A0A061ACP8_CAEEL Loading...

SH3 domain-containing protein

AlphaFold DB , UniProt , Accession A0A061ACP8, Species CAEEL (Caenorhabditis elegans), Gene eps-8, Length 942 aa.

						>A0A061ACP8_CAEEL|A0A061ACP8|eps-8
MRRGGSMGPPSGDPYQSRPSPGGYYYNRSTPGGQPAPSPSHSQQSASSHHPRGVPMSQPIARRSDYRTGSEQMTPRSDHRGPSMGYGNGGSVDQRVDDVTPSYYVEHLATFAVGRQFGLTFPADGIRKLKQMEKNSAIWAQPLILRFRHNAVTVEDDNGELVEQFPLELIEQPTAHVSNDSRETYNNVLLFVVREDRKRMSTPTEMHIFQCIRVSATDVAEDLKNYVQGQFRRVRNGRRTAAPTHLQAQQQQMPFYPPDDASISSETSEMFERDVNTLNRCFDDIERFVARIQSAALAQREIEQQNHRYRTANRRDKKNQQPPDPNGILFMRAQLPLESEFVDILKKFKLSFNLLAKLKNHIHEPNAPELLHFLFTPLAVILEACHWGLGRNVAPTVASPLLSLEARELMQNCLTSHESDIWMSLGEAWRTPPEDWTKPLPPPYRPIFNDGFAPYGVADRAMATPNQIHRGHSAPPEHFRQPPPRERNMVDTAPNTPQSMQRTPKSRPPHRNMSVDNLEFDRLTLERERLEFEKAKIMERESRLRHEEKQIEDEKRRMHAEKDLITKETTQPVPPPAAVVTHQPITKRYDPPISISPPPQRNNYSHVKVTVDSDTSPRQQAFIDDIVAKGGKLAVVTYDRGGQNTKELTVHKGEYLEVIFDERNWWECKNMHQRVGYVPHTILSMVPFEQQQYASPNHHNNSSSTGGYNNGHHQGPAQNVYRPPPPPLVSDAGVQVEIRREHVAPPPPPVVIPPPPPPVRTPTMEELLRMQQQQQQKQRKPPVEEPVYQPQPAQRAGLEIWRRNQNPQLIQEVTETVGQHSGDILRPAMQRATRVAINEKSSPEDVTRWLQEKGFSPRVIDLLDGQDGANLFSLSKLHLQQACGRDEGGYLYSQLLVQKKRSGFRTHTGDELKAILNHRRTHVELSNEAAADEPVFTINPIL
					

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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	38.2	Very low	40.7	Very low	249 Å²	249	141.3 Å²	141.3	100%	1.227	84%	0.837	S	S	*	*				0	160.3	0	-80.3	167.3	160.6	0	0	109.5
2	R	35.4	Very low	40	Very low	209 Å²	209	135.5 Å²	135.5	79%	0.789	83%	0.829	S	S	*	*			trans	-10	133.3	176.1	-70.2	-178.5	172.1	-160.2	-2.2	121.5
3	R	35.8	Very low	39.5	Very low	220 Å²	220	137.4 Å²	137.4	83%	0.83	83%	0.831	S	S	*	*			trans	62.3	150.7	134.5	-60.5	177.4	-179.9	-166.5	-2.5	120
4	G	36.2	Very low	40.5	Very low	78 Å²	78	133.9 Å²	133.9	80%	0.804	81%	0.813	S	S	*	*			cis	129.6	115	-19.3	0	0	0	0	0	117.4
5	G	36.7	Very low	40.1	Very low	77 Å²	77	140.3 Å²	140.3	79%	0.794	82%	0.819	S	S	*	*			trans	95.5	115.9	138.5	0	0	0	0	0	121.8
6	S	37.9	Very low	40	Very low	116 Å²	116	141.9 Å²	141.9	81%	0.811	82%	0.816	S	S	*	*			trans	73.1	167.5	134.3	-147.6	0	0	0	0	122.3
7	M	36.1	Very low	39.7	Very low	179 Å²	179	139.7 Å²	139.7	88%	0.882	81%	0.811	S	S	*	*			trans	74.3	129.5	167.5	-55	-62.3	-157.3	0	0	120.6
8	G	29.8	Very low	39.5	Very low	64 Å²	64	143.4 Å²	143.4	66%	0.66	81%	0.809	S	S	*	*			trans	-128.9	-159	131.2	0	0	0	0	0	106.8
9	P	63.6	Low	39.8	Very low	125 Å²	125	142.5 Å²	142.5	81%	0.812	81%	0.81	S	S	*	*			cis	-105.3	-140.2	-19.9	36.8	-18.3	0	0	0	107.9
10	P	62.7	Low	39.5	Very low	112 Å²	112	139.3 Å²	139.3	73%	0.727	80%	0.796	S	S	*	*			cis	-134.3	-153.7	-14	42.3	-22.1	0	0	0	114.6
11	S	35.5	Very low	40.2	Very low	125 Å²	125	138.7 Å²	138.7	87%	0.874	80%	0.798	S	S	*	*			trans	88.5	135.3	174	75	0	0	0	0	116.9
12	G	32.2	Very low	40	Very low	72 Å²	72	130.5 Å²	130.5	74%	0.742	78%	0.777	S	S	*	*			cis	-171.4	157.8	-7.2	0	0	0	0	0	114.8
13	D	32.8	Very low	39.7	Very low	160 Å²	160	124 Å²	124	86%	0.856	78%	0.775	S	S	*	*			trans	-73.5	-173.7	174.3	-61.3	-74.1	0	0	0	112.4
14	P	53.8	Low	39.4	Very low	88 Å²	88	123.9 Å²	123.9	57%	0.571	78%	0.776	S	S	*	*			cis	-140.6	172.2	3.3	43.9	-26.7	0	0	0	117.6
15	Y	34.9	Very low	39	Very low	231 Å²	231	129.9 Å²	129.9	91%	0.906	78%	0.776	S	S	*	*				-156.3	154.4	112.9	-107	-72.5	0	0	0	111.5
16	Q	38.1	Very low	38.6	Very low	165 Å²	165	135.4 Å²	135.4	77%	0.771	77%	0.774	S	S	*	*			trans	-127.6	170.1	-159.4	-78.8	-177.5	-3.3	0	0	110.7
17	S	35.6	Very low	38.1	Very low	105 Å²	105	136.3 Å²	136.3	73%	0.734	77%	0.77	S	S	*	*			cis	-164.8	175.2	-9.8	-110.6	0	0	0	0	111.8
18	R	35.2	Very low	37.6	Very low	207 Å²	207	138.5 Å²	138.5	78%	0.781	77%	0.768	S	S	*	*			trans	-54.4	177.3	166.5	-67.7	178.4	163.7	-146.6	2.4	115.1	S20	R18-S20 PolarHBondContact NH1-OG 2.84Å; R18-S20 VanDerWaalsContact NH1-OG 3.09Å
19	P	45	Very low	37.6	Very low	126 Å²	126	140.2 Å²	140.2	82%	0.818	77%	0.77	S	S	*	*				-125.1	177.6	106.8	37.9	-35	0	0	0	116.2
20	S	35.6	Very low	36.3	Very low	77 Å²	77	140.8 Å²	140.8	54%	0.538	77%	0.772	S	S	.	*			trans	-136.3	-156.5	170.3	-53.4	0	0	0	0	105.4	R18	R18-S20 PolarHBondContact NH1-OG 2.84Å; R18-S20 VanDerWaalsContact NH1-OG 3.09Å
21	P	54	Low	35.8	Very low	127 Å²	127	141.6 Å²	141.6	83%	0.825	78%	0.777	S	S	*	*			cis	-132.3	-153.6	-9.4	42.2	-21.8	0	0	0	112.1
22	G	33.5	Very low	35.5	Very low	77 Å²	77	139.3 Å²	139.3	79%	0.794	77%	0.773	S	S	*	*			trans	-94.6	177.2	167.9	0	0	0	0	0	114.2
23	G	28.1	Very low	35.4	Very low	72 Å²	72	140 Å²	140	74%	0.742	78%	0.78	S	S	*	*			trans	-163	177.1	-176.5	0	0	0	0	0	114.9
24	Y	30.1	Very low	35.5	Very low	219 Å²	219	141.4 Å²	141.4	86%	0.859	78%	0.781	S	S	*	*			trans	-131	148.3	-162.8	-76.3	-92.7	0	0	0	115.3
25	Y	27.5	Very low	35.3	Very low	204 Å²	204	143 Å²	143	80%	0.8	79%	0.792	S	S	*	*			trans	66.2	148.9	146.8	-92.3	-75.4	0	0	0	124.7
26	Y	28.3	Very low	35.3	Very low	192 Å²	192	135.9 Å²	135.9	75%	0.753	78%	0.781	S	S	*	*			trans	89.5	117.3	153.4	-91.2	-67.7	0	0	0	123.4
27	N	28	Very low	35.9	Very low	136 Å²	136	134 Å²	134	73%	0.727	78%	0.783	S	S	*	*			trans	33.2	152.7	141.3	-73.3	-13	0	0	0	122.3
28	R	26.4	Very low	35.9	Very low	224 Å²	224	134.2 Å²	134.2	85%	0.845	78%	0.784	S	S	*	*			cis	-166.3	166.9	37.7	-151	-175.9	-165.5	-164.1	5.3	113.7
29	S	29.7	Very low	36.5	Very low	100 Å²	100	130.6 Å²	130.6	70%	0.699	79%	0.788	S	S	*	*			trans	88.8	110	148.7	-54.6	0	0	0	0	121.6
30	T	34.8	Very low	36	Very low	137 Å²	137	129.2 Å²	129.2	84%	0.84	78%	0.781	S	S	*	*			trans	-64.6	174.9	144.8	15.1	0	0	0	0	111.9
31	P	52	Low	36	Very low	129 Å²	129	134.2 Å²	134.2	84%	0.838	80%	0.796	S	S	*	*			cis	-126.6	-175.3	28.6	40	-21.9	0	0	0	114.3
32	G	30.8	Very low	35	Very low	77 Å²	77	132.1 Å²	132.1	79%	0.794	78%	0.784	S	S	*	*			cis	147.8	150.4	-5.2	0	0	0	0	0	111.1
33	G	30.2	Very low	34.9	Very low	86 Å²	86	135.9 Å²	135.9	89%	0.887	78%	0.781	S	S	*	*			trans	151.2	112.7	176.2	0	0	0	0	0	115.8
34	Q	34.6	Very low	35	Very low	190 Å²	190	139.8 Å²	139.8	89%	0.888	78%	0.78	S	S	*	*			trans	-97.1	170.3	162.5	-121.2	-177.3	21.5	0	0	108.4
35	P	49.1	Very low	35.1	Very low	122 Å²	122	134.3 Å²	134.3	79%	0.792	77%	0.774	S	S	*	*				-146.2	-176.2	53.9	39.6	-17.8	0	0	0	116.8
36	A	35.8	Very low	35.2	Very low	82 Å²	82	128.9 Å²	128.9	68%	0.678	77%	0.771	S	S	*	*			trans	-86.3	-173.7	171.5	0	0	0	0	0	112
37	P	49.5	Very low	35.4	Very low	125 Å²	125	124.8 Å²	124.8	81%	0.812	77%	0.77	S	S	*	*				-146.6	162.1	80.7	40.2	-24.1	0	0	0	116.5
38	S	36.1	Very low	35.6	Very low	109 Å²	109	123 Å²	123	76%	0.762	77%	0.769	S	S	*	*			trans	-95.9	167.3	154.2	-49.3	0	0	0	0	109.9
39	P	47.8	Very low	35.9	Very low	132 Å²	132	121 Å²	121	86%	0.857	77%	0.768	S	S	*	*			trans	-126.7	164.5	137.1	36.3	-28.5	0	0	0	112.6
40	S	33.3	Very low	36.2	Very low	97 Å²	97	124.7 Å²	124.7	68%	0.678	77%	0.774	S	S	*	*			trans	-143.1	171.6	-173.7	56.2	0	0	0	0	111.5
41	H	36.2	Very low	37.1	Very low	181 Å²	181	123.4 Å²	123.4	84%	0.838	77%	0.768	S	S	*	*			trans	70	146.8	173.2	-67.7	-69.6	0	0	0	116.2
42	S	33.1	Very low	36.2	Very low	84 Å²	84	129.2 Å²	129.2	59%	0.587	77%	0.774	S	S	*	*			cis	-166.8	178.9	-6.1	47.6	0	0	0	0	112.4
43	Q	31.1	Very low	36.1	Very low	156 Å²	156	129.2 Å²	129.2	73%	0.729	77%	0.773	S	S	*	*			trans	100.8	132.4	146.9	-77.7	179.1	78.9	0	0	122.1
44	Q	31.4	Very low	36.2	Very low	153 Å²	153	131.9 Å²	131.9	72%	0.715	77%	0.772	S	S	*	*			trans	74.8	107.1	142.8	-69.1	-176.1	55.3	0	0	122.7
45	S	31	Very low	37.1	Very low	105 Å²	105	127.7 Å²	127.7	73%	0.734	76%	0.762	S	S	*	*				74	127.6	112.7	-54	0	0	0	0	123.6
46	A	31.1	Very low	36.4	Very low	89 Å²	89	130.4 Å²	130.4	74%	0.736	77%	0.766	S	S	*	*			trans	81.8	116.4	134.1	0	0	0	0	0	122.9
47	S	30.9	Very low	36.1	Very low	106 Å²	106	132 Å²	132	74%	0.741	77%	0.772	S	S	*	*				74.3	97.3	124.4	-57.4	0	0	0	0	123.4
48	S	32.4	Very low	35.2	Very low	100 Å²	100	134.7 Å²	134.7	70%	0.699	77%	0.774	S	S	*	*				88.7	163.1	112.7	80.6	0	0	0	0	122.9
49	H	32.2	Very low	36.1	Very low	180 Å²	180	134.4 Å²	134.4	83%	0.833	77%	0.769	S	S	*	*			trans	93.8	127.3	159.5	-77	84.9	0	0	0	122.7
50	H	37.4	Very low	35.3	Very low	178 Å²	178	136.4 Å²	136.4	82%	0.824	77%	0.771	S	S	*	*			trans	-75.8	-179.3	160.6	-84.5	25.2	0	0	0	110.4
51	P	54.1	Low	35.1	Very low	110 Å²	110	135.8 Å²	135.8	71%	0.714	77%	0.772	S	S	*	*			cis	-156.7	175.3	31.7	45.4	-23.1	0	0	0	121.8
52	R	32	Very low	34.8	Very low	252 Å²	252	139.2 Å²	139.2	95%	0.951	78%	0.777	S	S	*	*			trans	43	134.1	141	-71.3	176.2	173.7	-173.3	-1.7	122.8
53	G	29.7	Very low	34.5	Very low	76 Å²	76	146.3 Å²	146.3	78%	0.784	79%	0.791	S	S	*	*			trans	-168.9	137.2	154.5	0	0	0	0	0	113.8
54	V	31.3	Very low	34.4	Very low	143 Å²	143	143.2 Å²	143.2	87%	0.867	79%	0.787	S	S	*	*			trans	-152.3	177	-178.8	-119.8	0	0	0	0	107.5
55	P	53.3	Low	34.3	Very low	102 Å²	102	141.8 Å²	141.8	66%	0.662	78%	0.784	S	S	*	*			cis	-139.6	-168.3	-2.1	40.9	-20.4	0	0	0	116.7
56	M	33.9	Very low	34.2	Very low	179 Å²	179	147.1 Å²	147.1	88%	0.882	79%	0.789	S	S	*	*			trans	71.5	155.6	151.1	-82.4	169.5	171.9	0	0	119.5
57	S	31.2	Very low	34	Very low	115 Å²	115	154.1 Å²	154.1	80%	0.804	80%	0.797	S	S	*	*			cis	-155.7	170.1	0.7	32.3	0	0	0	0	112.8
58	Q	29.5	Very low	33.8	Very low	182 Å²	182	155.5 Å²	155.5	85%	0.85	80%	0.801	S	S	*	*			trans	-102.9	-164.5	174.5	-39.4	177.9	-10.6	0	0	111.5
59	P	55.3	Low	33.6	Very low	102 Å²	102	154.5 Å²	154.5	66%	0.662	81%	0.806	S	S	*	*			cis	-134.5	-174.5	-20.9	33.7	-13.1	0	0	0	113.9
60	I	30.6	Very low	33.4	Very low	174 Å²	174	151.8 Å²	151.8	89%	0.892	81%	0.808	S	S	*	*				170	154.2	128.2	-87.4	161.4	0	0	0	111.8
61	A	29.4	Very low	32.9	Very low	85 Å²	85	152.6 Å²	152.6	70%	0.702	81%	0.812	S	S	*	*			trans	-111.5	166.9	-160.1	0	0	0	0	0	116.5
62	R	30	Very low	31.8	Very low	252 Å²	252	156.5 Å²	156.5	95%	0.951	82%	0.821	S	S	*	*				-169.2	167.1	124.5	-102.4	167.2	-168	-123.6	1.2	113.6
63	R	26.9	Very low	31.6	Very low	234 Å²	234	152.6 Å²	152.6	88%	0.883	82%	0.815	S	S	*	*			trans	-79.3	173	-179.9	-61.7	-177.4	169.3	-165.4	-2.7	111.6
64	S	28.9	Very low	31.6	Very low	91 Å²	91	155.9 Å²	155.9	64%	0.636	82%	0.82	S	S	*	*			cis	-155.2	159.9	22.6	-44.4	0	0	0	0	113.2
65	D	29.3	Very low	31.7	Very low	122 Å²	122	153.8 Å²	153.8	65%	0.652	81%	0.809	S	S	*	*			trans	28.3	144.1	144.7	-41.6	-34.5	0	0	0	120.6
66	Y	28.8	Very low	30.3	Very low	217 Å²	217	160.2 Å²	160.2	85%	0.851	82%	0.821	S	S	*	*			cis	-154	154.3	39	-48.7	-95.8	0	0	0	115.4
67	R	27.3	Very low	30.6	Very low	236 Å²	236	157.1 Å²	157.1	89%	0.891	82%	0.816	S	S	*	*			trans	76.6	134.5	141.1	-144.2	-179.4	-163.9	165.1	4.9	121.7
68	T	26.9	Very low	30.5	Very low	136 Å²	136	158.6 Å²	158.6	83%	0.834	82%	0.815	S	S	*	*			trans	94.7	127.7	155.4	-28.3	0	0	0	0	117
69	G	26.8	Very low	30.6	Very low	78 Å²	78	157.9 Å²	157.9	80%	0.804	81%	0.812	S	S	*	*			trans	93.4	92.1	168.9	0	0	0	0	0	115.1
70	S	28.6	Very low	29.3	Very low	124 Å²	124	165 Å²	165	87%	0.867	83%	0.825	S	S	*	*			trans	-111.2	99.6	170.3	58.9	0	0	0	0	110.8
71	E	27.1	Very low	29.2	Very low	194 Å²	194	159.9 Å²	159.9	91%	0.907	82%	0.815	S	S	*	*			trans	-71.2	180	166	-70.5	180	87.2	0	0	111.9
72	Q	31.7	Very low	29.8	Very low	192 Å²	192	162.6 Å²	162.6	90%	0.897	83%	0.826	S	S	*	*			trans	-62.6	135.4	177.1	-57	171.4	4.2	0	0	112.1
73	M	26.8	Very low	29.8	Very low	171 Å²	171	155.9 Å²	155.9	84%	0.842	82%	0.818	S	S	*	*			trans	-161.7	129.3	150.9	-115.7	-169.5	-168.1	0	0	113.2
74	T	29.5	Very low	30.1	Very low	145 Å²	145	152.5 Å²	152.5	89%	0.89	81%	0.814	S	S	*	*			trans	-136.7	106.4	154.7	43.6	0	0	0	0	109.3
75	P	33.1	Very low	30	Very low	98 Å²	98	151.7 Å²	151.7	64%	0.636	82%	0.82	S	S	*	*			trans	-104.6	144.9	179.7	36	-30.5	0	0	0	113.6
76	R	25.3	Very low	30.1	Very low	238 Å²	238	156.1 Å²	156.1	90%	0.898	83%	0.829	S	S	*	*			trans	54.9	108.3	146.9	-67	-177.6	170.4	-179.5	-4	120
77	S	39.4	Very low	30.2	Very low	113 Å²	113	149.1 Å²	149.1	79%	0.79	82%	0.822	S	S	*	*			trans	-5.7	145.2	130.5	-32.6	0	0	0	0	118.8
78	D	28.7	Very low	30.3	Very low	146 Å²	146	146.5 Å²	146.5	78%	0.781	83%	0.826	S	S	*	*			trans	-152.8	126.7	144.3	-108.1	-19.3	0	0	0	115.1
79	H	32.8	Very low	30.6	Very low	168 Å²	168	143.3 Å²	143.3	78%	0.778	82%	0.82	S	S	*	*			trans	34.2	114.7	148.5	-64.2	80.7	0	0	0	123.1
80	R	27.4	Very low	30.7	Very low	251 Å²	251	142.6 Å²	142.6	95%	0.947	81%	0.813	S	S	*	*				-176	141.6	102.5	-100.6	175.5	-179.5	-174.7	0.2	113.7
81	G	29.4	Very low	30.9	Very low	66 Å²	66	142.4 Å²	142.4	68%	0.68	81%	0.811	S	S	*	*			trans	-95.5	176.5	162.1	0	0	0	0	0	112
82	P	41.9	Very low	31.3	Very low	142 Å²	142	139.6 Å²	139.6	92%	0.922	81%	0.807	S	S	*	*				-131.4	-165.6	95.2	39.6	-30.9	0	0	0	113.9
83	S	29.8	Very low	31.5	Very low	112 Å²	112	137 Å²	137	78%	0.783	80%	0.8	S	S	*	*			trans	-133.3	178.6	-158.8	-170.4	0	0	0	0	113.9
84	M	32	Very low	31.8	Very low	162 Å²	162	136.8 Å²	136.8	80%	0.798	80%	0.797	S	S	*	*			trans	78.7	127.6	170.3	-70	-72.6	-168.2	0	0	118.9
85	G	27.1	Very low	32.2	Very low	74 Å²	74	140.7 Å²	140.7	76%	0.763	80%	0.795	S	S	*	*			trans	164.8	93.2	172.1	0	0	0	0	0	113.6
86	Y	32.4	Very low	32.5	Very low	216 Å²	216	141 Å²	141	85%	0.847	80%	0.795	S	S	*	*			trans	-63.1	154.2	172.9	-44.6	-98.9	0	0	0	111.4
87	G	29.1	Very low	33.4	Very low	69 Å²	69	132.7 Å²	132.7	71%	0.711	77%	0.768	S	S	*	*			cis	160	157.6	-2.6	0	0	0	0	0	111
88	N	31.1	Very low	33.8	Very low	181 Å²	181	134.2 Å²	134.2	97%	0.968	77%	0.767	S	S	*	*			trans	68.9	129.1	179.9	-161.5	48.8	0	0	0	116.1
89	G	32.5	Very low	35.3	Very low	69 Å²	69	131 Å²	131	71%	0.711	75%	0.753	S	S	*	*			cis	179.3	134.7	-9.5	0	0	0	0	0	111.5
90	G	28	Very low	37.1	Very low	63 Å²	63	123.5 Å²	123.5	65%	0.649	72%	0.719	S	S	*	*			trans	165.7	121.9	177.6	0	0	0	0	0	115.1
91	S	34.6	Very low	39.8	Very low	120 Å²	120	111.5 Å²	111.5	84%	0.839	67%	0.674	S	S	*	*			trans	42.3	76.8	154.4	-50.3	0	0	0	0	118.9
92	V	33.8	Very low	42.5	Very low	136 Å²	136	109.1 Å²	109.1	82%	0.824	65%	0.646	S	S	*	*			trans	-118.5	72.1	168.5	-170.8	0	0	0	0	110.4
93	D	35.8	Very low	44.8	Very low	138 Å²	138	102.3 Å²	102.3	74%	0.738	60%	0.603	S	S	*	*			trans	-137.4	-29.2	174.9	-141.6	6	0	0	0	112.9	R95	D93-R95 PolarHBondContact O-N 2.84Å
94	Q	34.4	Very low	47.5	Very low	166 Å²	166	99.8 Å²	99.8	78%	0.776	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	10.5	-179.6	-73.4	177.2	-35.6	0	0	116.3
95	R	36.8	Very low	50.3	Low	226 Å²	226	92.1 Å²	92.1	85%	0.853	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.4	3.7	-173.8	-72.5	-170.5	177.2	178	1.1	115.9	D93	D93-R95 PolarHBondContact O-N 2.84Å
96	V	40.5	Very low	53.4	Low	104 Å²	104	91.2 Å²	91.2	63%	0.63	51%	0.514	S	S	*	.	S	Bend	trans	-102.3	-15.5	174.2	-171.8	0	0	0	0	111.7
97	D	43.7	Very low	56.3	Low	65 Å²	65	82.6 Å²	82.6	35%	0.348	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-88.3	-16.7	-164.9	-92.3	6.4	0	0	0	116.3	V99 T100 R146 R148	D97-V99 PolarHBondContact O-N 3.21Å; D97-T100 PolarHBondContact O-OG1 3.35Å; D97-R146 PolarHBondContact O-NH1 2.88Å; D97-R148 IonicContact OD1-CZ 3.3Å; D97-R148 IonicContact OD1-NH1 2.68Å; D97-R148 PolarHBondContact OD1-NH1 2.9Å; D97-R148 IonicContact OD1-NH2 2.77Å; D97-R148 IonicContact OD2-CZ 3.04Å; D97-R148 IonicContact OD2-NH1 3.96Å; D97-R148 PolarHBondContact OD2-NH1 3.27Å; D97-R148 IonicContact OD2-NH2 3.67Å; D97-R148 PolarHBondContact OD2-NH2 3.02Å
98	D	48.3	Very low	59.2	Low	144 Å²	144	79.8 Å²	79.8	77%	0.77	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-72.6	-8.9	-178.6	-81.2	-39.4	0	0	0	114.3
99	V	59.2	Low	62.1	Low	80 Å²	80	71.6 Å²	71.6	49%	0.485	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-104.3	-10.4	-169.4	-171	0	0	0	0	112.4	D97 N236 G237	D97-V99 PolarHBondContact O-N 3.21Å; V99-N236 HydrophobicContact CG1-CB 3.91Å; V99-N236 WeakPolarHBondContact CG1-ND2 3.33Å; V99-N236 VanDerWaalsContact O-CB 3.26Å; V99-N236 WeakPolarHBondContact O-CB 3.41Å; V99-G237 PolarHBondContact O-N 3.23Å
100	T	70.4	Confident	64.9	Low	9 Å²	9	70.7 Å²	70.7	6%	0.055	39%	0.389	C	S	.	.	S	Bend	trans	-69.8	142.1	-179.4	47.8	0	0	0	0	113	D97 S102 F147	D97-T100 PolarHBondContact O-OG1 3.35Å; T100-S102 PolarHBondContact O-N 3.15Å; T100-S102 PolarHBondContact O-OG 3.02Å; T100-F147 WeakPolarHBondContact CB-O 3.26Å; T100-F147 WeakPolarHBondContact CG2-O 3.31Å
101	P	84.8	Confident	67.9	Low	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.36	C	S	.	.			trans	-57.5	135.3	174.6	-18.7	29.9	0	0	0	111.6	Y103 R146 F147 Y226 V234	P101-Y103 HydrophobicContact CB-CE2 3.88Å; P101-Y103 WeakPolarHBondContact CB-OH 3.45Å; P101-R146 WeakPolarHBondContact O-CA 3.48Å; P101-F147 PolarHBondContact O-N 2.85Å; P101-Y226 WeakPolarHBondContact CD-OH 3.02Å; P101-Y226 HydrophobicContact CG-CE2 4.17Å; P101-V234 HydrophobicContact CB-CG1 4.12Å; P101-V234 HydrophobicContact CG-CG1 3.41Å; P101-V234 VanDerWaalsContact CG-CG1 3.41Å
102	S	86.8	Confident	70.5	Confident	15 Å²	15	64.1 Å²	64.1	11%	0.105	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	135.9	-179.2	-49	0	0	0	0	110.5	T100 L145 R146 G237 R239	T100-S102 PolarHBondContact O-N 3.15Å; T100-S102 PolarHBondContact O-OG 3.02Å; S102-L145 WeakPolarHBondContact CA-O 3.25Å; S102-R146 VanDerWaalsContact OG-CD 3.28Å; S102-R146 WeakPolarHBondContact OG-CD 3.41Å; S102-R146 WeakPolarHBondContact OG-CG 3.5Å; S102-G237 PolarHBondContact N-O 3.34Å; S102-R239 PolarHBondContact O-N 2.89Å
103	Y	88.8	Confident	73.2	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	136.1	-172.2	-47.4	-85.7	0	0	0	110.7	P101 L145 F147 V214 V219 D222 R239	P101-Y103 HydrophobicContact CB-CE2 3.88Å; P101-Y103 WeakPolarHBondContact CB-OH 3.45Å; Y103-L145 WeakPolarHBondContact CD2-O 3.43Å; Y103-L145 PolarHBondContact N-O 3.01Å; Y103-L145 PolarHBondContact O-N 2.91Å; Y103-F147 HydrophobicContact CD2-CE1 4.26Å; Y103-F147 HydrophobicContact CD2-CE2 4.36Å; Y103-F147 HydrophobicContact CD2-CZ 4.14Å; Y103-F147 HydrophobicContact CE2-CD1 4.19Å; Y103-F147 AromaticContact CE2-CD2 3.64Å; Y103-F147 HydrophobicContact CE2-CD2 3.64Å; Y103-F147 HydrophobicContact CE2-CE1 4.07Å; Y103-F147 AromaticContact CE2-CE2 3.47Å; Y103-F147 HydrophobicContact CE2-CE2 3.47Å; Y103-F147 VanDerWaalsContact CE2-CE2 3.47Å; Y103-F147 AromaticContact CE2-CG 3.98Å; Y103-F147 HydrophobicContact CE2-CG 3.98Å; Y103-F147 AromaticContact CE2-CZ 3.7Å; Y103-F147 HydrophobicContact CE2-CZ 3.7Å; Y103-V214 HydrophobicContact CD1-CG1 4.18Å; Y103-V214 HydrophobicContact CD1-CG2 4.21Å; Y103-V219 HydrophobicContact CD1-CG1 4.41Å; Y103-V219 HydrophobicContact CD1-CG2 3.63Å; Y103-V219 HydrophobicContact CD2-CG1 4.01Å; Y103-V219 HydrophobicContact CE1-CG2 3.96Å; Y103-V219 HydrophobicContact CE2-CG1 4.21Å; Y103-V219 HydrophobicContact CG-CG1 4.12Å; Y103-V219 HydrophobicContact CG-CG2 4Å; Y103-D222 WeakPolarHBondContact OH-CB 3.44Å; Y103-D222 PolarHBondContact OH-OD2 3.44Å; Y103-R239 HydrophobicContact CD1-CB 4.39Å; Y103-R239 HydrophobicContact CE1-CB 4.44Å; Y103-R239 HydrophobicContact CE1-CG 4.11Å
104	Y	87.8	Confident	75.6	Confident	59 Å²	59	53 Å²	53	23%	0.231	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	122.1	172.6	-70.5	-82.6	0	0	0	109.9	I144 I212 R238	Y104-I144 HydrophobicContact CD1-CG1 3.98Å; Y104-I144 HydrophobicContact CE1-CD1 3.83Å; Y104-I144 HydrophobicContact CE1-CG1 3.75Å; Y104-I212 PolarHBondContact O-N 2.83Å; Y104-R238 PolarHBondContact OH-NH1 3.05Å
105	V	90.6	Very high	77.9	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	166.7	-176.4	-60.7	0	0	0	0	110.3	L143 L145 F209 Q210	V105-L143 HydrophobicContact CG2-CB 4.33Å; V105-L143 PolarHBondContact N-O 2.87Å; V105-L143 PolarHBondContact O-N 3.45Å; V105-L145 HydrophobicContact CG1-CB 4.37Å; V105-L145 HydrophobicContact CG2-CB 3.99Å; V105-F209 HydrophobicContact CB-CB 4.22Å; V105-F209 HydrophobicContact CB-CD1 4.47Å; V105-F209 HydrophobicContact CG2-CB 4.45Å; V105-F209 HydrophobicContact CG2-CD1 3.83Å; V105-F209 HydrophobicContact CG2-CG 4.45Å; V105-Q210 CarbonylContact C-O 3.54Å; V105-Q210 WeakPolarHBondContact CA-O 3.2Å; V105-Q210 VanDerWaalsContact CB-O 3.31Å; V105-Q210 WeakPolarHBondContact CB-O 3.42Å
106	E	91.9	Very high	79.9	Confident	56 Å²	56	52 Å²	52	26%	0.262	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	127.7	164.9	-42.8	176.4	125.9	0	0	108.7	A140 Q141 F209 Q210 I212	E106-A140 HydrophobicContact CB-CB 3.9Å; E106-A140 HydrophobicContact CG-CB 4.47Å; E106-Q141 CarbonylContact C-O 3.59Å; E106-Q141 WeakPolarHBondContact CA-O 3.47Å; E106-F209 CarbonylContact O-C 3.57Å; E106-F209 WeakPolarHBondContact O-CA 3.34Å; E106-Q210 HydrophobicContact CB-CB 4.11Å; E106-Q210 HydrophobicContact CG-CB 4.49Å; E106-Q210 PolarHBondContact N-O 3.22Å; E106-Q210 PolarHBondContact O-N 2.99Å; E106-I212 HydrophobicContact CG-CD1 3.64Å; E106-I212 HydrophobicContact CG-CG1 3.89Å
107	H	92.8	Very high	81.8	Confident	34 Å²	34	52.3 Å²	52.3	16%	0.157	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	133	170.7	177.7	-96.2	0	0	0	109.7	A109 T110 A140 Q141 L143 F209	H107-A109 VanDerWaalsContact CE1-C 3.43Å; H107-A109 VanDerWaalsContact NE2-C 3.31Å; H107-A109 PolarHBondContact NE2-O 3.26Å; H107-T110 PolarHBondContact CE1-OG1 3.15Å; H107-T110 PolarHBondContact NE2-OG1 3.47Å; H107-A140 CarbonylContact O-C 3.47Å; H107-A140 WeakPolarHBondContact O-CA 3.28Å; H107-Q141 HydrophobicContact CB-CB 4.43Å; H107-Q141 PolarHBondContact N-O 2.92Å; H107-Q141 PolarHBondContact O-N 3.46Å; H107-L143 HydrophobicContact CB-CD1 3.68Å; H107-F209 HydrophobicContact CB-CD1 3.88Å; H107-F209 HydrophobicContact CB-CE1 3.86Å; H107-F209 AromaticContact CD2-CE1 3.69Å; H107-F209 AromaticContact CD2-CZ 3.91Å
108	L	91.2	Very high	83.6	Confident	11 Å²	11	51.4 Å²	51.4	6%	0.058	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-41	-178.9	-60.8	-179.2	0	0	0	112.2	L129 I138 A140 Y185 V188 I208 Q210	L108-L129 HydrophobicContact CB-CD1 4.27Å; L108-L129 HydrophobicContact CD1-CD2 4.1Å; L108-I138 HydrophobicContact CB-CG2 4.13Å; L108-I138 HydrophobicContact CD2-CG2 4.3Å; L108-I138 WeakPolarHBondContact O-CG2 3.47Å; L108-A140 HydrophobicContact CD2-CB 3.92Å; L108-Y185 HydrophobicContact CD1-CD1 3.52Å; L108-Y185 HydrophobicContact CD1-CE1 4.12Å; L108-Y185 HydrophobicContact CD1-CG 4.12Å; L108-Y185 HydrophobicContact CD2-CD1 3.98Å; L108-Y185 HydrophobicContact CD2-CE1 3.76Å; L108-Y185 HydrophobicContact CG-CD1 4.4Å; L108-V188 HydrophobicContact CD1-CG2 4.34Å; L108-I208 HydrophobicContact CB-CG2 4.45Å; L108-I208 HydrophobicContact CD1-CG2 4.35Å; L108-I208 PolarHBondContact N-O 2.93Å; L108-Q210 HydrophobicContact CD1-CB 4.08Å; L108-Q210 HydrophobicContact CD2-CB 4.11Å; L108-Q210 HydrophobicContact CG-CB 4.12Å
109	A	91.4	Very high	85.3	Confident	9 Å²	9	44.7 Å²	44.7	7%	0.074	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	148.3	-176.5	0	0	0	0	0	112.4	H107 F111 L129 I208	H107-A109 VanDerWaalsContact CE1-C 3.43Å; H107-A109 VanDerWaalsContact NE2-C 3.31Å; H107-A109 PolarHBondContact NE2-O 3.26Å; A109-F111 HydrophobicContact CB-CD1 4.33Å; A109-F111 HydrophobicContact CB-CE1 3.73Å; A109-F111 HydrophobicContact CB-CE2 4.26Å; A109-F111 HydrophobicContact CB-CZ 3.69Å; A109-L129 HydrophobicContact CB-CD1 4Å; A109-I208 HydrophobicContact CB-CB 4.48Å; A109-I208 HydrophobicContact CB-CD1 4.47Å; A109-I208 PolarHBondContact N-O 3.32Å; A109-I208 PolarHBondContact O-N 3.15Å
110	T	91.1	Very high	86.4	Confident	50 Å²	50	43.6 Å²	43.6	31%	0.307	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	131.7	159.5	-58.2	0	0	0	0	108.7	H107 E205 M206 H207	H107-T110 PolarHBondContact CE1-OG1 3.15Å; H107-T110 PolarHBondContact NE2-OG1 3.47Å; T110-E205 HydrophobicContact CG2-CB 3.86Å; T110-E205 HydrophobicContact CG2-CG 4.22Å; T110-E205 VanDerWaalsContact CG2-OE2 3.26Å; T110-E205 WeakPolarHBondContact CG2-OE2 3.48Å; T110-M206 CarbonylContact C-O 3.45Å; T110-M206 WeakPolarHBondContact CA-O 3.48Å; T110-H207 PolarHBondContact OG1-ND1 3.44Å
111	F	91.4	Very high	87.1	Confident	11 Å²	11	49.2 Å²	49.2	5%	0.048	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	131.7	178.4	-59.9	-37.8	0	0	0	112.2	A109 V113 L119 K128 M132 E205 M206 I208	A109-F111 HydrophobicContact CB-CD1 4.33Å; A109-F111 HydrophobicContact CB-CE1 3.73Å; A109-F111 HydrophobicContact CB-CE2 4.26Å; A109-F111 HydrophobicContact CB-CZ 3.69Å; F111-V113 PolarHBondContact O-N 2.68Å; F111-L119 HydrophobicContact CB-CD1 3.8Å; F111-L119 HydrophobicContact CD2-CD1 4.46Å; F111-L119 HydrophobicContact CD2-CD2 4.46Å; F111-L119 HydrophobicContact CG-CD1 4.27Å; F111-K128 HydrophobicContact CD1-CD 4.32Å; F111-K128 HydrophobicContact CD2-CD 4.08Å; F111-K128 HydrophobicContact CE1-CD 4.22Å; F111-K128 HydrophobicContact CE2-CB 4.1Å; F111-K128 HydrophobicContact CE2-CD 3.97Å; F111-K128 HydrophobicContact CE2-CG 4.14Å; F111-K128 HydrophobicContact CG-CD 4.27Å; F111-K128 HydrophobicContact CZ-CB 4.48Å; F111-K128 HydrophobicContact CZ-CD 4.04Å; F111-K128 HydrophobicContact CZ-CG 4.11Å; F111-M132 HydrophobicContact CE1-CE 4.08Å; F111-M132 HydrophobicContact CE1-SD 3.42Å; F111-M132 WeakPolarHBondContact CE1-SD 3.43Å; F111-M132 HydrophobicContact CZ-CE 4.49Å; F111-M132 HydrophobicContact CZ-SD 3.59Å; F111-M132 VanDerWaalsContact CZ-SD 3.59Å; F111-E205 CarbonylContact O-C 3.52Å; F111-E205 WeakPolarHBondContact O-CA 3.43Å; F111-M206 PolarHBondContact N-O 3.36Å; F111-M206 PolarHBondContact O-N 2.78Å; F111-I208 HydrophobicContact CD2-CD1 3.89Å; F111-I208 HydrophobicContact CE2-CD1 3.63Å
112	A	89.8	Confident	87.2	Confident	34 Å²	34	50.3 Å²	50.3	28%	0.281	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	128.2	166.5	0	0	0	0	0	111	F117 L119	A112-F117 HydrophobicContact CB-CD2 3.94Å; A112-F117 HydrophobicContact CB-CE2 3.62Å; A112-F117 HydrophobicContact CB-CZ 4.22Å; A112-F117 WeakPolarHBondContact O-CD2 3.33Å; A112-L119 WeakPolarHBondContact O-CD1 3.4Å
113	V	89.8	Confident	87.2	Confident	26 Å²	26	52.8 Å²	52.8	16%	0.158	28%	0.278	C	S	.	.			trans	-98.9	135.8	-177.2	-177.5	0	0	0	0	109.4	F111 L119 V192 T204 M206	F111-V113 PolarHBondContact O-N 2.68Å; V113-L119 WeakPolarHBondContact CG1-O 3.45Å; V113-V192 HydrophobicContact CG2-CG1 4.31Å; V113-T204 HydrophobicContact CB-CG2 3.98Å; V113-T204 HydrophobicContact CG1-CG2 4.44Å; V113-T204 PolarHBondContact N-O 3.01Å; V113-M206 HydrophobicContact CG2-CB 3.52Å; V113-M206 HydrophobicContact CG2-CE 4.38Å
114	G	85.7	Confident	87.2	Confident	13 Å²	13	53.6 Å²	53.6	13%	0.134	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	164.3	153.9	-178.7	0	0	0	0	0	112.3	Q116 F117 G118 L119	G114-Q116 PolarHBondContact O-N 3.35Å; G114-F117 PolarHBondContact O-N 2.71Å; G114-G118 PolarHBondContact O-N 2.86Å; G114-L119 CarbonylContact C-O 3.54Å; G114-L119 PolarHBondContact N-O 3.23Å
115	R	84	Confident	87.3	Confident	229 Å²	229	50.8 Å²	50.8	86%	0.864	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-59.7	-34.3	-179.9	-64.2	-174.6	-176.1	-147.4	0.9	111.9	F117 G118 T120	R115-F117 PolarHBondContact O-N 3.07Å; R115-G118 PolarHBondContact O-N 2.93Å; R115-T120 HydrophobicContact CG-CG2 4.01Å
116	Q	78.8	Confident	87.3	Confident	143 Å²	143	51.4 Å²	51.4	67%	0.668	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-65	-16.8	175	68.2	-79.5	6.4	0	0	114.5	G114	G114-Q116 PolarHBondContact O-N 3.35Å
117	F	79.6	Confident	87.2	Confident	110 Å²	110	55.2 Å²	55.2	48%	0.482	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-106.4	0.6	-179.3	-54.5	-52.4	0	0	0	113.6	A112 G114 R115 L119	A112-F117 HydrophobicContact CB-CD2 3.94Å; A112-F117 HydrophobicContact CB-CE2 3.62Å; A112-F117 HydrophobicContact CB-CZ 4.22Å; A112-F117 WeakPolarHBondContact O-CD2 3.33Å; G114-F117 PolarHBondContact O-N 2.71Å; R115-F117 PolarHBondContact O-N 3.07Å; F117-L119 HydrophobicContact CB-CB 4.39Å; F117-L119 HydrophobicContact CB-CD1 4.25Å; F117-L119 PolarHBondContact O-N 3.29Å
118	G	80.6	Confident	86.9	Confident	47 Å²	47	57 Å²	57	49%	0.485	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	18.6	-174	0	0	0	0	0	114.1	G114 R115	G114-G118 PolarHBondContact O-N 2.86Å; R115-G118 PolarHBondContact O-N 2.93Å
119	L	85.8	Confident	86.8	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.016	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-122.2	106.9	-175.9	-74	165.6	0	0	0	109	F111 A112 V113 G114 F117 D124 K128	F111-L119 HydrophobicContact CB-CD1 3.8Å; F111-L119 HydrophobicContact CD2-CD1 4.46Å; F111-L119 HydrophobicContact CD2-CD2 4.46Å; F111-L119 HydrophobicContact CG-CD1 4.27Å; A112-L119 WeakPolarHBondContact O-CD1 3.4Å; V113-L119 WeakPolarHBondContact CG1-O 3.45Å; G114-L119 CarbonylContact C-O 3.54Å; G114-L119 PolarHBondContact N-O 3.23Å; F117-L119 HydrophobicContact CB-CB 4.39Å; F117-L119 HydrophobicContact CB-CD1 4.25Å; F117-L119 PolarHBondContact O-N 3.29Å; L119-D124 HydrophobicContact CD2-CB 3.9Å; L119-K128 HydrophobicContact CD1-CD 3.75Å; L119-K128 HydrophobicContact CD2-CB 4.17Å; L119-K128 HydrophobicContact CD2-CD 3.94Å; L119-K128 HydrophobicContact CG-CD 4.19Å
120	T	81.6	Confident	86.6	Confident	57 Å²	57	57.8 Å²	57.8	35%	0.35	30%	0.295	S	S	.	.			trans	-138.7	-21.8	-176.7	38.9	0	0	0	0	114.4	R115 D124	R115-T120 HydrophobicContact CG-CG2 4.01Å; T120-D124 PolarHBondContact N-OD2 3.43Å; T120-D124 PolarHBondContact OG1-OD2 3.31Å; T120-D124 VanDerWaalsContact OG1-OD2 3.07Å
121	F	85.8	Confident	86.3	Confident	127 Å²	127	61.3 Å²	61.3	56%	0.557	31%	0.308	S	S	*	.	S	Bend	trans	-128.9	155.7	179.6	-56.6	-76.3	0	0	0	110.7	A123 D124	F121-A123 PolarHBondContact O-N 3.41Å; F121-A123 VanDerWaalsContact O-N 3.12Å; F121-D124 PolarHBondContact N-OD2 2.98Å; F121-D124 WeakPolarHBondContact O-CA 3.35Å; F121-D124 VanDerWaalsContact O-CB 3.27Å; F121-D124 WeakPolarHBondContact O-CB 3.43Å; F121-D124 PolarHBondContact O-N 3.24Å
122	P	85.3	Confident	85.8	Confident	22 Å²	22	63.9 Å²	63.9	14%	0.143	32%	0.321	C	S	.	.	H	α-helix	trans	-48.6	-39.3	175.2	-35.1	40.7	0	0	0	114.4	D124 G125 I126 Q172 T174 L190	P122-D124 VanDerWaalsContact C-N 3.26Å; P122-D124 PolarHBondContact O-N 3.16Å; P122-G125 PolarHBondContact O-N 3.07Å; P122-G125 VanDerWaalsContact O-N 3.16Å; P122-I126 PolarHBondContact O-N 3.39Å; P122-Q172 VanDerWaalsContact CD-OE1 3.31Å; P122-Q172 HydrophobicContact CG-CB 4.34Å; P122-T174 HydrophobicContact CB-CG2 3.8Å; P122-T174 HydrophobicContact CG-CG2 4.3Å; P122-T174 WeakPolarHBondContact CG-OG1 3.34Å; P122-L190 HydrophobicContact CB-CD1 3.86Å; P122-L190 HydrophobicContact CB-CD2 4.35Å; P122-L190 HydrophobicContact CG-CD1 4.32Å
123	A	87.1	Confident	85.4	Confident	68 Å²	68	65.2 Å²	65.2	56%	0.562	32%	0.321	S	S	*	.	H	α-helix	trans	-66.8	-23.5	177.6	0	0	0	0	0	113.6	F121 R127	F121-A123 PolarHBondContact O-N 3.41Å; F121-A123 VanDerWaalsContact O-N 3.12Å; A123-R127 WeakPolarHBondContact O-CB 3.48Å; A123-R127 PolarHBondContact O-N 3.09Å; A123-R127 VanDerWaalsContact O-N 3.09Å
124	D	90.3	Very high	84.7	Confident	17 Å²	17	72.1 Å²	72.1	9%	0.091	35%	0.349	C	S	.	.	H	α-helix	trans	-71.4	-39.3	172.4	-55.1	-36.4	0	0	0	111	L119 T120 F121 P122 R127 K128	L119-D124 HydrophobicContact CD2-CB 3.9Å; T120-D124 PolarHBondContact N-OD2 3.43Å; T120-D124 PolarHBondContact OG1-OD2 3.31Å; T120-D124 VanDerWaalsContact OG1-OD2 3.07Å; F121-D124 PolarHBondContact N-OD2 2.98Å; F121-D124 WeakPolarHBondContact O-CA 3.35Å; F121-D124 VanDerWaalsContact O-CB 3.27Å; F121-D124 WeakPolarHBondContact O-CB 3.43Å; F121-D124 PolarHBondContact O-N 3.24Å; P122-D124 VanDerWaalsContact C-N 3.26Å; P122-D124 PolarHBondContact O-N 3.16Å; D124-R127 PolarHBondContact O-N 3.14Å; D124-R127 IonicContact OD1-CZ 3.22Å; D124-R127 VanDerWaalsContact OD1-CZ 3.22Å; D124-R127 IonicContact OD1-NH1 2.78Å; D124-R127 PolarHBondContact OD1-NH1 2.99Å; D124-R127 IonicContact OD1-NH2 2.74Å; D124-R127 PolarHBondContact OD1-NH2 3.32Å; D124-K128 WeakPolarHBondContact O-CB 3.32Å; D124-K128 PolarHBondContact O-N 3.45Å
125	G	89.3	Confident	83.8	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-60.5	-52.3	175.3	0	0	0	0	0	112.3	P122 R127 K128 L129	P122-G125 PolarHBondContact O-N 3.07Å; P122-G125 VanDerWaalsContact O-N 3.16Å; G125-R127 VanDerWaalsContact C-N 3.34Å; G125-R127 PolarHBondContact O-N 3Å; G125-K128 PolarHBondContact O-N 2.93Å; G125-L129 WeakPolarHBondContact O-CB 3.47Å; G125-L129 PolarHBondContact O-N 2.9Å
126	I	90.8	Very high	82.5	Confident	13 Å²	13	69.2 Å²	69.2	7%	0.067	35%	0.352	C	S	.	.	H	α-helix	trans	-60.9	-41.6	176.5	-62.4	-61.8	0	0	0	111.8	P122 K128 L129 K130 H176 V188 L190	P122-I126 PolarHBondContact O-N 3.39Å; I126-K128 VanDerWaalsContact C-N 3.34Å; I126-K128 PolarHBondContact O-N 3.3Å; I126-L129 WeakPolarHBondContact O-CB 3.46Å; I126-L129 PolarHBondContact O-N 2.89Å; I126-K130 HydrophobicContact CG2-CD 4.1Å; I126-K130 WeakPolarHBondContact O-CG 3.42Å; I126-K130 PolarHBondContact O-N 2.85Å; I126-H176 HydrophobicContact CD1-CB 3.65Å; I126-H176 HydrophobicContact CG1-CB 3.83Å; I126-V188 HydrophobicContact CD1-CB 4.45Å; I126-V188 HydrophobicContact CD1-CG1 3.97Å; I126-L190 HydrophobicContact CD1-CD2 3.71Å; I126-L190 HydrophobicContact CG1-CD2 3.77Å
127	R	88.8	Confident	81.5	Confident	136 Å²	136	65 Å²	65	51%	0.513	34%	0.341	S	S	.	.	H	α-helix	trans	-62.8	-40.1	176.5	-175.4	176.9	68.1	-107.9	1.7	111.8	A123 D124 G125 Q131	A123-R127 WeakPolarHBondContact O-CB 3.48Å; A123-R127 PolarHBondContact O-N 3.09Å; A123-R127 VanDerWaalsContact O-N 3.09Å; D124-R127 PolarHBondContact O-N 3.14Å; D124-R127 IonicContact OD1-CZ 3.22Å; D124-R127 VanDerWaalsContact OD1-CZ 3.22Å; D124-R127 IonicContact OD1-NH1 2.78Å; D124-R127 PolarHBondContact OD1-NH1 2.99Å; D124-R127 IonicContact OD1-NH2 2.74Å; D124-R127 PolarHBondContact OD1-NH2 3.32Å; G125-R127 VanDerWaalsContact C-N 3.34Å; G125-R127 PolarHBondContact O-N 3Å; R127-Q131 WeakPolarHBondContact O-CB 3.49Å; R127-Q131 PolarHBondContact O-N 2.89Å; R127-Q131 VanDerWaalsContact O-N 3.12Å
128	K	87.8	Confident	81.5	Confident	70 Å²	70	61 Å²	61	30%	0.304	32%	0.324	S	S	.	.	H	α-helix	trans	-70.2	-38.6	175.6	-173.5	-178.8	174.8	-168.4	0	112.1	F111 L119 D124 G125 I126 Q131 M132	F111-K128 HydrophobicContact CD1-CD 4.32Å; F111-K128 HydrophobicContact CD2-CD 4.08Å; F111-K128 HydrophobicContact CE1-CD 4.22Å; F111-K128 HydrophobicContact CE2-CB 4.1Å; F111-K128 HydrophobicContact CE2-CD 3.97Å; F111-K128 HydrophobicContact CE2-CG 4.14Å; F111-K128 HydrophobicContact CG-CD 4.27Å; F111-K128 HydrophobicContact CZ-CB 4.48Å; F111-K128 HydrophobicContact CZ-CD 4.04Å; F111-K128 HydrophobicContact CZ-CG 4.11Å; L119-K128 HydrophobicContact CD1-CD 3.75Å; L119-K128 HydrophobicContact CD2-CB 4.17Å; L119-K128 HydrophobicContact CD2-CD 3.94Å; L119-K128 HydrophobicContact CG-CD 4.19Å; D124-K128 WeakPolarHBondContact O-CB 3.32Å; D124-K128 PolarHBondContact O-N 3.45Å; G125-K128 PolarHBondContact O-N 2.93Å; I126-K128 VanDerWaalsContact C-N 3.34Å; I126-K128 PolarHBondContact O-N 3.3Å; K128-Q131 CarbonylContact O-C 3.6Å; K128-Q131 WeakPolarHBondContact O-CB 3.27Å; K128-Q131 PolarHBondContact O-N 3.28Å; K128-Q131 VanDerWaalsContact O-N 3.15Å; K128-M132 HydrophobicContact CG-CG 4.48Å; K128-M132 HydrophobicContact CG-SD 4.24Å; K128-M132 WeakPolarHBondContact O-CG 3.44Å; K128-M132 PolarHBondContact O-N 2.77Å
129	L	89.2	Confident	81.4	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-57.7	-52.3	174.4	-169.3	77.9	0	0	0	110.7	L108 A109 G125 I126 Q131 M132 E133 I138 Y185 I208	L108-L129 HydrophobicContact CB-CD1 4.27Å; L108-L129 HydrophobicContact CD1-CD2 4.1Å; A109-L129 HydrophobicContact CB-CD1 4Å; G125-L129 WeakPolarHBondContact O-CB 3.47Å; G125-L129 PolarHBondContact O-N 2.9Å; I126-L129 WeakPolarHBondContact O-CB 3.46Å; I126-L129 PolarHBondContact O-N 2.89Å; L129-Q131 PolarHBondContact O-N 3.31Å; L129-M132 PolarHBondContact O-N 2.89Å; L129-E133 PolarHBondContact O-N 3.34Å; L129-I138 HydrophobicContact CD1-CD1 3.75Å; L129-I138 HydrophobicContact CG-CD1 3.98Å; L129-Y185 HydrophobicContact CD2-CD2 4.25Å; L129-Y185 HydrophobicContact CD2-CG 4.13Å; L129-I208 HydrophobicContact CD2-CG2 4.21Å
130	K	86.1	Confident	81.4	Confident	36 Å²	36	63.7 Å²	63.7	16%	0.157	33%	0.327	C	S	.	.	H	α-helix	trans	-66.9	-15.2	176.2	-67.8	175.5	176.1	178.1	0	114.3	I126 K134 H176 E183	I126-K130 HydrophobicContact CG2-CD 4.1Å; I126-K130 WeakPolarHBondContact O-CG 3.42Å; I126-K130 PolarHBondContact O-N 2.85Å; K130-K134 WeakPolarHBondContact O-CE 3.5Å; K130-H176 PolarHBondContact NZ-NE2 3Å; K130-E183 WeakPolarHBondContact CE-OE1 3.45Å; K130-E183 IonicContact NZ-OE1 2.71Å; K130-E183 PolarHBondContact NZ-OE1 3Å; K130-E183 IonicContact NZ-OE2 2.68Å; K130-E183 PolarHBondContact NZ-OE2 3.13Å
131	Q	84.1	Confident	81.6	Confident	124 Å²	124	64.1 Å²	64.1	58%	0.579	33%	0.325	S	S	*	.	H	α-helix	trans	-85.8	-38.6	169.3	-176.7	179.5	-6.3	0	0	111.6	R127 K128 L129	R127-Q131 WeakPolarHBondContact O-CB 3.49Å; R127-Q131 PolarHBondContact O-N 2.89Å; R127-Q131 VanDerWaalsContact O-N 3.12Å; K128-Q131 CarbonylContact O-C 3.6Å; K128-Q131 WeakPolarHBondContact O-CB 3.27Å; K128-Q131 PolarHBondContact O-N 3.28Å; K128-Q131 VanDerWaalsContact O-N 3.15Å; L129-Q131 PolarHBondContact O-N 3.31Å
132	M	82.6	Confident	81.6	Confident	65 Å²	65	61 Å²	61	32%	0.32	32%	0.318	S	S	.	.	H	α-helix	trans	-67.5	-42.7	176.7	-78.6	178.5	54.9	0	0	111.5	F111 K128 L129 K134 N135 S136 I138	F111-M132 HydrophobicContact CE1-CE 4.08Å; F111-M132 HydrophobicContact CE1-SD 3.42Å; F111-M132 WeakPolarHBondContact CE1-SD 3.43Å; F111-M132 HydrophobicContact CZ-CE 4.49Å; F111-M132 HydrophobicContact CZ-SD 3.59Å; F111-M132 VanDerWaalsContact CZ-SD 3.59Å; K128-M132 HydrophobicContact CG-CG 4.48Å; K128-M132 HydrophobicContact CG-SD 4.24Å; K128-M132 WeakPolarHBondContact O-CG 3.44Å; K128-M132 PolarHBondContact O-N 2.77Å; L129-M132 PolarHBondContact O-N 2.89Å; M132-K134 PolarHBondContact O-N 3.42Å; M132-K134 VanDerWaalsContact O-N 3.13Å; M132-N135 CarbonylContact O-C 3.53Å; M132-N135 PolarHBondContact O-N 3.05Å; M132-S136 WeakPolarHBondContact O-CA 3.34Å; M132-S136 PolarHBondContact O-N 3.21Å; M132-S136 PolarHBondContact O-OG 3.18Å; M132-I138 HydrophobicContact CB-CD1 4.4Å
133	E	80.3	Confident	81.9	Confident	63 Å²	63	60.3 Å²	60.3	29%	0.294	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.1	-43.5	173.8	-179.5	-169.2	-175.2	0	0	113.1	L129 N135 I138 T184 Y185	L129-E133 PolarHBondContact O-N 3.34Å; E133-N135 VanDerWaalsContact C-N 3.26Å; E133-N135 PolarHBondContact O-N 2.98Å; E133-I138 HydrophobicContact CB-CD1 3.96Å; E133-T184 WeakPolarHBondContact OE1-CB 3.31Å; E133-T184 VanDerWaalsContact OE1-CG2 3.22Å; E133-T184 WeakPolarHBondContact OE1-CG2 3.3Å; E133-T184 PolarHBondContact OE1-OG1 3.33Å; E133-Y185 HydrophobicContact CB-CE2 4.33Å; E133-Y185 HydrophobicContact CG-CE2 4.06Å
134	K	75.1	Confident	82.1	Confident	170 Å²	170	58 Å²	58	74%	0.739	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-17.3	-176.6	-63.3	179	-175.4	-177.5	0	113.7	K130 M132	K130-K134 WeakPolarHBondContact O-CE 3.5Å; M132-K134 PolarHBondContact O-N 3.42Å; M132-K134 VanDerWaalsContact O-N 3.13Å
135	N	66.3	Low	82.2	Confident	131 Å²	131	57.2 Å²	57.2	70%	0.701	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123	-9.9	-170.4	-66.1	3.8	0	0	0	113.2	M132 E133	M132-N135 CarbonylContact O-C 3.53Å; M132-N135 PolarHBondContact O-N 3.05Å; E133-N135 VanDerWaalsContact C-N 3.26Å; E133-N135 PolarHBondContact O-N 2.98Å
136	S	56.7	Low	82.2	Confident	51 Å²	51	59.4 Å²	59.4	36%	0.357	30%	0.295	S	S	.	.	S	Bend	trans	-161.5	145.3	-173.1	53.4	0	0	0	0	110.7	M132 I138	M132-S136 WeakPolarHBondContact O-CA 3.34Å; M132-S136 PolarHBondContact O-N 3.21Å; M132-S136 PolarHBondContact O-OG 3.18Å; S136-I138 PolarHBondContact O-N 2.93Å
137	A	59.4	Low	82.2	Confident	54 Å²	54	58.8 Å²	58.8	45%	0.446	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-68.1	122.1	168.1	0	0	0	0	0	109.3	Y638	A137-Y638 HydrophobicContact CB-CD2 4.43Å
138	I	78.4	Confident	82.2	Confident	25 Å²	25	53.9 Å²	53.9	13%	0.128	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-83	133.1	165.6	-68.2	160.8	0	0	0	106.6	L108 L129 M132 E133 S136 Y185	L108-I138 HydrophobicContact CB-CG2 4.13Å; L108-I138 HydrophobicContact CD2-CG2 4.3Å; L108-I138 WeakPolarHBondContact O-CG2 3.47Å; L129-I138 HydrophobicContact CD1-CD1 3.75Å; L129-I138 HydrophobicContact CG-CD1 3.98Å; M132-I138 HydrophobicContact CB-CD1 4.4Å; E133-I138 HydrophobicContact CB-CD1 3.96Å; S136-I138 PolarHBondContact O-N 2.93Å; I138-Y185 HydrophobicContact CD1-CD2 4.46Å; I138-Y185 HydrophobicContact CD1-CE2 3.75Å; I138-Y185 HydrophobicContact CG2-CE1 4.48Å
139	W	78.8	Confident	81.9	Confident	75 Å²	75	56.1 Å²	56.1	28%	0.284	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-103.7	116.4	179.7	-172.1	73.6	0	0	0	109.4	Q141 Y638 D639 K652	W139-Q141 HydrophobicContact CE3-CB 3.95Å; W139-Q141 HydrophobicContact CH2-CB 4.08Å; W139-Q141 HydrophobicContact CH2-CG 3.85Å; W139-Q141 HydrophobicContact CZ3-CB 3.51Å; W139-Q141 HydrophobicContact CZ3-CG 3.65Å; W139-Y638 HydrophobicContact CB-CD1 3.56Å; W139-Y638 HydrophobicContact CB-CE1 3.68Å; W139-Y638 AromaticContact CD1-CD1 3.93Å; W139-Y638 AromaticContact CG-CD1 3.85Å; W139-Y638 HydrophobicContact CG-CD1 3.85Å; W139-Y638 HydrophobicContact CG-CE1 4.33Å; W139-D639 PolarHBondContact NE1-OD2 2.9Å; W139-K652 HydrophobicContact CD2-CD 4.1Å; W139-K652 VanDerWaalsContact CD2-NZ 3.31Å; W139-K652 VanDerWaalsContact CE2-CD 3.49Å; W139-K652 HydrophobicContact CH2-CD 4.1Å; W139-K652 HydrophobicContact CZ2-CD 3.51Å
140	A	85.4	Confident	81.8	Confident	32 Å²	32	61.6 Å²	61.6	26%	0.264	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-80.6	122.2	174.9	0	0	0	0	0	109.4	E106 H107 L108	E106-A140 HydrophobicContact CB-CB 3.9Å; E106-A140 HydrophobicContact CG-CB 4.47Å; H107-A140 CarbonylContact O-C 3.47Å; H107-A140 WeakPolarHBondContact O-CA 3.28Å; L108-A140 HydrophobicContact CD2-CB 3.92Å
141	Q	85.4	Confident	82	Confident	66 Å²	66	60 Å²	60	31%	0.308	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	110.1	175.7	-171.8	179.3	-21	0	0	110.8	E106 H107 W139 L143	E106-Q141 CarbonylContact C-O 3.59Å; E106-Q141 WeakPolarHBondContact CA-O 3.47Å; H107-Q141 HydrophobicContact CB-CB 4.43Å; H107-Q141 PolarHBondContact N-O 2.92Å; H107-Q141 PolarHBondContact O-N 3.46Å; W139-Q141 HydrophobicContact CE3-CB 3.95Å; W139-Q141 HydrophobicContact CH2-CB 4.08Å; W139-Q141 HydrophobicContact CH2-CG 3.85Å; W139-Q141 HydrophobicContact CZ3-CB 3.51Å; W139-Q141 HydrophobicContact CZ3-CG 3.65Å; Q141-L143 HydrophobicContact CB-CD1 4.42Å; Q141-L143 HydrophobicContact CG-CD1 4.27Å; Q141-L143 HydrophobicContact CG-CD2 4.46Å; Q141-L143 HydrophobicContact CG-CG 4.15Å; Q141-L143 WeakPolarHBondContact O-CG 3.49Å; Q141-L143 PolarHBondContact O-N 3.4Å
142	P	87	Confident	82.4	Confident	63 Å²	63	54.1 Å²	54.1	41%	0.409	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	127.4	174.2	-25.5	35.7	0	0	0	112.2
143	L	91.3	Very high	82.9	Confident	7 Å²	7	51.3 Å²	51.3	4%	0.037	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	158.7	-173.9	-70.5	167	0	0	0	111.4	V105 H107 Q141 V154 V162	V105-L143 HydrophobicContact CG2-CB 4.33Å; V105-L143 PolarHBondContact N-O 2.87Å; V105-L143 PolarHBondContact O-N 3.45Å; H107-L143 HydrophobicContact CB-CD1 3.68Å; Q141-L143 HydrophobicContact CB-CD1 4.42Å; Q141-L143 HydrophobicContact CG-CD1 4.27Å; Q141-L143 HydrophobicContact CG-CD2 4.46Å; Q141-L143 HydrophobicContact CG-CG 4.15Å; Q141-L143 WeakPolarHBondContact O-CG 3.49Å; Q141-L143 PolarHBondContact O-N 3.4Å; L143-V154 HydrophobicContact CB-CG1 4.09Å; L143-V154 HydrophobicContact CD1-CG1 3.68Å; L143-V154 HydrophobicContact CD2-CG1 4.08Å; L143-V154 HydrophobicContact CG-CG1 4.15Å; L143-V162 HydrophobicContact CD2-CB 4.49Å; L143-V162 HydrophobicContact CD2-CG2 3.97Å
144	I	90.7	Very high	83.4	Confident	20 Å²	20	48.3 Å²	48.3	10%	0.103	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	115.6	174.9	-58.2	176	0	0	0	109	Y104 E155	Y104-I144 HydrophobicContact CD1-CG1 3.98Å; Y104-I144 HydrophobicContact CE1-CD1 3.83Å; Y104-I144 HydrophobicContact CE1-CG1 3.75Å; I144-E155 HydrophobicContact CB-CB 4.38Å; I144-E155 PolarHBondContact N-O 3.39Å; I144-E155 PolarHBondContact O-N 3Å
145	L	92.3	Very high	84.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	116.1	175.3	-163.1	70.5	0	0	0	109.3	S102 Y103 V105 F147 V152 V154 L189 V219	S102-L145 WeakPolarHBondContact CA-O 3.25Å; Y103-L145 WeakPolarHBondContact CD2-O 3.43Å; Y103-L145 PolarHBondContact N-O 3.01Å; Y103-L145 PolarHBondContact O-N 2.91Å; V105-L145 HydrophobicContact CG1-CB 4.37Å; V105-L145 HydrophobicContact CG2-CB 3.99Å; L145-F147 HydrophobicContact CD2-CE1 3.77Å; L145-F147 HydrophobicContact CD2-CZ 4.35Å; L145-F147 HydrophobicContact CG-CE1 3.91Å; L145-V152 HydrophobicContact CD1-CG1 3.44Å; L145-V152 VanDerWaalsContact CD1-CG1 3.44Å; L145-V152 HydrophobicContact CG-CG1 3.82Å; L145-V154 HydrophobicContact CD1-CG2 3.84Å; L145-L189 HydrophobicContact CD2-CD2 3.71Å; L145-V219 HydrophobicContact CD2-CG1 4.44Å
146	R	90.3	Very high	84.9	Confident	46 Å²	46	36.4 Å²	36.4	17%	0.174	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.3	-174.8	-170.8	159.4	63.8	143.8	-19.1	111.9	D97 P101 S102 R148 T153 E155	D97-R146 PolarHBondContact O-NH1 2.88Å; P101-R146 WeakPolarHBondContact O-CA 3.48Å; S102-R146 VanDerWaalsContact OG-CD 3.28Å; S102-R146 WeakPolarHBondContact OG-CD 3.41Å; S102-R146 WeakPolarHBondContact OG-CG 3.5Å; R146-R148 VanDerWaalsContact CZ-NH2 3.32Å; R146-T153 PolarHBondContact N-O 3.05Å; R146-T153 PolarHBondContact O-N 3.11Å; R146-T153 PolarHBondContact O-OG1 3.41Å; R146-E155 IonicContact CZ-OE1 2.72Å; R146-E155 IonicContact CZ-OE2 3.19Å; R146-E155 VanDerWaalsContact NE-CD 3.31Å; R146-E155 IonicContact NE-OE1 3.61Å; R146-E155 PolarHBondContact NE-OE1 2.84Å; R146-E155 IonicContact NE-OE2 2.95Å; R146-E155 PolarHBondContact NE-OE2 3.06Å; R146-E155 VanDerWaalsContact NH2-CD 3.27Å; R146-E155 IonicContact NH2-OE1 2.73Å; R146-E155 PolarHBondContact NH2-OE1 2.77Å; R146-E155 VanDerWaalsContact NH2-OE1 3.16Å; R146-E155 IonicContact NH2-OE2 2.71Å; R146-E155 PolarHBondContact NH2-OE2 3.23Å
147	F	91.3	Very high	85.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	104.6	-171.6	-69.8	-1.5	0	0	0	111.7	T100 P101 Y103 L145 V152 V219 D222 L223 Y226	T100-F147 WeakPolarHBondContact CB-O 3.26Å; T100-F147 WeakPolarHBondContact CG2-O 3.31Å; P101-F147 PolarHBondContact O-N 2.85Å; Y103-F147 HydrophobicContact CD2-CE1 4.26Å; Y103-F147 HydrophobicContact CD2-CE2 4.36Å; Y103-F147 HydrophobicContact CD2-CZ 4.14Å; Y103-F147 HydrophobicContact CE2-CD1 4.19Å; Y103-F147 AromaticContact CE2-CD2 3.64Å; Y103-F147 HydrophobicContact CE2-CD2 3.64Å; Y103-F147 HydrophobicContact CE2-CE1 4.07Å; Y103-F147 AromaticContact CE2-CE2 3.47Å; Y103-F147 HydrophobicContact CE2-CE2 3.47Å; Y103-F147 VanDerWaalsContact CE2-CE2 3.47Å; Y103-F147 AromaticContact CE2-CG 3.98Å; Y103-F147 HydrophobicContact CE2-CG 3.98Å; Y103-F147 AromaticContact CE2-CZ 3.7Å; Y103-F147 HydrophobicContact CE2-CZ 3.7Å; L145-F147 HydrophobicContact CD2-CE1 3.77Å; L145-F147 HydrophobicContact CD2-CZ 4.35Å; L145-F147 HydrophobicContact CG-CE1 3.91Å; F147-V152 HydrophobicContact CD1-CB 4.42Å; F147-V152 HydrophobicContact CD1-CG1 3.92Å; F147-V152 HydrophobicContact CD1-CG2 3.75Å; F147-V152 HydrophobicContact CE1-CG1 4.01Å; F147-V152 HydrophobicContact CE1-CG2 4.01Å; F147-V219 HydrophobicContact CE2-CG1 4.31Å; F147-V219 HydrophobicContact CZ-CG1 3.67Å; F147-D222 HydrophobicContact CD2-CB 4.37Å; F147-D222 HydrophobicContact CE2-CB 3.86Å; F147-L223 HydrophobicContact CE1-CD1 4.18Å; F147-L223 HydrophobicContact CE2-CB 3.84Å; F147-L223 HydrophobicContact CE2-CD1 4.4Å; F147-L223 HydrophobicContact CZ-CB 3.71Å; F147-L223 HydrophobicContact CZ-CD1 4.07Å; F147-L223 HydrophobicContact CZ-CD2 4.35Å; F147-L223 HydrophobicContact CZ-CG 4.25Å; F147-Y226 HydrophobicContact CB-CD1 3.8Å; F147-Y226 HydrophobicContact CB-CD2 4.36Å; F147-Y226 HydrophobicContact CB-CE1 3.59Å; F147-Y226 HydrophobicContact CB-CE2 4.19Å; F147-Y226 HydrophobicContact CB-CG 4.19Å; F147-Y226 HydrophobicContact CD2-CD2 4.09Å; F147-Y226 HydrophobicContact CD2-CE2 4.4Å; F147-Y226 HydrophobicContact CD2-CG 4.25Å; F147-Y226 VanDerWaalsContact O-CE1 3.25Å; F147-Y226 WeakPolarHBondContact O-CE1 3.45Å; F147-Y226 PolarHBondContact O-OH 3.14Å
148	R	87	Confident	86.6	Confident	32 Å²	32	43.7 Å²	43.7	12%	0.121	22%	0.224	C	C	.	.			trans	-95.2	164.9	177.6	-36.1	-46.3	-137.2	96.7	20.7	110.9	D97 R146 N150 A151 T153 Y226	D97-R148 IonicContact OD1-CZ 3.3Å; D97-R148 IonicContact OD1-NH1 2.68Å; D97-R148 PolarHBondContact OD1-NH1 2.9Å; D97-R148 IonicContact OD1-NH2 2.77Å; D97-R148 IonicContact OD2-CZ 3.04Å; D97-R148 IonicContact OD2-NH1 3.96Å; D97-R148 PolarHBondContact OD2-NH1 3.27Å; D97-R148 IonicContact OD2-NH2 3.67Å; D97-R148 PolarHBondContact OD2-NH2 3.02Å; R146-R148 VanDerWaalsContact CZ-NH2 3.32Å; R148-N150 PolarHBondContact O-N 3.42Å; R148-A151 CarbonylContact C-O 3.03Å; R148-A151 VanDerWaalsContact CA-O 3.28Å; R148-A151 WeakPolarHBondContact CA-O 3.48Å; R148-A151 WeakPolarHBondContact CB-O 3.43Å; R148-A151 PolarHBondContact N-O 2.93Å; R148-A151 VanDerWaalsContact O-O 3.11Å; R148-T153 HydrophobicContact CG-CG2 4.08Å; R148-T153 PolarHBondContact NE-OG1 3.4Å; R148-Y226 WeakPolarHBondContact O-CD1 3.37Å; R148-Y226 WeakPolarHBondContact O-CE1 3.48Å
149	H	82.8	Confident	86.4	Confident	118 Å²	118	44.5 Å²	44.5	55%	0.546	24%	0.238	S	C	.	.	S	Bend	trans	-65.9	-19.8	-176.5	-69.1	99.9	0	0	0	114.6	F231	H149-F231 AromaticContact CD2-CD2 3.81Å; H149-F231 AromaticContact CD2-CG 3.97Å; H149-F231 WeakPolarHBondContact O-CZ 3.46Å
150	N	85.9	Confident	86.6	Confident	115 Å²	115	47.6 Å²	47.6	62%	0.615	26%	0.256	S	S	*	.	S	Bend	trans	-124.3	-11.6	-175.9	60.6	-15.3	0	0	0	113.9	R148 L167	R148-N150 PolarHBondContact O-N 3.42Å; N150-L167 WeakPolarHBondContact O-CB 3.36Å; N150-L167 PolarHBondContact O-N 2.78Å
151	A	91.2	Very high	86.7	Confident	3 Å²	3	50.6 Å²	50.6	3%	0.025	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	159.1	-175	0	0	0	0	0	111.5	R148 Q164 F165	R148-A151 CarbonylContact C-O 3.03Å; R148-A151 VanDerWaalsContact CA-O 3.28Å; R148-A151 WeakPolarHBondContact CA-O 3.48Å; R148-A151 WeakPolarHBondContact CB-O 3.43Å; R148-A151 PolarHBondContact N-O 2.93Å; R148-A151 VanDerWaalsContact O-O 3.11Å; A151-Q164 HydrophobicContact CB-CG 3.72Å; A151-F165 CarbonylContact C-O 3.59Å; A151-F165 WeakPolarHBondContact CA-O 3.48Å; A151-F165 VanDerWaalsContact CB-O 3.29Å; A151-F165 WeakPolarHBondContact CB-O 3.17Å
152	V	93.1	Very high	86.8	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	129.1	157.8	175.4	0	0	0	0	107.8	L145 F147 F165 L167 I170 L223	L145-V152 HydrophobicContact CD1-CG1 3.44Å; L145-V152 VanDerWaalsContact CD1-CG1 3.44Å; L145-V152 HydrophobicContact CG-CG1 3.82Å; F147-V152 HydrophobicContact CD1-CB 4.42Å; F147-V152 HydrophobicContact CD1-CG1 3.92Å; F147-V152 HydrophobicContact CD1-CG2 3.75Å; F147-V152 HydrophobicContact CE1-CG1 4.01Å; F147-V152 HydrophobicContact CE1-CG2 4.01Å; V152-F165 HydrophobicContact CB-CB 4.46Å; V152-F165 HydrophobicContact CB-CD2 4.34Å; V152-F165 HydrophobicContact CG1-CD2 4.38Å; V152-F165 PolarHBondContact N-O 2.94Å; V152-F165 PolarHBondContact O-N 3.47Å; V152-L167 HydrophobicContact CG2-CD1 4.37Å; V152-I170 HydrophobicContact CB-CD1 4.04Å; V152-I170 HydrophobicContact CG2-CD1 3.66Å; V152-L223 HydrophobicContact CG2-CD1 3.55Å
153	T	92	Very high	87	Confident	6 Å²	6	51.3 Å²	51.3	4%	0.037	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	141.6	171.5	46.7	0	0	0	0	110	R146 R148 E155 L161 Q164	R146-T153 PolarHBondContact N-O 3.05Å; R146-T153 PolarHBondContact O-N 3.11Å; R146-T153 PolarHBondContact O-OG1 3.41Å; R148-T153 HydrophobicContact CG-CG2 4.08Å; R148-T153 PolarHBondContact NE-OG1 3.4Å; T153-E155 VanDerWaalsContact CB-OE1 3.27Å; T153-E155 WeakPolarHBondContact CB-OE1 3.41Å; T153-E155 PolarHBondContact OG1-OE1 3.36Å; T153-L161 HydrophobicContact CG2-CD1 3.61Å; T153-Q164 HydrophobicContact CG2-CB 4.41Å; T153-Q164 HydrophobicContact CG2-CG 3.98Å
154	V	92.1	Very high	87	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.006	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.4	170.3	-176	0	0	0	0	106.1	L143 L145 V162 E163 F165 F209	L143-V154 HydrophobicContact CB-CG1 4.09Å; L143-V154 HydrophobicContact CD1-CG1 3.68Å; L143-V154 HydrophobicContact CD2-CG1 4.08Å; L143-V154 HydrophobicContact CG-CG1 4.15Å; L145-V154 HydrophobicContact CD1-CG2 3.84Å; V154-V162 HydrophobicContact CG1-CB 4.31Å; V154-V162 WeakPolarHBondContact O-CB 3.27Å; V154-V162 PolarHBondContact O-N 3.36Å; V154-E163 HydrophobicContact CB-CB 3.95Å; V154-E163 HydrophobicContact CG2-CB 4.07Å; V154-E163 PolarHBondContact N-O 3.27Å; V154-E163 PolarHBondContact O-N 2.76Å; V154-E163 VanDerWaalsContact O-N 3.15Å; V154-F165 HydrophobicContact CG2-CD2 4.21Å; V154-F165 HydrophobicContact CG2-CE2 3.5Å; V154-F165 VanDerWaalsContact CG2-CE2 3.5Å; V154-F165 HydrophobicContact CG2-CZ 4.23Å; V154-F209 HydrophobicContact CG2-CZ 4.44Å
155	E	88.4	Confident	87.1	Confident	13 Å²	13	55.2 Å²	55.2	6%	0.061	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	150.2	-172.7	-67.3	159.2	-145.5	0	0	109.5	I144 R146 T153 E160 L161	I144-E155 HydrophobicContact CB-CB 4.38Å; I144-E155 PolarHBondContact N-O 3.39Å; I144-E155 PolarHBondContact O-N 3Å; R146-E155 IonicContact CZ-OE1 2.72Å; R146-E155 IonicContact CZ-OE2 3.19Å; R146-E155 VanDerWaalsContact NE-CD 3.31Å; R146-E155 IonicContact NE-OE1 3.61Å; R146-E155 PolarHBondContact NE-OE1 2.84Å; R146-E155 IonicContact NE-OE2 2.95Å; R146-E155 PolarHBondContact NE-OE2 3.06Å; R146-E155 VanDerWaalsContact NH2-CD 3.27Å; R146-E155 IonicContact NH2-OE1 2.73Å; R146-E155 PolarHBondContact NH2-OE1 2.77Å; R146-E155 VanDerWaalsContact NH2-OE1 3.16Å; R146-E155 IonicContact NH2-OE2 2.71Å; R146-E155 PolarHBondContact NH2-OE2 3.23Å; T153-E155 VanDerWaalsContact CB-OE1 3.27Å; T153-E155 WeakPolarHBondContact CB-OE1 3.41Å; T153-E155 PolarHBondContact OG1-OE1 3.36Å; E155-E160 CarbonylContact C-O 3.53Å; E155-E160 VanDerWaalsContact CA-O 3.22Å; E155-E160 WeakPolarHBondContact CA-O 3.32Å; E155-L161 HydrophobicContact CG-CD1 4.32Å
156	D	84.1	Confident	87.1	Confident	37 Å²	37	56.8 Å²	56.8	20%	0.198	30%	0.297	C	S	.	.			trans	-83.8	-177.9	177.7	86.2	-23.9	0	0	0	112.5	N158 G159 E160 V162	D156-N158 PolarHBondContact O-N 2.84Å; D156-N158 WeakPolarHBondContact OD1-CA 3.37Å; D156-N158 WeakPolarHBondContact OD1-CB 3.31Å; D156-N158 PolarHBondContact OD1-N 3.01Å; D156-N158 PolarHBondContact OD2-ND2 2.66Å; D156-G159 PolarHBondContact O-N 2.8Å; D156-G159 VanDerWaalsContact O-N 3.08Å; D156-G159 PolarHBondContact OD1-N 3.4Å; D156-E160 PolarHBondContact N-O 3.23Å; D156-E160 PolarHBondContact OD1-N 2.88Å; D156-V162 HydrophobicContact CB-CG2 3.94Å
157	D	76.6	Confident	87.1	Confident	119 Å²	119	55.4 Å²	55.4	64%	0.636	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-22.2	177.5	-74	-28	0	0	0	113.8
158	N	75.3	Confident	87	Confident	140 Å²	140	60.9 Å²	60.9	75%	0.749	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-18.6	176.5	-54.4	-73.2	0	0	0	112.3	D156	D156-N158 PolarHBondContact O-N 2.84Å; D156-N158 WeakPolarHBondContact OD1-CA 3.37Å; D156-N158 WeakPolarHBondContact OD1-CB 3.31Å; D156-N158 PolarHBondContact OD1-N 3.01Å; D156-N158 PolarHBondContact OD2-ND2 2.66Å
159	G	73.6	Confident	87.2	Confident	42 Å²	42	60.3 Å²	60.3	43%	0.433	32%	0.318	S	S	.	.			trans	93.6	11.4	-174.6	0	0	0	0	0	114.3	D156	D156-G159 PolarHBondContact O-N 2.8Å; D156-G159 VanDerWaalsContact O-N 3.08Å; D156-G159 PolarHBondContact OD1-N 3.4Å
160	E	82.1	Confident	87.7	Confident	140 Å²	140	54.9 Å²	54.9	65%	0.654	29%	0.293	S	S	*	.			trans	-75.2	145.8	173.3	-70.2	-62	156.1	0	0	110.9	E155 D156 V162	E155-E160 CarbonylContact C-O 3.53Å; E155-E160 VanDerWaalsContact CA-O 3.22Å; E155-E160 WeakPolarHBondContact CA-O 3.32Å; D156-E160 PolarHBondContact N-O 3.23Å; D156-E160 PolarHBondContact OD1-N 2.88Å; E160-V162 PolarHBondContact O-N 2.98Å
161	L	87.6	Confident	87.9	Confident	94 Å²	94	53 Å²	53	49%	0.492	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	110.6	-175.5	-178.3	66.7	0	0	0	111.1	T153 E155 E163 Q164	T153-L161 HydrophobicContact CG2-CD1 3.61Å; E155-L161 HydrophobicContact CG-CD1 4.32Å; L161-E163 WeakPolarHBondContact CD1-O 3.21Å; L161-Q164 HydrophobicContact CD1-CB 4.46Å; L161-Q164 HydrophobicContact CD2-CB 4.46Å
162	V	88.4	Confident	87.7	Confident	75 Å²	75	57 Å²	57	46%	0.455	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-49.1	176.5	-179.6	0	0	0	0	111.1	L143 V154 D156 E160	L143-V162 HydrophobicContact CD2-CB 4.49Å; L143-V162 HydrophobicContact CD2-CG2 3.97Å; V154-V162 HydrophobicContact CG1-CB 4.31Å; V154-V162 WeakPolarHBondContact O-CB 3.27Å; V154-V162 PolarHBondContact O-N 3.36Å; D156-V162 HydrophobicContact CB-CG2 3.94Å; E160-V162 PolarHBondContact O-N 2.98Å
163	E	90.3	Very high	87.8	Confident	70 Å²	70	57.6 Å²	57.6	33%	0.327	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	152.3	-175.9	-161.1	170.4	-165.6	0	0	111.5	V154 L161 F165 H207	V154-E163 HydrophobicContact CB-CB 3.95Å; V154-E163 HydrophobicContact CG2-CB 4.07Å; V154-E163 PolarHBondContact N-O 3.27Å; V154-E163 PolarHBondContact O-N 2.76Å; V154-E163 VanDerWaalsContact O-N 3.15Å; L161-E163 WeakPolarHBondContact CD1-O 3.21Å; E163-F165 HydrophobicContact CB-CZ 4.42Å; E163-F165 HydrophobicContact CG-CD1 4.43Å; E163-F165 HydrophobicContact CG-CE1 3.72Å; E163-F165 HydrophobicContact CG-CZ 3.79Å; E163-F165 VanDerWaalsContact OE1-CE1 3.26Å; E163-F165 WeakPolarHBondContact OE1-CE1 3.47Å; E163-F165 WeakPolarHBondContact OE2-CZ 3.39Å; E163-H207 IonicContact OE1-CE1 3.44Å
164	Q	91.3	Very high	87.8	Confident	103 Å²	103	59.4 Å²	59.4	48%	0.481	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	117	178.8	-175	177.5	46.2	0	0	111.7	A151 T153 L161 P166	A151-Q164 HydrophobicContact CB-CG 3.72Å; T153-Q164 HydrophobicContact CG2-CB 4.41Å; T153-Q164 HydrophobicContact CG2-CG 3.98Å; L161-Q164 HydrophobicContact CD1-CB 4.46Å; L161-Q164 HydrophobicContact CD2-CB 4.46Å; Q164-P166 WeakPolarHBondContact O-CD 3.3Å
165	F	92.9	Very high	87.9	Confident	6 Å²	6	60.8 Å²	60.8	3%	0.026	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	112.6	179.1	-53.5	-59.1	0	0	0	110.7	A151 V152 V154 E163 L167 I170 F191 V193 H207 F209	A151-F165 CarbonylContact C-O 3.59Å; A151-F165 WeakPolarHBondContact CA-O 3.48Å; A151-F165 VanDerWaalsContact CB-O 3.29Å; A151-F165 WeakPolarHBondContact CB-O 3.17Å; V152-F165 HydrophobicContact CB-CB 4.46Å; V152-F165 HydrophobicContact CB-CD2 4.34Å; V152-F165 HydrophobicContact CG1-CD2 4.38Å; V152-F165 PolarHBondContact N-O 2.94Å; V152-F165 PolarHBondContact O-N 3.47Å; V154-F165 HydrophobicContact CG2-CD2 4.21Å; V154-F165 HydrophobicContact CG2-CE2 3.5Å; V154-F165 VanDerWaalsContact CG2-CE2 3.5Å; V154-F165 HydrophobicContact CG2-CZ 4.23Å; E163-F165 HydrophobicContact CB-CZ 4.42Å; E163-F165 HydrophobicContact CG-CD1 4.43Å; E163-F165 HydrophobicContact CG-CE1 3.72Å; E163-F165 HydrophobicContact CG-CZ 3.79Å; E163-F165 VanDerWaalsContact OE1-CE1 3.26Å; E163-F165 WeakPolarHBondContact OE1-CE1 3.47Å; E163-F165 WeakPolarHBondContact OE2-CZ 3.39Å; F165-L167 PolarHBondContact O-N 3.03Å; F165-I170 HydrophobicContact CB-CD1 3.78Å; F165-I170 HydrophobicContact CB-CG1 4.02Å; F165-F191 AromaticContact CD2-CE2 3.7Å; F165-F191 HydrophobicContact CD2-CE2 3.7Å; F165-F191 AromaticContact CD2-CZ 3.66Å; F165-F191 HydrophobicContact CD2-CZ 3.66Å; F165-F191 AromaticContact CE2-CE2 3.83Å; F165-F191 HydrophobicContact CE2-CE2 3.83Å; F165-F191 AromaticContact CE2-CZ 3.59Å; F165-F191 HydrophobicContact CE2-CZ 3.59Å; F165-F191 HydrophobicContact CG-CE2 4.08Å; F165-F191 HydrophobicContact CG-CZ 4.49Å; F165-F191 HydrophobicContact CZ-CE2 4.32Å; F165-F191 HydrophobicContact CZ-CZ 4.37Å; F165-V193 HydrophobicContact CB-CG2 4.4Å; F165-V193 HydrophobicContact CD1-CG1 4.26Å; F165-V193 HydrophobicContact CD1-CG2 3.64Å; F165-V193 HydrophobicContact CE1-CG2 4.09Å; F165-V193 HydrophobicContact CG-CG2 4.08Å; F165-H207 AromaticContact CE1-CE1 3.33Å; F165-H207 WeakPolarHBondContact CE1-CE1 3.4Å; F165-H207 AromaticContact CE1-ND1 3.63Å; F165-H207 AromaticContact CE1-NE2 3.61Å; F165-H207 AromaticContact CZ-CE1 3.67Å; F165-H207 AromaticContact CZ-CG 3.83Å; F165-H207 AromaticContact CZ-ND1 3.43Å; F165-H207 WeakPolarHBondContact CZ-ND1 3.25Å; F165-F209 HydrophobicContact CE2-CZ 4.37Å
166	P	92.1	Very high	88	Confident	32 Å²	32	62.2 Å²	62.2	21%	0.208	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	129.6	173.2	-22.5	33.9	0	0	0	110.6	Q164 E168 L169	Q164-P166 WeakPolarHBondContact O-CD 3.3Å; P166-E168 HydrophobicContact CB-CG 4.29Å; P166-E168 PolarHBondContact O-N 3.35Å; P166-E168 VanDerWaalsContact O-N 3.1Å; P166-L169 HydrophobicContact CB-CD1 4.06Å; P166-L169 HydrophobicContact CB-CG 4.16Å; P166-L169 HydrophobicContact CG-CD1 3.89Å; P166-L169 PolarHBondContact O-N 3.3Å
167	L	90.3	Very high	88.1	Confident	18 Å²	18	63.7 Å²	63.7	9%	0.094	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-20.3	-170.9	-164.1	62.3	0	0	0	112.9	N150 V152 F165 L169 I170 L223 Y226 V227 F231	N150-L167 WeakPolarHBondContact O-CB 3.36Å; N150-L167 PolarHBondContact O-N 2.78Å; V152-L167 HydrophobicContact CG2-CD1 4.37Å; F165-L167 PolarHBondContact O-N 3.03Å; L167-L169 VanDerWaalsContact C-N 3.29Å; L167-L169 PolarHBondContact O-N 3.17Å; L167-I170 HydrophobicContact CD1-CD1 4.15Å; L167-L223 HydrophobicContact CD1-CD1 4.32Å; L167-Y226 HydrophobicContact CD2-CD1 4.41Å; L167-Y226 WeakPolarHBondContact CD2-O 3.44Å; L167-V227 HydrophobicContact CD1-CG2 3.65Å; L167-V227 HydrophobicContact CG-CG2 4.29Å; L167-F231 HydrophobicContact CD2-CE1 3.97Å; L167-F231 HydrophobicContact CD2-CZ 4.35Å
168	E	89.7	Confident	88.1	Confident	115 Å²	115	59.1 Å²	59.1	54%	0.537	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-13.5	172.2	65.7	175.9	-169	0	0	114.4	P166 R194 K198	P166-E168 HydrophobicContact CB-CG 4.29Å; P166-E168 PolarHBondContact O-N 3.35Å; P166-E168 VanDerWaalsContact O-N 3.1Å; E168-R194 PolarHBondContact O-NH2 3.48Å; E168-K198 IonicContact OE1-NZ 3.14Å; E168-K198 PolarHBondContact OE1-NZ 3.24Å; E168-K198 IonicContact OE2-NZ 2.69Å
169	L	92	Very high	87.5	Confident	19 Å²	19	59.5 Å²	59.5	10%	0.099	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-16.4	-179.8	-58.7	179.4	0	0	0	113.1	P166 L167 V193 R194 D196	P166-L169 HydrophobicContact CB-CD1 4.06Å; P166-L169 HydrophobicContact CB-CG 4.16Å; P166-L169 HydrophobicContact CG-CD1 3.89Å; P166-L169 PolarHBondContact O-N 3.3Å; L167-L169 VanDerWaalsContact C-N 3.29Å; L167-L169 PolarHBondContact O-N 3.17Å; L169-V193 HydrophobicContact CB-CG1 4.07Å; L169-R194 HydrophobicContact CD2-CB 4.41Å; L169-R194 PolarHBondContact O-N 3.16Å; L169-D196 HydrophobicContact CD1-CB 3.76Å
170	I	93.4	Very high	87.1	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.021	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	122.8	-179.9	-56.9	-178.5	0	0	0	110.6	V152 F165 L167 P173 F191 V192 L223 V227	V152-I170 HydrophobicContact CB-CD1 4.04Å; V152-I170 HydrophobicContact CG2-CD1 3.66Å; F165-I170 HydrophobicContact CB-CD1 3.78Å; F165-I170 HydrophobicContact CB-CG1 4.02Å; L167-I170 HydrophobicContact CD1-CD1 4.15Å; I170-P173 HydrophobicContact CG2-CG 4.24Å; I170-F191 HydrophobicContact CD1-CE2 4.48Å; I170-F191 HydrophobicContact CG2-CB 4.01Å; I170-F191 HydrophobicContact CG2-CD2 3.91Å; I170-F191 HydrophobicContact CG2-CG 4.1Å; I170-V192 CarbonylContact C-O 3.38Å; I170-V192 WeakPolarHBondContact CA-O 3.32Å; I170-L223 HydrophobicContact CD1-CD1 4.35Å; I170-L223 HydrophobicContact CG2-CD2 4.44Å; I170-V227 HydrophobicContact CB-CG2 4.12Å; I170-V227 HydrophobicContact CG2-CG2 4.1Å
171	E	89.8	Confident	85.9	Confident	75 Å²	75	60.4 Å²	60.4	35%	0.35	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	158.4	174.2	-66	-164.9	151.2	0	0	111.8	P173 V192 R194	E171-P173 VanDerWaalsContact C-CD 3.44Å; E171-V192 PolarHBondContact N-O 3.05Å; E171-V192 PolarHBondContact O-N 2.92Å; E171-R194 VanDerWaalsContact CD-CD 3.5Å; E171-R194 HydrophobicContact CG-CG 4.3Å; E171-R194 IonicContact OE1-CZ 2.69Å; E171-R194 IonicContact OE1-NE 3.99Å; E171-R194 IonicContact OE1-NH1 2.91Å; E171-R194 PolarHBondContact OE1-NH1 2.95Å; E171-R194 IonicContact OE1-NH2 3.16Å
172	Q	87.1	Confident	84.6	Confident	89 Å²	89	66.1 Å²	66.1	42%	0.416	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	50.1	46.8	173.2	-54.2	-178.2	-0.3	0	0	117	P122 T174	P122-Q172 VanDerWaalsContact CD-OE1 3.31Å; P122-Q172 HydrophobicContact CG-CB 4.34Å; Q172-T174 PolarHBondContact O-N 3.12Å; Q172-T174 VanDerWaalsContact O-N 3.08Å; Q172-T174 PolarHBondContact O-OG1 3.27Å
173	P	94.3	Very high	83.7	Confident	12 Å²	12	65.5 Å²	65.5	8%	0.078	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	119.6	170.4	-20.8	32.5	0	0	0	111	I170 E171 L190 F191 L223 K224	I170-P173 HydrophobicContact CG2-CG 4.24Å; E171-P173 VanDerWaalsContact C-CD 3.44Å; P173-L190 WeakPolarHBondContact CA-O 3.45Å; P173-F191 HydrophobicContact CB-CB 4.48Å; P173-F191 HydrophobicContact CG-CB 4.49Å; P173-L223 HydrophobicContact CB-CB 4.16Å; P173-L223 HydrophobicContact CB-CD2 4Å; P173-L223 HydrophobicContact CB-CG 4Å; P173-L223 HydrophobicContact CG-CB 4.35Å; P173-L223 HydrophobicContact CG-CD2 4.07Å; P173-L223 HydrophobicContact CG-CG 3.8Å; P173-K224 HydrophobicContact CB-CG 4.17Å; P173-K224 HydrophobicContact CG-CG 4.26Å; P173-K224 WeakPolarHBondContact O-CE 3.38Å
174	T	92.8	Very high	82.6	Confident	43 Å²	43	66.2 Å²	66.2	26%	0.264	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	134.7	-169.6	-56.4	0	0	0	0	109.4	P122 Q172 L190	P122-T174 HydrophobicContact CB-CG2 3.8Å; P122-T174 HydrophobicContact CG-CG2 4.3Å; P122-T174 WeakPolarHBondContact CG-OG1 3.34Å; Q172-T174 PolarHBondContact O-N 3.12Å; Q172-T174 VanDerWaalsContact O-N 3.08Å; Q172-T174 PolarHBondContact O-OG1 3.27Å; T174-L190 PolarHBondContact N-O 3.4Å; T174-L190 PolarHBondContact O-N 2.93Å
175	A	93.7	Very high	81.9	Confident	31 Å²	31	63.3 Å²	63.3	26%	0.256	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	139	169.2	0	0	0	0	0	109.5	V188 A216 A220	A175-V188 CarbonylContact C-O 3.5Å; A175-V188 WeakPolarHBondContact CA-O 3.39Å; A175-A216 HydrophobicContact CB-CB 4.03Å; A175-A220 HydrophobicContact CB-CB 4.17Å
176	H	90.1	Very high	81.4	Confident	43 Å²	43	65.3 Å²	65.3	20%	0.199	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	115.4	164.6	-178.7	62.1	0	0	0	109.1	I126 K130 N187 V188	I126-H176 HydrophobicContact CD1-CB 3.65Å; I126-H176 HydrophobicContact CG1-CB 3.83Å; K130-H176 PolarHBondContact NZ-NE2 3Å; H176-N187 PolarHBondContact O-N 3.22Å; H176-V188 HydrophobicContact CB-CB 4.36Å; H176-V188 PolarHBondContact N-O 2.99Å; H176-V188 PolarHBondContact O-N 2.92Å
177	V	86.3	Confident	81.3	Confident	67 Å²	67	65.4 Å²	65.4	41%	0.406	34%	0.342	S	S	.	.			trans	-121.7	143	172	-175	0	0	0	0	106.9	N186	V177-N186 WeakPolarHBondContact CA-OD1 3.43Å
178	S	76.8	Confident	81.4	Confident	23 Å²	23	64.5 Å²	64.5	16%	0.161	34%	0.337	C	S	.	.			trans	-131.3	153.1	-178.1	-168.7	0	0	0	0	110.8	D180 E183 N186	S178-D180 PolarHBondContact OG-N 3Å; S178-E183 WeakPolarHBondContact CB-OE2 3.32Å; S178-E183 PolarHBondContact OG-OE2 2.88Å; S178-N186 PolarHBondContact N-OD1 2.68Å; S178-N186 PolarHBondContact O-ND2 3.37Å; S178-N186 PolarHBondContact O-OD1 2.95Å
179	N	63.4	Low	81.7	Confident	149 Å²	149	59 Å²	59	80%	0.797	31%	0.312	S	S	*	.	S	Bend	trans	-105.6	-0.1	178.6	-64.3	18.7	0	0	0	112.1
180	D	64.4	Low	81.9	Confident	75 Å²	75	58.2 Å²	58.2	40%	0.401	31%	0.307	S	S	.	.			trans	-88.2	114.6	173.3	-171.4	-12.5	0	0	0	109.9	S178 R182 E183	S178-D180 PolarHBondContact OG-N 3Å; D180-R182 PolarHBondContact O-N 2.77Å; D180-R182 VanDerWaalsContact O-N 3.08Å; D180-R182 VanDerWaalsContact OD1-CB 3.28Å; D180-R182 WeakPolarHBondContact OD1-CB 3.38Å; D180-R182 WeakPolarHBondContact OD1-CG 3.5Å; D180-R182 PolarHBondContact OD1-N 3.22Å; D180-E183 HydrophobicContact CB-CG 4.2Å; D180-E183 PolarHBondContact O-N 3.45Å; D180-E183 VanDerWaalsContact O-N 3.14Å
181	S	57.6	Low	82	Confident	125 Å²	125	58 Å²	58	87%	0.874	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	0.5	178.9	57	0	0	0	0	114.4
182	R	60.7	Low	82.2	Confident	215 Å²	215	54.9 Å²	54.9	81%	0.811	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-7.3	172.5	-60	169.2	174.4	163.9	-0.8	113.4	D180	D180-R182 PolarHBondContact O-N 2.77Å; D180-R182 VanDerWaalsContact O-N 3.08Å; D180-R182 VanDerWaalsContact OD1-CB 3.28Å; D180-R182 WeakPolarHBondContact OD1-CB 3.38Å; D180-R182 WeakPolarHBondContact OD1-CG 3.5Å; D180-R182 PolarHBondContact OD1-N 3.22Å
183	E	68.7	Low	82.4	Confident	61 Å²	61	51.3 Å²	51.3	29%	0.285	28%	0.276	S	S	.	.			trans	-88.5	115.2	175.5	-63.6	-165.5	136.3	0	0	110.3	K130 S178 D180	K130-E183 WeakPolarHBondContact CE-OE1 3.45Å; K130-E183 IonicContact NZ-OE1 2.71Å; K130-E183 PolarHBondContact NZ-OE1 3Å; K130-E183 IonicContact NZ-OE2 2.68Å; K130-E183 PolarHBondContact NZ-OE2 3.13Å; S178-E183 WeakPolarHBondContact CB-OE2 3.32Å; S178-E183 PolarHBondContact OG-OE2 2.88Å; D180-E183 HydrophobicContact CB-CG 4.2Å; D180-E183 PolarHBondContact O-N 3.45Å; D180-E183 VanDerWaalsContact O-N 3.14Å
184	T	67.6	Low	82.2	Confident	85 Å²	85	55.5 Å²	55.5	52%	0.521	29%	0.291	S	S	.	.	S	Bend	trans	-63.5	-42.8	-177	50	0	0	0	0	113	E133	E133-T184 WeakPolarHBondContact OE1-CB 3.31Å; E133-T184 VanDerWaalsContact OE1-CG2 3.22Å; E133-T184 WeakPolarHBondContact OE1-CG2 3.3Å; E133-T184 PolarHBondContact OE1-OG1 3.33Å
185	Y	76.8	Confident	81.8	Confident	43 Å²	43	57.8 Å²	57.8	17%	0.169	30%	0.298	C	S	.	.			trans	-97.5	95.6	179.2	-55.5	-69.4	0	0	0	110.7	L108 L129 E133 I138	L108-Y185 HydrophobicContact CD1-CD1 3.52Å; L108-Y185 HydrophobicContact CD1-CE1 4.12Å; L108-Y185 HydrophobicContact CD1-CG 4.12Å; L108-Y185 HydrophobicContact CD2-CD1 3.98Å; L108-Y185 HydrophobicContact CD2-CE1 3.76Å; L108-Y185 HydrophobicContact CG-CD1 4.4Å; L129-Y185 HydrophobicContact CD2-CD2 4.25Å; L129-Y185 HydrophobicContact CD2-CG 4.13Å; E133-Y185 HydrophobicContact CB-CE2 4.33Å; E133-Y185 HydrophobicContact CG-CE2 4.06Å; I138-Y185 HydrophobicContact CD1-CD2 4.46Å; I138-Y185 HydrophobicContact CD1-CE2 3.75Å; I138-Y185 HydrophobicContact CG2-CE1 4.48Å
186	N	81.8	Confident	81.1	Confident	47 Å²	47	56.8 Å²	56.8	25%	0.251	29%	0.289	S	S	.	.			trans	-131.2	149.2	178.8	-171.6	5.8	0	0	0	108.9	V177 S178 Q210	V177-N186 WeakPolarHBondContact CA-OD1 3.43Å; S178-N186 PolarHBondContact N-OD1 2.68Å; S178-N186 PolarHBondContact O-ND2 3.37Å; S178-N186 PolarHBondContact O-OD1 2.95Å; N186-Q210 PolarHBondContact O-NE2 2.81Å; N186-Q210 PolarHBondContact O-OE1 3.4Å
187	N	90.3	Very high	80	Confident	34 Å²	34	65.5 Å²	65.5	18%	0.182	32%	0.32	C	S	.	.	S	Bend	trans	65.2	47.2	-167.5	-164.2	51.1	0	0	0	112.7	H176 Q210 C211 V214 S215 A216	H176-N187 PolarHBondContact O-N 3.22Å; N187-Q210 PolarHBondContact O-NE2 3.14Å; N187-C211 WeakPolarHBondContact ND2-CB 3.19Å; N187-C211 PolarHBondContact ND2-O 2.84Å; N187-C211 WeakPolarHBondContact O-CB 3.36Å; N187-C211 PolarHBondContact O-N 2.84Å; N187-V214 PolarHBondContact ND2-O 3.37Å; N187-S215 WeakPolarHBondContact OD1-CA 3.12Å; N187-A216 PolarHBondContact OD1-N 2.98Å
188	V	93.4	Very high	79	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	128.8	-176.9	176.1	0	0	0	0	110.9	L108 I126 A175 H176 I208 F209 A216	L108-V188 HydrophobicContact CD1-CG2 4.34Å; I126-V188 HydrophobicContact CD1-CB 4.45Å; I126-V188 HydrophobicContact CD1-CG1 3.97Å; A175-V188 CarbonylContact C-O 3.5Å; A175-V188 WeakPolarHBondContact CA-O 3.39Å; H176-V188 HydrophobicContact CB-CB 4.36Å; H176-V188 PolarHBondContact N-O 2.99Å; H176-V188 PolarHBondContact O-N 2.92Å; V188-I208 HydrophobicContact CG1-CG2 3.42Å; V188-I208 VanDerWaalsContact CG1-CG2 3.42Å; V188-F209 CarbonylContact C-O 3.57Å; V188-F209 WeakPolarHBondContact CA-O 3.2Å; V188-A216 VanDerWaalsContact C-CB 3.46Å
189	L	95.6	Very high	78.2	Confident	0 Å²	0	76 Å²	76	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	140.9	166.4	172.3	69	0	0	0	109.5	L145 F209 A216 V219 A220	L145-L189 HydrophobicContact CD2-CD2 3.71Å; L189-F209 HydrophobicContact CB-CB 4.49Å; L189-F209 PolarHBondContact N-O 2.91Å; L189-F209 PolarHBondContact O-N 3.39Å; L189-F209 VanDerWaalsContact O-O 3.13Å; L189-A216 HydrophobicContact CB-CB 4.2Å; L189-V219 HydrophobicContact CD2-CB 4.3Å; L189-V219 HydrophobicContact CD2-CG1 3.63Å; L189-A220 HydrophobicContact CD1-CB 3.72Å
190	L	95.6	Very high	77.8	Confident	1 Å²	1	77 Å²	77	1%	0.005	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	154.7	165.3	76	104.8	0	0	0	112.3	P122 I126 P173 T174 M206 H207 I208	P122-L190 HydrophobicContact CB-CD1 3.86Å; P122-L190 HydrophobicContact CB-CD2 4.35Å; P122-L190 HydrophobicContact CG-CD1 4.32Å; I126-L190 HydrophobicContact CD1-CD2 3.71Å; I126-L190 HydrophobicContact CG1-CD2 3.77Å; P173-L190 WeakPolarHBondContact CA-O 3.45Å; T174-L190 PolarHBondContact N-O 3.4Å; T174-L190 PolarHBondContact O-N 2.93Å; L190-M206 HydrophobicContact CD1-CE 4.21Å; L190-M206 HydrophobicContact CD1-CG 3.86Å; L190-M206 HydrophobicContact CD1-SD 3.83Å; L190-H207 VanDerWaalsContact CA-O 3.23Å; L190-H207 WeakPolarHBondContact CA-O 3.49Å; L190-H207 WeakPolarHBondContact CB-O 3.49Å; L190-I208 HydrophobicContact CB-CB 4.41Å; L190-I208 HydrophobicContact CB-CG1 4.03Å; L190-I208 HydrophobicContact CB-CG2 4.42Å
191	F	95.5	Very high	77.6	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	161.2	172.1	53.9	-94.1	0	0	0	110.9	F165 I170 P173 V193 M206 H207 F209 L223	F165-F191 AromaticContact CD2-CE2 3.7Å; F165-F191 HydrophobicContact CD2-CE2 3.7Å; F165-F191 AromaticContact CD2-CZ 3.66Å; F165-F191 HydrophobicContact CD2-CZ 3.66Å; F165-F191 AromaticContact CE2-CE2 3.83Å; F165-F191 HydrophobicContact CE2-CE2 3.83Å; F165-F191 AromaticContact CE2-CZ 3.59Å; F165-F191 HydrophobicContact CE2-CZ 3.59Å; F165-F191 HydrophobicContact CG-CE2 4.08Å; F165-F191 HydrophobicContact CG-CZ 4.49Å; F165-F191 HydrophobicContact CZ-CE2 4.32Å; F165-F191 HydrophobicContact CZ-CZ 4.37Å; I170-F191 HydrophobicContact CD1-CE2 4.48Å; I170-F191 HydrophobicContact CG2-CB 4.01Å; I170-F191 HydrophobicContact CG2-CD2 3.91Å; I170-F191 HydrophobicContact CG2-CG 4.1Å; P173-F191 HydrophobicContact CB-CB 4.48Å; P173-F191 HydrophobicContact CG-CB 4.49Å; F191-V193 HydrophobicContact CD2-CG2 3.83Å; F191-V193 HydrophobicContact CE2-CG2 3.73Å; F191-M206 WeakPolarHBondContact O-CA 3.31Å; F191-H207 HydrophobicContact CE2-CB 4.25Å; F191-H207 HydrophobicContact CZ-CB 4.35Å; F191-H207 PolarHBondContact N-O 3.26Å; F191-H207 VanDerWaalsContact N-O 3.14Å; F191-H207 PolarHBondContact O-N 3.47Å; F191-F209 HydrophobicContact CE1-CD2 4.02Å; F191-F209 AromaticContact CE1-CE2 3.56Å; F191-F209 HydrophobicContact CE1-CE2 3.56Å; F191-F209 AromaticContact CZ-CE2 3.66Å; F191-F209 HydrophobicContact CZ-CE2 3.66Å; F191-F209 HydrophobicContact CZ-CZ 4.34Å; F191-L223 HydrophobicContact CB-CD2 4.45Å; F191-L223 HydrophobicContact CD1-CD2 3.66Å; F191-L223 HydrophobicContact CE1-CD2 4.11Å; F191-L223 HydrophobicContact CG-CD2 4.14Å
192	V	93.3	Very high	77.9	Confident	9 Å²	9	75.8 Å²	75.8	6%	0.055	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	135.9	177.2	178.2	0	0	0	0	109	V113 I170 E171 T204 E205 M206	V113-V192 HydrophobicContact CG2-CG1 4.31Å; I170-V192 CarbonylContact C-O 3.38Å; I170-V192 WeakPolarHBondContact CA-O 3.32Å; E171-V192 PolarHBondContact N-O 3.05Å; E171-V192 PolarHBondContact O-N 2.92Å; V192-T204 HydrophobicContact CG1-CG2 3.6Å; V192-E205 CarbonylContact C-O 3.56Å; V192-E205 VanDerWaalsContact CA-O 3.24Å; V192-E205 WeakPolarHBondContact CA-O 3.45Å; V192-E205 WeakPolarHBondContact CG1-O 3.48Å; V192-M206 HydrophobicContact CG2-CB 4.34Å; V192-M206 HydrophobicContact CG2-CE 3.82Å; V192-M206 HydrophobicContact CG2-CG 4.43Å
193	V	92.6	Very high	78.9	Confident	15 Å²	15	68.7 Å²	68.7	9%	0.091	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	122.3	173	-177	0	0	0	0	107.8	F165 L169 F191 T204 E205 H207	F165-V193 HydrophobicContact CB-CG2 4.4Å; F165-V193 HydrophobicContact CD1-CG1 4.26Å; F165-V193 HydrophobicContact CD1-CG2 3.64Å; F165-V193 HydrophobicContact CE1-CG2 4.09Å; F165-V193 HydrophobicContact CG-CG2 4.08Å; L169-V193 HydrophobicContact CB-CG1 4.07Å; F191-V193 HydrophobicContact CD2-CG2 3.83Å; F191-V193 HydrophobicContact CE2-CG2 3.73Å; V193-T204 CarbonylContact O-C 3.46Å; V193-T204 VanDerWaalsContact O-CA 3.3Å; V193-T204 WeakPolarHBondContact O-CA 3.32Å; V193-T204 WeakPolarHBondContact O-CG2 3.26Å; V193-E205 PolarHBondContact N-O 2.96Å; V193-E205 PolarHBondContact O-N 2.72Å; V193-H207 VanDerWaalsContact CG2-CD2 3.5Å; V193-H207 WeakPolarHBondContact CG2-CD2 3.24Å
194	R	89.7	Confident	79.9	Confident	100 Å²	100	67.8 Å²	67.8	38%	0.377	33%	0.33	S	S	.	.			trans	-77.5	150.7	177.9	-65.2	-174.2	-62.5	-160.8	-3.9	112.4	E168 L169 E171 D196	E168-R194 PolarHBondContact O-NH2 3.48Å; L169-R194 HydrophobicContact CD2-CB 4.41Å; L169-R194 PolarHBondContact O-N 3.16Å; E171-R194 VanDerWaalsContact CD-CD 3.5Å; E171-R194 HydrophobicContact CG-CG 4.3Å; E171-R194 IonicContact OE1-CZ 2.69Å; E171-R194 IonicContact OE1-NE 3.99Å; E171-R194 IonicContact OE1-NH1 2.91Å; E171-R194 PolarHBondContact OE1-NH1 2.95Å; E171-R194 IonicContact OE1-NH2 3.16Å; R194-D196 PolarHBondContact O-N 2.71Å
195	E	84	Confident	81	Confident	91 Å²	91	66.6 Å²	66.6	43%	0.425	32%	0.318	S	S	.	.			trans	-48.3	122.3	167.9	169	173.1	-142	0	0	112.1	R197 T202 T204	E195-R197 PolarHBondContact O-N 3.16Å; E195-R197 VanDerWaalsContact O-N 3.13Å; E195-T202 WeakPolarHBondContact CA-O 3.17Å; E195-T202 VanDerWaalsContact CB-O 3.22Å; E195-T202 WeakPolarHBondContact CB-O 3.5Å; E195-T202 VanDerWaalsContact CG-O 3.24Å; E195-T202 WeakPolarHBondContact CG-O 3.42Å; E195-T204 PolarHBondContact N-OG1 3.24Å
196	D	78.8	Confident	81.8	Confident	9 Å²	9	64.5 Å²	64.5	5%	0.048	31%	0.31	C	S	.	.			trans	-74.1	100.1	171.2	-175.8	-5	0	0	0	109.6	L169 R194 K198 R199 T202	L169-D196 HydrophobicContact CD1-CB 3.76Å; R194-D196 PolarHBondContact O-N 2.71Å; D196-K198 PolarHBondContact O-N 3.34Å; D196-K198 WeakPolarHBondContact OD1-CB 3.23Å; D196-K198 WeakPolarHBondContact OD1-CG 3.39Å; D196-K198 PolarHBondContact OD1-N 2.94Å; D196-R199 HydrophobicContact CB-CB 4.23Å; D196-R199 CarbonylContact O-C 3.5Å; D196-R199 WeakPolarHBondContact O-CA 3.34Å; D196-R199 PolarHBondContact O-N 3.41Å; D196-R199 IonicContact OD2-CZ 3.17Å; D196-R199 VanDerWaalsContact OD2-CZ 3.25Å; D196-R199 IonicContact OD2-NE 3.8Å; D196-R199 PolarHBondContact OD2-NE 3.45Å; D196-R199 IonicContact OD2-NH2 3.72Å; D196-R199 PolarHBondContact OD2-NH2 2.95Å; D196-T202 PolarHBondContact N-OG1 3.04Å
197	R	66.8	Low	82.4	Confident	226 Å²	226	62.4 Å²	62.4	85%	0.853	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-11.2	177.4	-66.9	-175.6	176.9	180	-0.5	114.6	E195	E195-R197 PolarHBondContact O-N 3.16Å; E195-R197 VanDerWaalsContact O-N 3.13Å
198	K	65.5	Low	82.6	Confident	155 Å²	155	60.8 Å²	60.8	67%	0.674	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-23.6	172.3	-50.8	155.7	-171	161.5	0	111.6	E168 D196	E168-K198 IonicContact OE1-NZ 3.14Å; E168-K198 PolarHBondContact OE1-NZ 3.24Å; E168-K198 IonicContact OE2-NZ 2.69Å; D196-K198 PolarHBondContact O-N 3.34Å; D196-K198 WeakPolarHBondContact OD1-CB 3.23Å; D196-K198 WeakPolarHBondContact OD1-CG 3.39Å; D196-K198 PolarHBondContact OD1-N 2.94Å
199	R	61.3	Low	82.7	Confident	155 Å²	155	60.8 Å²	60.8	59%	0.585	29%	0.29	S	S	*	.	S	Bend	trans	-122.5	83.5	178.8	-78.2	178.1	-75.3	-166.3	-1.7	109.6	D196 S201	D196-R199 HydrophobicContact CB-CB 4.23Å; D196-R199 CarbonylContact O-C 3.5Å; D196-R199 WeakPolarHBondContact O-CA 3.34Å; D196-R199 PolarHBondContact O-N 3.41Å; D196-R199 IonicContact OD2-CZ 3.17Å; D196-R199 VanDerWaalsContact OD2-CZ 3.25Å; D196-R199 IonicContact OD2-NE 3.8Å; D196-R199 PolarHBondContact OD2-NE 3.45Å; D196-R199 IonicContact OD2-NH2 3.72Å; D196-R199 PolarHBondContact OD2-NH2 2.95Å; R199-S201 PolarHBondContact O-N 3.48Å
200	M	54.9	Low	82.6	Confident	172 Å²	172	62 Å²	62	85%	0.847	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	39.3	-164.3	-149.7	179.1	-55.5	0	0	116.2
201	S	58.8	Low	82.2	Confident	109 Å²	109	62.1 Å²	62.1	76%	0.762	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-151.3	-1.7	-170.6	-169.4	0	0	0	0	115.3	R199	R199-S201 PolarHBondContact O-N 3.48Å
202	T	65	Low	81.4	Confident	65 Å²	65	65.1 Å²	65.1	40%	0.399	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-102.5	117.9	178.1	53.3	0	0	0	0	110.4	E195 D196	E195-T202 WeakPolarHBondContact CA-O 3.17Å; E195-T202 VanDerWaalsContact CB-O 3.22Å; E195-T202 WeakPolarHBondContact CB-O 3.5Å; E195-T202 VanDerWaalsContact CG-O 3.24Å; E195-T202 WeakPolarHBondContact CG-O 3.42Å; D196-T202 PolarHBondContact N-OG1 3.04Å
203	P	80.8	Confident	80.4	Confident	66 Å²	66	71.1 Å²	71.1	43%	0.429	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-67	171.6	174.6	30.2	-33.4	0	0	0	111.1	E205	P203-E205 HydrophobicContact CG-CG 4.02Å; P203-E205 WeakPolarHBondContact CG-OE1 3.23Å
204	T	89.1	Confident	79.8	Confident	42 Å²	42	71.2 Å²	71.2	26%	0.258	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-75.6	128.1	167.3	-60.6	0	0	0	0	108.6	V113 V192 V193 E195	V113-T204 HydrophobicContact CB-CG2 3.98Å; V113-T204 HydrophobicContact CG1-CG2 4.44Å; V113-T204 PolarHBondContact N-O 3.01Å; V192-T204 HydrophobicContact CG1-CG2 3.6Å; V193-T204 CarbonylContact O-C 3.46Å; V193-T204 VanDerWaalsContact O-CA 3.3Å; V193-T204 WeakPolarHBondContact O-CA 3.32Å; V193-T204 WeakPolarHBondContact O-CG2 3.26Å; E195-T204 PolarHBondContact N-OG1 3.24Å
205	E	92.1	Very high	79.7	Confident	59 Å²	59	68.4 Å²	68.4	28%	0.276	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	157.2	-171.4	-70.2	-174.9	173.7	0	0	112	T110 F111 V192 V193 P203 H207	T110-E205 HydrophobicContact CG2-CB 3.86Å; T110-E205 HydrophobicContact CG2-CG 4.22Å; T110-E205 VanDerWaalsContact CG2-OE2 3.26Å; T110-E205 WeakPolarHBondContact CG2-OE2 3.48Å; F111-E205 CarbonylContact O-C 3.52Å; F111-E205 WeakPolarHBondContact O-CA 3.43Å; V192-E205 CarbonylContact C-O 3.56Å; V192-E205 VanDerWaalsContact CA-O 3.24Å; V192-E205 WeakPolarHBondContact CA-O 3.45Å; V192-E205 WeakPolarHBondContact CG1-O 3.48Å; V193-E205 PolarHBondContact N-O 2.96Å; V193-E205 PolarHBondContact O-N 2.72Å; P203-E205 HydrophobicContact CG-CG 4.02Å; P203-E205 WeakPolarHBondContact CG-OE1 3.23Å; E205-H207 IonicContact OE2-CE1 2.7Å; E205-H207 IonicContact OE2-NE2 2.7Å
206	M	93.7	Very high	79.9	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	114.2	177.4	175.6	-177.5	-69.6	0	0	108.3	T110 F111 V113 L190 F191 V192 I208	T110-M206 CarbonylContact C-O 3.45Å; T110-M206 WeakPolarHBondContact CA-O 3.48Å; F111-M206 PolarHBondContact N-O 3.36Å; F111-M206 PolarHBondContact O-N 2.78Å; V113-M206 HydrophobicContact CG2-CB 3.52Å; V113-M206 HydrophobicContact CG2-CE 4.38Å; L190-M206 HydrophobicContact CD1-CE 4.21Å; L190-M206 HydrophobicContact CD1-CG 3.86Å; L190-M206 HydrophobicContact CD1-SD 3.83Å; F191-M206 WeakPolarHBondContact O-CA 3.31Å; V192-M206 HydrophobicContact CG2-CB 4.34Å; V192-M206 HydrophobicContact CG2-CE 3.82Å; V192-M206 HydrophobicContact CG2-CG 4.43Å; M206-I208 HydrophobicContact CG-CG1 4.29Å
207	H	93.9	Very high	80.5	Confident	2 Å²	2	66.4 Å²	66.4	1%	0.009	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	131.4	-176.9	-51.9	-106.1	0	0	0	108.1	T110 E163 F165 L190 F191 V193 E205 F209	T110-H207 PolarHBondContact OG1-ND1 3.44Å; E163-H207 IonicContact OE1-CE1 3.44Å; F165-H207 AromaticContact CE1-CE1 3.33Å; F165-H207 WeakPolarHBondContact CE1-CE1 3.4Å; F165-H207 AromaticContact CE1-ND1 3.63Å; F165-H207 AromaticContact CE1-NE2 3.61Å; F165-H207 AromaticContact CZ-CE1 3.67Å; F165-H207 AromaticContact CZ-CG 3.83Å; F165-H207 AromaticContact CZ-ND1 3.43Å; F165-H207 WeakPolarHBondContact CZ-ND1 3.25Å; L190-H207 VanDerWaalsContact CA-O 3.23Å; L190-H207 WeakPolarHBondContact CA-O 3.49Å; L190-H207 WeakPolarHBondContact CB-O 3.49Å; F191-H207 HydrophobicContact CE2-CB 4.25Å; F191-H207 HydrophobicContact CZ-CB 4.35Å; F191-H207 PolarHBondContact N-O 3.26Å; F191-H207 VanDerWaalsContact N-O 3.14Å; F191-H207 PolarHBondContact O-N 3.47Å; V193-H207 VanDerWaalsContact CG2-CD2 3.5Å; V193-H207 WeakPolarHBondContact CG2-CD2 3.24Å; E205-H207 IonicContact OE2-CE1 2.7Å; E205-H207 IonicContact OE2-NE2 2.7Å; H207-F209 HydrophobicContact CB-CD2 4.42Å; H207-F209 HydrophobicContact CB-CE2 3.55Å; H207-F209 HydrophobicContact CB-CZ 4.08Å
208	I	94.6	Very high	81.6	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	126.5	-172.5	-52.9	-176.7	0	0	0	108.5	L108 A109 F111 L129 V188 L190 M206	L108-I208 HydrophobicContact CB-CG2 4.45Å; L108-I208 HydrophobicContact CD1-CG2 4.35Å; L108-I208 PolarHBondContact N-O 2.93Å; A109-I208 HydrophobicContact CB-CB 4.48Å; A109-I208 HydrophobicContact CB-CD1 4.47Å; A109-I208 PolarHBondContact N-O 3.32Å; A109-I208 PolarHBondContact O-N 3.15Å; F111-I208 HydrophobicContact CD2-CD1 3.89Å; F111-I208 HydrophobicContact CE2-CD1 3.63Å; L129-I208 HydrophobicContact CD2-CG2 4.21Å; V188-I208 HydrophobicContact CG1-CG2 3.42Å; V188-I208 VanDerWaalsContact CG1-CG2 3.42Å; L190-I208 HydrophobicContact CB-CB 4.41Å; L190-I208 HydrophobicContact CB-CG1 4.03Å; L190-I208 HydrophobicContact CB-CG2 4.42Å; M206-I208 HydrophobicContact CG-CG1 4.29Å
209	F	95.2	Very high	82.8	Confident	1 Å²	1	52.1 Å²	52.1	0%	0.004	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	130.8	-174.1	-59.7	-92.8	0	0	0	111.5	V105 E106 H107 V154 F165 V188 L189 F191 H207	V105-F209 HydrophobicContact CB-CB 4.22Å; V105-F209 HydrophobicContact CB-CD1 4.47Å; V105-F209 HydrophobicContact CG2-CB 4.45Å; V105-F209 HydrophobicContact CG2-CD1 3.83Å; V105-F209 HydrophobicContact CG2-CG 4.45Å; E106-F209 CarbonylContact O-C 3.57Å; E106-F209 WeakPolarHBondContact O-CA 3.34Å; H107-F209 HydrophobicContact CB-CD1 3.88Å; H107-F209 HydrophobicContact CB-CE1 3.86Å; H107-F209 AromaticContact CD2-CE1 3.69Å; H107-F209 AromaticContact CD2-CZ 3.91Å; V154-F209 HydrophobicContact CG2-CZ 4.44Å; F165-F209 HydrophobicContact CE2-CZ 4.37Å; V188-F209 CarbonylContact C-O 3.57Å; V188-F209 WeakPolarHBondContact CA-O 3.2Å; L189-F209 HydrophobicContact CB-CB 4.49Å; L189-F209 PolarHBondContact N-O 2.91Å; L189-F209 PolarHBondContact O-N 3.39Å; L189-F209 VanDerWaalsContact O-O 3.13Å; F191-F209 HydrophobicContact CE1-CD2 4.02Å; F191-F209 AromaticContact CE1-CE2 3.56Å; F191-F209 HydrophobicContact CE1-CE2 3.56Å; F191-F209 AromaticContact CZ-CE2 3.66Å; F191-F209 HydrophobicContact CZ-CE2 3.66Å; F191-F209 HydrophobicContact CZ-CZ 4.34Å; H207-F209 HydrophobicContact CB-CD2 4.42Å; H207-F209 HydrophobicContact CB-CE2 3.55Å; H207-F209 HydrophobicContact CB-CZ 4.08Å
210	Q	92.9	Very high	84.3	Confident	26 Å²	26	44.8 Å²	44.8	12%	0.121	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	128.6	165.1	-177.4	52.2	50.3	0	0	109.3	V105 E106 L108 N186 N187	V105-Q210 CarbonylContact C-O 3.54Å; V105-Q210 WeakPolarHBondContact CA-O 3.2Å; V105-Q210 VanDerWaalsContact CB-O 3.31Å; V105-Q210 WeakPolarHBondContact CB-O 3.42Å; E106-Q210 HydrophobicContact CB-CB 4.11Å; E106-Q210 HydrophobicContact CG-CB 4.49Å; E106-Q210 PolarHBondContact N-O 3.22Å; E106-Q210 PolarHBondContact O-N 2.99Å; L108-Q210 HydrophobicContact CD1-CB 4.08Å; L108-Q210 HydrophobicContact CD2-CB 4.11Å; L108-Q210 HydrophobicContact CG-CB 4.12Å; N186-Q210 PolarHBondContact O-NE2 2.81Å; N186-Q210 PolarHBondContact O-OE1 3.4Å; N187-Q210 PolarHBondContact O-NE2 3.14Å
211	C	88.7	Confident	86	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.014	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	127	171.1	-69.6	0	0	0	0	109.6	N187 V214 A216	N187-C211 WeakPolarHBondContact ND2-CB 3.19Å; N187-C211 PolarHBondContact ND2-O 2.84Å; N187-C211 WeakPolarHBondContact O-CB 3.36Å; N187-C211 PolarHBondContact O-N 2.84Å; C211-V214 HydrophobicContact CB-CG1 4.21Å; C211-V214 WeakPolarHBondContact CB-O 3.34Å; C211-A216 HydrophobicContact CB-CB 4.12Å
212	I	78.1	Confident	87.5	Confident	64 Å²	64	37.2 Å²	37.2	33%	0.328	20%	0.196	S	C	.	.	S	Bend	trans	-89.9	-61.5	-173	-46	173.8	0	0	0	110.9	Y104 E106	Y104-I212 PolarHBondContact O-N 2.83Å; E106-I212 HydrophobicContact CG-CD1 3.64Å; E106-I212 HydrophobicContact CG-CG1 3.89Å
213	R	72.6	Confident	88.9	Confident	135 Å²	135	34.1 Å²	34.1	51%	0.509	18%	0.177	S	C	.	.	S	Bend	trans	-110.2	18.4	-167.6	-63.1	-177.8	176.6	153.3	2.7	114.6
214	V	79.9	Confident	89.4	Confident	16 Å²	16	34.8 Å²	34.8	10%	0.097	17%	0.173	C	C	.	.	S	Bend	trans	-156.1	149.7	-172.2	62.1	0	0	0	0	109.2	Y103 N187 C211 A216 D218 V219	Y103-V214 HydrophobicContact CD1-CG1 4.18Å; Y103-V214 HydrophobicContact CD1-CG2 4.21Å; N187-V214 PolarHBondContact ND2-O 3.37Å; C211-V214 HydrophobicContact CB-CG1 4.21Å; C211-V214 WeakPolarHBondContact CB-O 3.34Å; V214-A216 PolarHBondContact O-N 2.82Å; V214-D218 HydrophobicContact CG2-CB 4.36Å; V214-V219 HydrophobicContact CB-CG2 4.28Å; V214-V219 HydrophobicContact CG1-CG2 3.5Å; V214-V219 VanDerWaalsContact CG1-CG2 3.5Å; V214-V219 HydrophobicContact CG2-CG2 3.75Å
215	S	86.9	Confident	89.5	Confident	42 Å²	42	33.6 Å²	33.6	29%	0.294	17%	0.165	S	C	.	.			trans	-68.2	129.5	173.4	-174.7	0	0	0	0	110.6	N187 T217 D218 V219	N187-S215 WeakPolarHBondContact OD1-CA 3.12Å; S215-T217 PolarHBondContact O-N 3.3Å; S215-T217 WeakPolarHBondContact OG-CB 3.44Å; S215-T217 PolarHBondContact OG-N 3.04Å; S215-D218 WeakPolarHBondContact O-CB 3.32Å; S215-D218 PolarHBondContact O-N 2.67Å; S215-V219 WeakPolarHBondContact O-CG2 3.27Å; S215-V219 PolarHBondContact O-N 3.47Å; S215-V219 VanDerWaalsContact O-N 3.08Å
216	A	89.5	Confident	89.4	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.7	-27.1	170.3	0	0	0	0	0	112	A175 N187 V188 L189 C211 V214 A220	A175-A216 HydrophobicContact CB-CB 4.03Å; N187-A216 PolarHBondContact OD1-N 2.98Å; V188-A216 VanDerWaalsContact C-CB 3.46Å; L189-A216 HydrophobicContact CB-CB 4.2Å; C211-A216 HydrophobicContact CB-CB 4.12Å; V214-A216 PolarHBondContact O-N 2.82Å; A216-A220 WeakPolarHBondContact O-CB 3.13Å; A216-A220 PolarHBondContact O-N 2.7Å
217	T	90.5	Very high	89.2	Confident	58 Å²	58	33.7 Å²	33.7	36%	0.356	17%	0.169	S	C	.	.	H	α-helix	trans	-62.6	-49.9	172.5	-54.3	0	0	0	0	110.9	S215 V219 A220 E221	S215-T217 PolarHBondContact O-N 3.3Å; S215-T217 WeakPolarHBondContact OG-CB 3.44Å; S215-T217 PolarHBondContact OG-N 3.04Å; T217-V219 PolarHBondContact O-N 3.45Å; T217-A220 PolarHBondContact O-N 3Å; T217-E221 WeakPolarHBondContact O-CG 3.39Å; T217-E221 PolarHBondContact O-N 3.29Å
218	D	89	Confident	88.9	Confident	81 Å²	81	39.4 Å²	39.4	43%	0.433	20%	0.195	S	C	.	.	H	α-helix	trans	-58.1	-50.2	175.5	-66.2	-15.7	0	0	0	110.4	V214 S215 A220 E221 D222	V214-D218 HydrophobicContact CG2-CB 4.36Å; S215-D218 WeakPolarHBondContact O-CB 3.32Å; S215-D218 PolarHBondContact O-N 2.67Å; D218-A220 VanDerWaalsContact C-N 3.32Å; D218-A220 PolarHBondContact O-N 2.84Å; D218-E221 PolarHBondContact O-N 3.31Å; D218-E221 VanDerWaalsContact O-N 3.13Å; D218-D222 WeakPolarHBondContact O-CB 3.46Å; D218-D222 PolarHBondContact O-N 3.11Å; D218-D222 VanDerWaalsContact O-OD2 3.04Å
219	V	90.4	Very high	88.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.9	-37.6	-178.4	-171.2	0	0	0	0	111.7	Y103 L145 F147 L189 V214 S215 T217 L223	Y103-V219 HydrophobicContact CD1-CG1 4.41Å; Y103-V219 HydrophobicContact CD1-CG2 3.63Å; Y103-V219 HydrophobicContact CD2-CG1 4.01Å; Y103-V219 HydrophobicContact CE1-CG2 3.96Å; Y103-V219 HydrophobicContact CE2-CG1 4.21Å; Y103-V219 HydrophobicContact CG-CG1 4.12Å; Y103-V219 HydrophobicContact CG-CG2 4Å; L145-V219 HydrophobicContact CD2-CG1 4.44Å; F147-V219 HydrophobicContact CE2-CG1 4.31Å; F147-V219 HydrophobicContact CZ-CG1 3.67Å; L189-V219 HydrophobicContact CD2-CB 4.3Å; L189-V219 HydrophobicContact CD2-CG1 3.63Å; V214-V219 HydrophobicContact CB-CG2 4.28Å; V214-V219 HydrophobicContact CG1-CG2 3.5Å; V214-V219 VanDerWaalsContact CG1-CG2 3.5Å; V214-V219 HydrophobicContact CG2-CG2 3.75Å; S215-V219 WeakPolarHBondContact O-CG2 3.27Å; S215-V219 PolarHBondContact O-N 3.47Å; S215-V219 VanDerWaalsContact O-N 3.08Å; T217-V219 PolarHBondContact O-N 3.45Å; V219-L223 VanDerWaalsContact O-CB 3.24Å; V219-L223 WeakPolarHBondContact O-CB 3.3Å; V219-L223 PolarHBondContact O-N 3.46Å
220	A	93.1	Very high	88	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-68.7	-34.6	174.8	0	0	0	0	0	112.4	A175 L189 A216 T217 D218 K224	A175-A220 HydrophobicContact CB-CB 4.17Å; L189-A220 HydrophobicContact CD1-CB 3.72Å; A216-A220 WeakPolarHBondContact O-CB 3.13Å; A216-A220 PolarHBondContact O-N 2.7Å; T217-A220 PolarHBondContact O-N 3Å; D218-A220 VanDerWaalsContact C-N 3.32Å; D218-A220 PolarHBondContact O-N 2.84Å; A220-K224 WeakPolarHBondContact O-CD 3.37Å; A220-K224 WeakPolarHBondContact O-CE 3.4Å; A220-K224 WeakPolarHBondContact O-CG 3.31Å; A220-K224 PolarHBondContact O-N 3.44Å
221	E	91.1	Very high	87.4	Confident	109 Å²	109	46 Å²	46	51%	0.509	24%	0.237	S	C	.	.	H	α-helix	trans	-71.8	-43.5	172.5	-74	-160.5	-176.6	0	0	112.5	T217 D218 L223 K224 N225	T217-E221 WeakPolarHBondContact O-CG 3.39Å; T217-E221 PolarHBondContact O-N 3.29Å; D218-E221 PolarHBondContact O-N 3.31Å; D218-E221 VanDerWaalsContact O-N 3.13Å; E221-L223 VanDerWaalsContact C-N 3.27Å; E221-L223 PolarHBondContact O-N 2.92Å; E221-K224 PolarHBondContact O-N 2.94Å; E221-N225 PolarHBondContact O-N 2.97Å; E221-N225 PolarHBondContact O-ND2 2.74Å
222	D	91.3	Very high	86.7	Confident	13 Å²	13	58 Å²	58	7%	0.07	28%	0.282	C	S	.	.	H	α-helix	trans	-59.1	-40.6	173.1	-70	-55.4	0	0	0	110.9	Y103 F147 D218 N225 Y226 V234 R239	Y103-D222 WeakPolarHBondContact OH-CB 3.44Å; Y103-D222 PolarHBondContact OH-OD2 3.44Å; F147-D222 HydrophobicContact CD2-CB 4.37Å; F147-D222 HydrophobicContact CE2-CB 3.86Å; D218-D222 WeakPolarHBondContact O-CB 3.46Å; D218-D222 PolarHBondContact O-N 3.11Å; D218-D222 VanDerWaalsContact O-OD2 3.04Å; D222-N225 PolarHBondContact O-N 3.37Å; D222-Y226 WeakPolarHBondContact O-CD2 3.36Å; D222-Y226 PolarHBondContact O-N 3.35Å; D222-V234 HydrophobicContact CB-CG1 4.04Å; D222-V234 HydrophobicContact CB-CG2 4.02Å; D222-V234 VanDerWaalsContact OD1-CG1 3.3Å; D222-V234 WeakPolarHBondContact OD1-CG1 3.29Å; D222-V234 WeakPolarHBondContact OD1-CG2 3.28Å; D222-R239 IonicContact OD1-CZ 3.28Å; D222-R239 IonicContact OD1-NH1 2.66Å; D222-R239 IonicContact OD1-NH2 3.27Å; D222-R239 PolarHBondContact OD1-NH2 3.09Å; D222-R239 IonicContact OD2-CZ 2.57Å; D222-R239 IonicContact OD2-NH1 2.73Å; D222-R239 PolarHBondContact OD2-NH1 3.25Å; D222-R239 IonicContact OD2-NH2 3.99Å; D222-R239 PolarHBondContact OD2-NH2 3.36Å
223	L	92.9	Very high	86.4	Confident	0 Å²	0	63 Å²	63	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.9	-40.5	176.2	-173.1	49.2	0	0	0	112.2	F147 V152 L167 I170 P173 F191 V219 E221 N225 Y226 V227	F147-L223 HydrophobicContact CE1-CD1 4.18Å; F147-L223 HydrophobicContact CE2-CB 3.84Å; F147-L223 HydrophobicContact CE2-CD1 4.4Å; F147-L223 HydrophobicContact CZ-CB 3.71Å; F147-L223 HydrophobicContact CZ-CD1 4.07Å; F147-L223 HydrophobicContact CZ-CD2 4.35Å; F147-L223 HydrophobicContact CZ-CG 4.25Å; V152-L223 HydrophobicContact CG2-CD1 3.55Å; L167-L223 HydrophobicContact CD1-CD1 4.32Å; I170-L223 HydrophobicContact CD1-CD1 4.35Å; I170-L223 HydrophobicContact CG2-CD2 4.44Å; P173-L223 HydrophobicContact CB-CB 4.16Å; P173-L223 HydrophobicContact CB-CD2 4Å; P173-L223 HydrophobicContact CB-CG 4Å; P173-L223 HydrophobicContact CG-CB 4.35Å; P173-L223 HydrophobicContact CG-CD2 4.07Å; P173-L223 HydrophobicContact CG-CG 3.8Å; F191-L223 HydrophobicContact CB-CD2 4.45Å; F191-L223 HydrophobicContact CD1-CD2 3.66Å; F191-L223 HydrophobicContact CE1-CD2 4.11Å; F191-L223 HydrophobicContact CG-CD2 4.14Å; V219-L223 VanDerWaalsContact O-CB 3.24Å; V219-L223 WeakPolarHBondContact O-CB 3.3Å; V219-L223 PolarHBondContact O-N 3.46Å; E221-L223 VanDerWaalsContact C-N 3.27Å; E221-L223 PolarHBondContact O-N 2.92Å; L223-N225 VanDerWaalsContact C-N 3.33Å; L223-N225 PolarHBondContact O-N 2.86Å; L223-Y226 PolarHBondContact O-N 2.9Å; L223-V227 HydrophobicContact CD1-CG2 4.31Å; L223-V227 WeakPolarHBondContact O-CG2 3.47Å; L223-V227 PolarHBondContact O-N 2.94Å
224	K	92.6	Very high	86.7	Confident	80 Å²	80	57 Å²	57	35%	0.348	28%	0.275	S	S	.	.	H	α-helix	trans	-59.2	-43.9	170.6	-72.4	160.6	-159.5	163.1	0	111.4	P173 A220 E221 Y226 V227 Q228	P173-K224 HydrophobicContact CB-CG 4.17Å; P173-K224 HydrophobicContact CG-CG 4.26Å; P173-K224 WeakPolarHBondContact O-CE 3.38Å; A220-K224 WeakPolarHBondContact O-CD 3.37Å; A220-K224 WeakPolarHBondContact O-CE 3.4Å; A220-K224 WeakPolarHBondContact O-CG 3.31Å; A220-K224 PolarHBondContact O-N 3.44Å; E221-K224 PolarHBondContact O-N 2.94Å; K224-Y226 VanDerWaalsContact C-N 3.32Å; K224-Y226 PolarHBondContact O-N 3.17Å; K224-V227 PolarHBondContact O-N 2.84Å; K224-Q228 WeakPolarHBondContact O-CB 3.48Å; K224-Q228 VanDerWaalsContact O-CG 3.24Å; K224-Q228 WeakPolarHBondContact O-CG 3.43Å; K224-Q228 PolarHBondContact O-N 3.41Å
225	N	90.4	Very high	86	Confident	17 Å²	17	65.4 Å²	65.4	9%	0.091	31%	0.305	C	S	.	.	H	α-helix	trans	-62.2	-39.9	176.5	-75.2	-66	0	0	0	111.1	E221 D222 L223 Q228 G229 Q230 R233 V234	E221-N225 PolarHBondContact O-N 2.97Å; E221-N225 PolarHBondContact O-ND2 2.74Å; D222-N225 PolarHBondContact O-N 3.37Å; L223-N225 VanDerWaalsContact C-N 3.33Å; L223-N225 PolarHBondContact O-N 2.86Å; N225-Q228 PolarHBondContact O-N 2.73Å; N225-G229 PolarHBondContact O-N 3.43Å; N225-Q230 HydrophobicContact CB-CB 4.37Å; N225-Q230 WeakPolarHBondContact O-CA 3.42Å; N225-Q230 WeakPolarHBondContact O-CB 3.21Å; N225-Q230 PolarHBondContact O-N 3.1Å; N225-R233 PolarHBondContact OD1-NH1 3.03Å; N225-V234 HydrophobicContact CB-CG2 3.68Å
226	Y	90	Very high	84.5	Confident	5 Å²	5	68.2 Å²	68.2	2%	0.02	32%	0.317	C	S	.	.	H	α-helix	trans	-63.7	-51.2	173.8	-97.2	-111.3	0	0	0	112.6	P101 F147 R148 L167 D222 L223 K224 Q228 G229 F231 V234	P101-Y226 WeakPolarHBondContact CD-OH 3.02Å; P101-Y226 HydrophobicContact CG-CE2 4.17Å; F147-Y226 HydrophobicContact CB-CD1 3.8Å; F147-Y226 HydrophobicContact CB-CD2 4.36Å; F147-Y226 HydrophobicContact CB-CE1 3.59Å; F147-Y226 HydrophobicContact CB-CE2 4.19Å; F147-Y226 HydrophobicContact CB-CG 4.19Å; F147-Y226 HydrophobicContact CD2-CD2 4.09Å; F147-Y226 HydrophobicContact CD2-CE2 4.4Å; F147-Y226 HydrophobicContact CD2-CG 4.25Å; F147-Y226 VanDerWaalsContact O-CE1 3.25Å; F147-Y226 WeakPolarHBondContact O-CE1 3.45Å; F147-Y226 PolarHBondContact O-OH 3.14Å; R148-Y226 WeakPolarHBondContact O-CD1 3.37Å; R148-Y226 WeakPolarHBondContact O-CE1 3.48Å; L167-Y226 HydrophobicContact CD2-CD1 4.41Å; L167-Y226 WeakPolarHBondContact CD2-O 3.44Å; D222-Y226 WeakPolarHBondContact O-CD2 3.36Å; D222-Y226 PolarHBondContact O-N 3.35Å; L223-Y226 PolarHBondContact O-N 2.9Å; K224-Y226 VanDerWaalsContact C-N 3.32Å; K224-Y226 PolarHBondContact O-N 3.17Å; Y226-Q228 PolarHBondContact O-N 3.13Å; Y226-G229 WeakPolarHBondContact O-CA 3.41Å; Y226-G229 PolarHBondContact O-N 2.75Å; Y226-F231 AromaticContact CD1-CD1 3.44Å; Y226-F231 HydrophobicContact CD1-CD1 3.44Å; Y226-F231 VanDerWaalsContact CD1-CD1 3.44Å; Y226-F231 AromaticContact CD1-CE1 3.56Å; Y226-F231 HydrophobicContact CD1-CE1 3.56Å; Y226-F231 AromaticContact CD2-CD1 3.96Å; Y226-F231 HydrophobicContact CD2-CD1 3.96Å; Y226-F231 AromaticContact CE1-CD1 3.53Å; Y226-F231 HydrophobicContact CE1-CD1 3.53Å; Y226-F231 AromaticContact CE1-CE1 3.97Å; Y226-F231 HydrophobicContact CE1-CE1 3.97Å; Y226-F231 HydrophobicContact CE2-CB 4.45Å; Y226-F231 HydrophobicContact CE2-CD1 4.03Å; Y226-F231 AromaticContact CG-CD1 3.67Å; Y226-F231 HydrophobicContact CG-CD1 3.67Å; Y226-F231 AromaticContact CG-CE1 3.96Å; Y226-F231 HydrophobicContact CG-CE1 3.96Å; Y226-F231 AromaticContact CZ-CD1 3.84Å; Y226-F231 WeakPolarHBondContact O-CE1 3.23Å; Y226-V234 HydrophobicContact CD2-CB 4.35Å; Y226-V234 HydrophobicContact CD2-CG1 4.45Å; Y226-V234 HydrophobicContact CD2-CG2 3.82Å; Y226-V234 HydrophobicContact CE2-CB 3.86Å; Y226-V234 HydrophobicContact CE2-CG1 3.84Å; Y226-V234 HydrophobicContact CE2-CG2 3.85Å
227	V	90.3	Very high	82.9	Confident	57 Å²	57	69.4 Å²	69.4	35%	0.345	33%	0.329	S	S	.	.	H	α-helix	trans	-58.6	-30.2	177.2	173.3	0	0	0	0	112	L167 I170 L223 K224 G229	L167-V227 HydrophobicContact CD1-CG2 3.65Å; L167-V227 HydrophobicContact CG-CG2 4.29Å; I170-V227 HydrophobicContact CB-CG2 4.12Å; I170-V227 HydrophobicContact CG2-CG2 4.1Å; L223-V227 HydrophobicContact CD1-CG2 4.31Å; L223-V227 WeakPolarHBondContact O-CG2 3.47Å; L223-V227 PolarHBondContact O-N 2.94Å; K224-V227 PolarHBondContact O-N 2.84Å; V227-G229 VanDerWaalsContact C-N 3.32Å
228	Q	88	Confident	81	Confident	121 Å²	121	75 Å²	75	57%	0.565	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	4	174.1	-67.1	175.1	22.1	0	0	114.4	K224 N225 Y226 Q230	K224-Q228 WeakPolarHBondContact O-CB 3.48Å; K224-Q228 VanDerWaalsContact O-CG 3.24Å; K224-Q228 WeakPolarHBondContact O-CG 3.43Å; K224-Q228 PolarHBondContact O-N 3.41Å; N225-Q228 PolarHBondContact O-N 2.73Å; Y226-Q228 PolarHBondContact O-N 3.13Å; Q228-Q230 HydrophobicContact CB-CG 4Å; Q228-Q230 PolarHBondContact O-N 3.38Å
229	G	84.1	Confident	79.3	Confident	43 Å²	43	73.5 Å²	73.5	44%	0.443	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	10.3	-177.3	0	0	0	0	0	115	N225 Y226 V227 F231	N225-G229 PolarHBondContact O-N 3.43Å; Y226-G229 WeakPolarHBondContact O-CA 3.41Å; Y226-G229 PolarHBondContact O-N 2.75Å; V227-G229 VanDerWaalsContact C-N 3.32Å; G229-F231 WeakPolarHBondContact O-CD2 3.34Å; G229-F231 PolarHBondContact O-N 3.09Å; G229-F231 VanDerWaalsContact O-N 3.15Å
230	Q	85.2	Confident	77	Confident	72 Å²	72	78.1 Å²	78.1	34%	0.336	36%	0.36	S	S	.	.			trans	-88.5	37.2	-174.5	-56.1	-172	15.8	0	0	112.6	N225 Q228 R232 R233	N225-Q230 HydrophobicContact CB-CB 4.37Å; N225-Q230 WeakPolarHBondContact O-CA 3.42Å; N225-Q230 WeakPolarHBondContact O-CB 3.21Å; N225-Q230 PolarHBondContact O-N 3.1Å; Q228-Q230 HydrophobicContact CB-CG 4Å; Q228-Q230 PolarHBondContact O-N 3.38Å; Q230-R232 PolarHBondContact O-N 2.74Å; Q230-R233 HydrophobicContact CB-CG 4.26Å; Q230-R233 WeakPolarHBondContact O-CB 3.49Å; Q230-R233 PolarHBondContact O-N 2.92Å
231	F	80.9	Confident	74	Confident	51 Å²	51	82.5 Å²	82.5	22%	0.224	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-46.4	-38.1	-173.1	-47.1	-63.6	0	0	0	114	H149 L167 Y226 G229 R233 V234	H149-F231 AromaticContact CD2-CD2 3.81Å; H149-F231 AromaticContact CD2-CG 3.97Å; H149-F231 WeakPolarHBondContact O-CZ 3.46Å; L167-F231 HydrophobicContact CD2-CE1 3.97Å; L167-F231 HydrophobicContact CD2-CZ 4.35Å; Y226-F231 AromaticContact CD1-CD1 3.44Å; Y226-F231 HydrophobicContact CD1-CD1 3.44Å; Y226-F231 VanDerWaalsContact CD1-CD1 3.44Å; Y226-F231 AromaticContact CD1-CE1 3.56Å; Y226-F231 HydrophobicContact CD1-CE1 3.56Å; Y226-F231 AromaticContact CD2-CD1 3.96Å; Y226-F231 HydrophobicContact CD2-CD1 3.96Å; Y226-F231 AromaticContact CE1-CD1 3.53Å; Y226-F231 HydrophobicContact CE1-CD1 3.53Å; Y226-F231 AromaticContact CE1-CE1 3.97Å; Y226-F231 HydrophobicContact CE1-CE1 3.97Å; Y226-F231 HydrophobicContact CE2-CB 4.45Å; Y226-F231 HydrophobicContact CE2-CD1 4.03Å; Y226-F231 AromaticContact CG-CD1 3.67Å; Y226-F231 HydrophobicContact CG-CD1 3.67Å; Y226-F231 AromaticContact CG-CE1 3.96Å; Y226-F231 HydrophobicContact CG-CE1 3.96Å; Y226-F231 AromaticContact CZ-CD1 3.84Å; Y226-F231 WeakPolarHBondContact O-CE1 3.23Å; G229-F231 WeakPolarHBondContact O-CD2 3.34Å; G229-F231 PolarHBondContact O-N 3.09Å; G229-F231 VanDerWaalsContact O-N 3.15Å; F231-R233 PolarHBondContact O-N 2.9Å; F231-R233 VanDerWaalsContact O-N 3.15Å; F231-V234 WeakPolarHBondContact O-CB 3.47Å; F231-V234 PolarHBondContact O-N 2.77Å; F231-V234 VanDerWaalsContact O-N 3.12Å
232	R	73.5	Confident	70.9	Confident	253 Å²	253	81.3 Å²	81.3	96%	0.955	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-66.5	-10.8	-179.7	-63.3	-173.6	-179.4	-167.4	0.6	115.4	Q230	Q230-R232 PolarHBondContact O-N 2.74Å
233	R	73.3	Confident	68.2	Low	169 Å²	169	86.6 Å²	86.6	64%	0.638	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-83.8	-20.1	174.5	-63.8	-177.4	67.8	-163.7	-6.6	112.6	N225 Q230 F231	N225-R233 PolarHBondContact OD1-NH1 3.03Å; Q230-R233 HydrophobicContact CB-CG 4.26Å; Q230-R233 WeakPolarHBondContact O-CB 3.49Å; Q230-R233 PolarHBondContact O-N 2.92Å; F231-R233 PolarHBondContact O-N 2.9Å; F231-R233 VanDerWaalsContact O-N 3.15Å
234	V	77.1	Confident	65.2	Low	9 Å²	9	93.1 Å²	93.1	6%	0.055	48%	0.48	C	S	.	.	S	Bend	trans	-86.5	140.7	-177.5	173.9	0	0	0	0	109.7	P101 D222 N225 Y226 F231	P101-V234 HydrophobicContact CB-CG1 4.12Å; P101-V234 HydrophobicContact CG-CG1 3.41Å; P101-V234 VanDerWaalsContact CG-CG1 3.41Å; D222-V234 HydrophobicContact CB-CG1 4.04Å; D222-V234 HydrophobicContact CB-CG2 4.02Å; D222-V234 VanDerWaalsContact OD1-CG1 3.3Å; D222-V234 WeakPolarHBondContact OD1-CG1 3.29Å; D222-V234 WeakPolarHBondContact OD1-CG2 3.28Å; N225-V234 HydrophobicContact CB-CG2 3.68Å; Y226-V234 HydrophobicContact CD2-CB 4.35Å; Y226-V234 HydrophobicContact CD2-CG1 4.45Å; Y226-V234 HydrophobicContact CD2-CG2 3.82Å; Y226-V234 HydrophobicContact CE2-CB 3.86Å; Y226-V234 HydrophobicContact CE2-CG1 3.84Å; Y226-V234 HydrophobicContact CE2-CG2 3.85Å; F231-V234 WeakPolarHBondContact O-CB 3.47Å; F231-V234 PolarHBondContact O-N 2.77Å; F231-V234 VanDerWaalsContact O-N 3.12Å
235	R	66.3	Low	62.3	Low	193 Å²	193	96.4 Å²	96.4	73%	0.728	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-79.9	126.2	175.5	-63.2	-179.8	-177.7	164.4	1.7	110.6	R239	R235-R239 VanDerWaalsContact N-NH2 3.18Å; R235-R239 PolarHBondContact O-NE 3.09Å; R235-R239 PolarHBondContact O-NH2 3.29Å
236	N	55.6	Low	59.4	Low	102 Å²	102	103.9 Å²	103.9	55%	0.545	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-72.6	156.2	-179.9	-69	-6.2	0	0	0	113.1	V99	V99-N236 HydrophobicContact CG1-CB 3.91Å; V99-N236 WeakPolarHBondContact CG1-ND2 3.33Å; V99-N236 VanDerWaalsContact O-CB 3.26Å; V99-N236 WeakPolarHBondContact O-CB 3.41Å
237	G	54.5	Low	56.6	Low	24 Å²	24	111.5 Å²	111.5	25%	0.247	57%	0.572	C	S	.	*	S	Bend	trans	95.8	174.6	176.3	0	0	0	0	0	115.5	V99 S102 R239	V99-G237 PolarHBondContact O-N 3.23Å; S102-G237 PolarHBondContact N-O 3.34Å; G237-R239 PolarHBondContact O-N 2.93Å
238	R	52.5	Low	53.7	Low	176 Å²	176	113.3 Å²	113.3	66%	0.664	59%	0.592	S	S	*	*	B	Isolated β-bridge	trans	-68.8	121.8	173.7	-65.4	-171.2	-176	-158.5	3.1	109.5	Y104 T240	Y104-R238 PolarHBondContact OH-NH1 3.05Å; R238-T240 PolarHBondContact O-N 2.87Å
239	R	51.9	Low	50.8	Low	49 Å²	49	117 Å²	117	19%	0.185	61%	0.61	C	S	.	*			trans	-89	100.6	179.5	-63	-155.1	-169	163.4	12	112.1	S102 Y103 D222 R235 G237	S102-R239 PolarHBondContact O-N 2.89Å; Y103-R239 HydrophobicContact CD1-CB 4.39Å; Y103-R239 HydrophobicContact CE1-CB 4.44Å; Y103-R239 HydrophobicContact CE1-CG 4.11Å; D222-R239 IonicContact OD1-CZ 3.28Å; D222-R239 IonicContact OD1-NH1 2.66Å; D222-R239 IonicContact OD1-NH2 3.27Å; D222-R239 PolarHBondContact OD1-NH2 3.09Å; D222-R239 IonicContact OD2-CZ 2.57Å; D222-R239 IonicContact OD2-NH1 2.73Å; D222-R239 PolarHBondContact OD2-NH1 3.25Å; D222-R239 IonicContact OD2-NH2 3.99Å; D222-R239 PolarHBondContact OD2-NH2 3.36Å; R235-R239 VanDerWaalsContact N-NH2 3.18Å; R235-R239 PolarHBondContact O-NE 3.09Å; R235-R239 PolarHBondContact O-NH2 3.29Å; G237-R239 PolarHBondContact O-N 2.93Å
240	T	41.9	Very low	48.4	Very low	98 Å²	98	123.4 Å²	123.4	60%	0.601	63%	0.628	S	S	*	*			trans	-104.8	121.9	154.4	51.7	0	0	0	0	107.6	R238 A242	R238-T240 PolarHBondContact O-N 2.87Å; T240-A242 PolarHBondContact O-N 3.28Å; T240-A242 VanDerWaalsContact O-N 3.15Å
241	A	31	Very low	45.8	Very low	91 Å²	91	129.5 Å²	129.5	75%	0.752	66%	0.656	S	S	*	*	S	Bend	trans	-78.5	100	-165.4	0	0	0	0	0	114.1
242	A	25.3	Very low	43.4	Very low	84 Å²	84	135.4 Å²	135.4	69%	0.694	69%	0.685	S	S	*	*			trans	-162.8	120.3	154.7	0	0	0	0	0	111.7	T240	T240-A242 PolarHBondContact O-N 3.28Å; T240-A242 VanDerWaalsContact O-N 3.15Å
243	P	35	Very low	41	Very low	124 Å²	124	131.5 Å²	131.5	81%	0.805	68%	0.679	S	S	*	*			trans	-93.1	117.5	166.8	0.5	19.3	0	0	0	110.8	H245	P243-H245 PolarHBondContact O-N 2.94Å
244	T	30.3	Very low	39.4	Very low	138 Å²	138	128.6 Å²	128.6	85%	0.847	68%	0.682	S	S	*	*			trans	-76.6	117.9	177.3	-45.8	0	0	0	0	112.1
245	H	31.9	Very low	37.6	Very low	149 Å²	149	137.4 Å²	137.4	69%	0.69	72%	0.72	S	S	*	*			trans	0.6	122.1	157.2	-170	-73.5	0	0	0	119.1	P243	P243-H245 PolarHBondContact O-N 2.94Å
246	L	28.8	Very low	35.8	Very low	173 Å²	173	138.8 Å²	138.8	91%	0.906	73%	0.727	S	S	*	*			trans	-115.9	149.5	158	-103.3	165.8	0	0	0	110.2
247	Q	31.4	Very low	34.9	Very low	166 Å²	166	138.9 Å²	138.9	78%	0.776	73%	0.733	S	S	*	*			trans	-87	148.4	-159.9	-80.4	172.7	-33.2	0	0	116.3
248	A	28.6	Very low	34.2	Very low	94 Å²	94	143.4 Å²	143.4	78%	0.777	76%	0.758	S	S	*	*			trans	67.7	110.2	147.5	0	0	0	0	0	120.3
249	Q	27.4	Very low	33.2	Very low	200 Å²	200	142 Å²	142	94%	0.935	76%	0.764	S	S	*	*				-161	168.3	96.8	-103.8	-178.8	9.8	0	0	112.3
250	Q	33.5	Very low	32.4	Very low	177 Å²	177	146.2 Å²	146.2	83%	0.827	79%	0.79	S	S	*	*			trans	-92.8	140	-177	-63.3	170	-21.9	0	0	112.3
251	Q	30.7	Very low	32.1	Very low	199 Å²	199	144.6 Å²	144.6	93%	0.93	79%	0.787	S	S	*	*				-166.5	177.8	126.8	-107.7	155.8	80.4	0	0	112.2
252	Q	31	Very low	32.2	Very low	176 Å²	176	144.8 Å²	144.8	82%	0.822	78%	0.783	S	S	*	*			trans	-107.7	149.8	-154.8	-67.6	179.2	-19	0	0	114.8
253	M	23.8	Very low	32.7	Very low	171 Å²	171	145.6 Å²	145.6	84%	0.842	77%	0.774	S	S	*	*			trans	70.1	155	158.6	-64	-70.6	-89.3	0	0	118.4
254	P	38.9	Very low	32.8	Very low	107 Å²	107	143.1 Å²	143.1	70%	0.695	76%	0.76	S	S	*	*			cis	-128.6	176	-23.4	35.5	-17.8	0	0	0	114.7
255	F	39	Very low	33.2	Very low	194 Å²	194	139.8 Å²	139.8	85%	0.851	74%	0.742	S	S	*	*			trans	-29.6	125.9	172	-117.4	-104.1	0	0	0	118
256	Y	28.1	Very low	33.8	Very low	223 Å²	223	139.5 Å²	139.5	88%	0.875	74%	0.741	S	S	*	*			trans	-149	136.7	140.4	-96.4	-83.4	0	0	0	108.2
257	P	38.3	Very low	34.8	Very low	103 Å²	103	133.2 Å²	133.2	67%	0.669	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-81.5	140.8	176.1	32.6	-33.2	0	0	0	111.5
258	P	38.5	Very low	36	Very low	120 Å²	120	128.7 Å²	128.7	78%	0.779	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-83.4	152.6	164.5	34.5	-32.6	0	0	0	111.3
259	D	32.7	Very low	37.8	Very low	146 Å²	146	129.3 Å²	129.3	78%	0.781	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-68.8	145.5	-171.8	-57.9	-80.5	0	0	0	115	A261	D259-A261 PolarHBondContact O-N 3.35Å
260	D	34	Very low	39.7	Very low	137 Å²	137	122.7 Å²	122.7	73%	0.733	65%	0.653	S	S	*	*	G	3₁₀ helix	trans	-60.1	-8.6	-169.8	-74.1	-65.6	0	0	0	117.3	S262 I263	D260-S262 VanDerWaalsContact C-N 3.27Å; D260-S262 PolarHBondContact O-N 3.48Å; D260-S262 VanDerWaalsContact O-N 3.14Å; D260-I263 PolarHBondContact O-N 3.04Å
261	A	36.4	Very low	41.9	Very low	65 Å²	65	116.8 Å²	116.8	54%	0.537	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-66.1	-20.5	-166.3	0	0	0	0	0	115.1	D259 S264	D259-A261 PolarHBondContact O-N 3.35Å; A261-S264 PolarHBondContact O-OG 3.2Å
262	S	32.2	Very low	44.2	Very low	95 Å²	95	113.9 Å²	113.9	66%	0.664	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-91.3	-13.1	179.9	53.5	0	0	0	0	114.6	D260	D260-S262 VanDerWaalsContact C-N 3.27Å; D260-S262 PolarHBondContact O-N 3.48Å; D260-S262 VanDerWaalsContact O-N 3.14Å
263	I	35.3	Very low	46.7	Very low	101 Å²	101	109.9 Å²	109.9	52%	0.518	59%	0.589	S	S	.	*	H	α-helix	trans	-81.2	-26.5	-176.7	-97.9	171.5	0	0	0	112.9	D260 S265 T267	D260-I263 PolarHBondContact O-N 3.04Å; I263-S265 PolarHBondContact O-N 2.88Å; I263-T267 HydrophobicContact CG2-CG2 4.08Å; I263-T267 WeakPolarHBondContact O-CB 3.49Å; I263-T267 WeakPolarHBondContact O-CG2 3.43Å; I263-T267 PolarHBondContact O-N 2.71Å; I263-T267 PolarHBondContact O-OG1 3.27Å
264	S	37.5	Very low	49.7	Very low	72 Å²	72	101.9 Å²	101.9	50%	0.503	55%	0.549	S	S	.	.	H	α-helix	trans	-65.9	-37.7	-172.8	55.3	0	0	0	0	113.9	A261 T267 S268	A261-S264 PolarHBondContact O-OG 3.2Å; S264-T267 WeakPolarHBondContact CA-OG1 3.38Å; S264-T267 PolarHBondContact O-OG1 2.67Å; S264-S268 VanDerWaalsContact O-CB 3.28Å; S264-S268 WeakPolarHBondContact O-CB 3.37Å; S264-S268 PolarHBondContact O-N 3.41Å
265	S	39.6	Very low	52.1	Low	67 Å²	67	99.2 Å²	99.2	47%	0.469	53%	0.531	S	S	.	.	H	α-helix	trans	-74	-48.4	-179.7	175.2	0	0	0	0	112	I263 T267 S268 E269	I263-S265 PolarHBondContact O-N 2.88Å; S265-T267 VanDerWaalsContact C-N 3.32Å; S265-T267 PolarHBondContact O-N 2.95Å; S265-S268 PolarHBondContact O-N 3.02Å; S265-S268 VanDerWaalsContact O-N 3.12Å; S265-E269 PolarHBondContact O-N 3.29Å
266	E	43.3	Very low	54.4	Low	143 Å²	143	93.7 Å²	93.7	67%	0.668	51%	0.51	S	S	*	.	H	α-helix	trans	-66.8	-33.3	178.1	-172	176.3	-160.3	0	0	112	M270	E266-M270 WeakPolarHBondContact O-CB 3.35Å; E266-M270 PolarHBondContact O-N 3.02Å; E266-M270 VanDerWaalsContact O-N 3.12Å
267	T	50.6	Low	57.4	Low	41 Å²	41	83 Å²	83	25%	0.252	47%	0.468	S	S	.	.	H	α-helix	trans	-69.4	-37.5	170.5	51.9	0	0	0	0	112.3	I263 S264 S265 M270 F271	I263-T267 HydrophobicContact CG2-CG2 4.08Å; I263-T267 WeakPolarHBondContact O-CB 3.49Å; I263-T267 WeakPolarHBondContact O-CG2 3.43Å; I263-T267 PolarHBondContact O-N 2.71Å; I263-T267 PolarHBondContact O-OG1 3.27Å; S264-T267 WeakPolarHBondContact CA-OG1 3.38Å; S264-T267 PolarHBondContact O-OG1 2.67Å; S265-T267 VanDerWaalsContact C-N 3.32Å; S265-T267 PolarHBondContact O-N 2.95Å; T267-M270 HydrophobicContact CG2-CE 4.42Å; T267-M270 PolarHBondContact O-N 2.81Å; T267-F271 WeakPolarHBondContact O-CB 3.46Å; T267-F271 WeakPolarHBondContact O-CD2 3.49Å; T267-F271 WeakPolarHBondContact O-CG 3.36Å; T267-F271 PolarHBondContact O-N 3.14Å
268	S	57.4	Low	60.1	Low	72 Å²	72	78.4 Å²	78.4	50%	0.503	44%	0.438	S	S	.	.	H	α-helix	trans	-64.3	-50.8	176.7	-171.9	0	0	0	0	112.7	S264 S265 M270 F271 E272	S264-S268 VanDerWaalsContact O-CB 3.28Å; S264-S268 WeakPolarHBondContact O-CB 3.37Å; S264-S268 PolarHBondContact O-N 3.41Å; S265-S268 PolarHBondContact O-N 3.02Å; S265-S268 VanDerWaalsContact O-N 3.12Å; S268-M270 VanDerWaalsContact C-N 3.25Å; S268-M270 PolarHBondContact O-N 3Å; S268-F271 PolarHBondContact O-N 2.83Å; S268-F271 VanDerWaalsContact O-N 3.15Å; S268-E272 PolarHBondContact O-N 3.35Å
269	E	64.7	Low	62.6	Low	107 Å²	107	76.5 Å²	76.5	50%	0.5	42%	0.421	S	S	.	.	H	α-helix	trans	-59.8	-37.7	175.1	-69.7	-166.4	162.3	0	0	111.5	S265 R273	S265-E269 PolarHBondContact O-N 3.29Å; E269-R273 WeakPolarHBondContact O-CB 3.25Å; E269-R273 PolarHBondContact O-N 2.76Å
270	M	68	Low	65.5	Low	60 Å²	60	72.7 Å²	72.7	30%	0.296	40%	0.396	S	S	.	.	H	α-helix	trans	-68	-40	175.6	175	162	44.8	0	0	112.7	E266 T267 S268 D274 K357	E266-M270 WeakPolarHBondContact O-CB 3.35Å; E266-M270 PolarHBondContact O-N 3.02Å; E266-M270 VanDerWaalsContact O-N 3.12Å; T267-M270 HydrophobicContact CG2-CE 4.42Å; T267-M270 PolarHBondContact O-N 2.81Å; S268-M270 VanDerWaalsContact C-N 3.25Å; S268-M270 PolarHBondContact O-N 3Å; M270-D274 VanDerWaalsContact O-CB 3.25Å; M270-D274 WeakPolarHBondContact O-CB 3.44Å; M270-D274 PolarHBondContact O-N 3.12Å; M270-K357 PolarHBondContact SD-NZ 3.23Å
271	F	79.1	Confident	68.4	Low	54 Å²	54	66.1 Å²	66.1	24%	0.237	36%	0.361	C	S	.	.	H	α-helix	trans	-66.4	-41.6	175.9	-71.2	-48	0	0	0	111.6	T267 S268 D274 V275 L358 H361	T267-F271 WeakPolarHBondContact O-CB 3.46Å; T267-F271 WeakPolarHBondContact O-CD2 3.49Å; T267-F271 WeakPolarHBondContact O-CG 3.36Å; T267-F271 PolarHBondContact O-N 3.14Å; S268-F271 PolarHBondContact O-N 2.83Å; S268-F271 VanDerWaalsContact O-N 3.15Å; F271-D274 PolarHBondContact O-N 2.94Å; F271-V275 WeakPolarHBondContact O-CG2 3.47Å; F271-V275 PolarHBondContact O-N 2.99Å; F271-L358 HydrophobicContact CB-CD2 4.38Å; F271-L358 HydrophobicContact CD1-CD2 3.79Å; F271-L358 HydrophobicContact CG-CD2 4.48Å; F271-H361 AromaticContact CE1-CE1 3.65Å; F271-H361 AromaticContact CE1-ND1 3.83Å; F271-H361 AromaticContact CE2-CE1 3.73Å; F271-H361 AromaticContact CZ-CE1 3.32Å; F271-H361 WeakPolarHBondContact CZ-CE1 3.26Å; F271-H361 AromaticContact CZ-ND1 3.95Å
272	E	79.3	Confident	71.2	Confident	138 Å²	138	65.5 Å²	65.5	65%	0.645	35%	0.346	S	S	*	.	H	α-helix	trans	-62	-46.4	175.8	-169	-171.9	161.5	0	0	111.3	S268 D274 V275 N276	S268-E272 PolarHBondContact O-N 3.35Å; E272-D274 VanDerWaalsContact C-N 3.29Å; E272-D274 PolarHBondContact O-N 2.99Å; E272-V275 PolarHBondContact O-N 3.48Å; E272-N276 WeakPolarHBondContact O-CB 3.3Å; E272-N276 PolarHBondContact O-N 2.98Å
273	R	83.1	Confident	74.2	Confident	92 Å²	92	62.9 Å²	62.9	35%	0.347	33%	0.325	S	S	.	.	H	α-helix	trans	-59.1	-40.9	174.2	-174.1	-170.1	66	-164.7	-11.3	112	E269 N276 T277 P454	E269-R273 WeakPolarHBondContact O-CB 3.25Å; E269-R273 PolarHBondContact O-N 2.76Å; R273-N276 PolarHBondContact O-N 3.36Å; R273-T277 VanDerWaalsContact O-CB 3.31Å; R273-T277 WeakPolarHBondContact O-CB 3.41Å; R273-T277 PolarHBondContact O-N 3.34Å; R273-T277 PolarHBondContact O-OG1 3.1Å; R273-P454 HydrophobicContact CG-CB 4.14Å
274	D	88.4	Confident	77	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.016	30%	0.304	C	S	.	.	H	α-helix	trans	-70	-38	-179.4	-73.9	-4.4	0	0	0	111.6	M270 F271 E272 T277 L278 L354 K357 L358	M270-D274 VanDerWaalsContact O-CB 3.25Å; M270-D274 WeakPolarHBondContact O-CB 3.44Å; M270-D274 PolarHBondContact O-N 3.12Å; F271-D274 PolarHBondContact O-N 2.94Å; E272-D274 VanDerWaalsContact C-N 3.29Å; E272-D274 PolarHBondContact O-N 2.99Å; D274-T277 PolarHBondContact O-N 3.21Å; D274-L278 WeakPolarHBondContact O-CB 3.39Å; D274-L278 PolarHBondContact O-N 2.96Å; D274-L354 HydrophobicContact CB-CD2 3.81Å; D274-K357 WeakPolarHBondContact OD2-CD 3.45Å; D274-K357 WeakPolarHBondContact OD2-CE 3.28Å; D274-K357 IonicContact OD2-NZ 2.76Å; D274-K357 PolarHBondContact OD2-NZ 3.16Å; D274-L358 HydrophobicContact CB-CD1 4.34Å; D274-L358 HydrophobicContact CB-CD2 4.38Å
275	V	87.9	Confident	79.8	Confident	51 Å²	51	55.5 Å²	55.5	31%	0.309	28%	0.281	S	S	.	.	H	α-helix	trans	-64.6	-45.6	171.7	168.7	0	0	0	0	111.3	F271 E272 T277 L278 N279 L358	F271-V275 WeakPolarHBondContact O-CG2 3.47Å; F271-V275 PolarHBondContact O-N 2.99Å; E272-V275 PolarHBondContact O-N 3.48Å; V275-T277 VanDerWaalsContact C-N 3.33Å; V275-T277 PolarHBondContact O-N 3.27Å; V275-L278 WeakPolarHBondContact O-CB 3.49Å; V275-L278 PolarHBondContact O-N 2.57Å; V275-N279 PolarHBondContact O-N 2.66Å; V275-N279 PolarHBondContact O-ND2 3.42Å; V275-L358 HydrophobicContact CG2-CD1 3.75Å; V275-L358 HydrophobicContact CG2-CD2 3.86Å; V275-L358 HydrophobicContact CG2-CG 4.42Å
276	N	88.6	Confident	82.5	Confident	77 Å²	77	59.2 Å²	59.2	41%	0.412	29%	0.291	S	S	.	.	H	α-helix	trans	-61.6	-42.5	176.5	-170.1	-11.8	0	0	0	111.2	E272 R273 L278 N279 R280	E272-N276 WeakPolarHBondContact O-CB 3.3Å; E272-N276 PolarHBondContact O-N 2.98Å; R273-N276 PolarHBondContact O-N 3.36Å; N276-L278 PolarHBondContact O-N 3.28Å; N276-N279 PolarHBondContact O-N 3.28Å; N276-R280 PolarHBondContact O-N 3.22Å
277	T	90.9	Very high	84.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.2	-40.7	174.4	-57.5	0	0	0	0	112.3	R273 D274 V275 R280 C281 L350 L354 F448 P454	R273-T277 VanDerWaalsContact O-CB 3.31Å; R273-T277 WeakPolarHBondContact O-CB 3.41Å; R273-T277 PolarHBondContact O-N 3.34Å; R273-T277 PolarHBondContact O-OG1 3.1Å; D274-T277 PolarHBondContact O-N 3.21Å; V275-T277 VanDerWaalsContact C-N 3.33Å; V275-T277 PolarHBondContact O-N 3.27Å; T277-R280 PolarHBondContact O-N 2.72Å; T277-C281 PolarHBondContact O-N 2.91Å; T277-C281 PolarHBondContact O-SG 2.96Å; T277-L350 HydrophobicContact CG2-CD2 3.93Å; T277-L354 HydrophobicContact CG2-CD1 3.73Å; T277-F448 HydrophobicContact CG2-CE2 4.09Å; T277-F448 HydrophobicContact CG2-CZ 3.91Å; T277-P454 HydrophobicContact CG2-CG 3.84Å; T277-P454 WeakPolarHBondContact OG1-CB 3.25Å; T277-P454 WeakPolarHBondContact OG1-CG 3.33Å
278	L	93.9	Very high	87	Confident	5 Å²	5	55.6 Å²	55.6	3%	0.026	27%	0.266	C	S	.	.	H	α-helix	trans	-64.3	-44.8	176.3	176.1	62.1	0	0	0	111.6	D274 V275 N276 R280 C281 F282 L354 L355 L358 I362	D274-L278 WeakPolarHBondContact O-CB 3.39Å; D274-L278 PolarHBondContact O-N 2.96Å; V275-L278 WeakPolarHBondContact O-CB 3.49Å; V275-L278 PolarHBondContact O-N 2.57Å; N276-L278 PolarHBondContact O-N 3.28Å; L278-R280 PolarHBondContact O-N 3.44Å; L278-C281 WeakPolarHBondContact O-CB 3.16Å; L278-C281 PolarHBondContact O-N 3.41Å; L278-C281 VanDerWaalsContact O-N 3.09Å; L278-F282 HydrophobicContact CD1-CE1 4.16Å; L278-F282 HydrophobicContact CD1-CE2 3.91Å; L278-F282 HydrophobicContact CD1-CZ 3.63Å; L278-F282 HydrophobicContact CD2-CE2 4.17Å; L278-F282 HydrophobicContact CD2-CZ 4.3Å; L278-F282 HydrophobicContact CG-CD2 4.36Å; L278-F282 HydrophobicContact CG-CE2 3.64Å; L278-F282 HydrophobicContact CG-CZ 3.87Å; L278-F282 WeakPolarHBondContact O-CD2 3.39Å; L278-F282 PolarHBondContact O-N 2.8Å; L278-L354 HydrophobicContact CB-CB 4.3Å; L278-L354 HydrophobicContact CB-CD1 4.08Å; L278-L354 HydrophobicContact CD1-CB 4.32Å; L278-L355 HydrophobicContact CD1-CD2 4.34Å; L278-L355 HydrophobicContact CD1-CG 4.12Å; L278-L355 HydrophobicContact CD2-CD2 3.7Å; L278-L355 HydrophobicContact CD2-CG 4.24Å; L278-L358 HydrophobicContact CD2-CD1 4Å; L278-I362 HydrophobicContact CD2-CD1 4.46Å
279	N	92.8	Very high	88.9	Confident	81 Å²	81	52.9 Å²	52.9	43%	0.433	25%	0.247	S	C	.	.	H	α-helix	trans	-60.7	-44.5	176.3	-72	-24.5	0	0	0	111.9	V275 N276 C281 F282 D283	V275-N279 PolarHBondContact O-N 2.66Å; V275-N279 PolarHBondContact O-ND2 3.42Å; N276-N279 PolarHBondContact O-N 3.28Å; N279-C281 VanDerWaalsContact C-N 3.27Å; N279-C281 PolarHBondContact O-N 2.8Å; N279-F282 WeakPolarHBondContact O-CB 3.16Å; N279-F282 PolarHBondContact O-N 3.27Å; N279-D283 PolarHBondContact O-N 3.42Å
280	R	91.9	Very high	90.2	Very high	65 Å²	65	50.4 Å²	50.4	25%	0.245	24%	0.244	C	C	.	.	H	α-helix	trans	-64.3	-27.7	173.9	-71.8	-79.8	88.3	139.7	8.9	113.6	N276 T277 L278 D283 D284 F448 D450 F452	N276-R280 PolarHBondContact O-N 3.22Å; T277-R280 PolarHBondContact O-N 2.72Å; L278-R280 PolarHBondContact O-N 3.44Å; R280-D283 IonicContact CZ-OD1 3.64Å; R280-D283 IonicContact CZ-OD2 2.66Å; R280-D283 IonicContact NE-OD2 2.83Å; R280-D283 PolarHBondContact NE-OD2 3.26Å; R280-D283 IonicContact NH2-OD1 3.25Å; R280-D283 PolarHBondContact NH2-OD1 2.85Å; R280-D283 VanDerWaalsContact NH2-OD1 3.12Å; R280-D283 IonicContact NH2-OD2 3.92Å; R280-D283 PolarHBondContact NH2-OD2 2.89Å; R280-D284 PolarHBondContact O-N 3.33Å; R280-F448 HydrophobicContact CB-CB 4.47Å; R280-F448 HydrophobicContact CB-CD1 3.72Å; R280-F448 HydrophobicContact CB-CD2 4.04Å; R280-F448 HydrophobicContact CB-CE1 3.88Å; R280-F448 HydrophobicContact CB-CE2 4.17Å; R280-F448 HydrophobicContact CB-CG 3.81Å; R280-F448 HydrophobicContact CB-CZ 4.09Å; R280-F448 WeakPolarHBondContact O-CD1 3.37Å; R280-D450 WeakPolarHBondContact CD-OD2 3.35Å; R280-D450 IonicContact CZ-OD2 2.91Å; R280-D450 IonicContact NE-OD2 2.85Å; R280-D450 IonicContact NH1-OD2 3.72Å; R280-D450 PolarHBondContact NH1-OD2 3.22Å; R280-F452 HydrophobicContact CG-CD1 4.09Å
281	C	95.8	Very high	91.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-66.7	-44.1	168.4	-65.3	0	0	0	0	111.5	T277 L278 N279 D284 I285 K347 S351 F448	T277-C281 PolarHBondContact O-N 2.91Å; T277-C281 PolarHBondContact O-SG 2.96Å; L278-C281 WeakPolarHBondContact O-CB 3.16Å; L278-C281 PolarHBondContact O-N 3.41Å; L278-C281 VanDerWaalsContact O-N 3.09Å; N279-C281 VanDerWaalsContact C-N 3.27Å; N279-C281 PolarHBondContact O-N 2.8Å; C281-D284 PolarHBondContact O-N 3.04Å; C281-I285 WeakPolarHBondContact O-CB 3.36Å; C281-I285 WeakPolarHBondContact O-CD1 3.11Å; C281-I285 WeakPolarHBondContact O-CG1 3.32Å; C281-I285 PolarHBondContact O-N 3.26Å; C281-K347 HydrophobicContact CB-CB 4.47Å; C281-S351 WeakPolarHBondContact CB-OG 3.23Å; C281-F448 HydrophobicContact CB-CE1 4.34Å; C281-F448 VanDerWaalsContact SG-CE1 3.53Å
282	F	95.7	Very high	92.1	Very high	51 Å²	51	50.5 Å²	50.5	22%	0.224	24%	0.24	C	C	.	.	H	α-helix	trans	-61.3	-45.3	175.8	-61.4	-47.3	0	0	0	112	L278 N279 D284 I285 E286 L370 L374	L278-F282 HydrophobicContact CD1-CE1 4.16Å; L278-F282 HydrophobicContact CD1-CE2 3.91Å; L278-F282 HydrophobicContact CD1-CZ 3.63Å; L278-F282 HydrophobicContact CD2-CE2 4.17Å; L278-F282 HydrophobicContact CD2-CZ 4.3Å; L278-F282 HydrophobicContact CG-CD2 4.36Å; L278-F282 HydrophobicContact CG-CE2 3.64Å; L278-F282 HydrophobicContact CG-CZ 3.87Å; L278-F282 WeakPolarHBondContact O-CD2 3.39Å; L278-F282 PolarHBondContact O-N 2.8Å; N279-F282 WeakPolarHBondContact O-CB 3.16Å; N279-F282 PolarHBondContact O-N 3.27Å; F282-D284 PolarHBondContact O-N 2.9Å; F282-I285 PolarHBondContact O-N 3.43Å; F282-E286 PolarHBondContact O-N 2.89Å; F282-L370 HydrophobicContact CE2-CD2 4.03Å; F282-L370 HydrophobicContact CZ-CB 4.36Å; F282-L370 HydrophobicContact CZ-CD2 3.8Å; F282-L370 HydrophobicContact CZ-CG 4.46Å; F282-L374 HydrophobicContact CD1-CD2 3.89Å; F282-L374 HydrophobicContact CD1-CG 4.48Å; F282-L374 HydrophobicContact CE1-CD1 4.02Å; F282-L374 HydrophobicContact CE1-CD2 3.73Å; F282-L374 HydrophobicContact CE1-CG 3.85Å
283	D	93.6	Very high	92.7	Very high	40 Å²	40	48.9 Å²	48.9	21%	0.214	23%	0.233	C	C	.	.	H	α-helix	trans	-51.5	-54	174.3	-86.4	-83.5	0	0	0	112.6	N279 R280 I285 R287	N279-D283 PolarHBondContact O-N 3.42Å; R280-D283 IonicContact CZ-OD1 3.64Å; R280-D283 IonicContact CZ-OD2 2.66Å; R280-D283 IonicContact NE-OD2 2.83Å; R280-D283 PolarHBondContact NE-OD2 3.26Å; R280-D283 IonicContact NH2-OD1 3.25Å; R280-D283 PolarHBondContact NH2-OD1 2.85Å; R280-D283 VanDerWaalsContact NH2-OD1 3.12Å; R280-D283 IonicContact NH2-OD2 3.92Å; R280-D283 PolarHBondContact NH2-OD2 2.89Å; D283-I285 VanDerWaalsContact C-N 3.32Å; D283-I285 PolarHBondContact O-N 3.03Å; D283-R287 WeakPolarHBondContact O-CB 3.4Å; D283-R287 VanDerWaalsContact O-CD 3.32Å; D283-R287 WeakPolarHBondContact O-CD 3.39Å; D283-R287 WeakPolarHBondContact O-CG 3.42Å; D283-R287 PolarHBondContact O-N 3.16Å; D283-R287 IonicContact OD1-CZ 3.5Å; D283-R287 IonicContact OD1-NE 2.66Å; D283-R287 IonicContact OD1-NH2 3.63Å; D283-R287 PolarHBondContact OD1-NH2 3.09Å
284	D	95.7	Very high	93	Very high	14 Å²	14	47.2 Å²	47.2	8%	0.075	24%	0.235	C	C	.	.	H	α-helix	trans	-66.7	-35.8	-177.8	-89.5	8.3	0	0	0	110.9	R280 C281 F282 F288 I344 K347 N449	R280-D284 PolarHBondContact O-N 3.33Å; C281-D284 PolarHBondContact O-N 3.04Å; F282-D284 PolarHBondContact O-N 2.9Å; D284-F288 VanDerWaalsContact O-CB 3.27Å; D284-F288 WeakPolarHBondContact O-CB 3.29Å; D284-F288 PolarHBondContact O-N 2.9Å; D284-I344 HydrophobicContact CB-CD1 4Å; D284-K347 HydrophobicContact CB-CD 4.12Å; D284-K347 WeakPolarHBondContact OD2-CE 3.36Å; D284-K347 IonicContact OD2-NZ 2.71Å; D284-K347 PolarHBondContact OD2-NZ 3.3Å; D284-N449 WeakPolarHBondContact OD1-CB 3.2Å; D284-N449 PolarHBondContact OD1-N 3.07Å; D284-N449 PolarHBondContact OD2-N 3.48Å
285	I	96.6	Very high	93.1	Very high	5 Å²	5	47 Å²	47	3%	0.026	23%	0.234	C	C	.	.	H	α-helix	trans	-65.6	-48.6	177.2	-73	165.7	0	0	0	110.9	C281 F282 D283 R287 F288 V289 I344 F348 L374 P377	C281-I285 WeakPolarHBondContact O-CB 3.36Å; C281-I285 WeakPolarHBondContact O-CD1 3.11Å; C281-I285 WeakPolarHBondContact O-CG1 3.32Å; C281-I285 PolarHBondContact O-N 3.26Å; F282-I285 PolarHBondContact O-N 3.43Å; D283-I285 VanDerWaalsContact C-N 3.32Å; D283-I285 PolarHBondContact O-N 3.03Å; I285-R287 PolarHBondContact O-N 3.44Å; I285-F288 PolarHBondContact O-N 2.89Å; I285-V289 WeakPolarHBondContact O-CG2 3.34Å; I285-V289 PolarHBondContact O-N 3.46Å; I285-I344 HydrophobicContact CG1-CD1 3.85Å; I285-I344 HydrophobicContact CG1-CG1 3.93Å; I285-F348 HydrophobicContact CB-CZ 4.39Å; I285-F348 HydrophobicContact CD1-CD1 4.03Å; I285-F348 HydrophobicContact CD1-CD2 4.03Å; I285-F348 HydrophobicContact CD1-CE1 3.91Å; I285-F348 HydrophobicContact CD1-CE2 3.91Å; I285-F348 HydrophobicContact CD1-CG 4.08Å; I285-F348 HydrophobicContact CD1-CZ 3.86Å; I285-F348 HydrophobicContact CG1-CD2 4.22Å; I285-F348 HydrophobicContact CG1-CE2 3.79Å; I285-F348 HydrophobicContact CG1-CZ 3.98Å; I285-F348 HydrophobicContact CG2-CE1 4.2Å; I285-F348 HydrophobicContact CG2-CE2 4Å; I285-F348 HydrophobicContact CG2-CZ 3.48Å; I285-F348 VanDerWaalsContact CG2-CZ 3.48Å; I285-L374 HydrophobicContact CD1-CD2 3.81Å; I285-P377 HydrophobicContact CG2-CB 3.89Å; I285-P377 HydrophobicContact CG2-CG 4.03Å
286	E	95.7	Very high	93.1	Very high	145 Å²	145	46.5 Å²	46.5	68%	0.678	24%	0.235	S	C	*	.	H	α-helix	trans	-60.7	-46.5	177.7	-172	-175.6	-178.6	0	0	111	F282 F288 V289 A290	F282-E286 PolarHBondContact O-N 2.89Å; E286-F288 VanDerWaalsContact C-N 3.29Å; E286-F288 PolarHBondContact O-N 3.47Å; E286-V289 PolarHBondContact O-N 2.77Å; E286-A290 WeakPolarHBondContact O-CB 3.33Å; E286-A290 PolarHBondContact O-N 3.24Å
287	R	92.9	Very high	93.1	Very high	102 Å²	102	48.2 Å²	48.2	39%	0.385	24%	0.244	S	C	.	.	H	α-helix	trans	-60.1	-37.8	176	-68.8	166.5	-162.4	-166.7	9.9	112.2	D283 I285 R291	D283-R287 WeakPolarHBondContact O-CB 3.4Å; D283-R287 VanDerWaalsContact O-CD 3.32Å; D283-R287 WeakPolarHBondContact O-CD 3.39Å; D283-R287 WeakPolarHBondContact O-CG 3.42Å; D283-R287 PolarHBondContact O-N 3.16Å; D283-R287 IonicContact OD1-CZ 3.5Å; D283-R287 IonicContact OD1-NE 2.66Å; D283-R287 IonicContact OD1-NH2 3.63Å; D283-R287 PolarHBondContact OD1-NH2 3.09Å; I285-R287 PolarHBondContact O-N 3.44Å; R287-R291 WeakPolarHBondContact O-CG 3.28Å; R287-R291 PolarHBondContact O-N 3.49Å; R287-R291 VanDerWaalsContact O-N 3.09Å
288	F	95.6	Very high	93	Very high	5 Å²	5	48.6 Å²	48.6	2%	0.022	25%	0.247	C	C	.	.	H	α-helix	trans	-69.7	-43	178	-167.2	-96.4	0	0	0	112.2	D284 I285 E286 R291 I292 P336 E340 F341 I344 I381	D284-F288 VanDerWaalsContact O-CB 3.27Å; D284-F288 WeakPolarHBondContact O-CB 3.29Å; D284-F288 PolarHBondContact O-N 2.9Å; I285-F288 PolarHBondContact O-N 2.89Å; E286-F288 VanDerWaalsContact C-N 3.29Å; E286-F288 PolarHBondContact O-N 3.47Å; F288-R291 PolarHBondContact O-N 2.76Å; F288-I292 HydrophobicContact CD1-CD1 3.67Å; F288-I292 HydrophobicContact CD1-CG1 4.49Å; F288-I292 HydrophobicContact CE1-CD1 3.4Å; F288-I292 HydrophobicContact CE1-CG1 4.28Å; F288-I292 HydrophobicContact CZ-CD1 4.28Å; F288-I292 PolarHBondContact O-N 3.33Å; F288-P336 HydrophobicContact CD2-CB 4.47Å; F288-P336 HydrophobicContact CD2-CG 4.3Å; F288-P336 HydrophobicContact CE2-CB 3.45Å; F288-P336 VanDerWaalsContact CE2-CB 3.45Å; F288-P336 HydrophobicContact CE2-CG 3.6Å; F288-P336 HydrophobicContact CZ-CB 3.69Å; F288-P336 HydrophobicContact CZ-CG 3.74Å; F288-E340 HydrophobicContact CE2-CB 3.74Å; F288-E340 HydrophobicContact CZ-CB 4.48Å; F288-F341 AromaticContact CE1-CD1 3.74Å; F288-F341 HydrophobicContact CE1-CD1 3.74Å; F288-F341 AromaticContact CE1-CE1 3.81Å; F288-F341 HydrophobicContact CE1-CE1 3.81Å; F288-F341 HydrophobicContact CE1-CG 4.29Å; F288-F341 HydrophobicContact CE1-CZ 4.4Å; F288-F341 HydrophobicContact CZ-CB 4.41Å; F288-F341 AromaticContact CZ-CD1 3.71Å; F288-F341 HydrophobicContact CZ-CD1 3.71Å; F288-F341 HydrophobicContact CZ-CD2 4.06Å; F288-F341 AromaticContact CZ-CE1 3.95Å; F288-F341 HydrophobicContact CZ-CE1 3.95Å; F288-F341 HydrophobicContact CZ-CE2 4.27Å; F288-F341 AromaticContact CZ-CG 3.78Å; F288-F341 HydrophobicContact CZ-CG 3.78Å; F288-F341 HydrophobicContact CZ-CZ 4.23Å; F288-I344 HydrophobicContact CB-CD1 4.07Å; F288-I344 HydrophobicContact CB-CG1 3.93Å; F288-I344 HydrophobicContact CD1-CB 4.23Å; F288-I344 HydrophobicContact CD1-CG1 4.13Å; F288-I344 HydrophobicContact CD1-CG2 3.73Å; F288-I344 HydrophobicContact CD2-CB 4.38Å; F288-I344 HydrophobicContact CE1-CB 4.45Å; F288-I344 HydrophobicContact CE1-CG2 3.64Å; F288-I344 HydrophobicContact CE2-CG2 4.49Å; F288-I344 HydrophobicContact CG-CB 4.18Å; F288-I344 HydrophobicContact CG-CD1 4.44Å; F288-I344 HydrophobicContact CG-CG1 3.95Å; F288-I344 HydrophobicContact CG-CG2 4.18Å; F288-I344 HydrophobicContact CZ-CG2 4.06Å; F288-I381 HydrophobicContact CD1-CD1 3.74Å; F288-I381 HydrophobicContact CD1-CG1 3.86Å; F288-I381 HydrophobicContact CE1-CD1 4.32Å; F288-I381 HydrophobicContact CE1-CG1 4.09Å; F288-I381 HydrophobicContact CE1-CG2 4.18Å
289	V	95.8	Very high	92.6	Very high	16 Å²	16	51.6 Å²	51.6	10%	0.097	26%	0.26	C	S	.	.	H	α-helix	trans	-62	-43.8	173.4	172.2	0	0	0	0	111.3	I285 E286 R291 I292 Q293 P377 V380 I381	I285-V289 WeakPolarHBondContact O-CG2 3.34Å; I285-V289 PolarHBondContact O-N 3.46Å; E286-V289 PolarHBondContact O-N 2.77Å; V289-R291 VanDerWaalsContact C-N 3.29Å; V289-R291 PolarHBondContact O-N 3.17Å; V289-I292 PolarHBondContact O-N 3.02Å; V289-I292 VanDerWaalsContact O-N 3.16Å; V289-Q293 HydrophobicContact CG1-CG 4.25Å; V289-Q293 WeakPolarHBondContact O-CG 3.23Å; V289-Q293 PolarHBondContact O-N 2.94Å; V289-P377 HydrophobicContact CG2-CB 3.61Å; V289-V380 HydrophobicContact CG1-CG1 4.3Å; V289-I381 HydrophobicContact CG2-CD1 3.81Å; V289-I381 HydrophobicContact CG2-CG1 4.02Å
290	A	93.4	Very high	92.4	Very high	54 Å²	54	55.8 Å²	55.8	45%	0.446	27%	0.27	S	S	.	.	H	α-helix	trans	-59.9	-37.9	176.1	0	0	0	0	0	112.3	E286 S294	E286-A290 WeakPolarHBondContact O-CB 3.33Å; E286-A290 PolarHBondContact O-N 3.24Å; A290-S294 VanDerWaalsContact O-CB 3.31Å; A290-S294 WeakPolarHBondContact O-CB 3.43Å; A290-S294 PolarHBondContact O-N 3.28Å
291	R	92.8	Very high	92.2	Very high	110 Å²	110	56 Å²	56	42%	0.415	27%	0.274	S	S	.	.	H	α-helix	trans	-64.4	-45.7	172.4	-74.6	-163.6	-69.6	150.3	-11.1	112.4	R287 F288 V289 S294 A295 E340	R287-R291 WeakPolarHBondContact O-CG 3.28Å; R287-R291 PolarHBondContact O-N 3.49Å; R287-R291 VanDerWaalsContact O-N 3.09Å; F288-R291 PolarHBondContact O-N 2.76Å; V289-R291 VanDerWaalsContact C-N 3.29Å; V289-R291 PolarHBondContact O-N 3.17Å; R291-S294 PolarHBondContact O-N 3.18Å; R291-A295 PolarHBondContact O-N 2.8Å; R291-E340 IonicContact CZ-OE1 3.53Å; R291-E340 IonicContact NH1-OE1 3.14Å; R291-E340 PolarHBondContact NH1-OE1 3.04Å; R291-E340 IonicContact NH1-OE2 2.88Å; R291-E340 IonicContact NH2-OE1 2.68Å; R291-E340 PolarHBondContact NH2-OE1 3.27Å
292	I	93.3	Very high	91.6	Very high	6 Å²	6	57.5 Å²	57.5	3%	0.031	28%	0.282	C	S	.	.	H	α-helix	trans	-59.6	-47.3	176.2	-75	167.7	0	0	0	111.5	F288 V289 S294 A295 A296 L335 P336 F341 V380 I381 A384	F288-I292 HydrophobicContact CD1-CD1 3.67Å; F288-I292 HydrophobicContact CD1-CG1 4.49Å; F288-I292 HydrophobicContact CE1-CD1 3.4Å; F288-I292 HydrophobicContact CE1-CG1 4.28Å; F288-I292 HydrophobicContact CZ-CD1 4.28Å; F288-I292 PolarHBondContact O-N 3.33Å; V289-I292 PolarHBondContact O-N 3.02Å; V289-I292 VanDerWaalsContact O-N 3.16Å; I292-S294 PolarHBondContact O-N 3.07Å; I292-A295 PolarHBondContact O-N 3.34Å; I292-A296 PolarHBondContact O-N 3.16Å; I292-L335 HydrophobicContact CG1-CD2 4.13Å; I292-P336 HydrophobicContact CG1-CG 4.32Å; I292-F341 HydrophobicContact CD1-CE1 3.82Å; I292-F341 HydrophobicContact CD1-CZ 4.09Å; I292-F341 HydrophobicContact CG1-CZ 4.4Å; I292-V380 HydrophobicContact CG2-CG1 4.26Å; I292-I381 HydrophobicContact CD1-CG1 3.84Å; I292-A384 HydrophobicContact CD1-CB 3.78Å; I292-A384 HydrophobicContact CG1-CB 4.17Å; I292-A384 HydrophobicContact CG2-CB 3.7Å
293	Q	92.6	Very high	91.2	Very high	104 Å²	104	62 Å²	62	49%	0.486	30%	0.303	S	S	.	.	H	α-helix	trans	-63.9	-40.9	179.1	-70	178.1	0.4	0	0	111.5	V289 A295 A296 L297	V289-Q293 HydrophobicContact CG1-CG 4.25Å; V289-Q293 WeakPolarHBondContact O-CG 3.23Å; V289-Q293 PolarHBondContact O-N 2.94Å; Q293-A295 VanDerWaalsContact C-N 3.34Å; Q293-A295 PolarHBondContact O-N 3.17Å; Q293-A296 PolarHBondContact O-N 3.2Å; Q293-L297 WeakPolarHBondContact O-CB 3.47Å; Q293-L297 VanDerWaalsContact O-CG 3.3Å; Q293-L297 WeakPolarHBondContact O-CG 3.42Å; Q293-L297 PolarHBondContact O-N 3Å
294	S	89.4	Confident	90.9	Very high	57 Å²	57	63.7 Å²	63.7	40%	0.399	31%	0.31	S	S	.	.	H	α-helix	trans	-60.8	-42.4	174.1	-164.9	0	0	0	0	112	A290 R291 I292 L297 A298	A290-S294 VanDerWaalsContact O-CB 3.31Å; A290-S294 WeakPolarHBondContact O-CB 3.43Å; A290-S294 PolarHBondContact O-N 3.28Å; R291-S294 PolarHBondContact O-N 3.18Å; I292-S294 PolarHBondContact O-N 3.07Å; S294-L297 PolarHBondContact O-N 2.89Å; S294-A298 WeakPolarHBondContact O-CB 3.45Å; S294-A298 PolarHBondContact O-N 3.46Å
295	A	89.3	Confident	90.3	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.3	-46.7	176.4	0	0	0	0	0	112.6	R291 I292 Q293 L297 A298 Q299 R332 L335	R291-A295 PolarHBondContact O-N 2.8Å; I292-A295 PolarHBondContact O-N 3.34Å; Q293-A295 VanDerWaalsContact C-N 3.34Å; Q293-A295 PolarHBondContact O-N 3.17Å; A295-L297 VanDerWaalsContact C-N 3.33Å; A295-L297 PolarHBondContact O-N 3.49Å; A295-A298 PolarHBondContact O-N 2.73Å; A295-Q299 VanDerWaalsContact O-CG 3.31Å; A295-Q299 WeakPolarHBondContact O-CG 3.33Å; A295-Q299 PolarHBondContact O-N 2.7Å; A295-R332 VanDerWaalsContact CA-O 3.27Å; A295-R332 WeakPolarHBondContact CA-O 3.26Å; A295-L335 HydrophobicContact CB-CD2 4.16Å
296	A	89.5	Confident	89.7	Confident	39 Å²	39	68.7 Å²	68.7	32%	0.322	33%	0.334	S	S	.	.	H	α-helix	trans	-61.1	-39.4	177.3	0	0	0	0	0	112.6	I292 Q293 R300 W387	I292-A296 PolarHBondContact O-N 3.16Å; Q293-A296 PolarHBondContact O-N 3.2Å; A296-R300 PolarHBondContact O-N 3.38Å; A296-R300 VanDerWaalsContact O-N 3.12Å; A296-W387 HydrophobicContact CB-CZ2 4.25Å
297	L	88.3	Confident	89.2	Confident	114 Å²	114	66.9 Å²	66.9	60%	0.597	33%	0.326	S	S	*	.	H	α-helix	trans	-66.4	-44.5	174.2	-71.2	172	0	0	0	111.9	Q293 S294 A295 R300 E301	Q293-L297 WeakPolarHBondContact O-CB 3.47Å; Q293-L297 VanDerWaalsContact O-CG 3.3Å; Q293-L297 WeakPolarHBondContact O-CG 3.42Å; Q293-L297 PolarHBondContact O-N 3Å; S294-L297 PolarHBondContact O-N 2.89Å; A295-L297 VanDerWaalsContact C-N 3.33Å; A295-L297 PolarHBondContact O-N 3.49Å; L297-R300 PolarHBondContact O-N 3.48Å; L297-E301 PolarHBondContact O-N 3.22Å
298	A	88.3	Confident	88.7	Confident	7 Å²	7	68.8 Å²	68.8	6%	0.058	33%	0.333	C	S	.	.	H	α-helix	trans	-64.9	-38.3	178	0	0	0	0	0	112.4	S294 A295 E301 I302 L329 R332 A333	S294-A298 WeakPolarHBondContact O-CB 3.45Å; S294-A298 PolarHBondContact O-N 3.46Å; A295-A298 PolarHBondContact O-N 2.73Å; A298-E301 PolarHBondContact O-N 3.45Å; A298-I302 VanDerWaalsContact O-CG1 3.32Å; A298-I302 WeakPolarHBondContact O-CG1 3.35Å; A298-I302 PolarHBondContact O-N 3.02Å; A298-L329 HydrophobicContact CB-CD1 4.03Å; A298-R332 HydrophobicContact CB-CB 3.91Å; A298-A333 HydrophobicContact CB-CB 3.88Å
299	Q	86.8	Confident	88	Confident	68 Å²	68	71.5 Å²	71.5	32%	0.318	34%	0.343	S	S	.	.	H	α-helix	trans	-61.8	-44.9	172.7	-72.5	176	13.8	0	0	112	A295 E301 I302 E303 A333	A295-Q299 VanDerWaalsContact O-CG 3.31Å; A295-Q299 WeakPolarHBondContact O-CG 3.33Å; A295-Q299 PolarHBondContact O-N 2.7Å; Q299-E301 VanDerWaalsContact C-N 3.27Å; Q299-E301 PolarHBondContact O-N 3.21Å; Q299-I302 PolarHBondContact O-N 3.4Å; Q299-E303 PolarHBondContact O-N 2.84Å; Q299-A333 HydrophobicContact CG-CB 3.7Å; Q299-A333 PolarHBondContact NE2-O 3.14Å
300	R	88.1	Confident	87.3	Confident	169 Å²	169	79 Å²	79	64%	0.638	37%	0.37	S	S	*	.	H	α-helix	trans	-62.3	-32.9	175.8	-171.2	-177.8	-68.9	179.3	-1	112.4	A296 L297 Q304	A296-R300 PolarHBondContact O-N 3.38Å; A296-R300 VanDerWaalsContact O-N 3.12Å; L297-R300 PolarHBondContact O-N 3.48Å; R300-Q304 VanDerWaalsContact O-CG 3.32Å; R300-Q304 WeakPolarHBondContact O-CG 3.43Å; R300-Q304 PolarHBondContact O-N 2.9Å; R300-Q304 VanDerWaalsContact O-N 3.16Å; R300-Q304 PolarHBondContact O-NE2 3.41Å
301	E	87.7	Confident	86.6	Confident	70 Å²	70	78 Å²	78	33%	0.327	36%	0.359	S	S	.	.	H	α-helix	trans	-71.2	-40.8	173.8	-169	61.6	-152.3	0	0	111.7	L297 A298 Q299 Q304 Q305 L329	L297-E301 PolarHBondContact O-N 3.22Å; A298-E301 PolarHBondContact O-N 3.45Å; Q299-E301 VanDerWaalsContact C-N 3.27Å; Q299-E301 PolarHBondContact O-N 3.21Å; E301-Q304 WeakPolarHBondContact O-CB 3.38Å; E301-Q304 PolarHBondContact O-N 3.45Å; E301-Q304 PolarHBondContact OE2-NE2 3.08Å; E301-Q305 WeakPolarHBondContact O-CG 3.11Å; E301-Q305 PolarHBondContact O-N 2.92Å; E301-L329 HydrophobicContact CB-CD1 4.14Å; E301-L329 HydrophobicContact CB-CD2 4.08Å; E301-L329 HydrophobicContact CG-CD1 4.13Å; E301-L329 HydrophobicContact CG-CD2 3.74Å
302	I	83.4	Confident	85.7	Confident	32 Å²	32	73.6 Å²	73.6	16%	0.164	35%	0.345	C	S	.	.	H	α-helix	trans	-64.2	-41.5	175.1	-68.2	165.9	0	0	0	111.7	A298 Q299 Q304 Q305 N306 L329 F330 A333	A298-I302 VanDerWaalsContact O-CG1 3.32Å; A298-I302 WeakPolarHBondContact O-CG1 3.35Å; A298-I302 PolarHBondContact O-N 3.02Å; Q299-I302 PolarHBondContact O-N 3.4Å; I302-Q304 VanDerWaalsContact C-N 3.35Å; I302-Q305 PolarHBondContact O-N 2.89Å; I302-N306 WeakPolarHBondContact CG2-ND2 3.49Å; I302-N306 WeakPolarHBondContact O-CB 3.45Å; I302-N306 PolarHBondContact O-N 3.49Å; I302-N306 PolarHBondContact O-ND2 2.91Å; I302-L329 HydrophobicContact CD1-CG 4.21Å; I302-L329 HydrophobicContact CG1-CD2 3.63Å; I302-L329 HydrophobicContact CG1-CG 3.73Å; I302-F330 HydrophobicContact CD1-CB 4.32Å; I302-F330 HydrophobicContact CD1-CD2 4.17Å; I302-A333 HydrophobicContact CD1-CB 3.35Å
303	E	86.8	Confident	84.5	Confident	144 Å²	144	76.6 Å²	76.6	67%	0.673	36%	0.361	S	S	*	.	H	α-helix	trans	-64.9	-41.1	176.7	-172.7	170.9	-148.1	0	0	111.2	Q299 N306 H307	Q299-E303 PolarHBondContact O-N 2.84Å; E303-N306 PolarHBondContact O-N 2.82Å; E303-H307 WeakPolarHBondContact O-CB 3.34Å; E303-H307 PolarHBondContact O-N 2.85Å
304	Q	86.4	Confident	83.2	Confident	77 Å²	77	78.5 Å²	78.5	36%	0.36	36%	0.364	S	S	.	.	H	α-helix	trans	-60.9	-43.6	171.4	-77.3	179.5	80.6	0	0	112.8	R300 E301 I302 H307 R308	R300-Q304 VanDerWaalsContact O-CG 3.32Å; R300-Q304 WeakPolarHBondContact O-CG 3.43Å; R300-Q304 PolarHBondContact O-N 2.9Å; R300-Q304 VanDerWaalsContact O-N 3.16Å; R300-Q304 PolarHBondContact O-NE2 3.41Å; E301-Q304 WeakPolarHBondContact O-CB 3.38Å; E301-Q304 PolarHBondContact O-N 3.45Å; E301-Q304 PolarHBondContact OE2-NE2 3.08Å; I302-Q304 VanDerWaalsContact C-N 3.35Å; Q304-H307 PolarHBondContact O-N 3.12Å; Q304-R308 WeakPolarHBondContact O-CB 3.4Å; Q304-R308 VanDerWaalsContact O-CG 3.27Å; Q304-R308 WeakPolarHBondContact O-CG 3.21Å; Q304-R308 PolarHBondContact O-N 2.95Å
305	Q	83.1	Confident	82	Confident	77 Å²	77	83.3 Å²	83.3	36%	0.36	37%	0.374	S	S	.	.	H	α-helix	trans	-61	-45	175.1	-74.8	-169.5	6	0	0	111.4	E301 I302 H307 R308 Y309	E301-Q305 WeakPolarHBondContact O-CG 3.11Å; E301-Q305 PolarHBondContact O-N 2.92Å; I302-Q305 PolarHBondContact O-N 2.89Å; Q305-H307 VanDerWaalsContact C-N 3.34Å; Q305-H307 PolarHBondContact O-N 3.24Å; Q305-R308 PolarHBondContact O-N 2.7Å; Q305-Y309 WeakPolarHBondContact O-CB 3.44Å; Q305-Y309 PolarHBondContact O-N 2.75Å
306	N	84.4	Confident	80.6	Confident	46 Å²	46	90.3 Å²	90.3	25%	0.246	41%	0.411	C	S	.	.	H	α-helix	trans	-60.9	-40.1	175	-83.8	-67	0	0	0	112.4	I302 E303 R310	I302-N306 WeakPolarHBondContact CG2-ND2 3.49Å; I302-N306 WeakPolarHBondContact O-CB 3.45Å; I302-N306 PolarHBondContact O-N 3.49Å; I302-N306 PolarHBondContact O-ND2 2.91Å; E303-N306 PolarHBondContact O-N 2.82Å; N306-R310 WeakPolarHBondContact O-CB 3.36Å; N306-R310 WeakPolarHBondContact O-CG 3.34Å; N306-R310 PolarHBondContact O-N 2.69Å
307	H	85.1	Confident	79.1	Confident	108 Å²	108	96.1 Å²	96.1	50%	0.5	43%	0.429	S	S	.	.	H	α-helix	trans	-65.5	-42.6	174.8	-169.3	100.4	0	0	0	112	E303 Q304 Q305 T311	E303-H307 WeakPolarHBondContact O-CB 3.34Å; E303-H307 PolarHBondContact O-N 2.85Å; Q304-H307 PolarHBondContact O-N 3.12Å; Q305-H307 VanDerWaalsContact C-N 3.34Å; Q305-H307 PolarHBondContact O-N 3.24Å; H307-T311 WeakPolarHBondContact O-CB 3.43Å; H307-T311 WeakPolarHBondContact O-CG2 3.35Å; H307-T311 PolarHBondContact O-N 2.75Å; H307-T311 PolarHBondContact O-OG1 2.85Å
308	R	82.4	Confident	77.4	Confident	141 Å²	141	99.3 Å²	99.3	53%	0.532	44%	0.438	S	S	.	.	H	α-helix	trans	-61.5	-47.3	175.1	-69.7	172	-164.9	-176	11.9	111	Q304 Q305 T311 A312	Q304-R308 WeakPolarHBondContact O-CB 3.4Å; Q304-R308 VanDerWaalsContact O-CG 3.27Å; Q304-R308 WeakPolarHBondContact O-CG 3.21Å; Q304-R308 PolarHBondContact O-N 2.95Å; Q305-R308 PolarHBondContact O-N 2.7Å; R308-T311 PolarHBondContact O-N 2.88Å; R308-T311 PolarHBondContact O-OG1 2.9Å; R308-T311 VanDerWaalsContact O-OG1 3.07Å; R308-A312 WeakPolarHBondContact O-CB 2.97Å; R308-A312 PolarHBondContact O-N 3.4Å
309	Y	80.9	Confident	75.8	Confident	62 Å²	62	106.6 Å²	106.6	24%	0.243	48%	0.476	C	S	.	.	H	α-helix	trans	-60.6	-50.1	176.8	-179.1	-106.9	0	0	0	112.5	Q305 T311 A312 N313 Q320 P322	Q305-Y309 WeakPolarHBondContact O-CB 3.44Å; Q305-Y309 PolarHBondContact O-N 2.75Å; Y309-T311 VanDerWaalsContact C-N 3.28Å; Y309-T311 PolarHBondContact O-N 3.36Å; Y309-A312 PolarHBondContact O-N 2.75Å; Y309-N313 PolarHBondContact O-N 3.49Å; Y309-N313 PolarHBondContact OH-ND2 2.9Å; Y309-Q320 HydrophobicContact CD2-CB 4.4Å; Y309-P322 HydrophobicContact CE1-CB 4.45Å; Y309-P322 HydrophobicContact CE2-CB 4.34Å
310	R	80.9	Confident	74.7	Confident	173 Å²	173	108.4 Å²	108.4	65%	0.653	49%	0.485	S	S	*	.	H	α-helix	trans	-59.6	-36.2	176.6	-71.9	171.4	-173.9	174.6	3.6	112.5	N306 R314	N306-R310 WeakPolarHBondContact O-CB 3.36Å; N306-R310 WeakPolarHBondContact O-CG 3.34Å; N306-R310 PolarHBondContact O-N 2.69Å; R310-R314 WeakPolarHBondContact O-CG 3.37Å
311	T	80.3	Confident	73.6	Confident	35 Å²	35	108.9 Å²	108.9	22%	0.215	49%	0.494	C	S	.	.	H	α-helix	trans	-82.4	-22	179.9	54.4	0	0	0	0	114.2	H307 R308 Y309 R802	H307-T311 WeakPolarHBondContact O-CB 3.43Å; H307-T311 WeakPolarHBondContact O-CG2 3.35Å; H307-T311 PolarHBondContact O-N 2.75Å; H307-T311 PolarHBondContact O-OG1 2.85Å; R308-T311 PolarHBondContact O-N 2.88Å; R308-T311 PolarHBondContact O-OG1 2.9Å; R308-T311 VanDerWaalsContact O-OG1 3.07Å; Y309-T311 VanDerWaalsContact C-N 3.28Å; Y309-T311 PolarHBondContact O-N 3.36Å; T311-R802 HydrophobicContact CG2-CG 4.46Å; T311-R802 PolarHBondContact O-NH2 3.08Å; T311-R802 VanDerWaalsContact O-NH2 3.16Å
312	A	73.4	Confident	72.5	Confident	16 Å²	16	109.6 Å²	109.6	13%	0.132	51%	0.505	C	S	.	.	H	α-helix	trans	-78.3	-44.6	173	0	0	0	0	0	113	R308 Y309 R314 R315	R308-A312 WeakPolarHBondContact O-CB 2.97Å; R308-A312 PolarHBondContact O-N 3.4Å; Y309-A312 PolarHBondContact O-N 2.75Å; A312-R314 PolarHBondContact O-N 2.86Å; A312-R315 WeakPolarHBondContact O-CB 3.32Å; A312-R315 PolarHBondContact O-N 3.29Å
313	N	66.5	Low	71.6	Confident	69 Å²	69	110.2 Å²	110.2	37%	0.369	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-26.8	175.4	-89.3	-14.3	0	0	0	112.6	Y309 R315	Y309-N313 PolarHBondContact O-N 3.49Å; Y309-N313 PolarHBondContact OH-ND2 2.9Å; N313-R315 PolarHBondContact O-N 3.47Å; N313-R315 VanDerWaalsContact O-N 3.15Å
314	R	66.5	Low	70.9	Confident	144 Å²	144	108.3 Å²	108.3	54%	0.543	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	21.2	169.9	-74.6	177.6	164.9	-123.5	4.5	114.7	R310 A312 E799 R802	R310-R314 WeakPolarHBondContact O-CG 3.37Å; A312-R314 PolarHBondContact O-N 2.86Å; R314-E799 IonicContact CZ-OE1 3.15Å; R314-E799 VanDerWaalsContact NH1-CD 3.25Å; R314-E799 IonicContact NH1-OE1 2.75Å; R314-E799 PolarHBondContact NH1-OE1 3.34Å; R314-E799 IonicContact NH1-OE2 3.12Å; R314-E799 PolarHBondContact NH1-OE2 3.2Å; R314-E799 IonicContact NH2-OE1 2.68Å; R314-E799 PolarHBondContact NH2-OE1 3.08Å; R314-R802 PolarHBondContact O-NH2 2.81Å
315	R	64.9	Low	69.8	Low	158 Å²	158	108.8 Å²	108.8	60%	0.596	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.8	22	-177.3	-73.6	-178.4	154.3	169.9	-8.3	113	A312 N313 K317	A312-R315 WeakPolarHBondContact O-CB 3.32Å; A312-R315 PolarHBondContact O-N 3.29Å; N313-R315 PolarHBondContact O-N 3.47Å; N313-R315 VanDerWaalsContact O-N 3.15Å; R315-K317 PolarHBondContact O-N 2.84Å
316	D	58.4	Low	69.2	Low	147 Å²	147	111.3 Å²	111.3	79%	0.786	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	10.4	-178.1	-70.1	-65.7	0	0	0	116.9	K318	D316-K318 PolarHBondContact O-N 3.16Å
317	K	59	Low	68.7	Low	161 Å²	161	109.9 Å²	109.9	70%	0.7	53%	0.527	S	S	*	.			trans	-78	65.4	170.1	-74.2	-164.9	169.9	-169.9	0	110.6	R315 N319	R315-K317 PolarHBondContact O-N 2.84Å; K317-N319 PolarHBondContact O-N 2.91Å
318	K	51.8	Low	68.3	Low	181 Å²	181	110.2 Å²	110.2	79%	0.787	53%	0.531	S	S	*	.			trans	-67.5	20.8	-169.9	-140	171.1	-170.8	171.1	0	115.7	D316	D316-K318 PolarHBondContact O-N 3.16Å
319	N	55.8	Low	68	Low	161 Å²	161	105.9 Å²	105.9	86%	0.861	52%	0.518	S	S	*	.			trans	-130.1	25.4	-169.9	-156.7	33.8	0	0	0	113.3	K317	K317-N319 PolarHBondContact O-N 2.91Å
320	Q	63.1	Low	68	Low	106 Å²	106	107.4 Å²	107.4	50%	0.495	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-97.7	131.1	161.3	-75.8	-174.2	-14.5	0	0	108.6	Y309	Y309-Q320 HydrophobicContact CD2-CB 4.4Å
321	Q	64	Low	67.9	Low	178 Å²	178	105 Å²	105	83%	0.832	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-71.1	149	172.7	-68.3	174.2	-10.1	0	0	109.7
322	P	64.6	Low	67.9	Low	86 Å²	86	110.9 Å²	110.9	56%	0.558	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-62.6	150.8	169.9	28.8	-34.9	0	0	0	110.3	Y309 D324	Y309-P322 HydrophobicContact CE1-CB 4.45Å; Y309-P322 HydrophobicContact CE2-CB 4.34Å; P322-D324 PolarHBondContact O-N 3.14Å
323	P	66.1	Low	68.4	Low	45 Å²	45	110.5 Å²	110.5	29%	0.292	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-61.9	135.7	175.5	25.9	-33.3	0	0	0	110.9	P325	P323-P325 WeakPolarHBondContact O-CD 3.38Å
324	D	70.9	Confident	69.2	Low	103 Å²	103	113 Å²	113	55%	0.551	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-68.3	117.6	-177.8	176.3	9.1	0	0	0	111.3	P322 N326 G327	P322-D324 PolarHBondContact O-N 3.14Å; D324-N326 PolarHBondContact O-N 3.04Å; D324-N326 PolarHBondContact OD1-N 3.25Å; D324-G327 PolarHBondContact O-N 3.01Å; D324-G327 VanDerWaalsContact O-N 3.15Å; D324-G327 PolarHBondContact OD2-N 3.35Å
325	P	63.1	Low	70.2	Confident	87 Å²	87	107.9 Å²	107.9	57%	0.565	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-15.7	179.2	29.9	-36.4	0	0	0	113.7	P323 F330	P323-P325 WeakPolarHBondContact O-CD 3.38Å; P325-F330 WeakPolarHBondContact O-CD1 3.42Å; P325-F330 VanDerWaalsContact O-CG 3.25Å; P325-F330 WeakPolarHBondContact O-CG 3.44Å
326	N	71	Confident	71.3	Confident	131 Å²	131	100.9 Å²	100.9	70%	0.701	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	5.3	174.9	-69.7	-26.4	0	0	0	112.8	D324	D324-N326 PolarHBondContact O-N 3.04Å; D324-N326 PolarHBondContact OD1-N 3.25Å
327	G	74.4	Confident	72.8	Confident	15 Å²	15	99.6 Å²	99.6	16%	0.155	50%	0.5	C	S	.	.	S	Bend	trans	-63.1	153.3	-176.4	0	0	0	0	0	112.9	D324 L329 F330 M331	D324-G327 PolarHBondContact O-N 3.01Å; D324-G327 VanDerWaalsContact O-N 3.15Å; D324-G327 PolarHBondContact OD2-N 3.35Å; G327-L329 PolarHBondContact O-N 2.92Å; G327-F330 WeakPolarHBondContact O-CA 3.45Å; G327-F330 WeakPolarHBondContact O-CB 3.49Å; G327-F330 PolarHBondContact O-N 2.78Å; G327-M331 PolarHBondContact O-N 3.27Å; G327-M331 VanDerWaalsContact O-N 3.09Å
328	I	76.1	Confident	74.3	Confident	115 Å²	115	95.4 Å²	95.4	59%	0.59	48%	0.483	S	S	*	.	H	α-helix	trans	-53.3	-31	-178.7	-55.3	173.1	0	0	0	112.1	R332	I328-R332 WeakPolarHBondContact O-CG 3.49Å; I328-R332 PolarHBondContact O-N 2.88Å
329	L	77.3	Confident	76.2	Confident	50 Å²	50	90.7 Å²	90.7	26%	0.262	47%	0.473	S	S	.	.	H	α-helix	trans	-67	-41.5	175.1	-171.5	67.6	0	0	0	112.4	A298 E301 I302 G327 R332 A333	A298-L329 HydrophobicContact CB-CD1 4.03Å; E301-L329 HydrophobicContact CB-CD1 4.14Å; E301-L329 HydrophobicContact CB-CD2 4.08Å; E301-L329 HydrophobicContact CG-CD1 4.13Å; E301-L329 HydrophobicContact CG-CD2 3.74Å; I302-L329 HydrophobicContact CD1-CG 4.21Å; I302-L329 HydrophobicContact CG1-CD2 3.63Å; I302-L329 HydrophobicContact CG1-CG 3.73Å; G327-L329 PolarHBondContact O-N 2.92Å; L329-R332 PolarHBondContact O-N 2.71Å; L329-A333 WeakPolarHBondContact O-CB 2.99Å; L329-A333 PolarHBondContact O-N 2.81Å
330	F	80.3	Confident	77.9	Confident	95 Å²	95	85.9 Å²	85.9	42%	0.417	45%	0.445	S	S	.	.	H	α-helix	trans	-66.4	-39.9	174.8	-171.1	-93.2	0	0	0	111.6	I302 P325 G327 R332 A333	I302-F330 HydrophobicContact CD1-CB 4.32Å; I302-F330 HydrophobicContact CD1-CD2 4.17Å; P325-F330 WeakPolarHBondContact O-CD1 3.42Å; P325-F330 VanDerWaalsContact O-CG 3.25Å; P325-F330 WeakPolarHBondContact O-CG 3.44Å; G327-F330 WeakPolarHBondContact O-CA 3.45Å; G327-F330 WeakPolarHBondContact O-CB 3.49Å; G327-F330 PolarHBondContact O-N 2.78Å; F330-R332 VanDerWaalsContact C-N 3.33Å; F330-R332 PolarHBondContact O-N 3.32Å; F330-A333 WeakPolarHBondContact O-CB 3.49Å; F330-A333 PolarHBondContact O-N 3.44Å; F330-A333 VanDerWaalsContact O-N 3.14Å
331	M	78.8	Confident	79.4	Confident	123 Å²	123	80.8 Å²	80.8	61%	0.606	42%	0.421	S	S	*	.	H	α-helix	trans	-60.3	-42.2	172.6	-61.1	-170.9	76.6	0	0	112	G327 A333 Q334	G327-M331 PolarHBondContact O-N 3.27Å; G327-M331 VanDerWaalsContact O-N 3.09Å; M331-A333 VanDerWaalsContact C-N 3.27Å; M331-A333 PolarHBondContact O-N 2.64Å; M331-Q334 PolarHBondContact O-N 3.23Å
332	R	79.6	Confident	80.8	Confident	157 Å²	157	73.8 Å²	73.8	59%	0.592	39%	0.39	S	S	*	.	H	α-helix	trans	-68.5	-23.4	175.5	-77.3	-179.5	174.8	132.8	3.1	113.9	A295 A298 I328 L329 F330 Q334	A295-R332 VanDerWaalsContact CA-O 3.27Å; A295-R332 WeakPolarHBondContact CA-O 3.26Å; A298-R332 HydrophobicContact CB-CB 3.91Å; I328-R332 WeakPolarHBondContact O-CG 3.49Å; I328-R332 PolarHBondContact O-N 2.88Å; L329-R332 PolarHBondContact O-N 2.71Å; F330-R332 VanDerWaalsContact C-N 3.33Å; F330-R332 PolarHBondContact O-N 3.32Å; R332-Q334 VanDerWaalsContact C-N 3.29Å
333	A	83.8	Confident	82.2	Confident	9 Å²	9	72 Å²	72	7%	0.074	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-3.1	178.6	0	0	0	0	0	114	A298 Q299 I302 L329 F330 M331	A298-A333 HydrophobicContact CB-CB 3.88Å; Q299-A333 HydrophobicContact CG-CB 3.7Å; Q299-A333 PolarHBondContact NE2-O 3.14Å; I302-A333 HydrophobicContact CD1-CB 3.35Å; L329-A333 WeakPolarHBondContact O-CB 2.99Å; L329-A333 PolarHBondContact O-N 2.81Å; F330-A333 WeakPolarHBondContact O-CB 3.49Å; F330-A333 PolarHBondContact O-N 3.44Å; F330-A333 VanDerWaalsContact O-N 3.14Å; M331-A333 VanDerWaalsContact C-N 3.27Å; M331-A333 PolarHBondContact O-N 2.64Å
334	Q	84.6	Confident	83.6	Confident	121 Å²	121	70.2 Å²	70.2	57%	0.565	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-76.7	133	174.8	-63.3	-177.1	-0.1	0	0	110.5	M331 R332	M331-Q334 PolarHBondContact O-N 3.23Å; R332-Q334 VanDerWaalsContact C-N 3.29Å
335	L	87.1	Confident	84.8	Confident	37 Å²	37	65.3 Å²	65.3	19%	0.194	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-73.8	160.5	170.1	-84.8	176.4	0	0	0	111.3	I292 A295 F341 W387	I292-L335 HydrophobicContact CG1-CD2 4.13Å; A295-L335 HydrophobicContact CB-CD2 4.16Å; L335-F341 HydrophobicContact CD2-CZ 4.44Å; L335-W387 HydrophobicContact CD1-CD2 4.47Å; L335-W387 HydrophobicContact CD1-CE3 3.94Å; L335-W387 HydrophobicContact CD1-CH2 3.55Å; L335-W387 HydrophobicContact CD1-CZ2 4.11Å; L335-W387 HydrophobicContact CD1-CZ3 3.45Å; L335-W387 VanDerWaalsContact CD1-CZ3 3.45Å; L335-W387 HydrophobicContact CD2-CH2 3.68Å; L335-W387 HydrophobicContact CD2-CZ2 3.93Å; L335-W387 HydrophobicContact CD2-CZ3 4.43Å; L335-W387 HydrophobicContact CG-CH2 3.63Å; L335-W387 HydrophobicContact CG-CZ2 4.32Å; L335-W387 HydrophobicContact CG-CZ3 3.93Å
336	P	88.4	Confident	86.4	Confident	11 Å²	11	64 Å²	64	7%	0.071	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-55.2	155.3	166.4	-22.5	34.2	0	0	0	112.5	F288 I292 E340 F341	F288-P336 HydrophobicContact CD2-CB 4.47Å; F288-P336 HydrophobicContact CD2-CG 4.3Å; F288-P336 HydrophobicContact CE2-CB 3.45Å; F288-P336 VanDerWaalsContact CE2-CB 3.45Å; F288-P336 HydrophobicContact CE2-CG 3.6Å; F288-P336 HydrophobicContact CZ-CB 3.69Å; F288-P336 HydrophobicContact CZ-CG 3.74Å; I292-P336 HydrophobicContact CG1-CG 4.32Å; P336-E340 WeakPolarHBondContact CA-OE2 3.43Å; P336-E340 HydrophobicContact CB-CB 4.11Å; P336-E340 WeakPolarHBondContact CB-OE2 3.41Å; P336-F341 HydrophobicContact CB-CD2 4.31Å; P336-F341 HydrophobicContact CB-CE2 4.06Å; P336-F341 HydrophobicContact CG-CE2 4.41Å; P336-F341 WeakPolarHBondContact O-CE2 3.28Å
337	L	89.6	Confident	87.5	Confident	119 Å²	119	58 Å²	58	62%	0.623	29%	0.291	S	S	*	.	P	Polyproline II helix	trans	-70.9	153.8	176.4	-63.9	172.4	0	0	0	111.1	S339 E340 F341	L337-S339 PolarHBondContact O-N 3.49Å; L337-S339 VanDerWaalsContact O-N 3.13Å; L337-E340 HydrophobicContact CB-CG 4.29Å; L337-E340 PolarHBondContact N-OE2 3.32Å; L337-E340 WeakPolarHBondContact O-CA 3.37Å; L337-E340 WeakPolarHBondContact O-CB 3.13Å; L337-E340 PolarHBondContact O-N 2.99Å; L337-F341 PolarHBondContact O-N 3.33Å; L337-F341 VanDerWaalsContact O-N 3.14Å
338	E	90.5	Very high	88.6	Confident	74 Å²	74	57.3 Å²	57.3	35%	0.346	28%	0.284	S	S	.	.	H	α-helix	trans	-53.6	-35	177.1	176.8	170.3	-178.6	0	0	113	E340 F341 V342 L389 R391 V393	E338-E340 VanDerWaalsContact C-N 3.27Å; E338-E340 PolarHBondContact O-N 3.5Å; E338-F341 PolarHBondContact O-N 3Å; E338-V342 WeakPolarHBondContact O-CG2 3.33Å; E338-V342 PolarHBondContact O-N 3.27Å; E338-L389 HydrophobicContact CB-CD1 4.06Å; E338-L389 HydrophobicContact CB-CD2 4.18Å; E338-L389 HydrophobicContact CG-CD1 4.11Å; E338-R391 IonicContact OE1-CZ 3.7Å; E338-R391 IonicContact OE1-NE 2.9Å; E338-R391 IonicContact OE1-NH2 2.94Å; E338-R391 PolarHBondContact OE1-NH2 3.18Å; E338-R391 IonicContact OE2-CZ 2.64Å; E338-R391 IonicContact OE2-NH1 2.9Å; E338-R391 IonicContact OE2-NH2 2.71Å; E338-R391 PolarHBondContact OE2-NH2 2.95Å; E338-V393 HydrophobicContact CG-CG1 4.3Å
339	S	90.8	Very high	89.6	Confident	82 Å²	82	51.9 Å²	51.9	57%	0.573	26%	0.256	S	S	*	.	H	α-helix	trans	-62.3	-31.8	174.1	50.9	0	0	0	0	113.6	L337 D343	L337-S339 PolarHBondContact O-N 3.49Å; L337-S339 VanDerWaalsContact O-N 3.13Å; S339-D343 PolarHBondContact O-N 3.14Å
340	E	91.9	Very high	90.5	Very high	59 Å²	59	50.1 Å²	50.1	28%	0.276	25%	0.247	S	C	.	.	H	α-helix	trans	-79.1	-38.7	177.1	-53.5	180	76.5	0	0	111.2	F288 R291 P336 L337 E338 V342 D343 I344	F288-E340 HydrophobicContact CE2-CB 3.74Å; F288-E340 HydrophobicContact CZ-CB 4.48Å; R291-E340 IonicContact CZ-OE1 3.53Å; R291-E340 IonicContact NH1-OE1 3.14Å; R291-E340 PolarHBondContact NH1-OE1 3.04Å; R291-E340 IonicContact NH1-OE2 2.88Å; R291-E340 IonicContact NH2-OE1 2.68Å; R291-E340 PolarHBondContact NH2-OE1 3.27Å; P336-E340 WeakPolarHBondContact CA-OE2 3.43Å; P336-E340 HydrophobicContact CB-CB 4.11Å; P336-E340 WeakPolarHBondContact CB-OE2 3.41Å; L337-E340 HydrophobicContact CB-CG 4.29Å; L337-E340 PolarHBondContact N-OE2 3.32Å; L337-E340 WeakPolarHBondContact O-CA 3.37Å; L337-E340 WeakPolarHBondContact O-CB 3.13Å; L337-E340 PolarHBondContact O-N 2.99Å; E338-E340 VanDerWaalsContact C-N 3.27Å; E338-E340 PolarHBondContact O-N 3.5Å; E340-V342 VanDerWaalsContact C-N 3.29Å; E340-V342 PolarHBondContact O-N 3Å; E340-D343 PolarHBondContact O-N 3Å; E340-I344 PolarHBondContact O-N 3.2Å
341	F	94	Very high	91.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58.4	-42.1	168.4	-81.3	-81.5	0	0	0	111.4	F288 I292 L335 P336 L337 E338 I344 L345 I381 A384 C385 L389 V393	F288-F341 AromaticContact CE1-CD1 3.74Å; F288-F341 HydrophobicContact CE1-CD1 3.74Å; F288-F341 AromaticContact CE1-CE1 3.81Å; F288-F341 HydrophobicContact CE1-CE1 3.81Å; F288-F341 HydrophobicContact CE1-CG 4.29Å; F288-F341 HydrophobicContact CE1-CZ 4.4Å; F288-F341 HydrophobicContact CZ-CB 4.41Å; F288-F341 AromaticContact CZ-CD1 3.71Å; F288-F341 HydrophobicContact CZ-CD1 3.71Å; F288-F341 HydrophobicContact CZ-CD2 4.06Å; F288-F341 AromaticContact CZ-CE1 3.95Å; F288-F341 HydrophobicContact CZ-CE1 3.95Å; F288-F341 HydrophobicContact CZ-CE2 4.27Å; F288-F341 AromaticContact CZ-CG 3.78Å; F288-F341 HydrophobicContact CZ-CG 3.78Å; F288-F341 HydrophobicContact CZ-CZ 4.23Å; I292-F341 HydrophobicContact CD1-CE1 3.82Å; I292-F341 HydrophobicContact CD1-CZ 4.09Å; I292-F341 HydrophobicContact CG1-CZ 4.4Å; L335-F341 HydrophobicContact CD2-CZ 4.44Å; P336-F341 HydrophobicContact CB-CD2 4.31Å; P336-F341 HydrophobicContact CB-CE2 4.06Å; P336-F341 HydrophobicContact CG-CE2 4.41Å; P336-F341 WeakPolarHBondContact O-CE2 3.28Å; L337-F341 PolarHBondContact O-N 3.33Å; L337-F341 VanDerWaalsContact O-N 3.14Å; E338-F341 PolarHBondContact O-N 3Å; F341-I344 WeakPolarHBondContact O-CG2 3.32Å; F341-L345 WeakPolarHBondContact O-CB 3.28Å; F341-L345 WeakPolarHBondContact O-CD1 3.42Å; F341-L345 WeakPolarHBondContact O-CG 3.41Å; F341-L345 PolarHBondContact O-N 2.97Å; F341-L345 VanDerWaalsContact O-N 3.17Å; F341-I381 HydrophobicContact CD1-CG2 4.02Å; F341-I381 HydrophobicContact CE1-CG2 4.28Å; F341-A384 HydrophobicContact CE1-CB 3.91Å; F341-A384 HydrophobicContact CZ-CB 3.99Å; F341-C385 WeakPolarHBondContact CD1-SG 3.21Å; F341-L389 HydrophobicContact CB-CD1 4.41Å; F341-L389 HydrophobicContact CD2-CD1 3.93Å; F341-L389 HydrophobicContact CE2-CD1 4.42Å; F341-L389 HydrophobicContact CG-CD1 4.21Å; F341-V393 HydrophobicContact CB-CG2 4.19Å
342	V	93.7	Very high	92.1	Very high	31 Å²	31	39.9 Å²	39.9	19%	0.188	20%	0.198	C	C	.	.	H	α-helix	trans	-63.9	-47.9	174.3	166.4	0	0	0	0	111.2	E338 E340 L345 K346 V397	E338-V342 WeakPolarHBondContact O-CG2 3.33Å; E338-V342 PolarHBondContact O-N 3.27Å; E340-V342 VanDerWaalsContact C-N 3.29Å; E340-V342 PolarHBondContact O-N 3Å; V342-L345 PolarHBondContact O-N 2.82Å; V342-K346 WeakPolarHBondContact O-CG 3.35Å; V342-K346 PolarHBondContact O-N 3.44Å; V342-K346 VanDerWaalsContact O-N 3.11Å; V342-V397 HydrophobicContact CG1-CG2 4.45Å; V342-V397 HydrophobicContact CG2-CG2 4.45Å
343	D	93.6	Very high	92.9	Very high	49 Å²	49	33.9 Å²	33.9	26%	0.262	18%	0.178	S	C	.	.	H	α-helix	trans	-63.8	-42.7	179.9	-175.2	60.5	0	0	0	113	S339 E340 L345 K346 K347 Y444	S339-D343 PolarHBondContact O-N 3.14Å; E340-D343 PolarHBondContact O-N 3Å; D343-L345 VanDerWaalsContact C-N 3.28Å; D343-L345 PolarHBondContact O-N 2.97Å; D343-K346 WeakPolarHBondContact O-CA 3.36Å; D343-K346 WeakPolarHBondContact O-CB 3.31Å; D343-K346 PolarHBondContact O-N 3.3Å; D343-K347 PolarHBondContact O-N 2.86Å; D343-K347 VanDerWaalsContact OD2-CE 3.23Å; D343-K347 WeakPolarHBondContact OD2-CE 3.37Å; D343-K347 IonicContact OD2-NZ 3.35Å; D343-K347 PolarHBondContact OD2-NZ 2.9Å; D343-Y444 PolarHBondContact OD1-OH 3.14Å
344	I	96.1	Very high	93.4	Very high	6 Å²	6	33.8 Å²	33.8	3%	0.031	18%	0.176	C	C	.	.	H	α-helix	trans	-64.9	-36	179.3	-152	65.1	0	0	0	111.6	D284 I285 F288 E340 F341 K346 K347 F348 I381	D284-I344 HydrophobicContact CB-CD1 4Å; I285-I344 HydrophobicContact CG1-CD1 3.85Å; I285-I344 HydrophobicContact CG1-CG1 3.93Å; F288-I344 HydrophobicContact CB-CD1 4.07Å; F288-I344 HydrophobicContact CB-CG1 3.93Å; F288-I344 HydrophobicContact CD1-CB 4.23Å; F288-I344 HydrophobicContact CD1-CG1 4.13Å; F288-I344 HydrophobicContact CD1-CG2 3.73Å; F288-I344 HydrophobicContact CD2-CB 4.38Å; F288-I344 HydrophobicContact CE1-CB 4.45Å; F288-I344 HydrophobicContact CE1-CG2 3.64Å; F288-I344 HydrophobicContact CE2-CG2 4.49Å; F288-I344 HydrophobicContact CG-CB 4.18Å; F288-I344 HydrophobicContact CG-CD1 4.44Å; F288-I344 HydrophobicContact CG-CG1 3.95Å; F288-I344 HydrophobicContact CG-CG2 4.18Å; F288-I344 HydrophobicContact CZ-CG2 4.06Å; E340-I344 PolarHBondContact O-N 3.2Å; F341-I344 WeakPolarHBondContact O-CG2 3.32Å; I344-K346 VanDerWaalsContact C-N 3.3Å; I344-K346 PolarHBondContact O-N 3.23Å; I344-K347 HydrophobicContact CD1-CB 4.42Å; I344-K347 HydrophobicContact CD1-CD 4.06Å; I344-K347 CarbonylContact O-C 3.59Å; I344-K347 WeakPolarHBondContact O-CA 3.31Å; I344-K347 WeakPolarHBondContact O-CB 3.46Å; I344-K347 PolarHBondContact O-N 3.04Å; I344-K347 VanDerWaalsContact O-N 3.07Å; I344-F348 HydrophobicContact CG1-CE2 4.42Å; I344-F348 VanDerWaalsContact O-CD2 3.28Å; I344-F348 WeakPolarHBondContact O-CD2 3.27Å; I344-F348 PolarHBondContact O-N 3.36Å; I344-I381 HydrophobicContact CG2-CD1 4.26Å; I344-I381 HydrophobicContact CG2-CG2 4.19Å
345	L	96.3	Very high	93.9	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.9	-31.2	173.6	-73.7	168.8	0	0	0	112.1	F341 V342 D343 F348 K349 L378 V393 A394 V397 W429	F341-L345 WeakPolarHBondContact O-CB 3.28Å; F341-L345 WeakPolarHBondContact O-CD1 3.42Å; F341-L345 WeakPolarHBondContact O-CG 3.41Å; F341-L345 PolarHBondContact O-N 2.97Å; F341-L345 VanDerWaalsContact O-N 3.17Å; V342-L345 PolarHBondContact O-N 2.82Å; D343-L345 VanDerWaalsContact C-N 3.28Å; D343-L345 PolarHBondContact O-N 2.97Å; L345-F348 HydrophobicContact CD2-CD2 4.49Å; L345-F348 PolarHBondContact O-N 3.43Å; L345-K349 WeakPolarHBondContact O-CG 3.42Å; L345-K349 PolarHBondContact O-N 2.63Å; L345-K349 VanDerWaalsContact O-N 3.16Å; L345-L378 HydrophobicContact CD2-CD1 3.72Å; L345-V393 HydrophobicContact CD1-CG2 3.85Å; L345-A394 HydrophobicContact CD1-CB 4.07Å; L345-A394 HydrophobicContact CD2-CB 4.46Å; L345-V397 HydrophobicContact CB-CG1 4.22Å; L345-V397 HydrophobicContact CB-CG2 3.98Å; L345-V397 HydrophobicContact CD1-CG2 4.16Å; L345-W429 HydrophobicContact CB-CH2 4.15Å; L345-W429 HydrophobicContact CB-CZ2 4.04Å; L345-W429 HydrophobicContact CD2-CH2 3.86Å; L345-W429 HydrophobicContact CD2-CZ2 4.04Å; L345-W429 WeakPolarHBondContact O-CH2 3.49Å
346	K	95.6	Very high	94.1	Very high	60 Å²	60	26.4 Å²	26.4	26%	0.261	14%	0.142	S	C	.	.	H	α-helix	trans	-66.7	-37.4	169	-59.3	-178	-173.7	161.8	0	112	V342 D343 I344 K349 L350 V397 S399 Y444	V342-K346 WeakPolarHBondContact O-CG 3.35Å; V342-K346 PolarHBondContact O-N 3.44Å; V342-K346 VanDerWaalsContact O-N 3.11Å; D343-K346 WeakPolarHBondContact O-CA 3.36Å; D343-K346 WeakPolarHBondContact O-CB 3.31Å; D343-K346 PolarHBondContact O-N 3.3Å; I344-K346 VanDerWaalsContact C-N 3.3Å; I344-K346 PolarHBondContact O-N 3.23Å; K346-K349 PolarHBondContact O-N 3.03Å; K346-L350 WeakPolarHBondContact O-CB 3.1Å; K346-L350 PolarHBondContact O-N 3.31Å; K346-V397 HydrophobicContact CG-CG1 3.6Å; K346-S399 WeakPolarHBondContact CD-O 3.49Å; K346-S399 VanDerWaalsContact CG-O 3.23Å; K346-S399 WeakPolarHBondContact CG-O 3.33Å; K346-Y444 HydrophobicContact CB-CD1 4.28Å; K346-Y444 HydrophobicContact CB-CD2 4.29Å; K346-Y444 HydrophobicContact CB-CE1 3.74Å; K346-Y444 HydrophobicContact CB-CE2 3.77Å; K346-Y444 VanDerWaalsContact CB-CZ 3.46Å; K346-Y444 HydrophobicContact CD-CD2 3.73Å; K346-Y444 HydrophobicContact CD-CE2 3.45Å; K346-Y444 VanDerWaalsContact CD-CE2 3.45Å; K346-Y444 HydrophobicContact CG-CE2 4.25Å
347	K	96.1	Very high	94.2	Very high	6 Å²	6	30.1 Å²	30.1	3%	0.026	16%	0.157	C	C	.	.	H	α-helix	trans	-64.7	-38.5	174.8	-71	168.1	175.2	162	0	111.6	C281 D284 D343 I344 L350 S351 Y444 I447 F448	C281-K347 HydrophobicContact CB-CB 4.47Å; D284-K347 HydrophobicContact CB-CD 4.12Å; D284-K347 WeakPolarHBondContact OD2-CE 3.36Å; D284-K347 IonicContact OD2-NZ 2.71Å; D284-K347 PolarHBondContact OD2-NZ 3.3Å; D343-K347 PolarHBondContact O-N 2.86Å; D343-K347 VanDerWaalsContact OD2-CE 3.23Å; D343-K347 WeakPolarHBondContact OD2-CE 3.37Å; D343-K347 IonicContact OD2-NZ 3.35Å; D343-K347 PolarHBondContact OD2-NZ 2.9Å; I344-K347 HydrophobicContact CD1-CB 4.42Å; I344-K347 HydrophobicContact CD1-CD 4.06Å; I344-K347 CarbonylContact O-C 3.59Å; I344-K347 WeakPolarHBondContact O-CA 3.31Å; I344-K347 WeakPolarHBondContact O-CB 3.46Å; I344-K347 PolarHBondContact O-N 3.04Å; I344-K347 VanDerWaalsContact O-N 3.07Å; K347-L350 PolarHBondContact O-N 3.37Å; K347-S351 PolarHBondContact O-N 2.87Å; K347-S351 PolarHBondContact O-OG 2.74Å; K347-Y444 WeakPolarHBondContact CG-OH 3.39Å; K347-I447 WeakPolarHBondContact CE-O 3.46Å; K347-I447 PolarHBondContact NZ-O 2.82Å; K347-F448 HydrophobicContact CD-CD1 4.3Å; K347-F448 HydrophobicContact CD-CE1 4.15Å; K347-F448 HydrophobicContact CG-CE1 4.3Å
348	F	97.4	Very high	94.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-57.8	-49.1	168.1	-83.6	-80.7	0	0	0	112.9	I285 I344 L345 L350 S351 F352 L374 P377 L378 I381 W429	I285-F348 HydrophobicContact CB-CZ 4.39Å; I285-F348 HydrophobicContact CD1-CD1 4.03Å; I285-F348 HydrophobicContact CD1-CD2 4.03Å; I285-F348 HydrophobicContact CD1-CE1 3.91Å; I285-F348 HydrophobicContact CD1-CE2 3.91Å; I285-F348 HydrophobicContact CD1-CG 4.08Å; I285-F348 HydrophobicContact CD1-CZ 3.86Å; I285-F348 HydrophobicContact CG1-CD2 4.22Å; I285-F348 HydrophobicContact CG1-CE2 3.79Å; I285-F348 HydrophobicContact CG1-CZ 3.98Å; I285-F348 HydrophobicContact CG2-CE1 4.2Å; I285-F348 HydrophobicContact CG2-CE2 4Å; I285-F348 HydrophobicContact CG2-CZ 3.48Å; I285-F348 VanDerWaalsContact CG2-CZ 3.48Å; I344-F348 HydrophobicContact CG1-CE2 4.42Å; I344-F348 VanDerWaalsContact O-CD2 3.28Å; I344-F348 WeakPolarHBondContact O-CD2 3.27Å; I344-F348 PolarHBondContact O-N 3.36Å; L345-F348 HydrophobicContact CD2-CD2 4.49Å; L345-F348 PolarHBondContact O-N 3.43Å; F348-L350 VanDerWaalsContact C-N 3.28Å; F348-L350 PolarHBondContact O-N 3Å; F348-S351 PolarHBondContact O-N 2.77Å; F348-F352 HydrophobicContact CD1-CZ 4.29Å; F348-F352 WeakPolarHBondContact O-CD2 3.26Å; F348-F352 WeakPolarHBondContact O-CG 3.27Å; F348-F352 PolarHBondContact O-N 3.37Å; F348-L374 HydrophobicContact CD1-CB 4.35Å; F348-L374 HydrophobicContact CD1-CD2 3.89Å; F348-L374 HydrophobicContact CE1-CB 4.15Å; F348-L374 HydrophobicContact CE1-CD2 3.66Å; F348-L374 WeakPolarHBondContact CE1-O 3.35Å; F348-P377 HydrophobicContact CE1-CG 4.3Å; F348-P377 HydrophobicContact CZ-CB 4.27Å; F348-P377 HydrophobicContact CZ-CG 4.21Å; F348-L378 HydrophobicContact CD1-CB 4.23Å; F348-L378 HydrophobicContact CD1-CD1 4.32Å; F348-L378 HydrophobicContact CD2-CD1 4.23Å; F348-L378 HydrophobicContact CE1-CB 3.76Å; F348-L378 HydrophobicContact CE1-CD1 4.46Å; F348-L378 HydrophobicContact CE2-CD1 4.38Å; F348-L378 HydrophobicContact CG-CD1 4.21Å; F348-L378 HydrophobicContact CZ-CB 4.02Å; F348-L378 HydrophobicContact CZ-CD1 4.48Å; F348-I381 HydrophobicContact CE2-CD1 3.53Å; F348-I381 HydrophobicContact CZ-CD1 3.93Å; F348-W429 HydrophobicContact CB-CH2 4.21Å; F348-W429 HydrophobicContact CB-CZ3 4.28Å
349	K	95.8	Very high	94.1	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-61.8	-38	178.7	-64.3	-175.8	91.5	-168.7	0	112.3	L345 K346 N353 V397 A398 P400 L402 A428 W429	L345-K349 WeakPolarHBondContact O-CG 3.42Å; L345-K349 PolarHBondContact O-N 2.63Å; L345-K349 VanDerWaalsContact O-N 3.16Å; K346-K349 PolarHBondContact O-N 3.03Å; K349-N353 PolarHBondContact O-N 3.2Å; K349-V397 HydrophobicContact CD-CG1 4.11Å; K349-V397 PolarHBondContact NZ-O 2.86Å; K349-A398 PolarHBondContact NZ-O 3.42Å; K349-P400 HydrophobicContact CB-CG 3.75Å; K349-P400 WeakPolarHBondContact CD-O 3.49Å; K349-P400 WeakPolarHBondContact CE-O 3.37Å; K349-P400 PolarHBondContact NZ-O 2.82Å; K349-L402 HydrophobicContact CB-CD2 3.61Å; K349-L402 HydrophobicContact CG-CD2 3.92Å; K349-L402 WeakPolarHBondContact O-CD2 3.33Å; K349-A428 WeakPolarHBondContact CE-O 3.49Å; K349-A428 PolarHBondContact NZ-O 3.13Å; K349-W429 HydrophobicContact CD-CD2 3.9Å; K349-W429 HydrophobicContact CD-CE3 4.04Å; K349-W429 HydrophobicContact CD-CH2 3.97Å; K349-W429 HydrophobicContact CD-CZ2 3.79Å; K349-W429 HydrophobicContact CD-CZ3 4.09Å; K349-W429 HydrophobicContact CG-CD2 3.96Å; K349-W429 HydrophobicContact CG-CE3 3.56Å; K349-W429 HydrophobicContact CG-CH2 3.42Å; K349-W429 VanDerWaalsContact CG-CH2 3.42Å; K349-W429 HydrophobicContact CG-CZ2 3.8Å; K349-W429 HydrophobicContact CG-CZ3 3.28Å
350	L	95.7	Very high	93.9	Very high	14 Å²	14	26.3 Å²	26.3	7%	0.073	13%	0.129	C	C	.	.	H	α-helix	trans	-64.6	-47.1	172.9	-179.1	59.9	0	0	0	111.4	T277 K346 K347 F348 F352 N353 L354 P400 Y444 P446	T277-L350 HydrophobicContact CG2-CD2 3.93Å; K346-L350 WeakPolarHBondContact O-CB 3.1Å; K346-L350 PolarHBondContact O-N 3.31Å; K347-L350 PolarHBondContact O-N 3.37Å; F348-L350 VanDerWaalsContact C-N 3.28Å; F348-L350 PolarHBondContact O-N 3Å; L350-F352 VanDerWaalsContact C-N 3.34Å; L350-F352 PolarHBondContact O-N 2.88Å; L350-N353 PolarHBondContact O-N 3.31Å; L350-L354 HydrophobicContact CD1-CD1 3.97Å; L350-L354 HydrophobicContact CD1-CG 4.02Å; L350-L354 HydrophobicContact CD2-CD1 4.44Å; L350-L354 HydrophobicContact CG-CD1 3.77Å; L350-L354 HydrophobicContact CG-CG 4.25Å; L350-L354 VanDerWaalsContact O-CG 3.31Å; L350-L354 WeakPolarHBondContact O-CG 3.45Å; L350-L354 PolarHBondContact O-N 2.94Å; L350-P400 HydrophobicContact CB-CG 4.4Å; L350-Y444 HydrophobicContact CB-CD1 4.41Å; L350-Y444 HydrophobicContact CB-CE1 4.3Å; L350-Y444 HydrophobicContact CD2-CD1 4.27Å; L350-Y444 HydrophobicContact CD2-CE1 4.02Å; L350-P446 HydrophobicContact CD2-CB 4.09Å; L350-P446 HydrophobicContact CD2-CG 3.63Å
351	S	96.9	Very high	93.2	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-57.3	-43.4	176	-65.6	0	0	0	0	112.5	C281 K347 F348 N353 L354 L355	C281-S351 WeakPolarHBondContact CB-OG 3.23Å; K347-S351 PolarHBondContact O-N 2.87Å; K347-S351 PolarHBondContact O-OG 2.74Å; F348-S351 PolarHBondContact O-N 2.77Å; S351-N353 PolarHBondContact O-N 3.48Å; S351-L354 PolarHBondContact O-N 3.43Å; S351-L355 WeakPolarHBondContact O-CB 3.34Å; S351-L355 VanDerWaalsContact O-CG 3.27Å; S351-L355 WeakPolarHBondContact O-CG 3.25Å; S351-L355 PolarHBondContact O-N 3.36Å
352	F	96.6	Very high	92.7	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.009	15%	0.145	C	C	.	.	H	α-helix	trans	-62.2	-41	177.5	-62.2	-30.5	0	0	0	112.3	F348 L350 A356 L371 L374 F375 L378 L402 M410 W429	F348-F352 HydrophobicContact CD1-CZ 4.29Å; F348-F352 WeakPolarHBondContact O-CD2 3.26Å; F348-F352 WeakPolarHBondContact O-CG 3.27Å; F348-F352 PolarHBondContact O-N 3.37Å; L350-F352 VanDerWaalsContact C-N 3.34Å; L350-F352 PolarHBondContact O-N 2.88Å; F352-A356 WeakPolarHBondContact O-CB 3.45Å; F352-A356 PolarHBondContact O-N 2.92Å; F352-L371 HydrophobicContact CD1-CD1 3.5Å; F352-L371 VanDerWaalsContact CD1-CD1 3.5Å; F352-L371 HydrophobicContact CE1-CD1 3.59Å; F352-L371 HydrophobicContact CG-CD1 4.44Å; F352-L374 HydrophobicContact CD1-CD1 3.77Å; F352-L374 HydrophobicContact CE1-CB 3.82Å; F352-L374 HydrophobicContact CE1-CD1 3.62Å; F352-L374 HydrophobicContact CE1-CG 4.36Å; F352-F375 HydrophobicContact CE1-CE2 4.02Å; F352-F375 HydrophobicContact CZ-CD2 4.41Å; F352-F375 AromaticContact CZ-CE2 3.75Å; F352-F375 HydrophobicContact CZ-CE2 3.75Å; F352-F375 HydrophobicContact CZ-CZ 4.17Å; F352-L378 HydrophobicContact CZ-CD2 4.19Å; F352-L402 HydrophobicContact CB-CD2 4.28Å; F352-L402 HydrophobicContact CD2-CD1 4.35Å; F352-L402 HydrophobicContact CD2-CD2 4.37Å; F352-M410 HydrophobicContact CD2-SD 4.21Å; F352-M410 HydrophobicContact CE2-SD 4.46Å; F352-M410 HydrophobicContact CG-SD 4.46Å; F352-W429 HydrophobicContact CD2-CZ3 4.41Å; F352-W429 HydrophobicContact CE2-CE3 4.38Å; F352-W429 AromaticContact CE2-CZ3 3.98Å; F352-W429 HydrophobicContact CE2-CZ3 3.98Å
353	N	95.4	Very high	91.9	Very high	31 Å²	31	34.2 Å²	34.2	17%	0.166	16%	0.164	C	C	.	.	H	α-helix	trans	-66.5	-42.2	174.6	-70.7	-7.9	0	0	0	112.4	K349 L350 S351 A356 K357 L401 L402 S403	K349-N353 PolarHBondContact O-N 3.2Å; L350-N353 PolarHBondContact O-N 3.31Å; S351-N353 PolarHBondContact O-N 3.48Å; N353-A356 PolarHBondContact O-N 3.37Å; N353-K357 PolarHBondContact O-N 3.44Å; N353-L401 PolarHBondContact ND2-O 3.22Å; N353-L402 VanDerWaalsContact OD1-CA 3.25Å; N353-L402 WeakPolarHBondContact OD1-CA 3.18Å; N353-S403 PolarHBondContact OD1-N 3.41Å
354	L	94.5	Very high	91.1	Very high	8 Å²	8	41 Å²	41	4%	0.042	19%	0.194	C	C	.	.	H	α-helix	trans	-66.9	-44.3	178.5	-68	173.2	0	0	0	111.3	D274 T277 L278 L350 S351 A356 K357 L358	D274-L354 HydrophobicContact CB-CD2 3.81Å; T277-L354 HydrophobicContact CG2-CD1 3.73Å; L278-L354 HydrophobicContact CB-CB 4.3Å; L278-L354 HydrophobicContact CB-CD1 4.08Å; L278-L354 HydrophobicContact CD1-CB 4.32Å; L350-L354 HydrophobicContact CD1-CD1 3.97Å; L350-L354 HydrophobicContact CD1-CG 4.02Å; L350-L354 HydrophobicContact CD2-CD1 4.44Å; L350-L354 HydrophobicContact CG-CD1 3.77Å; L350-L354 HydrophobicContact CG-CG 4.25Å; L350-L354 VanDerWaalsContact O-CG 3.31Å; L350-L354 WeakPolarHBondContact O-CG 3.45Å; L350-L354 PolarHBondContact O-N 2.94Å; S351-L354 PolarHBondContact O-N 3.43Å; L354-A356 VanDerWaalsContact C-N 3.3Å; L354-A356 PolarHBondContact O-N 3.26Å; L354-K357 PolarHBondContact O-N 3.33Å; L354-L358 HydrophobicContact CB-CD1 4.42Å; L354-L358 WeakPolarHBondContact O-CB 3.22Å; L354-L358 WeakPolarHBondContact O-CG 3.45Å; L354-L358 PolarHBondContact O-N 3.43Å
355	L	94.8	Very high	90.5	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-57.5	-42.5	172.9	-73.9	173.8	0	0	0	111.6	L278 S351 K357 L358 K359 I362 A367 L370 L374 L409	L278-L355 HydrophobicContact CD1-CD2 4.34Å; L278-L355 HydrophobicContact CD1-CG 4.12Å; L278-L355 HydrophobicContact CD2-CD2 3.7Å; L278-L355 HydrophobicContact CD2-CG 4.24Å; S351-L355 WeakPolarHBondContact O-CB 3.34Å; S351-L355 VanDerWaalsContact O-CG 3.27Å; S351-L355 WeakPolarHBondContact O-CG 3.25Å; S351-L355 PolarHBondContact O-N 3.36Å; L355-K357 PolarHBondContact O-N 3.38Å; L355-L358 PolarHBondContact O-N 3.32Å; L355-K359 WeakPolarHBondContact O-CA 3.3Å; L355-K359 WeakPolarHBondContact O-CB 3.39Å; L355-K359 PolarHBondContact O-N 3.08Å; L355-I362 HydrophobicContact CD2-CD1 3.64Å; L355-A367 HydrophobicContact CD2-CB 4.42Å; L355-L370 HydrophobicContact CD1-CB 4.14Å; L355-L370 HydrophobicContact CD2-CB 3.62Å; L355-L370 HydrophobicContact CD2-CD1 3.75Å; L355-L370 HydrophobicContact CD2-CG 4.33Å; L355-L374 HydrophobicContact CD1-CD1 3.59Å; L355-L409 HydrophobicContact CB-CD2 4.39Å
356	A	92.8	Very high	90.2	Very high	3 Å²	3	45.6 Å²	45.6	3%	0.025	22%	0.222	C	C	.	.	H	α-helix	trans	-66.8	-34.5	178.6	0	0	0	0	0	113.8	F352 N353 L354 K359 E405 A406 L409	F352-A356 WeakPolarHBondContact O-CB 3.45Å; F352-A356 PolarHBondContact O-N 2.92Å; N353-A356 PolarHBondContact O-N 3.37Å; L354-A356 VanDerWaalsContact C-N 3.3Å; L354-A356 PolarHBondContact O-N 3.26Å; A356-K359 VanDerWaalsContact O-CD 3.26Å; A356-K359 WeakPolarHBondContact O-CD 3.34Å; A356-K359 VanDerWaalsContact O-CE 3.29Å; A356-K359 WeakPolarHBondContact O-CE 3.38Å; A356-K359 WeakPolarHBondContact O-CG 3.45Å; A356-E405 HydrophobicContact CB-CB 4.2Å; A356-A406 VanDerWaalsContact CB-CA 3.45Å; A356-A406 HydrophobicContact CB-CB 3.67Å; A356-L409 HydrophobicContact CB-CD2 4.33Å
357	K	90.8	Very high	90	Very high	89 Å²	89	42.7 Å²	42.7	39%	0.387	21%	0.21	S	C	.	.	H	α-helix	trans	-74.3	-36.9	173.3	-173.3	-179	178.8	-173.1	0	112.4	M270 D274 N353 L354 L355	M270-K357 PolarHBondContact SD-NZ 3.23Å; D274-K357 WeakPolarHBondContact OD2-CD 3.45Å; D274-K357 WeakPolarHBondContact OD2-CE 3.28Å; D274-K357 IonicContact OD2-NZ 2.76Å; D274-K357 PolarHBondContact OD2-NZ 3.16Å; N353-K357 PolarHBondContact O-N 3.44Å; L354-K357 PolarHBondContact O-N 3.33Å; L355-K357 PolarHBondContact O-N 3.38Å
358	L	89.8	Confident	89.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-90.7	-4.7	-175.1	-65.9	169.5	0	0	0	113.9	F271 D274 V275 L278 L354 L355 N360 H361 I362	F271-L358 HydrophobicContact CB-CD2 4.38Å; F271-L358 HydrophobicContact CD1-CD2 3.79Å; F271-L358 HydrophobicContact CG-CD2 4.48Å; D274-L358 HydrophobicContact CB-CD1 4.34Å; D274-L358 HydrophobicContact CB-CD2 4.38Å; V275-L358 HydrophobicContact CG2-CD1 3.75Å; V275-L358 HydrophobicContact CG2-CD2 3.86Å; V275-L358 HydrophobicContact CG2-CG 4.42Å; L278-L358 HydrophobicContact CD2-CD1 4Å; L354-L358 HydrophobicContact CB-CD1 4.42Å; L354-L358 WeakPolarHBondContact O-CB 3.22Å; L354-L358 WeakPolarHBondContact O-CG 3.45Å; L354-L358 PolarHBondContact O-N 3.43Å; L355-L358 PolarHBondContact O-N 3.32Å; L358-N360 PolarHBondContact O-N 3.42Å; L358-H361 WeakPolarHBondContact O-CA 3.5Å; L358-H361 PolarHBondContact O-N 2.65Å; L358-I362 HydrophobicContact CB-CD1 4.01Å; L358-I362 HydrophobicContact CB-CG2 4.27Å; L358-I362 PolarHBondContact O-N 3.08Å
359	K	87.2	Confident	89.5	Confident	71 Å²	71	48.5 Å²	48.5	31%	0.309	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-23.6	-172.7	66.7	-170.8	172	-173.4	0	116.7	L355 A356 A367 L409	L355-K359 WeakPolarHBondContact O-CA 3.3Å; L355-K359 WeakPolarHBondContact O-CB 3.39Å; L355-K359 PolarHBondContact O-N 3.08Å; A356-K359 VanDerWaalsContact O-CD 3.26Å; A356-K359 WeakPolarHBondContact O-CD 3.34Å; A356-K359 VanDerWaalsContact O-CE 3.29Å; A356-K359 WeakPolarHBondContact O-CE 3.38Å; A356-K359 WeakPolarHBondContact O-CG 3.45Å; K359-A367 HydrophobicContact CB-CB 3.73Å; K359-L409 HydrophobicContact CD-CD1 4.44Å
360	N	85.8	Confident	89.5	Confident	124 Å²	124	49.7 Å²	49.7	66%	0.663	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	-2.4	177.3	-64.1	-9.5	0	0	0	113.6	L358	L358-N360 PolarHBondContact O-N 3.42Å
361	H	77.7	Confident	89.5	Confident	101 Å²	101	49 Å²	49	47%	0.468	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-124.2	-9.5	-172.7	-52	112.4	0	0	0	113.3	F271 L358	F271-H361 AromaticContact CE1-CE1 3.65Å; F271-H361 AromaticContact CE1-ND1 3.83Å; F271-H361 AromaticContact CE2-CE1 3.73Å; F271-H361 AromaticContact CZ-CE1 3.32Å; F271-H361 WeakPolarHBondContact CZ-CE1 3.26Å; F271-H361 AromaticContact CZ-ND1 3.95Å; L358-H361 WeakPolarHBondContact O-CA 3.5Å; L358-H361 PolarHBondContact O-N 2.65Å
362	I	84.6	Confident	89.3	Confident	26 Å²	26	51.7 Å²	51.7	13%	0.133	26%	0.256	C	S	.	.			trans	-117.8	122.6	176.7	66.1	-170.5	0	0	0	110.2	L278 L355 L358 A367 L370	L278-I362 HydrophobicContact CD2-CD1 4.46Å; L355-I362 HydrophobicContact CD2-CD1 3.64Å; L358-I362 HydrophobicContact CB-CD1 4.01Å; L358-I362 HydrophobicContact CB-CG2 4.27Å; L358-I362 PolarHBondContact O-N 3.08Å; I362-A367 HydrophobicContact CD1-CB 3.97Å; I362-A367 HydrophobicContact CG1-CB 4.04Å; I362-L370 HydrophobicContact CD1-CD1 3.84Å
363	H	76.8	Confident	89.3	Confident	129 Å²	129	58 Å²	58	60%	0.597	28%	0.283	S	S	*	.	B	Isolated β-bridge	trans	-124.9	-27.9	-168.9	-61	-49.2	0	0	0	114.4	P365 N366	H363-P365 CarbonylContact O-C 3.15Å; H363-N366 PolarHBondContact O-N 3.4Å
364	E	76.2	Confident	89.3	Confident	190 Å²	190	56.6 Å²	56.6	89%	0.888	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.8	101.5	-177.3	-66.5	-173.5	-170.1	0	0	111.4
365	P	84.8	Confident	89.4	Confident	56 Å²	56	56.4 Å²	56.4	36%	0.364	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	cis	-62.7	157.1	-18.9	29.9	-36.5	0	0	0	112.2	H363 E369 L370 F373	H363-P365 CarbonylContact O-C 3.15Å; P365-E369 WeakPolarHBondContact CA-OE2 2.95Å; P365-E369 HydrophobicContact CB-CB 4Å; P365-E369 VanDerWaalsContact CB-OE2 3.24Å; P365-E369 WeakPolarHBondContact CB-OE2 3.48Å; P365-L370 HydrophobicContact CB-CD2 4.5Å; P365-L370 HydrophobicContact CB-CG 4.27Å; P365-L370 HydrophobicContact CG-CD1 4.25Å; P365-L370 HydrophobicContact CG-CD2 3.58Å; P365-L370 HydrophobicContact CG-CG 3.76Å; P365-F373 HydrophobicContact CB-CE2 4.31Å
366	N	88.8	Confident	89.4	Confident	47 Å²	47	61.1 Å²	61.1	25%	0.251	30%	0.304	S	S	.	.	B	Isolated β-bridge	trans	-80.5	167.6	179.7	57.2	63	0	0	0	112.7	H363 P368 E369 L370	H363-N366 PolarHBondContact O-N 3.4Å; N366-P368 VanDerWaalsContact OD1-CD 3.26Å; N366-P368 WeakPolarHBondContact OD1-CD 3.45Å; N366-E369 VanDerWaalsContact CG-CD 3.49Å; N366-E369 PolarHBondContact N-OE2 2.97Å; N366-E369 PolarHBondContact ND2-OE1 2.69Å; N366-E369 PolarHBondContact ND2-OE2 3.5Å; N366-E369 PolarHBondContact O-N 3.25Å; N366-E369 VanDerWaalsContact O-N 3.17Å; N366-E369 WeakPolarHBondContact OD1-CG 3.45Å; N366-E369 PolarHBondContact OD1-N 3.45Å; N366-L370 PolarHBondContact O-N 2.89Å
367	A	90.7	Very high	89.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.5	-39.6	-177.7	0	0	0	0	0	114.7	L355 K359 I362 L371	L355-A367 HydrophobicContact CD2-CB 4.42Å; K359-A367 HydrophobicContact CB-CB 3.73Å; I362-A367 HydrophobicContact CD1-CB 3.97Å; I362-A367 HydrophobicContact CG1-CB 4.04Å; A367-L371 WeakPolarHBondContact O-CB 3.33Å; A367-L371 PolarHBondContact O-N 2.84Å
368	P	91.8	Very high	89.9	Confident	43 Å²	43	57.9 Å²	57.9	28%	0.279	29%	0.291	S	S	.	.	H	α-helix	trans	-58.9	-45.6	169.3	-27.8	35.2	0	0	0	114.3	N366 L371 H372 C413	N366-P368 VanDerWaalsContact OD1-CD 3.26Å; N366-P368 WeakPolarHBondContact OD1-CD 3.45Å; P368-L371 WeakPolarHBondContact O-CB 3.43Å; P368-L371 PolarHBondContact O-N 3.18Å; P368-H372 PolarHBondContact O-CD2 2.94Å; P368-H372 PolarHBondContact O-N 3.21Å; P368-C413 HydrophobicContact CB-CB 4.24Å
369	E	92.9	Very high	90.2	Very high	84 Å²	84	59.6 Å²	59.6	39%	0.393	31%	0.306	S	S	.	.	H	α-helix	trans	-61	-46.6	176.1	-76.8	160.2	-162.2	0	0	111.8	P365 N366 L371 H372 F373	P365-E369 WeakPolarHBondContact CA-OE2 2.95Å; P365-E369 HydrophobicContact CB-CB 4Å; P365-E369 VanDerWaalsContact CB-OE2 3.24Å; P365-E369 WeakPolarHBondContact CB-OE2 3.48Å; N366-E369 VanDerWaalsContact CG-CD 3.49Å; N366-E369 PolarHBondContact N-OE2 2.97Å; N366-E369 PolarHBondContact ND2-OE1 2.69Å; N366-E369 PolarHBondContact ND2-OE2 3.5Å; N366-E369 PolarHBondContact O-N 3.25Å; N366-E369 VanDerWaalsContact O-N 3.17Å; N366-E369 WeakPolarHBondContact OD1-CG 3.45Å; N366-E369 PolarHBondContact OD1-N 3.45Å; E369-L371 PolarHBondContact O-N 2.88Å; E369-H372 PolarHBondContact O-N 2.96Å; E369-F373 HydrophobicContact CB-CD2 4.45Å; E369-F373 HydrophobicContact CB-CE2 4.06Å; E369-F373 WeakPolarHBondContact O-CD2 3.44Å; E369-F373 VanDerWaalsContact O-CG 3.32Å; E369-F373 WeakPolarHBondContact O-CG 3.45Å; E369-F373 PolarHBondContact O-N 2.6Å
370	L	94.6	Very high	90.5	Very high	25 Å²	25	58.1 Å²	58.1	13%	0.131	30%	0.302	C	S	.	.	H	α-helix	trans	-62	-30.7	175	-72.4	169.3	0	0	0	112.9	F282 L355 I362 P365 N366 F373 L374	F282-L370 HydrophobicContact CE2-CD2 4.03Å; F282-L370 HydrophobicContact CZ-CB 4.36Å; F282-L370 HydrophobicContact CZ-CD2 3.8Å; F282-L370 HydrophobicContact CZ-CG 4.46Å; L355-L370 HydrophobicContact CD1-CB 4.14Å; L355-L370 HydrophobicContact CD2-CB 3.62Å; L355-L370 HydrophobicContact CD2-CD1 3.75Å; L355-L370 HydrophobicContact CD2-CG 4.33Å; I362-L370 HydrophobicContact CD1-CD1 3.84Å; P365-L370 HydrophobicContact CB-CD2 4.5Å; P365-L370 HydrophobicContact CB-CG 4.27Å; P365-L370 HydrophobicContact CG-CD1 4.25Å; P365-L370 HydrophobicContact CG-CD2 3.58Å; P365-L370 HydrophobicContact CG-CG 3.76Å; N366-L370 PolarHBondContact O-N 2.89Å; L370-F373 HydrophobicContact CD2-CD2 4.48Å; L370-L374 WeakPolarHBondContact O-CG 3.37Å; L370-L374 PolarHBondContact O-N 3.16Å; L370-L374 VanDerWaalsContact O-N 3.16Å
371	L	95.3	Very high	90.9	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-66.7	-48.7	173.1	-175.2	68.6	0	0	0	110.8	F352 A367 P368 E369 F373 L374 F375 L409 M410 C413 L414	F352-L371 HydrophobicContact CD1-CD1 3.5Å; F352-L371 VanDerWaalsContact CD1-CD1 3.5Å; F352-L371 HydrophobicContact CE1-CD1 3.59Å; F352-L371 HydrophobicContact CG-CD1 4.44Å; A367-L371 WeakPolarHBondContact O-CB 3.33Å; A367-L371 PolarHBondContact O-N 2.84Å; P368-L371 WeakPolarHBondContact O-CB 3.43Å; P368-L371 PolarHBondContact O-N 3.18Å; E369-L371 PolarHBondContact O-N 2.88Å; L371-F373 VanDerWaalsContact C-N 3.32Å; L371-F373 PolarHBondContact O-N 3.39Å; L371-L374 WeakPolarHBondContact O-CB 3.25Å; L371-L374 PolarHBondContact O-N 2.88Å; L371-F375 HydrophobicContact CD1-CE2 4.1Å; L371-F375 HydrophobicContact CG-CE2 4.37Å; L371-F375 WeakPolarHBondContact O-CD2 3.3Å; L371-F375 PolarHBondContact O-N 3.45Å; L371-L409 HydrophobicContact CD2-CG 4.31Å; L371-M410 HydrophobicContact CD1-CG 4.11Å; L371-M410 HydrophobicContact CD2-CG 4.08Å; L371-C413 HydrophobicContact CD2-CB 4.14Å; L371-L414 HydrophobicContact CD2-CD2 3.62Å; L371-L414 HydrophobicContact CD2-CG 4.16Å; L371-L414 HydrophobicContact CG-CD2 3.79Å
372	H	94.1	Very high	91.7	Very high	56 Å²	56	48 Å²	48	26%	0.259	25%	0.252	S	S	.	.	H	α-helix	trans	-60.2	-41.1	174.7	-66.5	-61.7	0	0	0	112.3	P368 E369 L374 F375 C413 E418	P368-H372 PolarHBondContact O-CD2 2.94Å; P368-H372 PolarHBondContact O-N 3.21Å; E369-H372 PolarHBondContact O-N 2.96Å; H372-L374 PolarHBondContact O-N 3.35Å; H372-F375 PolarHBondContact O-N 3.02Å; H372-F375 VanDerWaalsContact O-N 3.1Å; H372-C413 PolarHBondContact CE1-O 2.91Å; H372-C413 PolarHBondContact NE2-O 2.9Å; H372-E418 WeakPolarHBondContact CA-OE1 3.25Å; H372-E418 IonicContact CE1-OE1 3.21Å; H372-E418 IonicContact CE1-OE2 3.4Å; H372-E418 PolarHBondContact CE1-OE2 3.38Å; H372-E418 VanDerWaalsContact CE1-OE2 3.3Å; H372-E418 IonicContact CG-OE1 2.72Å; H372-E418 VanDerWaalsContact ND1-CD 3.26Å; H372-E418 IonicContact ND1-OE1 2.78Å; H372-E418 PolarHBondContact ND1-OE1 3.12Å; H372-E418 IonicContact ND1-OE2 3.17Å; H372-E418 PolarHBondContact ND1-OE2 2.83Å
373	F	95.3	Very high	92	Very high	133 Å²	133	52.9 Å²	52.9	58%	0.583	27%	0.274	S	S	*	.	H	α-helix	trans	-64	-19.9	175	-65	-44	0	0	0	113.6	P365 E369 L370 L371 P377	P365-F373 HydrophobicContact CB-CE2 4.31Å; E369-F373 HydrophobicContact CB-CD2 4.45Å; E369-F373 HydrophobicContact CB-CE2 4.06Å; E369-F373 WeakPolarHBondContact O-CD2 3.44Å; E369-F373 VanDerWaalsContact O-CG 3.32Å; E369-F373 WeakPolarHBondContact O-CG 3.45Å; E369-F373 PolarHBondContact O-N 2.6Å; L370-F373 HydrophobicContact CD2-CD2 4.48Å; L371-F373 VanDerWaalsContact C-N 3.32Å; L371-F373 PolarHBondContact O-N 3.39Å; F373-P377 WeakPolarHBondContact O-CD 3.42Å; F373-P377 WeakPolarHBondContact O-CG 3.39Å
374	L	96.8	Very high	92.7	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-83.1	-29.8	170.5	-76.6	169.1	0	0	0	113.6	F282 I285 F348 F352 L355 L370 L371 H372 T376 P377 L378	F282-L374 HydrophobicContact CD1-CD2 3.89Å; F282-L374 HydrophobicContact CD1-CG 4.48Å; F282-L374 HydrophobicContact CE1-CD1 4.02Å; F282-L374 HydrophobicContact CE1-CD2 3.73Å; F282-L374 HydrophobicContact CE1-CG 3.85Å; I285-L374 HydrophobicContact CD1-CD2 3.81Å; F348-L374 HydrophobicContact CD1-CB 4.35Å; F348-L374 HydrophobicContact CD1-CD2 3.89Å; F348-L374 HydrophobicContact CE1-CB 4.15Å; F348-L374 HydrophobicContact CE1-CD2 3.66Å; F348-L374 WeakPolarHBondContact CE1-O 3.35Å; F352-L374 HydrophobicContact CD1-CD1 3.77Å; F352-L374 HydrophobicContact CE1-CB 3.82Å; F352-L374 HydrophobicContact CE1-CD1 3.62Å; F352-L374 HydrophobicContact CE1-CG 4.36Å; L355-L374 HydrophobicContact CD1-CD1 3.59Å; L370-L374 WeakPolarHBondContact O-CG 3.37Å; L370-L374 PolarHBondContact O-N 3.16Å; L370-L374 VanDerWaalsContact O-N 3.16Å; L371-L374 WeakPolarHBondContact O-CB 3.25Å; L371-L374 PolarHBondContact O-N 2.88Å; H372-L374 PolarHBondContact O-N 3.35Å; L374-T376 VanDerWaalsContact C-N 3.33Å; L374-T376 PolarHBondContact O-N 3.35Å; L374-P377 VanDerWaalsContact O-CD 3.25Å; L374-P377 WeakPolarHBondContact O-CD 3.31Å; L374-P377 VanDerWaalsContact O-CG 3.3Å; L374-P377 WeakPolarHBondContact O-CG 3.42Å; L374-L378 VanDerWaalsContact O-CB 3.23Å; L374-L378 WeakPolarHBondContact O-CB 3.35Å; L374-L378 PolarHBondContact O-N 3.01Å
375	F	96.6	Very high	93.3	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.018	20%	0.203	C	C	.	.	H	α-helix	trans	-70	-29.9	-178.8	-90.7	-95.3	0	0	0	113.4	F352 L371 H372 L378 A379 L414 E418 I421 W422	F352-F375 HydrophobicContact CE1-CE2 4.02Å; F352-F375 HydrophobicContact CZ-CD2 4.41Å; F352-F375 AromaticContact CZ-CE2 3.75Å; F352-F375 HydrophobicContact CZ-CE2 3.75Å; F352-F375 HydrophobicContact CZ-CZ 4.17Å; L371-F375 HydrophobicContact CD1-CE2 4.1Å; L371-F375 HydrophobicContact CG-CE2 4.37Å; L371-F375 WeakPolarHBondContact O-CD2 3.3Å; L371-F375 PolarHBondContact O-N 3.45Å; H372-F375 PolarHBondContact O-N 3.02Å; H372-F375 VanDerWaalsContact O-N 3.1Å; F375-L378 HydrophobicContact CD1-CD2 4.27Å; F375-L378 HydrophobicContact CE1-CD2 4.11Å; F375-L378 HydrophobicContact CZ-CD2 4.43Å; F375-L378 PolarHBondContact O-N 3.47Å; F375-A379 WeakPolarHBondContact O-CB 3.43Å; F375-A379 PolarHBondContact O-N 2.96Å; F375-L414 HydrophobicContact CD2-CD2 3.67Å; F375-L414 HydrophobicContact CE1-CD1 4.19Å; F375-L414 HydrophobicContact CE2-CD1 3.83Å; F375-L414 HydrophobicContact CE2-CD2 3.5Å; F375-L414 VanDerWaalsContact CE2-CD2 3.5Å; F375-L414 HydrophobicContact CE2-CG 4.31Å; F375-L414 HydrophobicContact CG-CD2 4.37Å; F375-L414 HydrophobicContact CZ-CD1 3.55Å; F375-L414 HydrophobicContact CZ-CD2 4.05Å; F375-L414 HydrophobicContact CZ-CG 4.47Å; F375-E418 HydrophobicContact CB-CB 4.32Å; F375-E418 HydrophobicContact CB-CG 3.77Å; F375-E418 HydrophobicContact CD1-CB 3.66Å; F375-E418 HydrophobicContact CD1-CG 4.03Å; F375-E418 HydrophobicContact CE1-CB 4.13Å; F375-E418 WeakPolarHBondContact CE1-O 3.34Å; F375-E418 HydrophobicContact CG-CB 3.88Å; F375-E418 HydrophobicContact CG-CG 3.91Å; F375-I421 HydrophobicContact CD1-CB 4.2Å; F375-I421 HydrophobicContact CD1-CG2 3.97Å; F375-I421 HydrophobicContact CE1-CB 4.22Å; F375-I421 HydrophobicContact CE1-CG2 3.97Å; F375-W422 HydrophobicContact CE1-CB 4.02Å; F375-W422 HydrophobicContact CZ-CB 4.03Å
376	T	94.9	Very high	93.4	Very high	100 Å²	100	39.9 Å²	39.9	61%	0.613	21%	0.208	S	C	*	.	H	α-helix	trans	-61.3	-56.1	174.1	-63.2	0	0	0	0	113.1	L374 L378 A379 V380	L374-T376 VanDerWaalsContact C-N 3.33Å; L374-T376 PolarHBondContact O-N 3.35Å; T376-L378 VanDerWaalsContact C-N 3.33Å; T376-L378 PolarHBondContact O-N 3.34Å; T376-A379 PolarHBondContact O-N 3.47Å; T376-V380 PolarHBondContact O-N 3.22Å
377	P	96.6	Very high	93.3	Very high	24 Å²	24	42.8 Å²	42.8	16%	0.156	22%	0.216	C	C	.	.	H	α-helix	trans	-67.4	-31.3	175.6	26.8	-34.8	0	0	0	112.8	I285 V289 F348 F373 L374 V380 I381	I285-P377 HydrophobicContact CG2-CB 3.89Å; I285-P377 HydrophobicContact CG2-CG 4.03Å; V289-P377 HydrophobicContact CG2-CB 3.61Å; F348-P377 HydrophobicContact CE1-CG 4.3Å; F348-P377 HydrophobicContact CZ-CB 4.27Å; F348-P377 HydrophobicContact CZ-CG 4.21Å; F373-P377 WeakPolarHBondContact O-CD 3.42Å; F373-P377 WeakPolarHBondContact O-CG 3.39Å; L374-P377 VanDerWaalsContact O-CD 3.25Å; L374-P377 WeakPolarHBondContact O-CD 3.31Å; L374-P377 VanDerWaalsContact O-CG 3.3Å; L374-P377 WeakPolarHBondContact O-CG 3.42Å; P377-V380 PolarHBondContact O-N 3.09Å; P377-I381 WeakPolarHBondContact O-CG1 3.43Å; P377-I381 PolarHBondContact O-N 3.48Å
378	L	96.8	Very high	92.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.7	-44.7	174.1	-179	59.6	0	0	0	111.6	L345 F348 F352 L374 F375 T376 V380 I381 L382 I421 L425	L345-L378 HydrophobicContact CD2-CD1 3.72Å; F348-L378 HydrophobicContact CD1-CB 4.23Å; F348-L378 HydrophobicContact CD1-CD1 4.32Å; F348-L378 HydrophobicContact CD2-CD1 4.23Å; F348-L378 HydrophobicContact CE1-CB 3.76Å; F348-L378 HydrophobicContact CE1-CD1 4.46Å; F348-L378 HydrophobicContact CE2-CD1 4.38Å; F348-L378 HydrophobicContact CG-CD1 4.21Å; F348-L378 HydrophobicContact CZ-CB 4.02Å; F348-L378 HydrophobicContact CZ-CD1 4.48Å; F352-L378 HydrophobicContact CZ-CD2 4.19Å; L374-L378 VanDerWaalsContact O-CB 3.23Å; L374-L378 WeakPolarHBondContact O-CB 3.35Å; L374-L378 PolarHBondContact O-N 3.01Å; F375-L378 HydrophobicContact CD1-CD2 4.27Å; F375-L378 HydrophobicContact CE1-CD2 4.11Å; F375-L378 HydrophobicContact CZ-CD2 4.43Å; F375-L378 PolarHBondContact O-N 3.47Å; T376-L378 VanDerWaalsContact C-N 3.33Å; T376-L378 PolarHBondContact O-N 3.34Å; L378-V380 PolarHBondContact O-N 3.06Å; L378-I381 PolarHBondContact O-N 3.05Å; L378-L382 HydrophobicContact CD1-CD1 4.35Å; L378-L382 HydrophobicContact CD1-CG 4.26Å; L378-L382 HydrophobicContact CG-CD1 4.08Å; L378-L382 HydrophobicContact CG-CG 4.45Å; L378-L382 VanDerWaalsContact O-CG 3.3Å; L378-L382 WeakPolarHBondContact O-CG 3.3Å; L378-L382 PolarHBondContact O-N 3.48Å; L378-I421 HydrophobicContact CD2-CG2 4.45Å; L378-L425 HydrophobicContact CD2-CD1 4.15Å
379	A	95.1	Very high	92.5	Very high	36 Å²	36	44.2 Å²	44.2	30%	0.298	23%	0.229	S	C	.	.	H	α-helix	trans	-58.8	-45.8	177	0	0	0	0	0	112.1	F375 T376 I381 L382 E383 I421	F375-A379 WeakPolarHBondContact O-CB 3.43Å; F375-A379 PolarHBondContact O-N 2.96Å; T376-A379 PolarHBondContact O-N 3.47Å; A379-I381 VanDerWaalsContact C-N 3.32Å; A379-I381 PolarHBondContact O-N 3.07Å; A379-L382 PolarHBondContact O-N 3.43Å; A379-E383 PolarHBondContact O-N 2.93Å; A379-I421 HydrophobicContact CB-CD1 4.19Å
380	V	94.5	Very high	92	Very high	40 Å²	40	43.5 Å²	43.5	24%	0.242	24%	0.244	C	C	.	.	H	α-helix	trans	-61.5	-39.2	176.8	176.2	0	0	0	0	111.8	V289 I292 T376 P377 L378 A384	V289-V380 HydrophobicContact CG1-CG1 4.3Å; I292-V380 HydrophobicContact CG2-CG1 4.26Å; T376-V380 PolarHBondContact O-N 3.22Å; P377-V380 PolarHBondContact O-N 3.09Å; L378-V380 PolarHBondContact O-N 3.06Å; V380-A384 WeakPolarHBondContact O-CB 3.15Å; V380-A384 PolarHBondContact O-N 3.26Å
381	I	94.5	Very high	91.5	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-70.1	-39.8	178.1	-72.2	166.5	0	0	0	111.3	F288 V289 I292 F341 I344 F348 P377 L378 A379 A384 C385	F288-I381 HydrophobicContact CD1-CD1 3.74Å; F288-I381 HydrophobicContact CD1-CG1 3.86Å; F288-I381 HydrophobicContact CE1-CD1 4.32Å; F288-I381 HydrophobicContact CE1-CG1 4.09Å; F288-I381 HydrophobicContact CE1-CG2 4.18Å; V289-I381 HydrophobicContact CG2-CD1 3.81Å; V289-I381 HydrophobicContact CG2-CG1 4.02Å; I292-I381 HydrophobicContact CD1-CG1 3.84Å; F341-I381 HydrophobicContact CD1-CG2 4.02Å; F341-I381 HydrophobicContact CE1-CG2 4.28Å; I344-I381 HydrophobicContact CG2-CD1 4.26Å; I344-I381 HydrophobicContact CG2-CG2 4.19Å; F348-I381 HydrophobicContact CE2-CD1 3.53Å; F348-I381 HydrophobicContact CZ-CD1 3.93Å; P377-I381 WeakPolarHBondContact O-CG1 3.43Å; P377-I381 PolarHBondContact O-N 3.48Å; L378-I381 PolarHBondContact O-N 3.05Å; A379-I381 VanDerWaalsContact C-N 3.32Å; A379-I381 PolarHBondContact O-N 3.07Å; I381-A384 PolarHBondContact O-N 3.48Å; I381-C385 PolarHBondContact O-N 2.97Å; I381-C385 PolarHBondContact O-SG 2.85Å
382	L	93.1	Very high	91.1	Very high	13 Å²	13	49.5 Å²	49.5	7%	0.068	27%	0.268	C	S	.	.	H	α-helix	trans	-65.5	-42.5	174.3	-67.8	169.3	0	0	0	111.6	L378 A379 A384 C385 H386 A394 I421 L425	L378-L382 HydrophobicContact CD1-CD1 4.35Å; L378-L382 HydrophobicContact CD1-CG 4.26Å; L378-L382 HydrophobicContact CG-CD1 4.08Å; L378-L382 HydrophobicContact CG-CG 4.45Å; L378-L382 VanDerWaalsContact O-CG 3.3Å; L378-L382 WeakPolarHBondContact O-CG 3.3Å; L378-L382 PolarHBondContact O-N 3.48Å; A379-L382 PolarHBondContact O-N 3.43Å; L382-A384 VanDerWaalsContact C-N 3.3Å; L382-A384 PolarHBondContact O-N 3.39Å; L382-C385 WeakPolarHBondContact O-CB 3.47Å; L382-C385 PolarHBondContact O-N 3.33Å; L382-C385 VanDerWaalsContact O-N 3.14Å; L382-H386 PolarHBondContact O-N 2.95Å; L382-H386 VanDerWaalsContact O-N 3.1Å; L382-H386 PolarHBondContact O-ND1 3.34Å; L382-A394 HydrophobicContact CD2-CB 4.06Å; L382-I421 HydrophobicContact CD1-CG2 3.74Å; L382-L425 HydrophobicContact CD1-CD2 3.72Å; L382-L425 HydrophobicContact CD2-CD2 3.76Å; L382-L425 HydrophobicContact CG-CD2 4.32Å
383	E	91.9	Very high	90.9	Very high	128 Å²	128	46.9 Å²	46.9	60%	0.598	26%	0.256	S	S	*	.	H	α-helix	trans	-57.8	-45.6	174.4	-169	-178.4	-172.6	0	0	110.6	A379 C385 H386 W387	A379-E383 PolarHBondContact O-N 2.93Å; E383-C385 VanDerWaalsContact C-N 3.34Å; E383-C385 PolarHBondContact O-N 2.98Å; E383-H386 PolarHBondContact O-N 2.8Å; E383-H386 VanDerWaalsContact O-N 3.09Å; E383-W387 PolarHBondContact O-N 3.45Å
384	A	90.8	Very high	90.7	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.6	-31.3	174.5	0	0	0	0	0	114.4	I292 F341 V380 I381 L382 G388	I292-A384 HydrophobicContact CD1-CB 3.78Å; I292-A384 HydrophobicContact CG1-CB 4.17Å; I292-A384 HydrophobicContact CG2-CB 3.7Å; F341-A384 HydrophobicContact CE1-CB 3.91Å; F341-A384 HydrophobicContact CZ-CB 3.99Å; V380-A384 WeakPolarHBondContact O-CB 3.15Å; V380-A384 PolarHBondContact O-N 3.26Å; I381-A384 PolarHBondContact O-N 3.48Å; L382-A384 VanDerWaalsContact C-N 3.3Å; L382-A384 PolarHBondContact O-N 3.39Å; A384-G388 VanDerWaalsContact O-CA 3.32Å; A384-G388 WeakPolarHBondContact O-CA 3.34Å; A384-G388 PolarHBondContact O-N 2.81Å
385	C	89.6	Confident	90.5	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.8	-44.8	169.4	-63	0	0	0	0	111.2	F341 I381 L382 E383 L389 G390 R391	F341-C385 WeakPolarHBondContact CD1-SG 3.21Å; I381-C385 PolarHBondContact O-N 2.97Å; I381-C385 PolarHBondContact O-SG 2.85Å; L382-C385 WeakPolarHBondContact O-CB 3.47Å; L382-C385 PolarHBondContact O-N 3.33Å; L382-C385 VanDerWaalsContact O-N 3.14Å; E383-C385 VanDerWaalsContact C-N 3.34Å; E383-C385 PolarHBondContact O-N 2.98Å; C385-L389 WeakPolarHBondContact O-CA 3.38Å; C385-L389 WeakPolarHBondContact O-CB 3.48Å; C385-L389 PolarHBondContact O-N 3.18Å; C385-G390 PolarHBondContact O-N 3.15Å; C385-R391 CarbonylContact C-O 3.17Å; C385-R391 VanDerWaalsContact O-O 3.13Å
386	H	87.4	Confident	90.2	Very high	102 Å²	102	48 Å²	48	47%	0.472	28%	0.275	S	S	.	.	H	α-helix	trans	-66.2	-50.8	-177.5	-70.3	93	0	0	0	112.4	L382 E383 G390	L382-H386 PolarHBondContact O-N 2.95Å; L382-H386 VanDerWaalsContact O-N 3.1Å; L382-H386 PolarHBondContact O-ND1 3.34Å; E383-H386 PolarHBondContact O-N 2.8Å; E383-H386 VanDerWaalsContact O-N 3.09Å; H386-G390 VanDerWaalsContact O-CA 3.25Å; H386-G390 WeakPolarHBondContact O-CA 3.31Å; H386-G390 PolarHBondContact O-N 3.19Å
387	W	85	Confident	90.1	Very high	107 Å²	107	43.3 Å²	43.3	41%	0.405	25%	0.246	S	C	.	.	H	α-helix	trans	-79.7	-25.9	-178.9	71.2	-108.1	0	0	0	113.6	A296 L335 E383	A296-W387 HydrophobicContact CB-CZ2 4.25Å; L335-W387 HydrophobicContact CD1-CD2 4.47Å; L335-W387 HydrophobicContact CD1-CE3 3.94Å; L335-W387 HydrophobicContact CD1-CH2 3.55Å; L335-W387 HydrophobicContact CD1-CZ2 4.11Å; L335-W387 HydrophobicContact CD1-CZ3 3.45Å; L335-W387 VanDerWaalsContact CD1-CZ3 3.45Å; L335-W387 HydrophobicContact CD2-CH2 3.68Å; L335-W387 HydrophobicContact CD2-CZ2 3.93Å; L335-W387 HydrophobicContact CD2-CZ3 4.43Å; L335-W387 HydrophobicContact CG-CH2 3.63Å; L335-W387 HydrophobicContact CG-CZ2 4.32Å; L335-W387 HydrophobicContact CG-CZ3 3.93Å; E383-W387 PolarHBondContact O-N 3.45Å
388	G	82	Confident	89.6	Confident	34 Å²	34	43.6 Å²	43.6	35%	0.351	25%	0.251	S	S	.	.	H	α-helix	trans	-89.8	-43.6	-177.6	0	0	0	0	0	115.7	A384	A384-G388 VanDerWaalsContact O-CA 3.32Å; A384-G388 WeakPolarHBondContact O-CA 3.34Å; A384-G388 PolarHBondContact O-N 2.81Å
389	L	83.5	Confident	89.3	Confident	39 Å²	39	44.5 Å²	44.5	20%	0.204	26%	0.257	C	S	.	.	H	α-helix	trans	-107.4	-1	-176.4	-57.2	177	0	0	0	112.9	E338 F341 C385 R391 V393	E338-L389 HydrophobicContact CB-CD1 4.06Å; E338-L389 HydrophobicContact CB-CD2 4.18Å; E338-L389 HydrophobicContact CG-CD1 4.11Å; F341-L389 HydrophobicContact CB-CD1 4.41Å; F341-L389 HydrophobicContact CD2-CD1 3.93Å; F341-L389 HydrophobicContact CE2-CD1 4.42Å; F341-L389 HydrophobicContact CG-CD1 4.21Å; C385-L389 WeakPolarHBondContact O-CA 3.38Å; C385-L389 WeakPolarHBondContact O-CB 3.48Å; C385-L389 PolarHBondContact O-N 3.18Å; L389-R391 PolarHBondContact O-N 2.88Å; L389-R391 PolarHBondContact O-NH1 3.47Å; L389-V393 HydrophobicContact CD1-CG1 3.82Å; L389-V393 HydrophobicContact CD1-CG2 4.45Å
390	G	82.4	Confident	89.1	Confident	69 Å²	69	43.6 Å²	43.6	71%	0.711	25%	0.248	S	C	*	.	S	Bend	trans	69	6.4	-177.7	0	0	0	0	0	114.7	C385 H386	C385-G390 PolarHBondContact O-N 3.15Å; H386-G390 VanDerWaalsContact O-CA 3.25Å; H386-G390 WeakPolarHBondContact O-CA 3.31Å; H386-G390 PolarHBondContact O-N 3.19Å
391	R	85.3	Confident	89	Confident	117 Å²	117	42.5 Å²	42.5	44%	0.442	24%	0.241	S	C	.	.	S	Bend	trans	-160.6	153.2	-172.7	68.7	-166.6	-176.5	-84.7	12.2	112.4	E338 C385 L389 V393	E338-R391 IonicContact OE1-CZ 3.7Å; E338-R391 IonicContact OE1-NE 2.9Å; E338-R391 IonicContact OE1-NH2 2.94Å; E338-R391 PolarHBondContact OE1-NH2 3.18Å; E338-R391 IonicContact OE2-CZ 2.64Å; E338-R391 IonicContact OE2-NH1 2.9Å; E338-R391 IonicContact OE2-NH2 2.71Å; E338-R391 PolarHBondContact OE2-NH2 2.95Å; C385-R391 CarbonylContact C-O 3.17Å; C385-R391 VanDerWaalsContact O-O 3.13Å; L389-R391 PolarHBondContact O-N 2.88Å; L389-R391 PolarHBondContact O-NH1 3.47Å; R391-V393 HydrophobicContact CG-CG1 4.23Å; R391-V393 PolarHBondContact O-N 3.08Å
392	N	85.8	Confident	88.9	Confident	36 Å²	36	42.7 Å²	42.7	19%	0.193	24%	0.242	C	C	.	.			trans	-74.3	120	166.5	-170.3	-6.6	0	0	0	110	A394	N392-A394 VanDerWaalsContact OD1-CB 3.25Å; N392-A394 WeakPolarHBondContact OD1-CB 3.25Å; N392-A394 PolarHBondContact OD1-N 3.47Å
393	V	90.8	Very high	88.8	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.006	25%	0.247	C	C	.	.			trans	-89.4	-14.6	176	-63.5	0	0	0	0	113.3	E338 F341 L345 L389 R391 P395 T396	E338-V393 HydrophobicContact CG-CG1 4.3Å; F341-V393 HydrophobicContact CB-CG2 4.19Å; L345-V393 HydrophobicContact CD1-CG2 3.85Å; L389-V393 HydrophobicContact CD1-CG1 3.82Å; L389-V393 HydrophobicContact CD1-CG2 4.45Å; R391-V393 HydrophobicContact CG-CG1 4.23Å; R391-V393 PolarHBondContact O-N 3.08Å; V393-P395 VanDerWaalsContact C-CD 3.46Å; V393-T396 WeakPolarHBondContact O-CB 3.47Å; V393-T396 PolarHBondContact O-N 3.47Å; V393-T396 PolarHBondContact O-OG1 3.49Å
394	A	91.5	Very high	88.8	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-55.1	-38.8	-177.6	0	0	0	0	0	114.7	L345 L382 N392 T396 V397 L425 W429	L345-A394 HydrophobicContact CD1-CB 4.07Å; L345-A394 HydrophobicContact CD2-CB 4.46Å; L382-A394 HydrophobicContact CD2-CB 4.06Å; N392-A394 VanDerWaalsContact OD1-CB 3.25Å; N392-A394 WeakPolarHBondContact OD1-CB 3.25Å; N392-A394 PolarHBondContact OD1-N 3.47Å; A394-T396 PolarHBondContact O-N 3.19Å; A394-V397 WeakPolarHBondContact O-CB 3.5Å; A394-V397 PolarHBondContact O-N 2.98Å; A394-L425 CarbonylContact C-O 3.53Å; A394-L425 HydrophobicContact CB-CB 4.44Å; A394-L425 HydrophobicContact CB-CD2 3.84Å; A394-W429 HydrophobicContact CB-CZ2 4.06Å; A394-W429 PolarHBondContact O-NE1 2.88Å
395	P	91.6	Very high	88.9	Confident	66 Å²	66	44.6 Å²	44.6	43%	0.429	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-59.1	-19.8	176	-26.7	36	0	0	0	114.9	V393 L425	V393-P395 VanDerWaalsContact C-CD 3.46Å; P395-L425 VanDerWaalsContact CA-O 3.29Å; P395-L425 WeakPolarHBondContact CA-O 3.25Å; P395-L425 WeakPolarHBondContact CG-O 3.2Å
396	T	90.4	Very high	89.1	Confident	96 Å²	96	44.7 Å²	44.7	59%	0.589	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-82.3	-15.5	176.4	72.9	0	0	0	0	113.7	V393 A394 A398	V393-T396 WeakPolarHBondContact O-CB 3.47Å; V393-T396 PolarHBondContact O-N 3.47Å; V393-T396 PolarHBondContact O-OG1 3.49Å; A394-T396 PolarHBondContact O-N 3.19Å; T396-A398 PolarHBondContact O-N 2.84Å
397	V	92.9	Very high	89.3	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.012	24%	0.243	C	C	.	.			trans	-85.5	78.5	-169.5	-171.7	0	0	0	0	110.3	V342 L345 K346 K349 A394 W429	V342-V397 HydrophobicContact CG1-CG2 4.45Å; V342-V397 HydrophobicContact CG2-CG2 4.45Å; L345-V397 HydrophobicContact CB-CG1 4.22Å; L345-V397 HydrophobicContact CB-CG2 3.98Å; L345-V397 HydrophobicContact CD1-CG2 4.16Å; K346-V397 HydrophobicContact CG-CG1 3.6Å; K349-V397 HydrophobicContact CD-CG1 4.11Å; K349-V397 PolarHBondContact NZ-O 2.86Å; A394-V397 WeakPolarHBondContact O-CB 3.5Å; A394-V397 PolarHBondContact O-N 2.98Å; V397-W429 HydrophobicContact CB-CZ2 4.27Å
398	A	87.4	Confident	89.7	Confident	30 Å²	30	41.3 Å²	41.3	25%	0.248	24%	0.242	C	C	.	.			trans	-69.9	-55.2	-177.1	0	0	0	0	0	113.5	K349 T396 P400 L401 P441	K349-A398 PolarHBondContact NZ-O 3.42Å; T396-A398 PolarHBondContact O-N 2.84Å; A398-P400 CarbonylContact O-C 3.47Å; A398-P400 VanDerWaalsContact O-O 3.05Å; A398-L401 PolarHBondContact O-N 3.48Å; A398-P441 HydrophobicContact CB-CB 4.15Å; A398-P441 HydrophobicContact CB-CG 4.37Å
399	S	89.1	Confident	90.2	Very high	19 Å²	19	40.5 Å²	40.5	13%	0.133	23%	0.23	C	C	.	.	S	Bend	trans	-92.7	137.1	-178.1	-164.8	0	0	0	0	112.4	K346 P442 Y444	K346-S399 WeakPolarHBondContact CD-O 3.49Å; K346-S399 VanDerWaalsContact CG-O 3.23Å; K346-S399 WeakPolarHBondContact CG-O 3.33Å; S399-P442 WeakPolarHBondContact CB-O 3.33Å; S399-P442 PolarHBondContact OG-O 3.3Å; S399-Y444 PolarHBondContact OG-N 2.98Å
400	P	92.3	Very high	90.7	Very high	17 Å²	17	38.8 Å²	38.8	11%	0.11	22%	0.221	C	C	.	.	S	Bend	cis	-72.7	151.2	-8.1	30.9	-32.3	0	0	0	110.8	K349 L350 A398 Y444	K349-P400 HydrophobicContact CB-CG 3.75Å; K349-P400 WeakPolarHBondContact CD-O 3.49Å; K349-P400 WeakPolarHBondContact CE-O 3.37Å; K349-P400 PolarHBondContact NZ-O 2.82Å; L350-P400 HydrophobicContact CB-CG 4.4Å; A398-P400 CarbonylContact O-C 3.47Å; A398-P400 VanDerWaalsContact O-O 3.05Å; P400-Y444 HydrophobicContact CG-CD1 3.99Å; P400-Y444 HydrophobicContact CG-CG 4.43Å
401	L	91.1	Very high	91.2	Very high	17 Å²	17	40.5 Å²	40.5	9%	0.089	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-71.2	154.2	165.3	-68.5	173.3	0	0	0	109.2	N353 A398 A428 P433 W436 L440 P441	N353-L401 PolarHBondContact ND2-O 3.22Å; A398-L401 PolarHBondContact O-N 3.48Å; L401-A428 HydrophobicContact CD2-CB 4.5Å; L401-P433 HydrophobicContact CB-CG 4.09Å; L401-P433 HydrophobicContact CD1-CB 4.36Å; L401-P433 HydrophobicContact CD1-CG 4.42Å; L401-W436 HydrophobicContact CD1-CB 3.94Å; L401-W436 HydrophobicContact CD1-CD2 3.95Å; L401-W436 HydrophobicContact CD1-CG 3.66Å; L401-W436 HydrophobicContact CD2-CD2 3.96Å; L401-W436 HydrophobicContact CD2-CE3 3.9Å; L401-W436 HydrophobicContact CD2-CH2 4.46Å; L401-W436 HydrophobicContact CD2-CZ2 4.49Å; L401-W436 HydrophobicContact CD2-CZ3 4.17Å; L401-L440 HydrophobicContact CD1-CD2 4.03Å; L401-P441 HydrophobicContact CD1-CG 4.24Å; L401-P441 HydrophobicContact CG-CG 4.02Å
402	L	92.1	Very high	91.6	Very high	3 Å²	3	41.4 Å²	41.4	2%	0.016	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-82.1	136	176.7	-60.2	-170.3	0	0	0	110.2	K349 F352 N353 M410 W429 P432 P433	K349-L402 HydrophobicContact CB-CD2 3.61Å; K349-L402 HydrophobicContact CG-CD2 3.92Å; K349-L402 WeakPolarHBondContact O-CD2 3.33Å; F352-L402 HydrophobicContact CB-CD2 4.28Å; F352-L402 HydrophobicContact CD2-CD1 4.35Å; F352-L402 HydrophobicContact CD2-CD2 4.37Å; N353-L402 VanDerWaalsContact OD1-CA 3.25Å; N353-L402 WeakPolarHBondContact OD1-CA 3.18Å; L402-M410 HydrophobicContact CD1-CE 3.46Å; L402-M410 VanDerWaalsContact CD1-CE 3.46Å; L402-M410 HydrophobicContact CD1-SD 4.37Å; L402-W429 HydrophobicContact CD1-CE3 4.47Å; L402-W429 VanDerWaalsContact CD1-O 3.26Å; L402-W429 WeakPolarHBondContact CD1-O 3.26Å; L402-P432 VanDerWaalsContact O-CA 3.25Å; L402-P432 WeakPolarHBondContact O-CA 3.43Å; L402-P432 WeakPolarHBondContact O-CB 3.35Å; L402-P433 WeakPolarHBondContact O-CD 3.33Å
403	S	91.9	Very high	91.9	Very high	26 Å²	26	41.3 Å²	41.3	18%	0.182	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-71	163.1	179.9	83.4	0	0	0	0	112	N353 E405 A406 R407	N353-S403 PolarHBondContact OD1-N 3.41Å; S403-E405 VanDerWaalsContact C-N 3.28Å; S403-E405 WeakPolarHBondContact CB-OE2 3.46Å; S403-E405 PolarHBondContact O-N 3.44Å; S403-E405 PolarHBondContact OG-OE2 3.23Å; S403-A406 PolarHBondContact O-N 3.34Å; S403-A406 VanDerWaalsContact O-N 3.16Å; S403-A406 PolarHBondContact OG-N 3.06Å; S403-R407 PolarHBondContact O-N 2.82Å
404	L	92.4	Very high	92	Very high	64 Å²	64	42.4 Å²	42.4	34%	0.335	23%	0.231	S	C	.	.	H	α-helix	trans	-56.7	-43.8	176.7	-179.7	59.3	0	0	0	111.5	A406 R407 E408	L404-A406 VanDerWaalsContact C-N 3.3Å; L404-A406 PolarHBondContact O-N 3.1Å; L404-R407 WeakPolarHBondContact O-CB 3.49Å; L404-R407 PolarHBondContact O-N 3.16Å; L404-E408 WeakPolarHBondContact O-CG 3.4Å; L404-E408 PolarHBondContact O-N 3.36Å
405	E	91.8	Very high	92.2	Very high	92 Å²	92	45.9 Å²	45.9	43%	0.43	25%	0.253	S	S	.	.	H	α-helix	trans	-68.4	-29.1	180	-46.4	78.6	-175.7	0	0	112.3	A356 S403 L409	A356-E405 HydrophobicContact CB-CB 4.2Å; S403-E405 VanDerWaalsContact C-N 3.28Å; S403-E405 WeakPolarHBondContact CB-OE2 3.46Å; S403-E405 PolarHBondContact O-N 3.44Å; S403-E405 PolarHBondContact OG-OE2 3.23Å; E405-L409 WeakPolarHBondContact O-CB 3.48Å; E405-L409 PolarHBondContact O-N 3.09Å
406	A	93.3	Very high	92.2	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.008	27%	0.265	C	S	.	.	H	α-helix	trans	-74.8	-40.1	174.4	0	0	0	0	0	111.6	A356 S403 L404 E408 L409 M410	A356-A406 VanDerWaalsContact CB-CA 3.45Å; A356-A406 HydrophobicContact CB-CB 3.67Å; S403-A406 PolarHBondContact O-N 3.34Å; S403-A406 VanDerWaalsContact O-N 3.16Å; S403-A406 PolarHBondContact OG-N 3.06Å; L404-A406 VanDerWaalsContact C-N 3.3Å; L404-A406 PolarHBondContact O-N 3.1Å; A406-E408 VanDerWaalsContact C-N 3.31Å; A406-E408 PolarHBondContact O-N 2.85Å; A406-L409 PolarHBondContact O-N 3.2Å; A406-M410 WeakPolarHBondContact O-CE 3.39Å; A406-M410 WeakPolarHBondContact O-CG 3.42Å; A406-M410 PolarHBondContact O-N 3.45Å
407	R	93.5	Very high	92.4	Very high	55 Å²	55	49.1 Å²	49.1	21%	0.208	27%	0.266	C	S	.	.	H	α-helix	trans	-58.8	-44.2	170.7	-173.8	178.4	64.2	62.3	-11.6	111.1	S403 L404 Q411 W422 R430	S403-R407 PolarHBondContact O-N 2.82Å; L404-R407 WeakPolarHBondContact O-CB 3.49Å; L404-R407 PolarHBondContact O-N 3.16Å; R407-Q411 WeakPolarHBondContact O-CB 3.5Å; R407-Q411 VanDerWaalsContact O-CG 3.27Å; R407-Q411 WeakPolarHBondContact O-CG 3.41Å; R407-Q411 PolarHBondContact O-N 3.17Å; R407-W422 HydrophobicContact CG-CH2 4.05Å; R407-W422 HydrophobicContact CG-CZ2 4.13Å; R407-R430 WeakPolarHBondContact CD-O 3.44Å
408	E	93.3	Very high	92.5	Very high	84 Å²	84	50 Å²	50	39%	0.393	27%	0.27	S	S	.	.	H	α-helix	trans	-67.3	-42.4	176.7	-72.3	177.6	172.4	0	0	113	L404 A406 M410 Q411 N412	L404-E408 WeakPolarHBondContact O-CG 3.4Å; L404-E408 PolarHBondContact O-N 3.36Å; A406-E408 VanDerWaalsContact C-N 3.31Å; A406-E408 PolarHBondContact O-N 2.85Å; E408-M410 VanDerWaalsContact C-N 3.34Å; E408-M410 PolarHBondContact O-N 3.24Å; E408-Q411 PolarHBondContact O-N 2.69Å; E408-N412 PolarHBondContact O-N 3.4Å; E408-N412 VanDerWaalsContact O-N 3.12Å; E408-N412 PolarHBondContact O-ND2 3.05Å
409	L	92.6	Very high	92.9	Very high	17 Å²	17	50.3 Å²	50.3	9%	0.089	27%	0.271	C	S	.	.	H	α-helix	trans	-58.9	-46.4	176.7	-177.1	66.6	0	0	0	110.9	L355 A356 K359 L371 E405 A406 N412 C413	L355-L409 HydrophobicContact CB-CD2 4.39Å; A356-L409 HydrophobicContact CB-CD2 4.33Å; K359-L409 HydrophobicContact CD-CD1 4.44Å; L371-L409 HydrophobicContact CD2-CG 4.31Å; E405-L409 WeakPolarHBondContact O-CB 3.48Å; E405-L409 PolarHBondContact O-N 3.09Å; A406-L409 PolarHBondContact O-N 3.2Å; L409-N412 PolarHBondContact O-N 2.95Å; L409-C413 WeakPolarHBondContact O-CB 3.41Å; L409-C413 PolarHBondContact O-N 3.01Å
410	M	93.3	Very high	93.1	Very high	3 Å²	3	54.8 Å²	54.8	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-64.6	-40.6	177	-68.8	-175.6	-62.7	0	0	112.9	F352 L371 L402 A406 E408 N412 L414 W422	F352-M410 HydrophobicContact CD2-SD 4.21Å; F352-M410 HydrophobicContact CE2-SD 4.46Å; F352-M410 HydrophobicContact CG-SD 4.46Å; L371-M410 HydrophobicContact CD1-CG 4.11Å; L371-M410 HydrophobicContact CD2-CG 4.08Å; L402-M410 HydrophobicContact CD1-CE 3.46Å; L402-M410 VanDerWaalsContact CD1-CE 3.46Å; L402-M410 HydrophobicContact CD1-SD 4.37Å; A406-M410 WeakPolarHBondContact O-CE 3.39Å; A406-M410 WeakPolarHBondContact O-CG 3.42Å; A406-M410 PolarHBondContact O-N 3.45Å; E408-M410 VanDerWaalsContact C-N 3.34Å; E408-M410 PolarHBondContact O-N 3.24Å; M410-N412 VanDerWaalsContact C-N 3.26Å; M410-N412 PolarHBondContact O-N 3.37Å; M410-L414 HydrophobicContact CB-CD1 3.79Å; M410-L414 HydrophobicContact CB-CG 4.15Å; M410-L414 HydrophobicContact CG-CD1 4.14Å; M410-L414 WeakPolarHBondContact O-CB 3.15Å; M410-L414 VanDerWaalsContact O-CG 3.28Å; M410-L414 WeakPolarHBondContact O-CG 3.47Å; M410-L414 PolarHBondContact O-N 2.82Å; M410-W422 HydrophobicContact CB-CD2 4.44Å; M410-W422 HydrophobicContact CB-CE3 4.29Å; M410-W422 HydrophobicContact CB-CH2 4.39Å; M410-W422 HydrophobicContact CB-CZ3 4.25Å; M410-W422 HydrophobicContact CE-CD2 4.26Å; M410-W422 VanDerWaalsContact CE-CE2 3.46Å; M410-W422 HydrophobicContact CE-CH2 4.37Å; M410-W422 HydrophobicContact CE-CZ2 3.55Å; M410-W422 HydrophobicContact SD-CD2 4.27Å; M410-W422 HydrophobicContact SD-CG 4.33Å
411	Q	93.1	Very high	93.2	Very high	105 Å²	105	55 Å²	55	49%	0.491	29%	0.293	S	S	.	.	H	α-helix	trans	-64.5	-28	178.6	-78.1	174.5	-17	0	0	113.8	R407 E408 W422	R407-Q411 WeakPolarHBondContact O-CB 3.5Å; R407-Q411 VanDerWaalsContact O-CG 3.27Å; R407-Q411 WeakPolarHBondContact O-CG 3.41Å; R407-Q411 PolarHBondContact O-N 3.17Å; E408-Q411 PolarHBondContact O-N 2.69Å; Q411-W422 HydrophobicContact CG-CH2 3.64Å; Q411-W422 HydrophobicContact CG-CZ3 3.65Å
412	N	92.4	Very high	93.4	Very high	135 Å²	135	54.3 Å²	54.3	72%	0.722	29%	0.289	S	S	*	.	H	α-helix	trans	-95.1	-24.4	-178.6	-70.5	-67.5	0	0	0	114	E408 L409 M410	E408-N412 PolarHBondContact O-N 3.4Å; E408-N412 VanDerWaalsContact O-N 3.12Å; E408-N412 PolarHBondContact O-ND2 3.05Å; L409-N412 PolarHBondContact O-N 2.95Å; M410-N412 VanDerWaalsContact C-N 3.26Å; M410-N412 PolarHBondContact O-N 3.37Å
413	C	93.1	Very high	93.5	Very high	35 Å²	35	57.8 Å²	57.8	24%	0.236	31%	0.306	C	S	.	.	H	α-helix	trans	-109.4	-28.2	-171.4	-63.1	0	0	0	0	115.3	P368 L371 H372 L409	P368-C413 HydrophobicContact CB-CB 4.24Å; L371-C413 HydrophobicContact CD2-CB 4.14Å; H372-C413 PolarHBondContact CE1-O 2.91Å; H372-C413 PolarHBondContact NE2-O 2.9Å; L409-C413 WeakPolarHBondContact O-CB 3.41Å; L409-C413 PolarHBondContact O-N 3.01Å
414	L	93.9	Very high	93.5	Very high	24 Å²	24	59.5 Å²	59.5	13%	0.126	32%	0.318	C	S	.	.			trans	-70.1	141	-173.4	-66.5	-176.9	0	0	0	113.2	L371 F375 M410 E418 W422	L371-L414 HydrophobicContact CD2-CD2 3.62Å; L371-L414 HydrophobicContact CD2-CG 4.16Å; L371-L414 HydrophobicContact CG-CD2 3.79Å; F375-L414 HydrophobicContact CD2-CD2 3.67Å; F375-L414 HydrophobicContact CE1-CD1 4.19Å; F375-L414 HydrophobicContact CE2-CD1 3.83Å; F375-L414 HydrophobicContact CE2-CD2 3.5Å; F375-L414 VanDerWaalsContact CE2-CD2 3.5Å; F375-L414 HydrophobicContact CE2-CG 4.31Å; F375-L414 HydrophobicContact CG-CD2 4.37Å; F375-L414 HydrophobicContact CZ-CD1 3.55Å; F375-L414 HydrophobicContact CZ-CD2 4.05Å; F375-L414 HydrophobicContact CZ-CG 4.47Å; M410-L414 HydrophobicContact CB-CD1 3.79Å; M410-L414 HydrophobicContact CB-CG 4.15Å; M410-L414 HydrophobicContact CG-CD1 4.14Å; M410-L414 WeakPolarHBondContact O-CB 3.15Å; M410-L414 VanDerWaalsContact O-CG 3.28Å; M410-L414 WeakPolarHBondContact O-CG 3.47Å; M410-L414 PolarHBondContact O-N 2.82Å; L414-E418 HydrophobicContact CB-CB 4.06Å; L414-E418 HydrophobicContact CD1-CB 4.39Å; L414-E418 HydrophobicContact CD2-CB 3.93Å; L414-E418 HydrophobicContact CG-CB 4.34Å; L414-W422 HydrophobicContact CD1-CB 4.16Å; L414-W422 HydrophobicContact CD1-CD2 4.47Å; L414-W422 HydrophobicContact CD1-CE3 4.23Å; L414-W422 HydrophobicContact CD1-CG 4.46Å
415	T	94.2	Very high	93.5	Very high	73 Å²	73	56.5 Å²	56.5	45%	0.448	30%	0.302	S	S	.	.			trans	-68	162.7	166.6	66.7	0	0	0	0	110.8	H417 E418 S419	T415-H417 PolarHBondContact O-N 3.14Å; T415-E418 VanDerWaalsContact CB-OE2 3.26Å; T415-E418 WeakPolarHBondContact CB-OE2 3.47Å; T415-E418 VanDerWaalsContact CG2-OE2 3.31Å; T415-E418 WeakPolarHBondContact CG2-OE2 3.05Å; T415-E418 PolarHBondContact N-OE2 2.68Å; T415-E418 PolarHBondContact O-N 2.93Å; T415-E418 VanDerWaalsContact O-N 3.11Å; T415-E418 VanDerWaalsContact OG1-CD 3.31Å; T415-E418 WeakPolarHBondContact OG1-CG 3.26Å; T415-E418 PolarHBondContact OG1-OE2 3.11Å; T415-S419 WeakPolarHBondContact O-CB 3.29Å; T415-S419 PolarHBondContact O-N 2.66Å
416	S	93.1	Very high	93.4	Very high	99 Å²	99	52.8 Å²	52.8	69%	0.692	29%	0.289	S	S	*	.	H	α-helix	trans	-53.1	-40.9	179.8	-44.7	0	0	0	0	113.1	S419 D420	S416-S419 WeakPolarHBondContact O-CB 3.41Å; S416-S419 PolarHBondContact O-N 3.07Å; S416-D420 PolarHBondContact O-N 3.49Å
417	H	92.8	Very high	93.2	Very high	131 Å²	131	56.7 Å²	56.7	61%	0.606	31%	0.307	S	S	*	.	H	α-helix	trans	-67.9	-40.2	-179.6	-179.3	42.7	0	0	0	112.7	T415 S419 D420 I421	T415-H417 PolarHBondContact O-N 3.14Å; H417-S419 VanDerWaalsContact C-N 3.35Å; H417-D420 PolarHBondContact O-N 3.27Å; H417-I421 WeakPolarHBondContact O-CG1 3.25Å; H417-I421 PolarHBondContact O-N 3.15Å
418	E	95.8	Very high	92.9	Very high	19 Å²	19	54.3 Å²	54.3	9%	0.089	30%	0.3	C	S	.	.	H	α-helix	trans	-71.3	-34.2	176.6	-62.6	163.9	122.7	0	0	111.3	H372 F375 L414 T415 I421 W422	H372-E418 WeakPolarHBondContact CA-OE1 3.25Å; H372-E418 IonicContact CE1-OE1 3.21Å; H372-E418 IonicContact CE1-OE2 3.4Å; H372-E418 PolarHBondContact CE1-OE2 3.38Å; H372-E418 VanDerWaalsContact CE1-OE2 3.3Å; H372-E418 IonicContact CG-OE1 2.72Å; H372-E418 VanDerWaalsContact ND1-CD 3.26Å; H372-E418 IonicContact ND1-OE1 2.78Å; H372-E418 PolarHBondContact ND1-OE1 3.12Å; H372-E418 IonicContact ND1-OE2 3.17Å; H372-E418 PolarHBondContact ND1-OE2 2.83Å; F375-E418 HydrophobicContact CB-CB 4.32Å; F375-E418 HydrophobicContact CB-CG 3.77Å; F375-E418 HydrophobicContact CD1-CB 3.66Å; F375-E418 HydrophobicContact CD1-CG 4.03Å; F375-E418 HydrophobicContact CE1-CB 4.13Å; F375-E418 WeakPolarHBondContact CE1-O 3.34Å; F375-E418 HydrophobicContact CG-CB 3.88Å; F375-E418 HydrophobicContact CG-CG 3.91Å; L414-E418 HydrophobicContact CB-CB 4.06Å; L414-E418 HydrophobicContact CD1-CB 4.39Å; L414-E418 HydrophobicContact CD2-CB 3.93Å; L414-E418 HydrophobicContact CG-CB 4.34Å; T415-E418 VanDerWaalsContact CB-OE2 3.26Å; T415-E418 WeakPolarHBondContact CB-OE2 3.47Å; T415-E418 VanDerWaalsContact CG2-OE2 3.31Å; T415-E418 WeakPolarHBondContact CG2-OE2 3.05Å; T415-E418 PolarHBondContact N-OE2 2.68Å; T415-E418 PolarHBondContact O-N 2.93Å; T415-E418 VanDerWaalsContact O-N 3.11Å; T415-E418 VanDerWaalsContact OG1-CD 3.31Å; T415-E418 WeakPolarHBondContact OG1-CG 3.26Å; T415-E418 PolarHBondContact OG1-OE2 3.11Å; E418-I421 PolarHBondContact O-N 2.85Å; E418-W422 WeakPolarHBondContact O-CB 3.46Å; E418-W422 PolarHBondContact O-N 3.5Å
419	S	95.1	Very high	93	Very high	38 Å²	38	50.3 Å²	50.3	27%	0.266	28%	0.281	S	S	.	.	H	α-helix	trans	-63.3	-43	171.5	-164.3	0	0	0	0	111.5	T415 S416 H417 I421 W422 M423	T415-S419 WeakPolarHBondContact O-CB 3.29Å; T415-S419 PolarHBondContact O-N 2.66Å; S416-S419 WeakPolarHBondContact O-CB 3.41Å; S416-S419 PolarHBondContact O-N 3.07Å; H417-S419 VanDerWaalsContact C-N 3.35Å; S419-I421 PolarHBondContact O-N 3.08Å; S419-W422 PolarHBondContact O-N 3.03Å; S419-M423 WeakPolarHBondContact O-CB 3.35Å; S419-M423 WeakPolarHBondContact O-CG 3.41Å; S419-M423 PolarHBondContact O-N 3.2Å
420	D	94.2	Very high	92.8	Very high	112 Å²	112	54.1 Å²	54.1	60%	0.599	29%	0.294	S	S	*	.	H	α-helix	trans	-60.2	-44.3	172.5	-70.6	-32.4	0	0	0	111.7	S416 H417 M423 S424	S416-D420 PolarHBondContact O-N 3.49Å; H417-D420 PolarHBondContact O-N 3.27Å; D420-M423 PolarHBondContact O-N 2.98Å; D420-S424 PolarHBondContact O-N 3.39Å; D420-S424 VanDerWaalsContact O-N 3.08Å
421	I	94.8	Very high	92.5	Very high	22 Å²	22	55.4 Å²	55.4	11%	0.113	30%	0.302	C	S	.	.	H	α-helix	trans	-58.5	-50.5	174	-69.5	165.3	0	0	0	110.1	F375 L378 A379 L382 H417 E418 S419 M423 S424 L425	F375-I421 HydrophobicContact CD1-CB 4.2Å; F375-I421 HydrophobicContact CD1-CG2 3.97Å; F375-I421 HydrophobicContact CE1-CB 4.22Å; F375-I421 HydrophobicContact CE1-CG2 3.97Å; L378-I421 HydrophobicContact CD2-CG2 4.45Å; A379-I421 HydrophobicContact CB-CD1 4.19Å; L382-I421 HydrophobicContact CD1-CG2 3.74Å; H417-I421 WeakPolarHBondContact O-CG1 3.25Å; H417-I421 PolarHBondContact O-N 3.15Å; E418-I421 PolarHBondContact O-N 2.85Å; S419-I421 PolarHBondContact O-N 3.08Å; I421-M423 VanDerWaalsContact C-N 3.35Å; I421-M423 PolarHBondContact O-N 3.29Å; I421-S424 WeakPolarHBondContact O-CB 3.41Å; I421-S424 PolarHBondContact O-N 3.09Å; I421-S424 VanDerWaalsContact O-N 3.08Å; I421-S424 PolarHBondContact O-OG 3.41Å; I421-L425 PolarHBondContact O-N 3.21Å
422	W	95.5	Very high	92.3	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-58.8	-43.9	179.6	175.6	40	0	0	0	112.2	F375 R407 M410 Q411 L414 E418 S419 S424 L425 W429 R430	F375-W422 HydrophobicContact CE1-CB 4.02Å; F375-W422 HydrophobicContact CZ-CB 4.03Å; R407-W422 HydrophobicContact CG-CH2 4.05Å; R407-W422 HydrophobicContact CG-CZ2 4.13Å; M410-W422 HydrophobicContact CB-CD2 4.44Å; M410-W422 HydrophobicContact CB-CE3 4.29Å; M410-W422 HydrophobicContact CB-CH2 4.39Å; M410-W422 HydrophobicContact CB-CZ3 4.25Å; M410-W422 HydrophobicContact CE-CD2 4.26Å; M410-W422 VanDerWaalsContact CE-CE2 3.46Å; M410-W422 HydrophobicContact CE-CH2 4.37Å; M410-W422 HydrophobicContact CE-CZ2 3.55Å; M410-W422 HydrophobicContact SD-CD2 4.27Å; M410-W422 HydrophobicContact SD-CG 4.33Å; Q411-W422 HydrophobicContact CG-CH2 3.64Å; Q411-W422 HydrophobicContact CG-CZ3 3.65Å; L414-W422 HydrophobicContact CD1-CB 4.16Å; L414-W422 HydrophobicContact CD1-CD2 4.47Å; L414-W422 HydrophobicContact CD1-CE3 4.23Å; L414-W422 HydrophobicContact CD1-CG 4.46Å; E418-W422 WeakPolarHBondContact O-CB 3.46Å; E418-W422 PolarHBondContact O-N 3.5Å; S419-W422 PolarHBondContact O-N 3.03Å; W422-S424 PolarHBondContact O-N 3.2Å; W422-L425 WeakPolarHBondContact O-CB 3.1Å; W422-L425 PolarHBondContact O-N 3.23Å; W422-L425 VanDerWaalsContact O-N 3.16Å; W422-W429 PolarHBondContact NE1-O 2.77Å; W422-R430 HydrophobicContact CZ2-CG 3.98Å
423	M	92.8	Very high	91.9	Very high	76 Å²	76	46.3 Å²	46.3	37%	0.374	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-30.4	176.5	-68.6	-68.2	164.6	0	0	112.7	S419 D420 I421 L425 R430	S419-M423 WeakPolarHBondContact O-CB 3.35Å; S419-M423 WeakPolarHBondContact O-CG 3.41Å; S419-M423 PolarHBondContact O-N 3.2Å; D420-M423 PolarHBondContact O-N 2.98Å; I421-M423 VanDerWaalsContact C-N 3.35Å; I421-M423 PolarHBondContact O-N 3.29Å; M423-L425 VanDerWaalsContact C-N 3.33Å; M423-L425 PolarHBondContact O-N 2.89Å; M423-R430 WeakPolarHBondContact SD-CD 3.36Å; M423-R430 PolarHBondContact SD-NH1 2.93Å
424	S	92.4	Very high	91.4	Very high	63 Å²	63	51.1 Å²	51.1	44%	0.441	28%	0.279	S	S	.	.	H	α-helix	trans	-73.6	-16.5	176.4	84	0	0	0	0	114.8	D420 I421 W422 G426	D420-S424 PolarHBondContact O-N 3.39Å; D420-S424 VanDerWaalsContact O-N 3.08Å; I421-S424 WeakPolarHBondContact O-CB 3.41Å; I421-S424 PolarHBondContact O-N 3.09Å; I421-S424 VanDerWaalsContact O-N 3.08Å; I421-S424 PolarHBondContact O-OG 3.41Å; W422-S424 PolarHBondContact O-N 3.2Å; S424-G426 PolarHBondContact O-N 3.13Å
425	L	91.9	Very high	90.8	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-16.2	-178.4	-57.6	178.4	0	0	0	113.5	L378 L382 A394 P395 I421 W422 M423 W429	L378-L425 HydrophobicContact CD2-CD1 4.15Å; L382-L425 HydrophobicContact CD1-CD2 3.72Å; L382-L425 HydrophobicContact CD2-CD2 3.76Å; L382-L425 HydrophobicContact CG-CD2 4.32Å; A394-L425 CarbonylContact C-O 3.53Å; A394-L425 HydrophobicContact CB-CB 4.44Å; A394-L425 HydrophobicContact CB-CD2 3.84Å; P395-L425 VanDerWaalsContact CA-O 3.29Å; P395-L425 WeakPolarHBondContact CA-O 3.25Å; P395-L425 WeakPolarHBondContact CG-O 3.2Å; I421-L425 PolarHBondContact O-N 3.21Å; W422-L425 WeakPolarHBondContact O-CB 3.1Å; W422-L425 PolarHBondContact O-N 3.23Å; W422-L425 VanDerWaalsContact O-N 3.16Å; M423-L425 VanDerWaalsContact C-N 3.33Å; M423-L425 PolarHBondContact O-N 2.89Å; L425-W429 HydrophobicContact CB-CB 3.74Å; L425-W429 HydrophobicContact CB-CD2 3.81Å; L425-W429 HydrophobicContact CB-CE3 4.42Å; L425-W429 HydrophobicContact CB-CG 3.49Å; L425-W429 VanDerWaalsContact CB-CG 3.49Å; L425-W429 HydrophobicContact CD1-CB 4.33Å; L425-W429 HydrophobicContact CD1-CD2 3.65Å; L425-W429 HydrophobicContact CD1-CE3 3.36Å; L425-W429 HydrophobicContact CD1-CG 4.1Å; L425-W429 HydrophobicContact CD1-CH2 4.44Å; L425-W429 HydrophobicContact CD1-CZ3 3.8Å; L425-W429 HydrophobicContact CG-CD2 4.29Å; L425-W429 HydrophobicContact CG-CE3 4.44Å; L425-W429 HydrophobicContact CG-CG 4.42Å
426	G	90.8	Very high	90.5	Very high	15 Å²	15	52.5 Å²	52.5	16%	0.155	28%	0.281	C	S	.	.			trans	104.9	-166.6	174.9	0	0	0	0	0	115.1	S424 R430	S424-G426 PolarHBondContact O-N 3.13Å; G426-R430 PolarHBondContact O-NE 3.47Å
427	E	88.9	Confident	89.9	Confident	83 Å²	83	53.7 Å²	53.7	39%	0.388	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-69.5	-49.2	-175.4	-177.7	-167.3	-142.2	0	0	112.4	W429 R430 T431 W436 K438	E427-W429 PolarHBondContact O-N 2.87Å; E427-R430 PolarHBondContact O-N 3.15Å; E427-T431 PolarHBondContact O-N 2.9Å; E427-T431 PolarHBondContact O-OG1 3.3Å; E427-W436 HydrophobicContact CG-CZ3 4.28Å; E427-K438 VanDerWaalsContact CD-NZ 3.32Å; E427-K438 IonicContact OE1-NZ 2.99Å; E427-K438 PolarHBondContact OE1-NZ 3.42Å; E427-K438 IonicContact OE2-NZ 3.97Å; E427-K438 PolarHBondContact OE2-NZ 3.46Å
428	A	87.8	Confident	89.2	Confident	5 Å²	5	52 Å²	52	4%	0.041	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-66.1	-3.8	-176.1	0	0	0	0	0	115.1	K349 L401 W436	K349-A428 WeakPolarHBondContact CE-O 3.49Å; K349-A428 PolarHBondContact NZ-O 3.13Å; L401-A428 HydrophobicContact CD2-CB 4.5Å; A428-W436 HydrophobicContact CB-CH2 3.87Å; A428-W436 HydrophobicContact CB-CZ3 4.01Å
429	W	93.9	Very high	88.4	Confident	0 Å²	0	57 Å²	57	0%	0	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-103.8	1.1	173.2	-65.9	77.4	0	0	0	112.7	L345 F348 K349 F352 A394 V397 L402 W422 L425 E427	L345-W429 HydrophobicContact CB-CH2 4.15Å; L345-W429 HydrophobicContact CB-CZ2 4.04Å; L345-W429 HydrophobicContact CD2-CH2 3.86Å; L345-W429 HydrophobicContact CD2-CZ2 4.04Å; L345-W429 WeakPolarHBondContact O-CH2 3.49Å; F348-W429 HydrophobicContact CB-CH2 4.21Å; F348-W429 HydrophobicContact CB-CZ3 4.28Å; K349-W429 HydrophobicContact CD-CD2 3.9Å; K349-W429 HydrophobicContact CD-CE3 4.04Å; K349-W429 HydrophobicContact CD-CH2 3.97Å; K349-W429 HydrophobicContact CD-CZ2 3.79Å; K349-W429 HydrophobicContact CD-CZ3 4.09Å; K349-W429 HydrophobicContact CG-CD2 3.96Å; K349-W429 HydrophobicContact CG-CE3 3.56Å; K349-W429 HydrophobicContact CG-CH2 3.42Å; K349-W429 VanDerWaalsContact CG-CH2 3.42Å; K349-W429 HydrophobicContact CG-CZ2 3.8Å; K349-W429 HydrophobicContact CG-CZ3 3.28Å; F352-W429 HydrophobicContact CD2-CZ3 4.41Å; F352-W429 HydrophobicContact CE2-CE3 4.38Å; F352-W429 AromaticContact CE2-CZ3 3.98Å; F352-W429 HydrophobicContact CE2-CZ3 3.98Å; A394-W429 HydrophobicContact CB-CZ2 4.06Å; A394-W429 PolarHBondContact O-NE1 2.88Å; V397-W429 HydrophobicContact CB-CZ2 4.27Å; L402-W429 HydrophobicContact CD1-CE3 4.47Å; L402-W429 VanDerWaalsContact CD1-O 3.26Å; L402-W429 WeakPolarHBondContact CD1-O 3.26Å; W422-W429 PolarHBondContact NE1-O 2.77Å; L425-W429 HydrophobicContact CB-CB 3.74Å; L425-W429 HydrophobicContact CB-CD2 3.81Å; L425-W429 HydrophobicContact CB-CE3 4.42Å; L425-W429 HydrophobicContact CB-CG 3.49Å; L425-W429 VanDerWaalsContact CB-CG 3.49Å; L425-W429 HydrophobicContact CD1-CB 4.33Å; L425-W429 HydrophobicContact CD1-CD2 3.65Å; L425-W429 HydrophobicContact CD1-CE3 3.36Å; L425-W429 HydrophobicContact CD1-CG 4.1Å; L425-W429 HydrophobicContact CD1-CH2 4.44Å; L425-W429 HydrophobicContact CD1-CZ3 3.8Å; L425-W429 HydrophobicContact CG-CD2 4.29Å; L425-W429 HydrophobicContact CG-CE3 4.44Å; L425-W429 HydrophobicContact CG-CG 4.42Å; E427-W429 PolarHBondContact O-N 2.87Å
430	R	90.1	Very high	87.6	Confident	97 Å²	97	60.9 Å²	60.9	37%	0.366	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.5	-26.7	-175.8	-64.7	-177.2	-67.6	165.1	6.6	113.2	R407 W422 M423 G426 E427	R407-R430 WeakPolarHBondContact CD-O 3.44Å; W422-R430 HydrophobicContact CZ2-CG 3.98Å; M423-R430 WeakPolarHBondContact SD-CD 3.36Å; M423-R430 PolarHBondContact SD-NH1 2.93Å; G426-R430 PolarHBondContact O-NE 3.47Å; E427-R430 PolarHBondContact O-N 3.15Å
431	T	87.1	Confident	86.9	Confident	30 Å²	30	57 Å²	57	18%	0.184	31%	0.307	C	S	.	.	S	Bend	trans	-88.2	117.7	174.4	-51.5	0	0	0	0	110.2	E427 D435 W436	E427-T431 PolarHBondContact O-N 2.9Å; E427-T431 PolarHBondContact O-OG1 3.3Å; T431-D435 VanDerWaalsContact CG2-C 3.48Å; T431-D435 HydrophobicContact CG2-CB 3.65Å; T431-D435 VanDerWaalsContact CG2-O 3.29Å; T431-D435 WeakPolarHBondContact CG2-O 3.41Å; T431-W436 HydrophobicContact CG2-CB 4.46Å; T431-W436 HydrophobicContact CG2-CE3 3.88Å
432	P	87.8	Confident	86.1	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.013	33%	0.334	C	S	.	.			trans	-76.6	171.1	174.6	36.3	-39.4	0	0	0	112	L402 E434 D435 W436	L402-P432 VanDerWaalsContact O-CA 3.25Å; L402-P432 WeakPolarHBondContact O-CA 3.43Å; L402-P432 WeakPolarHBondContact O-CB 3.35Å; P432-E434 WeakPolarHBondContact CB-OE2 3.25Å; P432-E434 PolarHBondContact O-N 2.84Å; P432-E434 VanDerWaalsContact O-N 3.15Å; P432-D435 WeakPolarHBondContact CD-OD2 3.3Å; P432-D435 HydrophobicContact CG-CB 4.22Å; P432-D435 VanDerWaalsContact CG-OD2 3.25Å; P432-D435 WeakPolarHBondContact CG-OD2 3.45Å; P432-D435 PolarHBondContact O-N 2.86Å; P432-W436 PolarHBondContact O-N 3.39Å
433	P	83.2	Confident	85.2	Confident	47 Å²	47	66.2 Å²	66.2	31%	0.305	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-30.9	-175.1	-24.7	33.3	0	0	0	115	L401 L402 W436 L440	L401-P433 HydrophobicContact CB-CG 4.09Å; L401-P433 HydrophobicContact CD1-CB 4.36Å; L401-P433 HydrophobicContact CD1-CG 4.42Å; L402-P433 WeakPolarHBondContact O-CD 3.33Å; P433-W436 WeakPolarHBondContact O-CB 3.16Å; P433-W436 PolarHBondContact O-N 2.98Å; P433-L440 HydrophobicContact CB-CD2 4.36Å
434	E	83	Confident	84.9	Confident	136 Å²	136	64.2 Å²	64.2	64%	0.636	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-34.2	-175.5	-55.9	68	-141.9	0	0	111.6	P432	P432-E434 WeakPolarHBondContact CB-OE2 3.25Å; P432-E434 PolarHBondContact O-N 2.84Å; P432-E434 VanDerWaalsContact O-N 3.15Å
435	D	81.9	Confident	84.5	Confident	95 Å²	95	67.8 Å²	67.8	51%	0.508	36%	0.361	S	S	.	.	S	Bend	trans	-90.4	0.8	177.6	-63.7	-43.4	0	0	0	112.3	T431 P432 T437	T431-D435 VanDerWaalsContact CG2-C 3.48Å; T431-D435 HydrophobicContact CG2-CB 3.65Å; T431-D435 VanDerWaalsContact CG2-O 3.29Å; T431-D435 WeakPolarHBondContact CG2-O 3.41Å; P432-D435 WeakPolarHBondContact CD-OD2 3.3Å; P432-D435 HydrophobicContact CG-CB 4.22Å; P432-D435 VanDerWaalsContact CG-OD2 3.25Å; P432-D435 WeakPolarHBondContact CG-OD2 3.45Å; P432-D435 PolarHBondContact O-N 2.86Å; D435-T437 PolarHBondContact O-N 3.06Å; D435-T437 VanDerWaalsContact O-N 3.13Å
436	W	86.8	Confident	84.3	Confident	31 Å²	31	67.9 Å²	67.9	12%	0.117	36%	0.361	C	S	.	.			trans	-78.3	100.1	-171.4	-171.6	-108.2	0	0	0	112.3	L401 E427 A428 T431 P432 P433 K438 P439 L440	L401-W436 HydrophobicContact CD1-CB 3.94Å; L401-W436 HydrophobicContact CD1-CD2 3.95Å; L401-W436 HydrophobicContact CD1-CG 3.66Å; L401-W436 HydrophobicContact CD2-CD2 3.96Å; L401-W436 HydrophobicContact CD2-CE3 3.9Å; L401-W436 HydrophobicContact CD2-CH2 4.46Å; L401-W436 HydrophobicContact CD2-CZ2 4.49Å; L401-W436 HydrophobicContact CD2-CZ3 4.17Å; E427-W436 HydrophobicContact CG-CZ3 4.28Å; A428-W436 HydrophobicContact CB-CH2 3.87Å; A428-W436 HydrophobicContact CB-CZ3 4.01Å; T431-W436 HydrophobicContact CG2-CB 4.46Å; T431-W436 HydrophobicContact CG2-CE3 3.88Å; P432-W436 PolarHBondContact O-N 3.39Å; P433-W436 WeakPolarHBondContact O-CB 3.16Å; P433-W436 PolarHBondContact O-N 2.98Å; W436-K438 HydrophobicContact CH2-CD 4.11Å; W436-K438 HydrophobicContact CZ2-CB 4Å; W436-K438 HydrophobicContact CZ2-CD 3.92Å; W436-K438 PolarHBondContact NE1-O 2.9Å; W436-K438 PolarHBondContact O-N 2.93Å; W436-P439 PolarHBondContact NE1-O 2.94Å; W436-P439 VanDerWaalsContact NE1-O 3.1Å; W436-L440 HydrophobicContact CB-CD2 4.42Å
437	T	81	Confident	84.2	Confident	123 Å²	123	71.4 Å²	71.4	76%	0.755	38%	0.376	S	S	*	.			trans	-72	-6.2	-175.3	57.7	0	0	0	0	115.8	D435	D435-T437 PolarHBondContact O-N 3.06Å; D435-T437 VanDerWaalsContact O-N 3.13Å
438	K	79.4	Confident	84.3	Confident	96 Å²	96	67.8 Å²	67.8	42%	0.417	36%	0.359	S	S	.	.	S	Bend	trans	-106	167	-177.9	-69	157.4	-171.2	169.6	0	109.1	E427 W436 L440	E427-K438 VanDerWaalsContact CD-NZ 3.32Å; E427-K438 IonicContact OE1-NZ 2.99Å; E427-K438 PolarHBondContact OE1-NZ 3.42Å; E427-K438 IonicContact OE2-NZ 3.97Å; E427-K438 PolarHBondContact OE2-NZ 3.46Å; W436-K438 HydrophobicContact CH2-CD 4.11Å; W436-K438 HydrophobicContact CZ2-CB 4Å; W436-K438 HydrophobicContact CZ2-CD 3.92Å; W436-K438 PolarHBondContact NE1-O 2.9Å; W436-K438 PolarHBondContact O-N 2.93Å; K438-L440 PolarHBondContact O-N 2.97Å
439	P	78.9	Confident	84	Confident	123 Å²	123	73 Å²	73	80%	0.799	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-51.1	132.8	170.9	-27.1	35.9	0	0	0	110.9	W436	W436-P439 PolarHBondContact NE1-O 2.94Å; W436-P439 VanDerWaalsContact NE1-O 3.1Å
440	L	76.9	Confident	83.3	Confident	121 Å²	121	76.8 Å²	76.8	63%	0.634	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-59.4	129.8	177.9	-76	170.1	0	0	0	109.2	L401 P433 W436 K438	L401-L440 HydrophobicContact CD1-CD2 4.03Å; P433-L440 HydrophobicContact CB-CD2 4.36Å; W436-L440 HydrophobicContact CB-CD2 4.42Å; K438-L440 PolarHBondContact O-N 2.97Å
441	P	80	Confident	82.9	Confident	29 Å²	29	74.7 Å²	74.7	19%	0.188	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-73.8	153.9	-176.3	34	-37.5	0	0	0	110.4	A398 L401	A398-P441 HydrophobicContact CB-CB 4.15Å; A398-P441 HydrophobicContact CB-CG 4.37Å; L401-P441 HydrophobicContact CD1-CG 4.24Å; L401-P441 HydrophobicContact CG-CG 4.02Å
442	P	77.2	Confident	82.7	Confident	105 Å²	105	76.3 Å²	76.3	68%	0.682	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-54.8	140.4	-177.9	-27.6	35.3	0	0	0	112.8	S399 Y444	S399-P442 WeakPolarHBondContact CB-O 3.33Å; S399-P442 PolarHBondContact OG-O 3.3Å; P442-Y444 PolarHBondContact O-N 3.13Å
443	P	77.7	Confident	82.6	Confident	113 Å²	113	77.3 Å²	77.3	73%	0.734	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-54.1	126.4	-179.5	-27.6	35	0	0	0	112.3	R445	P443-R445 PolarHBondContact O-N 3.39Å
444	Y	87.3	Confident	82.2	Confident	34 Å²	34	75.8 Å²	75.8	13%	0.133	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-70.5	122.3	178.9	-177.7	-131	0	0	0	110.5	D343 K346 K347 L350 S399 P400 P442 P446	D343-Y444 PolarHBondContact OD1-OH 3.14Å; K346-Y444 HydrophobicContact CB-CD1 4.28Å; K346-Y444 HydrophobicContact CB-CD2 4.29Å; K346-Y444 HydrophobicContact CB-CE1 3.74Å; K346-Y444 HydrophobicContact CB-CE2 3.77Å; K346-Y444 VanDerWaalsContact CB-CZ 3.46Å; K346-Y444 HydrophobicContact CD-CD2 3.73Å; K346-Y444 HydrophobicContact CD-CE2 3.45Å; K346-Y444 VanDerWaalsContact CD-CE2 3.45Å; K346-Y444 HydrophobicContact CG-CE2 4.25Å; K347-Y444 WeakPolarHBondContact CG-OH 3.39Å; L350-Y444 HydrophobicContact CB-CD1 4.41Å; L350-Y444 HydrophobicContact CB-CE1 4.3Å; L350-Y444 HydrophobicContact CD2-CD1 4.27Å; L350-Y444 HydrophobicContact CD2-CE1 4.02Å; S399-Y444 PolarHBondContact OG-N 2.98Å; P400-Y444 HydrophobicContact CG-CD1 3.99Å; P400-Y444 HydrophobicContact CG-CG 4.43Å; P442-Y444 PolarHBondContact O-N 3.13Å; Y444-P446 HydrophobicContact CE1-CB 3.75Å; Y444-P446 HydrophobicContact CE1-CG 4.24Å
445	R	83.4	Confident	81.9	Confident	139 Å²	139	72.7 Å²	72.7	53%	0.525	40%	0.401	S	S	.	.			trans	-111.2	97.4	166.7	-60.9	-171.3	-168.9	-116.7	-2.5	107.5	P443 Y455	P443-R445 PolarHBondContact O-N 3.39Å; R445-Y455 PolarHBondContact NH1-O 2.63Å
446	P	88	Confident	81.2	Confident	1 Å²	1	70 Å²	70	1%	0.006	40%	0.395	C	S	.	.			trans	-58.2	145.4	172.8	26.2	-38.9	0	0	0	111.3	L350 Y444 F448 P454 Y455	L350-P446 HydrophobicContact CD2-CB 4.09Å; L350-P446 HydrophobicContact CD2-CG 3.63Å; Y444-P446 HydrophobicContact CE1-CB 3.75Å; Y444-P446 HydrophobicContact CE1-CG 4.24Å; P446-F448 HydrophobicContact CB-CD2 4.45Å; P446-F448 HydrophobicContact CB-CE1 4.44Å; P446-F448 HydrophobicContact CB-CE2 3.78Å; P446-F448 HydrophobicContact CB-CZ 3.77Å; P446-F448 HydrophobicContact CG-CE2 3.95Å; P446-F448 HydrophobicContact CG-CZ 4.11Å; P446-P454 HydrophobicContact CG-CG 4.04Å; P446-Y455 HydrophobicContact CG-CD2 4.24Å; P446-Y455 HydrophobicContact CG-CE2 4.07Å
447	I	87.9	Confident	80.1	Confident	90 Å²	90	73.3 Å²	73.3	46%	0.462	42%	0.419	S	S	.	.			trans	-123.5	126.3	160.8	-57.6	174.7	0	0	0	105.5	K347 F452 A453 V457	K347-I447 WeakPolarHBondContact CE-O 3.46Å; K347-I447 PolarHBondContact NZ-O 2.82Å; I447-F452 WeakPolarHBondContact CA-O 3.44Å; I447-A453 HydrophobicContact CG1-CB 4.45Å; I447-V457 HydrophobicContact CD1-CG1 4.14Å
448	F	91.2	Very high	78.6	Confident	6 Å²	6	71.2 Å²	71.2	3%	0.026	41%	0.414	C	S	.	.			trans	-93.1	165	-177.8	-64.2	-79	0	0	0	111.6	T277 R280 C281 K347 P446 D450 G451 F452 P454	T277-F448 HydrophobicContact CG2-CE2 4.09Å; T277-F448 HydrophobicContact CG2-CZ 3.91Å; R280-F448 HydrophobicContact CB-CB 4.47Å; R280-F448 HydrophobicContact CB-CD1 3.72Å; R280-F448 HydrophobicContact CB-CD2 4.04Å; R280-F448 HydrophobicContact CB-CE1 3.88Å; R280-F448 HydrophobicContact CB-CE2 4.17Å; R280-F448 HydrophobicContact CB-CG 3.81Å; R280-F448 HydrophobicContact CB-CZ 4.09Å; R280-F448 WeakPolarHBondContact O-CD1 3.37Å; C281-F448 HydrophobicContact CB-CE1 4.34Å; C281-F448 VanDerWaalsContact SG-CE1 3.53Å; K347-F448 HydrophobicContact CD-CD1 4.3Å; K347-F448 HydrophobicContact CD-CE1 4.15Å; K347-F448 HydrophobicContact CG-CE1 4.3Å; P446-F448 HydrophobicContact CB-CD2 4.45Å; P446-F448 HydrophobicContact CB-CE1 4.44Å; P446-F448 HydrophobicContact CB-CE2 3.78Å; P446-F448 HydrophobicContact CB-CZ 3.77Å; P446-F448 HydrophobicContact CG-CE2 3.95Å; P446-F448 HydrophobicContact CG-CZ 4.11Å; F448-D450 WeakPolarHBondContact CB-OD1 3.43Å; F448-D450 PolarHBondContact O-N 3.27Å; F448-D450 VanDerWaalsContact O-N 3.09Å; F448-G451 PolarHBondContact O-N 3.15Å; F448-F452 HydrophobicContact CB-CB 4.34Å; F448-F452 HydrophobicContact CD2-CB 4.23Å; F448-F452 AromaticContact CD2-CD1 3.69Å; F448-F452 HydrophobicContact CD2-CD1 3.69Å; F448-F452 HydrophobicContact CD2-CG 4.41Å; F448-F452 WeakPolarHBondContact CD2-O 3.42Å; F448-F452 HydrophobicContact CE2-CD1 4.04Å; F448-F452 PolarHBondContact N-O 2.91Å; F448-P454 HydrophobicContact CE2-CG 4.16Å
449	N	81.6	Confident	76.7	Confident	115 Å²	115	73.8 Å²	73.8	62%	0.615	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-15	-174.9	-169.7	111.6	0	0	0	113.9	D284	D284-N449 WeakPolarHBondContact OD1-CB 3.2Å; D284-N449 PolarHBondContact OD1-N 3.07Å; D284-N449 PolarHBondContact OD2-N 3.48Å
450	D	79.1	Confident	74.9	Confident	80 Å²	80	77.4 Å²	77.4	43%	0.428	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-2.8	172.6	61.3	-4.9	0	0	0	113.8	R280 F448 F452	R280-D450 WeakPolarHBondContact CD-OD2 3.35Å; R280-D450 IonicContact CZ-OD2 2.91Å; R280-D450 IonicContact NE-OD2 2.85Å; R280-D450 IonicContact NH1-OD2 3.72Å; R280-D450 PolarHBondContact NH1-OD2 3.22Å; F448-D450 WeakPolarHBondContact CB-OD1 3.43Å; F448-D450 PolarHBondContact O-N 3.27Å; F448-D450 VanDerWaalsContact O-N 3.09Å; D450-F452 WeakPolarHBondContact OD1-CB 3.35Å; D450-F452 PolarHBondContact OD1-N 3.15Å
451	G	80.9	Confident	72.7	Confident	53 Å²	53	75.5 Å²	75.5	55%	0.546	43%	0.431	S	S	.	.			trans	88.1	1.5	-174.2	0	0	0	0	0	114.5	F448	F448-G451 PolarHBondContact O-N 3.15Å
452	F	83.8	Confident	70.6	Confident	64 Å²	64	83.1 Å²	83.1	28%	0.281	47%	0.467	S	S	.	.			trans	-63.4	136.8	176.1	-176.1	-119.5	0	0	0	111.1	R280 I447 F448 D450 P454	R280-F452 HydrophobicContact CG-CD1 4.09Å; I447-F452 WeakPolarHBondContact CA-O 3.44Å; F448-F452 HydrophobicContact CB-CB 4.34Å; F448-F452 HydrophobicContact CD2-CB 4.23Å; F448-F452 AromaticContact CD2-CD1 3.69Å; F448-F452 HydrophobicContact CD2-CD1 3.69Å; F448-F452 HydrophobicContact CD2-CG 4.41Å; F448-F452 WeakPolarHBondContact CD2-O 3.42Å; F448-F452 HydrophobicContact CE2-CD1 4.04Å; F448-F452 PolarHBondContact N-O 2.91Å; D450-F452 WeakPolarHBondContact OD1-CB 3.35Å; D450-F452 PolarHBondContact OD1-N 3.15Å; F452-P454 HydrophobicContact CE1-CB 3.8Å; F452-P454 HydrophobicContact CE1-CG 4Å; F452-P454 HydrophobicContact CZ-CB 3.84Å
453	A	85.7	Confident	68.4	Low	22 Å²	22	80.9 Å²	80.9	18%	0.182	46%	0.457	C	S	.	.			trans	-143.3	87.9	-178.7	0	0	0	0	0	109.4	I447 Y455 G456 V457	I447-A453 HydrophobicContact CG1-CB 4.45Å; A453-Y455 PolarHBondContact O-N 2.97Å; A453-G456 PolarHBondContact O-N 3.12Å; A453-V457 HydrophobicContact CB-CG1 4.11Å
454	P	75.3	Confident	66.1	Low	16 Å²	16	81.9 Å²	81.9	10%	0.104	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-13	-169.5	24.1	-34.4	0	0	0	115	R273 T277 P446 F448 F452	R273-P454 HydrophobicContact CG-CB 4.14Å; T277-P454 HydrophobicContact CG2-CG 3.84Å; T277-P454 WeakPolarHBondContact OG1-CB 3.25Å; T277-P454 WeakPolarHBondContact OG1-CG 3.33Å; P446-P454 HydrophobicContact CG-CG 4.04Å; F448-P454 HydrophobicContact CE2-CG 4.16Å; F452-P454 HydrophobicContact CE1-CB 3.8Å; F452-P454 HydrophobicContact CE1-CG 4Å; F452-P454 HydrophobicContact CZ-CB 3.84Å
455	Y	76.2	Confident	63.5	Low	71 Å²	71	85.6 Å²	85.6	28%	0.278	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	18.8	174.2	-44.4	-73.2	0	0	0	112.1	R445 P446 A453	R445-Y455 PolarHBondContact NH1-O 2.63Å; P446-Y455 HydrophobicContact CG-CD2 4.24Å; P446-Y455 HydrophobicContact CG-CE2 4.07Å; A453-Y455 PolarHBondContact O-N 2.97Å
456	G	67.9	Low	61	Low	37 Å²	37	87 Å²	87	38%	0.381	51%	0.508	S	S	.	.			trans	72.9	154.8	-173.5	0	0	0	0	0	113.8	A453	A453-G456 PolarHBondContact O-N 3.12Å
457	V	62.3	Low	58.2	Low	102 Å²	102	95.7 Å²	95.7	62%	0.618	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-69.2	143.4	166.9	-73.6	0	0	0	0	110.2	I447 A453 D459	I447-V457 HydrophobicContact CD1-CG1 4.14Å; A453-V457 HydrophobicContact CB-CG1 4.11Å; V457-D459 PolarHBondContact O-N 3.15Å
458	A	49.1	Very low	55.6	Low	79 Å²	79	98.9 Å²	98.9	65%	0.653	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-65.2	132.5	172.4	0	0	0	0	0	109.8	R460	A458-R460 PolarHBondContact O-N 3.15Å
459	D	39.9	Very low	52.7	Low	149 Å²	149	107.8 Å²	107.8	80%	0.797	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-61.4	121	-174	-161.3	-13.1	0	0	0	110.8	V457 A461	V457-D459 PolarHBondContact O-N 3.15Å; D459-A461 PolarHBondContact O-N 2.9Å
460	R	40.9	Very low	50	Low	200 Å²	200	113.3 Å²	113.3	76%	0.755	62%	0.618	S	S	*	*			trans	-81	14.8	-168	-160.6	177.1	159.5	155.1	-1.8	112.9	A458 M462 A463	A458-R460 PolarHBondContact O-N 3.15Å; R460-M462 PolarHBondContact O-N 2.78Å; R460-A463 PolarHBondContact O-N 3.27Å
461	A	31.8	Very low	47.6	Very low	80 Å²	80	112.9 Å²	112.9	66%	0.661	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	34.3	-178	0	0	0	0	0	115.6	D459	D459-A461 PolarHBondContact O-N 2.9Å
462	M	35	Very low	45.1	Very low	190 Å²	190	118.8 Å²	118.8	94%	0.936	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.1	7.1	171.2	-97.1	-65	163	0	0	114.5	R460	R460-M462 PolarHBondContact O-N 2.78Å
463	A	31.1	Very low	42.6	Very low	58 Å²	58	121.9 Å²	121.9	48%	0.479	68%	0.675	S	S	.	*	S	Bend	trans	-126.3	110.3	175.1	0	0	0	0	0	110.4	R460	R460-A463 PolarHBondContact O-N 3.27Å
464	T	28.8	Very low	39.8	Very low	133 Å²	133	125.1 Å²	125.1	82%	0.816	70%	0.702	S	S	*	*			trans	-55	140.5	-170.8	41.4	0	0	0	0	113.5
465	P	34.6	Very low	37.9	Very low	112 Å²	112	129.9 Å²	129.9	73%	0.727	73%	0.733	S	S	*	*			trans	-75.7	150.5	170.7	33.3	-34.4	0	0	0	110.3
466	N	29.8	Very low	36.1	Very low	170 Å²	170	131.8 Å²	131.8	91%	0.909	75%	0.754	S	S	*	*			trans	-144.7	128.3	149.2	-122.6	-22.4	0	0	0	108.8
467	Q	29.3	Very low	34.1	Very low	182 Å²	182	138.5 Å²	138.5	85%	0.85	78%	0.775	S	S	*	*			trans	-87.7	158.1	-176.9	-64.4	-170.6	19.8	0	0	111.4
468	I	33.2	Very low	32.6	Very low	158 Å²	158	140.6 Å²	140.6	81%	0.81	78%	0.778	S	S	*	*			trans	-77.5	123.9	176	-53.3	165.1	0	0	0	108.9
469	H	30.1	Very low	31.7	Very low	193 Å²	193	145.4 Å²	145.4	89%	0.894	78%	0.784	S	S	*	*			trans	-147.9	146.4	157.6	-110.5	53.3	0	0	0	111.4
470	R	25.6	Very low	31	Very low	230 Å²	230	149.4 Å²	149.4	87%	0.868	79%	0.789	S	S	*	*			trans	-144.9	100	-169.6	-177.2	-173.1	-169.1	-179.7	4.9	109.1
471	G	27.9	Very low	30.5	Very low	72 Å²	72	148.3 Å²	148.3	74%	0.742	79%	0.792	S	S	*	*			trans	-161.3	47.2	-161.6	0	0	0	0	0	118.2
472	H	29.3	Very low	30.7	Very low	177 Å²	177	150 Å²	150	82%	0.819	80%	0.796	S	S	*	*			trans	28.3	113.1	155.1	-58.8	90.9	0	0	0	121.1
473	S	29.9	Very low	31	Very low	129 Å²	129	146.7 Å²	146.7	90%	0.902	79%	0.789	S	S	*	*			trans	-134.9	157.9	130.2	43	0	0	0	0	108.4
474	A	26.8	Very low	32.1	Very low	89 Å²	89	149.3 Å²	149.3	74%	0.736	80%	0.801	S	S	*	*			trans	-134.4	-164.5	-157	0	0	0	0	0	112.4
475	P	36	Very low	32.3	Very low	117 Å²	117	153.9 Å²	153.9	76%	0.76	80%	0.803	S	S	*	*				-127.7	-144.2	-81.6	42.5	-25.9	0	0	0	110
476	P	38.6	Very low	32.2	Very low	110 Å²	110	155.4 Å²	155.4	71%	0.714	80%	0.801	S	S	*	*			cis	-117.9	-175.7	-49.4	34.5	-17.8	0	0	0	112.5
477	E	27.1	Very low	32.4	Very low	179 Å²	179	157.4 Å²	157.4	84%	0.836	80%	0.795	S	S	*	*			trans	-150.4	159.1	149.6	-107.4	-76.5	85.2	0	0	108.9
478	H	29.6	Very low	32.6	Very low	145 Å²	145	155.9 Å²	155.9	67%	0.671	79%	0.793	S	S	*	*			trans	-154.1	123.9	-163.2	-110.4	42.1	0	0	0	116.6
479	F	30.4	Very low	32.6	Very low	180 Å²	180	156.8 Å²	156.8	79%	0.789	80%	0.796	S	S	*	*			trans	62.2	157.8	163.9	-66.8	-107.3	0	0	0	115.4
480	R	25.2	Very low	32.9	Very low	234 Å²	234	153.1 Å²	153.1	88%	0.883	79%	0.787	S	S	*	*			cis	-165.3	172.3	25.7	-144.1	168.7	-166	172.8	3.7	110.9
481	Q	30.3	Very low	33.1	Very low	176 Å²	176	148.2 Å²	148.2	82%	0.822	78%	0.778	S	S	*	*			trans	-77.4	175.7	167.4	-47.8	168.2	-27.1	0	0	111.1
482	P	36.3	Very low	33.3	Very low	117 Å²	117	150.2 Å²	150.2	76%	0.76	78%	0.776	S	S	*	*				-158.2	-144.5	70.5	51.1	-26.9	0	0	0	114.8
483	P	40.9	Very low	33.3	Very low	119 Å²	119	145.9 Å²	145.9	77%	0.773	77%	0.771	S	S	*	*			trans	-131.7	-119	-131.9	29.3	2.3	0	0	0	118.7
484	P	54.2	Low	34.5	Very low	114 Å²	114	145.1 Å²	145.1	74%	0.74	76%	0.763	S	S	*	*				-129.6	-170.4	-108.4	43.6	-25.8	0	0	0	117.8
485	R	34.3	Very low	34.5	Very low	229 Å²	229	148.7 Å²	148.7	86%	0.864	77%	0.77	S	S	*	*			trans	-165	129	157.5	-103.4	161.5	-177.9	175.4	2.1	111.1
486	E	32.3	Very low	34.3	Very low	144 Å²	144	149.2 Å²	149.2	67%	0.673	77%	0.771	S	S	*	*				66	143.5	93.5	-81.8	-166.4	-120.4	0	0	116.3
487	R	33.2	Very low	34.7	Very low	211 Å²	211	149.1 Å²	149.1	80%	0.796	77%	0.77	S	S	*	*			cis	-152.4	169.8	21.5	-173.4	165.8	-80.9	-156.8	-6.7	113.8
488	N	34	Very low	34.7	Very low	151 Å²	151	149.3 Å²	149.3	81%	0.807	77%	0.771	S	S	*	*			trans	-86.5	162.2	-174.9	-60.3	-22.8	0	0	0	117.2
489	M	32.8	Very low	34.7	Very low	176 Å²	176	147.1 Å²	147.1	87%	0.867	77%	0.772	S	S	*	*			trans	160.6	156.3	138.2	-91.3	176.6	80.8	0	0	110
490	V	36.3	Very low	34.6	Very low	117 Å²	117	146.6 Å²	146.6	71%	0.709	77%	0.774	S	S	*	*			cis	-168.9	167.3	-23.8	81.4	0	0	0	0	106
491	D	30.9	Very low	34.8	Very low	127 Å²	127	142.7 Å²	142.7	68%	0.679	77%	0.766	S	S	*	*			cis	-161.9	171.7	9.5	-163.8	26.8	0	0	0	113.6
492	T	30.6	Very low	34.6	Very low	114 Å²	114	145.5 Å²	145.5	70%	0.699	77%	0.769	S	S	*	*			trans	46.8	141.6	148.1	-69	0	0	0	0	124.5
493	A	29	Very low	34.6	Very low	86 Å²	86	146.1 Å²	146.1	71%	0.711	77%	0.771	S	S	*	*			trans	-140.6	-174.5	164.5	0	0	0	0	0	109.1
494	P	56.7	Low	34.7	Very low	113 Å²	113	145.3 Å²	145.3	73%	0.734	77%	0.766	S	S	*	*			cis	-125.7	-170.7	-15	42.9	-28	0	0	0	112.4
495	N	25.6	Very low	33.7	Very low	163 Å²	163	149.6 Å²	149.6	87%	0.872	77%	0.773	S	S	*	*			trans	-171.2	139.7	144.1	-104.4	-27.5	0	0	0	115.7
496	T	33.2	Very low	33.4	Very low	128 Å²	128	144.7 Å²	144.7	79%	0.785	77%	0.773	S	S	*	*			trans	-108.4	177.1	152.8	24.7	0	0	0	0	107.7
497	P	46.8	Very low	33.1	Very low	109 Å²	109	148.6 Å²	148.6	71%	0.708	78%	0.782	S	S	*	*			cis	-137.9	-156.4	12.9	28.3	-0.9	0	0	0	114.2
498	Q	25.6	Very low	33.7	Very low	183 Å²	183	143.7 Å²	143.7	86%	0.855	78%	0.777	S	S	*	*			trans	100.6	100.4	154.4	-58.5	-167.2	-1.7	0	0	120.3
499	S	29.6	Very low	34.2	Very low	98 Å²	98	142 Å²	142	69%	0.685	78%	0.775	S	S	*	*			trans	-34.7	143.9	145.3	174.2	0	0	0	0	115.8
500	M	28.9	Very low	34.2	Very low	170 Å²	170	141.9 Å²	141.9	84%	0.837	77%	0.772	S	S	*	*				-155.9	156.5	129	-111.8	-67	115.8	0	0	111.7
501	Q	29.7	Very low	34	Very low	151 Å²	151	148 Å²	148	71%	0.706	78%	0.782	S	S	*	*			trans	-99.2	143.8	-177.7	-59.4	166.6	-21.2	0	0	111.3
502	R	25.9	Very low	34.3	Very low	235 Å²	235	148.4 Å²	148.4	89%	0.887	78%	0.784	S	S	*	*				170.3	149.4	116.9	-92	160.7	-178.9	-116.1	-2.4	113.5
503	T	35.5	Very low	34.3	Very low	131 Å²	131	150.6 Å²	150.6	80%	0.804	79%	0.788	S	S	*	*			trans	-99.5	170.6	167.7	65.5	0	0	0	0	109.1
504	P	44.6	Very low	34.7	Very low	102 Å²	102	149.1 Å²	149.1	66%	0.662	77%	0.773	S	S	*	*				-159.8	169.1	80	43.1	-23	0	0	0	118.7
505	K	33.4	Very low	33.9	Very low	204 Å²	204	149.6 Å²	149.6	89%	0.887	77%	0.773	S	S	*	*			trans	69	144.6	162	-64	160.6	-176	179.8	0	116.8
506	S	27.3	Very low	34.7	Very low	125 Å²	125	147 Å²	147	87%	0.874	76%	0.759	S	S	*	*			cis	-138.7	-166.1	-1	59.2	0	0	0	0	112.4
507	R	26.3	Very low	35	Very low	227 Å²	227	144.4 Å²	144.4	86%	0.857	74%	0.741	S	S	*	*			trans	-142.6	174.4	-161.7	-135.6	-172	171.6	-168.5	-1.6	108.7
508	P	45	Very low	35	Very low	107 Å²	107	145.4 Å²	145.4	70%	0.695	74%	0.74	S	S	*	*			cis	-130.2	-163	-8.3	46.2	-29.6	0	0	0	112.1
509	P	44.8	Very low	36.1	Very low	117 Å²	117	142.9 Å²	142.9	76%	0.76	73%	0.728	S	S	*	*			cis	-120.1	150.6	-12.2	38.2	-23.9	0	0	0	115
510	H	31.9	Very low	36.8	Very low	172 Å²	172	145.1 Å²	145.1	80%	0.796	73%	0.725	S	S	*	*			trans	-93	157.4	163.5	-74.2	-106.9	0	0	0	110.7
511	R	32.4	Very low	37.9	Very low	247 Å²	247	141.2 Å²	141.2	93%	0.932	71%	0.708	S	S	*	*			trans	-138.1	96.8	155.4	-167.8	173.6	-176.6	174.9	-0.1	109.9
512	N	38.1	Very low	39.5	Very low	134 Å²	134	140.9 Å²	140.9	72%	0.717	70%	0.7	S	S	*	*			trans	-98.7	179.4	169.3	-90.2	12.4	0	0	0	110.1
513	M	29.6	Very low	41	Very low	160 Å²	160	134.6 Å²	134.6	79%	0.788	68%	0.684	S	S	*	*			trans	78.7	143.1	169.9	-56.4	162.7	58.5	0	0	116.3
514	S	37.1	Very low	42.4	Very low	56 Å²	56	130.8 Å²	130.8	39%	0.392	66%	0.66	S	S	.	*			cis	-160.7	140.5	-35.6	-132.7	0	0	0	0	107.7	D516 N517	S514-D516 PolarHBondContact OG-OD2 3.35Å; S514-N517 VanDerWaalsContact CB-OD1 3.31Å; S514-N517 WeakPolarHBondContact CB-OD1 3.27Å
515	V	40.8	Very low	43.4	Very low	123 Å²	123	131.2 Å²	131.2	75%	0.745	66%	0.657	S	S	*	*	S	Bend	trans	-77	-30.8	172.5	-136.7	0	0	0	0	110.6	N517 L518	V515-N517 PolarHBondContact O-N 3.25Å; V515-L518 PolarHBondContact O-N 3.46Å; V515-L518 VanDerWaalsContact O-N 3.15Å
516	D	42.5	Very low	45	Very low	108 Å²	108	125.8 Å²	125.8	58%	0.578	63%	0.634	S	S	*	*	H	α-helix	trans	-61.3	-28.5	-179.2	-35.3	-82.1	0	0	0	112.9	S514 L518 E519 F520	S514-D516 PolarHBondContact OG-OD2 3.35Å; D516-L518 VanDerWaalsContact C-N 3.26Å; D516-L518 PolarHBondContact O-N 2.91Å; D516-E519 PolarHBondContact O-N 3.24Å; D516-F520 WeakPolarHBondContact O-CB 3.29Å; D516-F520 PolarHBondContact O-N 3.04Å
517	N	39	Very low	46.9	Very low	73 Å²	73	127.3 Å²	127.3	39%	0.39	62%	0.621	S	S	.	*	H	α-helix	trans	-59.9	-35.8	177.4	-82.2	52.9	0	0	0	111.9	S514 V515 F520 D521	S514-N517 VanDerWaalsContact CB-OD1 3.31Å; S514-N517 WeakPolarHBondContact CB-OD1 3.27Å; V515-N517 PolarHBondContact O-N 3.25Å; N517-F520 PolarHBondContact O-N 3.36Å; N517-D521 VanDerWaalsContact O-CB 3.24Å; N517-D521 WeakPolarHBondContact O-CB 3.39Å; N517-D521 PolarHBondContact O-N 3.2Å
518	L	46.5	Very low	49	Very low	131 Å²	131	122.1 Å²	122.1	69%	0.686	61%	0.606	S	S	*	*	H	α-helix	trans	-73	-33.8	-179.2	-77.9	163.2	0	0	0	112.6	V515 D516 R522	V515-L518 PolarHBondContact O-N 3.46Å; V515-L518 VanDerWaalsContact O-N 3.15Å; D516-L518 VanDerWaalsContact C-N 3.26Å; D516-L518 PolarHBondContact O-N 2.91Å; L518-R522 WeakPolarHBondContact O-CB 3.35Å; L518-R522 PolarHBondContact O-N 2.85Å
519	E	49.4	Very low	50.4	Low	129 Å²	129	124.2 Å²	124.2	60%	0.603	60%	0.6	S	S	*	*	H	α-helix	trans	-74.7	-37.7	169.8	-77.3	-157.5	127.8	0	0	111.9	D516 R522 L523	D516-E519 PolarHBondContact O-N 3.24Å; E519-R522 PolarHBondContact O-N 2.66Å; E519-L523 WeakPolarHBondContact O-CB 3.45Å; E519-L523 VanDerWaalsContact O-CG 3.26Å; E519-L523 WeakPolarHBondContact O-CG 3.2Å; E519-L523 PolarHBondContact O-N 3.25Å
520	F	44.3	Very low	51.5	Low	145 Å²	145	123.4 Å²	123.4	64%	0.636	59%	0.589	S	S	*	*	H	α-helix	trans	-69	-41.9	179.9	-158.5	-85.4	0	0	0	112.3	D516 N517 L523 T524	D516-F520 WeakPolarHBondContact O-CB 3.29Å; D516-F520 PolarHBondContact O-N 3.04Å; N517-F520 PolarHBondContact O-N 3.36Å; F520-L523 PolarHBondContact O-N 3.48Å; F520-T524 VanDerWaalsContact O-CB 3.23Å; F520-T524 WeakPolarHBondContact O-CB 3.13Å; F520-T524 PolarHBondContact O-N 2.88Å; F520-T524 PolarHBondContact O-OG1 3.45Å
521	D	52.4	Low	53.2	Low	88 Å²	88	119.9 Å²	119.9	47%	0.471	57%	0.573	S	S	.	*	H	α-helix	trans	-64.4	-41.4	173.3	-70.7	-18.8	0	0	0	110.3	N517 T524 L525	N517-D521 VanDerWaalsContact O-CB 3.24Å; N517-D521 WeakPolarHBondContact O-CB 3.39Å; N517-D521 PolarHBondContact O-N 3.2Å; D521-T524 PolarHBondContact O-N 2.9Å; D521-L525 WeakPolarHBondContact O-CB 3.46Å; D521-L525 WeakPolarHBondContact O-CG 3.15Å; D521-L525 PolarHBondContact O-N 3.38Å
522	R	62.6	Low	55.3	Low	144 Å²	144	115.3 Å²	115.3	54%	0.543	56%	0.56	S	S	.	*	H	α-helix	trans	-62.5	-47	175.2	178.6	177.9	165.8	-112.3	-25	112.2	L518 E519 T524 L525 E526	L518-R522 WeakPolarHBondContact O-CB 3.35Å; L518-R522 PolarHBondContact O-N 2.85Å; E519-R522 PolarHBondContact O-N 2.66Å; R522-T524 VanDerWaalsContact C-N 3.29Å; R522-T524 PolarHBondContact O-N 3.32Å; R522-L525 PolarHBondContact O-N 2.85Å; R522-E526 IonicContact CZ-OE2 3.61Å; R522-E526 IonicContact NH2-OE2 3.56Å; R522-E526 PolarHBondContact NH2-OE2 2.82Å; R522-E526 VanDerWaalsContact O-CB 3.28Å; R522-E526 WeakPolarHBondContact O-CB 3.49Å; R522-E526 PolarHBondContact O-N 3.26Å
523	L	58.2	Low	56.7	Low	104 Å²	104	113 Å²	113	55%	0.545	55%	0.545	S	S	.	.	H	α-helix	trans	-66.7	-31.6	177	-74.2	166.9	0	0	0	111.9	E519 F520 R527	E519-L523 WeakPolarHBondContact O-CB 3.45Å; E519-L523 VanDerWaalsContact O-CG 3.26Å; E519-L523 WeakPolarHBondContact O-CG 3.2Å; E519-L523 PolarHBondContact O-N 3.25Å; F520-L523 PolarHBondContact O-N 3.48Å; L523-R527 WeakPolarHBondContact O-CB 3.47Å; L523-R527 PolarHBondContact O-N 3.21Å
524	T	64.9	Low	58.4	Low	50 Å²	50	111.9 Å²	111.9	31%	0.307	54%	0.536	S	S	.	.	H	α-helix	trans	-71.4	-45.5	175.3	-59	0	0	0	0	110.6	F520 D521 R522 E526 R527 E528	F520-T524 VanDerWaalsContact O-CB 3.23Å; F520-T524 WeakPolarHBondContact O-CB 3.13Å; F520-T524 PolarHBondContact O-N 2.88Å; F520-T524 PolarHBondContact O-OG1 3.45Å; D521-T524 PolarHBondContact O-N 2.9Å; R522-T524 VanDerWaalsContact C-N 3.29Å; R522-T524 PolarHBondContact O-N 3.32Å; T524-E526 PolarHBondContact O-N 3.04Å; T524-R527 CarbonylContact O-C 3.53Å; T524-R527 WeakPolarHBondContact O-CB 3.19Å; T524-R527 PolarHBondContact O-N 2.94Å; T524-E528 WeakPolarHBondContact O-CB 3.09Å; T524-E528 WeakPolarHBondContact O-CG 3.42Å; T524-E528 PolarHBondContact O-N 3.37Å
525	L	65.6	Low	60.5	Low	112 Å²	112	111.9 Å²	111.9	59%	0.586	54%	0.539	S	S	*	.	H	α-helix	trans	-62.9	-40.1	173.8	-74.5	165.5	0	0	0	112.6	D521 R522 R527 E528 R529	D521-L525 WeakPolarHBondContact O-CB 3.46Å; D521-L525 WeakPolarHBondContact O-CG 3.15Å; D521-L525 PolarHBondContact O-N 3.38Å; R522-L525 PolarHBondContact O-N 2.85Å; L525-R527 VanDerWaalsContact C-N 3.34Å; L525-E528 PolarHBondContact O-N 2.95Å; L525-R529 VanDerWaalsContact O-CB 3.26Å; L525-R529 WeakPolarHBondContact O-CB 3.4Å; L525-R529 PolarHBondContact O-N 2.86Å
526	E	65.9	Low	62.3	Low	90 Å²	90	112.6 Å²	112.6	42%	0.421	53%	0.532	S	S	.	.	H	α-helix	trans	-66.8	-36.9	176	-171.2	158.5	-168.5	0	0	111.2	R522 T524 L530	R522-E526 IonicContact CZ-OE2 3.61Å; R522-E526 IonicContact NH2-OE2 3.56Å; R522-E526 PolarHBondContact NH2-OE2 2.82Å; R522-E526 VanDerWaalsContact O-CB 3.28Å; R522-E526 WeakPolarHBondContact O-CB 3.49Å; R522-E526 PolarHBondContact O-N 3.26Å; T524-E526 PolarHBondContact O-N 3.04Å; E526-L530 WeakPolarHBondContact O-CG 3.45Å; E526-L530 PolarHBondContact O-N 3.23Å; E526-L530 VanDerWaalsContact O-N 3.09Å
527	R	67.1	Low	63.8	Low	157 Å²	157	112 Å²	112	59%	0.592	53%	0.528	S	S	*	.	H	α-helix	trans	-68.8	-45.4	171.7	179.4	177.7	170.9	-152.5	-17.4	113	L523 T524 L525 R529 L530 E531	L523-R527 WeakPolarHBondContact O-CB 3.47Å; L523-R527 PolarHBondContact O-N 3.21Å; T524-R527 CarbonylContact O-C 3.53Å; T524-R527 WeakPolarHBondContact O-CB 3.19Å; T524-R527 PolarHBondContact O-N 2.94Å; L525-R527 VanDerWaalsContact C-N 3.34Å; R527-R529 VanDerWaalsContact C-N 3.31Å; R527-R529 PolarHBondContact O-N 2.92Å; R527-L530 CarbonylContact O-C 3.56Å; R527-L530 PolarHBondContact O-N 2.82Å; R527-E531 HydrophobicContact CG-CG 4.42Å; R527-E531 IonicContact CZ-OE1 2.66Å; R527-E531 IonicContact NE-OE1 3.63Å; R527-E531 PolarHBondContact NE-OE1 3.32Å; R527-E531 IonicContact NH2-OE1 3.51Å; R527-E531 PolarHBondContact NH2-OE1 3.11Å; R527-E531 IonicContact NH2-OE2 2.91Å; R527-E531 WeakPolarHBondContact O-CG 3.34Å; R527-E531 PolarHBondContact O-N 3.06Å
528	E	71.9	Confident	65.8	Low	117 Å²	117	113.9 Å²	113.9	55%	0.547	54%	0.536	S	S	.	.	H	α-helix	trans	-62.1	-39.8	176.4	-76.8	-175.8	160.4	0	0	111.1	T524 L525 L530 E531 F532	T524-E528 WeakPolarHBondContact O-CB 3.09Å; T524-E528 WeakPolarHBondContact O-CG 3.42Å; T524-E528 PolarHBondContact O-N 3.37Å; L525-E528 PolarHBondContact O-N 2.95Å; E528-L530 PolarHBondContact O-N 3.3Å; E528-E531 PolarHBondContact O-N 2.88Å; E528-F532 VanDerWaalsContact O-CB 3.27Å; E528-F532 WeakPolarHBondContact O-CB 3.37Å; E528-F532 PolarHBondContact O-N 3.03Å
529	R	72.9	Confident	67.4	Low	152 Å²	152	114.3 Å²	114.3	57%	0.574	53%	0.534	S	S	*	.	H	α-helix	trans	-58.1	-46.6	171.6	-177.9	-173.6	174.9	-65	-7.2	111.4	L525 R527 E533	L525-R529 VanDerWaalsContact O-CB 3.26Å; L525-R529 WeakPolarHBondContact O-CB 3.4Å; L525-R529 PolarHBondContact O-N 2.86Å; R527-R529 VanDerWaalsContact C-N 3.31Å; R527-R529 PolarHBondContact O-N 2.92Å; R529-E533 IonicContact CZ-OE2 2.69Å; R529-E533 IonicContact NH1-OE2 3.3Å; R529-E533 PolarHBondContact NH1-OE2 2.93Å; R529-E533 IonicContact NH2-OE2 2.77Å; R529-E533 VanDerWaalsContact O-CB 3.26Å; R529-E533 WeakPolarHBondContact O-CB 3.32Å; R529-E533 PolarHBondContact O-N 3.45Å
530	L	68.9	Low	68.2	Low	99 Å²	99	117 Å²	117	52%	0.518	54%	0.539	S	S	.	.	H	α-helix	trans	-68.5	-37.4	177.4	-74.4	167.9	0	0	0	112.9	E526 R527 E528 K534	E526-L530 WeakPolarHBondContact O-CG 3.45Å; E526-L530 PolarHBondContact O-N 3.23Å; E526-L530 VanDerWaalsContact O-N 3.09Å; R527-L530 CarbonylContact O-C 3.56Å; R527-L530 PolarHBondContact O-N 2.82Å; E528-L530 PolarHBondContact O-N 3.3Å; L530-K534 WeakPolarHBondContact O-CB 3.47Å; L530-K534 PolarHBondContact O-N 2.96Å
531	E	68.1	Low	69.6	Low	99 Å²	99	114.3 Å²	114.3	46%	0.463	53%	0.528	S	S	.	.	H	α-helix	trans	-69.6	-37.3	176	-73.6	-175.6	-168.3	0	0	111.4	R527 E528 A535	R527-E531 HydrophobicContact CG-CG 4.42Å; R527-E531 IonicContact CZ-OE1 2.66Å; R527-E531 IonicContact NE-OE1 3.63Å; R527-E531 PolarHBondContact NE-OE1 3.32Å; R527-E531 IonicContact NH2-OE1 3.51Å; R527-E531 PolarHBondContact NH2-OE1 3.11Å; R527-E531 IonicContact NH2-OE2 2.91Å; R527-E531 WeakPolarHBondContact O-CG 3.34Å; R527-E531 PolarHBondContact O-N 3.06Å; E528-E531 PolarHBondContact O-N 2.88Å; E531-A535 VanDerWaalsContact O-CB 3.29Å; E531-A535 WeakPolarHBondContact O-CB 3.49Å; E531-A535 PolarHBondContact O-N 3.37Å
532	F	76.6	Confident	71	Confident	150 Å²	150	112.6 Å²	112.6	66%	0.658	52%	0.523	S	S	*	.	H	α-helix	trans	-66.2	-45.6	171.6	-179.4	-96.7	0	0	0	112.6	E528 K534 A535 K536	E528-F532 VanDerWaalsContact O-CB 3.27Å; E528-F532 WeakPolarHBondContact O-CB 3.37Å; E528-F532 PolarHBondContact O-N 3.03Å; F532-K534 VanDerWaalsContact C-N 3.34Å; F532-K534 PolarHBondContact O-N 2.91Å; F532-A535 PolarHBondContact O-N 2.86Å; F532-K536 WeakPolarHBondContact O-CB 3.36Å; F532-K536 PolarHBondContact O-N 2.86Å
533	E	67.1	Low	71.5	Confident	85 Å²	85	114.4 Å²	114.4	40%	0.397	53%	0.53	S	S	.	.	H	α-helix	trans	-62.6	-42.1	176.6	-175.1	156.4	-147.9	0	0	111.1	R529 K536 I537	R529-E533 IonicContact CZ-OE2 2.69Å; R529-E533 IonicContact NH1-OE2 3.3Å; R529-E533 PolarHBondContact NH1-OE2 2.93Å; R529-E533 IonicContact NH2-OE2 2.77Å; R529-E533 VanDerWaalsContact O-CB 3.26Å; R529-E533 WeakPolarHBondContact O-CB 3.32Å; R529-E533 PolarHBondContact O-N 3.45Å; E533-K536 PolarHBondContact O-N 2.88Å; E533-I537 HydrophobicContact CG-CD1 4.49Å; E533-I537 WeakPolarHBondContact O-CG1 3.29Å; E533-I537 PolarHBondContact O-N 3.39Å
534	K	65.3	Low	72.2	Confident	138 Å²	138	114 Å²	114	60%	0.6	53%	0.528	S	S	*	.	H	α-helix	trans	-66	-37.6	173.4	-174.3	176.9	-179	-180	0	113.1	L530 F532 I537 M538	L530-K534 WeakPolarHBondContact O-CB 3.47Å; L530-K534 PolarHBondContact O-N 2.96Å; F532-K534 VanDerWaalsContact C-N 3.34Å; F532-K534 PolarHBondContact O-N 2.91Å; K534-I537 PolarHBondContact O-N 3.34Å; K534-M538 WeakPolarHBondContact O-CB 3.1Å; K534-M538 PolarHBondContact O-N 2.93Å
535	A	79.6	Confident	72.9	Confident	55 Å²	55	117.6 Å²	117.6	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-64.2	-42.6	173.6	0	0	0	0	0	111.3	E531 F532 I537 M538 E539	E531-A535 VanDerWaalsContact O-CB 3.29Å; E531-A535 WeakPolarHBondContact O-CB 3.49Å; E531-A535 PolarHBondContact O-N 3.37Å; F532-A535 PolarHBondContact O-N 2.86Å; A535-I537 VanDerWaalsContact C-N 3.35Å; A535-I537 PolarHBondContact O-N 2.99Å; A535-M538 PolarHBondContact O-N 3.31Å; A535-E539 WeakPolarHBondContact O-CB 3.49Å; A535-E539 PolarHBondContact O-N 3.48Å
536	K	79.5	Confident	73.6	Confident	139 Å²	139	117.9 Å²	117.9	60%	0.604	53%	0.534	S	S	*	.	H	α-helix	trans	-64	-36.3	175.5	-167.8	178.6	-176.7	-178.3	0	112.7	F532 E533 R540	F532-K536 WeakPolarHBondContact O-CB 3.36Å; F532-K536 PolarHBondContact O-N 2.86Å; E533-K536 PolarHBondContact O-N 2.88Å; K536-R540 WeakPolarHBondContact O-CB 3.49Å; K536-R540 PolarHBondContact O-N 2.87Å; K536-R540 VanDerWaalsContact O-N 3.08Å
537	I	74.2	Confident	73.9	Confident	96 Å²	96	118.2 Å²	118.2	49%	0.492	54%	0.535	S	S	.	.	H	α-helix	trans	-66.5	-45.7	171	-68.5	164.9	0	0	0	110.6	E533 K534 A535 E539 R540 E541	E533-I537 HydrophobicContact CG-CD1 4.49Å; E533-I537 WeakPolarHBondContact O-CG1 3.29Å; E533-I537 PolarHBondContact O-N 3.39Å; K534-I537 PolarHBondContact O-N 3.34Å; A535-I537 VanDerWaalsContact C-N 3.35Å; A535-I537 PolarHBondContact O-N 2.99Å; I537-E539 VanDerWaalsContact C-N 3.35Å; I537-E539 PolarHBondContact O-N 3.16Å; I537-R540 WeakPolarHBondContact O-CB 3.26Å; I537-R540 PolarHBondContact O-N 3.35Å; I537-E541 PolarHBondContact O-N 2.9Å
538	M	81.9	Confident	74.4	Confident	112 Å²	112	116.9 Å²	116.9	55%	0.552	54%	0.536	S	S	*	.	H	α-helix	trans	-64.1	-37.2	178.9	-169.8	-176	-60	0	0	112.6	K534 A535 S542	K534-M538 WeakPolarHBondContact O-CB 3.1Å; K534-M538 PolarHBondContact O-N 2.93Å; A535-M538 PolarHBondContact O-N 3.31Å; M538-S542 VanDerWaalsContact O-CB 3.25Å; M538-S542 WeakPolarHBondContact O-CB 3.22Å; M538-S542 PolarHBondContact O-N 3.05Å
539	E	79.3	Confident	75.1	Confident	140 Å²	140	117.6 Å²	117.6	65%	0.654	54%	0.537	S	S	*	.	H	α-helix	trans	-63.4	-45.9	171.9	-175.4	-177.1	-162.7	0	0	111	A535 I537 E541 S542 R543	A535-E539 WeakPolarHBondContact O-CB 3.49Å; A535-E539 PolarHBondContact O-N 3.48Å; I537-E539 VanDerWaalsContact C-N 3.35Å; I537-E539 PolarHBondContact O-N 3.16Å; E539-E541 PolarHBondContact O-N 3.26Å; E539-S542 PolarHBondContact O-N 3.19Å; E539-R543 WeakPolarHBondContact O-CB 3.1Å; E539-R543 PolarHBondContact O-N 3.42Å
540	R	66.5	Low	75.3	Confident	186 Å²	186	117.1 Å²	117.1	70%	0.702	54%	0.541	S	S	*	.	H	α-helix	trans	-60.2	-45.1	175.7	-172.6	177.9	-177.4	175.3	1.2	111.9	K536 I537 R543 L544	K536-R540 WeakPolarHBondContact O-CB 3.49Å; K536-R540 PolarHBondContact O-N 2.87Å; K536-R540 VanDerWaalsContact O-N 3.08Å; I537-R540 WeakPolarHBondContact O-CB 3.26Å; I537-R540 PolarHBondContact O-N 3.35Å; R540-R543 PolarHBondContact O-N 2.83Å; R540-L544 HydrophobicContact CG-CD1 4.35Å; R540-L544 WeakPolarHBondContact O-CG 3.36Å; R540-L544 PolarHBondContact O-N 3.1Å
541	E	73.8	Confident	75.7	Confident	87 Å²	87	117.2 Å²	117.2	41%	0.407	54%	0.541	S	S	.	.	H	α-helix	trans	-64.1	-40.6	173.4	-71.5	-169.6	-176.3	0	0	112.6	I537 E539 R543 L544 R545	I537-E541 PolarHBondContact O-N 2.9Å; E539-E541 PolarHBondContact O-N 3.26Å; E541-R543 VanDerWaalsContact C-N 3.31Å; E541-R543 PolarHBondContact O-N 2.82Å; E541-L544 PolarHBondContact O-N 3.22Å; E541-R545 VanDerWaalsContact CB-NH2 3.3Å; E541-R545 WeakPolarHBondContact O-CB 3.43Å; E541-R545 WeakPolarHBondContact O-CG 3.32Å; E541-R545 PolarHBondContact O-N 2.82Å; E541-R545 IonicContact OE2-CZ 2.82Å; E541-R545 IonicContact OE2-NH1 2.79Å; E541-R545 PolarHBondContact OE2-NH1 3.04Å; E541-R545 IonicContact OE2-NH2 2.74Å; E541-R545 PolarHBondContact OE2-NH2 2.79Å
542	S	81.1	Confident	76.3	Confident	53 Å²	53	117.1 Å²	117.1	37%	0.371	54%	0.541	S	S	.	.	H	α-helix	trans	-62.9	-40.4	179.1	-171.7	0	0	0	0	111.2	M538 E539 R545 H546	M538-S542 VanDerWaalsContact O-CB 3.25Å; M538-S542 WeakPolarHBondContact O-CB 3.22Å; M538-S542 PolarHBondContact O-N 3.05Å; E539-S542 PolarHBondContact O-N 3.19Å; S542-R545 PolarHBondContact O-N 2.79Å; S542-H546 PolarHBondContact O-N 2.96Å; S542-H546 PolarHBondContact O-ND1 2.85Å
543	R	74.1	Confident	76.5	Confident	182 Å²	182	113.7 Å²	113.7	69%	0.687	53%	0.529	S	S	*	.	H	α-helix	trans	-65.3	-47	173.8	-178.4	173.3	166.1	179.5	-4.4	111.8	E539 R540 E541 R545 H546 E547	E539-R543 WeakPolarHBondContact O-CB 3.1Å; E539-R543 PolarHBondContact O-N 3.42Å; R540-R543 PolarHBondContact O-N 2.83Å; E541-R543 VanDerWaalsContact C-N 3.31Å; E541-R543 PolarHBondContact O-N 2.82Å; R543-R545 VanDerWaalsContact C-N 3.33Å; R543-R545 PolarHBondContact O-N 2.79Å; R543-H546 WeakPolarHBondContact O-CB 3.34Å; R543-H546 PolarHBondContact O-N 3.39Å; R543-H546 VanDerWaalsContact O-N 3.1Å; R543-E547 WeakPolarHBondContact O-CB 3.41Å; R543-E547 PolarHBondContact O-N 3.37Å
544	L	71.6	Confident	76.9	Confident	96 Å²	96	115.8 Å²	115.8	50%	0.503	54%	0.539	S	S	.	.	H	α-helix	trans	-59.2	-41.9	175.2	-73.2	168.5	0	0	0	112	R540 E541 H546 E547 E548	R540-L544 HydrophobicContact CG-CD1 4.35Å; R540-L544 WeakPolarHBondContact O-CG 3.36Å; R540-L544 PolarHBondContact O-N 3.1Å; E541-L544 PolarHBondContact O-N 3.22Å; L544-H546 VanDerWaalsContact C-N 3.31Å; L544-H546 PolarHBondContact O-N 2.86Å; L544-E547 PolarHBondContact O-N 2.86Å; L544-E548 VanDerWaalsContact O-CB 3.25Å; L544-E548 WeakPolarHBondContact O-CB 3.46Å; L544-E548 PolarHBondContact O-N 2.9Å
545	R	79.7	Confident	77.6	Confident	125 Å²	125	114.9 Å²	114.9	47%	0.472	54%	0.535	S	S	.	.	H	α-helix	trans	-66.7	-27	175	-76.3	-173.1	-77.1	-100.7	1.5	113.8	E541 S542 R543 K549	E541-R545 VanDerWaalsContact CB-NH2 3.3Å; E541-R545 WeakPolarHBondContact O-CB 3.43Å; E541-R545 WeakPolarHBondContact O-CG 3.32Å; E541-R545 PolarHBondContact O-N 2.82Å; E541-R545 IonicContact OE2-CZ 2.82Å; E541-R545 IonicContact OE2-NH1 2.79Å; E541-R545 PolarHBondContact OE2-NH1 3.04Å; E541-R545 IonicContact OE2-NH2 2.74Å; E541-R545 PolarHBondContact OE2-NH2 2.79Å; S542-R545 PolarHBondContact O-N 2.79Å; R543-R545 VanDerWaalsContact C-N 3.33Å; R543-R545 PolarHBondContact O-N 2.79Å; R545-K549 VanDerWaalsContact O-CB 3.31Å; R545-K549 WeakPolarHBondContact O-CB 3.1Å; R545-K549 PolarHBondContact O-N 3.15Å
546	H	81.4	Confident	78	Confident	117 Å²	117	121.1 Å²	121.1	54%	0.542	55%	0.547	S	S	.	.	H	α-helix	trans	-75.3	-38	171	-81.8	81.4	0	0	0	112.1	S542 R543 L544 K549 Q550	S542-H546 PolarHBondContact O-N 2.96Å; S542-H546 PolarHBondContact O-ND1 2.85Å; R543-H546 WeakPolarHBondContact O-CB 3.34Å; R543-H546 PolarHBondContact O-N 3.39Å; R543-H546 VanDerWaalsContact O-N 3.1Å; L544-H546 VanDerWaalsContact C-N 3.31Å; L544-H546 PolarHBondContact O-N 2.86Å; H546-K549 PolarHBondContact O-N 2.99Å; H546-Q550 WeakPolarHBondContact O-CG 3.4Å; H546-Q550 PolarHBondContact O-N 3.34Å
547	E	70.6	Confident	78.2	Confident	97 Å²	97	123.9 Å²	123.9	45%	0.453	55%	0.554	S	S	.	*	H	α-helix	trans	-69.2	-47.7	178.8	-163.2	157.4	-146.2	0	0	110.9	R543 L544 K549 Q550 I551	R543-E547 WeakPolarHBondContact O-CB 3.41Å; R543-E547 PolarHBondContact O-N 3.37Å; L544-E547 PolarHBondContact O-N 2.86Å; E547-K549 VanDerWaalsContact C-N 3.31Å; E547-K549 PolarHBondContact O-N 2.89Å; E547-Q550 PolarHBondContact O-N 3.5Å; E547-Q550 VanDerWaalsContact O-N 3.15Å; E547-I551 WeakPolarHBondContact O-CG1 3.43Å; E547-I551 PolarHBondContact O-N 2.92Å
548	E	77.5	Confident	78.3	Confident	129 Å²	129	125.3 Å²	125.3	60%	0.603	56%	0.56	S	S	*	*	H	α-helix	trans	-52.4	-45.7	168.8	179.2	-178	-150.3	0	0	112	L544 I551 E552	L544-E548 VanDerWaalsContact O-CB 3.25Å; L544-E548 WeakPolarHBondContact O-CB 3.46Å; L544-E548 PolarHBondContact O-N 2.9Å; E548-I551 PolarHBondContact O-N 2.95Å; E548-E552 PolarHBondContact O-N 2.99Å
549	K	86.6	Confident	78.2	Confident	132 Å²	132	125.4 Å²	125.4	57%	0.574	56%	0.559	S	S	*	*	H	α-helix	trans	-65.8	-40.7	177.5	-175.4	-178.9	175.2	-169.6	0	112.6	R545 H546 E547 I551 E552 D553	R545-K549 VanDerWaalsContact O-CB 3.31Å; R545-K549 WeakPolarHBondContact O-CB 3.1Å; R545-K549 PolarHBondContact O-N 3.15Å; H546-K549 PolarHBondContact O-N 2.99Å; E547-K549 VanDerWaalsContact C-N 3.31Å; E547-K549 PolarHBondContact O-N 2.89Å; K549-I551 VanDerWaalsContact C-N 3.32Å; K549-E552 PolarHBondContact O-N 2.91Å; K549-D553 WeakPolarHBondContact CE-OD2 3.46Å; K549-D553 WeakPolarHBondContact O-CB 3.36Å; K549-D553 PolarHBondContact O-N 2.86Å
550	Q	78.7	Confident	78.2	Confident	142 Å²	142	121.6 Å²	121.6	66%	0.664	55%	0.551	S	S	*	*	H	α-helix	trans	-62.1	-42.6	175.9	-75.3	-179.9	21.9	0	0	111.1	H546 E547 D553 E554	H546-Q550 WeakPolarHBondContact O-CG 3.4Å; H546-Q550 PolarHBondContact O-N 3.34Å; E547-Q550 PolarHBondContact O-N 3.5Å; E547-Q550 VanDerWaalsContact O-N 3.15Å; Q550-D553 PolarHBondContact O-N 2.84Å; Q550-E554 VanDerWaalsContact O-CB 3.32Å; Q550-E554 WeakPolarHBondContact O-CB 3.32Å; Q550-E554 PolarHBondContact O-N 2.88Å
551	I	76.9	Confident	78.7	Confident	101 Å²	101	118.4 Å²	118.4	52%	0.518	54%	0.544	S	S	.	.	H	α-helix	trans	-62	-43.5	175.9	-66.6	163.2	0	0	0	111	E547 E548 K549 E554 K555	E547-I551 WeakPolarHBondContact O-CG1 3.43Å; E547-I551 PolarHBondContact O-N 2.92Å; E548-I551 PolarHBondContact O-N 2.95Å; K549-I551 VanDerWaalsContact C-N 3.32Å; I551-E554 PolarHBondContact O-N 3.46Å; I551-K555 WeakPolarHBondContact O-CB 3.28Å; I551-K555 PolarHBondContact O-N 3.41Å
552	E	80.4	Confident	78.6	Confident	97 Å²	97	121.2 Å²	121.2	45%	0.453	56%	0.555	S	S	.	*	H	α-helix	trans	-69.4	-39.9	178.4	-165	63.7	-137.9	0	0	112.3	E548 K549 K555 R556	E548-E552 PolarHBondContact O-N 2.99Å; K549-E552 PolarHBondContact O-N 2.91Å; E552-K555 VanDerWaalsContact CD-NZ 3.32Å; E552-K555 IonicContact OE1-NZ 3.92Å; E552-K555 PolarHBondContact OE1-NZ 2.86Å; E552-K555 VanDerWaalsContact OE1-NZ 3.14Å; E552-K555 IonicContact OE2-NZ 2.74Å; E552-K555 PolarHBondContact OE2-NZ 3.23Å; E552-R556 VanDerWaalsContact O-CB 3.3Å; E552-R556 WeakPolarHBondContact O-CB 3.48Å; E552-R556 PolarHBondContact O-N 2.9Å
553	D	80.4	Confident	78.1	Confident	78 Å²	78	122 Å²	122	42%	0.417	56%	0.555	S	S	.	*	H	α-helix	trans	-66.1	-35.2	174.8	-82	-35.8	0	0	0	112.1	K549 Q550 R556 R557	K549-D553 WeakPolarHBondContact CE-OD2 3.46Å; K549-D553 WeakPolarHBondContact O-CB 3.36Å; K549-D553 PolarHBondContact O-N 2.86Å; Q550-D553 PolarHBondContact O-N 2.84Å; D553-R556 PolarHBondContact O-N 3.49Å; D553-R557 PolarHBondContact O-N 2.99Å
554	E	76.1	Confident	78	Confident	130 Å²	130	119.1 Å²	119.1	61%	0.607	55%	0.553	S	S	*	*	H	α-helix	trans	-70.1	-48.1	174	-179.7	168.8	-136.7	0	0	112.2	Q550 I551 R556 R557 M558	Q550-E554 VanDerWaalsContact O-CB 3.32Å; Q550-E554 WeakPolarHBondContact O-CB 3.32Å; Q550-E554 PolarHBondContact O-N 2.88Å; I551-E554 PolarHBondContact O-N 3.46Å; E554-R556 PolarHBondContact O-N 2.92Å; E554-R557 WeakPolarHBondContact O-CA 3.37Å; E554-R557 WeakPolarHBondContact O-CB 3.37Å; E554-R557 PolarHBondContact O-N 2.89Å; E554-M558 PolarHBondContact O-N 3.17Å
555	K	80.1	Confident	77.5	Confident	118 Å²	118	119.1 Å²	119.1	51%	0.513	55%	0.552	S	S	.	*	H	α-helix	trans	-54.8	-35.1	171.8	175.5	-178.3	164.6	-156.4	0	111.9	I551 E552 H559	I551-K555 WeakPolarHBondContact O-CB 3.28Å; I551-K555 PolarHBondContact O-N 3.41Å; E552-K555 VanDerWaalsContact CD-NZ 3.32Å; E552-K555 IonicContact OE1-NZ 3.92Å; E552-K555 PolarHBondContact OE1-NZ 2.86Å; E552-K555 VanDerWaalsContact OE1-NZ 3.14Å; E552-K555 IonicContact OE2-NZ 2.74Å; E552-K555 PolarHBondContact OE2-NZ 3.23Å; K555-H559 PolarHBondContact O-N 3.18Å
556	R	86.8	Confident	76.7	Confident	186 Å²	186	117.3 Å²	117.3	70%	0.702	56%	0.555	S	S	*	*	H	α-helix	trans	-70.4	-36	174.8	-152.7	174.7	-155.3	-165.7	4.9	113.2	E552 D553 E554 A560	E552-R556 VanDerWaalsContact O-CB 3.3Å; E552-R556 WeakPolarHBondContact O-CB 3.48Å; E552-R556 PolarHBondContact O-N 2.9Å; D553-R556 PolarHBondContact O-N 3.49Å; E554-R556 PolarHBondContact O-N 2.92Å; R556-A560 PolarHBondContact O-N 3Å; R556-A560 VanDerWaalsContact O-N 3.16Å
557	R	83.9	Confident	75.7	Confident	197 Å²	197	119.4 Å²	119.4	74%	0.743	56%	0.563	S	S	*	*	H	α-helix	trans	-65.4	-49.2	170.6	-70.6	176	173.4	-150.5	-2.1	111.3	D553 E554 H559 A560 E561	D553-R557 PolarHBondContact O-N 2.99Å; E554-R557 WeakPolarHBondContact O-CA 3.37Å; E554-R557 WeakPolarHBondContact O-CB 3.37Å; E554-R557 PolarHBondContact O-N 2.89Å; R557-H559 PolarHBondContact O-N 2.86Å; R557-A560 PolarHBondContact O-N 3.17Å; R557-E561 PolarHBondContact O-N 3.5Å
558	M	77.9	Confident	75	Confident	126 Å²	126	122.8 Å²	122.8	62%	0.621	58%	0.579	S	S	*	*	H	α-helix	trans	-54.8	-38.4	175.9	-76.4	-86.8	-81.3	0	0	112.5	E554 K562	E554-M558 PolarHBondContact O-N 3.17Å; M558-K562 VanDerWaalsContact O-CB 3.31Å; M558-K562 WeakPolarHBondContact O-CB 3.32Å; M558-K562 PolarHBondContact O-N 3.36Å
559	H	77.8	Confident	73.8	Confident	114 Å²	114	121.9 Å²	121.9	53%	0.528	58%	0.582	S	S	.	*	H	α-helix	trans	-67.9	-46.1	174.4	-159.5	-57	0	0	0	112.3	K555 R557 E561 K562 D563	K555-H559 PolarHBondContact O-N 3.18Å; R557-H559 PolarHBondContact O-N 2.86Å; H559-E561 VanDerWaalsContact C-N 3.34Å; H559-E561 PolarHBondContact O-N 3.18Å; H559-K562 WeakPolarHBondContact O-CB 3.31Å; H559-K562 PolarHBondContact O-N 3.16Å; H559-D563 IonicContact CE1-OD1 3.85Å; H559-D563 IonicContact CE1-OD2 2.89Å; H559-D563 PolarHBondContact CE1-OD2 3.02Å; H559-D563 VanDerWaalsContact CE1-OD2 3.3Å; H559-D563 IonicContact ND1-OD1 3.97Å; H559-D563 IonicContact ND1-OD2 3.95Å; H559-D563 PolarHBondContact ND1-OD2 2.73Å; H559-D563 PolarHBondContact O-N 2.98Å
560	A	81.1	Confident	71.9	Confident	60 Å²	60	120.9 Å²	120.9	50%	0.496	59%	0.587	S	S	.	*	H	α-helix	trans	-63.8	-36.8	-179.5	0	0	0	0	0	112.9	R556 R557 D563 L564	R556-A560 PolarHBondContact O-N 3Å; R556-A560 VanDerWaalsContact O-N 3.16Å; R557-A560 PolarHBondContact O-N 3.17Å; A560-D563 PolarHBondContact O-N 3.05Å; A560-L564 PolarHBondContact O-N 3.26Å
561	E	76	Confident	69.9	Low	120 Å²	120	122.9 Å²	122.9	56%	0.561	60%	0.597	S	S	*	*	H	α-helix	trans	-64.9	-44.9	173.5	-175.2	174.3	175.1	0	0	111.5	R557 H559 D563 L564 I565	R557-E561 PolarHBondContact O-N 3.5Å; H559-E561 VanDerWaalsContact C-N 3.34Å; H559-E561 PolarHBondContact O-N 3.18Å; E561-D563 VanDerWaalsContact C-N 3.33Å; E561-D563 PolarHBondContact O-N 3.42Å; E561-L564 WeakPolarHBondContact O-CA 3.32Å; E561-L564 VanDerWaalsContact O-CB 3.26Å; E561-L564 WeakPolarHBondContact O-CB 3.48Å; E561-L564 PolarHBondContact O-N 2.94Å; E561-I565 HydrophobicContact CG-CD1 4.23Å; E561-I565 WeakPolarHBondContact O-CG1 3.39Å; E561-I565 PolarHBondContact O-N 3.06Å
562	K	70.9	Confident	68.5	Low	145 Å²	145	124.1 Å²	124.1	63%	0.63	61%	0.611	S	S	*	*	H	α-helix	trans	-62.9	-35.9	176.3	-170.6	175.5	-176.2	176.3	0	113.1	M558 H559 L564 T566	M558-K562 VanDerWaalsContact O-CB 3.31Å; M558-K562 WeakPolarHBondContact O-CB 3.32Å; M558-K562 PolarHBondContact O-N 3.36Å; H559-K562 WeakPolarHBondContact O-CB 3.31Å; H559-K562 PolarHBondContact O-N 3.16Å; K562-L564 VanDerWaalsContact C-N 3.29Å; K562-T566 WeakPolarHBondContact O-CB 3.29Å; K562-T566 PolarHBondContact O-N 3.02Å; K562-T566 PolarHBondContact O-OG1 3.3Å
563	D	71.7	Confident	66.4	Low	70 Å²	70	126.1 Å²	126.1	37%	0.374	63%	0.63	S	S	.	*	H	α-helix	trans	-69.1	-26.3	173.3	-69.4	-38.9	0	0	0	112.7	H559 A560 E561 K567	H559-D563 IonicContact CE1-OD1 3.85Å; H559-D563 IonicContact CE1-OD2 2.89Å; H559-D563 PolarHBondContact CE1-OD2 3.02Å; H559-D563 VanDerWaalsContact CE1-OD2 3.3Å; H559-D563 IonicContact ND1-OD1 3.97Å; H559-D563 IonicContact ND1-OD2 3.95Å; H559-D563 PolarHBondContact ND1-OD2 2.73Å; H559-D563 PolarHBondContact O-N 2.98Å; A560-D563 PolarHBondContact O-N 3.05Å; E561-D563 VanDerWaalsContact C-N 3.33Å; E561-D563 PolarHBondContact O-N 3.42Å; D563-K567 WeakPolarHBondContact O-CD 3.36Å; D563-K567 WeakPolarHBondContact O-CG 3.33Å; D563-K567 PolarHBondContact O-N 2.88Å
564	L	71.1	Confident	64.6	Low	122 Å²	122	128 Å²	128	64%	0.639	65%	0.646	S	S	*	*	H	α-helix	trans	-72.8	-52.8	174.8	-146.8	76.2	0	0	0	110.6	A560 E561 K562 T566 K567 E568	A560-L564 PolarHBondContact O-N 3.26Å; E561-L564 WeakPolarHBondContact O-CA 3.32Å; E561-L564 VanDerWaalsContact O-CB 3.26Å; E561-L564 WeakPolarHBondContact O-CB 3.48Å; E561-L564 PolarHBondContact O-N 2.94Å; K562-L564 VanDerWaalsContact C-N 3.29Å; L564-T566 PolarHBondContact O-N 2.79Å; L564-K567 WeakPolarHBondContact O-CB 3.48Å; L564-K567 PolarHBondContact O-N 3.48Å; L564-E568 PolarHBondContact O-N 3.21Å; L564-E568 VanDerWaalsContact O-N 3.15Å
565	I	62.7	Low	63.9	Low	95 Å²	95	127.3 Å²	127.3	49%	0.487	65%	0.653	S	S	.	*	H	α-helix	trans	-56.9	-39.3	177.3	-64.2	164.1	0	0	0	111.1	E561 K567 E568 T569	E561-I565 HydrophobicContact CG-CD1 4.23Å; E561-I565 WeakPolarHBondContact O-CG1 3.39Å; E561-I565 PolarHBondContact O-N 3.06Å; I565-K567 VanDerWaalsContact C-N 3.3Å; I565-K567 PolarHBondContact O-N 2.88Å; I565-E568 PolarHBondContact O-N 2.97Å; I565-T569 PolarHBondContact O-N 3.48Å; I565-T569 PolarHBondContact O-OG1 3.49Å
566	T	61.3	Low	62.2	Low	87 Å²	87	127.4 Å²	127.4	53%	0.534	67%	0.666	S	S	.	*	H	α-helix	trans	-63.9	-33.3	178.2	-58.4	0	0	0	0	112.4	K562 L564	K562-T566 WeakPolarHBondContact O-CB 3.29Å; K562-T566 PolarHBondContact O-N 3.02Å; K562-T566 PolarHBondContact O-OG1 3.3Å; L564-T566 PolarHBondContact O-N 2.79Å
567	K	61	Low	59.6	Low	161 Å²	161	123.2 Å²	123.2	70%	0.7	67%	0.67	S	S	*	*	H	α-helix	trans	-77.2	-33.6	177.2	-72.4	168	-176.8	168.3	0	112.8	D563 L564 I565 T569	D563-K567 WeakPolarHBondContact O-CD 3.36Å; D563-K567 WeakPolarHBondContact O-CG 3.33Å; D563-K567 PolarHBondContact O-N 2.88Å; L564-K567 WeakPolarHBondContact O-CB 3.48Å; L564-K567 PolarHBondContact O-N 3.48Å; I565-K567 VanDerWaalsContact C-N 3.3Å; I565-K567 PolarHBondContact O-N 2.88Å; K567-T569 PolarHBondContact O-N 3.17Å
568	E	55.5	Low	57.2	Low	168 Å²	168	118.1 Å²	118.1	79%	0.785	67%	0.671	S	S	*	*	H	α-helix	trans	-68.4	-25.1	177.5	-165.6	165.1	-156.8	0	0	112.5	L564 I565 T570	L564-E568 PolarHBondContact O-N 3.21Å; L564-E568 VanDerWaalsContact O-N 3.15Å; I565-E568 PolarHBondContact O-N 2.97Å; E568-T570 VanDerWaalsContact C-N 3.27Å; E568-T570 PolarHBondContact O-N 3.23Å
569	T	52.5	Low	55	Low	110 Å²	110	118.1 Å²	118.1	68%	0.675	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	5	-176.2	-51	0	0	0	0	114.4	I565 K567	I565-T569 PolarHBondContact O-N 3.48Å; I565-T569 PolarHBondContact O-OG1 3.49Å; K567-T569 PolarHBondContact O-N 3.17Å
570	T	46.4	Very low	53	Low	112 Å²	112	118.8 Å²	118.8	69%	0.687	69%	0.689	S	S	*	*			trans	-127.9	98.2	-175.6	-54.8	0	0	0	0	113.7	E568	E568-T570 VanDerWaalsContact C-N 3.27Å; E568-T570 PolarHBondContact O-N 3.23Å
571	Q	36.9	Very low	50.5	Low	184 Å²	184	121.4 Å²	121.4	86%	0.86	70%	0.699	S	S	*	*			trans	-129	147.3	157.2	-70.1	-164.3	23.7	0	0	110.6
572	P	48.7	Very low	48.3	Very low	126 Å²	126	123.7 Å²	123.7	82%	0.818	71%	0.71	S	S	*	*			trans	-97.4	156.5	-171.9	37.3	-35.1	0	0	0	114.5
573	V	35.3	Very low	46.2	Very low	140 Å²	140	124.8 Å²	124.8	85%	0.848	72%	0.717	S	S	*	*			trans	-128.7	137.7	171.4	-178.1	0	0	0	0	109
574	P	42.5	Very low	45.1	Very low	117 Å²	117	125.7 Å²	125.7	76%	0.76	73%	0.727	S	S	*	*			trans	-88.7	166.8	-169.6	34.6	-36.9	0	0	0	115.8
575	P	62.5	Low	43.2	Very low	115 Å²	115	126.9 Å²	126.9	75%	0.747	73%	0.732	S	S	*	*			trans	-110.2	178.9	-171.2	42.9	-36.5	0	0	0	115.4
576	P	43.8	Very low	41.7	Very low	121 Å²	121	127.2 Å²	127.2	79%	0.786	74%	0.739	S	S	*	*				-125.7	135.6	128.1	9	12.5	0	0	0	111.5
577	A	32.2	Very low	40.2	Very low	97 Å²	97	132 Å²	132	80%	0.802	75%	0.752	S	S	*	*				67	134.8	76.5	0	0	0	0	0	114.2
578	A	34.2	Very low	38.7	Very low	90 Å²	90	136 Å²	136	74%	0.744	76%	0.763	S	S	*	*			cis	-160.7	166	-9.5	0	0	0	0	0	108.1
579	V	30.9	Very low	37.4	Very low	127 Å²	127	138.2 Å²	138.2	77%	0.77	77%	0.766	S	S	*	*				163.7	113.9	96.8	158.8	0	0	0	0	105
580	V	35.1	Very low	36.2	Very low	127 Å²	127	139.5 Å²	139.5	77%	0.77	77%	0.768	S	S	*	*				59.4	119.4	90.5	163.4	0	0	0	0	112.9
581	T	30.4	Very low	36.6	Very low	115 Å²	115	139.2 Å²	139.2	71%	0.706	77%	0.768	S	S	*	*			cis	-147.4	-154.3	14	-7.3	0	0	0	0	109.5
582	H	29.6	Very low	37.3	Very low	169 Å²	169	135.4 Å²	135.4	78%	0.782	76%	0.76	S	S	*	*			cis	-152.5	-145.3	9.7	-141.6	-40.9	0	0	0	113.7
583	Q	26.2	Very low	36.5	Very low	168 Å²	168	137 Å²	137	79%	0.785	76%	0.76	S	S	*	*			trans	-168.2	-175.8	-172	-111.8	-166.7	41	0	0	108.9
584	P	48.8	Very low	36.1	Very low	89 Å²	89	134.7 Å²	134.7	58%	0.578	75%	0.75	S	S	*	*			cis	-146	-174.2	-29	36	-13.7	0	0	0	117
585	I	31.4	Very low	35.4	Very low	147 Å²	147	136.5 Å²	136.5	75%	0.754	75%	0.751	S	S	*	*				99.3	125.8	128.9	-100.5	169.1	0	0	0	126.7
586	T	29.7	Very low	34.1	Very low	102 Å²	102	134.7 Å²	134.7	63%	0.626	74%	0.741	S	S	*	*			trans	78.5	114.2	145.9	53.9	0	0	0	0	129.4
587	K	30.1	Very low	33.8	Very low	188 Å²	188	132.1 Å²	132.1	82%	0.817	73%	0.725	S	S	*	*				50.6	129.1	117	-56	174.6	-177.6	178.1	0	124.5
588	R	29.3	Very low	35	Very low	245 Å²	245	130.5 Å²	130.5	93%	0.925	71%	0.706	S	S	*	*				171.4	173.7	103.1	-91.2	-161.5	-170.6	-124.2	7.6	115.6
589	Y	28.9	Very low	35.7	Very low	214 Å²	214	129.9 Å²	129.9	84%	0.839	69%	0.694	S	S	*	*			trans	-64.5	173.4	179.2	-82.1	-159.7	0	0	0	115.8
590	D	26.5	Very low	35.6	Very low	136 Å²	136	130.4 Å²	130.4	73%	0.727	69%	0.689	S	S	*	*			cis	-158.5	173.6	14	-116.2	-18.6	0	0	0	113.9
591	P	55.8	Low	35.7	Very low	106 Å²	106	134.6 Å²	134.6	69%	0.688	69%	0.69	S	S	*	*			trans	-101.3	-154.1	-174	44.1	-39.9	0	0	0	115
592	P	51.9	Low	35.8	Very low	105 Å²	105	136 Å²	136	68%	0.682	69%	0.694	S	S	*	*			cis	-147	-157.3	3	42.4	-17.3	0	0	0	119
593	I	31.1	Very low	35.9	Very low	159 Å²	159	134.4 Å²	134.4	82%	0.815	69%	0.691	S	S	*	*			trans	70.2	160.7	159.3	62.4	165.5	0	0	0	121.5
594	S	27.1	Very low	36.2	Very low	92 Å²	92	137.3 Å²	137.3	64%	0.643	70%	0.696	S	S	*	*			cis	-165.1	157.9	4.5	-129.9	0	0	0	0	117.6
595	I	28.2	Very low	35.6	Very low	155 Å²	155	138.6 Å²	138.6	80%	0.795	71%	0.707	S	S	*	*			trans	64.8	129.9	148.8	-63.6	161.9	0	0	0	123.3
596	S	34.4	Very low	35.8	Very low	76 Å²	76	138.8 Å²	138.8	53%	0.531	71%	0.705	S	S	.	*			trans	-143.2	126.5	-177.8	-47.1	0	0	0	0	118.7	H922	S596-H922 PolarHBondContact OG-NE2 2.93Å; S596-H922 VanDerWaalsContact OG-NE2 3.07Å
597	P	38.3	Very low	36.4	Very low	68 Å²	68	138.8 Å²	138.8	44%	0.442	70%	0.704	S	S	.	*			trans	-54.9	168.7	168.5	38.3	-14.4	0	0	0	126.8	T921 L925	P597-T921 VanDerWaalsContact O-O 3.04Å; P597-L925 HydrophobicContact CB-CD1 3.94Å; P597-L925 HydrophobicContact CG-CD1 4.36Å; P597-L925 WeakPolarHBondContact O-CB 3.49Å
598	P	57.5	Low	37	Very low	62 Å²	62	138.4 Å²	138.4	40%	0.403	70%	0.703	S	S	.	*			trans	-132.4	143.3	151.2	38.6	-25	0	0	0	117.4	E924	P598-E924 VanDerWaalsContact CA-CB 3.44Å; P598-E924 HydrophobicContact CB-CB 3.39Å; P598-E924 HydrophobicContact CB-CG 4.27Å
599	P	47.8	Very low	38	Very low	78 Å²	78	128.2 Å²	128.2	51%	0.506	67%	0.668	S	S	.	*				-163.6	133.7	110.5	38.6	-14.4	0	0	0	123.2	E924	P599-E924 CarbonylContact C-O 3.56Å; P599-E924 WeakPolarHBondContact CA-O 3.48Å; P599-E924 WeakPolarHBondContact CD-O 3.47Å
600	Q	28.9	Very low	38.9	Very low	138 Å²	138	124.8 Å²	124.8	65%	0.645	67%	0.669	S	S	*	*			trans	82.3	109.9	136.3	-58.2	-62.6	-64.5	0	0	129	E924	Q600-E924 PolarHBondContact N-OE1 3.17Å; Q600-E924 PolarHBondContact NE2-OE1 3.41Å
601	R	37.8	Very low	40.2	Very low	214 Å²	214	119.5 Å²	119.5	81%	0.808	64%	0.642	S	S	*	*				25.7	127.9	124.5	-167.1	-173.9	-163.3	-165.5	4.7	124.8
602	N	32.8	Very low	39.9	Very low	145 Å²	145	120.7 Å²	120.7	78%	0.775	64%	0.642	S	S	*	*			trans	-167.6	167.2	133.5	-120.8	-11.9	0	0	0	120.1
603	N	31.7	Very low	39.6	Very low	135 Å²	135	121.4 Å²	121.4	72%	0.722	65%	0.65	S	S	*	*			trans	-55	168.3	-168.5	-64	-15.8	0	0	0	123
604	Y	33.3	Very low	40.5	Very low	229 Å²	229	121.7 Å²	121.7	90%	0.898	65%	0.653	S	S	*	*			trans	-128	170.4	164.6	-95.5	-87.8	0	0	0	113.4
605	S	34.3	Very low	42.2	Very low	116 Å²	116	118.9 Å²	118.9	81%	0.811	63%	0.632	S	S	*	*			trans	-88.5	160.8	-173.8	48.2	0	0	0	0	115.2
606	H	37.4	Very low	44.3	Very low	152 Å²	152	113.7 Å²	113.7	70%	0.704	61%	0.61	S	S	*	*			trans	-111.8	122.8	-167.9	-154.8	-33	0	0	0	111.6
607	V	42.2	Very low	46.1	Very low	101 Å²	101	115.8 Å²	115.8	61%	0.612	62%	0.621	S	S	*	*			trans	-87.4	141.2	159.4	177.9	0	0	0	0	107.7	V627	V607-V627 HydrophobicContact CB-CG1 4.33Å; V607-V627 HydrophobicContact CG1-CG1 4.27Å
608	K	42.2	Very low	47.7	Very low	181 Å²	181	120.4 Å²	120.4	79%	0.787	63%	0.63	S	S	*	*			trans	-110.3	113.1	171.9	-85.9	-164.3	170.3	-166.7	0	110.8
609	V	49.2	Very low	48.6	Very low	31 Å²	31	118.9 Å²	118.9	19%	0.188	62%	0.617	C	S	.	*			trans	-77.3	135.5	154.1	-178	0	0	0	0	107.1	V611 V627 V686	V609-V611 VanDerWaalsContact C-N 3.3Å; V609-V611 HydrophobicContact CB-CG2 4.04Å; V609-V611 HydrophobicContact CG1-CG2 3.97Å; V609-V611 PolarHBondContact O-N 3.42Å; V609-V627 HydrophobicContact CG2-CG2 3.64Å; V609-V686 HydrophobicContact CG1-CG1 3.87Å
610	T	48.2	Very low	50.1	Low	142 Å²	142	117.9 Å²	117.9	87%	0.871	61%	0.606	S	S	*	*			trans	-77.7	85.6	167.1	46.5	0	0	0	0	108.9
611	V	53.7	Low	52.4	Low	24 Å²	24	114 Å²	114	15%	0.145	60%	0.598	C	S	.	*			trans	-84.9	144.4	170.4	-153.5	0	0	0	0	108.6	V609 T615 I623 Y655	V609-V611 VanDerWaalsContact C-N 3.3Å; V609-V611 HydrophobicContact CB-CG2 4.04Å; V609-V611 HydrophobicContact CG1-CG2 3.97Å; V609-V611 PolarHBondContact O-N 3.42Å; V611-T615 HydrophobicContact CG1-CG2 4.13Å; V611-T615 VanDerWaalsContact CG1-OG1 3.23Å; V611-T615 WeakPolarHBondContact CG1-OG1 3.38Å; V611-I623 HydrophobicContact CG1-CD1 3.74Å; V611-I623 HydrophobicContact CG2-CD1 4.23Å; V611-I623 HydrophobicContact CG2-CG2 4.45Å; V611-Y655 HydrophobicContact CG1-CD2 4.48Å; V611-Y655 HydrophobicContact CG1-CE2 3.54Å; V611-Y655 WeakPolarHBondContact CG1-OH 3.38Å
612	D	50.6	Low	54.6	Low	131 Å²	131	104.3 Å²	104.3	70%	0.701	56%	0.561	S	S	*	*			trans	-64.9	144.7	174.5	-74.7	-51.2	0	0	0	111.5	D614 T615	D612-D614 VanDerWaalsContact C-N 3.26Å; D612-D614 PolarHBondContact O-N 3.19Å; D612-D614 VanDerWaalsContact O-N 3.08Å; D612-T615 PolarHBondContact O-N 2.89Å; D612-T615 PolarHBondContact O-OG1 2.88Å
613	S	45	Very low	57	Low	121 Å²	121	97.4 Å²	97.4	85%	0.846	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-13.6	-153.4	-64.7	0	0	0	0	115.7
614	D	50.2	Low	59.2	Low	165 Å²	165	94.3 Å²	94.3	88%	0.882	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	10.6	-177.8	-61.6	-55	0	0	0	113.6	D612 S616	D612-D614 VanDerWaalsContact C-N 3.26Å; D612-D614 PolarHBondContact O-N 3.19Å; D612-D614 VanDerWaalsContact O-N 3.08Å; D614-S616 PolarHBondContact O-N 2.95Å
615	T	62.5	Low	61.6	Low	32 Å²	32	86.2 Å²	86.2	20%	0.196	48%	0.48	C	S	.	.			trans	-64.2	126	-179.3	-59.9	0	0	0	0	112	V611 D612 Q619 I623	V611-T615 HydrophobicContact CG1-CG2 4.13Å; V611-T615 VanDerWaalsContact CG1-OG1 3.23Å; V611-T615 WeakPolarHBondContact CG1-OG1 3.38Å; D612-T615 PolarHBondContact O-N 2.89Å; D612-T615 PolarHBondContact O-OG1 2.88Å; T615-Q619 HydrophobicContact CG2-CB 3.94Å; T615-Q619 HydrophobicContact CG2-CG 3.81Å; T615-I623 HydrophobicContact CG2-CD1 4.01Å
616	S	73.4	Confident	63.9	Low	47 Å²	47	80.7 Å²	80.7	33%	0.329	44%	0.441	S	S	.	.			trans	-62.7	146.2	-174.9	76.2	0	0	0	0	112.9	D614 R618 Q619 Q620	D614-S616 PolarHBondContact O-N 2.95Å; S616-R618 PolarHBondContact O-N 3.05Å; S616-Q619 CarbonylContact O-C 3.21Å; S616-Q619 WeakPolarHBondContact O-CA 3.3Å; S616-Q619 WeakPolarHBondContact O-CB 3.26Å; S616-Q619 PolarHBondContact O-N 3.22Å; S616-Q619 VanDerWaalsContact OG-CB 3.28Å; S616-Q619 WeakPolarHBondContact OG-CB 3.37Å; S616-Q619 PolarHBondContact OG-N 2.7Å; S616-Q619 PolarHBondContact OG-OE1 3.48Å; S616-Q620 PolarHBondContact O-N 3.23Å
617	P	72.2	Confident	65.8	Low	119 Å²	119	74.9 Å²	74.9	77%	0.773	42%	0.417	S	S	*	.	H	α-helix	trans	-58	-26.4	-176.4	-28.2	35.4	0	0	0	115.1	A621	P617-A621 WeakPolarHBondContact O-CB 3.22Å; P617-A621 PolarHBondContact O-N 2.92Å; P617-A621 VanDerWaalsContact O-N 3.14Å
618	R	71.3	Confident	67.4	Low	166 Å²	166	74.3 Å²	74.3	63%	0.626	42%	0.423	S	S	*	.	H	α-helix	trans	-75.3	-35.2	175.6	-175	178.3	-176.7	171.8	1.3	112.4	S616 F622 M671	S616-R618 PolarHBondContact O-N 3.05Å; R618-F622 PolarHBondContact O-N 3.31Å; R618-M671 HydrophobicContact CG-SD 4.34Å
619	Q	76.5	Confident	69.1	Low	29 Å²	29	71.9 Å²	71.9	14%	0.136	41%	0.412	C	S	.	.	H	α-helix	trans	-77.5	-37.2	177.3	-173.4	173.5	-8	0	0	110.5	T615 S616 F622 I623 G653 Y655 M671	T615-Q619 HydrophobicContact CG2-CB 3.94Å; T615-Q619 HydrophobicContact CG2-CG 3.81Å; S616-Q619 CarbonylContact O-C 3.21Å; S616-Q619 WeakPolarHBondContact O-CA 3.3Å; S616-Q619 WeakPolarHBondContact O-CB 3.26Å; S616-Q619 PolarHBondContact O-N 3.22Å; S616-Q619 VanDerWaalsContact OG-CB 3.28Å; S616-Q619 WeakPolarHBondContact OG-CB 3.37Å; S616-Q619 PolarHBondContact OG-N 2.7Å; S616-Q619 PolarHBondContact OG-OE1 3.48Å; Q619-F622 WeakPolarHBondContact O-CB 3.46Å; Q619-F622 PolarHBondContact O-N 3.06Å; Q619-F622 VanDerWaalsContact O-N 3.14Å; Q619-I623 WeakPolarHBondContact O-CG1 3.37Å; Q619-I623 PolarHBondContact O-N 3.27Å; Q619-G653 PolarHBondContact NE2-O 3.22Å; Q619-Y655 HydrophobicContact CG-CD2 4.38Å; Q619-M671 HydrophobicContact CB-SD 4.31Å
620	Q	77.9	Confident	70.5	Confident	57 Å²	57	73.5 Å²	73.5	27%	0.266	44%	0.435	S	S	.	.	H	α-helix	trans	-58.4	-49.5	169	-171.6	60.9	49.6	0	0	111.3	S616 F622 I623 D624	S616-Q620 PolarHBondContact O-N 3.23Å; Q620-F622 PolarHBondContact O-N 3.3Å; Q620-F622 VanDerWaalsContact O-N 3.16Å; Q620-I623 WeakPolarHBondContact O-CB 3.39Å; Q620-I623 PolarHBondContact O-N 3.31Å; Q620-I623 VanDerWaalsContact O-N 3.08Å; Q620-D624 PolarHBondContact NE2-OD1 3.27Å; Q620-D624 PolarHBondContact O-N 3.34Å
621	A	78.6	Confident	71.9	Confident	57 Å²	57	67.4 Å²	67.4	47%	0.471	40%	0.401	S	S	.	.	H	α-helix	trans	-61.9	-23.7	176.4	0	0	0	0	0	113.9	P617 D625	P617-A621 WeakPolarHBondContact O-CB 3.22Å; P617-A621 PolarHBondContact O-N 2.92Å; P617-A621 VanDerWaalsContact O-N 3.14Å; A621-D625 WeakPolarHBondContact O-CB 3.48Å; A621-D625 PolarHBondContact O-N 2.96Å
622	F	83.3	Confident	73.4	Confident	11 Å²	11	70.6 Å²	70.6	5%	0.048	41%	0.413	C	S	.	.	H	α-helix	trans	-79.3	-40	173	178.7	-112.5	0	0	0	112	R618 Q619 Q620 D625 I626 Y655 E657 N670 M671	R618-F622 PolarHBondContact O-N 3.31Å; Q619-F622 WeakPolarHBondContact O-CB 3.46Å; Q619-F622 PolarHBondContact O-N 3.06Å; Q619-F622 VanDerWaalsContact O-N 3.14Å; Q620-F622 PolarHBondContact O-N 3.3Å; Q620-F622 VanDerWaalsContact O-N 3.16Å; F622-D625 PolarHBondContact O-N 3.44Å; F622-I626 HydrophobicContact CD1-CD1 3.92Å; F622-I626 HydrophobicContact CD2-CD1 4.44Å; F622-I626 HydrophobicContact CE1-CD1 3.57Å; F622-I626 HydrophobicContact CE2-CD1 4.13Å; F622-I626 HydrophobicContact CG-CD1 4.36Å; F622-I626 HydrophobicContact CZ-CD1 3.69Å; F622-I626 WeakPolarHBondContact O-CG1 3.28Å; F622-I626 PolarHBondContact O-N 3.2Å; F622-I626 VanDerWaalsContact O-N 3.11Å; F622-Y655 WeakPolarHBondContact CE1-O 3.24Å; F622-E657 HydrophobicContact CZ-CB 4.41Å; F622-N670 WeakPolarHBondContact CZ-O 3.44Å; F622-M671 HydrophobicContact CB-CB 4.06Å; F622-M671 HydrophobicContact CD1-CB 3.77Å; F622-M671 HydrophobicContact CD2-CB 4.22Å; F622-M671 HydrophobicContact CE1-CB 4.23Å; F622-M671 HydrophobicContact CG-CB 3.75Å
623	I	83.3	Confident	75.3	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-59.6	-50.2	170.9	-66.5	162.5	0	0	0	109.8	V611 T615 Q619 Q620 D625 I626 V627 L633 Y655	V611-I623 HydrophobicContact CG1-CD1 3.74Å; V611-I623 HydrophobicContact CG2-CD1 4.23Å; V611-I623 HydrophobicContact CG2-CG2 4.45Å; T615-I623 HydrophobicContact CG2-CD1 4.01Å; Q619-I623 WeakPolarHBondContact O-CG1 3.37Å; Q619-I623 PolarHBondContact O-N 3.27Å; Q620-I623 WeakPolarHBondContact O-CB 3.39Å; Q620-I623 PolarHBondContact O-N 3.31Å; Q620-I623 VanDerWaalsContact O-N 3.08Å; I623-D625 VanDerWaalsContact C-N 3.28Å; I623-D625 PolarHBondContact O-N 3.26Å; I623-I626 PolarHBondContact O-N 3Å; I623-I626 VanDerWaalsContact O-N 3.12Å; I623-V627 HydrophobicContact CG2-CG2 4.02Å; I623-V627 WeakPolarHBondContact O-CB 3.43Å; I623-V627 WeakPolarHBondContact O-CG2 3.5Å; I623-V627 PolarHBondContact O-N 3.4Å; I623-L633 HydrophobicContact CG2-CD2 3.88Å; I623-Y655 HydrophobicContact CD1-CD1 4.27Å; I623-Y655 HydrophobicContact CD1-CD2 3.47Å; I623-Y655 VanDerWaalsContact CD1-CD2 3.47Å; I623-Y655 HydrophobicContact CD1-CE2 3.86Å; I623-Y655 HydrophobicContact CD1-CG 3.72Å; I623-Y655 HydrophobicContact CG1-CD1 4.36Å; I623-Y655 HydrophobicContact CG1-CD2 4.12Å; I623-Y655 HydrophobicContact CG1-CG 3.86Å
624	D	78.9	Confident	77.4	Confident	69 Å²	69	58.6 Å²	58.6	37%	0.369	34%	0.339	S	S	.	.	H	α-helix	trans	-60.5	-37.2	-178.6	-61.7	-22.3	0	0	0	111.8	Q620 A628	Q620-D624 PolarHBondContact NE2-OD1 3.27Å; Q620-D624 PolarHBondContact O-N 3.34Å; D624-A628 WeakPolarHBondContact O-CB 3.25Å; D624-A628 PolarHBondContact O-N 3.38Å
625	D	82.2	Confident	79.4	Confident	60 Å²	60	52.2 Å²	52.2	32%	0.321	31%	0.306	S	S	.	.	H	α-helix	trans	-67.2	-38.3	175.1	179.6	69.8	0	0	0	112.8	A621 F622 I623 K629	A621-D625 WeakPolarHBondContact O-CB 3.48Å; A621-D625 PolarHBondContact O-N 2.96Å; F622-D625 PolarHBondContact O-N 3.44Å; I623-D625 VanDerWaalsContact C-N 3.28Å; I623-D625 PolarHBondContact O-N 3.26Å; D625-K629 VanDerWaalsContact O-CD 3.31Å; D625-K629 WeakPolarHBondContact O-CD 3.37Å; D625-K629 VanDerWaalsContact O-CG 3.25Å; D625-K629 WeakPolarHBondContact O-CG 3.41Å; D625-K629 PolarHBondContact O-N 2.96Å; D625-K629 WeakPolarHBondContact OD1-CE 3.32Å; D625-K629 IonicContact OD1-NZ 2.64Å; D625-K629 PolarHBondContact OD1-NZ 3.42Å; D625-K629 IonicContact OD2-NZ 3.72Å; D625-K629 PolarHBondContact OD2-NZ 3.45Å
626	I	82.9	Confident	80.8	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-69.8	-44.8	174	-65.3	162.2	0	0	0	110.6	F622 I623 A628 K629 G630 G631 L633 E657	F622-I626 HydrophobicContact CD1-CD1 3.92Å; F622-I626 HydrophobicContact CD2-CD1 4.44Å; F622-I626 HydrophobicContact CE1-CD1 3.57Å; F622-I626 HydrophobicContact CE2-CD1 4.13Å; F622-I626 HydrophobicContact CG-CD1 4.36Å; F622-I626 HydrophobicContact CZ-CD1 3.69Å; F622-I626 WeakPolarHBondContact O-CG1 3.28Å; F622-I626 PolarHBondContact O-N 3.2Å; F622-I626 VanDerWaalsContact O-N 3.11Å; I623-I626 PolarHBondContact O-N 3Å; I623-I626 VanDerWaalsContact O-N 3.12Å; I626-A628 PolarHBondContact O-N 3.38Å; I626-K629 CarbonylContact O-C 3.58Å; I626-K629 PolarHBondContact O-N 2.8Å; I626-K629 VanDerWaalsContact O-N 3.15Å; I626-G630 PolarHBondContact O-N 3.27Å; I626-G630 VanDerWaalsContact O-N 3.08Å; I626-G631 PolarHBondContact O-N 2.57Å; I626-L633 HydrophobicContact CB-CD1 4.33Å; I626-L633 HydrophobicContact CD1-CD1 3.65Å; I626-L633 HydrophobicContact CG2-CB 4.19Å; I626-L633 HydrophobicContact CG2-CD1 4.1Å; I626-E657 HydrophobicContact CD1-CB 3.78Å; I626-E657 HydrophobicContact CG1-CB 4.13Å; I626-E657 HydrophobicContact CG1-CG 4.39Å
627	V	78.8	Confident	81.3	Confident	30 Å²	30	50.4 Å²	50.4	18%	0.182	29%	0.293	C	S	.	.	H	α-helix	trans	-59.4	-46.6	177.5	173.2	0	0	0	0	110.4	V607 V609 I623 K629 G630 F688	V607-V627 HydrophobicContact CB-CG1 4.33Å; V607-V627 HydrophobicContact CG1-CG1 4.27Å; V609-V627 HydrophobicContact CG2-CG2 3.64Å; I623-V627 HydrophobicContact CG2-CG2 4.02Å; I623-V627 WeakPolarHBondContact O-CB 3.43Å; I623-V627 WeakPolarHBondContact O-CG2 3.5Å; I623-V627 PolarHBondContact O-N 3.4Å; V627-K629 PolarHBondContact O-N 3.29Å; V627-G630 PolarHBondContact O-N 3.4Å; V627-G630 VanDerWaalsContact O-N 3.07Å; V627-F688 HydrophobicContact CG2-CE1 4.07Å
628	A	74.1	Confident	81.8	Confident	89 Å²	89	48.6 Å²	48.6	74%	0.736	27%	0.271	S	S	*	.	H	α-helix	trans	-64.4	-23.8	178.1	0	0	0	0	0	113.6	D624 I626	D624-A628 WeakPolarHBondContact O-CB 3.25Å; D624-A628 PolarHBondContact O-N 3.38Å; I626-A628 PolarHBondContact O-N 3.38Å
629	K	79.5	Confident	82.5	Confident	129 Å²	129	44.1 Å²	44.1	56%	0.561	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-6.3	174.9	-69.4	167.4	-168.6	167.2	0	113.7	D625 I626 V627 G631	D625-K629 VanDerWaalsContact O-CD 3.31Å; D625-K629 WeakPolarHBondContact O-CD 3.37Å; D625-K629 VanDerWaalsContact O-CG 3.25Å; D625-K629 WeakPolarHBondContact O-CG 3.41Å; D625-K629 PolarHBondContact O-N 2.96Å; D625-K629 WeakPolarHBondContact OD1-CE 3.32Å; D625-K629 IonicContact OD1-NZ 2.64Å; D625-K629 PolarHBondContact OD1-NZ 3.42Å; D625-K629 IonicContact OD2-NZ 3.72Å; D625-K629 PolarHBondContact OD2-NZ 3.45Å; I626-K629 CarbonylContact O-C 3.58Å; I626-K629 PolarHBondContact O-N 2.8Å; I626-K629 VanDerWaalsContact O-N 3.15Å; V627-K629 PolarHBondContact O-N 3.29Å; K629-G631 PolarHBondContact O-N 2.97Å
630	G	76.8	Confident	82.9	Confident	65 Å²	65	44.9 Å²	44.9	67%	0.67	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	23.5	-173	0	0	0	0	0	113.9	I626 V627	I626-G630 PolarHBondContact O-N 3.27Å; I626-G630 VanDerWaalsContact O-N 3.08Å; V627-G630 PolarHBondContact O-N 3.4Å; V627-G630 VanDerWaalsContact O-N 3.07Å
631	G	78	Confident	83.3	Confident	15 Å²	15	44.5 Å²	44.5	16%	0.155	27%	0.272	C	S	.	.			trans	-72.1	154.4	-178.5	0	0	0	0	0	113.1	I626 K629 L633 F688	I626-G631 PolarHBondContact O-N 2.57Å; K629-G631 PolarHBondContact O-N 2.97Å; G631-L633 PolarHBondContact O-N 3.16Å; G631-F688 WeakPolarHBondContact O-CZ 3.26Å
632	K	85.9	Confident	83.5	Confident	91 Å²	91	42.9 Å²	42.9	40%	0.396	26%	0.262	S	S	.	.			trans	-68.4	111.2	173.8	-72	-177.1	-175.8	-178.5	0	109.6	V658 D661 M685	K632-V658 HydrophobicContact CB-CB 3.89Å; K632-V658 PolarHBondContact O-N 3.29Å; K632-D661 IonicContact NZ-OD1 3.55Å; K632-D661 PolarHBondContact NZ-OD1 3.44Å; K632-D661 IonicContact NZ-OD2 2.64Å; K632-D661 PolarHBondContact NZ-OD2 2.88Å; K632-M685 HydrophobicContact CB-CE 4Å; K632-M685 HydrophobicContact CG-CE 4.33Å
633	L	89.4	Confident	82.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	130	176.9	-172	70.9	0	0	0	110.5	I623 I626 G631 Y655 M685 V686 F688	I623-L633 HydrophobicContact CG2-CD2 3.88Å; I626-L633 HydrophobicContact CB-CD1 4.33Å; I626-L633 HydrophobicContact CD1-CD1 3.65Å; I626-L633 HydrophobicContact CG2-CB 4.19Å; I626-L633 HydrophobicContact CG2-CD1 4.1Å; G631-L633 PolarHBondContact O-N 3.16Å; L633-Y655 HydrophobicContact CD1-CD1 4.31Å; L633-Y655 HydrophobicContact CD2-CD1 4.18Å; L633-Y655 HydrophobicContact CG-CD1 4.19Å; L633-M685 WeakPolarHBondContact O-CE 3.33Å; L633-V686 HydrophobicContact CB-CB 4.29Å; L633-V686 HydrophobicContact CB-CG2 4.43Å; L633-V686 HydrophobicContact CD2-CB 4.04Å; L633-V686 HydrophobicContact CD2-CG1 4.18Å; L633-V686 HydrophobicContact CD2-CG2 3.96Å; L633-V686 HydrophobicContact CG-CB 4.22Å; L633-V686 HydrophobicContact CG-CG2 3.93Å; L633-V686 PolarHBondContact O-N 3.11Å; L633-F688 HydrophobicContact CB-CZ 3.93Å
634	A	90.3	Very high	82.2	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	149	169.2	0	0	0	0	0	110.8	Y655 L656 V658 L683 S684 M685	A634-Y655 WeakPolarHBondContact O-CA 3.39Å; A634-L656 PolarHBondContact N-O 3.29Å; A634-L656 PolarHBondContact O-N 2.78Å; A634-V658 HydrophobicContact CB-CG2 3.54Å; A634-L683 HydrophobicContact CB-CB 4.3Å; A634-L683 HydrophobicContact CB-CD2 4.43Å; A634-S684 CarbonylContact C-O 3.53Å; A634-S684 VanDerWaalsContact CA-O 3.28Å; A634-S684 WeakPolarHBondContact CA-O 3.26Å; A634-M685 HydrophobicContact CB-SD 4.13Å
635	V	91.7	Very high	82.1	Confident	30 Å²	30	57.3 Å²	57.3	18%	0.182	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	137	167.8	67.8	0	0	0	0	109.6	T637 Y655 S684 V686	V635-T637 PolarHBondContact O-N 3.29Å; V635-Y655 HydrophobicContact CB-CD1 3.82Å; V635-Y655 HydrophobicContact CB-CE1 3.58Å; V635-Y655 HydrophobicContact CG2-CD1 4.09Å; V635-Y655 HydrophobicContact CG2-CD2 4.48Å; V635-Y655 HydrophobicContact CG2-CE1 3.77Å; V635-Y655 HydrophobicContact CG2-CE2 4.19Å; V635-Y655 HydrophobicContact CG2-CG 4.43Å; V635-S684 PolarHBondContact N-O 2.86Å; V635-S684 PolarHBondContact O-N 3.34Å; V635-V686 HydrophobicContact CB-CG2 4.39Å
636	V	91.9	Very high	82	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.012	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	120.7	175.7	175.2	0	0	0	0	108.8	Y638 V650 H651 K652 G653 E654 L656 I682 L683	V636-Y638 WeakPolarHBondContact CG1-O 3.5Å; V636-V650 HydrophobicContact CG1-CB 4.13Å; V636-V650 HydrophobicContact CG1-CG2 3.9Å; V636-V650 HydrophobicContact CG2-CB 3.96Å; V636-V650 HydrophobicContact CG2-CG1 4.4Å; V636-V650 HydrophobicContact CG2-CG2 4.31Å; V636-H651 VanDerWaalsContact CB-O 3.26Å; V636-H651 WeakPolarHBondContact CB-O 3.49Å; V636-H651 VanDerWaalsContact CG1-O 3.22Å; V636-H651 WeakPolarHBondContact CG1-O 3.29Å; V636-K652 WeakPolarHBondContact O-CA 3.32Å; V636-G653 PolarHBondContact O-N 3.12Å; V636-E654 WeakPolarHBondContact CB-O 3.27Å; V636-E654 HydrophobicContact CG2-CB 4.36Å; V636-E654 WeakPolarHBondContact CG2-O 3.45Å; V636-E654 PolarHBondContact N-O 3.38Å; V636-L656 HydrophobicContact CG2-CD1 3.47Å; V636-L656 VanDerWaalsContact CG2-CD1 3.47Å; V636-L656 HydrophobicContact CG2-CG 3.77Å; V636-I682 WeakPolarHBondContact CA-O 3.43Å; V636-L683 HydrophobicContact CG2-CD2 3.82Å
637	T	84.4	Confident	82.2	Confident	40 Å²	40	63 Å²	63	25%	0.245	36%	0.362	C	S	.	.			trans	-87	-19.7	-177.1	52	0	0	0	0	113.4	V635 K652 I682	V635-T637 PolarHBondContact O-N 3.29Å; T637-K652 WeakPolarHBondContact O-CD 3.36Å; T637-K652 WeakPolarHBondContact O-CE 3.41Å; T637-K652 WeakPolarHBondContact O-CG 3.37Å; T637-I682 PolarHBondContact N-O 3.19Å; T637-I682 VanDerWaalsContact OG1-C 3.22Å; T637-I682 WeakPolarHBondContact OG1-CA 3.42Å; T637-I682 PolarHBondContact OG1-O 3.48Å
638	Y	83.3	Confident	82.7	Confident	80 Å²	80	62 Å²	62	31%	0.314	36%	0.356	S	S	.	.	S	Bend	trans	-146.9	140.6	-176.5	-56.8	-63.8	0	0	0	111.7	A137 W139 V636 I682	A137-Y638 HydrophobicContact CB-CD2 4.43Å; W139-Y638 HydrophobicContact CB-CD1 3.56Å; W139-Y638 HydrophobicContact CB-CE1 3.68Å; W139-Y638 AromaticContact CD1-CD1 3.93Å; W139-Y638 AromaticContact CG-CD1 3.85Å; W139-Y638 HydrophobicContact CG-CD1 3.85Å; W139-Y638 HydrophobicContact CG-CE1 4.33Å; V636-Y638 WeakPolarHBondContact CG1-O 3.5Å; Y638-I682 HydrophobicContact CD2-CB 4.21Å; Y638-I682 HydrophobicContact CD2-CG2 3.96Å
639	D	86.1	Confident	83.5	Confident	73 Å²	73	61.1 Å²	61.1	39%	0.39	34%	0.341	S	S	.	.			trans	-63.4	138.5	175.5	-51.9	-83.4	0	0	0	111.8	W139 H651 K652	W139-D639 PolarHBondContact NE1-OD2 2.9Å; D639-H651 VanDerWaalsContact OD1-CA 3.29Å; D639-H651 WeakPolarHBondContact OD1-CA 3.44Å; D639-K652 PolarHBondContact OD1-N 3.22Å; D639-K652 WeakPolarHBondContact OD2-CB 3.49Å
640	R	83.5	Confident	84	Confident	45 Å²	45	55 Å²	55	17%	0.17	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-152.6	119.5	176.6	-169.6	169.9	179.7	-74.3	-10.7	112.4	E647 T649 V650 I682	R640-E647 IonicContact CZ-OE2 3.6Å; R640-E647 IonicContact NH1-OE2 3.2Å; R640-E647 PolarHBondContact NH1-OE2 3.39Å; R640-E647 IonicContact NH2-OE2 3.76Å; R640-E647 PolarHBondContact NH2-OE2 2.88Å; R640-T649 WeakPolarHBondContact O-CA 3.43Å; R640-V650 HydrophobicContact CB-CG2 4.07Å; R640-V650 PolarHBondContact N-O 3.42Å; R640-V650 PolarHBondContact O-N 3.18Å; R640-I682 HydrophobicContact CB-CD1 3.55Å; R640-I682 HydrophobicContact CG-CD1 4.22Å
641	G	85.8	Confident	84.5	Confident	48 Å²	48	57 Å²	57	50%	0.495	31%	0.306	S	S	.	.			trans	-68.2	134.2	165	0	0	0	0	0	111.5	Q643	G641-Q643 PolarHBondContact O-N 3.3Å
642	G	84.1	Confident	84.9	Confident	24 Å²	24	60.6 Å²	60.6	25%	0.247	32%	0.318	C	S	.	.			trans	-69.7	120.4	172.7	0	0	0	0	0	110.7	N644 T649	G642-N644 VanDerWaalsContact C-N 3.27Å; G642-N644 PolarHBondContact O-N 2.64Å; G642-T649 PolarHBondContact N-OG1 2.78Å
643	Q	62.4	Low	84.7	Confident	155 Å²	155	57.8 Å²	57.8	72%	0.724	32%	0.315	S	S	*	.	S	Bend	trans	-79.6	-7.8	-171.9	-64.7	179.9	-19	0	0	113.7	G641 E647	G641-Q643 PolarHBondContact O-N 3.3Å; Q643-E647 PolarHBondContact N-OE2 3.49Å
644	N	76.6	Confident	84.7	Confident	79 Å²	79	58.5 Å²	58.5	42%	0.422	32%	0.318	S	S	.	.	S	Bend	trans	-158.2	174.3	175.2	59.4	76.3	0	0	0	110.3	G642 K646 E647	G642-N644 VanDerWaalsContact C-N 3.27Å; G642-N644 PolarHBondContact O-N 2.64Å; N644-K646 PolarHBondContact O-N 3.08Å; N644-K646 WeakPolarHBondContact OD1-CB 3.46Å; N644-K646 PolarHBondContact OD1-N 3.37Å; N644-E647 PolarHBondContact ND2-OE1 3.05Å; N644-E647 PolarHBondContact O-N 3.13Å
645	T	76.3	Confident	84.7	Confident	149 Å²	149	59.3 Å²	59.3	91%	0.914	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-1.8	-175.4	55.5	0	0	0	0	116
646	K	81.1	Confident	84.8	Confident	148 Å²	148	57.9 Å²	57.9	64%	0.643	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.4	-10.1	174	-55.5	176.7	-176.5	171.4	0	113	N644 G676 Y677	N644-K646 PolarHBondContact O-N 3.08Å; N644-K646 WeakPolarHBondContact OD1-CB 3.46Å; N644-K646 PolarHBondContact OD1-N 3.37Å; K646-G676 WeakPolarHBondContact O-CA 3.48Å; K646-Y677 HydrophobicContact CB-CD2 4.16Å; K646-Y677 WeakPolarHBondContact O-CD2 3.4Å; K646-Y677 PolarHBondContact O-N 3.1Å
647	E	87.1	Confident	84.9	Confident	30 Å²	30	59.4 Å²	59.4	14%	0.14	32%	0.32	C	S	.	.	B	Isolated β-bridge	trans	-95.7	141.4	179.4	-66.4	-178	-151.2	0	0	110.8	R640 Q643 N644 W665 Y677	R640-E647 IonicContact CZ-OE2 3.6Å; R640-E647 IonicContact NH1-OE2 3.2Å; R640-E647 PolarHBondContact NH1-OE2 3.39Å; R640-E647 IonicContact NH2-OE2 3.76Å; R640-E647 PolarHBondContact NH2-OE2 2.88Å; Q643-E647 PolarHBondContact N-OE2 3.49Å; N644-E647 PolarHBondContact ND2-OE1 3.05Å; N644-E647 PolarHBondContact O-N 3.13Å; E647-W665 VanDerWaalsContact CD-CH2 3.46Å; E647-W665 VanDerWaalsContact CD-CZ3 3.4Å; E647-W665 HydrophobicContact CG-CH2 4.21Å; E647-W665 HydrophobicContact CG-CZ3 3.67Å; E647-W665 WeakPolarHBondContact OE1-CH2 2.99Å; E647-Y677 WeakPolarHBondContact CA-O 3.46Å
648	L	88.9	Confident	85.3	Confident	10 Å²	10	57.9 Å²	57.9	5%	0.052	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-89	126.3	177.2	-167	64.6	0	0	0	109.6	V650 L656 N670 R674 Y677 V678	L648-V650 HydrophobicContact CB-CG1 4.16Å; L648-V650 HydrophobicContact CD2-CG1 3.88Å; L648-V650 HydrophobicContact CG-CG1 3.83Å; L648-L656 HydrophobicContact CD2-CD2 4.31Å; L648-N670 HydrophobicContact CD2-CB 4.23Å; L648-R674 HydrophobicContact CD1-CB 3.8Å; L648-Y677 PolarHBondContact N-O 3.49Å; L648-Y677 VanDerWaalsContact N-O 3.11Å; L648-V678 HydrophobicContact CB-CG2 3.77Å; L648-V678 HydrophobicContact CD2-CG2 4.25Å
649	T	90.1	Very high	85.6	Confident	71 Å²	71	57.9 Å²	57.9	44%	0.436	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-71.4	125.6	164.5	-63.6	0	0	0	0	109	R640 G642	R640-T649 WeakPolarHBondContact O-CA 3.43Å; G642-T649 PolarHBondContact N-OG1 2.78Å
650	V	90.6	Very high	85.7	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.006	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-137.6	150.1	-173	-64.6	0	0	0	0	110.8	V636 R640 L648 L656 V678 I682	V636-V650 HydrophobicContact CG1-CB 4.13Å; V636-V650 HydrophobicContact CG1-CG2 3.9Å; V636-V650 HydrophobicContact CG2-CB 3.96Å; V636-V650 HydrophobicContact CG2-CG1 4.4Å; V636-V650 HydrophobicContact CG2-CG2 4.31Å; R640-V650 HydrophobicContact CB-CG2 4.07Å; R640-V650 PolarHBondContact N-O 3.42Å; R640-V650 PolarHBondContact O-N 3.18Å; L648-V650 HydrophobicContact CB-CG1 4.16Å; L648-V650 HydrophobicContact CD2-CG1 3.88Å; L648-V650 HydrophobicContact CG-CG1 3.83Å; V650-L656 HydrophobicContact CG1-CD1 3.87Å; V650-L656 HydrophobicContact CG1-CD2 4.39Å; V650-V678 HydrophobicContact CG1-CG2 3.93Å; V650-V678 HydrophobicContact CG2-CG1 4.21Å; V650-I682 HydrophobicContact CG2-CD1 3.92Å
651	H	87.7	Confident	85.8	Confident	106 Å²	106	58.8 Å²	58.8	49%	0.491	32%	0.319	S	S	.	.			trans	-118.7	151.7	-179.7	-55	81.5	0	0	0	111.4	V636 D639 G653 E654	V636-H651 VanDerWaalsContact CB-O 3.26Å; V636-H651 WeakPolarHBondContact CB-O 3.49Å; V636-H651 VanDerWaalsContact CG1-O 3.22Å; V636-H651 WeakPolarHBondContact CG1-O 3.29Å; D639-H651 VanDerWaalsContact OD1-CA 3.29Å; D639-H651 WeakPolarHBondContact OD1-CA 3.44Å; H651-G653 PolarHBondContact O-N 3.49Å; H651-E654 PolarHBondContact N-OE2 3.48Å; H651-E654 VanDerWaalsContact N-OE2 3.16Å; H651-E654 IonicContact ND1-OE2 3.69Å; H651-E654 WeakPolarHBondContact O-CB 3.26Å; H651-E654 PolarHBondContact O-N 3Å
652	K	86	Confident	85	Confident	90 Å²	90	63.6 Å²	63.6	39%	0.391	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	131.2	177.9	179.8	172.6	178.6	-177.7	0	110.5	W139 V636 T637 D639 E654	W139-K652 HydrophobicContact CD2-CD 4.1Å; W139-K652 VanDerWaalsContact CD2-NZ 3.31Å; W139-K652 VanDerWaalsContact CE2-CD 3.49Å; W139-K652 HydrophobicContact CH2-CD 4.1Å; W139-K652 HydrophobicContact CZ2-CD 3.51Å; V636-K652 WeakPolarHBondContact O-CA 3.32Å; T637-K652 WeakPolarHBondContact O-CD 3.36Å; T637-K652 WeakPolarHBondContact O-CE 3.41Å; T637-K652 WeakPolarHBondContact O-CG 3.37Å; D639-K652 PolarHBondContact OD1-N 3.22Å; D639-K652 WeakPolarHBondContact OD2-CB 3.49Å; K652-E654 VanDerWaalsContact C-N 3.28Å; K652-E654 PolarHBondContact O-N 3.42Å
653	G	80.6	Confident	84.7	Confident	33 Å²	33	70.8 Å²	70.8	34%	0.34	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	-3.8	-172.2	0	0	0	0	0	114.9	Q619 V636 H651 Y655	Q619-G653 PolarHBondContact NE2-O 3.22Å; V636-G653 PolarHBondContact O-N 3.12Å; H651-G653 PolarHBondContact O-N 3.49Å; G653-Y655 PolarHBondContact O-N 3.05Å
654	E	89.9	Confident	85.8	Confident	14 Å²	14	69.1 Å²	69.1	7%	0.065	35%	0.345	C	S	.	.			trans	-67.6	129.7	169.1	-166.5	169.4	-174.4	0	0	109.3	V636 H651 K652 L656 N670	V636-E654 WeakPolarHBondContact CB-O 3.27Å; V636-E654 HydrophobicContact CG2-CB 4.36Å; V636-E654 WeakPolarHBondContact CG2-O 3.45Å; V636-E654 PolarHBondContact N-O 3.38Å; H651-E654 PolarHBondContact N-OE2 3.48Å; H651-E654 VanDerWaalsContact N-OE2 3.16Å; H651-E654 IonicContact ND1-OE2 3.69Å; H651-E654 WeakPolarHBondContact O-CB 3.26Å; H651-E654 PolarHBondContact O-N 3Å; K652-E654 VanDerWaalsContact C-N 3.28Å; K652-E654 PolarHBondContact O-N 3.42Å; E654-L656 HydrophobicContact CG-CD2 4.19Å; E654-N670 VanDerWaalsContact OE1-CB 3.3Å; E654-N670 WeakPolarHBondContact OE1-CB 3.35Å; E654-N670 PolarHBondContact OE1-ND2 2.93Å; E654-N670 VanDerWaalsContact OE1-ND2 3.09Å
655	Y	91.3	Very high	86.3	Confident	17 Å²	17	70.2 Å²	70.2	7%	0.067	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	137	174.6	-74.4	-87	0	0	0	109.6	V611 Q619 F622 I623 L633 A634 V635 G653 V686	V611-Y655 HydrophobicContact CG1-CD2 4.48Å; V611-Y655 HydrophobicContact CG1-CE2 3.54Å; V611-Y655 WeakPolarHBondContact CG1-OH 3.38Å; Q619-Y655 HydrophobicContact CG-CD2 4.38Å; F622-Y655 WeakPolarHBondContact CE1-O 3.24Å; I623-Y655 HydrophobicContact CD1-CD1 4.27Å; I623-Y655 HydrophobicContact CD1-CD2 3.47Å; I623-Y655 VanDerWaalsContact CD1-CD2 3.47Å; I623-Y655 HydrophobicContact CD1-CE2 3.86Å; I623-Y655 HydrophobicContact CD1-CG 3.72Å; I623-Y655 HydrophobicContact CG1-CD1 4.36Å; I623-Y655 HydrophobicContact CG1-CD2 4.12Å; I623-Y655 HydrophobicContact CG1-CG 3.86Å; L633-Y655 HydrophobicContact CD1-CD1 4.31Å; L633-Y655 HydrophobicContact CD2-CD1 4.18Å; L633-Y655 HydrophobicContact CG-CD1 4.19Å; A634-Y655 WeakPolarHBondContact O-CA 3.39Å; V635-Y655 HydrophobicContact CB-CD1 3.82Å; V635-Y655 HydrophobicContact CB-CE1 3.58Å; V635-Y655 HydrophobicContact CG2-CD1 4.09Å; V635-Y655 HydrophobicContact CG2-CD2 4.48Å; V635-Y655 HydrophobicContact CG2-CE1 3.77Å; V635-Y655 HydrophobicContact CG2-CE2 4.19Å; V635-Y655 HydrophobicContact CG2-CG 4.43Å; G653-Y655 PolarHBondContact O-N 3.05Å; Y655-V686 HydrophobicContact CD1-CG2 4.13Å; Y655-V686 HydrophobicContact CE1-CG2 3.82Å
656	L	93.4	Very high	87.1	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	146	-176.3	-56.4	-179.2	0	0	0	111.6	A634 V636 L648 V650 E654 C668 K669 N670 V678 L683	A634-L656 PolarHBondContact N-O 3.29Å; A634-L656 PolarHBondContact O-N 2.78Å; V636-L656 HydrophobicContact CG2-CD1 3.47Å; V636-L656 VanDerWaalsContact CG2-CD1 3.47Å; V636-L656 HydrophobicContact CG2-CG 3.77Å; L648-L656 HydrophobicContact CD2-CD2 4.31Å; V650-L656 HydrophobicContact CG1-CD1 3.87Å; V650-L656 HydrophobicContact CG1-CD2 4.39Å; E654-L656 HydrophobicContact CG-CD2 4.19Å; L656-C668 HydrophobicContact CB-CB 4.36Å; L656-C668 HydrophobicContact CD1-CB 3.88Å; L656-K669 WeakPolarHBondContact CA-O 3.41Å; L656-N670 HydrophobicContact CD2-CB 3.4Å; L656-V678 HydrophobicContact CD1-CG2 4.28Å; L656-L683 HydrophobicContact CD1-CD2 3.88Å
657	E	93.6	Very high	87.7	Confident	34 Å²	34	60.5 Å²	60.5	16%	0.159	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	119.2	163.8	-176.6	177.5	-152.3	0	0	108.5	F622 I626 C668 K669	F622-E657 HydrophobicContact CZ-CB 4.41Å; I626-E657 HydrophobicContact CD1-CB 3.78Å; I626-E657 HydrophobicContact CG1-CB 4.13Å; I626-E657 HydrophobicContact CG1-CG 4.39Å; E657-C668 CarbonylContact O-C 3.4Å; E657-C668 WeakPolarHBondContact O-CA 3.42Å; E657-K669 HydrophobicContact CB-CB 4.31Å; E657-K669 PolarHBondContact N-O 3.05Å; E657-K669 PolarHBondContact O-N 2.8Å; E657-K669 WeakPolarHBondContact OE2-CD 3.47Å; E657-K669 WeakPolarHBondContact OE2-CE 3.28Å; E657-K669 IonicContact OE2-NZ 3.78Å; E657-K669 PolarHBondContact OE2-NZ 3.35Å
658	V	92.2	Very high	88	Confident	8 Å²	8	59 Å²	59	5%	0.048	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	109.8	175.4	-178.5	0	0	0	0	108.5	K632 A634 D661 W666 M685	K632-V658 HydrophobicContact CB-CB 3.89Å; K632-V658 PolarHBondContact O-N 3.29Å; A634-V658 HydrophobicContact CB-CG2 3.54Å; V658-D661 HydrophobicContact CG1-CB 4.04Å; V658-W666 HydrophobicContact CG1-CB 4.42Å; V658-W666 HydrophobicContact CG1-CD2 4.22Å; V658-W666 HydrophobicContact CG1-CE3 3.73Å; V658-W666 HydrophobicContact CG1-CZ3 4.35Å; V658-W666 HydrophobicContact CG2-CE3 4.01Å; V658-W666 HydrophobicContact CG2-CZ3 4.31Å; V658-M685 HydrophobicContact CG2-SD 4.2Å
659	I	91	Very high	88.2	Confident	81 Å²	81	60.1 Å²	60.1	42%	0.415	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-38.6	-178.9	-59.9	177.1	0	0	0	110.5	E667 K669 V675	I659-E667 WeakPolarHBondContact CA-O 3.22Å; I659-E667 WeakPolarHBondContact CB-O 3.47Å; I659-E667 PolarHBondContact N-O 3.01Å; I659-K669 HydrophobicContact CD1-CB 3.79Å; I659-K669 HydrophobicContact CD1-CD 4.03Å; I659-K669 HydrophobicContact CG1-CB 4.35Å; I659-V675 HydrophobicContact CD1-CG1 4.06Å; I659-V675 HydrophobicContact CD1-CG2 4.1Å
660	F	87.3	Confident	88.2	Confident	79 Å²	79	57 Å²	57	35%	0.346	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	122	-174.5	-155.8	-103.5	0	0	0	112.8	E662 W666 E667	F660-E662 HydrophobicContact CD1-CB 4.35Å; F660-E662 HydrophobicContact CD1-CG 4.38Å; F660-E662 HydrophobicContact CE1-CB 3.73Å; F660-E662 HydrophobicContact CE1-CG 3.7Å; F660-E662 HydrophobicContact CE2-CG 4.23Å; F660-E662 HydrophobicContact CZ-CB 4.16Å; F660-E662 HydrophobicContact CZ-CG 3.63Å; F660-E662 WeakPolarHBondContact CZ-OE2 3.28Å; F660-W666 CarbonylContact O-C 3.53Å; F660-W666 WeakPolarHBondContact O-CA 3.22Å; F660-W666 WeakPolarHBondContact O-CB 3.43Å; F660-E667 HydrophobicContact CB-CB 3.84Å; F660-E667 PolarHBondContact N-O 2.8Å; F660-E667 PolarHBondContact O-N 3.15Å
661	D	86.5	Confident	87.9	Confident	57 Å²	57	59 Å²	59	31%	0.305	28%	0.276	S	S	.	.			trans	-118.7	5.9	-169.4	54	-36.4	0	0	0	116.2	K632 V658 R663 W666	K632-D661 IonicContact NZ-OD1 3.55Å; K632-D661 PolarHBondContact NZ-OD1 3.44Å; K632-D661 IonicContact NZ-OD2 2.64Å; K632-D661 PolarHBondContact NZ-OD2 2.88Å; V658-D661 HydrophobicContact CG1-CB 4.04Å; D661-R663 PolarHBondContact O-N 3.42Å; D661-W666 VanDerWaalsContact CA-CD1 3.45Å; D661-W666 HydrophobicContact CB-CD2 3.78Å; D661-W666 HydrophobicContact CB-CE3 4.36Å; D661-W666 HydrophobicContact CB-CG 4.04Å; D661-W666 HydrophobicContact CB-CZ2 3.93Å; D661-W666 PolarHBondContact O-NE1 3Å
662	E	69.3	Low	87.7	Confident	149 Å²	149	58.7 Å²	58.7	70%	0.696	28%	0.275	S	S	*	.	S	Bend	trans	-69.4	3.9	-175.4	-57.7	-173.6	171	0	0	116.3	F660	F660-E662 HydrophobicContact CD1-CB 4.35Å; F660-E662 HydrophobicContact CD1-CG 4.38Å; F660-E662 HydrophobicContact CE1-CB 3.73Å; F660-E662 HydrophobicContact CE1-CG 3.7Å; F660-E662 HydrophobicContact CE2-CG 4.23Å; F660-E662 HydrophobicContact CZ-CB 4.16Å; F660-E662 HydrophobicContact CZ-CG 3.63Å; F660-E662 WeakPolarHBondContact CZ-OE2 3.28Å
663	R	78.1	Confident	87.6	Confident	176 Å²	176	59.6 Å²	59.6	66%	0.664	28%	0.28	S	S	*	.	S	Bend	trans	-141.1	166.2	-170.9	-62.4	-176.9	-177.3	178.1	1.9	111.5	D661 W665 W666	D661-R663 PolarHBondContact O-N 3.42Å; R663-W665 PolarHBondContact O-N 2.84Å; R663-W666 PolarHBondContact O-NE1 3.12Å
664	N	83.6	Confident	87.9	Confident	119 Å²	119	66.4 Å²	66.4	64%	0.636	30%	0.296	S	S	*	.	S	Bend	trans	-61.6	-14.8	175	-67.9	-9.1	0	0	0	113.9	H680	N664-H680 WeakPolarHBondContact CA-ND1 3.34Å; N664-H680 PolarHBondContact O-N 2.85Å; N664-H680 VanDerWaalsContact O-N 3.1Å; N664-H680 PolarHBondContact O-ND1 3.33Å
665	W	88.6	Confident	87.9	Confident	102 Å²	102	69.1 Å²	69.1	39%	0.386	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	122.1	172.3	-68.6	73.1	0	0	0	108.1	E647 R663 V678 P679	E647-W665 VanDerWaalsContact CD-CH2 3.46Å; E647-W665 VanDerWaalsContact CD-CZ3 3.4Å; E647-W665 HydrophobicContact CG-CH2 4.21Å; E647-W665 HydrophobicContact CG-CZ3 3.67Å; E647-W665 WeakPolarHBondContact OE1-CH2 2.99Å; R663-W665 PolarHBondContact O-N 2.84Å; W665-V678 CarbonylContact C-O 3.46Å; W665-V678 WeakPolarHBondContact CA-O 3.38Å; W665-P679 HydrophobicContact CD2-CG 4.19Å; W665-P679 HydrophobicContact CE3-CG 3.89Å; W665-P679 HydrophobicContact CH2-CG 4.16Å; W665-P679 HydrophobicContact CZ2-CG 4.38Å; W665-P679 HydrophobicContact CZ3-CG 3.86Å
666	W	92.8	Very high	87.9	Confident	35 Å²	35	68.6 Å²	68.6	13%	0.133	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	139.4	-178.1	-67.8	-2.5	0	0	0	110.4	V658 F660 D661 R663 C668 Y677 V678 H680 L683 M685	V658-W666 HydrophobicContact CG1-CB 4.42Å; V658-W666 HydrophobicContact CG1-CD2 4.22Å; V658-W666 HydrophobicContact CG1-CE3 3.73Å; V658-W666 HydrophobicContact CG1-CZ3 4.35Å; V658-W666 HydrophobicContact CG2-CE3 4.01Å; V658-W666 HydrophobicContact CG2-CZ3 4.31Å; F660-W666 CarbonylContact O-C 3.53Å; F660-W666 WeakPolarHBondContact O-CA 3.22Å; F660-W666 WeakPolarHBondContact O-CB 3.43Å; D661-W666 VanDerWaalsContact CA-CD1 3.45Å; D661-W666 HydrophobicContact CB-CD2 3.78Å; D661-W666 HydrophobicContact CB-CE3 4.36Å; D661-W666 HydrophobicContact CB-CG 4.04Å; D661-W666 HydrophobicContact CB-CZ2 3.93Å; D661-W666 PolarHBondContact O-NE1 3Å; R663-W666 PolarHBondContact O-NE1 3.12Å; W666-C668 PolarHBondContact O-N 3.18Å; W666-Y677 WeakPolarHBondContact O-CA 3.31Å; W666-V678 PolarHBondContact N-O 2.95Å; W666-V678 PolarHBondContact O-N 2.9Å; W666-H680 HydrophobicContact CD2-CB 3.81Å; W666-H680 VanDerWaalsContact CE2-CB 3.46Å; W666-H680 HydrophobicContact CG-CB 4.07Å; W666-H680 HydrophobicContact CZ2-CB 3.9Å; W666-L683 HydrophobicContact CB-CD1 4.21Å; W666-L683 HydrophobicContact CD2-CD1 4.23Å; W666-L683 HydrophobicContact CE3-CB 4.38Å; W666-L683 HydrophobicContact CE3-CD1 3.58Å; W666-L683 HydrophobicContact CZ3-CB 4.37Å; W666-L683 HydrophobicContact CZ3-CD1 4.35Å; W666-M685 HydrophobicContact CH2-CG 3.99Å; W666-M685 HydrophobicContact CH2-SD 4.25Å; W666-M685 HydrophobicContact CZ3-CG 4Å; W666-M685 HydrophobicContact CZ3-SD 3.79Å
667	E	93.2	Very high	87.8	Confident	58 Å²	58	72.7 Å²	72.7	27%	0.271	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	111.2	171.2	-157.8	162.1	146.2	0	0	108.1	I659 F660 V675 Y677	I659-E667 WeakPolarHBondContact CA-O 3.22Å; I659-E667 WeakPolarHBondContact CB-O 3.47Å; I659-E667 PolarHBondContact N-O 3.01Å; F660-E667 HydrophobicContact CB-CB 3.84Å; F660-E667 PolarHBondContact N-O 2.8Å; F660-E667 PolarHBondContact O-N 3.15Å; E667-V675 HydrophobicContact CG-CG1 3.66Å; E667-Y677 HydrophobicContact CB-CD1 4.07Å; E667-Y677 HydrophobicContact CB-CE1 3.68Å; E667-Y677 HydrophobicContact CG-CD1 4.32Å; E667-Y677 HydrophobicContact CG-CE1 3.81Å; E667-Y677 VanDerWaalsContact OE2-CE1 3.25Å; E667-Y677 WeakPolarHBondContact OE2-CE1 3.22Å; E667-Y677 PolarHBondContact OE2-OH 2.96Å
668	C	94.4	Very high	87.7	Confident	0 Å²	0	71 Å²	71	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	157.3	-171.8	-62.1	0	0	0	0	110.8	L656 E657 W666 V675 G676 V678 L683	L656-C668 HydrophobicContact CB-CB 4.36Å; L656-C668 HydrophobicContact CD1-CB 3.88Å; E657-C668 CarbonylContact O-C 3.4Å; E657-C668 WeakPolarHBondContact O-CA 3.42Å; W666-C668 PolarHBondContact O-N 3.18Å; C668-V675 WeakPolarHBondContact O-CA 3.39Å; C668-G676 PolarHBondContact N-O 2.69Å; C668-G676 PolarHBondContact O-N 2.84Å; C668-V678 HydrophobicContact CB-CB 4.38Å; C668-V678 HydrophobicContact CB-CG2 3.91Å; C668-L683 VanDerWaalsContact SG-CD1 3.57Å
669	K	91.5	Very high	87.6	Confident	32 Å²	32	71.3 Å²	71.3	14%	0.139	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	131.7	-176.5	175.1	178.6	155.5	-135.5	0	111.3	L656 E657 I659 Q673 R674 V675	L656-K669 WeakPolarHBondContact CA-O 3.41Å; E657-K669 HydrophobicContact CB-CB 4.31Å; E657-K669 PolarHBondContact N-O 3.05Å; E657-K669 PolarHBondContact O-N 2.8Å; E657-K669 WeakPolarHBondContact OE2-CD 3.47Å; E657-K669 WeakPolarHBondContact OE2-CE 3.28Å; E657-K669 IonicContact OE2-NZ 3.78Å; E657-K669 PolarHBondContact OE2-NZ 3.35Å; I659-K669 HydrophobicContact CD1-CB 3.79Å; I659-K669 HydrophobicContact CD1-CD 4.03Å; I659-K669 HydrophobicContact CG1-CB 4.35Å; K669-Q673 VanDerWaalsContact NZ-OE1 3.16Å; K669-R674 VanDerWaalsContact CA-O 3.28Å; K669-R674 WeakPolarHBondContact CA-O 3.46Å; K669-V675 HydrophobicContact CB-CG2 4.12Å; K669-V675 HydrophobicContact CD-CG2 4.01Å; K669-V675 HydrophobicContact CG-CG2 4.07Å
670	N	90.7	Very high	87.4	Confident	7 Å²	7	70.9 Å²	70.9	4%	0.037	32%	0.319	C	S	.	.			trans	-100	176.5	-176.7	75.2	-8.9	0	0	0	114.2	F622 L648 E654 L656 H672 Q673 R674	F622-N670 WeakPolarHBondContact CZ-O 3.44Å; L648-N670 HydrophobicContact CD2-CB 4.23Å; E654-N670 VanDerWaalsContact OE1-CB 3.3Å; E654-N670 WeakPolarHBondContact OE1-CB 3.35Å; E654-N670 PolarHBondContact OE1-ND2 2.93Å; E654-N670 VanDerWaalsContact OE1-ND2 3.09Å; L656-N670 HydrophobicContact CD2-CB 3.4Å; N670-H672 PolarHBondContact O-N 2.9Å; N670-H672 WeakPolarHBondContact OD1-CB 3.35Å; N670-H672 PolarHBondContact OD1-N 3.38Å; N670-Q673 WeakPolarHBondContact O-CA 3.38Å; N670-Q673 PolarHBondContact O-N 3.05Å; N670-R674 PolarHBondContact N-O 3.17Å; N670-R674 VanDerWaalsContact N-O 3.17Å; N670-R674 PolarHBondContact OD1-N 2.82Å
671	M	85.1	Confident	87.4	Confident	42 Å²	42	71.5 Å²	71.5	21%	0.207	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-15.3	178.9	65	158.8	166.9	0	0	114.4	R618 Q619 F622 Q673	R618-M671 HydrophobicContact CG-SD 4.34Å; Q619-M671 HydrophobicContact CB-SD 4.31Å; F622-M671 HydrophobicContact CB-CB 4.06Å; F622-M671 HydrophobicContact CD1-CB 3.77Å; F622-M671 HydrophobicContact CD2-CB 4.22Å; F622-M671 HydrophobicContact CE1-CB 4.23Å; F622-M671 HydrophobicContact CG-CB 3.75Å; M671-Q673 VanDerWaalsContact C-N 3.26Å
672	H	83	Confident	87.5	Confident	99 Å²	99	69.2 Å²	69.2	46%	0.458	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	6.8	172.2	-60.2	101.5	0	0	0	113.4	N670 R674	N670-H672 PolarHBondContact O-N 2.9Å; N670-H672 WeakPolarHBondContact OD1-CB 3.35Å; N670-H672 PolarHBondContact OD1-N 3.38Å; H672-R674 HydrophobicContact CB-CG 4.28Å; H672-R674 PolarHBondContact O-N 3.17Å
673	Q	84.4	Confident	88.4	Confident	110 Å²	110	63 Å²	63	51%	0.514	29%	0.288	S	S	.	.			trans	58.4	18.7	-175.3	-52.5	-70.3	-51.6	0	0	113.7	K669 N670 M671	K669-Q673 VanDerWaalsContact NZ-OE1 3.16Å; N670-Q673 WeakPolarHBondContact O-CA 3.38Å; N670-Q673 PolarHBondContact O-N 3.05Å; M671-Q673 VanDerWaalsContact C-N 3.26Å
674	R	86.8	Confident	88.9	Confident	176 Å²	176	57.4 Å²	57.4	66%	0.664	28%	0.276	S	S	*	.			trans	-83	134.7	173.5	-63.4	-177	-179.4	179.4	0.3	109	L648 K669 N670 H672	L648-R674 HydrophobicContact CD1-CB 3.8Å; K669-R674 VanDerWaalsContact CA-O 3.28Å; K669-R674 WeakPolarHBondContact CA-O 3.46Å; N670-R674 PolarHBondContact N-O 3.17Å; N670-R674 VanDerWaalsContact N-O 3.17Å; N670-R674 PolarHBondContact OD1-N 2.82Å; H672-R674 HydrophobicContact CB-CG 4.28Å; H672-R674 PolarHBondContact O-N 3.17Å
675	V	90.4	Very high	89	Confident	71 Å²	71	55.3 Å²	55.3	43%	0.43	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	140.2	176.2	-175	0	0	0	0	109	I659 E667 C668 K669	I659-V675 HydrophobicContact CD1-CG1 4.06Å; I659-V675 HydrophobicContact CD1-CG2 4.1Å; E667-V675 HydrophobicContact CG-CG1 3.66Å; C668-V675 WeakPolarHBondContact O-CA 3.39Å; K669-V675 HydrophobicContact CB-CG2 4.12Å; K669-V675 HydrophobicContact CD-CG2 4.01Å; K669-V675 HydrophobicContact CG-CG2 4.07Å
676	G	90.1	Very high	88.8	Confident	5 Å²	5	51.4 Å²	51.4	5%	0.052	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.8	170.8	172	0	0	0	0	0	112.1	K646 C668	K646-G676 WeakPolarHBondContact O-CA 3.48Å; C668-G676 PolarHBondContact N-O 2.69Å; C668-G676 PolarHBondContact O-N 2.84Å
677	Y	92.4	Very high	87.6	Confident	86 Å²	86	55 Å²	55	34%	0.337	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	136	-179.3	-64.1	-67.5	0	0	0	112.1	K646 E647 L648 W666 E667	K646-Y677 HydrophobicContact CB-CD2 4.16Å; K646-Y677 WeakPolarHBondContact O-CD2 3.4Å; K646-Y677 PolarHBondContact O-N 3.1Å; E647-Y677 WeakPolarHBondContact CA-O 3.46Å; L648-Y677 PolarHBondContact N-O 3.49Å; L648-Y677 VanDerWaalsContact N-O 3.11Å; W666-Y677 WeakPolarHBondContact O-CA 3.31Å; E667-Y677 HydrophobicContact CB-CD1 4.07Å; E667-Y677 HydrophobicContact CB-CE1 3.68Å; E667-Y677 HydrophobicContact CG-CD1 4.32Å; E667-Y677 HydrophobicContact CG-CE1 3.81Å; E667-Y677 VanDerWaalsContact OE2-CE1 3.25Å; E667-Y677 WeakPolarHBondContact OE2-CE1 3.22Å; E667-Y677 PolarHBondContact OE2-OH 2.96Å
678	V	90.9	Very high	86.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	133.9	177.4	-175.3	0	0	0	0	108.6	L648 V650 L656 W665 W666 C668 H680 I682 L683	L648-V678 HydrophobicContact CB-CG2 3.77Å; L648-V678 HydrophobicContact CD2-CG2 4.25Å; V650-V678 HydrophobicContact CG1-CG2 3.93Å; V650-V678 HydrophobicContact CG2-CG1 4.21Å; L656-V678 HydrophobicContact CD1-CG2 4.28Å; W665-V678 CarbonylContact C-O 3.46Å; W665-V678 WeakPolarHBondContact CA-O 3.38Å; W666-V678 PolarHBondContact N-O 2.95Å; W666-V678 PolarHBondContact O-N 2.9Å; C668-V678 HydrophobicContact CB-CB 4.38Å; C668-V678 HydrophobicContact CB-CG2 3.91Å; V678-H680 PolarHBondContact O-N 2.94Å; V678-I682 HydrophobicContact CG1-CD1 3.8Å; V678-I682 HydrophobicContact CG1-CG1 3.74Å; V678-L683 HydrophobicContact CB-CD1 4.2Å; V678-L683 HydrophobicContact CG1-CD1 4.06Å; V678-L683 HydrophobicContact CG1-CD2 3.95Å; V678-L683 HydrophobicContact CG1-CG 3.99Å
679	P	89.8	Confident	83.8	Confident	14 Å²	14	64.3 Å²	64.3	9%	0.091	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	131.5	176.1	-23	33.7	0	0	0	111.7	W665 T681 I682	W665-P679 HydrophobicContact CD2-CG 4.19Å; W665-P679 HydrophobicContact CE3-CG 3.89Å; W665-P679 HydrophobicContact CH2-CG 4.16Å; W665-P679 HydrophobicContact CZ2-CG 4.38Å; W665-P679 HydrophobicContact CZ3-CG 3.86Å; P679-T681 PolarHBondContact O-N 3.18Å; P679-T681 VanDerWaalsContact O-N 3.08Å; P679-I682 HydrophobicContact CB-CG1 4.48Å; P679-I682 VanDerWaalsContact O-CG1 3.31Å; P679-I682 WeakPolarHBondContact O-CG1 3.31Å; P679-I682 PolarHBondContact O-N 2.95Å; P679-I682 VanDerWaalsContact O-N 3.1Å
680	H	86	Confident	81.4	Confident	71 Å²	71	70.7 Å²	70.7	33%	0.329	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-59.8	-23.7	179.5	76.4	-72.3	0	0	0	113.3	N664 W666 V678 I682 L683	N664-H680 WeakPolarHBondContact CA-ND1 3.34Å; N664-H680 PolarHBondContact O-N 2.85Å; N664-H680 VanDerWaalsContact O-N 3.1Å; N664-H680 PolarHBondContact O-ND1 3.33Å; W666-H680 HydrophobicContact CD2-CB 3.81Å; W666-H680 VanDerWaalsContact CE2-CB 3.46Å; W666-H680 HydrophobicContact CG-CB 4.07Å; W666-H680 HydrophobicContact CZ2-CB 3.9Å; V678-H680 PolarHBondContact O-N 2.94Å; H680-I682 PolarHBondContact O-N 3.17Å; H680-L683 PolarHBondContact O-N 3.01Å
681	T	87.2	Confident	78.6	Confident	92 Å²	92	76.5 Å²	76.5	56%	0.564	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-69.5	-13.7	178.6	51	0	0	0	0	114.4	P679	P679-T681 PolarHBondContact O-N 3.18Å; P679-T681 VanDerWaalsContact O-N 3.08Å
682	I	89	Confident	76.5	Confident	10 Å²	10	83.2 Å²	83.2	5%	0.051	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-109.6	16.3	174.8	71.5	163	0	0	0	112.7	V636 T637 Y638 R640 V650 V678 P679 H680	V636-I682 WeakPolarHBondContact CA-O 3.43Å; T637-I682 PolarHBondContact N-O 3.19Å; T637-I682 VanDerWaalsContact OG1-C 3.22Å; T637-I682 WeakPolarHBondContact OG1-CA 3.42Å; T637-I682 PolarHBondContact OG1-O 3.48Å; Y638-I682 HydrophobicContact CD2-CB 4.21Å; Y638-I682 HydrophobicContact CD2-CG2 3.96Å; R640-I682 HydrophobicContact CB-CD1 3.55Å; R640-I682 HydrophobicContact CG-CD1 4.22Å; V650-I682 HydrophobicContact CG2-CD1 3.92Å; V678-I682 HydrophobicContact CG1-CD1 3.8Å; V678-I682 HydrophobicContact CG1-CG1 3.74Å; P679-I682 HydrophobicContact CB-CG1 4.48Å; P679-I682 VanDerWaalsContact O-CG1 3.31Å; P679-I682 WeakPolarHBondContact O-CG1 3.31Å; P679-I682 PolarHBondContact O-N 2.95Å; P679-I682 VanDerWaalsContact O-N 3.1Å; H680-I682 PolarHBondContact O-N 3.17Å
683	L	88.4	Confident	74	Confident	17 Å²	17	87.6 Å²	87.6	9%	0.089	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	132	179.1	-63.3	177.3	0	0	0	109.8	A634 V636 L656 W666 C668 V678 H680	A634-L683 HydrophobicContact CB-CB 4.3Å; A634-L683 HydrophobicContact CB-CD2 4.43Å; V636-L683 HydrophobicContact CG2-CD2 3.82Å; L656-L683 HydrophobicContact CD1-CD2 3.88Å; W666-L683 HydrophobicContact CB-CD1 4.21Å; W666-L683 HydrophobicContact CD2-CD1 4.23Å; W666-L683 HydrophobicContact CE3-CB 4.38Å; W666-L683 HydrophobicContact CE3-CD1 3.58Å; W666-L683 HydrophobicContact CZ3-CB 4.37Å; W666-L683 HydrophobicContact CZ3-CD1 4.35Å; C668-L683 VanDerWaalsContact SG-CD1 3.57Å; V678-L683 HydrophobicContact CB-CD1 4.2Å; V678-L683 HydrophobicContact CG1-CD1 4.06Å; V678-L683 HydrophobicContact CG1-CD2 3.95Å; V678-L683 HydrophobicContact CG1-CG 3.99Å; H680-L683 PolarHBondContact O-N 3.01Å
684	S	87.8	Confident	71.5	Confident	59 Å²	59	87 Å²	87	41%	0.413	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122.9	167.7	-163.7	0	0	0	0	109.5	A634 V635 V686	A634-S684 CarbonylContact C-O 3.53Å; A634-S684 VanDerWaalsContact CA-O 3.28Å; A634-S684 WeakPolarHBondContact CA-O 3.26Å; V635-S684 PolarHBondContact N-O 2.86Å; V635-S684 PolarHBondContact O-N 3.34Å; S684-V686 PolarHBondContact O-N 3.3Å
685	M	86.9	Confident	68.6	Low	76 Å²	76	83.3 Å²	83.3	37%	0.374	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	126.9	177	-78.4	-61.7	-54.7	0	0	110	K632 L633 A634 V658 W666 P687	K632-M685 HydrophobicContact CB-CE 4Å; K632-M685 HydrophobicContact CG-CE 4.33Å; L633-M685 WeakPolarHBondContact O-CE 3.33Å; A634-M685 HydrophobicContact CB-SD 4.13Å; V658-M685 HydrophobicContact CG2-SD 4.2Å; W666-M685 HydrophobicContact CH2-CG 3.99Å; W666-M685 HydrophobicContact CH2-SD 4.25Å; W666-M685 HydrophobicContact CZ3-CG 4Å; W666-M685 HydrophobicContact CZ3-SD 3.79Å; M685-P687 WeakPolarHBondContact O-CD 3.46Å
686	V	84.4	Confident	65.8	Low	20 Å²	20	86.2 Å²	86.2	12%	0.121	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-79	117.9	178.6	-174.6	0	0	0	0	108.7	V609 L633 V635 Y655 S684 F688	V609-V686 HydrophobicContact CG1-CG1 3.87Å; L633-V686 HydrophobicContact CB-CB 4.29Å; L633-V686 HydrophobicContact CB-CG2 4.43Å; L633-V686 HydrophobicContact CD2-CB 4.04Å; L633-V686 HydrophobicContact CD2-CG1 4.18Å; L633-V686 HydrophobicContact CD2-CG2 3.96Å; L633-V686 HydrophobicContact CG-CB 4.22Å; L633-V686 HydrophobicContact CG-CG2 3.93Å; L633-V686 PolarHBondContact O-N 3.11Å; V635-V686 HydrophobicContact CB-CG2 4.39Å; Y655-V686 HydrophobicContact CD1-CG2 4.13Å; Y655-V686 HydrophobicContact CE1-CG2 3.82Å; S684-V686 PolarHBondContact O-N 3.3Å; V686-F688 PolarHBondContact O-N 3.07Å
687	P	67.9	Low	63	Low	109 Å²	109	93.2 Å²	93.2	71%	0.708	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-74.6	128.8	-179.8	29.7	-33.4	0	0	0	111	M685 E689	M685-P687 WeakPolarHBondContact O-CD 3.46Å; P687-E689 PolarHBondContact O-N 2.95Å
688	F	62.6	Low	60.1	Low	87 Å²	87	97.3 Å²	97.3	38%	0.382	52%	0.517	S	S	.	.			trans	-85	97.8	171.7	-59.9	-74.8	0	0	0	110.3	V627 G631 L633 V686 Q690	V627-F688 HydrophobicContact CG2-CE1 4.07Å; G631-F688 WeakPolarHBondContact O-CZ 3.26Å; L633-F688 HydrophobicContact CB-CZ 3.93Å; V686-F688 PolarHBondContact O-N 3.07Å; F688-Q690 PolarHBondContact O-N 2.87Å
689	E	45.6	Very low	57.3	Low	167 Å²	167	104.9 Å²	104.9	78%	0.78	55%	0.552	S	S	*	*			trans	-69.4	96	169.2	-76	-155.2	151.1	0	0	111	P687 Q691	P687-E689 PolarHBondContact O-N 2.95Å; E689-Q691 PolarHBondContact O-N 2.62Å
690	Q	40.2	Very low	54.3	Low	166 Å²	166	112 Å²	112	78%	0.776	59%	0.589	S	S	*	*			trans	-71.1	95.6	166	-69.9	-176	-10.9	0	0	109.5	F688 Q692	F688-Q690 PolarHBondContact O-N 2.87Å; Q690-Q692 PolarHBondContact O-N 3.3Å
691	Q	32.7	Very low	51.5	Low	130 Å²	130	115.4 Å²	115.4	61%	0.607	61%	0.61	S	S	*	*			trans	-63.8	101.1	172.5	-69.5	-175	-13.3	0	0	110.3	E689 Y693	E689-Q691 PolarHBondContact O-N 2.62Å; Q691-Y693 VanDerWaalsContact C-N 3.3Å; Q691-Y693 HydrophobicContact CB-CD2 4.08Å; Q691-Y693 HydrophobicContact CB-CE2 3.78Å; Q691-Y693 PolarHBondContact O-N 2.75Å
692	Q	39.9	Very low	48.7	Very low	182 Å²	182	115.9 Å²	115.9	85%	0.85	62%	0.617	S	S	*	*			trans	-72.6	78.9	179.2	-68.1	-173.6	-5.3	0	0	111.4	Q690 A694	Q690-Q692 PolarHBondContact O-N 3.3Å; Q692-A694 PolarHBondContact O-N 3.18Å
693	Y	31.6	Very low	45.8	Very low	191 Å²	191	120.1 Å²	120.1	75%	0.749	65%	0.647	S	S	*	*			trans	-78.2	105.5	166.6	-72.5	-67.6	0	0	0	110.5	Q691	Q691-Y693 VanDerWaalsContact C-N 3.3Å; Q691-Y693 HydrophobicContact CB-CD2 4.08Å; Q691-Y693 HydrophobicContact CB-CE2 3.78Å; Q691-Y693 PolarHBondContact O-N 2.75Å
694	A	31.2	Very low	42.9	Very low	97 Å²	97	124.4 Å²	124.4	80%	0.802	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-65.3	134.9	170.3	0	0	0	0	0	111	Q692	Q692-A694 PolarHBondContact O-N 3.18Å
695	S	26.7	Very low	40	Very low	100 Å²	100	128.4 Å²	128.4	70%	0.699	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-69.1	136.7	-177	-49.1	0	0	0	0	113.4
696	P	29.9	Very low	37.3	Very low	132 Å²	132	128.9 Å²	128.9	86%	0.857	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-76	117.3	155.9	-9.9	27.3	0	0	0	109.3
697	N	32.6	Very low	34.6	Very low	152 Å²	152	130.9 Å²	130.9	81%	0.813	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-73.7	159.5	-173.1	-93.5	-17.3	0	0	0	114.6
698	H	31	Very low	32.7	Very low	171 Å²	171	136.3 Å²	136.3	79%	0.792	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-90.5	129.4	162.4	-126.7	35.7	0	0	0	110.7
699	H	31.5	Very low	31.1	Very low	160 Å²	160	138.9 Å²	138.9	74%	0.741	78%	0.776	S	S	*	*			trans	33.9	110.9	159.7	-67.8	93	0	0	0	119.9
700	N	27.6	Very low	30.4	Very low	164 Å²	164	138.7 Å²	138.7	88%	0.877	78%	0.78	S	S	*	*				-144.7	142.4	108.5	-136.3	-22.2	0	0	0	113.7
701	N	27.7	Very low	29.7	Very low	141 Å²	141	134.1 Å²	134.1	75%	0.754	78%	0.778	S	S	*	*			trans	-35.8	127	-172.3	-171.7	18.9	0	0	0	119.6
702	S	26.6	Very low	29.5	Very low	103 Å²	103	135.7 Å²	135.7	72%	0.72	78%	0.784	S	S	*	*				169.7	137.3	118	48.1	0	0	0	0	117.2
703	S	28.2	Very low	29.1	Very low	99 Å²	99	134.5 Å²	134.5	69%	0.692	78%	0.779	S	S	*	*			trans	28.6	117.2	151.4	57.2	0	0	0	0	124.8
704	S	27.9	Very low	28.9	Very low	107 Å²	107	134.7 Å²	134.7	75%	0.748	79%	0.786	S	S	*	*				79.3	121.2	120.5	-54.2	0	0	0	0	124.4
705	T	28.4	Very low	28.7	Very low	143 Å²	143	133.3 Å²	133.3	88%	0.877	78%	0.781	S	S	*	*			trans	66.3	120.1	142.9	40.4	0	0	0	0	123.4
706	G	29	Very low	29.6	Very low	85 Å²	85	134.5 Å²	134.5	88%	0.876	79%	0.787	S	S	*	*			trans	81.2	160.4	151.1	0	0	0	0	0	117.2
707	G	27.6	Very low	29.5	Very low	63 Å²	63	132.6 Å²	132.6	65%	0.649	78%	0.782	S	S	*	*			cis	157.9	113.2	-12.2	0	0	0	0	0	115
708	Y	27.9	Very low	29.5	Very low	222 Å²	222	133.3 Å²	133.3	87%	0.871	78%	0.781	S	S	*	*			trans	66.5	142.5	161	-58.3	-81	0	0	0	122.4
709	N	28.7	Very low	29.4	Very low	141 Å²	141	131.8 Å²	131.8	75%	0.754	78%	0.779	S	S	*	*			trans	76.7	132.7	143.1	-70.3	-7.6	0	0	0	124.6
710	N	30.7	Very low	29.4	Very low	164 Å²	164	130.9 Å²	130.9	88%	0.877	78%	0.784	S	S	*	*			trans	20.4	138.6	139.1	-76	-8.5	0	0	0	121.8
711	G	26.3	Very low	29.5	Very low	70 Å²	70	132.9 Å²	132.9	72%	0.722	78%	0.781	S	S	*	*				145.4	108	128.3	0	0	0	0	0	119.4
712	H	28.8	Very low	30	Very low	162 Å²	162	137.1 Å²	137.1	75%	0.75	79%	0.786	S	S	*	*			trans	37.9	120.9	132	-77.7	30.4	0	0	0	122.7
713	H	32	Very low	30.6	Very low	158 Å²	158	137.2 Å²	137.2	73%	0.731	78%	0.784	S	S	*	*			trans	86.2	157.7	134.5	-57.1	-28	0	0	0	122.6
714	Q	27.6	Very low	31.1	Very low	194 Å²	194	138.1 Å²	138.1	91%	0.907	79%	0.788	S	S	*	*			trans	81.9	132.6	164.9	-50.2	-167.3	14.8	0	0	118.8
715	G	25.3	Very low	32.3	Very low	68 Å²	68	138.3 Å²	138.3	70%	0.701	79%	0.786	S	S	*	*			trans	-107.1	-147.2	163.7	0	0	0	0	0	110.1
716	P	45.4	Very low	33.1	Very low	126 Å²	126	137.2 Å²	137.2	82%	0.818	78%	0.782	S	S	*	*			cis	-136.8	177.8	14	43	-26.6	0	0	0	116.5
717	A	29.3	Very low	34	Very low	92 Å²	92	137.8 Å²	137.8	76%	0.76	77%	0.77	S	S	*	*			trans	70.4	152	158.7	0	0	0	0	0	117.6
718	Q	30.9	Very low	34.2	Very low	167 Å²	167	142.3 Å²	142.3	78%	0.78	78%	0.779	S	S	*	*			cis	-133	160.9	5.8	-70.4	-177.9	-5	0	0	112.1
719	N	29.2	Very low	34.3	Very low	139 Å²	139	137.9 Å²	137.9	74%	0.743	77%	0.774	S	S	*	*			trans	44.8	137	151.1	-61.9	-17.8	0	0	0	120.3
720	V	31.6	Very low	34.4	Very low	141 Å²	141	136.4 Å²	136.4	86%	0.855	78%	0.775	S	S	*	*			cis	-133.3	156.4	29.2	175.2	0	0	0	0	111.7
721	Y	29.7	Very low	34.4	Very low	205 Å²	205	136.6 Å²	136.6	80%	0.804	78%	0.776	S	S	*	*			trans	-77.4	133.5	-172.1	-108.2	-122.3	0	0	0	116	P723	Y721-P723 HydrophobicContact CD1-CG 4.33Å
722	R	39	Very low	34.7	Very low	230 Å²	230	137.7 Å²	137.7	87%	0.868	78%	0.778	S	S	*	*			trans	-78.6	153	135.5	-103	-172.4	-174.2	-154	7.4	108.2
723	P	38.3	Very low	34.7	Very low	106 Å²	106	133.7 Å²	133.7	69%	0.688	78%	0.781	S	S	*	*				-152.2	-172.6	95.6	36.5	-14.3	0	0	0	114.4	Y721	Y721-P723 HydrophobicContact CD1-CG 4.33Å
724	P	38.5	Very low	34.6	Very low	118 Å²	118	132.3 Å²	132.3	77%	0.766	78%	0.783	S	S	*	*			trans	-116.1	-146.2	-165.5	48.3	-35.8	0	0	0	113.4
725	P	53.9	Low	34.6	Very low	110 Å²	110	132.4 Å²	132.4	71%	0.714	78%	0.784	S	S	*	*			trans	-87.4	-162.2	-163.8	45	-45.6	0	0	0	113.1
726	P	45.6	Very low	35.2	Very low	120 Å²	120	134.9 Å²	134.9	78%	0.779	79%	0.785	S	S	*	*			cis	-132.1	-109	8.9	26.8	2.9	0	0	0	119.9
727	P	48.2	Very low	34.4	Very low	98 Å²	98	137.1 Å²	137.1	64%	0.636	79%	0.785	S	S	*	*				-134.9	178.6	-119.6	45.1	-27	0	0	0	118.9
728	L	30.6	Very low	35	Very low	158 Å²	158	139.7 Å²	139.7	83%	0.827	78%	0.784	S	S	*	*			trans	66.4	163.4	168.5	-56.3	170.6	0	0	0	115.1
729	V	30.8	Very low	35.1	Very low	129 Å²	129	143.4 Å²	143.4	78%	0.782	79%	0.791	S	S	*	*			cis	-145.5	-179	6.4	-134.6	0	0	0	0	111.3
730	S	31.4	Very low	35.3	Very low	110 Å²	110	147.9 Å²	147.9	77%	0.769	80%	0.797	S	S	*	*			trans	-38.1	155.9	171.9	-37.2	0	0	0	0	119.9
731	D	30.3	Very low	35.3	Very low	167 Å²	167	150.1 Å²	150.1	89%	0.893	80%	0.798	S	S	*	*				-161.3	-179.3	101.3	-149.4	-8.3	0	0	0	112.6
732	A	31.7	Very low	35.7	Very low	93 Å²	93	149.5 Å²	149.5	77%	0.769	80%	0.802	S	S	*	*			trans	-103.8	168	-160.3	0	0	0	0	0	117.3
733	G	28.6	Very low	35.7	Very low	78 Å²	78	145.1 Å²	145.1	80%	0.804	80%	0.801	S	S	*	*			trans	-176.5	108.7	163.5	0	0	0	0	0	112.8
734	V	30.3	Very low	36	Very low	129 Å²	129	144 Å²	144	78%	0.782	80%	0.8	S	S	*	*			trans	-109	134.4	-179	173.4	0	0	0	0	110.9
735	Q	28.1	Very low	36.7	Very low	197 Å²	197	144 Å²	144	92%	0.921	80%	0.8	S	S	*	*			trans	-146.6	168	141.8	-81.3	-140	-5.7	0	0	110.7
736	V	37.4	Very low	37	Very low	119 Å²	119	144.1 Å²	144.1	72%	0.721	80%	0.801	S	S	*	*			trans	-118.3	137.1	-158.2	-179.1	0	0	0	0	110.9
737	E	29.6	Very low	37.5	Very low	174 Å²	174	144 Å²	144	81%	0.813	80%	0.801	S	S	*	*			trans	-150.9	149.3	154.2	-166.1	51	-88.7	0	0	111.1
738	I	40.8	Very low	38	Very low	145 Å²	145	144.8 Å²	144.8	74%	0.744	81%	0.805	S	S	*	*			trans	-98.2	120.8	-162.7	-59.7	166.3	0	0	0	112
739	R	32.6	Very low	38.7	Very low	245 Å²	245	142.8 Å²	142.8	93%	0.925	80%	0.802	S	S	*	*			trans	-146.1	135.3	159.9	-153.8	163	-176.6	157.1	-0.5	113.4
740	R	33.6	Very low	39.6	Very low	233 Å²	233	143 Å²	143	88%	0.879	80%	0.803	S	S	*	*			trans	-65.3	140	-173.5	-60.5	171	180	161.5	-1.7	112.4
741	E	31.8	Very low	40.4	Very low	188 Å²	188	143.9 Å²	143.9	88%	0.879	80%	0.804	S	S	*	*			trans	-66.6	152.1	162.3	-63.5	-170.6	136.4	0	0	111.4
742	H	38.9	Very low	41.6	Very low	193 Å²	193	142.7 Å²	142.7	89%	0.894	80%	0.796	S	S	*	*			trans	-86.9	110.6	168.8	-87.6	88.2	0	0	0	109.8	A744	H742-A744 PolarHBondContact O-N 2.94Å
743	V	38.6	Very low	42.7	Very low	138 Å²	138	143.1 Å²	143.1	84%	0.836	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-65.5	126.2	166.9	176.2	0	0	0	0	108.8
744	A	44.7	Very low	44.2	Very low	81 Å²	81	144.9 Å²	144.9	67%	0.669	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-63.9	139.4	173.2	0	0	0	0	0	110.5	H742	H742-A744 PolarHBondContact O-N 2.94Å
745	P	52.9	Low	45.5	Very low	119 Å²	119	144.2 Å²	144.2	77%	0.773	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-66.6	145	-175.9	27.5	-34.8	0	0	0	111.7
746	P	59.3	Low	46.9	Very low	113 Å²	113	140.5 Å²	140.5	73%	0.734	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-67.7	157.1	175.3	30.2	-35.7	0	0	0	111.4
747	P	56.9	Low	47.8	Very low	118 Å²	118	140 Å²	140	77%	0.766	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-61.7	149.2	172.7	27.7	-35.1	0	0	0	111.2
748	P	59.2	Low	48.7	Very low	113 Å²	113	137.8 Å²	137.8	73%	0.734	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-65.4	149.1	178.3	28.6	-35.1	0	0	0	111.4	V750	P748-V750 PolarHBondContact O-N 2.91Å
749	P	45.9	Very low	49	Very low	117 Å²	117	137.4 Å²	137.4	76%	0.76	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-66.8	134.6	178.9	28.2	-34.6	0	0	0	111.1	V751	P749-V751 PolarHBondContact O-N 2.81Å; P749-V751 VanDerWaalsContact O-N 3.16Å
750	V	48.4	Very low	49.9	Very low	133 Å²	133	137.1 Å²	137.1	81%	0.806	78%	0.782	S	S	*	*			trans	-67.6	111.9	170.3	178.2	0	0	0	0	108.5	P748 I752	P748-V750 PolarHBondContact O-N 2.91Å; V750-I752 PolarHBondContact O-N 3.32Å; V750-I752 VanDerWaalsContact O-N 3.11Å
751	V	49.6	Very low	50.6	Low	128 Å²	128	131.7 Å²	131.7	78%	0.776	78%	0.775	S	S	*	*			trans	-74	102.3	172.6	179.9	0	0	0	0	108.3	P749	P749-V751 PolarHBondContact O-N 2.81Å; P749-V751 VanDerWaalsContact O-N 3.16Å
752	I	54	Low	51.5	Low	143 Å²	143	126.3 Å²	126.3	73%	0.733	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-65.7	123.5	171.8	-54.8	173.9	0	0	0	107.8	V750	V750-I752 PolarHBondContact O-N 3.32Å; V750-I752 VanDerWaalsContact O-N 3.11Å
753	P	56.1	Low	52.7	Low	102 Å²	102	121 Å²	121	66%	0.662	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-65.7	141.5	173.4	28	-33.7	0	0	0	109.8
754	P	59.9	Low	53.2	Low	114 Å²	114	121.7 Å²	121.7	74%	0.74	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-63.1	148.1	-179.9	27.1	-34.7	0	0	0	111.1
755	P	57.7	Low	53.7	Low	116 Å²	116	124.5 Å²	124.5	75%	0.753	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-62.2	147.2	177.9	27.2	-35	0	0	0	111
756	P	57.4	Low	53.8	Low	118 Å²	118	124 Å²	124	77%	0.766	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-62.7	144.9	176.7	27.2	-34.5	0	0	0	110.8
757	P	56.5	Low	53.7	Low	109 Å²	109	123.4 Å²	123.4	71%	0.708	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-64.1	150.2	175.3	28.6	-35.1	0	0	0	110.6	V759	P757-V759 PolarHBondContact O-N 3.27Å; P757-V759 VanDerWaalsContact O-N 3.16Å
758	P	47.9	Very low	53.8	Low	127 Å²	127	122.3 Å²	122.3	83%	0.825	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-62.7	120.4	-178.9	25.5	-34.1	0	0	0	110.7	R760	P758-R760 PolarHBondContact O-N 2.86Å; P758-R760 VanDerWaalsContact O-N 3.17Å
759	V	47.8	Very low	54	Low	137 Å²	137	126.2 Å²	126.2	83%	0.83	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-63.1	116.4	171.4	179.2	0	0	0	0	107.9	P757 T761	P757-V759 PolarHBondContact O-N 3.27Å; P757-V759 VanDerWaalsContact O-N 3.16Å; V759-T761 PolarHBondContact O-N 3.41Å
760	R	51.3	Low	54.6	Low	239 Å²	239	127 Å²	127	90%	0.902	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-63.6	118.2	172.8	-76	-177.5	168.8	-168.4	-3.9	109.1	P758	P758-R760 PolarHBondContact O-N 2.86Å; P758-R760 VanDerWaalsContact O-N 3.17Å
761	T	48.3	Very low	55.2	Low	120 Å²	120	126.8 Å²	126.8	74%	0.736	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-62.7	136.3	162	48.2	0	0	0	0	109.2	V759	V759-T761 PolarHBondContact O-N 3.41Å
762	P	49.8	Very low	55.4	Low	74 Å²	74	127 Å²	127	48%	0.481	68%	0.676	S	S	.	*	P	Polyproline II helix	trans	-61.7	142.2	172	27.8	-34.3	0	0	0	109.7	E766 L767	P762-E766 VanDerWaalsContact CA-OE2 3.23Å; P762-E766 WeakPolarHBondContact CA-OE2 3.43Å; P762-E766 HydrophobicContact CB-CB 4.22Å; P762-L767 HydrophobicContact CG-CG 4.47Å
763	T	64.6	Low	55.1	Low	82 Å²	82	127.9 Å²	127.9	50%	0.503	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-75.8	162.2	-179.7	60.1	0	0	0	0	111	E765 E766 L767	T763-E765 PolarHBondContact O-N 2.87Å; T763-E765 VanDerWaalsContact O-N 3.1Å; T763-E766 PolarHBondContact N-OE2 2.93Å; T763-E766 WeakPolarHBondContact O-CB 3.17Å; T763-E766 PolarHBondContact O-N 2.73Å; T763-L767 PolarHBondContact O-N 2.98Å
764	M	48.7	Very low	54.7	Low	152 Å²	152	130.6 Å²	130.6	75%	0.749	68%	0.68	S	S	*	*	H	α-helix	trans	-57.6	-30	-175.4	-162	-170.4	77.4	0	0	113	L768	M764-L768 WeakPolarHBondContact O-CB 3.24Å; M764-L768 PolarHBondContact O-N 3.39Å
765	E	54.9	Low	54	Low	141 Å²	141	132.8 Å²	132.8	66%	0.659	68%	0.681	S	S	*	*	H	α-helix	trans	-71.5	-30.3	175.8	-70.2	-179.5	98	0	0	113.6	T763 R769	T763-E765 PolarHBondContact O-N 2.87Å; T763-E765 VanDerWaalsContact O-N 3.1Å; E765-R769 WeakPolarHBondContact O-CB 3.17Å; E765-R769 WeakPolarHBondContact O-CG 3.33Å; E765-R769 PolarHBondContact O-N 3.36Å
766	E	55.4	Low	53.3	Low	107 Å²	107	135.5 Å²	135.5	50%	0.5	68%	0.684	S	S	.	*	H	α-helix	trans	-71.5	-42.6	175.5	-64	179.7	121	0	0	110.7	P762 T763 R769 M770	P762-E766 VanDerWaalsContact CA-OE2 3.23Å; P762-E766 WeakPolarHBondContact CA-OE2 3.43Å; P762-E766 HydrophobicContact CB-CB 4.22Å; T763-E766 PolarHBondContact N-OE2 2.93Å; T763-E766 WeakPolarHBondContact O-CB 3.17Å; T763-E766 PolarHBondContact O-N 2.73Å; E766-R769 PolarHBondContact O-N 3.17Å; E766-M770 PolarHBondContact O-N 3.47Å
767	L	56.9	Low	52.5	Low	101 Å²	101	139.1 Å²	139.1	53%	0.529	69%	0.687	S	S	.	*	H	α-helix	trans	-61	-43.6	172	-79.5	164	0	0	0	112	P762 T763 R769 M770 Q771	P762-L767 HydrophobicContact CG-CG 4.47Å; T763-L767 PolarHBondContact O-N 2.98Å; L767-R769 PolarHBondContact O-N 2.91Å; L767-M770 PolarHBondContact O-N 3.01Å; L767-Q771 PolarHBondContact O-N 3.03Å
768	L	59.9	Low	51.3	Low	95 Å²	95	142.7 Å²	142.7	50%	0.497	69%	0.694	S	S	.	*	H	α-helix	trans	-65.2	-38	178.9	-164.1	66.8	0	0	0	111.9	M764 Q772	M764-L768 WeakPolarHBondContact O-CB 3.24Å; M764-L768 PolarHBondContact O-N 3.39Å; L768-Q772 WeakPolarHBondContact O-CB 3.21Å; L768-Q772 PolarHBondContact O-N 3.03Å; L768-Q772 VanDerWaalsContact O-N 3.07Å
769	R	63.9	Low	50.7	Low	196 Å²	196	147.8 Å²	147.8	74%	0.74	70%	0.697	S	S	*	*	H	α-helix	trans	-64.9	-42.3	173	-79	179.4	171.6	-166.2	-1.4	112.7	E765 E766 L767 Q772 Q773	E765-R769 WeakPolarHBondContact O-CB 3.17Å; E765-R769 WeakPolarHBondContact O-CG 3.33Å; E765-R769 PolarHBondContact O-N 3.36Å; E766-R769 PolarHBondContact O-N 3.17Å; L767-R769 PolarHBondContact O-N 2.91Å; R769-Q772 PolarHBondContact O-N 3.23Å; R769-Q773 PolarHBondContact O-N 2.91Å; R769-Q773 VanDerWaalsContact O-N 3.17Å
770	M	57.9	Low	49.8	Very low	132 Å²	132	151.2 Å²	151.2	65%	0.65	70%	0.701	S	S	*	*	H	α-helix	trans	-62.6	-43.6	175.7	-80.6	178.6	57.4	0	0	112.3	E766 L767 Q773 Q774	E766-M770 PolarHBondContact O-N 3.47Å; L767-M770 PolarHBondContact O-N 3.01Å; M770-Q773 PolarHBondContact O-N 2.96Å; M770-Q774 PolarHBondContact O-N 3.11Å
771	Q	60	Low	48.9	Very low	129 Å²	129	145.2 Å²	145.2	60%	0.603	69%	0.693	S	S	*	*	H	α-helix	trans	-63.5	-43.3	178.5	-172.2	174.1	65.1	0	0	111.8	L767 Q773 Q774 Q775	L767-Q771 PolarHBondContact O-N 3.03Å; Q771-Q773 VanDerWaalsContact C-N 3.28Å; Q771-Q773 PolarHBondContact O-N 2.88Å; Q771-Q774 PolarHBondContact O-N 2.95Å; Q771-Q775 PolarHBondContact O-N 2.93Å
772	Q	54.8	Low	48.3	Very low	134 Å²	134	145.5 Å²	145.5	63%	0.626	70%	0.697	S	S	*	*	H	α-helix	trans	-65.3	-29.4	179.4	-166.5	167.1	88.2	0	0	112.8	L768 R769	L768-Q772 WeakPolarHBondContact O-CB 3.21Å; L768-Q772 PolarHBondContact O-N 3.03Å; L768-Q772 VanDerWaalsContact O-N 3.07Å; R769-Q772 PolarHBondContact O-N 3.23Å
773	Q	47.9	Very low	47.4	Very low	161 Å²	161	148.8 Å²	148.8	75%	0.752	72%	0.715	S	S	*	*	H	α-helix	trans	-77.8	-26.7	179.4	-158.5	172.7	55	0	0	113.8	R769 M770 Q771	R769-Q773 PolarHBondContact O-N 2.91Å; R769-Q773 VanDerWaalsContact O-N 3.17Å; M770-Q773 PolarHBondContact O-N 2.96Å; Q771-Q773 VanDerWaalsContact C-N 3.28Å; Q771-Q773 PolarHBondContact O-N 2.88Å
774	Q	48	Very low	45.8	Very low	158 Å²	158	153.7 Å²	153.7	74%	0.738	73%	0.732	S	S	*	*	H	α-helix	trans	-73.9	-33.5	172.5	-73.5	-172	-14.9	0	0	112.5	M770 Q771 Q776 K777	M770-Q774 PolarHBondContact O-N 3.11Å; Q771-Q774 PolarHBondContact O-N 2.95Å; Q774-Q776 VanDerWaalsContact C-N 3.26Å; Q774-Q776 PolarHBondContact O-N 2.83Å; Q774-K777 PolarHBondContact O-N 2.99Å
775	Q	44.8	Very low	44.7	Very low	161 Å²	161	154.5 Å²	154.5	75%	0.752	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-15	-170.4	-151.1	165.4	58.1	0	0	114.4	Q771	Q771-Q775 PolarHBondContact O-N 2.93Å
776	Q	42.7	Very low	43.7	Very low	173 Å²	173	154 Å²	154	81%	0.808	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-10.6	175.3	-69.9	-170.1	-8.3	0	0	114.6	Q774	Q774-Q776 VanDerWaalsContact C-N 3.26Å; Q774-Q776 PolarHBondContact O-N 2.83Å
777	K	41.3	Very low	42.3	Very low	193 Å²	193	154.1 Å²	154.1	84%	0.839	75%	0.751	S	S	*	*	S	Bend	trans	-90.9	2.5	-170.7	-129.1	175.7	-174.7	178.6	0	115.7	Q774	Q774-K777 PolarHBondContact O-N 2.99Å
778	Q	31.5	Very low	41	Very low	184 Å²	184	159.4 Å²	159.4	86%	0.86	77%	0.765	S	S	*	*			trans	-125.3	79.4	176.3	-67.4	-162.8	49	0	0	112.8
779	R	35.1	Very low	39.5	Very low	235 Å²	235	162.2 Å²	162.2	89%	0.887	78%	0.776	S	S	*	*			trans	-145.5	113.3	160.5	-69.6	-168.7	73.9	-166.3	2.7	111.5
780	K	28.8	Very low	37.9	Very low	209 Å²	209	158.3 Å²	158.3	91%	0.909	78%	0.776	S	S	*	*			trans	-144.6	159.1	155	-87	-155.4	175.4	-177.1	0	109.9
781	P	32.6	Very low	36.2	Very low	113 Å²	113	160.8 Å²	160.8	73%	0.734	79%	0.786	S	S	*	*			trans	-92.7	167.7	-151.9	36	-36.9	0	0	0	115.3
782	P	34.6	Very low	35	Very low	125 Å²	125	160.5 Å²	160.5	81%	0.812	80%	0.796	S	S	*	*			trans	-85.3	164.7	-178.4	36	-37.4	0	0	0	114.2
783	V	31.2	Very low	33.8	Very low	143 Å²	143	159.1 Å²	159.1	87%	0.867	81%	0.807	S	S	*	*			trans	-141.4	158.3	167.5	-172.6	0	0	0	0	107.6
784	E	31.4	Very low	32.7	Very low	186 Å²	186	160.8 Å²	160.8	87%	0.869	82%	0.815	S	S	*	*			trans	-91.1	172.5	-154.5	-63.8	156.2	119	0	0	116.4
785	E	25.5	Very low	31.6	Very low	168 Å²	168	165.6 Å²	165.6	79%	0.785	83%	0.826	S	S	*	*			trans	-68.5	169.5	173.7	-57.4	-173.3	136.6	0	0	113.2
786	P	32.5	Very low	30.6	Very low	131 Å²	131	162.8 Å²	162.8	85%	0.851	83%	0.831	S	S	*	*				-138.2	157.8	105.7	37.9	-27.7	0	0	0	116.1
787	V	27.4	Very low	29.8	Very low	109 Å²	109	158.3 Å²	158.3	66%	0.661	83%	0.83	S	S	*	*			trans	-86.6	147.8	-176.9	174.4	0	0	0	0	112.8
788	Y	29.6	Very low	29.5	Very low	212 Å²	212	157.2 Å²	157.2	83%	0.831	83%	0.833	S	S	*	*			trans	-151.1	168.3	145.4	-134.8	-95.1	0	0	0	114.8
789	Q	27.4	Very low	29.2	Very low	155 Å²	155	154.1 Å²	154.1	72%	0.724	82%	0.819	S	S	*	*			trans	-85.5	162.4	-165	-67	172.1	-34.4	0	0	115.7
790	P	30.5	Very low	28.8	Very low	114 Å²	114	147 Å²	147	74%	0.74	80%	0.797	S	S	*	*			trans	-98.9	166.8	-175.9	38.6	-36.5	0	0	0	115.9
791	Q	23.2	Very low	28.9	Very low	183 Å²	183	146.8 Å²	146.8	86%	0.855	79%	0.791	S	S	*	*			trans	79.6	155.1	170.2	-49.6	-173.3	24.6	0	0	117.3
792	P	34.2	Very low	28.7	Very low	124 Å²	124	144.7 Å²	144.7	81%	0.805	77%	0.768	S	S	*	*			cis	-122.3	125	-12.8	31.9	-14.4	0	0	0	113.3
793	A	28.6	Very low	28.5	Very low	104 Å²	104	148.3 Å²	148.3	86%	0.86	77%	0.766	S	S	*	*			trans	-122.7	138.5	164.1	0	0	0	0	0	109.6
794	Q	25.7	Very low	28.4	Very low	197 Å²	197	146.6 Å²	146.6	92%	0.921	75%	0.752	S	S	*	*			trans	-79.1	147.4	-164.4	-68.8	162.9	-11.3	0	0	112.8	A796	Q794-A796 PolarHBondContact O-N 3.43Å
795	R	24.9	Very low	28.5	Very low	258 Å²	258	144.7 Å²	144.7	97%	0.974	74%	0.743	S	S	*	*			trans	-64.3	99.1	176.1	-78.8	177.3	167.2	166	-5.4	111.6
796	A	24.9	Very low	28.7	Very low	103 Å²	103	142.2 Å²	142.2	85%	0.851	74%	0.735	S	S	*	*			trans	-109.9	106.3	150.2	0	0	0	0	0	107.2	Q794	Q794-A796 PolarHBondContact O-N 3.43Å
797	G	24.5	Very low	29.1	Very low	78 Å²	78	140.4 Å²	140.4	80%	0.804	72%	0.723	S	S	*	*			trans	163.8	14.8	-170	0	0	0	0	0	116.7
798	L	34.3	Very low	29.4	Very low	170 Å²	170	140.2 Å²	140.2	89%	0.89	72%	0.715	S	S	*	*	S	Bend	trans	-128.4	47.7	167.5	-133.4	-178.8	0	0	0	110.7
799	E	27	Very low	29.6	Very low	120 Å²	120	136.1 Å²	136.1	56%	0.561	71%	0.707	S	S	*	*			trans	-159.8	142.7	163.7	-117.1	-166.9	-165.6	0	0	113.6	R314	R314-E799 IonicContact CZ-OE1 3.15Å; R314-E799 VanDerWaalsContact NH1-CD 3.25Å; R314-E799 IonicContact NH1-OE1 2.75Å; R314-E799 PolarHBondContact NH1-OE1 3.34Å; R314-E799 IonicContact NH1-OE2 3.12Å; R314-E799 PolarHBondContact NH1-OE2 3.2Å; R314-E799 IonicContact NH2-OE1 2.68Å; R314-E799 PolarHBondContact NH2-OE1 3.08Å
800	I	26.9	Very low	30.3	Very low	85 Å²	85	135.8 Å²	135.8	44%	0.436	71%	0.708	S	S	.	*			trans	63.9	122.2	155.3	-58.7	170	0	0	0	114.5	R802	I800-R802 HydrophobicContact CG2-CB 4.09Å
801	W	29.3	Very low	30.5	Very low	204 Å²	204	134.9 Å²	134.9	77%	0.773	69%	0.694	S	S	*	*			cis	-124.5	151.4	46.8	-63.7	73	0	0	0	112.3
802	R	29.6	Very low	31.2	Very low	69 Å²	69	130.7 Å²	130.7	26%	0.26	68%	0.675	S	S	.	*			cis	69.9	34.9	16.8	-145.8	-149.9	-141.6	160.9	5.4	117.3	T311 R314 I800	T311-R802 HydrophobicContact CG2-CG 4.46Å; T311-R802 PolarHBondContact O-NH2 3.08Å; T311-R802 VanDerWaalsContact O-NH2 3.16Å; R314-R802 PolarHBondContact O-NH2 2.81Å; I800-R802 HydrophobicContact CG2-CB 4.09Å
803	R	29.6	Very low	31.3	Very low	201 Å²	201	129.2 Å²	129.2	76%	0.758	66%	0.663	S	S	*	*			trans	-116.1	119.9	138	-81.4	-176.9	162.7	97.5	-6.6	105.5
804	N	29.4	Very low	31.7	Very low	108 Å²	108	129.4 Å²	129.4	58%	0.578	65%	0.654	S	S	*	*			cis	50.2	101.7	22.2	-172.7	74.2	0	0	0	113.3
805	Q	33.7	Very low	32.1	Very low	145 Å²	145	125.6 Å²	125.6	68%	0.678	64%	0.636	S	S	*	*			trans	64.5	111.5	177.1	-62.1	176.7	-27.5	0	0	114.5
806	N	28.4	Very low	32.6	Very low	116 Å²	116	117.6 Å²	117.6	62%	0.62	62%	0.616	S	S	*	*				-116.5	133.2	94.6	-124.5	-5.9	0	0	0	108.7	Q808	N806-Q808 HydrophobicContact CB-CB 4.31Å; N806-Q808 HydrophobicContact CB-CG 4.24Å; N806-Q808 VanDerWaalsContact ND2-CD 3.32Å; N806-Q808 PolarHBondContact ND2-OE1 2.84Å; N806-Q808 PolarHBondContact O-N 2.61Å
807	P	42.1	Very low	33	Very low	93 Å²	93	118.9 Å²	118.9	60%	0.604	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	25.1	176.3	34.2	-36.3	0	0	0	112.4
808	Q	33	Very low	33.6	Very low	105 Å²	105	117 Å²	117	49%	0.491	59%	0.593	S	S	.	*	H	α-helix	trans	-89	-30.2	-169.7	-72.3	-178.5	-33.5	0	0	113.2	N806 I810 Q811 E812	N806-Q808 HydrophobicContact CB-CB 4.31Å; N806-Q808 HydrophobicContact CB-CG 4.24Å; N806-Q808 VanDerWaalsContact ND2-CD 3.32Å; N806-Q808 PolarHBondContact ND2-OE1 2.84Å; N806-Q808 PolarHBondContact O-N 2.61Å; Q808-I810 VanDerWaalsContact C-N 3.3Å; Q808-I810 PolarHBondContact O-N 2.92Å; Q808-Q811 CarbonylContact O-C 3.43Å; Q808-Q811 WeakPolarHBondContact O-CA 3.44Å; Q808-Q811 WeakPolarHBondContact O-CB 3.35Å; Q808-Q811 PolarHBondContact O-N 2.77Å; Q808-E812 VanDerWaalsContact O-CB 3.31Å; Q808-E812 WeakPolarHBondContact O-CB 3.43Å; Q808-E812 PolarHBondContact O-N 3.28Å
809	L	34.6	Very low	33.4	Very low	126 Å²	126	116.6 Å²	116.6	66%	0.66	59%	0.587	S	S	*	*	H	α-helix	trans	-66.5	-31.1	-177.5	-146.2	84.1	0	0	0	113.3	Q811 E812 V813	L809-Q811 VanDerWaalsContact C-N 3.32Å; L809-E812 WeakPolarHBondContact CD1-OE2 3.36Å; L809-V813 WeakPolarHBondContact O-CB 3.31Å; L809-V813 VanDerWaalsContact O-CG2 3.3Å; L809-V813 WeakPolarHBondContact O-CG2 3.42Å; L809-V813 PolarHBondContact O-N 3.37Å
810	I	42.4	Very low	33.6	Very low	148 Å²	148	119.1 Å²	119.1	76%	0.759	60%	0.598	S	S	*	*	H	α-helix	trans	-70.2	-33.2	172	-64.4	177.1	0	0	0	110.5	Q808 T814	Q808-I810 VanDerWaalsContact C-N 3.3Å; Q808-I810 PolarHBondContact O-N 2.92Å; I810-T814 PolarHBondContact O-N 3.24Å; I810-T814 PolarHBondContact O-OG1 3.07Å
811	Q	34.9	Very low	34.2	Very low	95 Å²	95	121.3 Å²	121.3	44%	0.444	62%	0.621	S	S	.	*	H	α-helix	trans	-74.4	-40.2	175.8	-173.2	174.3	-13.2	0	0	111.7	Q808 L809 T814 E815	Q808-Q811 CarbonylContact O-C 3.43Å; Q808-Q811 WeakPolarHBondContact O-CA 3.44Å; Q808-Q811 WeakPolarHBondContact O-CB 3.35Å; Q808-Q811 PolarHBondContact O-N 2.77Å; L809-Q811 VanDerWaalsContact C-N 3.32Å; Q811-T814 WeakPolarHBondContact CA-OG1 3.4Å; Q811-T814 CarbonylContact O-C 3.6Å; Q811-T814 WeakPolarHBondContact O-CA 3.28Å; Q811-T814 PolarHBondContact O-N 3.22Å; Q811-T814 PolarHBondContact O-OG1 3.04Å; Q811-E815 HydrophobicContact CG-CG 4.44Å; Q811-E815 WeakPolarHBondContact CG-OE1 3.38Å; Q811-E815 PolarHBondContact NE2-OE1 3.43Å; Q811-E815 WeakPolarHBondContact O-CB 3.47Å; Q811-E815 WeakPolarHBondContact O-CG 3.43Å; Q811-E815 PolarHBondContact O-N 3.46Å
812	E	36.1	Very low	34.2	Very low	96 Å²	96	114.6 Å²	114.6	45%	0.449	62%	0.615	S	S	.	*	H	α-helix	trans	-68.2	-39.3	179.4	-173.5	170.9	-154.4	0	0	111.5	Q808 L809 T814 E815 T816	Q808-E812 VanDerWaalsContact O-CB 3.31Å; Q808-E812 WeakPolarHBondContact O-CB 3.43Å; Q808-E812 PolarHBondContact O-N 3.28Å; L809-E812 WeakPolarHBondContact CD1-OE2 3.36Å; E812-T814 PolarHBondContact O-N 3.48Å; E812-E815 PolarHBondContact O-N 3.33Å; E812-T816 HydrophobicContact CG-CG2 3.91Å; E812-T816 WeakPolarHBondContact O-CB 3.25Å; E812-T816 PolarHBondContact O-N 3.45Å; E812-T816 PolarHBondContact O-OG1 3.25Å
813	V	37.1	Very low	34.1	Very low	92 Å²	92	118.9 Å²	118.9	56%	0.558	64%	0.643	S	S	*	*	H	α-helix	trans	-66.4	-23.4	169.8	172.6	0	0	0	0	112.1	L809 V817	L809-V813 WeakPolarHBondContact O-CB 3.31Å; L809-V813 VanDerWaalsContact O-CG2 3.3Å; L809-V813 WeakPolarHBondContact O-CG2 3.42Å; L809-V813 PolarHBondContact O-N 3.37Å; V813-V817 WeakPolarHBondContact O-CG2 3.37Å
814	T	37.6	Very low	34.1	Very low	109 Å²	109	115.1 Å²	115.1	67%	0.669	64%	0.637	S	S	*	*	H	α-helix	trans	-86	-11.2	167.6	53.3	0	0	0	0	115	I810 Q811 E812	I810-T814 PolarHBondContact O-N 3.24Å; I810-T814 PolarHBondContact O-OG1 3.07Å; Q811-T814 WeakPolarHBondContact CA-OG1 3.4Å; Q811-T814 CarbonylContact O-C 3.6Å; Q811-T814 WeakPolarHBondContact O-CA 3.28Å; Q811-T814 PolarHBondContact O-N 3.22Å; Q811-T814 PolarHBondContact O-OG1 3.04Å; E812-T814 PolarHBondContact O-N 3.48Å
815	E	32.8	Very low	34.2	Very low	117 Å²	117	118.1 Å²	118.1	55%	0.547	65%	0.652	S	S	.	*	H	α-helix	trans	-106.6	-29.5	-177.6	-75.5	172.9	179.7	0	0	112.9	Q811 E812	Q811-E815 HydrophobicContact CG-CG 4.44Å; Q811-E815 WeakPolarHBondContact CG-OE1 3.38Å; Q811-E815 PolarHBondContact NE2-OE1 3.43Å; Q811-E815 WeakPolarHBondContact O-CB 3.47Å; Q811-E815 WeakPolarHBondContact O-CG 3.43Å; Q811-E815 PolarHBondContact O-N 3.46Å; E812-E815 PolarHBondContact O-N 3.33Å
816	T	35.9	Very low	34	Very low	89 Å²	89	121.8 Å²	121.8	55%	0.546	66%	0.66	S	S	.	*	T	Hydrogen-bonded Turn	trans	-92.6	-4.6	-177.8	54.5	0	0	0	0	115.4	E812 G818	E812-T816 HydrophobicContact CG-CG2 3.91Å; E812-T816 WeakPolarHBondContact O-CB 3.25Å; E812-T816 PolarHBondContact O-N 3.45Å; E812-T816 PolarHBondContact O-OG1 3.25Å; T816-G818 PolarHBondContact O-N 2.93Å
817	V	34.7	Very low	34.4	Very low	131 Å²	131	121.7 Å²	121.7	79%	0.794	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-6.1	164.1	176.4	0	0	0	0	111	V813	V813-V817 WeakPolarHBondContact O-CG2 3.37Å
818	G	35.6	Very low	33.7	Very low	37 Å²	37	121.6 Å²	121.6	38%	0.381	67%	0.673	S	S	.	*	S	Bend	trans	-109.2	132.7	166.7	0	0	0	0	0	111.7	T816	T816-G818 PolarHBondContact O-N 2.93Å
819	Q	30.4	Very low	33.6	Very low	162 Å²	162	125 Å²	125	76%	0.757	69%	0.691	S	S	*	*			trans	75.9	130.8	176.3	-48.4	169.1	68.8	0	0	113.6
820	H	32.2	Very low	33.6	Very low	173 Å²	173	125.1 Å²	125.1	80%	0.801	69%	0.688	S	S	*	*			cis	-131.4	138	9.3	-59.2	-97	0	0	0	112.1
821	S	38.6	Very low	33.2	Very low	131 Å²	131	128.7 Å²	128.7	92%	0.916	69%	0.692	S	S	*	*			trans	-108.9	138.1	153.1	-52.9	0	0	0	0	107.3
822	G	30.1	Very low	33.5	Very low	63 Å²	63	128.4 Å²	128.4	65%	0.649	71%	0.706	S	S	*	*			trans	174.8	92.2	179.1	0	0	0	0	0	116.5
823	D	26	Very low	33.8	Very low	159 Å²	159	125.8 Å²	125.8	85%	0.85	70%	0.696	S	S	*	*			trans	-149.7	85.4	134.3	-100	-35.2	0	0	0	106
824	I	31.6	Very low	34.3	Very low	123 Å²	123	132.7 Å²	132.7	63%	0.631	71%	0.712	S	S	*	*				72.1	106	79.8	-63.2	171.9	0	0	0	112.9	R826	I824-R826 HydrophobicContact CG2-CG 4.5Å
825	L	31.4	Very low	35.3	Very low	171 Å²	171	129.4 Å²	129.4	90%	0.895	69%	0.692	S	S	*	*	S	Bend	trans	-136.4	67.1	131.3	-83.8	-171.9	0	0	0	111.8
826	R	28.6	Very low	36.9	Very low	222 Å²	222	126.5 Å²	126.5	84%	0.838	69%	0.688	S	S	*	*			trans	63.9	158.2	149.2	-75.1	-177.8	168.2	-162.1	-4.3	120.3	I824	I824-R826 HydrophobicContact CG2-CG 4.5Å
827	P	36.4	Very low	38.7	Very low	113 Å²	113	122.4 Å²	122.4	73%	0.734	66%	0.662	S	S	*	*			cis	-135.5	133.2	-17.5	30.7	-9.7	0	0	0	117.1
828	A	27.4	Very low	40.6	Very low	92 Å²	92	119.5 Å²	119.5	76%	0.76	64%	0.642	S	S	*	*			trans	71.4	122.6	133.3	0	0	0	0	0	124.6
829	M	32.3	Very low	42.1	Very low	176 Å²	176	122.5 Å²	122.5	87%	0.867	65%	0.647	S	S	*	*			trans	76	148.7	142.7	-102.3	-171	168	0	0	119
830	Q	34.7	Very low	43.8	Very low	128 Å²	128	123.7 Å²	123.7	60%	0.598	65%	0.649	S	S	*	*			cis	-141.8	158.9	10.1	-62.1	-168.8	9.4	0	0	115.4
831	R	32.4	Very low	46	Very low	224 Å²	224	116 Å²	116	85%	0.845	62%	0.615	S	S	*	*			trans	64.5	159.6	145	-81.7	175.3	171.8	160.3	-2.4	121.4
832	A	40.9	Very low	48	Very low	89 Å²	89	111.8 Å²	111.8	74%	0.736	59%	0.585	S	S	*	*			trans	-97.4	125	179.2	0	0	0	0	0	110.8
833	T	42.8	Very low	50.1	Low	41 Å²	41	111 Å²	111	25%	0.252	57%	0.569	S	S	.	*			trans	-68.4	125.2	-169.6	-24	0	0	0	0	112.4	E852 K853	T833-E852 HydrophobicContact CG2-CB 3.75Å; T833-E852 HydrophobicContact CG2-CG 3.78Å; T833-E852 WeakPolarHBondContact CG2-OE2 3.5Å; T833-K853 HydrophobicContact CG2-CD 4.09Å; T833-K853 HydrophobicContact CG2-CG 4.12Å; T833-K853 WeakPolarHBondContact OG1-CD 3.38Å; T833-K853 WeakPolarHBondContact OG1-CE 3.34Å; T833-K853 PolarHBondContact OG1-NZ 2.8Å
834	R	47.8	Very low	52.6	Low	237 Å²	237	110 Å²	110	89%	0.894	56%	0.559	S	S	*	*			trans	-88.3	-27.2	172.6	-73.4	-171.2	171.4	-139.3	-1.3	113.1	E852	R834-E852 PolarHBondContact N-OE1 3.15Å; R834-E852 PolarHBondContact N-OE2 3.01Å
835	V	58.6	Low	54.9	Low	40 Å²	40	106.7 Å²	106.7	24%	0.242	54%	0.543	C	S	.	.			trans	-77.7	141.4	176.3	-177.5	0	0	0	0	110.4	R848 W849 E852	V835-R848 HydrophobicContact CG2-CG 4.4Å; V835-W849 HydrophobicContact CB-CB 4.5Å; V835-W849 HydrophobicContact CG1-CB 3.93Å; V835-W849 HydrophobicContact CG1-CG 4.46Å; V835-W849 VanDerWaalsContact O-CD1 3.25Å; V835-E852 WeakPolarHBondContact CB-OE2 3.27Å; V835-E852 WeakPolarHBondContact CG2-OE2 3.38Å; V835-E852 PolarHBondContact N-OE2 3.05Å
836	A	65.9	Low	57.2	Low	55 Å²	55	98.5 Å²	98.5	46%	0.455	50%	0.5	S	S	.	.			trans	-138.5	126.5	171.9	0	0	0	0	0	109.6
837	I	75	Confident	59.7	Low	3 Å²	3	88.7 Å²	88.7	2%	0.015	46%	0.464	C	S	.	.			trans	-94.7	147.4	-175.2	55.8	166.7	0	0	0	112.6	S841 V846 W849 L871 F872 L895 Q898	I837-S841 VanDerWaalsContact CA-OG 3.32Å; I837-S841 WeakPolarHBondContact CA-OG 3.47Å; I837-V846 HydrophobicContact CD1-CG2 4.41Å; I837-V846 HydrophobicContact CG2-CG2 4.23Å; I837-W849 HydrophobicContact CD1-CD2 3.78Å; I837-W849 HydrophobicContact CD1-CE3 3.48Å; I837-W849 VanDerWaalsContact CD1-CE3 3.48Å; I837-W849 HydrophobicContact CD1-CG 4.41Å; I837-W849 HydrophobicContact CD1-CH2 4.19Å; I837-W849 HydrophobicContact CD1-CZ2 4.47Å; I837-W849 HydrophobicContact CD1-CZ3 3.71Å; I837-W849 HydrophobicContact CG1-CD2 3.83Å; I837-W849 HydrophobicContact CG1-CE3 4.08Å; I837-W849 HydrophobicContact CG1-CG 4.17Å; I837-W849 HydrophobicContact CG1-CZ2 4.39Å; I837-W849 HydrophobicContact CG1-CZ3 4.45Å; I837-W849 HydrophobicContact CG2-CB 3.68Å; I837-W849 HydrophobicContact CG2-CD2 4.32Å; I837-W849 HydrophobicContact CG2-CG 3.82Å; I837-L871 HydrophobicContact CD1-CD2 4.18Å; I837-F872 HydrophobicContact CD1-CZ 4.19Å; I837-F872 HydrophobicContact CG1-CE2 4.44Å; I837-F872 HydrophobicContact CG1-CZ 4.05Å; I837-L895 HydrophobicContact CD1-CD2 3.76Å; I837-Q898 HydrophobicContact CG1-CG 4.25Å
838	N	73.3	Confident	61.8	Low	70 Å²	70	88.5 Å²	88.5	37%	0.374	45%	0.449	S	S	.	.			trans	-135	176.9	175.5	70.3	85.6	0	0	0	109.7	K840 S841	N838-K840 PolarHBondContact O-N 3.09Å; N838-K840 PolarHBondContact OD1-N 3.17Å; N838-S841 PolarHBondContact N-OG 3.12Å; N838-S841 PolarHBondContact ND2-OG 3.28Å; N838-S841 WeakPolarHBondContact O-CB 3.29Å; N838-S841 PolarHBondContact O-N 2.81Å; N838-S841 PolarHBondContact O-OG 3.43Å
839	E	68.8	Low	64.5	Low	100 Å²	100	84.1 Å²	84.1	47%	0.467	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-19.6	-177.2	-170.6	172.8	-172.1	0	0	114.4	A869 F904	E839-A869 HydrophobicContact CG-CB 4.15Å; E839-A869 WeakPolarHBondContact O-CB 3.5Å; E839-A869 PolarHBondContact O-N 2.91Å; E839-F904 WeakPolarHBondContact OE2-CD2 3.4Å
840	K	64.8	Low	66.9	Low	188 Å²	188	75.7 Å²	75.7	82%	0.817	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	15.4	178	-53.7	-172.2	-179.7	-173.6	0	113.7	N838	N838-K840 PolarHBondContact O-N 3.09Å; N838-K840 PolarHBondContact OD1-N 3.17Å
841	S	79	Confident	69.1	Low	10 Å²	10	75 Å²	75	7%	0.07	37%	0.369	C	S	.	.			trans	-69.3	135	173	-75.2	0	0	0	0	110.8	I837 N838 G868	I837-S841 VanDerWaalsContact CA-OG 3.32Å; I837-S841 WeakPolarHBondContact CA-OG 3.47Å; N838-S841 PolarHBondContact N-OG 3.12Å; N838-S841 PolarHBondContact ND2-OG 3.28Å; N838-S841 WeakPolarHBondContact O-CB 3.29Å; N838-S841 PolarHBondContact O-N 2.81Å; N838-S841 PolarHBondContact O-OG 3.43Å; S841-G868 PolarHBondContact O-N 3.36Å
842	S	79.4	Confident	71.3	Confident	43 Å²	43	67.6 Å²	67.6	30%	0.301	34%	0.343	S	S	.	.			trans	-68.3	160.3	176.7	71.4	0	0	0	0	111.4	E844 D845 V846	S842-E844 PolarHBondContact O-N 3.28Å; S842-D845 WeakPolarHBondContact CB-OD2 3.42Å; S842-D845 PolarHBondContact N-OD2 3.47Å; S842-D845 WeakPolarHBondContact O-CB 3.49Å; S842-D845 PolarHBondContact O-N 3.23Å; S842-D845 PolarHBondContact OG-N 3.36Å; S842-D845 PolarHBondContact OG-OD2 2.87Å; S842-V846 PolarHBondContact O-N 3.33Å
843	P	75.1	Confident	73	Confident	47 Å²	47	65.6 Å²	65.6	31%	0.305	32%	0.318	S	S	.	.	H	α-helix	trans	-53.3	-40.9	171.3	-28.6	36.5	0	0	0	113.3	D845 V846 T847 G865 Q866 D867	P843-D845 VanDerWaalsContact C-N 3.28Å; P843-D845 PolarHBondContact O-N 2.83Å; P843-V846 WeakPolarHBondContact O-CB 3.15Å; P843-V846 PolarHBondContact O-N 3.42Å; P843-T847 PolarHBondContact O-N 3.32Å; P843-T847 PolarHBondContact O-OG1 3.24Å; P843-G865 WeakPolarHBondContact CG-O 3.49Å; P843-Q866 WeakPolarHBondContact CA-O 3.26Å; P843-D867 HydrophobicContact CG-CB 4.07Å
844	E	78.8	Confident	74.7	Confident	137 Å²	137	66.7 Å²	66.7	64%	0.64	34%	0.337	S	S	*	.	H	α-helix	trans	-60.4	-36.6	176.1	-64.4	-177.2	-155.7	0	0	112.8	S842 R848	S842-E844 PolarHBondContact O-N 3.28Å; E844-R848 WeakPolarHBondContact O-CB 3.43Å; E844-R848 PolarHBondContact O-N 3.14Å; E844-R848 IonicContact OE2-NH2 3.99Å
845	D	79.9	Confident	76.3	Confident	54 Å²	54	55.8 Å²	55.8	29%	0.289	30%	0.296	S	S	.	.	H	α-helix	trans	-72.3	-31.8	175.8	-61	-52.7	0	0	0	112	S842 P843 R848 W849	S842-D845 WeakPolarHBondContact CB-OD2 3.42Å; S842-D845 PolarHBondContact N-OD2 3.47Å; S842-D845 WeakPolarHBondContact O-CB 3.49Å; S842-D845 PolarHBondContact O-N 3.23Å; S842-D845 PolarHBondContact OG-N 3.36Å; S842-D845 PolarHBondContact OG-OD2 2.87Å; P843-D845 VanDerWaalsContact C-N 3.28Å; P843-D845 PolarHBondContact O-N 2.83Å; D845-R848 IonicContact OD1-NH1 3.2Å; D845-R848 PolarHBondContact OD1-NH1 2.69Å; D845-W849 WeakPolarHBondContact O-CB 3.16Å; D845-W849 PolarHBondContact O-N 2.98Å
846	V	80.4	Confident	77.4	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-70.5	-52.3	174.7	171	0	0	0	0	110.7	I837 S842 P843 R848 W849 L850 Q866 L871	I837-V846 HydrophobicContact CD1-CG2 4.41Å; I837-V846 HydrophobicContact CG2-CG2 4.23Å; S842-V846 PolarHBondContact O-N 3.33Å; P843-V846 WeakPolarHBondContact O-CB 3.15Å; P843-V846 PolarHBondContact O-N 3.42Å; V846-R848 VanDerWaalsContact C-N 3.32Å; V846-R848 PolarHBondContact O-N 3.24Å; V846-W849 WeakPolarHBondContact O-CA 3.33Å; V846-W849 WeakPolarHBondContact O-CB 3.4Å; V846-W849 PolarHBondContact O-N 2.99Å; V846-L850 HydrophobicContact CG1-CD1 4.2Å; V846-L850 WeakPolarHBondContact O-CG 3.24Å; V846-L850 PolarHBondContact O-N 2.9Å; V846-Q866 WeakPolarHBondContact CB-O 3.49Å; V846-Q866 WeakPolarHBondContact CG1-O 3.38Å; V846-L871 HydrophobicContact CG1-CD2 3.49Å; V846-L871 VanDerWaalsContact CG1-CD2 3.49Å
847	T	80.1	Confident	77.7	Confident	15 Å²	15	57.3 Å²	57.3	9%	0.092	30%	0.303	C	S	.	.	H	α-helix	trans	-57.8	-44.4	176.1	-56.9	0	0	0	0	110.7	P843 W849 L850 Q851 I860 D864	P843-T847 PolarHBondContact O-N 3.32Å; P843-T847 PolarHBondContact O-OG1 3.24Å; T847-W849 PolarHBondContact O-N 3.14Å; T847-L850 PolarHBondContact O-N 3.12Å; T847-Q851 WeakPolarHBondContact O-CB 3.18Å; T847-Q851 VanDerWaalsContact O-CG 3.28Å; T847-Q851 WeakPolarHBondContact O-CG 3.5Å; T847-Q851 PolarHBondContact O-N 3.33Å; T847-I860 HydrophobicContact CG2-CG2 3.72Å; T847-D864 WeakPolarHBondContact CB-OD1 3.39Å; T847-D864 WeakPolarHBondContact CG2-OD1 3.5Å; T847-D864 PolarHBondContact OG1-OD1 3.25Å
848	R	79.9	Confident	77.9	Confident	109 Å²	109	65 Å²	65	41%	0.411	33%	0.332	S	S	.	.	H	α-helix	trans	-63.9	-36.5	174.3	-170.7	-176.4	-58.5	127.9	5.8	112.8	V835 E844 D845 V846 E852	V835-R848 HydrophobicContact CG2-CG 4.4Å; E844-R848 WeakPolarHBondContact O-CB 3.43Å; E844-R848 PolarHBondContact O-N 3.14Å; E844-R848 IonicContact OE2-NH2 3.99Å; D845-R848 IonicContact OD1-NH1 3.2Å; D845-R848 PolarHBondContact OD1-NH1 2.69Å; V846-R848 VanDerWaalsContact C-N 3.32Å; V846-R848 PolarHBondContact O-N 3.24Å; R848-E852 WeakPolarHBondContact O-CB 3.43Å; R848-E852 PolarHBondContact O-N 3.47Å
849	W	85.7	Confident	78	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-69.1	-40.9	175.4	179.7	77.8	0	0	0	112.4	V835 I837 D845 V846 T847 E852 K853 L891 Q894 L895 Q898	V835-W849 HydrophobicContact CB-CB 4.5Å; V835-W849 HydrophobicContact CG1-CB 3.93Å; V835-W849 HydrophobicContact CG1-CG 4.46Å; V835-W849 VanDerWaalsContact O-CD1 3.25Å; I837-W849 HydrophobicContact CD1-CD2 3.78Å; I837-W849 HydrophobicContact CD1-CE3 3.48Å; I837-W849 VanDerWaalsContact CD1-CE3 3.48Å; I837-W849 HydrophobicContact CD1-CG 4.41Å; I837-W849 HydrophobicContact CD1-CH2 4.19Å; I837-W849 HydrophobicContact CD1-CZ2 4.47Å; I837-W849 HydrophobicContact CD1-CZ3 3.71Å; I837-W849 HydrophobicContact CG1-CD2 3.83Å; I837-W849 HydrophobicContact CG1-CE3 4.08Å; I837-W849 HydrophobicContact CG1-CG 4.17Å; I837-W849 HydrophobicContact CG1-CZ2 4.39Å; I837-W849 HydrophobicContact CG1-CZ3 4.45Å; I837-W849 HydrophobicContact CG2-CB 3.68Å; I837-W849 HydrophobicContact CG2-CD2 4.32Å; I837-W849 HydrophobicContact CG2-CG 3.82Å; D845-W849 WeakPolarHBondContact O-CB 3.16Å; D845-W849 PolarHBondContact O-N 2.98Å; V846-W849 WeakPolarHBondContact O-CA 3.33Å; V846-W849 WeakPolarHBondContact O-CB 3.4Å; V846-W849 PolarHBondContact O-N 2.99Å; T847-W849 PolarHBondContact O-N 3.14Å; W849-E852 PolarHBondContact O-N 3.46Å; W849-K853 HydrophobicContact CD2-CG 4.09Å; W849-K853 HydrophobicContact CG-CG 4.49Å; W849-K853 HydrophobicContact CZ2-CD 4.45Å; W849-K853 HydrophobicContact CZ2-CG 4.06Å; W849-K853 VanDerWaalsContact O-CB 3.26Å; W849-K853 WeakPolarHBondContact O-CB 3.38Å; W849-K853 VanDerWaalsContact O-CG 3.22Å; W849-K853 WeakPolarHBondContact O-CG 3.44Å; W849-K853 PolarHBondContact O-N 2.78Å; W849-L891 HydrophobicContact CH2-CD1 4.42Å; W849-L891 HydrophobicContact CZ3-CD1 3.91Å; W849-Q894 HydrophobicContact CH2-CB 3.73Å; W849-Q894 HydrophobicContact CZ2-CB 4.09Å; W849-L895 HydrophobicContact CH2-CD2 4.16Å; W849-L895 HydrophobicContact CH2-CG 4.41Å; W849-L895 HydrophobicContact CZ3-CD2 4.11Å; W849-Q898 HydrophobicContact CH2-CG 4.43Å; W849-Q898 HydrophobicContact CZ2-CG 3.71Å; W849-Q898 VanDerWaalsContact NE1-NE2 3.17Å
850	L	81.4	Confident	78.6	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-63.3	-43.5	175.4	-67.6	171.6	0	0	0	111.1	V846 T847 K853 G854 F855 I860 L863 L891	V846-L850 HydrophobicContact CG1-CD1 4.2Å; V846-L850 WeakPolarHBondContact O-CG 3.24Å; V846-L850 PolarHBondContact O-N 2.9Å; T847-L850 PolarHBondContact O-N 3.12Å; L850-K853 PolarHBondContact O-N 3.36Å; L850-G854 PolarHBondContact O-N 2.89Å; L850-F855 HydrophobicContact CB-CD2 4.32Å; L850-F855 HydrophobicContact CD2-CD2 3.65Å; L850-F855 HydrophobicContact CD2-CE2 3.94Å; L850-F855 HydrophobicContact CD2-CG 4.22Å; L850-F855 PolarHBondContact O-N 2.82Å; L850-I860 HydrophobicContact CB-CG1 3.79Å; L850-L863 HydrophobicContact CD1-CB 3.92Å; L850-L863 HydrophobicContact CD1-CD1 3.99Å; L850-L891 HydrophobicContact CD2-CD1 3.6Å
851	Q	81.9	Confident	79.1	Confident	114 Å²	114	53.5 Å²	53.5	53%	0.533	28%	0.283	S	S	.	.	H	α-helix	trans	-59.5	-51.3	172.5	-72	169.4	4.2	0	0	112.2	T847 K853 G854 I860	T847-Q851 WeakPolarHBondContact O-CB 3.18Å; T847-Q851 VanDerWaalsContact O-CG 3.28Å; T847-Q851 WeakPolarHBondContact O-CG 3.5Å; T847-Q851 PolarHBondContact O-N 3.33Å; Q851-K853 PolarHBondContact O-N 2.85Å; Q851-G854 PolarHBondContact O-N 3.34Å; Q851-I860 HydrophobicContact CB-CD1 4.42Å; Q851-I860 HydrophobicContact CG-CD1 3.76Å; Q851-I860 HydrophobicContact CG-CG1 4.26Å; Q851-I860 HydrophobicContact CG-CG2 3.93Å
852	E	78.9	Confident	79	Confident	67 Å²	67	53.9 Å²	53.9	31%	0.313	28%	0.284	S	S	.	.	H	α-helix	trans	-70.9	-15	180	-156	-164.1	-174.2	0	0	112.9	T833 R834 V835 R848 W849	T833-E852 HydrophobicContact CG2-CB 3.75Å; T833-E852 HydrophobicContact CG2-CG 3.78Å; T833-E852 WeakPolarHBondContact CG2-OE2 3.5Å; R834-E852 PolarHBondContact N-OE1 3.15Å; R834-E852 PolarHBondContact N-OE2 3.01Å; V835-E852 WeakPolarHBondContact CB-OE2 3.27Å; V835-E852 WeakPolarHBondContact CG2-OE2 3.38Å; V835-E852 PolarHBondContact N-OE2 3.05Å; R848-E852 WeakPolarHBondContact O-CB 3.43Å; R848-E852 PolarHBondContact O-N 3.47Å; W849-E852 PolarHBondContact O-N 3.46Å
853	K	75.6	Confident	78.8	Confident	48 Å²	48	52 Å²	52	21%	0.209	27%	0.27	C	S	.	.	H	α-helix	trans	-85.1	-11.8	169.7	-78.9	-66	179.4	-162.9	0	114.4	T833 W849 L850 Q851 F855	T833-K853 HydrophobicContact CG2-CD 4.09Å; T833-K853 HydrophobicContact CG2-CG 4.12Å; T833-K853 WeakPolarHBondContact OG1-CD 3.38Å; T833-K853 WeakPolarHBondContact OG1-CE 3.34Å; T833-K853 PolarHBondContact OG1-NZ 2.8Å; W849-K853 HydrophobicContact CD2-CG 4.09Å; W849-K853 HydrophobicContact CG-CG 4.49Å; W849-K853 HydrophobicContact CZ2-CD 4.45Å; W849-K853 HydrophobicContact CZ2-CG 4.06Å; W849-K853 VanDerWaalsContact O-CB 3.26Å; W849-K853 WeakPolarHBondContact O-CB 3.38Å; W849-K853 VanDerWaalsContact O-CG 3.22Å; W849-K853 WeakPolarHBondContact O-CG 3.44Å; W849-K853 PolarHBondContact O-N 2.78Å; L850-K853 PolarHBondContact O-N 3.36Å; Q851-K853 PolarHBondContact O-N 2.85Å; K853-F855 HydrophobicContact CB-CD2 3.62Å; K853-F855 HydrophobicContact CB-CE2 3.58Å; K853-F855 HydrophobicContact CG-CE2 4.18Å
854	G	78	Confident	78.7	Confident	63 Å²	63	53.4 Å²	53.4	65%	0.649	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	73	31.7	-179.5	0	0	0	0	0	114.4	L850 Q851	L850-G854 PolarHBondContact O-N 2.89Å; Q851-G854 PolarHBondContact O-N 3.34Å
855	F	81.9	Confident	78.1	Confident	9 Å²	9	49.1 Å²	49.1	4%	0.039	27%	0.268	C	S	.	.			trans	-67	156.6	165.4	-73.4	-81.5	0	0	0	110.6	L850 K853 V859 I860 Y890 L891 Q894	L850-F855 HydrophobicContact CB-CD2 4.32Å; L850-F855 HydrophobicContact CD2-CD2 3.65Å; L850-F855 HydrophobicContact CD2-CE2 3.94Å; L850-F855 HydrophobicContact CD2-CG 4.22Å; L850-F855 PolarHBondContact O-N 2.82Å; K853-F855 HydrophobicContact CB-CD2 3.62Å; K853-F855 HydrophobicContact CB-CE2 3.58Å; K853-F855 HydrophobicContact CG-CE2 4.18Å; F855-V859 HydrophobicContact CB-CB 4.39Å; F855-V859 HydrophobicContact CB-CG1 4.15Å; F855-V859 HydrophobicContact CD1-CG1 4.21Å; F855-V859 HydrophobicContact CG-CG1 4.38Å; F855-I860 HydrophobicContact CB-CG1 4.42Å; F855-I860 WeakPolarHBondContact O-CD1 3.32Å; F855-Y890 HydrophobicContact CD1-CD1 4.4Å; F855-Y890 AromaticContact CE1-CD1 3.49Å; F855-Y890 HydrophobicContact CE1-CD1 3.49Å; F855-Y890 VanDerWaalsContact CE1-CD1 3.49Å; F855-Y890 HydrophobicContact CE1-CE1 4.07Å; F855-Y890 HydrophobicContact CE1-CG 4.43Å; F855-Y890 AromaticContact CZ-CD1 3.68Å; F855-Y890 HydrophobicContact CZ-CD1 3.68Å; F855-Y890 AromaticContact CZ-CE1 3.91Å; F855-Y890 HydrophobicContact CZ-CE1 3.91Å; F855-L891 HydrophobicContact CE1-CB 3.68Å; F855-L891 HydrophobicContact CE1-CD1 4.28Å; F855-L891 HydrophobicContact CE1-CG 4.5Å; F855-L891 HydrophobicContact CE2-CD1 4.09Å; F855-L891 HydrophobicContact CZ-CB 3.88Å; F855-L891 HydrophobicContact CZ-CD1 3.81Å; F855-L891 HydrophobicContact CZ-CG 4.44Å; F855-Q894 HydrophobicContact CZ-CG 4.34Å
856	S	80.9	Confident	77.9	Confident	32 Å²	32	48.3 Å²	48.3	22%	0.224	26%	0.262	C	S	.	.			trans	-61.9	148	178.3	72	0	0	0	0	111.8	R858 V859 I860 E887	S856-R858 PolarHBondContact O-N 2.9Å; S856-R858 VanDerWaalsContact O-N 3.17Å; S856-V859 PolarHBondContact O-N 2.91Å; S856-V859 WeakPolarHBondContact OG-CG2 3.36Å; S856-V859 PolarHBondContact OG-N 3.14Å; S856-I860 PolarHBondContact O-N 3.29Å; S856-I860 VanDerWaalsContact O-N 3.12Å; S856-E887 WeakPolarHBondContact CB-OE1 3.2Å; S856-E887 VanDerWaalsContact CB-OE2 3.29Å; S856-E887 WeakPolarHBondContact CB-OE2 3.46Å; S856-E887 PolarHBondContact N-OE1 3.4Å; S856-E887 PolarHBondContact OG-OE1 3.34Å; S856-E887 PolarHBondContact OG-OE2 2.64Å
857	P	72.9	Confident	77.6	Confident	94 Å²	94	50.9 Å²	50.9	61%	0.61	28%	0.276	S	S	*	.	H	α-helix	trans	-51.6	-39.8	175.9	-29	36.2	0	0	0	112.4	V859 I860 D861	P857-V859 VanDerWaalsContact C-N 3.31Å; P857-V859 PolarHBondContact O-N 2.8Å; P857-I860 CarbonylContact O-C 3.54Å; P857-I860 WeakPolarHBondContact O-CA 3.49Å; P857-I860 WeakPolarHBondContact O-CB 3.16Å; P857-I860 PolarHBondContact O-N 3.16Å; P857-D861 PolarHBondContact O-N 3.13Å
858	R	78.8	Confident	77.2	Confident	165 Å²	165	50.1 Å²	50.1	62%	0.623	27%	0.271	S	S	*	.	H	α-helix	trans	-53.6	-42.4	173.6	-179.6	-179.2	172.2	155.2	2	113.5	S856 L862 I941	S856-R858 PolarHBondContact O-N 2.9Å; S856-R858 VanDerWaalsContact O-N 3.17Å; R858-L862 WeakPolarHBondContact O-CB 3.38Å; R858-L862 PolarHBondContact O-N 2.77Å; R858-L862 VanDerWaalsContact O-N 3.09Å; R858-I941 HydrophobicContact CG-CD1 3.73Å
859	V	76.9	Confident	76.6	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-75	-30.9	179.1	168.1	0	0	0	0	111.5	F855 S856 P857 L863 C883 E887 L891	F855-V859 HydrophobicContact CB-CB 4.39Å; F855-V859 HydrophobicContact CB-CG1 4.15Å; F855-V859 HydrophobicContact CD1-CG1 4.21Å; F855-V859 HydrophobicContact CG-CG1 4.38Å; S856-V859 PolarHBondContact O-N 2.91Å; S856-V859 WeakPolarHBondContact OG-CG2 3.36Å; S856-V859 PolarHBondContact OG-N 3.14Å; P857-V859 VanDerWaalsContact C-N 3.31Å; P857-V859 PolarHBondContact O-N 2.8Å; V859-L863 HydrophobicContact CG1-CD1 4.07Å; V859-L863 WeakPolarHBondContact O-CB 3.42Å; V859-L863 WeakPolarHBondContact O-CG 3.26Å; V859-L863 PolarHBondContact O-N 2.77Å; V859-C883 HydrophobicContact CG1-CB 4.23Å; V859-C883 HydrophobicContact CG2-CB 3.76Å; V859-E887 HydrophobicContact CG2-CB 4.25Å; V859-E887 WeakPolarHBondContact CG2-OE2 3.29Å; V859-L891 HydrophobicContact CG1-CD2 4.45Å
860	I	80.7	Confident	75.8	Confident	13 Å²	13	49 Å²	49	7%	0.067	28%	0.279	C	S	.	.	H	α-helix	trans	-67.7	-50.6	174.2	-66.2	154.7	0	0	0	109.8	T847 L850 Q851 F855 S856 P857 L862 L863 D864	T847-I860 HydrophobicContact CG2-CG2 3.72Å; L850-I860 HydrophobicContact CB-CG1 3.79Å; Q851-I860 HydrophobicContact CB-CD1 4.42Å; Q851-I860 HydrophobicContact CG-CD1 3.76Å; Q851-I860 HydrophobicContact CG-CG1 4.26Å; Q851-I860 HydrophobicContact CG-CG2 3.93Å; F855-I860 HydrophobicContact CB-CG1 4.42Å; F855-I860 WeakPolarHBondContact O-CD1 3.32Å; S856-I860 PolarHBondContact O-N 3.29Å; S856-I860 VanDerWaalsContact O-N 3.12Å; P857-I860 CarbonylContact O-C 3.54Å; P857-I860 WeakPolarHBondContact O-CA 3.49Å; P857-I860 WeakPolarHBondContact O-CB 3.16Å; P857-I860 PolarHBondContact O-N 3.16Å; I860-L862 PolarHBondContact O-N 2.75Å; I860-L863 CarbonylContact O-C 3.45Å; I860-L863 PolarHBondContact O-N 3.28Å; I860-D864 PolarHBondContact O-N 2.88Å
861	D	75.4	Confident	75.6	Confident	102 Å²	102	49.1 Å²	49.1	55%	0.545	28%	0.279	S	S	.	.	H	α-helix	trans	-64.4	-38	-180	-57.6	-27.1	0	0	0	112.3	P857 L863 D864	P857-D861 PolarHBondContact O-N 3.13Å; D861-L863 VanDerWaalsContact C-N 3.29Å; D861-L863 PolarHBondContact O-N 2.76Å; D861-D864 PolarHBondContact O-N 2.97Å
862	L	76.4	Confident	75.4	Confident	18 Å²	18	44.5 Å²	44.5	9%	0.094	26%	0.257	C	S	.	.	H	α-helix	trans	-67.5	-27.9	178.4	-173.9	70.5	0	0	0	113.3	R858 I860 A882 I938 N939 I941	R858-L862 WeakPolarHBondContact O-CB 3.38Å; R858-L862 PolarHBondContact O-N 2.77Å; R858-L862 VanDerWaalsContact O-N 3.09Å; I860-L862 PolarHBondContact O-N 2.75Å; L862-A882 VanDerWaalsContact CD2-C 3.49Å; L862-A882 HydrophobicContact CD2-CB 3.95Å; L862-A882 WeakPolarHBondContact CD2-O 3.4Å; L862-I938 HydrophobicContact CD1-CG2 3.5Å; L862-I938 HydrophobicContact CG-CG2 3.83Å; L862-N939 WeakPolarHBondContact CD1-O 3.23Å; L862-I941 HydrophobicContact CD1-CD1 4Å; L862-I941 HydrophobicContact CD1-CG1 4.25Å
863	L	74.4	Confident	74.8	Confident	3 Å²	3	45.4 Å²	45.4	2%	0.016	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107	4.8	-179.6	-62.8	176.5	0	0	0	112.8	L850 V859 I860 D861 Q866 L871 L891	L850-L863 HydrophobicContact CD1-CB 3.92Å; L850-L863 HydrophobicContact CD1-CD1 3.99Å; V859-L863 HydrophobicContact CG1-CD1 4.07Å; V859-L863 WeakPolarHBondContact O-CB 3.42Å; V859-L863 WeakPolarHBondContact O-CG 3.26Å; V859-L863 PolarHBondContact O-N 2.77Å; I860-L863 CarbonylContact O-C 3.45Å; I860-L863 PolarHBondContact O-N 3.28Å; D861-L863 VanDerWaalsContact C-N 3.29Å; D861-L863 PolarHBondContact O-N 2.76Å; L863-Q866 VanDerWaalsContact O-CB 3.26Å; L863-Q866 WeakPolarHBondContact O-CB 3.39Å; L863-Q866 WeakPolarHBondContact O-CG 3.46Å; L863-Q866 PolarHBondContact O-N 3.42Å; L863-Q866 VanDerWaalsContact O-N 3.13Å; L863-L871 HydrophobicContact CD1-CD1 4.33Å; L863-L891 HydrophobicContact CD1-CD2 3.42Å; L863-L891 VanDerWaalsContact CD1-CD2 3.42Å
864	D	72.9	Confident	74.5	Confident	77 Å²	77	45.3 Å²	45.3	41%	0.412	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	143.6	177.9	-165.4	44.2	0	0	0	110.7	T847 I860 D861 Q866	T847-D864 WeakPolarHBondContact CB-OD1 3.39Å; T847-D864 WeakPolarHBondContact CG2-OD1 3.5Å; T847-D864 PolarHBondContact OG1-OD1 3.25Å; I860-D864 PolarHBondContact O-N 2.88Å; D861-D864 PolarHBondContact O-N 2.97Å; D864-Q866 VanDerWaalsContact C-N 3.26Å; D864-Q866 PolarHBondContact O-N 2.85Å
865	G	68	Low	74.2	Confident	47 Å²	47	44.6 Å²	44.6	49%	0.485	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	-6.6	-170.2	0	0	0	0	0	115.6	P843	P843-G865 WeakPolarHBondContact CG-O 3.49Å
866	Q	75.1	Confident	73.7	Confident	36 Å²	36	48.6 Å²	48.6	17%	0.168	28%	0.275	C	S	.	.			trans	-82.5	125.6	175.9	-60.5	-59.1	-45.3	0	0	112.2	P843 V846 L863 D864	P843-Q866 WeakPolarHBondContact CA-O 3.26Å; V846-Q866 WeakPolarHBondContact CB-O 3.49Å; V846-Q866 WeakPolarHBondContact CG1-O 3.38Å; L863-Q866 VanDerWaalsContact O-CB 3.26Å; L863-Q866 WeakPolarHBondContact O-CB 3.39Å; L863-Q866 WeakPolarHBondContact O-CG 3.46Å; L863-Q866 PolarHBondContact O-N 3.42Å; L863-Q866 VanDerWaalsContact O-N 3.13Å; D864-Q866 VanDerWaalsContact C-N 3.26Å; D864-Q866 PolarHBondContact O-N 2.85Å
867	D	73.4	Confident	72.8	Confident	54 Å²	54	52.2 Å²	52.2	29%	0.289	29%	0.291	S	S	.	.			trans	-80.2	172.8	175.9	77.3	17.5	0	0	0	113.3	P843 A869 N870 L871	P843-D867 HydrophobicContact CG-CB 4.07Å; D867-A869 PolarHBondContact O-N 2.76Å; D867-A869 PolarHBondContact OD1-N 3.41Å; D867-N870 WeakPolarHBondContact OD1-CB 3.42Å; D867-N870 PolarHBondContact OD1-N 3.37Å; D867-N870 PolarHBondContact OD1-ND2 2.89Å; D867-L871 WeakPolarHBondContact O-CB 3.24Å; D867-L871 PolarHBondContact O-N 3.33Å
868	G	72.3	Confident	72.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.2	-37.5	179.6	0	0	0	0	0	113.9	S841 F872	S841-G868 PolarHBondContact O-N 3.36Å; G868-F872 WeakPolarHBondContact O-CB 3.3Å; G868-F872 WeakPolarHBondContact O-CD2 3.24Å; G868-F872 WeakPolarHBondContact O-CG 3.37Å; G868-F872 PolarHBondContact O-N 2.78Å
869	A	67.9	Low	72.2	Confident	36 Å²	36	45 Å²	45	30%	0.298	26%	0.256	S	S	.	.	H	α-helix	trans	-66.1	-48	-178.8	0	0	0	0	0	111.2	E839 D867 F872 S873	E839-A869 HydrophobicContact CG-CB 4.15Å; E839-A869 WeakPolarHBondContact O-CB 3.5Å; E839-A869 PolarHBondContact O-N 2.91Å; D867-A869 PolarHBondContact O-N 2.76Å; D867-A869 PolarHBondContact OD1-N 3.41Å; A869-F872 PolarHBondContact O-N 2.72Å; A869-S873 PolarHBondContact O-N 3.3Å
870	N	68.9	Low	72.2	Confident	50 Å²	50	47.4 Å²	47.4	27%	0.267	27%	0.267	S	S	.	.	H	α-helix	trans	-63.7	-46.7	177.3	-69	-28.4	0	0	0	110.7	D867 F872 S873 L874	D867-N870 WeakPolarHBondContact OD1-CB 3.42Å; D867-N870 PolarHBondContact OD1-N 3.37Å; D867-N870 PolarHBondContact OD1-ND2 2.89Å; N870-F872 VanDerWaalsContact C-N 3.27Å; N870-F872 PolarHBondContact O-N 2.76Å; N870-S873 PolarHBondContact O-N 3.1Å; N870-S873 PolarHBondContact O-OG 3.1Å; N870-L874 WeakPolarHBondContact O-CG 3.22Å; N870-L874 PolarHBondContact O-N 3.39Å; N870-L874 VanDerWaalsContact O-N 3.14Å
871	L	77.2	Confident	71.4	Confident	1 Å²	1	53 Å²	53	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-65	-29	178.5	-170.5	58.9	0	0	0	113.2	I837 V846 L863 D867 L874 L879 L895	I837-L871 HydrophobicContact CD1-CD2 4.18Å; V846-L871 HydrophobicContact CG1-CD2 3.49Å; V846-L871 VanDerWaalsContact CG1-CD2 3.49Å; L863-L871 HydrophobicContact CD1-CD1 4.33Å; D867-L871 WeakPolarHBondContact O-CB 3.24Å; D867-L871 PolarHBondContact O-N 3.33Å; L871-L874 HydrophobicContact CD1-CD1 4.24Å; L871-L879 HydrophobicContact CD1-CD2 4.05Å; L871-L895 HydrophobicContact CD1-CD1 3.87Å; L871-L895 HydrophobicContact CD2-CD1 4.35Å; L871-L895 HydrophobicContact CD2-CD2 3.83Å; L871-L895 HydrophobicContact CG-CD1 3.75Å; L871-L895 HydrophobicContact CG-CD2 3.77Å; L871-L895 HydrophobicContact CG-CG 4.42Å
872	F	75.9	Confident	70.7	Confident	18 Å²	18	49.5 Å²	49.5	8%	0.079	28%	0.278	C	S	.	.	H	α-helix	trans	-83.7	-7.1	171.7	-73.5	-53.8	0	0	0	115	I837 G868 A869 N870 L895 Q898 K899	I837-F872 HydrophobicContact CD1-CZ 4.19Å; I837-F872 HydrophobicContact CG1-CE2 4.44Å; I837-F872 HydrophobicContact CG1-CZ 4.05Å; G868-F872 WeakPolarHBondContact O-CB 3.3Å; G868-F872 WeakPolarHBondContact O-CD2 3.24Å; G868-F872 WeakPolarHBondContact O-CG 3.37Å; G868-F872 PolarHBondContact O-N 2.78Å; A869-F872 PolarHBondContact O-N 2.72Å; N870-F872 VanDerWaalsContact C-N 3.27Å; N870-F872 PolarHBondContact O-N 2.76Å; F872-L895 HydrophobicContact CD1-CB 4.21Å; F872-L895 HydrophobicContact CD1-CD2 3.98Å; F872-L895 HydrophobicContact CE1-CB 3.99Å; F872-L895 HydrophobicContact CE1-CD2 3.56Å; F872-L895 HydrophobicContact CE1-CG 4.41Å; F872-L895 WeakPolarHBondContact CE1-O 3.48Å; F872-L895 HydrophobicContact CZ-CD2 4.11Å; F872-Q898 HydrophobicContact CE1-CB 3.97Å; F872-Q898 HydrophobicContact CZ-CB 3.71Å; F872-K899 HydrophobicContact CB-CD 4.44Å; F872-K899 HydrophobicContact CD1-CB 4.07Å; F872-K899 HydrophobicContact CD1-CD 4.14Å; F872-K899 HydrophobicContact CD1-CG 4.38Å; F872-K899 HydrophobicContact CE1-CB 4.06Å; F872-K899 PolarHBondContact O-NZ 2.98Å
873	S	67.9	Low	70.5	Confident	86 Å²	86	49.2 Å²	49.2	60%	0.601	28%	0.278	S	S	*	.	H	α-helix	trans	-93.6	-28.2	173.9	83.6	0	0	0	0	112.4	A869 N870 S875	A869-S873 PolarHBondContact O-N 3.3Å; N870-S873 PolarHBondContact O-N 3.1Å; N870-S873 PolarHBondContact O-OG 3.1Å; S873-S875 PolarHBondContact O-N 3.08Å
874	L	69.1	Low	70.4	Confident	45 Å²	45	50.7 Å²	50.7	24%	0.236	29%	0.294	C	S	.	.	S	Bend	trans	-58.8	134.1	178.7	-70.5	176.4	0	0	0	112.7	N870 L871 L879	N870-L874 WeakPolarHBondContact O-CG 3.22Å; N870-L874 PolarHBondContact O-N 3.39Å; N870-L874 VanDerWaalsContact O-N 3.14Å; L871-L874 HydrophobicContact CD1-CD1 4.24Å; L874-L879 HydrophobicContact CB-CD1 4.43Å; L874-L879 HydrophobicContact CB-CD2 4.04Å; L874-L879 HydrophobicContact CB-CG 4.05Å; L874-L879 HydrophobicContact CD1-CD2 3.76Å
875	S	70.7	Confident	69.9	Low	48 Å²	48	56.6 Å²	56.6	34%	0.336	31%	0.31	S	S	.	.			trans	-74.7	155.9	179.9	81.7	0	0	0	0	111.6	S873 L877 H878 L879	S873-S875 PolarHBondContact O-N 3.08Å; S875-L877 PolarHBondContact O-N 2.8Å; S875-L877 PolarHBondContact OG-N 2.92Å; S875-H878 PolarHBondContact O-N 3.17Å; S875-H878 PolarHBondContact OG-N 2.66Å; S875-H878 VanDerWaalsContact OG-N 3.09Å; S875-H878 PolarHBondContact OG-ND1 2.69Å; S875-L879 PolarHBondContact O-N 2.98Å
876	K	71.3	Confident	70	Confident	94 Å²	94	60.7 Å²	60.7	41%	0.409	32%	0.321	S	S	.	.	H	α-helix	trans	-52.9	-38.7	172.2	-174	177.5	177.1	-179.6	0	112	Q880 Y892	K876-Q880 HydrophobicContact CG-CG 4.46Å; K876-Q880 WeakPolarHBondContact O-CB 3.37Å; K876-Q880 VanDerWaalsContact O-CG 3.29Å; K876-Q880 WeakPolarHBondContact O-CG 3.26Å; K876-Q880 PolarHBondContact O-N 2.92Å; K876-Y892 HydrophobicContact CB-CD1 3.73Å; K876-Y892 HydrophobicContact CB-CD2 3.69Å; K876-Y892 HydrophobicContact CB-CE1 3.87Å; K876-Y892 HydrophobicContact CB-CE2 3.83Å; K876-Y892 HydrophobicContact CB-CG 3.63Å; K876-Y892 HydrophobicContact CD-CD1 3.73Å; K876-Y892 HydrophobicContact CD-CE1 4.02Å; K876-Y892 HydrophobicContact CD-CG 4.33Å; K876-Y892 HydrophobicContact CG-CD1 3.65Å; K876-Y892 HydrophobicContact CG-CD2 4.31Å; K876-Y892 HydrophobicContact CG-CE1 4.16Å; K876-Y892 HydrophobicContact CG-CG 3.73Å
877	L	62.8	Low	70	Confident	107 Å²	107	62.1 Å²	62.1	56%	0.56	33%	0.328	S	S	*	.	H	α-helix	trans	-67.3	-46.6	-179.3	-175.6	62	0	0	0	111.4	S875 L879 Q880 Q881	S875-L877 PolarHBondContact O-N 2.8Å; S875-L877 PolarHBondContact OG-N 2.92Å; L877-L879 PolarHBondContact O-N 2.64Å; L877-Q880 CarbonylContact O-C 3.6Å; L877-Q880 PolarHBondContact O-N 2.93Å; L877-Q881 HydrophobicContact CD1-CG 4.5Å; L877-Q881 WeakPolarHBondContact O-CB 3.34Å; L877-Q881 WeakPolarHBondContact O-CG 3.33Å; L877-Q881 PolarHBondContact O-N 2.78Å
878	H	65.4	Low	69.9	Low	106 Å²	106	59.5 Å²	59.5	49%	0.491	31%	0.314	S	S	.	.	H	α-helix	trans	-63.3	-41.9	177.9	-65.1	162.1	0	0	0	111.8	S875 Q880 Q881 A882	S875-H878 PolarHBondContact O-N 3.17Å; S875-H878 PolarHBondContact OG-N 2.66Å; S875-H878 VanDerWaalsContact OG-N 3.09Å; S875-H878 PolarHBondContact OG-ND1 2.69Å; H878-Q880 PolarHBondContact O-N 2.77Å; H878-Q881 PolarHBondContact O-N 3.08Å; H878-A882 WeakPolarHBondContact O-CB 3.42Å; H878-A882 PolarHBondContact O-N 2.83Å
879	L	72.6	Confident	69.7	Low	2 Å²	2	60 Å²	60	1%	0.01	32%	0.319	C	S	.	.	H	α-helix	trans	-64.6	-38.1	174.8	-66.7	175.8	0	0	0	112.1	L871 L874 S875 L877 Q881 C883 G888 L891 Y892 L895	L871-L879 HydrophobicContact CD1-CD2 4.05Å; L874-L879 HydrophobicContact CB-CD1 4.43Å; L874-L879 HydrophobicContact CB-CD2 4.04Å; L874-L879 HydrophobicContact CB-CG 4.05Å; L874-L879 HydrophobicContact CD1-CD2 3.76Å; S875-L879 PolarHBondContact O-N 2.98Å; L877-L879 PolarHBondContact O-N 2.64Å; L879-Q881 VanDerWaalsContact C-N 3.34Å; L879-C883 VanDerWaalsContact O-CB 3.3Å; L879-C883 WeakPolarHBondContact O-CB 3.33Å; L879-C883 PolarHBondContact O-N 2.86Å; L879-G888 WeakPolarHBondContact O-CA 2.86Å; L879-L891 HydrophobicContact CD1-CG 4.45Å; L879-L891 HydrophobicContact CD2-CD2 4.07Å; L879-Y892 HydrophobicContact CD1-CD2 4.13Å; L879-L895 HydrophobicContact CD1-CD1 3.7Å
880	Q	77.4	Confident	70.3	Confident	52 Å²	52	63.9 Å²	63.9	24%	0.243	33%	0.327	C	S	.	.	H	α-helix	trans	-71.9	-22.9	174.6	-74.4	-172.7	-65.9	0	0	114.1	K876 L877 H878 G884 R885	K876-Q880 HydrophobicContact CG-CG 4.46Å; K876-Q880 WeakPolarHBondContact O-CB 3.37Å; K876-Q880 VanDerWaalsContact O-CG 3.29Å; K876-Q880 WeakPolarHBondContact O-CG 3.26Å; K876-Q880 PolarHBondContact O-N 2.92Å; L877-Q880 CarbonylContact O-C 3.6Å; L877-Q880 PolarHBondContact O-N 2.93Å; H878-Q880 PolarHBondContact O-N 2.77Å; Q880-G884 CarbonylContact O-C 3.56Å; Q880-G884 VanDerWaalsContact O-CA 3.27Å; Q880-G884 WeakPolarHBondContact O-CA 3.37Å; Q880-G884 PolarHBondContact O-N 3.42Å; Q880-R885 PolarHBondContact NE2-O 2.81Å; Q880-R885 PolarHBondContact O-N 3.21Å
881	Q	64.4	Low	70.8	Confident	132 Å²	132	61.5 Å²	61.5	62%	0.617	31%	0.314	S	S	*	.	H	α-helix	trans	-81.1	-44	173.3	-75.2	168.9	-37.6	0	0	111.6	L877 H878 L879	L877-Q881 HydrophobicContact CD1-CG 4.5Å; L877-Q881 WeakPolarHBondContact O-CB 3.34Å; L877-Q881 WeakPolarHBondContact O-CG 3.33Å; L877-Q881 PolarHBondContact O-N 2.78Å; H878-Q881 PolarHBondContact O-N 3.08Å; L879-Q881 VanDerWaalsContact C-N 3.34Å
882	A	61.3	Low	70.8	Confident	28 Å²	28	65.1 Å²	65.1	23%	0.231	33%	0.328	C	S	.	.	H	α-helix	trans	-71.9	-56.7	179.7	0	0	0	0	0	112	L862 H878 G884 I938	L862-A882 VanDerWaalsContact CD2-C 3.49Å; L862-A882 HydrophobicContact CD2-CB 3.95Å; L862-A882 WeakPolarHBondContact CD2-O 3.4Å; H878-A882 WeakPolarHBondContact O-CB 3.42Å; H878-A882 PolarHBondContact O-N 2.83Å; A882-G884 VanDerWaalsContact C-N 3.32Å; A882-G884 PolarHBondContact O-N 2.81Å; A882-I938 HydrophobicContact CB-CD1 4.42Å
883	C	72.3	Confident	70.9	Confident	12 Å²	12	67.2 Å²	67.2	8%	0.081	35%	0.345	C	S	.	.	S	Bend	trans	-88.2	2.3	-174.2	-51.7	0	0	0	0	113.4	V859 L879	V859-C883 HydrophobicContact CG1-CB 4.23Å; V859-C883 HydrophobicContact CG2-CB 3.76Å; L879-C883 VanDerWaalsContact O-CB 3.3Å; L879-C883 WeakPolarHBondContact O-CB 3.33Å; L879-C883 PolarHBondContact O-N 2.86Å
884	G	70.7	Confident	71.5	Confident	34 Å²	34	64.9 Å²	64.9	35%	0.351	32%	0.324	S	S	.	.			trans	79.6	162.3	-171.2	0	0	0	0	0	113.5	Q880 A882 D886 G888	Q880-G884 CarbonylContact O-C 3.56Å; Q880-G884 VanDerWaalsContact O-CA 3.27Å; Q880-G884 WeakPolarHBondContact O-CA 3.37Å; Q880-G884 PolarHBondContact O-N 3.42Å; A882-G884 VanDerWaalsContact C-N 3.32Å; A882-G884 PolarHBondContact O-N 2.81Å; G884-D886 VanDerWaalsContact C-N 3.32Å; G884-D886 PolarHBondContact O-N 3.46Å; G884-G888 WeakPolarHBondContact O-CA 3.48Å; G884-G888 PolarHBondContact O-N 3.23Å
885	R	63.2	Low	72	Confident	200 Å²	200	63 Å²	63	76%	0.755	31%	0.314	S	S	*	.	H	α-helix	trans	-59.3	-40	-165.2	-158.4	-179	-155.2	-178.7	7.3	113.5	Q880 G889	Q880-R885 PolarHBondContact NE2-O 2.81Å; Q880-R885 PolarHBondContact O-N 3.21Å; R885-G889 PolarHBondContact O-N 3.35Å
886	D	69.3	Low	72.2	Confident	133 Å²	133	64.4 Å²	64.4	71%	0.711	32%	0.318	S	S	*	.	H	α-helix	trans	-92.6	-51.4	-170.9	-53.8	-49.2	0	0	0	111.7	G884 G888 G889 Y890	G884-D886 VanDerWaalsContact C-N 3.32Å; G884-D886 PolarHBondContact O-N 3.46Å; D886-G888 PolarHBondContact O-N 2.59Å; D886-G889 PolarHBondContact O-N 2.8Å; D886-Y890 WeakPolarHBondContact O-CB 3.47Å; D886-Y890 PolarHBondContact O-N 2.79Å
887	E	75	Confident	72.4	Confident	66 Å²	66	64.1 Å²	64.1	31%	0.308	32%	0.324	S	S	.	.	H	α-helix	trans	-62.1	-43.3	174.3	-70.8	-157.7	92.3	0	0	111.9	S856 V859 G889 Y890 L891	S856-E887 WeakPolarHBondContact CB-OE1 3.2Å; S856-E887 VanDerWaalsContact CB-OE2 3.29Å; S856-E887 WeakPolarHBondContact CB-OE2 3.46Å; S856-E887 PolarHBondContact N-OE1 3.4Å; S856-E887 PolarHBondContact OG-OE1 3.34Å; S856-E887 PolarHBondContact OG-OE2 2.64Å; V859-E887 HydrophobicContact CG2-CB 4.25Å; V859-E887 WeakPolarHBondContact CG2-OE2 3.29Å; E887-G889 VanDerWaalsContact C-N 3.33Å; E887-G889 PolarHBondContact O-N 3.35Å; E887-Y890 PolarHBondContact O-N 3.06Å; E887-L891 VanDerWaalsContact O-CB 3.29Å; E887-L891 WeakPolarHBondContact O-CB 3.21Å; E887-L891 PolarHBondContact O-N 3.21Å
888	G	71.7	Confident	72.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-66.7	-31.8	175.4	0	0	0	0	0	113.8	L879 G884 D886 Y892	L879-G888 WeakPolarHBondContact O-CA 2.86Å; G884-G888 WeakPolarHBondContact O-CA 3.48Å; G884-G888 PolarHBondContact O-N 3.23Å; D886-G888 PolarHBondContact O-N 2.59Å; G888-Y892 WeakPolarHBondContact O-CB 3.38Å; G888-Y892 PolarHBondContact O-N 2.77Å
889	G	68.6	Low	73	Confident	11 Å²	11	57.3 Å²	57.3	11%	0.113	29%	0.288	C	S	.	.	H	α-helix	trans	-69.8	-39.8	173.8	0	0	0	0	0	112.1	R885 D886 E887 S893	R885-G889 PolarHBondContact O-N 3.35Å; D886-G889 PolarHBondContact O-N 2.8Å; E887-G889 VanDerWaalsContact C-N 3.33Å; E887-G889 PolarHBondContact O-N 3.35Å; G889-S893 WeakPolarHBondContact O-CB 3.4Å; G889-S893 PolarHBondContact O-N 2.94Å; G889-S893 PolarHBondContact O-OG 3.03Å
890	Y	79.9	Confident	72.4	Confident	116 Å²	116	65.1 Å²	65.1	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-68.5	-43.2	174.1	-179.2	-122.6	0	0	0	111.7	F855 D886 E887 S893 Q894	F855-Y890 HydrophobicContact CD1-CD1 4.4Å; F855-Y890 AromaticContact CE1-CD1 3.49Å; F855-Y890 HydrophobicContact CE1-CD1 3.49Å; F855-Y890 VanDerWaalsContact CE1-CD1 3.49Å; F855-Y890 HydrophobicContact CE1-CE1 4.07Å; F855-Y890 HydrophobicContact CE1-CG 4.43Å; F855-Y890 AromaticContact CZ-CD1 3.68Å; F855-Y890 HydrophobicContact CZ-CD1 3.68Å; F855-Y890 AromaticContact CZ-CE1 3.91Å; F855-Y890 HydrophobicContact CZ-CE1 3.91Å; D886-Y890 WeakPolarHBondContact O-CB 3.47Å; D886-Y890 PolarHBondContact O-N 2.79Å; E887-Y890 PolarHBondContact O-N 3.06Å; Y890-S893 WeakPolarHBondContact O-CB 3.41Å; Y890-S893 PolarHBondContact O-N 3.13Å; Y890-S893 VanDerWaalsContact O-N 3.13Å; Y890-Q894 HydrophobicContact CD2-CG 4.49Å; Y890-Q894 HydrophobicContact CE1-CG 4.4Å; Y890-Q894 HydrophobicContact CE2-CG 4.17Å; Y890-Q894 WeakPolarHBondContact O-CG 3.46Å; Y890-Q894 PolarHBondContact O-N 2.98Å; Y890-Q894 PolarHBondContact OH-NE2 3.07Å
891	L	79.6	Confident	71.6	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-59.1	-51.9	175.7	177.2	56.4	0	0	0	112.1	W849 L850 F855 V859 L863 L879 E887 S893 Q894 L895	W849-L891 HydrophobicContact CH2-CD1 4.42Å; W849-L891 HydrophobicContact CZ3-CD1 3.91Å; L850-L891 HydrophobicContact CD2-CD1 3.6Å; F855-L891 HydrophobicContact CE1-CB 3.68Å; F855-L891 HydrophobicContact CE1-CD1 4.28Å; F855-L891 HydrophobicContact CE1-CG 4.5Å; F855-L891 HydrophobicContact CE2-CD1 4.09Å; F855-L891 HydrophobicContact CZ-CB 3.88Å; F855-L891 HydrophobicContact CZ-CD1 3.81Å; F855-L891 HydrophobicContact CZ-CG 4.44Å; V859-L891 HydrophobicContact CG1-CD2 4.45Å; L863-L891 HydrophobicContact CD1-CD2 3.42Å; L863-L891 VanDerWaalsContact CD1-CD2 3.42Å; L879-L891 HydrophobicContact CD1-CG 4.45Å; L879-L891 HydrophobicContact CD2-CD2 4.07Å; E887-L891 VanDerWaalsContact O-CB 3.29Å; E887-L891 WeakPolarHBondContact O-CB 3.21Å; E887-L891 PolarHBondContact O-N 3.21Å; L891-S893 PolarHBondContact O-N 2.83Å; L891-Q894 PolarHBondContact O-N 2.91Å; L891-Q894 VanDerWaalsContact O-N 3.15Å; L891-L895 HydrophobicContact CD1-CD1 3.92Å; L891-L895 HydrophobicContact CD1-CG 4.09Å; L891-L895 HydrophobicContact CG-CD1 3.89Å; L891-L895 WeakPolarHBondContact O-CB 3.22Å; L891-L895 WeakPolarHBondContact O-CG 3.41Å; L891-L895 PolarHBondContact O-N 2.73Å
892	Y	77.8	Confident	71.3	Confident	78 Å²	78	68.6 Å²	68.6	31%	0.306	34%	0.337	S	S	.	.	H	α-helix	trans	-56.9	-35.8	175	-179.7	-96	0	0	0	112.2	K876 L879 G888 L895 L896	K876-Y892 HydrophobicContact CB-CD1 3.73Å; K876-Y892 HydrophobicContact CB-CD2 3.69Å; K876-Y892 HydrophobicContact CB-CE1 3.87Å; K876-Y892 HydrophobicContact CB-CE2 3.83Å; K876-Y892 HydrophobicContact CB-CG 3.63Å; K876-Y892 HydrophobicContact CD-CD1 3.73Å; K876-Y892 HydrophobicContact CD-CE1 4.02Å; K876-Y892 HydrophobicContact CD-CG 4.33Å; K876-Y892 HydrophobicContact CG-CD1 3.65Å; K876-Y892 HydrophobicContact CG-CD2 4.31Å; K876-Y892 HydrophobicContact CG-CE1 4.16Å; K876-Y892 HydrophobicContact CG-CG 3.73Å; L879-Y892 HydrophobicContact CD1-CD2 4.13Å; G888-Y892 WeakPolarHBondContact O-CB 3.38Å; G888-Y892 PolarHBondContact O-N 2.77Å; Y892-L895 PolarHBondContact O-N 3.35Å; Y892-L896 WeakPolarHBondContact O-CB 3.39Å; Y892-L896 PolarHBondContact O-N 3.33Å
893	S	78.7	Confident	70.8	Confident	61 Å²	61	69.8 Å²	69.8	43%	0.427	35%	0.352	S	S	.	.	H	α-helix	trans	-69.6	-42	178	-56.1	0	0	0	0	112.2	G889 Y890 L891 L896 V897	G889-S893 WeakPolarHBondContact O-CB 3.4Å; G889-S893 PolarHBondContact O-N 2.94Å; G889-S893 PolarHBondContact O-OG 3.03Å; Y890-S893 WeakPolarHBondContact O-CB 3.41Å; Y890-S893 PolarHBondContact O-N 3.13Å; Y890-S893 VanDerWaalsContact O-N 3.13Å; L891-S893 PolarHBondContact O-N 2.83Å; S893-L896 PolarHBondContact O-N 3.3Å; S893-V897 WeakPolarHBondContact O-CG2 3.42Å; S893-V897 PolarHBondContact O-N 3.17Å
894	Q	80	Confident	69.5	Low	37 Å²	37	73.2 Å²	73.2	17%	0.173	37%	0.365	C	S	.	.	H	α-helix	trans	-64.3	-40.3	172.8	-68.8	-71.2	-24.9	0	0	111.6	W849 F855 Y890 L891 V897 Q898	W849-Q894 HydrophobicContact CH2-CB 3.73Å; W849-Q894 HydrophobicContact CZ2-CB 4.09Å; F855-Q894 HydrophobicContact CZ-CG 4.34Å; Y890-Q894 HydrophobicContact CD2-CG 4.49Å; Y890-Q894 HydrophobicContact CE1-CG 4.4Å; Y890-Q894 HydrophobicContact CE2-CG 4.17Å; Y890-Q894 WeakPolarHBondContact O-CG 3.46Å; Y890-Q894 PolarHBondContact O-N 2.98Å; Y890-Q894 PolarHBondContact OH-NE2 3.07Å; L891-Q894 PolarHBondContact O-N 2.91Å; L891-Q894 VanDerWaalsContact O-N 3.15Å; Q894-V897 WeakPolarHBondContact O-CB 3.35Å; Q894-V897 PolarHBondContact O-N 3.46Å; Q894-Q898 WeakPolarHBondContact O-CG 3.5Å; Q894-Q898 PolarHBondContact O-N 3.12Å
895	L	78.6	Confident	68	Low	5 Å²	5	82.2 Å²	82.2	3%	0.026	39%	0.389	C	S	.	.	H	α-helix	trans	-64	-41.7	175.1	-70.2	166.1	0	0	0	111.7	I837 W849 L871 F872 L879 L891 Y892 V897 Q898 K899	I837-L895 HydrophobicContact CD1-CD2 3.76Å; W849-L895 HydrophobicContact CH2-CD2 4.16Å; W849-L895 HydrophobicContact CH2-CG 4.41Å; W849-L895 HydrophobicContact CZ3-CD2 4.11Å; L871-L895 HydrophobicContact CD1-CD1 3.87Å; L871-L895 HydrophobicContact CD2-CD1 4.35Å; L871-L895 HydrophobicContact CD2-CD2 3.83Å; L871-L895 HydrophobicContact CG-CD1 3.75Å; L871-L895 HydrophobicContact CG-CD2 3.77Å; L871-L895 HydrophobicContact CG-CG 4.42Å; F872-L895 HydrophobicContact CD1-CB 4.21Å; F872-L895 HydrophobicContact CD1-CD2 3.98Å; F872-L895 HydrophobicContact CE1-CB 3.99Å; F872-L895 HydrophobicContact CE1-CD2 3.56Å; F872-L895 HydrophobicContact CE1-CG 4.41Å; F872-L895 WeakPolarHBondContact CE1-O 3.48Å; F872-L895 HydrophobicContact CZ-CD2 4.11Å; L879-L895 HydrophobicContact CD1-CD1 3.7Å; L891-L895 HydrophobicContact CD1-CD1 3.92Å; L891-L895 HydrophobicContact CD1-CG 4.09Å; L891-L895 HydrophobicContact CG-CD1 3.89Å; L891-L895 WeakPolarHBondContact O-CB 3.22Å; L891-L895 WeakPolarHBondContact O-CG 3.41Å; L891-L895 PolarHBondContact O-N 2.73Å; Y892-L895 PolarHBondContact O-N 3.35Å; L895-V897 VanDerWaalsContact C-N 3.25Å; L895-V897 PolarHBondContact O-N 2.99Å; L895-Q898 PolarHBondContact O-N 3.49Å; L895-Q898 VanDerWaalsContact O-N 3.14Å; L895-K899 WeakPolarHBondContact O-CB 3.45Å; L895-K899 PolarHBondContact O-N 3.01Å
896	L	75.3	Confident	67	Low	79 Å²	79	78.4 Å²	78.4	41%	0.414	39%	0.387	S	S	.	.	H	α-helix	trans	-62.4	-33.2	175.9	-172.5	61.9	0	0	0	112.4	Y892 S893 K900	Y892-L896 WeakPolarHBondContact O-CB 3.39Å; Y892-L896 PolarHBondContact O-N 3.33Å; S893-L896 PolarHBondContact O-N 3.3Å; L896-K900 WeakPolarHBondContact O-CG 3.39Å; L896-K900 PolarHBondContact O-N 3.02Å
897	V	75.9	Confident	65.5	Low	87 Å²	87	78.4 Å²	78.4	53%	0.527	38%	0.383	S	S	.	.	H	α-helix	trans	-67.8	-46.4	171.5	172.3	0	0	0	0	111.2	S893 Q894 L895 K899 K900 R901	S893-V897 WeakPolarHBondContact O-CG2 3.42Å; S893-V897 PolarHBondContact O-N 3.17Å; Q894-V897 WeakPolarHBondContact O-CB 3.35Å; Q894-V897 PolarHBondContact O-N 3.46Å; L895-V897 VanDerWaalsContact C-N 3.25Å; L895-V897 PolarHBondContact O-N 2.99Å; V897-K899 PolarHBondContact O-N 3.16Å; V897-K900 PolarHBondContact O-N 2.57Å; V897-R901 WeakPolarHBondContact O-CB 3.09Å; V897-R901 PolarHBondContact O-N 2.71Å
898	Q	71.9	Confident	64	Low	13 Å²	13	80 Å²	80	6%	0.061	40%	0.398	C	S	.	.	H	α-helix	trans	-64	-40.7	177.1	-63.3	-64.5	6.9	0	0	112.3	I837 W849 F872 Q894 L895 K900 R901 S902	I837-Q898 HydrophobicContact CG1-CG 4.25Å; W849-Q898 HydrophobicContact CH2-CG 4.43Å; W849-Q898 HydrophobicContact CZ2-CG 3.71Å; W849-Q898 VanDerWaalsContact NE1-NE2 3.17Å; F872-Q898 HydrophobicContact CE1-CB 3.97Å; F872-Q898 HydrophobicContact CZ-CB 3.71Å; Q894-Q898 WeakPolarHBondContact O-CG 3.5Å; Q894-Q898 PolarHBondContact O-N 3.12Å; L895-Q898 PolarHBondContact O-N 3.49Å; L895-Q898 VanDerWaalsContact O-N 3.14Å; Q898-K900 VanDerWaalsContact C-N 3.29Å; Q898-K900 PolarHBondContact O-N 2.68Å; Q898-R901 CarbonylContact O-C 3.59Å; Q898-R901 WeakPolarHBondContact O-CA 3.36Å; Q898-R901 PolarHBondContact O-N 3.14Å; Q898-S902 WeakPolarHBondContact O-CB 3.5Å; Q898-S902 PolarHBondContact O-N 2.94Å; Q898-S902 PolarHBondContact O-OG 3.22Å; Q898-S902 VanDerWaalsContact O-OG 3.12Å
899	K	68.2	Low	62.6	Low	57 Å²	57	82.5 Å²	82.5	25%	0.248	42%	0.423	C	S	.	.	H	α-helix	trans	-63.9	-31.8	178.6	-162.2	164.5	-169	168.6	0	112.8	F872 L895 V897 S902 F904	F872-K899 HydrophobicContact CB-CD 4.44Å; F872-K899 HydrophobicContact CD1-CB 4.07Å; F872-K899 HydrophobicContact CD1-CD 4.14Å; F872-K899 HydrophobicContact CD1-CG 4.38Å; F872-K899 HydrophobicContact CE1-CB 4.06Å; F872-K899 PolarHBondContact O-NZ 2.98Å; L895-K899 WeakPolarHBondContact O-CB 3.45Å; L895-K899 PolarHBondContact O-N 3.01Å; V897-K899 PolarHBondContact O-N 3.16Å; K899-S902 PolarHBondContact O-OG 3.34Å; K899-F904 HydrophobicContact CD-CD1 4.39Å; K899-F904 VanDerWaalsContact CE-CD1 3.41Å; K899-F904 VanDerWaalsContact CE-CE1 3.49Å; K899-F904 HydrophobicContact CG-CB 3.82Å; K899-F904 HydrophobicContact CG-CD1 4.25Å; K899-F904 HydrophobicContact CG-CG 4.04Å; K899-F904 PolarHBondContact O-N 2.85Å
900	K	61.8	Low	61.2	Low	166 Å²	166	87.8 Å²	87.8	72%	0.722	45%	0.449	S	S	*	.	H	α-helix	trans	-72	-40.1	168	-74.8	-179.2	178.2	-177.2	0	112.2	L896 V897 Q898 G903	L896-K900 WeakPolarHBondContact O-CG 3.39Å; L896-K900 PolarHBondContact O-N 3.02Å; V897-K900 PolarHBondContact O-N 2.57Å; Q898-K900 VanDerWaalsContact C-N 3.29Å; Q898-K900 PolarHBondContact O-N 2.68Å; K900-G903 PolarHBondContact O-N 3.08Å
901	R	58.6	Low	59.4	Low	200 Å²	200	86.2 Å²	86.2	76%	0.755	45%	0.445	S	S	*	.	H	α-helix	trans	-72.8	-28.4	-178	-165.4	174.1	-173.3	163.6	3.4	113.7	V897 Q898	V897-R901 WeakPolarHBondContact O-CB 3.09Å; V897-R901 PolarHBondContact O-N 2.71Å; Q898-R901 CarbonylContact O-C 3.59Å; Q898-R901 WeakPolarHBondContact O-CA 3.36Å; Q898-R901 PolarHBondContact O-N 3.14Å
902	S	59	Low	57.6	Low	58 Å²	58	91.3 Å²	91.3	41%	0.406	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-7.5	176.1	62.6	0	0	0	0	114.1	Q898 K899	Q898-S902 WeakPolarHBondContact O-CB 3.5Å; Q898-S902 PolarHBondContact O-N 2.94Å; Q898-S902 PolarHBondContact O-OG 3.22Å; Q898-S902 VanDerWaalsContact O-OG 3.12Å; K899-S902 PolarHBondContact O-OG 3.34Å
903	G	49.9	Very low	56	Low	53 Å²	53	94.5 Å²	94.5	55%	0.546	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	79	22.9	173.7	0	0	0	0	0	115.5	K900 R905	K900-G903 PolarHBondContact O-N 3.08Å; G903-R905 PolarHBondContact O-N 2.82Å
904	F	45.4	Very low	54.2	Low	84 Å²	84	94.4 Å²	94.4	37%	0.368	49%	0.491	S	S	.	.			trans	-54.2	126.1	-178.5	-174.2	-94	0	0	0	112.6	E839 K899 T906	E839-F904 WeakPolarHBondContact OE2-CD2 3.4Å; K899-F904 HydrophobicContact CD-CD1 4.39Å; K899-F904 VanDerWaalsContact CE-CD1 3.41Å; K899-F904 VanDerWaalsContact CE-CE1 3.49Å; K899-F904 HydrophobicContact CG-CB 3.82Å; K899-F904 HydrophobicContact CG-CD1 4.25Å; K899-F904 HydrophobicContact CG-CG 4.04Å; K899-F904 PolarHBondContact O-N 2.85Å; F904-T906 HydrophobicContact CE1-CG2 3.86Å
905	R	39.1	Very low	52.6	Low	223 Å²	223	96.7 Å²	96.7	84%	0.842	50%	0.503	S	S	*	.			trans	-119.2	124.4	175.9	-68.2	-175	179	-165.6	-0.2	109.9	G903	G903-R905 PolarHBondContact O-N 2.82Å
906	T	43.2	Very low	50.8	Low	119 Å²	119	101.5 Å²	101.5	73%	0.73	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-72.3	132.9	165.9	48.9	0	0	0	0	110	F904	F904-T906 HydrophobicContact CE1-CG2 3.86Å
907	H	38.1	Very low	49.1	Very low	134 Å²	134	102.9 Å²	102.9	62%	0.62	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-54.7	148.5	-172	-73.8	-87.1	0	0	0	114.9	E911	H907-E911 HydrophobicContact CB-CB 4.41Å; H907-E911 WeakPolarHBondContact CB-OE2 3.37Å; H907-E911 IonicContact CE1-OE1 2.75Å; H907-E911 IonicContact CG-OE2 3.8Å; H907-E911 IonicContact ND1-OE1 3.2Å; H907-E911 PolarHBondContact ND1-OE1 3.02Å; H907-E911 IonicContact ND1-OE2 3.73Å; H907-E911 PolarHBondContact ND1-OE2 3.32Å
908	T	42.4	Very low	47.3	Very low	100 Å²	100	104.8 Å²	104.8	61%	0.613	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-75.4	146.6	175.4	33.2	0	0	0	0	111.7	D910 E911	T908-D910 PolarHBondContact O-N 2.89Å; T908-E911 PolarHBondContact N-OE2 2.88Å; T908-E911 WeakPolarHBondContact O-CB 3.42Å; T908-E911 PolarHBondContact O-N 3.42Å; T908-E911 PolarHBondContact OG1-OE2 3.2Å
909	G	42	Very low	45.9	Very low	52 Å²	52	112.7 Å²	112.7	54%	0.536	57%	0.569	S	S	.	*	H	α-helix	trans	-59.1	-20.7	-165.5	0	0	0	0	0	116.8	L912 K913	G909-L912 PolarHBondContact O-N 2.84Å; G909-K913 PolarHBondContact O-N 3.43Å
910	D	38.9	Very low	44.7	Very low	122 Å²	122	118.9 Å²	118.9	65%	0.652	59%	0.59	S	S	*	*	H	α-helix	trans	-76.8	-29.2	176.8	-62.1	-54.1	0	0	0	112.9	T908 L912 K913 A914	T908-D910 PolarHBondContact O-N 2.89Å; D910-L912 VanDerWaalsContact C-N 3.35Å; D910-K913 PolarHBondContact O-N 2.89Å; D910-A914 WeakPolarHBondContact O-CB 3.28Å; D910-A914 PolarHBondContact O-N 2.82Å
911	E	43.2	Very low	43.6	Very low	82 Å²	82	114.3 Å²	114.3	38%	0.383	58%	0.576	S	S	.	*	H	α-helix	trans	-66.7	-39.6	168.3	-67	172	102	0	0	110.6	H907 T908 K913 A914 I915	H907-E911 HydrophobicContact CB-CB 4.41Å; H907-E911 WeakPolarHBondContact CB-OE2 3.37Å; H907-E911 IonicContact CE1-OE1 2.75Å; H907-E911 IonicContact CG-OE2 3.8Å; H907-E911 IonicContact ND1-OE1 3.2Å; H907-E911 PolarHBondContact ND1-OE1 3.02Å; H907-E911 IonicContact ND1-OE2 3.73Å; H907-E911 PolarHBondContact ND1-OE2 3.32Å; T908-E911 PolarHBondContact N-OE2 2.88Å; T908-E911 WeakPolarHBondContact O-CB 3.42Å; T908-E911 PolarHBondContact O-N 3.42Å; T908-E911 PolarHBondContact OG1-OE2 3.2Å; E911-K913 VanDerWaalsContact C-N 3.33Å; E911-K913 PolarHBondContact O-N 2.95Å; E911-A914 PolarHBondContact O-N 3.15Å; E911-I915 WeakPolarHBondContact O-CB 3.39Å; E911-I915 PolarHBondContact O-N 3.09Å; E911-I915 VanDerWaalsContact O-CG1 3.28Å; E911-I915 WeakPolarHBondContact O-CG1 3.27Å
912	L	41	Very low	42.5	Very low	108 Å²	108	108.9 Å²	108.9	57%	0.565	56%	0.559	S	S	*	*	H	α-helix	trans	-62.7	-40.9	175.6	-164.3	74.1	0	0	0	111.1	G909 D910 L916	G909-L912 PolarHBondContact O-N 2.84Å; D910-L912 VanDerWaalsContact C-N 3.35Å; L912-L916 HydrophobicContact CG-CD1 4.11Å; L912-L916 VanDerWaalsContact O-CB 3.3Å; L912-L916 WeakPolarHBondContact O-CB 3.48Å; L912-L916 WeakPolarHBondContact O-CG 3.46Å; L912-L916 PolarHBondContact O-N 3.47Å
913	K	43.9	Very low	41.6	Very low	144 Å²	144	111.8 Å²	111.8	63%	0.626	57%	0.574	S	S	*	*	H	α-helix	trans	-61.6	-43.7	171	-91	176.9	175.4	170.7	0	112.7	G909 D910 E911 L916 N917	G909-K913 PolarHBondContact O-N 3.43Å; D910-K913 PolarHBondContact O-N 2.89Å; E911-K913 VanDerWaalsContact C-N 3.33Å; E911-K913 PolarHBondContact O-N 2.95Å; K913-L916 PolarHBondContact O-N 3.24Å; K913-N917 WeakPolarHBondContact O-CB 3.47Å; K913-N917 PolarHBondContact O-N 3.5Å
914	A	42.4	Very low	41.1	Very low	60 Å²	60	111.8 Å²	111.8	50%	0.496	56%	0.56	S	S	.	*	H	α-helix	trans	-62.6	-47.2	178.4	0	0	0	0	0	111.5	D910 E911 N917 H918	D910-A914 WeakPolarHBondContact O-CB 3.28Å; D910-A914 PolarHBondContact O-N 2.82Å; E911-A914 PolarHBondContact O-N 3.15Å; A914-N917 PolarHBondContact O-N 3.28Å; A914-H918 VanDerWaalsContact O-CB 3.31Å; A914-H918 PolarHBondContact O-N 2.92Å; A914-H918 WeakPolarHBondContact O-CB 3.37Å
915	I	45	Very low	40.5	Very low	84 Å²	84	112.2 Å²	112.2	43%	0.431	57%	0.566	S	S	.	*	H	α-helix	trans	-63.4	-42.3	178	-67.2	163.6	0	0	0	111.2	E911 H918 R919	E911-I915 WeakPolarHBondContact O-CB 3.39Å; E911-I915 PolarHBondContact O-N 3.09Å; E911-I915 VanDerWaalsContact O-CG1 3.28Å; E911-I915 WeakPolarHBondContact O-CG1 3.27Å; I915-H918 PolarHBondContact O-N 3.02Å; I915-R919 WeakPolarHBondContact O-CB 3.21Å; I915-R919 PolarHBondContact O-N 3.12Å
916	L	42.5	Very low	40.2	Very low	106 Å²	106	105.4 Å²	105.4	56%	0.555	55%	0.552	S	S	*	*	H	α-helix	trans	-67.6	-41.6	177.9	-73.8	170.2	0	0	0	112.4	L912 K913 R920	L912-L916 HydrophobicContact CG-CD1 4.11Å; L912-L916 VanDerWaalsContact O-CB 3.3Å; L912-L916 WeakPolarHBondContact O-CB 3.48Å; L912-L916 WeakPolarHBondContact O-CG 3.46Å; L912-L916 PolarHBondContact O-N 3.47Å; K913-L916 PolarHBondContact O-N 3.24Å; L916-R920 VanDerWaalsContact O-CB 3.26Å; L916-R920 WeakPolarHBondContact O-CB 3.46Å; L916-R920 PolarHBondContact O-N 3.37Å
917	N	38.9	Very low	40	Very low	109 Å²	109	107.7 Å²	107.7	58%	0.583	56%	0.56	S	S	*	*	H	α-helix	trans	-64.1	-41.7	172.7	-94.9	3.7	0	0	0	111.8	K913 A914 R920 T921	K913-N917 WeakPolarHBondContact O-CB 3.47Å; K913-N917 PolarHBondContact O-N 3.5Å; A914-N917 PolarHBondContact O-N 3.28Å; N917-R920 WeakPolarHBondContact O-CB 3.47Å; N917-R920 PolarHBondContact O-N 3.48Å; N917-T921 PolarHBondContact O-N 3.1Å; N917-T921 PolarHBondContact O-OG1 2.96Å
918	H	38.5	Very low	39.7	Very low	127 Å²	127	110.1 Å²	110.1	59%	0.588	57%	0.572	S	S	*	*	H	α-helix	trans	-66.7	-42.5	-178.9	-166.3	33.2	0	0	0	112	A914 I915 T921 H922	A914-H918 VanDerWaalsContact O-CB 3.31Å; A914-H918 PolarHBondContact O-N 2.92Å; A914-H918 WeakPolarHBondContact O-CB 3.37Å; I915-H918 PolarHBondContact O-N 3.02Å; H918-T921 PolarHBondContact O-N 3.2Å; H918-T921 PolarHBondContact O-OG1 2.74Å; H918-H922 WeakPolarHBondContact O-CB 3.46Å; H918-H922 PolarHBondContact O-N 2.78Å
919	R	41.6	Very low	39.7	Very low	179 Å²	179	110.3 Å²	110.3	68%	0.675	58%	0.583	S	S	*	*	H	α-helix	trans	-63.8	-38.2	170.9	-77.3	-174.7	169.8	-173.5	-4.4	112.3	I915 T921 H922 V923	I915-R919 WeakPolarHBondContact O-CB 3.21Å; I915-R919 PolarHBondContact O-N 3.12Å; R919-T921 VanDerWaalsContact C-N 3.32Å; R919-T921 PolarHBondContact O-N 3.07Å; R919-H922 PolarHBondContact O-N 3.27Å; R919-H922 VanDerWaalsContact O-N 3.11Å; R919-V923 WeakPolarHBondContact O-CG2 3.49Å; R919-V923 PolarHBondContact O-N 3.36Å
920	R	43.3	Very low	39.3	Very low	187 Å²	187	112.5 Å²	112.5	71%	0.706	60%	0.596	S	S	*	*	H	α-helix	trans	-59.9	-40.4	176	-167.1	178.6	-159.1	152	7.2	112.2	L916 N917	L916-R920 VanDerWaalsContact O-CB 3.26Å; L916-R920 WeakPolarHBondContact O-CB 3.46Å; L916-R920 PolarHBondContact O-N 3.37Å; N917-R920 WeakPolarHBondContact O-CB 3.47Å; N917-R920 PolarHBondContact O-N 3.48Å
921	T	37.9	Very low	38.9	Very low	69 Å²	69	111.6 Å²	111.6	42%	0.423	61%	0.606	S	S	.	*	H	α-helix	trans	-71.2	-33.3	173.1	45.7	0	0	0	0	113.3	P597 N917 H918 R919	P597-T921 VanDerWaalsContact O-O 3.04Å; N917-T921 PolarHBondContact O-N 3.1Å; N917-T921 PolarHBondContact O-OG1 2.96Å; H918-T921 PolarHBondContact O-N 3.2Å; H918-T921 PolarHBondContact O-OG1 2.74Å; R919-T921 VanDerWaalsContact C-N 3.32Å; R919-T921 PolarHBondContact O-N 3.07Å
922	H	36.6	Very low	39.2	Very low	87 Å²	87	115.2 Å²	115.2	40%	0.403	63%	0.628	S	S	.	*	H	α-helix	trans	-87.5	-24.3	-170	-145.5	-52.7	0	0	0	114.7	S596 H918 R919 E924	S596-H922 PolarHBondContact OG-NE2 2.93Å; S596-H922 VanDerWaalsContact OG-NE2 3.07Å; H918-H922 WeakPolarHBondContact O-CB 3.46Å; H918-H922 PolarHBondContact O-N 2.78Å; R919-H922 PolarHBondContact O-N 3.27Å; R919-H922 VanDerWaalsContact O-N 3.11Å; H922-E924 PolarHBondContact O-N 3.26Å
923	V	39.5	Very low	38.6	Very low	118 Å²	118	118.6 Å²	118.6	72%	0.715	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-19.7	172.7	169.8	0	0	0	0	111.7	R919	R919-V923 WeakPolarHBondContact O-CG2 3.49Å; R919-V923 PolarHBondContact O-N 3.36Å
924	E	38.8	Very low	38	Very low	54 Å²	54	115.2 Å²	115.2	25%	0.252	63%	0.633	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.9	-36.5	-167.2	-88.2	-158.8	106.6	0	0	114.9	P598 P599 Q600 H922	P598-E924 VanDerWaalsContact CA-CB 3.44Å; P598-E924 HydrophobicContact CB-CB 3.39Å; P598-E924 HydrophobicContact CB-CG 4.27Å; P599-E924 CarbonylContact C-O 3.56Å; P599-E924 WeakPolarHBondContact CA-O 3.48Å; P599-E924 WeakPolarHBondContact CD-O 3.47Å; Q600-E924 PolarHBondContact N-OE1 3.17Å; Q600-E924 PolarHBondContact NE2-OE1 3.41Å; H922-E924 PolarHBondContact O-N 3.26Å
925	L	34.5	Very low	37.6	Very low	93 Å²	93	118.7 Å²	118.7	49%	0.487	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-103.5	-17.3	-174.1	-160.9	132.9	0	0	0	117.2	P597 N927	P597-L925 HydrophobicContact CB-CD1 3.94Å; P597-L925 HydrophobicContact CG-CD1 4.36Å; P597-L925 WeakPolarHBondContact O-CB 3.49Å; L925-N927 PolarHBondContact O-N 3.16Å
926	S	32	Very low	37.1	Very low	80 Å²	80	121.2 Å²	121.2	56%	0.559	66%	0.656	S	S	*	*			trans	-98.5	73.3	178.8	59.4	0	0	0	0	111.4	E928	S926-E928 PolarHBondContact O-N 3.49Å
927	N	39.4	Very low	37	Very low	167 Å²	167	120.5 Å²	120.5	89%	0.893	66%	0.657	S	S	*	*			trans	-81.2	58.9	177.7	-167.5	35.3	0	0	0	111.8	L925	L925-N927 PolarHBondContact O-N 3.16Å
928	E	30.4	Very low	37.2	Very low	185 Å²	185	119 Å²	119	86%	0.864	65%	0.648	S	S	*	*			trans	-138.4	129.7	176.5	-167	167.5	-126.6	0	0	108.6	S926	S926-E928 PolarHBondContact O-N 3.49Å
929	A	44.3	Very low	37.3	Very low	103 Å²	103	117 Å²	117	85%	0.851	64%	0.641	S	S	*	*			trans	-100.8	135.3	-171.3	0	0	0	0	0	111.7
930	A	31.6	Very low	36.9	Very low	98 Å²	98	113.8 Å²	113.8	81%	0.81	64%	0.643	S	S	*	*			trans	-148.4	125.9	172.1	0	0	0	0	0	112.9
931	A	32.5	Very low	36.5	Very low	103 Å²	103	109.3 Å²	109.3	85%	0.851	63%	0.633	S	S	*	*			trans	68.9	149.5	159.9	0	0	0	0	0	120.3
932	D	47.8	Very low	36.3	Very low	159 Å²	159	117.4 Å²	117.4	85%	0.85	67%	0.672	S	S	*	*			trans	-77.2	147.9	174.3	-60.1	-74.8	0	0	0	112.7
933	E	28.2	Very low	36.2	Very low	178 Å²	178	118.9 Å²	118.9	83%	0.832	69%	0.685	S	S	*	*			trans	-140.3	142.2	170.7	-89	-75	164.7	0	0	107.5
934	P	31.5	Very low	36.1	Very low	73 Å²	73	118.9 Å²	118.9	47%	0.474	68%	0.684	S	S	.	*				-120.8	159.2	-82.7	35.6	-26.2	0	0	0	112.8	F936	P934-F936 HydrophobicContact CG-CD2 4.44Å; P934-F936 HydrophobicContact CG-CE2 3.88Å; P934-F936 HydrophobicContact CG-CZ 4.32Å; P934-F936 WeakPolarHBondContact O-CD2 3.37Å; P934-F936 PolarHBondContact O-N 3.11Å
935	V	35	Very low	35.9	Very low	133 Å²	133	122.6 Å²	122.6	81%	0.806	71%	0.708	S	S	*	*			trans	-74	108.4	174	-179.8	0	0	0	0	109.7	T937	V935-T937 VanDerWaalsContact C-N 3.33Å; V935-T937 PolarHBondContact O-N 3.16Å
936	F	35.1	Very low	36	Very low	138 Å²	138	124.3 Å²	124.3	61%	0.605	72%	0.721	S	S	*	*			trans	-75.6	82.8	172.9	-78.6	-89.3	0	0	0	111.1	P934 I938	P934-F936 HydrophobicContact CG-CD2 4.44Å; P934-F936 HydrophobicContact CG-CE2 3.88Å; P934-F936 HydrophobicContact CG-CZ 4.32Å; P934-F936 WeakPolarHBondContact O-CD2 3.37Å; P934-F936 PolarHBondContact O-N 3.11Å; F936-I938 PolarHBondContact O-N 3.42Å
937	T	38.6	Very low	36.3	Very low	91 Å²	91	127.1 Å²	127.1	56%	0.558	73%	0.731	S	S	*	*			trans	-69.8	113.2	174.7	-52.7	0	0	0	0	110.6	V935	V935-T937 VanDerWaalsContact C-N 3.33Å; V935-T937 PolarHBondContact O-N 3.16Å
938	I	43.3	Very low	36	Very low	78 Å²	78	124.4 Å²	124.4	40%	0.4	72%	0.72	S	S	.	*	P	Polyproline II helix	trans	-78	132.8	160.7	-60.1	177.2	0	0	0	107.1	L862 A882 F936 P940	L862-I938 HydrophobicContact CD1-CG2 3.5Å; L862-I938 HydrophobicContact CG-CG2 3.83Å; A882-I938 HydrophobicContact CB-CD1 4.42Å; F936-I938 PolarHBondContact O-N 3.42Å; I938-P940 WeakPolarHBondContact O-CD 3.23Å
939	N	40.8	Very low	36.4	Very low	83 Å²	83	120.1 Å²	120.1	44%	0.444	71%	0.71	S	S	.	*	P	Polyproline II helix	trans	-59.7	121	-173.5	-73.5	-36.7	0	0	0	111.6	L862 I941	L862-N939 WeakPolarHBondContact CD1-O 3.23Å; N939-I941 PolarHBondContact O-N 3.09Å
940	P	34.7	Very low	35.8	Very low	112 Å²	112	121.4 Å²	121.4	73%	0.727	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-71.7	122.6	174.7	28.9	-32.6	0	0	0	109.9	I938	I938-P940 WeakPolarHBondContact O-CD 3.23Å
941	I	34.1	Very low	36.2	Very low	93 Å²	93	123.3 Å²	123.3	48%	0.477	69%	0.69	S	S	.	*	P	Polyproline II helix	trans	-71.7	132	175.4	-58.5	157.3	0	0	0	109	R858 L862 N939	R858-I941 HydrophobicContact CG-CD1 3.73Å; L862-I941 HydrophobicContact CD1-CD1 4Å; L862-I941 HydrophobicContact CD1-CG1 4.25Å; N939-I941 PolarHBondContact O-N 3.09Å
942	L	32.7	Very low	36.5	Very low	239 Å²	239	125.2 Å²	125.2	100%	1.251	68%	0.675	S	S	*	*			trans	-88.4	0	169.6	-79.6	167.8	0	0	0	111.6

Retrieved 942 of 942 residues in 706.4 ms (Link to these results)

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