophobicContact CD-CD2 4.29Å; K394-L426 HydrophobicContact CG-CD1 4.33Å; K394-L426 HydrophobicContact CG-CD2 4.14Å; K394-E430 PolarHBondContact NZ-O 2.86Å
395	S	79.6	Confident	63.7	Low	52 Å²	52	101.1 Å²	101.1	36%	0.364	54%	0.537	S	S	.	.			trans	-52.9	150.1	-173.1	172.8	0	0	0	0	111.1	K393 E397 Q398 L399	K393-S395 PolarHBondContact O-N 2.8Å; K393-S395 VanDerWaalsContact O-N 3.13Å; S395-E397 PolarHBondContact O-N 3.34Å; S395-E397 VanDerWaalsContact O-N 3.14Å; S395-E397 PolarHBondContact OG-N 3.45Å; S395-Q398 PolarHBondContact O-N 2.8Å; S395-Q398 VanDerWaalsContact O-N 3.1Å; S395-L399 PolarHBondContact O-N 2.99Å
396	K	78.8	Confident	66.6	Low	192 Å²	192	97.2 Å²	97.2	84%	0.835	50%	0.501	S	S	*	.	H	α-helix	trans	-50.4	-37.1	173.2	-175.1	-178.9	176.6	-173.8	0	111.2	A400	K396-A400 PolarHBondContact O-N 3.38Å
397	E	80.4	Confident	69.4	Low	152 Å²	152	97.5 Å²	97.5	71%	0.71	50%	0.502	S	S	*	.	H	α-helix	trans	-71.1	-50.7	175.7	-177.1	179.3	-159.2	0	0	112.9	S395 L399 A400 E401	S395-E397 PolarHBondContact O-N 3.34Å; S395-E397 VanDerWaalsContact O-N 3.14Å; S395-E397 PolarHBondContact OG-N 3.45Å; E397-L399 PolarHBondContact O-N 3.28Å; E397-L399 VanDerWaalsContact O-N 3.16Å; E397-A400 WeakPolarHBondContact O-CA 3.4Å; E397-A400 WeakPolarHBondContact O-CB 3.32Å; E397-A400 PolarHBondContact O-N 2.91Å; E397-E401 PolarHBondContact O-N 3.2Å
398	Q	83.6	Confident	71.6	Confident	44 Å²	44	99.8 Å²	99.8	21%	0.206	50%	0.498	C	S	.	.	H	α-helix	trans	-54.1	-36.7	172.4	-69.2	171.5	-20.9	0	0	111.4	K394 S395 L402 T424 L426	K394-Q398 VanDerWaalsContact CA-OE1 3.24Å; S395-Q398 PolarHBondContact O-N 2.8Å; S395-Q398 VanDerWaalsContact O-N 3.1Å; Q398-L402 VanDerWaalsContact O-CB 3.28Å; Q398-L402 WeakPolarHBondContact O-CB 3.38Å; Q398-L402 WeakPolarHBondContact O-CD1 3.46Å; Q398-L402 WeakPolarHBondContact O-CG 3.33Å; Q398-L402 PolarHBondContact O-N 3.43Å; Q398-L402 VanDerWaalsContact O-N 3.07Å; Q398-T424 HydrophobicContact CB-CG2 4.38Å; Q398-T424 PolarHBondContact NE2-O 3.31Å; Q398-L426 HydrophobicContact CB-CD1 4.49Å
399	L	84.6	Confident	73.5	Confident	54 Å²	54	94.2 Å²	94.2	28%	0.283	48%	0.477	S	S	.	.	H	α-helix	trans	-73	-34.3	174.3	-109	64.9	0	0	0	113.5	K394 S395 E397 K403	K394-L399 HydrophobicContact CB-CD1 3.38Å; K394-L399 HydrophobicContact CD-CD1 4.09Å; K394-L399 HydrophobicContact CG-CD1 4.37Å; S395-L399 PolarHBondContact O-N 2.99Å; E397-L399 PolarHBondContact O-N 3.28Å; E397-L399 VanDerWaalsContact O-N 3.16Å; L399-K403 WeakPolarHBondContact O-CB 3.27Å; L399-K403 WeakPolarHBondContact O-CD 3.48Å; L399-K403 WeakPolarHBondContact O-CG 3.44Å; L399-K403 PolarHBondContact O-N 3.37Å
400	A	87.2	Confident	75.5	Confident	57 Å²	57	92.4 Å²	92.4	47%	0.471	46%	0.455	S	S	.	.	H	α-helix	trans	-65.8	-47	174.9	0	0	0	0	0	110.4	K396 E397 K403 A404	K396-A400 PolarHBondContact O-N 3.38Å; E397-A400 WeakPolarHBondContact O-CA 3.4Å; E397-A400 WeakPolarHBondContact O-CB 3.32Å; E397-A400 PolarHBondContact O-N 2.91Å; A400-K403 WeakPolarHBondContact O-CB 3.46Å; A400-K403 PolarHBondContact O-N 3.14Å; A400-K403 VanDerWaalsContact O-N 3.16Å; A400-A404 PolarHBondContact O-N 3.1Å
401	E	88.6	Confident	77.5	Confident	47 Å²	47	92.1 Å²	92.1	22%	0.22	45%	0.448	C	S	.	.	H	α-helix	trans	-68.2	-41.6	-179.3	-174.6	52	-147.9	0	0	112.3	E397 K403 A404 S405 R419 L420 L423 T424	E397-E401 PolarHBondContact O-N 3.2Å; E401-K403 VanDerWaalsContact C-N 3.29Å; E401-K403 PolarHBondContact O-N 2.79Å; E401-A404 PolarHBondContact O-N 3.09Å; E401-S405 VanDerWaalsContact O-CB 3.3Å; E401-S405 WeakPolarHBondContact O-CB 3.27Å; E401-S405 PolarHBondContact O-N 2.85Å; E401-R419 IonicContact OE1-CZ 3.9Å; E401-R419 IonicContact OE1-NH1 2.87Å; E401-R419 PolarHBondContact OE1-NH1 2.92Å; E401-R419 IonicContact OE1-NH2 2.73Å; E401-R419 PolarHBondContact OE1-NH2 3.24Å; E401-L420 HydrophobicContact CG-CD2 3.95Å; E401-L423 HydrophobicContact CG-CB 4.09Å; E401-L423 HydrophobicContact CG-CD2 4Å; E401-T424 HydrophobicContact CB-CG2 4.14Å; E401-T424 HydrophobicContact CG-CG2 4.11Å
402	L	90.1	Very high	79.8	Confident	0 Å²	0	83.3 Å²	83.3	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-58.9	-38.1	170.2	-77.6	170.8	0	0	0	112.5	K394 Q398 Y406 L420 T424 L426 I431 W434 F435	K394-L402 HydrophobicContact CD-CD1 4.29Å; Q398-L402 VanDerWaalsContact O-CB 3.28Å; Q398-L402 WeakPolarHBondContact O-CB 3.38Å; Q398-L402 WeakPolarHBondContact O-CD1 3.46Å; Q398-L402 WeakPolarHBondContact O-CG 3.33Å; Q398-L402 PolarHBondContact O-N 3.43Å; Q398-L402 VanDerWaalsContact O-N 3.07Å; L402-Y406 VanDerWaalsContact O-CB 3.31Å; L402-Y406 WeakPolarHBondContact O-CB 3.22Å; L402-Y406 PolarHBondContact O-N 2.67Å; L402-L420 HydrophobicContact CD2-CD1 4.01Å; L402-L420 HydrophobicContact CD2-CD2 4.16Å; L402-T424 HydrophobicContact CG-CG2 4.46Å; L402-L426 HydrophobicContact CD1-CD1 3.77Å; L402-I431 HydrophobicContact CD2-CG1 4.35Å; L402-I431 HydrophobicContact CD2-CG2 4.21Å; L402-W434 VanDerWaalsContact C-CH2 3.5Å; L402-W434 HydrophobicContact CB-CD2 4.08Å; L402-W434 HydrophobicContact CB-CE3 3.92Å; L402-W434 HydrophobicContact CB-CH2 3.75Å; L402-W434 HydrophobicContact CB-CZ2 3.88Å; L402-W434 HydrophobicContact CB-CZ3 3.76Å; L402-W434 HydrophobicContact CD1-CD2 3.9Å; L402-W434 HydrophobicContact CD1-CE3 4.33Å; L402-W434 HydrophobicContact CD1-CG 3.99Å; L402-W434 HydrophobicContact CD2-CD2 4.34Å; L402-W434 HydrophobicContact CD2-CE3 3.96Å; L402-W434 HydrophobicContact CD2-CZ3 4.41Å; L402-W434 HydrophobicContact CG-CD2 4.35Å; L402-W434 HydrophobicContact CG-CE3 4.31Å; L402-W434 VanDerWaalsContact O-CH2 3.31Å; L402-W434 WeakPolarHBondContact O-CH2 3.22Å; L402-W434 VanDerWaalsContact O-CZ3 3.3Å; L402-W434 WeakPolarHBondContact O-CZ3 3.36Å; L402-F435 HydrophobicContact CD2-CD2 4.45Å; L402-F435 HydrophobicContact CD2-CE2 3.88Å
403	K	89.1	Confident	81.6	Confident	119 Å²	119	82 Å²	82	52%	0.517	41%	0.412	S	S	.	.	H	α-helix	trans	-71	-45.3	176.1	-76.6	169.7	-178.7	-178.5	0	112.2	L399 A400 E401 S405 Y406 L407 W434	L399-K403 WeakPolarHBondContact O-CB 3.27Å; L399-K403 WeakPolarHBondContact O-CD 3.48Å; L399-K403 WeakPolarHBondContact O-CG 3.44Å; L399-K403 PolarHBondContact O-N 3.37Å; A400-K403 WeakPolarHBondContact O-CB 3.46Å; A400-K403 PolarHBondContact O-N 3.14Å; A400-K403 VanDerWaalsContact O-N 3.16Å; E401-K403 VanDerWaalsContact C-N 3.29Å; E401-K403 PolarHBondContact O-N 2.79Å; K403-S405 VanDerWaalsContact C-N 3.31Å; K403-S405 PolarHBondContact O-N 2.81Å; K403-Y406 WeakPolarHBondContact O-CB 3.36Å; K403-Y406 PolarHBondContact O-N 3.35Å; K403-Y406 VanDerWaalsContact O-N 3.11Å; K403-L407 WeakPolarHBondContact O-CD1 3.44Å; K403-L407 PolarHBondContact O-N 2.83Å; K403-W434 HydrophobicContact CG-CH2 4.22Å; K403-W434 HydrophobicContact CG-CZ2 4.13Å
404	A	86.8	Confident	83.3	Confident	54 Å²	54	76.6 Å²	76.6	45%	0.446	39%	0.393	S	S	.	.	H	α-helix	trans	-58.7	-45.7	177.4	0	0	0	0	0	110.8	A400 E401 L407 K408	A400-A404 PolarHBondContact O-N 3.1Å; E401-A404 PolarHBondContact O-N 3.09Å; A404-L407 PolarHBondContact O-N 3.09Å; A404-K408 PolarHBondContact O-N 2.74Å
405	S	87.2	Confident	84.3	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-59	-44.9	171.4	-178.8	0	0	0	0	112.8	E401 K403 L407 K408 N409 E416 L420	E401-S405 VanDerWaalsContact O-CB 3.3Å; E401-S405 WeakPolarHBondContact O-CB 3.27Å; E401-S405 PolarHBondContact O-N 2.85Å; K403-S405 VanDerWaalsContact C-N 3.31Å; K403-S405 PolarHBondContact O-N 2.81Å; S405-L407 PolarHBondContact O-N 3.32Å; S405-K408 CarbonylContact O-C 3.57Å; S405-K408 PolarHBondContact O-N 2.79Å; S405-K408 VanDerWaalsContact O-N 3.17Å; S405-N409 PolarHBondContact O-N 3.04Å; S405-E416 WeakPolarHBondContact CB-OE1 3.49Å; S405-E416 VanDerWaalsContact OG-CG 3.29Å; S405-E416 WeakPolarHBondContact OG-CG 3.35Å; S405-E416 PolarHBondContact OG-OE1 2.87Å; S405-L420 WeakPolarHBondContact OG-CD1 3.35Å
406	Y	88.6	Confident	84.7	Confident	13 Å²	13	76.7 Å²	76.7	5%	0.051	40%	0.402	C	S	.	.	H	α-helix	trans	-63	-39.3	177.7	-173.8	-85.6	0	0	0	113.3	L402 K403 K408 N409 H410 W434 F435 T438 R439 Q442	L402-Y406 VanDerWaalsContact O-CB 3.31Å; L402-Y406 WeakPolarHBondContact O-CB 3.22Å; L402-Y406 PolarHBondContact O-N 2.67Å; K403-Y406 WeakPolarHBondContact O-CB 3.36Å; K403-Y406 PolarHBondContact O-N 3.35Å; K403-Y406 VanDerWaalsContact O-N 3.11Å; Y406-K408 VanDerWaalsContact C-N 3.33Å; Y406-N409 CarbonylContact O-C 3.59Å; Y406-N409 VanDerWaalsContact O-C 3.25Å; Y406-N409 PolarHBondContact O-N 2.86Å; Y406-H410 AromaticContact CD1-ND1 3.92Å; Y406-H410 AromaticContact CE1-CE1 3.67Å; Y406-H410 AromaticContact CE1-CG 3.91Å; Y406-H410 AromaticContact CE1-ND1 3.67Å; Y406-H410 AromaticContact CE1-NE2 3.86Å; Y406-H410 HydrophobicContact CE2-CB 4.47Å; Y406-H410 AromaticContact CZ-CG 3.94Å; Y406-H410 PolarHBondContact O-N 3.1Å; Y406-H410 PolarHBondContact O-ND1 3.25Å; Y406-W434 HydrophobicContact CD2-CZ3 4.15Å; Y406-W434 HydrophobicContact CG-CH2 4.45Å; Y406-W434 HydrophobicContact CG-CZ3 4.39Å; Y406-F435 AromaticContact CD2-CD1 3.7Å; Y406-F435 HydrophobicContact CD2-CD1 3.7Å; Y406-F435 AromaticContact CD2-CE1 3.77Å; Y406-F435 HydrophobicContact CD2-CE1 3.77Å; Y406-F435 HydrophobicContact CE2-CD1 4.38Å; Y406-F435 HydrophobicContact CG-CE1 4.34Å; Y406-T438 HydrophobicContact CD1-CG2 4.34Å; Y406-T438 HydrophobicContact CD2-CG2 3.83Å; Y406-T438 HydrophobicContact CE1-CG2 4.15Å; Y406-T438 HydrophobicContact CE2-CG2 3.59Å; Y406-T438 HydrophobicContact CG-CG2 4.22Å; Y406-R439 HydrophobicContact CE2-CG 3.94Å; Y406-Q442 PolarHBondContact OH-NE2 2.9Å
407	L	83.3	Confident	85.2	Confident	137 Å²	137	67.7 Å²	67.7	72%	0.717	36%	0.363	S	S	*	.	H	α-helix	trans	-62.6	-41.6	173.6	-93.1	71.2	0	0	0	110.8	K403 A404 S405	K403-L407 WeakPolarHBondContact O-CD1 3.44Å; K403-L407 PolarHBondContact O-N 2.83Å; A404-L407 PolarHBondContact O-N 3.09Å; S405-L407 PolarHBondContact O-N 3.32Å
408	K	78.6	Confident	85.6	Confident	161 Å²	161	62.8 Å²	62.8	70%	0.7	35%	0.348	S	S	*	.	H	α-helix	trans	-69.5	-37.4	177.3	-167.3	173.4	-174.9	175.9	0	113.1	A404 S405 Y406	A404-K408 PolarHBondContact O-N 2.74Å; S405-K408 CarbonylContact O-C 3.57Å; S405-K408 PolarHBondContact O-N 2.79Å; S405-K408 VanDerWaalsContact O-N 3.17Å; Y406-K408 VanDerWaalsContact C-N 3.33Å
409	N	80.1	Confident	86	Confident	77 Å²	77	64.6 Å²	64.6	41%	0.412	35%	0.353	S	S	.	.			trans	-151.1	109.1	179.3	-85.3	-60	0	0	0	111.4	S405 Y406 F411 F435	S405-N409 PolarHBondContact O-N 3.04Å; Y406-N409 CarbonylContact O-C 3.59Å; Y406-N409 VanDerWaalsContact O-C 3.25Å; Y406-N409 PolarHBondContact O-N 2.86Å; N409-F411 PolarHBondContact O-N 3.07Å; N409-F411 VanDerWaalsContact O-N 3.1Å; N409-F435 WeakPolarHBondContact O-CE1 3.45Å
410	H	78	Confident	86.2	Confident	80 Å²	80	62 Å²	62	37%	0.37	34%	0.34	S	S	.	.	S	Bend	trans	-65	-15.2	177	-72.3	19.2	0	0	0	114	Y406 R439 Q442	Y406-H410 AromaticContact CD1-ND1 3.92Å; Y406-H410 AromaticContact CE1-CE1 3.67Å; Y406-H410 AromaticContact CE1-CG 3.91Å; Y406-H410 AromaticContact CE1-ND1 3.67Å; Y406-H410 AromaticContact CE1-NE2 3.86Å; Y406-H410 HydrophobicContact CE2-CB 4.47Å; Y406-H410 AromaticContact CZ-CG 3.94Å; Y406-H410 PolarHBondContact O-N 3.1Å; Y406-H410 PolarHBondContact O-ND1 3.25Å; H410-R439 WeakPolarHBondContact O-CD 3.4Å; H410-R439 PolarHBondContact O-NH1 2.75Å; H410-Q442 PolarHBondContact NE2-NE2 3.19Å
411	F	81.9	Confident	86.3	Confident	151 Å²	151	62.9 Å²	62.9	66%	0.662	34%	0.335	S	S	*	.	S	Bend	trans	-117.1	109.4	170	-66.1	-87.9	0	0	0	109	N409 S413	N409-F411 PolarHBondContact O-N 3.07Å; N409-F411 VanDerWaalsContact O-N 3.1Å; F411-S413 PolarHBondContact O-N 3.45Å; F411-S413 VanDerWaalsContact O-N 3.09Å
412	A	83.8	Confident	86.2	Confident	21 Å²	21	68.9 Å²	68.9	17%	0.174	36%	0.36	C	S	.	.			trans	-65.3	110.7	174.1	0	0	0	0	0	109.9	I417 F435	A412-I417 HydrophobicContact CB-CD1 4.12Å; A412-I417 HydrophobicContact CB-CG1 3.53Å; A412-I417 WeakPolarHBondContact O-CD1 3.4Å; A412-F435 HydrophobicContact CB-CD1 3.79Å; A412-F435 HydrophobicContact CB-CD2 3.93Å; A412-F435 HydrophobicContact CB-CE1 3.79Å; A412-F435 HydrophobicContact CB-CE2 3.96Å; A412-F435 HydrophobicContact CB-CG 3.86Å; A412-F435 HydrophobicContact CB-CZ 3.89Å
413	S	85.9	Confident	86	Confident	62 Å²	62	73.6 Å²	73.6	43%	0.434	39%	0.385	S	S	.	.			trans	-70.5	159.2	170.2	62.1	0	0	0	0	110.1	F411 A415 E416 I417	F411-S413 PolarHBondContact O-N 3.45Å; F411-S413 VanDerWaalsContact O-N 3.09Å; S413-A415 PolarHBondContact O-N 2.92Å; S413-E416 PolarHBondContact O-N 3.25Å; S413-E416 PolarHBondContact OG-N 2.77Å; S413-I417 VanDerWaalsContact O-CG1 3.3Å; S413-I417 WeakPolarHBondContact O-CG1 3.29Å; S413-I417 PolarHBondContact O-N 3.27Å
414	D	85.7	Confident	85.8	Confident	93 Å²	93	68 Å²	68	50%	0.497	36%	0.361	S	S	.	.	H	α-helix	trans	-61.7	-29	-176.8	-82.7	-54.3	0	0	0	113.7	A418 K428	D414-A418 WeakPolarHBondContact O-CB 3.15Å; D414-A418 PolarHBondContact O-N 2.84Å; D414-K428 WeakPolarHBondContact OD1-CE 3.41Å; D414-K428 IonicContact OD1-NZ 3.16Å; D414-K428 PolarHBondContact OD1-NZ 3.49Å
415	A	88.2	Confident	85.8	Confident	78 Å²	78	72.2 Å²	72.2	65%	0.645	38%	0.375	S	S	*	.	H	α-helix	trans	-67.7	-43.5	171.2	0	0	0	0	0	112.4	S413 A418 R419	S413-A415 PolarHBondContact O-N 2.92Å; A415-A418 PolarHBondContact O-N 3.11Å; A415-R419 PolarHBondContact O-N 2.9Å
416	E	87.9	Confident	85.8	Confident	19 Å²	19	72.8 Å²	72.8	9%	0.089	38%	0.379	C	S	.	.	H	α-helix	trans	-71.9	-32.4	177.8	-177.6	62.7	-179	0	0	111.7	S405 S413 R419 L420	S405-E416 WeakPolarHBondContact CB-OE1 3.49Å; S405-E416 VanDerWaalsContact OG-CG 3.29Å; S405-E416 WeakPolarHBondContact OG-CG 3.35Å; S405-E416 PolarHBondContact OG-OE1 2.87Å; S413-E416 PolarHBondContact O-N 3.25Å; S413-E416 PolarHBondContact OG-N 2.77Å; E416-R419 PolarHBondContact O-N 3.37Å; E416-R419 IonicContact OE1-CZ 2.69Å; E416-R419 IonicContact OE1-NE 2.66Å; E416-R419 PolarHBondContact OE1-NE 2.91Å; E416-R419 IonicContact OE1-NH2 3.41Å; E416-R419 PolarHBondContact OE1-NH2 3.29Å; E416-R419 IonicContact OE2-CZ 3.77Å; E416-R419 IonicContact OE2-NE 3.38Å; E416-R419 PolarHBondContact OE2-NE 3.3Å; E416-R419 IonicContact OE2-NH2 2.66Å; E416-L420 HydrophobicContact CG-CD1 4.44Å; E416-L420 WeakPolarHBondContact O-CB 3.35Å; E416-L420 VanDerWaalsContact O-CG 3.32Å; E416-L420 WeakPolarHBondContact O-CG 3.44Å; E416-L420 PolarHBondContact O-N 2.63Å
417	I	89.3	Confident	85.9	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.01	40%	0.399	C	S	.	.	H	α-helix	trans	-64.8	-42.8	169.9	-60.3	160.9	0	0	0	110.2	A412 S413 R419 L420 M421 K428 I431 K432	A412-I417 HydrophobicContact CB-CD1 4.12Å; A412-I417 HydrophobicContact CB-CG1 3.53Å; A412-I417 WeakPolarHBondContact O-CD1 3.4Å; S413-I417 VanDerWaalsContact O-CG1 3.3Å; S413-I417 WeakPolarHBondContact O-CG1 3.29Å; S413-I417 PolarHBondContact O-N 3.27Å; I417-R419 VanDerWaalsContact C-N 3.33Å; I417-R419 PolarHBondContact O-N 3.5Å; I417-L420 PolarHBondContact O-N 3.04Å; I417-M421 HydrophobicContact CG2-CG 4.3Å; I417-M421 HydrophobicContact CG2-SD 4.18Å; I417-M421 WeakPolarHBondContact O-CB 3.37Å; I417-M421 VanDerWaalsContact O-CG 3.24Å; I417-M421 WeakPolarHBondContact O-CG 3.36Å; I417-M421 PolarHBondContact O-N 3.17Å; I417-K428 HydrophobicContact CG2-CB 4.4Å; I417-K428 HydrophobicContact CG2-CD 4.46Å; I417-K428 HydrophobicContact CG2-CG 3.94Å; I417-I431 HydrophobicContact CG1-CG2 4.27Å; I417-I431 HydrophobicContact CG2-CB 4.27Å; I417-I431 HydrophobicContact CG2-CD1 4.26Å; I417-I431 HydrophobicContact CG2-CG2 4.07Å; I417-K432 HydrophobicContact CD1-CD 3.89Å; I417-K432 HydrophobicContact CD1-CG 3.58Å; I417-K432 HydrophobicContact CG1-CG 4.42Å
418	A	88.4	Confident	86.2	Confident	49 Å²	49	73.6 Å²	73.6	41%	0.405	38%	0.383	S	S	.	.	H	α-helix	trans	-63.1	-38.1	176	0	0	0	0	0	112.3	D414 A415 M421 K422	D414-A418 WeakPolarHBondContact O-CB 3.15Å; D414-A418 PolarHBondContact O-N 2.84Å; A415-A418 PolarHBondContact O-N 3.11Å; A418-M421 PolarHBondContact O-N 3.43Å; A418-K422 PolarHBondContact O-N 3.32Å
419	R	91.8	Very high	86.7	Confident	83 Å²	83	68.3 Å²	68.3	31%	0.313	37%	0.374	S	S	.	.	H	α-helix	trans	-63.2	-48.6	172.2	-164.2	-170.5	68.5	77.1	4.1	111.4	E401 A415 E416 I417 M421 K422 L423	E401-R419 IonicContact OE1-CZ 3.9Å; E401-R419 IonicContact OE1-NH1 2.87Å; E401-R419 PolarHBondContact OE1-NH1 2.92Å; E401-R419 IonicContact OE1-NH2 2.73Å; E401-R419 PolarHBondContact OE1-NH2 3.24Å; A415-R419 PolarHBondContact O-N 2.9Å; E416-R419 PolarHBondContact O-N 3.37Å; E416-R419 IonicContact OE1-CZ 2.69Å; E416-R419 IonicContact OE1-NE 2.66Å; E416-R419 PolarHBondContact OE1-NE 2.91Å; E416-R419 IonicContact OE1-NH2 3.41Å; E416-R419 PolarHBondContact OE1-NH2 3.29Å; E416-R419 IonicContact OE2-CZ 3.77Å; E416-R419 IonicContact OE2-NE 3.38Å; E416-R419 PolarHBondContact OE2-NE 3.3Å; E416-R419 IonicContact OE2-NH2 2.66Å; I417-R419 VanDerWaalsContact C-N 3.33Å; I417-R419 PolarHBondContact O-N 3.5Å; R419-M421 VanDerWaalsContact C-N 3.34Å; R419-M421 PolarHBondContact O-N 3.4Å; R419-K422 PolarHBondContact O-N 2.95Å; R419-K422 VanDerWaalsContact O-N 3.14Å; R419-L423 HydrophobicContact CG-CD1 3.94Å; R419-L423 VanDerWaalsContact O-CD1 3.23Å; R419-L423 WeakPolarHBondContact O-CD1 3.4Å; R419-L423 PolarHBondContact O-N 2.76Å
420	L	88.8	Confident	87.2	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-63.3	-35	177.1	-77	171.4	0	0	0	113.3	E401 L402 S405 E416 I417 K422 L423 T424 I431 F435	E401-L420 HydrophobicContact CG-CD2 3.95Å; L402-L420 HydrophobicContact CD2-CD1 4.01Å; L402-L420 HydrophobicContact CD2-CD2 4.16Å; S405-L420 WeakPolarHBondContact OG-CD1 3.35Å; E416-L420 HydrophobicContact CG-CD1 4.44Å; E416-L420 WeakPolarHBondContact O-CB 3.35Å; E416-L420 VanDerWaalsContact O-CG 3.32Å; E416-L420 WeakPolarHBondContact O-CG 3.44Å; E416-L420 PolarHBondContact O-N 2.63Å; I417-L420 PolarHBondContact O-N 3.04Å; L420-K422 VanDerWaalsContact C-N 3.29Å; L420-K422 PolarHBondContact O-N 2.92Å; L420-L423 PolarHBondContact O-N 3.32Å; L420-T424 HydrophobicContact CD2-CG2 4.24Å; L420-T424 WeakPolarHBondContact O-CB 3.23Å; L420-T424 PolarHBondContact O-N 2.86Å; L420-T424 PolarHBondContact O-OG1 2.89Å; L420-I431 HydrophobicContact CB-CD1 3.85Å; L420-I431 HydrophobicContact CB-CG1 4.47Å; L420-I431 HydrophobicContact CB-CG2 4.29Å; L420-I431 HydrophobicContact CD1-CG2 3.73Å; L420-F435 HydrophobicContact CD1-CE2 3.53Å; L420-F435 HydrophobicContact CD1-CZ 3.9Å
421	M	89.6	Confident	87.8	Confident	74 Å²	74	63.7 Å²	63.7	37%	0.365	35%	0.35	S	S	.	.	H	α-helix	trans	-59.1	-43	173	-75.5	172	63.7	0	0	110.6	I417 A418 R419 N425 L426 K428 I431	I417-M421 HydrophobicContact CG2-CG 4.3Å; I417-M421 HydrophobicContact CG2-SD 4.18Å; I417-M421 WeakPolarHBondContact O-CB 3.37Å; I417-M421 VanDerWaalsContact O-CG 3.24Å; I417-M421 WeakPolarHBondContact O-CG 3.36Å; I417-M421 PolarHBondContact O-N 3.17Å; A418-M421 PolarHBondContact O-N 3.43Å; R419-M421 VanDerWaalsContact C-N 3.34Å; R419-M421 PolarHBondContact O-N 3.4Å; M421-N425 VanDerWaalsContact O-CA 3.3Å; M421-N425 WeakPolarHBondContact O-CA 3.27Å; M421-N425 PolarHBondContact O-N 2.94Å; M421-L426 WeakPolarHBondContact CG-O 3.44Å; M421-K428 HydrophobicContact CE-CB 4.41Å; M421-K428 HydrophobicContact SD-CB 3.74Å; M421-K428 HydrophobicContact SD-CD 4.43Å; M421-K428 HydrophobicContact SD-CG 4.42Å; M421-I431 HydrophobicContact CB-CD1 4.28Å; M421-I431 HydrophobicContact CG-CD1 3.52Å
422	K	87.4	Confident	88.3	Confident	174 Å²	174	61.5 Å²	61.5	76%	0.757	34%	0.34	S	S	*	.	H	α-helix	trans	-68.4	-43	177.7	-68.3	-175.5	177.2	-167.9	0	113.7	A418 R419 L420	A418-K422 PolarHBondContact O-N 3.32Å; R419-K422 PolarHBondContact O-N 2.95Å; R419-K422 VanDerWaalsContact O-N 3.14Å; L420-K422 VanDerWaalsContact C-N 3.29Å; L420-K422 PolarHBondContact O-N 2.92Å
423	L	85.8	Confident	88.7	Confident	98 Å²	98	66.9 Å²	66.9	51%	0.513	36%	0.36	S	S	.	.	H	α-helix	trans	-80.1	-31.1	-178.7	-81.1	85.2	0	0	0	113.5	E401 R419 L420	E401-L423 HydrophobicContact CG-CB 4.09Å; E401-L423 HydrophobicContact CG-CD2 4Å; R419-L423 HydrophobicContact CG-CD1 3.94Å; R419-L423 VanDerWaalsContact O-CD1 3.23Å; R419-L423 WeakPolarHBondContact O-CD1 3.4Å; R419-L423 PolarHBondContact O-N 2.76Å; L420-L423 PolarHBondContact O-N 3.32Å
424	T	84.3	Confident	89.1	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.012	35%	0.346	C	S	.	.	H	α-helix	trans	-105.1	-11.4	-173.2	70.2	0	0	0	0	113.9	Q398 E401 L402 L420 L426	Q398-T424 HydrophobicContact CB-CG2 4.38Å; Q398-T424 PolarHBondContact NE2-O 3.31Å; E401-T424 HydrophobicContact CB-CG2 4.14Å; E401-T424 HydrophobicContact CG-CG2 4.11Å; L402-T424 HydrophobicContact CG-CG2 4.46Å; L420-T424 HydrophobicContact CD2-CG2 4.24Å; L420-T424 WeakPolarHBondContact O-CB 3.23Å; L420-T424 PolarHBondContact O-N 2.86Å; L420-T424 PolarHBondContact O-OG1 2.89Å; T424-L426 PolarHBondContact O-N 3.42Å; T424-L426 WeakPolarHBondContact OG1-CB 3.32Å
425	N	88	Confident	89.4	Confident	142 Å²	142	61.3 Å²	61.3	76%	0.759	32%	0.323	S	S	*	.			trans	53.5	21	-172.5	-64.8	-40.6	0	0	0	114.2	M421	M421-N425 VanDerWaalsContact O-CA 3.3Å; M421-N425 WeakPolarHBondContact O-CA 3.27Å; M421-N425 PolarHBondContact O-N 2.94Å
426	L	87.3	Confident	89.4	Confident	13 Å²	13	60.1 Å²	60.1	7%	0.068	31%	0.309	C	S	.	.			trans	-90.6	147.6	175.8	-66.2	171.2	0	0	0	110.8	K394 Q398 L402 M421 T424 E430 I431	K394-L426 HydrophobicContact CD-CD1 3.77Å; K394-L426 HydrophobicContact CD-CD2 4.29Å; K394-L426 HydrophobicContact CG-CD1 4.33Å; K394-L426 HydrophobicContact CG-CD2 4.14Å; Q398-L426 HydrophobicContact CB-CD1 4.49Å; L402-L426 HydrophobicContact CD1-CD1 3.77Å; M421-L426 WeakPolarHBondContact CG-O 3.44Å; T424-L426 PolarHBondContact O-N 3.42Å; T424-L426 WeakPolarHBondContact OG1-CB 3.32Å; L426-E430 HydrophobicContact CB-CB 4.47Å; L426-I431 HydrophobicContact CB-CD1 4.17Å; L426-I431 HydrophobicContact CB-CG1 3.88Å; L426-I431 WeakPolarHBondContact O-CD1 3.39Å
427	T	90.9	Very high	89.5	Confident	77 Å²	77	62.6 Å²	62.6	47%	0.472	32%	0.323	S	S	.	.			trans	-66.4	153.4	178.8	63.5	0	0	0	0	112.3	G429 E430 I431	T427-G429 PolarHBondContact O-N 2.9Å; T427-G429 VanDerWaalsContact O-N 3.08Å; T427-E430 WeakPolarHBondContact CB-OE2 3.33Å; T427-E430 WeakPolarHBondContact CG2-OE2 3.36Å; T427-E430 PolarHBondContact N-OE2 3.02Å; T427-E430 VanDerWaalsContact N-OE2 3.08Å; T427-E430 PolarHBondContact O-N 2.72Å; T427-E430 VanDerWaalsContact OG1-CG 3.26Å; T427-E430 WeakPolarHBondContact OG1-CG 3.25Å; T427-E430 PolarHBondContact OG1-N 2.63Å; T427-E430 PolarHBondContact OG1-OE2 3.12Å; T427-I431 PolarHBondContact O-N 3.04Å
428	K	88.9	Confident	89.6	Confident	90 Å²	90	64 Å²	64	39%	0.391	33%	0.332	S	S	.	.	H	α-helix	trans	-49.2	-35.7	171	-175.3	153.7	-173.1	169.3	0	112.5	D414 I417 M421 K432	D414-K428 WeakPolarHBondContact OD1-CE 3.41Å; D414-K428 IonicContact OD1-NZ 3.16Å; D414-K428 PolarHBondContact OD1-NZ 3.49Å; I417-K428 HydrophobicContact CG2-CB 4.4Å; I417-K428 HydrophobicContact CG2-CD 4.46Å; I417-K428 HydrophobicContact CG2-CG 3.94Å; M421-K428 HydrophobicContact CE-CB 4.41Å; M421-K428 HydrophobicContact SD-CB 3.74Å; M421-K428 HydrophobicContact SD-CD 4.43Å; M421-K428 HydrophobicContact SD-CG 4.42Å; K428-K432 HydrophobicContact CG-CD 4.17Å; K428-K432 WeakPolarHBondContact O-CB 3.32Å; K428-K432 VanDerWaalsContact O-CG 3.27Å; K428-K432 WeakPolarHBondContact O-CG 3.49Å; K428-K432 PolarHBondContact O-N 3.19Å; K428-K432 VanDerWaalsContact O-N 3.11Å
429	G	88.3	Confident	89.7	Confident	49 Å²	49	64.9 Å²	64.9	51%	0.505	33%	0.325	S	S	.	.	H	α-helix	trans	-66.7	-48.5	175.1	0	0	0	0	0	113.2	T427 I431 K432 K433	T427-G429 PolarHBondContact O-N 2.9Å; T427-G429 VanDerWaalsContact O-N 3.08Å; G429-I431 PolarHBondContact O-N 3.5Å; G429-K432 PolarHBondContact O-N 2.92Å; G429-K433 WeakPolarHBondContact O-CB 3.27Å; G429-K433 PolarHBondContact O-N 3.16Å
430	E	91.4	Very high	89.5	Confident	60 Å²	60	68.4 Å²	68.4	28%	0.28	34%	0.339	S	S	.	.	H	α-helix	trans	-71.2	-27.5	-178.7	-71.2	169.4	100.5	0	0	114.4	K394 L426 T427 W434	K394-E430 PolarHBondContact NZ-O 2.86Å; L426-E430 HydrophobicContact CB-CB 4.47Å; T427-E430 WeakPolarHBondContact CB-OE2 3.33Å; T427-E430 WeakPolarHBondContact CG2-OE2 3.36Å; T427-E430 PolarHBondContact N-OE2 3.02Å; T427-E430 VanDerWaalsContact N-OE2 3.08Å; T427-E430 PolarHBondContact O-N 2.72Å; T427-E430 VanDerWaalsContact OG1-CG 3.26Å; T427-E430 WeakPolarHBondContact OG1-CG 3.25Å; T427-E430 PolarHBondContact OG1-N 2.63Å; T427-E430 PolarHBondContact OG1-OE2 3.12Å; E430-W434 WeakPolarHBondContact O-CB 3.37Å; E430-W434 PolarHBondContact O-N 3.12Å
431	I	91.1	Very high	89.3	Confident	0 Å²	0	73 Å²	73	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-71.6	-55.4	171.4	-64.7	161.4	0	0	0	108.7	L402 I417 L420 M421 L426 T427 G429 K433 W434 F435	L402-I431 HydrophobicContact CD2-CG1 4.35Å; L402-I431 HydrophobicContact CD2-CG2 4.21Å; I417-I431 HydrophobicContact CG1-CG2 4.27Å; I417-I431 HydrophobicContact CG2-CB 4.27Å; I417-I431 HydrophobicContact CG2-CD1 4.26Å; I417-I431 HydrophobicContact CG2-CG2 4.07Å; L420-I431 HydrophobicContact CB-CD1 3.85Å; L420-I431 HydrophobicContact CB-CG1 4.47Å; L420-I431 HydrophobicContact CB-CG2 4.29Å; L420-I431 HydrophobicContact CD1-CG2 3.73Å; M421-I431 HydrophobicContact CB-CD1 4.28Å; M421-I431 HydrophobicContact CG-CD1 3.52Å; L426-I431 HydrophobicContact CB-CD1 4.17Å; L426-I431 HydrophobicContact CB-CG1 3.88Å; L426-I431 WeakPolarHBondContact O-CD1 3.39Å; T427-I431 PolarHBondContact O-N 3.04Å; G429-I431 PolarHBondContact O-N 3.5Å; I431-K433 PolarHBondContact O-N 3.43Å; I431-W434 PolarHBondContact O-N 3.49Å; I431-W434 VanDerWaalsContact O-N 3.1Å; I431-F435 HydrophobicContact CG2-CD2 3.9Å; I431-F435 HydrophobicContact CG2-CE2 4Å; I431-F435 WeakPolarHBondContact O-CD2 3.45Å; I431-F435 PolarHBondContact O-N 3.26Å
432	K	91.2	Very high	88.8	Confident	106 Å²	106	72.1 Å²	72.1	46%	0.461	36%	0.359	S	S	.	.	H	α-helix	trans	-58.1	-36.6	177.7	-72.5	179.9	72.8	162	0	112.5	I417 K428 G429 S436	I417-K432 HydrophobicContact CD1-CD 3.89Å; I417-K432 HydrophobicContact CD1-CG 3.58Å; I417-K432 HydrophobicContact CG1-CG 4.42Å; K428-K432 HydrophobicContact CG-CD 4.17Å; K428-K432 WeakPolarHBondContact O-CB 3.32Å; K428-K432 VanDerWaalsContact O-CG 3.27Å; K428-K432 WeakPolarHBondContact O-CG 3.49Å; K428-K432 PolarHBondContact O-N 3.19Å; K428-K432 VanDerWaalsContact O-N 3.11Å; G429-K432 PolarHBondContact O-N 2.92Å; K432-S436 WeakPolarHBondContact O-CB 3.39Å; K432-S436 PolarHBondContact O-N 2.82Å; K432-S436 VanDerWaalsContact O-N 3.11Å; K432-S436 PolarHBondContact O-OG 2.94Å
433	K	92.8	Very high	88.3	Confident	134 Å²	134	73.5 Å²	73.5	58%	0.583	36%	0.359	S	S	*	.	H	α-helix	trans	-65.8	-51.7	172.7	-178.2	168.9	-178.9	176.3	0	111.4	G429 I431 F435 S436 D437	G429-K433 WeakPolarHBondContact O-CB 3.27Å; G429-K433 PolarHBondContact O-N 3.16Å; I431-K433 PolarHBondContact O-N 3.43Å; K433-F435 VanDerWaalsContact C-N 3.31Å; K433-F435 PolarHBondContact O-N 2.62Å; K433-S436 CarbonylContact O-C 3.25Å; K433-S436 WeakPolarHBondContact O-CA 3.5Å; K433-S436 WeakPolarHBondContact O-CB 3.44Å; K433-S436 PolarHBondContact O-N 2.91Å; K433-D437 WeakPolarHBondContact CE-OD2 3.21Å; K433-D437 WeakPolarHBondContact CG-OD2 3.43Å; K433-D437 PolarHBondContact O-N 3.28Å
434	W	93.3	Very high	87.7	Confident	37 Å²	37	73.3 Å²	73.3	14%	0.14	36%	0.359	C	S	.	.	H	α-helix	trans	-59.6	-39	178.9	-178.9	94.6	0	0	0	113	L402 K403 Y406 E430 I431 S436 T438	L402-W434 VanDerWaalsContact C-CH2 3.5Å; L402-W434 HydrophobicContact CB-CD2 4.08Å; L402-W434 HydrophobicContact CB-CE3 3.92Å; L402-W434 HydrophobicContact CB-CH2 3.75Å; L402-W434 HydrophobicContact CB-CZ2 3.88Å; L402-W434 HydrophobicContact CB-CZ3 3.76Å; L402-W434 HydrophobicContact CD1-CD2 3.9Å; L402-W434 HydrophobicContact CD1-CE3 4.33Å; L402-W434 HydrophobicContact CD1-CG 3.99Å; L402-W434 HydrophobicContact CD2-CD2 4.34Å; L402-W434 HydrophobicContact CD2-CE3 3.96Å; L402-W434 HydrophobicContact CD2-CZ3 4.41Å; L402-W434 HydrophobicContact CG-CD2 4.35Å; L402-W434 HydrophobicContact CG-CE3 4.31Å; L402-W434 VanDerWaalsContact O-CH2 3.31Å; L402-W434 WeakPolarHBondContact O-CH2 3.22Å; L402-W434 VanDerWaalsContact O-CZ3 3.3Å; L402-W434 WeakPolarHBondContact O-CZ3 3.36Å; K403-W434 HydrophobicContact CG-CH2 4.22Å; K403-W434 HydrophobicContact CG-CZ2 4.13Å; Y406-W434 HydrophobicContact CD2-CZ3 4.15Å; Y406-W434 HydrophobicContact CG-CH2 4.45Å; Y406-W434 HydrophobicContact CG-CZ3 4.39Å; E430-W434 WeakPolarHBondContact O-CB 3.37Å; E430-W434 PolarHBondContact O-N 3.12Å; I431-W434 PolarHBondContact O-N 3.49Å; I431-W434 VanDerWaalsContact O-N 3.1Å; W434-S436 VanDerWaalsContact C-N 3.29Å; W434-S436 PolarHBondContact O-N 2.95Å; W434-T438 HydrophobicContact CH2-CG2 4.25Å; W434-T438 WeakPolarHBondContact O-CB 3.41Å; W434-T438 PolarHBondContact O-N 3.43Å; W434-T438 PolarHBondContact O-OG1 2.68Å
435	F	92.1	Very high	86.6	Confident	1 Å²	1	76.1 Å²	76.1	0%	0.004	38%	0.379	C	S	.	.	H	α-helix	trans	-64.7	-32.9	172.9	-90.5	-97.9	0	0	0	112.6	L402 Y406 N409 A412 L420 I431 K433 R439	L402-F435 HydrophobicContact CD2-CD2 4.45Å; L402-F435 HydrophobicContact CD2-CE2 3.88Å; Y406-F435 AromaticContact CD2-CD1 3.7Å; Y406-F435 HydrophobicContact CD2-CD1 3.7Å; Y406-F435 AromaticContact CD2-CE1 3.77Å; Y406-F435 HydrophobicContact CD2-CE1 3.77Å; Y406-F435 HydrophobicContact CE2-CD1 4.38Å; Y406-F435 HydrophobicContact CG-CE1 4.34Å; N409-F435 WeakPolarHBondContact O-CE1 3.45Å; A412-F435 HydrophobicContact CB-CD1 3.79Å; A412-F435 HydrophobicContact CB-CD2 3.93Å; A412-F435 HydrophobicContact CB-CE1 3.79Å; A412-F435 HydrophobicContact CB-CE2 3.96Å; A412-F435 HydrophobicContact CB-CG 3.86Å; A412-F435 HydrophobicContact CB-CZ 3.89Å; L420-F435 HydrophobicContact CD1-CE2 3.53Å; L420-F435 HydrophobicContact CD1-CZ 3.9Å; I431-F435 HydrophobicContact CG2-CD2 3.9Å; I431-F435 HydrophobicContact CG2-CE2 4Å; I431-F435 WeakPolarHBondContact O-CD2 3.45Å; I431-F435 PolarHBondContact O-N 3.26Å; K433-F435 VanDerWaalsContact C-N 3.31Å; K433-F435 PolarHBondContact O-N 2.62Å; F435-R439 WeakPolarHBondContact O-CB 3.47Å; F435-R439 WeakPolarHBondContact O-CG 3.37Å; F435-R439 PolarHBondContact O-N 2.88Å
436	S	90	Very high	85.1	Confident	52 Å²	52	75.7 Å²	75.7	36%	0.364	37%	0.37	S	S	.	.	H	α-helix	trans	-76.7	-44.1	177.6	-56.8	0	0	0	0	111.7	K432 K433 W434 T438 R439 Y440	K432-S436 WeakPolarHBondContact O-CB 3.39Å; K432-S436 PolarHBondContact O-N 2.82Å; K432-S436 VanDerWaalsContact O-N 3.11Å; K432-S436 PolarHBondContact O-OG 2.94Å; K433-S436 CarbonylContact O-C 3.25Å; K433-S436 WeakPolarHBondContact O-CA 3.5Å; K433-S436 WeakPolarHBondContact O-CB 3.44Å; K433-S436 PolarHBondContact O-N 2.91Å; W434-S436 VanDerWaalsContact C-N 3.29Å; W434-S436 PolarHBondContact O-N 2.95Å; S436-T438 VanDerWaalsContact C-N 3.33Å; S436-T438 PolarHBondContact O-N 3.22Å; S436-R439 PolarHBondContact O-N 3.44Å; S436-R439 PolarHBondContact OG-NH2 3.04Å; S436-R439 VanDerWaalsContact OG-NH2 3.14Å; S436-Y440 VanDerWaalsContact O-CB 3.28Å; S436-Y440 WeakPolarHBondContact O-CB 3.49Å; S436-Y440 PolarHBondContact O-N 3.29Å
437	D	89.6	Confident	82.7	Confident	72 Å²	72	81 Å²	81	39%	0.385	40%	0.398	S	S	.	.	H	α-helix	trans	-62.5	-39.8	174.3	-64.1	-13.6	0	0	0	110.5	K433 Y440 N441	K433-D437 WeakPolarHBondContact CE-OD2 3.21Å; K433-D437 WeakPolarHBondContact CG-OD2 3.43Å; K433-D437 PolarHBondContact O-N 3.28Å; D437-Y440 PolarHBondContact O-N 3.41Å; D437-N441 VanDerWaalsContact O-CB 3.3Å; D437-N441 WeakPolarHBondContact O-CB 3.48Å; D437-N441 VanDerWaalsContact O-CG 3.25Å; D437-N441 PolarHBondContact O-N 2.92Å; D437-N441 PolarHBondContact O-ND2 2.96Å
438	T	91.1	Very high	80.2	Confident	32 Å²	32	82.1 Å²	82.1	20%	0.196	41%	0.41	C	S	.	.	H	α-helix	trans	-67.8	-44.3	175.8	-59.9	0	0	0	0	111.8	Y406 W434 S436 Y440 Q442	Y406-T438 HydrophobicContact CD1-CG2 4.34Å; Y406-T438 HydrophobicContact CD2-CG2 3.83Å; Y406-T438 HydrophobicContact CE1-CG2 4.15Å; Y406-T438 HydrophobicContact CE2-CG2 3.59Å; Y406-T438 HydrophobicContact CG-CG2 4.22Å; W434-T438 HydrophobicContact CH2-CG2 4.25Å; W434-T438 WeakPolarHBondContact O-CB 3.41Å; W434-T438 PolarHBondContact O-N 3.43Å; W434-T438 PolarHBondContact O-OG1 2.68Å; S436-T438 VanDerWaalsContact C-N 3.33Å; S436-T438 PolarHBondContact O-N 3.22Å; T438-Y440 VanDerWaalsContact C-N 3.35Å; T438-Y440 PolarHBondContact O-N 3.34Å; T438-Q442 VanDerWaalsContact O-CB 3.31Å; T438-Q442 WeakPolarHBondContact O-CB 3.35Å; T438-Q442 PolarHBondContact O-N 3.33Å
439	R	89.4	Confident	77.7	Confident	67 Å²	67	84.6 Å²	84.6	25%	0.253	42%	0.422	S	S	.	.	H	α-helix	trans	-62.9	-39.4	171.9	-77.8	-171	-59.2	-89.4	-5.5	112.3	Y406 H410 F435 S436 Q442 R443	Y406-R439 HydrophobicContact CE2-CG 3.94Å; H410-R439 WeakPolarHBondContact O-CD 3.4Å; H410-R439 PolarHBondContact O-NH1 2.75Å; F435-R439 WeakPolarHBondContact O-CB 3.47Å; F435-R439 WeakPolarHBondContact O-CG 3.37Å; F435-R439 PolarHBondContact O-N 2.88Å; S436-R439 PolarHBondContact O-N 3.44Å; S436-R439 PolarHBondContact OG-NH2 3.04Å; S436-R439 VanDerWaalsContact OG-NH2 3.14Å; R439-Q442 PolarHBondContact O-N 2.99Å; R439-R443 WeakPolarHBondContact O-CB 3.38Å; R439-R443 PolarHBondContact O-N 3.46Å
440	Y	88.6	Confident	74.9	Confident	156 Å²	156	88.2 Å²	88.2	61%	0.612	43%	0.434	S	S	*	.	H	α-helix	trans	-64.5	-49.3	177.9	-179.3	-93.9	0	0	0	111	S436 D437 T438 Q442 R443 N444	S436-Y440 VanDerWaalsContact O-CB 3.28Å; S436-Y440 WeakPolarHBondContact O-CB 3.49Å; S436-Y440 PolarHBondContact O-N 3.29Å; D437-Y440 PolarHBondContact O-N 3.41Å; T438-Y440 VanDerWaalsContact C-N 3.35Å; T438-Y440 PolarHBondContact O-N 3.34Å; Y440-Q442 PolarHBondContact O-N 2.99Å; Y440-R443 PolarHBondContact O-N 3.24Å; Y440-R443 VanDerWaalsContact O-N 3.16Å; Y440-N444 WeakPolarHBondContact O-CB 3.41Å; Y440-N444 PolarHBondContact O-N 2.87Å
441	N	83.5	Confident	72.2	Confident	98 Å²	98	91.2 Å²	91.2	52%	0.524	45%	0.451	S	S	.	.	H	α-helix	trans	-60.8	-42.3	175	-74.2	-25.2	0	0	0	111.7	D437 R443 N444 S445	D437-N441 VanDerWaalsContact O-CB 3.3Å; D437-N441 WeakPolarHBondContact O-CB 3.48Å; D437-N441 VanDerWaalsContact O-CG 3.25Å; D437-N441 PolarHBondContact O-N 2.92Å; D437-N441 PolarHBondContact O-ND2 2.96Å; N441-R443 VanDerWaalsContact C-N 3.33Å; N441-R443 PolarHBondContact O-N 3.41Å; N441-N444 PolarHBondContact O-N 3.1Å; N441-S445 WeakPolarHBondContact O-CB 3.17Å; N441-S445 PolarHBondContact O-N 3.28Å; N441-S445 PolarHBondContact O-OG 3.49Å
442	Q	79.3	Confident	69.3	Low	55 Å²	55	97.1 Å²	97.1	26%	0.257	49%	0.487	S	S	.	.	H	α-helix	trans	-62.3	-38.6	175.1	-162.3	-159.2	91.9	0	0	111.8	Y406 H410 T438 R439 Y440 S445 K446	Y406-Q442 PolarHBondContact OH-NE2 2.9Å; H410-Q442 PolarHBondContact NE2-NE2 3.19Å; T438-Q442 VanDerWaalsContact O-CB 3.31Å; T438-Q442 WeakPolarHBondContact O-CB 3.35Å; T438-Q442 PolarHBondContact O-N 3.33Å; R439-Q442 PolarHBondContact O-N 2.99Å; Y440-Q442 PolarHBondContact O-N 2.99Å; Q442-S445 PolarHBondContact O-OG 3.13Å; Q442-K446 HydrophobicContact CG-CD 4.22Å; Q442-K446 VanDerWaalsContact O-CB 3.24Å; Q442-K446 WeakPolarHBondContact O-CB 3.37Å; Q442-K446 WeakPolarHBondContact O-CD 3.26Å; Q442-K446 WeakPolarHBondContact O-CG 3.36Å; Q442-K446 PolarHBondContact O-N 3.48Å
443	R	78.3	Confident	66.2	Low	203 Å²	203	101.2 Å²	101.2	77%	0.766	51%	0.505	S	S	*	.	H	α-helix	trans	-72.7	-36.6	177.1	-168.2	173.3	-179.9	99	-1.4	112	R439 Y440 N441 N447	R439-R443 WeakPolarHBondContact O-CB 3.38Å; R439-R443 PolarHBondContact O-N 3.46Å; Y440-R443 PolarHBondContact O-N 3.24Å; Y440-R443 VanDerWaalsContact O-N 3.16Å; N441-R443 VanDerWaalsContact C-N 3.33Å; N441-R443 PolarHBondContact O-N 3.41Å; R443-N447 WeakPolarHBondContact O-CB 3.17Å; R443-N447 PolarHBondContact O-N 3.26Å; R443-N447 VanDerWaalsContact O-N 3.09Å
444	N	72.6	Confident	63.1	Low	93 Å²	93	103.5 Å²	103.5	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-71.1	-42.4	177.6	-164.5	37.8	0	0	0	111.8	Y440 N441 N447 S448	Y440-N444 WeakPolarHBondContact O-CB 3.41Å; Y440-N444 PolarHBondContact O-N 2.87Å; N441-N444 PolarHBondContact O-N 3.1Å; N444-N447 CarbonylContact O-C 3.54Å; N444-N447 PolarHBondContact O-N 2.9Å; N444-N447 VanDerWaalsContact O-N 3.16Å; N444-S448 PolarHBondContact O-N 3.2Å
445	S	61	Low	60.3	Low	62 Å²	62	108.8 Å²	108.8	43%	0.434	55%	0.548	S	S	.	.	H	α-helix	trans	-69.4	-37.8	175.7	65.5	0	0	0	0	112.5	N441 Q442 N447 S448 H449	N441-S445 WeakPolarHBondContact O-CB 3.17Å; N441-S445 PolarHBondContact O-N 3.28Å; N441-S445 PolarHBondContact O-OG 3.49Å; Q442-S445 PolarHBondContact O-OG 3.13Å; S445-N447 PolarHBondContact O-N 3.08Å; S445-S448 WeakPolarHBondContact O-CA 3.3Å; S445-S448 VanDerWaalsContact O-CB 3.29Å; S445-S448 WeakPolarHBondContact O-CB 3.37Å; S445-S448 PolarHBondContact O-N 3.23Å; S445-H449 PolarHBondContact O-N 2.87Å
446	K	56.3	Low	57.1	Low	132 Å²	132	112.5 Å²	112.5	57%	0.574	59%	0.586	S	S	*	*	H	α-helix	trans	-61.6	-29.3	169	-76.5	173.9	174.5	178.5	0	112.8	Q442 H449	Q442-K446 HydrophobicContact CG-CD 4.22Å; Q442-K446 VanDerWaalsContact O-CB 3.24Å; Q442-K446 WeakPolarHBondContact O-CB 3.37Å; Q442-K446 WeakPolarHBondContact O-CD 3.26Å; Q442-K446 WeakPolarHBondContact O-CG 3.36Å; Q442-K446 PolarHBondContact O-N 3.48Å; K446-H449 PolarHBondContact O-N 2.88Å
447	N	36.6	Very low	54.4	Low	124 Å²	124	112.9 Å²	112.9	66%	0.663	60%	0.599	S	S	*	*	H	α-helix	trans	-83.5	-10.7	173.8	-155.1	65.8	0	0	0	113.6	R443 N444 S445	R443-N447 WeakPolarHBondContact O-CB 3.17Å; R443-N447 PolarHBondContact O-N 3.26Å; R443-N447 VanDerWaalsContact O-N 3.09Å; N444-N447 CarbonylContact O-C 3.54Å; N444-N447 PolarHBondContact O-N 2.9Å; N444-N447 VanDerWaalsContact O-N 3.16Å; S445-N447 PolarHBondContact O-N 3.08Å
448	S	38.4	Very low	51.3	Low	102 Å²	102	113.4 Å²	113.4	71%	0.713	62%	0.621	S	S	*	*	H	α-helix	trans	-81.3	-32.6	165.5	-167.5	0	0	0	0	111.2	N444 S445 V450	N444-S448 PolarHBondContact O-N 3.2Å; S445-S448 WeakPolarHBondContact O-CA 3.3Å; S445-S448 VanDerWaalsContact O-CB 3.29Å; S445-S448 WeakPolarHBondContact O-CB 3.37Å; S445-S448 PolarHBondContact O-N 3.23Å; S448-V450 VanDerWaalsContact C-N 3.29Å; S448-V450 PolarHBondContact O-N 3.33Å
449	H	36.3	Very low	48.6	Very low	142 Å²	142	124.1 Å²	124.1	66%	0.657	66%	0.658	S	S	*	*			trans	-80.3	67.1	171.4	-83.6	-92.2	0	0	0	113.1	S445 K446 I451	S445-H449 PolarHBondContact O-N 2.87Å; K446-H449 PolarHBondContact O-N 2.88Å; H449-I451 PolarHBondContact O-N 3.47Å; H449-I451 VanDerWaalsContact O-N 3.17Å
450	V	30.8	Very low	45.6	Very low	124 Å²	124	125 Å²	125	75%	0.752	69%	0.687	S	S	*	*			trans	-85.2	64	155.9	-171.6	0	0	0	0	109	S448	S448-V450 VanDerWaalsContact C-N 3.29Å; S448-V450 PolarHBondContact O-N 3.33Å
451	I	33.8	Very low	42.6	Very low	123 Å²	123	120.8 Å²	120.8	63%	0.631	69%	0.692	S	S	*	*	S	Bend	trans	-125.4	127.5	161.5	-62.5	-66.6	0	0	0	105.9	H449 F453	H449-I451 PolarHBondContact O-N 3.47Å; H449-I451 VanDerWaalsContact O-N 3.17Å; I451-F453 HydrophobicContact CG2-CD2 4.32Å; I451-F453 HydrophobicContact CG2-CE2 4.01Å; I451-F453 PolarHBondContact O-N 3.02Å
452	V	30.2	Very low	39.8	Very low	124 Å²	124	122.1 Å²	122.1	75%	0.752	71%	0.709	S	S	*	*			trans	-73.4	119.7	-176.6	176.5	0	0	0	0	110
453	F	26.1	Very low	37.4	Very low	192 Å²	192	124.3 Å²	124.3	84%	0.842	73%	0.73	S	S	*	*			trans	-127.7	112.1	149.7	-76.7	-78.4	0	0	0	107.9	I451	I451-F453 HydrophobicContact CG2-CD2 4.32Å; I451-F453 HydrophobicContact CG2-CE2 4.01Å; I451-F453 PolarHBondContact O-N 3.02Å
454	H	29	Very low	34.9	Very low	182 Å²	182	120.5 Å²	120.5	84%	0.843	73%	0.734	S	S	*	*			trans	-99.7	148.4	166.3	-123.8	-78.7	0	0	0	108.5
455	D	33.2	Very low	32.7	Very low	149 Å²	149	121.3 Å²	121.3	80%	0.797	75%	0.747	S	S	*	*			trans	-65.2	159.7	-169.2	-179.1	45.9	0	0	0	115.2	G457	D455-G457 PolarHBondContact OD1-N 3.38Å
456	G	26.1	Very low	31.3	Very low	78 Å²	78	123.9 Å²	123.9	80%	0.804	77%	0.765	S	S	*	*			trans	-153.3	41.4	177.9	0	0	0	0	0	113.3
457	G	32.1	Very low	30	Very low	60 Å²	60	121.9 Å²	121.9	62%	0.619	77%	0.773	S	S	*	*			trans	-66.9	146.8	-176	0	0	0	0	0	116	D455	D455-G457 PolarHBondContact OD1-N 3.38Å
458	G	24.6	Very low	29.7	Very low	83 Å²	83	120 Å²	120	86%	0.856	78%	0.776	S	S	*	*			trans	-107.7	143.5	169.2	0	0	0	0	0	111.8
459	R	35.3	Very low	29.3	Very low	258 Å²	258	122.6 Å²	122.6	97%	0.974	78%	0.782	S	S	*	*			trans	-108.2	148.2	-173.3	-57	173.8	87.8	-156.1	9.9	112.6
460	G	25.2	Very low	29.1	Very low	84 Å²	84	122 Å²	122	87%	0.866	79%	0.788	S	S	*	*			trans	171.6	117.9	162.1	0	0	0	0	0	110.8
461	G	25.8	Very low	29.4	Very low	69 Å²	69	121.5 Å²	121.5	71%	0.711	79%	0.787	S	S	*	*			cis	-174.6	178.3	-6.7	0	0	0	0	0	111.5
462	S	26	Very low	29.3	Very low	125 Å²	125	122.7 Å²	122.7	87%	0.874	79%	0.793	S	S	*	*			trans	59.2	149.9	159.4	-57.2	0	0	0	0	120.1
463	S	27.5	Very low	29.2	Very low	101 Å²	101	123.3 Å²	123.3	71%	0.706	80%	0.797	S	S	*	*			cis	-172.4	168.6	-27.5	46.1	0	0	0	0	109.2
464	S	26.1	Very low	29.6	Very low	123 Å²	123	121.8 Å²	121.8	86%	0.86	80%	0.796	S	S	*	*			trans	77.6	148.1	-177	83.2	0	0	0	0	115.5
465	S	27.3	Very low	29.4	Very low	110 Å²	110	120.2 Å²	120.2	77%	0.769	79%	0.794	S	S	*	*			cis	-141.8	159.6	3.6	63.9	0	0	0	0	114.8
466	S	29.8	Very low	29.4	Very low	116 Å²	116	117.7 Å²	117.7	81%	0.811	79%	0.788	S	S	*	*			trans	-44.8	166	162.4	-53.3	0	0	0	0	116.1
467	A	29.4	Very low	29.8	Very low	90 Å²	90	118.7 Å²	118.7	74%	0.744	78%	0.783	S	S	*	*			cis	-173.1	171.6	-18.2	0	0	0	0	0	111.4
468	A	30.1	Very low	29.7	Very low	86 Å²	86	123.1 Å²	123.1	71%	0.711	79%	0.792	S	S	*	*			trans	67.2	156.5	162.7	0	0	0	0	0	117.6
469	N	29.8	Very low	30	Very low	156 Å²	156	127.7 Å²	127.7	83%	0.834	79%	0.791	S	S	*	*			cis	-128.9	160	12.5	-72.6	-72.4	0	0	0	113.8
470	T	33.7	Very low	29.8	Very low	130 Å²	130	121.2 Å²	121.2	80%	0.798	78%	0.78	S	S	*	*			trans	-99	-149.4	160.9	61.9	0	0	0	0	108.5
471	P	36.6	Very low	30.9	Very low	112 Å²	112	122.9 Å²	122.9	73%	0.727	78%	0.776	S	S	*	*			cis	-90.5	-148.3	3.5	16.8	7.4	0	0	0	110.2
472	I	31	Very low	31	Very low	149 Å²	149	124.5 Å²	124.5	76%	0.764	78%	0.782	S	S	*	*			cis	-143.3	149.9	6.3	-53.9	161.8	0	0	0	109
473	V	27.7	Very low	31	Very low	137 Å²	137	123.7 Å²	123.7	83%	0.83	78%	0.777	S	S	*	*			trans	-129	152.7	157.3	171.4	0	0	0	0	107.8
474	I	34.3	Very low	31.7	Very low	159 Å²	159	124.1 Å²	124.1	82%	0.815	78%	0.777	S	S	*	*			trans	-68	143.1	-178	-59.7	164.9	0	0	0	111.2
475	D	26.2	Very low	31.6	Very low	150 Å²	150	126.3 Å²	126.3	80%	0.802	77%	0.774	S	S	*	*			trans	-138	170.6	153.2	-155	-5.1	0	0	0	109.8
476	S	33.5	Very low	32.4	Very low	96 Å²	96	126.6 Å²	126.6	67%	0.671	77%	0.773	S	S	*	*			trans	-101.4	172.8	-169.4	-41.6	0	0	0	0	111.4
477	S	34.7	Very low	32.9	Very low	99 Å²	99	126.4 Å²	126.4	69%	0.692	77%	0.769	S	S	*	*			cis	-139.8	-140.6	9.6	-58	0	0	0	0	109
478	D	29.7	Very low	32.6	Very low	152 Å²	152	127.1 Å²	127.1	81%	0.813	77%	0.769	S	S	*	*			cis	-160	-174.3	-4	-136.1	-55.1	0	0	0	111.9
479	E	30.7	Very low	32.3	Very low	180 Å²	180	129 Å²	129	84%	0.841	77%	0.771	S	S	*	*			trans	75.5	130.2	167.4	-138	-178.7	135.1	0	0	119.9
480	T	31	Very low	32	Very low	121 Å²	121	126.6 Å²	126.6	74%	0.742	77%	0.767	S	S	*	*			trans	-87.5	-177.9	177.5	37.8	0	0	0	0	112.9
481	P	48	Very low	32.3	Very low	119 Å²	119	125.8 Å²	125.8	77%	0.773	76%	0.764	S	S	*	*			cis	-132.5	-174	-1.4	21.6	4.2	0	0	0	115.8
482	A	27.3	Very low	31.7	Very low	103 Å²	103	125.7 Å²	125.7	85%	0.851	76%	0.761	S	S	*	*			trans	94.4	137.8	149.3	0	0	0	0	0	120.3
483	S	27.5	Very low	31.6	Very low	108 Å²	108	126.9 Å²	126.9	76%	0.755	76%	0.76	S	S	*	*			trans	-90.8	165.8	168.5	-119.1	0	0	0	0	109.7
484	P	40.7	Very low	31.5	Very low	111 Å²	111	125.8 Å²	125.8	72%	0.721	75%	0.746	S	S	*	*			cis	-147.1	178.7	42.2	42.3	-21.8	0	0	0	118.5
485	H	25.4	Very low	31.2	Very low	168 Å²	168	126.8 Å²	126.8	78%	0.778	75%	0.745	S	S	*	*			trans	-5.7	162.1	142.3	-61.9	-66.7	0	0	0	120.9
486	P	43.2	Very low	31.2	Very low	117 Å²	117	126.5 Å²	126.5	76%	0.76	74%	0.738	S	S	*	*			cis	-131.6	-114.3	-15.5	29.2	-2.4	0	0	0	113.9
487	P	41.2	Very low	31	Very low	112 Å²	112	129.3 Å²	129.3	73%	0.727	74%	0.739	S	S	*	*			trans	-134.5	-165.6	-138.7	41.9	-18.1	0	0	0	116.5
488	S	22.1	Very low	30.7	Very low	105 Å²	105	132.2 Å²	132.2	73%	0.734	74%	0.741	S	S	*	*			trans	87.5	170.6	152.2	-150.8	0	0	0	0	119
489	T	24.5	Very low	30.6	Very low	125 Å²	125	131 Å²	131	77%	0.767	74%	0.739	S	S	*	*			trans	58.6	96.4	170.4	51.1	0	0	0	0	118.9
490	S	23.9	Very low	30.4	Very low	106 Å²	106	133 Å²	133	74%	0.741	74%	0.739	S	S	*	*			trans	-51.5	178.6	134.7	64.4	0	0	0	0	112.8
491	P	38.5	Very low	30.3	Very low	112 Å²	112	134.2 Å²	134.2	73%	0.727	75%	0.746	S	S	*	*			cis	-140.3	-158.5	6.7	23.6	4.6	0	0	0	114.6
492	V	24.5	Very low	29.9	Very low	111 Å²	111	137.2 Å²	137.2	67%	0.673	75%	0.747	S	S	*	*			trans	103.4	98.7	147	-173.8	0	0	0	0	119.4
493	K	28.5	Very low	29.9	Very low	173 Å²	173	138.3 Å²	138.3	75%	0.752	74%	0.744	S	S	*	*			trans	70.4	156.5	140.9	-67.3	178.9	169	-128.2	0	119.7
494	E	26.9	Very low	30	Very low	114 Å²	114	143.5 Å²	143.5	53%	0.533	75%	0.747	S	S	.	*			cis	-153	154.3	-9.6	-129.7	173.2	-121.9	0	0	111.9
495	K	27.4	Very low	30	Very low	180 Å²	180	145.9 Å²	145.9	78%	0.783	75%	0.753	S	S	*	*			trans	66.7	154.9	167.9	-63.2	160.6	-174.7	158.2	0	114.7
496	E	26.8	Very low	30.3	Very low	144 Å²	144	142.9 Å²	142.9	67%	0.673	75%	0.749	S	S	*	*			cis	-145.8	172.6	12.4	-145.8	-158.4	156.1	0	0	111.9
497	K	29.6	Very low	29.6	Very low	155 Å²	155	146.7 Å²	146.7	67%	0.674	75%	0.754	S	S	*	*			trans	72.2	122.6	155.3	-74.9	167.4	-178.1	143.1	0	122.8
498	E	27.6	Very low	29.8	Very low	161 Å²	161	146.2 Å²	146.2	75%	0.752	75%	0.75	S	S	*	*				88.2	121.3	122.6	-162	165.4	-172.8	0	0	123.2
499	T	27.2	Very low	30.4	Very low	125 Å²	125	147.6 Å²	147.6	77%	0.767	75%	0.75	S	S	*	*			trans	66.5	141.9	158.1	61	0	0	0	0	123.1
500	R	27.4	Very low	30.8	Very low	222 Å²	222	150.3 Å²	150.3	84%	0.838	75%	0.751	S	S	*	*			trans	61.1	93.1	145.4	-161.5	173.3	-165.6	147.4	3.6	118	K502	R500-K502 PolarHBondContact O-N 3.28Å
501	V	29.1	Very low	31.5	Very low	148 Å²	148	149.2 Å²	149.2	90%	0.897	74%	0.74	S	S	*	*			trans	-50	124.1	167	-179.6	0	0	0	0	111.6
502	K	38.5	Very low	31.9	Very low	182 Å²	182	152.7 Å²	152.7	79%	0.791	75%	0.751	S	S	*	*			trans	-113.2	142.8	168.1	-69	169.1	177.5	167.6	0	108.9	R500	R500-K502 PolarHBondContact O-N 3.28Å
503	T	27	Very low	32.5	Very low	126 Å²	126	153.9 Å²	153.9	77%	0.773	75%	0.75	S	S	*	*			trans	-177.4	133.7	161.1	-82.5	0	0	0	0	107.9
504	W	29.4	Very low	32.9	Very low	217 Å²	217	155.7 Å²	155.7	82%	0.822	76%	0.758	S	S	*	*			cis	-151.9	146	-30.7	-109.2	97.6	0	0	0	104.5	P506	W504-P506 WeakPolarHBondContact O-CD 3.42Å
505	N	40.8	Very low	33.6	Very low	161 Å²	161	157.5 Å²	157.5	86%	0.861	76%	0.764	S	S	*	*			trans	-103.4	97.6	175.3	-84.1	-3.1	0	0	0	110.7
506	P	31.7	Very low	34.7	Very low	104 Å²	104	156.3 Å²	156.3	68%	0.675	76%	0.759	S	S	*	*			trans	-84.1	112.1	162	32.4	-29.9	0	0	0	109.8	W504	W504-P506 WeakPolarHBondContact O-CD 3.42Å
507	F	29.4	Very low	36	Very low	198 Å²	198	156.6 Å²	156.6	87%	0.868	76%	0.76	S	S	*	*			trans	154.7	130.1	138.8	-87.7	-66.4	0	0	0	109.6
508	P	44.6	Very low	37.5	Very low	101 Å²	101	151 Å²	151	66%	0.656	74%	0.736	S	S	*	*			trans	-80.6	169.8	-178.4	34.7	-36.1	0	0	0	112.5	F510	P508-F510 PolarHBondContact O-N 2.82Å; P508-F510 VanDerWaalsContact O-N 3.09Å
509	D	34.2	Very low	39.7	Very low	134 Å²	134	146 Å²	146	72%	0.717	72%	0.717	S	S	*	*			trans	-46.2	104.8	170.6	-173.7	13.9	0	0	0	113.3	T511	D509-T511 VanDerWaalsContact OD1-CG2 3.23Å; D509-T511 WeakPolarHBondContact OD1-CG2 3.49Å; D509-T511 PolarHBondContact OD1-N 3.38Å
510	F	34.1	Very low	41.7	Very low	183 Å²	183	145 Å²	145	80%	0.803	71%	0.712	S	S	*	*			trans	-105.5	92.9	159.1	-99.3	-79.5	0	0	0	109	P508	P508-F510 PolarHBondContact O-N 2.82Å; P508-F510 VanDerWaalsContact O-N 3.09Å
511	T	38	Very low	43.8	Very low	82 Å²	82	141.4 Å²	141.4	50%	0.503	71%	0.705	S	S	.	*			trans	-60.3	178.5	169.7	69.1	0	0	0	0	111.9	D509 Q513	D509-T511 VanDerWaalsContact OD1-CG2 3.23Å; D509-T511 WeakPolarHBondContact OD1-CG2 3.49Å; D509-T511 PolarHBondContact OD1-N 3.38Å; T511-Q513 PolarHBondContact O-N 3.46Å
512	L	48.3	Very low	46.5	Very low	185 Å²	185	136.1 Å²	136.1	97%	0.969	67%	0.67	S	S	*	*	S	Bend	trans	-72	59.1	-179.7	-68.2	168.9	0	0	0	113.1
513	Q	36.6	Very low	48.6	Very low	137 Å²	137	130.8 Å²	130.8	64%	0.64	65%	0.65	S	S	*	*			trans	-106.7	83.4	-172.6	-174	170.7	-5.9	0	0	111.6	T511 F515	T511-Q513 PolarHBondContact O-N 3.46Å; Q513-F515 PolarHBondContact O-N 3.07Å
514	K	36.8	Very low	51.4	Low	211 Å²	211	129.3 Å²	129.3	92%	0.917	64%	0.641	S	S	*	*			trans	28	33	146.5	-51.3	179.7	-171.9	169	0	120.3
515	F	41.9	Very low	54.1	Low	152 Å²	152	120.8 Å²	120.8	67%	0.667	61%	0.612	S	S	*	*			trans	-140.7	87.3	177.1	-143.5	-90.2	0	0	0	113.3	Q513 E517	Q513-F515 PolarHBondContact O-N 3.07Å; F515-E517 HydrophobicContact CE1-CB 4.39Å; F515-E517 HydrophobicContact CE2-CG 4.35Å; F515-E517 HydrophobicContact CZ-CB 4.37Å; F515-E517 HydrophobicContact CZ-CG 4.07Å; F515-E517 WeakPolarHBondContact CZ-OE2 3.49Å
516	K	50.1	Low	56.3	Low	155 Å²	155	113.1 Å²	113.1	67%	0.674	57%	0.571	S	S	*	*			trans	-139.2	78.2	142.8	-161.4	71.4	63.2	-178.6	0	107.7	K518	K516-K518 VanDerWaalsContact C-N 3.32Å; K516-K518 PolarHBondContact O-N 3.41Å
517	E	53.8	Low	59	Low	149 Å²	149	111 Å²	111	70%	0.696	55%	0.552	S	S	*	*			trans	-51.1	112.3	144.1	-71.9	-173.8	134.4	0	0	105.9	F515	F515-E517 HydrophobicContact CE1-CB 4.39Å; F515-E517 HydrophobicContact CE2-CG 4.35Å; F515-E517 HydrophobicContact CZ-CB 4.37Å; F515-E517 HydrophobicContact CZ-CG 4.07Å; F515-E517 WeakPolarHBondContact CZ-OE2 3.49Å
518	K	62	Low	61.7	Low	38 Å²	38	106 Å²	106	17%	0.165	53%	0.531	C	S	.	.			trans	-64.3	139.1	160.2	-72.2	153.9	-176.1	160.3	0	105	K516 Q522 L523 L526 L550	K516-K518 VanDerWaalsContact C-N 3.32Å; K516-K518 PolarHBondContact O-N 3.41Å; K518-Q522 HydrophobicContact CB-CB 4.08Å; K518-L523 HydrophobicContact CB-CD1 4.49Å; K518-L523 HydrophobicContact CB-CD2 3.81Å; K518-L523 HydrophobicContact CB-CG 3.78Å; K518-L523 HydrophobicContact CD-CD2 3.82Å; K518-L523 HydrophobicContact CG-CD2 4.46Å; K518-L526 HydrophobicContact CD-CD1 4.19Å; K518-L550 HydrophobicContact CD-CD1 4.45Å; K518-L550 HydrophobicContact CG-CD1 4.36Å
519	T	72	Confident	63.7	Low	57 Å²	57	101.8 Å²	101.8	35%	0.35	51%	0.505	S	S	.	.			trans	-55.5	148.6	178.3	68.7	0	0	0	0	108.7	E521 Q522 L523	T519-E521 PolarHBondContact O-N 3Å; T519-E521 VanDerWaalsContact O-N 3.11Å; T519-Q522 WeakPolarHBondContact O-CA 3.5Å; T519-Q522 WeakPolarHBondContact O-CB 3.4Å; T519-Q522 PolarHBondContact O-N 3.19Å; T519-Q522 VanDerWaalsContact OG1-CG 3.28Å; T519-Q522 WeakPolarHBondContact OG1-CG 3.35Å; T519-Q522 PolarHBondContact OG1-N 3.16Å; T519-Q522 VanDerWaalsContact OG1-N 3.15Å; T519-L523 PolarHBondContact O-N 3.36Å
520	P	70.3	Confident	66.2	Low	102 Å²	102	97.3 Å²	97.3	66%	0.662	48%	0.479	S	S	*	.	H	α-helix	trans	-53.8	-35.1	179.2	19.2	-31.4	0	0	0	111.3	L523 V524	P520-L523 PolarHBondContact O-N 3.25Å; P520-V524 VanDerWaalsContact O-CG2 3.32Å; P520-V524 WeakPolarHBondContact O-CG2 3.41Å; P520-V524 PolarHBondContact O-N 2.65Å
521	E	71.9	Confident	68.7	Low	148 Å²	148	96 Å²	96	69%	0.692	48%	0.475	S	S	*	.	H	α-helix	trans	-59.3	-48.5	171.1	-55.1	163.5	162.6	0	0	113.1	T519 L523 V524 V525	T519-E521 PolarHBondContact O-N 3Å; T519-E521 VanDerWaalsContact O-N 3.11Å; E521-L523 VanDerWaalsContact C-N 3.28Å; E521-L523 PolarHBondContact O-N 3.18Å; E521-V524 PolarHBondContact O-N 3Å; E521-V525 WeakPolarHBondContact O-CG2 3.14Å; E521-V525 PolarHBondContact O-N 3.17Å
522	Q	84.4	Confident	70.8	Confident	37 Å²	37	98.5 Å²	98.5	17%	0.173	48%	0.479	C	S	.	.	H	α-helix	trans	-61.1	-36.9	174.8	-75.7	171.2	-21.6	0	0	111.8	K518 T519 L526 T548	K518-Q522 HydrophobicContact CB-CB 4.08Å; T519-Q522 WeakPolarHBondContact O-CA 3.5Å; T519-Q522 WeakPolarHBondContact O-CB 3.4Å; T519-Q522 PolarHBondContact O-N 3.19Å; T519-Q522 VanDerWaalsContact OG1-CG 3.28Å; T519-Q522 WeakPolarHBondContact OG1-CG 3.35Å; T519-Q522 PolarHBondContact OG1-N 3.16Å; T519-Q522 VanDerWaalsContact OG1-N 3.15Å; Q522-L526 WeakPolarHBondContact O-CB 3.35Å; Q522-L526 WeakPolarHBondContact O-CD1 3.5Å; Q522-L526 WeakPolarHBondContact O-CG 3.41Å; Q522-L526 PolarHBondContact O-N 3.44Å; Q522-L526 VanDerWaalsContact O-N 3.14Å; Q522-T548 WeakPolarHBondContact CG-O 3.41Å; Q522-T548 PolarHBondContact NE2-O 3.22Å
523	L	83.3	Confident	72	Confident	69 Å²	69	90.6 Å²	90.6	36%	0.361	44%	0.439	S	S	.	.	H	α-helix	trans	-69	-45.9	175.7	-71.4	174.9	0	0	0	111.4	K518 T519 P520 E521 V525 L526 E527	K518-L523 HydrophobicContact CB-CD1 4.49Å; K518-L523 HydrophobicContact CB-CD2 3.81Å; K518-L523 HydrophobicContact CB-CG 3.78Å; K518-L523 HydrophobicContact CD-CD2 3.82Å; K518-L523 HydrophobicContact CG-CD2 4.46Å; T519-L523 PolarHBondContact O-N 3.36Å; P520-L523 PolarHBondContact O-N 3.25Å; E521-L523 VanDerWaalsContact C-N 3.28Å; E521-L523 PolarHBondContact O-N 3.18Å; L523-V525 PolarHBondContact O-N 2.96Å; L523-L526 PolarHBondContact O-N 3.46Å; L523-E527 VanDerWaalsContact O-CB 3.23Å; L523-E527 WeakPolarHBondContact O-CB 3.43Å; L523-E527 PolarHBondContact O-N 2.65Å
524	V	85.6	Confident	73.9	Confident	96 Å²	96	86.2 Å²	86.2	58%	0.582	42%	0.424	S	S	*	.	H	α-helix	trans	-57.8	-47.8	177.3	167.5	0	0	0	0	111.2	P520 E521 L526 E527 E528	P520-V524 VanDerWaalsContact O-CG2 3.32Å; P520-V524 WeakPolarHBondContact O-CG2 3.41Å; P520-V524 PolarHBondContact O-N 2.65Å; E521-V524 PolarHBondContact O-N 3Å; V524-L526 VanDerWaalsContact C-N 3.34Å; V524-L526 PolarHBondContact O-N 3.26Å; V524-E527 PolarHBondContact O-N 2.82Å; V524-E528 VanDerWaalsContact O-CB 3.27Å; V524-E528 WeakPolarHBondContact O-CB 3.38Å; V524-E528 PolarHBondContact O-N 3.11Å
525	V	87.1	Confident	75.8	Confident	37 Å²	37	81.8 Å²	81.8	22%	0.224	41%	0.408	C	S	.	.	H	α-helix	trans	-64.2	-37.6	178.2	171.1	0	0	0	0	112.2	E521 L523 S529 L544 E547 T548	E521-V525 WeakPolarHBondContact O-CG2 3.14Å; E521-V525 PolarHBondContact O-N 3.17Å; L523-V525 PolarHBondContact O-N 2.96Å; V525-S529 WeakPolarHBondContact O-CB 3.35Å; V525-S529 PolarHBondContact O-N 2.85Å; V525-S529 VanDerWaalsContact O-N 3.17Å; V525-L544 HydrophobicContact CG1-CD2 3.78Å; V525-E547 HydrophobicContact CG1-CB 3.98Å; V525-T548 HydrophobicContact CB-CG2 4.15Å; V525-T548 HydrophobicContact CG1-CG2 3.72Å
526	L	86.9	Confident	77.7	Confident	0 Å²	0	75.2 Å²	75.2	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-69.1	-40	174.6	-75.8	171.5	0	0	0	112.5	K518 Q522 L523 V524 S529 F530 L544 T548 L550 I555 W558 F559	K518-L526 HydrophobicContact CD-CD1 4.19Å; Q522-L526 WeakPolarHBondContact O-CB 3.35Å; Q522-L526 WeakPolarHBondContact O-CD1 3.5Å; Q522-L526 WeakPolarHBondContact O-CG 3.41Å; Q522-L526 PolarHBondContact O-N 3.44Å; Q522-L526 VanDerWaalsContact O-N 3.14Å; L523-L526 PolarHBondContact O-N 3.46Å; V524-L526 VanDerWaalsContact C-N 3.34Å; V524-L526 PolarHBondContact O-N 3.26Å; L526-S529 PolarHBondContact O-N 3.31Å; L526-F530 WeakPolarHBondContact O-CB 3.49Å; L526-F530 PolarHBondContact O-N 3.21Å; L526-L544 HydrophobicContact CD2-CD1 4.36Å; L526-L544 HydrophobicContact CD2-CD2 4.18Å; L526-T548 HydrophobicContact CD2-CG2 4.18Å; L526-T548 HydrophobicContact CG-CG2 3.98Å; L526-L550 HydrophobicContact CD1-CD1 3.89Å; L526-I555 HydrophobicContact CD2-CG1 4.47Å; L526-I555 HydrophobicContact CD2-CG2 4.03Å; L526-W558 VanDerWaalsContact C-CH2 3.43Å; L526-W558 HydrophobicContact CB-CD2 4.11Å; L526-W558 HydrophobicContact CB-CE3 3.82Å; L526-W558 HydrophobicContact CB-CH2 3.71Å; L526-W558 HydrophobicContact CB-CZ2 3.98Å; L526-W558 HydrophobicContact CB-CZ3 3.64Å; L526-W558 HydrophobicContact CD1-CD2 3.95Å; L526-W558 HydrophobicContact CD1-CE3 4.22Å; L526-W558 HydrophobicContact CD1-CG 4.15Å; L526-W558 HydrophobicContact CD2-CE3 4Å; L526-W558 HydrophobicContact CD2-CZ3 4.39Å; L526-W558 HydrophobicContact CG-CD2 4.43Å; L526-W558 HydrophobicContact CG-CE3 4.24Å; L526-W558 HydrophobicContact CG-CZ3 4.49Å; L526-W558 VanDerWaalsContact O-CH2 3.27Å; L526-W558 WeakPolarHBondContact O-CH2 3.4Å; L526-W558 VanDerWaalsContact O-CZ3 3.25Å; L526-W558 WeakPolarHBondContact O-CZ3 3.05Å; L526-F559 HydrophobicContact CD2-CD2 4.46Å; L526-F559 HydrophobicContact CD2-CE2 3.82Å
527	E	88.2	Confident	79.4	Confident	60 Å²	60	71 Å²	71	28%	0.28	37%	0.37	S	S	.	.	H	α-helix	trans	-68.5	-48.8	179.6	-163.1	95.5	-83.8	0	0	110.9	L523 V524 S529 F530 E531 R562	L523-E527 VanDerWaalsContact O-CB 3.23Å; L523-E527 WeakPolarHBondContact O-CB 3.43Å; L523-E527 PolarHBondContact O-N 2.65Å; V524-E527 PolarHBondContact O-N 2.82Å; E527-S529 VanDerWaalsContact C-N 3.26Å; E527-S529 PolarHBondContact O-N 3.03Å; E527-F530 CarbonylContact O-C 3.52Å; E527-F530 WeakPolarHBondContact O-CA 3.5Å; E527-F530 WeakPolarHBondContact O-CB 3.39Å; E527-F530 PolarHBondContact O-N 3.45Å; E527-E531 WeakPolarHBondContact O-CG 3.29Å; E527-E531 PolarHBondContact O-N 3.4Å; E527-R562 IonicContact OE1-CZ 2.63Å; E527-R562 IonicContact OE1-NE 2.85Å; E527-R562 PolarHBondContact OE1-NE 2.89Å; E527-R562 IonicContact OE1-NH2 3.8Å; E527-R562 PolarHBondContact OE1-NH2 2.66Å; E527-R562 IonicContact OE2-CZ 3.55Å; E527-R562 IonicContact OE2-NE 3.19Å; E527-R562 IonicContact OE2-NH2 3.53Å; E527-R562 PolarHBondContact OE2-NH2 2.59Å
528	E	86.6	Confident	80.9	Confident	92 Å²	92	68.9 Å²	68.9	43%	0.43	36%	0.364	S	S	.	.	H	α-helix	trans	-58.2	-38.9	174.7	-163.9	-155.3	178.1	0	0	111.1	V524 K532	V524-E528 VanDerWaalsContact O-CB 3.27Å; V524-E528 WeakPolarHBondContact O-CB 3.38Å; V524-E528 PolarHBondContact O-N 3.11Å; E528-K532 WeakPolarHBondContact O-CB 3.37Å; E528-K532 WeakPolarHBondContact O-CD 3.5Å; E528-K532 WeakPolarHBondContact O-CG 3.35Å; E528-K532 PolarHBondContact O-N 3.26Å; E528-K532 VanDerWaalsContact O-N 3.13Å; E528-K532 WeakPolarHBondContact OE1-CE 3.48Å; E528-K532 IonicContact OE1-NZ 3.76Å; E528-K532 PolarHBondContact OE1-NZ 3.3Å; E528-K532 IonicContact OE2-NZ 3.08Å; E528-K532 PolarHBondContact OE2-NZ 3.32Å
529	S	85.8	Confident	82.2	Confident	13 Å²	13	74.1 Å²	74.1	9%	0.091	39%	0.389	C	S	.	.	H	α-helix	trans	-73.6	-24.2	172.1	-174.7	0	0	0	0	113.7	V525 L526 E527 S533	V525-S529 WeakPolarHBondContact O-CB 3.35Å; V525-S529 PolarHBondContact O-N 2.85Å; V525-S529 VanDerWaalsContact O-N 3.17Å; L526-S529 PolarHBondContact O-N 3.31Å; E527-S529 VanDerWaalsContact C-N 3.26Å; E527-S529 PolarHBondContact O-N 3.03Å; S529-S533 CarbonylContact O-C 3.49Å; S529-S533 PolarHBondContact O-N 2.94Å; S529-S533 PolarHBondContact O-OG 3.14Å
530	F	85.9	Confident	82.9	Confident	41 Å²	41	74.3 Å²	74.3	18%	0.18	39%	0.386	C	S	.	.	H	α-helix	trans	-76.6	-36.6	176.3	-173.2	-97	0	0	0	112.3	L526 E527 S533 S534 W558 F559 R562 R563	L526-F530 WeakPolarHBondContact O-CB 3.49Å; L526-F530 PolarHBondContact O-N 3.21Å; E527-F530 CarbonylContact O-C 3.52Å; E527-F530 WeakPolarHBondContact O-CA 3.5Å; E527-F530 WeakPolarHBondContact O-CB 3.39Å; E527-F530 PolarHBondContact O-N 3.45Å; F530-S533 CarbonylContact O-C 3.43Å; F530-S534 WeakPolarHBondContact CZ-OG 2.74Å; F530-S534 PolarHBondContact O-N 2.78Å; F530-S534 VanDerWaalsContact O-N 3.16Å; F530-W558 HydrophobicContact CB-CH2 3.78Å; F530-W558 HydrophobicContact CB-CZ3 3.92Å; F530-W558 HydrophobicContact CD2-CH2 4.35Å; F530-W558 HydrophobicContact CD2-CZ3 4.09Å; F530-W558 HydrophobicContact CG-CH2 4.19Å; F530-W558 HydrophobicContact CG-CZ3 4.31Å; F530-F559 HydrophobicContact CB-CE1 4.07Å; F530-F559 HydrophobicContact CB-CZ 4.41Å; F530-F559 AromaticContact CD2-CD1 3.68Å; F530-F559 HydrophobicContact CD2-CD1 3.68Å; F530-F559 AromaticContact CD2-CE1 3.73Å; F530-F559 HydrophobicContact CD2-CE1 3.73Å; F530-F559 HydrophobicContact CE2-CD1 4.32Å; F530-F559 HydrophobicContact CG-CE1 4.39Å; F530-R562 HydrophobicContact CD1-CG 3.97Å; F530-R562 HydrophobicContact CD2-CB 4.11Å; F530-R562 HydrophobicContact CD2-CG 4.04Å; F530-R562 HydrophobicContact CE1-CG 3.74Å; F530-R562 HydrophobicContact CE2-CB 3.71Å; F530-R562 HydrophobicContact CE2-CG 3.82Å; F530-R562 HydrophobicContact CG-CG 4.12Å; F530-R562 HydrophobicContact CZ-CB 3.93Å; F530-R562 HydrophobicContact CZ-CG 3.66Å; F530-R563 HydrophobicContact CE2-CG 3.9Å; F530-R563 HydrophobicContact CZ-CG 4.03Å
531	E	86.3	Confident	83.6	Confident	156 Å²	156	69.9 Å²	69.9	73%	0.729	36%	0.356	S	S	*	.	H	α-helix	trans	-65.8	-44	171.5	-68.7	177.7	166.8	0	0	111.1	E527	E527-E531 WeakPolarHBondContact O-CG 3.29Å; E527-E531 PolarHBondContact O-N 3.4Å
532	K	82.5	Confident	84.3	Confident	134 Å²	134	65.9 Å²	65.9	58%	0.583	35%	0.345	S	S	*	.	H	α-helix	trans	-63.9	-46.6	172.1	-70.4	165.1	-171.5	169.7	0	112.3	E528	E528-K532 WeakPolarHBondContact O-CB 3.37Å; E528-K532 WeakPolarHBondContact O-CD 3.5Å; E528-K532 WeakPolarHBondContact O-CG 3.35Å; E528-K532 PolarHBondContact O-N 3.26Å; E528-K532 VanDerWaalsContact O-N 3.13Å; E528-K532 WeakPolarHBondContact OE1-CE 3.48Å; E528-K532 IonicContact OE1-NZ 3.76Å; E528-K532 PolarHBondContact OE1-NZ 3.3Å; E528-K532 IonicContact OE2-NZ 3.08Å; E528-K532 PolarHBondContact OE2-NZ 3.32Å
533	S	73.9	Confident	84.6	Confident	19 Å²	19	71.2 Å²	71.2	13%	0.133	36%	0.363	C	S	.	.			trans	-151.1	96.4	-175.4	57.8	0	0	0	0	113.1	S529 F530 M535 P536 E540 F559	S529-S533 CarbonylContact O-C 3.49Å; S529-S533 PolarHBondContact O-N 2.94Å; S529-S533 PolarHBondContact O-OG 3.14Å; F530-S533 CarbonylContact O-C 3.43Å; S533-M535 PolarHBondContact O-N 2.62Å; S533-P536 WeakPolarHBondContact O-CD 3.47Å; S533-P536 WeakPolarHBondContact OG-CA 3.36Å; S533-E540 WeakPolarHBondContact CB-OE1 3.32Å; S533-E540 PolarHBondContact OG-OE1 3Å; S533-E540 PolarHBondContact OG-OE2 3.11Å; S533-F559 WeakPolarHBondContact O-CE1 3.14Å
534	S	76.3	Confident	84.9	Confident	44 Å²	44	68 Å²	68	31%	0.308	35%	0.347	S	S	.	.	S	Bend	trans	-58.5	-14.6	173.6	-166.6	0	0	0	0	114	F530 R563	F530-S534 WeakPolarHBondContact CZ-OG 2.74Å; F530-S534 PolarHBondContact O-N 2.78Å; F530-S534 VanDerWaalsContact O-N 3.16Å; S534-R563 VanDerWaalsContact O-CD 3.32Å; S534-R563 WeakPolarHBondContact O-CD 3.46Å; S534-R563 PolarHBondContact O-NE 2.83Å
535	M	77.6	Confident	85.1	Confident	119 Å²	119	68.5 Å²	68.5	59%	0.586	34%	0.338	S	S	*	.	S	Bend	trans	-132	89.9	165.4	-73.8	-92.7	54.5	0	0	109.4	S533 R563	S533-M535 PolarHBondContact O-N 2.62Å; M535-R563 PolarHBondContact SD-NH1 3.31Å
536	P	82.3	Confident	85.1	Confident	14 Å²	14	71.5 Å²	71.5	9%	0.091	36%	0.357	C	S	.	.			trans	-70.6	146.5	-172.7	28.7	-36.3	0	0	0	112.2	S533 E540 L541 F559	S533-P536 WeakPolarHBondContact O-CD 3.47Å; S533-P536 WeakPolarHBondContact OG-CA 3.36Å; P536-E540 WeakPolarHBondContact CA-OE2 3.49Å; P536-E540 HydrophobicContact CB-CB 3.87Å; P536-L541 HydrophobicContact CB-CD1 4.49Å; P536-L541 HydrophobicContact CB-CD2 4.29Å; P536-L541 HydrophobicContact CB-CG 3.95Å; P536-L541 HydrophobicContact CG-CD1 4.04Å; P536-L541 HydrophobicContact CG-CD2 3.6Å; P536-L541 HydrophobicContact CG-CG 3.68Å; P536-L541 WeakPolarHBondContact O-CD1 3.43Å; P536-F559 HydrophobicContact CB-CE1 4.33Å; P536-F559 HydrophobicContact CB-CZ 4.44Å; P536-F559 VanDerWaalsContact CD-CE1 3.49Å; P536-F559 HydrophobicContact CG-CD1 3.71Å; P536-F559 HydrophobicContact CG-CD2 4.23Å; P536-F559 HydrophobicContact CG-CE1 3.59Å; P536-F559 HydrophobicContact CG-CE2 4.15Å; P536-F559 HydrophobicContact CG-CG 4.04Å; P536-F559 HydrophobicContact CG-CZ 3.83Å
537	S	84.6	Confident	85.1	Confident	66 Å²	66	75.6 Å²	75.6	46%	0.462	38%	0.376	S	S	.	.			trans	-65.8	166.3	174.7	-172.7	0	0	0	0	111.9	E539 E540 L541	S537-E539 PolarHBondContact O-N 2.97Å; S537-E540 WeakPolarHBondContact CB-OE2 3.49Å; S537-E540 PolarHBondContact N-OE2 2.69Å; S537-E540 PolarHBondContact O-N 3.14Å; S537-L541 VanDerWaalsContact O-CB 3.26Å; S537-L541 WeakPolarHBondContact O-CB 3.15Å; S537-L541 VanDerWaalsContact O-CG 3.26Å; S537-L541 WeakPolarHBondContact O-CG 3.33Å; S537-L541 PolarHBondContact O-N 2.73Å
538	D	85.1	Confident	84.8	Confident	105 Å²	105	72.9 Å²	72.9	56%	0.561	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-29.3	178.4	-159.3	49.7	0	0	0	112.6	L541 S542 R552	D538-L541 CarbonylContact O-C 3.53Å; D538-S542 PolarHBondContact O-N 3.24Å; D538-R552 IonicContact OD1-CZ 2.86Å; D538-R552 IonicContact OD1-NH1 2.86Å; D538-R552 PolarHBondContact OD1-NH1 2.97Å; D538-R552 IonicContact OD1-NH2 2.63Å; D538-R552 PolarHBondContact OD1-NH2 3.32Å
539	E	88.9	Confident	84.8	Confident	148 Å²	148	77.3 Å²	77.3	69%	0.692	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-48.4	174.3	-177.2	173.4	-169.8	0	0	112.2	S537 L541 S542 R543	S537-E539 PolarHBondContact O-N 2.97Å; E539-L541 VanDerWaalsContact C-N 3.31Å; E539-L541 PolarHBondContact O-N 2.92Å; E539-S542 WeakPolarHBondContact O-CA 3.47Å; E539-S542 VanDerWaalsContact O-CB 3.24Å; E539-S542 WeakPolarHBondContact O-CB 3.38Å; E539-S542 PolarHBondContact O-N 2.75Å; E539-R543 PolarHBondContact O-N 2.87Å
540	E	86.6	Confident	84.7	Confident	60 Å²	60	77.3 Å²	77.3	28%	0.28	38%	0.38	S	S	.	.	H	α-helix	trans	-60.1	-42.8	171.7	-65.9	170.7	110.4	0	0	110.5	S533 P536 S537 S542 R543 L544	S533-E540 WeakPolarHBondContact CB-OE1 3.32Å; S533-E540 PolarHBondContact OG-OE1 3Å; S533-E540 PolarHBondContact OG-OE2 3.11Å; P536-E540 WeakPolarHBondContact CA-OE2 3.49Å; P536-E540 HydrophobicContact CB-CB 3.87Å; S537-E540 WeakPolarHBondContact CB-OE2 3.49Å; S537-E540 PolarHBondContact N-OE2 2.69Å; S537-E540 PolarHBondContact O-N 3.14Å; E540-S542 PolarHBondContact O-N 2.95Å; E540-S542 VanDerWaalsContact O-N 3.16Å; E540-R543 PolarHBondContact O-N 3.09Å; E540-L544 WeakPolarHBondContact O-CB 3.1Å; E540-L544 VanDerWaalsContact O-CG 3.29Å; E540-L544 WeakPolarHBondContact O-CG 3.25Å; E540-L544 PolarHBondContact O-N 3.29Å
541	L	86.3	Confident	84.8	Confident	9 Å²	9	79.1 Å²	79.1	5%	0.047	40%	0.395	C	S	.	.	H	α-helix	trans	-74.3	5.8	172.6	-67.6	166.1	0	0	0	114.4	P536 S537 D538 E539 L544 R545 R552 I555	P536-L541 HydrophobicContact CB-CD1 4.49Å; P536-L541 HydrophobicContact CB-CD2 4.29Å; P536-L541 HydrophobicContact CB-CG 3.95Å; P536-L541 HydrophobicContact CG-CD1 4.04Å; P536-L541 HydrophobicContact CG-CD2 3.6Å; P536-L541 HydrophobicContact CG-CG 3.68Å; P536-L541 WeakPolarHBondContact O-CD1 3.43Å; S537-L541 VanDerWaalsContact O-CB 3.26Å; S537-L541 WeakPolarHBondContact O-CB 3.15Å; S537-L541 VanDerWaalsContact O-CG 3.26Å; S537-L541 WeakPolarHBondContact O-CG 3.33Å; S537-L541 PolarHBondContact O-N 2.73Å; D538-L541 CarbonylContact O-C 3.53Å; E539-L541 VanDerWaalsContact C-N 3.31Å; E539-L541 PolarHBondContact O-N 2.92Å; L541-L544 HydrophobicContact CD2-CD1 4.32Å; L541-R545 WeakPolarHBondContact O-CG 3.41Å; L541-R545 PolarHBondContact O-NE 2.81Å; L541-R552 VanDerWaalsContact CB-CZ 3.4Å; L541-R552 VanDerWaalsContact CD1-CZ 3.49Å; L541-R552 PolarHBondContact O-NH1 3.35Å; L541-I555 HydrophobicContact CD2-CB 4.43Å; L541-I555 HydrophobicContact CD2-CG2 3.48Å; L541-I555 VanDerWaalsContact CD2-CG2 3.48Å
542	S	86.8	Confident	84.7	Confident	65 Å²	65	74.4 Å²	74.4	46%	0.455	37%	0.37	S	S	.	.	H	α-helix	trans	-100.8	-50.9	165.1	-164.1	0	0	0	0	109.2	D538 E539 E540 L544 R545 T546	D538-S542 PolarHBondContact O-N 3.24Å; E539-S542 WeakPolarHBondContact O-CA 3.47Å; E539-S542 VanDerWaalsContact O-CB 3.24Å; E539-S542 WeakPolarHBondContact O-CB 3.38Å; E539-S542 PolarHBondContact O-N 2.75Å; E540-S542 PolarHBondContact O-N 2.95Å; E540-S542 VanDerWaalsContact O-N 3.16Å; S542-L544 VanDerWaalsContact C-N 3.34Å; S542-L544 PolarHBondContact O-N 2.83Å; S542-R545 WeakPolarHBondContact O-CA 3.26Å; S542-R545 WeakPolarHBondContact O-CB 3.43Å; S542-R545 PolarHBondContact O-N 2.75Å; S542-T546 PolarHBondContact O-N 2.97Å
543	R	91.1	Very high	84.8	Confident	148 Å²	148	78.1 Å²	78.1	56%	0.558	38%	0.381	S	S	*	.	H	α-helix	trans	-53.1	-47.2	172.6	-75.7	-166.9	59.4	-175	-7.8	112.9	E539 E540 R545 T546 E547	E539-R543 PolarHBondContact O-N 2.87Å; E540-R543 PolarHBondContact O-N 3.09Å; R543-R545 PolarHBondContact O-N 3.38Å; R543-T546 WeakPolarHBondContact CA-OG1 3.39Å; R543-T546 PolarHBondContact O-N 3.08Å; R543-T546 PolarHBondContact O-OG1 3.43Å; R543-E547 IonicContact CZ-OE1 3.22Å; R543-E547 VanDerWaalsContact CZ-OE1 3.23Å; R543-E547 IonicContact NE-OE1 2.78Å; R543-E547 PolarHBondContact NE-OE1 2.81Å; R543-E547 IonicContact NH2-OE1 3.9Å; R543-E547 PolarHBondContact NH2-OE1 3.5Å; R543-E547 IonicContact NH2-OE2 2.66Å; R543-E547 WeakPolarHBondContact O-CB 3.28Å; R543-E547 VanDerWaalsContact O-CG 3.29Å; R543-E547 WeakPolarHBondContact O-CG 3.33Å; R543-E547 PolarHBondContact O-N 3.38Å
544	L	88.9	Confident	85.5	Confident	3 Å²	3	81 Å²	81	2%	0.016	39%	0.392	C	S	.	.	H	α-helix	trans	-59.4	-29.9	175.5	-74.7	175.3	0	0	0	112.9	V525 L526 E540 L541 S542 T548 I555 F559	V525-L544 HydrophobicContact CG1-CD2 3.78Å; L526-L544 HydrophobicContact CD2-CD1 4.36Å; L526-L544 HydrophobicContact CD2-CD2 4.18Å; E540-L544 WeakPolarHBondContact O-CB 3.1Å; E540-L544 VanDerWaalsContact O-CG 3.29Å; E540-L544 WeakPolarHBondContact O-CG 3.25Å; E540-L544 PolarHBondContact O-N 3.29Å; L541-L544 HydrophobicContact CD2-CD1 4.32Å; S542-L544 VanDerWaalsContact C-N 3.34Å; S542-L544 PolarHBondContact O-N 2.83Å; L544-T548 HydrophobicContact CD2-CG2 4.18Å; L544-T548 VanDerWaalsContact O-CB 3.24Å; L544-T548 WeakPolarHBondContact O-CB 3.26Å; L544-T548 WeakPolarHBondContact O-CG2 3.29Å; L544-T548 PolarHBondContact O-N 3.25Å; L544-T548 PolarHBondContact O-OG1 2.78Å; L544-I555 HydrophobicContact CB-CD1 3.96Å; L544-I555 HydrophobicContact CB-CG2 4.31Å; L544-I555 HydrophobicContact CD1-CG2 3.83Å; L544-F559 HydrophobicContact CD1-CE2 3.59Å; L544-F559 HydrophobicContact CD1-CZ 3.89Å
545	R	89.2	Confident	86	Confident	105 Å²	105	78.9 Å²	78.9	40%	0.396	38%	0.377	S	S	.	.	H	α-helix	trans	-72.4	-39.8	173.8	-59.1	179.5	-150.2	-175.3	5.2	111.7	L541 S542 R543 K549 I555	L541-R545 WeakPolarHBondContact O-CG 3.41Å; L541-R545 PolarHBondContact O-NE 2.81Å; S542-R545 WeakPolarHBondContact O-CA 3.26Å; S542-R545 WeakPolarHBondContact O-CB 3.43Å; S542-R545 PolarHBondContact O-N 2.75Å; R543-R545 PolarHBondContact O-N 3.38Å; R545-K549 WeakPolarHBondContact O-CA 3.34Å; R545-K549 PolarHBondContact O-N 2.7Å; R545-I555 HydrophobicContact CB-CD1 4.38Å; R545-I555 HydrophobicContact CG-CD1 3.7Å
546	T	87.7	Confident	86.5	Confident	101 Å²	101	75.8 Å²	75.8	62%	0.62	36%	0.363	S	S	*	.	H	α-helix	trans	-72	-38.1	179	44.7	0	0	0	0	112	S542 R543	S542-T546 PolarHBondContact O-N 2.97Å; R543-T546 WeakPolarHBondContact CA-OG1 3.39Å; R543-T546 PolarHBondContact O-N 3.08Å; R543-T546 PolarHBondContact O-OG1 3.43Å
547	E	85.9	Confident	86.8	Confident	86 Å²	86	77.8 Å²	77.8	40%	0.402	38%	0.381	S	S	.	.	H	α-helix	trans	-80.4	-49.5	-176.7	-65.8	161.3	-169.4	0	0	111.2	V525 R543	V525-E547 HydrophobicContact CG1-CB 3.98Å; R543-E547 IonicContact CZ-OE1 3.22Å; R543-E547 VanDerWaalsContact CZ-OE1 3.23Å; R543-E547 IonicContact NE-OE1 2.78Å; R543-E547 PolarHBondContact NE-OE1 2.81Å; R543-E547 IonicContact NH2-OE1 3.9Å; R543-E547 PolarHBondContact NH2-OE1 3.5Å; R543-E547 IonicContact NH2-OE2 2.66Å; R543-E547 WeakPolarHBondContact O-CB 3.28Å; R543-E547 VanDerWaalsContact O-CG 3.29Å; R543-E547 WeakPolarHBondContact O-CG 3.33Å; R543-E547 PolarHBondContact O-N 3.38Å
548	T	83.4	Confident	87	Confident	3 Å²	3	75.5 Å²	75.5	2%	0.018	36%	0.362	C	S	.	.	H	α-helix	trans	-85.7	-17	-179.2	75.7	0	0	0	0	114	Q522 V525 L526 L544 L550	Q522-T548 WeakPolarHBondContact CG-O 3.41Å; Q522-T548 PolarHBondContact NE2-O 3.22Å; V525-T548 HydrophobicContact CB-CG2 4.15Å; V525-T548 HydrophobicContact CG1-CG2 3.72Å; L526-T548 HydrophobicContact CD2-CG2 4.18Å; L526-T548 HydrophobicContact CG-CG2 3.98Å; L544-T548 HydrophobicContact CD2-CG2 4.18Å; L544-T548 VanDerWaalsContact O-CB 3.24Å; L544-T548 WeakPolarHBondContact O-CB 3.26Å; L544-T548 WeakPolarHBondContact O-CG2 3.29Å; L544-T548 PolarHBondContact O-N 3.25Å; L544-T548 PolarHBondContact O-OG1 2.78Å; T548-L550 PolarHBondContact O-N 2.9Å; T548-L550 VanDerWaalsContact O-N 3.12Å; T548-L550 WeakPolarHBondContact OG1-CB 3.35Å; T548-L550 PolarHBondContact OG1-N 3.26Å
549	K	85.4	Confident	87.2	Confident	184 Å²	184	70.6 Å²	70.6	80%	0.8	34%	0.335	S	S	*	.			trans	59.2	11.8	-171.5	-59.3	174.4	-176.8	167.5	0	115.2	R545	R545-K549 WeakPolarHBondContact O-CA 3.34Å; R545-K549 PolarHBondContact O-N 2.7Å
550	L	84.8	Confident	87.1	Confident	14 Å²	14	67.8 Å²	67.8	7%	0.073	33%	0.325	C	S	.	.			trans	-80.4	152.1	173.8	-62.8	173.5	0	0	0	111.4	K518 L526 T548 E554 I555	K518-L550 HydrophobicContact CD-CD1 4.45Å; K518-L550 HydrophobicContact CG-CD1 4.36Å; L526-L550 HydrophobicContact CD1-CD1 3.89Å; T548-L550 PolarHBondContact O-N 2.9Å; T548-L550 VanDerWaalsContact O-N 3.12Å; T548-L550 WeakPolarHBondContact OG1-CB 3.35Å; T548-L550 PolarHBondContact OG1-N 3.26Å; L550-E554 HydrophobicContact CB-CB 4.27Å; L550-I555 HydrophobicContact CB-CD1 4.25Å; L550-I555 HydrophobicContact CB-CG1 3.8Å
551	T	87.4	Confident	87.1	Confident	78 Å²	78	70.6 Å²	70.6	48%	0.479	34%	0.338	S	S	.	.			trans	-70.1	154.5	172.8	70.5	0	0	0	0	110.8	R553 E554 I555	T551-R553 PolarHBondContact O-N 2.71Å; T551-E554 WeakPolarHBondContact CA-OE2 3.29Å; T551-E554 WeakPolarHBondContact CB-OE2 3.34Å; T551-E554 VanDerWaalsContact CG2-OE2 3.29Å; T551-E554 WeakPolarHBondContact CG2-OE2 3.26Å; T551-E554 PolarHBondContact N-OE2 3.02Å; T551-E554 PolarHBondContact O-N 3.16Å; T551-E554 PolarHBondContact OG1-N 2.95Å; T551-E554 PolarHBondContact OG1-OE2 2.84Å; T551-I555 WeakPolarHBondContact O-CG1 3.24Å; T551-I555 PolarHBondContact O-N 3.45Å
552	R	84.4	Confident	86.9	Confident	57 Å²	57	74.3 Å²	74.3	22%	0.215	35%	0.352	C	S	.	.	H	α-helix	trans	-48.8	-38	175	-176.7	52.1	170.4	-93.5	-16.4	113	D538 L541 D556	D538-R552 IonicContact OD1-CZ 2.86Å; D538-R552 IonicContact OD1-NH1 2.86Å; D538-R552 PolarHBondContact OD1-NH1 2.97Å; D538-R552 IonicContact OD1-NH2 2.63Å; D538-R552 PolarHBondContact OD1-NH2 3.32Å; L541-R552 VanDerWaalsContact CB-CZ 3.4Å; L541-R552 VanDerWaalsContact CD1-CZ 3.49Å; L541-R552 PolarHBondContact O-NH1 3.35Å; R552-D556 WeakPolarHBondContact CG-OD2 3.45Å; R552-D556 IonicContact NE-OD1 3.89Å; R552-D556 PolarHBondContact NE-OD1 2.88Å; R552-D556 IonicContact NE-OD2 2.73Å; R552-D556 PolarHBondContact NE-OD2 3.47Å; R552-D556 VanDerWaalsContact O-CB 3.24Å; R552-D556 WeakPolarHBondContact O-CB 3.41Å; R552-D556 PolarHBondContact O-N 2.93Å
553	R	84.4	Confident	86.7	Confident	213 Å²	213	75.3 Å²	75.3	80%	0.804	35%	0.346	S	S	*	.	H	α-helix	trans	-71	-33.1	-179	-64	-179.7	-177.8	170.6	1.9	112.8	T551 A557	T551-R553 PolarHBondContact O-N 2.71Å; R553-A557 WeakPolarHBondContact O-CB 3.31Å; R553-A557 PolarHBondContact O-N 2.96Å
554	E	87.5	Confident	85.9	Confident	78 Å²	78	76.5 Å²	76.5	36%	0.364	36%	0.355	S	S	.	.	H	α-helix	trans	-76.1	-36.9	176.3	-69.4	159.8	119.3	0	0	111.6	L550 T551 A557 W558	L550-E554 HydrophobicContact CB-CB 4.27Å; T551-E554 WeakPolarHBondContact CA-OE2 3.29Å; T551-E554 WeakPolarHBondContact CB-OE2 3.34Å; T551-E554 VanDerWaalsContact CG2-OE2 3.29Å; T551-E554 WeakPolarHBondContact CG2-OE2 3.26Å; T551-E554 PolarHBondContact N-OE2 3.02Å; T551-E554 PolarHBondContact O-N 3.16Å; T551-E554 PolarHBondContact OG1-N 2.95Å; T551-E554 PolarHBondContact OG1-OE2 2.84Å; E554-A557 PolarHBondContact O-N 3.42Å; E554-W558 WeakPolarHBondContact O-CB 3.49Å; E554-W558 PolarHBondContact O-N 3.46Å
555	I	88.6	Confident	84.8	Confident	0 Å²	0	80 Å²	80	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-65.3	-54.7	172.2	-59.3	163.2	0	0	0	109.3	L526 L541 L544 R545 L550 T551 A557 W558 F559	L526-I555 HydrophobicContact CD2-CG1 4.47Å; L526-I555 HydrophobicContact CD2-CG2 4.03Å; L541-I555 HydrophobicContact CD2-CB 4.43Å; L541-I555 HydrophobicContact CD2-CG2 3.48Å; L541-I555 VanDerWaalsContact CD2-CG2 3.48Å; L544-I555 HydrophobicContact CB-CD1 3.96Å; L544-I555 HydrophobicContact CB-CG2 4.31Å; L544-I555 HydrophobicContact CD1-CG2 3.83Å; R545-I555 HydrophobicContact CB-CD1 4.38Å; R545-I555 HydrophobicContact CG-CD1 3.7Å; L550-I555 HydrophobicContact CB-CD1 4.25Å; L550-I555 HydrophobicContact CB-CG1 3.8Å; T551-I555 WeakPolarHBondContact O-CG1 3.24Å; T551-I555 PolarHBondContact O-N 3.45Å; I555-A557 PolarHBondContact O-N 3.29Å; I555-W558 PolarHBondContact O-N 3.04Å; I555-W558 VanDerWaalsContact O-N 3.09Å; I555-F559 HydrophobicContact CG2-CD2 3.74Å; I555-F559 HydrophobicContact CG2-CE2 3.86Å; I555-F559 WeakPolarHBondContact O-CD2 3.33Å; I555-F559 PolarHBondContact O-N 3.1Å
556	D	87.9	Confident	82.5	Confident	55 Å²	55	79.8 Å²	79.8	29%	0.294	39%	0.388	S	S	.	.	H	α-helix	trans	-55.7	-39.3	175.9	-70.9	-26.6	0	0	0	111	R552 N560	R552-D556 WeakPolarHBondContact CG-OD2 3.45Å; R552-D556 IonicContact NE-OD1 3.89Å; R552-D556 PolarHBondContact NE-OD1 2.88Å; R552-D556 IonicContact NE-OD2 2.73Å; R552-D556 PolarHBondContact NE-OD2 3.47Å; R552-D556 VanDerWaalsContact O-CB 3.24Å; R552-D556 WeakPolarHBondContact O-CB 3.41Å; R552-D556 PolarHBondContact O-N 2.93Å; D556-N560 WeakPolarHBondContact O-CB 3.45Å; D556-N560 PolarHBondContact O-N 3.17Å; D556-N560 PolarHBondContact O-ND2 2.69Å
557	A	88.8	Confident	80.5	Confident	55 Å²	55	80 Å²	80	46%	0.455	40%	0.401	S	S	.	.	H	α-helix	trans	-63.8	-47.7	175.3	0	0	0	0	0	112.1	R553 E554 I555 N560 E561	R553-A557 WeakPolarHBondContact O-CB 3.31Å; R553-A557 PolarHBondContact O-N 2.96Å; E554-A557 PolarHBondContact O-N 3.42Å; I555-A557 PolarHBondContact O-N 3.29Å; A557-N560 CarbonylContact O-C 3.59Å; A557-N560 WeakPolarHBondContact O-CA 3.45Å; A557-N560 WeakPolarHBondContact O-CB 3.44Å; A557-N560 PolarHBondContact O-N 3.03Å; A557-N560 VanDerWaalsContact O-N 3.11Å; A557-E561 WeakPolarHBondContact O-CB 3.26Å; A557-E561 PolarHBondContact O-N 2.73Å
558	W	88.1	Confident	78.1	Confident	18 Å²	18	80.2 Å²	80.2	7%	0.068	42%	0.417	C	S	.	.	H	α-helix	trans	-63.9	-42.4	177.5	-177	77.6	0	0	0	112.2	L526 F530 E554 I555 N560 E561 R562	L526-W558 VanDerWaalsContact C-CH2 3.43Å; L526-W558 HydrophobicContact CB-CD2 4.11Å; L526-W558 HydrophobicContact CB-CE3 3.82Å; L526-W558 HydrophobicContact CB-CH2 3.71Å; L526-W558 HydrophobicContact CB-CZ2 3.98Å; L526-W558 HydrophobicContact CB-CZ3 3.64Å; L526-W558 HydrophobicContact CD1-CD2 3.95Å; L526-W558 HydrophobicContact CD1-CE3 4.22Å; L526-W558 HydrophobicContact CD1-CG 4.15Å; L526-W558 HydrophobicContact CD2-CE3 4Å; L526-W558 HydrophobicContact CD2-CZ3 4.39Å; L526-W558 HydrophobicContact CG-CD2 4.43Å; L526-W558 HydrophobicContact CG-CE3 4.24Å; L526-W558 HydrophobicContact CG-CZ3 4.49Å; L526-W558 VanDerWaalsContact O-CH2 3.27Å; L526-W558 WeakPolarHBondContact O-CH2 3.4Å; L526-W558 VanDerWaalsContact O-CZ3 3.25Å; L526-W558 WeakPolarHBondContact O-CZ3 3.05Å; F530-W558 HydrophobicContact CB-CH2 3.78Å; F530-W558 HydrophobicContact CB-CZ3 3.92Å; F530-W558 HydrophobicContact CD2-CH2 4.35Å; F530-W558 HydrophobicContact CD2-CZ3 4.09Å; F530-W558 HydrophobicContact CG-CH2 4.19Å; F530-W558 HydrophobicContact CG-CZ3 4.31Å; E554-W558 WeakPolarHBondContact O-CB 3.49Å; E554-W558 PolarHBondContact O-N 3.46Å; I555-W558 PolarHBondContact O-N 3.04Å; I555-W558 VanDerWaalsContact O-N 3.09Å; W558-N560 PolarHBondContact O-N 3.41Å; W558-E561 CarbonylContact O-C 3.37Å; W558-E561 WeakPolarHBondContact O-CB 3.3Å; W558-E561 PolarHBondContact O-N 3.24Å; W558-R562 HydrophobicContact CH2-CB 4.36Å; W558-R562 HydrophobicContact CH2-CG 4.12Å; W558-R562 HydrophobicContact CZ2-CB 4.33Å; W558-R562 HydrophobicContact CZ2-CG 4.09Å; W558-R562 PolarHBondContact O-N 3.02Å
559	F	88.6	Confident	75.9	Confident	2 Å²	2	84.1 Å²	84.1	1%	0.009	45%	0.445	C	S	.	.	H	α-helix	trans	-64.4	-27.5	173.4	-87.6	-93.1	0	0	0	112.5	L526 F530 S533 P536 L544 I555 R563	L526-F559 HydrophobicContact CD2-CD2 4.46Å; L526-F559 HydrophobicContact CD2-CE2 3.82Å; F530-F559 HydrophobicContact CB-CE1 4.07Å; F530-F559 HydrophobicContact CB-CZ 4.41Å; F530-F559 AromaticContact CD2-CD1 3.68Å; F530-F559 HydrophobicContact CD2-CD1 3.68Å; F530-F559 AromaticContact CD2-CE1 3.73Å; F530-F559 HydrophobicContact CD2-CE1 3.73Å; F530-F559 HydrophobicContact CE2-CD1 4.32Å; F530-F559 HydrophobicContact CG-CE1 4.39Å; S533-F559 WeakPolarHBondContact O-CE1 3.14Å; P536-F559 HydrophobicContact CB-CE1 4.33Å; P536-F559 HydrophobicContact CB-CZ 4.44Å; P536-F559 VanDerWaalsContact CD-CE1 3.49Å; P536-F559 HydrophobicContact CG-CD1 3.71Å; P536-F559 HydrophobicContact CG-CD2 4.23Å; P536-F559 HydrophobicContact CG-CE1 3.59Å; P536-F559 HydrophobicContact CG-CE2 4.15Å; P536-F559 HydrophobicContact CG-CG 4.04Å; P536-F559 HydrophobicContact CG-CZ 3.83Å; L544-F559 HydrophobicContact CD1-CE2 3.59Å; L544-F559 HydrophobicContact CD1-CZ 3.89Å; I555-F559 HydrophobicContact CG2-CD2 3.74Å; I555-F559 HydrophobicContact CG2-CE2 3.86Å; I555-F559 WeakPolarHBondContact O-CD2 3.33Å; I555-F559 PolarHBondContact O-N 3.1Å; F559-R563 WeakPolarHBondContact O-CG 3.38Å; F559-R563 PolarHBondContact O-NE 2.96Å; F559-R563 PolarHBondContact O-NH2 3.27Å; F559-R563 VanDerWaalsContact O-NH2 3.11Å
560	N	87.4	Confident	73.5	Confident	90 Å²	90	81.6 Å²	81.6	48%	0.481	45%	0.445	S	S	.	.	H	α-helix	trans	-76.2	-33.4	169.4	-81.9	-71.8	0	0	0	112.6	D556 A557 W558 R563 K564	D556-N560 WeakPolarHBondContact O-CB 3.45Å; D556-N560 PolarHBondContact O-N 3.17Å; D556-N560 PolarHBondContact O-ND2 2.69Å; A557-N560 CarbonylContact O-C 3.59Å; A557-N560 WeakPolarHBondContact O-CA 3.45Å; A557-N560 WeakPolarHBondContact O-CB 3.44Å; A557-N560 PolarHBondContact O-N 3.03Å; A557-N560 VanDerWaalsContact O-N 3.11Å; W558-N560 PolarHBondContact O-N 3.41Å; N560-R563 PolarHBondContact OD1-NH2 2.77Å; N560-K564 WeakPolarHBondContact O-CB 3.44Å; N560-K564 PolarHBondContact O-N 2.94Å; N560-K564 VanDerWaalsContact O-N 3.09Å
561	E	85.7	Confident	70.9	Confident	118 Å²	118	86.3 Å²	86.3	55%	0.551	48%	0.479	S	S	*	.	H	α-helix	trans	-73.9	-46.7	179.8	-173.4	164.1	-125.9	0	0	112.2	A557 W558 R563 K564 V565	A557-E561 WeakPolarHBondContact O-CB 3.26Å; A557-E561 PolarHBondContact O-N 2.73Å; W558-E561 CarbonylContact O-C 3.37Å; W558-E561 WeakPolarHBondContact O-CB 3.3Å; W558-E561 PolarHBondContact O-N 3.24Å; E561-R563 VanDerWaalsContact C-N 3.26Å; E561-R563 PolarHBondContact O-N 2.66Å; E561-K564 WeakPolarHBondContact O-CA 3.29Å; E561-K564 WeakPolarHBondContact O-CB 3.27Å; E561-K564 PolarHBondContact O-N 3.41Å; E561-V565 PolarHBondContact O-N 3.41Å; E561-V565 VanDerWaalsContact O-N 3.09Å
562	R	82.6	Confident	68.2	Low	88 Å²	88	88 Å²	88	33%	0.332	49%	0.494	S	S	.	.	H	α-helix	trans	-61.7	-32.9	174	-157.1	70.3	168.9	132.1	-13.8	111.9	E527 F530 W558	E527-R562 IonicContact OE1-CZ 2.63Å; E527-R562 IonicContact OE1-NE 2.85Å; E527-R562 PolarHBondContact OE1-NE 2.89Å; E527-R562 IonicContact OE1-NH2 3.8Å; E527-R562 PolarHBondContact OE1-NH2 2.66Å; E527-R562 IonicContact OE2-CZ 3.55Å; E527-R562 IonicContact OE2-NE 3.19Å; E527-R562 IonicContact OE2-NH2 3.53Å; E527-R562 PolarHBondContact OE2-NH2 2.59Å; F530-R562 HydrophobicContact CD1-CG 3.97Å; F530-R562 HydrophobicContact CD2-CB 4.11Å; F530-R562 HydrophobicContact CD2-CG 4.04Å; F530-R562 HydrophobicContact CE1-CG 3.74Å; F530-R562 HydrophobicContact CE2-CB 3.71Å; F530-R562 HydrophobicContact CE2-CG 3.82Å; F530-R562 HydrophobicContact CG-CG 4.12Å; F530-R562 HydrophobicContact CZ-CB 3.93Å; F530-R562 HydrophobicContact CZ-CG 3.66Å; W558-R562 HydrophobicContact CH2-CB 4.36Å; W558-R562 HydrophobicContact CH2-CG 4.12Å; W558-R562 HydrophobicContact CZ2-CB 4.33Å; W558-R562 HydrophobicContact CZ2-CG 4.09Å; W558-R562 PolarHBondContact O-N 3.02Å
563	R	83	Confident	66	Low	85 Å²	85	90.4 Å²	90.4	32%	0.321	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-8.9	168.4	-76.4	-179.5	-66.1	129.1	11.5	114.9	F530 S534 M535 F559 N560 E561	F530-R563 HydrophobicContact CE2-CG 3.9Å; F530-R563 HydrophobicContact CZ-CG 4.03Å; S534-R563 VanDerWaalsContact O-CD 3.32Å; S534-R563 WeakPolarHBondContact O-CD 3.46Å; S534-R563 PolarHBondContact O-NE 2.83Å; M535-R563 PolarHBondContact SD-NH1 3.31Å; F559-R563 WeakPolarHBondContact O-CG 3.38Å; F559-R563 PolarHBondContact O-NE 2.96Å; F559-R563 PolarHBondContact O-NH2 3.27Å; F559-R563 VanDerWaalsContact O-NH2 3.11Å; N560-R563 PolarHBondContact OD1-NH2 2.77Å; E561-R563 VanDerWaalsContact C-N 3.26Å; E561-R563 PolarHBondContact O-N 2.66Å
564	K	73.3	Confident	63.3	Low	174 Å²	174	89.2 Å²	89.2	76%	0.757	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-33.9	176.5	-161.5	81.2	170.6	-156.1	0	111.5	N560 E561 P566	N560-K564 WeakPolarHBondContact O-CB 3.44Å; N560-K564 PolarHBondContact O-N 2.94Å; N560-K564 VanDerWaalsContact O-N 3.09Å; E561-K564 WeakPolarHBondContact O-CA 3.29Å; E561-K564 WeakPolarHBondContact O-CB 3.27Å; E561-K564 PolarHBondContact O-N 3.41Å; K564-P566 WeakPolarHBondContact O-CD 3.35Å
565	V	66.7	Low	60.5	Low	75 Å²	75	91.4 Å²	91.4	46%	0.455	54%	0.544	S	S	.	.	S	Bend	trans	-69.2	120.9	172.9	179.7	0	0	0	0	108.5	E561	E561-V565 PolarHBondContact O-N 3.41Å; E561-V565 VanDerWaalsContact O-N 3.09Å
566	P	42	Very low	57.9	Low	101 Å²	101	96.1 Å²	96.1	66%	0.656	58%	0.577	S	S	*	*			trans	-64.8	146.7	171.4	-18.7	32.8	0	0	0	110.6	K564 A568	K564-P566 WeakPolarHBondContact O-CD 3.35Å; P566-A568 PolarHBondContact O-N 3.02Å
567	A	44.1	Very low	55.1	Low	107 Å²	107	102.2 Å²	102.2	88%	0.884	60%	0.604	S	S	*	*	S	Bend	trans	-71.3	76.6	177.8	0	0	0	0	0	111.4
568	A	36.8	Very low	52.3	Low	90 Å²	90	103 Å²	103	74%	0.744	62%	0.618	S	S	*	*			trans	-139.3	37	-174.9	0	0	0	0	0	111.6	P566	P566-A568 PolarHBondContact O-N 3.02Å
569	S	36.4	Very low	49.5	Very low	85 Å²	85	106.7 Å²	106.7	59%	0.594	65%	0.652	S	S	*	*	S	Bend	trans	-157.5	46.1	177.8	68.7	0	0	0	0	112.5
570	T	35.2	Very low	46.6	Very low	131 Å²	131	111.8 Å²	111.8	80%	0.804	69%	0.688	S	S	*	*			trans	-136.2	36.7	172.1	60	0	0	0	0	111.1
571	S	30.2	Very low	43.9	Very low	112 Å²	112	113.1 Å²	113.1	78%	0.783	70%	0.704	S	S	*	*			trans	-88.4	97.4	169.3	52.7	0	0	0	0	108.8
572	S	30	Very low	41.2	Very low	114 Å²	114	112.2 Å²	112.2	80%	0.797	71%	0.711	S	S	*	*			trans	-65.3	134.2	170.4	-165.3	0	0	0	0	109.6
573	P	39.5	Very low	38.9	Very low	108 Å²	108	119.2 Å²	119.2	70%	0.701	74%	0.737	S	S	*	*			trans	-76.9	142.4	168.6	32.1	-32.4	0	0	0	111
574	E	26.5	Very low	36.4	Very low	187 Å²	187	124.9 Å²	124.9	87%	0.874	76%	0.764	S	S	*	*			trans	59.5	100.2	137.8	-147.4	163	118.4	0	0	120.3
575	S	28.6	Very low	34.1	Very low	124 Å²	124	120.1 Å²	120.1	87%	0.867	77%	0.765	S	S	*	*				-141.2	139.3	117.3	-170.2	0	0	0	0	109
576	S	34.7	Very low	32.4	Very low	99 Å²	99	121.5 Å²	121.5	69%	0.692	78%	0.778	S	S	*	*			trans	-101	-164.9	173.2	-164.9	0	0	0	0	110.1
577	E	30	Very low	31.9	Very low	183 Å²	183	125.5 Å²	125.5	86%	0.855	79%	0.788	S	S	*	*			trans	72.5	123.9	-176	-46.8	-70.2	100.6	0	0	113.5
578	G	28.6	Very low	31.2	Very low	73 Å²	73	126.7 Å²	126.7	75%	0.753	78%	0.784	S	S	*	*			cis	-178.5	167	-7.4	0	0	0	0	0	114
579	A	29.6	Very low	31.6	Very low	95 Å²	95	127.8 Å²	127.8	79%	0.785	78%	0.784	S	S	*	*			trans	51.5	100.2	154.9	0	0	0	0	0	123.3
580	S	27.8	Very low	31.8	Very low	109 Å²	109	129.7 Å²	129.7	76%	0.762	79%	0.794	S	S	*	*				90.8	149.4	115.1	82.2	0	0	0	0	123.7
581	S	31.7	Very low	31.4	Very low	118 Å²	118	127.4 Å²	127.4	83%	0.825	80%	0.796	S	S	*	*			trans	74.1	158.3	161.9	83.3	0	0	0	0	119.2
582	S	28.6	Very low	31.3	Very low	99 Å²	99	125.8 Å²	125.8	69%	0.692	80%	0.798	S	S	*	*			cis	-169	157.6	-41.2	-167.8	0	0	0	0	110.5
583	R	32.8	Very low	31.4	Very low	234 Å²	234	132.8 Å²	132.8	88%	0.883	81%	0.806	S	S	*	*			trans	70.2	166.6	168.8	-47.1	172.8	-176.4	-178.4	0.1	116.9
584	K	30.6	Very low	31	Very low	204 Å²	204	133 Å²	133	89%	0.887	81%	0.81	S	S	*	*			cis	-171.5	124.3	-47.2	178.2	176.9	178.1	-179	0	110
585	G	26.6	Very low	31.2	Very low	75 Å²	75	132.8 Å²	132.8	77%	0.773	81%	0.807	S	S	*	*			trans	73.9	175.4	167	0	0	0	0	0	115.9
586	S	29.5	Very low	31.3	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	80%	0.798	S	S	*	*			cis	-161.8	138.2	-12.6	-167.7	0	0	0	0	112
587	Q	31.7	Very low	31	Very low	186 Å²	186	136.2 Å²	136.2	87%	0.869	80%	0.802	S	S	*	*			trans	58.9	179.9	157	-71.7	174.6	-7.7	0	0	119.5
588	T	29.9	Very low	30.8	Very low	132 Å²	132	133.2 Å²	133.2	81%	0.81	80%	0.802	S	S	*	*			trans	-141.8	-165.5	-161.8	55.1	0	0	0	0	109.6
589	P	45.8	Very low	31	Very low	113 Å²	113	133.8 Å²	133.8	73%	0.734	81%	0.807	S	S	*	*				-107.4	-134.5	-64.5	39.1	-23	0	0	0	107.5
590	P	40.6	Very low	30.8	Very low	125 Å²	125	132.9 Å²	132.9	81%	0.812	81%	0.807	S	S	*	*			cis	-121.1	-179.3	-35.1	39.7	-25	0	0	0	113
591	G	25.9	Very low	31.1	Very low	82 Å²	82	131.4 Å²	131.4	85%	0.845	81%	0.809	S	S	*	*			trans	156.5	109.2	165.2	0	0	0	0	0	113.9
592	G	29.1	Very low	31.1	Very low	79 Å²	79	131.2 Å²	131.2	81%	0.814	81%	0.807	S	S	*	*			trans	-98.4	161.3	-177.7	0	0	0	0	0	114.3
593	R	30.4	Very low	31.5	Very low	260 Å²	260	129.8 Å²	129.8	98%	0.981	80%	0.797	S	S	*	*			trans	-152.5	157.1	161.7	-122.6	174.4	176.4	-163.3	-3.4	112.8
594	S	31.6	Very low	32.1	Very low	112 Å²	112	127.7 Å²	127.7	78%	0.783	79%	0.794	S	S	*	*			trans	-100.9	140.6	-165.8	172.6	0	0	0	0	114
595	K	31.6	Very low	32.7	Very low	184 Å²	184	125.1 Å²	125.1	80%	0.8	78%	0.783	S	S	*	*			trans	170.4	160.8	144.1	-96.8	170	176.1	-177.7	0	109
596	Q	29.5	Very low	33.7	Very low	145 Å²	145	125 Å²	125	68%	0.678	76%	0.764	S	S	*	*			cis	178.2	137.4	-27	164.5	-177.2	-64.2	0	0	107.9
597	L	28.3	Very low	34.6	Very low	149 Å²	149	124.6 Å²	124.6	78%	0.78	75%	0.754	S	S	*	*			trans	69.2	157.2	163.7	-77.5	170.9	0	0	0	121.5
598	S	26.9	Very low	35	Very low	121 Å²	121	123.5 Å²	123.5	85%	0.846	75%	0.746	S	S	*	*			trans	77.6	137.7	158.5	-63.5	0	0	0	0	118.8
599	G	32	Very low	35.4	Very low	84 Å²	84	123.5 Å²	123.5	87%	0.866	74%	0.737	S	S	*	*			trans	-105.9	163	-173	0	0	0	0	0	114.5
600	G	26.2	Very low	35.7	Very low	76 Å²	76	122.8 Å²	122.8	78%	0.784	72%	0.722	S	S	*	*			trans	-126.6	146.8	172.1	0	0	0	0	0	111.1	C602	G600-C602 PolarHBondContact O-N 2.85Å
601	G	34	Very low	36.4	Very low	79 Å²	79	120.6 Å²	120.6	81%	0.814	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-69.8	128.4	-171.8	0	0	0	0	0	114.1	S603	G601-S603 PolarHBondContact O-N 2.81Å
602	C	31.6	Very low	38.1	Very low	114 Å²	114	123.7 Å²	123.7	77%	0.77	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-61.3	133.7	173.4	-176.7	0	0	0	0	111.5	G600	G600-C602 PolarHBondContact O-N 2.85Å
603	S	35.9	Very low	40.5	Very low	69 Å²	69	122.2 Å²	122.2	48%	0.483	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-67.9	132.5	-170.2	-95.4	0	0	0	0	113.7	G601 K605 D606	G601-S603 PolarHBondContact O-N 2.81Å; S603-K605 PolarHBondContact O-N 2.94Å; S603-K605 VanDerWaalsContact O-N 3.12Å; S603-D606 WeakPolarHBondContact CB-OD2 3.19Å; S603-D606 PolarHBondContact O-N 2.94Å
604	K	47.1	Very low	43.3	Very low	190 Å²	190	112.4 Å²	112.4	83%	0.826	64%	0.64	S	S	*	*	H	α-helix	trans	-66	-8.7	172.2	-69.3	176.4	-179.5	168.9	0	113.6
605	K	42.7	Very low	45.8	Very low	149 Å²	149	112.6 Å²	112.6	65%	0.648	64%	0.639	S	S	*	*	H	α-helix	trans	-70.7	-52.5	174.6	-73.8	-178.5	177.4	175.3	0	110.7	S603 L607 K608 E609	S603-K605 PolarHBondContact O-N 2.94Å; S603-K605 VanDerWaalsContact O-N 3.12Å; K605-L607 VanDerWaalsContact C-N 3.3Å; K605-L607 PolarHBondContact O-N 2.87Å; K605-K608 WeakPolarHBondContact O-CA 3.28Å; K605-K608 WeakPolarHBondContact O-CB 3.45Å; K605-K608 PolarHBondContact O-N 3.32Å; K605-E609 PolarHBondContact O-N 2.96Å
606	D	47.2	Very low	48.4	Very low	72 Å²	72	110.8 Å²	110.8	39%	0.385	63%	0.633	S	S	.	*	H	α-helix	trans	-55	-44.1	-179.1	-57.7	-105.5	0	0	0	112.6	S603 K608 E609 K610	S603-D606 WeakPolarHBondContact CB-OD2 3.19Å; S603-D606 PolarHBondContact O-N 2.94Å; D606-K608 PolarHBondContact O-N 3.25Å; D606-K608 VanDerWaalsContact O-N 3.16Å; D606-E609 PolarHBondContact O-N 3.48Å; D606-E609 VanDerWaalsContact O-N 3.14Å; D606-K610 HydrophobicContact CB-CD 4.41Å; D606-K610 WeakPolarHBondContact O-CB 3.05Å; D606-K610 WeakPolarHBondContact O-CD 3.43Å; D606-K610 VanDerWaalsContact O-CG 3.23Å; D606-K610 WeakPolarHBondContact O-CG 3.44Å; D606-K610 PolarHBondContact O-N 2.93Å
607	L	47.6	Very low	51.4	Low	96 Å²	96	105.6 Å²	105.6	50%	0.503	61%	0.609	S	S	.	*	H	α-helix	trans	-56.2	-31.8	177.6	-143.4	75	0	0	0	112.4	K605 S611 Y649	K605-L607 VanDerWaalsContact C-N 3.3Å; K605-L607 PolarHBondContact O-N 2.87Å; L607-S611 PolarHBondContact O-N 2.98Å; L607-S611 PolarHBondContact O-OG 2.92Å; L607-Y649 WeakPolarHBondContact CD1-OH 3.49Å; L607-Y649 VanDerWaalsContact CG-OH 3.29Å; L607-Y649 WeakPolarHBondContact CG-OH 3.29Å
608	K	40.4	Very low	54.4	Low	163 Å²	163	101 Å²	101	71%	0.709	59%	0.585	S	S	*	*	H	α-helix	trans	-87.8	-19.1	-177.2	-164.2	166.5	-174.9	170.7	0	113.5	K605 D606	K605-K608 WeakPolarHBondContact O-CA 3.28Å; K605-K608 WeakPolarHBondContact O-CB 3.45Å; K605-K608 PolarHBondContact O-N 3.32Å; D606-K608 PolarHBondContact O-N 3.25Å; D606-K608 VanDerWaalsContact O-N 3.16Å
609	E	39.2	Very low	57.5	Low	132 Å²	132	98 Å²	98	62%	0.617	56%	0.557	S	S	*	*	H	α-helix	trans	-88	-39.6	170.1	-59.4	-141.8	97.6	0	0	111.3	K605 D606 S611 K612	K605-E609 PolarHBondContact O-N 2.96Å; D606-E609 PolarHBondContact O-N 3.48Å; D606-E609 VanDerWaalsContact O-N 3.14Å; E609-S611 PolarHBondContact O-N 3.31Å; E609-K612 PolarHBondContact O-N 3.39Å; E609-K612 IonicContact OE1-NZ 3.05Å
610	K	50.9	Low	60.4	Low	97 Å²	97	95.4 Å²	95.4	42%	0.422	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-16.9	167.9	-67.4	163.5	-173.2	173.1	0	113.4	D606 K612	D606-K610 HydrophobicContact CB-CD 4.41Å; D606-K610 WeakPolarHBondContact O-CB 3.05Å; D606-K610 WeakPolarHBondContact O-CD 3.43Å; D606-K610 VanDerWaalsContact O-CG 3.23Å; D606-K610 WeakPolarHBondContact O-CG 3.44Å; D606-K610 PolarHBondContact O-N 2.93Å; K610-K612 VanDerWaalsContact C-N 3.3Å; K610-K612 PolarHBondContact O-N 2.87Å
611	S	55.3	Low	63.7	Low	79 Å²	79	91.8 Å²	91.8	55%	0.552	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-19.3	171.6	-62.6	0	0	0	0	114	L607 E609 K613	L607-S611 PolarHBondContact O-N 2.98Å; L607-S611 PolarHBondContact O-OG 2.92Å; E609-S611 PolarHBondContact O-N 3.31Å; S611-K613 PolarHBondContact O-N 3.34Å
612	K	62.8	Low	66.5	Low	147 Å²	147	90 Å²	90	64%	0.639	46%	0.456	S	S	*	.	S	Bend	trans	-92.7	74.4	176	-60.9	174.2	-166.2	151.8	0	110.2	E609 K610 T614	E609-K612 PolarHBondContact O-N 3.39Å; E609-K612 IonicContact OE1-NZ 3.05Å; K610-K612 VanDerWaalsContact C-N 3.3Å; K610-K612 PolarHBondContact O-N 2.87Å; K612-T614 PolarHBondContact O-N 3.24Å
613	K	79.9	Confident	69.4	Low	49 Å²	49	86.5 Å²	86.5	21%	0.213	43%	0.433	C	S	.	.			trans	-50.2	132.7	171.5	-65.1	-178.6	165.8	68.8	0	109.9	S611 Q617 L618 L621 L645	S611-K613 PolarHBondContact O-N 3.34Å; K613-Q617 HydrophobicContact CB-CB 4.49Å; K613-L618 HydrophobicContact CB-CD1 4.26Å; K613-L618 HydrophobicContact CB-CD2 4.03Å; K613-L618 HydrophobicContact CB-CG 3.78Å; K613-L618 HydrophobicContact CD-CD2 3.66Å; K613-L618 HydrophobicContact CD-CG 4.32Å; K613-L621 HydrophobicContact CD-CD1 3.86Å; K613-L645 HydrophobicContact CD-CD1 4.3Å; K613-L645 HydrophobicContact CG-CD1 4.13Å
614	T	88	Confident	72.1	Confident	54 Å²	54	83.3 Å²	83.3	33%	0.331	41%	0.41	S	S	.	.			trans	-66.9	160.4	176.6	72.5	0	0	0	0	110.6	K612 E616 Q617 L618	K612-T614 PolarHBondContact O-N 3.24Å; T614-E616 PolarHBondContact O-N 3.43Å; T614-Q617 PolarHBondContact O-N 3.15Å; T614-Q617 WeakPolarHBondContact OG1-CB 3.46Å; T614-Q617 VanDerWaalsContact OG1-CG 3.24Å; T614-Q617 WeakPolarHBondContact OG1-CG 3.24Å; T614-Q617 PolarHBondContact OG1-N 3.2Å; T614-L618 WeakPolarHBondContact O-CB 3.41Å; T614-L618 WeakPolarHBondContact O-CG 3.12Å; T614-L618 PolarHBondContact O-N 3.03Å
615	P	84.3	Confident	74.3	Confident	115 Å²	115	74.2 Å²	74.2	75%	0.747	37%	0.371	S	S	*	.	H	α-helix	trans	-58.1	-32.1	175.3	-24.7	35.5	0	0	0	113.1	H619	P615-H619 PolarHBondContact O-N 2.58Å
616	E	86.3	Confident	76.7	Confident	146 Å²	146	69 Å²	69	68%	0.682	35%	0.351	S	S	*	.	H	α-helix	trans	-73	-49.3	178.4	177.9	174.4	-134.5	0	0	112	T614 L618 H619 I620	T614-E616 PolarHBondContact O-N 3.43Å; E616-L618 PolarHBondContact O-N 2.89Å; E616-H619 WeakPolarHBondContact O-CA 3.37Å; E616-H619 WeakPolarHBondContact O-CB 3.46Å; E616-H619 PolarHBondContact O-N 2.91Å; E616-I620 WeakPolarHBondContact O-CG1 3.39Å; E616-I620 PolarHBondContact O-N 3.23Å
617	Q	92.1	Very high	78.8	Confident	36 Å²	36	73.6 Å²	73.6	17%	0.168	36%	0.363	C	S	.	.	H	α-helix	trans	-55.7	-39.9	169.1	-74.2	174.2	-23.3	0	0	111.9	K613 T614 H619 L621 S643 L645	K613-Q617 HydrophobicContact CB-CB 4.49Å; T614-Q617 PolarHBondContact O-N 3.15Å; T614-Q617 WeakPolarHBondContact OG1-CB 3.46Å; T614-Q617 VanDerWaalsContact OG1-CG 3.24Å; T614-Q617 WeakPolarHBondContact OG1-CG 3.24Å; T614-Q617 PolarHBondContact OG1-N 3.2Å; Q617-H619 VanDerWaalsContact C-N 3.33Å; Q617-L621 WeakPolarHBondContact O-CB 3.38Å; Q617-L621 WeakPolarHBondContact O-CG 3.37Å; Q617-L621 PolarHBondContact O-N 3.22Å; Q617-L621 VanDerWaalsContact O-N 3.1Å; Q617-S643 VanDerWaalsContact CG-O 3.25Å; Q617-S643 WeakPolarHBondContact CG-O 3.48Å; Q617-S643 PolarHBondContact NE2-O 3.02Å; Q617-L645 HydrophobicContact CB-CD1 4.11Å; Q617-L645 HydrophobicContact CG-CD1 4.3Å; Q617-L645 HydrophobicContact CG-CG 4.29Å
618	L	92.1	Very high	80.8	Confident	53 Å²	53	70.7 Å²	70.7	28%	0.277	35%	0.349	S	S	.	.	H	α-helix	trans	-69.4	-28.1	173.9	-74.7	169.1	0	0	0	112.9	K613 T614 E616 K622	K613-L618 HydrophobicContact CB-CD1 4.26Å; K613-L618 HydrophobicContact CB-CD2 4.03Å; K613-L618 HydrophobicContact CB-CG 3.78Å; K613-L618 HydrophobicContact CD-CD2 3.66Å; K613-L618 HydrophobicContact CD-CG 4.32Å; T614-L618 WeakPolarHBondContact O-CB 3.41Å; T614-L618 WeakPolarHBondContact O-CG 3.12Å; T614-L618 PolarHBondContact O-N 3.03Å; E616-L618 PolarHBondContact O-N 2.89Å; L618-K622 VanDerWaalsContact O-CB 3.23Å; L618-K622 WeakPolarHBondContact O-CB 3.39Å; L618-K622 VanDerWaalsContact O-CD 3.27Å; L618-K622 WeakPolarHBondContact O-CD 3.1Å; L618-K622 WeakPolarHBondContact O-CG 3.42Å; L618-K622 PolarHBondContact O-N 3.42Å
619	H	92.1	Very high	83.3	Confident	57 Å²	57	65.1 Å²	65.1	26%	0.264	33%	0.326	S	S	.	.	H	α-helix	trans	-71.2	-50.5	175.4	179.8	71.5	0	0	0	110.8	P615 E616 Q617 L621 K622 S623 Y672	P615-H619 PolarHBondContact O-N 2.58Å; E616-H619 WeakPolarHBondContact O-CA 3.37Å; E616-H619 WeakPolarHBondContact O-CB 3.46Å; E616-H619 PolarHBondContact O-N 2.91Å; Q617-H619 VanDerWaalsContact C-N 3.33Å; H619-L621 PolarHBondContact O-N 3.48Å; H619-K622 PolarHBondContact O-N 3.15Å; H619-K622 VanDerWaalsContact O-N 3.09Å; H619-S623 PolarHBondContact O-N 3.09Å; H619-S623 PolarHBondContact O-OG 3.44Å; H619-Y672 AromaticContact CE1-CE1 4Å; H619-Y672 AromaticContact ND1-CE1 3.49Å; H619-Y672 WeakPolarHBondContact ND1-CE1 3.28Å; H619-Y672 AromaticContact ND1-CZ 3.67Å; H619-Y672 PolarHBondContact ND1-OH 3.32Å; H619-Y672 VanDerWaalsContact ND1-OH 3.12Å
620	I	93.7	Very high	85.7	Confident	31 Å²	31	66.7 Å²	66.7	16%	0.159	33%	0.326	C	S	.	.	H	α-helix	trans	-54.9	-50.6	176.7	-64.8	164.5	0	0	0	111	E616 K622 S623 A624 L639 E642	E616-I620 WeakPolarHBondContact O-CG1 3.39Å; E616-I620 PolarHBondContact O-N 3.23Å; I620-K622 VanDerWaalsContact C-N 3.3Å; I620-K622 PolarHBondContact O-N 2.86Å; I620-S623 PolarHBondContact O-OG 3.23Å; I620-S623 VanDerWaalsContact O-OG 3.04Å; I620-A624 VanDerWaalsContact O-CB 3.26Å; I620-A624 WeakPolarHBondContact O-CB 3.48Å; I620-A624 PolarHBondContact O-N 2.85Å; I620-L639 HydrophobicContact CG2-CD2 3.85Å; I620-E642 HydrophobicContact CD1-CB 4.47Å; I620-E642 WeakPolarHBondContact CD1-O 3.45Å; I620-E642 HydrophobicContact CG2-CB 3.96Å
621	L	94.3	Very high	87.8	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.6	-36.3	177.9	-72.7	175	0	0	0	112.9	K613 Q617 H619 F625 L645 I650 W653 F654	K613-L621 HydrophobicContact CD-CD1 3.86Å; Q617-L621 WeakPolarHBondContact O-CB 3.38Å; Q617-L621 WeakPolarHBondContact O-CG 3.37Å; Q617-L621 PolarHBondContact O-N 3.22Å; Q617-L621 VanDerWaalsContact O-N 3.1Å; H619-L621 PolarHBondContact O-N 3.48Å; L621-F625 VanDerWaalsContact O-CB 3.27Å; L621-F625 WeakPolarHBondContact O-CB 3.33Å; L621-F625 PolarHBondContact O-N 3.49Å; L621-L645 HydrophobicContact CD1-CD1 3.83Å; L621-I650 HydrophobicContact CD2-CB 4.37Å; L621-I650 HydrophobicContact CD2-CD1 4.38Å; L621-I650 HydrophobicContact CD2-CG1 4.14Å; L621-I650 HydrophobicContact CD2-CG2 3.7Å; L621-W653 HydrophobicContact CB-CD2 4.26Å; L621-W653 HydrophobicContact CB-CE3 3.88Å; L621-W653 HydrophobicContact CB-CH2 3.74Å; L621-W653 HydrophobicContact CB-CZ2 4.1Å; L621-W653 HydrophobicContact CB-CZ3 3.63Å; L621-W653 HydrophobicContact CD1-CD2 4.03Å; L621-W653 HydrophobicContact CD1-CE3 4.23Å; L621-W653 HydrophobicContact CD1-CG 4.32Å; L621-W653 HydrophobicContact CD2-CE3 4.1Å; L621-W653 HydrophobicContact CD2-CZ3 4.44Å; L621-W653 HydrophobicContact CG-CE3 4.31Å; L621-W653 VanDerWaalsContact O-CH2 3.3Å; L621-W653 WeakPolarHBondContact O-CH2 3.39Å; L621-W653 VanDerWaalsContact O-CZ3 3.24Å; L621-W653 WeakPolarHBondContact O-CZ3 3.38Å; L621-F654 HydrophobicContact CD2-CE2 3.99Å
622	K	93.1	Very high	89.6	Confident	42 Å²	42	61.7 Å²	61.7	18%	0.183	30%	0.301	C	S	.	.	H	α-helix	trans	-78	-39.9	-179.5	-75.2	176.2	178	-177.1	0	113.6	L618 H619 I620 A624 F625 V626 W653 W668 Y672	L618-K622 VanDerWaalsContact O-CB 3.23Å; L618-K622 WeakPolarHBondContact O-CB 3.39Å; L618-K622 VanDerWaalsContact O-CD 3.27Å; L618-K622 WeakPolarHBondContact O-CD 3.1Å; L618-K622 WeakPolarHBondContact O-CG 3.42Å; L618-K622 PolarHBondContact O-N 3.42Å; H619-K622 PolarHBondContact O-N 3.15Å; H619-K622 VanDerWaalsContact O-N 3.09Å; I620-K622 VanDerWaalsContact C-N 3.3Å; I620-K622 PolarHBondContact O-N 2.86Å; K622-A624 VanDerWaalsContact C-N 3.35Å; K622-F625 PolarHBondContact O-N 2.9Å; K622-V626 WeakPolarHBondContact O-CG2 3.24Å; K622-V626 PolarHBondContact O-N 2.82Å; K622-V626 VanDerWaalsContact O-N 3.11Å; K622-W653 HydrophobicContact CG-CH2 4.2Å; K622-W653 HydrophobicContact CG-CZ2 4.16Å; K622-W668 HydrophobicContact CB-CE3 3.91Å; K622-W668 HydrophobicContact CB-CH2 4Å; K622-W668 HydrophobicContact CB-CZ3 3.55Å; K622-W668 HydrophobicContact CD-CD2 3.77Å; K622-W668 HydrophobicContact CD-CE3 3.69Å; K622-W668 HydrophobicContact CD-CG 4.31Å; K622-W668 HydrophobicContact CD-CZ3 4.1Å; K622-W668 HydrophobicContact CG-CD2 3.94Å; K622-W668 HydrophobicContact CG-CE3 3.62Å; K622-W668 HydrophobicContact CG-CH2 3.61Å; K622-W668 HydrophobicContact CG-CZ2 3.84Å; K622-W668 HydrophobicContact CG-CZ3 3.48Å; K622-W668 VanDerWaalsContact CG-CZ3 3.48Å; K622-Y672 HydrophobicContact CB-CD1 3.67Å; K622-Y672 HydrophobicContact CB-CE1 3.36Å; K622-Y672 HydrophobicContact CB-CE2 4.46Å; K622-Y672 HydrophobicContact CB-CG 4.37Å; K622-Y672 HydrophobicContact CD-CE1 4.12Å; K622-Y672 HydrophobicContact CD-CE2 3.91Å; K622-Y672 HydrophobicContact CG-CE1 4.42Å
623	S	91.5	Very high	91	Very high	40 Å²	40	58.2 Å²	58.2	28%	0.28	29%	0.293	S	S	.	.	H	α-helix	trans	-64	-45.3	174.8	59	0	0	0	0	109.6	H619 I620 F625 V626 R627	H619-S623 PolarHBondContact O-N 3.09Å; H619-S623 PolarHBondContact O-OG 3.44Å; I620-S623 PolarHBondContact O-OG 3.23Å; I620-S623 VanDerWaalsContact O-OG 3.04Å; S623-F625 PolarHBondContact O-N 3.1Å; S623-V626 PolarHBondContact O-N 3.36Å; S623-V626 VanDerWaalsContact O-N 3.15Å; S623-R627 WeakPolarHBondContact O-CG 3.31Å; S623-R627 PolarHBondContact O-N 2.98Å
624	A	93	Very high	91.7	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.008	31%	0.311	C	S	.	.	H	α-helix	trans	-57.8	-46.8	172.8	0	0	0	0	0	112.8	I620 K622 V626 R627 T628 L639 F654	I620-A624 VanDerWaalsContact O-CB 3.26Å; I620-A624 WeakPolarHBondContact O-CB 3.48Å; I620-A624 PolarHBondContact O-N 2.85Å; K622-A624 VanDerWaalsContact C-N 3.35Å; A624-V626 PolarHBondContact O-N 3.43Å; A624-R627 PolarHBondContact O-N 3.48Å; A624-R627 VanDerWaalsContact O-N 3.08Å; A624-T628 PolarHBondContact O-N 3.32Å; A624-T628 VanDerWaalsContact O-O 3.11Å; A624-L639 HydrophobicContact CB-CD1 3.84Å; A624-L639 HydrophobicContact CB-CD2 3.51Å; A624-L639 HydrophobicContact CB-CG 4.32Å; A624-F654 HydrophobicContact CB-CZ 4.08Å
625	F	94.2	Very high	91.9	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-61.9	-26.3	177.4	-171.6	-85.3	0	0	0	113.9	L621 K622 S623 T628 Q629 W653 F654 R658 W661 L666 W668 F669	L621-F625 VanDerWaalsContact O-CB 3.27Å; L621-F625 WeakPolarHBondContact O-CB 3.33Å; L621-F625 PolarHBondContact O-N 3.49Å; K622-F625 PolarHBondContact O-N 2.9Å; S623-F625 PolarHBondContact O-N 3.1Å; F625-T628 CarbonylContact C-O 3.58Å; F625-T628 WeakPolarHBondContact CA-O 3.41Å; F625-T628 CarbonylContact O-C 3.6Å; F625-Q629 HydrophobicContact CD1-CG 4.42Å; F625-Q629 HydrophobicContact CE1-CG 3.97Å; F625-Q629 HydrophobicContact CE2-CB 4.44Å; F625-Q629 HydrophobicContact CE2-CG 4.41Å; F625-Q629 HydrophobicContact CZ-CB 4.38Å; F625-Q629 HydrophobicContact CZ-CG 3.95Å; F625-W653 HydrophobicContact CB-CH2 4.02Å; F625-W653 HydrophobicContact CB-CZ3 4Å; F625-W653 HydrophobicContact CD2-CZ3 4.15Å; F625-W653 HydrophobicContact CG-CH2 4.39Å; F625-W653 HydrophobicContact CG-CZ3 4.37Å; F625-F654 HydrophobicContact CB-CE1 3.94Å; F625-F654 HydrophobicContact CB-CZ 4.2Å; F625-F654 AromaticContact CD2-CD1 3.59Å; F625-F654 HydrophobicContact CD2-CD1 3.59Å; F625-F654 AromaticContact CD2-CE1 3.71Å; F625-F654 HydrophobicContact CD2-CE1 3.71Å; F625-F654 HydrophobicContact CD2-CG 4.34Å; F625-F654 HydrophobicContact CE2-CD1 4.25Å; F625-F654 HydrophobicContact CG-CE1 4.28Å; F625-R658 HydrophobicContact CE2-CG 3.93Å; F625-R658 HydrophobicContact CZ-CG 4.22Å; F625-W661 HydrophobicContact CZ-CB 4.35Å; F625-L666 HydrophobicContact CD1-CD2 4.19Å; F625-L666 HydrophobicContact CE1-CD2 3.52Å; F625-L666 HydrophobicContact CZ-CD2 4.06Å; F625-W668 HydrophobicContact CB-CH2 4.1Å; F625-W668 AromaticContact CD1-CH2 3.66Å; F625-W668 HydrophobicContact CD1-CH2 3.66Å; F625-W668 HydrophobicContact CD1-CZ3 4.38Å; F625-W668 HydrophobicContact CE1-CH2 4.41Å; F625-W668 HydrophobicContact CG-CH2 4.03Å; F625-F669 AromaticContact CD1-CD2 3.61Å; F625-F669 HydrophobicContact CD1-CD2 3.61Å; F625-F669 AromaticContact CD1-CE2 3.65Å; F625-F669 HydrophobicContact CD1-CE2 3.65Å; F625-F669 AromaticContact CE1-CD2 3.62Å; F625-F669 HydrophobicContact CE1-CD2 3.62Å; F625-F669 AromaticContact CE1-CE2 3.69Å; F625-F669 HydrophobicContact CE1-CE2 3.69Å
626	V	92.5	Very high	92.4	Very high	40 Å²	40	58.1 Å²	58.1	24%	0.242	28%	0.279	C	S	.	.	H	α-helix	trans	-82.6	-29.4	174.7	169	0	0	0	0	112.2	K622 S623 A624 W668 F669 Q673	K622-V626 WeakPolarHBondContact O-CG2 3.24Å; K622-V626 PolarHBondContact O-N 2.82Å; K622-V626 VanDerWaalsContact O-N 3.11Å; S623-V626 PolarHBondContact O-N 3.36Å; S623-V626 VanDerWaalsContact O-N 3.15Å; A624-V626 PolarHBondContact O-N 3.43Å; V626-W668 HydrophobicContact CG2-CZ3 4.18Å; V626-F669 HydrophobicContact CB-CE2 4.38Å; V626-F669 HydrophobicContact CG2-CD2 3.67Å; V626-F669 HydrophobicContact CG2-CE2 3.68Å; V626-F669 HydrophobicContact CG2-CG 4.18Å; V626-F669 HydrophobicContact CG2-CZ 4.2Å; V626-Q673 HydrophobicContact CG1-CB 4.07Å; V626-Q673 HydrophobicContact CG1-CG 4.44Å
627	R	91.4	Very high	92.7	Very high	168 Å²	168	54.6 Å²	54.6	63%	0.634	27%	0.265	S	S	*	.	H	α-helix	trans	-69.4	-48.3	168.6	-61.8	-172.5	-53.9	-149.4	3.3	111.5	S623 A624	S623-R627 WeakPolarHBondContact O-CG 3.31Å; S623-R627 PolarHBondContact O-N 2.98Å; A624-R627 PolarHBondContact O-N 3.48Å; A624-R627 VanDerWaalsContact O-N 3.08Å
628	T	90.5	Very high	92.8	Very high	34 Å²	34	57.5 Å²	57.5	21%	0.209	28%	0.278	C	S	.	.			trans	-146.1	131	179.4	175.7	0	0	0	0	111.1	A624 F625 W630 P631	A624-T628 PolarHBondContact O-N 3.32Å; A624-T628 VanDerWaalsContact O-O 3.11Å; F625-T628 CarbonylContact C-O 3.58Å; F625-T628 WeakPolarHBondContact CA-O 3.41Å; F625-T628 CarbonylContact O-C 3.6Å; T628-W630 VanDerWaalsContact C-N 3.28Å; T628-W630 PolarHBondContact OG1-N 3.06Å; T628-W630 VanDerWaalsContact OG1-N 3.08Å; T628-W630 PolarHBondContact OG1-O 3.47Å; T628-W630 VanDerWaalsContact OG1-O 3.12Å; T628-P631 HydrophobicContact CG2-CB 4.4Å; T628-P631 HydrophobicContact CG2-CG 4.13Å
629	Q	91.4	Very high	92.9	Very high	46 Å²	46	55.1 Å²	55.1	22%	0.215	27%	0.266	C	S	.	.	S	Bend	trans	-81.6	-11.2	171.6	-61.9	-167.2	1.5	0	0	112.5	F625 R658 W661	F625-Q629 HydrophobicContact CD1-CG 4.42Å; F625-Q629 HydrophobicContact CE1-CG 3.97Å; F625-Q629 HydrophobicContact CE2-CB 4.44Å; F625-Q629 HydrophobicContact CE2-CG 4.41Å; F625-Q629 HydrophobicContact CZ-CB 4.38Å; F625-Q629 HydrophobicContact CZ-CG 3.95Å; Q629-R658 HydrophobicContact CB-CG 4.37Å; Q629-R658 VanDerWaalsContact O-CD 3.32Å; Q629-R658 WeakPolarHBondContact O-CD 3.47Å; Q629-R658 PolarHBondContact O-NH1 2.96Å; Q629-W661 VanDerWaalsContact NE2-NE1 3.17Å
630	W	91.3	Very high	93	Very high	166 Å²	166	53.4 Å²	53.4	63%	0.629	26%	0.262	S	S	*	.	S	Bend	trans	-133.5	77	-178.9	-61.7	101.2	0	0	0	110	T628 R658	T628-W630 VanDerWaalsContact C-N 3.28Å; T628-W630 PolarHBondContact OG1-N 3.06Å; T628-W630 VanDerWaalsContact OG1-N 3.08Å; T628-W630 PolarHBondContact OG1-O 3.47Å; T628-W630 VanDerWaalsContact OG1-O 3.12Å; W630-R658 VanDerWaalsContact CE2-CD 3.43Å; W630-R658 VanDerWaalsContact CE3-CZ 3.44Å; W630-R658 VanDerWaalsContact CZ2-CD 3.49Å; W630-R658 VanDerWaalsContact CZ3-CZ 3.44Å; W630-R658 VanDerWaalsContact CZ3-NE 3.34Å
631	P	93.5	Very high	92.9	Very high	11 Å²	11	59.5 Å²	59.5	7%	0.071	29%	0.289	C	S	.	.			trans	-54.9	145.8	175.2	-24.3	30.3	0	0	0	112.7	T628 E635 Y636 L639 F654	T628-P631 HydrophobicContact CG2-CB 4.4Å; T628-P631 HydrophobicContact CG2-CG 4.13Å; P631-E635 WeakPolarHBondContact CA-OE2 3.44Å; P631-E635 HydrophobicContact CB-CB 3.76Å; P631-Y636 HydrophobicContact CB-CD1 4.05Å; P631-Y636 HydrophobicContact CB-CD2 4Å; P631-Y636 HydrophobicContact CB-CE1 3.94Å; P631-Y636 HydrophobicContact CB-CE2 3.88Å; P631-Y636 HydrophobicContact CB-CG 4.08Å; P631-Y636 HydrophobicContact CG-CD1 4.26Å; P631-Y636 HydrophobicContact CG-CE1 3.79Å; P631-Y636 HydrophobicContact CG-CE2 4.42Å; P631-Y636 WeakPolarHBondContact O-CE2 3.24Å; P631-L639 HydrophobicContact CG-CD1 4.37Å; P631-F654 VanDerWaalsContact CD-CD1 3.45Å; P631-F654 VanDerWaalsContact CD-CE1 3.48Å; P631-F654 HydrophobicContact CG-CD1 3.62Å; P631-F654 HydrophobicContact CG-CD2 4.48Å; P631-F654 HydrophobicContact CG-CE1 3.24Å; P631-F654 HydrophobicContact CG-CE2 4.18Å; P631-F654 HydrophobicContact CG-CG 4.24Å; P631-F654 HydrophobicContact CG-CZ 3.57Å
632	T	93.4	Very high	92.8	Very high	60 Å²	60	63.4 Å²	63.4	37%	0.368	31%	0.308	S	S	.	.			trans	-66.5	166.9	168.7	82.7	0	0	0	0	110.9	E634 E635 Y636	T632-E634 WeakPolarHBondContact CB-OE2 3.35Å; T632-E634 PolarHBondContact O-N 3.12Å; T632-E634 PolarHBondContact OG1-N 3.02Å; T632-E634 PolarHBondContact OG1-OE2 2.94Å; T632-E635 HydrophobicContact CG2-CG 4.41Å; T632-E635 PolarHBondContact N-OE2 3.19Å; T632-E635 PolarHBondContact O-N 2.73Å; T632-E635 PolarHBondContact OG1-N 2.58Å; T632-E635 VanDerWaalsContact OG1-N 3.15Å; T632-Y636 WeakPolarHBondContact O-CD2 3.5Å; T632-Y636 PolarHBondContact O-N 2.89Å
633	P	92.6	Very high	92.6	Very high	73 Å²	73	61.8 Å²	61.8	47%	0.474	30%	0.301	S	S	.	.	H	α-helix	trans	-51.8	-44.5	172.5	-25.4	35	0	0	0	112.2	Y636 D637 R647	P633-Y636 WeakPolarHBondContact O-CB 3.41Å; P633-Y636 PolarHBondContact O-N 3.14Å; P633-D637 PolarHBondContact O-N 3.05Å; P633-R647 PolarHBondContact O-NH2 3.25Å
634	E	93.4	Very high	92.6	Very high	126 Å²	126	62.6 Å²	62.6	59%	0.589	32%	0.316	S	S	*	.	H	α-helix	trans	-67.7	-42.6	-177.9	-52.5	67.9	-141.8	0	0	110.9	T632 Y636 D637 Q638	T632-E634 WeakPolarHBondContact CB-OE2 3.35Å; T632-E634 PolarHBondContact O-N 3.12Å; T632-E634 PolarHBondContact OG1-N 3.02Å; T632-E634 PolarHBondContact OG1-OE2 2.94Å; E634-Y636 VanDerWaalsContact C-N 3.29Å; E634-Y636 PolarHBondContact O-N 3.41Å; E634-D637 PolarHBondContact O-N 2.94Å; E634-Q638 PolarHBondContact O-N 2.84Å
635	E	92.3	Very high	92.5	Very high	66 Å²	66	63 Å²	63	31%	0.308	32%	0.318	S	S	.	.	H	α-helix	trans	-62.4	-34.3	173.3	-69.4	-176.1	116.9	0	0	112.2	P631 T632 D637 L639	P631-E635 WeakPolarHBondContact CA-OE2 3.44Å; P631-E635 HydrophobicContact CB-CB 3.76Å; T632-E635 HydrophobicContact CG2-CG 4.41Å; T632-E635 PolarHBondContact N-OE2 3.19Å; T632-E635 PolarHBondContact O-N 2.73Å; T632-E635 PolarHBondContact OG1-N 2.58Å; T632-E635 VanDerWaalsContact OG1-N 3.15Å; E635-D637 VanDerWaalsContact C-N 3.32Å; E635-D637 PolarHBondContact O-N 3.2Å; E635-L639 WeakPolarHBondContact O-CB 3.28Å; E635-L639 WeakPolarHBondContact O-CD1 3.49Å; E635-L639 WeakPolarHBondContact O-CG 3.06Å; E635-L639 PolarHBondContact O-N 2.94Å
636	Y	94.7	Very high	92.4	Very high	24 Å²	24	65.6 Å²	65.6	9%	0.094	34%	0.335	C	S	.	.	H	α-helix	trans	-68	-28.9	172.8	-76.7	-63.3	0	0	0	113.4	P631 T632 P633 E634 A640 I650 V651 F654 R658	P631-Y636 HydrophobicContact CB-CD1 4.05Å; P631-Y636 HydrophobicContact CB-CD2 4Å; P631-Y636 HydrophobicContact CB-CE1 3.94Å; P631-Y636 HydrophobicContact CB-CE2 3.88Å; P631-Y636 HydrophobicContact CB-CG 4.08Å; P631-Y636 HydrophobicContact CG-CD1 4.26Å; P631-Y636 HydrophobicContact CG-CE1 3.79Å; P631-Y636 HydrophobicContact CG-CE2 4.42Å; P631-Y636 WeakPolarHBondContact O-CE2 3.24Å; T632-Y636 WeakPolarHBondContact O-CD2 3.5Å; T632-Y636 PolarHBondContact O-N 2.89Å; P633-Y636 WeakPolarHBondContact O-CB 3.41Å; P633-Y636 PolarHBondContact O-N 3.14Å; E634-Y636 VanDerWaalsContact C-N 3.29Å; E634-Y636 PolarHBondContact O-N 3.41Å; Y636-A640 WeakPolarHBondContact O-CB 3.35Å; Y636-A640 PolarHBondContact O-N 2.87Å; Y636-I650 HydrophobicContact CD1-CG2 3.79Å; Y636-I650 HydrophobicContact CE1-CG2 4.25Å; Y636-V651 HydrophobicContact CD1-CG2 3.74Å; Y636-V651 HydrophobicContact CD2-CG2 4.19Å; Y636-V651 HydrophobicContact CE1-CB 4.38Å; Y636-V651 HydrophobicContact CE1-CG2 3.82Å; Y636-V651 HydrophobicContact CE2-CG2 4.26Å; Y636-V651 HydrophobicContact CG-CG2 3.94Å; Y636-F654 HydrophobicContact CE1-CB 4.14Å; Y636-F654 AromaticContact CE1-CD2 3.98Å; Y636-F654 HydrophobicContact CE1-CD2 3.98Å; Y636-F654 AromaticContact CE1-CG 3.99Å; Y636-F654 HydrophobicContact CE1-CG 3.99Å; Y636-R658 PolarHBondContact OH-NH1 3.35Å
637	D	93.9	Very high	92.3	Very high	72 Å²	72	68 Å²	68	39%	0.385	34%	0.34	S	S	.	.	H	α-helix	trans	-77.5	-45	174.7	-71.6	-44.1	0	0	0	110.8	P633 E634 E635 L639 A640 E641 R647	P633-D637 PolarHBondContact O-N 3.05Å; E634-D637 PolarHBondContact O-N 2.94Å; E635-D637 VanDerWaalsContact C-N 3.32Å; E635-D637 PolarHBondContact O-N 3.2Å; D637-L639 VanDerWaalsContact C-N 3.31Å; D637-L639 PolarHBondContact O-N 3.46Å; D637-A640 WeakPolarHBondContact O-CA 3.3Å; D637-A640 VanDerWaalsContact O-CB 3.31Å; D637-A640 WeakPolarHBondContact O-CB 3.47Å; D637-A640 PolarHBondContact O-N 2.83Å; D637-E641 PolarHBondContact O-N 3.34Å; D637-R647 VanDerWaalsContact OD1-CD 3.23Å; D637-R647 WeakPolarHBondContact OD1-CD 3.45Å; D637-R647 IonicContact OD1-CZ 2.96Å; D637-R647 IonicContact OD1-NE 3.2Å; D637-R647 PolarHBondContact OD1-NE 3.04Å; D637-R647 IonicContact OD1-NH1 2.72Å; D637-R647 PolarHBondContact OD1-NH1 3.33Å; D637-R647 IonicContact OD1-NH2 3.62Å; D637-R647 IonicContact OD2-CZ 2.93Å; D637-R647 IonicContact OD2-NE 3.81Å; D637-R647 IonicContact OD2-NH1 2.81Å; D637-R647 PolarHBondContact OD2-NH1 3.16Å; D637-R647 IonicContact OD2-NH2 2.76Å; D637-R647 PolarHBondContact OD2-NH2 3.09Å
638	Q	93.3	Very high	92.5	Very high	97 Å²	97	65.5 Å²	65.5	45%	0.453	34%	0.335	S	S	.	.	H	α-helix	trans	-53.9	-46	171.3	179.9	64.8	30.9	0	0	111.6	E634 A640 E641 E642	E634-Q638 PolarHBondContact O-N 2.84Å; Q638-A640 VanDerWaalsContact C-N 3.26Å; Q638-A640 PolarHBondContact O-N 3.04Å; Q638-E641 PolarHBondContact O-N 3.2Å; Q638-E642 HydrophobicContact CG-CG 4.49Å; Q638-E642 WeakPolarHBondContact CG-OE1 3.29Å; Q638-E642 PolarHBondContact NE2-OE1 3.4Å; Q638-E642 WeakPolarHBondContact O-CG 3.22Å; Q638-E642 PolarHBondContact O-N 2.8Å
639	L	94.3	Very high	92.6	Very high	4 Å²	4	66 Å²	66	2%	0.021	33%	0.333	C	S	.	.	H	α-helix	trans	-68.1	-24.7	176.5	-69.5	167.7	0	0	0	113	I620 A624 P631 E635 D637 S643 I650 F654	I620-L639 HydrophobicContact CG2-CD2 3.85Å; A624-L639 HydrophobicContact CB-CD1 3.84Å; A624-L639 HydrophobicContact CB-CD2 3.51Å; A624-L639 HydrophobicContact CB-CG 4.32Å; P631-L639 HydrophobicContact CG-CD1 4.37Å; E635-L639 WeakPolarHBondContact O-CB 3.28Å; E635-L639 WeakPolarHBondContact O-CD1 3.49Å; E635-L639 WeakPolarHBondContact O-CG 3.06Å; E635-L639 PolarHBondContact O-N 2.94Å; D637-L639 VanDerWaalsContact C-N 3.31Å; D637-L639 PolarHBondContact O-N 3.46Å; L639-S643 VanDerWaalsContact O-CB 3.31Å; L639-S643 WeakPolarHBondContact O-CB 3.37Å; L639-S643 PolarHBondContact O-N 2.68Å; L639-S643 VanDerWaalsContact O-N 3.09Å; L639-S643 PolarHBondContact O-OG 3.32Å; L639-I650 HydrophobicContact CB-CD1 3.95Å; L639-I650 HydrophobicContact CB-CG2 4.26Å; L639-I650 HydrophobicContact CD1-CG2 4.45Å; L639-I650 WeakPolarHBondContact O-CD1 3.27Å; L639-F654 HydrophobicContact CD1-CE2 3.97Å; L639-F654 HydrophobicContact CD1-CZ 3.97Å
640	A	93.7	Very high	92.7	Very high	21 Å²	21	63.8 Å²	63.8	17%	0.174	32%	0.323	C	S	.	.	H	α-helix	trans	-73.5	-34.3	174.6	0	0	0	0	0	111.8	Y636 D637 Q638 G644 L645 R647 I650	Y636-A640 WeakPolarHBondContact O-CB 3.35Å; Y636-A640 PolarHBondContact O-N 2.87Å; D637-A640 WeakPolarHBondContact O-CA 3.3Å; D637-A640 VanDerWaalsContact O-CB 3.31Å; D637-A640 WeakPolarHBondContact O-CB 3.47Å; D637-A640 PolarHBondContact O-N 2.83Å; Q638-A640 VanDerWaalsContact C-N 3.26Å; Q638-A640 PolarHBondContact O-N 3.04Å; A640-G644 CarbonylContact O-C 3.58Å; A640-G644 VanDerWaalsContact O-CA 3.23Å; A640-G644 WeakPolarHBondContact O-CA 3.03Å; A640-G644 PolarHBondContact O-N 3.33Å; A640-G644 VanDerWaalsContact O-N 3.07Å; A640-L645 WeakPolarHBondContact CA-O 3.41Å; A640-L645 WeakPolarHBondContact CB-O 3.41Å; A640-L645 PolarHBondContact O-N 2.94Å; A640-R647 HydrophobicContact CB-CB 4.3Å; A640-I650 VanDerWaalsContact CA-CD1 3.48Å; A640-I650 HydrophobicContact CB-CD1 4Å
641	E	93.6	Very high	92.9	Very high	158 Å²	158	58.8 Å²	58.8	74%	0.738	31%	0.311	S	S	*	.	H	α-helix	trans	-70.6	-57.9	170.4	-173.1	161.4	-158.5	0	0	111.1	D637 Q638 S643 G644	D637-E641 PolarHBondContact O-N 3.34Å; Q638-E641 PolarHBondContact O-N 3.2Å; E641-S643 VanDerWaalsContact C-N 3.32Å; E641-S643 PolarHBondContact O-N 3.17Å; E641-G644 PolarHBondContact O-N 2.67Å; E641-G644 VanDerWaalsContact O-N 3.09Å
642	E	90.9	Very high	92.9	Very high	83 Å²	83	61.5 Å²	61.5	39%	0.388	33%	0.33	S	S	.	.	H	α-helix	trans	-54.3	-42.9	-178.5	-73.5	176.3	-169.5	0	0	113.3	I620 Q638	I620-E642 HydrophobicContact CD1-CB 4.47Å; I620-E642 WeakPolarHBondContact CD1-O 3.45Å; I620-E642 HydrophobicContact CG2-CB 3.96Å; Q638-E642 HydrophobicContact CG-CG 4.49Å; Q638-E642 WeakPolarHBondContact CG-OE1 3.29Å; Q638-E642 PolarHBondContact NE2-OE1 3.4Å; Q638-E642 WeakPolarHBondContact O-CG 3.22Å; Q638-E642 PolarHBondContact O-N 2.8Å
643	S	90	Very high	93	Very high	7 Å²	7	60 Å²	60	5%	0.049	32%	0.318	C	S	.	.	H	α-helix	trans	-92.3	-9.8	-179.5	73	0	0	0	0	114	Q617 L639 E641 L645	Q617-S643 VanDerWaalsContact CG-O 3.25Å; Q617-S643 WeakPolarHBondContact CG-O 3.48Å; Q617-S643 PolarHBondContact NE2-O 3.02Å; L639-S643 VanDerWaalsContact O-CB 3.31Å; L639-S643 WeakPolarHBondContact O-CB 3.37Å; L639-S643 PolarHBondContact O-N 2.68Å; L639-S643 VanDerWaalsContact O-N 3.09Å; L639-S643 PolarHBondContact O-OG 3.32Å; E641-S643 VanDerWaalsContact C-N 3.32Å; E641-S643 PolarHBondContact O-N 3.17Å; S643-L645 PolarHBondContact O-N 3.28Å; S643-L645 VanDerWaalsContact O-N 3.1Å; S643-L645 WeakPolarHBondContact OG-CB 3.4Å; S643-L645 PolarHBondContact OG-N 3.45Å
644	G	90.4	Very high	93.1	Very high	57 Å²	57	56.5 Å²	56.5	59%	0.588	30%	0.295	S	S	*	.			trans	57.4	19	-170.5	0	0	0	0	0	114.2	A640 E641	A640-G644 CarbonylContact O-C 3.58Å; A640-G644 VanDerWaalsContact O-CA 3.23Å; A640-G644 WeakPolarHBondContact O-CA 3.03Å; A640-G644 PolarHBondContact O-N 3.33Å; A640-G644 VanDerWaalsContact O-N 3.07Å; E641-G644 PolarHBondContact O-N 2.67Å; E641-G644 VanDerWaalsContact O-N 3.09Å
645	L	91.6	Very high	93.1	Very high	10 Å²	10	51.8 Å²	51.8	5%	0.052	28%	0.281	C	S	.	.			trans	-98.4	134.7	178	-67.5	174.2	0	0	0	110	K613 Q617 L621 A640 S643 R647 I650	K613-L645 HydrophobicContact CD-CD1 4.3Å; K613-L645 HydrophobicContact CG-CD1 4.13Å; Q617-L645 HydrophobicContact CB-CD1 4.11Å; Q617-L645 HydrophobicContact CG-CD1 4.3Å; Q617-L645 HydrophobicContact CG-CG 4.29Å; L621-L645 HydrophobicContact CD1-CD1 3.83Å; A640-L645 WeakPolarHBondContact CA-O 3.41Å; A640-L645 WeakPolarHBondContact CB-O 3.41Å; A640-L645 PolarHBondContact O-N 2.94Å; S643-L645 PolarHBondContact O-N 3.28Å; S643-L645 VanDerWaalsContact O-N 3.1Å; S643-L645 WeakPolarHBondContact OG-CB 3.4Å; S643-L645 PolarHBondContact OG-N 3.45Å; L645-R647 PolarHBondContact O-N 3.06Å; L645-I650 HydrophobicContact CB-CD1 4.23Å; L645-I650 HydrophobicContact CB-CG1 4.09Å
646	P	92.1	Very high	93.1	Very high	55 Å²	55	53.6 Å²	53.6	36%	0.357	29%	0.292	S	S	.	.			trans	-57.6	131.9	177.9	-23.2	32.1	0	0	0	111.6	H648 Y649	P646-H648 PolarHBondContact O-N 2.78Å; P646-Y649 HydrophobicContact CB-CD2 4.18Å; P646-Y649 HydrophobicContact CG-CD2 4.12Å; P646-Y649 WeakPolarHBondContact O-CB 3.43Å; P646-Y649 PolarHBondContact O-N 2.82Å
647	R	90.9	Very high	93	Very high	90 Å²	90	52.8 Å²	52.8	34%	0.34	29%	0.29	S	S	.	.	H	α-helix	trans	-40.3	-42	-177	-165.6	-168	-168.2	155.1	2.8	114.7	P633 D637 A640 L645 Y649 I650 V651	P633-R647 PolarHBondContact O-NH2 3.25Å; D637-R647 VanDerWaalsContact OD1-CD 3.23Å; D637-R647 WeakPolarHBondContact OD1-CD 3.45Å; D637-R647 IonicContact OD1-CZ 2.96Å; D637-R647 IonicContact OD1-NE 3.2Å; D637-R647 PolarHBondContact OD1-NE 3.04Å; D637-R647 IonicContact OD1-NH1 2.72Å; D637-R647 PolarHBondContact OD1-NH1 3.33Å; D637-R647 IonicContact OD1-NH2 3.62Å; D637-R647 IonicContact OD2-CZ 2.93Å; D637-R647 IonicContact OD2-NE 3.81Å; D637-R647 IonicContact OD2-NH1 2.81Å; D637-R647 PolarHBondContact OD2-NH1 3.16Å; D637-R647 IonicContact OD2-NH2 2.76Å; D637-R647 PolarHBondContact OD2-NH2 3.09Å; A640-R647 HydrophobicContact CB-CB 4.3Å; L645-R647 PolarHBondContact O-N 3.06Å; R647-Y649 VanDerWaalsContact C-N 3.31Å; R647-Y649 PolarHBondContact O-N 3.46Å; R647-I650 WeakPolarHBondContact O-CA 3.21Å; R647-I650 WeakPolarHBondContact O-CB 3.14Å; R647-I650 PolarHBondContact O-N 2.91Å; R647-V651 HydrophobicContact CG-CG2 4.47Å; R647-V651 WeakPolarHBondContact O-CG2 3.4Å; R647-V651 PolarHBondContact O-N 3.03Å
648	H	94.3	Very high	93	Very high	115 Å²	115	51.4 Å²	51.4	53%	0.532	28%	0.28	S	S	.	.	H	α-helix	trans	-62.4	-31.8	178.8	66.5	-100.3	0	0	0	113.8	P646 I650 S652	P646-H648 PolarHBondContact O-N 2.78Å; H648-I650 VanDerWaalsContact C-N 3.33Å; H648-S652 WeakPolarHBondContact O-CB 3.37Å; H648-S652 PolarHBondContact O-N 2.6Å; H648-S652 PolarHBondContact O-OG 3.02Å
649	Y	93.4	Very high	92.8	Very high	44 Å²	44	54.7 Å²	54.7	17%	0.173	29%	0.289	C	S	.	.	H	α-helix	trans	-70.9	-30.8	172.1	-83.4	-74.3	0	0	0	112.6	L607 P646 R647 W653	L607-Y649 WeakPolarHBondContact CD1-OH 3.49Å; L607-Y649 VanDerWaalsContact CG-OH 3.29Å; L607-Y649 WeakPolarHBondContact CG-OH 3.29Å; P646-Y649 HydrophobicContact CB-CD2 4.18Å; P646-Y649 HydrophobicContact CG-CD2 4.12Å; P646-Y649 WeakPolarHBondContact O-CB 3.43Å; P646-Y649 PolarHBondContact O-N 2.82Å; R647-Y649 VanDerWaalsContact C-N 3.31Å; R647-Y649 PolarHBondContact O-N 3.46Å; Y649-W653 WeakPolarHBondContact O-CB 3.5Å; Y649-W653 PolarHBondContact O-N 3.13Å
650	I	93.9	Very high	92.6	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-72.7	-53.7	178.6	-57.1	-173.8	0	0	0	109	L621 Y636 L639 A640 L645 R647 H648 S652 W653 F654	L621-I650 HydrophobicContact CD2-CB 4.37Å; L621-I650 HydrophobicContact CD2-CD1 4.38Å; L621-I650 HydrophobicContact CD2-CG1 4.14Å; L621-I650 HydrophobicContact CD2-CG2 3.7Å; Y636-I650 HydrophobicContact CD1-CG2 3.79Å; Y636-I650 HydrophobicContact CE1-CG2 4.25Å; L639-I650 HydrophobicContact CB-CD1 3.95Å; L639-I650 HydrophobicContact CB-CG2 4.26Å; L639-I650 HydrophobicContact CD1-CG2 4.45Å; L639-I650 WeakPolarHBondContact O-CD1 3.27Å; A640-I650 VanDerWaalsContact CA-CD1 3.48Å; A640-I650 HydrophobicContact CB-CD1 4Å; L645-I650 HydrophobicContact CB-CD1 4.23Å; L645-I650 HydrophobicContact CB-CG1 4.09Å; R647-I650 WeakPolarHBondContact O-CA 3.21Å; R647-I650 WeakPolarHBondContact O-CB 3.14Å; R647-I650 PolarHBondContact O-N 2.91Å; H648-I650 VanDerWaalsContact C-N 3.33Å; I650-S652 VanDerWaalsContact C-N 3.26Å; I650-S652 PolarHBondContact O-N 2.84Å; I650-W653 PolarHBondContact O-N 2.91Å; I650-F654 HydrophobicContact CG2-CD2 3.69Å; I650-F654 HydrophobicContact CG2-CE2 3.75Å; I650-F654 WeakPolarHBondContact O-CD2 3.27Å; I650-F654 PolarHBondContact O-N 2.91Å
651	V	94.3	Very high	92.2	Very high	62 Å²	62	59.1 Å²	59.1	38%	0.376	31%	0.307	S	S	.	.	H	α-helix	trans	-52.2	-45	173.2	175.5	0	0	0	0	111.2	Y636 R647 F654 G655	Y636-V651 HydrophobicContact CD1-CG2 3.74Å; Y636-V651 HydrophobicContact CD2-CG2 4.19Å; Y636-V651 HydrophobicContact CE1-CB 4.38Å; Y636-V651 HydrophobicContact CE1-CG2 3.82Å; Y636-V651 HydrophobicContact CE2-CG2 4.26Å; Y636-V651 HydrophobicContact CG-CG2 3.94Å; R647-V651 HydrophobicContact CG-CG2 4.47Å; R647-V651 WeakPolarHBondContact O-CG2 3.4Å; R647-V651 PolarHBondContact O-N 3.03Å; V651-F654 PolarHBondContact O-N 3.23Å; V651-G655 PolarHBondContact O-N 3.11Å
652	S	94.4	Very high	91.6	Very high	68 Å²	68	60.5 Å²	60.5	48%	0.476	31%	0.311	S	S	.	.	H	α-helix	trans	-61.4	-47.4	175.4	-55.9	0	0	0	0	112.5	H648 I650 F654 G655 D656	H648-S652 WeakPolarHBondContact O-CB 3.37Å; H648-S652 PolarHBondContact O-N 2.6Å; H648-S652 PolarHBondContact O-OG 3.02Å; I650-S652 VanDerWaalsContact C-N 3.26Å; I650-S652 PolarHBondContact O-N 2.84Å; S652-F654 PolarHBondContact O-N 3.14Å; S652-G655 WeakPolarHBondContact O-CA 3.44Å; S652-G655 PolarHBondContact O-N 3.24Å; S652-G655 VanDerWaalsContact O-N 3.12Å; S652-D656 PolarHBondContact O-N 2.92Å
653	W	94.8	Very high	91.1	Very high	27 Å²	27	60.4 Å²	60.4	10%	0.102	31%	0.313	C	S	.	.	H	α-helix	trans	-68	-33.4	-178.9	178.7	84.4	0	0	0	112.8	L621 K622 F625 Y649 I650 G655 D656 S657 W668	L621-W653 HydrophobicContact CB-CD2 4.26Å; L621-W653 HydrophobicContact CB-CE3 3.88Å; L621-W653 HydrophobicContact CB-CH2 3.74Å; L621-W653 HydrophobicContact CB-CZ2 4.1Å; L621-W653 HydrophobicContact CB-CZ3 3.63Å; L621-W653 HydrophobicContact CD1-CD2 4.03Å; L621-W653 HydrophobicContact CD1-CE3 4.23Å; L621-W653 HydrophobicContact CD1-CG 4.32Å; L621-W653 HydrophobicContact CD2-CE3 4.1Å; L621-W653 HydrophobicContact CD2-CZ3 4.44Å; L621-W653 HydrophobicContact CG-CE3 4.31Å; L621-W653 VanDerWaalsContact O-CH2 3.3Å; L621-W653 WeakPolarHBondContact O-CH2 3.39Å; L621-W653 VanDerWaalsContact O-CZ3 3.24Å; L621-W653 WeakPolarHBondContact O-CZ3 3.38Å; K622-W653 HydrophobicContact CG-CH2 4.2Å; K622-W653 HydrophobicContact CG-CZ2 4.16Å; F625-W653 HydrophobicContact CB-CH2 4.02Å; F625-W653 HydrophobicContact CB-CZ3 4Å; F625-W653 HydrophobicContact CD2-CZ3 4.15Å; F625-W653 HydrophobicContact CG-CH2 4.39Å; F625-W653 HydrophobicContact CG-CZ3 4.37Å; Y649-W653 WeakPolarHBondContact O-CB 3.5Å; Y649-W653 PolarHBondContact O-N 3.13Å; I650-W653 PolarHBondContact O-N 2.91Å; W653-G655 VanDerWaalsContact C-N 3.35Å; W653-D656 PolarHBondContact O-N 2.76Å; W653-S657 WeakPolarHBondContact CZ2-OG 3.2Å; W653-S657 WeakPolarHBondContact O-CB 3.48Å; W653-S657 PolarHBondContact O-N 2.87Å; W653-S657 PolarHBondContact O-OG 2.91Å; W653-W668 HydrophobicContact CH2-CH2 4.11Å; W653-W668 HydrophobicContact CH2-CZ2 4.16Å; W653-W668 HydrophobicContact CZ2-CH2 4.49Å; W653-W668 HydrophobicContact CZ2-CZ2 4.11Å
654	F	94.6	Very high	90.4	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-66.2	-38.1	170.7	-92.3	-97.1	0	0	0	111	L621 A624 F625 P631 Y636 L639 I650 V651 S652 S657 R658	L621-F654 HydrophobicContact CD2-CE2 3.99Å; A624-F654 HydrophobicContact CB-CZ 4.08Å; F625-F654 HydrophobicContact CB-CE1 3.94Å; F625-F654 HydrophobicContact CB-CZ 4.2Å; F625-F654 AromaticContact CD2-CD1 3.59Å; F625-F654 HydrophobicContact CD2-CD1 3.59Å; F625-F654 AromaticContact CD2-CE1 3.71Å; F625-F654 HydrophobicContact CD2-CE1 3.71Å; F625-F654 HydrophobicContact CD2-CG 4.34Å; F625-F654 HydrophobicContact CE2-CD1 4.25Å; F625-F654 HydrophobicContact CG-CE1 4.28Å; P631-F654 VanDerWaalsContact CD-CD1 3.45Å; P631-F654 VanDerWaalsContact CD-CE1 3.48Å; P631-F654 HydrophobicContact CG-CD1 3.62Å; P631-F654 HydrophobicContact CG-CD2 4.48Å; P631-F654 HydrophobicContact CG-CE1 3.24Å; P631-F654 HydrophobicContact CG-CE2 4.18Å; P631-F654 HydrophobicContact CG-CG 4.24Å; P631-F654 HydrophobicContact CG-CZ 3.57Å; Y636-F654 HydrophobicContact CE1-CB 4.14Å; Y636-F654 AromaticContact CE1-CD2 3.98Å; Y636-F654 HydrophobicContact CE1-CD2 3.98Å; Y636-F654 AromaticContact CE1-CG 3.99Å; Y636-F654 HydrophobicContact CE1-CG 3.99Å; L639-F654 HydrophobicContact CD1-CE2 3.97Å; L639-F654 HydrophobicContact CD1-CZ 3.97Å; I650-F654 HydrophobicContact CG2-CD2 3.69Å; I650-F654 HydrophobicContact CG2-CE2 3.75Å; I650-F654 WeakPolarHBondContact O-CD2 3.27Å; I650-F654 PolarHBondContact O-N 2.91Å; V651-F654 PolarHBondContact O-N 3.23Å; S652-F654 PolarHBondContact O-N 3.14Å; F654-S657 PolarHBondContact O-N 2.99Å; F654-R658 WeakPolarHBondContact O-CB 3.3Å; F654-R658 WeakPolarHBondContact O-CG 3.49Å; F654-R658 PolarHBondContact O-N 3.33Å
655	G	93.8	Very high	89.6	Confident	28 Å²	28	66.2 Å²	66.2	29%	0.289	35%	0.345	S	S	.	.	H	α-helix	trans	-59.5	-52.7	169.6	0	0	0	0	0	113.1	V651 S652 W653 S657 R658 Y659	V651-G655 PolarHBondContact O-N 3.11Å; S652-G655 WeakPolarHBondContact O-CA 3.44Å; S652-G655 PolarHBondContact O-N 3.24Å; S652-G655 VanDerWaalsContact O-N 3.12Å; W653-G655 VanDerWaalsContact C-N 3.35Å; G655-S657 VanDerWaalsContact C-N 3.25Å; G655-S657 PolarHBondContact O-N 3.42Å; G655-R658 PolarHBondContact O-N 2.96Å; G655-Y659 PolarHBondContact O-N 2.97Å
656	D	92.2	Very high	89.2	Confident	104 Å²	104	66.3 Å²	66.3	56%	0.556	35%	0.345	S	S	*	.	H	α-helix	trans	-56.9	-39.3	176	-70.7	-28.8	0	0	0	112.1	S652 W653 S660	S652-D656 PolarHBondContact O-N 2.92Å; W653-D656 PolarHBondContact O-N 2.76Å; D656-S660 VanDerWaalsContact O-CB 3.28Å; D656-S660 WeakPolarHBondContact O-CB 3.48Å; D656-S660 PolarHBondContact O-N 2.67Å; D656-S660 PolarHBondContact O-OG 3.11Å
657	S	92.8	Very high	88.7	Confident	6 Å²	6	72.2 Å²	72.2	4%	0.042	37%	0.365	C	S	.	.	H	α-helix	trans	-74.2	-40.8	-179.1	-60.6	0	0	0	0	112	W653 F654 G655 S660 W661	W653-S657 WeakPolarHBondContact CZ2-OG 3.2Å; W653-S657 WeakPolarHBondContact O-CB 3.48Å; W653-S657 PolarHBondContact O-N 2.87Å; W653-S657 PolarHBondContact O-OG 2.91Å; F654-S657 PolarHBondContact O-N 2.99Å; G655-S657 VanDerWaalsContact C-N 3.25Å; G655-S657 PolarHBondContact O-N 3.42Å; S657-S660 PolarHBondContact O-N 2.74Å; S657-W661 WeakPolarHBondContact O-CB 3.31Å; S657-W661 PolarHBondContact O-N 3.44Å
658	R	93.4	Very high	88.5	Confident	44 Å²	44	70.2 Å²	70.2	17%	0.166	36%	0.358	C	S	.	.	H	α-helix	trans	-61.3	-42.5	170.5	-76.5	-169.8	-65	-90.9	1.3	111.7	F625 Q629 W630 Y636 F654 G655 S660 W661 K662	F625-R658 HydrophobicContact CE2-CG 3.93Å; F625-R658 HydrophobicContact CZ-CG 4.22Å; Q629-R658 HydrophobicContact CB-CG 4.37Å; Q629-R658 VanDerWaalsContact O-CD 3.32Å; Q629-R658 WeakPolarHBondContact O-CD 3.47Å; Q629-R658 PolarHBondContact O-NH1 2.96Å; W630-R658 VanDerWaalsContact CE2-CD 3.43Å; W630-R658 VanDerWaalsContact CE3-CZ 3.44Å; W630-R658 VanDerWaalsContact CZ2-CD 3.49Å; W630-R658 VanDerWaalsContact CZ3-CZ 3.44Å; W630-R658 VanDerWaalsContact CZ3-NE 3.34Å; Y636-R658 PolarHBondContact OH-NH1 3.35Å; F654-R658 WeakPolarHBondContact O-CB 3.3Å; F654-R658 WeakPolarHBondContact O-CG 3.49Å; F654-R658 PolarHBondContact O-N 3.33Å; G655-R658 PolarHBondContact O-N 2.96Å; R658-S660 VanDerWaalsContact C-N 3.34Å; R658-S660 PolarHBondContact O-N 3.4Å; R658-W661 PolarHBondContact O-N 3.46Å; R658-K662 PolarHBondContact O-N 3.2Å
659	Y	90.4	Very high	88	Confident	165 Å²	165	65.3 Å²	65.3	65%	0.647	34%	0.335	S	S	*	.	H	α-helix	trans	-63.1	-41.6	174.7	-178.1	-99	0	0	0	111.6	G655 N663	G655-Y659 PolarHBondContact O-N 2.97Å; Y659-N663 WeakPolarHBondContact CE1-ND2 3.18Å; Y659-N663 WeakPolarHBondContact CE2-ND2 3.24Å; Y659-N663 PolarHBondContact O-N 3.24Å; Y659-N663 PolarHBondContact O-ND2 2.85Å
660	S	89.1	Confident	87.5	Confident	39 Å²	39	69 Å²	69	27%	0.273	35%	0.352	S	S	.	.	H	α-helix	trans	-69.2	-33.6	178.1	-62	0	0	0	0	113	D656 S657 R658 G664 N665	D656-S660 VanDerWaalsContact O-CB 3.28Å; D656-S660 WeakPolarHBondContact O-CB 3.48Å; D656-S660 PolarHBondContact O-N 2.67Å; D656-S660 PolarHBondContact O-OG 3.11Å; S657-S660 PolarHBondContact O-N 2.74Å; R658-S660 VanDerWaalsContact C-N 3.34Å; R658-S660 PolarHBondContact O-N 3.4Å; S660-G664 PolarHBondContact O-N 2.91Å; S660-N665 PolarHBondContact O-N 3.27Å
661	W	85.3	Confident	86.9	Confident	80 Å²	80	72.7 Å²	72.7	30%	0.303	37%	0.369	S	S	.	.	H	α-helix	trans	-65	-54.1	172.5	177.6	-115.7	0	0	0	111.5	F625 Q629 S657 R658 N663 G664 L666 F669 F670	F625-W661 HydrophobicContact CZ-CB 4.35Å; Q629-W661 VanDerWaalsContact NE2-NE1 3.17Å; S657-W661 WeakPolarHBondContact O-CB 3.31Å; S657-W661 PolarHBondContact O-N 3.44Å; R658-W661 PolarHBondContact O-N 3.46Å; W661-N663 PolarHBondContact O-N 3.11Å; W661-N663 VanDerWaalsContact O-N 3.08Å; W661-G664 PolarHBondContact O-N 2.77Å; W661-L666 HydrophobicContact CB-CD2 3.96Å; W661-L666 HydrophobicContact CE3-CB 4.14Å; W661-L666 HydrophobicContact CE3-CD2 4.22Å; W661-F669 HydrophobicContact CE3-CB 4.08Å; W661-F669 HydrophobicContact CE3-CD1 4.08Å; W661-F669 HydrophobicContact CE3-CD2 4.22Å; W661-F669 AromaticContact CE3-CG 3.86Å; W661-F669 HydrophobicContact CE3-CG 3.86Å; W661-F669 AromaticContact CH2-CD1 3.38Å; W661-F669 HydrophobicContact CH2-CD1 3.38Å; W661-F669 AromaticContact CH2-CE1 3.53Å; W661-F669 HydrophobicContact CH2-CE1 3.53Å; W661-F669 HydrophobicContact CH2-CG 4.05Å; W661-F669 HydrophobicContact CH2-CZ 4.3Å; W661-F669 HydrophobicContact CZ2-CD1 4.28Å; W661-F669 HydrophobicContact CZ2-CE1 4.04Å; W661-F669 HydrophobicContact CZ2-CZ 4.44Å; W661-F669 HydrophobicContact CZ3-CB 3.76Å; W661-F669 AromaticContact CZ3-CD1 3.26Å; W661-F669 HydrophobicContact CZ3-CD1 3.26Å; W661-F669 HydrophobicContact CZ3-CD2 4.21Å; W661-F669 AromaticContact CZ3-CE1 3.87Å; W661-F669 HydrophobicContact CZ3-CE1 3.87Å; W661-F669 AromaticContact CZ3-CG 3.47Å; W661-F669 HydrophobicContact CZ3-CG 3.47Å; W661-F669 VanDerWaalsContact CZ3-CG 3.47Å; W661-F670 AromaticContact CH2-CE1 3.73Å; W661-F670 HydrophobicContact CH2-CE1 3.73Å; W661-F670 HydrophobicContact CH2-CE2 4.28Å; W661-F670 AromaticContact CH2-CZ 3.54Å; W661-F670 HydrophobicContact CH2-CZ 3.54Å; W661-F670 HydrophobicContact CZ3-CE1 4.06Å; W661-F670 AromaticContact CZ3-CE2 3.81Å; W661-F670 HydrophobicContact CZ3-CE2 3.81Å; W661-F670 AromaticContact CZ3-CZ 3.54Å; W661-F670 HydrophobicContact CZ3-CZ 3.54Å
662	K	80.4	Confident	86.3	Confident	187 Å²	187	71.6 Å²	71.6	81%	0.813	36%	0.358	S	S	*	.	H	α-helix	trans	-59.1	-24.4	179.6	-172	166.4	-176.7	168.5	0	113.4	R658	R658-K662 PolarHBondContact O-N 3.2Å
663	N	80.8	Confident	85.6	Confident	81 Å²	81	74.1 Å²	74.1	43%	0.433	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	12.7	175.9	-68	-65	0	0	0	114.2	Y659 W661 N665	Y659-N663 WeakPolarHBondContact CE1-ND2 3.18Å; Y659-N663 WeakPolarHBondContact CE2-ND2 3.24Å; Y659-N663 PolarHBondContact O-N 3.24Å; Y659-N663 PolarHBondContact O-ND2 2.85Å; W661-N663 PolarHBondContact O-N 3.11Å; W661-N663 VanDerWaalsContact O-N 3.08Å; N663-N665 PolarHBondContact O-N 3.02Å; N663-N665 PolarHBondContact O-ND2 3.38Å; N663-N665 VanDerWaalsContact O-ND2 3.14Å
664	G	75	Confident	84.4	Confident	63 Å²	63	76.1 Å²	76.1	65%	0.649	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	9.6	174.6	0	0	0	0	0	116.1	S660 W661	S660-G664 PolarHBondContact O-N 2.91Å; W661-G664 PolarHBondContact O-N 2.77Å
665	N	74.8	Confident	82.5	Confident	123 Å²	123	79 Å²	79	66%	0.658	41%	0.41	S	S	*	.			trans	-88.6	-5.8	-172.2	-72.9	-61.7	0	0	0	114.1	S660 N663 K667	S660-N665 PolarHBondContact O-N 3.27Å; N663-N665 PolarHBondContact O-N 3.02Å; N663-N665 PolarHBondContact O-ND2 3.38Å; N663-N665 VanDerWaalsContact O-ND2 3.14Å; N665-K667 PolarHBondContact O-N 3.28Å; N665-K667 VanDerWaalsContact O-N 3.14Å
666	L	83.1	Confident	80.3	Confident	11 Å²	11	81.2 Å²	81.2	6%	0.058	42%	0.415	C	S	.	.			trans	-92.7	53.3	-165.7	-152.8	70.6	0	0	0	114.1	F625 W661 W668 F669	F625-L666 HydrophobicContact CD1-CD2 4.19Å; F625-L666 HydrophobicContact CE1-CD2 3.52Å; F625-L666 HydrophobicContact CZ-CD2 4.06Å; W661-L666 HydrophobicContact CB-CD2 3.96Å; W661-L666 HydrophobicContact CE3-CB 4.14Å; W661-L666 HydrophobicContact CE3-CD2 4.22Å; L666-W668 HydrophobicContact CD1-CZ2 3.61Å; L666-W668 HydrophobicContact CD2-CH2 4.03Å; L666-W668 HydrophobicContact CD2-CZ2 3.68Å; L666-W668 HydrophobicContact CG-CD2 4.34Å; L666-W668 HydrophobicContact CG-CH2 4.42Å; L666-W668 HydrophobicContact CG-CZ2 3.7Å; L666-W668 PolarHBondContact O-N 3.34Å; L666-F669 HydrophobicContact CD2-CB 4.16Å; L666-F669 HydrophobicContact CD2-CD2 4.23Å; L666-F669 HydrophobicContact CG-CB 4.28Å; L666-F669 VanDerWaalsContact O-CB 3.26Å; L666-F669 WeakPolarHBondContact O-CB 3.49Å; L666-F669 PolarHBondContact O-N 2.89Å
667	K	80.6	Confident	78.3	Confident	179 Å²	179	78.4 Å²	78.4	78%	0.778	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-26.1	-173.6	-67.6	-170.2	176.6	-173.3	0	115.8	N665 F669	N665-K667 PolarHBondContact O-N 3.28Å; N665-K667 VanDerWaalsContact O-N 3.14Å; K667-F669 VanDerWaalsContact C-N 3.28Å; K667-F669 PolarHBondContact O-N 3.49Å
668	W	86.1	Confident	75.9	Confident	49 Å²	49	87.6 Å²	87.6	19%	0.186	44%	0.444	C	S	.	.	H	α-helix	trans	-70.9	-21.3	177.5	63.8	-103.5	0	0	0	113.5	K622 F625 V626 W653 L666 Q671 Y672	K622-W668 HydrophobicContact CB-CE3 3.91Å; K622-W668 HydrophobicContact CB-CH2 4Å; K622-W668 HydrophobicContact CB-CZ3 3.55Å; K622-W668 HydrophobicContact CD-CD2 3.77Å; K622-W668 HydrophobicContact CD-CE3 3.69Å; K622-W668 HydrophobicContact CD-CG 4.31Å; K622-W668 HydrophobicContact CD-CZ3 4.1Å; K622-W668 HydrophobicContact CG-CD2 3.94Å; K622-W668 HydrophobicContact CG-CE3 3.62Å; K622-W668 HydrophobicContact CG-CH2 3.61Å; K622-W668 HydrophobicContact CG-CZ2 3.84Å; K622-W668 HydrophobicContact CG-CZ3 3.48Å; K622-W668 VanDerWaalsContact CG-CZ3 3.48Å; F625-W668 HydrophobicContact CB-CH2 4.1Å; F625-W668 AromaticContact CD1-CH2 3.66Å; F625-W668 HydrophobicContact CD1-CH2 3.66Å; F625-W668 HydrophobicContact CD1-CZ3 4.38Å; F625-W668 HydrophobicContact CE1-CH2 4.41Å; F625-W668 HydrophobicContact CG-CH2 4.03Å; V626-W668 HydrophobicContact CG2-CZ3 4.18Å; W653-W668 HydrophobicContact CH2-CH2 4.11Å; W653-W668 HydrophobicContact CH2-CZ2 4.16Å; W653-W668 HydrophobicContact CZ2-CH2 4.49Å; W653-W668 HydrophobicContact CZ2-CZ2 4.11Å; L666-W668 HydrophobicContact CD1-CZ2 3.61Å; L666-W668 HydrophobicContact CD2-CH2 4.03Å; L666-W668 HydrophobicContact CD2-CZ2 3.68Å; L666-W668 HydrophobicContact CG-CD2 4.34Å; L666-W668 HydrophobicContact CG-CH2 4.42Å; L666-W668 HydrophobicContact CG-CZ2 3.7Å; L666-W668 PolarHBondContact O-N 3.34Å; W668-Q671 PolarHBondContact O-N 3.15Å; W668-Y672 HydrophobicContact CE3-CD2 4.17Å; W668-Y672 HydrophobicContact CE3-CG 4.32Å; W668-Y672 WeakPolarHBondContact O-CD2 3.5Å; W668-Y672 PolarHBondContact O-N 3.04Å; W668-Y672 VanDerWaalsContact O-N 3.1Å
669	F	85.4	Confident	73.2	Confident	12 Å²	12	87.8 Å²	87.8	5%	0.053	46%	0.46	C	S	.	.	H	α-helix	trans	-58	-52.7	-178.1	-175.4	-86.1	0	0	0	111.1	F625 V626 W661 L666 K667 Q671 Y672 Q673	F625-F669 AromaticContact CD1-CD2 3.61Å; F625-F669 HydrophobicContact CD1-CD2 3.61Å; F625-F669 AromaticContact CD1-CE2 3.65Å; F625-F669 HydrophobicContact CD1-CE2 3.65Å; F625-F669 AromaticContact CE1-CD2 3.62Å; F625-F669 HydrophobicContact CE1-CD2 3.62Å; F625-F669 AromaticContact CE1-CE2 3.69Å; F625-F669 HydrophobicContact CE1-CE2 3.69Å; V626-F669 HydrophobicContact CB-CE2 4.38Å; V626-F669 HydrophobicContact CG2-CD2 3.67Å; V626-F669 HydrophobicContact CG2-CE2 3.68Å; V626-F669 HydrophobicContact CG2-CG 4.18Å; V626-F669 HydrophobicContact CG2-CZ 4.2Å; W661-F669 HydrophobicContact CE3-CB 4.08Å; W661-F669 HydrophobicContact CE3-CD1 4.08Å; W661-F669 HydrophobicContact CE3-CD2 4.22Å; W661-F669 AromaticContact CE3-CG 3.86Å; W661-F669 HydrophobicContact CE3-CG 3.86Å; W661-F669 AromaticContact CH2-CD1 3.38Å; W661-F669 HydrophobicContact CH2-CD1 3.38Å; W661-F669 AromaticContact CH2-CE1 3.53Å; W661-F669 HydrophobicContact CH2-CE1 3.53Å; W661-F669 HydrophobicContact CH2-CG 4.05Å; W661-F669 HydrophobicContact CH2-CZ 4.3Å; W661-F669 HydrophobicContact CZ2-CD1 4.28Å; W661-F669 HydrophobicContact CZ2-CE1 4.04Å; W661-F669 HydrophobicContact CZ2-CZ 4.44Å; W661-F669 HydrophobicContact CZ3-CB 3.76Å; W661-F669 AromaticContact CZ3-CD1 3.26Å; W661-F669 HydrophobicContact CZ3-CD1 3.26Å; W661-F669 HydrophobicContact CZ3-CD2 4.21Å; W661-F669 AromaticContact CZ3-CE1 3.87Å; W661-F669 HydrophobicContact CZ3-CE1 3.87Å; W661-F669 AromaticContact CZ3-CG 3.47Å; W661-F669 HydrophobicContact CZ3-CG 3.47Å; W661-F669 VanDerWaalsContact CZ3-CG 3.47Å; L666-F669 HydrophobicContact CD2-CB 4.16Å; L666-F669 HydrophobicContact CD2-CD2 4.23Å; L666-F669 HydrophobicContact CG-CB 4.28Å; L666-F669 VanDerWaalsContact O-CB 3.26Å; L666-F669 WeakPolarHBondContact O-CB 3.49Å; L666-F669 PolarHBondContact O-N 2.89Å; K667-F669 VanDerWaalsContact C-N 3.28Å; K667-F669 PolarHBondContact O-N 3.49Å; F669-Q671 PolarHBondContact O-N 3.04Å; F669-Y672 PolarHBondContact O-N 3.28Å; F669-Q673 HydrophobicContact CE1-CB 4.49Å; F669-Q673 WeakPolarHBondContact O-CB 3.4Å; F669-Q673 PolarHBondContact O-N 2.82Å
670	F	83.1	Confident	71.6	Confident	121 Å²	121	86.4 Å²	86.4	53%	0.531	47%	0.471	S	S	.	.	H	α-helix	trans	-61.5	-30.5	178.4	-56.7	-73.8	0	0	0	113.1	W661 S674	W661-F670 AromaticContact CH2-CE1 3.73Å; W661-F670 HydrophobicContact CH2-CE1 3.73Å; W661-F670 HydrophobicContact CH2-CE2 4.28Å; W661-F670 AromaticContact CH2-CZ 3.54Å; W661-F670 HydrophobicContact CH2-CZ 3.54Å; W661-F670 HydrophobicContact CZ3-CE1 4.06Å; W661-F670 AromaticContact CZ3-CE2 3.81Å; W661-F670 HydrophobicContact CZ3-CE2 3.81Å; W661-F670 AromaticContact CZ3-CZ 3.54Å; W661-F670 HydrophobicContact CZ3-CZ 3.54Å; F670-S674 WeakPolarHBondContact O-CB 3.39Å; F670-S674 PolarHBondContact O-N 3.24Å; F670-S674 PolarHBondContact O-OG 2.84Å
671	Q	80	Confident	69	Low	78 Å²	78	89.5 Å²	89.5	36%	0.364	49%	0.493	S	S	.	.	H	α-helix	trans	-72.4	-32.3	176	-170	176.5	16.8	0	0	112.5	W668 F669 S674 N676	W668-Q671 PolarHBondContact O-N 3.15Å; F669-Q671 PolarHBondContact O-N 3.04Å; Q671-S674 PolarHBondContact O-OG 3.44Å; Q671-N676 HydrophobicContact CG-CB 4.16Å; Q671-N676 PolarHBondContact O-N 3.32Å
672	Y	82.8	Confident	66.6	Low	38 Å²	38	94.8 Å²	94.8	15%	0.149	52%	0.521	C	S	.	.	H	α-helix	trans	-77.2	-42.7	173.2	-85.6	-121.2	0	0	0	110.7	H619 K622 W668 F669 S674 G675 V677	H619-Y672 AromaticContact CE1-CE1 4Å; H619-Y672 AromaticContact ND1-CE1 3.49Å; H619-Y672 WeakPolarHBondContact ND1-CE1 3.28Å; H619-Y672 AromaticContact ND1-CZ 3.67Å; H619-Y672 PolarHBondContact ND1-OH 3.32Å; H619-Y672 VanDerWaalsContact ND1-OH 3.12Å; K622-Y672 HydrophobicContact CB-CD1 3.67Å; K622-Y672 HydrophobicContact CB-CE1 3.36Å; K622-Y672 HydrophobicContact CB-CE2 4.46Å; K622-Y672 HydrophobicContact CB-CG 4.37Å; K622-Y672 HydrophobicContact CD-CE1 4.12Å; K622-Y672 HydrophobicContact CD-CE2 3.91Å; K622-Y672 HydrophobicContact CG-CE1 4.42Å; W668-Y672 HydrophobicContact CE3-CD2 4.17Å; W668-Y672 HydrophobicContact CE3-CG 4.32Å; W668-Y672 WeakPolarHBondContact O-CD2 3.5Å; W668-Y672 PolarHBondContact O-N 3.04Å; W668-Y672 VanDerWaalsContact O-N 3.1Å; F669-Y672 PolarHBondContact O-N 3.28Å; Y672-S674 VanDerWaalsContact C-N 3.27Å; Y672-S674 PolarHBondContact O-N 3.08Å; Y672-G675 PolarHBondContact O-N 2.91Å; Y672-V677 HydrophobicContact CD1-CG2 3.8Å; Y672-V677 HydrophobicContact CD2-CG1 3.91Å; Y672-V677 HydrophobicContact CD2-CG2 4.03Å; Y672-V677 HydrophobicContact CE1-CG2 3.99Å; Y672-V677 HydrophobicContact CE2-CB 4.35Å; Y672-V677 HydrophobicContact CE2-CG1 3.55Å; Y672-V677 HydrophobicContact CE2-CG2 4.2Å; Y672-V677 HydrophobicContact CG-CG2 3.8Å
673	Q	78.1	Confident	64.2	Low	121 Å²	121	89.8 Å²	89.8	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-63.1	-29	177.8	-167.2	-178.7	15.2	0	0	113.4	V626 F669 G675	V626-Q673 HydrophobicContact CG1-CB 4.07Å; V626-Q673 HydrophobicContact CG1-CG 4.44Å; F669-Q673 HydrophobicContact CE1-CB 4.49Å; F669-Q673 WeakPolarHBondContact O-CB 3.4Å; F669-Q673 PolarHBondContact O-N 2.82Å; Q673-G675 VanDerWaalsContact C-N 3.28Å; Q673-G675 PolarHBondContact O-N 3.16Å
674	S	69.9	Low	61.7	Low	70 Å²	70	89.9 Å²	89.9	49%	0.49	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	10.5	174.6	52.1	0	0	0	0	114.4	F670 Q671 Y672 N676	F670-S674 WeakPolarHBondContact O-CB 3.39Å; F670-S674 PolarHBondContact O-N 3.24Å; F670-S674 PolarHBondContact O-OG 2.84Å; Q671-S674 PolarHBondContact O-OG 3.44Å; Y672-S674 VanDerWaalsContact C-N 3.27Å; Y672-S674 PolarHBondContact O-N 3.08Å; S674-N676 VanDerWaalsContact C-N 3.28Å; S674-N676 PolarHBondContact O-N 3.04Å
675	G	55.6	Low	59.6	Low	59 Å²	59	91 Å²	91	61%	0.608	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.9	13.4	174.5	0	0	0	0	0	115.1	Y672 Q673 V677	Y672-G675 PolarHBondContact O-N 2.91Å; Q673-G675 VanDerWaalsContact C-N 3.28Å; Q673-G675 PolarHBondContact O-N 3.16Å; G675-V677 PolarHBondContact O-N 2.83Å
676	N	48.1	Very low	57.4	Low	75 Å²	75	89 Å²	89	40%	0.401	56%	0.563	S	S	.	*			trans	-86	38.6	-172.1	-160.7	99.6	0	0	0	112.9	Q671 S674	Q671-N676 HydrophobicContact CG-CB 4.16Å; Q671-N676 PolarHBondContact O-N 3.32Å; S674-N676 VanDerWaalsContact C-N 3.28Å; S674-N676 PolarHBondContact O-N 3.04Å
677	V	50.1	Low	54.8	Low	46 Å²	46	92.7 Å²	92.7	28%	0.279	60%	0.604	S	S	.	*			trans	-149.8	70	-176.5	-77.5	0	0	0	0	112.6	Y672 G675 G679	Y672-V677 HydrophobicContact CD1-CG2 3.8Å; Y672-V677 HydrophobicContact CD2-CG1 3.91Å; Y672-V677 HydrophobicContact CD2-CG2 4.03Å; Y672-V677 HydrophobicContact CE1-CG2 3.99Å; Y672-V677 HydrophobicContact CE2-CB 4.35Å; Y672-V677 HydrophobicContact CE2-CG1 3.55Å; Y672-V677 HydrophobicContact CE2-CG2 4.2Å; Y672-V677 HydrophobicContact CG-CG2 3.8Å; G675-V677 PolarHBondContact O-N 2.83Å; V677-G679 PolarHBondContact O-N 3.45Å
678	E	41.9	Very low	52.5	Low	198 Å²	198	87.8 Å²	87.8	93%	0.925	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-66.9	119.2	165.8	-66.8	177.5	151.2	0	0	110.1
679	G	37.3	Very low	50	Low	49 Å²	49	94.9 Å²	94.9	51%	0.505	64%	0.636	S	S	.	*	P	Polyproline II helix	trans	-96.6	144.2	162.7	0	0	0	0	0	109.7	V677	V677-G679 PolarHBondContact O-N 3.45Å
680	P	55.3	Low	47.3	Very low	135 Å²	135	101.1 Å²	101.1	88%	0.877	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-86.8	126.8	-172.3	32.6	-33.2	0	0	0	112.9
681	S	36.3	Very low	44.8	Very low	104 Å²	104	99.2 Å²	99.2	73%	0.727	69%	0.69	S	S	*	*			trans	-150.1	127.2	152.8	-142	0	0	0	0	112.8
682	E	33.3	Very low	42.4	Very low	191 Å²	191	99.7 Å²	99.7	89%	0.893	72%	0.716	S	S	*	*			trans	27.8	127.1	149.4	-59	179.1	118.7	0	0	121.8
683	G	30.4	Very low	39.8	Very low	82 Å²	82	102.1 Å²	102.1	85%	0.845	75%	0.752	S	S	*	*			trans	-169.8	18	173.4	0	0	0	0	0	117.3
684	G	29.1	Very low	37.5	Very low	83 Å²	83	99.8 Å²	99.8	86%	0.856	76%	0.761	S	S	*	*			trans	78.5	161.8	-178.6	0	0	0	0	0	115.4
685	G	30	Very low	36	Very low	87 Å²	87	108.7 Å²	108.7	90%	0.897	78%	0.784	S	S	*	*			cis	166.2	111.3	-10.2	0	0	0	0	0	113.4
686	G	28.6	Very low	35	Very low	82 Å²	82	116 Å²	116	85%	0.845	80%	0.799	S	S	*	*			trans	151.5	137.2	167.8	0	0	0	0	0	116.7
687	G	28.8	Very low	34.4	Very low	88 Å²	88	123.8 Å²	123.8	91%	0.907	82%	0.823	S	S	*	*			trans	66.2	89.2	156	0	0	0	0	0	118.6
688	G	31.7	Very low	33.8	Very low	76 Å²	76	133.8 Å²	133.8	78%	0.784	86%	0.855	S	S	*	*			trans	-106.2	169.6	173.9	0	0	0	0	0	115
689	K	33.9	Very low	33.2	Very low	198 Å²	198	128 Å²	128	86%	0.861	85%	0.849	S	S	*	*			trans	-158.3	114.3	157.3	-112.7	166.9	-173.7	176.2	0	112.8
690	T	30.1	Very low	33.2	Very low	142 Å²	142	136.7 Å²	136.7	87%	0.871	87%	0.866	S	S	*	*			trans	30.2	114.6	147	55.5	0	0	0	0	120.5
691	G	29.2	Very low	32.1	Very low	82 Å²	82	136.8 Å²	136.8	85%	0.845	86%	0.859	S	S	*	*			trans	-165.1	120.5	161.7	0	0	0	0	0	112.2
692	G	29.2	Very low	32	Very low	87 Å²	87	143.1 Å²	143.1	90%	0.897	87%	0.867	S	S	*	*			trans	-71.8	144.8	-172.1	0	0	0	0	0	114.8
693	G	29.7	Very low	31.7	Very low	89 Å²	89	137.8 Å²	137.8	92%	0.918	86%	0.864	S	S	*	*			trans	-80.5	154.4	-176.4	0	0	0	0	0	115.2
694	G	28.8	Very low	31.9	Very low	73 Å²	73	146.9 Å²	146.9	75%	0.753	87%	0.873	S	S	*	*			trans	-151.8	70.7	-178.4	0	0	0	0	0	114.3	K696	G694-K696 PolarHBondContact O-N 2.66Å
695	R	38.4	Very low	31.9	Very low	257 Å²	257	146.7 Å²	146.7	97%	0.97	87%	0.87	S	S	*	*			trans	-66.3	81.4	177.9	-71.7	-178.8	173.6	177.5	-1.6	112.4
696	K	34.7	Very low	32.1	Very low	212 Å²	212	154.6 Å²	154.6	92%	0.922	87%	0.873	S	S	*	*			trans	-76.7	130.1	172.5	-106.1	178.1	-179.9	174.2	0	112	G694	G694-K696 PolarHBondContact O-N 2.66Å
697	R	34.8	Very low	32.2	Very low	239 Å²	239	156.6 Å²	156.6	90%	0.902	87%	0.874	S	S	*	*			trans	-67.6	154.7	-163.9	-63.7	172.7	168.6	-150.9	-3.5	113.6	G699	R697-G699 PolarHBondContact O-N 3.29Å; R697-G699 VanDerWaalsContact O-N 3.09Å
698	R	38.8	Very low	32.5	Very low	256 Å²	256	162.3 Å²	162.3	97%	0.966	87%	0.874	S	S	*	*			trans	-58.6	108.8	158.8	-74.5	178.8	172.3	170	-2.8	109.8
699	G	28	Very low	32.6	Very low	76 Å²	76	165.3 Å²	165.3	78%	0.784	88%	0.878	S	S	*	*			trans	-78.4	140	167.9	0	0	0	0	0	111.8	R697	R697-G699 PolarHBondContact O-N 3.29Å; R697-G699 VanDerWaalsContact O-N 3.09Å
700	R	38.6	Very low	32.4	Very low	232 Å²	232	165.8 Å²	165.8	88%	0.875	87%	0.874	S	S	*	*			trans	-124.3	126.8	158.2	-76	-177.3	174.4	177.6	-1.5	107.6
701	N	30.9	Very low	32.5	Very low	137 Å²	137	167.1 Å²	167.1	73%	0.733	87%	0.868	S	S	*	*				173.8	144.4	120.1	-89.6	-14	0	0	0	113.1
702	R	35	Very low	32.6	Very low	237 Å²	237	171.7 Å²	171.7	89%	0.894	87%	0.867	S	S	*	*			trans	37.6	122.1	141.9	-59.1	176	176.9	168.1	-1.7	119.7
703	G	27	Very low	33.4	Very low	79 Å²	79	171.9 Å²	171.9	81%	0.814	85%	0.853	S	S	*	*			trans	-179.2	113.6	156.2	0	0	0	0	0	112.2
704	W	33.9	Very low	33.4	Very low	273 Å²	273	177.1 Å²	177.1	100%	1.034	85%	0.85	S	S	*	*			trans	-81.4	137.8	158.5	-92.2	-10	0	0	0	108.1
705	G	28.9	Very low	33.4	Very low	78 Å²	78	185 Å²	185	80%	0.804	86%	0.857	S	S	*	*			trans	-168.2	106.6	175.3	0	0	0	0	0	111.7
706	R	34.9	Very low	33	Very low	253 Å²	253	178.6 Å²	178.6	96%	0.955	85%	0.851	S	S	*	*			trans	-83.8	136.1	164.7	-75.1	-179.3	168.8	-162.3	-1.1	108.8
707	S	30.3	Very low	32.6	Very low	125 Å²	125	174.5 Å²	174.5	87%	0.874	85%	0.85	S	S	*	*			trans	-155	146.9	151.6	-93.3	0	0	0	0	111
708	K	34.8	Very low	32.3	Very low	207 Å²	207	168.7 Å²	168.7	90%	0.9	85%	0.845	S	S	*	*			trans	-123.3	120.5	179.1	-74.9	-176.5	176.5	-178.2	0	109.7
709	T	34.4	Very low	31.8	Very low	140 Å²	140	161.7 Å²	161.7	86%	0.859	84%	0.836	S	S	*	*			trans	-152.4	150.5	160.8	35.4	0	0	0	0	108.2
710	R	30.6	Very low	31.8	Very low	207 Å²	207	163.4 Å²	163.4	78%	0.781	84%	0.836	S	S	*	*			cis	163.5	111.3	-39.4	163.9	174.7	156.1	139	-7.7	104.6
711	K	31.3	Very low	31.2	Very low	170 Å²	170	158.2 Å²	158.2	74%	0.739	84%	0.835	S	S	*	*			trans	71.9	127.5	173.7	-62.8	-176.5	178.1	-164.5	0	114.4
712	Q	32.4	Very low	31.2	Very low	179 Å²	179	155.3 Å²	155.3	84%	0.836	83%	0.83	S	S	*	*				84.9	155	53.5	-71.3	-110.8	-18.2	0	0	112.9
713	P	44.8	Very low	31	Very low	91 Å²	91	150.9 Å²	150.9	59%	0.591	82%	0.824	S	S	*	*			cis	-145.4	-171.8	-40.1	41.1	-23.2	0	0	0	114.9
714	K	30.1	Very low	31.5	Very low	199 Å²	199	153.1 Å²	153.1	87%	0.865	82%	0.822	S	S	*	*			trans	71.7	161	168.1	-58.4	178.4	-178.5	-175.4	0	114.8
715	R	29.2	Very low	31.5	Very low	239 Å²	239	149.6 Å²	149.6	90%	0.902	81%	0.814	S	S	*	*			cis	-129.4	163.4	12.3	-64.4	164.8	65	165.8	0.5	112.3
716	S	29.2	Very low	31.8	Very low	121 Å²	121	158 Å²	158	85%	0.846	82%	0.821	S	S	*	*			trans	-94.7	154.5	166.9	-36.8	0	0	0	0	111.4
717	S	26.9	Very low	31.6	Very low	127 Å²	127	150.9 Å²	150.9	89%	0.888	81%	0.81	S	S	*	*			trans	-155.9	147.4	162.8	51.7	0	0	0	0	110.4
718	S	28.4	Very low	32.2	Very low	116 Å²	116	150.5 Å²	150.5	81%	0.811	81%	0.805	S	S	*	*			trans	-121.9	142.4	-162.4	49.5	0	0	0	0	114.5
719	S	28.9	Very low	32.4	Very low	109 Å²	109	146.5 Å²	146.5	76%	0.762	80%	0.8	S	S	*	*			trans	-173.4	142	161	9	0	0	0	0	107.2
720	S	27	Very low	32.4	Very low	112 Å²	112	144.1 Å²	144.1	78%	0.783	79%	0.789	S	S	*	*			cis	62.3	113.9	36.5	77.8	0	0	0	0	113.6
721	S	27.1	Very low	33.1	Very low	124 Å²	124	143.1 Å²	143.1	87%	0.867	79%	0.79	S	S	*	*			cis	-158.4	-172.7	-2.7	-149.6	0	0	0	0	106.9
722	A	30.9	Very low	33.8	Very low	76 Å²	76	142.5 Å²	142.5	63%	0.628	79%	0.788	S	S	*	*			cis	-155.6	-162.2	8	0	0	0	0	0	111
723	D	29.5	Very low	34.5	Very low	144 Å²	144	141.5 Å²	141.5	77%	0.77	78%	0.781	S	S	*	*			trans	44	116.6	153	-84.2	-106.1	0	0	0	124.5
724	V	37.5	Very low	35.6	Very low	126 Å²	126	141.1 Å²	141.1	76%	0.764	77%	0.77	S	S	*	*			trans	47.5	93.6	131	-169.7	0	0	0	0	118.5
725	K	33.4	Very low	38	Very low	198 Å²	198	135.6 Å²	135.6	86%	0.861	75%	0.753	S	S	*	*				-151.3	134.9	109.4	-112.6	173.5	-174.4	177.6	0	112.1	S727	K725-S727 PolarHBondContact O-N 2.83Å
726	R	35.4	Very low	40.5	Very low	255 Å²	255	125 Å²	125	96%	0.962	72%	0.718	S	S	*	*			trans	-86.6	90.7	-169.4	-170.7	-177.3	-169.7	178.1	4.5	111.9
727	S	31.3	Very low	43	Very low	103 Å²	103	125.5 Å²	125.5	72%	0.72	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-78.8	144.5	169.4	-63.4	0	0	0	0	111.6	K725	K725-S727 PolarHBondContact O-N 2.83Å
728	P	42.8	Very low	45.8	Very low	118 Å²	118	122.8 Å²	122.8	77%	0.766	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-74	142.9	-178	29.8	-34.8	0	0	0	112.1
729	P	40.1	Very low	48.6	Very low	123 Å²	123	118.7 Å²	118.7	80%	0.799	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-71.1	138.8	176.3	29.5	-34	0	0	0	111.3	K731	P729-K731 PolarHBondContact O-N 3.3Å
730	S	33.7	Very low	51.5	Low	90 Å²	90	113.5 Å²	113.5	63%	0.629	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-54.3	129.2	174.5	59.1	0	0	0	0	111.7	K732	S730-K732 VanDerWaalsContact C-N 3.32Å; S730-K732 PolarHBondContact O-N 3.14Å
731	K	45.5	Very low	54.4	Low	185 Å²	185	112 Å²	112	80%	0.804	59%	0.586	S	S	*	*			trans	-62.2	88.2	172.1	-79.7	-177.1	175.9	175.9	0	111.2	P729	P729-K731 PolarHBondContact O-N 3.3Å
732	K	45.8	Very low	57.2	Low	157 Å²	157	111.2 Å²	111.2	68%	0.683	57%	0.569	S	S	*	*			trans	-71.1	152.7	157.6	-63.5	172.9	-175.1	172.2	0	107.8	S730 K734	S730-K732 VanDerWaalsContact C-N 3.32Å; S730-K732 PolarHBondContact O-N 3.14Å; K732-K734 PolarHBondContact O-N 3.23Å
733	F	46.3	Very low	60	Low	158 Å²	158	108.3 Å²	108.3	69%	0.693	54%	0.542	S	S	*	.			trans	-64	107.7	167.8	-82.3	-92.6	0	0	0	108.1	T735	F733-T735 PolarHBondContact O-N 3.31Å; F733-T735 VanDerWaalsContact O-N 3.15Å
734	K	68.3	Low	62.7	Low	84 Å²	84	102 Å²	102	37%	0.365	51%	0.508	S	S	.	.			trans	-54.2	116.7	-178.8	-139.8	72	169.8	-80.4	0	108.4	K732 E738 I739 E742	K732-K734 PolarHBondContact O-N 3.23Å; K734-E738 WeakPolarHBondContact CA-OE2 3.41Å; K734-E738 HydrophobicContact CD-CG 3.86Å; K734-E738 HydrophobicContact CG-CB 4.23Å; K734-E738 HydrophobicContact CG-CG 3.95Å; K734-I739 HydrophobicContact CB-CD1 4.2Å; K734-I739 HydrophobicContact CB-CG1 3.74Å; K734-I739 HydrophobicContact CG-CG1 3.69Å; K734-E742 IonicContact NZ-OE1 2.82Å; K734-E742 PolarHBondContact NZ-OE1 2.82Å; K734-E742 IonicContact NZ-OE2 3.34Å; K734-E742 PolarHBondContact NZ-OE2 3.38Å
735	T	80.4	Confident	65	Low	82 Å²	82	100.8 Å²	100.8	50%	0.503	50%	0.496	S	S	.	.			trans	-71.3	158.5	179.3	65.3	0	0	0	0	110.5	F733 R737 E738 I739	F733-T735 PolarHBondContact O-N 3.31Å; F733-T735 VanDerWaalsContact O-N 3.15Å; T735-R737 VanDerWaalsContact C-N 3.28Å; T735-R737 PolarHBondContact O-N 2.87Å; T735-E738 PolarHBondContact N-OE2 2.74Å; T735-E738 CarbonylContact O-C 3.38Å; T735-E738 WeakPolarHBondContact O-CA 3.4Å; T735-E738 WeakPolarHBondContact O-CB 3.3Å; T735-E738 PolarHBondContact O-N 2.78Å; T735-E738 VanDerWaalsContact OG1-CB 3.27Å; T735-E738 WeakPolarHBondContact OG1-CB 3.28Å; T735-E738 PolarHBondContact OG1-N 2.86Å; T735-I739 PolarHBondContact O-N 2.73Å
736	G	81.1	Confident	67.4	Low	17 Å²	17	98.2 Å²	98.2	18%	0.175	49%	0.485	C	S	.	.	H	α-helix	trans	-52.3	-45.4	179	0	0	0	0	0	112.8	E738 I739 L740	G736-E738 VanDerWaalsContact C-N 3.29Å; G736-E738 PolarHBondContact O-N 2.86Å; G736-I739 PolarHBondContact O-N 2.87Å; G736-L740 VanDerWaalsContact O-CG 3.3Å; G736-L740 WeakPolarHBondContact O-CG 3.31Å; G736-L740 PolarHBondContact O-N 3.43Å
737	R	82.9	Confident	69.5	Low	131 Å²	131	89.5 Å²	89.5	49%	0.494	46%	0.455	S	S	.	.	H	α-helix	trans	-65	-27.1	174.3	-68.4	-174.8	176.1	-175.9	-1.7	114.2	T735 K741 E789	T735-R737 VanDerWaalsContact C-N 3.28Å; T735-R737 PolarHBondContact O-N 2.87Å; R737-K741 VanDerWaalsContact O-CB 3.29Å; R737-K741 WeakPolarHBondContact O-CB 3.45Å; R737-K741 PolarHBondContact O-N 3.09Å; R737-E789 IonicContact CZ-OE1 3.47Å; R737-E789 IonicContact NH1-OE1 3.7Å; R737-E789 PolarHBondContact NH1-OE1 3.27Å; R737-E789 IonicContact NH1-OE2 3.15Å; R737-E789 PolarHBondContact NH1-OE2 2.94Å
738	E	86.5	Confident	71.7	Confident	71 Å²	71	90.5 Å²	90.5	33%	0.332	45%	0.448	S	S	.	.	H	α-helix	trans	-80.9	-31.2	178	-169.6	-177.2	-178.9	0	0	112.1	K734 T735 G736 E742	K734-E738 WeakPolarHBondContact CA-OE2 3.41Å; K734-E738 HydrophobicContact CD-CG 3.86Å; K734-E738 HydrophobicContact CG-CB 4.23Å; K734-E738 HydrophobicContact CG-CG 3.95Å; T735-E738 PolarHBondContact N-OE2 2.74Å; T735-E738 CarbonylContact O-C 3.38Å; T735-E738 WeakPolarHBondContact O-CA 3.4Å; T735-E738 WeakPolarHBondContact O-CB 3.3Å; T735-E738 PolarHBondContact O-N 2.78Å; T735-E738 VanDerWaalsContact OG1-CB 3.27Å; T735-E738 WeakPolarHBondContact OG1-CB 3.28Å; T735-E738 PolarHBondContact OG1-N 2.86Å; G736-E738 VanDerWaalsContact C-N 3.29Å; G736-E738 PolarHBondContact O-N 2.86Å; E738-E742 WeakPolarHBondContact O-CB 3.14Å; E738-E742 PolarHBondContact O-N 3.45Å
739	I	87.1	Confident	73.5	Confident	29 Å²	29	91.3 Å²	91.3	15%	0.149	44%	0.44	C	S	.	.	H	α-helix	trans	-68.6	-45.1	168.8	-63.6	168.3	0	0	0	109.9	K734 T735 G736 K741 E742 Y743 L758 K761 T762	K734-I739 HydrophobicContact CB-CD1 4.2Å; K734-I739 HydrophobicContact CB-CG1 3.74Å; K734-I739 HydrophobicContact CG-CG1 3.69Å; T735-I739 PolarHBondContact O-N 2.73Å; G736-I739 PolarHBondContact O-N 2.87Å; I739-K741 VanDerWaalsContact C-N 3.34Å; I739-K741 PolarHBondContact O-N 3.06Å; I739-E742 PolarHBondContact O-N 3.5Å; I739-Y743 PolarHBondContact O-N 3.05Å; I739-L758 HydrophobicContact CG2-CD1 4.05Å; I739-K761 HydrophobicContact CD1-CB 4.44Å; I739-K761 WeakPolarHBondContact CD1-O 3.42Å; I739-K761 HydrophobicContact CG2-CB 4.03Å; I739-T762 HydrophobicContact CB-CG2 4Å; I739-T762 HydrophobicContact CG2-CG2 3.84Å
740	L	89.1	Confident	75.6	Confident	0 Å²	0	87 Å²	87	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-59	-44.4	173.5	-70.1	167	0	0	0	111.5	G736 Y743 Y744 L758 T762 M764 V769 W772 F773	G736-L740 VanDerWaalsContact O-CG 3.3Å; G736-L740 WeakPolarHBondContact O-CG 3.31Å; G736-L740 PolarHBondContact O-N 3.43Å; L740-Y743 PolarHBondContact O-N 3.36Å; L740-Y744 WeakPolarHBondContact O-CB 3.23Å; L740-Y744 PolarHBondContact O-N 3.48Å; L740-L758 HydrophobicContact CD2-CD1 4.43Å; L740-L758 HydrophobicContact CD2-CD2 3.78Å; L740-L758 HydrophobicContact CD2-CG 3.82Å; L740-T762 HydrophobicContact CD1-CG2 4.32Å; L740-T762 HydrophobicContact CD2-CG2 3.97Å; L740-T762 HydrophobicContact CG-CG2 3.7Å; L740-M764 HydrophobicContact CD1-CE 3.59Å; L740-M764 HydrophobicContact CD1-SD 3.6Å; L740-V769 HydrophobicContact CD2-CB 4.48Å; L740-V769 HydrophobicContact CD2-CG1 3.85Å; L740-V769 HydrophobicContact CD2-CG2 4.23Å; L740-W772 HydrophobicContact CB-CD2 3.78Å; L740-W772 HydrophobicContact CB-CE3 3.71Å; L740-W772 HydrophobicContact CB-CH2 3.75Å; L740-W772 HydrophobicContact CB-CZ2 3.78Å; L740-W772 HydrophobicContact CB-CZ3 3.71Å; L740-W772 HydrophobicContact CD1-CB 4.15Å; L740-W772 HydrophobicContact CD1-CD2 3.85Å; L740-W772 HydrophobicContact CD1-CE3 4.29Å; L740-W772 HydrophobicContact CD1-CG 3.78Å; L740-W772 HydrophobicContact CD2-CE3 4.26Å; L740-W772 HydrophobicContact CG-CD2 4.29Å; L740-W772 HydrophobicContact CG-CE3 4.3Å; L740-W772 WeakPolarHBondContact O-CH2 3.23Å; L740-F773 HydrophobicContact CD2-CD2 4.44Å; L740-F773 HydrophobicContact CD2-CE2 3.63Å; L740-F773 HydrophobicContact CD2-CZ 4.39Å
741	K	86.9	Confident	77.9	Confident	80 Å²	80	84.2 Å²	84.2	35%	0.348	39%	0.391	S	S	.	.	H	α-helix	trans	-61.1	-42.8	174.1	-179.5	164.5	-175.7	167.3	0	112.8	R737 I739 Y743 Y744 L745 W772 F787	R737-K741 VanDerWaalsContact O-CB 3.29Å; R737-K741 WeakPolarHBondContact O-CB 3.45Å; R737-K741 PolarHBondContact O-N 3.09Å; I739-K741 VanDerWaalsContact C-N 3.34Å; I739-K741 PolarHBondContact O-N 3.06Å; K741-Y743 VanDerWaalsContact C-N 3.35Å; K741-Y744 PolarHBondContact O-N 2.87Å; K741-L745 HydrophobicContact CG-CD1 3.95Å; K741-L745 WeakPolarHBondContact O-CB 3.4Å; K741-L745 WeakPolarHBondContact O-CD1 3.21Å; K741-L745 PolarHBondContact O-N 2.78Å; K741-W772 HydrophobicContact CB-CH2 4.49Å; K741-W772 HydrophobicContact CB-CZ2 4.38Å; K741-F787 HydrophobicContact CB-CD1 4.41Å; K741-F787 HydrophobicContact CB-CE1 4.47Å; K741-F787 HydrophobicContact CD-CB 4.13Å; K741-F787 HydrophobicContact CD-CD1 3.49Å; K741-F787 VanDerWaalsContact CD-CD1 3.49Å; K741-F787 HydrophobicContact CD-CD2 4.45Å; K741-F787 HydrophobicContact CD-CE1 3.99Å; K741-F787 HydrophobicContact CD-CG 3.75Å; K741-F787 HydrophobicContact CG-CD1 3.72Å; K741-F787 HydrophobicContact CG-CE1 3.72Å; K741-F787 HydrophobicContact CG-CG 4.41Å; K741-F787 HydrophobicContact CG-CZ 4.42Å; K741-F787 VanDerWaalsContact NZ-CD2 3.3Å
742	E	87.3	Confident	79.8	Confident	108 Å²	108	80.5 Å²	80.5	51%	0.505	38%	0.376	S	S	.	.	H	α-helix	trans	-65.3	-37	176.9	179.5	164.6	-109.9	0	0	112.6	K734 E738 I739 K746	K734-E742 IonicContact NZ-OE1 2.82Å; K734-E742 PolarHBondContact NZ-OE1 2.82Å; K734-E742 IonicContact NZ-OE2 3.34Å; K734-E742 PolarHBondContact NZ-OE2 3.38Å; E738-E742 WeakPolarHBondContact O-CB 3.14Å; E738-E742 PolarHBondContact O-N 3.45Å; I739-E742 PolarHBondContact O-N 3.5Å; E742-K746 WeakPolarHBondContact O-CB 3.37Å; E742-K746 PolarHBondContact O-N 3.49Å
743	Y	89.4	Confident	81.6	Confident	16 Å²	16	80.8 Å²	80.8	6%	0.063	38%	0.38	C	S	.	.	H	α-helix	trans	-67.4	-47.8	172.7	-176.1	-77.9	0	0	0	111.5	I739 L740 K741 L745 K746 H747 F749 S751 D754 L758 F773	I739-Y743 PolarHBondContact O-N 3.05Å; L740-Y743 PolarHBondContact O-N 3.36Å; K741-Y743 VanDerWaalsContact C-N 3.35Å; Y743-L745 VanDerWaalsContact C-N 3.34Å; Y743-L745 PolarHBondContact O-N 3.2Å; Y743-K746 WeakPolarHBondContact O-CA 3.46Å; Y743-K746 WeakPolarHBondContact O-CB 3.38Å; Y743-K746 PolarHBondContact O-N 3.07Å; Y743-H747 HydrophobicContact CD1-CB 4.27Å; Y743-H747 AromaticContact CD1-CD2 3.88Å; Y743-H747 AromaticContact CD2-CD2 3.59Å; Y743-H747 AromaticContact CD2-NE2 3.29Å; Y743-H747 VanDerWaalsContact CD2-NE2 3.29Å; Y743-H747 WeakPolarHBondContact CD2-NE2 3.46Å; Y743-H747 HydrophobicContact CE1-CB 3.79Å; Y743-H747 AromaticContact CE1-CD2 3.65Å; Y743-H747 AromaticContact CE1-CG 3.97Å; Y743-H747 AromaticContact CE2-CD2 3.32Å; Y743-H747 WeakPolarHBondContact CE2-CD2 3.33Å; Y743-H747 AromaticContact CE2-NE2 2.74Å; Y743-H747 WeakPolarHBondContact CE2-NE2 3.3Å; Y743-H747 AromaticContact CG-CD2 3.85Å; Y743-H747 AromaticContact CZ-CD2 3.35Å; Y743-H747 AromaticContact CZ-CG 3.81Å; Y743-H747 AromaticContact CZ-NE2 3.4Å; Y743-H747 PolarHBondContact O-N 2.82Å; Y743-F749 WeakPolarHBondContact CE1-O 3.31Å; Y743-S751 WeakPolarHBondContact OH-CB 3.19Å; Y743-S751 PolarHBondContact OH-N 2.77Å; Y743-D754 HydrophobicContact CE2-CB 3.61Å; Y743-D754 VanDerWaalsContact CE2-OD2 3.24Å; Y743-D754 WeakPolarHBondContact CE2-OD2 3.45Å; Y743-D754 VanDerWaalsContact CZ-OD2 3.31Å; Y743-D754 WeakPolarHBondContact OH-CB 3.38Å; Y743-D754 PolarHBondContact OH-OD2 2.84Å; Y743-L758 HydrophobicContact CD1-CD2 4Å; Y743-L758 HydrophobicContact CD2-CD1 3.89Å; Y743-L758 HydrophobicContact CD2-CD2 4.08Å; Y743-L758 HydrophobicContact CE1-CD2 4.36Å; Y743-L758 HydrophobicContact CE2-CD2 4.46Å; Y743-L758 HydrophobicContact CG-CD1 3.98Å; Y743-L758 HydrophobicContact CG-CD2 3.85Å; Y743-F773 AromaticContact CD1-CE1 3.94Å; Y743-F773 HydrophobicContact CD1-CE1 3.94Å; Y743-F773 AromaticContact CD1-CZ 3.52Å; Y743-F773 HydrophobicContact CD1-CZ 3.52Å; Y743-F773 HydrophobicContact CE1-CE1 4.3Å; Y743-F773 HydrophobicContact CE1-CZ 4.05Å; Y743-F773 HydrophobicContact CG-CZ 4.39Å
744	Y	86.2	Confident	83.6	Confident	11 Å²	11	75 Å²	75	4%	0.043	36%	0.356	C	S	.	.	H	α-helix	trans	-61.6	-39.6	179.4	-177	-93	0	0	0	112.2	L740 K741 K746 H748 W772 F773 V776 F787	L740-Y744 WeakPolarHBondContact O-CB 3.23Å; L740-Y744 PolarHBondContact O-N 3.48Å; K741-Y744 PolarHBondContact O-N 2.87Å; Y744-K746 PolarHBondContact O-N 3.48Å; Y744-H748 WeakPolarHBondContact CE2-O 3.31Å; Y744-H748 VanDerWaalsContact O-CA 3.28Å; Y744-H748 WeakPolarHBondContact O-CA 3.48Å; Y744-H748 PolarHBondContact O-N 2.93Å; Y744-W772 HydrophobicContact CG-CH2 4.43Å; Y744-W772 HydrophobicContact CG-CZ3 4.45Å; Y744-F773 AromaticContact CD2-CD1 3.78Å; Y744-F773 HydrophobicContact CD2-CD1 3.78Å; Y744-F773 AromaticContact CD2-CE1 3.75Å; Y744-F773 HydrophobicContact CD2-CE1 3.75Å; Y744-F773 HydrophobicContact CG-CE1 4.35Å; Y744-V776 HydrophobicContact CD1-CG1 4.1Å; Y744-V776 HydrophobicContact CD2-CG1 3.83Å; Y744-V776 HydrophobicContact CE1-CG1 3.76Å; Y744-V776 HydrophobicContact CE2-CG1 3.48Å; Y744-V776 VanDerWaalsContact CE2-CG1 3.48Å; Y744-V776 HydrophobicContact CG-CG1 4.13Å; Y744-V776 VanDerWaalsContact CZ-CG1 3.45Å; Y744-F787 AromaticContact CD1-CE1 3.78Å; Y744-F787 HydrophobicContact CD1-CE1 3.78Å; Y744-F787 AromaticContact CD1-CZ 3.69Å; Y744-F787 HydrophobicContact CD1-CZ 3.69Å; Y744-F787 HydrophobicContact CE1-CE1 4.29Å; Y744-F787 AromaticContact CE1-CZ 3.95Å; Y744-F787 HydrophobicContact CE1-CZ 3.95Å
745	L	85.8	Confident	84.5	Confident	101 Å²	101	71 Å²	71	53%	0.529	34%	0.339	S	S	.	.	H	α-helix	trans	-64.4	-15.5	172.6	-101.3	71.8	0	0	0	114.4	K741 Y743 F787	K741-L745 HydrophobicContact CG-CD1 3.95Å; K741-L745 WeakPolarHBondContact O-CB 3.4Å; K741-L745 WeakPolarHBondContact O-CD1 3.21Å; K741-L745 PolarHBondContact O-N 2.78Å; Y743-L745 VanDerWaalsContact C-N 3.34Å; Y743-L745 PolarHBondContact O-N 3.2Å; L745-F787 HydrophobicContact CD1-CE1 3.93Å; L745-F787 HydrophobicContact CD1-CE2 3.92Å; L745-F787 HydrophobicContact CD1-CZ 3.33Å
746	K	84.1	Confident	84.9	Confident	143 Å²	143	71.7 Å²	71.7	62%	0.622	34%	0.339	S	S	*	.	H	α-helix	trans	-103.9	-29	-177.5	178	175.2	171.6	-69.1	0	113	E742 Y743 Y744	E742-K746 WeakPolarHBondContact O-CB 3.37Å; E742-K746 PolarHBondContact O-N 3.49Å; Y743-K746 WeakPolarHBondContact O-CA 3.46Å; Y743-K746 WeakPolarHBondContact O-CB 3.38Å; Y743-K746 PolarHBondContact O-N 3.07Å; Y744-K746 PolarHBondContact O-N 3.48Å
747	H	79.6	Confident	85.3	Confident	72 Å²	72	75.4 Å²	75.4	33%	0.333	35%	0.352	S	S	.	.	H	α-helix	trans	-123.1	-18.7	-173.1	-65.5	-90.1	0	0	0	114.4	Y743 F749 D754	Y743-H747 HydrophobicContact CD1-CB 4.27Å; Y743-H747 AromaticContact CD1-CD2 3.88Å; Y743-H747 AromaticContact CD2-CD2 3.59Å; Y743-H747 AromaticContact CD2-NE2 3.29Å; Y743-H747 VanDerWaalsContact CD2-NE2 3.29Å; Y743-H747 WeakPolarHBondContact CD2-NE2 3.46Å; Y743-H747 HydrophobicContact CE1-CB 3.79Å; Y743-H747 AromaticContact CE1-CD2 3.65Å; Y743-H747 AromaticContact CE1-CG 3.97Å; Y743-H747 AromaticContact CE2-CD2 3.32Å; Y743-H747 WeakPolarHBondContact CE2-CD2 3.33Å; Y743-H747 AromaticContact CE2-NE2 2.74Å; Y743-H747 WeakPolarHBondContact CE2-NE2 3.3Å; Y743-H747 AromaticContact CG-CD2 3.85Å; Y743-H747 AromaticContact CZ-CD2 3.35Å; Y743-H747 AromaticContact CZ-CG 3.81Å; Y743-H747 AromaticContact CZ-NE2 3.4Å; Y743-H747 PolarHBondContact O-N 2.82Å; H747-F749 WeakPolarHBondContact O-CD1 3.31Å; H747-F749 WeakPolarHBondContact O-CE1 3.14Å; H747-F749 PolarHBondContact O-N 2.81Å; H747-D754 IonicContact CE1-OD2 2.74Å; H747-D754 PolarHBondContact CE1-OD2 3.43Å; H747-D754 VanDerWaalsContact CE1-OD2 3.31Å; H747-D754 IonicContact NE2-OD2 3.98Å; H747-D754 PolarHBondContact NE2-OD2 3.14Å
748	H	77.9	Confident	85.6	Confident	125 Å²	125	69.3 Å²	69.3	58%	0.579	33%	0.329	S	S	*	.	S	Bend	trans	58.5	-21.4	-176.6	-70	-90.6	0	0	0	117.6	Y744	Y744-H748 WeakPolarHBondContact CE2-O 3.31Å; Y744-H748 VanDerWaalsContact O-CA 3.28Å; Y744-H748 WeakPolarHBondContact O-CA 3.48Å; Y744-H748 PolarHBondContact O-N 2.93Å
749	F	79.3	Confident	85.8	Confident	135 Å²	135	66.9 Å²	66.9	59%	0.592	32%	0.319	S	S	*	.	S	Bend	trans	-123.2	168.7	168.4	67	-85.4	0	0	0	110.3	Y743 H747	Y743-F749 WeakPolarHBondContact CE1-O 3.31Å; H747-F749 WeakPolarHBondContact O-CD1 3.31Å; H747-F749 WeakPolarHBondContact O-CE1 3.14Å; H747-F749 PolarHBondContact O-N 2.81Å
750	L	84.4	Confident	85.9	Confident	33 Å²	33	70.4 Å²	70.4	17%	0.173	34%	0.342	C	S	.	.			trans	-88.8	115.4	172.5	174.6	57.8	0	0	0	110	L755 L758 V769 R770 F773	L750-L755 HydrophobicContact CD1-CD1 4.3Å; L750-L755 HydrophobicContact CD2-CD1 4.27Å; L750-L758 HydrophobicContact CD1-CD2 3.95Å; L750-V769 HydrophobicContact CD1-CG1 4.22Å; L750-V769 HydrophobicContact CD2-CG1 4.29Å; L750-R770 HydrophobicContact CD2-CB 4.43Å; L750-R770 HydrophobicContact CD2-CG 3.77Å; L750-F773 HydrophobicContact CB-CB 4.21Å; L750-F773 HydrophobicContact CB-CD1 3.82Å; L750-F773 HydrophobicContact CB-CD2 3.98Å; L750-F773 HydrophobicContact CB-CE1 4.16Å; L750-F773 HydrophobicContact CB-CE2 4.33Å; L750-F773 HydrophobicContact CB-CG 3.74Å; L750-F773 HydrophobicContact CB-CZ 4.43Å; L750-F773 HydrophobicContact CD1-CD2 4.02Å; L750-F773 HydrophobicContact CD1-CE2 3.79Å; L750-F773 HydrophobicContact CD1-CZ 4.18Å; L750-F773 HydrophobicContact CD2-CB 4.39Å; L750-F773 HydrophobicContact CD2-CD2 3.87Å; L750-F773 HydrophobicContact CD2-CE2 4.47Å; L750-F773 HydrophobicContact CD2-CG 4.22Å; L750-F773 HydrophobicContact CG-CD2 4.18Å; L750-F773 HydrophobicContact CG-CE2 4.42Å; L750-F773 HydrophobicContact CG-CG 4.42Å
751	S	82.9	Confident	85.8	Confident	31 Å²	31	75.2 Å²	75.2	22%	0.217	36%	0.363	C	S	.	.			trans	-76.8	123.3	167.1	-174.9	0	0	0	0	110	Y743 Q753 D754 L755	Y743-S751 WeakPolarHBondContact OH-CB 3.19Å; Y743-S751 PolarHBondContact OH-N 2.77Å; S751-Q753 PolarHBondContact O-N 2.72Å; S751-Q753 PolarHBondContact OG-N 2.95Å; S751-D754 PolarHBondContact O-N 2.93Å; S751-D754 VanDerWaalsContact O-N 3.09Å; S751-L755 PolarHBondContact O-N 2.99Å
752	E	84.2	Confident	85.9	Confident	107 Å²	107	72 Å²	72	50%	0.5	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.6	170.6	-76.2	-72.9	140.9	0	0	112.2	L755 R770	E752-L755 WeakPolarHBondContact O-CB 3.42Å; E752-L755 PolarHBondContact O-N 3.23Å; E752-R770 VanDerWaalsContact CD-NH2 3.26Å; E752-R770 IonicContact OE1-CZ 3.72Å; E752-R770 IonicContact OE1-NE 2.73Å; E752-R770 PolarHBondContact OE1-NE 3.11Å; E752-R770 IonicContact OE1-NH2 2.69Å; E752-R770 PolarHBondContact OE1-NH2 3.31Å; E752-R770 VanDerWaalsContact OE1-NH2 3.08Å; E752-R770 IonicContact OE2-CZ 3.29Å; E752-R770 IonicContact OE2-NE 3.87Å; E752-R770 IonicContact OE2-NH2 2.7Å; E752-R770 PolarHBondContact OE2-NH2 2.9Å
753	Q	83.6	Confident	85.8	Confident	163 Å²	163	73.9 Å²	73.9	76%	0.762	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-27.2	176	-175.1	57.7	89.5	0	0	113.2	S751	S751-Q753 PolarHBondContact O-N 2.72Å; S751-Q753 PolarHBondContact OG-N 2.95Å
754	D	87.7	Confident	85.8	Confident	35 Å²	35	74.9 Å²	74.9	19%	0.187	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	-7.5	178.1	-61.4	-30.9	0	0	0	112.2	Y743 H747 S751 D756 E757 L758	Y743-D754 HydrophobicContact CE2-CB 3.61Å; Y743-D754 VanDerWaalsContact CE2-OD2 3.24Å; Y743-D754 WeakPolarHBondContact CE2-OD2 3.45Å; Y743-D754 VanDerWaalsContact CZ-OD2 3.31Å; Y743-D754 WeakPolarHBondContact OH-CB 3.38Å; Y743-D754 PolarHBondContact OH-OD2 2.84Å; H747-D754 IonicContact CE1-OD2 2.74Å; H747-D754 PolarHBondContact CE1-OD2 3.43Å; H747-D754 VanDerWaalsContact CE1-OD2 3.31Å; H747-D754 IonicContact NE2-OD2 3.98Å; H747-D754 PolarHBondContact NE2-OD2 3.14Å; S751-D754 PolarHBondContact O-N 2.93Å; S751-D754 VanDerWaalsContact O-N 3.09Å; D754-D756 PolarHBondContact O-N 3.16Å; D754-E757 WeakPolarHBondContact O-CB 3.43Å; D754-E757 PolarHBondContact O-N 2.86Å; D754-E757 VanDerWaalsContact O-N 3.1Å; D754-L758 WeakPolarHBondContact O-CB 3.4Å; D754-L758 PolarHBondContact O-N 3.1Å
755	L	88.1	Confident	85.9	Confident	2 Å²	2	76.4 Å²	76.4	1%	0.01	38%	0.382	C	S	.	.	H	α-helix	trans	-60.6	-44.9	-170.3	176	57	0	0	0	112.7	L750 S751 E752 E757 L758 V759 Y766 V769 R770	L750-L755 HydrophobicContact CD1-CD1 4.3Å; L750-L755 HydrophobicContact CD2-CD1 4.27Å; S751-L755 PolarHBondContact O-N 2.99Å; E752-L755 WeakPolarHBondContact O-CB 3.42Å; E752-L755 PolarHBondContact O-N 3.23Å; L755-E757 VanDerWaalsContact C-N 3.31Å; L755-E757 PolarHBondContact O-N 2.8Å; L755-L758 PolarHBondContact O-N 3.14Å; L755-V759 HydrophobicContact CD1-CG2 4.22Å; L755-V759 WeakPolarHBondContact O-CB 3.26Å; L755-V759 WeakPolarHBondContact O-CG2 3.46Å; L755-V759 PolarHBondContact O-N 2.98Å; L755-Y766 HydrophobicContact CD1-CD1 4.28Å; L755-Y766 HydrophobicContact CD2-CD1 3.96Å; L755-Y766 HydrophobicContact CG-CD1 3.77Å; L755-Y766 HydrophobicContact CG-CE1 4.16Å; L755-V769 HydrophobicContact CD1-CB 3.88Å; L755-V769 HydrophobicContact CD1-CG1 3.51Å; L755-R770 HydrophobicContact CD2-CG 4.37Å
756	D	89	Confident	86.1	Confident	96 Å²	96	76.4 Å²	76.4	51%	0.513	38%	0.375	S	S	.	.	H	α-helix	trans	-58.5	-41.6	173.9	-75.3	33.3	0	0	0	112.2	D754 T760 Y766	D754-D756 PolarHBondContact O-N 3.16Å; D756-T760 VanDerWaalsContact O-CB 3.31Å; D756-T760 WeakPolarHBondContact O-CB 3.39Å; D756-T760 PolarHBondContact O-N 3.18Å; D756-T760 PolarHBondContact O-OG1 3.07Å; D756-Y766 WeakPolarHBondContact OD1-CE1 3.2Å
757	E	89.6	Confident	86.4	Confident	94 Å²	94	76.8 Å²	76.8	44%	0.439	38%	0.379	S	S	.	.	H	α-helix	trans	-69.2	-38.5	178.7	-155.3	-148.2	-167.6	0	0	110.7	D754 L755 T760 K761	D754-E757 WeakPolarHBondContact O-CB 3.43Å; D754-E757 PolarHBondContact O-N 2.86Å; D754-E757 VanDerWaalsContact O-N 3.1Å; L755-E757 VanDerWaalsContact C-N 3.31Å; L755-E757 PolarHBondContact O-N 2.8Å; E757-T760 PolarHBondContact O-N 2.99Å; E757-K761 HydrophobicContact CG-CD 4.32Å; E757-K761 WeakPolarHBondContact O-CB 3.45Å; E757-K761 VanDerWaalsContact O-CG 3.25Å; E757-K761 WeakPolarHBondContact O-CG 3.13Å; E757-K761 PolarHBondContact O-N 3.07Å; E757-K761 WeakPolarHBondContact OE1-CE 3.3Å; E757-K761 IonicContact OE1-NZ 3.32Å; E757-K761 PolarHBondContact OE1-NZ 3.37Å; E757-K761 WeakPolarHBondContact OE2-CE 3.18Å; E757-K761 IonicContact OE2-NZ 3.67Å; E757-K761 PolarHBondContact OE2-NZ 3.1Å
758	L	89.4	Confident	86.9	Confident	3 Å²	3	77.8 Å²	77.8	2%	0.016	38%	0.384	C	S	.	.	H	α-helix	trans	-72.3	-40.9	-179.8	-156	58.6	0	0	0	111.4	I739 L740 Y743 L750 D754 L755 K761 T762 V769 F773	I739-L758 HydrophobicContact CG2-CD1 4.05Å; L740-L758 HydrophobicContact CD2-CD1 4.43Å; L740-L758 HydrophobicContact CD2-CD2 3.78Å; L740-L758 HydrophobicContact CD2-CG 3.82Å; Y743-L758 HydrophobicContact CD1-CD2 4Å; Y743-L758 HydrophobicContact CD2-CD1 3.89Å; Y743-L758 HydrophobicContact CD2-CD2 4.08Å; Y743-L758 HydrophobicContact CE1-CD2 4.36Å; Y743-L758 HydrophobicContact CE2-CD2 4.46Å; Y743-L758 HydrophobicContact CG-CD1 3.98Å; Y743-L758 HydrophobicContact CG-CD2 3.85Å; L750-L758 HydrophobicContact CD1-CD2 3.95Å; D754-L758 WeakPolarHBondContact O-CB 3.4Å; D754-L758 PolarHBondContact O-N 3.1Å; L755-L758 PolarHBondContact O-N 3.14Å; L758-K761 PolarHBondContact O-N 3.13Å; L758-T762 HydrophobicContact CD1-CG2 4.42Å; L758-T762 HydrophobicContact CG-CG2 4.39Å; L758-T762 VanDerWaalsContact O-CB 3.22Å; L758-T762 WeakPolarHBondContact O-CB 3.2Å; L758-T762 WeakPolarHBondContact O-CG2 3.4Å; L758-T762 PolarHBondContact O-N 2.88Å; L758-T762 PolarHBondContact O-OG1 3.1Å; L758-V769 HydrophobicContact CD2-CG1 4.04Å; L758-V769 HydrophobicContact CG-CG1 4.42Å; L758-F773 HydrophobicContact CD2-CE2 3.66Å; L758-F773 HydrophobicContact CD2-CZ 3.86Å
759	V	89.4	Confident	87.4	Confident	20 Å²	20	71.9 Å²	71.9	12%	0.121	36%	0.357	C	S	.	.	H	α-helix	trans	-55.4	-49.2	167.1	157.8	0	0	0	0	110.8	L755 K761 T762 N763 M764 Y766 V769	L755-V759 HydrophobicContact CD1-CG2 4.22Å; L755-V759 WeakPolarHBondContact O-CB 3.26Å; L755-V759 WeakPolarHBondContact O-CG2 3.46Å; L755-V759 PolarHBondContact O-N 2.98Å; V759-K761 PolarHBondContact O-N 3.17Å; V759-T762 PolarHBondContact O-N 3.46Å; V759-T762 PolarHBondContact O-OG1 3.47Å; V759-N763 WeakPolarHBondContact O-CA 3.39Å; V759-N763 PolarHBondContact O-N 3.09Å; V759-M764 WeakPolarHBondContact CG1-O 3.11Å; V759-Y766 HydrophobicContact CB-CE1 4.29Å; V759-Y766 HydrophobicContact CG1-CE1 4.45Å; V759-Y766 HydrophobicContact CG1-CE2 4.25Å; V759-Y766 HydrophobicContact CG2-CD1 3.71Å; V759-Y766 HydrophobicContact CG2-CE1 3.86Å; V759-Y766 HydrophobicContact CG2-CG 4.03Å; V759-V769 HydrophobicContact CG2-CB 4.42Å; V759-V769 HydrophobicContact CG2-CG2 3.8Å
760	T	89.3	Confident	87.9	Confident	103 Å²	103	71 Å²	71	63%	0.632	35%	0.349	S	S	*	.	H	α-helix	trans	-63.9	-42.2	-179.2	-59.6	0	0	0	0	112.5	D756 E757 N763	D756-T760 VanDerWaalsContact O-CB 3.31Å; D756-T760 WeakPolarHBondContact O-CB 3.39Å; D756-T760 PolarHBondContact O-N 3.18Å; D756-T760 PolarHBondContact O-OG1 3.07Å; E757-T760 PolarHBondContact O-N 2.99Å; T760-N763 PolarHBondContact O-ND2 3.25Å
761	K	86.8	Confident	88.2	Confident	102 Å²	102	75.9 Å²	75.9	44%	0.443	37%	0.372	S	S	.	.	H	α-helix	trans	-69.5	-42.3	177.4	-74.7	169.7	174.8	173.2	0	112.5	I739 E757 L758 V759	I739-K761 HydrophobicContact CD1-CB 4.44Å; I739-K761 WeakPolarHBondContact CD1-O 3.42Å; I739-K761 HydrophobicContact CG2-CB 4.03Å; E757-K761 HydrophobicContact CG-CD 4.32Å; E757-K761 WeakPolarHBondContact O-CB 3.45Å; E757-K761 VanDerWaalsContact O-CG 3.25Å; E757-K761 WeakPolarHBondContact O-CG 3.13Å; E757-K761 PolarHBondContact O-N 3.07Å; E757-K761 WeakPolarHBondContact OE1-CE 3.3Å; E757-K761 IonicContact OE1-NZ 3.32Å; E757-K761 PolarHBondContact OE1-NZ 3.37Å; E757-K761 WeakPolarHBondContact OE2-CE 3.18Å; E757-K761 IonicContact OE2-NZ 3.67Å; E757-K761 PolarHBondContact OE2-NZ 3.1Å; L758-K761 PolarHBondContact O-N 3.13Å; V759-K761 PolarHBondContact O-N 3.17Å
762	T	89.3	Confident	88.6	Confident	12 Å²	12	76.1 Å²	76.1	7%	0.074	37%	0.368	C	S	.	.	H	α-helix	trans	-83.4	-23.3	-173.2	60.7	0	0	0	0	113.6	I739 L740 L758 V759 M764	I739-T762 HydrophobicContact CB-CG2 4Å; I739-T762 HydrophobicContact CG2-CG2 3.84Å; L740-T762 HydrophobicContact CD1-CG2 4.32Å; L740-T762 HydrophobicContact CD2-CG2 3.97Å; L740-T762 HydrophobicContact CG-CG2 3.7Å; L758-T762 HydrophobicContact CD1-CG2 4.42Å; L758-T762 HydrophobicContact CG-CG2 4.39Å; L758-T762 VanDerWaalsContact O-CB 3.22Å; L758-T762 WeakPolarHBondContact O-CB 3.2Å; L758-T762 WeakPolarHBondContact O-CG2 3.4Å; L758-T762 PolarHBondContact O-N 2.88Å; L758-T762 PolarHBondContact O-OG1 3.1Å; V759-T762 PolarHBondContact O-N 3.46Å; V759-T762 PolarHBondContact O-OG1 3.47Å; T762-M764 PolarHBondContact O-N 3.33Å; T762-M764 PolarHBondContact OG1-N 2.8Å
763	N	86.2	Confident	88.8	Confident	147 Å²	147	71.8 Å²	71.8	79%	0.786	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	32.9	-168.6	-66.3	-107.7	0	0	0	112.7	V759 T760	V759-N763 WeakPolarHBondContact O-CA 3.39Å; V759-N763 PolarHBondContact O-N 3.09Å; T760-N763 PolarHBondContact O-ND2 3.25Å
764	M	88.3	Confident	89	Confident	38 Å²	38	66.9 Å²	66.9	19%	0.187	34%	0.335	C	S	.	.			trans	-108.4	155.8	171.9	-68	171.3	52.6	0	0	109.7	L740 V759 T762 Q768 V769	L740-M764 HydrophobicContact CD1-CE 3.59Å; L740-M764 HydrophobicContact CD1-SD 3.6Å; V759-M764 WeakPolarHBondContact CG1-O 3.11Å; T762-M764 PolarHBondContact O-N 3.33Å; T762-M764 PolarHBondContact OG1-N 2.8Å; M764-Q768 HydrophobicContact CB-CB 4.03Å; M764-Q768 HydrophobicContact CE-CB 3.88Å; M764-Q768 WeakPolarHBondContact CE-O 3.41Å; M764-V769 HydrophobicContact CB-CG2 4.15Å
765	S	89.9	Confident	88.9	Confident	43 Å²	43	67.9 Å²	67.9	30%	0.301	34%	0.338	S	S	.	.			trans	-72.1	161.5	177.8	73.6	0	0	0	0	112.6	E767 Q768 V769	S765-E767 PolarHBondContact O-N 2.83Å; S765-Q768 PolarHBondContact O-N 3.16Å; S765-Q768 VanDerWaalsContact OG-CG 3.31Å; S765-Q768 WeakPolarHBondContact OG-CG 3.47Å; S765-Q768 PolarHBondContact OG-N 3.11Å; S765-Q768 VanDerWaalsContact OG-N 3.15Å; S765-V769 WeakPolarHBondContact O-CG2 3.15Å; S765-V769 PolarHBondContact O-N 2.97Å
766	Y	90.1	Very high	88.8	Confident	101 Å²	101	67.8 Å²	67.8	40%	0.396	34%	0.338	S	S	.	.	H	α-helix	trans	-48.4	-44.6	171.8	-68.8	-77.4	0	0	0	112.8	L755 D756 V759 V769 R770	L755-Y766 HydrophobicContact CD1-CD1 4.28Å; L755-Y766 HydrophobicContact CD2-CD1 3.96Å; L755-Y766 HydrophobicContact CG-CD1 3.77Å; L755-Y766 HydrophobicContact CG-CE1 4.16Å; D756-Y766 WeakPolarHBondContact OD1-CE1 3.2Å; V759-Y766 HydrophobicContact CB-CE1 4.29Å; V759-Y766 HydrophobicContact CG1-CE1 4.45Å; V759-Y766 HydrophobicContact CG1-CE2 4.25Å; V759-Y766 HydrophobicContact CG2-CD1 3.71Å; V759-Y766 HydrophobicContact CG2-CE1 3.86Å; V759-Y766 HydrophobicContact CG2-CG 4.03Å; Y766-V769 PolarHBondContact O-N 3.45Å; Y766-R770 WeakPolarHBondContact O-CG 3.28Å; Y766-R770 PolarHBondContact O-N 3.37Å
767	E	90	Very high	88.5	Confident	151 Å²	151	67 Å²	67	71%	0.706	33%	0.331	S	S	*	.	H	α-helix	trans	-64.2	-48.1	176.2	-62.5	168.7	153.5	0	0	111.2	S765 V769 R770 E771	S765-E767 PolarHBondContact O-N 2.83Å; E767-V769 VanDerWaalsContact C-N 3.28Å; E767-V769 PolarHBondContact O-N 2.94Å; E767-R770 PolarHBondContact O-N 3.37Å; E767-E771 WeakPolarHBondContact O-CB 3.39Å; E767-E771 PolarHBondContact O-N 3.07Å
768	Q	89	Confident	88.3	Confident	93 Å²	93	68 Å²	68	44%	0.435	33%	0.331	S	S	.	.	H	α-helix	trans	-65.1	-29.1	179.4	-72.8	172.2	-17.4	0	0	113.5	M764 S765 W772	M764-Q768 HydrophobicContact CB-CB 4.03Å; M764-Q768 HydrophobicContact CE-CB 3.88Å; M764-Q768 WeakPolarHBondContact CE-O 3.41Å; S765-Q768 PolarHBondContact O-N 3.16Å; S765-Q768 VanDerWaalsContact OG-CG 3.31Å; S765-Q768 WeakPolarHBondContact OG-CG 3.47Å; S765-Q768 PolarHBondContact OG-N 3.11Å; S765-Q768 VanDerWaalsContact OG-N 3.15Å; Q768-W772 VanDerWaalsContact O-CB 3.3Å; Q768-W772 WeakPolarHBondContact O-CB 3.27Å; Q768-W772 PolarHBondContact O-N 3.07Å
769	V	89.6	Confident	87.9	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-71.7	-55	171.9	174	0	0	0	0	109.5	L740 L750 L755 L758 V759 M764 S765 Y766 E767 E771 W772 F773	L740-V769 HydrophobicContact CD2-CB 4.48Å; L740-V769 HydrophobicContact CD2-CG1 3.85Å; L740-V769 HydrophobicContact CD2-CG2 4.23Å; L750-V769 HydrophobicContact CD1-CG1 4.22Å; L750-V769 HydrophobicContact CD2-CG1 4.29Å; L755-V769 HydrophobicContact CD1-CB 3.88Å; L755-V769 HydrophobicContact CD1-CG1 3.51Å; L758-V769 HydrophobicContact CD2-CG1 4.04Å; L758-V769 HydrophobicContact CG-CG1 4.42Å; V759-V769 HydrophobicContact CG2-CB 4.42Å; V759-V769 HydrophobicContact CG2-CG2 3.8Å; M764-V769 HydrophobicContact CB-CG2 4.15Å; S765-V769 WeakPolarHBondContact O-CG2 3.15Å; S765-V769 PolarHBondContact O-N 2.97Å; Y766-V769 PolarHBondContact O-N 3.45Å; E767-V769 VanDerWaalsContact C-N 3.28Å; E767-V769 PolarHBondContact O-N 2.94Å; V769-E771 VanDerWaalsContact C-N 3.35Å; V769-E771 PolarHBondContact O-N 2.91Å; V769-W772 WeakPolarHBondContact O-CB 3.35Å; V769-W772 PolarHBondContact O-N 3.11Å; V769-W772 VanDerWaalsContact O-N 3.11Å; V769-F773 HydrophobicContact CG1-CD2 4.09Å; V769-F773 HydrophobicContact CG1-CE2 3.98Å; V769-F773 WeakPolarHBondContact O-CD2 3.33Å; V769-F773 PolarHBondContact O-N 3.48Å; V769-F773 VanDerWaalsContact O-N 3.11Å
770	R	88.8	Confident	87.5	Confident	116 Å²	116	72.6 Å²	72.6	44%	0.438	35%	0.352	S	S	.	.	H	α-helix	trans	-58.2	-43.5	178.7	-73.3	-177.4	179.9	141.9	-0.3	112.6	L750 E752 L755 Y766 E767 W772 F773 A774	L750-R770 HydrophobicContact CD2-CB 4.43Å; L750-R770 HydrophobicContact CD2-CG 3.77Å; E752-R770 VanDerWaalsContact CD-NH2 3.26Å; E752-R770 IonicContact OE1-CZ 3.72Å; E752-R770 IonicContact OE1-NE 2.73Å; E752-R770 PolarHBondContact OE1-NE 3.11Å; E752-R770 IonicContact OE1-NH2 2.69Å; E752-R770 PolarHBondContact OE1-NH2 3.31Å; E752-R770 VanDerWaalsContact OE1-NH2 3.08Å; E752-R770 IonicContact OE2-CZ 3.29Å; E752-R770 IonicContact OE2-NE 3.87Å; E752-R770 IonicContact OE2-NH2 2.7Å; E752-R770 PolarHBondContact OE2-NH2 2.9Å; L755-R770 HydrophobicContact CD2-CG 4.37Å; Y766-R770 WeakPolarHBondContact O-CG 3.28Å; Y766-R770 PolarHBondContact O-N 3.37Å; E767-R770 PolarHBondContact O-N 3.37Å; R770-W772 VanDerWaalsContact C-N 3.34Å; R770-W772 PolarHBondContact O-N 3.45Å; R770-F773 PolarHBondContact O-N 3.32Å; R770-A774 WeakPolarHBondContact O-CB 3.48Å; R770-A774 PolarHBondContact O-N 2.76Å
771	E	90.7	Very high	87.2	Confident	137 Å²	137	73 Å²	73	64%	0.64	35%	0.35	S	S	*	.	H	α-helix	trans	-60.9	-39.7	175.7	-176.8	-177.7	-143	0	0	111.7	E767 V769 A774 E775	E767-E771 WeakPolarHBondContact O-CB 3.39Å; E767-E771 PolarHBondContact O-N 3.07Å; V769-E771 VanDerWaalsContact C-N 3.35Å; V769-E771 PolarHBondContact O-N 2.91Å; E771-A774 PolarHBondContact O-N 3.07Å; E771-E775 VanDerWaalsContact O-CB 3.31Å; E771-E775 WeakPolarHBondContact O-CB 3.48Å; E771-E775 PolarHBondContact O-N 2.62Å
772	W	91.4	Very high	87.1	Confident	35 Å²	35	73.5 Å²	73.5	13%	0.133	36%	0.357	C	S	.	.	H	α-helix	trans	-64.8	-43.1	175.6	-177.4	93	0	0	0	111.9	L740 K741 Y744 Q768 V769 R770 E775 V776	L740-W772 HydrophobicContact CB-CD2 3.78Å; L740-W772 HydrophobicContact CB-CE3 3.71Å; L740-W772 HydrophobicContact CB-CH2 3.75Å; L740-W772 HydrophobicContact CB-CZ2 3.78Å; L740-W772 HydrophobicContact CB-CZ3 3.71Å; L740-W772 HydrophobicContact CD1-CB 4.15Å; L740-W772 HydrophobicContact CD1-CD2 3.85Å; L740-W772 HydrophobicContact CD1-CE3 4.29Å; L740-W772 HydrophobicContact CD1-CG 3.78Å; L740-W772 HydrophobicContact CD2-CE3 4.26Å; L740-W772 HydrophobicContact CG-CD2 4.29Å; L740-W772 HydrophobicContact CG-CE3 4.3Å; L740-W772 WeakPolarHBondContact O-CH2 3.23Å; K741-W772 HydrophobicContact CB-CH2 4.49Å; K741-W772 HydrophobicContact CB-CZ2 4.38Å; Y744-W772 HydrophobicContact CG-CH2 4.43Å; Y744-W772 HydrophobicContact CG-CZ3 4.45Å; Q768-W772 VanDerWaalsContact O-CB 3.3Å; Q768-W772 WeakPolarHBondContact O-CB 3.27Å; Q768-W772 PolarHBondContact O-N 3.07Å; V769-W772 WeakPolarHBondContact O-CB 3.35Å; V769-W772 PolarHBondContact O-N 3.11Å; V769-W772 VanDerWaalsContact O-N 3.11Å; R770-W772 VanDerWaalsContact C-N 3.34Å; R770-W772 PolarHBondContact O-N 3.45Å; W772-E775 PolarHBondContact O-N 3.01Å; W772-V776 HydrophobicContact CD2-CG2 3.92Å; W772-V776 HydrophobicContact CE3-CG2 4Å; W772-V776 HydrophobicContact CH2-CG2 3.81Å; W772-V776 HydrophobicContact CZ2-CG2 3.74Å; W772-V776 HydrophobicContact CZ3-CG2 3.94Å; W772-V776 WeakPolarHBondContact O-CB 3.43Å; W772-V776 WeakPolarHBondContact O-CG2 3.3Å; W772-V776 PolarHBondContact O-N 3.08Å
773	F	88.1	Confident	86.4	Confident	16 Å²	16	76.3 Å²	76.3	7%	0.07	39%	0.389	C	S	.	.	H	α-helix	trans	-66.6	-39.3	175.4	-80.4	-92.2	0	0	0	112.1	L740 Y743 Y744 L750 L758 V769 R770 V776 Q777	L740-F773 HydrophobicContact CD2-CD2 4.44Å; L740-F773 HydrophobicContact CD2-CE2 3.63Å; L740-F773 HydrophobicContact CD2-CZ 4.39Å; Y743-F773 AromaticContact CD1-CE1 3.94Å; Y743-F773 HydrophobicContact CD1-CE1 3.94Å; Y743-F773 AromaticContact CD1-CZ 3.52Å; Y743-F773 HydrophobicContact CD1-CZ 3.52Å; Y743-F773 HydrophobicContact CE1-CE1 4.3Å; Y743-F773 HydrophobicContact CE1-CZ 4.05Å; Y743-F773 HydrophobicContact CG-CZ 4.39Å; Y744-F773 AromaticContact CD2-CD1 3.78Å; Y744-F773 HydrophobicContact CD2-CD1 3.78Å; Y744-F773 AromaticContact CD2-CE1 3.75Å; Y744-F773 HydrophobicContact CD2-CE1 3.75Å; Y744-F773 HydrophobicContact CG-CE1 4.35Å; L750-F773 HydrophobicContact CB-CB 4.21Å; L750-F773 HydrophobicContact CB-CD1 3.82Å; L750-F773 HydrophobicContact CB-CD2 3.98Å; L750-F773 HydrophobicContact CB-CE1 4.16Å; L750-F773 HydrophobicContact CB-CE2 4.33Å; L750-F773 HydrophobicContact CB-CG 3.74Å; L750-F773 HydrophobicContact CB-CZ 4.43Å; L750-F773 HydrophobicContact CD1-CD2 4.02Å; L750-F773 HydrophobicContact CD1-CE2 3.79Å; L750-F773 HydrophobicContact CD1-CZ 4.18Å; L750-F773 HydrophobicContact CD2-CB 4.39Å; L750-F773 HydrophobicContact CD2-CD2 3.87Å; L750-F773 HydrophobicContact CD2-CE2 4.47Å; L750-F773 HydrophobicContact CD2-CG 4.22Å; L750-F773 HydrophobicContact CG-CD2 4.18Å; L750-F773 HydrophobicContact CG-CE2 4.42Å; L750-F773 HydrophobicContact CG-CG 4.42Å; L758-F773 HydrophobicContact CD2-CE2 3.66Å; L758-F773 HydrophobicContact CD2-CZ 3.86Å; V769-F773 HydrophobicContact CG1-CD2 4.09Å; V769-F773 HydrophobicContact CG1-CE2 3.98Å; V769-F773 WeakPolarHBondContact O-CD2 3.33Å; V769-F773 PolarHBondContact O-N 3.48Å; V769-F773 VanDerWaalsContact O-N 3.11Å; R770-F773 PolarHBondContact O-N 3.32Å; F773-V776 PolarHBondContact O-N 2.69Å; F773-Q777 WeakPolarHBondContact O-CB 3.32Å; F773-Q777 PolarHBondContact O-N 2.7Å
774	A	88.6	Confident	86	Confident	61 Å²	61	74 Å²	74	50%	0.504	38%	0.376	S	S	.	.	H	α-helix	trans	-63	-42.4	175.1	0	0	0	0	0	112.1	R770 E771 Q777 R778	R770-A774 WeakPolarHBondContact O-CB 3.48Å; R770-A774 PolarHBondContact O-N 2.76Å; E771-A774 PolarHBondContact O-N 3.07Å; A774-Q777 PolarHBondContact O-N 2.82Å; A774-R778 VanDerWaalsContact O-CB 3.23Å; A774-R778 WeakPolarHBondContact O-CB 3.37Å; A774-R778 PolarHBondContact O-N 3.38Å
775	E	86.4	Confident	85.2	Confident	55 Å²	55	75.9 Å²	75.9	26%	0.257	39%	0.387	S	S	.	.	H	α-helix	trans	-70	-31.4	176.6	173.5	59.9	-169.6	0	0	112.8	E771 W772 R778 R779	E771-E775 VanDerWaalsContact O-CB 3.31Å; E771-E775 WeakPolarHBondContact O-CB 3.48Å; E771-E775 PolarHBondContact O-N 2.62Å; W772-E775 PolarHBondContact O-N 3.01Å; E775-R778 IonicContact OE1-CZ 2.75Å; E775-R778 IonicContact OE1-NH2 3.16Å; E775-R778 PolarHBondContact OE1-NH2 3.44Å; E775-R778 IonicContact OE2-CZ 3.23Å; E775-R778 IonicContact OE2-NE 2.71Å; E775-R778 PolarHBondContact OE2-NE 2.82Å; E775-R778 IonicContact OE2-NH2 2.7Å; E775-R778 PolarHBondContact OE2-NH2 3.03Å; E775-R779 VanDerWaalsContact O-CG 3.27Å; E775-R779 WeakPolarHBondContact O-CG 3.29Å; E775-R779 PolarHBondContact O-N 3.08Å; E775-R779 IonicContact OE1-CZ 2.69Å; E775-R779 IonicContact OE1-NE 2.83Å; E775-R779 PolarHBondContact OE1-NE 3.29Å; E775-R779 IonicContact OE1-NH2 2.82Å; E775-R779 PolarHBondContact OE1-NH2 2.72Å
776	V	85.5	Confident	84.3	Confident	1 Å²	1	75 Å²	75	1%	0.006	38%	0.38	C	S	.	.	H	α-helix	trans	-68.5	-44.4	172.3	164.7	0	0	0	0	110.7	Y744 W772 F773 R779 L780 P786	Y744-V776 HydrophobicContact CD1-CG1 4.1Å; Y744-V776 HydrophobicContact CD2-CG1 3.83Å; Y744-V776 HydrophobicContact CE1-CG1 3.76Å; Y744-V776 HydrophobicContact CE2-CG1 3.48Å; Y744-V776 VanDerWaalsContact CE2-CG1 3.48Å; Y744-V776 HydrophobicContact CG-CG1 4.13Å; Y744-V776 VanDerWaalsContact CZ-CG1 3.45Å; W772-V776 HydrophobicContact CD2-CG2 3.92Å; W772-V776 HydrophobicContact CE3-CG2 4Å; W772-V776 HydrophobicContact CH2-CG2 3.81Å; W772-V776 HydrophobicContact CZ2-CG2 3.74Å; W772-V776 HydrophobicContact CZ3-CG2 3.94Å; W772-V776 WeakPolarHBondContact O-CB 3.43Å; W772-V776 WeakPolarHBondContact O-CG2 3.3Å; W772-V776 PolarHBondContact O-N 3.08Å; F773-V776 PolarHBondContact O-N 2.69Å; V776-R779 PolarHBondContact O-N 2.73Å; V776-L780 PolarHBondContact O-N 3.14Å; V776-P786 HydrophobicContact CG1-CB 3.88Å
777	Q	83.1	Confident	83.5	Confident	79 Å²	79	73 Å²	73	37%	0.369	37%	0.373	S	S	.	.	H	α-helix	trans	-62	-50.6	174.1	-172.1	60.4	45.7	0	0	111.1	F773 A774 R779 L780 D781	F773-Q777 WeakPolarHBondContact O-CB 3.32Å; F773-Q777 PolarHBondContact O-N 2.7Å; A774-Q777 PolarHBondContact O-N 2.82Å; Q777-R779 PolarHBondContact O-N 2.56Å; Q777-L780 WeakPolarHBondContact O-CA 3.24Å; Q777-L780 WeakPolarHBondContact O-CB 3.49Å; Q777-L780 PolarHBondContact O-N 3.43Å; Q777-D781 PolarHBondContact NE2-OD1 3.46Å; Q777-D781 PolarHBondContact O-N 2.96Å
778	R	84.6	Confident	82.4	Confident	114 Å²	114	70.9 Å²	70.9	43%	0.43	37%	0.366	S	S	.	.	H	α-helix	trans	-59.2	-17.5	178.5	-163.2	-155.7	59.7	65.3	-0.6	114	A774 E775 L782	A774-R778 VanDerWaalsContact O-CB 3.23Å; A774-R778 WeakPolarHBondContact O-CB 3.37Å; A774-R778 PolarHBondContact O-N 3.38Å; E775-R778 IonicContact OE1-CZ 2.75Å; E775-R778 IonicContact OE1-NH2 3.16Å; E775-R778 PolarHBondContact OE1-NH2 3.44Å; E775-R778 IonicContact OE2-CZ 3.23Å; E775-R778 IonicContact OE2-NE 2.71Å; E775-R778 PolarHBondContact OE2-NE 2.82Å; E775-R778 IonicContact OE2-NH2 2.7Å; E775-R778 PolarHBondContact OE2-NH2 3.03Å; R778-L782 WeakPolarHBondContact O-CB 2.99Å
779	R	80.3	Confident	80.6	Confident	33 Å²	33	71.4 Å²	71.4	13%	0.125	37%	0.369	C	S	.	.	H	α-helix	trans	-85.4	-41.1	170.8	-74.8	169.7	-166.3	178.5	3.3	112.3	E775 V776 Q777 L782 G783 L784 L788	E775-R779 VanDerWaalsContact O-CG 3.27Å; E775-R779 WeakPolarHBondContact O-CG 3.29Å; E775-R779 PolarHBondContact O-N 3.08Å; E775-R779 IonicContact OE1-CZ 2.69Å; E775-R779 IonicContact OE1-NE 2.83Å; E775-R779 PolarHBondContact OE1-NE 3.29Å; E775-R779 IonicContact OE1-NH2 2.82Å; E775-R779 PolarHBondContact OE1-NH2 2.72Å; V776-R779 PolarHBondContact O-N 2.73Å; Q777-R779 PolarHBondContact O-N 2.56Å; R779-L782 CarbonylContact O-C 3.52Å; R779-L782 WeakPolarHBondContact O-CA 3.23Å; R779-L782 PolarHBondContact O-N 3.19Å; R779-L782 VanDerWaalsContact O-N 3.11Å; R779-G783 PolarHBondContact O-N 2.87Å; R779-G783 VanDerWaalsContact O-N 3.14Å; R779-L784 HydrophobicContact CB-CB 4.31Å; R779-L784 PolarHBondContact O-N 2.66Å; R779-L788 PolarHBondContact NH1-O 3.46Å
780	L	82.7	Confident	78.6	Confident	88 Å²	88	76.1 Å²	76.1	46%	0.461	40%	0.399	S	S	.	.	H	α-helix	trans	-61.5	-45.3	173.7	-169.4	154	0	0	0	110.6	V776 Q777 L782 G783 P786	V776-L780 PolarHBondContact O-N 3.14Å; Q777-L780 WeakPolarHBondContact O-CA 3.24Å; Q777-L780 WeakPolarHBondContact O-CB 3.49Å; Q777-L780 PolarHBondContact O-N 3.43Å; L780-L782 PolarHBondContact O-N 3.06Å; L780-L782 VanDerWaalsContact O-N 3.13Å; L780-G783 PolarHBondContact O-N 3.39Å; L780-P786 HydrophobicContact CB-CG 4.36Å
781	D	82.6	Confident	76.4	Confident	110 Å²	110	74.2 Å²	74.2	59%	0.588	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-22.6	174.2	-53.5	-26.3	0	0	0	112.9	Q777	Q777-D781 PolarHBondContact NE2-OD1 3.46Å; Q777-D781 PolarHBondContact O-N 2.96Å
782	L	84.1	Confident	74.2	Confident	113 Å²	113	71.7 Å²	71.7	59%	0.592	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	9.7	179.8	-152.7	71.1	0	0	0	112.8	R778 R779 L780 L784	R778-L782 WeakPolarHBondContact O-CB 2.99Å; R779-L782 CarbonylContact O-C 3.52Å; R779-L782 WeakPolarHBondContact O-CA 3.23Å; R779-L782 PolarHBondContact O-N 3.19Å; R779-L782 VanDerWaalsContact O-N 3.11Å; L780-L782 PolarHBondContact O-N 3.06Å; L780-L782 VanDerWaalsContact O-N 3.13Å; L782-L784 VanDerWaalsContact C-N 3.27Å; L782-L784 HydrophobicContact CD2-CD1 4.05Å; L782-L784 PolarHBondContact O-N 2.8Å
783	G	74.4	Confident	71.8	Confident	72 Å²	72	74.8 Å²	74.8	74%	0.742	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	16.1	178.3	0	0	0	0	0	115.6	R779 L780	R779-G783 PolarHBondContact O-N 2.87Å; R779-G783 VanDerWaalsContact O-N 3.14Å; L780-G783 PolarHBondContact O-N 3.39Å
784	L	77.1	Confident	69.6	Low	98 Å²	98	76.9 Å²	76.9	51%	0.513	48%	0.477	S	S	.	.	S	Bend	trans	-96.9	151.3	-179.6	-59.5	179.4	0	0	0	111.4	R779 L782 P786	R779-L784 HydrophobicContact CB-CB 4.31Å; R779-L784 PolarHBondContact O-N 2.66Å; L782-L784 VanDerWaalsContact C-N 3.27Å; L782-L784 HydrophobicContact CD2-CD1 4.05Å; L782-L784 PolarHBondContact O-N 2.8Å; L784-P786 VanDerWaalsContact O-CD 3.27Å; L784-P786 WeakPolarHBondContact O-CD 3.3Å; L784-P786 VanDerWaalsContact O-N 3.09Å
785	D	72.9	Confident	67.1	Low	78 Å²	78	85.7 Å²	85.7	42%	0.417	50%	0.498	S	S	.	.			trans	-53.6	117.5	171.6	-179.8	-22.6	0	0	0	109.3	F787 L788	D785-F787 PolarHBondContact O-N 2.86Å; D785-F787 WeakPolarHBondContact OD1-CD2 3.38Å; D785-F787 PolarHBondContact OD1-N 3.47Å; D785-L788 HydrophobicContact CB-CB 4.23Å; D785-L788 HydrophobicContact CB-CD1 3.76Å; D785-L788 HydrophobicContact CB-CG 3.74Å; D785-L788 PolarHBondContact O-N 2.99Å
786	P	71	Confident	64.7	Low	23 Å²	23	89.8 Å²	89.8	15%	0.149	53%	0.527	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-17.3	-175.8	-22.7	32.6	0	0	0	113.6	V776 L780 L784	V776-P786 HydrophobicContact CG1-CB 3.88Å; L780-P786 HydrophobicContact CB-CG 4.36Å; L784-P786 VanDerWaalsContact O-CD 3.27Å; L784-P786 WeakPolarHBondContact O-CD 3.3Å; L784-P786 VanDerWaalsContact O-N 3.09Å
787	F	73.4	Confident	62.1	Low	59 Å²	59	93.7 Å²	93.7	26%	0.259	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.2	2.6	-173.8	-43.3	-68.6	0	0	0	115.3	K741 Y744 L745 D785	K741-F787 HydrophobicContact CB-CD1 4.41Å; K741-F787 HydrophobicContact CB-CE1 4.47Å; K741-F787 HydrophobicContact CD-CB 4.13Å; K741-F787 HydrophobicContact CD-CD1 3.49Å; K741-F787 VanDerWaalsContact CD-CD1 3.49Å; K741-F787 HydrophobicContact CD-CD2 4.45Å; K741-F787 HydrophobicContact CD-CE1 3.99Å; K741-F787 HydrophobicContact CD-CG 3.75Å; K741-F787 HydrophobicContact CG-CD1 3.72Å; K741-F787 HydrophobicContact CG-CE1 3.72Å; K741-F787 HydrophobicContact CG-CG 4.41Å; K741-F787 HydrophobicContact CG-CZ 4.42Å; K741-F787 VanDerWaalsContact NZ-CD2 3.3Å; Y744-F787 AromaticContact CD1-CE1 3.78Å; Y744-F787 HydrophobicContact CD1-CE1 3.78Å; Y744-F787 AromaticContact CD1-CZ 3.69Å; Y744-F787 HydrophobicContact CD1-CZ 3.69Å; Y744-F787 HydrophobicContact CE1-CE1 4.29Å; Y744-F787 AromaticContact CE1-CZ 3.95Å; Y744-F787 HydrophobicContact CE1-CZ 3.95Å; L745-F787 HydrophobicContact CD1-CE1 3.93Å; L745-F787 HydrophobicContact CD1-CE2 3.92Å; L745-F787 HydrophobicContact CD1-CZ 3.33Å; D785-F787 PolarHBondContact O-N 2.86Å; D785-F787 WeakPolarHBondContact OD1-CD2 3.38Å; D785-F787 PolarHBondContact OD1-N 3.47Å
788	L	65.7	Low	59.8	Low	108 Å²	108	93.7 Å²	93.7	57%	0.565	59%	0.588	S	S	*	*			trans	-75.9	130.3	172.2	-77.8	177.5	0	0	0	111.1	R779 D785	R779-L788 PolarHBondContact NH1-O 3.46Å; D785-L788 HydrophobicContact CB-CB 4.23Å; D785-L788 HydrophobicContact CB-CD1 3.76Å; D785-L788 HydrophobicContact CB-CG 3.74Å; D785-L788 PolarHBondContact O-N 2.99Å
789	E	51.6	Low	57.3	Low	103 Å²	103	95.3 Å²	95.3	48%	0.481	61%	0.605	S	S	.	*			trans	-72.4	131.3	172.3	-71.2	-76.4	157.9	0	0	109.8	R737 G791 A792	R737-E789 IonicContact CZ-OE1 3.47Å; R737-E789 IonicContact NH1-OE1 3.7Å; R737-E789 PolarHBondContact NH1-OE1 3.27Å; R737-E789 IonicContact NH1-OE2 3.15Å; R737-E789 PolarHBondContact NH1-OE2 2.94Å; E789-G791 PolarHBondContact O-N 3.29Å; E789-A792 PolarHBondContact O-N 3.3Å
790	P	46.7	Very low	55.1	Low	99 Å²	99	102.3 Å²	102.3	64%	0.643	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-2.3	-177.5	26.2	-34.4	0	0	0	114.4
791	G	43.2	Very low	52.7	Low	76 Å²	76	102.9 Å²	102.9	78%	0.784	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-8.4	173.8	0	0	0	0	0	115.5	E789	E789-G791 PolarHBondContact O-N 3.29Å
792	A	44.3	Very low	50.2	Low	84 Å²	84	101.9 Å²	101.9	69%	0.694	66%	0.662	S	S	*	*	S	Bend	trans	-86.2	-28.9	-177.5	0	0	0	0	0	114.1	E789 G794	E789-A792 PolarHBondContact O-N 3.3Å; A792-G794 PolarHBondContact O-N 3.49Å; A792-G794 VanDerWaalsContact O-N 3.14Å
793	A	42.1	Very low	47.7	Very low	100 Å²	100	107 Å²	107	83%	0.826	67%	0.673	S	S	*	*	S	Bend	trans	-89.8	64.5	-174.4	0	0	0	0	0	112.1
794	G	41.3	Very low	45.6	Very low	60 Å²	60	109.3 Å²	109.3	62%	0.619	67%	0.668	S	S	*	*			trans	-167.6	31.3	-169.2	0	0	0	0	0	119.4	A792	A792-G794 PolarHBondContact O-N 3.49Å; A792-G794 VanDerWaalsContact O-N 3.14Å
795	R	36.1	Very low	43.4	Very low	246 Å²	246	111.1 Å²	111.1	93%	0.928	68%	0.679	S	S	*	*			trans	-164.7	56	166.6	-116.5	163	-128.9	-90.4	1.7	117.6
796	T	36.6	Very low	41.5	Very low	142 Å²	142	115 Å²	115	87%	0.871	69%	0.694	S	S	*	*			trans	-125.1	107.3	147.1	46	0	0	0	0	107.9
797	G	30.8	Very low	39.6	Very low	82 Å²	82	121.9 Å²	121.9	85%	0.845	72%	0.724	S	S	*	*			trans	-76.1	135.2	172	0	0	0	0	0	109.6
798	G	34.9	Very low	37.5	Very low	80 Å²	80	126.1 Å²	126.1	83%	0.825	75%	0.745	S	S	*	*			trans	-78.9	160.3	163.8	0	0	0	0	0	110.7
799	D	32.3	Very low	35.7	Very low	147 Å²	147	125.6 Å²	125.6	79%	0.786	75%	0.746	S	S	*	*			trans	-155.5	157.9	148.7	-155.9	-5.1	0	0	0	110.1
800	K	32.2	Very low	34.7	Very low	180 Å²	180	128.3 Å²	128.3	78%	0.783	76%	0.759	S	S	*	*			trans	67.3	86	168.2	-55.3	-158.5	173.9	-171	0	118.2
801	A	32.6	Very low	33.8	Very low	101 Å²	101	126.7 Å²	126.7	84%	0.835	76%	0.76	S	S	*	*			trans	-48	156.7	143.3	0	0	0	0	0	113.4
802	A	30.3	Very low	33.3	Very low	89 Å²	89	131 Å²	131	74%	0.736	76%	0.76	S	S	*	*				-164.4	129.7	120.3	0	0	0	0	0	111.5
803	R	31.2	Very low	32.7	Very low	219 Å²	219	137.9 Å²	137.9	83%	0.826	77%	0.768	S	S	*	*			trans	66.9	156	136.2	-97.6	-174.5	-178	-135	0.7	122.5
804	D	30.8	Very low	32.4	Very low	122 Å²	122	137.1 Å²	137.1	65%	0.652	76%	0.756	S	S	*	*			trans	59.3	153.4	157.5	-45.2	-18	0	0	0	117.1
805	D	30.4	Very low	32	Very low	136 Å²	136	141.3 Å²	141.3	73%	0.727	76%	0.76	S	S	*	*				-163.2	168.8	-50	-132.7	-49	0	0	0	107.2
806	E	33.6	Very low	31.7	Very low	159 Å²	159	135 Å²	135	74%	0.743	74%	0.744	S	S	*	*			trans	61	142.3	162.2	-67.1	174.1	164.5	0	0	120
807	E	30.5	Very low	31.4	Very low	167 Å²	167	133.5 Å²	133.5	78%	0.78	74%	0.736	S	S	*	*			trans	49	151.9	132.8	-62.8	-165.4	148.3	0	0	122.8
808	E	30.8	Very low	31.6	Very low	148 Å²	148	138.6 Å²	138.6	69%	0.692	74%	0.737	S	S	*	*			cis	-146.6	-162.3	4.8	-140.2	-146.7	110.1	0	0	112.7
809	T	27.9	Very low	31.6	Very low	97 Å²	97	143.1 Å²	143.1	60%	0.595	74%	0.737	S	S	*	*			trans	-53.2	177.2	174.9	62.5	0	0	0	0	116.3
810	H	30.2	Very low	32.2	Very low	161 Å²	161	141.5 Å²	141.5	75%	0.745	74%	0.735	S	S	*	*			cis	-148.3	179.2	14.8	-149.5	-92.4	0	0	0	112
811	G	28.4	Very low	32.3	Very low	65 Å²	65	137.4 Å²	137.4	67%	0.67	73%	0.734	S	S	*	*			trans	-66.6	-160.7	-178.3	0	0	0	0	0	116.4
812	E	31.9	Very low	32.2	Very low	166 Å²	166	136.3 Å²	136.3	78%	0.776	73%	0.732	S	S	*	*			cis	-140.3	177.2	17.7	-54.4	-176.3	153	0	0	109.2
813	R	32.5	Very low	32.5	Very low	228 Å²	228	137.1 Å²	137.1	86%	0.86	73%	0.733	S	S	*	*			cis	-169	152.4	32.7	-175	174.2	165.3	-148.3	-3.8	111.9
814	S	34.2	Very low	32.5	Very low	84 Å²	84	134 Å²	134	59%	0.587	73%	0.728	S	S	*	*			trans	-29.5	156.3	156	-67.3	0	0	0	0	117
815	E	32.9	Very low	32.7	Very low	148 Å²	148	133.5 Å²	133.5	69%	0.692	73%	0.729	S	S	*	*			cis	-170	-179.7	5.6	-111	159.4	59	0	0	108.1
816	N	30.3	Very low	32.8	Very low	113 Å²	113	137.9 Å²	137.9	60%	0.604	74%	0.735	S	S	*	*			cis	-155.7	149.4	10	-127.4	-31.3	0	0	0	113.4
817	T	31.6	Very low	33.1	Very low	112 Å²	112	137.4 Å²	137.4	69%	0.687	73%	0.733	S	S	*	*				24.7	120.7	126.3	-51.3	0	0	0	0	121.4
818	E	33.5	Very low	33.3	Very low	189 Å²	189	135.5 Å²	135.5	88%	0.883	74%	0.735	S	S	*	*				-171.6	133.7	104.5	-92.8	-169.3	170.1	0	0	111.5
819	E	34.7	Very low	33.3	Very low	175 Å²	175	132.3 Å²	132.3	82%	0.818	73%	0.729	S	S	*	*			trans	-124.6	158.4	163.6	-129	-151.1	-132.6	0	0	106.1
820	P	45.9	Very low	33.6	Very low	113 Å²	113	138 Å²	138	73%	0.734	74%	0.74	S	S	*	*				-154.3	176.3	60.3	42.3	-21.8	0	0	0	118.8
821	A	34	Very low	33.7	Very low	94 Å²	94	135 Å²	135	78%	0.777	74%	0.737	S	S	*	*			trans	71.9	129.3	146.5	0	0	0	0	0	121
822	G	31	Very low	33.9	Very low	77 Å²	77	138 Å²	138	79%	0.794	74%	0.742	S	S	*	*			trans	172.2	58.7	171.4	0	0	0	0	0	117.3
823	S	35.5	Very low	33.9	Very low	106 Å²	106	140.8 Å²	140.8	74%	0.741	75%	0.745	S	S	*	*			trans	48.7	114.2	162.4	-75.8	0	0	0	0	120
824	E	32.4	Very low	33.9	Very low	154 Å²	154	139 Å²	139	72%	0.72	74%	0.743	S	S	*	*				85.7	88.5	90.5	-158	168.7	-165.1	0	0	112.3
825	V	35.5	Very low	33.8	Very low	112 Å²	112	139.3 Å²	139.3	68%	0.679	75%	0.746	S	S	*	*				72.8	127.1	88.1	174.9	0	0	0	0	110.9
826	W	31.1	Very low	33.8	Very low	228 Å²	228	140 Å²	140	86%	0.864	75%	0.753	S	S	*	*				-157.4	136.7	82.2	-88	86.6	0	0	0	114.2
827	E	40.6	Very low	33.9	Very low	149 Å²	149	138.8 Å²	138.8	70%	0.696	75%	0.754	S	S	*	*			trans	-80.6	-179.4	151.2	-69.3	-161.2	127.9	0	0	110.4
828	P	34.5	Very low	33.8	Very low	126 Å²	126	141.1 Å²	141.1	82%	0.818	76%	0.761	S	S	*	*				-144.7	161.4	100.5	37	-22.7	0	0	0	115.6
829	S	30.4	Very low	33.9	Very low	81 Å²	81	136.1 Å²	136.1	57%	0.566	75%	0.747	S	S	*	*			trans	-139.8	151.6	-176.9	-130.7	0	0	0	0	114.1
830	R	34.9	Very low	34.1	Very low	218 Å²	218	136.6 Å²	136.6	82%	0.823	75%	0.749	S	S	*	*			trans	67.5	97.4	147.8	-69	166.7	177.9	-93.8	0.2	122.1
831	S	31.8	Very low	33.7	Very low	98 Å²	98	142.6 Å²	142.6	69%	0.685	78%	0.775	S	S	*	*				59.4	121.5	114.1	69.6	0	0	0	0	124
832	V	32.5	Very low	33.7	Very low	127 Å²	127	145.1 Å²	145.1	77%	0.77	78%	0.775	S	S	*	*				91.6	134.4	124.4	168.2	0	0	0	0	121.6
833	R	33.3	Very low	33.8	Very low	224 Å²	224	148.6 Å²	148.6	85%	0.845	77%	0.774	S	S	*	*			trans	87.1	102.1	158.4	-85	163.4	-161.3	-151.1	5.4	122.1
834	K	32	Very low	33.7	Very low	190 Å²	190	151 Å²	151	83%	0.826	78%	0.776	S	S	*	*				87.8	138.9	111.3	-143.5	112.8	178	-178.9	0	121.4
835	S	32.3	Very low	33.8	Very low	92 Å²	92	150.8 Å²	150.8	64%	0.643	78%	0.779	S	S	*	*			trans	79.3	120	141.7	40.8	0	0	0	0	123.3
836	L	31.7	Very low	33.7	Very low	162 Å²	162	153.3 Å²	153.3	85%	0.848	79%	0.786	S	S	*	*			trans	69.9	157.1	146.5	-55.8	166.5	0	0	0	116.9
837	S	31.9	Very low	33.9	Very low	87 Å²	87	148.3 Å²	148.3	61%	0.608	78%	0.78	S	S	*	*			cis	-173.3	165.8	-28.7	-96.8	0	0	0	0	108.9
838	L	31	Very low	33.4	Very low	162 Å²	162	148.2 Å²	148.2	85%	0.848	79%	0.786	S	S	*	*			trans	64.5	160.8	173.3	-84.7	71.1	0	0	0	114.8
839	S	35.5	Very low	33.3	Very low	83 Å²	83	149.9 Å²	149.9	58%	0.58	78%	0.784	S	S	*	*			cis	-166.8	164.7	-28.8	47.9	0	0	0	0	109.2
840	E	37.6	Very low	33.6	Very low	185 Å²	185	155.7 Å²	155.7	86%	0.864	80%	0.802	S	S	*	*			trans	18.5	112	155.1	-68	138.5	95.4	0	0	119.6
841	D	38.2	Very low	33.4	Very low	240 Å²	240	150 Å²	150	100%	1.283	80%	0.8	S	S	*	*				-148.2	0	91	-158.5	-126	0	0	0	109.6

Retrieved 841 of 841 residues in 512.2 ms (Link to these results)

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