A0A087YG80_POEFO Loading...

Rho guanine nucleotide exchange factor 10 like

AlphaFold DB , UniProt , Accession A0A087YG80, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,274 aa.

						>A0A087YG80_POEFO|A0A087YG80
MSSTISHQPPKDDDEEDNEEQGEEFMFDDSTDEEKAQEDISSERVTPVCVPKPDNNEASGAVAADGTQLFKPPPPAGPESIVASSPTTDVPAAESPNEVSAAPAAAEPGASDRCLGEELPVVPLSDSGDRSKETVQGSSDSRDISEEAGAPEASLEVIYDDVPSEEPLSPDEDMIYEDVQRESGPLEANNGWSSSEFESYDEQSDNDAKLPARSKLSPEVHRLRERCARTKRELAMRLSGKHNYDIKVQQLMRAARTGTKGGLERTKIAVMRKVSFLQRKDQMEEDDDAGYLDVAVSEVKHPPPQLSPMPEGLTNHQVVRRHILGSIIQSERSYLESLRRILQEYHRPLMEAEPRILSPRKIRPIFHRIREITQCHSMFQIALASRVAEWDSSEKIGDLFVASFSKSMVLDVYSDYVNNFTNAMALIKKACMSKPAFLEFLKRKQASSVDRITLYGLMVKPIQRFPQFILLLQDMLKNTPKGHVDRLPLQLALTELETLAEKLNEQKRVADQIAETQQLARSVSDRLLSKQLNSEQRSLVLCETLIETVYGERGQVLKSKERKVFLFDDVLICANINVKGPPDISSLVPVGPKYTMKWSAPLQHVQVVEVGQENSQSKDTLFQQSGTKRPSGACNSGKALLGPPRLYQELQELQHDLSVVEEVTLLVGTLQGIYQNLNTTVSQDWCLALQRLIRIKEEQIQCANKCRLRLQVPGRPDKSGRPVSFMVVFNTPNPLSKISWVNRLHLAKIALREENSRGWLYGEDEGKTIVPFSCPLLACHMPVFATKSPERKLETALHNPVNCALLGFSAASTSLPQGYLWVAGAGEGFQGHVEIFSLNRPTPRAVKSLQISSAIRCLEYVQAPSPTEEGDVGIHKAAAGAGTNICVGLDDGRILVYGSADTAAQCLLTLHNPEGCPVLCLKHSARFLFAGLRNGTVMVYGRNNNDDLWDPESPICVSLGAEPIRTLLVLDESVWASCGNSVTVIQISTLTTQKFEVHPDPMISVTHMACAGGGVWMAFSEGSSIRLFHTETLELLQEINISTRSMLQNTGQKNMRVTSLLICQGLLWVGTAQGLIITLPVPKLEGIPKITGKGMISLNAHCGPVDFLVATTSTLSPDLLKRDSVGDGPDSACGGEDRSDSSSQESLQPSSCYKAEEKGKGRGVLLQYRLRSTSGLPGRPLTAHGDEASDSSLESLEHSVEDGSIYELSDDPEMWVRGRPCEKDAVRRDRVISAAVISGGKGFRRLKEGIGVGSRTSGDSLENTLMVWQLPLTV
					

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Loading PAE data...

(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	29.2	Very low	33.3	Very low	246 Å²	246	138.3 Å²	138.3	100%	1.212	77%	0.767	S	S	*	*				0	165.2	0	-88.6	171.1	162	0	0	108.5
2	S	26.5	Very low	33.2	Very low	109 Å²	109	134.9 Å²	134.9	76%	0.762	75%	0.747	S	S	*	*			trans	-58.4	132.1	-171.3	-36.6	0	0	0	0	115.3
3	S	28.2	Very low	33.1	Very low	92 Å²	92	134.2 Å²	134.2	64%	0.643	74%	0.741	S	S	*	*				53.1	135.9	120.4	70.5	0	0	0	0	123
4	T	29.9	Very low	32.9	Very low	120 Å²	120	134.6 Å²	134.6	74%	0.736	74%	0.742	S	S	*	*			trans	64.1	146.4	133.2	54.6	0	0	0	0	121.2
5	I	31.6	Very low	32.9	Very low	145 Å²	145	137.5 Å²	137.5	74%	0.744	75%	0.748	S	S	*	*			cis	-169.4	155.1	-25.1	-124.8	174	0	0	0	107.7
6	S	28.1	Very low	32.7	Very low	94 Å²	94	139.6 Å²	139.6	66%	0.657	75%	0.751	S	S	*	*			trans	57.4	157.3	168.9	64	0	0	0	0	118.2
7	H	27.8	Very low	32.5	Very low	153 Å²	153	139.5 Å²	139.5	71%	0.708	75%	0.75	S	S	*	*			cis	-148.1	136.3	29.3	-104.5	-94.3	0	0	0	114.9
8	Q	26.8	Very low	32.3	Very low	169 Å²	169	139 Å²	139	79%	0.79	75%	0.747	S	S	*	*			trans	57	149.4	140.2	-76.6	173.6	-55.9	0	0	125.1
9	P	53	Low	32.3	Very low	115 Å²	115	140.7 Å²	140.7	75%	0.747	75%	0.75	S	S	*	*			trans	-102.7	-169.8	178.3	43.9	-34.1	0	0	0	112.5
10	P	53.2	Low	32.2	Very low	109 Å²	109	143.5 Å²	143.5	71%	0.708	76%	0.759	S	S	*	*				-158.2	161.3	93	41.2	-22.2	0	0	0	119.3
11	K	32.1	Very low	32.2	Very low	169 Å²	169	146.1 Å²	146.1	74%	0.735	77%	0.767	S	S	*	*			trans	65.3	153.9	144.2	-74	-173.4	142.6	-73.4	0	120
12	D	32.2	Very low	32.4	Very low	98 Å²	98	138.2 Å²	138.2	52%	0.524	75%	0.748	S	S	.	*			cis	-154.7	151.2	0.9	-104.4	-17.4	0	0	0	113.8
13	D	31.6	Very low	32.6	Very low	125 Å²	125	141.1 Å²	141.1	67%	0.668	75%	0.75	S	S	*	*			trans	67.7	139.3	139.1	-53.2	-20.6	0	0	0	127.7
14	D	30.9	Very low	32.7	Very low	141 Å²	141	146.1 Å²	146.1	75%	0.754	76%	0.763	S	S	*	*			trans	92.9	112.9	144.3	-61.6	-18.7	0	0	0	128
15	E	31.6	Very low	32.6	Very low	177 Å²	177	148.5 Å²	148.5	83%	0.827	76%	0.763	S	S	*	*				94.3	136.3	129.8	-74.1	-175.2	161.1	0	0	127
16	E	29.8	Very low	32.4	Very low	171 Å²	171	149.9 Å²	149.9	80%	0.799	77%	0.768	S	S	*	*			trans	63.5	110.6	162.1	-65.3	-170.5	159.9	0	0	124.4
17	D	29.4	Very low	32.5	Very low	139 Å²	139	154.6 Å²	154.6	74%	0.743	78%	0.777	S	S	*	*				41.4	140.6	123.7	-66.5	18.3	0	0	0	122
18	N	29.8	Very low	32.5	Very low	130 Å²	130	155 Å²	155	70%	0.695	79%	0.785	S	S	*	*			cis	-161.4	162.9	18.2	-134.5	-31.4	0	0	0	115.5
19	E	32	Very low	32.6	Very low	172 Å²	172	154 Å²	154	80%	0.804	79%	0.785	S	S	*	*			trans	66.8	137.5	157	-80.2	178	169.6	0	0	124.9
20	E	30.9	Very low	31.5	Very low	196 Å²	196	154.2 Å²	154.2	92%	0.916	79%	0.789	S	S	*	*			trans	60.9	123.4	167.2	-58.9	-161.2	139.2	0	0	121.9
21	Q	30.5	Very low	30.4	Very low	199 Å²	199	154.4 Å²	154.4	93%	0.93	79%	0.789	S	S	*	*			trans	-100.4	155.2	177.8	-64.6	175.1	-10.6	0	0	110.8
22	G	33.9	Very low	30.2	Very low	79 Å²	79	153.3 Å²	153.3	81%	0.814	79%	0.791	S	S	*	*			trans	-99	153.7	178.7	0	0	0	0	0	114.1
23	E	30.6	Very low	30.3	Very low	171 Å²	171	157 Å²	157	80%	0.799	81%	0.805	S	S	*	*			trans	-121.3	135.7	168.2	-66.7	-170.7	140	0	0	110.6	F25	E23-F25 HydrophobicContact CB-CD2 4.34Å; E23-F25 HydrophobicContact CB-CE2 4.14Å
24	E	31.2	Very low	30.3	Very low	197 Å²	197	159.2 Å²	159.2	92%	0.921	81%	0.811	S	S	*	*			trans	-111.4	107.4	174.2	-173	168.7	-147.9	0	0	108.8
25	F	27.9	Very low	30.1	Very low	170 Å²	170	161.8 Å²	161.8	75%	0.746	82%	0.816	S	S	*	*			trans	-77.1	126.7	-169	-93.9	-106.6	0	0	0	113.6	E23	E23-F25 HydrophobicContact CB-CD2 4.34Å; E23-F25 HydrophobicContact CB-CE2 4.14Å
26	M	27.8	Very low	30	Very low	173 Å²	173	156.8 Å²	156.8	85%	0.852	81%	0.805	S	S	*	*			trans	-115.9	146.1	163.5	-88.4	-76.9	-69	0	0	109.6
27	F	28.9	Very low	30	Very low	193 Å²	193	156 Å²	156	85%	0.846	80%	0.801	S	S	*	*			trans	-92.3	143.3	176.4	-84.2	-109.2	0	0	0	110.9
28	D	28.6	Very low	30.1	Very low	162 Å²	162	156.6 Å²	156.6	87%	0.866	80%	0.799	S	S	*	*			trans	-152.7	167.8	151.6	-138.7	-27.7	0	0	0	111.1
29	D	29.8	Very low	29.8	Very low	149 Å²	149	156.4 Å²	156.4	80%	0.797	80%	0.798	S	S	*	*			trans	-77.2	151.4	-173	-87.6	-41.9	0	0	0	115
30	S	28.5	Very low	29.7	Very low	118 Å²	118	154.7 Å²	154.7	83%	0.825	79%	0.793	S	S	*	*				164	160.5	126.7	46.7	0	0	0	0	114.5
31	T	30.7	Very low	29.5	Very low	114 Å²	114	149.9 Å²	149.9	70%	0.699	78%	0.781	S	S	*	*			trans	-81.6	164.6	163.7	57.3	0	0	0	0	109.5
32	D	27.6	Very low	29.6	Very low	145 Å²	145	145.4 Å²	145.4	78%	0.775	77%	0.772	S	S	*	*			cis	-151.3	-158.7	37	-92.4	-67.4	0	0	0	112.7
33	E	33.6	Very low	29.3	Very low	176 Å²	176	148.4 Å²	148.4	82%	0.822	77%	0.765	S	S	*	*			trans	-58.5	177	178.4	-51.5	-174.6	127.3	0	0	113.8
34	E	33.3	Very low	29.3	Very low	171 Å²	171	149.7 Å²	149.7	80%	0.799	76%	0.762	S	S	*	*			cis	-175.3	167.4	37.4	-166	-160.5	-138.5	0	0	109.7
35	K	26	Very low	29	Very low	196 Å²	196	146.4 Å²	146.4	85%	0.852	76%	0.755	S	S	*	*			trans	-167.5	132.1	144.1	-119	166.7	-174	169.3	0	118.7
36	A	30.3	Very low	29.2	Very low	72 Å²	72	144.1 Å²	144.1	60%	0.595	76%	0.756	S	S	*	*			trans	73	140.1	143.5	0	0	0	0	0	119.8
37	Q	28	Very low	30.4	Very low	153 Å²	153	141.2 Å²	141.2	72%	0.715	75%	0.75	S	S	*	*			cis	-159.7	156.7	-3.2	-126.6	163.8	-88.3	0	0	112.7
38	E	31.8	Very low	30.2	Very low	153 Å²	153	138.4 Å²	138.4	72%	0.715	75%	0.748	S	S	*	*			trans	69.7	143.6	157.1	-74.1	151.7	-155.2	0	0	118.8
39	D	24.6	Very low	30.4	Very low	126 Å²	126	135.8 Å²	135.8	67%	0.674	74%	0.741	S	S	*	*			cis	-156.8	154	17.4	-137.8	-3.3	0	0	0	117.3
40	I	29.8	Very low	30.8	Very low	135 Å²	135	134.8 Å²	134.8	69%	0.692	74%	0.74	S	S	*	*			trans	70.2	115.1	147	-75.3	161.1	0	0	0	126.2
41	S	27	Very low	31.6	Very low	96 Å²	96	134.7 Å²	134.7	67%	0.671	74%	0.737	S	S	*	*			trans	63.9	101.7	137.6	80.4	0	0	0	0	127.7
42	S	31.5	Very low	31.4	Very low	105 Å²	105	139.3 Å²	139.3	73%	0.734	75%	0.747	S	S	*	*				22.9	134.2	117.4	65.4	0	0	0	0	125.4
43	E	27.5	Very low	33.1	Very low	142 Å²	142	137.3 Å²	137.3	66%	0.664	74%	0.742	S	S	*	*				171	141.1	98.9	-91.9	-135.4	133.8	0	0	117.1
44	R	30.1	Very low	32.8	Very low	197 Å²	197	136.2 Å²	136.2	74%	0.743	74%	0.742	S	S	*	*			trans	60.2	123.5	140.8	-70.2	-169.9	-155.1	-110	-16.1	127
45	V	26.9	Very low	32.6	Very low	128 Å²	128	134.6 Å²	134.6	78%	0.776	74%	0.739	S	S	*	*				94.7	144.9	122.2	169.7	0	0	0	0	121.7
46	T	31.6	Very low	32.9	Very low	123 Å²	123	132.5 Å²	132.5	76%	0.755	74%	0.737	S	S	*	*			trans	-102.4	-159.3	-173.7	57.2	0	0	0	0	110.6
47	P	52	Low	32.8	Very low	112 Å²	112	137.5 Å²	137.5	73%	0.727	75%	0.748	S	S	*	*			cis	-151.9	-162.3	22.2	39	-11.7	0	0	0	119.1
48	V	25.6	Very low	32.7	Very low	134 Å²	134	134.3 Å²	134.3	81%	0.812	75%	0.748	S	S	*	*			trans	121.2	145.8	151.6	-174	0	0	0	0	116.1
49	C	33.3	Very low	32.4	Very low	106 Å²	106	133 Å²	133	72%	0.716	76%	0.755	S	S	*	*			trans	-138.7	149.5	-154	-54.7	0	0	0	0	115.4
50	V	37.2	Very low	32.4	Very low	128 Å²	128	131 Å²	131	78%	0.776	76%	0.764	S	S	*	*				54	128.9	124	179	0	0	0	0	118.7
51	P	44.4	Very low	32.3	Very low	117 Å²	117	129 Å²	129	76%	0.76	77%	0.768	S	S	*	*				-158.6	139.9	73.2	39.8	-17	0	0	0	122.5
52	K	27.5	Very low	32.3	Very low	211 Å²	211	131.4 Å²	131.4	92%	0.917	78%	0.778	S	S	*	*			trans	61.9	166.3	136.7	-83.4	-158.1	168	-172.5	0	123.1
53	P	63	Low	32.1	Very low	103 Å²	103	130.4 Å²	130.4	67%	0.669	78%	0.777	S	S	*	*			trans	-121.1	-173.7	-152.2	46.3	-36.1	0	0	0	115.6
54	D	26.6	Very low	32.2	Very low	152 Å²	152	127.8 Å²	127.8	81%	0.813	78%	0.78	S	S	*	*			trans	-167.8	177.2	134.7	-108.8	-26.7	0	0	0	114.6
55	N	30.7	Very low	32.1	Very low	138 Å²	138	126.3 Å²	126.3	74%	0.738	79%	0.786	S	S	*	*			trans	-86	164	-172.8	-43.2	-76.2	0	0	0	114.7
56	N	30.7	Very low	32.1	Very low	152 Å²	152	123.2 Å²	123.2	81%	0.813	78%	0.78	S	S	*	*				177.3	-178.5	103.7	-114	18.3	0	0	0	115.7
57	E	28.6	Very low	32.1	Very low	176 Å²	176	123.9 Å²	123.9	82%	0.822	78%	0.784	S	S	*	*			trans	-89.7	-175.8	-165.8	-48.9	169.6	108.9	0	0	116.4
58	A	27.1	Very low	31	Very low	87 Å²	87	127.1 Å²	127.1	72%	0.719	79%	0.789	S	S	*	*			trans	102.1	107.1	141.5	0	0	0	0	0	120.7
59	S	25.8	Very low	31.3	Very low	124 Å²	124	127.2 Å²	127.2	87%	0.867	79%	0.785	S	S	*	*			trans	29	127.6	133.2	63.1	0	0	0	0	121.8
60	G	24.5	Very low	31	Very low	84 Å²	84	131.7 Å²	131.7	87%	0.866	79%	0.793	S	S	*	*			trans	-169	129	158.1	0	0	0	0	0	112.4
61	A	26.6	Very low	30.8	Very low	93 Å²	93	135 Å²	135	77%	0.769	80%	0.796	S	S	*	*			trans	-130.8	-179.5	177.3	0	0	0	0	0	110.3
62	V	26.9	Very low	31	Very low	147 Å²	147	134.8 Å²	134.8	89%	0.891	80%	0.795	S	S	*	*			trans	76.5	141	172.2	-173.8	0	0	0	0	114.7
63	A	27.1	Very low	31.6	Very low	84 Å²	84	130.5 Å²	130.5	69%	0.694	79%	0.789	S	S	*	*			cis	-170.9	174.8	-29.5	0	0	0	0	0	110.4
64	A	29.2	Very low	31	Very low	88 Å²	88	131.3 Å²	131.3	73%	0.727	79%	0.794	S	S	*	*			trans	80.4	141.2	148	0	0	0	0	0	121.7
65	D	28	Very low	32.3	Very low	166 Å²	166	130.2 Å²	130.2	89%	0.888	80%	0.795	S	S	*	*			trans	49.5	140.6	156.6	-58.4	-11.6	0	0	0	122.3
66	G	28.3	Very low	32.4	Very low	62 Å²	62	128.7 Å²	128.7	64%	0.639	80%	0.802	S	S	*	*			cis	167.4	154.7	-8.7	0	0	0	0	0	115.4
67	T	30.8	Very low	32.4	Very low	137 Å²	137	124.6 Å²	124.6	84%	0.84	80%	0.795	S	S	*	*			trans	60.5	111.7	158.7	-12.8	0	0	0	0	120.3
68	Q	29	Very low	33.9	Very low	180 Å²	180	121.6 Å²	121.6	84%	0.841	79%	0.791	S	S	*	*				171.9	175.3	108.2	-89.8	-167.8	21.3	0	0	113.7
69	L	32.3	Very low	34.3	Very low	137 Å²	137	124.8 Å²	124.8	72%	0.717	79%	0.791	S	S	*	*			trans	-81.1	150	-167.1	-70.6	62.4	0	0	0	113.7
70	F	27.5	Very low	34.5	Very low	200 Å²	200	124.6 Å²	124.6	88%	0.877	79%	0.79	S	S	*	*				-179.5	170.9	98.8	-108.9	-83.3	0	0	0	113.5
71	K	32	Very low	35	Very low	197 Å²	197	127 Å²	127	86%	0.857	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-93	167	177.2	-108.9	-172	172.6	-179.3	0	112.2
72	P	48.3	Very low	35	Very low	113 Å²	113	129.3 Å²	129.3	73%	0.734	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-90.1	167.5	-152.4	35.9	-40.1	0	0	0	116.8
73	P	39.9	Very low	35.7	Very low	121 Å²	121	126.7 Å²	126.7	79%	0.786	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-90.3	171.1	169.9	1.7	19.8	0	0	0	114.4
74	P	50.7	Low	35.9	Very low	120 Å²	120	128.7 Å²	128.7	78%	0.779	79%	0.788	S	S	*	*			trans	-112.1	-178.1	-168.9	43.5	-34.1	0	0	0	114.3
75	P	55.2	Low	36.3	Very low	128 Å²	128	129.9 Å²	129.9	83%	0.831	79%	0.792	S	S	*	*			trans	-87.3	164.1	-179.9	34.7	-36.8	0	0	0	115.7
76	A	32	Very low	37.9	Very low	106 Å²	106	126.9 Å²	126.9	88%	0.876	78%	0.781	S	S	*	*			trans	-145.8	171.9	167.9	0	0	0	0	0	108.2
77	G	31.4	Very low	38.1	Very low	66 Å²	66	129.6 Å²	129.6	68%	0.68	79%	0.786	S	S	*	*			cis	-171.4	-177.3	6.4	0	0	0	0	0	111
78	P	59.1	Low	38.3	Very low	114 Å²	114	128.6 Å²	128.6	74%	0.74	78%	0.779	S	S	*	*			trans	-134.2	-168.1	-144.5	44.5	-29.6	0	0	0	118
79	E	35.4	Very low	38.5	Very low	154 Å²	154	126.6 Å²	126.6	72%	0.72	77%	0.774	S	S	*	*			trans	91.3	137.5	142.4	-88.9	171.4	-133.4	0	0	124.3
80	S	29.6	Very low	38.6	Very low	120 Å²	120	126.4 Å²	126.4	84%	0.839	78%	0.778	S	S	*	*				-167.7	177.4	123.8	46.2	0	0	0	0	111.4
81	I	34.6	Very low	40	Very low	133 Å²	133	122.3 Å²	122.3	68%	0.682	77%	0.772	S	S	*	*				-143.8	159.2	-121.5	-84.7	155.9	0	0	0	113.4
82	V	27.8	Very low	40.1	Very low	143 Å²	143	117.5 Å²	117.5	87%	0.867	77%	0.769	S	S	*	*			trans	178.7	150.5	136	147.1	0	0	0	0	110.9
83	A	41.9	Very low	39.5	Very low	92 Å²	92	116.4 Å²	116.4	76%	0.76	77%	0.77	S	S	*	*			trans	-151.4	168.1	-174.9	0	0	0	0	0	114.4
84	S	31.9	Very low	38.9	Very low	125 Å²	125	119.5 Å²	119.5	87%	0.874	77%	0.774	S	S	*	*			trans	-174.7	166.3	155.7	33.4	0	0	0	0	113.9
85	S	35.7	Very low	38	Very low	114 Å²	114	118.4 Å²	118.4	80%	0.797	77%	0.769	S	S	*	*			trans	-158.6	-169.1	-174	63.4	0	0	0	0	109.3
86	P	63.5	Low	37.9	Very low	103 Å²	103	117 Å²	117	67%	0.669	76%	0.76	S	S	*	*			cis	-143.7	-161.6	0.5	40.5	-17.5	0	0	0	117.1
87	T	32.5	Very low	37.9	Very low	119 Å²	119	118.2 Å²	118.2	73%	0.73	75%	0.752	S	S	*	*			trans	100.3	128.4	143.6	32.4	0	0	0	0	126.2
88	T	34.1	Very low	38	Very low	115 Å²	115	122.4 Å²	122.4	71%	0.706	75%	0.753	S	S	*	*			trans	85.4	113.4	143.7	41.6	0	0	0	0	125.8
89	D	32.9	Very low	36.6	Very low	139 Å²	139	123.1 Å²	123.1	74%	0.743	76%	0.755	S	S	*	*				96.9	106.7	122	-73.3	10.9	0	0	0	127.3
90	V	34.2	Very low	36.3	Very low	132 Å²	132	120.9 Å²	120.9	80%	0.8	76%	0.757	S	S	*	*			trans	53.7	163.6	142.4	-87.1	0	0	0	0	124
91	P	58.2	Low	36.2	Very low	115 Å²	115	120 Å²	120	75%	0.747	76%	0.756	S	S	*	*			cis	-141.1	168.4	-24.6	36.8	-17.4	0	0	0	118.6
92	A	33.7	Very low	36	Very low	96 Å²	96	118 Å²	118	79%	0.793	76%	0.759	S	S	*	*			trans	77.7	128.1	136.7	0	0	0	0	0	127.2
93	A	34.9	Very low	37.1	Very low	90 Å²	90	117 Å²	117	74%	0.744	76%	0.756	S	S	*	*				104.2	120.5	127.7	0	0	0	0	0	124
94	E	28.1	Very low	36.4	Very low	186 Å²	186	117 Å²	117	87%	0.869	76%	0.756	S	S	*	*			trans	57.2	152.1	147.3	-66	179.7	-175.1	0	0	123
95	S	31.6	Very low	36.2	Very low	97 Å²	97	116 Å²	116	68%	0.678	76%	0.756	S	S	*	*			cis	172	-178	-37.6	63	0	0	0	0	108.7
96	P	53.4	Low	35.8	Very low	99 Å²	99	115.6 Å²	115.6	64%	0.643	76%	0.759	S	S	*	*			cis	-134.3	159.6	-27.6	25.2	-2.4	0	0	0	116.7
97	N	31.4	Very low	34.2	Very low	131 Å²	131	119.5 Å²	119.5	70%	0.701	77%	0.769	S	S	*	*			trans	60.7	156	131.9	-61	28	0	0	0	123.7
98	E	32.7	Very low	34.7	Very low	154 Å²	154	119.5 Å²	119.5	72%	0.72	77%	0.771	S	S	*	*			cis	-169.1	149	-13.4	-108.4	176.7	140.8	0	0	115.5
99	V	29.7	Very low	34.3	Very low	129 Å²	129	117.5 Å²	117.5	78%	0.782	77%	0.772	S	S	*	*			trans	69.1	-176.1	134.2	177.2	0	0	0	0	120.9
100	S	30.1	Very low	34	Very low	107 Å²	107	115.5 Å²	115.5	75%	0.748	78%	0.775	S	S	*	*			trans	-147.5	-179	-135.9	63.9	0	0	0	0	116.5
101	A	28.3	Very low	33.7	Very low	100 Å²	100	115 Å²	115	83%	0.826	78%	0.777	S	S	*	*			trans	107.4	166.7	153.7	0	0	0	0	0	120
102	A	30	Very low	32.3	Very low	91 Å²	91	116.1 Å²	116.1	75%	0.752	78%	0.777	S	S	*	*			trans	-122.3	176	176.2	0	0	0	0	0	108.2
103	P	50.1	Low	32	Very low	122 Å²	122	122.2 Å²	122.2	79%	0.792	78%	0.78	S	S	*	*			cis	-146.1	-169.7	19.7	44.8	-24	0	0	0	117.5
104	A	26.5	Very low	31.6	Very low	93 Å²	93	122.9 Å²	122.9	77%	0.769	78%	0.778	S	S	*	*			trans	72.1	116.3	145.3	0	0	0	0	0	124
105	A	27.8	Very low	31.6	Very low	104 Å²	104	121.4 Å²	121.4	86%	0.86	78%	0.775	S	S	*	*			trans	79.6	148.2	130.9	0	0	0	0	0	124
106	A	27.4	Very low	31.3	Very low	105 Å²	105	120 Å²	120	87%	0.868	78%	0.776	S	S	*	*			trans	85.4	150.8	164.1	0	0	0	0	0	120.7
107	E	30	Very low	30.1	Very low	186 Å²	186	123.1 Å²	123.1	87%	0.869	78%	0.782	S	S	*	*			trans	-97.6	-165.9	-177	-37.5	-177.5	143.4	0	0	111.5
108	P	43.8	Very low	30	Very low	119 Å²	119	124.2 Å²	124.2	77%	0.773	78%	0.783	S	S	*	*			cis	-136.4	-174.5	-12.7	40	-21.9	0	0	0	114.8
109	G	25.1	Very low	29.7	Very low	72 Å²	72	123.6 Å²	123.6	74%	0.742	78%	0.784	S	S	*	*			trans	98.3	92.1	135.8	0	0	0	0	0	121.9
110	A	27.6	Very low	31	Very low	97 Å²	97	122.4 Å²	122.4	80%	0.802	78%	0.779	S	S	*	*			trans	34.8	149.6	136	0	0	0	0	0	125.5
111	S	28.1	Very low	30.8	Very low	121 Å²	121	123.5 Å²	123.5	85%	0.846	78%	0.781	S	S	*	*			trans	75.4	143.8	154.6	71.3	0	0	0	0	119
112	D	28.8	Very low	30.9	Very low	140 Å²	140	125 Å²	125	75%	0.749	78%	0.78	S	S	*	*			cis	-172.8	176.4	-9.4	168.6	46.6	0	0	0	109
113	R	27.1	Very low	32.1	Very low	224 Å²	224	125.8 Å²	125.8	85%	0.845	78%	0.777	S	S	*	*			trans	102.9	143.5	162.4	-62.8	-176.7	174.6	-164.3	-2	119.1
114	C	25.9	Very low	30.9	Very low	104 Å²	104	128 Å²	128	70%	0.703	78%	0.781	S	S	*	*			cis	-171	-179.4	-24.7	-152.2	0	0	0	0	112.1
115	L	28	Very low	31.2	Very low	154 Å²	154	128.6 Å²	128.6	81%	0.806	78%	0.78	S	S	*	*			trans	76.6	129.2	170.4	-49.3	177.8	0	0	0	116.2
116	G	25.5	Very low	31.1	Very low	69 Å²	69	131.1 Å²	131.1	71%	0.711	78%	0.779	S	S	*	*			cis	-157.4	-151.5	2.5	0	0	0	0	0	110.2
117	E	28	Very low	31.2	Very low	163 Å²	163	131.4 Å²	131.4	76%	0.762	77%	0.774	S	S	*	*			cis	169.8	140.6	-21.2	-92.3	149.5	-120.4	0	0	105.5
118	E	29.5	Very low	31.1	Very low	155 Å²	155	125.9 Å²	125.9	72%	0.724	77%	0.768	S	S	*	*			cis	-149.6	154.5	-8.3	-111.6	-143.1	160.6	0	0	107.3
119	L	27.5	Very low	30.3	Very low	141 Å²	141	127 Å²	127	74%	0.738	77%	0.767	S	S	*	*				65.5	160.2	77.6	-65.1	-177.9	0	0	0	116.1
120	P	55	Low	30.4	Very low	104 Å²	104	134.8 Å²	134.8	68%	0.675	77%	0.774	S	S	*	*			cis	-144.4	-174	19	34.1	-8.5	0	0	0	119.7
121	V	26.7	Very low	30.5	Very low	129 Å²	129	135 Å²	135	78%	0.782	77%	0.77	S	S	*	*			trans	100.6	134	155.3	-164.4	0	0	0	0	119.9
122	V	31.6	Very low	30.5	Very low	133 Å²	133	137.6 Å²	137.6	81%	0.806	77%	0.766	S	S	*	*			trans	-155.8	-174.6	-176	-112.9	0	0	0	0	106.5
123	P	53.2	Low	30.4	Very low	106 Å²	106	137.6 Å²	137.6	69%	0.688	76%	0.761	S	S	*	*			cis	-136	-174.3	10.4	44.6	-27	0	0	0	115.5
124	L	26.1	Very low	30.3	Very low	169 Å²	169	133 Å²	133	89%	0.885	76%	0.758	S	S	*	*				-174.1	160.5	120.1	-102.3	167.9	0	0	0	113.3
125	S	31.8	Very low	30.4	Very low	106 Å²	106	133.3 Å²	133.3	74%	0.741	76%	0.757	S	S	*	*			trans	-138.4	144.5	-178.4	57.4	0	0	0	0	110.7
126	D	26	Very low	30.2	Very low	157 Å²	157	135.1 Å²	135.1	84%	0.84	76%	0.761	S	S	*	*			trans	-146.8	-173.9	160.6	-148.2	-23.5	0	0	0	110.9
127	S	30.8	Very low	30.2	Very low	110 Å²	110	135.3 Å²	135.3	77%	0.769	76%	0.763	S	S	*	*			trans	-136.7	-172.7	-138.8	62.5	0	0	0	0	114.2
128	G	26.5	Very low	30.2	Very low	71 Å²	71	132.7 Å²	132.7	73%	0.732	76%	0.763	S	S	*	*			trans	118	81.1	144.9	0	0	0	0	0	117.8
129	D	28.5	Very low	30.1	Very low	142 Å²	142	129.9 Å²	129.9	76%	0.759	76%	0.76	S	S	*	*			trans	-50.3	133.8	157.8	161.8	53.6	0	0	0	113
130	R	27.5	Very low	30.1	Very low	235 Å²	235	130.1 Å²	130.1	89%	0.887	76%	0.762	S	S	*	*				-174.1	161.8	128.5	-105.8	171.8	-179.8	-161.4	-1.8	114.9
131	S	28.4	Very low	28.8	Very low	103 Å²	103	130 Å²	130	72%	0.72	76%	0.764	S	S	*	*			trans	-130.9	140.5	179.3	52	0	0	0	0	112.4
132	K	29.3	Very low	28.8	Very low	175 Å²	175	134.4 Å²	134.4	76%	0.761	77%	0.766	S	S	*	*			trans	176.7	151.8	136.4	-105.5	176.8	163.3	-131.3	0	115.7
133	E	25.2	Very low	28.6	Very low	140 Å²	140	134.8 Å²	134.8	65%	0.654	76%	0.764	S	S	*	*			trans	75.6	90.3	145	-75.1	162.2	-153.3	0	0	123.3
134	T	25.4	Very low	27.3	Very low	126 Å²	126	137 Å²	137	77%	0.773	77%	0.768	S	S	*	*				47.8	129.8	114.2	-22	0	0	0	0	122.1
135	V	27.2	Very low	27.2	Very low	111 Å²	111	133.2 Å²	133.2	67%	0.673	76%	0.756	S	S	*	*				171.2	125.6	108.2	156.2	0	0	0	0	113.3
136	Q	25.3	Very low	26.9	Very low	192 Å²	192	136.6 Å²	136.6	90%	0.897	76%	0.76	S	S	*	*			trans	42.1	149.2	154.8	-64.2	170.2	-74.9	0	0	121.5
137	G	25.7	Very low	27	Very low	73 Å²	73	137.8 Å²	137.8	75%	0.753	76%	0.761	S	S	*	*			cis	163.6	168.9	-0.2	0	0	0	0	0	109.9
138	S	27.3	Very low	26.9	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	76%	0.763	S	S	*	*			cis	-169.8	148.5	-6.4	50.3	0	0	0	0	112.4
139	S	27.9	Very low	26.7	Very low	96 Å²	96	137.8 Å²	137.8	67%	0.671	77%	0.769	S	S	*	*			trans	57.4	126.6	143.4	61.8	0	0	0	0	124.2
140	D	27	Very low	26.9	Very low	146 Å²	146	135.7 Å²	135.7	78%	0.781	77%	0.771	S	S	*	*				78.8	101.7	126.1	-59.9	2	0	0	0	124.9
141	S	28.3	Very low	27.9	Very low	101 Å²	101	129.9 Å²	129.9	71%	0.706	76%	0.763	S	S	*	*				84.7	156	119.7	83.1	0	0	0	0	122.8
142	R	26.6	Very low	28.3	Very low	223 Å²	223	133.3 Å²	133.3	84%	0.842	77%	0.768	S	S	*	*			trans	76.6	128.1	158	-68.2	176.6	-179.2	167.5	2.2	121.4
143	D	27.5	Very low	28.6	Very low	140 Å²	140	128.6 Å²	128.6	75%	0.749	76%	0.762	S	S	*	*				8.7	141.9	126.8	-64.7	-54.8	0	0	0	121.9
144	I	24.4	Very low	29.3	Very low	152 Å²	152	126.8 Å²	126.8	78%	0.779	76%	0.764	S	S	*	*			trans	88.5	120.3	140.3	-73.2	162.8	0	0	0	120.7
145	S	25.9	Very low	29.5	Very low	91 Å²	91	127.5 Å²	127.5	64%	0.636	76%	0.763	S	S	*	*			trans	68.4	136	147.1	67.3	0	0	0	0	125.3
146	E	25	Very low	30	Very low	177 Å²	177	130.3 Å²	130.3	83%	0.827	77%	0.769	S	S	*	*			trans	84.7	114.9	133.3	-77.2	170.5	-176.6	0	0	124.3
147	E	27.5	Very low	30.6	Very low	181 Å²	181	126.3 Å²	126.3	85%	0.846	76%	0.757	S	S	*	*				78.8	133.8	129.6	-74.8	-147.4	136.7	0	0	126.8
148	A	28.2	Very low	31.4	Very low	100 Å²	100	128.6 Å²	128.6	83%	0.826	75%	0.751	S	S	*	*			trans	78.3	131.3	139.3	0	0	0	0	0	122.9
149	G	23.5	Very low	31.9	Very low	82 Å²	82	132.2 Å²	132.2	85%	0.845	75%	0.749	S	S	*	*			trans	144.8	91.4	159.5	0	0	0	0	0	116.4
150	A	31.6	Very low	32.4	Very low	97 Å²	97	133.9 Å²	133.9	80%	0.802	75%	0.751	S	S	*	*			trans	-106.9	-155.8	166.5	0	0	0	0	0	109.5
151	P	48.6	Very low	33.1	Very low	113 Å²	113	133.4 Å²	133.4	73%	0.734	75%	0.748	S	S	*	*			cis	-107.6	-156.1	1.8	43.2	-29.3	0	0	0	111.4
152	E	37.4	Very low	33.4	Very low	175 Å²	175	134.3 Å²	134.3	82%	0.818	75%	0.749	S	S	*	*			cis	-155	-170.1	-0	-139.9	177.2	-72.1	0	0	105.8
153	A	35.1	Very low	34.5	Very low	76 Å²	76	128.8 Å²	128.8	63%	0.628	74%	0.742	S	S	*	*			cis	-164.9	167	-0.5	0	0	0	0	0	106.4
154	S	39.4	Very low	34.5	Very low	102 Å²	102	126.9 Å²	126.9	71%	0.713	74%	0.74	S	S	*	*			cis	-168.4	-159.3	-18.6	59.4	0	0	0	0	107.5
155	L	29.7	Very low	34.6	Very low	141 Å²	141	128.5 Å²	128.5	74%	0.738	74%	0.744	S	S	*	*			trans	63.9	85.2	179.9	-63.5	174.5	0	0	0	115.7
156	E	39	Very low	34.7	Very low	171 Å²	171	132.4 Å²	132.4	80%	0.799	75%	0.752	S	S	*	*				85.2	138.8	70.8	-73.4	-174.2	169	0	0	114
157	V	37.4	Very low	35.7	Very low	107 Å²	107	128.9 Å²	128.9	65%	0.648	75%	0.745	S	S	*	*			cis	-154	122.4	14.5	101.6	0	0	0	0	112.6
158	I	43	Very low	35.4	Very low	122 Å²	122	127.9 Å²	127.9	63%	0.626	74%	0.744	S	S	*	*			trans	35.5	157.3	144.2	27.2	169.4	0	0	0	123.2
159	Y	38	Very low	35.8	Very low	184 Å²	184	127.9 Å²	127.9	72%	0.722	74%	0.738	S	S	*	*			cis	-152.2	150.4	25.3	-106.9	-52.4	0	0	0	115.1
160	D	36.7	Very low	36.8	Very low	130 Å²	130	128.6 Å²	128.6	70%	0.695	73%	0.728	S	S	*	*			trans	45.5	148.4	141.8	-68.4	3.6	0	0	0	125.4
161	D	41.9	Very low	36.5	Very low	136 Å²	136	131 Å²	131	73%	0.727	73%	0.727	S	S	*	*			cis	-164.8	155.2	-29.2	-153.8	15.7	0	0	0	113.9
162	V	34.2	Very low	35.6	Very low	120 Å²	120	133.8 Å²	133.8	73%	0.727	73%	0.731	S	S	*	*			trans	60.3	148	152.2	154.6	0	0	0	0	123.7
163	P	50.4	Low	35.3	Very low	108 Å²	108	131.6 Å²	131.6	70%	0.701	72%	0.724	S	S	*	*			trans	-137.8	-163.7	-159.5	37.2	-12.6	0	0	0	116.9
164	S	28.6	Very low	35.1	Very low	100 Å²	100	134.4 Å²	134.4	70%	0.699	73%	0.726	S	S	*	*			trans	113.1	131.7	143.8	-53.6	0	0	0	0	121
165	E	26	Very low	34.7	Very low	185 Å²	185	135.6 Å²	135.6	86%	0.864	72%	0.723	S	S	*	*			trans	71.3	165.9	143.5	-60.8	-80.9	111.1	0	0	122.2
166	E	26.7	Very low	34.8	Very low	174 Å²	174	139.5 Å²	139.5	81%	0.813	73%	0.73	S	S	*	*			trans	-92.9	-162.7	-175.3	-38.6	-175.8	137.8	0	0	111.6
167	P	46.5	Very low	34.4	Very low	102 Å²	102	139.3 Å²	139.3	66%	0.662	73%	0.729	S	S	*	*			cis	-136.5	-158.8	-12.7	28.9	-3.1	0	0	0	113.4
168	L	22	Very low	34.1	Very low	161 Å²	161	141.2 Å²	141.2	84%	0.843	74%	0.735	S	S	*	*			trans	86.3	143.4	156	-64.4	167.4	0	0	0	121.4
169	S	35.3	Very low	33.7	Very low	100 Å²	100	140.3 Å²	140.3	70%	0.699	74%	0.735	S	S	*	*			trans	-76.1	176	164.5	54.4	0	0	0	0	111
170	P	44.2	Very low	33.3	Very low	97 Å²	97	140.9 Å²	140.9	63%	0.63	74%	0.744	S	S	*	*			cis	-157.8	-166.6	33.4	47.6	-24.9	0	0	0	119.3
171	D	26.9	Very low	32.9	Very low	147 Å²	147	145.5 Å²	145.5	79%	0.786	75%	0.752	S	S	*	*			trans	74.6	164.8	144.3	-63.2	-20.8	0	0	0	123.6
172	E	29.3	Very low	32.1	Very low	172 Å²	172	147.9 Å²	147.9	80%	0.804	76%	0.759	S	S	*	*			trans	-64.4	176.7	-172.9	-49.9	-179.4	121	0	0	111.1
173	D	31.2	Very low	31.7	Very low	128 Å²	128	147.3 Å²	147.3	68%	0.684	76%	0.76	S	S	*	*			cis	179.9	168.2	49.4	-149.2	-4	0	0	0	114.4
174	M	30.1	Very low	30.6	Very low	135 Å²	135	145.5 Å²	145.5	67%	0.665	76%	0.761	S	S	*	*			trans	59	116.1	147.7	-67	-116	-85.1	0	0	125.2
175	I	31.4	Very low	31.4	Very low	127 Å²	127	146.3 Å²	146.3	65%	0.651	76%	0.764	S	S	*	*				59	126.8	118.9	-61.6	-173.3	0	0	0	120.8
176	Y	31.5	Very low	31.6	Very low	224 Å²	224	144.1 Å²	144.1	88%	0.878	76%	0.758	S	S	*	*				-162.7	145.6	114.9	-115.6	-76.4	0	0	0	114.4
177	E	31.9	Very low	31.7	Very low	167 Å²	167	144.4 Å²	144.4	78%	0.78	76%	0.759	S	S	*	*			trans	-75.4	173.6	162.3	-60.9	-179.5	125	0	0	109
178	D	29.8	Very low	30.9	Very low	147 Å²	147	143.8 Å²	143.8	79%	0.786	76%	0.763	S	S	*	*			cis	-169.1	-169.4	39.4	-161.5	-2.4	0	0	0	112.2
179	V	36	Very low	31.1	Very low	102 Å²	102	142.7 Å²	142.7	62%	0.618	76%	0.758	S	S	*	*			trans	-99.7	141.9	-164.8	174.3	0	0	0	0	114.5
180	Q	28.2	Very low	30.8	Very low	196 Å²	196	145 Å²	145	92%	0.916	76%	0.762	S	S	*	*			trans	-156.7	172.9	142.8	-117.4	142.3	93.1	0	0	115
181	R	28.9	Very low	30	Very low	227 Å²	227	143.5 Å²	143.5	86%	0.857	76%	0.764	S	S	*	*			trans	-127.5	163.3	-164.1	-47.4	168.8	-177.4	149.1	-0.4	111
182	E	25.7	Very low	30.1	Very low	186 Å²	186	148.8 Å²	148.8	87%	0.869	77%	0.773	S	S	*	*				-162.8	158.8	122.2	-118.6	177	-172.2	0	0	116.2
183	S	25.3	Very low	30	Very low	109 Å²	109	145.4 Å²	145.4	76%	0.762	77%	0.769	S	S	*	*			trans	28.3	133.7	160.4	54.4	0	0	0	0	123.9
184	G	26.8	Very low	29.9	Very low	70 Å²	70	144.5 Å²	144.5	72%	0.722	77%	0.773	S	S	*	*			trans	-93.4	-135.7	159.7	0	0	0	0	0	112.3
185	P	46.2	Very low	29.9	Very low	116 Å²	116	142.3 Å²	142.3	75%	0.753	77%	0.77	S	S	*	*			cis	-138	176.7	1.1	40.6	-22.4	0	0	0	115.7
186	L	29.8	Very low	29.8	Very low	140 Å²	140	144 Å²	144	73%	0.733	78%	0.776	S	S	*	*				170.4	135.1	124	-91.8	163.1	0	0	0	113.9
187	E	28	Very low	29.6	Very low	179 Å²	179	142.2 Å²	142.2	84%	0.836	77%	0.773	S	S	*	*			trans	32.4	135.6	142.9	-71.1	175.3	-174.9	0	0	121.3
188	A	29.6	Very low	29.8	Very low	90 Å²	90	141.8 Å²	141.8	74%	0.744	77%	0.771	S	S	*	*			cis	-169.3	145.6	28	0	0	0	0	0	113.5
189	N	26.1	Very low	29.6	Very low	138 Å²	138	140.4 Å²	140.4	74%	0.738	77%	0.773	S	S	*	*			trans	47.2	126.3	148.4	-78.2	-15.9	0	0	0	123.6
190	N	30.9	Very low	29.5	Very low	147 Å²	147	145 Å²	145	79%	0.786	78%	0.78	S	S	*	*				43.6	128	123.6	-46.6	-22.5	0	0	0	119.5
191	G	25.4	Very low	29.6	Very low	66 Å²	66	143.7 Å²	143.7	68%	0.68	78%	0.779	S	S	*	*			cis	120.8	169.5	12.7	0	0	0	0	0	111.3
192	W	29.2	Very low	29.8	Very low	258 Å²	258	140.1 Å²	140.1	98%	0.977	77%	0.772	S	S	*	*			trans	68.3	157.6	178.9	-68.9	32	0	0	0	114.7
193	S	27.1	Very low	29.9	Very low	101 Å²	101	140.6 Å²	140.6	71%	0.706	78%	0.775	S	S	*	*			cis	-157.1	171.6	-28.4	-170	0	0	0	0	109.6
194	S	30.5	Very low	30.1	Very low	110 Å²	110	140.3 Å²	140.3	77%	0.769	77%	0.773	S	S	*	*			trans	-53.6	169.8	175.6	-42.7	0	0	0	0	117.2
195	S	29.3	Very low	30.2	Very low	88 Å²	88	143.6 Å²	143.6	62%	0.615	77%	0.774	S	S	*	*			trans	99.7	125.1	146.1	142.4	0	0	0	0	119.2
196	E	29.8	Very low	29.3	Very low	163 Å²	163	145.6 Å²	145.6	76%	0.762	78%	0.778	S	S	*	*			trans	50.5	137.8	134.1	-55.9	153.1	146.7	0	0	119.2
197	F	26.5	Very low	29.2	Very low	186 Å²	186	146.1 Å²	146.1	82%	0.816	78%	0.782	S	S	*	*				-153.3	173.6	50.2	-139.4	-92.7	0	0	0	113.7
198	E	35.8	Very low	29.5	Very low	158 Å²	158	141.7 Å²	141.7	74%	0.738	78%	0.776	S	S	*	*			trans	-74.9	148.4	169.2	-62	-177.5	123	0	0	112.5
199	S	27.5	Very low	29.5	Very low	118 Å²	118	146.7 Å²	146.7	83%	0.825	78%	0.781	S	S	*	*			trans	-149.1	141.6	152.2	51.9	0	0	0	0	110.5
200	Y	33.8	Very low	30	Very low	199 Å²	199	148.2 Å²	148.2	78%	0.78	79%	0.788	S	S	*	*			trans	-96.3	150.5	169.1	-81.3	-109.1	0	0	0	108.8
201	D	29.8	Very low	30.2	Very low	168 Å²	168	146.8 Å²	146.8	90%	0.898	79%	0.787	S	S	*	*				-173.3	160.2	109.9	-93.2	-24.1	0	0	0	112.7
202	E	33.3	Very low	30.3	Very low	152 Å²	152	148.3 Å²	148.3	71%	0.71	79%	0.793	S	S	*	*			trans	-98.9	132.1	173.6	-62.7	-177.5	130.9	0	0	110.3
203	Q	27.9	Very low	30.5	Very low	197 Å²	197	148.2 Å²	148.2	92%	0.921	79%	0.792	S	S	*	*			trans	-170	123.5	143.6	-108.5	142.7	77.9	0	0	116.9
204	S	29.2	Very low	30.8	Very low	103 Å²	103	149.1 Å²	149.1	72%	0.72	80%	0.799	S	S	*	*			trans	49.9	104.9	135.1	-161.6	0	0	0	0	123
205	D	28.4	Very low	31.1	Very low	139 Å²	139	154 Å²	154	74%	0.743	81%	0.806	S	S	*	*				19.5	117.8	127.8	-54.8	-8.6	0	0	0	121.7
206	N	28	Very low	31.5	Very low	157 Å²	157	157.7 Å²	157.7	84%	0.84	82%	0.818	S	S	*	*				150.7	123.4	111	-91.5	-67.1	0	0	0	112.4
207	D	28	Very low	32.3	Very low	152 Å²	152	152.8 Å²	152.8	81%	0.813	80%	0.802	S	S	*	*				-164.4	151.8	117.9	-146.3	-8.3	0	0	0	111.3
208	A	33.7	Very low	33.1	Very low	86 Å²	86	148.8 Å²	148.8	71%	0.711	80%	0.795	S	S	*	*			trans	-101.3	128.7	-171.4	0	0	0	0	0	113.8
209	K	29.7	Very low	33.5	Very low	194 Å²	194	148.1 Å²	148.1	84%	0.843	79%	0.792	S	S	*	*			trans	-152.9	124.2	165.5	-103.6	146.3	-168.2	159.5	0	112.7
210	L	36.5	Very low	34.7	Very low	170 Å²	170	146.7 Å²	146.7	89%	0.89	78%	0.778	S	S	*	*			trans	-66.4	147.4	162.1	-70.4	161.9	0	0	0	109.5
211	P	34.9	Very low	35.5	Very low	118 Å²	118	143.4 Å²	143.4	77%	0.766	77%	0.769	S	S	*	*				-153.2	168.8	106.3	39.4	-22.9	0	0	0	117.4
212	A	27.1	Very low	36.4	Very low	98 Å²	98	144.4 Å²	144.4	81%	0.81	76%	0.76	S	S	*	*			trans	64.5	126.4	145.1	0	0	0	0	0	121.8
213	R	34.6	Very low	37.1	Very low	255 Å²	255	143.3 Å²	143.3	96%	0.962	76%	0.759	S	S	*	*			trans	-74	136.2	159.4	-66	169.6	169	164.6	-5.5	110.7
214	S	32.6	Very low	38.2	Very low	121 Å²	121	143.3 Å²	143.3	85%	0.846	75%	0.75	S	S	*	*			trans	-108.9	165.8	154.8	64.8	0	0	0	0	110.3
215	K	37	Very low	39.1	Very low	211 Å²	211	143.5 Å²	143.5	92%	0.917	74%	0.74	S	S	*	*			trans	-109.6	133.1	-165.8	-62.6	172.8	-177.7	172	0	112
216	L	37.4	Very low	40	Very low	166 Å²	166	146.2 Å²	146.2	87%	0.869	74%	0.74	S	S	*	*			trans	-77.7	157.1	165.2	-76.7	164.7	0	0	0	111.3
217	S	46.4	Very low	40.7	Very low	61 Å²	61	143 Å²	143	43%	0.427	73%	0.729	S	S	.	*			trans	-78.1	160.2	-168.7	81.2	0	0	0	0	114.5	E219	S217-E219 VanDerWaalsContact C-N 3.28Å; S217-E219 PolarHBondContact O-N 3.08Å
218	P	43.6	Very low	41.8	Very low	101 Å²	101	137.7 Å²	137.7	66%	0.656	71%	0.705	S	S	*	*	H	α-helix	trans	-64.7	-22.9	-177.2	-23.8	35.5	0	0	0	115.6	H221 R222	P218-H221 PolarHBondContact O-N 3.26Å; P218-R222 PolarHBondContact O-N 3.1Å
219	E	45.2	Very low	42.2	Very low	145 Å²	145	142.3 Å²	142.3	68%	0.678	70%	0.704	S	S	*	*	H	α-helix	trans	-72.9	-36.8	-172.8	-65.2	-176.7	110.9	0	0	112.8	S217 H221 R222 L223	S217-E219 VanDerWaalsContact C-N 3.28Å; S217-E219 PolarHBondContact O-N 3.08Å; E219-H221 PolarHBondContact O-N 3.38Å; E219-R222 PolarHBondContact O-N 3.14Å; E219-R222 VanDerWaalsContact O-N 3.14Å; E219-L223 PolarHBondContact O-N 3.2Å; E219-L223 VanDerWaalsContact O-N 3.1Å
220	V	52.6	Low	43.1	Very low	87 Å²	87	137 Å²	137	53%	0.527	69%	0.689	S	S	.	*	H	α-helix	trans	-58.4	-32.8	175.4	-176.1	0	0	0	0	110.9	R224	V220-R224 PolarHBondContact O-N 3.4Å
221	H	50.3	Low	43.5	Very low	130 Å²	130	137.1 Å²	137.1	60%	0.602	68%	0.682	S	S	*	*	H	α-helix	trans	-71.3	-42.7	178.2	-142.8	-80.9	0	0	0	112.4	P218 E219 L223 R224 E225	P218-H221 PolarHBondContact O-N 3.26Å; E219-H221 PolarHBondContact O-N 3.38Å; H221-L223 PolarHBondContact O-N 3.35Å; H221-R224 PolarHBondContact O-N 3.46Å; H221-E225 PolarHBondContact O-N 3.49Å; H221-E225 VanDerWaalsContact O-N 3.1Å
222	R	48.5	Very low	43.7	Very low	189 Å²	189	139.7 Å²	139.7	71%	0.713	68%	0.676	S	S	*	*	H	α-helix	trans	-63	-40.9	177	-70.8	-179.7	173.3	171.2	-2.3	112.2	P218 E219 R224 E225 R226	P218-R222 PolarHBondContact O-N 3.1Å; E219-R222 PolarHBondContact O-N 3.14Å; E219-R222 VanDerWaalsContact O-N 3.14Å; R222-R224 VanDerWaalsContact C-N 3.31Å; R222-R224 PolarHBondContact O-N 3.48Å; R222-E225 PolarHBondContact O-N 3.28Å; R222-R226 PolarHBondContact O-N 3.1Å; R222-R226 VanDerWaalsContact O-N 3.08Å
223	L	47.9	Very low	44.2	Very low	129 Å²	129	140.5 Å²	140.5	68%	0.675	66%	0.663	S	S	*	*	H	α-helix	trans	-63	-39.9	177.3	-172.8	63.5	0	0	0	111.5	E219 H221 R226 C227	E219-L223 PolarHBondContact O-N 3.2Å; E219-L223 VanDerWaalsContact O-N 3.1Å; H221-L223 PolarHBondContact O-N 3.35Å; L223-R226 PolarHBondContact O-N 2.76Å; L223-C227 PolarHBondContact O-N 3.29Å
224	R	51.1	Low	44.3	Very low	198 Å²	198	134.6 Å²	134.6	75%	0.747	65%	0.65	S	S	*	*	H	α-helix	trans	-66.1	-39.2	177.9	-143.2	175	-164.5	-179.5	5.4	112.5	V220 H221 R222 A228	V220-R224 PolarHBondContact O-N 3.4Å; H221-R224 PolarHBondContact O-N 3.46Å; R222-R224 VanDerWaalsContact C-N 3.31Å; R222-R224 PolarHBondContact O-N 3.48Å; R224-A228 WeakPolarHBondContact O-CB 3.2Å; R224-A228 PolarHBondContact O-N 2.95Å; R224-A228 VanDerWaalsContact O-N 3.13Å
225	E	48.4	Very low	44.6	Very low	107 Å²	107	132.4 Å²	132.4	50%	0.5	64%	0.639	S	S	.	*	H	α-helix	trans	-66	-41.1	173.5	-78.9	-167.4	93.6	0	0	113.1	H221 R222 C227 A228 R229	H221-E225 PolarHBondContact O-N 3.49Å; H221-E225 VanDerWaalsContact O-N 3.1Å; R222-E225 PolarHBondContact O-N 3.28Å; E225-C227 PolarHBondContact O-N 3.09Å; E225-A228 CarbonylContact O-C 3.55Å; E225-A228 PolarHBondContact O-N 3.07Å; E225-A228 VanDerWaalsContact O-N 3.12Å; E225-R229 PolarHBondContact O-N 3.45Å
226	R	47.5	Very low	44.5	Very low	196 Å²	196	130 Å²	130	74%	0.74	63%	0.633	S	S	*	*	H	α-helix	trans	-60.4	-47.3	-179.9	-153.8	174.4	-166.6	174.5	3.8	110.8	R222 L223 A228 R229 T230	R222-R226 PolarHBondContact O-N 3.1Å; R222-R226 VanDerWaalsContact O-N 3.08Å; L223-R226 PolarHBondContact O-N 2.76Å; R226-A228 VanDerWaalsContact C-N 3.31Å; R226-A228 PolarHBondContact O-N 3.02Å; R226-R229 PolarHBondContact O-N 3.18Å; R226-T230 PolarHBondContact O-N 3.12Å; R226-T230 PolarHBondContact O-OG1 3.46Å
227	C	42.8	Very low	44.4	Very low	90 Å²	90	131.4 Å²	131.4	61%	0.608	63%	0.627	S	S	*	*	H	α-helix	trans	-62	-36.2	174.9	-164	0	0	0	0	112.6	L223 E225 R229 K231	L223-C227 PolarHBondContact O-N 3.29Å; E225-C227 PolarHBondContact O-N 3.09Å; C227-R229 VanDerWaalsContact C-N 3.34Å; C227-R229 PolarHBondContact O-N 2.99Å; C227-K231 PolarHBondContact O-N 3.13Å
228	A	49.4	Very low	43.7	Very low	39 Å²	39	136.3 Å²	136.3	32%	0.322	65%	0.647	S	S	.	*	H	α-helix	trans	-74.7	-14.6	177	0	0	0	0	0	114.9	R224 E225 R226 R232	R224-A228 WeakPolarHBondContact O-CB 3.2Å; R224-A228 PolarHBondContact O-N 2.95Å; R224-A228 VanDerWaalsContact O-N 3.13Å; E225-A228 CarbonylContact O-C 3.55Å; E225-A228 PolarHBondContact O-N 3.07Å; E225-A228 VanDerWaalsContact O-N 3.12Å; R226-A228 VanDerWaalsContact C-N 3.31Å; R226-A228 PolarHBondContact O-N 3.02Å; A228-R232 PolarHBondContact O-NH1 3.32Å
229	R	42.8	Very low	43	Very low	184 Å²	184	137.8 Å²	137.8	69%	0.694	66%	0.66	S	S	*	*	H	α-helix	trans	-81.8	-51	169.3	-73.3	-170.1	-177	-165.2	1.9	111.2	E225 R226 C227 K231 R232 E233	E225-R229 PolarHBondContact O-N 3.45Å; R226-R229 PolarHBondContact O-N 3.18Å; C227-R229 VanDerWaalsContact C-N 3.34Å; C227-R229 PolarHBondContact O-N 2.99Å; R229-K231 PolarHBondContact O-N 3.36Å; R229-R232 WeakPolarHBondContact O-CB 3.47Å; R229-R232 PolarHBondContact O-N 3.29Å; R229-E233 PolarHBondContact O-N 3.24Å; R229-E233 VanDerWaalsContact O-N 3.13Å
230	T	48.2	Very low	42.2	Very low	83 Å²	83	134.4 Å²	134.4	51%	0.509	66%	0.664	S	S	.	*	H	α-helix	trans	-55.4	-39.7	179.7	-40	0	0	0	0	112.1	R226 R232 E233 L234	R226-T230 PolarHBondContact O-N 3.12Å; R226-T230 PolarHBondContact O-OG1 3.46Å; T230-R232 VanDerWaalsContact C-N 3.28Å; T230-R232 PolarHBondContact O-N 3.49Å; T230-E233 PolarHBondContact O-N 3.48Å; T230-L234 PolarHBondContact O-N 3.32Å
231	K	44.8	Very low	41.1	Very low	171 Å²	171	140 Å²	140	74%	0.743	68%	0.681	S	S	*	*	H	α-helix	trans	-68.7	-18.6	176.9	-166.3	165.4	-174.6	169.3	0	114.6	C227 R229	C227-K231 PolarHBondContact O-N 3.13Å; R229-K231 PolarHBondContact O-N 3.36Å
232	R	39.8	Very low	39.9	Very low	173 Å²	173	141.8 Å²	141.8	65%	0.653	69%	0.689	S	S	*	*	H	α-helix	trans	-88.7	-34.6	172.9	-75.1	-176.6	177.7	91.8	-11.2	112.6	A228 R229 T230 A235	A228-R232 PolarHBondContact O-NH1 3.32Å; R229-R232 WeakPolarHBondContact O-CB 3.47Å; R229-R232 PolarHBondContact O-N 3.29Å; T230-R232 VanDerWaalsContact C-N 3.28Å; T230-R232 PolarHBondContact O-N 3.49Å; R232-A235 WeakPolarHBondContact O-CB 3.37Å; R232-A235 PolarHBondContact O-N 3.22Å; R232-A235 VanDerWaalsContact O-N 3.16Å
233	E	38.5	Very low	38.9	Very low	114 Å²	114	139 Å²	139	53%	0.533	69%	0.689	S	S	.	*	H	α-helix	trans	-66.3	-43.6	-179.1	-165	177.8	154.8	0	0	111.9	R229 T230 A235 M236 R237	R229-E233 PolarHBondContact O-N 3.24Å; R229-E233 VanDerWaalsContact O-N 3.13Å; T230-E233 PolarHBondContact O-N 3.48Å; E233-A235 PolarHBondContact O-N 3.44Å; E233-M236 PolarHBondContact O-N 3.11Å; E233-R237 IonicContact OE1-NH1 2.66Å; E233-R237 PolarHBondContact OE1-NH1 2.78Å
234	L	36.3	Very low	37.9	Very low	132 Å²	132	144.3 Å²	144.3	69%	0.691	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-61.5	-27.1	172.3	-74.2	165.7	0	0	0	113.2	T230 M236	T230-L234 PolarHBondContact O-N 3.32Å; L234-M236 VanDerWaalsContact C-N 3.32Å; L234-M236 PolarHBondContact O-N 3.01Å
235	A	37.8	Very low	37.1	Very low	74 Å²	74	137.7 Å²	137.7	61%	0.612	68%	0.681	S	S	*	*	G	3₁₀ helix	trans	-77.8	-11.8	-178.4	0	0	0	0	0	114.2	R232 E233	R232-A235 WeakPolarHBondContact O-CB 3.37Å; R232-A235 PolarHBondContact O-N 3.22Å; R232-A235 VanDerWaalsContact O-N 3.16Å; E233-A235 PolarHBondContact O-N 3.44Å
236	M	34.8	Very low	36.7	Very low	161 Å²	161	139.1 Å²	139.1	79%	0.793	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-100.3	-6.2	-178.4	-64.5	-159.4	-61.2	0	0	114.7	E233 L234	E233-M236 PolarHBondContact O-N 3.11Å; L234-M236 VanDerWaalsContact C-N 3.32Å; L234-M236 PolarHBondContact O-N 3.01Å
237	R	35.4	Very low	36.3	Very low	195 Å²	195	138.9 Å²	138.9	74%	0.736	70%	0.695	S	S	*	*	S	Bend	trans	-92.2	1.7	-175.7	-85.6	-174.5	165.2	117.6	-3.1	115.9	E233	E233-R237 IonicContact OE1-NH1 2.66Å; E233-R237 PolarHBondContact OE1-NH1 2.78Å
238	L	31.9	Very low	36.2	Very low	164 Å²	164	138.9 Å²	138.9	86%	0.859	69%	0.692	S	S	*	*			trans	-131.7	95.8	-178.5	-68.4	173.7	0	0	0	112.3
239	S	28.3	Very low	35.7	Very low	133 Å²	133	141.3 Å²	141.3	93%	0.93	70%	0.696	S	S	*	*			trans	-154.7	118.9	171.1	-175.6	0	0	0	0	111.5
240	G	29.1	Very low	35.7	Very low	73 Å²	73	139.7 Å²	139.7	75%	0.753	70%	0.697	S	S	*	*			trans	-167.9	104.6	-178.6	0	0	0	0	0	113.9
241	K	29.1	Very low	35.2	Very low	204 Å²	204	142.5 Å²	142.5	89%	0.887	71%	0.708	S	S	*	*			trans	9.4	141.8	145.7	-69.1	174.7	179.3	178.8	0	119.3
242	H	25.7	Very low	35.1	Very low	168 Å²	168	139 Å²	139	78%	0.778	70%	0.696	S	S	*	*			cis	-168.9	-178.7	-8.3	-145.6	43.8	0	0	0	110.7
243	N	28.3	Very low	35.2	Very low	131 Å²	131	139.5 Å²	139.5	70%	0.701	70%	0.697	S	S	*	*			trans	59.1	91.9	163.1	-66.6	-6.7	0	0	0	120
244	Y	26.8	Very low	35.4	Very low	241 Å²	241	137.4 Å²	137.4	95%	0.945	70%	0.7	S	S	*	*	S	Bend		-167.6	51.4	114.6	-124.9	-78.8	0	0	0	112.6
245	D	32.7	Very low	35.6	Very low	59 Å²	59	134.8 Å²	134.8	32%	0.316	70%	0.697	S	S	.	*			trans	-154.1	126.9	-171.1	-172	13.3	0	0	0	114.9	V248 Q249	D245-V248 WeakPolarHBondContact OD1-CA 3.44Å; D245-V248 WeakPolarHBondContact OD1-CB 3.32Å; D245-V248 PolarHBondContact OD1-N 2.84Å; D245-Q249 VanDerWaalsContact CG-N 3.32Å; D245-Q249 PolarHBondContact OD1-N 3.02Å; D245-Q249 WeakPolarHBondContact OD2-CA 3.28Å; D245-Q249 WeakPolarHBondContact OD2-CB 3.41Å; D245-Q249 VanDerWaalsContact OD2-CG 3.22Å; D245-Q249 WeakPolarHBondContact OD2-CG 3.44Å; D245-Q249 PolarHBondContact OD2-N 2.68Å; D245-Q249 VanDerWaalsContact OD2-N 3.16Å; D245-Q249 PolarHBondContact OD2-NE2 3.13Å
246	I	39.9	Very low	36.1	Very low	137 Å²	137	141.4 Å²	141.4	70%	0.703	71%	0.706	S	S	*	*	S	Bend	trans	-139.1	-42.3	165.6	-64	-175.7	0	0	0	110.3
247	K	40.8	Very low	36.7	Very low	191 Å²	191	138.1 Å²	138.1	83%	0.83	70%	0.695	S	S	*	*	H	α-helix	trans	-85.3	-26.2	-178.3	-70.9	-173.2	178.2	179.1	0	114.5
248	V	39.7	Very low	37.4	Very low	89 Å²	89	132.8 Å²	132.8	54%	0.539	70%	0.701	S	S	.	*	H	α-helix	trans	-81.6	-32.5	174.3	179.5	0	0	0	0	110.1	D245 Q250 L251 M252	D245-V248 WeakPolarHBondContact OD1-CA 3.44Å; D245-V248 WeakPolarHBondContact OD1-CB 3.32Å; D245-V248 PolarHBondContact OD1-N 2.84Å; V248-Q250 VanDerWaalsContact C-N 3.3Å; V248-Q250 PolarHBondContact O-N 3.16Å; V248-L251 WeakPolarHBondContact O-CB 3.12Å; V248-L251 PolarHBondContact O-N 2.89Å; V248-L251 VanDerWaalsContact O-N 3.07Å; V248-M252 HydrophobicContact CG1-CG 3.99Å; V248-M252 PolarHBondContact O-N 3.33Å
249	Q	39.9	Very low	38.4	Very low	90 Å²	90	129.1 Å²	129.1	42%	0.421	69%	0.686	S	S	.	*	H	α-helix	trans	-63.7	-30.8	-178.4	-135.1	158.7	97.6	0	0	114.1	D245 R253	D245-Q249 VanDerWaalsContact CG-N 3.32Å; D245-Q249 PolarHBondContact OD1-N 3.02Å; D245-Q249 WeakPolarHBondContact OD2-CA 3.28Å; D245-Q249 WeakPolarHBondContact OD2-CB 3.41Å; D245-Q249 VanDerWaalsContact OD2-CG 3.22Å; D245-Q249 WeakPolarHBondContact OD2-CG 3.44Å; D245-Q249 PolarHBondContact OD2-N 2.68Å; D245-Q249 VanDerWaalsContact OD2-N 3.16Å; D245-Q249 PolarHBondContact OD2-NE2 3.13Å; Q249-R253 WeakPolarHBondContact O-CB 3.44Å; Q249-R253 WeakPolarHBondContact O-CG 3.5Å; Q249-R253 PolarHBondContact O-N 3.36Å
250	Q	42	Very low	39.2	Very low	150 Å²	150	132.1 Å²	132.1	70%	0.701	68%	0.682	S	S	*	*	H	α-helix	trans	-66.6	-41	173.6	-70.4	-172.3	-11.9	0	0	111.4	V248	V248-Q250 VanDerWaalsContact C-N 3.3Å; V248-Q250 PolarHBondContact O-N 3.16Å
251	L	36.8	Very low	40.1	Very low	143 Å²	143	130.8 Å²	130.8	75%	0.749	67%	0.668	S	S	*	*	H	α-helix	trans	-67.8	-45.8	174.5	-133.6	80.7	0	0	0	111.2	V248 R253 A254 A255	V248-L251 WeakPolarHBondContact O-CB 3.12Å; V248-L251 PolarHBondContact O-N 2.89Å; V248-L251 VanDerWaalsContact O-N 3.07Å; L251-R253 PolarHBondContact O-N 3.19Å; L251-A254 PolarHBondContact O-N 3.26Å; L251-A255 PolarHBondContact O-N 3.16Å
252	M	43.6	Very low	40.9	Very low	98 Å²	98	122.1 Å²	122.1	48%	0.483	64%	0.637	S	S	.	*	H	α-helix	trans	-65.6	-32.4	179.3	-78.2	-71.8	-158.3	0	0	113.5	V248 A255 R256	V248-M252 HydrophobicContact CG1-CG 3.99Å; V248-M252 PolarHBondContact O-N 3.33Å; M252-A255 PolarHBondContact O-N 3.47Å; M252-R256 PolarHBondContact O-N 2.95Å
253	R	42.7	Very low	41.9	Very low	182 Å²	182	120.3 Å²	120.3	69%	0.687	63%	0.632	S	S	*	*	H	α-helix	trans	-63.1	-40.9	173.7	-89.3	-175.2	172.4	178.4	-0.3	111.9	Q249 L251 A255 R256 T257	Q249-R253 WeakPolarHBondContact O-CB 3.44Å; Q249-R253 WeakPolarHBondContact O-CG 3.5Å; Q249-R253 PolarHBondContact O-N 3.36Å; L251-R253 PolarHBondContact O-N 3.19Å; R253-A255 VanDerWaalsContact C-N 3.27Å; R253-A255 PolarHBondContact O-N 3.39Å; R253-R256 PolarHBondContact O-N 3.34Å; R253-T257 PolarHBondContact O-N 3.27Å; R253-T257 PolarHBondContact O-OG1 3.18Å
254	A	41.6	Very low	42.8	Very low	71 Å²	71	117.9 Å²	117.9	59%	0.587	62%	0.617	S	S	*	*	H	α-helix	trans	-64.1	-32.5	176.5	0	0	0	0	0	112.7	L251	L251-A254 PolarHBondContact O-N 3.26Å
255	A	41	Very low	43.6	Very low	76 Å²	76	116 Å²	116	63%	0.628	61%	0.608	S	S	*	*	H	α-helix	trans	-78.8	-36.4	177	0	0	0	0	0	113.8	L251 M252 R253	L251-A255 PolarHBondContact O-N 3.16Å; M252-A255 PolarHBondContact O-N 3.47Å; R253-A255 VanDerWaalsContact C-N 3.27Å; R253-A255 PolarHBondContact O-N 3.39Å
256	R	47.6	Very low	44.3	Very low	213 Å²	213	117.5 Å²	117.5	80%	0.804	62%	0.619	S	S	*	*	H	α-helix	trans	-78.4	-23	-174.2	-76.6	-174.4	174.4	-176.2	-1.1	114.9	M252 R253 G258	M252-R256 PolarHBondContact O-N 2.95Å; R253-R256 PolarHBondContact O-N 3.34Å; R256-G258 PolarHBondContact O-N 3.31Å
257	T	47	Very low	44.5	Very low	92 Å²	92	114.2 Å²	114.2	56%	0.564	60%	0.6	S	S	*	*	S	Bend	trans	-86.1	82.2	172.1	53.8	0	0	0	0	110.9	R253 T259	R253-T257 PolarHBondContact O-N 3.27Å; R253-T257 PolarHBondContact O-OG1 3.18Å; T257-T259 VanDerWaalsContact C-N 3.28Å; T257-T259 PolarHBondContact O-N 3.42Å; T257-T259 PolarHBondContact O-OG1 2.98Å
258	G	50.7	Low	45	Very low	84 Å²	84	108.5 Å²	108.5	87%	0.866	58%	0.578	S	S	*	*			trans	-61.6	77.3	-177.9	0	0	0	0	0	114.4	R256	R256-G258 PolarHBondContact O-N 3.31Å
259	T	52.5	Low	45.2	Very low	87 Å²	87	106.8 Å²	106.8	53%	0.534	57%	0.573	S	S	.	*			trans	-107.8	144.8	174.3	56.1	0	0	0	0	109.5	T257 G261 G262 L263	T257-T259 VanDerWaalsContact C-N 3.28Å; T257-T259 PolarHBondContact O-N 3.42Å; T257-T259 PolarHBondContact O-OG1 2.98Å; T259-G261 PolarHBondContact O-N 3.33Å; T259-G261 VanDerWaalsContact O-N 3.1Å; T259-G262 PolarHBondContact O-N 3.49Å; T259-L263 PolarHBondContact O-N 2.71Å
260	K	45.3	Very low	45.4	Very low	195 Å²	195	106.1 Å²	106.1	85%	0.848	58%	0.575	S	S	*	*	H	α-helix	trans	-53.4	-36.4	-174.5	-167.7	172.7	-179.6	177.3	0	113	E264	K260-E264 WeakPolarHBondContact O-CB 3.27Å; K260-E264 PolarHBondContact O-N 3.29Å
261	G	48.9	Very low	45.6	Very low	45 Å²	45	102.2 Å²	102.2	46%	0.464	56%	0.557	S	S	.	*	H	α-helix	trans	-75.7	-20.4	176.7	0	0	0	0	0	115.7	T259 R265	T259-G261 PolarHBondContact O-N 3.33Å; T259-G261 VanDerWaalsContact O-N 3.1Å; G261-R265 WeakPolarHBondContact O-CB 3.44Å; G261-R265 VanDerWaalsContact O-CG 3.3Å; G261-R265 WeakPolarHBondContact O-CG 3.25Å; G261-R265 PolarHBondContact O-N 2.8Å
262	G	45	Very low	45.9	Very low	22 Å²	22	105.3 Å²	105.3	23%	0.227	56%	0.559	C	S	.	*	H	α-helix	trans	-72.3	-49.5	174.6	0	0	0	0	0	111.6	T259 E264 R265 T266	T259-G262 PolarHBondContact O-N 3.49Å; G262-E264 VanDerWaalsContact C-N 3.34Å; G262-E264 PolarHBondContact O-N 3.27Å; G262-R265 PolarHBondContact O-N 3.3Å; G262-T266 PolarHBondContact O-N 3.43Å; G262-T266 PolarHBondContact O-OG1 3.45Å
263	L	46.7	Very low	45.8	Very low	131 Å²	131	109.8 Å²	109.8	69%	0.686	58%	0.576	S	S	*	*	H	α-helix	trans	-59	-45.7	173.9	-178.4	62.4	0	0	0	111.2	T259 R265 T266 K267	T259-L263 PolarHBondContact O-N 2.71Å; L263-R265 VanDerWaalsContact C-N 3.34Å; L263-R265 PolarHBondContact O-N 3.44Å; L263-T266 PolarHBondContact O-N 3.12Å; L263-K267 VanDerWaalsContact O-CB 3.29Å; L263-K267 WeakPolarHBondContact O-CB 3.45Å; L263-K267 PolarHBondContact O-N 3.29Å
264	E	46.7	Very low	45.5	Very low	79 Å²	79	103.1 Å²	103.1	37%	0.369	56%	0.555	S	S	.	*	H	α-helix	trans	-65.3	-34.9	178.8	-158.5	62.5	-148.8	0	0	112.1	K260 G262 K267 I268	K260-E264 WeakPolarHBondContact O-CB 3.27Å; K260-E264 PolarHBondContact O-N 3.29Å; G262-E264 VanDerWaalsContact C-N 3.34Å; G262-E264 PolarHBondContact O-N 3.27Å; E264-K267 WeakPolarHBondContact OE1-CE 3.41Å; E264-K267 IonicContact OE1-NZ 3.83Å; E264-K267 PolarHBondContact OE1-NZ 3.05Å; E264-K267 IonicContact OE2-NZ 3.89Å; E264-K267 PolarHBondContact OE2-NZ 2.71Å; E264-I268 HydrophobicContact CG-CD1 4.12Å; E264-I268 VanDerWaalsContact O-CB 3.31Å; E264-I268 WeakPolarHBondContact O-CB 3.31Å; E264-I268 WeakPolarHBondContact O-CD1 3.43Å; E264-I268 WeakPolarHBondContact O-CG1 3.42Å; E264-I268 PolarHBondContact O-N 2.68Å
265	R	45	Very low	45.3	Very low	202 Å²	202	103.9 Å²	103.9	76%	0.762	56%	0.557	S	S	*	*	H	α-helix	trans	-67	-40.7	172.4	-82.8	179.1	176.1	-177.2	-0.3	113.1	G261 G262 L263 I268 A269	G261-R265 WeakPolarHBondContact O-CB 3.44Å; G261-R265 VanDerWaalsContact O-CG 3.3Å; G261-R265 WeakPolarHBondContact O-CG 3.25Å; G261-R265 PolarHBondContact O-N 2.8Å; G262-R265 PolarHBondContact O-N 3.3Å; L263-R265 VanDerWaalsContact C-N 3.34Å; L263-R265 PolarHBondContact O-N 3.44Å; R265-I268 PolarHBondContact O-N 3.03Å; R265-A269 WeakPolarHBondContact O-CB 3.25Å; R265-A269 PolarHBondContact O-N 3.18Å
266	T	46.3	Very low	45.6	Very low	91 Å²	91	103.2 Å²	103.2	56%	0.558	54%	0.54	S	S	*	.	H	α-helix	trans	-65.5	-43.5	175.2	-59.4	0	0	0	0	111	G262 L263 A269 V270	G262-T266 PolarHBondContact O-N 3.43Å; G262-T266 PolarHBondContact O-OG1 3.45Å; L263-T266 PolarHBondContact O-N 3.12Å; T266-A269 WeakPolarHBondContact O-CB 3.43Å; T266-A269 PolarHBondContact O-N 3.28Å; T266-A269 VanDerWaalsContact O-N 3.15Å; T266-V270 WeakPolarHBondContact O-CG2 3.32Å; T266-V270 PolarHBondContact O-N 3.39Å
267	K	45.2	Very low	45.2	Very low	67 Å²	67	95.2 Å²	95.2	29%	0.291	51%	0.513	S	S	.	.	H	α-helix	trans	-58.5	-47	173	177.1	-177.4	166.7	-149.2	0	111.9	L263 E264 A269 V270 M271	L263-K267 VanDerWaalsContact O-CB 3.29Å; L263-K267 WeakPolarHBondContact O-CB 3.45Å; L263-K267 PolarHBondContact O-N 3.29Å; E264-K267 WeakPolarHBondContact OE1-CE 3.41Å; E264-K267 IonicContact OE1-NZ 3.83Å; E264-K267 PolarHBondContact OE1-NZ 3.05Å; E264-K267 IonicContact OE2-NZ 3.89Å; E264-K267 PolarHBondContact OE2-NZ 2.71Å; K267-A269 VanDerWaalsContact C-N 3.33Å; K267-A269 PolarHBondContact O-N 2.82Å; K267-V270 PolarHBondContact O-N 3.44Å; K267-M271 WeakPolarHBondContact O-CB 3.44Å; K267-M271 WeakPolarHBondContact O-CG 3.1Å; K267-M271 PolarHBondContact O-N 2.85Å
268	I	50.3	Low	45	Very low	71 Å²	71	96.6 Å²	96.6	36%	0.364	51%	0.513	S	S	.	.	H	α-helix	trans	-63.2	-36.5	173.7	-71.7	164.6	0	0	0	111.5	E264 R265 M271 R272	E264-I268 HydrophobicContact CG-CD1 4.12Å; E264-I268 VanDerWaalsContact O-CB 3.31Å; E264-I268 WeakPolarHBondContact O-CB 3.31Å; E264-I268 WeakPolarHBondContact O-CD1 3.43Å; E264-I268 WeakPolarHBondContact O-CG1 3.42Å; E264-I268 PolarHBondContact O-N 2.68Å; R265-I268 PolarHBondContact O-N 3.03Å; I268-M271 PolarHBondContact O-N 2.77Å; I268-R272 HydrophobicContact CG2-CG 4.32Å; I268-R272 VanDerWaalsContact O-CB 3.27Å; I268-R272 WeakPolarHBondContact O-CB 3.27Å; I268-R272 VanDerWaalsContact O-CG 3.25Å; I268-R272 WeakPolarHBondContact O-CG 3.4Å; I268-R272 PolarHBondContact O-N 3.1Å
269	A	43.8	Very low	44.4	Very low	53 Å²	53	100.3 Å²	100.3	44%	0.438	50%	0.5	S	S	.	.	H	α-helix	trans	-68.3	-37	176.7	0	0	0	0	0	112.5	R265 T266 K267 K273	R265-A269 WeakPolarHBondContact O-CB 3.25Å; R265-A269 PolarHBondContact O-N 3.18Å; T266-A269 WeakPolarHBondContact O-CB 3.43Å; T266-A269 PolarHBondContact O-N 3.28Å; T266-A269 VanDerWaalsContact O-N 3.15Å; K267-A269 VanDerWaalsContact C-N 3.33Å; K267-A269 PolarHBondContact O-N 2.82Å; A269-K273 WeakPolarHBondContact O-CB 3.42Å; A269-K273 PolarHBondContact O-N 3.36Å
270	V	45.5	Very low	43.7	Very low	77 Å²	77	101.9 Å²	101.9	47%	0.467	50%	0.5	S	S	.	.	H	α-helix	trans	-66	-51.7	170.9	173.1	0	0	0	0	110.2	T266 K267 R272 K273 V274	T266-V270 WeakPolarHBondContact O-CG2 3.32Å; T266-V270 PolarHBondContact O-N 3.39Å; K267-V270 PolarHBondContact O-N 3.44Å; V270-R272 PolarHBondContact O-N 3.38Å; V270-R272 VanDerWaalsContact O-N 3.17Å; V270-K273 CarbonylContact O-C 3.59Å; V270-K273 PolarHBondContact O-N 3.25Å; V270-V274 HydrophobicContact CG1-CG2 4.3Å; V270-V274 WeakPolarHBondContact O-CG2 3.43Å; V270-V274 PolarHBondContact O-N 2.67Å
271	M	44.9	Very low	43	Very low	67 Å²	67	99.1 Å²	99.1	33%	0.33	49%	0.494	S	S	.	.	H	α-helix	trans	-57.5	-31.3	176.9	-64.7	-83	-73.2	0	0	112.8	K267 I268 L277 R279	K267-M271 WeakPolarHBondContact O-CB 3.44Å; K267-M271 WeakPolarHBondContact O-CG 3.1Å; K267-M271 PolarHBondContact O-N 2.85Å; I268-M271 PolarHBondContact O-N 2.77Å; M271-L277 HydrophobicContact SD-CB 4.06Å; M271-R279 HydrophobicContact CE-CB 4.08Å
272	R	44.4	Very low	42.1	Very low	209 Å²	209	103.8 Å²	103.8	79%	0.789	50%	0.504	S	S	*	.	H	α-helix	trans	-81.4	-26.3	175.2	-76	177.8	176	-172.1	-2.7	114.2	I268 V270	I268-R272 HydrophobicContact CG2-CG 4.32Å; I268-R272 VanDerWaalsContact O-CB 3.27Å; I268-R272 WeakPolarHBondContact O-CB 3.27Å; I268-R272 VanDerWaalsContact O-CG 3.25Å; I268-R272 WeakPolarHBondContact O-CG 3.4Å; I268-R272 PolarHBondContact O-N 3.1Å; V270-R272 PolarHBondContact O-N 3.38Å; V270-R272 VanDerWaalsContact O-N 3.17Å
273	K	40.8	Very low	41.3	Very low	192 Å²	192	111.7 Å²	111.7	84%	0.835	54%	0.537	S	S	*	.	H	α-helix	trans	-82.7	-20.9	171.3	-82.3	-165.2	169.9	-166.5	0	113.2	A269 V270	A269-K273 WeakPolarHBondContact O-CB 3.42Å; A269-K273 PolarHBondContact O-N 3.36Å; V270-K273 CarbonylContact O-C 3.59Å; V270-K273 PolarHBondContact O-N 3.25Å
274	V	36.9	Very low	40.8	Very low	41 Å²	41	114.5 Å²	114.5	25%	0.248	55%	0.547	C	S	.	.	S	Bend	trans	-117.5	75.1	-177.6	-165	0	0	0	0	109.1	V270 F276 L277	V270-V274 HydrophobicContact CG1-CG2 4.3Å; V270-V274 WeakPolarHBondContact O-CG2 3.43Å; V270-V274 PolarHBondContact O-N 2.67Å; V274-F276 HydrophobicContact CG1-CD1 3.85Å; V274-F276 HydrophobicContact CG1-CD2 4.34Å; V274-F276 HydrophobicContact CG1-CE1 3.3Å; V274-F276 HydrophobicContact CG1-CE2 3.84Å; V274-F276 HydrophobicContact CG1-CG 4.35Å; V274-F276 HydrophobicContact CG1-CZ 3.29Å; V274-F276 PolarHBondContact O-N 3.36Å; V274-L277 HydrophobicContact CB-CD1 3.91Å; V274-L277 HydrophobicContact CB-CG 4.02Å; V274-L277 HydrophobicContact CG1-CD1 3.79Å; V274-L277 HydrophobicContact CG1-CD2 4.07Å; V274-L277 HydrophobicContact CG1-CG 3.61Å; V274-L277 PolarHBondContact O-N 3.25Å; V274-L277 VanDerWaalsContact O-N 3.16Å
275	S	36.3	Very low	40.2	Very low	88 Å²	88	117.6 Å²	117.6	62%	0.615	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	11.7	-165.4	59.4	0	0	0	0	116.6	K300	S275-K300 PolarHBondContact O-NZ 3.42Å
276	F	47.2	Very low	40	Very low	62 Å²	62	115.2 Å²	115.2	27%	0.272	56%	0.564	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114	-7.3	176.5	60.1	-96.8	0	0	0	113.8	V274 Q278 H301 I381	V274-F276 HydrophobicContact CG1-CD1 3.85Å; V274-F276 HydrophobicContact CG1-CD2 4.34Å; V274-F276 HydrophobicContact CG1-CE1 3.3Å; V274-F276 HydrophobicContact CG1-CE2 3.84Å; V274-F276 HydrophobicContact CG1-CG 4.35Å; V274-F276 HydrophobicContact CG1-CZ 3.29Å; V274-F276 PolarHBondContact O-N 3.36Å; F276-Q278 PolarHBondContact O-N 2.86Å; F276-H301 AromaticContact CG-NE2 3.76Å; F276-I381 HydrophobicContact CE2-CD1 4.39Å
277	L	39.8	Very low	39.5	Very low	45 Å²	45	118.4 Å²	118.4	24%	0.236	58%	0.577	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.7	110.1	175.7	-52.5	-174.7	0	0	0	110.3	M271 V274 V294	M271-L277 HydrophobicContact SD-CB 4.06Å; V274-L277 HydrophobicContact CB-CD1 3.91Å; V274-L277 HydrophobicContact CB-CG 4.02Å; V274-L277 HydrophobicContact CG1-CD1 3.79Å; V274-L277 HydrophobicContact CG1-CD2 4.07Å; V274-L277 HydrophobicContact CG1-CG 3.61Å; V274-L277 PolarHBondContact O-N 3.25Å; V274-L277 VanDerWaalsContact O-N 3.16Å; L277-V294 HydrophobicContact CB-CG1 3.63Å; L277-V294 HydrophobicContact CD1-CG1 4.4Å; L277-V294 HydrophobicContact CD2-CG1 3.67Å; L277-V294 HydrophobicContact CG-CG1 4.04Å
278	Q	43.6	Very low	39.2	Very low	121 Å²	121	120.7 Å²	120.7	57%	0.565	59%	0.593	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-102.6	131.6	167.5	-74.4	-175.7	-25.9	0	0	110.1	F276 A295	F276-Q278 PolarHBondContact O-N 2.86Å; Q278-A295 PolarHBondContact N-O 2.85Å; Q278-A295 PolarHBondContact O-N 3.16Å; Q278-A295 VanDerWaalsContact O-N 3.12Å
279	R	37.8	Very low	38.8	Very low	161 Å²	161	120 Å²	120	61%	0.608	60%	0.598	S	S	*	*			trans	-83.1	127.8	167.2	-168.5	-175.8	-165.7	-146.1	1.3	107.8	M271 D281	M271-R279 HydrophobicContact CE-CB 4.08Å; R279-D281 IonicContact NH1-OD1 3.32Å
280	K	36.8	Very low	38.7	Very low	121 Å²	121	121.4 Å²	121.4	53%	0.526	62%	0.617	S	S	.	*			trans	-89.9	111.4	171.6	-166.7	-172.5	-172.5	-164.6	0	108.4	Q282	K280-Q282 PolarHBondContact O-N 3.41Å
281	D	30.2	Very low	38.7	Very low	136 Å²	136	121.9 Å²	121.9	73%	0.727	61%	0.611	S	S	*	*			trans	-77.7	105.6	170.9	-67.7	-38.7	0	0	0	108.1	R279	R279-D281 IonicContact NH1-OD1 3.32Å
282	Q	29.9	Very low	38.7	Very low	144 Å²	144	124.5 Å²	124.5	67%	0.673	63%	0.626	S	S	*	*			trans	-131.9	141.3	175.5	-165.2	157.3	13.6	0	0	108.1	K280	K280-Q282 PolarHBondContact O-N 3.41Å
283	M	30.1	Very low	38.5	Very low	187 Å²	187	119 Å²	119	92%	0.921	61%	0.612	S	S	*	*			trans	-64.2	154.9	-169.2	-78.2	172.5	58.7	0	0	113.5
284	E	35.3	Very low	38.9	Very low	191 Å²	191	111.1 Å²	111.1	89%	0.893	58%	0.58	S	S	*	*			trans	-63.9	126.5	-169.5	-61.1	172.4	152.5	0	0	113
285	E	34.3	Very low	39.4	Very low	143 Å²	143	111 Å²	111	67%	0.668	58%	0.583	S	S	*	*			trans	-120.5	123.2	143.5	-72	-156	92.9	0	0	106.9	D287 R363	E285-D287 PolarHBondContact O-N 2.97Å; E285-R363 IonicContact OE1-CZ 2.75Å; E285-R363 IonicContact OE1-NH1 2.77Å; E285-R363 IonicContact OE1-NH2 3.72Å; E285-R363 PolarHBondContact OE1-NH2 2.97Å; E285-R363 IonicContact OE2-CZ 3.14Å; E285-R363 IonicContact OE2-NH2 2.71Å; E285-R363 PolarHBondContact OE2-NH2 2.92Å
286	D	40.1	Very low	40.2	Very low	152 Å²	152	108.4 Å²	108.4	81%	0.813	56%	0.564	S	S	*	*			trans	-65.8	116.7	167.9	-81.7	-42.9	0	0	0	109.3
287	D	37.2	Very low	40.2	Very low	158 Å²	158	106.7 Å²	106.7	85%	0.845	56%	0.56	S	S	*	*				-175.3	158.8	107.8	-114.7	-33.9	0	0	0	114.2	E285	E285-D287 PolarHBondContact O-N 2.97Å
288	D	38.9	Very low	40.5	Very low	115 Å²	115	109.8 Å²	109.8	62%	0.615	57%	0.573	S	S	*	*			trans	81.1	143.2	155.5	-158.1	36.8	0	0	0	123.3	G290 R368	D288-G290 PolarHBondContact O-N 2.69Å; D288-R368 IonicContact OD2-NH1 3.35Å; D288-R368 IonicContact OD2-NH2 2.79Å; D288-R368 PolarHBondContact OD2-NH2 2.61Å
289	A	40.5	Very low	40.6	Very low	58 Å²	58	110.6 Å²	110.6	48%	0.479	59%	0.586	S	S	.	*	S	Bend	trans	51.1	33.6	151.3	0	0	0	0	0	122.4	Y291	A289-Y291 PolarHBondContact O-N 3.16Å
290	G	42.1	Very low	41.2	Very low	81 Å²	81	108.9 Å²	108.9	84%	0.835	58%	0.583	S	S	*	*			trans	60.5	12	150.3	0	0	0	0	0	118.2	D288	D288-G290 PolarHBondContact O-N 2.69Å
291	Y	45	Very low	42.1	Very low	87 Å²	87	106.3 Å²	106.3	34%	0.341	57%	0.572	S	S	.	*			trans	-89.6	126.9	-170.7	-165.4	-98.2	0	0	0	110.2	A289 D293 E371 Q374	A289-Y291 PolarHBondContact O-N 3.16Å; Y291-D293 PolarHBondContact O-N 2.82Å; Y291-E371 HydrophobicContact CD1-CG 4.25Å; Y291-E371 HydrophobicContact CE1-CB 4.41Å; Y291-E371 HydrophobicContact CE1-CG 3.96Å; Y291-E371 HydrophobicContact CE2-CB 4.27Å; Y291-E371 HydrophobicContact CE2-CG 4.23Å; Y291-E371 PolarHBondContact OH-O 3.36Å; Y291-Q374 WeakPolarHBondContact OH-CB 3.35Å; Y291-Q374 WeakPolarHBondContact OH-CG 3.12Å
292	L	44.8	Very low	43.4	Very low	123 Å²	123	104.7 Å²	104.7	64%	0.644	57%	0.569	S	S	*	*			trans	-78	109.8	168	-85.2	82.4	0	0	0	108.9	V294 Q374	L292-V294 HydrophobicContact CB-CG2 3.77Å; L292-V294 PolarHBondContact O-N 2.77Å; L292-V294 VanDerWaalsContact O-N 3.09Å; L292-Q374 PolarHBondContact O-NE2 2.94Å
293	D	41.7	Very low	45.1	Very low	94 Å²	94	101.1 Å²	101.1	50%	0.503	56%	0.559	S	S	.	*			trans	-59.4	107.9	156.7	-177.7	11.6	0	0	0	107.9	Y291	Y291-D293 PolarHBondContact O-N 2.82Å
294	V	49.2	Very low	47.2	Very low	25 Å²	25	92.8 Å²	92.8	15%	0.152	52%	0.519	C	S	.	.			trans	-121.7	107.6	177	-172.2	0	0	0	0	108.1	L277 L292 V296	L277-V294 HydrophobicContact CB-CG1 3.63Å; L277-V294 HydrophobicContact CD1-CG1 4.4Å; L277-V294 HydrophobicContact CD2-CG1 3.67Å; L277-V294 HydrophobicContact CG-CG1 4.04Å; L292-V294 HydrophobicContact CB-CG2 3.77Å; L292-V294 PolarHBondContact O-N 2.77Å; L292-V294 VanDerWaalsContact O-N 3.09Å; V294-V296 PolarHBondContact O-N 3.02Å
295	A	46.4	Very low	49.2	Very low	38 Å²	38	90.2 Å²	90.2	31%	0.314	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	100.5	175.4	0	0	0	0	0	109.2	Q278 S297	Q278-A295 PolarHBondContact N-O 2.85Å; Q278-A295 PolarHBondContact O-N 3.16Å; Q278-A295 VanDerWaalsContact O-N 3.12Å; A295-S297 PolarHBondContact O-N 3.35Å
296	V	53	Low	51.4	Low	35 Å²	35	85.8 Å²	85.8	21%	0.212	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	116.8	165.3	170.8	0	0	0	0	107.6	V294 E298 I381	V294-V296 PolarHBondContact O-N 3.02Å; V296-E298 PolarHBondContact O-N 2.65Å; V296-I381 HydrophobicContact CG1-CD1 3.68Å; V296-I381 HydrophobicContact CG1-CG1 4.43Å; V296-I381 HydrophobicContact CG2-CD1 4.28Å
297	S	47.8	Very low	53.3	Low	26 Å²	26	80.7 Å²	80.7	18%	0.182	46%	0.464	C	S	.	.			trans	-80.2	100.6	176.8	-167.2	0	0	0	0	110.3	A295 V299 K300	A295-S297 PolarHBondContact O-N 3.35Å; S297-V299 PolarHBondContact O-N 2.83Å; S297-V299 VanDerWaalsContact O-N 3.13Å; S297-K300 PolarHBondContact O-N 3.43Å
298	E	45.5	Very low	55.2	Low	109 Å²	109	79 Å²	79	51%	0.509	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-57	-27.6	-179.9	-58.5	-174.5	155.1	0	0	112.5	V296 K300 H301 R339	V296-E298 PolarHBondContact O-N 2.65Å; E298-K300 PolarHBondContact O-N 2.67Å; E298-H301 PolarHBondContact O-N 2.87Å; E298-R339 IonicContact OE1-CZ 2.93Å; E298-R339 IonicContact OE1-NE 3.61Å; E298-R339 PolarHBondContact OE1-NE 2.63Å; E298-R339 IonicContact OE1-NH2 3.57Å; E298-R339 PolarHBondContact OE1-NH2 2.68Å; E298-R339 IonicContact OE2-NE 2.67Å
299	V	47	Very low	57.2	Low	139 Å²	139	78.4 Å²	78.4	84%	0.842	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-63.8	-9	-178.4	-168.9	0	0	0	0	113.8	S297	S297-V299 PolarHBondContact O-N 2.83Å; S297-V299 VanDerWaalsContact O-N 3.13Å
300	K	49.7	Very low	59.1	Low	124 Å²	124	78 Å²	78	54%	0.539	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-106.2	-6.5	-178.3	-73.1	-164.9	178.9	-171	0	116.1	S275 S297 E298	S275-K300 PolarHBondContact O-NZ 3.42Å; S297-K300 PolarHBondContact O-N 3.43Å; E298-K300 PolarHBondContact O-N 2.67Å
301	H	54.8	Low	60.9	Low	67 Å²	67	83.5 Å²	83.5	31%	0.31	45%	0.452	S	S	.	.	S	Bend	trans	-126.3	122.9	-176	-64.3	-75.2	0	0	0	110.2	F276 E298	F276-H301 AromaticContact CG-NE2 3.76Å; E298-H301 PolarHBondContact O-N 2.87Å
302	P	59.3	Low	62.6	Low	102 Å²	102	83.4 Å²	83.4	66%	0.662	48%	0.478	S	S	*	.			trans	-61.9	148.1	171.5	28.4	-33.9	0	0	0	109.4
303	P	65.6	Low	64.4	Low	70 Å²	70	79.7 Å²	79.7	46%	0.455	46%	0.458	S	S	.	.			trans	-60	147	174.6	26.8	-34.3	0	0	0	110	Q305	P303-Q305 HydrophobicContact CG-CG 4.2Å; P303-Q305 PolarHBondContact O-N 2.89Å
304	P	73.1	Confident	66.5	Low	12 Å²	12	78.7 Å²	78.7	8%	0.078	46%	0.456	C	S	.	.			trans	-56.5	112.3	170.7	22.4	-31.8	0	0	0	109.5	I328 Q380 L383 A384 V387	P304-I328 HydrophobicContact CB-CG1 4.4Å; P304-I328 HydrophobicContact CB-CG2 3.96Å; P304-I328 HydrophobicContact CG-CG2 3.99Å; P304-I328 VanDerWaalsContact O-CG2 3.24Å; P304-I328 WeakPolarHBondContact O-CG2 3.37Å; P304-Q380 HydrophobicContact CG-CG 4.39Å; P304-L383 HydrophobicContact CB-CG 4.3Å; P304-L383 HydrophobicContact CG-CD2 4.5Å; P304-A384 HydrophobicContact CB-CB 4.1Å; P304-V387 HydrophobicContact CB-CG2 4.42Å
305	Q	76.7	Confident	68.3	Low	137 Å²	137	84.1 Å²	84.1	64%	0.64	48%	0.484	S	S	*	.			trans	-135	128.9	178.8	-73.9	-178.2	-20.2	0	0	108.1	P303 V387	P303-Q305 HydrophobicContact CG-CG 4.2Å; P303-Q305 PolarHBondContact O-N 2.89Å; Q305-V387 VanDerWaalsContact O-CG1 3.24Å; Q305-V387 WeakPolarHBondContact O-CG1 3.43Å
306	L	81	Confident	70.2	Confident	50 Å²	50	87.2 Å²	87.2	26%	0.262	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-70.6	144.6	174.8	-74.2	160.6	0	0	0	110	R321 L324 I328 V387 W390	L306-R321 HydrophobicContact CD1-CG 4.13Å; L306-L324 HydrophobicContact CD2-CD2 3.97Å; L306-L324 HydrophobicContact CD2-CG 4.48Å; L306-I328 HydrophobicContact CD1-CD1 4.1Å; L306-I328 HydrophobicContact CD2-CD1 4.48Å; L306-I328 HydrophobicContact CG-CD1 3.92Å; L306-V387 HydrophobicContact CD2-CG1 3.98Å; L306-V387 HydrophobicContact CG-CG1 4.15Å; L306-W390 HydrophobicContact CD2-CG 4.49Å
307	S	79.3	Confident	71.8	Confident	45 Å²	45	88 Å²	88	32%	0.315	49%	0.493	S	S	.	.	P	Polyproline II helix	trans	-52.8	157	163.6	31.7	0	0	0	0	111.3	R321 D391	S307-R321 PolarHBondContact O-NH2 3.02Å; S307-R321 PolarHBondContact OG-NH2 3.25Å; S307-D391 PolarHBondContact OG-OD2 3.1Å
308	P	78.4	Confident	73.8	Confident	122 Å²	122	88.4 Å²	88.4	79%	0.792	49%	0.494	S	S	*	.	S	Bend	trans	-48.4	143.1	158.9	-23.3	34.2	0	0	0	109.8	P310	P308-P310 VanDerWaalsContact O-CD 3.29Å; P308-P310 WeakPolarHBondContact O-CD 3.48Å
309	M	80.3	Confident	76	Confident	102 Å²	102	86 Å²	86	50%	0.502	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-67.7	123.8	-173.1	-172.1	158.6	70.8	0	0	110.9	L313 V318	M309-L313 HydrophobicContact CG-CD1 3.78Å; M309-L313 HydrophobicContact SD-CD1 4.37Å; M309-V318 HydrophobicContact CE-CG1 4.36Å; M309-V318 HydrophobicContact CE-CG2 4.46Å; M309-V318 HydrophobicContact SD-CB 4.49Å; M309-V318 HydrophobicContact SD-CG1 4.06Å; M309-V318 HydrophobicContact SD-CG2 4.04Å
310	P	80.7	Confident	78.2	Confident	50 Å²	50	79.5 Å²	79.5	33%	0.325	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-59.6	144.7	174.6	-25.1	34.2	0	0	0	112.9	P308 L313 D391	P308-P310 VanDerWaalsContact O-CD 3.29Å; P308-P310 WeakPolarHBondContact O-CD 3.48Å; P310-L313 HydrophobicContact CB-CD1 4.47Å; P310-L313 HydrophobicContact CB-CG 4.32Å; P310-D391 HydrophobicContact CG-CB 4.33Å
311	E	79.7	Confident	80.2	Confident	196 Å²	196	74.2 Å²	74.2	92%	0.916	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	150.7	171.6	-65.5	176	-164.8	0	0	111.1	L313	E311-L313 PolarHBondContact O-N 2.88Å
312	G	80.7	Confident	82	Confident	86 Å²	86	76.6 Å²	76.6	89%	0.887	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.3	7.2	176.1	0	0	0	0	0	116.4
313	L	82.6	Confident	83.7	Confident	44 Å²	44	72.6 Å²	72.6	23%	0.23	41%	0.408	C	S	.	.			trans	-64.4	144.6	172.9	-69.3	179.6	0	0	0	112.6	M309 P310 E311 Q317 V318	M309-L313 HydrophobicContact CG-CD1 3.78Å; M309-L313 HydrophobicContact SD-CD1 4.37Å; P310-L313 HydrophobicContact CB-CD1 4.47Å; P310-L313 HydrophobicContact CB-CG 4.32Å; E311-L313 PolarHBondContact O-N 2.88Å; L313-Q317 HydrophobicContact CB-CB 4.25Å; L313-Q317 HydrophobicContact CD2-CB 4.06Å; L313-V318 HydrophobicContact CB-CG2 3.88Å; L313-V318 HydrophobicContact CD1-CG2 4.43Å
314	T	86.1	Confident	85	Confident	73 Å²	73	69.2 Å²	69.2	45%	0.448	39%	0.386	S	S	.	.			trans	-73.6	155.7	170.1	65	0	0	0	0	111.8	H316 Q317 V318	T314-H316 PolarHBondContact O-N 2.94Å; T314-H316 VanDerWaalsContact O-N 3.11Å; T314-Q317 WeakPolarHBondContact O-CB 3.34Å; T314-Q317 PolarHBondContact O-N 2.78Å; T314-Q317 WeakPolarHBondContact OG1-CG 3.47Å; T314-Q317 PolarHBondContact OG1-N 2.93Å; T314-Q317 PolarHBondContact OG1-OE1 3.01Å; T314-V318 PolarHBondContact O-N 3.2Å
315	N	86.4	Confident	86	Confident	139 Å²	139	69.8 Å²	69.8	74%	0.743	39%	0.394	S	S	*	.	H	α-helix	trans	-51.5	-37.7	177	-66.1	-3.5	0	0	0	113	V318 V319	N315-V318 PolarHBondContact O-N 3.27Å; N315-V319 WeakPolarHBondContact O-CG2 3.31Å; N315-V319 PolarHBondContact O-N 2.88Å
316	H	85.9	Confident	86.9	Confident	103 Å²	103	66.2 Å²	66.2	48%	0.477	38%	0.384	S	S	.	.	H	α-helix	trans	-63.1	-45.4	175.3	-74.3	-75.6	0	0	0	112.3	T314 V318 V319 R320 N478	T314-H316 PolarHBondContact O-N 2.94Å; T314-H316 VanDerWaalsContact O-N 3.11Å; H316-V318 PolarHBondContact O-N 2.89Å; H316-V319 PolarHBondContact O-N 3.3Å; H316-R320 WeakPolarHBondContact O-CB 3.48Å; H316-R320 VanDerWaalsContact O-CG 3.22Å; H316-R320 WeakPolarHBondContact O-CG 3.29Å; H316-R320 PolarHBondContact O-N 3.04Å; H316-N478 PolarHBondContact ND1-O 2.76Å
317	Q	87	Confident	87.6	Confident	52 Å²	52	63.9 Å²	63.9	24%	0.243	37%	0.372	C	S	.	.	H	α-helix	trans	-65.7	-38.7	178.9	-65	166.8	-69.8	0	0	111.6	L313 T314 R320 R321 E394	L313-Q317 HydrophobicContact CB-CB 4.25Å; L313-Q317 HydrophobicContact CD2-CB 4.06Å; T314-Q317 WeakPolarHBondContact O-CB 3.34Å; T314-Q317 PolarHBondContact O-N 2.78Å; T314-Q317 WeakPolarHBondContact OG1-CG 3.47Å; T314-Q317 PolarHBondContact OG1-N 2.93Å; T314-Q317 PolarHBondContact OG1-OE1 3.01Å; Q317-R320 PolarHBondContact O-N 3.23Å; Q317-R321 WeakPolarHBondContact O-CB 3.27Å; Q317-R321 PolarHBondContact O-N 2.99Å; Q317-E394 WeakPolarHBondContact CG-OE1 3.34Å; Q317-E394 PolarHBondContact NE2-OE1 2.83Å
318	V	89.8	Confident	88.3	Confident	34 Å²	34	62.3 Å²	62.3	21%	0.206	36%	0.36	C	S	.	.	H	α-helix	trans	-61.2	-50.2	173.8	175.7	0	0	0	0	110.9	M309 L313 T314 N315 H316 R320 R321 H322	M309-V318 HydrophobicContact CE-CG1 4.36Å; M309-V318 HydrophobicContact CE-CG2 4.46Å; M309-V318 HydrophobicContact SD-CB 4.49Å; M309-V318 HydrophobicContact SD-CG1 4.06Å; M309-V318 HydrophobicContact SD-CG2 4.04Å; L313-V318 HydrophobicContact CB-CG2 3.88Å; L313-V318 HydrophobicContact CD1-CG2 4.43Å; T314-V318 PolarHBondContact O-N 3.2Å; N315-V318 PolarHBondContact O-N 3.27Å; H316-V318 PolarHBondContact O-N 2.89Å; V318-R320 PolarHBondContact O-N 3.17Å; V318-R321 WeakPolarHBondContact O-CB 3.42Å; V318-R321 PolarHBondContact O-N 2.88Å; V318-H322 PolarHBondContact O-CD2 2.96Å; V318-H322 PolarHBondContact O-N 3.44Å
319	V	91.4	Very high	89	Confident	58 Å²	58	61.7 Å²	61.7	35%	0.352	35%	0.346	S	S	.	.	H	α-helix	trans	-61.9	-43.2	177.4	173.6	0	0	0	0	111.6	N315 H316 R321 H322 I323 N478	N315-V319 WeakPolarHBondContact O-CG2 3.31Å; N315-V319 PolarHBondContact O-N 2.88Å; H316-V319 PolarHBondContact O-N 3.3Å; V319-R321 VanDerWaalsContact C-N 3.32Å; V319-R321 PolarHBondContact O-N 3.31Å; V319-H322 PolarHBondContact O-N 3.46Å; V319-I323 HydrophobicContact CG1-CD1 3.82Å; V319-I323 HydrophobicContact CG1-CG1 4.46Å; V319-I323 WeakPolarHBondContact O-CG1 3.12Å; V319-I323 PolarHBondContact O-N 2.76Å; V319-N478 HydrophobicContact CG1-CB 4.21Å; V319-N478 VanDerWaalsContact CG1-CG 3.49Å; V319-N478 WeakPolarHBondContact CG1-OD1 3.21Å
320	R	93.4	Very high	89.8	Confident	3 Å²	3	58.3 Å²	58.3	1%	0.011	33%	0.333	C	S	.	.	H	α-helix	trans	-60.8	-39	174.7	-69.5	177.4	79	-148.2	2	112.1	H316 Q317 V318 I323 L324 E394 M475 N478 T479 H483 D485	H316-R320 WeakPolarHBondContact O-CB 3.48Å; H316-R320 VanDerWaalsContact O-CG 3.22Å; H316-R320 WeakPolarHBondContact O-CG 3.29Å; H316-R320 PolarHBondContact O-N 3.04Å; Q317-R320 PolarHBondContact O-N 3.23Å; V318-R320 PolarHBondContact O-N 3.17Å; R320-I323 PolarHBondContact O-N 2.75Å; R320-L324 WeakPolarHBondContact O-CB 3.36Å; R320-L324 PolarHBondContact O-N 3.24Å; R320-E394 IonicContact CZ-OE2 3.73Å; R320-E394 IonicContact NH1-OE2 2.69Å; R320-E394 PolarHBondContact NH1-OE2 3.36Å; R320-E394 PolarHBondContact NH2-O 2.83Å; R320-M475 HydrophobicContact CB-SD 3.8Å; R320-M475 HydrophobicContact CG-SD 3.76Å; R320-M475 WeakPolarHBondContact O-CE 3.46Å; R320-N478 HydrophobicContact CG-CB 3.98Å; R320-T479 PolarHBondContact NE-OG1 3.29Å; R320-H483 PolarHBondContact NH1-CE1 2.84Å; R320-H483 PolarHBondContact NH1-NE2 3.02Å; R320-H483 VanDerWaalsContact NH1-NE2 3.12Å; R320-H483 PolarHBondContact NH2-CE1 2.7Å; R320-D485 IonicContact NH2-OD2 3.29Å
321	R	91.9	Very high	90.5	Very high	14 Å²	14	56 Å²	56	5%	0.053	32%	0.318	C	S	.	.	H	α-helix	trans	-60	-45.2	173.3	-172	-174.7	-155.2	76	0	111.8	L306 S307 Q317 V318 V319 L324 G325 D391	L306-R321 HydrophobicContact CD1-CG 4.13Å; S307-R321 PolarHBondContact O-NH2 3.02Å; S307-R321 PolarHBondContact OG-NH2 3.25Å; Q317-R321 WeakPolarHBondContact O-CB 3.27Å; Q317-R321 PolarHBondContact O-N 2.99Å; V318-R321 WeakPolarHBondContact O-CB 3.42Å; V318-R321 PolarHBondContact O-N 2.88Å; V319-R321 VanDerWaalsContact C-N 3.32Å; V319-R321 PolarHBondContact O-N 3.31Å; R321-L324 PolarHBondContact O-N 2.88Å; R321-G325 PolarHBondContact O-N 3.49Å; R321-D391 IonicContact CZ-OD1 3.56Å; R321-D391 IonicContact NH1-OD1 2.65Å; R321-D391 PolarHBondContact NH1-OD1 3.46Å; R321-D391 IonicContact NH2-OD1 3.6Å; R321-D391 IonicContact NH2-OD2 3.71Å
322	H	92.5	Very high	91.1	Very high	116 Å²	116	51.8 Å²	51.8	54%	0.537	29%	0.293	S	S	.	.	H	α-helix	trans	-64	-42.4	177	-69.4	-65.4	0	0	0	112.3	V318 V319 L324 G325 S326	V318-H322 PolarHBondContact O-CD2 2.96Å; V318-H322 PolarHBondContact O-N 3.44Å; V319-H322 PolarHBondContact O-N 3.46Å; H322-L324 VanDerWaalsContact C-N 3.34Å; H322-L324 PolarHBondContact O-N 2.9Å; H322-G325 WeakPolarHBondContact O-CA 3.41Å; H322-G325 PolarHBondContact O-N 2.79Å; H322-G325 VanDerWaalsContact O-N 3.13Å; H322-S326 PolarHBondContact O-N 2.92Å; H322-S326 PolarHBondContact O-OG 3.02Å
323	I	94.4	Very high	91.7	Very high	18 Å²	18	50 Å²	50	9%	0.092	27%	0.267	C	S	.	.	H	α-helix	trans	-63.1	-40.8	176.5	-61.7	161	0	0	0	110.8	V319 R320 G325 S326 I327 L471 D474 M475 N478	V319-I323 HydrophobicContact CG1-CD1 3.82Å; V319-I323 HydrophobicContact CG1-CG1 4.46Å; V319-I323 WeakPolarHBondContact O-CG1 3.12Å; V319-I323 PolarHBondContact O-N 2.76Å; R320-I323 PolarHBondContact O-N 2.75Å; I323-G325 VanDerWaalsContact C-N 3.35Å; I323-G325 PolarHBondContact O-N 3.31Å; I323-S326 WeakPolarHBondContact O-CB 3.38Å; I323-S326 PolarHBondContact O-N 3Å; I323-I327 HydrophobicContact CG2-CD1 4.35Å; I323-I327 WeakPolarHBondContact O-CG1 3.27Å; I323-I327 PolarHBondContact O-N 3.12Å; I323-L471 WeakPolarHBondContact CG2-O 3.45Å; I323-D474 HydrophobicContact CD1-CB 4.04Å; I323-M475 HydrophobicContact CB-CE 4.05Å; I323-M475 HydrophobicContact CG2-CB 4.11Å; I323-M475 HydrophobicContact CG2-CE 3.95Å; I323-N478 HydrophobicContact CD1-CB 4.44Å
324	L	94.3	Very high	92.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.4	-40.4	172.5	178	58.9	0	0	0	112	L306 R320 R321 H322 S326 I327 I328 L383 V387 W390 I396 M475	L306-L324 HydrophobicContact CD2-CD2 3.97Å; L306-L324 HydrophobicContact CD2-CG 4.48Å; R320-L324 WeakPolarHBondContact O-CB 3.36Å; R320-L324 PolarHBondContact O-N 3.24Å; R321-L324 PolarHBondContact O-N 2.88Å; H322-L324 VanDerWaalsContact C-N 3.34Å; H322-L324 PolarHBondContact O-N 2.9Å; L324-S326 VanDerWaalsContact C-N 3.31Å; L324-S326 PolarHBondContact O-N 3.01Å; L324-I327 WeakPolarHBondContact O-CB 3.4Å; L324-I327 PolarHBondContact O-N 3.38Å; L324-I328 HydrophobicContact CD1-CD1 4.21Å; L324-I328 HydrophobicContact CD1-CG1 4.24Å; L324-I328 HydrophobicContact CG-CD1 3.94Å; L324-I328 HydrophobicContact CG-CG1 4.46Å; L324-I328 WeakPolarHBondContact O-CD1 3.22Å; L324-I328 VanDerWaalsContact O-CG1 3.25Å; L324-I328 WeakPolarHBondContact O-CG1 3.33Å; L324-I328 PolarHBondContact O-N 3.03Å; L324-L383 HydrophobicContact CD1-CD1 4.26Å; L324-V387 HydrophobicContact CD1-CG2 4.5Å; L324-V387 HydrophobicContact CD2-CG2 4.5Å; L324-W390 HydrophobicContact CD2-CB 4.38Å; L324-W390 HydrophobicContact CD2-CD2 3.24Å; L324-W390 HydrophobicContact CD2-CE3 3.39Å; L324-W390 HydrophobicContact CD2-CG 3.68Å; L324-W390 HydrophobicContact CD2-CH2 4.12Å; L324-W390 HydrophobicContact CD2-CZ2 4.02Å; L324-W390 HydrophobicContact CD2-CZ3 3.82Å; L324-I396 HydrophobicContact CD1-CD1 4.3Å; L324-I396 HydrophobicContact CD1-CG1 4.35Å; L324-M475 HydrophobicContact CB-CE 4.12Å
325	G	93.5	Very high	92.8	Very high	23 Å²	23	44.7 Å²	44.7	24%	0.237	24%	0.236	C	C	.	.	H	α-helix	trans	-55.2	-44.7	171.1	0	0	0	0	0	112.7	R321 H322 I323 I328 Q329	R321-G325 PolarHBondContact O-N 3.49Å; H322-G325 WeakPolarHBondContact O-CA 3.41Å; H322-G325 PolarHBondContact O-N 2.79Å; H322-G325 VanDerWaalsContact O-N 3.13Å; I323-G325 VanDerWaalsContact C-N 3.35Å; I323-G325 PolarHBondContact O-N 3.31Å; G325-I328 PolarHBondContact O-N 3.22Å; G325-Q329 WeakPolarHBondContact O-CB 3.49Å; G325-Q329 PolarHBondContact O-N 2.87Å
326	S	95.5	Very high	93.1	Very high	63 Å²	63	41.9 Å²	41.9	44%	0.441	22%	0.218	S	C	.	.	H	α-helix	trans	-65.7	-37.2	174.9	-64.1	0	0	0	0	113.3	H322 I323 L324 S330	H322-S326 PolarHBondContact O-N 2.92Å; H322-S326 PolarHBondContact O-OG 3.02Å; I323-S326 WeakPolarHBondContact O-CB 3.38Å; I323-S326 PolarHBondContact O-N 3Å; L324-S326 VanDerWaalsContact C-N 3.31Å; L324-S326 PolarHBondContact O-N 3.01Å; S326-S330 WeakPolarHBondContact O-CB 3.43Å; S326-S330 PolarHBondContact O-N 2.97Å; S326-S330 PolarHBondContact O-OG 3.42Å
327	I	95.4	Very high	93.5	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-50.4	172.1	-69.3	166.6	0	0	0	110.1	I323 L324 S330 E331 F400 L471 L472 M475	I323-I327 HydrophobicContact CG2-CD1 4.35Å; I323-I327 WeakPolarHBondContact O-CG1 3.27Å; I323-I327 PolarHBondContact O-N 3.12Å; L324-I327 WeakPolarHBondContact O-CB 3.4Å; L324-I327 PolarHBondContact O-N 3.38Å; I327-S330 PolarHBondContact O-OG 2.85Å; I327-S330 VanDerWaalsContact O-OG 3.07Å; I327-E331 VanDerWaalsContact O-CB 3.32Å; I327-E331 WeakPolarHBondContact O-CB 3.46Å; I327-E331 PolarHBondContact O-N 3.11Å; I327-F400 HydrophobicContact CG2-CE2 4.37Å; I327-F400 HydrophobicContact CG2-CZ 3.95Å; I327-L471 HydrophobicContact CD1-CB 4.38Å; I327-L471 HydrophobicContact CG1-CB 3.92Å; I327-L471 HydrophobicContact CG1-CD1 3.98Å; I327-L471 HydrophobicContact CG1-CG 4.37Å; I327-L472 HydrophobicContact CD1-CD2 4.14Å; I327-M475 HydrophobicContact CD1-CE 4.37Å
328	I	94.1	Very high	93.9	Very high	13 Å²	13	34.9 Å²	34.9	7%	0.067	19%	0.186	C	C	.	.	H	α-helix	trans	-57.8	-52.9	178.7	-68.8	163	0	0	0	111.3	P304 L306 L324 G325 E331 R332 L383 V387	P304-I328 HydrophobicContact CB-CG1 4.4Å; P304-I328 HydrophobicContact CB-CG2 3.96Å; P304-I328 HydrophobicContact CG-CG2 3.99Å; P304-I328 VanDerWaalsContact O-CG2 3.24Å; P304-I328 WeakPolarHBondContact O-CG2 3.37Å; L306-I328 HydrophobicContact CD1-CD1 4.1Å; L306-I328 HydrophobicContact CD2-CD1 4.48Å; L306-I328 HydrophobicContact CG-CD1 3.92Å; L324-I328 HydrophobicContact CD1-CD1 4.21Å; L324-I328 HydrophobicContact CD1-CG1 4.24Å; L324-I328 HydrophobicContact CG-CD1 3.94Å; L324-I328 HydrophobicContact CG-CG1 4.46Å; L324-I328 WeakPolarHBondContact O-CD1 3.22Å; L324-I328 VanDerWaalsContact O-CG1 3.25Å; L324-I328 WeakPolarHBondContact O-CG1 3.33Å; L324-I328 PolarHBondContact O-N 3.03Å; G325-I328 PolarHBondContact O-N 3.22Å; I328-E331 PolarHBondContact O-N 2.96Å; I328-R332 WeakPolarHBondContact O-CB 3.43Å; I328-R332 PolarHBondContact O-N 3.01Å; I328-L383 HydrophobicContact CG1-CD1 4.41Å; I328-L383 HydrophobicContact CG1-CD2 4.08Å; I328-L383 HydrophobicContact CG1-CG 4.35Å; I328-V387 HydrophobicContact CD1-CG1 4.09Å; I328-V387 HydrophobicContact CD1-CG2 3.57Å; I328-V387 HydrophobicContact CG1-CG2 4.05Å
329	Q	93.9	Very high	94.1	Very high	108 Å²	108	35.2 Å²	35.2	51%	0.505	18%	0.184	S	C	.	.	H	α-helix	trans	-69.6	-36.9	-174.7	-178.5	59.8	6.4	0	0	112.1	G325 E331 S333	G325-Q329 WeakPolarHBondContact O-CB 3.49Å; G325-Q329 PolarHBondContact O-N 2.87Å; Q329-E331 VanDerWaalsContact C-N 3.34Å; Q329-S333 WeakPolarHBondContact O-CB 3.36Å; Q329-S333 PolarHBondContact O-N 3.3Å
330	S	95.5	Very high	94.1	Very high	32 Å²	32	34 Å²	34	22%	0.224	17%	0.173	C	C	.	.	H	α-helix	trans	-67	-35.4	173.9	71.7	0	0	0	0	112.2	S326 I327 Y334 R464	S326-S330 WeakPolarHBondContact O-CB 3.43Å; S326-S330 PolarHBondContact O-N 2.97Å; S326-S330 PolarHBondContact O-OG 3.42Å; I327-S330 PolarHBondContact O-OG 2.85Å; I327-S330 VanDerWaalsContact O-OG 3.07Å; S330-Y334 WeakPolarHBondContact O-CB 3.41Å; S330-Y334 PolarHBondContact O-N 3.08Å; S330-R464 PolarHBondContact OG-NH1 3.26Å; S330-R464 PolarHBondContact OG-NH2 3.44Å; S330-R464 VanDerWaalsContact OG-NH2 3.08Å
331	E	95.4	Very high	94.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-71.3	-41.4	177.8	-174.5	57.6	-160.5	0	0	112	I327 I328 Q329 Y334 L335 H376 F379 R464 F468	I327-E331 VanDerWaalsContact O-CB 3.32Å; I327-E331 WeakPolarHBondContact O-CB 3.46Å; I327-E331 PolarHBondContact O-N 3.11Å; I328-E331 PolarHBondContact O-N 2.96Å; Q329-E331 VanDerWaalsContact C-N 3.34Å; E331-Y334 PolarHBondContact O-N 2.82Å; E331-L335 HydrophobicContact CG-CD1 4.37Å; E331-L335 PolarHBondContact O-N 3.25Å; E331-H376 WeakPolarHBondContact OE1-CB 3.18Å; E331-H376 IonicContact OE1-CE1 2.94Å; E331-H376 IonicContact OE1-CG 3.19Å; E331-H376 IonicContact OE1-ND1 3.47Å; E331-H376 PolarHBondContact OE1-ND1 3.29Å; E331-H376 IonicContact OE2-CE1 3.89Å; E331-H376 IonicContact OE2-ND1 2.85Å; E331-H376 PolarHBondContact OE2-ND1 3.35Å; E331-F379 HydrophobicContact CG-CD1 3.89Å; E331-F379 HydrophobicContact CG-CE1 3.96Å; E331-R464 VanDerWaalsContact N-NH2 3.11Å; E331-R464 IonicContact OE2-CZ 3.71Å; E331-R464 IonicContact OE2-NE 3.23Å; E331-R464 PolarHBondContact OE2-NE 3.24Å; E331-R464 VanDerWaalsContact OE2-NE 3.13Å; E331-R464 IonicContact OE2-NH2 2.69Å; E331-R464 PolarHBondContact OE2-NH2 3.36Å; E331-F468 WeakPolarHBondContact OE2-CZ 3.31Å
332	R	93.4	Very high	94.3	Very high	108 Å²	108	34.8 Å²	34.8	41%	0.408	18%	0.178	S	C	.	.	H	α-helix	trans	-56.7	-54	170.7	178.5	179.3	173.6	177.8	-1.2	111.2	I328 Y334 L335 E336	I328-R332 WeakPolarHBondContact O-CB 3.43Å; I328-R332 PolarHBondContact O-N 3.01Å; R332-Y334 VanDerWaalsContact C-N 3.29Å; R332-Y334 PolarHBondContact O-N 3.11Å; R332-L335 PolarHBondContact O-N 3.36Å; R332-E336 HydrophobicContact CG-CG 4.47Å; R332-E336 WeakPolarHBondContact CG-OE1 3.42Å; R332-E336 IonicContact CZ-OE1 3.63Å; R332-E336 IonicContact NE-OE1 2.78Å; R332-E336 PolarHBondContact NE-OE1 2.89Å; R332-E336 IonicContact NH2-OE1 2.84Å; R332-E336 PolarHBondContact NH2-OE1 2.89Å; R332-E336 WeakPolarHBondContact O-CB 3.45Å; R332-E336 WeakPolarHBondContact O-CG 3.5Å; R332-E336 PolarHBondContact O-N 2.87Å
333	S	93.4	Very high	94.3	Very high	48 Å²	48	35.2 Å²	35.2	34%	0.336	18%	0.181	S	C	.	.	H	α-helix	trans	-62.1	-35.8	179.8	-176.5	0	0	0	0	112.6	Q329 S337	Q329-S333 WeakPolarHBondContact O-CB 3.36Å; Q329-S333 PolarHBondContact O-N 3.3Å; S333-S337 WeakPolarHBondContact O-CB 3.47Å; S333-S337 PolarHBondContact O-N 3.11Å; S333-S337 PolarHBondContact O-OG 3.12Å
334	Y	96	Very high	94.1	Very high	7 Å²	7	37 Å²	37	3%	0.027	19%	0.189	C	C	.	.	H	α-helix	trans	-65.3	-49.2	175.3	178.5	-119.4	0	0	0	111.8	S330 E331 R332 S337 L338 I372 H376 Y413 K460 P461 R464	S330-Y334 WeakPolarHBondContact O-CB 3.41Å; S330-Y334 PolarHBondContact O-N 3.08Å; E331-Y334 PolarHBondContact O-N 2.82Å; R332-Y334 VanDerWaalsContact C-N 3.29Å; R332-Y334 PolarHBondContact O-N 3.11Å; Y334-S337 WeakPolarHBondContact O-CA 3.06Å; Y334-S337 VanDerWaalsContact O-CB 3.31Å; Y334-S337 WeakPolarHBondContact O-CB 3.44Å; Y334-S337 PolarHBondContact O-N 2.83Å; Y334-S337 VanDerWaalsContact O-N 3.13Å; Y334-L338 HydrophobicContact CD1-CD1 4.19Å; Y334-L338 HydrophobicContact CE1-CD1 3.64Å; Y334-L338 HydrophobicContact CE1-CG 4.37Å; Y334-L338 HydrophobicContact CE2-CD1 4.27Å; Y334-L338 HydrophobicContact CE2-CD2 4.24Å; Y334-L338 HydrophobicContact CE2-CG 4.15Å; Y334-L338 WeakPolarHBondContact O-CG 3.43Å; Y334-L338 PolarHBondContact O-N 3.35Å; Y334-I372 WeakPolarHBondContact OH-CG2 3.37Å; Y334-H376 AromaticContact CD1-CE1 3.98Å; Y334-H376 AromaticContact CD1-ND1 3.63Å; Y334-H376 HydrophobicContact CE1-CB 4.35Å; Y334-H376 AromaticContact CE1-CD2 3.73Å; Y334-H376 AromaticContact CE1-CE1 3.58Å; Y334-H376 AromaticContact CE1-CG 3.59Å; Y334-H376 AromaticContact CE1-ND1 3.5Å; Y334-H376 AromaticContact CE1-NE2 3.72Å; Y334-Y413 PolarHBondContact OH-OH 3.45Å; Y334-K460 HydrophobicContact CD2-CB 4.07Å; Y334-K460 HydrophobicContact CE2-CB 3.99Å; Y334-P461 HydrophobicContact CE2-CG 4.29Å; Y334-P461 WeakPolarHBondContact OH-CA 3.45Å; Y334-P461 WeakPolarHBondContact OH-CB 3.35Å; Y334-R464 HydrophobicContact CD1-CG 3.96Å; Y334-R464 HydrophobicContact CE1-CB 4.38Å; Y334-R464 HydrophobicContact CE1-CG 3.82Å; Y334-R464 HydrophobicContact CE2-CB 4.28Å; Y334-R464 HydrophobicContact CE2-CG 4.39Å; Y334-R464 HydrophobicContact CG-CG 4.31Å
335	L	94.7	Very high	94	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-65.6	-38.5	176.6	-83.7	164.8	0	0	0	112.9	E331 R332 S337 L338 R339 T373 H376 Q380	E331-L335 HydrophobicContact CG-CD1 4.37Å; E331-L335 PolarHBondContact O-N 3.25Å; R332-L335 PolarHBondContact O-N 3.36Å; L335-S337 VanDerWaalsContact C-N 3.29Å; L335-S337 PolarHBondContact O-N 2.84Å; L335-L338 HydrophobicContact CD2-CD1 4.36Å; L335-L338 PolarHBondContact O-N 3.2Å; L335-R339 WeakPolarHBondContact O-CB 3.34Å; L335-R339 VanDerWaalsContact O-CG 3.29Å; L335-R339 WeakPolarHBondContact O-CG 3.47Å; L335-R339 PolarHBondContact O-N 2.6Å; L335-T373 HydrophobicContact CD2-CG2 4.12Å; L335-H376 HydrophobicContact CD1-CB 4.28Å; L335-H376 HydrophobicContact CD2-CB 3.63Å; L335-H376 HydrophobicContact CG-CB 3.97Å; L335-Q380 HydrophobicContact CD1-CB 3.6Å; L335-Q380 HydrophobicContact CD1-CG 4.15Å
336	E	93.3	Very high	94	Very high	79 Å²	79	37.2 Å²	37.2	37%	0.369	18%	0.184	S	C	.	.	H	α-helix	trans	-59.4	-40.3	170.3	-73.5	168.1	172.3	0	0	111.3	R332 R339 R340	R332-E336 HydrophobicContact CG-CG 4.47Å; R332-E336 WeakPolarHBondContact CG-OE1 3.42Å; R332-E336 IonicContact CZ-OE1 3.63Å; R332-E336 IonicContact NE-OE1 2.78Å; R332-E336 PolarHBondContact NE-OE1 2.89Å; R332-E336 IonicContact NH2-OE1 2.84Å; R332-E336 PolarHBondContact NH2-OE1 2.89Å; R332-E336 WeakPolarHBondContact O-CB 3.45Å; R332-E336 WeakPolarHBondContact O-CG 3.5Å; R332-E336 PolarHBondContact O-N 2.87Å; E336-R339 PolarHBondContact O-N 2.76Å; E336-R340 WeakPolarHBondContact O-CB 3.13Å; E336-R340 PolarHBondContact O-N 2.94Å
337	S	94.4	Very high	93.8	Very high	6 Å²	6	41 Å²	41	4%	0.042	19%	0.188	C	C	.	.	H	α-helix	trans	-64.4	-42.2	174.7	-55	0	0	0	0	112.6	S333 Y334 L335 R340 I341 K460	S333-S337 WeakPolarHBondContact O-CB 3.47Å; S333-S337 PolarHBondContact O-N 3.11Å; S333-S337 PolarHBondContact O-OG 3.12Å; Y334-S337 WeakPolarHBondContact O-CA 3.06Å; Y334-S337 VanDerWaalsContact O-CB 3.31Å; Y334-S337 WeakPolarHBondContact O-CB 3.44Å; Y334-S337 PolarHBondContact O-N 2.83Å; Y334-S337 VanDerWaalsContact O-N 3.13Å; L335-S337 VanDerWaalsContact C-N 3.29Å; L335-S337 PolarHBondContact O-N 2.84Å; S337-R340 WeakPolarHBondContact O-CB 3.08Å; S337-R340 PolarHBondContact O-N 2.78Å; S337-I341 WeakPolarHBondContact O-CG1 3.11Å; S337-I341 PolarHBondContact O-N 2.83Å; S337-I341 VanDerWaalsContact O-N 3.12Å; S337-K460 VanDerWaalsContact CB-CD 3.49Å; S337-K460 WeakPolarHBondContact OG-CD 3.27Å; S337-K460 WeakPolarHBondContact OG-CE 3.47Å; S337-K460 PolarHBondContact OG-NZ 3.17Å
338	L	95.4	Very high	93.7	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-65.9	-45.1	176.3	-70.6	178.9	0	0	0	112.1	Y334 L335 R340 I341 L342 I372 T373 P461	Y334-L338 HydrophobicContact CD1-CD1 4.19Å; Y334-L338 HydrophobicContact CE1-CD1 3.64Å; Y334-L338 HydrophobicContact CE1-CG 4.37Å; Y334-L338 HydrophobicContact CE2-CD1 4.27Å; Y334-L338 HydrophobicContact CE2-CD2 4.24Å; Y334-L338 HydrophobicContact CE2-CG 4.15Å; Y334-L338 WeakPolarHBondContact O-CG 3.43Å; Y334-L338 PolarHBondContact O-N 3.35Å; L335-L338 HydrophobicContact CD2-CD1 4.36Å; L335-L338 PolarHBondContact O-N 3.2Å; L338-R340 PolarHBondContact O-N 2.79Å; L338-I341 HydrophobicContact CD2-CD1 4.35Å; L338-I341 PolarHBondContact O-N 3.2Å; L338-L342 PolarHBondContact O-N 2.97Å; L338-L342 VanDerWaalsContact O-N 3.15Å; L338-I372 HydrophobicContact CD1-CG2 3.94Å; L338-I372 HydrophobicContact CD2-CG2 4.35Å; L338-T373 HydrophobicContact CB-CG2 4.21Å; L338-P461 HydrophobicContact CD2-CG 4.1Å
339	R	93.9	Very high	93.5	Very high	42 Å²	42	42.2 Å²	42.2	16%	0.158	20%	0.196	C	C	.	.	H	α-helix	trans	-55.1	-41.8	171.4	-71.8	177.1	-171.1	105.7	-0.3	110.3	E298 L335 E336 L342 Q343	E298-R339 IonicContact OE1-CZ 2.93Å; E298-R339 IonicContact OE1-NE 3.61Å; E298-R339 PolarHBondContact OE1-NE 2.63Å; E298-R339 IonicContact OE1-NH2 3.57Å; E298-R339 PolarHBondContact OE1-NH2 2.68Å; E298-R339 IonicContact OE2-NE 2.67Å; L335-R339 WeakPolarHBondContact O-CB 3.34Å; L335-R339 VanDerWaalsContact O-CG 3.29Å; L335-R339 WeakPolarHBondContact O-CG 3.47Å; L335-R339 PolarHBondContact O-N 2.6Å; E336-R339 PolarHBondContact O-N 2.76Å; R339-L342 PolarHBondContact O-N 3.44Å; R339-Q343 VanDerWaalsContact O-CB 3.3Å; R339-Q343 WeakPolarHBondContact O-CB 3.44Å; R339-Q343 VanDerWaalsContact O-CG 3.29Å; R339-Q343 WeakPolarHBondContact O-CG 3.15Å; R339-Q343 PolarHBondContact O-N 2.81Å
340	R	92.7	Very high	93.3	Very high	32 Å²	32	40.5 Å²	40.5	12%	0.121	19%	0.189	C	C	.	.	H	α-helix	trans	-61.6	-43.9	177.4	-156.5	165.6	100.7	-145	12.1	113.1	E336 S337 L338 L342 Q343 E344 S448 D450 I452	E336-R340 WeakPolarHBondContact O-CB 3.13Å; E336-R340 PolarHBondContact O-N 2.94Å; S337-R340 WeakPolarHBondContact O-CB 3.08Å; S337-R340 PolarHBondContact O-N 2.78Å; L338-R340 PolarHBondContact O-N 2.79Å; R340-L342 VanDerWaalsContact C-N 3.29Å; R340-L342 PolarHBondContact O-N 3.1Å; R340-Q343 PolarHBondContact O-N 2.93Å; R340-E344 WeakPolarHBondContact CD-OE1 3.31Å; R340-E344 WeakPolarHBondContact CD-OE2 3.49Å; R340-E344 HydrophobicContact CG-CB 4.17Å; R340-E344 HydrophobicContact CG-CG 3.9Å; R340-E344 WeakPolarHBondContact CG-OE1 3.24Å; R340-E344 VanDerWaalsContact CG-OE2 3.28Å; R340-E344 WeakPolarHBondContact CG-OE2 3.32Å; R340-E344 IonicContact NE-OE2 2.7Å; R340-E344 WeakPolarHBondContact O-CB 3.3Å; R340-E344 PolarHBondContact O-N 3.22Å; R340-S448 PolarHBondContact NH2-OG 2.92Å; R340-D450 IonicContact CZ-OD1 2.78Å; R340-D450 IonicContact CZ-OD2 3.42Å; R340-D450 VanDerWaalsContact NH1-CG 3.29Å; R340-D450 IonicContact NH1-OD1 3.13Å; R340-D450 PolarHBondContact NH1-OD1 2.97Å; R340-D450 VanDerWaalsContact NH1-OD1 3.17Å; R340-D450 IonicContact NH1-OD2 2.83Å; R340-D450 PolarHBondContact NH1-OD2 2.89Å; R340-D450 IonicContact NH2-OD1 3.36Å; R340-D450 PolarHBondContact NH2-OD1 2.79Å; R340-D450 IonicContact NH2-OD2 2.77Å; R340-I452 PolarHBondContact NH2-O 3.09Å
341	I	94.3	Very high	93	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	20%	0.204	C	C	.	.	I	π-helix	trans	-56.1	-45.4	173.6	-62.7	168.5	0	0	0	110.6	S337 L338 Y345 H346 F366 I369 L457 M458	S337-I341 WeakPolarHBondContact O-CG1 3.11Å; S337-I341 PolarHBondContact O-N 2.83Å; S337-I341 VanDerWaalsContact O-N 3.12Å; L338-I341 HydrophobicContact CD2-CD1 4.35Å; L338-I341 PolarHBondContact O-N 3.2Å; I341-Y345 WeakPolarHBondContact O-CB 3.38Å; I341-Y345 PolarHBondContact O-N 3.37Å; I341-H346 PolarHBondContact O-N 3.41Å; I341-F366 HydrophobicContact CG2-CD1 3.58Å; I341-F366 HydrophobicContact CG2-CE1 3.75Å; I341-I369 HydrophobicContact CB-CG2 4.46Å; I341-I369 HydrophobicContact CD1-CD1 4.23Å; I341-I369 HydrophobicContact CG2-CG1 4.42Å; I341-I369 HydrophobicContact CG2-CG2 4.08Å; I341-L457 HydrophobicContact CD1-CB 3.95Å; I341-L457 HydrophobicContact CG1-CB 3.73Å; I341-L457 HydrophobicContact CG1-CD1 4.22Å; I341-M458 HydrophobicContact CD1-CG 4.22Å
342	L	93.7	Very high	92.5	Very high	33 Å²	33	45.4 Å²	45.4	17%	0.173	21%	0.212	C	C	.	.	I	π-helix	trans	-72.2	-42.8	-177.7	-70	174	0	0	0	113.4	L338 R339 R340 R347 I369 R370 T373	L338-L342 PolarHBondContact O-N 2.97Å; L338-L342 VanDerWaalsContact O-N 3.15Å; R339-L342 PolarHBondContact O-N 3.44Å; R340-L342 VanDerWaalsContact C-N 3.29Å; R340-L342 PolarHBondContact O-N 3.1Å; L342-R347 WeakPolarHBondContact O-CB 3.49Å; L342-R347 PolarHBondContact O-N 3.45Å; L342-I369 HydrophobicContact CD1-CG2 4.25Å; L342-I369 HydrophobicContact CD2-CB 4.41Å; L342-I369 HydrophobicContact CD2-CG2 3.72Å; L342-I369 HydrophobicContact CG-CG2 3.77Å; L342-R370 HydrophobicContact CD1-CG 4.27Å; L342-R370 HydrophobicContact CD2-CG 3.74Å; L342-T373 HydrophobicContact CD1-CG2 4.38Å
343	Q	92.3	Very high	91.6	Very high	126 Å²	126	48.8 Å²	48.8	59%	0.589	23%	0.232	S	C	*	.	I	π-helix	trans	-89.6	-35.4	-170.7	-65.3	177.3	3.6	0	0	113.9	R339 R340 P348	R339-Q343 VanDerWaalsContact O-CB 3.3Å; R339-Q343 WeakPolarHBondContact O-CB 3.44Å; R339-Q343 VanDerWaalsContact O-CG 3.29Å; R339-Q343 WeakPolarHBondContact O-CG 3.15Å; R339-Q343 PolarHBondContact O-N 2.81Å; R340-Q343 PolarHBondContact O-N 2.93Å; Q343-P348 WeakPolarHBondContact O-CD 3.39Å; Q343-P348 WeakPolarHBondContact O-CG 3.34Å
344	E	91.4	Very high	91	Very high	56 Å²	56	52.4 Å²	52.4	26%	0.262	26%	0.255	S	S	.	.	I	π-helix	trans	-97.1	-27.4	-177.8	-70.7	-179.5	-162.5	0	0	113.9	R340 P348 K444	R340-E344 WeakPolarHBondContact CD-OE1 3.31Å; R340-E344 WeakPolarHBondContact CD-OE2 3.49Å; R340-E344 HydrophobicContact CG-CB 4.17Å; R340-E344 HydrophobicContact CG-CG 3.9Å; R340-E344 WeakPolarHBondContact CG-OE1 3.24Å; R340-E344 VanDerWaalsContact CG-OE2 3.28Å; R340-E344 WeakPolarHBondContact CG-OE2 3.32Å; R340-E344 IonicContact NE-OE2 2.7Å; R340-E344 WeakPolarHBondContact O-CB 3.3Å; R340-E344 PolarHBondContact O-N 3.22Å; E344-P348 WeakPolarHBondContact O-CG 3.2Å; E344-K444 HydrophobicContact CB-CD 4.34Å; E344-K444 WeakPolarHBondContact O-CE 3.41Å; E344-K444 PolarHBondContact O-NZ 2.92Å
345	Y	92.4	Very high	90.5	Very high	1 Å²	1	59.7 Å²	59.7	0%	0.004	28%	0.282	C	S	.	.	I	π-helix	trans	-110.5	-66.6	-176.5	-63.2	-92.2	0	0	0	112.2	I341 R347 L349 F440 L441 K444 L454 L457	I341-Y345 WeakPolarHBondContact O-CB 3.38Å; I341-Y345 PolarHBondContact O-N 3.37Å; Y345-R347 PolarHBondContact O-N 2.88Å; Y345-L349 VanDerWaalsContact O-CB 3.3Å; Y345-L349 WeakPolarHBondContact O-CB 3.37Å; Y345-L349 WeakPolarHBondContact O-CD1 3.47Å; Y345-L349 WeakPolarHBondContact O-CG 3.43Å; Y345-L349 PolarHBondContact O-N 3.15Å; Y345-F440 HydrophobicContact CD1-CE1 4.11Å; Y345-L441 HydrophobicContact CD1-CD2 3.76Å; Y345-L441 HydrophobicContact CE1-CD2 3.75Å; Y345-K444 HydrophobicContact CD1-CB 4.47Å; Y345-K444 HydrophobicContact CE1-CB 3.69Å; Y345-K444 HydrophobicContact CE1-CG 4.34Å; Y345-L454 HydrophobicContact CD1-CB 4.21Å; Y345-L454 HydrophobicContact CD1-CD1 4.03Å; Y345-L454 HydrophobicContact CD1-CD2 3.97Å; Y345-L454 HydrophobicContact CD1-CG 4.29Å; Y345-L454 HydrophobicContact CD2-CD1 4.15Å; Y345-L454 HydrophobicContact CE1-CB 3.92Å; Y345-L454 HydrophobicContact CE1-CD1 4.43Å; Y345-L454 HydrophobicContact CE1-CD2 4.48Å; Y345-L454 HydrophobicContact CG-CD1 3.87Å; Y345-L454 HydrophobicContact CG-CD2 4.48Å; Y345-L457 HydrophobicContact CD2-CD1 4.31Å; Y345-L457 HydrophobicContact CE2-CD1 3.68Å
346	H	93.1	Very high	90.1	Very high	26 Å²	26	61 Å²	61	12%	0.12	29%	0.289	C	S	.	.	I	π-helix	trans	-58.1	-54	-175.6	169.7	-77.2	0	0	0	112.1	I341 L349 M350 F366 R370	I341-H346 PolarHBondContact O-N 3.41Å; H346-L349 PolarHBondContact O-N 2.75Å; H346-M350 WeakPolarHBondContact O-CG 3.3Å; H346-M350 PolarHBondContact O-N 3.1Å; H346-M350 VanDerWaalsContact O-N 3.12Å; H346-F366 HydrophobicContact CB-CB 4.46Å; H346-F366 HydrophobicContact CB-CD1 4.14Å; H346-F366 HydrophobicContact CB-CD2 4Å; H346-F366 HydrophobicContact CB-CE1 4.35Å; H346-F366 HydrophobicContact CB-CE2 4.23Å; H346-F366 HydrophobicContact CB-CG 3.95Å; H346-F366 HydrophobicContact CB-CZ 4.4Å; H346-F366 AromaticContact CD2-CD2 3.75Å; H346-F366 AromaticContact CD2-CG 3.89Å; H346-R370 PolarHBondContact CE1-NH2 3.35Å
347	R	92.1	Very high	89.9	Confident	143 Å²	143	57.5 Å²	57.5	54%	0.54	27%	0.273	S	S	.	.	H	α-helix	trans	-62.3	-51.4	-175.6	173.6	174.5	-169.1	178.7	7.7	112.1	L342 Y345 L349 M350 E351	L342-R347 WeakPolarHBondContact O-CB 3.49Å; L342-R347 PolarHBondContact O-N 3.45Å; Y345-R347 PolarHBondContact O-N 2.88Å; R347-L349 VanDerWaalsContact C-N 3.3Å; R347-L349 PolarHBondContact O-N 3.18Å; R347-M350 PolarHBondContact O-N 3.29Å; R347-M350 VanDerWaalsContact O-N 3.08Å; R347-E351 HydrophobicContact CG-CG 4.34Å; R347-E351 WeakPolarHBondContact CG-OE2 3.12Å; R347-E351 IonicContact CZ-OE1 3.17Å; R347-E351 VanDerWaalsContact CZ-OE1 3.26Å; R347-E351 IonicContact CZ-OE2 3.36Å; R347-E351 IonicContact NE-OE1 3.63Å; R347-E351 PolarHBondContact NE-OE1 3.11Å; R347-E351 IonicContact NE-OE2 2.73Å; R347-E351 PolarHBondContact NE-OE2 2.61Å; R347-E351 IonicContact NH2-OE1 2.81Å; R347-E351 PolarHBondContact NH2-OE1 2.63Å; R347-E351 IonicContact NH2-OE2 3.44Å; R347-E351 PolarHBondContact O-N 2.83Å
348	P	91.4	Very high	89.6	Confident	33 Å²	33	59.7 Å²	59.7	21%	0.214	29%	0.288	C	S	.	.	H	α-helix	trans	-65.4	-27.8	177.3	-26.4	39	0	0	0	113.9	Q343 E344 M350 A352 F440	Q343-P348 WeakPolarHBondContact O-CD 3.39Å; Q343-P348 WeakPolarHBondContact O-CG 3.34Å; E344-P348 WeakPolarHBondContact O-CG 3.2Å; P348-M350 VanDerWaalsContact C-N 3.32Å; P348-A352 WeakPolarHBondContact O-CB 3.23Å; P348-A352 PolarHBondContact O-N 2.64Å; P348-F440 HydrophobicContact CB-CE2 4.05Å; P348-F440 HydrophobicContact CB-CZ 4.11Å
349	L	90.9	Very high	89.3	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-70.3	-28.5	173	-73.3	168.1	0	0	0	113	Y345 H346 R347 I356 I362 F366 F437 F440	Y345-L349 VanDerWaalsContact O-CB 3.3Å; Y345-L349 WeakPolarHBondContact O-CB 3.37Å; Y345-L349 WeakPolarHBondContact O-CD1 3.47Å; Y345-L349 WeakPolarHBondContact O-CG 3.43Å; Y345-L349 PolarHBondContact O-N 3.15Å; H346-L349 PolarHBondContact O-N 2.75Å; R347-L349 VanDerWaalsContact C-N 3.3Å; R347-L349 PolarHBondContact O-N 3.18Å; L349-I356 HydrophobicContact CD2-CB 4.15Å; L349-I356 HydrophobicContact CD2-CD1 4.42Å; L349-I356 HydrophobicContact CD2-CG2 3.95Å; L349-I362 HydrophobicContact CB-CD1 4.02Å; L349-I362 HydrophobicContact CB-CG1 4.43Å; L349-I362 WeakPolarHBondContact O-CD1 3.44Å; L349-F366 HydrophobicContact CD1-CE2 3.89Å; L349-F366 HydrophobicContact CD1-CZ 3.94Å; L349-F437 HydrophobicContact CD1-CE2 3.91Å; L349-F437 HydrophobicContact CD2-CD2 3.84Å; L349-F437 HydrophobicContact CD2-CE2 3.84Å; L349-F440 HydrophobicContact CD1-CE1 4Å; L349-F440 HydrophobicContact CD2-CD1 3.85Å; L349-F440 HydrophobicContact CD2-CE1 3.7Å; L349-F440 HydrophobicContact CD2-CG 4.37Å; L349-F440 HydrophobicContact CD2-CZ 4.09Å; L349-F440 HydrophobicContact CG-CD1 4.33Å; L349-F440 HydrophobicContact CG-CE1 3.67Å; L349-F440 HydrophobicContact CG-CZ 3.88Å
350	M	89	Confident	89	Confident	72 Å²	72	70.8 Å²	70.8	36%	0.355	34%	0.336	S	S	.	.	H	α-helix	trans	-81.6	-34.2	174.1	-72.2	-67.1	-63.2	0	0	112.9	H346 R347 P348 P359 I362	H346-M350 WeakPolarHBondContact O-CG 3.3Å; H346-M350 PolarHBondContact O-N 3.1Å; H346-M350 VanDerWaalsContact O-N 3.12Å; R347-M350 PolarHBondContact O-N 3.29Å; R347-M350 VanDerWaalsContact O-N 3.08Å; P348-M350 VanDerWaalsContact C-N 3.32Å; M350-P359 HydrophobicContact CE-CB 4.09Å; M350-P359 HydrophobicContact CE-CG 4.18Å; M350-P359 HydrophobicContact SD-CB 4.08Å; M350-P359 HydrophobicContact SD-CG 4.26Å; M350-I362 HydrophobicContact CG-CD1 4.41Å; M350-I362 HydrophobicContact CG-CG2 4.01Å; M350-I362 HydrophobicContact SD-CB 4.03Å; M350-I362 HydrophobicContact SD-CD1 3.82Å; M350-I362 HydrophobicContact SD-CG2 3.81Å
351	E	89.7	Confident	88.8	Confident	116 Å²	116	74 Å²	74	54%	0.542	35%	0.35	S	S	.	.	H	α-helix	trans	-94.7	0.6	-176.8	-66.2	175.8	160.6	0	0	113.6	R347	R347-E351 HydrophobicContact CG-CG 4.34Å; R347-E351 WeakPolarHBondContact CG-OE2 3.12Å; R347-E351 IonicContact CZ-OE1 3.17Å; R347-E351 VanDerWaalsContact CZ-OE1 3.26Å; R347-E351 IonicContact CZ-OE2 3.36Å; R347-E351 IonicContact NE-OE1 3.63Å; R347-E351 PolarHBondContact NE-OE1 3.11Å; R347-E351 IonicContact NE-OE2 2.73Å; R347-E351 PolarHBondContact NE-OE2 2.61Å; R347-E351 IonicContact NH2-OE1 2.81Å; R347-E351 PolarHBondContact NH2-OE1 2.63Å; R347-E351 IonicContact NH2-OE2 3.44Å; R347-E351 PolarHBondContact O-N 2.83Å
352	A	85	Confident	88.6	Confident	19 Å²	19	74 Å²	74	16%	0.157	35%	0.35	C	S	.	.			trans	-74.3	125.8	-177	0	0	0	0	0	113.8	P348 P354 R355 I356	P348-A352 WeakPolarHBondContact O-CB 3.23Å; P348-A352 PolarHBondContact O-N 2.64Å; A352-P354 CarbonylContact O-C 3.59Å; A352-R355 VanDerWaalsContact O-CA 3.32Å; A352-R355 WeakPolarHBondContact O-CA 3.33Å; A352-R355 PolarHBondContact O-N 2.77Å; A352-I356 HydrophobicContact CB-CD1 3.81Å; A352-I356 HydrophobicContact CB-CG1 3.9Å
353	E	75.4	Confident	88.5	Confident	180 Å²	180	78.2 Å²	78.2	84%	0.841	36%	0.364	S	S	*	.	S	Bend	trans	-119.5	123	167.2	-61.7	-169.6	154.3	0	0	109.4
354	P	79.6	Confident	88.5	Confident	124 Å²	124	74.1 Å²	74.1	81%	0.805	35%	0.348	S	S	*	.	S	Bend	cis	-68.4	152.3	-5.1	30.5	-36.1	0	0	0	113.4	A352 I356	A352-P354 CarbonylContact O-C 3.59Å; P354-I356 PolarHBondContact O-N 3.37Å
355	R	84.9	Confident	88.5	Confident	159 Å²	159	71.6 Å²	71.6	60%	0.6	34%	0.337	S	S	*	.			trans	-63.4	103.1	-171.3	-69.8	177.9	178.1	160.8	-1.1	113.8	A352 L357 K434	A352-R355 VanDerWaalsContact O-CA 3.32Å; A352-R355 WeakPolarHBondContact O-CA 3.33Å; A352-R355 PolarHBondContact O-N 2.77Å; R355-L357 PolarHBondContact O-N 2.97Å; R355-K434 PolarHBondContact O-NZ 3.24Å
356	I	87.7	Confident	88.7	Confident	29 Å²	29	72.1 Å²	72.1	15%	0.149	34%	0.339	C	S	.	.	S	Bend	trans	-58.8	-49	177	-58.3	171.8	0	0	0	110.5	L349 A352 P354 K434 F437 F440	L349-I356 HydrophobicContact CD2-CB 4.15Å; L349-I356 HydrophobicContact CD2-CD1 4.42Å; L349-I356 HydrophobicContact CD2-CG2 3.95Å; A352-I356 HydrophobicContact CB-CD1 3.81Å; A352-I356 HydrophobicContact CB-CG1 3.9Å; P354-I356 PolarHBondContact O-N 3.37Å; I356-K434 WeakPolarHBondContact O-CD 3.27Å; I356-K434 WeakPolarHBondContact O-CE 3.25Å; I356-K434 PolarHBondContact O-NZ 3.33Å; I356-F437 HydrophobicContact CG2-CB 3.73Å; I356-F437 HydrophobicContact CG2-CD2 3.86Å; I356-F437 HydrophobicContact CG2-CG 4.3Å; I356-F440 HydrophobicContact CD1-CB 4.17Å; I356-F440 HydrophobicContact CD1-CD2 3.69Å; I356-F440 HydrophobicContact CD1-CE2 4.36Å; I356-F440 HydrophobicContact CD1-CG 4.05Å
357	L	88.8	Confident	88.7	Confident	5 Å²	5	73.9 Å²	73.9	3%	0.026	35%	0.347	C	S	.	.	S	Bend	trans	-132	158.5	173.1	-78.9	176	0	0	0	111.2	R355 K361 I362 I365 A430 K434 F437	R355-L357 PolarHBondContact O-N 2.97Å; L357-K361 HydrophobicContact CD2-CD 4.29Å; L357-I362 HydrophobicContact CB-CD1 3.97Å; L357-I362 HydrophobicContact CB-CG1 3.8Å; L357-I365 HydrophobicContact CD1-CD1 4.41Å; L357-A430 HydrophobicContact CD1-CB 4.23Å; L357-A430 HydrophobicContact CD2-CB 4Å; L357-K434 HydrophobicContact CD2-CD 4.25Å; L357-F437 HydrophobicContact CD1-CD2 3.54Å; L357-F437 HydrophobicContact CD1-CE1 4.39Å; L357-F437 HydrophobicContact CD1-CE2 3.41Å; L357-F437 VanDerWaalsContact CD1-CE2 3.41Å; L357-F437 HydrophobicContact CD1-CG 4.1Å; L357-F437 HydrophobicContact CD1-CZ 3.86Å; L357-F437 HydrophobicContact CG-CD2 3.97Å; L357-F437 HydrophobicContact CG-CE2 4.33Å; L357-F437 HydrophobicContact CG-CG 4.36Å
358	S	88.8	Confident	88.8	Confident	51 Å²	51	68.6 Å²	68.6	36%	0.357	33%	0.327	S	S	.	.			trans	-81.9	143	173.7	53.9	0	0	0	0	110.8	R360 K361 I362	S358-R360 PolarHBondContact O-N 3.43Å; S358-R360 VanDerWaalsContact O-N 3.11Å; S358-K361 WeakPolarHBondContact O-CA 3.49Å; S358-K361 PolarHBondContact O-N 3.33Å; S358-I362 PolarHBondContact O-N 2.8Å
359	P	87.6	Confident	88.9	Confident	46 Å²	46	67 Å²	67	30%	0.299	32%	0.317	S	S	.	.	H	α-helix	trans	-52.2	-36.2	179.1	-31.9	37.4	0	0	0	114.3	M350 K361 I362 R363	M350-P359 HydrophobicContact CE-CB 4.09Å; M350-P359 HydrophobicContact CE-CG 4.18Å; M350-P359 HydrophobicContact SD-CB 4.08Å; M350-P359 HydrophobicContact SD-CG 4.26Å; P359-K361 PolarHBondContact O-N 3.17Å; P359-K361 VanDerWaalsContact O-N 3.15Å; P359-I362 PolarHBondContact O-N 2.85Å; P359-R363 PolarHBondContact O-N 3Å
360	R	88.2	Confident	89	Confident	232 Å²	232	73.6 Å²	73.6	88%	0.875	34%	0.342	S	S	*	.	H	α-helix	trans	-58.6	-22.2	173.9	-66.6	-176.7	179.9	169.1	1.1	114.3	S358 P364	S358-R360 PolarHBondContact O-N 3.43Å; S358-R360 VanDerWaalsContact O-N 3.11Å; R360-P364 VanDerWaalsContact O-CD 3.32Å; R360-P364 WeakPolarHBondContact O-CD 3.47Å
361	K	88.4	Confident	89.3	Confident	99 Å²	99	71.7 Å²	71.7	43%	0.43	33%	0.332	S	S	.	.	H	α-helix	trans	-97.1	-25.1	172.4	-68.7	177	179.4	172.5	0	112.7	L357 S358 P359 I365	L357-K361 HydrophobicContact CD2-CD 4.29Å; S358-K361 WeakPolarHBondContact O-CA 3.49Å; S358-K361 PolarHBondContact O-N 3.33Å; P359-K361 PolarHBondContact O-N 3.17Å; P359-K361 VanDerWaalsContact O-N 3.15Å; K361-I365 VanDerWaalsContact O-CD1 3.27Å; K361-I365 WeakPolarHBondContact O-CD1 3.26Å; K361-I365 VanDerWaalsContact O-CG1 3.28Å; K361-I365 WeakPolarHBondContact O-CG1 3.29Å
362	I	90.9	Very high	89.5	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-77.4	-45.4	-179.7	-61.6	165.1	0	0	0	111	L349 M350 L357 S358 P359 I365 F366	L349-I362 HydrophobicContact CB-CD1 4.02Å; L349-I362 HydrophobicContact CB-CG1 4.43Å; L349-I362 WeakPolarHBondContact O-CD1 3.44Å; M350-I362 HydrophobicContact CG-CD1 4.41Å; M350-I362 HydrophobicContact CG-CG2 4.01Å; M350-I362 HydrophobicContact SD-CB 4.03Å; M350-I362 HydrophobicContact SD-CD1 3.82Å; M350-I362 HydrophobicContact SD-CG2 3.81Å; L357-I362 HydrophobicContact CB-CD1 3.97Å; L357-I362 HydrophobicContact CB-CG1 3.8Å; S358-I362 PolarHBondContact O-N 2.8Å; P359-I362 PolarHBondContact O-N 2.85Å; I362-I365 PolarHBondContact O-N 2.9Å; I362-F366 HydrophobicContact CG2-CD2 3.76Å; I362-F366 HydrophobicContact CG2-CE2 3.99Å; I362-F366 WeakPolarHBondContact O-CD2 3.47Å; I362-F366 PolarHBondContact O-N 3.33Å
363	R	90.6	Very high	90	Very high	122 Å²	122	66 Å²	66	46%	0.46	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-46.7	-180	-66.3	-174.6	-169.7	163.1	11.2	112.7	E285 P359 I365 F366 H367	E285-R363 IonicContact OE1-CZ 2.75Å; E285-R363 IonicContact OE1-NH1 2.77Å; E285-R363 IonicContact OE1-NH2 3.72Å; E285-R363 PolarHBondContact OE1-NH2 2.97Å; E285-R363 IonicContact OE2-CZ 3.14Å; E285-R363 IonicContact OE2-NH2 2.71Å; E285-R363 PolarHBondContact OE2-NH2 2.92Å; P359-R363 PolarHBondContact O-N 3Å; R363-I365 VanDerWaalsContact C-N 3.3Å; R363-I365 PolarHBondContact O-N 3.34Å; R363-F366 PolarHBondContact O-N 2.98Å; R363-H367 PolarHBondContact O-N 3.28Å; R363-H367 VanDerWaalsContact O-N 3.12Å
364	P	91.9	Very high	90.8	Very high	40 Å²	40	59 Å²	59	26%	0.26	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-16.7	176.9	-19.4	34.2	0	0	0	114.8	R360 N419 L426	R360-P364 VanDerWaalsContact O-CD 3.32Å; R360-P364 WeakPolarHBondContact O-CD 3.47Å; P364-N419 PolarHBondContact O-ND2 3.26Å; P364-L426 HydrophobicContact CB-CD1 3.8Å
365	I	93.1	Very high	91.4	Very high	3 Å²	3	54 Å²	54	2%	0.015	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-39.2	175.8	-70.8	169.1	0	0	0	110.7	L357 K361 I362 R363 L426 I427 M458	L357-I365 HydrophobicContact CD1-CD1 4.41Å; K361-I365 VanDerWaalsContact O-CD1 3.27Å; K361-I365 WeakPolarHBondContact O-CD1 3.26Å; K361-I365 VanDerWaalsContact O-CG1 3.28Å; K361-I365 WeakPolarHBondContact O-CG1 3.29Å; I362-I365 PolarHBondContact O-N 2.9Å; R363-I365 VanDerWaalsContact C-N 3.3Å; R363-I365 PolarHBondContact O-N 3.34Å; I365-L426 HydrophobicContact CD1-CB 4.15Å; I365-L426 HydrophobicContact CG1-CB 3.91Å; I365-L426 HydrophobicContact CG1-CD1 4.39Å; I365-I427 HydrophobicContact CD1-CG1 3.99Å; I365-I427 HydrophobicContact CG1-CG1 4.19Å; I365-I427 HydrophobicContact CG2-CD1 3.83Å; I365-I427 HydrophobicContact CG2-CG1 3.8Å; I365-M458 HydrophobicContact CG2-CE 4.36Å; I365-M458 WeakPolarHBondContact O-CE 3.3Å
366	F	94.8	Very high	91.8	Very high	11 Å²	11	46.4 Å²	46.4	5%	0.048	21%	0.209	C	C	.	.	S	Bend	trans	-111.9	18.8	-173.3	-57.5	-79	0	0	0	114.2	I341 H346 L349 I362 R363 I369 L454 M458	I341-F366 HydrophobicContact CG2-CD1 3.58Å; I341-F366 HydrophobicContact CG2-CE1 3.75Å; H346-F366 HydrophobicContact CB-CB 4.46Å; H346-F366 HydrophobicContact CB-CD1 4.14Å; H346-F366 HydrophobicContact CB-CD2 4Å; H346-F366 HydrophobicContact CB-CE1 4.35Å; H346-F366 HydrophobicContact CB-CE2 4.23Å; H346-F366 HydrophobicContact CB-CG 3.95Å; H346-F366 HydrophobicContact CB-CZ 4.4Å; H346-F366 AromaticContact CD2-CD2 3.75Å; H346-F366 AromaticContact CD2-CG 3.89Å; L349-F366 HydrophobicContact CD1-CE2 3.89Å; L349-F366 HydrophobicContact CD1-CZ 3.94Å; I362-F366 HydrophobicContact CG2-CD2 3.76Å; I362-F366 HydrophobicContact CG2-CE2 3.99Å; I362-F366 WeakPolarHBondContact O-CD2 3.47Å; I362-F366 PolarHBondContact O-N 3.33Å; R363-F366 PolarHBondContact O-N 2.98Å; F366-I369 PolarHBondContact O-N 3.47Å; F366-L454 HydrophobicContact CE1-CD1 4.12Å; F366-L454 HydrophobicContact CE1-CD2 4.46Å; F366-L454 HydrophobicContact CZ-CD2 4.33Å; F366-M458 HydrophobicContact CE1-SD 4.47Å
367	H	93.3	Very high	92	Very high	63 Å²	63	45.7 Å²	45.7	29%	0.292	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	142.4	177.3	-175.6	59.6	0	0	0	111.7	R363 I369 Y416	R363-H367 PolarHBondContact O-N 3.28Å; R363-H367 VanDerWaalsContact O-N 3.12Å; H367-I369 PolarHBondContact O-N 3.13Å; H367-Y416 WeakPolarHBondContact O-CD2 3.35Å
368	R	94.4	Very high	92.2	Very high	32 Å²	32	50.1 Å²	50.1	12%	0.121	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	-5.7	-176.7	-61.9	-49.1	-174.2	-151.5	-6.9	119	D288 R370 E371 I372 V412 D415 Y416	D288-R368 IonicContact OD2-NH1 3.35Å; D288-R368 IonicContact OD2-NH2 2.79Å; D288-R368 PolarHBondContact OD2-NH2 2.61Å; R368-R370 VanDerWaalsContact C-N 3.28Å; R368-R370 PolarHBondContact O-N 3.15Å; R368-E371 VanDerWaalsContact CA-OE2 3.3Å; R368-E371 WeakPolarHBondContact CA-OE2 3.29Å; R368-E371 WeakPolarHBondContact CD-OE1 3.35Å; R368-E371 IonicContact CZ-OE1 2.69Å; R368-E371 IonicContact NE-OE1 3.31Å; R368-E371 IonicContact NH1-OE1 3.36Å; R368-E371 PolarHBondContact NH1-OE1 3.1Å; R368-E371 PolarHBondContact O-N 2.94Å; R368-I372 WeakPolarHBondContact O-CG1 3.43Å; R368-I372 PolarHBondContact O-N 3.08Å; R368-V412 HydrophobicContact CB-CG1 4.28Å; R368-D415 HydrophobicContact CG-CB 3.52Å; R368-D415 IonicContact CZ-OD2 3.16Å; R368-D415 VanDerWaalsContact CZ-OD2 3.23Å; R368-D415 IonicContact NE-OD2 2.7Å; R368-D415 PolarHBondContact NE-OD2 2.77Å; R368-D415 IonicContact NH2-OD2 3.84Å; R368-D415 PolarHBondContact NH2-OD2 2.83Å; R368-Y416 HydrophobicContact CB-CD2 4.48Å
369	I	95	Very high	92.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.9	-37	-179.2	-68.3	-71.6	0	0	0	112.3	I341 L342 F366 H367 T373 Y416	I341-I369 HydrophobicContact CB-CG2 4.46Å; I341-I369 HydrophobicContact CD1-CD1 4.23Å; I341-I369 HydrophobicContact CG2-CG1 4.42Å; I341-I369 HydrophobicContact CG2-CG2 4.08Å; L342-I369 HydrophobicContact CD1-CG2 4.25Å; L342-I369 HydrophobicContact CD2-CB 4.41Å; L342-I369 HydrophobicContact CD2-CG2 3.72Å; L342-I369 HydrophobicContact CG-CG2 3.77Å; F366-I369 PolarHBondContact O-N 3.47Å; H367-I369 PolarHBondContact O-N 3.13Å; I369-T373 WeakPolarHBondContact O-CB 3.37Å; I369-T373 PolarHBondContact O-N 2.96Å; I369-T373 PolarHBondContact O-OG1 2.88Å; I369-Y416 HydrophobicContact CD1-CD2 4.14Å; I369-Y416 HydrophobicContact CD1-CE2 3.33Å; I369-Y416 HydrophobicContact CG1-CD2 4.47Å; I369-Y416 HydrophobicContact CG1-CE2 3.87Å
370	R	92.9	Very high	92.6	Very high	143 Å²	143	47 Å²	47	54%	0.54	20%	0.204	S	C	.	.	H	α-helix	trans	-67.7	-45.9	-178.9	-66.8	-176.3	-179.2	-171.8	3.4	111.3	L342 H346 R368 T373 Q374	L342-R370 HydrophobicContact CD1-CG 4.27Å; L342-R370 HydrophobicContact CD2-CG 3.74Å; H346-R370 PolarHBondContact CE1-NH2 3.35Å; R368-R370 VanDerWaalsContact C-N 3.28Å; R368-R370 PolarHBondContact O-N 3.15Å; R370-T373 WeakPolarHBondContact O-CA 3.4Å; R370-T373 WeakPolarHBondContact O-CB 3.38Å; R370-T373 PolarHBondContact O-N 3.33Å; R370-T373 VanDerWaalsContact O-N 3.12Å; R370-Q374 PolarHBondContact O-N 3.21Å
371	E	93.8	Very high	92.6	Very high	32 Å²	32	37.6 Å²	37.6	15%	0.15	17%	0.171	C	C	.	.	H	α-helix	trans	-64.8	-42.1	-179.2	-56.7	95.9	117.9	0	0	110.9	Y291 R368 T373 Q374 C375 V412	Y291-E371 HydrophobicContact CD1-CG 4.25Å; Y291-E371 HydrophobicContact CE1-CB 4.41Å; Y291-E371 HydrophobicContact CE1-CG 3.96Å; Y291-E371 HydrophobicContact CE2-CB 4.27Å; Y291-E371 HydrophobicContact CE2-CG 4.23Å; Y291-E371 PolarHBondContact OH-O 3.36Å; R368-E371 VanDerWaalsContact CA-OE2 3.3Å; R368-E371 WeakPolarHBondContact CA-OE2 3.29Å; R368-E371 WeakPolarHBondContact CD-OE1 3.35Å; R368-E371 IonicContact CZ-OE1 2.69Å; R368-E371 IonicContact NE-OE1 3.31Å; R368-E371 IonicContact NH1-OE1 3.36Å; R368-E371 PolarHBondContact NH1-OE1 3.1Å; R368-E371 PolarHBondContact O-N 2.94Å; E371-T373 VanDerWaalsContact C-N 3.34Å; E371-T373 PolarHBondContact O-N 2.86Å; E371-Q374 PolarHBondContact O-N 2.8Å; E371-C375 PolarHBondContact O-N 2.74Å; E371-C375 PolarHBondContact O-SG 2.73Å; E371-C375 VanDerWaalsContact O-SG 3.36Å; E371-V412 HydrophobicContact CB-CG1 3.72Å; E371-V412 HydrophobicContact CB-CG2 4Å
372	I	95.3	Very high	92.7	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-58	-45.6	170	-69.2	175.4	0	0	0	111	Y334 L338 R368 Q374 C375 H376 V412 Y413 Y416 P461	Y334-I372 WeakPolarHBondContact OH-CG2 3.37Å; L338-I372 HydrophobicContact CD1-CG2 3.94Å; L338-I372 HydrophobicContact CD2-CG2 4.35Å; R368-I372 WeakPolarHBondContact O-CG1 3.43Å; R368-I372 PolarHBondContact O-N 3.08Å; I372-Q374 PolarHBondContact O-N 2.96Å; I372-C375 PolarHBondContact O-N 3.28Å; I372-H376 PolarHBondContact O-N 3.35Å; I372-H376 VanDerWaalsContact O-N 3.1Å; I372-V412 HydrophobicContact CG1-CG1 3.59Å; I372-Y413 HydrophobicContact CB-CE2 4.48Å; I372-Y413 HydrophobicContact CD1-CD1 4.41Å; I372-Y413 HydrophobicContact CD1-CE1 4.32Å; I372-Y413 HydrophobicContact CD1-CE2 4.39Å; I372-Y413 HydrophobicContact CG1-CD2 4.16Å; I372-Y413 HydrophobicContact CG1-CE2 3.91Å; I372-Y413 HydrophobicContact CG2-CE2 4.09Å; I372-Y413 WeakPolarHBondContact CG2-OH 3.35Å; I372-Y416 HydrophobicContact CD1-CD1 4.07Å; I372-Y416 HydrophobicContact CD1-CD2 4.06Å; I372-Y416 HydrophobicContact CD1-CG 3.65Å; I372-P461 HydrophobicContact CD1-CB 4.34Å
373	T	94.8	Very high	92.8	Very high	14 Å²	14	34.6 Å²	34.6	9%	0.086	16%	0.164	C	C	.	.	H	α-helix	trans	-61.3	-44.9	178.7	-51.7	0	0	0	0	111.2	L335 L338 L342 I369 R370 E371 H376 S377	L335-T373 HydrophobicContact CD2-CG2 4.12Å; L338-T373 HydrophobicContact CB-CG2 4.21Å; L342-T373 HydrophobicContact CD1-CG2 4.38Å; I369-T373 WeakPolarHBondContact O-CB 3.37Å; I369-T373 PolarHBondContact O-N 2.96Å; I369-T373 PolarHBondContact O-OG1 2.88Å; R370-T373 WeakPolarHBondContact O-CA 3.4Å; R370-T373 WeakPolarHBondContact O-CB 3.38Å; R370-T373 PolarHBondContact O-N 3.33Å; R370-T373 VanDerWaalsContact O-N 3.12Å; E371-T373 VanDerWaalsContact C-N 3.34Å; E371-T373 PolarHBondContact O-N 2.86Å; T373-H376 PolarHBondContact O-N 3.11Å; T373-S377 WeakPolarHBondContact O-CB 3.46Å; T373-S377 PolarHBondContact O-N 2.89Å; T373-S377 PolarHBondContact O-OG 2.95Å; T373-S377 VanDerWaalsContact O-OG 3.1Å
374	Q	91.4	Very high	92.7	Very high	34 Å²	34	29.6 Å²	29.6	16%	0.159	15%	0.149	C	C	.	.	H	α-helix	trans	-68	-37.5	179.1	178	172.1	-27	0	0	112.5	Y291 L292 R370 E371 I372 H376 S377 M378	Y291-Q374 WeakPolarHBondContact OH-CB 3.35Å; Y291-Q374 WeakPolarHBondContact OH-CG 3.12Å; L292-Q374 PolarHBondContact O-NE2 2.94Å; R370-Q374 PolarHBondContact O-N 3.21Å; E371-Q374 PolarHBondContact O-N 2.8Å; I372-Q374 PolarHBondContact O-N 2.96Å; Q374-H376 VanDerWaalsContact C-N 3.33Å; Q374-H376 PolarHBondContact O-N 2.74Å; Q374-S377 PolarHBondContact O-N 3.2Å; Q374-M378 HydrophobicContact CG-CE 4.43Å; Q374-M378 WeakPolarHBondContact O-CG 3.37Å; Q374-M378 PolarHBondContact O-N 2.89Å
375	C	92.9	Very high	92.5	Very high	19 Å²	19	31.4 Å²	31.4	13%	0.128	16%	0.163	C	C	.	.	H	α-helix	trans	-55.9	-47.1	170.8	-76.2	0	0	0	0	111.8	E371 I372 M378 F379	E371-C375 PolarHBondContact O-N 2.74Å; E371-C375 PolarHBondContact O-SG 2.73Å; E371-C375 VanDerWaalsContact O-SG 3.36Å; I372-C375 PolarHBondContact O-N 3.28Å; C375-M378 PolarHBondContact O-N 3.38Å; C375-F379 PolarHBondContact O-N 3.04Å
376	H	94.3	Very high	92.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-74.5	-34.7	179.4	-84.2	-94.9	0	0	0	113.4	E331 Y334 L335 I372 T373 Q374 M378 F379 Q380 F404 Y413 F468	E331-H376 WeakPolarHBondContact OE1-CB 3.18Å; E331-H376 IonicContact OE1-CE1 2.94Å; E331-H376 IonicContact OE1-CG 3.19Å; E331-H376 IonicContact OE1-ND1 3.47Å; E331-H376 PolarHBondContact OE1-ND1 3.29Å; E331-H376 IonicContact OE2-CE1 3.89Å; E331-H376 IonicContact OE2-ND1 2.85Å; E331-H376 PolarHBondContact OE2-ND1 3.35Å; Y334-H376 AromaticContact CD1-CE1 3.98Å; Y334-H376 AromaticContact CD1-ND1 3.63Å; Y334-H376 HydrophobicContact CE1-CB 4.35Å; Y334-H376 AromaticContact CE1-CD2 3.73Å; Y334-H376 AromaticContact CE1-CE1 3.58Å; Y334-H376 AromaticContact CE1-CG 3.59Å; Y334-H376 AromaticContact CE1-ND1 3.5Å; Y334-H376 AromaticContact CE1-NE2 3.72Å; L335-H376 HydrophobicContact CD1-CB 4.28Å; L335-H376 HydrophobicContact CD2-CB 3.63Å; L335-H376 HydrophobicContact CG-CB 3.97Å; I372-H376 PolarHBondContact O-N 3.35Å; I372-H376 VanDerWaalsContact O-N 3.1Å; T373-H376 PolarHBondContact O-N 3.11Å; Q374-H376 VanDerWaalsContact C-N 3.33Å; Q374-H376 PolarHBondContact O-N 2.74Å; H376-M378 VanDerWaalsContact C-N 3.3Å; H376-M378 PolarHBondContact O-N 3.33Å; H376-F379 CarbonylContact O-C 3.54Å; H376-F379 WeakPolarHBondContact O-CB 3.45Å; H376-F379 PolarHBondContact O-N 2.77Å; H376-F379 VanDerWaalsContact O-N 3.11Å; H376-Q380 PolarHBondContact O-N 3.15Å; H376-F404 AromaticContact CE1-CE1 3.79Å; H376-F404 AromaticContact CE1-CZ 3.88Å; H376-F404 AromaticContact NE2-CE1 3.69Å; H376-Y413 PolarHBondContact NE2-OH 3.36Å; H376-F468 AromaticContact CE1-CE2 3.79Å
377	S	91.8	Very high	92.1	Very high	14 Å²	14	33.2 Å²	33.2	10%	0.098	17%	0.169	C	C	.	.	H	α-helix	trans	-60.6	-38.4	171.8	-67	0	0	0	0	112	T373 Q374 Q380 I381	T373-S377 WeakPolarHBondContact O-CB 3.46Å; T373-S377 PolarHBondContact O-N 2.89Å; T373-S377 PolarHBondContact O-OG 2.95Å; T373-S377 VanDerWaalsContact O-OG 3.1Å; Q374-S377 PolarHBondContact O-N 3.2Å; S377-Q380 PolarHBondContact O-N 2.61Å; S377-I381 WeakPolarHBondContact O-CG1 3.43Å; S377-I381 PolarHBondContact O-N 3.04Å; S377-I381 VanDerWaalsContact O-N 3.12Å
378	M	91.1	Very high	91.8	Very high	97 Å²	97	34.3 Å²	34.3	48%	0.478	19%	0.19	S	C	.	.	H	α-helix	trans	-64.3	-40.7	173	-71	-175.4	-67.4	0	0	112.2	Q374 C375 H376 A382	Q374-M378 HydrophobicContact CG-CE 4.43Å; Q374-M378 WeakPolarHBondContact O-CG 3.37Å; Q374-M378 PolarHBondContact O-N 2.89Å; C375-M378 PolarHBondContact O-N 3.38Å; H376-M378 VanDerWaalsContact C-N 3.3Å; H376-M378 PolarHBondContact O-N 3.33Å; M378-A382 PolarHBondContact O-N 2.82Å
379	F	93.4	Very high	91.4	Very high	1 Å²	1	38.8 Å²	38.8	0%	0.004	21%	0.212	C	C	.	.	H	α-helix	trans	-63.8	-41.9	173.9	176.4	-114.6	0	0	0	111.8	E331 C375 H376 I381 A382 L383 L399 F400 S403 F404 F468	E331-F379 HydrophobicContact CG-CD1 3.89Å; E331-F379 HydrophobicContact CG-CE1 3.96Å; C375-F379 PolarHBondContact O-N 3.04Å; H376-F379 CarbonylContact O-C 3.54Å; H376-F379 WeakPolarHBondContact O-CB 3.45Å; H376-F379 PolarHBondContact O-N 2.77Å; H376-F379 VanDerWaalsContact O-N 3.11Å; F379-I381 PolarHBondContact O-N 2.81Å; F379-A382 PolarHBondContact O-N 2.92Å; F379-L383 HydrophobicContact CE1-CD2 4.43Å; F379-L383 VanDerWaalsContact O-CB 3.25Å; F379-L383 WeakPolarHBondContact O-CB 3.37Å; F379-L383 PolarHBondContact O-N 2.87Å; F379-L399 HydrophobicContact CD2-CD2 4.21Å; F379-L399 HydrophobicContact CD2-CG 4.25Å; F379-L399 HydrophobicContact CE2-CD2 3.7Å; F379-L399 HydrophobicContact CE2-CG 3.94Å; F379-L399 HydrophobicContact CZ-CD2 4.45Å; F379-F400 HydrophobicContact CE1-CE1 4.36Å; F379-F400 HydrophobicContact CE1-CZ 4.39Å; F379-F400 HydrophobicContact CE2-CD1 4.3Å; F379-F400 HydrophobicContact CE2-CD2 4.45Å; F379-F400 HydrophobicContact CE2-CE1 4.25Å; F379-F400 HydrophobicContact CE2-CE2 4.4Å; F379-F400 HydrophobicContact CE2-CG 4.41Å; F379-F400 HydrophobicContact CE2-CZ 4.32Å; F379-F400 HydrophobicContact CZ-CD1 4.17Å; F379-F400 HydrophobicContact CZ-CD2 4.42Å; F379-F400 AromaticContact CZ-CE1 3.66Å; F379-F400 HydrophobicContact CZ-CE1 3.66Å; F379-F400 AromaticContact CZ-CE2 3.95Å; F379-F400 HydrophobicContact CZ-CE2 3.95Å; F379-F400 AromaticContact CZ-CZ 3.55Å; F379-F400 HydrophobicContact CZ-CZ 3.55Å; F379-S403 WeakPolarHBondContact CD2-OG 3.43Å; F379-F404 HydrophobicContact CB-CZ 4.19Å; F379-F404 HydrophobicContact CD1-CE2 4.31Å; F379-F404 AromaticContact CD1-CZ 3.96Å; F379-F404 HydrophobicContact CD1-CZ 3.96Å; F379-F404 AromaticContact CD2-CE2 3.86Å; F379-F404 HydrophobicContact CD2-CE2 3.86Å; F379-F404 HydrophobicContact CD2-CZ 4.1Å; F379-F404 HydrophobicContact CE1-CE2 4.39Å; F379-F404 HydrophobicContact CE1-CZ 4.37Å; F379-F404 AromaticContact CE2-CE2 3.93Å; F379-F404 HydrophobicContact CE2-CE2 3.93Å; F379-F404 HydrophobicContact CE2-CZ 4.48Å; F379-F404 HydrophobicContact CG-CE2 4.06Å; F379-F404 AromaticContact CG-CZ 3.81Å; F379-F404 HydrophobicContact CG-CZ 3.81Å; F379-F404 HydrophobicContact CZ-CE2 4.2Å; F379-F468 HydrophobicContact CD1-CZ 4.35Å; F379-F468 HydrophobicContact CE1-CE1 4.16Å; F379-F468 AromaticContact CE1-CZ 3.78Å; F379-F468 HydrophobicContact CE1-CZ 3.78Å; F379-F468 HydrophobicContact CZ-CZ 4.42Å
380	Q	91.6	Very high	91	Very high	32 Å²	32	39 Å²	39	15%	0.15	21%	0.213	C	C	.	.	H	α-helix	trans	-61.4	-40.4	176.9	173.8	164.1	80.3	0	0	113.2	P304 L335 H376 S377 L383 A384	P304-Q380 HydrophobicContact CG-CG 4.39Å; L335-Q380 HydrophobicContact CD1-CB 3.6Å; L335-Q380 HydrophobicContact CD1-CG 4.15Å; H376-Q380 PolarHBondContact O-N 3.15Å; S377-Q380 PolarHBondContact O-N 2.61Å; Q380-L383 PolarHBondContact O-N 3.23Å; Q380-A384 PolarHBondContact O-N 3.38Å
381	I	89.3	Confident	90.6	Very high	34 Å²	34	35.3 Å²	35.3	17%	0.174	20%	0.204	C	C	.	.	H	α-helix	trans	-62	-47.7	173.8	-61.7	160.8	0	0	0	110.5	F276 V296 S377 F379 L383 A384 S385	F276-I381 HydrophobicContact CE2-CD1 4.39Å; V296-I381 HydrophobicContact CG1-CD1 3.68Å; V296-I381 HydrophobicContact CG1-CG1 4.43Å; V296-I381 HydrophobicContact CG2-CD1 4.28Å; S377-I381 WeakPolarHBondContact O-CG1 3.43Å; S377-I381 PolarHBondContact O-N 3.04Å; S377-I381 VanDerWaalsContact O-N 3.12Å; F379-I381 PolarHBondContact O-N 2.81Å; I381-L383 VanDerWaalsContact C-N 3.32Å; I381-L383 PolarHBondContact O-N 2.92Å; I381-A384 PolarHBondContact O-N 3.2Å; I381-S385 PolarHBondContact O-N 3.39Å; I381-S385 VanDerWaalsContact O-N 3.12Å
382	A	90.3	Very high	90	Very high	34 Å²	34	39.5 Å²	39.5	28%	0.281	24%	0.236	S	C	.	.	H	α-helix	trans	-68.9	-33.5	-176.9	0	0	0	0	0	111.6	M378 F379 S385 R386 L399	M378-A382 PolarHBondContact O-N 2.82Å; F379-A382 PolarHBondContact O-N 2.92Å; A382-S385 PolarHBondContact O-N 2.94Å; A382-R386 PolarHBondContact O-N 3.49Å; A382-R386 VanDerWaalsContact O-N 3.11Å; A382-L399 HydrophobicContact CB-CD1 3.59Å
383	L	92	Very high	89.4	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-63.8	-46.9	171.2	-179.1	62.7	0	0	0	111.4	P304 L324 I328 F379 Q380 I381 S385 R386 V387 I396 L399	P304-L383 HydrophobicContact CB-CG 4.3Å; P304-L383 HydrophobicContact CG-CD2 4.5Å; L324-L383 HydrophobicContact CD1-CD1 4.26Å; I328-L383 HydrophobicContact CG1-CD1 4.41Å; I328-L383 HydrophobicContact CG1-CD2 4.08Å; I328-L383 HydrophobicContact CG1-CG 4.35Å; F379-L383 HydrophobicContact CE1-CD2 4.43Å; F379-L383 VanDerWaalsContact O-CB 3.25Å; F379-L383 WeakPolarHBondContact O-CB 3.37Å; F379-L383 PolarHBondContact O-N 2.87Å; Q380-L383 PolarHBondContact O-N 3.23Å; I381-L383 VanDerWaalsContact C-N 3.32Å; I381-L383 PolarHBondContact O-N 2.92Å; L383-S385 VanDerWaalsContact C-N 3.28Å; L383-S385 PolarHBondContact O-N 3.03Å; L383-R386 PolarHBondContact O-N 2.92Å; L383-R386 VanDerWaalsContact O-N 3.08Å; L383-V387 HydrophobicContact CD1-CG2 3.98Å; L383-V387 HydrophobicContact CG-CG2 4.21Å; L383-V387 WeakPolarHBondContact O-CB 3.47Å; L383-V387 VanDerWaalsContact O-CG2 3.22Å; L383-V387 WeakPolarHBondContact O-CG2 3.25Å; L383-V387 PolarHBondContact O-N 2.9Å; L383-I396 HydrophobicContact CD1-CD1 3.74Å; L383-L399 HydrophobicContact CB-CD2 4Å; L383-L399 HydrophobicContact CD1-CD2 4.06Å
384	A	89.7	Confident	89.1	Confident	17 Å²	17	41.9 Å²	41.9	14%	0.14	25%	0.25	C	S	.	.	H	α-helix	trans	-57.9	-40.9	176	0	0	0	0	0	112.1	P304 Q380 I381 R386 V387 A388	P304-A384 HydrophobicContact CB-CB 4.1Å; Q380-A384 PolarHBondContact O-N 3.38Å; I381-A384 PolarHBondContact O-N 3.2Å; A384-R386 PolarHBondContact O-N 2.81Å; A384-V387 PolarHBondContact O-N 3.34Å; A384-A388 PolarHBondContact O-N 3.49Å
385	S	87.7	Confident	89.1	Confident	79 Å²	79	43 Å²	43	55%	0.552	26%	0.255	S	S	*	.	H	α-helix	trans	-64.1	-36.2	174.8	-166.5	0	0	0	0	113.3	I381 A382 L383	I381-S385 PolarHBondContact O-N 3.39Å; I381-S385 VanDerWaalsContact O-N 3.12Å; A382-S385 PolarHBondContact O-N 2.94Å; L383-S385 VanDerWaalsContact C-N 3.28Å; L383-S385 PolarHBondContact O-N 3.03Å
386	R	89.3	Confident	89.1	Confident	48 Å²	48	42.1 Å²	42.1	18%	0.181	25%	0.249	C	C	.	.	H	α-helix	trans	-76	-37.2	178	-178.5	58.7	62.9	70.6	-6.2	112.4	A382 L383 A384 A388 E389 W390 K395 I396 D398	A382-R386 PolarHBondContact O-N 3.49Å; A382-R386 VanDerWaalsContact O-N 3.11Å; L383-R386 PolarHBondContact O-N 2.92Å; L383-R386 VanDerWaalsContact O-N 3.08Å; A384-R386 PolarHBondContact O-N 2.81Å; R386-A388 VanDerWaalsContact C-N 3.31Å; R386-A388 PolarHBondContact O-N 2.75Å; R386-E389 CarbonylContact O-C 3.57Å; R386-E389 PolarHBondContact O-N 2.82Å; R386-W390 PolarHBondContact O-N 2.84Å; R386-W390 VanDerWaalsContact O-N 3.12Å; R386-K395 WeakPolarHBondContact CD-O 3.37Å; R386-K395 VanDerWaalsContact CG-O 3.27Å; R386-K395 WeakPolarHBondContact CG-O 3.27Å; R386-K395 VanDerWaalsContact NH1-C 3.34Å; R386-K395 PolarHBondContact NH1-O 2.84Å; R386-I396 HydrophobicContact CG-CD1 4.05Å; R386-D398 IonicContact CZ-OD1 2.73Å; R386-D398 IonicContact NH1-OD1 3.61Å; R386-D398 PolarHBondContact NH1-OD1 3.17Å; R386-D398 IonicContact NH1-OD2 3.92Å; R386-D398 IonicContact NH2-OD1 3.67Å; R386-D398 PolarHBondContact NH2-OD1 2.84Å; R386-D398 VanDerWaalsContact NH2-OD1 3.08Å; R386-D398 IonicContact NH2-OD2 2.66Å; R386-D398 PolarHBondContact NH2-OD2 3.44Å; R386-D398 VanDerWaalsContact NH2-OD2 3.13Å
387	V	89.7	Confident	89.1	Confident	3 Å²	3	42.1 Å²	42.1	2%	0.018	25%	0.249	C	C	.	.	H	α-helix	trans	-65.3	-35.5	-179.1	170.1	0	0	0	0	111.6	P304 Q305 L306 L324 I328 L383 A384 E389 W390	P304-V387 HydrophobicContact CB-CG2 4.42Å; Q305-V387 VanDerWaalsContact O-CG1 3.24Å; Q305-V387 WeakPolarHBondContact O-CG1 3.43Å; L306-V387 HydrophobicContact CD2-CG1 3.98Å; L306-V387 HydrophobicContact CG-CG1 4.15Å; L324-V387 HydrophobicContact CD1-CG2 4.5Å; L324-V387 HydrophobicContact CD2-CG2 4.5Å; I328-V387 HydrophobicContact CD1-CG1 4.09Å; I328-V387 HydrophobicContact CD1-CG2 3.57Å; I328-V387 HydrophobicContact CG1-CG2 4.05Å; L383-V387 HydrophobicContact CD1-CG2 3.98Å; L383-V387 HydrophobicContact CG-CG2 4.21Å; L383-V387 WeakPolarHBondContact O-CB 3.47Å; L383-V387 VanDerWaalsContact O-CG2 3.22Å; L383-V387 WeakPolarHBondContact O-CG2 3.25Å; L383-V387 PolarHBondContact O-N 2.9Å; A384-V387 PolarHBondContact O-N 3.34Å; V387-E389 PolarHBondContact O-N 3.21Å; V387-W390 WeakPolarHBondContact O-CB 3.41Å; V387-W390 PolarHBondContact O-N 3.18Å
388	A	86.3	Confident	89.2	Confident	87 Å²	87	43.6 Å²	43.6	72%	0.719	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-21.2	174.9	0	0	0	0	0	114.3	A384 R386	A384-A388 PolarHBondContact O-N 3.49Å; R386-A388 VanDerWaalsContact C-N 3.31Å; R386-A388 PolarHBondContact O-N 2.75Å
389	E	86.7	Confident	89.3	Confident	126 Å²	126	39.8 Å²	39.8	59%	0.589	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.7	17.4	-179.4	-63.1	178.4	178.2	0	0	111.7	R386 V387 D391 S392 S393	R386-E389 CarbonylContact O-C 3.57Å; R386-E389 PolarHBondContact O-N 2.82Å; V387-E389 PolarHBondContact O-N 3.21Å; E389-D391 PolarHBondContact O-N 2.87Å; E389-S392 PolarHBondContact O-N 2.8Å; E389-S393 WeakPolarHBondContact O-CB 3.33Å; E389-S393 PolarHBondContact O-N 3.13Å; E389-S393 PolarHBondContact O-OG 2.86Å
390	W	87.1	Confident	89.4	Confident	4 Å²	4	39.8 Å²	39.8	2%	0.015	24%	0.237	C	C	.	.	H	α-helix	trans	-60.3	-47.1	-172.9	176.2	-100.9	0	0	0	112.6	L306 L324 R386 V387 S392 S393 E394 K395 I396 M475	L306-W390 HydrophobicContact CD2-CG 4.49Å; L324-W390 HydrophobicContact CD2-CB 4.38Å; L324-W390 HydrophobicContact CD2-CD2 3.24Å; L324-W390 HydrophobicContact CD2-CE3 3.39Å; L324-W390 HydrophobicContact CD2-CG 3.68Å; L324-W390 HydrophobicContact CD2-CH2 4.12Å; L324-W390 HydrophobicContact CD2-CZ2 4.02Å; L324-W390 HydrophobicContact CD2-CZ3 3.82Å; R386-W390 PolarHBondContact O-N 2.84Å; R386-W390 VanDerWaalsContact O-N 3.12Å; V387-W390 WeakPolarHBondContact O-CB 3.41Å; V387-W390 PolarHBondContact O-N 3.18Å; W390-S392 PolarHBondContact O-N 2.87Å; W390-S393 PolarHBondContact O-N 2.97Å; W390-E394 VanDerWaalsContact CH2-C 3.44Å; W390-E394 HydrophobicContact CZ2-CB 4.36Å; W390-E394 HydrophobicContact CZ2-CG 4.33Å; W390-E394 PolarHBondContact O-N 3Å; W390-K395 VanDerWaalsContact CZ3-N 3.26Å; W390-K395 WeakPolarHBondContact CZ3-O 3.22Å; W390-I396 HydrophobicContact CZ3-CB 4.09Å; W390-M475 HydrophobicContact CH2-CE 4.41Å
391	D	83.3	Confident	89.4	Confident	65 Å²	65	40.1 Å²	40.1	35%	0.348	24%	0.241	S	C	.	.	H	α-helix	trans	-65.4	-9.5	-174.7	-58.7	-36.9	0	0	0	113.9	S307 P310 R321 E389	S307-D391 PolarHBondContact OG-OD2 3.1Å; P310-D391 HydrophobicContact CG-CB 4.33Å; R321-D391 IonicContact CZ-OD1 3.56Å; R321-D391 IonicContact NH1-OD1 2.65Å; R321-D391 PolarHBondContact NH1-OD1 3.46Å; R321-D391 IonicContact NH2-OD1 3.6Å; R321-D391 IonicContact NH2-OD2 3.71Å; E389-D391 PolarHBondContact O-N 2.87Å
392	S	81.4	Confident	89.5	Confident	120 Å²	120	41.2 Å²	41.2	84%	0.839	26%	0.255	S	S	*	.	H	α-helix	trans	-114	-9.8	176.2	-56.6	0	0	0	0	113.7	E389 W390	E389-S392 PolarHBondContact O-N 2.8Å; W390-S392 PolarHBondContact O-N 2.87Å
393	S	83.3	Confident	89.5	Confident	35 Å²	35	40.7 Å²	40.7	25%	0.245	25%	0.249	C	C	.	.	H	α-helix	trans	-125.1	-31.4	-171.9	63.5	0	0	0	0	114.6	E389 W390 K395	E389-S393 WeakPolarHBondContact O-CB 3.33Å; E389-S393 PolarHBondContact O-N 3.13Å; E389-S393 PolarHBondContact O-OG 2.86Å; W390-S393 PolarHBondContact O-N 2.97Å; S393-K395 WeakPolarHBondContact O-CB 3.48Å; S393-K395 PolarHBondContact O-N 2.8Å
394	E	87.9	Confident	89.4	Confident	29 Å²	29	41 Å²	41	14%	0.136	25%	0.251	C	S	.	.			trans	43.9	30.9	180	-77.2	-159.8	-120.7	0	0	115.3	Q317 R320 W390 H483	Q317-E394 WeakPolarHBondContact CG-OE1 3.34Å; Q317-E394 PolarHBondContact NE2-OE1 2.83Å; R320-E394 IonicContact CZ-OE2 3.73Å; R320-E394 IonicContact NH1-OE2 2.69Å; R320-E394 PolarHBondContact NH1-OE2 3.36Å; R320-E394 PolarHBondContact NH2-O 2.83Å; W390-E394 VanDerWaalsContact CH2-C 3.44Å; W390-E394 HydrophobicContact CZ2-CB 4.36Å; W390-E394 HydrophobicContact CZ2-CG 4.33Å; W390-E394 PolarHBondContact O-N 3Å; E394-H483 PolarHBondContact O-CE1 2.81Å; E394-H483 VanDerWaalsContact O-CE1 3.29Å
395	K	91.2	Very high	89.1	Confident	59 Å²	59	42.9 Å²	42.9	26%	0.257	26%	0.263	S	S	.	.			trans	-120.3	132.6	-170.3	-161.7	-173.4	-173.5	-158.9	0	111.7	R386 W390 S393 D398 D485	R386-K395 WeakPolarHBondContact CD-O 3.37Å; R386-K395 VanDerWaalsContact CG-O 3.27Å; R386-K395 WeakPolarHBondContact CG-O 3.27Å; R386-K395 VanDerWaalsContact NH1-C 3.34Å; R386-K395 PolarHBondContact NH1-O 2.84Å; W390-K395 VanDerWaalsContact CZ3-N 3.26Å; W390-K395 WeakPolarHBondContact CZ3-O 3.22Å; S393-K395 WeakPolarHBondContact O-CB 3.48Å; S393-K395 PolarHBondContact O-N 2.8Å; K395-D398 WeakPolarHBondContact CD-OD2 3.48Å; K395-D398 VanDerWaalsContact CE-OD2 3.26Å; K395-D398 WeakPolarHBondContact CE-OD2 3.48Å; K395-D398 IonicContact NZ-OD2 2.8Å; K395-D398 PolarHBondContact NZ-OD2 3.25Å; K395-D485 HydrophobicContact CB-CB 4.34Å; K395-D485 HydrophobicContact CG-CB 3.97Å; K395-D485 WeakPolarHBondContact CG-OD1 3.3Å
396	I	94.6	Very high	88.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.259	C	S	.	.			trans	-140.2	-23.3	175.1	-161	63.3	0	0	0	114.6	L324 L383 R386 W390 D398 L399 F400 L472 M475 D485 L489	L324-I396 HydrophobicContact CD1-CD1 4.3Å; L324-I396 HydrophobicContact CD1-CG1 4.35Å; L383-I396 HydrophobicContact CD1-CD1 3.74Å; R386-I396 HydrophobicContact CG-CD1 4.05Å; W390-I396 HydrophobicContact CZ3-CB 4.09Å; I396-D398 VanDerWaalsContact C-N 3.31Å; I396-D398 PolarHBondContact O-N 3.13Å; I396-L399 HydrophobicContact CD1-CB 4.18Å; I396-L399 HydrophobicContact CD1-CD2 3.6Å; I396-L399 VanDerWaalsContact O-CB 3.23Å; I396-L399 WeakPolarHBondContact O-CB 3.37Å; I396-L399 PolarHBondContact O-N 3.01Å; I396-L399 VanDerWaalsContact O-N 3.08Å; I396-F400 HydrophobicContact CG1-CD2 4.18Å; I396-F400 HydrophobicContact CG1-CE2 3.88Å; I396-L472 HydrophobicContact CG2-CD2 4.45Å; I396-M475 HydrophobicContact CG2-CE 4.34Å; I396-M475 HydrophobicContact CG2-CG 4.39Å; I396-D485 PolarHBondContact N-OD1 2.89Å; I396-D485 PolarHBondContact N-OD2 2.81Å; I396-L489 HydrophobicContact CG2-CD2 3.87Å
397	G	93.3	Very high	88.4	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.5	-36.7	-174.7	0	0	0	0	0	113.7	L399 F400 V401 D485 P488	G397-L399 PolarHBondContact O-N 2.89Å; G397-F400 PolarHBondContact O-N 2.83Å; G397-V401 PolarHBondContact O-N 3.04Å; G397-V401 VanDerWaalsContact O-N 3.08Å; G397-D485 PolarHBondContact N-OD1 3.21Å; G397-P488 CarbonylContact C-O 3.57Å
398	D	93.6	Very high	88.2	Confident	45 Å²	45	51.4 Å²	51.4	24%	0.241	31%	0.305	C	S	.	.	H	α-helix	trans	-64.8	-28	177.9	67.8	-18.3	0	0	0	113.2	R386 K395 I396 A402 P488	R386-D398 IonicContact CZ-OD1 2.73Å; R386-D398 IonicContact NH1-OD1 3.61Å; R386-D398 PolarHBondContact NH1-OD1 3.17Å; R386-D398 IonicContact NH1-OD2 3.92Å; R386-D398 IonicContact NH2-OD1 3.67Å; R386-D398 PolarHBondContact NH2-OD1 2.84Å; R386-D398 VanDerWaalsContact NH2-OD1 3.08Å; R386-D398 IonicContact NH2-OD2 2.66Å; R386-D398 PolarHBondContact NH2-OD2 3.44Å; R386-D398 VanDerWaalsContact NH2-OD2 3.13Å; K395-D398 WeakPolarHBondContact CD-OD2 3.48Å; K395-D398 VanDerWaalsContact CE-OD2 3.26Å; K395-D398 WeakPolarHBondContact CE-OD2 3.48Å; K395-D398 IonicContact NZ-OD2 2.8Å; K395-D398 PolarHBondContact NZ-OD2 3.25Å; I396-D398 VanDerWaalsContact C-N 3.31Å; I396-D398 PolarHBondContact O-N 3.13Å; D398-A402 WeakPolarHBondContact O-CB 3.27Å; D398-A402 PolarHBondContact O-N 3.25Å; D398-P488 HydrophobicContact CB-CB 4.3Å
399	L	94.1	Very high	88.3	Confident	17 Å²	17	47.6 Å²	47.6	9%	0.089	27%	0.272	C	S	.	.	H	α-helix	trans	-67.6	-42.6	175.6	-165.1	73.5	0	0	0	111.4	F379 A382 L383 I396 G397 S403	F379-L399 HydrophobicContact CD2-CD2 4.21Å; F379-L399 HydrophobicContact CD2-CG 4.25Å; F379-L399 HydrophobicContact CE2-CD2 3.7Å; F379-L399 HydrophobicContact CE2-CG 3.94Å; F379-L399 HydrophobicContact CZ-CD2 4.45Å; A382-L399 HydrophobicContact CB-CD1 3.59Å; L383-L399 HydrophobicContact CB-CD2 4Å; L383-L399 HydrophobicContact CD1-CD2 4.06Å; I396-L399 HydrophobicContact CD1-CB 4.18Å; I396-L399 HydrophobicContact CD1-CD2 3.6Å; I396-L399 VanDerWaalsContact O-CB 3.23Å; I396-L399 WeakPolarHBondContact O-CB 3.37Å; I396-L399 PolarHBondContact O-N 3.01Å; I396-L399 VanDerWaalsContact O-N 3.08Å; G397-L399 PolarHBondContact O-N 2.89Å; L399-S403 VanDerWaalsContact O-CB 3.26Å; L399-S403 WeakPolarHBondContact O-CB 3.28Å; L399-S403 PolarHBondContact O-N 3.4Å; L399-S403 VanDerWaalsContact O-N 3.07Å; L399-S403 PolarHBondContact O-OG 3.46Å
400	F	94.9	Very high	88.3	Confident	1 Å²	1	43 Å²	43	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-65.4	-47.8	175.9	-81.1	-86.8	0	0	0	111.3	I327 F379 I396 G397 A402 S403 F404 F468 L472 A492 L496	I327-F400 HydrophobicContact CG2-CE2 4.37Å; I327-F400 HydrophobicContact CG2-CZ 3.95Å; F379-F400 HydrophobicContact CE1-CE1 4.36Å; F379-F400 HydrophobicContact CE1-CZ 4.39Å; F379-F400 HydrophobicContact CE2-CD1 4.3Å; F379-F400 HydrophobicContact CE2-CD2 4.45Å; F379-F400 HydrophobicContact CE2-CE1 4.25Å; F379-F400 HydrophobicContact CE2-CE2 4.4Å; F379-F400 HydrophobicContact CE2-CG 4.41Å; F379-F400 HydrophobicContact CE2-CZ 4.32Å; F379-F400 HydrophobicContact CZ-CD1 4.17Å; F379-F400 HydrophobicContact CZ-CD2 4.42Å; F379-F400 AromaticContact CZ-CE1 3.66Å; F379-F400 HydrophobicContact CZ-CE1 3.66Å; F379-F400 AromaticContact CZ-CE2 3.95Å; F379-F400 HydrophobicContact CZ-CE2 3.95Å; F379-F400 AromaticContact CZ-CZ 3.55Å; F379-F400 HydrophobicContact CZ-CZ 3.55Å; I396-F400 HydrophobicContact CG1-CD2 4.18Å; I396-F400 HydrophobicContact CG1-CE2 3.88Å; G397-F400 PolarHBondContact O-N 2.83Å; F400-A402 PolarHBondContact O-N 3.43Å; F400-S403 PolarHBondContact O-N 3.45Å; F400-F404 HydrophobicContact CB-CD2 4.45Å; F400-F404 AromaticContact CD1-CD2 3.8Å; F400-F404 HydrophobicContact CD1-CD2 3.8Å; F400-F404 AromaticContact CD1-CE2 3.63Å; F400-F404 HydrophobicContact CD1-CE2 3.63Å; F400-F404 HydrophobicContact CE1-CE2 4.06Å; F400-F404 WeakPolarHBondContact O-CD2 2.97Å; F400-F404 PolarHBondContact O-N 3.25Å; F400-F468 HydrophobicContact CE1-CB 4.18Å; F400-F468 AromaticContact CE1-CD1 3.51Å; F400-F468 HydrophobicContact CE1-CD1 3.51Å; F400-F468 AromaticContact CE1-CD2 3.92Å; F400-F468 HydrophobicContact CE1-CD2 3.92Å; F400-F468 AromaticContact CE1-CE1 3.61Å; F400-F468 HydrophobicContact CE1-CE1 3.61Å; F400-F468 HydrophobicContact CE1-CE2 4.02Å; F400-F468 AromaticContact CE1-CG 3.67Å; F400-F468 HydrophobicContact CE1-CG 3.67Å; F400-F468 AromaticContact CE1-CZ 3.87Å; F400-F468 HydrophobicContact CE1-CZ 3.87Å; F400-F468 AromaticContact CZ-CD1 3.9Å; F400-F468 HydrophobicContact CZ-CD1 3.9Å; F400-F468 AromaticContact CZ-CE1 3.94Å; F400-F468 HydrophobicContact CZ-CE1 3.94Å; F400-F468 HydrophobicContact CZ-CG 4.45Å; F400-L472 HydrophobicContact CB-CD1 4.31Å; F400-L472 HydrophobicContact CD1-CD1 4.02Å; F400-L472 HydrophobicContact CD2-CD1 3.93Å; F400-L472 HydrophobicContact CD2-CD2 4.01Å; F400-L472 HydrophobicContact CE1-CD1 4.29Å; F400-L472 HydrophobicContact CE2-CD1 4.21Å; F400-L472 HydrophobicContact CE2-CD2 3.74Å; F400-L472 HydrophobicContact CE2-CG 4.37Å; F400-L472 HydrophobicContact CG-CD1 3.82Å; F400-L472 HydrophobicContact CZ-CD1 4.37Å; F400-L472 HydrophobicContact CZ-CD2 4.22Å; F400-L472 HydrophobicContact CZ-CG 4.47Å; F400-A492 HydrophobicContact CB-CB 3.71Å; F400-L496 HydrophobicContact CD1-CD1 4.02Å
401	V	91.3	Very high	88.3	Confident	39 Å²	39	46.6 Å²	46.6	24%	0.236	27%	0.271	C	S	.	.	H	α-helix	trans	-56.7	-49.4	174.5	176.6	0	0	0	0	110.6	G397 S403 S405 L491 A492	G397-V401 PolarHBondContact O-N 3.04Å; G397-V401 VanDerWaalsContact O-N 3.08Å; V401-S403 PolarHBondContact O-N 2.68Å; V401-S405 VanDerWaalsContact O-CB 3.25Å; V401-S405 WeakPolarHBondContact O-CB 3.3Å; V401-S405 PolarHBondContact O-N 2.87Å; V401-S405 PolarHBondContact O-OG 3.01Å; V401-L491 HydrophobicContact CG2-CB 3.9Å; V401-A492 HydrophobicContact CG2-CB 4.06Å
402	A	91.4	Very high	88.8	Confident	56 Å²	56	44.1 Å²	44.1	46%	0.463	26%	0.259	S	S	.	.	H	α-helix	trans	-66.7	-19.7	-178.6	0	0	0	0	0	114.1	D398 F400 K406	D398-A402 WeakPolarHBondContact O-CB 3.27Å; D398-A402 PolarHBondContact O-N 3.25Å; F400-A402 PolarHBondContact O-N 3.43Å; A402-K406 WeakPolarHBondContact O-CE 3.25Å; A402-K406 PolarHBondContact O-NZ 3.01Å
403	S	90.5	Very high	89.3	Confident	23 Å²	23	38.5 Å²	38.5	16%	0.161	22%	0.219	C	C	.	.	H	α-helix	trans	-95.1	-46.8	-177.5	-57.9	0	0	0	0	112.5	F379 L399 F400 V401	F379-S403 WeakPolarHBondContact CD2-OG 3.43Å; L399-S403 VanDerWaalsContact O-CB 3.26Å; L399-S403 WeakPolarHBondContact O-CB 3.28Å; L399-S403 PolarHBondContact O-N 3.4Å; L399-S403 VanDerWaalsContact O-N 3.07Å; L399-S403 PolarHBondContact O-OG 3.46Å; F400-S403 PolarHBondContact O-N 3.45Å; V401-S403 PolarHBondContact O-N 2.68Å
404	F	90.9	Very high	89.7	Confident	8 Å²	8	37 Å²	37	4%	0.035	21%	0.208	C	C	.	.	H	α-helix	trans	-106.8	-11.4	-166	-56.7	-70.3	0	0	0	115.8	H376 F379 F400 K406 V409 F465 F468 L496 L499	H376-F404 AromaticContact CE1-CE1 3.79Å; H376-F404 AromaticContact CE1-CZ 3.88Å; H376-F404 AromaticContact NE2-CE1 3.69Å; F379-F404 HydrophobicContact CB-CZ 4.19Å; F379-F404 HydrophobicContact CD1-CE2 4.31Å; F379-F404 AromaticContact CD1-CZ 3.96Å; F379-F404 HydrophobicContact CD1-CZ 3.96Å; F379-F404 AromaticContact CD2-CE2 3.86Å; F379-F404 HydrophobicContact CD2-CE2 3.86Å; F379-F404 HydrophobicContact CD2-CZ 4.1Å; F379-F404 HydrophobicContact CE1-CE2 4.39Å; F379-F404 HydrophobicContact CE1-CZ 4.37Å; F379-F404 AromaticContact CE2-CE2 3.93Å; F379-F404 HydrophobicContact CE2-CE2 3.93Å; F379-F404 HydrophobicContact CE2-CZ 4.48Å; F379-F404 HydrophobicContact CG-CE2 4.06Å; F379-F404 AromaticContact CG-CZ 3.81Å; F379-F404 HydrophobicContact CG-CZ 3.81Å; F379-F404 HydrophobicContact CZ-CE2 4.2Å; F400-F404 HydrophobicContact CB-CD2 4.45Å; F400-F404 AromaticContact CD1-CD2 3.8Å; F400-F404 HydrophobicContact CD1-CD2 3.8Å; F400-F404 AromaticContact CD1-CE2 3.63Å; F400-F404 HydrophobicContact CD1-CE2 3.63Å; F400-F404 HydrophobicContact CE1-CE2 4.06Å; F400-F404 WeakPolarHBondContact O-CD2 2.97Å; F400-F404 PolarHBondContact O-N 3.25Å; F404-K406 PolarHBondContact O-N 3.24Å; F404-V409 HydrophobicContact CD1-CG1 4.17Å; F404-F465 AromaticContact CD1-CE1 3.81Å; F404-F465 HydrophobicContact CD1-CE1 3.81Å; F404-F465 HydrophobicContact CD1-CZ 4.42Å; F404-F465 HydrophobicContact CE1-CE1 4.17Å; F404-F465 HydrophobicContact CG-CE1 4.35Å; F404-F468 HydrophobicContact CE1-CE2 4.28Å; F404-F468 AromaticContact CE2-CE2 3.85Å; F404-F468 HydrophobicContact CE2-CE2 3.85Å; F404-F468 HydrophobicContact CE2-CZ 4.33Å; F404-F468 AromaticContact CZ-CE2 3.62Å; F404-F468 HydrophobicContact CZ-CE2 3.62Å; F404-F468 HydrophobicContact CZ-CZ 4.08Å; F404-L496 HydrophobicContact CB-CD2 3.96Å; F404-L496 HydrophobicContact CD2-CD2 4.14Å; F404-L496 HydrophobicContact CG-CD2 4.12Å; F404-L499 HydrophobicContact CB-CD2 4.48Å
405	S	82.9	Confident	89.8	Confident	56 Å²	56	38.5 Å²	38.5	39%	0.392	22%	0.217	S	C	.	.	S	Bend	trans	-72.9	-2.1	177.2	62.8	0	0	0	0	115.5	V401	V401-S405 VanDerWaalsContact O-CB 3.25Å; V401-S405 WeakPolarHBondContact O-CB 3.3Å; V401-S405 PolarHBondContact O-N 2.87Å; V401-S405 PolarHBondContact O-OG 3.01Å
406	K	83.4	Confident	89.9	Confident	108 Å²	108	35.8 Å²	35.8	47%	0.47	21%	0.205	S	C	.	.	S	Bend	trans	-83.7	134.6	-175.2	-65	166.7	-171.2	148.5	0	110.7	A402 F404 M408 V409	A402-K406 WeakPolarHBondContact O-CE 3.25Å; A402-K406 PolarHBondContact O-NZ 3.01Å; F404-K406 PolarHBondContact O-N 3.24Å; K406-M408 PolarHBondContact O-N 2.97Å; K406-M408 VanDerWaalsContact O-N 3.15Å; K406-V409 HydrophobicContact CB-CG2 4.36Å; K406-V409 WeakPolarHBondContact O-CB 3.26Å; K406-V409 PolarHBondContact O-N 3.3Å
407	S	78.9	Confident	89.7	Confident	82 Å²	82	36.4 Å²	36.4	57%	0.573	21%	0.209	S	C	*	.	H	α-helix	trans	-51.3	-41.9	178.7	62.1	0	0	0	0	113.2	V409 L410 D411	S407-V409 PolarHBondContact O-N 2.93Å; S407-L410 WeakPolarHBondContact O-CA 3.37Å; S407-L410 VanDerWaalsContact O-CB 3.32Å; S407-L410 WeakPolarHBondContact O-CB 3.46Å; S407-L410 PolarHBondContact O-N 2.84Å; S407-D411 VanDerWaalsContact C-OD2 3.25Å; S407-D411 PolarHBondContact O-N 3.44Å; S407-D411 VanDerWaalsContact O-OD2 3.04Å
408	M	85.9	Confident	89.4	Confident	120 Å²	120	39.1 Å²	39.1	59%	0.591	22%	0.224	S	C	*	.	H	α-helix	trans	-54.8	-27.5	178	-57.5	-173.8	-57.9	0	0	113.9	K406 V412	K406-M408 PolarHBondContact O-N 2.97Å; K406-M408 VanDerWaalsContact O-N 3.15Å; M408-V412 VanDerWaalsContact O-CB 3.31Å; M408-V412 WeakPolarHBondContact O-CB 3.37Å; M408-V412 WeakPolarHBondContact O-CG2 3.37Å; M408-V412 PolarHBondContact O-N 2.78Å; M408-V412 VanDerWaalsContact O-N 3.17Å
409	V	88.1	Confident	89.3	Confident	6 Å²	6	38.2 Å²	38.2	4%	0.036	22%	0.219	C	C	.	.	H	α-helix	trans	-74.1	-44.3	175.3	178.1	0	0	0	0	110.5	F404 K406 S407 Y413 F465 L499	F404-V409 HydrophobicContact CD1-CG1 4.17Å; K406-V409 HydrophobicContact CB-CG2 4.36Å; K406-V409 WeakPolarHBondContact O-CB 3.26Å; K406-V409 PolarHBondContact O-N 3.3Å; S407-V409 PolarHBondContact O-N 2.93Å; V409-Y413 HydrophobicContact CG1-CD2 4.12Å; V409-Y413 HydrophobicContact CG1-CE2 4.42Å; V409-Y413 WeakPolarHBondContact O-CB 3.31Å; V409-Y413 WeakPolarHBondContact O-CD2 3.46Å; V409-Y413 PolarHBondContact O-N 3.31Å; V409-F465 HydrophobicContact CG1-CZ 4.13Å; V409-L499 HydrophobicContact CG1-CD2 4.31Å
410	L	85.6	Confident	89.1	Confident	29 Å²	29	38.4 Å²	38.4	15%	0.152	22%	0.219	C	C	.	.	H	α-helix	trans	-57.8	-52	172.2	170.8	65.7	0	0	0	110.2	S407 V412 Y413 S414 L499 K502 L503	S407-L410 WeakPolarHBondContact O-CA 3.37Å; S407-L410 VanDerWaalsContact O-CB 3.32Å; S407-L410 WeakPolarHBondContact O-CB 3.46Å; S407-L410 PolarHBondContact O-N 2.84Å; L410-V412 PolarHBondContact O-N 3.22Å; L410-Y413 PolarHBondContact O-N 3.47Å; L410-S414 WeakPolarHBondContact O-CB 3.45Å; L410-S414 PolarHBondContact O-N 3.29Å; L410-S414 PolarHBondContact O-OG 3.18Å; L410-L499 HydrophobicContact CB-CD1 3.82Å; L410-L499 HydrophobicContact CD1-CD1 3.74Å; L410-L499 HydrophobicContact CG-CD1 4.37Å; L410-K502 HydrophobicContact CD1-CB 3.82Å; L410-K502 HydrophobicContact CD2-CD 4.04Å; L410-L503 HydrophobicContact CD1-CD2 3.96Å; L410-L503 HydrophobicContact CD1-CG 4.08Å
411	D	88.1	Confident	88.6	Confident	81 Å²	81	41.9 Å²	41.9	43%	0.433	24%	0.241	S	C	.	.	H	α-helix	trans	-58.5	-48.3	-175.8	-55.6	-39.2	0	0	0	111.6	S407 Y413 S414 D415	S407-D411 VanDerWaalsContact C-OD2 3.25Å; S407-D411 PolarHBondContact O-N 3.44Å; S407-D411 VanDerWaalsContact O-OD2 3.04Å; D411-Y413 PolarHBondContact O-N 2.85Å; D411-S414 PolarHBondContact O-N 3.35Å; D411-D415 PolarHBondContact O-N 2.7Å
412	V	92.6	Very high	88.4	Confident	13 Å²	13	43.8 Å²	43.8	8%	0.079	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-40.2	178.1	164.5	0	0	0	0	112.6	R368 E371 I372 M408 L410 Y416	R368-V412 HydrophobicContact CB-CG1 4.28Å; E371-V412 HydrophobicContact CB-CG1 3.72Å; E371-V412 HydrophobicContact CB-CG2 4Å; I372-V412 HydrophobicContact CG1-CG1 3.59Å; M408-V412 VanDerWaalsContact O-CB 3.31Å; M408-V412 WeakPolarHBondContact O-CB 3.37Å; M408-V412 WeakPolarHBondContact O-CG2 3.37Å; M408-V412 PolarHBondContact O-N 2.78Å; M408-V412 VanDerWaalsContact O-N 3.17Å; L410-V412 PolarHBondContact O-N 3.22Å; V412-Y416 PolarHBondContact O-N 3.02Å
413	Y	93.9	Very high	88.3	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-74.1	-33.8	176.9	-92.6	-96.4	0	0	0	112.7	Y334 I372 H376 V409 L410 D411 Y416 V417 P461 F465	Y334-Y413 PolarHBondContact OH-OH 3.45Å; I372-Y413 HydrophobicContact CB-CE2 4.48Å; I372-Y413 HydrophobicContact CD1-CD1 4.41Å; I372-Y413 HydrophobicContact CD1-CE1 4.32Å; I372-Y413 HydrophobicContact CD1-CE2 4.39Å; I372-Y413 HydrophobicContact CG1-CD2 4.16Å; I372-Y413 HydrophobicContact CG1-CE2 3.91Å; I372-Y413 HydrophobicContact CG2-CE2 4.09Å; I372-Y413 WeakPolarHBondContact CG2-OH 3.35Å; H376-Y413 PolarHBondContact NE2-OH 3.36Å; V409-Y413 HydrophobicContact CG1-CD2 4.12Å; V409-Y413 HydrophobicContact CG1-CE2 4.42Å; V409-Y413 WeakPolarHBondContact O-CB 3.31Å; V409-Y413 WeakPolarHBondContact O-CD2 3.46Å; V409-Y413 PolarHBondContact O-N 3.31Å; L410-Y413 PolarHBondContact O-N 3.47Å; D411-Y413 PolarHBondContact O-N 2.85Å; Y413-Y416 PolarHBondContact O-N 3.42Å; Y413-V417 WeakPolarHBondContact O-CB 3.41Å; Y413-V417 VanDerWaalsContact O-CG2 3.27Å; Y413-V417 WeakPolarHBondContact O-CG2 3.25Å; Y413-V417 PolarHBondContact O-N 3.12Å; Y413-P461 HydrophobicContact CE1-CB 4.07Å; Y413-P461 WeakPolarHBondContact CE1-O 3.42Å; Y413-F465 HydrophobicContact CD1-CD2 4.35Å; Y413-F465 AromaticContact CD1-CE2 3.5Å; Y413-F465 HydrophobicContact CD1-CE2 3.5Å; Y413-F465 VanDerWaalsContact CD1-CE2 3.5Å; Y413-F465 HydrophobicContact CD1-CZ 4.15Å; Y413-F465 AromaticContact CD2-CE2 3.93Å; Y413-F465 HydrophobicContact CD2-CE2 3.93Å; Y413-F465 AromaticContact CD2-CZ 3.86Å; Y413-F465 HydrophobicContact CD2-CZ 3.86Å; Y413-F465 HydrophobicContact CE1-CD2 4.36Å; Y413-F465 AromaticContact CE1-CE2 3.58Å; Y413-F465 HydrophobicContact CE1-CE2 3.58Å; Y413-F465 AromaticContact CE1-CZ 3.94Å; Y413-F465 HydrophobicContact CE1-CZ 3.94Å; Y413-F465 HydrophobicContact CE2-CE2 4.02Å; Y413-F465 AromaticContact CE2-CZ 3.65Å; Y413-F465 HydrophobicContact CE2-CZ 3.65Å; Y413-F465 AromaticContact CG-CE2 3.66Å; Y413-F465 HydrophobicContact CG-CE2 3.66Å; Y413-F465 HydrophobicContact CG-CZ 4.1Å; Y413-F465 AromaticContact CZ-CE2 3.84Å; Y413-F465 AromaticContact CZ-CZ 3.68Å
414	S	89.9	Confident	88.2	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-62.6	-51.6	175.4	-78.5	0	0	0	0	111.3	L410 D411 Y416 V417 N418 L503 Q506	L410-S414 WeakPolarHBondContact O-CB 3.45Å; L410-S414 PolarHBondContact O-N 3.29Å; L410-S414 PolarHBondContact O-OG 3.18Å; D411-S414 PolarHBondContact O-N 3.35Å; S414-Y416 PolarHBondContact O-N 2.94Å; S414-V417 PolarHBondContact O-N 3.26Å; S414-N418 VanDerWaalsContact O-CB 3.25Å; S414-N418 WeakPolarHBondContact O-CB 3.31Å; S414-N418 PolarHBondContact O-N 2.99Å; S414-N418 PolarHBondContact O-ND2 3.01Å; S414-N418 VanDerWaalsContact O-ND2 3.12Å; S414-L503 WeakPolarHBondContact OG-CD2 3.42Å; S414-Q506 PolarHBondContact OG-OE1 2.79Å
415	D	91.1	Very high	87.8	Confident	60 Å²	60	43.2 Å²	43.2	32%	0.321	24%	0.243	S	C	.	.	H	α-helix	trans	-54.6	-42.1	174.8	-83.3	-5	0	0	0	111.5	R368 D411 N419	R368-D415 HydrophobicContact CG-CB 3.52Å; R368-D415 IonicContact CZ-OD2 3.16Å; R368-D415 VanDerWaalsContact CZ-OD2 3.23Å; R368-D415 IonicContact NE-OD2 2.7Å; R368-D415 PolarHBondContact NE-OD2 2.77Å; R368-D415 IonicContact NH2-OD2 3.84Å; R368-D415 PolarHBondContact NH2-OD2 2.83Å; D411-D415 PolarHBondContact O-N 2.7Å; D415-N419 VanDerWaalsContact O-CB 3.26Å; D415-N419 WeakPolarHBondContact O-CB 3.44Å; D415-N419 PolarHBondContact O-N 3.21Å; D415-N419 VanDerWaalsContact O-N 3.12Å
416	Y	93.6	Very high	88	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.008	24%	0.236	C	C	.	.	H	α-helix	trans	-63.7	-52.7	176.2	-174.5	-102.8	0	0	0	113	H367 R368 I369 I372 V412 Y413 S414 N418 N419 F420 M458 P461 I462	H367-Y416 WeakPolarHBondContact O-CD2 3.35Å; R368-Y416 HydrophobicContact CB-CD2 4.48Å; I369-Y416 HydrophobicContact CD1-CD2 4.14Å; I369-Y416 HydrophobicContact CD1-CE2 3.33Å; I369-Y416 HydrophobicContact CG1-CD2 4.47Å; I369-Y416 HydrophobicContact CG1-CE2 3.87Å; I372-Y416 HydrophobicContact CD1-CD1 4.07Å; I372-Y416 HydrophobicContact CD1-CD2 4.06Å; I372-Y416 HydrophobicContact CD1-CG 3.65Å; V412-Y416 PolarHBondContact O-N 3.02Å; Y413-Y416 PolarHBondContact O-N 3.42Å; S414-Y416 PolarHBondContact O-N 2.94Å; Y416-N418 PolarHBondContact O-N 3.34Å; Y416-N419 PolarHBondContact O-N 2.9Å; Y416-F420 HydrophobicContact CE1-CD2 4.38Å; Y416-F420 PolarHBondContact O-N 2.78Å; Y416-M458 WeakPolarHBondContact OH-CB 3.32Å; Y416-M458 PolarHBondContact OH-O 2.96Å; Y416-P461 HydrophobicContact CD1-CB 4.06Å; Y416-P461 HydrophobicContact CE1-CB 3.75Å; Y416-P461 HydrophobicContact CE1-CG 3.84Å; Y416-I462 HydrophobicContact CE1-CG1 4.23Å
417	V	90.3	Very high	88.2	Confident	13 Å²	13	38.6 Å²	38.6	8%	0.079	22%	0.218	C	C	.	.	H	α-helix	trans	-65.2	-40.7	-176.1	170.1	0	0	0	0	111.2	Y413 S414 F420 I462 K507	Y413-V417 WeakPolarHBondContact O-CB 3.41Å; Y413-V417 VanDerWaalsContact O-CG2 3.27Å; Y413-V417 WeakPolarHBondContact O-CG2 3.25Å; Y413-V417 PolarHBondContact O-N 3.12Å; S414-V417 PolarHBondContact O-N 3.26Å; V417-F420 WeakPolarHBondContact O-CB 3.34Å; V417-F420 PolarHBondContact O-N 2.89Å; V417-I462 HydrophobicContact CG2-CG1 4.38Å; V417-K507 HydrophobicContact CG1-CB 3.91Å; V417-K507 HydrophobicContact CG1-CD 3.89Å; V417-K507 HydrophobicContact CG1-CG 3.95Å
418	N	87.6	Confident	88.4	Confident	57 Å²	57	39 Å²	39	31%	0.305	21%	0.209	S	C	.	.	H	α-helix	trans	-66.1	-39.8	177.6	-67.9	-25.1	0	0	0	111.6	S414 Y416 K507 A510	S414-N418 VanDerWaalsContact O-CB 3.25Å; S414-N418 WeakPolarHBondContact O-CB 3.31Å; S414-N418 PolarHBondContact O-N 2.99Å; S414-N418 PolarHBondContact O-ND2 3.01Å; S414-N418 VanDerWaalsContact O-ND2 3.12Å; Y416-N418 PolarHBondContact O-N 3.34Å; N418-K507 WeakPolarHBondContact OD1-CA 3.44Å; N418-A510 HydrophobicContact CB-CB 4.44Å
419	N	90.1	Very high	88.3	Confident	26 Å²	26	39.8 Å²	39.8	14%	0.139	21%	0.21	C	C	.	.	H	α-helix	trans	-80.1	-18.1	178	178.3	64.6	0	0	0	113.9	P364 D415 Y416 T421 N422 A423	P364-N419 PolarHBondContact O-ND2 3.26Å; D415-N419 VanDerWaalsContact O-CB 3.26Å; D415-N419 WeakPolarHBondContact O-CB 3.44Å; D415-N419 PolarHBondContact O-N 3.21Å; D415-N419 VanDerWaalsContact O-N 3.12Å; Y416-N419 PolarHBondContact O-N 2.9Å; N419-T421 VanDerWaalsContact C-N 3.32Å; N419-T421 PolarHBondContact O-N 3.34Å; N419-N422 WeakPolarHBondContact O-CA 3.42Å; N419-N422 WeakPolarHBondContact O-CB 3.22Å; N419-N422 PolarHBondContact O-N 3.12Å; N419-N422 PolarHBondContact OD1-ND2 3.38Å; N419-A423 PolarHBondContact O-N 3.17Å
420	F	89.4	Confident	88.2	Confident	22 Å²	22	39.8 Å²	39.8	10%	0.096	21%	0.211	C	C	.	.	H	α-helix	trans	-51.1	-46.4	-175.8	178.8	-94.3	0	0	0	113.3	Y416 V417 N422 A423 M424 Y455 M458 V459 I462	Y416-F420 HydrophobicContact CE1-CD2 4.38Å; Y416-F420 PolarHBondContact O-N 2.78Å; V417-F420 WeakPolarHBondContact O-CB 3.34Å; V417-F420 PolarHBondContact O-N 2.89Å; F420-N422 VanDerWaalsContact C-N 3.31Å; F420-N422 PolarHBondContact O-N 2.92Å; F420-A423 PolarHBondContact O-N 2.9Å; F420-M424 HydrophobicContact CD1-CG 4.14Å; F420-M424 HydrophobicContact CD2-CE 4.09Å; F420-M424 HydrophobicContact CE1-CG 3.68Å; F420-M424 HydrophobicContact CE2-CE 3.7Å; F420-M424 HydrophobicContact CE2-CG 4.12Å; F420-M424 HydrophobicContact CE2-SD 4.14Å; F420-M424 HydrophobicContact CZ-CE 4.13Å; F420-M424 HydrophobicContact CZ-CG 3.66Å; F420-M424 HydrophobicContact CZ-SD 3.95Å; F420-M424 WeakPolarHBondContact O-CG 3.38Å; F420-M424 PolarHBondContact O-N 2.9Å; F420-Y455 HydrophobicContact CZ-CE2 4.07Å; F420-M458 HydrophobicContact CE2-CB 4.06Å; F420-M458 WeakPolarHBondContact CE2-O 3.14Å; F420-V459 HydrophobicContact CE2-CG2 4.12Å; F420-V459 HydrophobicContact CZ-CG2 3.63Å; F420-I462 HydrophobicContact CB-CD1 4.28Å; F420-I462 HydrophobicContact CD1-CD1 3.96Å; F420-I462 HydrophobicContact CD2-CD1 3.81Å; F420-I462 HydrophobicContact CE1-CD1 4.25Å; F420-I462 HydrophobicContact CE2-CD1 4.1Å; F420-I462 HydrophobicContact CG-CD1 3.74Å; F420-I462 HydrophobicContact CZ-CD1 4.33Å
421	T	85.4	Confident	88.2	Confident	74 Å²	74	39.8 Å²	39.8	45%	0.454	21%	0.213	S	C	.	.	H	α-helix	trans	-59.9	-39.9	178.3	-52.9	0	0	0	0	112.1	N419 A425	N419-T421 VanDerWaalsContact C-N 3.32Å; N419-T421 PolarHBondContact O-N 3.34Å; T421-A425 PolarHBondContact O-N 3.41Å; T421-A425 VanDerWaalsContact O-N 3.09Å
422	N	86.8	Confident	88	Confident	79 Å²	79	39.6 Å²	39.6	42%	0.422	21%	0.21	S	C	.	.	H	α-helix	trans	-69.2	-45.3	176.3	173.6	49.4	0	0	0	111.7	N419 F420 M424 A425 L426	N419-N422 WeakPolarHBondContact O-CA 3.42Å; N419-N422 WeakPolarHBondContact O-CB 3.22Å; N419-N422 PolarHBondContact O-N 3.12Å; N419-N422 PolarHBondContact OD1-ND2 3.38Å; F420-N422 VanDerWaalsContact C-N 3.31Å; F420-N422 PolarHBondContact O-N 2.92Å; N422-M424 VanDerWaalsContact C-N 3.32Å; N422-M424 PolarHBondContact O-N 3.5Å; N422-A425 PolarHBondContact O-N 3.3Å; N422-L426 WeakPolarHBondContact O-CG 3.02Å; N422-L426 PolarHBondContact O-N 2.68Å
423	A	89.4	Confident	87.6	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.008	23%	0.231	C	C	.	.	H	α-helix	trans	-56.5	-44.7	174.7	0	0	0	0	0	111.8	N419 F420 L426 I427 M458	N419-A423 PolarHBondContact O-N 3.17Å; F420-A423 PolarHBondContact O-N 2.9Å; A423-L426 PolarHBondContact O-N 3.1Å; A423-I427 WeakPolarHBondContact O-CG1 2.94Å; A423-I427 PolarHBondContact O-N 3.1Å; A423-M458 HydrophobicContact CB-CE 4.16Å
424	M	87.8	Confident	87.3	Confident	30 Å²	30	46.1 Å²	46.1	15%	0.148	25%	0.247	C	C	.	.	H	α-helix	trans	-64.5	-40.7	176.3	-66.3	-50.9	108.9	0	0	112.5	F420 N422 L426 I427 K428 Y455 M458	F420-M424 HydrophobicContact CD1-CG 4.14Å; F420-M424 HydrophobicContact CD2-CE 4.09Å; F420-M424 HydrophobicContact CE1-CG 3.68Å; F420-M424 HydrophobicContact CE2-CE 3.7Å; F420-M424 HydrophobicContact CE2-CG 4.12Å; F420-M424 HydrophobicContact CE2-SD 4.14Å; F420-M424 HydrophobicContact CZ-CE 4.13Å; F420-M424 HydrophobicContact CZ-CG 3.66Å; F420-M424 HydrophobicContact CZ-SD 3.95Å; F420-M424 WeakPolarHBondContact O-CG 3.38Å; F420-M424 PolarHBondContact O-N 2.9Å; N422-M424 VanDerWaalsContact C-N 3.32Å; N422-M424 PolarHBondContact O-N 3.5Å; M424-L426 VanDerWaalsContact C-N 3.35Å; M424-L426 PolarHBondContact O-N 3.47Å; M424-I427 HydrophobicContact CE-CD1 3.72Å; M424-I427 PolarHBondContact O-N 3.49Å; M424-I427 HydrophobicContact SD-CD1 4.22Å; M424-K428 WeakPolarHBondContact O-CB 3.2Å; M424-K428 PolarHBondContact O-N 2.95Å; M424-Y455 HydrophobicContact CG-CD2 4.33Å; M424-Y455 HydrophobicContact CG-CE2 4.3Å; M424-Y455 HydrophobicContact SD-CD2 3.51Å; M424-Y455 VanDerWaalsContact SD-CD2 3.51Å; M424-Y455 HydrophobicContact SD-CE2 4.05Å; M424-M458 HydrophobicContact CE-CB 4.04Å; M424-M458 HydrophobicContact CE-CE 3.42Å; M424-M458 VanDerWaalsContact CE-CE 3.42Å; M424-M458 HydrophobicContact CE-SD 3.68Å
425	A	82.1	Confident	87.2	Confident	44 Å²	44	51 Å²	51	36%	0.364	28%	0.278	S	S	.	.	H	α-helix	trans	-64	-38.6	175	0	0	0	0	0	112.4	T421 N422 K428 K429	T421-A425 PolarHBondContact O-N 3.41Å; T421-A425 VanDerWaalsContact O-N 3.09Å; N422-A425 PolarHBondContact O-N 3.3Å; A425-K428 PolarHBondContact O-N 3.49Å; A425-K429 VanDerWaalsContact O-CB 3.31Å; A425-K429 WeakPolarHBondContact O-CB 3.37Å; A425-K429 PolarHBondContact O-N 3.28Å
426	L	88.2	Confident	87	Confident	46 Å²	46	50.8 Å²	50.8	24%	0.241	29%	0.285	C	S	.	.	H	α-helix	trans	-66.8	-45.3	175.7	-72.2	172.2	0	0	0	112.3	P364 I365 N422 A423 M424 K429 A430	P364-L426 HydrophobicContact CB-CD1 3.8Å; I365-L426 HydrophobicContact CD1-CB 4.15Å; I365-L426 HydrophobicContact CG1-CB 3.91Å; I365-L426 HydrophobicContact CG1-CD1 4.39Å; N422-L426 WeakPolarHBondContact O-CG 3.02Å; N422-L426 PolarHBondContact O-N 2.68Å; A423-L426 PolarHBondContact O-N 3.1Å; M424-L426 VanDerWaalsContact C-N 3.35Å; M424-L426 PolarHBondContact O-N 3.47Å; L426-K429 PolarHBondContact O-N 3.22Å; L426-A430 VanDerWaalsContact O-CB 3.3Å; L426-A430 WeakPolarHBondContact O-CB 3.34Å; L426-A430 PolarHBondContact O-N 3Å
427	I	87.3	Confident	86.8	Confident	20 Å²	20	50.8 Å²	50.8	10%	0.103	29%	0.285	C	S	.	.	H	α-helix	trans	-56.9	-51.3	172.6	-69.1	167.3	0	0	0	109.7	I365 A423 M424 K429 A430 C431 F437 L441 L454 M458	I365-I427 HydrophobicContact CD1-CG1 3.99Å; I365-I427 HydrophobicContact CG1-CG1 4.19Å; I365-I427 HydrophobicContact CG2-CD1 3.83Å; I365-I427 HydrophobicContact CG2-CG1 3.8Å; A423-I427 WeakPolarHBondContact O-CG1 2.94Å; A423-I427 PolarHBondContact O-N 3.1Å; M424-I427 HydrophobicContact CE-CD1 3.72Å; M424-I427 PolarHBondContact O-N 3.49Å; M424-I427 HydrophobicContact SD-CD1 4.22Å; I427-K429 PolarHBondContact O-N 3.11Å; I427-A430 WeakPolarHBondContact O-CB 3.49Å; I427-A430 PolarHBondContact O-N 2.9Å; I427-A430 VanDerWaalsContact O-N 3.1Å; I427-C431 PolarHBondContact O-N 2.63Å; I427-C431 PolarHBondContact O-SG 3.24Å; I427-F437 HydrophobicContact CG2-CE1 4.17Å; I427-F437 HydrophobicContact CG2-CZ 4.43Å; I427-L441 HydrophobicContact CG2-CD1 4.17Å; I427-L454 HydrophobicContact CD1-CD2 4.02Å; I427-L454 HydrophobicContact CD1-CG 4.48Å; I427-M458 HydrophobicContact CD1-SD 3.95Å
428	K	83.4	Confident	86.7	Confident	90 Å²	90	53.4 Å²	53.4	39%	0.391	30%	0.298	S	S	.	.	H	α-helix	trans	-62.8	-42.4	-176	-153.6	178.4	-170.4	-142.9	0	112	M424 A425 C431 M432 L587 V588	M424-K428 WeakPolarHBondContact O-CB 3.2Å; M424-K428 PolarHBondContact O-N 2.95Å; A425-K428 PolarHBondContact O-N 3.49Å; K428-C431 PolarHBondContact O-N 2.88Å; K428-M432 PolarHBondContact O-N 2.69Å; K428-L587 WeakPolarHBondContact CD-O 3.48Å; K428-L587 WeakPolarHBondContact CE-O 3.49Å; K428-L587 WeakPolarHBondContact CG-O 3.3Å; K428-L587 PolarHBondContact NZ-O 3.31Å; K428-V588 HydrophobicContact CB-CG2 4.22Å; K428-V588 HydrophobicContact CD-CG2 4.35Å; K428-V588 HydrophobicContact CG-CG2 4.22Å
429	K	84.4	Confident	86.7	Confident	138 Å²	138	55.7 Å²	55.7	60%	0.6	31%	0.307	S	S	*	.	H	α-helix	trans	-64.2	-37.4	173.2	-175.8	173.4	-179.1	175.2	0	112.4	A425 L426 I427 M432 S433	A425-K429 VanDerWaalsContact O-CB 3.31Å; A425-K429 WeakPolarHBondContact O-CB 3.37Å; A425-K429 PolarHBondContact O-N 3.28Å; L426-K429 PolarHBondContact O-N 3.22Å; I427-K429 PolarHBondContact O-N 3.11Å; K429-M432 PolarHBondContact O-N 3.42Å; K429-S433 WeakPolarHBondContact O-CB 3.24Å; K429-S433 PolarHBondContact O-N 3.13Å; K429-S433 VanDerWaalsContact O-N 3.1Å; K429-S433 PolarHBondContact O-OG 3.27Å
430	A	86.3	Confident	86.8	Confident	6 Å²	6	55.7 Å²	55.7	5%	0.05	31%	0.306	C	S	.	.	H	α-helix	trans	-65.8	-42.4	175.4	0	0	0	0	0	111.9	L357 L426 I427 M432 S433 K434 F437	L357-A430 HydrophobicContact CD1-CB 4.23Å; L357-A430 HydrophobicContact CD2-CB 4Å; L426-A430 VanDerWaalsContact O-CB 3.3Å; L426-A430 WeakPolarHBondContact O-CB 3.34Å; L426-A430 PolarHBondContact O-N 3Å; I427-A430 WeakPolarHBondContact O-CB 3.49Å; I427-A430 PolarHBondContact O-N 2.9Å; I427-A430 VanDerWaalsContact O-N 3.1Å; A430-M432 VanDerWaalsContact C-N 3.29Å; A430-M432 PolarHBondContact O-N 3.34Å; A430-S433 PolarHBondContact O-N 3.13Å; A430-K434 PolarHBondContact O-N 3.33Å; A430-F437 HydrophobicContact CB-CD1 3.45Å; A430-F437 VanDerWaalsContact CB-CD1 3.45Å; A430-F437 HydrophobicContact CB-CE1 3.54Å; A430-F437 HydrophobicContact CB-CG 4.21Å; A430-F437 HydrophobicContact CB-CZ 4.37Å
431	C	85.4	Confident	86.8	Confident	29 Å²	29	55.8 Å²	55.8	20%	0.196	31%	0.307	C	S	.	.	H	α-helix	trans	-59.7	-36.6	176.1	-67	0	0	0	0	113.1	I427 K428 L438	I427-C431 PolarHBondContact O-N 2.63Å; I427-C431 PolarHBondContact O-SG 3.24Å; K428-C431 PolarHBondContact O-N 2.88Å; C431-L438 HydrophobicContact CB-CB 4.45Å; C431-L438 HydrophobicContact CB-CD1 4.27Å
432	M	82.2	Confident	86.8	Confident	77 Å²	77	58.6 Å²	58.6	38%	0.379	31%	0.313	S	S	.	.	H	α-helix	trans	-69.1	-46.2	173.5	-63.8	176	68.1	0	0	112.8	K428 K429 A430 I584 L587 V588	K428-M432 PolarHBondContact O-N 2.69Å; K429-M432 PolarHBondContact O-N 3.42Å; A430-M432 VanDerWaalsContact C-N 3.29Å; A430-M432 PolarHBondContact O-N 3.34Å; M432-I584 HydrophobicContact CE-CG2 4.41Å; M432-L587 HydrophobicContact CE-CB 3.56Å; M432-L587 HydrophobicContact CE-CD1 3.95Å; M432-L587 HydrophobicContact CE-CG 4.41Å; M432-L587 HydrophobicContact CG-CB 3.75Å; M432-L587 HydrophobicContact CG-CD1 4.21Å; M432-L587 HydrophobicContact CG-CG 4.44Å; M432-L587 HydrophobicContact SD-CB 3.41Å; M432-L587 WeakPolarHBondContact SD-CB 3.37Å; M432-V588 HydrophobicContact SD-CG2 3.72Å
433	S	84.8	Confident	87	Confident	75 Å²	75	62.7 Å²	62.7	52%	0.524	32%	0.323	S	S	.	.	H	α-helix	trans	-92.7	-9.5	-165.6	54.9	0	0	0	0	114.4	K429 A430	K429-S433 WeakPolarHBondContact O-CB 3.24Å; K429-S433 PolarHBondContact O-N 3.13Å; K429-S433 VanDerWaalsContact O-N 3.1Å; K429-S433 PolarHBondContact O-OG 3.27Å; A430-S433 PolarHBondContact O-N 3.13Å
434	K	87.7	Confident	86.8	Confident	77 Å²	77	65.1 Å²	65.1	34%	0.335	33%	0.333	S	S	.	.			trans	-139.8	100.4	176.3	-74.2	-158.8	170.4	-154.4	0	111.3	R355 I356 L357 A430 A436 F437 L438	R355-K434 PolarHBondContact O-NZ 3.24Å; I356-K434 WeakPolarHBondContact O-CD 3.27Å; I356-K434 WeakPolarHBondContact O-CE 3.25Å; I356-K434 PolarHBondContact O-NZ 3.33Å; L357-K434 HydrophobicContact CD2-CD 4.25Å; A430-K434 PolarHBondContact O-N 3.33Å; K434-A436 VanDerWaalsContact C-N 3.26Å; K434-A436 PolarHBondContact O-N 3.1Å; K434-F437 HydrophobicContact CB-CB 4.04Å; K434-F437 WeakPolarHBondContact O-CB 3.37Å; K434-F437 PolarHBondContact O-N 2.91Å; K434-L438 PolarHBondContact O-N 3.39Å
435	P	87.2	Confident	86.8	Confident	105 Å²	105	66.9 Å²	66.9	68%	0.682	34%	0.341	S	S	*	.	H	α-helix	trans	-52.8	-40.7	175.1	-29.1	36.4	0	0	0	113.5	F437 L438 E439	P435-F437 PolarHBondContact O-N 3.2Å; P435-L438 PolarHBondContact O-N 3.33Å; P435-L438 VanDerWaalsContact O-N 3.13Å; P435-E439 WeakPolarHBondContact O-CB 3.38Å; P435-E439 PolarHBondContact O-N 2.95Å
436	A	87.9	Confident	87	Confident	56 Å²	56	68.7 Å²	68.7	46%	0.463	36%	0.356	S	S	.	.	H	α-helix	trans	-60.5	-28.3	176.9	0	0	0	0	0	114	K434 F440	K434-A436 VanDerWaalsContact C-N 3.26Å; K434-A436 PolarHBondContact O-N 3.1Å; A436-F440 VanDerWaalsContact O-CB 3.26Å; A436-F440 WeakPolarHBondContact O-CB 3.44Å; A436-F440 PolarHBondContact O-N 2.9Å
437	F	90	Very high	86.8	Confident	2 Å²	2	70.2 Å²	70.2	1%	0.009	37%	0.37	C	S	.	.	H	α-helix	trans	-77.5	-40.5	174.5	178.7	-108	0	0	0	111.7	L349 I356 L357 I427 A430 K434 P435 E439 F440 L441	L349-F437 HydrophobicContact CD1-CE2 3.91Å; L349-F437 HydrophobicContact CD2-CD2 3.84Å; L349-F437 HydrophobicContact CD2-CE2 3.84Å; I356-F437 HydrophobicContact CG2-CB 3.73Å; I356-F437 HydrophobicContact CG2-CD2 3.86Å; I356-F437 HydrophobicContact CG2-CG 4.3Å; L357-F437 HydrophobicContact CD1-CD2 3.54Å; L357-F437 HydrophobicContact CD1-CE1 4.39Å; L357-F437 HydrophobicContact CD1-CE2 3.41Å; L357-F437 VanDerWaalsContact CD1-CE2 3.41Å; L357-F437 HydrophobicContact CD1-CG 4.1Å; L357-F437 HydrophobicContact CD1-CZ 3.86Å; L357-F437 HydrophobicContact CG-CD2 3.97Å; L357-F437 HydrophobicContact CG-CE2 4.33Å; L357-F437 HydrophobicContact CG-CG 4.36Å; I427-F437 HydrophobicContact CG2-CE1 4.17Å; I427-F437 HydrophobicContact CG2-CZ 4.43Å; A430-F437 HydrophobicContact CB-CD1 3.45Å; A430-F437 VanDerWaalsContact CB-CD1 3.45Å; A430-F437 HydrophobicContact CB-CE1 3.54Å; A430-F437 HydrophobicContact CB-CG 4.21Å; A430-F437 HydrophobicContact CB-CZ 4.37Å; K434-F437 HydrophobicContact CB-CB 4.04Å; K434-F437 WeakPolarHBondContact O-CB 3.37Å; K434-F437 PolarHBondContact O-N 2.91Å; P435-F437 PolarHBondContact O-N 3.2Å; F437-E439 VanDerWaalsContact C-N 3.32Å; F437-F440 PolarHBondContact O-N 2.86Å; F437-L441 HydrophobicContact CD1-CD1 4.21Å; F437-L441 HydrophobicContact CE1-CD1 3.59Å; F437-L441 HydrophobicContact CE1-CG 4.26Å; F437-L441 HydrophobicContact CE2-CD1 4.4Å; F437-L441 HydrophobicContact CE2-CD2 4.38Å; F437-L441 HydrophobicContact CE2-CG 4.27Å; F437-L441 HydrophobicContact CZ-CD1 3.71Å; F437-L441 HydrophobicContact CZ-CD2 4.27Å; F437-L441 HydrophobicContact CZ-CG 4.06Å; F437-L441 WeakPolarHBondContact O-CG 3.35Å; F437-L441 PolarHBondContact O-N 3.41Å
438	L	87	Confident	86.7	Confident	68 Å²	68	69.6 Å²	69.6	36%	0.356	37%	0.368	S	S	.	.	H	α-helix	trans	-62.2	-41.5	172.9	176.9	60.2	0	0	0	111.3	C431 K434 P435 L441 K442	C431-L438 HydrophobicContact CB-CB 4.45Å; C431-L438 HydrophobicContact CB-CD1 4.27Å; K434-L438 PolarHBondContact O-N 3.39Å; P435-L438 PolarHBondContact O-N 3.33Å; P435-L438 VanDerWaalsContact O-N 3.13Å; L438-L441 PolarHBondContact O-N 2.75Å; L438-K442 WeakPolarHBondContact O-CG 3.35Å; L438-K442 PolarHBondContact O-N 3.23Å
439	E	88	Confident	86.6	Confident	104 Å²	104	72.6 Å²	72.6	49%	0.486	39%	0.393	S	S	.	.	H	α-helix	trans	-66.5	-44.2	176.1	-157.9	-154.8	141.8	0	0	111.7	P435 F437 L441 K442 R443	P435-E439 WeakPolarHBondContact O-CB 3.38Å; P435-E439 PolarHBondContact O-N 2.95Å; F437-E439 VanDerWaalsContact C-N 3.32Å; E439-L441 VanDerWaalsContact C-N 3.33Å; E439-L441 PolarHBondContact O-N 3.47Å; E439-K442 PolarHBondContact O-N 2.87Å; E439-R443 VanDerWaalsContact O-CB 3.28Å; E439-R443 WeakPolarHBondContact O-CB 3.39Å; E439-R443 PolarHBondContact O-N 3Å; E439-R443 IonicContact OE1-CZ 2.61Å; E439-R443 IonicContact OE1-NE 3.59Å; E439-R443 IonicContact OE1-NH2 2.63Å; E439-R443 PolarHBondContact OE1-NH2 3.32Å
440	F	91.5	Very high	86.5	Confident	27 Å²	27	69.6 Å²	69.6	12%	0.118	38%	0.384	C	S	.	.	H	α-helix	trans	-54.3	-47.5	172.9	171.6	-90.3	0	0	0	112	Y345 P348 L349 I356 A436 F437 R443 K444	Y345-F440 HydrophobicContact CD1-CE1 4.11Å; P348-F440 HydrophobicContact CB-CE2 4.05Å; P348-F440 HydrophobicContact CB-CZ 4.11Å; L349-F440 HydrophobicContact CD1-CE1 4Å; L349-F440 HydrophobicContact CD2-CD1 3.85Å; L349-F440 HydrophobicContact CD2-CE1 3.7Å; L349-F440 HydrophobicContact CD2-CG 4.37Å; L349-F440 HydrophobicContact CD2-CZ 4.09Å; L349-F440 HydrophobicContact CG-CD1 4.33Å; L349-F440 HydrophobicContact CG-CE1 3.67Å; L349-F440 HydrophobicContact CG-CZ 3.88Å; I356-F440 HydrophobicContact CD1-CB 4.17Å; I356-F440 HydrophobicContact CD1-CD2 3.69Å; I356-F440 HydrophobicContact CD1-CE2 4.36Å; I356-F440 HydrophobicContact CD1-CG 4.05Å; A436-F440 VanDerWaalsContact O-CB 3.26Å; A436-F440 WeakPolarHBondContact O-CB 3.44Å; A436-F440 PolarHBondContact O-N 2.9Å; F437-F440 PolarHBondContact O-N 2.86Å; F440-R443 PolarHBondContact O-N 2.93Å; F440-K444 HydrophobicContact CD2-CG 4.5Å; F440-K444 HydrophobicContact CE1-CG 4.13Å; F440-K444 HydrophobicContact CE2-CG 4.13Å; F440-K444 HydrophobicContact CZ-CG 3.92Å; F440-K444 WeakPolarHBondContact O-CB 3.46Å; F440-K444 WeakPolarHBondContact O-CG 3.43Å; F440-K444 PolarHBondContact O-N 3.4Å
441	L	89.1	Confident	86.4	Confident	23 Å²	23	78.5 Å²	78.5	12%	0.12	42%	0.416	C	S	.	.	H	α-helix	trans	-64.5	-43.5	178	-70	-178	0	0	0	112.4	Y345 I427 F437 L438 E439 K444 Q445 L454	Y345-L441 HydrophobicContact CD1-CD2 3.76Å; Y345-L441 HydrophobicContact CE1-CD2 3.75Å; I427-L441 HydrophobicContact CG2-CD1 4.17Å; F437-L441 HydrophobicContact CD1-CD1 4.21Å; F437-L441 HydrophobicContact CE1-CD1 3.59Å; F437-L441 HydrophobicContact CE1-CG 4.26Å; F437-L441 HydrophobicContact CE2-CD1 4.4Å; F437-L441 HydrophobicContact CE2-CD2 4.38Å; F437-L441 HydrophobicContact CE2-CG 4.27Å; F437-L441 HydrophobicContact CZ-CD1 3.71Å; F437-L441 HydrophobicContact CZ-CD2 4.27Å; F437-L441 HydrophobicContact CZ-CG 4.06Å; F437-L441 WeakPolarHBondContact O-CG 3.35Å; F437-L441 PolarHBondContact O-N 3.41Å; L438-L441 PolarHBondContact O-N 2.75Å; E439-L441 VanDerWaalsContact C-N 3.33Å; E439-L441 PolarHBondContact O-N 3.47Å; L441-K444 PolarHBondContact O-N 3.14Å; L441-Q445 WeakPolarHBondContact O-CB 3.46Å; L441-Q445 PolarHBondContact O-N 3.19Å; L441-L454 HydrophobicContact CD2-CB 4.27Å; L441-L454 HydrophobicContact CD2-CD2 3.72Å
442	K	87.2	Confident	86.4	Confident	134 Å²	134	79.7 Å²	79.7	58%	0.583	42%	0.42	S	S	*	.	H	α-helix	trans	-60.6	-46.1	174.9	-77.3	-177.3	174.9	-171.6	0	111.7	L438 E439 K444 Q445 A446	L438-K442 WeakPolarHBondContact O-CG 3.35Å; L438-K442 PolarHBondContact O-N 3.23Å; E439-K442 PolarHBondContact O-N 2.87Å; K442-K444 PolarHBondContact O-N 3.07Å; K442-Q445 PolarHBondContact O-N 3.34Å; K442-A446 WeakPolarHBondContact O-CB 3.38Å; K442-A446 PolarHBondContact O-N 2.74Å
443	R	89.4	Confident	86.8	Confident	165 Å²	165	78.7 Å²	78.7	62%	0.623	42%	0.418	S	S	*	.	H	α-helix	trans	-62.1	-43.4	179.6	-163.5	-172.9	-63.6	-178.4	-0.9	111	E439 F440 A446 S447	E439-R443 VanDerWaalsContact O-CB 3.28Å; E439-R443 WeakPolarHBondContact O-CB 3.39Å; E439-R443 PolarHBondContact O-N 3Å; E439-R443 IonicContact OE1-CZ 2.61Å; E439-R443 IonicContact OE1-NE 3.59Å; E439-R443 IonicContact OE1-NH2 2.63Å; E439-R443 PolarHBondContact OE1-NH2 3.32Å; F440-R443 PolarHBondContact O-N 2.93Å; R443-A446 PolarHBondContact O-N 2.95Å; R443-S447 PolarHBondContact O-N 3.3Å; R443-S447 PolarHBondContact O-OG 3.11Å
444	K	87	Confident	87	Confident	52 Å²	52	75.6 Å²	75.6	23%	0.226	40%	0.395	C	S	.	.	H	α-helix	trans	-67.1	-37.6	176.2	-74.6	-65.9	-173.6	172.9	0	113.7	E344 Y345 F440 L441 K442 S447 S448	E344-K444 HydrophobicContact CB-CD 4.34Å; E344-K444 WeakPolarHBondContact O-CE 3.41Å; E344-K444 PolarHBondContact O-NZ 2.92Å; Y345-K444 HydrophobicContact CD1-CB 4.47Å; Y345-K444 HydrophobicContact CE1-CB 3.69Å; Y345-K444 HydrophobicContact CE1-CG 4.34Å; F440-K444 HydrophobicContact CD2-CG 4.5Å; F440-K444 HydrophobicContact CE1-CG 4.13Å; F440-K444 HydrophobicContact CE2-CG 4.13Å; F440-K444 HydrophobicContact CZ-CG 3.92Å; F440-K444 WeakPolarHBondContact O-CB 3.46Å; F440-K444 WeakPolarHBondContact O-CG 3.43Å; F440-K444 PolarHBondContact O-N 3.4Å; L441-K444 PolarHBondContact O-N 3.14Å; K442-K444 PolarHBondContact O-N 3.07Å; K444-S447 WeakPolarHBondContact CA-OG 3.41Å; K444-S447 PolarHBondContact O-N 2.98Å; K444-S447 PolarHBondContact O-OG 2.78Å; K444-S448 PolarHBondContact O-N 3.29Å
445	Q	86.2	Confident	87	Confident	67 Å²	67	78.6 Å²	78.6	31%	0.313	41%	0.406	S	S	.	.	H	α-helix	trans	-68.1	-39.5	173.1	-170.6	-174.1	-4.8	0	0	112	L441 K442 S447 S448 R451	L441-Q445 WeakPolarHBondContact O-CB 3.46Å; L441-Q445 PolarHBondContact O-N 3.19Å; K442-Q445 PolarHBondContact O-N 3.34Å; Q445-S447 VanDerWaalsContact C-N 3.32Å; Q445-S447 PolarHBondContact O-N 2.93Å; Q445-S448 PolarHBondContact O-N 3.45Å; Q445-S448 PolarHBondContact O-OG 2.96Å; Q445-R451 VanDerWaalsContact CG-O 3.24Å; Q445-R451 WeakPolarHBondContact CG-O 3.42Å; Q445-R451 PolarHBondContact NE2-O 2.92Å
446	A	85.8	Confident	87	Confident	81 Å²	81	74.6 Å²	74.6	67%	0.669	38%	0.384	S	S	*	.	H	α-helix	trans	-66.8	-32.2	176.7	0	0	0	0	0	112.7	K442 R443 S448	K442-A446 WeakPolarHBondContact O-CB 3.38Å; K442-A446 PolarHBondContact O-N 2.74Å; R443-A446 PolarHBondContact O-N 2.95Å; A446-S448 VanDerWaalsContact C-N 3.35Å
447	S	85.5	Confident	87.2	Confident	79 Å²	79	72 Å²	72	55%	0.552	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-7.1	173.8	61.7	0	0	0	0	114.5	R443 K444 Q445	R443-S447 PolarHBondContact O-N 3.3Å; R443-S447 PolarHBondContact O-OG 3.11Å; K444-S447 WeakPolarHBondContact CA-OG 3.41Å; K444-S447 PolarHBondContact O-N 2.98Å; K444-S447 PolarHBondContact O-OG 2.78Å; Q445-S447 VanDerWaalsContact C-N 3.32Å; Q445-S447 PolarHBondContact O-N 2.93Å
448	S	84.7	Confident	87.3	Confident	6 Å²	6	71.9 Å²	71.9	4%	0.042	36%	0.362	C	S	.	.	S	Bend	trans	-92.6	126.2	-178.4	72.2	0	0	0	0	111.2	R340 K444 Q445 A446 D450 R451	R340-S448 PolarHBondContact NH2-OG 2.92Å; K444-S448 PolarHBondContact O-N 3.29Å; Q445-S448 PolarHBondContact O-N 3.45Å; Q445-S448 PolarHBondContact O-OG 2.96Å; A446-S448 VanDerWaalsContact C-N 3.35Å; S448-D450 VanDerWaalsContact C-N 3.26Å; S448-D450 PolarHBondContact O-N 2.8Å; S448-R451 WeakPolarHBondContact O-CA 3.47Å; S448-R451 PolarHBondContact O-N 3.18Å; S448-R451 WeakPolarHBondContact OG-CA 3.18Å
449	V	80.6	Confident	87.5	Confident	154 Å²	154	69.9 Å²	69.9	93%	0.933	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-40.1	-173.5	-175.6	0	0	0	0	113	R451	V449-R451 VanDerWaalsContact C-N 3.35Å
450	D	83.7	Confident	87.7	Confident	74 Å²	74	66.8 Å²	66.8	40%	0.396	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-1.5	179.2	63.7	13	0	0	0	114.5	R340 S448 I452	R340-D450 IonicContact CZ-OD1 2.78Å; R340-D450 IonicContact CZ-OD2 3.42Å; R340-D450 VanDerWaalsContact NH1-CG 3.29Å; R340-D450 IonicContact NH1-OD1 3.13Å; R340-D450 PolarHBondContact NH1-OD1 2.97Å; R340-D450 VanDerWaalsContact NH1-OD1 3.17Å; R340-D450 IonicContact NH1-OD2 2.83Å; R340-D450 PolarHBondContact NH1-OD2 2.89Å; R340-D450 IonicContact NH2-OD1 3.36Å; R340-D450 PolarHBondContact NH2-OD1 2.79Å; R340-D450 IonicContact NH2-OD2 2.77Å; S448-D450 VanDerWaalsContact C-N 3.26Å; S448-D450 PolarHBondContact O-N 2.8Å; D450-I452 HydrophobicContact CB-CD1 4.09Å; D450-I452 HydrophobicContact CB-CG1 3.92Å; D450-I452 VanDerWaalsContact CG-CG1 3.45Å; D450-I452 PolarHBondContact O-N 2.73Å; D450-I452 WeakPolarHBondContact OD1-CB 3.39Å; D450-I452 PolarHBondContact OD1-N 3.14Å; D450-I452 WeakPolarHBondContact OD2-CD1 3Å
451	R	83.8	Confident	87.9	Confident	194 Å²	194	65.5 Å²	65.5	73%	0.732	33%	0.332	S	S	*	.			trans	49.4	19.5	-171.8	-58.8	-176.8	178.4	-175.2	0.9	114.8	Q445 S448 V449 T453	Q445-R451 VanDerWaalsContact CG-O 3.24Å; Q445-R451 WeakPolarHBondContact CG-O 3.42Å; Q445-R451 PolarHBondContact NE2-O 2.92Å; S448-R451 WeakPolarHBondContact O-CA 3.47Å; S448-R451 PolarHBondContact O-N 3.18Å; S448-R451 WeakPolarHBondContact OG-CA 3.18Å; V449-R451 VanDerWaalsContact C-N 3.35Å; R451-T453 PolarHBondContact O-N 2.62Å
452	I	85.9	Confident	88	Confident	54 Å²	54	67.6 Å²	67.6	28%	0.277	34%	0.342	S	S	.	.			trans	-71.6	129.1	-177.4	-65.1	-179.3	0	0	0	110.3	R340 D450 L457	R340-I452 PolarHBondContact NH2-O 3.09Å; D450-I452 HydrophobicContact CB-CD1 4.09Å; D450-I452 HydrophobicContact CB-CG1 3.92Å; D450-I452 VanDerWaalsContact CG-CG1 3.45Å; D450-I452 PolarHBondContact O-N 2.73Å; D450-I452 WeakPolarHBondContact OD1-CB 3.39Å; D450-I452 PolarHBondContact OD1-N 3.14Å; D450-I452 WeakPolarHBondContact OD2-CD1 3Å; I452-L457 HydrophobicContact CG2-CD2 4.19Å; I452-L457 HydrophobicContact CG2-CG 4.11Å
453	T	89.4	Confident	88.2	Confident	55 Å²	55	65.5 Å²	65.5	34%	0.337	34%	0.335	S	S	.	.			trans	-64.6	157.1	176.9	59.6	0	0	0	0	112.3	R451 Y455 G456 L457	R451-T453 PolarHBondContact O-N 2.62Å; T453-Y455 PolarHBondContact O-N 3.31Å; T453-G456 WeakPolarHBondContact O-CA 3.21Å; T453-G456 PolarHBondContact O-N 3.26Å; T453-G456 PolarHBondContact OG1-N 2.86Å; T453-L457 PolarHBondContact O-N 2.84Å
454	L	89.3	Confident	88.5	Confident	10 Å²	10	57.7 Å²	57.7	5%	0.052	31%	0.305	C	S	.	.	H	α-helix	trans	-54.4	-34.6	169.6	178.1	59.4	0	0	0	112.4	Y345 F366 I427 L441 L457 M458	Y345-L454 HydrophobicContact CD1-CB 4.21Å; Y345-L454 HydrophobicContact CD1-CD1 4.03Å; Y345-L454 HydrophobicContact CD1-CD2 3.97Å; Y345-L454 HydrophobicContact CD1-CG 4.29Å; Y345-L454 HydrophobicContact CD2-CD1 4.15Å; Y345-L454 HydrophobicContact CE1-CB 3.92Å; Y345-L454 HydrophobicContact CE1-CD1 4.43Å; Y345-L454 HydrophobicContact CE1-CD2 4.48Å; Y345-L454 HydrophobicContact CG-CD1 3.87Å; Y345-L454 HydrophobicContact CG-CD2 4.48Å; F366-L454 HydrophobicContact CE1-CD1 4.12Å; F366-L454 HydrophobicContact CE1-CD2 4.46Å; F366-L454 HydrophobicContact CZ-CD2 4.33Å; I427-L454 HydrophobicContact CD1-CD2 4.02Å; I427-L454 HydrophobicContact CD1-CG 4.48Å; L441-L454 HydrophobicContact CD2-CB 4.27Å; L441-L454 HydrophobicContact CD2-CD2 3.72Å; L454-L457 PolarHBondContact O-N 3.2Å; L454-M458 HydrophobicContact CD1-CG 3.94Å; L454-M458 HydrophobicContact CD1-SD 3.77Å; L454-M458 HydrophobicContact CD2-SD 4.37Å; L454-M458 HydrophobicContact CG-CG 4.4Å; L454-M458 HydrophobicContact CG-SD 3.86Å; L454-M458 WeakPolarHBondContact O-CB 3.47Å; L454-M458 WeakPolarHBondContact O-CG 3.35Å; L454-M458 PolarHBondContact O-N 3.28Å
455	Y	86.8	Confident	88.8	Confident	140 Å²	140	55.5 Å²	55.5	55%	0.549	30%	0.295	S	S	.	.	H	α-helix	trans	-59	-51.9	171.7	177.9	-89.1	0	0	0	111.4	F420 M424 T453 L457 M458 V459	F420-Y455 HydrophobicContact CZ-CE2 4.07Å; M424-Y455 HydrophobicContact CG-CD2 4.33Å; M424-Y455 HydrophobicContact CG-CE2 4.3Å; M424-Y455 HydrophobicContact SD-CD2 3.51Å; M424-Y455 VanDerWaalsContact SD-CD2 3.51Å; M424-Y455 HydrophobicContact SD-CE2 4.05Å; T453-Y455 PolarHBondContact O-N 3.31Å; Y455-L457 VanDerWaalsContact C-N 3.3Å; Y455-L457 PolarHBondContact O-N 2.93Å; Y455-M458 PolarHBondContact O-N 3.01Å; Y455-M458 VanDerWaalsContact O-N 3.15Å; Y455-V459 HydrophobicContact CD1-CG2 4.12Å; Y455-V459 HydrophobicContact CE1-CG2 3.68Å; Y455-V459 HydrophobicContact CE2-CG2 4.29Å; Y455-V459 WeakPolarHBondContact O-CG2 3.32Å; Y455-V459 PolarHBondContact O-N 3.27Å
456	G	88.1	Confident	89.1	Confident	22 Å²	22	55.3 Å²	55.3	23%	0.227	30%	0.3	C	S	.	.	H	α-helix	trans	-60.3	-37.3	178.4	0	0	0	0	0	113.1	T453	T453-G456 WeakPolarHBondContact O-CA 3.21Å; T453-G456 PolarHBondContact O-N 3.26Å; T453-G456 PolarHBondContact OG1-N 2.86Å
457	L	91.7	Very high	89.5	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-64.5	-47.4	172.4	-66.3	175.2	0	0	0	111.9	I341 Y345 I452 T453 L454 Y455 V459 K460	I341-L457 HydrophobicContact CD1-CB 3.95Å; I341-L457 HydrophobicContact CG1-CB 3.73Å; I341-L457 HydrophobicContact CG1-CD1 4.22Å; Y345-L457 HydrophobicContact CD2-CD1 4.31Å; Y345-L457 HydrophobicContact CE2-CD1 3.68Å; I452-L457 HydrophobicContact CG2-CD2 4.19Å; I452-L457 HydrophobicContact CG2-CG 4.11Å; T453-L457 PolarHBondContact O-N 2.84Å; L454-L457 PolarHBondContact O-N 3.2Å; Y455-L457 VanDerWaalsContact C-N 3.3Å; Y455-L457 PolarHBondContact O-N 2.93Å; L457-V459 VanDerWaalsContact C-N 3.28Å; L457-V459 PolarHBondContact O-N 2.99Å; L457-K460 WeakPolarHBondContact O-CB 3.43Å; L457-K460 PolarHBondContact O-N 3.36Å
458	M	92	Very high	89.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-73.2	-15.1	-177.3	-71.5	-180	69.6	0	0	114.2	I341 I365 F366 Y416 F420 A423 M424 I427 L454 Y455 P461	I341-M458 HydrophobicContact CD1-CG 4.22Å; I365-M458 HydrophobicContact CG2-CE 4.36Å; I365-M458 WeakPolarHBondContact O-CE 3.3Å; F366-M458 HydrophobicContact CE1-SD 4.47Å; Y416-M458 WeakPolarHBondContact OH-CB 3.32Å; Y416-M458 PolarHBondContact OH-O 2.96Å; F420-M458 HydrophobicContact CE2-CB 4.06Å; F420-M458 WeakPolarHBondContact CE2-O 3.14Å; A423-M458 HydrophobicContact CB-CE 4.16Å; M424-M458 HydrophobicContact CE-CB 4.04Å; M424-M458 HydrophobicContact CE-CE 3.42Å; M424-M458 VanDerWaalsContact CE-CE 3.42Å; M424-M458 HydrophobicContact CE-SD 3.68Å; I427-M458 HydrophobicContact CD1-SD 3.95Å; L454-M458 HydrophobicContact CD1-CG 3.94Å; L454-M458 HydrophobicContact CD1-SD 3.77Å; L454-M458 HydrophobicContact CD2-SD 4.37Å; L454-M458 HydrophobicContact CG-CG 4.4Å; L454-M458 HydrophobicContact CG-SD 3.86Å; L454-M458 WeakPolarHBondContact O-CB 3.47Å; L454-M458 WeakPolarHBondContact O-CG 3.35Å; L454-M458 PolarHBondContact O-N 3.28Å; Y455-M458 PolarHBondContact O-N 3.01Å; Y455-M458 VanDerWaalsContact O-N 3.15Å; M458-P461 WeakPolarHBondContact O-CD 3.22Å
459	V	91.3	Very high	90.3	Very high	26 Å²	26	52 Å²	52	16%	0.158	26%	0.262	C	S	.	.	H	α-helix	trans	-77.7	-27.5	170.7	168.8	0	0	0	0	112.2	F420 Y455 L457 P461 I462 Q463	F420-V459 HydrophobicContact CE2-CG2 4.12Å; F420-V459 HydrophobicContact CZ-CG2 3.63Å; Y455-V459 HydrophobicContact CD1-CG2 4.12Å; Y455-V459 HydrophobicContact CE1-CG2 3.68Å; Y455-V459 HydrophobicContact CE2-CG2 4.29Å; Y455-V459 WeakPolarHBondContact O-CG2 3.32Å; Y455-V459 PolarHBondContact O-N 3.27Å; L457-V459 VanDerWaalsContact C-N 3.28Å; L457-V459 PolarHBondContact O-N 2.99Å; V459-P461 VanDerWaalsContact C-CD 3.48Å; V459-I462 WeakPolarHBondContact O-CB 3.35Å; V459-I462 PolarHBondContact O-N 3.38Å; V459-Q463 HydrophobicContact CG1-CG 3.93Å; V459-Q463 PolarHBondContact O-N 2.85Å
460	K	93.3	Very high	90.9	Very high	39 Å²	39	49.8 Å²	49.8	17%	0.17	24%	0.244	C	C	.	.	H	α-helix	trans	-52.8	-40.6	-175.7	-72.7	175.4	176.4	-128.4	0	115	Y334 S337 L457 I462 Q463 R464	Y334-K460 HydrophobicContact CD2-CB 4.07Å; Y334-K460 HydrophobicContact CE2-CB 3.99Å; S337-K460 VanDerWaalsContact CB-CD 3.49Å; S337-K460 WeakPolarHBondContact OG-CD 3.27Å; S337-K460 WeakPolarHBondContact OG-CE 3.47Å; S337-K460 PolarHBondContact OG-NZ 3.17Å; L457-K460 WeakPolarHBondContact O-CB 3.43Å; L457-K460 PolarHBondContact O-N 3.36Å; K460-I462 VanDerWaalsContact C-N 3.31Å; K460-I462 PolarHBondContact O-N 3.34Å; K460-Q463 PolarHBondContact O-N 3.5Å; K460-Q463 VanDerWaalsContact O-N 3.13Å; K460-R464 PolarHBondContact O-N 3.35Å
461	P	94.5	Very high	91.5	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.006	23%	0.234	C	C	.	.	H	α-helix	trans	-60.1	-39.6	176.5	-24.1	34.4	0	0	0	113.2	Y334 L338 I372 Y413 Y416 M458 V459 Q463 R464	Y334-P461 HydrophobicContact CE2-CG 4.29Å; Y334-P461 WeakPolarHBondContact OH-CA 3.45Å; Y334-P461 WeakPolarHBondContact OH-CB 3.35Å; L338-P461 HydrophobicContact CD2-CG 4.1Å; I372-P461 HydrophobicContact CD1-CB 4.34Å; Y413-P461 HydrophobicContact CE1-CB 4.07Å; Y413-P461 WeakPolarHBondContact CE1-O 3.42Å; Y416-P461 HydrophobicContact CD1-CB 4.06Å; Y416-P461 HydrophobicContact CE1-CB 3.75Å; Y416-P461 HydrophobicContact CE1-CG 3.84Å; M458-P461 WeakPolarHBondContact O-CD 3.22Å; V459-P461 VanDerWaalsContact C-CD 3.48Å; P461-Q463 PolarHBondContact O-N 2.9Å; P461-R464 PolarHBondContact O-N 2.83Å
462	I	91.1	Very high	92	Very high	67 Å²	67	38.6 Å²	38.6	34%	0.344	20%	0.199	S	C	.	.	H	α-helix	trans	-65.3	-30.8	178.8	-47.8	-176.4	0	0	0	110.6	Y416 V417 F420 V459 K460	Y416-I462 HydrophobicContact CE1-CG1 4.23Å; V417-I462 HydrophobicContact CG2-CG1 4.38Å; F420-I462 HydrophobicContact CB-CD1 4.28Å; F420-I462 HydrophobicContact CD1-CD1 3.96Å; F420-I462 HydrophobicContact CD2-CD1 3.81Å; F420-I462 HydrophobicContact CE1-CD1 4.25Å; F420-I462 HydrophobicContact CE2-CD1 4.1Å; F420-I462 HydrophobicContact CG-CD1 3.74Å; F420-I462 HydrophobicContact CZ-CD1 4.33Å; V459-I462 WeakPolarHBondContact O-CB 3.35Å; V459-I462 PolarHBondContact O-N 3.38Å; K460-I462 VanDerWaalsContact C-N 3.31Å; K460-I462 PolarHBondContact O-N 3.34Å
463	Q	92.4	Very high	92.3	Very high	90 Å²	90	39.7 Å²	39.7	42%	0.421	20%	0.203	S	C	.	.	H	α-helix	trans	-82.9	-13.8	178.5	-65.1	176	-39.1	0	0	114.1	V459 K460 P461 P466 Q467	V459-Q463 HydrophobicContact CG1-CG 3.93Å; V459-Q463 PolarHBondContact O-N 2.85Å; K460-Q463 PolarHBondContact O-N 3.5Å; K460-Q463 VanDerWaalsContact O-N 3.13Å; P461-Q463 PolarHBondContact O-N 2.9Å; Q463-P466 WeakPolarHBondContact O-CD 3.42Å; Q463-Q467 WeakPolarHBondContact O-CG 3.3Å; Q463-Q467 PolarHBondContact O-N 3.05Å
464	R	94.8	Very high	92.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-70.3	-43.9	-165	-166.9	64.6	-174.6	139.8	1.3	114	S330 E331 Y334 K460 P461 Q467 F468	S330-R464 PolarHBondContact OG-NH1 3.26Å; S330-R464 PolarHBondContact OG-NH2 3.44Å; S330-R464 VanDerWaalsContact OG-NH2 3.08Å; E331-R464 VanDerWaalsContact N-NH2 3.11Å; E331-R464 IonicContact OE2-CZ 3.71Å; E331-R464 IonicContact OE2-NE 3.23Å; E331-R464 PolarHBondContact OE2-NE 3.24Å; E331-R464 VanDerWaalsContact OE2-NE 3.13Å; E331-R464 IonicContact OE2-NH2 2.69Å; E331-R464 PolarHBondContact OE2-NH2 3.36Å; Y334-R464 HydrophobicContact CD1-CG 3.96Å; Y334-R464 HydrophobicContact CE1-CB 4.38Å; Y334-R464 HydrophobicContact CE1-CG 3.82Å; Y334-R464 HydrophobicContact CE2-CB 4.28Å; Y334-R464 HydrophobicContact CE2-CG 4.39Å; Y334-R464 HydrophobicContact CG-CG 4.31Å; K460-R464 PolarHBondContact O-N 3.35Å; P461-R464 PolarHBondContact O-N 2.83Å; R464-Q467 VanDerWaalsContact NH1-OE1 3.08Å; R464-Q467 WeakPolarHBondContact O-CB 3.17Å; R464-Q467 PolarHBondContact O-N 2.81Å; R464-F468 HydrophobicContact CG-CD2 4.34Å; R464-F468 HydrophobicContact CG-CE2 4.01Å; R464-F468 HydrophobicContact CG-CZ 4.36Å; R464-F468 VanDerWaalsContact CZ-CE1 3.47Å; R464-F468 PolarHBondContact O-N 3.21Å; R464-F468 VanDerWaalsContact O-N 3.09Å
465	F	93.5	Very high	92.7	Very high	6 Å²	6	40.3 Å²	40.3	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-67.2	-43.6	177.8	-58.5	-52	0	0	0	113.1	F404 V409 Y413 Q467 F468 I469 L496 L499 L503	F404-F465 AromaticContact CD1-CE1 3.81Å; F404-F465 HydrophobicContact CD1-CE1 3.81Å; F404-F465 HydrophobicContact CD1-CZ 4.42Å; F404-F465 HydrophobicContact CE1-CE1 4.17Å; F404-F465 HydrophobicContact CG-CE1 4.35Å; V409-F465 HydrophobicContact CG1-CZ 4.13Å; Y413-F465 HydrophobicContact CD1-CD2 4.35Å; Y413-F465 AromaticContact CD1-CE2 3.5Å; Y413-F465 HydrophobicContact CD1-CE2 3.5Å; Y413-F465 VanDerWaalsContact CD1-CE2 3.5Å; Y413-F465 HydrophobicContact CD1-CZ 4.15Å; Y413-F465 AromaticContact CD2-CE2 3.93Å; Y413-F465 HydrophobicContact CD2-CE2 3.93Å; Y413-F465 AromaticContact CD2-CZ 3.86Å; Y413-F465 HydrophobicContact CD2-CZ 3.86Å; Y413-F465 HydrophobicContact CE1-CD2 4.36Å; Y413-F465 AromaticContact CE1-CE2 3.58Å; Y413-F465 HydrophobicContact CE1-CE2 3.58Å; Y413-F465 AromaticContact CE1-CZ 3.94Å; Y413-F465 HydrophobicContact CE1-CZ 3.94Å; Y413-F465 HydrophobicContact CE2-CE2 4.02Å; Y413-F465 AromaticContact CE2-CZ 3.65Å; Y413-F465 HydrophobicContact CE2-CZ 3.65Å; Y413-F465 AromaticContact CG-CE2 3.66Å; Y413-F465 HydrophobicContact CG-CE2 3.66Å; Y413-F465 HydrophobicContact CG-CZ 4.1Å; Y413-F465 AromaticContact CZ-CE2 3.84Å; Y413-F465 AromaticContact CZ-CZ 3.68Å; F465-Q467 VanDerWaalsContact C-N 3.28Å; F465-Q467 PolarHBondContact O-N 3.16Å; F465-F468 HydrophobicContact CD1-CD2 4.13Å; F465-F468 PolarHBondContact O-N 3.03Å; F465-F468 VanDerWaalsContact O-N 3.13Å; F465-I469 WeakPolarHBondContact O-CG1 3.33Å; F465-I469 PolarHBondContact O-N 2.91Å; F465-L496 HydrophobicContact CD1-CD2 3.76Å; F465-L496 HydrophobicContact CE1-CD2 4.26Å; F465-L499 HydrophobicContact CD1-CD2 4.12Å; F465-L499 HydrophobicContact CD2-CD2 4.09Å; F465-L499 HydrophobicContact CD2-CG 4.24Å; F465-L499 HydrophobicContact CE1-CD2 3.77Å; F465-L499 HydrophobicContact CE2-CD2 3.71Å; F465-L499 HydrophobicContact CE2-CG 4.11Å; F465-L499 HydrophobicContact CG-CD2 4.29Å; F465-L499 HydrophobicContact CZ-CD2 3.56Å; F465-L499 HydrophobicContact CZ-CG 4.44Å; F465-L503 HydrophobicContact CD2-CD1 3.75Å; F465-L503 HydrophobicContact CE2-CD1 3.76Å
466	P	92.2	Very high	92.9	Very high	64 Å²	64	35 Å²	35	42%	0.416	19%	0.185	S	C	.	.	H	α-helix	trans	-52.8	-40.2	169.1	-30.1	35.8	0	0	0	114.5	Q463 I469 L470	Q463-P466 WeakPolarHBondContact O-CD 3.42Å; P466-I469 PolarHBondContact O-N 2.86Å; P466-L470 WeakPolarHBondContact O-CG 3.34Å; P466-L470 PolarHBondContact O-N 2.71Å
467	Q	94.5	Very high	93.1	Very high	76 Å²	76	42 Å²	42	36%	0.355	21%	0.209	S	C	.	.	H	α-helix	trans	-65.2	-43.1	175.6	-71.2	168.7	-1	0	0	112.5	Q463 R464 F465 L470 L471	Q463-Q467 WeakPolarHBondContact O-CG 3.3Å; Q463-Q467 PolarHBondContact O-N 3.05Å; R464-Q467 VanDerWaalsContact NH1-OE1 3.08Å; R464-Q467 WeakPolarHBondContact O-CB 3.17Å; R464-Q467 PolarHBondContact O-N 2.81Å; F465-Q467 VanDerWaalsContact C-N 3.28Å; F465-Q467 PolarHBondContact O-N 3.16Å; Q467-L470 PolarHBondContact O-N 3.24Å; Q467-L471 WeakPolarHBondContact O-CG 3.35Å; Q467-L471 PolarHBondContact O-N 3.06Å; Q467-L471 VanDerWaalsContact O-N 3.1Å
468	F	95.3	Very high	93	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.6	-39.2	176.3	-73.7	-37.8	0	0	0	112.7	E331 H376 F379 F400 F404 R464 F465 L470 L471 L472 L496	E331-F468 WeakPolarHBondContact OE2-CZ 3.31Å; H376-F468 AromaticContact CE1-CE2 3.79Å; F379-F468 HydrophobicContact CD1-CZ 4.35Å; F379-F468 HydrophobicContact CE1-CE1 4.16Å; F379-F468 AromaticContact CE1-CZ 3.78Å; F379-F468 HydrophobicContact CE1-CZ 3.78Å; F379-F468 HydrophobicContact CZ-CZ 4.42Å; F400-F468 HydrophobicContact CE1-CB 4.18Å; F400-F468 AromaticContact CE1-CD1 3.51Å; F400-F468 HydrophobicContact CE1-CD1 3.51Å; F400-F468 AromaticContact CE1-CD2 3.92Å; F400-F468 HydrophobicContact CE1-CD2 3.92Å; F400-F468 AromaticContact CE1-CE1 3.61Å; F400-F468 HydrophobicContact CE1-CE1 3.61Å; F400-F468 HydrophobicContact CE1-CE2 4.02Å; F400-F468 AromaticContact CE1-CG 3.67Å; F400-F468 HydrophobicContact CE1-CG 3.67Å; F400-F468 AromaticContact CE1-CZ 3.87Å; F400-F468 HydrophobicContact CE1-CZ 3.87Å; F400-F468 AromaticContact CZ-CD1 3.9Å; F400-F468 HydrophobicContact CZ-CD1 3.9Å; F400-F468 AromaticContact CZ-CE1 3.94Å; F400-F468 HydrophobicContact CZ-CE1 3.94Å; F400-F468 HydrophobicContact CZ-CG 4.45Å; F404-F468 HydrophobicContact CE1-CE2 4.28Å; F404-F468 AromaticContact CE2-CE2 3.85Å; F404-F468 HydrophobicContact CE2-CE2 3.85Å; F404-F468 HydrophobicContact CE2-CZ 4.33Å; F404-F468 AromaticContact CZ-CE2 3.62Å; F404-F468 HydrophobicContact CZ-CE2 3.62Å; F404-F468 HydrophobicContact CZ-CZ 4.08Å; R464-F468 HydrophobicContact CG-CD2 4.34Å; R464-F468 HydrophobicContact CG-CE2 4.01Å; R464-F468 HydrophobicContact CG-CZ 4.36Å; R464-F468 VanDerWaalsContact CZ-CE1 3.47Å; R464-F468 PolarHBondContact O-N 3.21Å; R464-F468 VanDerWaalsContact O-N 3.09Å; F465-F468 HydrophobicContact CD1-CD2 4.13Å; F465-F468 PolarHBondContact O-N 3.03Å; F465-F468 VanDerWaalsContact O-N 3.13Å; F468-L470 PolarHBondContact O-N 2.84Å; F468-L471 PolarHBondContact O-N 2.84Å; F468-L472 WeakPolarHBondContact O-CB 3.38Å; F468-L472 WeakPolarHBondContact O-CG 3.46Å; F468-L472 PolarHBondContact O-N 3.39Å; F468-L496 HydrophobicContact CB-CD1 3.92Å; F468-L496 HydrophobicContact CD2-CD2 4.5Å
469	I	93.1	Very high	93	Very high	21 Å²	21	43.8 Å²	43.8	11%	0.108	22%	0.219	C	C	.	.	H	α-helix	trans	-59.2	-48.1	178.1	-68.7	162.3	0	0	0	110.1	F465 P466 L472 Q473 L493 L496 E497 A500	F465-I469 WeakPolarHBondContact O-CG1 3.33Å; F465-I469 PolarHBondContact O-N 2.91Å; P466-I469 PolarHBondContact O-N 2.86Å; I469-L472 PolarHBondContact O-N 3.28Å; I469-Q473 HydrophobicContact CG2-CG 4.48Å; I469-Q473 WeakPolarHBondContact O-CB 3.41Å; I469-Q473 VanDerWaalsContact O-CG 3.28Å; I469-Q473 WeakPolarHBondContact O-CG 3.09Å; I469-Q473 PolarHBondContact O-N 3Å; I469-L493 HydrophobicContact CG2-CD2 4.18Å; I469-L493 WeakPolarHBondContact O-CD2 3.44Å; I469-L496 HydrophobicContact CD1-CB 4.39Å; I469-L496 HydrophobicContact CG1-CB 3.87Å; I469-E497 HydrophobicContact CD1-CG 3.87Å; I469-E497 HydrophobicContact CG1-CG 4.03Å; I469-E497 HydrophobicContact CG2-CG 4.01Å; I469-A500 HydrophobicContact CD1-CB 4.23Å
470	L	93.3	Very high	92.9	Very high	107 Å²	107	45.9 Å²	45.9	56%	0.56	23%	0.233	S	C	*	.	H	α-helix	trans	-61.1	-49.8	176.7	-65.9	170.6	0	0	0	112.2	P466 Q467 F468 L472 Q473 D474	P466-L470 WeakPolarHBondContact O-CG 3.34Å; P466-L470 PolarHBondContact O-N 2.71Å; Q467-L470 PolarHBondContact O-N 3.24Å; F468-L470 PolarHBondContact O-N 2.84Å; L470-L472 VanDerWaalsContact C-N 3.26Å; L470-L472 PolarHBondContact O-N 3.08Å; L470-Q473 PolarHBondContact O-N 3.4Å; L470-Q473 VanDerWaalsContact O-N 3.14Å; L470-D474 PolarHBondContact O-N 3.05Å
471	L	94.9	Very high	92.4	Very high	32 Å²	32	51.4 Å²	51.4	17%	0.168	26%	0.257	C	S	.	.	H	α-helix	trans	-61.7	-32.5	179.9	-71.9	167.6	0	0	0	113.1	I323 I327 Q467 F468 M475	I323-L471 WeakPolarHBondContact CG2-O 3.45Å; I327-L471 HydrophobicContact CD1-CB 4.38Å; I327-L471 HydrophobicContact CG1-CB 3.92Å; I327-L471 HydrophobicContact CG1-CD1 3.98Å; I327-L471 HydrophobicContact CG1-CG 4.37Å; Q467-L471 WeakPolarHBondContact O-CG 3.35Å; Q467-L471 PolarHBondContact O-N 3.06Å; Q467-L471 VanDerWaalsContact O-N 3.1Å; F468-L471 PolarHBondContact O-N 2.84Å; L471-M475 WeakPolarHBondContact O-CB 3.32Å; L471-M475 PolarHBondContact O-N 2.99Å
472	L	94.5	Very high	91.9	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-82.9	-27.2	176	-66.9	-175	0	0	0	113.2	I327 I396 F400 F468 I469 L470 M475 L476 L489 A492 L493 L496	I327-L472 HydrophobicContact CD1-CD2 4.14Å; I396-L472 HydrophobicContact CG2-CD2 4.45Å; F400-L472 HydrophobicContact CB-CD1 4.31Å; F400-L472 HydrophobicContact CD1-CD1 4.02Å; F400-L472 HydrophobicContact CD2-CD1 3.93Å; F400-L472 HydrophobicContact CD2-CD2 4.01Å; F400-L472 HydrophobicContact CE1-CD1 4.29Å; F400-L472 HydrophobicContact CE2-CD1 4.21Å; F400-L472 HydrophobicContact CE2-CD2 3.74Å; F400-L472 HydrophobicContact CE2-CG 4.37Å; F400-L472 HydrophobicContact CG-CD1 3.82Å; F400-L472 HydrophobicContact CZ-CD1 4.37Å; F400-L472 HydrophobicContact CZ-CD2 4.22Å; F400-L472 HydrophobicContact CZ-CG 4.47Å; F468-L472 WeakPolarHBondContact O-CB 3.38Å; F468-L472 WeakPolarHBondContact O-CG 3.46Å; F468-L472 PolarHBondContact O-N 3.39Å; I469-L472 PolarHBondContact O-N 3.28Å; L470-L472 VanDerWaalsContact C-N 3.26Å; L470-L472 PolarHBondContact O-N 3.08Å; L472-M475 PolarHBondContact O-N 3.09Å; L472-L476 VanDerWaalsContact O-CB 3.24Å; L472-L476 WeakPolarHBondContact O-CB 3.45Å; L472-L476 PolarHBondContact O-N 2.59Å; L472-L489 HydrophobicContact CD2-CD2 3.77Å; L472-A492 HydrophobicContact CD1-CB 3.8Å; L472-L493 HydrophobicContact CB-CD2 3.58Å; L472-L493 HydrophobicContact CB-CG 3.96Å; L472-L496 HydrophobicContact CD1-CD1 3.66Å
473	Q	93.1	Very high	91.8	Very high	78 Å²	78	53.1 Å²	53.1	36%	0.364	28%	0.28	S	S	.	.	H	α-helix	trans	-64.7	-44.9	168.5	-77.1	168.3	-5.5	0	0	110.2	I469 L470 L476 K477 L493 E497	I469-Q473 HydrophobicContact CG2-CG 4.48Å; I469-Q473 WeakPolarHBondContact O-CB 3.41Å; I469-Q473 VanDerWaalsContact O-CG 3.28Å; I469-Q473 WeakPolarHBondContact O-CG 3.09Å; I469-Q473 PolarHBondContact O-N 3Å; L470-Q473 PolarHBondContact O-N 3.4Å; L470-Q473 VanDerWaalsContact O-N 3.14Å; Q473-L476 PolarHBondContact O-N 3.21Å; Q473-K477 VanDerWaalsContact O-CB 3.31Å; Q473-K477 WeakPolarHBondContact O-CB 3.29Å; Q473-K477 PolarHBondContact O-N 3.13Å; Q473-L493 HydrophobicContact CG-CD1 4.02Å; Q473-L493 HydrophobicContact CG-CD2 3.8Å; Q473-E497 PolarHBondContact NE2-OE1 3.23Å
474	D	92.3	Very high	91.7	Very high	78 Å²	78	53.6 Å²	53.6	42%	0.417	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-42.6	173.5	-74.7	-34.1	0	0	0	112.3	I323 L470 K477 N478	I323-D474 HydrophobicContact CD1-CB 4.04Å; L470-D474 PolarHBondContact O-N 3.05Å; D474-K477 PolarHBondContact O-N 3.47Å; D474-N478 PolarHBondContact O-N 2.74Å; D474-N478 PolarHBondContact O-ND2 2.72Å
475	M	94.2	Very high	91.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.9	-45.8	174.8	-177.3	65	77.2	0	0	111.3	R320 I323 L324 I327 W390 I396 L471 L472 N478 T479 L489	R320-M475 HydrophobicContact CB-SD 3.8Å; R320-M475 HydrophobicContact CG-SD 3.76Å; R320-M475 WeakPolarHBondContact O-CE 3.46Å; I323-M475 HydrophobicContact CB-CE 4.05Å; I323-M475 HydrophobicContact CG2-CB 4.11Å; I323-M475 HydrophobicContact CG2-CE 3.95Å; L324-M475 HydrophobicContact CB-CE 4.12Å; I327-M475 HydrophobicContact CD1-CE 4.37Å; W390-M475 HydrophobicContact CH2-CE 4.41Å; I396-M475 HydrophobicContact CG2-CE 4.34Å; I396-M475 HydrophobicContact CG2-CG 4.39Å; L471-M475 WeakPolarHBondContact O-CB 3.32Å; L471-M475 PolarHBondContact O-N 2.99Å; L472-M475 PolarHBondContact O-N 3.09Å; M475-N478 CarbonylContact O-C 3.58Å; M475-N478 PolarHBondContact O-N 2.93Å; M475-T479 WeakPolarHBondContact O-CB 3.13Å; M475-T479 PolarHBondContact O-N 3.39Å; M475-T479 VanDerWaalsContact O-N 3.08Å; M475-T479 PolarHBondContact O-OG1 3.25Å; M475-L489 HydrophobicContact CB-CD2 4.24Å; M475-L489 HydrophobicContact CG-CD1 3.7Å; M475-L489 HydrophobicContact CG-CD2 3.7Å; M475-L489 HydrophobicContact CG-CG 4.38Å
476	L	91.7	Very high	91.5	Very high	27 Å²	27	55.2 Å²	55.2	14%	0.141	29%	0.294	C	S	.	.	H	α-helix	trans	-66.1	-41.4	179.5	179.6	62.4	0	0	0	111.9	L472 Q473 N478 T479 R486 L489 Q490 L493	L472-L476 VanDerWaalsContact O-CB 3.24Å; L472-L476 WeakPolarHBondContact O-CB 3.45Å; L472-L476 PolarHBondContact O-N 2.59Å; Q473-L476 PolarHBondContact O-N 3.21Å; L476-N478 PolarHBondContact O-N 3.24Å; L476-T479 PolarHBondContact O-N 3.24Å; L476-R486 HydrophobicContact CD1-CG 4.34Å; L476-R486 PolarHBondContact O-NH1 2.9Å; L476-L489 HydrophobicContact CB-CB 4.38Å; L476-L489 HydrophobicContact CD1-CB 4.08Å; L476-Q490 HydrophobicContact CD1-CG 3.83Å; L476-Q490 HydrophobicContact CD2-CG 3.62Å; L476-Q490 HydrophobicContact CG-CG 4.41Å; L476-L493 HydrophobicContact CB-CD1 4.34Å; L476-L493 HydrophobicContact CD2-CD1 3.7Å
477	K	91.1	Very high	91.4	Very high	170 Å²	170	53.6 Å²	53.6	74%	0.739	28%	0.282	S	S	*	.	H	α-helix	trans	-57.6	-35.2	175.2	-176.7	177.6	178.6	-178.7	0	112.2	Q473 D474	Q473-K477 VanDerWaalsContact O-CB 3.31Å; Q473-K477 WeakPolarHBondContact O-CB 3.29Å; Q473-K477 PolarHBondContact O-N 3.13Å; D474-K477 PolarHBondContact O-N 3.47Å
478	N	90.8	Very high	91.3	Very high	36 Å²	36	50.9 Å²	50.9	19%	0.193	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-0.2	176.9	-70.3	-77.9	0	0	0	114.1	H316 V319 R320 I323 D474 M475 L476	H316-N478 PolarHBondContact ND1-O 2.76Å; V319-N478 HydrophobicContact CG1-CB 4.21Å; V319-N478 VanDerWaalsContact CG1-CG 3.49Å; V319-N478 WeakPolarHBondContact CG1-OD1 3.21Å; R320-N478 HydrophobicContact CG-CB 3.98Å; I323-N478 HydrophobicContact CD1-CB 4.44Å; D474-N478 PolarHBondContact O-N 2.74Å; D474-N478 PolarHBondContact O-ND2 2.72Å; M475-N478 CarbonylContact O-C 3.58Å; M475-N478 PolarHBondContact O-N 2.93Å; L476-N478 PolarHBondContact O-N 3.24Å
479	T	91.8	Very high	91.2	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.012	27%	0.271	C	S	.	.	S	Bend	trans	-99.5	111.3	179.2	-62.4	0	0	0	0	110.1	R320 M475 L476 H483 R486 L489	R320-T479 PolarHBondContact NE-OG1 3.29Å; M475-T479 WeakPolarHBondContact O-CB 3.13Å; M475-T479 PolarHBondContact O-N 3.39Å; M475-T479 VanDerWaalsContact O-N 3.08Å; M475-T479 PolarHBondContact O-OG1 3.25Å; L476-T479 PolarHBondContact O-N 3.24Å; T479-H483 HydrophobicContact CG2-CB 3.69Å; T479-H483 WeakPolarHBondContact CG2-ND1 3.03Å; T479-R486 HydrophobicContact CG2-CB 4.13Å; T479-R486 VanDerWaalsContact O-CD 3.28Å; T479-R486 WeakPolarHBondContact O-CD 3.41Å; T479-R486 PolarHBondContact O-NH1 3.07Å; T479-L489 HydrophobicContact CG2-CD1 4.12Å; T479-L489 WeakPolarHBondContact OG1-CD1 3.36Å
480	P	88.1	Confident	91.1	Very high	69 Å²	69	50.4 Å²	50.4	45%	0.448	27%	0.268	S	S	.	.			trans	-70.1	157	-172.7	27.9	-34.2	0	0	0	113.1	G482 H483	P480-G482 PolarHBondContact O-N 2.85Å; P480-H483 HydrophobicContact CG-CB 4.22Å; P480-H483 WeakPolarHBondContact O-CB 3.3Å; P480-H483 PolarHBondContact O-N 3.43Å; P480-H483 VanDerWaalsContact O-N 3.08Å
481	K	83.2	Confident	91	Very high	156 Å²	156	46.7 Å²	46.7	68%	0.678	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	136.1	177.2	-59.5	-164.6	172.9	-179.3	0	110.4	H483 E1031	K481-H483 VanDerWaalsContact C-N 3.33Å; K481-H483 PolarHBondContact O-N 3.43Å; K481-E1031 HydrophobicContact CD-CG 4.31Å; K481-E1031 VanDerWaalsContact CE-OE1 3.31Å; K481-E1031 WeakPolarHBondContact CE-OE1 3.31Å
482	G	83.4	Confident	90.8	Very high	61 Å²	61	45.2 Å²	45.2	63%	0.629	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.9	-5	-175.2	0	0	0	0	0	116	P480	P480-G482 PolarHBondContact O-N 2.85Å
483	H	90.3	Very high	90.6	Very high	43 Å²	43	45.7 Å²	45.7	20%	0.199	24%	0.244	C	C	.	.			trans	-68.4	141.6	174.6	-178.7	-88.9	0	0	0	112.4	R320 E394 T479 P480 K481 D485 R486	R320-H483 PolarHBondContact NH1-CE1 2.84Å; R320-H483 PolarHBondContact NH1-NE2 3.02Å; R320-H483 VanDerWaalsContact NH1-NE2 3.12Å; R320-H483 PolarHBondContact NH2-CE1 2.7Å; E394-H483 PolarHBondContact O-CE1 2.81Å; E394-H483 VanDerWaalsContact O-CE1 3.29Å; T479-H483 HydrophobicContact CG2-CB 3.69Å; T479-H483 WeakPolarHBondContact CG2-ND1 3.03Å; P480-H483 HydrophobicContact CG-CB 4.22Å; P480-H483 WeakPolarHBondContact O-CB 3.3Å; P480-H483 PolarHBondContact O-N 3.43Å; P480-H483 VanDerWaalsContact O-N 3.08Å; K481-H483 VanDerWaalsContact C-N 3.33Å; K481-H483 PolarHBondContact O-N 3.43Å; H483-D485 PolarHBondContact CE1-N 2.88Å; H483-D485 WeakPolarHBondContact ND1-CB 3.17Å; H483-D485 PolarHBondContact ND1-N 2.76Å; H483-D485 PolarHBondContact O-N 3.16Å; H483-R486 WeakPolarHBondContact O-CB 3.37Å; H483-R486 PolarHBondContact O-N 2.91Å
484	V	90.5	Very high	90.4	Very high	100 Å²	100	42.2 Å²	42.2	61%	0.606	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.2	-172.5	-61.2	0	0	0	0	115.8
485	D	92.4	Very high	90.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-8.4	177.4	-159	36.9	0	0	0	113.8	R320 K395 I396 G397 H483 P488 L489	R320-D485 IonicContact NH2-OD2 3.29Å; K395-D485 HydrophobicContact CB-CB 4.34Å; K395-D485 HydrophobicContact CG-CB 3.97Å; K395-D485 WeakPolarHBondContact CG-OD1 3.3Å; I396-D485 PolarHBondContact N-OD1 2.89Å; I396-D485 PolarHBondContact N-OD2 2.81Å; G397-D485 PolarHBondContact N-OD1 3.21Å; H483-D485 PolarHBondContact CE1-N 2.88Å; H483-D485 WeakPolarHBondContact ND1-CB 3.17Å; H483-D485 PolarHBondContact ND1-N 2.76Å; H483-D485 PolarHBondContact O-N 3.16Å; D485-P488 WeakPolarHBondContact O-CD 3.32Å; D485-L489 HydrophobicContact CB-CD1 4.22Å; D485-L489 HydrophobicContact CB-CG 4.49Å; D485-L489 WeakPolarHBondContact O-CB 3.22Å; D485-L489 WeakPolarHBondContact O-CD1 3.48Å; D485-L489 WeakPolarHBondContact O-CG 3.35Å; D485-L489 PolarHBondContact O-N 2.94Å; D485-L489 WeakPolarHBondContact OD2-CD1 3.45Å; D485-L489 WeakPolarHBondContact OD2-CG 3.05Å
486	R	90.8	Very high	90.1	Very high	40 Å²	40	40.6 Å²	40.6	15%	0.151	22%	0.218	C	C	.	.	H	α-helix	trans	-54.8	-59.2	-176.8	-174.7	90.4	175.9	136.9	16.3	111.6	L476 T479 H483 L489 Q490 E1031	L476-R486 HydrophobicContact CD1-CG 4.34Å; L476-R486 PolarHBondContact O-NH1 2.9Å; T479-R486 HydrophobicContact CG2-CB 4.13Å; T479-R486 VanDerWaalsContact O-CD 3.28Å; T479-R486 WeakPolarHBondContact O-CD 3.41Å; T479-R486 PolarHBondContact O-NH1 3.07Å; H483-R486 WeakPolarHBondContact O-CB 3.37Å; H483-R486 PolarHBondContact O-N 2.91Å; R486-L489 PolarHBondContact O-N 3.39Å; R486-Q490 VanDerWaalsContact C-OE1 3.29Å; R486-Q490 WeakPolarHBondContact O-CG 3.33Å; R486-Q490 PolarHBondContact O-N 3.5Å; R486-Q490 PolarHBondContact O-OE1 3.32Å; R486-Q490 VanDerWaalsContact O-OE1 3.09Å; R486-E1031 WeakPolarHBondContact CG-OE2 3.26Å; R486-E1031 IonicContact CZ-OE1 3.42Å; R486-E1031 IonicContact CZ-OE2 3.7Å; R486-E1031 IonicContact NE-OE1 2.83Å; R486-E1031 PolarHBondContact NE-OE1 3.23Å; R486-E1031 IonicContact NE-OE2 3.26Å; R486-E1031 PolarHBondContact NE-OE2 3.19Å; R486-E1031 IonicContact NH2-OE1 2.72Å; R486-E1031 PolarHBondContact NH2-OE1 3.18Å; R486-E1031 IonicContact NH2-OE2 3.76Å
487	L	90.5	Very high	89.9	Confident	30 Å²	30	40.1 Å²	40.1	16%	0.157	22%	0.215	C	C	.	.	H	α-helix	trans	-63.2	-46.2	177.3	172	65.3	0	0	0	112.5	L489 Q490 L491 L1036 I1087	L487-L489 VanDerWaalsContact C-N 3.31Å; L487-L489 PolarHBondContact O-N 3.09Å; L487-Q490 PolarHBondContact O-N 3.27Å; L487-L491 HydrophobicContact CD1-CD1 4.07Å; L487-L491 HydrophobicContact CD1-CG 4.14Å; L487-L491 HydrophobicContact CG-CD1 4.03Å; L487-L491 WeakPolarHBondContact O-CB 3.27Å; L487-L491 VanDerWaalsContact O-CG 3.28Å; L487-L491 WeakPolarHBondContact O-CG 3.36Å; L487-L491 PolarHBondContact O-N 3Å; L487-L1036 HydrophobicContact CD1-CD1 4.02Å; L487-L1036 HydrophobicContact CD1-CD2 3.99Å; L487-L1036 HydrophobicContact CD2-CD2 3.68Å; L487-L1036 HydrophobicContact CG-CD2 4.49Å; L487-I1087 HydrophobicContact CD1-CD1 3.87Å; L487-I1087 HydrophobicContact CD1-CG1 3.94Å
488	P	92.6	Very high	89.5	Confident	19 Å²	19	33 Å²	33	12%	0.123	19%	0.185	C	C	.	.	H	α-helix	trans	-53.9	-38.7	170.6	-29.9	34.3	0	0	0	115.3	G397 D398 D485 A492	G397-P488 CarbonylContact C-O 3.57Å; D398-P488 HydrophobicContact CB-CB 4.3Å; D485-P488 WeakPolarHBondContact O-CD 3.32Å; P488-A492 WeakPolarHBondContact O-CB 3.48Å; P488-A492 PolarHBondContact O-N 3.37Å
489	L	92.8	Very high	89.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.6	-44	176.7	-73.1	165	0	0	0	111.9	I396 L472 M475 L476 T479 D485 R486 L487 L491 A492 L493	I396-L489 HydrophobicContact CG2-CD2 3.87Å; L472-L489 HydrophobicContact CD2-CD2 3.77Å; M475-L489 HydrophobicContact CB-CD2 4.24Å; M475-L489 HydrophobicContact CG-CD1 3.7Å; M475-L489 HydrophobicContact CG-CD2 3.7Å; M475-L489 HydrophobicContact CG-CG 4.38Å; L476-L489 HydrophobicContact CB-CB 4.38Å; L476-L489 HydrophobicContact CD1-CB 4.08Å; T479-L489 HydrophobicContact CG2-CD1 4.12Å; T479-L489 WeakPolarHBondContact OG1-CD1 3.36Å; D485-L489 HydrophobicContact CB-CD1 4.22Å; D485-L489 HydrophobicContact CB-CG 4.49Å; D485-L489 WeakPolarHBondContact O-CB 3.22Å; D485-L489 WeakPolarHBondContact O-CD1 3.48Å; D485-L489 WeakPolarHBondContact O-CG 3.35Å; D485-L489 PolarHBondContact O-N 2.94Å; D485-L489 WeakPolarHBondContact OD2-CD1 3.45Å; D485-L489 WeakPolarHBondContact OD2-CG 3.05Å; R486-L489 PolarHBondContact O-N 3.39Å; L487-L489 VanDerWaalsContact C-N 3.31Å; L487-L489 PolarHBondContact O-N 3.09Å; L489-L491 VanDerWaalsContact C-N 3.29Å; L489-L491 PolarHBondContact O-N 3.12Å; L489-A492 WeakPolarHBondContact O-CB 3.37Å; L489-A492 PolarHBondContact O-N 3.23Å; L489-L493 WeakPolarHBondContact O-CG 3.31Å; L489-L493 PolarHBondContact O-N 3.15Å
490	Q	91.1	Very high	89.1	Confident	10 Å²	10	33 Å²	33	5%	0.047	19%	0.189	C	C	.	.	H	α-helix	trans	-60.5	-40.5	174.5	-67.3	161.7	-70.8	0	0	111.1	L476 R486 L487 T494 H1029 I1087	L476-Q490 HydrophobicContact CD1-CG 3.83Å; L476-Q490 HydrophobicContact CD2-CG 3.62Å; L476-Q490 HydrophobicContact CG-CG 4.41Å; R486-Q490 VanDerWaalsContact C-OE1 3.29Å; R486-Q490 WeakPolarHBondContact O-CG 3.33Å; R486-Q490 PolarHBondContact O-N 3.5Å; R486-Q490 PolarHBondContact O-OE1 3.32Å; R486-Q490 VanDerWaalsContact O-OE1 3.09Å; L487-Q490 PolarHBondContact O-N 3.27Å; Q490-T494 PolarHBondContact O-N 3.08Å; Q490-T494 PolarHBondContact O-OG1 2.91Å; Q490-H1029 PolarHBondContact OE1-NE2 2.82Å; Q490-I1087 HydrophobicContact CB-CD1 3.74Å; Q490-I1087 HydrophobicContact CB-CG1 3.76Å; Q490-I1087 HydrophobicContact CG-CD1 4.45Å
491	L	90.4	Very high	88.9	Confident	30 Å²	30	33.7 Å²	33.7	16%	0.157	19%	0.187	C	C	.	.	H	α-helix	trans	-65.1	-42.1	173.3	-69.8	167.9	0	0	0	112.2	V401 L487 L489 T494 E495 I1087 K1089	V401-L491 HydrophobicContact CG2-CB 3.9Å; L487-L491 HydrophobicContact CD1-CD1 4.07Å; L487-L491 HydrophobicContact CD1-CG 4.14Å; L487-L491 HydrophobicContact CG-CD1 4.03Å; L487-L491 WeakPolarHBondContact O-CB 3.27Å; L487-L491 VanDerWaalsContact O-CG 3.28Å; L487-L491 WeakPolarHBondContact O-CG 3.36Å; L487-L491 PolarHBondContact O-N 3Å; L489-L491 VanDerWaalsContact C-N 3.29Å; L489-L491 PolarHBondContact O-N 3.12Å; L491-T494 WeakPolarHBondContact O-CB 3.42Å; L491-T494 PolarHBondContact O-N 3.34Å; L491-E495 WeakPolarHBondContact O-CG 2.93Å; L491-E495 PolarHBondContact O-N 3.04Å; L491-I1087 HydrophobicContact CD2-CB 3.89Å; L491-I1087 HydrophobicContact CD2-CG1 3.86Å; L491-I1087 HydrophobicContact CD2-CG2 4.12Å; L491-I1087 HydrophobicContact CG-CG1 4.06Å; L491-K1089 HydrophobicContact CD2-CD 3.73Å
492	A	92.3	Very high	88.8	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.008	17%	0.172	C	C	.	.	H	α-helix	trans	-61.8	-44.7	177.4	0	0	0	0	0	112.4	F400 V401 L472 P488 L489 E495 L496	F400-A492 HydrophobicContact CB-CB 3.71Å; V401-A492 HydrophobicContact CG2-CB 4.06Å; L472-A492 HydrophobicContact CD1-CB 3.8Å; P488-A492 WeakPolarHBondContact O-CB 3.48Å; P488-A492 PolarHBondContact O-N 3.37Å; L489-A492 WeakPolarHBondContact O-CB 3.37Å; L489-A492 PolarHBondContact O-N 3.23Å; A492-E495 PolarHBondContact O-N 2.98Å; A492-L496 WeakPolarHBondContact O-CB 3.41Å; A492-L496 VanDerWaalsContact O-CG 3.26Å; A492-L496 WeakPolarHBondContact O-CG 3.06Å; A492-L496 PolarHBondContact O-N 2.98Å
493	L	90.4	Very high	88.9	Confident	9 Å²	9	28.1 Å²	28.1	5%	0.047	15%	0.146	C	C	.	.	H	α-helix	trans	-58.3	-52	173.3	-75.1	170.7	0	0	0	110.9	I469 L472 Q473 L476 L489 E495 L496 E497	I469-L493 HydrophobicContact CG2-CD2 4.18Å; I469-L493 WeakPolarHBondContact O-CD2 3.44Å; L472-L493 HydrophobicContact CB-CD2 3.58Å; L472-L493 HydrophobicContact CB-CG 3.96Å; Q473-L493 HydrophobicContact CG-CD1 4.02Å; Q473-L493 HydrophobicContact CG-CD2 3.8Å; L476-L493 HydrophobicContact CB-CD1 4.34Å; L476-L493 HydrophobicContact CD2-CD1 3.7Å; L489-L493 WeakPolarHBondContact O-CG 3.31Å; L489-L493 PolarHBondContact O-N 3.15Å; L493-E495 VanDerWaalsContact C-N 3.31Å; L493-E495 PolarHBondContact O-N 2.89Å; L493-L496 PolarHBondContact O-N 3.17Å; L493-L496 VanDerWaalsContact O-N 3.16Å; L493-E497 VanDerWaalsContact O-CB 3.26Å; L493-E497 WeakPolarHBondContact O-CB 3.21Å; L493-E497 VanDerWaalsContact O-CG 3.26Å; L493-E497 WeakPolarHBondContact O-CG 3.35Å; L493-E497 PolarHBondContact O-N 3.41Å
494	T	88.4	Confident	88.6	Confident	5 Å²	5	31.5 Å²	31.5	3%	0.031	17%	0.165	C	C	.	.	H	α-helix	trans	-50.5	-48.9	178.4	-50.9	0	0	0	0	112.3	Q490 L491 T498 P1082 G1086 I1087	Q490-T494 PolarHBondContact O-N 3.08Å; Q490-T494 PolarHBondContact O-OG1 2.91Å; L491-T494 WeakPolarHBondContact O-CB 3.42Å; L491-T494 PolarHBondContact O-N 3.34Å; T494-T498 WeakPolarHBondContact O-CB 3.34Å; T494-T498 PolarHBondContact O-N 3.26Å; T494-T498 PolarHBondContact O-OG1 3.35Å; T494-P1082 HydrophobicContact CG2-CB 3.99Å; T494-P1082 HydrophobicContact CG2-CG 3.53Å; T494-G1086 WeakPolarHBondContact OG1-CA 3.47Å; T494-I1087 WeakPolarHBondContact CG2-O 3.43Å; T494-I1087 PolarHBondContact OG1-N 3.02Å
495	E	88.8	Confident	88.1	Confident	44 Å²	44	30.8 Å²	30.8	21%	0.206	16%	0.155	C	C	.	.	H	α-helix	trans	-69.1	-42.1	-178.3	-69.4	-65.6	142.7	0	0	112.2	L491 A492 L493 L499	L491-E495 WeakPolarHBondContact O-CG 2.93Å; L491-E495 PolarHBondContact O-N 3.04Å; A492-E495 PolarHBondContact O-N 2.98Å; L493-E495 VanDerWaalsContact C-N 3.31Å; L493-E495 PolarHBondContact O-N 2.89Å; E495-L499 WeakPolarHBondContact O-CB 3.29Å; E495-L499 PolarHBondContact O-N 3.13Å
496	L	90.3	Very high	87.4	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-69.8	-39.3	179.1	-70	170.3	0	0	0	112.8	F400 F404 F465 F468 I469 L472 A492 L493 L499 A500	F400-L496 HydrophobicContact CD1-CD1 4.02Å; F404-L496 HydrophobicContact CB-CD2 3.96Å; F404-L496 HydrophobicContact CD2-CD2 4.14Å; F404-L496 HydrophobicContact CG-CD2 4.12Å; F465-L496 HydrophobicContact CD1-CD2 3.76Å; F465-L496 HydrophobicContact CE1-CD2 4.26Å; F468-L496 HydrophobicContact CB-CD1 3.92Å; F468-L496 HydrophobicContact CD2-CD2 4.5Å; I469-L496 HydrophobicContact CD1-CB 4.39Å; I469-L496 HydrophobicContact CG1-CB 3.87Å; L472-L496 HydrophobicContact CD1-CD1 3.66Å; A492-L496 WeakPolarHBondContact O-CB 3.41Å; A492-L496 VanDerWaalsContact O-CG 3.26Å; A492-L496 WeakPolarHBondContact O-CG 3.06Å; A492-L496 PolarHBondContact O-N 2.98Å; L493-L496 PolarHBondContact O-N 3.17Å; L493-L496 VanDerWaalsContact O-N 3.16Å; L496-L499 PolarHBondContact O-N 3.31Å; L496-A500 WeakPolarHBondContact O-CB 3.43Å; L496-A500 PolarHBondContact O-N 2.84Å
497	E	87.5	Confident	86.9	Confident	17 Å²	17	36.1 Å²	36.1	8%	0.079	18%	0.181	C	C	.	.	H	α-helix	trans	-64.8	-48.1	174.2	-73.6	174.2	159.7	0	0	110.4	I469 Q473 L493 L499 A500 E501 L1084	I469-E497 HydrophobicContact CD1-CG 3.87Å; I469-E497 HydrophobicContact CG1-CG 4.03Å; I469-E497 HydrophobicContact CG2-CG 4.01Å; Q473-E497 PolarHBondContact NE2-OE1 3.23Å; L493-E497 VanDerWaalsContact O-CB 3.26Å; L493-E497 WeakPolarHBondContact O-CB 3.21Å; L493-E497 VanDerWaalsContact O-CG 3.26Å; L493-E497 WeakPolarHBondContact O-CG 3.35Å; L493-E497 PolarHBondContact O-N 3.41Å; E497-L499 VanDerWaalsContact C-N 3.28Å; E497-L499 PolarHBondContact O-N 3.24Å; E497-A500 PolarHBondContact O-N 3.49Å; E497-A500 VanDerWaalsContact O-N 3.15Å; E497-E501 PolarHBondContact O-N 3.06Å; E497-L1084 HydrophobicContact CB-CD1 3.7Å; E497-L1084 HydrophobicContact CG-CD1 3.96Å; E497-L1084 WeakPolarHBondContact OE2-CB 3.47Å
498	T	84	Confident	86.5	Confident	19 Å²	19	38.9 Å²	38.9	12%	0.117	19%	0.189	C	C	.	.	H	α-helix	trans	-60.6	-36.6	174.7	-61.3	0	0	0	0	112	T494 K502	T494-T498 WeakPolarHBondContact O-CB 3.34Å; T494-T498 PolarHBondContact O-N 3.26Å; T494-T498 PolarHBondContact O-OG1 3.35Å; T498-K502 HydrophobicContact CG2-CD 4.09Å; T498-K502 VanDerWaalsContact CG2-CE 3.45Å; T498-K502 WeakPolarHBondContact O-CB 3.38Å; T498-K502 WeakPolarHBondContact O-CD 3.45Å; T498-K502 WeakPolarHBondContact O-CG 3.39Å; T498-K502 PolarHBondContact O-N 3.05Å; T498-K502 VanDerWaalsContact O-N 3.09Å
499	L	86.4	Confident	85.7	Confident	10 Å²	10	40.1 Å²	40.1	5%	0.052	20%	0.196	C	C	.	.	H	α-helix	trans	-66.3	-44.7	174.1	176	57.4	0	0	0	111.3	F404 V409 L410 F465 E495 L496 E497 K502 L503	F404-L499 HydrophobicContact CB-CD2 4.48Å; V409-L499 HydrophobicContact CG1-CD2 4.31Å; L410-L499 HydrophobicContact CB-CD1 3.82Å; L410-L499 HydrophobicContact CD1-CD1 3.74Å; L410-L499 HydrophobicContact CG-CD1 4.37Å; F465-L499 HydrophobicContact CD1-CD2 4.12Å; F465-L499 HydrophobicContact CD2-CD2 4.09Å; F465-L499 HydrophobicContact CD2-CG 4.24Å; F465-L499 HydrophobicContact CE1-CD2 3.77Å; F465-L499 HydrophobicContact CE2-CD2 3.71Å; F465-L499 HydrophobicContact CE2-CG 4.11Å; F465-L499 HydrophobicContact CG-CD2 4.29Å; F465-L499 HydrophobicContact CZ-CD2 3.56Å; F465-L499 HydrophobicContact CZ-CG 4.44Å; E495-L499 WeakPolarHBondContact O-CB 3.29Å; E495-L499 PolarHBondContact O-N 3.13Å; L496-L499 PolarHBondContact O-N 3.31Å; E497-L499 VanDerWaalsContact C-N 3.28Å; E497-L499 PolarHBondContact O-N 3.24Å; L499-K502 PolarHBondContact O-N 2.62Å; L499-L503 HydrophobicContact CD1-CD1 3.94Å; L499-L503 HydrophobicContact CD1-CG 4.17Å; L499-L503 HydrophobicContact CG-CD1 4.03Å; L499-L503 WeakPolarHBondContact O-CB 3.35Å; L499-L503 VanDerWaalsContact O-CG 3.27Å; L499-L503 WeakPolarHBondContact O-CG 3.44Å; L499-L503 PolarHBondContact O-N 2.88Å
500	A	86.9	Confident	84.9	Confident	28 Å²	28	41.7 Å²	41.7	23%	0.231	21%	0.209	C	C	.	.	H	α-helix	trans	-64.3	-41.8	177.2	0	0	0	0	0	112.5	I469 L496 E497 L503 N504	I469-A500 HydrophobicContact CD1-CB 4.23Å; L496-A500 WeakPolarHBondContact O-CB 3.43Å; L496-A500 PolarHBondContact O-N 2.84Å; E497-A500 PolarHBondContact O-N 3.49Å; E497-A500 VanDerWaalsContact O-N 3.15Å; A500-L503 PolarHBondContact O-N 3.26Å; A500-N504 WeakPolarHBondContact O-CB 3.3Å; A500-N504 PolarHBondContact O-N 3.17Å
501	E	83	Confident	84.4	Confident	84 Å²	84	44.6 Å²	44.6	39%	0.393	23%	0.225	S	C	.	.	H	α-helix	trans	-59.3	-48.9	173.1	-74.1	-167.7	159.7	0	0	111.5	E497 L503 N504 E505	E497-E501 PolarHBondContact O-N 3.06Å; E501-L503 PolarHBondContact O-N 3.3Å; E501-N504 PolarHBondContact O-N 2.88Å; E501-E505 WeakPolarHBondContact O-CB 3.36Å; E501-E505 PolarHBondContact O-N 3.35Å
502	K	82.1	Confident	83.9	Confident	86 Å²	86	44.7 Å²	44.7	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-60.9	-42.7	178.8	-74.5	167.2	-177.1	168.6	0	112.5	L410 T498 L499 E505 Q506	L410-K502 HydrophobicContact CD1-CB 3.82Å; L410-K502 HydrophobicContact CD2-CD 4.04Å; T498-K502 HydrophobicContact CG2-CD 4.09Å; T498-K502 VanDerWaalsContact CG2-CE 3.45Å; T498-K502 WeakPolarHBondContact O-CB 3.38Å; T498-K502 WeakPolarHBondContact O-CD 3.45Å; T498-K502 WeakPolarHBondContact O-CG 3.39Å; T498-K502 PolarHBondContact O-N 3.05Å; T498-K502 VanDerWaalsContact O-N 3.09Å; L499-K502 PolarHBondContact O-N 2.62Å; K502-E505 PolarHBondContact O-N 2.79Å; K502-Q506 WeakPolarHBondContact O-CB 3.44Å; K502-Q506 WeakPolarHBondContact O-CG 3.43Å; K502-Q506 PolarHBondContact O-N 3.12Å
503	L	84.6	Confident	83.3	Confident	14 Å²	14	48.9 Å²	48.9	7%	0.073	25%	0.246	C	C	.	.	H	α-helix	trans	-65.3	-43	177.9	-72.6	168.5	0	0	0	112	L410 S414 F465 L499 A500 E501 K507	L410-L503 HydrophobicContact CD1-CD2 3.96Å; L410-L503 HydrophobicContact CD1-CG 4.08Å; S414-L503 WeakPolarHBondContact OG-CD2 3.42Å; F465-L503 HydrophobicContact CD2-CD1 3.75Å; F465-L503 HydrophobicContact CE2-CD1 3.76Å; L499-L503 HydrophobicContact CD1-CD1 3.94Å; L499-L503 HydrophobicContact CD1-CG 4.17Å; L499-L503 HydrophobicContact CG-CD1 4.03Å; L499-L503 WeakPolarHBondContact O-CB 3.35Å; L499-L503 VanDerWaalsContact O-CG 3.27Å; L499-L503 WeakPolarHBondContact O-CG 3.44Å; L499-L503 PolarHBondContact O-N 2.88Å; A500-L503 PolarHBondContact O-N 3.26Å; E501-L503 PolarHBondContact O-N 3.3Å; L503-K507 WeakPolarHBondContact O-CB 3.37Å; L503-K507 PolarHBondContact O-N 3.41Å; L503-K507 VanDerWaalsContact O-N 3.08Å
504	N	85.1	Confident	82.8	Confident	115 Å²	115	51.1 Å²	51.1	62%	0.615	27%	0.266	S	S	*	.	H	α-helix	trans	-65.6	-41.8	177.3	-175.4	60.6	0	0	0	112	A500 E501 K507 R508	A500-N504 WeakPolarHBondContact O-CB 3.3Å; A500-N504 PolarHBondContact O-N 3.17Å; E501-N504 PolarHBondContact O-N 2.88Å; N504-K507 PolarHBondContact O-N 3.19Å; N504-R508 WeakPolarHBondContact O-CB 3.41Å; N504-R508 PolarHBondContact O-N 3.47Å
505	E	79.5	Confident	82.4	Confident	85 Å²	85	53.2 Å²	53.2	40%	0.397	28%	0.275	S	S	.	.	H	α-helix	trans	-67.3	-43.3	177.6	177.8	59.2	-169.8	0	0	112.4	E501 K502 K507 R508 V509	E501-E505 WeakPolarHBondContact O-CB 3.36Å; E501-E505 PolarHBondContact O-N 3.35Å; K502-E505 PolarHBondContact O-N 2.79Å; E505-K507 VanDerWaalsContact C-N 3.33Å; E505-K507 PolarHBondContact O-N 2.97Å; E505-R508 WeakPolarHBondContact O-CB 3.45Å; E505-R508 PolarHBondContact O-N 2.93Å; E505-R508 IonicContact OE1-CZ 3.41Å; E505-R508 IonicContact OE1-NE 3.36Å; E505-R508 IonicContact OE1-NH2 3.63Å; E505-R508 PolarHBondContact OE1-NH2 3.49Å; E505-R508 IonicContact OE2-CZ 2.77Å; E505-R508 IonicContact OE2-NE 2.74Å; E505-R508 PolarHBondContact OE2-NE 2.92Å; E505-R508 IonicContact OE2-NH2 2.67Å; E505-R508 PolarHBondContact OE2-NH2 2.91Å; E505-V509 WeakPolarHBondContact O-CG2 3.16Å; E505-V509 PolarHBondContact O-N 3.26Å
506	Q	78.8	Confident	82.2	Confident	77 Å²	77	52 Å²	52	36%	0.36	27%	0.27	S	S	.	.	H	α-helix	trans	-63.5	-39.3	176.2	-74.2	-173.1	22.8	0	0	112	S414 K502 V509 A510	S414-Q506 PolarHBondContact OG-OE1 2.79Å; K502-Q506 WeakPolarHBondContact O-CB 3.44Å; K502-Q506 WeakPolarHBondContact O-CG 3.43Å; K502-Q506 PolarHBondContact O-N 3.12Å; Q506-V509 PolarHBondContact O-N 3.36Å; Q506-A510 WeakPolarHBondContact O-CB 3.36Å; Q506-A510 PolarHBondContact O-N 2.94Å
507	K	79.6	Confident	81.8	Confident	75 Å²	75	55.6 Å²	55.6	33%	0.326	29%	0.287	S	S	.	.	H	α-helix	trans	-60.3	-47.2	171.8	-170.3	-164.4	170.6	-169.9	0	111.6	V417 N418 L503 N504 E505 V509 A510 D511	V417-K507 HydrophobicContact CG1-CB 3.91Å; V417-K507 HydrophobicContact CG1-CD 3.89Å; V417-K507 HydrophobicContact CG1-CG 3.95Å; N418-K507 WeakPolarHBondContact OD1-CA 3.44Å; L503-K507 WeakPolarHBondContact O-CB 3.37Å; L503-K507 PolarHBondContact O-N 3.41Å; L503-K507 VanDerWaalsContact O-N 3.08Å; N504-K507 PolarHBondContact O-N 3.19Å; E505-K507 VanDerWaalsContact C-N 3.33Å; E505-K507 PolarHBondContact O-N 2.97Å; K507-V509 VanDerWaalsContact C-N 3.27Å; K507-V509 PolarHBondContact O-N 3.37Å; K507-A510 PolarHBondContact O-N 2.86Å; K507-A510 VanDerWaalsContact O-N 3.13Å; K507-D511 WeakPolarHBondContact CE-OD2 3.5Å; K507-D511 PolarHBondContact O-N 2.94Å
508	R	81.8	Confident	81.5	Confident	87 Å²	87	57.5 Å²	57.5	33%	0.328	30%	0.296	S	S	.	.	H	α-helix	trans	-56.1	-42.5	177.8	-167.9	-168	69.1	66.5	7.4	111.3	N504 E505 Q512	N504-R508 WeakPolarHBondContact O-CB 3.41Å; N504-R508 PolarHBondContact O-N 3.47Å; E505-R508 WeakPolarHBondContact O-CB 3.45Å; E505-R508 PolarHBondContact O-N 2.93Å; E505-R508 IonicContact OE1-CZ 3.41Å; E505-R508 IonicContact OE1-NE 3.36Å; E505-R508 IonicContact OE1-NH2 3.63Å; E505-R508 PolarHBondContact OE1-NH2 3.49Å; E505-R508 IonicContact OE2-CZ 2.77Å; E505-R508 IonicContact OE2-NE 2.74Å; E505-R508 PolarHBondContact OE2-NE 2.92Å; E505-R508 IonicContact OE2-NH2 2.67Å; E505-R508 PolarHBondContact OE2-NH2 2.91Å; R508-Q512 WeakPolarHBondContact O-CB 3.41Å; R508-Q512 VanDerWaalsContact O-CG 3.31Å; R508-Q512 WeakPolarHBondContact O-CG 3.26Å; R508-Q512 PolarHBondContact O-N 3.3Å; R508-Q512 VanDerWaalsContact O-N 3.1Å
509	V	75.8	Confident	81.4	Confident	46 Å²	46	56.6 Å²	56.6	28%	0.279	29%	0.291	S	S	.	.	H	α-helix	trans	-68.2	-42.7	176.1	171.3	0	0	0	0	111.7	E505 Q506 K507 Q512 I513	E505-V509 WeakPolarHBondContact O-CG2 3.16Å; E505-V509 PolarHBondContact O-N 3.26Å; Q506-V509 PolarHBondContact O-N 3.36Å; K507-V509 VanDerWaalsContact C-N 3.27Å; K507-V509 PolarHBondContact O-N 3.37Å; V509-Q512 PolarHBondContact O-N 3.07Å; V509-I513 HydrophobicContact CG1-CD1 3.76Å; V509-I513 HydrophobicContact CG1-CG1 4.4Å; V509-I513 VanDerWaalsContact O-CG1 3.31Å; V509-I513 WeakPolarHBondContact O-CG1 3.46Å; V509-I513 PolarHBondContact O-N 2.86Å
510	A	76.4	Confident	81.3	Confident	32 Å²	32	56.3 Å²	56.3	26%	0.264	29%	0.29	S	S	.	.	H	α-helix	trans	-62	-45.6	177.3	0	0	0	0	0	112.5	N418 Q506 K507 Q512 I513 A514	N418-A510 HydrophobicContact CB-CB 4.44Å; Q506-A510 WeakPolarHBondContact O-CB 3.36Å; Q506-A510 PolarHBondContact O-N 2.94Å; K507-A510 PolarHBondContact O-N 2.86Å; K507-A510 VanDerWaalsContact O-N 3.13Å; A510-Q512 VanDerWaalsContact C-N 3.34Å; A510-Q512 PolarHBondContact O-N 3.5Å; A510-I513 PolarHBondContact O-N 2.94Å; A510-A514 PolarHBondContact O-N 3.08Å
511	D	80.6	Confident	81	Confident	72 Å²	72	64.4 Å²	64.4	39%	0.385	31%	0.314	S	S	.	.	H	α-helix	trans	-61.3	-41.4	175	-75.4	-32.3	0	0	0	110.9	K507 A514 E515	K507-D511 WeakPolarHBondContact CE-OD2 3.5Å; K507-D511 PolarHBondContact O-N 2.94Å; D511-A514 PolarHBondContact O-N 3.44Å; D511-E515 PolarHBondContact O-N 3.48Å
512	Q	80.2	Confident	80.6	Confident	32 Å²	32	62 Å²	62	15%	0.15	31%	0.307	C	S	.	.	H	α-helix	trans	-65.2	-39.8	175.6	-80.2	-170.6	-42.6	0	0	113.9	R508 V509 A510 A514 T516 L539	R508-Q512 WeakPolarHBondContact O-CB 3.41Å; R508-Q512 VanDerWaalsContact O-CG 3.31Å; R508-Q512 WeakPolarHBondContact O-CG 3.26Å; R508-Q512 PolarHBondContact O-N 3.3Å; R508-Q512 VanDerWaalsContact O-N 3.1Å; V509-Q512 PolarHBondContact O-N 3.07Å; A510-Q512 VanDerWaalsContact C-N 3.34Å; A510-Q512 PolarHBondContact O-N 3.5Å; Q512-A514 VanDerWaalsContact C-N 3.34Å; Q512-T516 WeakPolarHBondContact O-CB 3.37Å; Q512-T516 PolarHBondContact O-N 2.81Å; Q512-T516 PolarHBondContact O-OG1 3.19Å; Q512-L539 HydrophobicContact CB-CB 4.46Å; Q512-L539 HydrophobicContact CB-CD2 4Å; Q512-L539 HydrophobicContact CG-CD2 3.95Å; Q512-L539 HydrophobicContact CG-CG 4.43Å; Q512-L539 PolarHBondContact NE2-O 2.61Å; Q512-L539 PolarHBondContact OE1-O 2.83Å
513	I	79.9	Confident	80.5	Confident	89 Å²	89	58.5 Å²	58.5	46%	0.456	29%	0.293	S	S	.	.	H	α-helix	trans	-64.5	-41.9	174.8	-70.1	166.3	0	0	0	109.8	V509 A510 T516 Q517	V509-I513 HydrophobicContact CG1-CD1 3.76Å; V509-I513 HydrophobicContact CG1-CG1 4.4Å; V509-I513 VanDerWaalsContact O-CG1 3.31Å; V509-I513 WeakPolarHBondContact O-CG1 3.46Å; V509-I513 PolarHBondContact O-N 2.86Å; A510-I513 PolarHBondContact O-N 2.94Å; I513-T516 PolarHBondContact O-N 3.5Å; I513-Q517 HydrophobicContact CG2-CG 4.42Å; I513-Q517 WeakPolarHBondContact O-CG 3.13Å; I513-Q517 PolarHBondContact O-N 2.98Å
514	A	79.5	Confident	79.8	Confident	55 Å²	55	63.6 Å²	63.6	46%	0.455	33%	0.329	S	S	.	.	H	α-helix	trans	-62.5	-45	177.3	0	0	0	0	0	112.5	A510 D511 Q512 Q518	A510-A514 PolarHBondContact O-N 3.08Å; D511-A514 PolarHBondContact O-N 3.44Å; Q512-A514 VanDerWaalsContact C-N 3.34Å; A514-Q518 PolarHBondContact O-N 2.8Å
515	E	79.9	Confident	79.5	Confident	50 Å²	50	61.2 Å²	61.2	23%	0.234	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-40.5	173.8	-70.1	-152.8	132.8	0	0	112.4	D511 Q518 L519 K563 F565 Y594	D511-E515 PolarHBondContact O-N 3.48Å; E515-Q518 PolarHBondContact O-N 2.88Å; E515-L519 PolarHBondContact O-N 3.4Å; E515-K563 WeakPolarHBondContact OE1-CE 3.44Å; E515-K563 IonicContact OE1-NZ 3.13Å; E515-K563 PolarHBondContact OE1-NZ 3.09Å; E515-K563 WeakPolarHBondContact OE2-CE 3.35Å; E515-K563 IonicContact OE2-NZ 3.79Å; E515-K563 PolarHBondContact OE2-NZ 2.81Å; E515-F565 HydrophobicContact CB-CE1 4.41Å; E515-Y594 PolarHBondContact OE1-OH 3.41Å
516	T	84.2	Confident	79.3	Confident	17 Å²	17	67.1 Å²	67.1	10%	0.104	34%	0.335	C	S	.	.	H	α-helix	trans	-65.7	-43.7	179.3	-57.1	0	0	0	0	111.5	Q512 I513 Q518 L519 A520 L532 F567	Q512-T516 WeakPolarHBondContact O-CB 3.37Å; Q512-T516 PolarHBondContact O-N 2.81Å; Q512-T516 PolarHBondContact O-OG1 3.19Å; I513-T516 PolarHBondContact O-N 3.5Å; T516-Q518 VanDerWaalsContact C-N 3.32Å; T516-Q518 PolarHBondContact O-N 2.73Å; T516-L519 PolarHBondContact O-N 2.93Å; T516-A520 WeakPolarHBondContact O-CB 3.33Å; T516-A520 PolarHBondContact O-N 2.87Å; T516-L532 WeakPolarHBondContact CG2-O 3.38Å; T516-F567 HydrophobicContact CG2-CE1 3.81Å; T516-F567 HydrophobicContact CG2-CZ 4.06Å
517	Q	82	Confident	79.2	Confident	78 Å²	78	69.4 Å²	69.4	36%	0.364	35%	0.349	S	S	.	.	H	α-helix	trans	-62.7	-37.7	173	-71.9	-176.2	22.9	0	0	112.1	I513 A520 R521	I513-Q517 HydrophobicContact CG2-CG 4.42Å; I513-Q517 WeakPolarHBondContact O-CG 3.13Å; I513-Q517 PolarHBondContact O-N 2.98Å; Q517-A520 PolarHBondContact O-N 2.94Å; Q517-R521 VanDerWaalsContact O-CG 3.25Å; Q517-R521 WeakPolarHBondContact O-CG 3.26Å; Q517-R521 PolarHBondContact O-N 3.1Å; Q517-R521 VanDerWaalsContact O-N 3.1Å
518	Q	80.4	Confident	79	Confident	56 Å²	56	67.1 Å²	67.1	26%	0.262	34%	0.341	S	S	.	.	H	α-helix	trans	-65.2	-40.9	175.2	-175	170.2	17.9	0	0	111.7	A514 E515 T516 G591 P592 Y594	A514-Q518 PolarHBondContact O-N 2.8Å; E515-Q518 PolarHBondContact O-N 2.88Å; T516-Q518 VanDerWaalsContact C-N 3.32Å; T516-Q518 PolarHBondContact O-N 2.73Å; Q518-G591 PolarHBondContact NE2-O 2.75Å; Q518-P592 PolarHBondContact NE2-O 2.85Å; Q518-P592 VanDerWaalsContact NE2-O 3.13Å; Q518-Y594 HydrophobicContact CB-CD2 4.49Å; Q518-Y594 HydrophobicContact CB-CE2 4.44Å; Q518-Y594 HydrophobicContact CG-CD2 4.06Å; Q518-Y594 HydrophobicContact CG-CE2 4.18Å
519	L	83.6	Confident	78.9	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63	-49.5	173.3	-179.4	65	0	0	0	111	E515 T516 R521 S522 V523 L532 F565 F567 I572 A574	E515-L519 PolarHBondContact O-N 3.4Å; T516-L519 PolarHBondContact O-N 2.93Å; L519-R521 VanDerWaalsContact C-N 3.29Å; L519-R521 PolarHBondContact O-N 2.86Å; L519-S522 WeakPolarHBondContact O-CA 3.47Å; L519-S522 WeakPolarHBondContact O-CB 3.44Å; L519-S522 PolarHBondContact O-N 3.15Å; L519-S522 PolarHBondContact O-OG 2.82Å; L519-V523 HydrophobicContact CG-CG2 4.47Å; L519-V523 PolarHBondContact O-N 3.42Å; L519-L532 HydrophobicContact CD2-CD1 4.39Å; L519-L532 HydrophobicContact CG-CD1 4.42Å; L519-F565 HydrophobicContact CB-CE1 4.27Å; L519-F565 HydrophobicContact CB-CZ 4.17Å; L519-F565 HydrophobicContact CD1-CD2 4.38Å; L519-F565 HydrophobicContact CD1-CE2 3.88Å; L519-F565 HydrophobicContact CD1-CZ 4.17Å; L519-F565 HydrophobicContact CD2-CB 4.36Å; L519-F565 HydrophobicContact CD2-CD1 3.91Å; L519-F565 HydrophobicContact CD2-CD2 3.8Å; L519-F565 HydrophobicContact CD2-CE1 4.06Å; L519-F565 HydrophobicContact CD2-CE2 3.96Å; L519-F565 HydrophobicContact CD2-CG 3.78Å; L519-F565 HydrophobicContact CD2-CZ 4.09Å; L519-F565 HydrophobicContact CG-CE2 4.39Å; L519-F565 HydrophobicContact CG-CZ 4.37Å; L519-F567 HydrophobicContact CD2-CE2 4.11Å; L519-F567 HydrophobicContact CD2-CZ 4.16Å; L519-I572 HydrophobicContact CD2-CD1 4.15Å; L519-I572 HydrophobicContact CD2-CG2 4.38Å; L519-A574 HydrophobicContact CD1-CB 4.39Å
520	A	84.3	Confident	79.1	Confident	4 Å²	4	69.4 Å²	69.4	3%	0.033	35%	0.352	C	S	.	.	H	α-helix	trans	-58.4	-38.2	-178.2	0	0	0	0	0	112.8	T516 Q517 S522 V523 L532	T516-A520 WeakPolarHBondContact O-CB 3.33Å; T516-A520 PolarHBondContact O-N 2.87Å; Q517-A520 PolarHBondContact O-N 2.94Å; A520-S522 PolarHBondContact O-N 3Å; A520-V523 PolarHBondContact O-N 3.29Å; A520-L532 HydrophobicContact CB-CB 3.85Å; A520-L532 HydrophobicContact CB-CD1 4.5Å
521	R	79.9	Confident	79.1	Confident	198 Å²	198	72.1 Å²	72.1	75%	0.747	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-13	173.4	-68.6	169.3	-164.5	170.8	10	114.1	Q517 L519	Q517-R521 VanDerWaalsContact O-CG 3.25Å; Q517-R521 WeakPolarHBondContact O-CG 3.26Å; Q517-R521 PolarHBondContact O-N 3.1Å; Q517-R521 VanDerWaalsContact O-N 3.1Å; L519-R521 VanDerWaalsContact C-N 3.29Å; L519-R521 PolarHBondContact O-N 2.86Å
522	S	75.2	Confident	79.1	Confident	35 Å²	35	69 Å²	69	25%	0.245	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-8.1	179.2	76.7	0	0	0	0	114.7	L519 A520 Y594	L519-S522 WeakPolarHBondContact O-CA 3.47Å; L519-S522 WeakPolarHBondContact O-CB 3.44Å; L519-S522 PolarHBondContact O-N 3.15Å; L519-S522 PolarHBondContact O-OG 2.82Å; A520-S522 PolarHBondContact O-N 3Å; S522-Y594 WeakPolarHBondContact CB-O 3.48Å; S522-Y594 PolarHBondContact OG-O 3.12Å
523	V	79.6	Confident	78.8	Confident	12 Å²	12	72.1 Å²	72.1	7%	0.073	36%	0.36	C	S	.	.			trans	-86.3	122.2	178.8	172.2	0	0	0	0	109.1	L519 A520 D525 L528 L532 M596	L519-V523 HydrophobicContact CG-CG2 4.47Å; L519-V523 PolarHBondContact O-N 3.42Å; A520-V523 PolarHBondContact O-N 3.29Å; V523-D525 VanDerWaalsContact C-N 3.31Å; V523-D525 HydrophobicContact CG1-CB 3.95Å; V523-L528 HydrophobicContact CG1-CB 3.98Å; V523-L532 HydrophobicContact CG2-CD1 4Å; V523-M596 HydrophobicContact CG1-CE 4.13Å; V523-M596 HydrophobicContact CG2-CB 4.41Å; V523-M596 HydrophobicContact CG2-SD 4.12Å
524	S	70.4	Confident	78.5	Confident	120 Å²	120	70 Å²	70	84%	0.839	35%	0.353	S	S	*	.			trans	-74	-20.3	179.2	49.1	0	0	0	0	113.9
525	D	77.2	Confident	77.7	Confident	66 Å²	66	76 Å²	76	35%	0.353	37%	0.372	S	S	.	.			trans	-77.2	119.8	175.6	-177.2	-17.8	0	0	0	110.8	V523 L527 L528 S529	V523-D525 VanDerWaalsContact C-N 3.31Å; V523-D525 HydrophobicContact CG1-CB 3.95Å; D525-L527 VanDerWaalsContact C-N 3.34Å; D525-L527 PolarHBondContact O-N 3.09Å; D525-L527 WeakPolarHBondContact OD1-CB 3.4Å; D525-L527 PolarHBondContact OD1-N 2.9Å; D525-L528 HydrophobicContact CB-CB 4.1Å; D525-L528 HydrophobicContact CB-CD1 4.15Å; D525-L528 HydrophobicContact CB-CG 4.33Å; D525-L528 PolarHBondContact OD1-N 2.88Å; D525-L528 WeakPolarHBondContact OD2-CD1 3.31Å; D525-L528 WeakPolarHBondContact OD2-CG 3.44Å; D525-S529 VanDerWaalsContact O-CB 3.31Å; D525-S529 WeakPolarHBondContact O-CB 3.3Å; D525-S529 PolarHBondContact O-N 3.37Å; D525-S529 PolarHBondContact O-OG 3.3Å
526	R	77.1	Confident	76.9	Confident	208 Å²	208	80.9 Å²	80.9	79%	0.785	40%	0.395	S	S	*	.	H	α-helix	trans	-71.3	-22.7	-179.5	-67.7	-177	177.2	-179.3	-1.1	113.9	S529 K530	R526-S529 VanDerWaalsContact CA-OG 3.32Å; R526-S529 WeakPolarHBondContact CA-OG 3.49Å; R526-S529 PolarHBondContact O-OG 3.07Å; R526-K530 WeakPolarHBondContact O-CB 3.3Å; R526-K530 VanDerWaalsContact O-CG 3.27Å; R526-K530 WeakPolarHBondContact O-CG 3Å; R526-K530 PolarHBondContact O-N 2.66Å
527	L	75.6	Confident	76.3	Confident	125 Å²	125	81.8 Å²	81.8	65%	0.654	40%	0.396	S	S	*	.	H	α-helix	trans	-80.8	-51.3	176.4	-63.5	175.6	0	0	0	109.9	D525 S529 K530 Q531	D525-L527 VanDerWaalsContact C-N 3.34Å; D525-L527 PolarHBondContact O-N 3.09Å; D525-L527 WeakPolarHBondContact OD1-CB 3.4Å; D525-L527 PolarHBondContact OD1-N 2.9Å; L527-S529 PolarHBondContact O-N 3.49Å; L527-K530 PolarHBondContact O-N 3.22Å; L527-Q531 WeakPolarHBondContact O-CG 3.14Å; L527-Q531 PolarHBondContact O-N 2.83Å
528	L	74.9	Confident	76	Confident	28 Å²	28	78.6 Å²	78.6	15%	0.147	38%	0.383	C	S	.	.	H	α-helix	trans	-61.2	-41.4	176.3	-71.4	175.2	0	0	0	112	V523 D525 K530 Q531 L532 M596	V523-L528 HydrophobicContact CG1-CB 3.98Å; D525-L528 HydrophobicContact CB-CB 4.1Å; D525-L528 HydrophobicContact CB-CD1 4.15Å; D525-L528 HydrophobicContact CB-CG 4.33Å; D525-L528 PolarHBondContact OD1-N 2.88Å; D525-L528 WeakPolarHBondContact OD2-CD1 3.31Å; D525-L528 WeakPolarHBondContact OD2-CG 3.44Å; L528-K530 PolarHBondContact O-N 3.06Å; L528-Q531 PolarHBondContact O-N 3.18Å; L528-L532 WeakPolarHBondContact O-CB 3.32Å; L528-L532 VanDerWaalsContact O-CG 3.27Å; L528-L532 WeakPolarHBondContact O-CG 3.5Å; L528-L532 PolarHBondContact O-N 3.36Å; L528-M596 HydrophobicContact CD1-CE 4.13Å
529	S	80.1	Confident	76.3	Confident	22 Å²	22	76.4 Å²	76.4	15%	0.154	37%	0.373	C	S	.	.	H	α-helix	trans	-67.1	-32	175.6	54.9	0	0	0	0	113.4	D525 R526 L527 N533	D525-S529 VanDerWaalsContact O-CB 3.31Å; D525-S529 WeakPolarHBondContact O-CB 3.3Å; D525-S529 PolarHBondContact O-N 3.37Å; D525-S529 PolarHBondContact O-OG 3.3Å; R526-S529 VanDerWaalsContact CA-OG 3.32Å; R526-S529 WeakPolarHBondContact CA-OG 3.49Å; R526-S529 PolarHBondContact O-OG 3.07Å; L527-S529 PolarHBondContact O-N 3.49Å; S529-N533 PolarHBondContact O-N 2.88Å; S529-N533 PolarHBondContact O-ND2 2.87Å
530	K	79.8	Confident	76.3	Confident	159 Å²	159	76.7 Å²	76.7	69%	0.691	38%	0.375	S	S	*	.	H	α-helix	trans	-65.8	-46.9	169.6	-83.3	179.4	175.5	-170.6	0	111.5	R526 L527 L528 L532 N533 S534	R526-K530 WeakPolarHBondContact O-CB 3.3Å; R526-K530 VanDerWaalsContact O-CG 3.27Å; R526-K530 WeakPolarHBondContact O-CG 3Å; R526-K530 PolarHBondContact O-N 2.66Å; L527-K530 PolarHBondContact O-N 3.22Å; L528-K530 PolarHBondContact O-N 3.06Å; K530-L532 PolarHBondContact O-N 3.06Å; K530-N533 CarbonylContact O-C 3.53Å; K530-N533 PolarHBondContact O-N 3.35Å; K530-N533 VanDerWaalsContact O-N 3.16Å; K530-S534 PolarHBondContact O-N 2.81Å
531	Q	76.8	Confident	76.5	Confident	89 Å²	89	77.7 Å²	77.7	42%	0.416	38%	0.379	S	S	.	.	H	α-helix	trans	-64.8	-36.6	178.8	-68.1	177.9	-26.1	0	0	112.8	L527 L528 N533 S534	L527-Q531 WeakPolarHBondContact O-CG 3.14Å; L527-Q531 PolarHBondContact O-N 2.83Å; L528-Q531 PolarHBondContact O-N 3.18Å; Q531-N533 PolarHBondContact O-N 3.34Å; Q531-S534 VanDerWaalsContact O-CB 3.25Å; Q531-S534 WeakPolarHBondContact O-CB 3.19Å; Q531-S534 PolarHBondContact O-N 3.45Å; Q531-S534 VanDerWaalsContact O-N 3.12Å
532	L	79.6	Confident	77	Confident	7 Å²	7	69.5 Å²	69.5	4%	0.037	35%	0.352	C	S	.	.	H	α-helix	trans	-68.9	-19.1	174.6	-73.2	168.5	0	0	0	113.6	T516 L519 A520 V523 L528 K530 F567 I572	T516-L532 WeakPolarHBondContact CG2-O 3.38Å; L519-L532 HydrophobicContact CD2-CD1 4.39Å; L519-L532 HydrophobicContact CG-CD1 4.42Å; A520-L532 HydrophobicContact CB-CB 3.85Å; A520-L532 HydrophobicContact CB-CD1 4.5Å; V523-L532 HydrophobicContact CG2-CD1 4Å; L528-L532 WeakPolarHBondContact O-CB 3.32Å; L528-L532 VanDerWaalsContact O-CG 3.27Å; L528-L532 WeakPolarHBondContact O-CG 3.5Å; L528-L532 PolarHBondContact O-N 3.36Å; K530-L532 PolarHBondContact O-N 3.06Å; L532-F567 HydrophobicContact CD2-CD1 4.4Å; L532-F567 HydrophobicContact CD2-CD2 4.23Å; L532-F567 HydrophobicContact CD2-CE1 3.84Å; L532-F567 HydrophobicContact CD2-CE2 3.64Å; L532-F567 HydrophobicContact CD2-CZ 3.42Å; L532-F567 VanDerWaalsContact CD2-CZ 3.42Å; L532-I572 HydrophobicContact CD1-CD1 4.16Å; L532-I572 HydrophobicContact CD2-CD1 4.02Å
533	N	75.1	Confident	77.8	Confident	96 Å²	96	70 Å²	70	51%	0.513	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	9.6	171.5	-68.2	-57.7	0	0	0	112.2	S529 K530 Q531	S529-N533 PolarHBondContact O-N 2.88Å; S529-N533 PolarHBondContact O-ND2 2.87Å; K530-N533 CarbonylContact O-C 3.53Å; K530-N533 PolarHBondContact O-N 3.35Å; K530-N533 VanDerWaalsContact O-N 3.16Å; Q531-N533 PolarHBondContact O-N 3.34Å
534	S	73.9	Confident	78.4	Confident	45 Å²	45	72.6 Å²	72.6	32%	0.315	37%	0.366	S	S	.	.			trans	-82.6	132.9	174.4	-173.7	0	0	0	0	110.4	K530 Q531 Q536 R537	K530-S534 PolarHBondContact O-N 2.81Å; Q531-S534 VanDerWaalsContact O-CB 3.25Å; Q531-S534 WeakPolarHBondContact O-CB 3.19Å; Q531-S534 PolarHBondContact O-N 3.45Å; Q531-S534 VanDerWaalsContact O-N 3.12Å; S534-Q536 PolarHBondContact O-N 3.16Å; S534-Q536 PolarHBondContact OG-N 3.23Å; S534-R537 PolarHBondContact O-N 3.01Å
535	E	62.3	Low	79.5	Confident	180 Å²	180	67 Å²	67	84%	0.841	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-12.9	174.8	-59.2	-177.7	159.6	0	0	113.2
536	Q	62.5	Low	80.2	Confident	153 Å²	153	67.2 Å²	67.2	72%	0.715	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-17.6	178.9	-63.5	176.2	-18	0	0	114.3	S534	S534-Q536 PolarHBondContact O-N 3.16Å; S534-Q536 PolarHBondContact OG-N 3.23Å
537	R	72.1	Confident	80.9	Confident	36 Å²	36	57.7 Å²	57.7	14%	0.136	29%	0.292	C	S	.	.			trans	-93.6	120.8	179.1	-95.4	-160.4	176.5	138.6	11.9	111.7	S534 D568 D569	S534-R537 PolarHBondContact O-N 3.01Å; R537-D568 WeakPolarHBondContact CA-OD2 3.09Å; R537-D569 IonicContact CZ-OD1 3.82Å; R537-D569 IonicContact CZ-OD2 2.82Å; R537-D569 VanDerWaalsContact NE-CG 3.32Å; R537-D569 IonicContact NE-OD1 3.57Å; R537-D569 PolarHBondContact NE-OD1 2.94Å; R537-D569 IonicContact NE-OD2 3.87Å; R537-D569 PolarHBondContact NE-OD2 2.94Å; R537-D569 VanDerWaalsContact NE-OD2 3.16Å; R537-D569 IonicContact NH2-OD1 2.65Å; R537-D569 PolarHBondContact NH2-OD1 2.79Å; R537-D569 IonicContact NH2-OD2 2.73Å; R537-D569 PolarHBondContact NH2-OD2 3.06Å
538	S	76.4	Confident	81.5	Confident	12 Å²	12	52.1 Å²	52.1	8%	0.084	26%	0.263	C	S	.	.			trans	-96.8	132.2	176.1	177.7	0	0	0	0	112.5	F567 D568 V770	S538-F567 CarbonylContact O-C 3.59Å; S538-F567 WeakPolarHBondContact O-CA 3.48Å; S538-D568 PolarHBondContact N-OD2 3.26Å; S538-D568 PolarHBondContact O-N 3.05Å; S538-V770 VanDerWaalsContact OG-CG1 3.23Å; S538-V770 WeakPolarHBondContact OG-CG1 3.5Å
539	L	85.1	Confident	81.9	Confident	10 Å²	10	53.6 Å²	53.6	5%	0.052	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	113.8	169	-176.9	61.8	0	0	0	110.4	Q512 C542 F565 F567	Q512-L539 HydrophobicContact CB-CB 4.46Å; Q512-L539 HydrophobicContact CB-CD2 4Å; Q512-L539 HydrophobicContact CG-CD2 3.95Å; Q512-L539 HydrophobicContact CG-CG 4.43Å; Q512-L539 PolarHBondContact NE2-O 2.61Å; Q512-L539 PolarHBondContact OE1-O 2.83Å; L539-C542 HydrophobicContact CD1-CB 4.28Å; L539-C542 HydrophobicContact CD2-CB 4.09Å; L539-C542 HydrophobicContact CG-CB 4.46Å; L539-F565 HydrophobicContact CD1-CB 4.01Å; L539-F565 HydrophobicContact CD1-CD1 4.14Å; L539-F565 HydrophobicContact CD2-CD1 4.43Å; L539-F567 HydrophobicContact CB-CD1 4.29Å; L539-F567 HydrophobicContact CB-CE1 4.03Å; L539-F567 HydrophobicContact CD1-CD1 4.18Å; L539-F567 HydrophobicContact CD1-CE1 3.84Å; L539-F567 HydrophobicContact CD1-CE2 4.23Å; L539-F567 HydrophobicContact CD1-CZ 3.86Å; L539-F567 HydrophobicContact CG-CE1 4.47Å
540	V	85.3	Confident	81.8	Confident	6 Å²	6	55.5 Å²	55.5	4%	0.036	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-38.7	-170.7	-171.4	0	0	0	0	112.4	L566 F567 R743 F772	V540-L566 WeakPolarHBondContact CA-O 3.37Å; V540-L566 HydrophobicContact CB-CD2 4.12Å; V540-L566 HydrophobicContact CB-CG 4.01Å; V540-L566 WeakPolarHBondContact CB-O 3.23Å; V540-L566 HydrophobicContact CG1-CD2 4.11Å; V540-L566 PolarHBondContact N-O 3.08Å; V540-F567 VanDerWaalsContact CG2-C 3.46Å; V540-F567 WeakPolarHBondContact CG2-O 3.28Å; V540-R743 HydrophobicContact CG1-CB 4.12Å; V540-R743 HydrophobicContact CG1-CG 4.44Å; V540-R743 PolarHBondContact O-NH1 3.43Å; V540-F772 HydrophobicContact CB-CE1 4.41Å; V540-F772 HydrophobicContact CB-CE2 4.35Å; V540-F772 HydrophobicContact CB-CZ 4.27Å; V540-F772 HydrophobicContact CG1-CD1 3.54Å; V540-F772 HydrophobicContact CG1-CD2 4.19Å; V540-F772 HydrophobicContact CG1-CE1 3.49Å; V540-F772 VanDerWaalsContact CG1-CE1 3.49Å; V540-F772 HydrophobicContact CG1-CE2 4.18Å; V540-F772 HydrophobicContact CG1-CG 3.9Å; V540-F772 HydrophobicContact CG1-CZ 3.83Å; V540-F772 HydrophobicContact CG2-CD1 4.41Å; V540-F772 HydrophobicContact CG2-CD2 3.7Å; V540-F772 HydrophobicContact CG2-CE1 4Å; V540-F772 HydrophobicContact CG2-CE2 3.25Å; V540-F772 HydrophobicContact CG2-CG 4.27Å; V540-F772 HydrophobicContact CG2-CZ 3.4Å; V540-F772 VanDerWaalsContact CG2-CZ 3.4Å
541	L	88.1	Confident	81.3	Confident	25 Å²	25	48.7 Å²	48.7	13%	0.131	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	142.6	175.6	-175.4	61.5	0	0	0	109.4	L566 W740	L541-L566 HydrophobicContact CB-CB 4.13Å; L541-L566 HydrophobicContact CB-CD2 4.19Å; L541-L566 PolarHBondContact N-O 3.46Å; L541-L566 PolarHBondContact O-N 2.9Å; L541-W740 HydrophobicContact CD2-CB 4.45Å; L541-W740 HydrophobicContact CD2-CD2 3.44Å; L541-W740 VanDerWaalsContact CD2-CD2 3.44Å; L541-W740 HydrophobicContact CD2-CE3 3.92Å; L541-W740 HydrophobicContact CD2-CG 3.73Å; L541-W740 HydrophobicContact CD2-CH2 4.19Å; L541-W740 HydrophobicContact CD2-CZ2 3.77Å; L541-W740 HydrophobicContact CD2-CZ3 4.28Å; L541-W740 HydrophobicContact CG-CD2 4.47Å; L541-W740 HydrophobicContact CG-CH2 4.28Å; L541-W740 HydrophobicContact CG-CZ2 3.93Å
542	C	89.6	Confident	80.9	Confident	26 Å²	26	54.3 Å²	54.3	18%	0.176	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	129.9	165.6	-168.1	0	0	0	0	111.1	L539 K563 V564 F565	L539-C542 HydrophobicContact CD1-CB 4.28Å; L539-C542 HydrophobicContact CD2-CB 4.09Å; L539-C542 HydrophobicContact CG-CB 4.46Å; C542-K563 WeakPolarHBondContact SG-CD 3.27Å; C542-K563 WeakPolarHBondContact SG-CE 3.32Å; C542-K563 PolarHBondContact SG-NZ 3.31Å; C542-V564 VanDerWaalsContact CA-O 3.3Å; C542-V564 WeakPolarHBondContact CA-O 3.38Å; C542-V564 PolarHBondContact SG-O 3.35Å; C542-F565 HydrophobicContact CB-CD1 4.16Å; C542-F565 WeakPolarHBondContact SG-CD1 3.19Å; C542-F565 WeakPolarHBondContact SG-CE1 3.39Å
543	E	91.5	Very high	79.7	Confident	45 Å²	45	64.3 Å²	64.3	21%	0.21	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	157.8	-177.2	-157.4	178.9	178.7	0	0	110.9	L545 V564 P732 S736 W740	E543-L545 HydrophobicContact CB-CD2 4.39Å; E543-L545 HydrophobicContact CG-CD2 4.3Å; E543-V564 PolarHBondContact N-O 2.85Å; E543-V564 PolarHBondContact O-N 2.82Å; E543-P732 WeakPolarHBondContact OE1-CD 3.46Å; E543-P732 WeakPolarHBondContact OE1-CG 3.4Å; E543-S736 WeakPolarHBondContact OE1-CB 3.41Å; E543-S736 PolarHBondContact OE1-OG 2.81Å; E543-S736 VanDerWaalsContact OE1-OG 3.07Å; E543-S736 PolarHBondContact OE2-OG 2.93Å; E543-W740 HydrophobicContact CB-CZ2 3.84Å; E543-W740 PolarHBondContact OE2-NE1 3.13Å
544	T	92.1	Very high	79.1	Confident	67 Å²	67	60.8 Å²	60.8	41%	0.411	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	115.8	169.2	-63.4	0	0	0	0	109.5	E561 R562 I576	T544-E561 HydrophobicContact CG2-CB 4.32Å; T544-R562 CarbonylContact C-O 3.52Å; T544-R562 VanDerWaalsContact CA-O 3.29Å; T544-R562 WeakPolarHBondContact CA-O 3.28Å; T544-I576 HydrophobicContact CG2-CD1 3.62Å
545	L	93.9	Very high	78.8	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	156.1	-178.8	-59.4	-176.2	0	0	0	111.5	E543 R562 V564 L708 F729 T731 W740	E543-L545 HydrophobicContact CB-CD2 4.39Å; E543-L545 HydrophobicContact CG-CD2 4.3Å; L545-R562 PolarHBondContact N-O 3.31Å; L545-R562 PolarHBondContact O-N 3.17Å; L545-V564 HydrophobicContact CB-CG2 4.34Å; L545-V564 HydrophobicContact CD1-CB 4.44Å; L545-V564 HydrophobicContact CD1-CG2 4.11Å; L545-V564 HydrophobicContact CG-CG2 4.36Å; L545-L708 HydrophobicContact CD1-CD2 4.41Å; L545-F729 HydrophobicContact CB-CB 4.1Å; L545-F729 HydrophobicContact CB-CD1 3.62Å; L545-F729 HydrophobicContact CB-CE1 4.34Å; L545-F729 HydrophobicContact CB-CG 4.12Å; L545-F729 HydrophobicContact CD1-CB 3.88Å; L545-F729 HydrophobicContact CD1-CD1 4.11Å; L545-F729 HydrophobicContact CD1-CD2 4.37Å; L545-F729 HydrophobicContact CD1-CG 3.89Å; L545-T731 HydrophobicContact CD2-CG2 3.96Å; L545-W740 HydrophobicContact CD1-CD2 4.28Å; L545-W740 HydrophobicContact CD1-CZ2 4.12Å
546	I	92.3	Very high	79.4	Confident	72 Å²	72	56.9 Å²	56.9	37%	0.369	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	102.6	178	-59	172.5	0	0	0	109.8	T548 K560 F729 N730	I546-T548 PolarHBondContact O-N 3.46Å; I546-K560 CarbonylContact C-O 3.58Å; I546-F729 WeakPolarHBondContact O-CA 3.36Å; I546-N730 HydrophobicContact CB-CB 4.49Å; I546-N730 PolarHBondContact N-O 3.2Å; I546-N730 VanDerWaalsContact N-O 3.17Å; I546-N730 PolarHBondContact O-N 2.86Å
547	E	92.4	Very high	80.2	Confident	7 Å²	7	54.3 Å²	54.3	3%	0.033	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	119.1	170.7	174.1	174.9	-114.8	0	0	110.1	V549 S559 K560 R562 K597 V727 V728 F729	E547-V549 HydrophobicContact CG-CG2 4.37Å; E547-S559 CarbonylContact O-C 3.53Å; E547-S559 WeakPolarHBondContact O-CA 3.26Å; E547-K560 PolarHBondContact N-O 2.99Å; E547-K560 PolarHBondContact O-N 3Å; E547-R562 HydrophobicContact CB-CG 3.55Å; E547-R562 IonicContact OE2-CZ 3.05Å; E547-R562 IonicContact OE2-NE 3.79Å; E547-R562 PolarHBondContact OE2-NE 3.01Å; E547-R562 IonicContact OE2-NH2 3.6Å; E547-R562 PolarHBondContact OE2-NH2 2.61Å; E547-K597 IonicContact OE1-NZ 3.33Å; E547-K597 PolarHBondContact OE1-NZ 2.84Å; E547-K597 IonicContact OE2-NZ 2.68Å; E547-K597 PolarHBondContact OE2-NZ 3.03Å; E547-V727 HydrophobicContact CG-CG1 4.27Å; E547-V728 WeakPolarHBondContact CA-O 3.44Å; E547-F729 HydrophobicContact CB-CD1 4.16Å; E547-F729 HydrophobicContact CB-CE1 4Å
548	T	88.1	Confident	80.8	Confident	9 Å²	9	59.1 Å²	59.1	6%	0.055	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	115	176.5	-53.1	0	0	0	0	109.2	I546 Y550 V556 V728 N730	I546-T548 PolarHBondContact O-N 3.46Å; T548-Y550 HydrophobicContact CG2-CD2 4.27Å; T548-Y550 HydrophobicContact CG2-CE1 4.16Å; T548-Y550 HydrophobicContact CG2-CE2 3.66Å; T548-V556 HydrophobicContact CG2-CB 4.39Å; T548-V556 HydrophobicContact CG2-CG1 3.78Å; T548-V556 HydrophobicContact CG2-CG2 3.78Å; T548-V728 PolarHBondContact N-O 3.5Å; T548-N730 PolarHBondContact OG1-ND2 3Å
549	V	83.6	Confident	81.3	Confident	58 Å²	58	62.1 Å²	62.1	35%	0.352	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	117.8	176.9	-175.9	0	0	0	0	108.8	E547 L557 K558	E547-V549 HydrophobicContact CG-CG2 4.37Å; V549-L557 PolarHBondContact O-N 3.41Å; V549-K558 HydrophobicContact CB-CB 4.46Å; V549-K558 WeakPolarHBondContact CB-O 3.21Å; V549-K558 PolarHBondContact N-O 2.85Å; V549-K558 PolarHBondContact O-N 3.26Å
550	Y	76.8	Confident	81.6	Confident	62 Å²	62	66.4 Å²	66.4	24%	0.243	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	154.4	176	-65.5	-84.1	0	0	0	111.6	T548 G554 Q555 V556 R707 V728	T548-Y550 HydrophobicContact CG2-CD2 4.27Å; T548-Y550 HydrophobicContact CG2-CE1 4.16Å; T548-Y550 HydrophobicContact CG2-CE2 3.66Å; Y550-G554 VanDerWaalsContact CD1-O 3.27Å; Y550-G554 WeakPolarHBondContact CD1-O 3.36Å; Y550-Q555 CarbonylContact C-O 3.59Å; Y550-Q555 WeakPolarHBondContact CA-O 3.42Å; Y550-V556 HydrophobicContact CD1-CG2 4.02Å; Y550-V556 HydrophobicContact CE1-CG2 3.59Å; Y550-R707 PolarHBondContact OH-NH1 3.37Å; Y550-V728 HydrophobicContact CD2-CB 4.46Å; Y550-V728 HydrophobicContact CD2-CG2 4.18Å; Y550-V728 HydrophobicContact CE2-CB 3.8Å; Y550-V728 HydrophobicContact CE2-CG1 3.95Å; Y550-V728 HydrophobicContact CE2-CG2 3.78Å
551	G	70.4	Confident	81.9	Confident	16 Å²	16	71.9 Å²	71.9	17%	0.165	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-97.4	172.9	169.5	0	0	0	0	0	112.2	R553 G554 Q555	G551-R553 PolarHBondContact O-N 2.83Å; G551-R553 VanDerWaalsContact O-N 3.09Å; G551-G554 PolarHBondContact O-N 2.95Å; G551-Q555 PolarHBondContact N-O 3.24Å
552	E	67.4	Low	82.1	Confident	208 Å²	208	71.4 Å²	71.4	97%	0.972	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-22.4	-177.2	-64.9	165.6	179.3	0	0	114
553	R	55.6	Low	82.2	Confident	216 Å²	216	71 Å²	71	82%	0.815	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	26.1	175.4	-56.1	-172.2	-66	-131	3.6	112.3	G551 Q555	G551-R553 PolarHBondContact O-N 2.83Å; G551-R553 VanDerWaalsContact O-N 3.09Å; R553-Q555 VanDerWaalsContact C-OE1 3.25Å; R553-Q555 PolarHBondContact O-N 3.17Å
554	G	62.2	Low	82.3	Confident	22 Å²	22	69 Å²	69	23%	0.227	34%	0.343	C	S	.	.	S	Bend	trans	69.3	-2.1	177.8	0	0	0	0	0	115.7	Y550 G551 P644	Y550-G554 VanDerWaalsContact CD1-O 3.27Å; Y550-G554 WeakPolarHBondContact CD1-O 3.36Å; G551-G554 PolarHBondContact O-N 2.95Å; G554-P644 VanDerWaalsContact O-CG 3.25Å; G554-P644 WeakPolarHBondContact O-CG 3.29Å
555	Q	67.8	Low	82.4	Confident	69 Å²	69	65.8 Å²	65.8	32%	0.322	32%	0.323	S	S	.	.			trans	-75.6	143.6	-177.3	79.8	-76.6	29	0	0	112	Y550 G551 R553 L557	Y550-Q555 CarbonylContact C-O 3.59Å; Y550-Q555 WeakPolarHBondContact CA-O 3.42Å; G551-Q555 PolarHBondContact N-O 3.24Å; R553-Q555 VanDerWaalsContact C-OE1 3.25Å; R553-Q555 PolarHBondContact O-N 3.17Å; Q555-L557 HydrophobicContact CG-CD2 4.26Å; Q555-L557 PolarHBondContact O-N 3.02Å
556	V	74.8	Confident	82.3	Confident	75 Å²	75	65.7 Å²	65.7	46%	0.455	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	116.1	173.1	178.3	0	0	0	0	109.1	T548 Y550	T548-V556 HydrophobicContact CG2-CB 4.39Å; T548-V556 HydrophobicContact CG2-CG1 3.78Å; T548-V556 HydrophobicContact CG2-CG2 3.78Å; Y550-V556 HydrophobicContact CD1-CG2 4.02Å; Y550-V556 HydrophobicContact CE1-CG2 3.59Å
557	L	79.9	Confident	82.2	Confident	98 Å²	98	62.3 Å²	62.3	51%	0.513	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-48.3	175.9	-66.6	176.3	0	0	0	111.4	V549 Q555	V549-L557 PolarHBondContact O-N 3.41Å; Q555-L557 HydrophobicContact CG-CD2 4.26Å; Q555-L557 PolarHBondContact O-N 3.02Å
558	K	84.1	Confident	81.9	Confident	138 Å²	138	63 Å²	63	60%	0.6	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-152.6	137.3	-174.1	-61.4	-177.4	-179.1	169.3	0	110.6	V549	V549-K558 HydrophobicContact CB-CB 4.46Å; V549-K558 WeakPolarHBondContact CB-O 3.21Å; V549-K558 PolarHBondContact N-O 2.85Å; V549-K558 PolarHBondContact O-N 3.26Å
559	S	87.4	Confident	81.9	Confident	75 Å²	75	64.9 Å²	64.9	52%	0.524	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	140.1	165.4	-58.4	0	0	0	0	109.4	E547	E547-S559 CarbonylContact O-C 3.53Å; E547-S559 WeakPolarHBondContact O-CA 3.26Å
560	K	90.7	Very high	82.2	Confident	100 Å²	100	62.8 Å²	62.8	44%	0.435	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	137.9	178.4	-69.3	-168.9	174.6	-169.8	0	112.1	I546 E547	I546-K560 CarbonylContact C-O 3.58Å; E547-K560 PolarHBondContact N-O 2.99Å; E547-K560 PolarHBondContact O-N 3Å
561	E	91	Very high	83	Confident	120 Å²	120	59.8 Å²	59.8	56%	0.561	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.1	142.2	170.3	-67.7	174	-173.7	0	0	111.9	T544 I576	T544-E561 HydrophobicContact CG2-CB 4.32Å; E561-I576 HydrophobicContact CB-CD1 4.36Å
562	R	92.6	Very high	84	Confident	16 Å²	16	59 Å²	59	6%	0.06	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	133.5	-179.8	-59.7	-63.1	166.5	-142.6	36.4	109.2	T544 L545 E547 V564 A574 N575 F729	T544-R562 CarbonylContact C-O 3.52Å; T544-R562 VanDerWaalsContact CA-O 3.29Å; T544-R562 WeakPolarHBondContact CA-O 3.28Å; L545-R562 PolarHBondContact N-O 3.31Å; L545-R562 PolarHBondContact O-N 3.17Å; E547-R562 HydrophobicContact CB-CG 3.55Å; E547-R562 IonicContact OE2-CZ 3.05Å; E547-R562 IonicContact OE2-NE 3.79Å; E547-R562 PolarHBondContact OE2-NE 3.01Å; E547-R562 IonicContact OE2-NH2 3.6Å; E547-R562 PolarHBondContact OE2-NH2 2.61Å; R562-V564 HydrophobicContact CB-CG2 4.1Å; R562-A574 WeakPolarHBondContact CA-O 3.45Å; R562-N575 PolarHBondContact NH1-OD1 2.98Å; R562-N575 VanDerWaalsContact NH1-OD1 3.11Å; R562-N575 PolarHBondContact NH2-OD1 3.09Å; R562-F729 HydrophobicContact CB-CE1 4.04Å; R562-F729 HydrophobicContact CG-CE1 4.06Å
563	K	92.3	Very high	85.3	Confident	18 Å²	18	49.1 Å²	49.1	8%	0.078	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	121	162.8	-174.2	73.2	148.1	150.1	0	106.5	E515 C542 F565 A574 I576 Y594	E515-K563 WeakPolarHBondContact OE1-CE 3.44Å; E515-K563 IonicContact OE1-NZ 3.13Å; E515-K563 PolarHBondContact OE1-NZ 3.09Å; E515-K563 WeakPolarHBondContact OE2-CE 3.35Å; E515-K563 IonicContact OE2-NZ 3.79Å; E515-K563 PolarHBondContact OE2-NZ 2.81Å; C542-K563 WeakPolarHBondContact SG-CD 3.27Å; C542-K563 WeakPolarHBondContact SG-CE 3.32Å; C542-K563 PolarHBondContact SG-NZ 3.31Å; K563-F565 HydrophobicContact CB-CE2 3.98Å; K563-F565 HydrophobicContact CB-CZ 4.35Å; K563-F565 HydrophobicContact CG-CD2 4.22Å; K563-F565 HydrophobicContact CG-CE1 4.2Å; K563-F565 HydrophobicContact CG-CE2 3.44Å; K563-F565 VanDerWaalsContact CG-CE2 3.44Å; K563-F565 HydrophobicContact CG-CZ 3.43Å; K563-F565 VanDerWaalsContact CG-CZ 3.43Å; K563-A574 PolarHBondContact N-O 3.09Å; K563-A574 VanDerWaalsContact N-O 3.12Å; K563-A574 PolarHBondContact O-N 3.31Å; K563-I576 HydrophobicContact CB-CD1 4.1Å; K563-I576 HydrophobicContact CB-CG1 3.95Å; K563-Y594 HydrophobicContact CB-CD1 3.85Å; K563-Y594 HydrophobicContact CB-CE1 3.63Å; K563-Y594 HydrophobicContact CD-CE1 4.22Å; K563-Y594 WeakPolarHBondContact CE-OH 3.49Å; K563-Y594 HydrophobicContact CG-CD1 4.08Å; K563-Y594 HydrophobicContact CG-CE1 3.54Å
564	V	93.9	Very high	87	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131	-178.6	-171.1	0	0	0	0	108.2	C542 E543 L545 R562 L571 I572 F729 W740	C542-V564 VanDerWaalsContact CA-O 3.3Å; C542-V564 WeakPolarHBondContact CA-O 3.38Å; C542-V564 PolarHBondContact SG-O 3.35Å; E543-V564 PolarHBondContact N-O 2.85Å; E543-V564 PolarHBondContact O-N 2.82Å; L545-V564 HydrophobicContact CB-CG2 4.34Å; L545-V564 HydrophobicContact CD1-CB 4.44Å; L545-V564 HydrophobicContact CD1-CG2 4.11Å; L545-V564 HydrophobicContact CG-CG2 4.36Å; R562-V564 HydrophobicContact CB-CG2 4.1Å; V564-L571 HydrophobicContact CG1-CD1 3.77Å; V564-L571 HydrophobicContact CG1-CG 4.44Å; V564-I572 WeakPolarHBondContact CA-O 3.32Å; V564-F729 HydrophobicContact CG2-CD1 4.4Å; V564-F729 HydrophobicContact CG2-CE1 3.69Å; V564-F729 HydrophobicContact CG2-CE2 4.48Å; V564-F729 HydrophobicContact CG2-CZ 3.74Å; V564-W740 HydrophobicContact CB-CH2 3.71Å; V564-W740 HydrophobicContact CB-CZ2 4.04Å; V564-W740 HydrophobicContact CB-CZ3 4.48Å; V564-W740 HydrophobicContact CG1-CH2 3.52Å; V564-W740 HydrophobicContact CG1-CZ2 4.29Å; V564-W740 HydrophobicContact CG1-CZ3 3.85Å
565	F	92.7	Very high	88.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	120.7	-177	-56.3	-104.3	0	0	0	108.6	E515 L519 L539 C542 K563 F567 I572 A574 Y594	E515-F565 HydrophobicContact CB-CE1 4.41Å; L519-F565 HydrophobicContact CB-CE1 4.27Å; L519-F565 HydrophobicContact CB-CZ 4.17Å; L519-F565 HydrophobicContact CD1-CD2 4.38Å; L519-F565 HydrophobicContact CD1-CE2 3.88Å; L519-F565 HydrophobicContact CD1-CZ 4.17Å; L519-F565 HydrophobicContact CD2-CB 4.36Å; L519-F565 HydrophobicContact CD2-CD1 3.91Å; L519-F565 HydrophobicContact CD2-CD2 3.8Å; L519-F565 HydrophobicContact CD2-CE1 4.06Å; L519-F565 HydrophobicContact CD2-CE2 3.96Å; L519-F565 HydrophobicContact CD2-CG 3.78Å; L519-F565 HydrophobicContact CD2-CZ 4.09Å; L519-F565 HydrophobicContact CG-CE2 4.39Å; L519-F565 HydrophobicContact CG-CZ 4.37Å; L539-F565 HydrophobicContact CD1-CB 4.01Å; L539-F565 HydrophobicContact CD1-CD1 4.14Å; L539-F565 HydrophobicContact CD2-CD1 4.43Å; C542-F565 HydrophobicContact CB-CD1 4.16Å; C542-F565 WeakPolarHBondContact SG-CD1 3.19Å; C542-F565 WeakPolarHBondContact SG-CE1 3.39Å; K563-F565 HydrophobicContact CB-CE2 3.98Å; K563-F565 HydrophobicContact CB-CZ 4.35Å; K563-F565 HydrophobicContact CG-CD2 4.22Å; K563-F565 HydrophobicContact CG-CE1 4.2Å; K563-F565 HydrophobicContact CG-CE2 3.44Å; K563-F565 VanDerWaalsContact CG-CE2 3.44Å; K563-F565 HydrophobicContact CG-CZ 3.43Å; K563-F565 VanDerWaalsContact CG-CZ 3.43Å; F565-F567 HydrophobicContact CB-CD2 4.27Å; F565-F567 HydrophobicContact CB-CE2 3.6Å; F565-F567 HydrophobicContact CB-CZ 4.22Å; F565-F567 HydrophobicContact CG-CE2 4.42Å; F565-I572 HydrophobicContact CB-CB 4.37Å; F565-I572 PolarHBondContact N-O 3.4Å; F565-I572 PolarHBondContact O-N 2.9Å; F565-A574 HydrophobicContact CE2-CB 4.07Å; F565-Y594 HydrophobicContact CE2-CG 4.46Å; F565-Y594 HydrophobicContact CZ-CD1 4.37Å; F565-Y594 AromaticContact CZ-CD2 3.81Å; F565-Y594 HydrophobicContact CZ-CD2 3.81Å; F565-Y594 HydrophobicContact CZ-CE1 4.42Å; F565-Y594 AromaticContact CZ-CE2 3.85Å; F565-Y594 HydrophobicContact CZ-CE2 3.85Å; F565-Y594 HydrophobicContact CZ-CG 4.09Å
566	L	92.3	Very high	89.2	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	109.2	172.1	177.1	65.8	0	0	0	108.1	V540 L541 L571 L602 W740 R743	V540-L566 WeakPolarHBondContact CA-O 3.37Å; V540-L566 HydrophobicContact CB-CD2 4.12Å; V540-L566 HydrophobicContact CB-CG 4.01Å; V540-L566 WeakPolarHBondContact CB-O 3.23Å; V540-L566 HydrophobicContact CG1-CD2 4.11Å; V540-L566 PolarHBondContact N-O 3.08Å; L541-L566 HydrophobicContact CB-CB 4.13Å; L541-L566 HydrophobicContact CB-CD2 4.19Å; L541-L566 PolarHBondContact N-O 3.46Å; L541-L566 PolarHBondContact O-N 2.9Å; L566-L571 HydrophobicContact CB-CD1 4.32Å; L566-L571 HydrophobicContact CD1-CD1 4.18Å; L566-L602 HydrophobicContact CD1-CD1 3.73Å; L566-L602 HydrophobicContact CD1-CD2 3.49Å; L566-L602 VanDerWaalsContact CD1-CD2 3.49Å; L566-L602 HydrophobicContact CD1-CG 4.26Å; L566-W740 HydrophobicContact CB-CH2 4.3Å; L566-W740 HydrophobicContact CB-CZ3 3.9Å; L566-R743 HydrophobicContact CD2-CB 3.7Å
567	F	90.1	Very high	89.4	Confident	1 Å²	1	37.2 Å²	37.2	0%	0.004	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-175.7	168.2	-64.8	-86.2	0	0	0	110.3	T516 L519 L532 S538 L539 V540 F565 V570 I572 L602	T516-F567 HydrophobicContact CG2-CE1 3.81Å; T516-F567 HydrophobicContact CG2-CZ 4.06Å; L519-F567 HydrophobicContact CD2-CE2 4.11Å; L519-F567 HydrophobicContact CD2-CZ 4.16Å; L532-F567 HydrophobicContact CD2-CD1 4.4Å; L532-F567 HydrophobicContact CD2-CD2 4.23Å; L532-F567 HydrophobicContact CD2-CE1 3.84Å; L532-F567 HydrophobicContact CD2-CE2 3.64Å; L532-F567 HydrophobicContact CD2-CZ 3.42Å; L532-F567 VanDerWaalsContact CD2-CZ 3.42Å; S538-F567 CarbonylContact O-C 3.59Å; S538-F567 WeakPolarHBondContact O-CA 3.48Å; L539-F567 HydrophobicContact CB-CD1 4.29Å; L539-F567 HydrophobicContact CB-CE1 4.03Å; L539-F567 HydrophobicContact CD1-CD1 4.18Å; L539-F567 HydrophobicContact CD1-CE1 3.84Å; L539-F567 HydrophobicContact CD1-CE2 4.23Å; L539-F567 HydrophobicContact CD1-CZ 3.86Å; L539-F567 HydrophobicContact CG-CE1 4.47Å; V540-F567 VanDerWaalsContact CG2-C 3.46Å; V540-F567 WeakPolarHBondContact CG2-O 3.28Å; F565-F567 HydrophobicContact CB-CD2 4.27Å; F565-F567 HydrophobicContact CB-CE2 3.6Å; F565-F567 HydrophobicContact CB-CZ 4.22Å; F565-F567 HydrophobicContact CG-CE2 4.42Å; F567-V570 WeakPolarHBondContact CB-O 3.42Å; F567-V570 PolarHBondContact N-O 2.81Å; F567-I572 HydrophobicContact CD2-CD1 4.23Å; F567-I572 HydrophobicContact CD2-CG1 4.33Å; F567-I572 HydrophobicContact CE2-CD1 3.89Å; F567-I572 HydrophobicContact CE2-CG1 4.25Å; F567-L602 VanDerWaalsContact O-CD1 3.27Å; F567-L602 WeakPolarHBondContact O-CD1 3.31Å
568	D	86.7	Confident	88.8	Confident	20 Å²	20	38.1 Å²	38.1	11%	0.107	20%	0.197	C	C	.	.	S	Bend	trans	-65.5	-38.4	170.5	35.4	30	0	0	0	112.9	R537 S538 L602 L751 F772	R537-D568 WeakPolarHBondContact CA-OD2 3.09Å; S538-D568 PolarHBondContact N-OD2 3.26Å; S538-D568 PolarHBondContact O-N 3.05Å; D568-L602 WeakPolarHBondContact O-CD1 3.1Å; D568-L751 WeakPolarHBondContact O-CD1 3.44Å; D568-L751 WeakPolarHBondContact O-CG 3.37Å; D568-F772 HydrophobicContact CB-CE2 4.03Å
569	D	87.6	Confident	87.2	Confident	49 Å²	49	40.9 Å²	40.9	26%	0.262	21%	0.209	S	C	.	.	S	Bend	trans	-110.9	-27.1	-175.9	71.3	-15	0	0	0	115.5	R537 L602 L751	R537-D569 IonicContact CZ-OD1 3.82Å; R537-D569 IonicContact CZ-OD2 2.82Å; R537-D569 VanDerWaalsContact NE-CG 3.32Å; R537-D569 IonicContact NE-OD1 3.57Å; R537-D569 PolarHBondContact NE-OD1 2.94Å; R537-D569 IonicContact NE-OD2 3.87Å; R537-D569 PolarHBondContact NE-OD2 2.94Å; R537-D569 VanDerWaalsContact NE-OD2 3.16Å; R537-D569 IonicContact NH2-OD1 2.65Å; R537-D569 PolarHBondContact NH2-OD1 2.79Å; R537-D569 IonicContact NH2-OD2 2.73Å; R537-D569 PolarHBondContact NH2-OD2 3.06Å; D569-L602 PolarHBondContact O-N 3.32Å; D569-L751 HydrophobicContact CB-CD2 4.18Å
570	V	90.5	Very high	85.5	Confident	14 Å²	14	39.5 Å²	39.5	9%	0.085	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	139.7	-169.4	173.5	0	0	0	0	112.7	F567 I572 A600	F567-V570 WeakPolarHBondContact CB-O 3.42Å; F567-V570 PolarHBondContact N-O 2.81Å; V570-I572 HydrophobicContact CG1-CD1 4.26Å; V570-I572 HydrophobicContact CG1-CG1 3.67Å; V570-A600 WeakPolarHBondContact CA-O 3.15Å
571	L	93.3	Very high	83.4	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	126.6	164.9	-173.5	67.2	0	0	0	110.1	V564 L566 W598 S599 A600 L602 V605 L710 W740	V564-L571 HydrophobicContact CG1-CD1 3.77Å; V564-L571 HydrophobicContact CG1-CG 4.44Å; L566-L571 HydrophobicContact CB-CD1 4.32Å; L566-L571 HydrophobicContact CD1-CD1 4.18Å; L571-W598 HydrophobicContact CB-CZ3 4.39Å; L571-W598 HydrophobicContact CD2-CH2 3.71Å; L571-W598 HydrophobicContact CD2-CZ3 3.87Å; L571-W598 HydrophobicContact CG-CH2 4.1Å; L571-W598 HydrophobicContact CG-CZ3 3.93Å; L571-S599 CarbonylContact O-C 3.58Å; L571-S599 VanDerWaalsContact O-CA 3.31Å; L571-S599 WeakPolarHBondContact O-CA 3.27Å; L571-A600 PolarHBondContact N-O 2.88Å; L571-A600 PolarHBondContact O-N 3.3Å; L571-L602 HydrophobicContact CB-CD2 3.8Å; L571-V605 HydrophobicContact CB-CG2 4.4Å; L571-V605 HydrophobicContact CD2-CG1 4.03Å; L571-V605 HydrophobicContact CD2-CG2 4.32Å; L571-L710 HydrophobicContact CD2-CD1 3.61Å; L571-W740 HydrophobicContact CD1-CZ3 3.94Å
572	I	92.1	Very high	81.4	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	131.6	177.2	-52	-173.6	0	0	0	110.3	L519 L532 V564 F565 F567 V570 M596	L519-I572 HydrophobicContact CD2-CD1 4.15Å; L519-I572 HydrophobicContact CD2-CG2 4.38Å; L532-I572 HydrophobicContact CD1-CD1 4.16Å; L532-I572 HydrophobicContact CD2-CD1 4.02Å; V564-I572 WeakPolarHBondContact CA-O 3.32Å; F565-I572 HydrophobicContact CB-CB 4.37Å; F565-I572 PolarHBondContact N-O 3.4Å; F565-I572 PolarHBondContact O-N 2.9Å; F567-I572 HydrophobicContact CD2-CD1 4.23Å; F567-I572 HydrophobicContact CD2-CG1 4.33Å; F567-I572 HydrophobicContact CE2-CD1 3.89Å; F567-I572 HydrophobicContact CE2-CG1 4.25Å; V570-I572 HydrophobicContact CG1-CD1 4.26Å; V570-I572 HydrophobicContact CG1-CG1 3.67Å; I572-M596 HydrophobicContact CG2-CG 3.82Å; I572-M596 HydrophobicContact CG2-SD 3.86Å
573	C	92.9	Very high	79.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	125.9	172.6	178.3	0	0	0	0	109.9	K597 W598	C573-K597 WeakPolarHBondContact O-CA 3.47Å; C573-K597 WeakPolarHBondContact O-CB 3.25Å; C573-K597 PolarHBondContact O-N 3Å; C573-W598 HydrophobicContact CB-CD2 3.62Å; C573-W598 HydrophobicContact CB-CE3 3.99Å; C573-W598 HydrophobicContact CB-CG 4.22Å; C573-W598 HydrophobicContact CB-CH2 3.82Å; C573-W598 HydrophobicContact CB-CZ2 3.43Å; C573-W598 VanDerWaalsContact CB-CZ2 3.43Å; C573-W598 HydrophobicContact CB-CZ3 4.08Å; C573-W598 PolarHBondContact N-O 3.33Å; C573-W598 PolarHBondContact O-N 2.94Å
574	A	91.9	Very high	77	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.6	-179.9	0	0	0	0	0	112.9	L519 R562 K563 F565 T595	L519-A574 HydrophobicContact CD1-CB 4.39Å; R562-A574 WeakPolarHBondContact CA-O 3.45Å; K563-A574 PolarHBondContact N-O 3.09Å; K563-A574 VanDerWaalsContact N-O 3.12Å; K563-A574 PolarHBondContact O-N 3.31Å; F565-A574 HydrophobicContact CE2-CB 4.07Å; A574-T595 WeakPolarHBondContact CA-O 3.47Å
575	N	89.8	Confident	74.5	Confident	39 Å²	39	50 Å²	50	21%	0.209	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	139.1	164.3	-51	-89.4	0	0	0	108.9	R562 N577 Y594 T595	R562-N575 PolarHBondContact NH1-OD1 2.98Å; R562-N575 VanDerWaalsContact NH1-OD1 3.11Å; R562-N575 PolarHBondContact NH2-OD1 3.09Å; N575-N577 PolarHBondContact O-ND2 2.81Å; N575-Y594 CarbonylContact O-C 3.53Å; N575-Y594 WeakPolarHBondContact O-CA 3.43Å; N575-T595 PolarHBondContact N-O 3.48Å; N575-T595 PolarHBondContact ND2-O 3.36Å; N575-T595 PolarHBondContact O-N 2.96Å
576	I	87.2	Confident	72.2	Confident	35 Å²	35	54.2 Å²	54.2	18%	0.179	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	115.3	173	-59.3	-178.2	0	0	0	107.7	T544 E561 K563 V578 P592	T544-I576 HydrophobicContact CG2-CD1 3.62Å; E561-I576 HydrophobicContact CB-CD1 4.36Å; K563-I576 HydrophobicContact CB-CD1 4.1Å; K563-I576 HydrophobicContact CB-CG1 3.95Å; I576-V578 HydrophobicContact CG2-CG2 3.85Å; I576-P592 HydrophobicContact CG2-CB 3.69Å; I576-P592 HydrophobicContact CG2-CG 4.5Å
577	N	77.9	Confident	70	Confident	58 Å²	58	58.3 Å²	58.3	31%	0.31	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	93.7	177.7	-50.5	-88	0	0	0	110.1	N575 K579 K593 T595	N575-N577 PolarHBondContact O-ND2 2.81Å; N577-K579 PolarHBondContact O-N 3.23Å; N577-K593 HydrophobicContact CB-CB 4.5Å; N577-K593 VanDerWaalsContact CB-O 3.22Å; N577-K593 WeakPolarHBondContact CB-O 3.45Å; N577-K593 PolarHBondContact N-O 2.92Å; N577-K593 PolarHBondContact ND2-O 2.84Å; N577-K593 PolarHBondContact O-N 3.33Å; N577-T595 PolarHBondContact ND2-OG1 3.12Å
578	V	67.8	Low	67.7	Low	117 Å²	117	59.6 Å²	59.6	71%	0.709	35%	0.346	S	S	*	.			trans	-79.9	31.3	175.2	-156.1	0	0	0	0	111.6	I576 G580	I576-V578 HydrophobicContact CG2-CG2 3.85Å; V578-G580 PolarHBondContact O-N 2.85Å
579	K	50.3	Low	65.6	Low	196 Å²	196	63.9 Å²	63.9	85%	0.852	38%	0.375	S	S	*	.			trans	-83.1	78.8	-178.2	-75.9	-164.6	172.6	-169.3	0	111.6	N577	N577-K579 PolarHBondContact O-N 3.23Å
580	G	52	Low	63.8	Low	45 Å²	45	66.3 Å²	66.3	46%	0.464	39%	0.392	S	S	.	.	S	Bend	trans	-91.5	166	146.6	0	0	0	0	0	110.6	V578	V578-G580 PolarHBondContact O-N 2.85Å
581	P	45.7	Very low	62.1	Low	75 Å²	75	67.2 Å²	67.2	49%	0.487	40%	0.403	S	S	.	.			trans	-65.6	145.6	164.3	30.3	-34.2	0	0	0	110.1	D583 I584 S585	P581-D583 VanDerWaalsContact C-N 3.27Å; P581-D583 PolarHBondContact O-N 3.4Å; P581-D583 VanDerWaalsContact O-N 3.15Å; P581-I584 HydrophobicContact CG-CB 4.44Å; P581-I584 HydrophobicContact CG-CD1 3.78Å; P581-I584 HydrophobicContact CG-CG1 4.07Å; P581-I584 PolarHBondContact O-N 2.98Å; P581-S585 PolarHBondContact O-OG 3.19Å
582	P	49.1	Very low	60.8	Low	104 Å²	104	69.3 Å²	69.3	68%	0.675	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-34.6	-166.2	21.5	-32.9	0	0	0	113.9	I584 S585	P582-I584 PolarHBondContact O-N 3Å; P582-S585 WeakPolarHBondContact CA-OG 3.46Å; P582-S585 PolarHBondContact O-N 3.45Å; P582-S585 PolarHBondContact O-OG 2.87Å
583	D	45.7	Very low	59.9	Low	138 Å²	138	76 Å²	76	74%	0.738	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-9.6	-174.5	-49.4	-62	0	0	0	114.6	P581	P581-D583 VanDerWaalsContact C-N 3.27Å; P581-D583 PolarHBondContact O-N 3.4Å; P581-D583 VanDerWaalsContact O-N 3.15Å
584	I	48	Very low	59.4	Low	85 Å²	85	76.4 Å²	76.4	44%	0.436	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-22.4	179.4	-54.5	-176.3	0	0	0	111.5	M432 P581 P582 S586 L587	M432-I584 HydrophobicContact CE-CG2 4.41Å; P581-I584 HydrophobicContact CG-CB 4.44Å; P581-I584 HydrophobicContact CG-CD1 3.78Å; P581-I584 HydrophobicContact CG-CG1 4.07Å; P581-I584 PolarHBondContact O-N 2.98Å; P582-I584 PolarHBondContact O-N 3Å; I584-S586 VanDerWaalsContact C-N 3.28Å; I584-S586 PolarHBondContact O-N 3.49Å; I584-L587 PolarHBondContact O-N 3.15Å
585	S	41.3	Very low	59.1	Low	74 Å²	74	79.3 Å²	79.3	52%	0.517	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-27.5	-173.2	-10.8	0	0	0	0	115.2	P581 P582	P581-S585 PolarHBondContact O-OG 3.19Å; P582-S585 WeakPolarHBondContact CA-OG 3.46Å; P582-S585 PolarHBondContact O-N 3.45Å; P582-S585 PolarHBondContact O-OG 2.87Å
586	S	44	Very low	59	Low	89 Å²	89	80 Å²	80	62%	0.622	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-24.6	-176.2	50.8	0	0	0	0	113.5	I584	I584-S586 VanDerWaalsContact C-N 3.28Å; I584-S586 PolarHBondContact O-N 3.49Å
587	L	45.5	Very low	59	Low	85 Å²	85	82.6 Å²	82.6	45%	0.445	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-21.6	-161.8	-71.4	165.2	0	0	0	115.1	K428 M432 I584	K428-L587 WeakPolarHBondContact CD-O 3.48Å; K428-L587 WeakPolarHBondContact CE-O 3.49Å; K428-L587 WeakPolarHBondContact CG-O 3.3Å; K428-L587 PolarHBondContact NZ-O 3.31Å; M432-L587 HydrophobicContact CE-CB 3.56Å; M432-L587 HydrophobicContact CE-CD1 3.95Å; M432-L587 HydrophobicContact CE-CG 4.41Å; M432-L587 HydrophobicContact CG-CB 3.75Å; M432-L587 HydrophobicContact CG-CD1 4.21Å; M432-L587 HydrophobicContact CG-CG 4.44Å; M432-L587 HydrophobicContact SD-CB 3.41Å; M432-L587 WeakPolarHBondContact SD-CB 3.37Å; I584-L587 PolarHBondContact O-N 3.15Å
588	V	41.3	Very low	59.6	Low	29 Å²	29	81.1 Å²	81.1	18%	0.176	47%	0.468	C	S	.	.	S	Bend	trans	-141.5	134.4	163.1	178.8	0	0	0	0	109.9	K428 M432 V590	K428-V588 HydrophobicContact CB-CG2 4.22Å; K428-V588 HydrophobicContact CD-CG2 4.35Å; K428-V588 HydrophobicContact CG-CG2 4.22Å; M432-V588 HydrophobicContact SD-CG2 3.72Å; V588-V590 PolarHBondContact O-N 2.89Å
589	P	44.2	Very low	60.6	Low	110 Å²	110	77.7 Å²	77.7	71%	0.714	45%	0.45	S	S	*	.			trans	-66.1	95.6	165.8	-12.8	28.4	0	0	0	109.3	G591	P589-G591 PolarHBondContact O-N 3.12Å; P589-G591 VanDerWaalsContact O-N 3.1Å
590	V	48.5	Very low	62.6	Low	100 Å²	100	68.4 Å²	68.4	61%	0.606	41%	0.409	S	S	*	.			trans	-68.6	105.8	163.7	179	0	0	0	0	106	V588	V588-V590 PolarHBondContact O-N 2.89Å
591	G	55.9	Low	64.4	Low	32 Å²	32	69.3 Å²	69.3	33%	0.33	41%	0.407	S	S	.	.			trans	-46.8	130.8	-174.6	0	0	0	0	0	111.5	Q518 P589 K593	Q518-G591 PolarHBondContact NE2-O 2.75Å; P589-G591 PolarHBondContact O-N 3.12Å; P589-G591 VanDerWaalsContact O-N 3.1Å; G591-K593 PolarHBondContact O-N 2.8Å
592	P	64.9	Low	66.5	Low	44 Å²	44	65.8 Å²	65.8	29%	0.286	38%	0.384	S	S	.	.			trans	-57.6	127.1	-162.6	19.5	-31.8	0	0	0	112.1	Q518 I576 Y594	Q518-P592 PolarHBondContact NE2-O 2.85Å; Q518-P592 VanDerWaalsContact NE2-O 3.13Å; I576-P592 HydrophobicContact CG2-CB 3.69Å; I576-P592 HydrophobicContact CG2-CG 4.5Å; P592-Y594 HydrophobicContact CB-CE1 4.26Å; P592-Y594 HydrophobicContact CG-CE1 3.89Å; P592-Y594 PolarHBondContact O-N 2.83Å
593	K	73.9	Confident	68.3	Low	142 Å²	142	67.2 Å²	67.2	62%	0.617	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.1	104.7	177.3	-74	-173.4	177.9	-179.5	0	109.6	N577 G591	N577-K593 HydrophobicContact CB-CB 4.5Å; N577-K593 VanDerWaalsContact CB-O 3.22Å; N577-K593 WeakPolarHBondContact CB-O 3.45Å; N577-K593 PolarHBondContact N-O 2.92Å; N577-K593 PolarHBondContact ND2-O 2.84Å; N577-K593 PolarHBondContact O-N 3.33Å; G591-K593 PolarHBondContact O-N 2.8Å
594	Y	83.3	Confident	70.3	Confident	8 Å²	8	66.4 Å²	66.4	3%	0.031	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	147.8	171	-52.7	-52	0	0	0	110.6	E515 Q518 S522 K563 F565 N575 P592	E515-Y594 PolarHBondContact OE1-OH 3.41Å; Q518-Y594 HydrophobicContact CB-CD2 4.49Å; Q518-Y594 HydrophobicContact CB-CE2 4.44Å; Q518-Y594 HydrophobicContact CG-CD2 4.06Å; Q518-Y594 HydrophobicContact CG-CE2 4.18Å; S522-Y594 WeakPolarHBondContact CB-O 3.48Å; S522-Y594 PolarHBondContact OG-O 3.12Å; K563-Y594 HydrophobicContact CB-CD1 3.85Å; K563-Y594 HydrophobicContact CB-CE1 3.63Å; K563-Y594 HydrophobicContact CD-CE1 4.22Å; K563-Y594 WeakPolarHBondContact CE-OH 3.49Å; K563-Y594 HydrophobicContact CG-CD1 4.08Å; K563-Y594 HydrophobicContact CG-CE1 3.54Å; F565-Y594 HydrophobicContact CE2-CG 4.46Å; F565-Y594 HydrophobicContact CZ-CD1 4.37Å; F565-Y594 AromaticContact CZ-CD2 3.81Å; F565-Y594 HydrophobicContact CZ-CD2 3.81Å; F565-Y594 HydrophobicContact CZ-CE1 4.42Å; F565-Y594 AromaticContact CZ-CE2 3.85Å; F565-Y594 HydrophobicContact CZ-CE2 3.85Å; F565-Y594 HydrophobicContact CZ-CG 4.09Å; N575-Y594 CarbonylContact O-C 3.53Å; N575-Y594 WeakPolarHBondContact O-CA 3.43Å; P592-Y594 HydrophobicContact CB-CE1 4.26Å; P592-Y594 HydrophobicContact CG-CE1 3.89Å; P592-Y594 PolarHBondContact O-N 2.83Å
595	T	84.4	Confident	72.4	Confident	60 Å²	60	62.3 Å²	62.3	37%	0.368	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	123.3	157.8	52.6	0	0	0	0	109.2	A574 N575 N577 K597	A574-T595 WeakPolarHBondContact CA-O 3.47Å; N575-T595 PolarHBondContact N-O 3.48Å; N575-T595 PolarHBondContact ND2-O 3.36Å; N575-T595 PolarHBondContact O-N 2.96Å; N577-T595 PolarHBondContact ND2-OG1 3.12Å; T595-K597 PolarHBondContact O-N 3.47Å
596	M	87.4	Confident	74.6	Confident	54 Å²	54	63 Å²	63	27%	0.266	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	129.7	-175.9	-172.2	167.3	74.1	0	0	111.4	V523 L528 I572	V523-M596 HydrophobicContact CG1-CE 4.13Å; V523-M596 HydrophobicContact CG2-CB 4.41Å; V523-M596 HydrophobicContact CG2-SD 4.12Å; L528-M596 HydrophobicContact CD1-CE 4.13Å; I572-M596 HydrophobicContact CG2-CG 3.82Å; I572-M596 HydrophobicContact CG2-SD 3.86Å
597	K	88.1	Confident	76.6	Confident	89 Å²	89	59.5 Å²	59.5	39%	0.387	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-47.3	173.7	-172.1	-165.8	170.6	-174.3	0	110.5	E547 C573 T595	E547-K597 IonicContact OE1-NZ 3.33Å; E547-K597 PolarHBondContact OE1-NZ 2.84Å; E547-K597 IonicContact OE2-NZ 2.68Å; E547-K597 PolarHBondContact OE2-NZ 3.03Å; C573-K597 WeakPolarHBondContact O-CA 3.47Å; C573-K597 WeakPolarHBondContact O-CB 3.25Å; C573-K597 PolarHBondContact O-N 3Å; T595-K597 PolarHBondContact O-N 3.47Å
598	W	89.6	Confident	78.4	Confident	27 Å²	27	56.4 Å²	56.4	10%	0.102	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	161.3	175.1	54.1	-106.5	0	0	0	110.4	L571 C573 V712 F725 V727 F729	L571-W598 HydrophobicContact CB-CZ3 4.39Å; L571-W598 HydrophobicContact CD2-CH2 3.71Å; L571-W598 HydrophobicContact CD2-CZ3 3.87Å; L571-W598 HydrophobicContact CG-CH2 4.1Å; L571-W598 HydrophobicContact CG-CZ3 3.93Å; C573-W598 HydrophobicContact CB-CD2 3.62Å; C573-W598 HydrophobicContact CB-CE3 3.99Å; C573-W598 HydrophobicContact CB-CG 4.22Å; C573-W598 HydrophobicContact CB-CH2 3.82Å; C573-W598 HydrophobicContact CB-CZ2 3.43Å; C573-W598 VanDerWaalsContact CB-CZ2 3.43Å; C573-W598 HydrophobicContact CB-CZ3 4.08Å; C573-W598 PolarHBondContact N-O 3.33Å; C573-W598 PolarHBondContact O-N 2.94Å; W598-V712 HydrophobicContact CD2-CG1 4.44Å; W598-V712 HydrophobicContact CE3-CG1 4.03Å; W598-V712 HydrophobicContact CH2-CG1 4.4Å; W598-V712 HydrophobicContact CH2-CG2 4.03Å; W598-V712 HydrophobicContact CZ2-CG2 4.31Å; W598-V712 HydrophobicContact CZ3-CG1 4.02Å; W598-V712 HydrophobicContact CZ3-CG2 4.4Å; W598-F725 HydrophobicContact CD2-CZ 4.46Å; W598-F725 HydrophobicContact CG-CZ 4.23Å; W598-V727 HydrophobicContact CZ2-CB 4.43Å; W598-V727 HydrophobicContact CZ2-CG1 4.33Å; W598-V727 HydrophobicContact CZ2-CG2 3.93Å; W598-F729 HydrophobicContact CZ2-CE2 4.33Å; W598-F729 HydrophobicContact CZ2-CZ 4.13Å
599	S	90.3	Very high	79.8	Confident	46 Å²	46	56.8 Å²	56.8	32%	0.322	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	142.3	174.1	52.1	0	0	0	0	109.1	L571	L571-S599 CarbonylContact O-C 3.58Å; L571-S599 VanDerWaalsContact O-CA 3.31Å; L571-S599 WeakPolarHBondContact O-CA 3.27Å
600	A	91.2	Very high	80.6	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.008	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	136.4	-178.5	0	0	0	0	0	112.3	V570 L571 V605 V712 P713	V570-A600 WeakPolarHBondContact CA-O 3.15Å; L571-A600 PolarHBondContact N-O 2.88Å; L571-A600 PolarHBondContact O-N 3.3Å; A600-V605 HydrophobicContact CB-CG2 3.76Å; A600-V712 HydrophobicContact CB-CG1 3.65Å; A600-P713 HydrophobicContact CB-CG 3.81Å
601	P	90.1	Very high	80.7	Confident	64 Å²	64	52.6 Å²	52.6	42%	0.416	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	134.9	171.3	-21.1	32.9	0	0	0	111.4	Q603 H604	P601-Q603 VanDerWaalsContact C-N 3.29Å; P601-Q603 PolarHBondContact O-N 2.67Å; P601-H604 PolarHBondContact O-N 2.95Å
602	L	89.4	Confident	80.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-65.6	-28.9	-170.9	-75.7	171.1	0	0	0	114.3	L566 F567 D568 D569 L571 H604 V605 L744 A747 K748 L751	L566-L602 HydrophobicContact CD1-CD1 3.73Å; L566-L602 HydrophobicContact CD1-CD2 3.49Å; L566-L602 VanDerWaalsContact CD1-CD2 3.49Å; L566-L602 HydrophobicContact CD1-CG 4.26Å; F567-L602 VanDerWaalsContact O-CD1 3.27Å; F567-L602 WeakPolarHBondContact O-CD1 3.31Å; D568-L602 WeakPolarHBondContact O-CD1 3.1Å; D569-L602 PolarHBondContact O-N 3.32Å; L571-L602 HydrophobicContact CB-CD2 3.8Å; L602-H604 PolarHBondContact O-N 2.92Å; L602-V605 PolarHBondContact O-N 3.25Å; L602-L744 HydrophobicContact CD2-CG 4.47Å; L602-A747 HydrophobicContact CD1-CB 3.89Å; L602-K748 WeakPolarHBondContact O-CE 3.46Å; L602-L751 HydrophobicContact CB-CD1 4.03Å
603	Q	86.7	Confident	79.1	Confident	134 Å²	134	59.7 Å²	59.7	63%	0.626	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-57	-30.3	173.1	-64.8	179.5	-6.2	0	0	112.1	P601 L751	P601-Q603 VanDerWaalsContact C-N 3.29Å; P601-Q603 PolarHBondContact O-N 2.67Å; Q603-L751 HydrophobicContact CG-CD1 4.21Å
604	H	88.9	Confident	77.3	Confident	121 Å²	121	57.9 Å²	57.9	56%	0.56	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-96.2	-5.2	-178.7	-57.7	144.5	0	0	0	114.8	P601 L602 P713	P601-H604 PolarHBondContact O-N 2.95Å; L602-H604 PolarHBondContact O-N 2.92Å; H604-P713 HydrophobicContact CB-CB 4.38Å; H604-P713 HydrophobicContact CB-CG 3.84Å
605	V	90.2	Very high	74.9	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.347	C	S	.	.			trans	-91	121.9	178.3	178.6	0	0	0	0	109.8	L571 A600 L602 L710 Q711 L744 K748	L571-V605 HydrophobicContact CB-CG2 4.4Å; L571-V605 HydrophobicContact CD2-CG1 4.03Å; L571-V605 HydrophobicContact CD2-CG2 4.32Å; A600-V605 HydrophobicContact CB-CG2 3.76Å; L602-V605 PolarHBondContact O-N 3.25Å; V605-L710 HydrophobicContact CG1-CB 4.29Å; V605-L710 HydrophobicContact CG1-CD1 4.4Å; V605-L710 HydrophobicContact CG1-CD2 4.28Å; V605-Q711 WeakPolarHBondContact CA-O 3.24Å; V605-L744 HydrophobicContact CG1-CD1 4.16Å; V605-K748 WeakPolarHBondContact O-CE 3.41Å; V605-K748 PolarHBondContact O-NZ 2.97Å
606	Q	88.1	Confident	72.6	Confident	89 Å²	89	68.9 Å²	68.9	42%	0.416	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	137	177.7	-178.4	167.8	-3.2	0	0	111.4	L710 Q711	Q606-L710 CarbonylContact O-C 3.56Å; Q606-L710 WeakPolarHBondContact O-CA 3.47Å; Q606-Q711 HydrophobicContact CB-CB 4.32Å; Q606-Q711 PolarHBondContact N-O 3.5Å; Q606-Q711 PolarHBondContact O-N 3.47Å
607	V	86.8	Confident	69.9	Low	15 Å²	15	71.5 Å²	71.5	9%	0.091	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	132.2	169.5	173.9	0	0	0	0	107.6	R709 L710 V741 L744 A810	V607-R709 WeakPolarHBondContact CA-O 3.38Å; V607-L710 HydrophobicContact CB-CD2 4.43Å; V607-L710 HydrophobicContact CG2-CD2 3.65Å; V607-V741 HydrophobicContact CG1-CG1 4.2Å; V607-V741 HydrophobicContact CG1-CG2 4.26Å; V607-V741 HydrophobicContact CG2-CG1 4.33Å; V607-L744 HydrophobicContact CG2-CD1 4.27Å; V607-L744 HydrophobicContact CG2-CD2 4.01Å; V607-A810 HydrophobicContact CB-CB 3.96Å; V607-A810 HydrophobicContact CG1-CB 4.03Å
608	V	82.6	Confident	67.2	Low	20 Å²	20	76.4 Å²	76.4	12%	0.121	42%	0.417	C	S	.	.			trans	-115.9	135.4	-174.6	-173.1	0	0	0	0	111.1	R709 Q711 M726	V608-R709 HydrophobicContact CB-CB 4.27Å; V608-R709 PolarHBondContact N-O 3.45Å; V608-R709 WeakPolarHBondContact O-CB 3.41Å; V608-Q711 HydrophobicContact CG2-CB 3.67Å; V608-M726 HydrophobicContact CB-CE 4.08Å; V608-M726 HydrophobicContact CG1-CE 3.8Å; V608-M726 HydrophobicContact CG2-CE 4.18Å
609	E	71.8	Confident	64.4	Low	37 Å²	37	82.8 Å²	82.8	17%	0.173	45%	0.453	C	S	.	.			trans	-107.9	163.9	-180	-76.1	161.1	-124.5	0	0	112	Q612 S809 A810	E609-Q612 HydrophobicContact CB-CG 4.38Å; E609-S809 VanDerWaalsContact CD-CB 3.48Å; E609-S809 PolarHBondContact OE1-OG 2.82Å; E609-S809 WeakPolarHBondContact OE2-CB 3.2Å; E609-S809 PolarHBondContact OE2-OG 3.08Å; E609-A810 WeakPolarHBondContact OE1-CB 3.16Å; E609-A810 PolarHBondContact OE1-N 2.86Å
610	V	60	Low	61.4	Low	46 Å²	46	87.2 Å²	87.2	28%	0.279	48%	0.478	S	S	.	.	S	Bend	trans	-93.6	126.3	176.2	-164	0	0	0	0	107.8	L641 Y647 R709	V610-L641 HydrophobicContact CG1-CB 4.08Å; V610-L641 HydrophobicContact CG2-CB 4.33Å; V610-Y647 HydrophobicContact CG1-CE1 4.38Å; V610-Y647 VanDerWaalsContact CG1-OH 3.22Å; V610-Y647 WeakPolarHBondContact CG1-OH 3.18Å; V610-R709 VanDerWaalsContact CG2-NH2 3.27Å
611	G	51.7	Low	58.5	Low	76 Å²	76	95 Å²	95	78%	0.784	52%	0.519	S	S	*	.	S	Bend	trans	101.3	-13.3	-174.7	0	0	0	0	0	114.8	E613	G611-E613 PolarHBondContact O-N 3.45Å; G611-E613 VanDerWaalsContact O-N 3.13Å
612	Q	49.3	Very low	55.7	Low	85 Å²	85	102.1 Å²	102.1	40%	0.397	54%	0.544	S	S	.	.			trans	-77.9	90.6	165	-76.8	-176.4	-4.4	0	0	110	E609	E609-Q612 HydrophobicContact CB-CG 4.38Å
613	E	36.7	Very low	52.8	Low	139 Å²	139	110.7 Å²	110.7	65%	0.65	58%	0.584	S	S	*	*			trans	-76.3	122.1	158.2	-68.3	-165.3	-176.7	0	0	108.6	G611 S615 K638	G611-E613 PolarHBondContact O-N 3.45Å; G611-E613 VanDerWaalsContact O-N 3.13Å; E613-S615 PolarHBondContact O-N 2.93Å; E613-K638 IonicContact OE1-NZ 3.87Å; E613-K638 PolarHBondContact OE1-NZ 2.93Å; E613-K638 IonicContact OE2-NZ 2.71Å
614	N	35.8	Very low	50	Low	105 Å²	105	113.9 Å²	113.9	56%	0.561	60%	0.599	S	S	*	*			trans	-69.2	97.6	-177	-81.4	-7.9	0	0	0	111.1	Q616	N614-Q616 PolarHBondContact O-N 3.4Å
615	S	34.1	Very low	47	Very low	110 Å²	110	114.1 Å²	114.1	77%	0.769	61%	0.614	S	S	*	*			trans	-71.6	-0.5	173.1	55.4	0	0	0	0	114.4	E613 S617	E613-S615 PolarHBondContact O-N 2.93Å; S615-S617 VanDerWaalsContact C-N 3.27Å; S615-S617 PolarHBondContact O-N 3.4Å
616	Q	35.7	Very low	44	Very low	188 Å²	188	117.7 Å²	117.7	88%	0.879	65%	0.651	S	S	*	*			trans	-82.6	61.7	177.8	-67.7	-169.5	-17.8	0	0	112.8	N614	N614-Q616 PolarHBondContact O-N 3.4Å
617	S	30.2	Very low	41.7	Very low	110 Å²	110	120 Å²	120	77%	0.769	67%	0.671	S	S	*	*			trans	-149.5	48	167.9	58.3	0	0	0	0	111.4	S615	S615-S617 VanDerWaalsContact C-N 3.27Å; S615-S617 PolarHBondContact O-N 3.4Å
618	K	32.6	Very low	39	Very low	192 Å²	192	129.3 Å²	129.3	84%	0.835	71%	0.71	S	S	*	*			trans	-124.9	42.1	-175.8	-151.5	-176.5	-178.9	-179	0	114.4
619	D	30.4	Very low	36.4	Very low	161 Å²	161	139.3 Å²	139.3	86%	0.861	75%	0.746	S	S	*	*			trans	-130.5	77.3	166.4	-90.7	-51.8	0	0	0	111
620	T	26.9	Very low	34.4	Very low	139 Å²	139	143.9 Å²	143.9	85%	0.853	78%	0.779	S	S	*	*			trans	-154.3	100.4	154.6	-24.8	0	0	0	0	109	F622	T620-F622 PolarHBondContact O-N 2.8Å
621	L	30.4	Very low	32.7	Very low	164 Å²	164	147.5 Å²	147.5	86%	0.859	81%	0.806	S	S	*	*			trans	-69.7	121.1	171.4	-80.2	143.8	0	0	0	109.7
622	F	30.6	Very low	31.6	Very low	214 Å²	214	147.4 Å²	147.4	94%	0.939	81%	0.805	S	S	*	*			trans	-148.4	137.7	143.3	-105.1	-70.8	0	0	0	111.2	T620	T620-F622 PolarHBondContact O-N 2.8Å
623	Q	28.6	Very low	31	Very low	179 Å²	179	148.3 Å²	148.3	84%	0.836	83%	0.827	S	S	*	*			trans	-110.9	124.1	-170.1	176.5	-170.4	23.1	0	0	110
624	Q	28.6	Very low	30.4	Very low	201 Å²	201	147 Å²	147	94%	0.939	83%	0.832	S	S	*	*			trans	-160.6	165	153.1	-119.2	160.3	79.5	0	0	113.3
625	S	26.6	Very low	30.3	Very low	127 Å²	127	150.2 Å²	150.2	89%	0.888	85%	0.849	S	S	*	*			trans	-100.3	152.7	-164	-174.6	0	0	0	0	113.2
626	G	27	Very low	30.2	Very low	74 Å²	74	149.8 Å²	149.8	76%	0.763	85%	0.846	S	S	*	*			trans	172.5	101.1	170.8	0	0	0	0	0	114.4
627	T	38.9	Very low	30	Very low	137 Å²	137	144.7 Å²	144.7	84%	0.84	84%	0.844	S	S	*	*			trans	-77.8	128.8	173.5	37.5	0	0	0	0	112.4
628	K	30.7	Very low	30.4	Very low	211 Å²	211	146.9 Å²	146.9	92%	0.917	84%	0.84	S	S	*	*			trans	-165	163.4	153.3	-105.8	142.4	-168.2	175.2	0	112.3
629	R	27.6	Very low	30.9	Very low	231 Å²	231	141.6 Å²	141.6	87%	0.872	83%	0.832	S	S	*	*			trans	-72.1	148.6	-169	-56.6	171.9	-177.5	158.5	-2.1	112.6
630	P	29.4	Very low	31.8	Very low	133 Å²	133	137.7 Å²	137.7	86%	0.864	81%	0.811	S	S	*	*			trans	-71.5	134.6	158.9	31.9	-32.5	0	0	0	110.1
631	S	24.4	Very low	33.1	Very low	121 Å²	121	133.8 Å²	133.8	85%	0.846	78%	0.784	S	S	*	*			trans	-161.5	132.6	168.6	-175.4	0	0	0	0	109.1
632	G	28.8	Very low	34.4	Very low	74 Å²	74	126.1 Å²	126.1	76%	0.763	75%	0.745	S	S	*	*	S	Bend	trans	83.9	126.6	175.7	0	0	0	0	0	114.8
633	A	37	Very low	36	Very low	105 Å²	105	116.8 Å²	116.8	87%	0.868	71%	0.706	S	S	*	*			trans	-49	145.2	-178.1	0	0	0	0	0	116.3
634	C	23.5	Very low	37.8	Very low	111 Å²	111	109.9 Å²	109.9	75%	0.75	68%	0.676	S	S	*	*			trans	-137.3	120.1	151.1	67.8	0	0	0	0	111	S636	C634-S636 PolarHBondContact O-N 3.24Å
635	N	34.6	Very low	40	Very low	172 Å²	172	109.2 Å²	109.2	92%	0.92	67%	0.665	S	S	*	*			trans	-85.3	83	171.6	-83.5	-10.6	0	0	0	109.2
636	S	31.1	Very low	42.3	Very low	102 Å²	102	104.7 Å²	104.7	71%	0.713	63%	0.631	S	S	*	*			trans	-75.8	125.1	163.2	55.6	0	0	0	0	108.9	C634 K638	C634-S636 PolarHBondContact O-N 3.24Å; S636-K638 PolarHBondContact O-N 2.66Å
637	G	32.6	Very low	44.7	Very low	81 Å²	81	103.4 Å²	103.4	84%	0.835	60%	0.603	S	S	*	*			trans	-67.3	98	-163.8	0	0	0	0	0	114.6	A639	G637-A639 PolarHBondContact O-N 3.39Å; G637-A639 VanDerWaalsContact O-N 3.1Å
638	K	39	Very low	46.7	Very low	155 Å²	155	101.9 Å²	101.9	67%	0.674	59%	0.587	S	S	*	*			trans	-64.2	106	155.8	-70	-156.7	175.5	-148.8	0	108.2	E613 S636 L640	E613-K638 IonicContact OE1-NZ 3.87Å; E613-K638 PolarHBondContact OE1-NZ 2.93Å; E613-K638 IonicContact OE2-NZ 2.71Å; S636-K638 PolarHBondContact O-N 2.66Å; K638-L640 PolarHBondContact O-N 3.22Å
639	A	42.8	Very low	49.2	Very low	81 Å²	81	94.5 Å²	94.5	67%	0.669	56%	0.555	S	S	*	*			trans	-63.6	107.1	172.9	0	0	0	0	0	108.6	G637 L641	G637-A639 PolarHBondContact O-N 3.39Å; G637-A639 VanDerWaalsContact O-N 3.1Å; A639-L641 WeakPolarHBondContact O-CG 3.37Å; A639-L641 PolarHBondContact O-N 3.01Å
640	L	48	Very low	52	Low	80 Å²	80	84 Å²	84	42%	0.419	52%	0.517	S	S	.	.			trans	-74.6	88.3	-172.9	-164.7	62.3	0	0	0	109.8	K638 G642 Y647	K638-L640 PolarHBondContact O-N 3.22Å; L640-G642 PolarHBondContact O-N 3.45Å; L640-Y647 HydrophobicContact CD1-CD1 4Å; L640-Y647 HydrophobicContact CD1-CG 4.16Å; L640-Y647 HydrophobicContact CG-CG 4.26Å
641	L	54.5	Low	54.6	Low	57 Å²	57	83.7 Å²	83.7	30%	0.298	50%	0.504	S	S	.	.			trans	-66.7	11.8	-165.8	-76.3	172.3	0	0	0	116.1	V610 A639 R709 M726	V610-L641 HydrophobicContact CG1-CB 4.08Å; V610-L641 HydrophobicContact CG2-CB 4.33Å; A639-L641 WeakPolarHBondContact O-CG 3.37Å; A639-L641 PolarHBondContact O-N 3.01Å; L641-R709 PolarHBondContact O-NE 3.1Å; L641-R709 PolarHBondContact O-NH2 2.81Å; L641-M726 HydrophobicContact CD2-CE 3.52Å; L641-M726 HydrophobicContact CD2-SD 3.58Å; L641-M726 VanDerWaalsContact CD2-SD 3.58Å
642	G	58.3	Low	57.8	Low	3 Å²	3	82.3 Å²	82.3	3%	0.031	48%	0.484	C	S	.	.	S	Bend	trans	-109.6	-168.1	-175.3	0	0	0	0	0	115.5	L640	L640-G642 PolarHBondContact O-N 3.45Å
643	P	64.6	Low	60.8	Low	18 Å²	18	79.9 Å²	79.9	12%	0.117	45%	0.453	C	S	.	.			trans	-64.9	115.3	158	-10.5	27.2	0	0	0	107.9	R645 L646 Y647 A703	P643-R645 VanDerWaalsContact C-N 3.31Å; P643-R645 PolarHBondContact O-N 3Å; P643-L646 HydrophobicContact CB-CB 4.35Å; P643-L646 HydrophobicContact CB-CD1 4.24Å; P643-L646 HydrophobicContact CB-CG 4.3Å; P643-L646 HydrophobicContact CG-CD1 4.19Å; P643-L646 PolarHBondContact O-N 2.69Å; P643-Y647 PolarHBondContact O-N 3.5Å; P643-A703 HydrophobicContact CG-CB 3.81Å
644	P	66.6	Low	63.3	Low	33 Å²	33	79.2 Å²	79.2	21%	0.214	43%	0.432	C	S	.	.	H	α-helix	trans	-60.8	-39.8	-165.5	26.2	-38.9	0	0	0	112.6	G554 Y647 Q648	G554-P644 VanDerWaalsContact O-CG 3.25Å; G554-P644 WeakPolarHBondContact O-CG 3.29Å; P644-Y647 PolarHBondContact O-N 2.69Å; P644-Q648 WeakPolarHBondContact O-CB 3.42Å; P644-Q648 PolarHBondContact O-N 2.9Å
645	R	73.6	Confident	66.6	Low	188 Å²	188	79.8 Å²	79.8	71%	0.709	42%	0.423	S	S	*	.	H	α-helix	trans	-63.7	-48.7	178.5	-70.2	-173.2	177.1	-178.6	-3.4	112.7	P643 Y647 Q648 E649	P643-R645 VanDerWaalsContact C-N 3.31Å; P643-R645 PolarHBondContact O-N 3Å; R645-Y647 VanDerWaalsContact C-N 3.28Å; R645-Y647 PolarHBondContact O-N 2.92Å; R645-Q648 WeakPolarHBondContact O-CB 3.49Å; R645-Q648 PolarHBondContact O-N 2.96Å; R645-Q648 VanDerWaalsContact O-N 3.13Å; R645-E649 WeakPolarHBondContact O-CB 3.36Å; R645-E649 WeakPolarHBondContact O-CG 3.28Å; R645-E649 PolarHBondContact O-N 2.83Å
646	L	75.4	Confident	69.5	Low	32 Å²	32	75.2 Å²	75.2	17%	0.168	40%	0.399	C	S	.	.	H	α-helix	trans	-64.3	-34.2	-179.6	-63.2	-178.3	0	0	0	112.4	P643 L650 Q699 I700 A703	P643-L646 HydrophobicContact CB-CB 4.35Å; P643-L646 HydrophobicContact CB-CD1 4.24Å; P643-L646 HydrophobicContact CB-CG 4.3Å; P643-L646 HydrophobicContact CG-CD1 4.19Å; P643-L646 PolarHBondContact O-N 2.69Å; L646-L650 VanDerWaalsContact O-CB 3.28Å; L646-L650 WeakPolarHBondContact O-CB 3.46Å; L646-L650 PolarHBondContact O-N 2.82Å; L646-Q699 HydrophobicContact CD1-CB 4.29Å; L646-I700 HydrophobicContact CB-CD1 4.14Å; L646-I700 HydrophobicContact CB-CG1 3.64Å; L646-I700 HydrophobicContact CD1-CG1 4.23Å; L646-A703 HydrophobicContact CD1-CB 4.43Å
647	Y	77.1	Confident	72.4	Confident	47 Å²	47	71.4 Å²	71.4	18%	0.184	37%	0.371	C	S	.	.	H	α-helix	trans	-75.4	-32.1	174	-85.4	-95.2	0	0	0	113.1	V610 L640 P643 P644 R645 Q651 I700	V610-Y647 HydrophobicContact CG1-CE1 4.38Å; V610-Y647 VanDerWaalsContact CG1-OH 3.22Å; V610-Y647 WeakPolarHBondContact CG1-OH 3.18Å; L640-Y647 HydrophobicContact CD1-CD1 4Å; L640-Y647 HydrophobicContact CD1-CG 4.16Å; L640-Y647 HydrophobicContact CG-CG 4.26Å; P643-Y647 PolarHBondContact O-N 3.5Å; P644-Y647 PolarHBondContact O-N 2.69Å; R645-Y647 VanDerWaalsContact C-N 3.28Å; R645-Y647 PolarHBondContact O-N 2.92Å; Y647-Q651 WeakPolarHBondContact O-CB 3.42Å; Y647-Q651 PolarHBondContact O-N 3.46Å; Y647-I700 HydrophobicContact CD1-CD1 4.35Å; Y647-I700 HydrophobicContact CD2-CD1 3.76Å; Y647-I700 HydrophobicContact CD2-CG1 4.02Å; Y647-I700 HydrophobicContact CD2-CG2 4.45Å; Y647-I700 HydrophobicContact CE1-CD1 4.35Å; Y647-I700 HydrophobicContact CE2-CB 4.26Å; Y647-I700 HydrophobicContact CE2-CD1 3.77Å; Y647-I700 HydrophobicContact CE2-CG1 3.83Å; Y647-I700 HydrophobicContact CE2-CG2 3.45Å; Y647-I700 VanDerWaalsContact CE2-CG2 3.45Å; Y647-I700 HydrophobicContact CG-CD1 4.08Å; Y647-I700 WeakPolarHBondContact OH-CG2 3.29Å
648	Q	81.4	Confident	75.3	Confident	104 Å²	104	70.2 Å²	70.2	49%	0.486	35%	0.35	S	S	.	.	H	α-helix	trans	-64.3	-50.1	169.9	178.2	-177.7	-15.4	0	0	110.3	P644 R645 L650 Q651 E652	P644-Q648 WeakPolarHBondContact O-CB 3.42Å; P644-Q648 PolarHBondContact O-N 2.9Å; R645-Q648 WeakPolarHBondContact O-CB 3.49Å; R645-Q648 PolarHBondContact O-N 2.96Å; R645-Q648 VanDerWaalsContact O-N 3.13Å; Q648-L650 VanDerWaalsContact C-N 3.26Å; Q648-L650 PolarHBondContact O-N 2.87Å; Q648-Q651 CarbonylContact O-C 3.54Å; Q648-Q651 PolarHBondContact O-N 2.97Å; Q648-E652 HydrophobicContact CG-CG 4.41Å; Q648-E652 VanDerWaalsContact CG-OE1 3.27Å; Q648-E652 WeakPolarHBondContact CG-OE1 3.4Å; Q648-E652 PolarHBondContact NE2-OE1 3.47Å; Q648-E652 WeakPolarHBondContact O-CB 3.39Å; Q648-E652 WeakPolarHBondContact O-CG 3.48Å; Q648-E652 PolarHBondContact O-N 3.24Å
649	E	83.1	Confident	77.9	Confident	56 Å²	56	65.8 Å²	65.8	26%	0.262	34%	0.335	S	S	.	.	H	α-helix	trans	-59.4	-35.2	176.3	-68	159.8	-143.7	0	0	111.9	R645 L653 K696	R645-E649 WeakPolarHBondContact O-CB 3.36Å; R645-E649 WeakPolarHBondContact O-CG 3.28Å; R645-E649 PolarHBondContact O-N 2.83Å; E649-L653 VanDerWaalsContact O-CG 3.31Å; E649-L653 WeakPolarHBondContact O-CG 3.42Å; E649-L653 PolarHBondContact O-N 3.35Å; E649-L653 VanDerWaalsContact O-N 3.09Å; E649-K696 HydrophobicContact CB-CD 4.45Å; E649-K696 WeakPolarHBondContact OE2-CE 3.46Å; E649-K696 IonicContact OE2-NZ 3.95Å; E649-K696 PolarHBondContact OE2-NZ 2.84Å
650	L	85.3	Confident	80.3	Confident	12 Å²	12	63 Å²	63	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-68.1	-44.2	172.2	178.2	65	0	0	0	111.9	L646 Q648 E652 L653 Q654 I693 K696 E697 I700	L646-L650 VanDerWaalsContact O-CB 3.28Å; L646-L650 WeakPolarHBondContact O-CB 3.46Å; L646-L650 PolarHBondContact O-N 2.82Å; Q648-L650 VanDerWaalsContact C-N 3.26Å; Q648-L650 PolarHBondContact O-N 2.87Å; L650-E652 VanDerWaalsContact C-N 3.34Å; L650-L653 PolarHBondContact O-N 3.4Å; L650-Q654 HydrophobicContact CD1-CG 4.45Å; L650-Q654 WeakPolarHBondContact O-CB 3.49Å; L650-Q654 VanDerWaalsContact O-CG 3.28Å; L650-Q654 WeakPolarHBondContact O-CG 3.39Å; L650-Q654 PolarHBondContact O-N 3.09Å; L650-I693 HydrophobicContact CD1-CB 4.33Å; L650-I693 HydrophobicContact CD1-CG1 4.47Å; L650-I693 HydrophobicContact CD1-CG2 3.83Å; L650-K696 HydrophobicContact CB-CB 4.4Å; L650-K696 HydrophobicContact CD1-CB 4.12Å; L650-E697 HydrophobicContact CD1-CG 3.88Å; L650-E697 HydrophobicContact CD2-CG 4.08Å; L650-I700 HydrophobicContact CB-CD1 4.22Å; L650-I700 HydrophobicContact CD2-CD1 3.74Å
651	Q	85.4	Confident	82.3	Confident	125 Å²	125	63.6 Å²	63.6	58%	0.584	31%	0.311	S	S	*	.	H	α-helix	trans	-67.7	-34.9	178.4	-175.3	177.2	-3.1	0	0	112	Y647 Q648 H655	Y647-Q651 WeakPolarHBondContact O-CB 3.42Å; Y647-Q651 PolarHBondContact O-N 3.46Å; Q648-Q651 CarbonylContact O-C 3.54Å; Q648-Q651 PolarHBondContact O-N 2.97Å; Q651-H655 WeakPolarHBondContact O-CB 3.41Å; Q651-H655 PolarHBondContact O-N 2.93Å
652	E	90.3	Very high	84	Confident	92 Å²	92	67.5 Å²	67.5	43%	0.43	33%	0.327	S	S	.	.	H	α-helix	trans	-62.6	-51.9	172.1	-73.6	164.2	175.5	0	0	109.8	Q648 L650 Q654 H655 D656	Q648-E652 HydrophobicContact CG-CG 4.41Å; Q648-E652 VanDerWaalsContact CG-OE1 3.27Å; Q648-E652 WeakPolarHBondContact CG-OE1 3.4Å; Q648-E652 PolarHBondContact NE2-OE1 3.47Å; Q648-E652 WeakPolarHBondContact O-CB 3.39Å; Q648-E652 WeakPolarHBondContact O-CG 3.48Å; Q648-E652 PolarHBondContact O-N 3.24Å; L650-E652 VanDerWaalsContact C-N 3.34Å; E652-Q654 VanDerWaalsContact C-N 3.34Å; E652-Q654 PolarHBondContact O-N 3.34Å; E652-H655 WeakPolarHBondContact O-CB 3.34Å; E652-H655 PolarHBondContact O-N 2.87Å; E652-H655 VanDerWaalsContact O-N 3.09Å; E652-D656 VanDerWaalsContact O-CG 3.29Å; E652-D656 PolarHBondContact O-N 3.46Å
653	L	92.1	Very high	85.5	Confident	24 Å²	24	69.9 Å²	69.9	13%	0.126	34%	0.341	C	S	.	.	H	α-helix	trans	-61.8	-35.2	175.5	-71.5	168.6	0	0	0	114.2	E649 L650 H655 D656 L657 L689 L692 I693 K696	E649-L653 VanDerWaalsContact O-CG 3.31Å; E649-L653 WeakPolarHBondContact O-CG 3.42Å; E649-L653 PolarHBondContact O-N 3.35Å; E649-L653 VanDerWaalsContact O-N 3.09Å; L650-L653 PolarHBondContact O-N 3.4Å; L653-H655 VanDerWaalsContact C-N 3.34Å; L653-D656 PolarHBondContact O-N 3.37Å; L653-L657 WeakPolarHBondContact O-CB 3.44Å; L653-L657 PolarHBondContact O-N 3.02Å; L653-L689 HydrophobicContact CD2-CD2 3.77Å; L653-L692 HydrophobicContact CD1-CB 3.93Å; L653-L692 HydrophobicContact CD2-CB 4.07Å; L653-L692 HydrophobicContact CD2-CD1 4.19Å; L653-I693 HydrophobicContact CB-CD1 4.47Å; L653-I693 HydrophobicContact CB-CG1 3.73Å; L653-K696 HydrophobicContact CD1-CG 3.62Å
654	Q	90.8	Very high	86.6	Confident	90 Å²	90	70.2 Å²	70.2	42%	0.421	34%	0.343	S	S	.	.	H	α-helix	trans	-68.2	-34.5	174.8	-76.7	173.4	-15	0	0	111.9	L650 E652 S658 I693	L650-Q654 HydrophobicContact CD1-CG 4.45Å; L650-Q654 WeakPolarHBondContact O-CB 3.49Å; L650-Q654 VanDerWaalsContact O-CG 3.28Å; L650-Q654 WeakPolarHBondContact O-CG 3.39Å; L650-Q654 PolarHBondContact O-N 3.09Å; E652-Q654 VanDerWaalsContact C-N 3.34Å; E652-Q654 PolarHBondContact O-N 3.34Å; Q654-S658 PolarHBondContact O-N 3.33Å; Q654-I693 HydrophobicContact CG-CD1 4.01Å; Q654-I693 HydrophobicContact CG-CG1 4.31Å
655	H	92.2	Very high	87.7	Confident	123 Å²	123	75.1 Å²	75.1	57%	0.569	37%	0.367	S	S	*	.	H	α-helix	trans	-70.4	-45.2	172.1	-177.7	35.9	0	0	0	111.4	Q651 E652 L653 L657 S658 V659	Q651-H655 WeakPolarHBondContact O-CB 3.41Å; Q651-H655 PolarHBondContact O-N 2.93Å; E652-H655 WeakPolarHBondContact O-CB 3.34Å; E652-H655 PolarHBondContact O-N 2.87Å; E652-H655 VanDerWaalsContact O-N 3.09Å; L653-H655 VanDerWaalsContact C-N 3.34Å; H655-L657 VanDerWaalsContact C-N 3.31Å; H655-L657 PolarHBondContact O-N 3.02Å; H655-S658 PolarHBondContact O-N 3.24Å; H655-V659 WeakPolarHBondContact O-CG2 3.43Å; H655-V659 PolarHBondContact O-N 2.75Å
656	D	94.2	Very high	88.4	Confident	77 Å²	77	71.7 Å²	71.7	41%	0.412	36%	0.362	S	S	.	.	H	α-helix	trans	-57.4	-43.5	176.1	-67	-22.9	0	0	0	111.1	E652 L653 V659 V660 L689	E652-D656 VanDerWaalsContact O-CG 3.29Å; E652-D656 PolarHBondContact O-N 3.46Å; L653-D656 PolarHBondContact O-N 3.37Å; D656-V659 PolarHBondContact O-N 3.22Å; D656-V660 WeakPolarHBondContact O-CG2 3.21Å; D656-V660 PolarHBondContact O-N 2.85Å; D656-L689 HydrophobicContact CB-CD1 4.27Å; D656-L689 HydrophobicContact CB-CD2 4.11Å
657	L	93.1	Very high	89	Confident	21 Å²	21	70.9 Å²	70.9	11%	0.11	36%	0.358	C	S	.	.	H	α-helix	trans	-59.3	-49.9	175.1	177.3	61.9	0	0	0	111.5	L653 H655 V659 V660 E661 C686 L689 Q690 I693	L653-L657 WeakPolarHBondContact O-CB 3.44Å; L653-L657 PolarHBondContact O-N 3.02Å; H655-L657 VanDerWaalsContact C-N 3.31Å; H655-L657 PolarHBondContact O-N 3.02Å; L657-V659 VanDerWaalsContact C-N 3.25Å; L657-V659 PolarHBondContact O-N 3.12Å; L657-V660 PolarHBondContact O-N 2.92Å; L657-V660 VanDerWaalsContact O-N 3.12Å; L657-E661 HydrophobicContact CD1-CG 4.16Å; L657-E661 HydrophobicContact CG-CG 4.44Å; L657-E661 WeakPolarHBondContact O-CG 3.41Å; L657-E661 PolarHBondContact O-N 3.11Å; L657-C686 HydrophobicContact CD1-CB 3.96Å; L657-L689 HydrophobicContact CB-CB 4.23Å; L657-L689 HydrophobicContact CB-CD1 4.47Å; L657-L689 HydrophobicContact CD1-CB 4.12Å; L657-Q690 HydrophobicContact CD1-CG 4.13Å; L657-Q690 HydrophobicContact CD2-CG 3.73Å; L657-I693 HydrophobicContact CB-CD1 4.09Å; L657-I693 HydrophobicContact CD2-CD1 3.69Å
658	S	93.6	Very high	89.4	Confident	57 Å²	57	71.1 Å²	71.1	40%	0.399	38%	0.375	S	S	.	.	H	α-helix	trans	-59.5	-35.2	178.2	178.8	0	0	0	0	112.7	Q654 H655 E662	Q654-S658 PolarHBondContact O-N 3.33Å; H655-S658 PolarHBondContact O-N 3.24Å; S658-E662 PolarHBondContact O-N 2.84Å
659	V	94.4	Very high	89.7	Confident	61 Å²	61	70.6 Å²	70.6	37%	0.37	38%	0.379	S	S	.	.	H	α-helix	trans	-73	-39.4	175.7	173	0	0	0	0	111.3	H655 D656 L657 E661 E662 V663	H655-V659 WeakPolarHBondContact O-CG2 3.43Å; H655-V659 PolarHBondContact O-N 2.75Å; D656-V659 PolarHBondContact O-N 3.22Å; L657-V659 VanDerWaalsContact C-N 3.25Å; L657-V659 PolarHBondContact O-N 3.12Å; V659-E661 VanDerWaalsContact C-N 3.33Å; V659-E662 PolarHBondContact O-N 2.9Å; V659-V663 WeakPolarHBondContact O-CG2 3.43Å; V659-V663 PolarHBondContact O-N 2.82Å
660	V	91.6	Very high	89.8	Confident	23 Å²	23	71.6 Å²	71.6	14%	0.139	39%	0.386	C	S	.	.	H	α-helix	trans	-70.2	-30	176.8	174.2	0	0	0	0	111.8	D656 L657 V663 T664 W685 L689	D656-V660 WeakPolarHBondContact O-CG2 3.21Å; D656-V660 PolarHBondContact O-N 2.85Å; L657-V660 PolarHBondContact O-N 2.92Å; L657-V660 VanDerWaalsContact O-N 3.12Å; V660-V663 PolarHBondContact O-N 3.22Å; V660-T664 WeakPolarHBondContact O-CB 3.48Å; V660-T664 PolarHBondContact O-N 3.02Å; V660-T664 PolarHBondContact O-OG1 3.35Å; V660-W685 HydrophobicContact CG1-CB 3.75Å; V660-W685 HydrophobicContact CG1-CE3 4.35Å; V660-L689 HydrophobicContact CB-CD1 4.03Å; V660-L689 HydrophobicContact CG1-CD1 4.46Å; V660-L689 HydrophobicContact CG2-CD1 3.75Å
661	E	90	Very high	89.5	Confident	92 Å²	92	80.9 Å²	80.9	43%	0.43	43%	0.429	S	S	.	.	H	α-helix	trans	-66.2	-43.5	170.5	-73.7	172.7	174	0	0	111.8	L657 V659 T664 L665	L657-E661 HydrophobicContact CD1-CG 4.16Å; L657-E661 HydrophobicContact CG-CG 4.44Å; L657-E661 WeakPolarHBondContact O-CG 3.41Å; L657-E661 PolarHBondContact O-N 3.11Å; V659-E661 VanDerWaalsContact C-N 3.33Å; E661-T664 WeakPolarHBondContact O-CB 3.48Å; E661-T664 PolarHBondContact O-N 2.95Å; E661-L665 PolarHBondContact O-N 3.4Å
662	E	91.7	Very high	89.1	Confident	139 Å²	139	76.4 Å²	76.4	65%	0.65	42%	0.417	S	S	*	.	H	α-helix	trans	-62.2	-40.9	171.5	-73.8	-174.4	178.6	0	0	112.3	S658 V659 L665 L666	S658-E662 PolarHBondContact O-N 2.84Å; V659-E662 PolarHBondContact O-N 2.9Å; E662-L665 PolarHBondContact O-N 3.33Å; E662-L666 PolarHBondContact O-N 3Å
663	V	88.9	Confident	88.3	Confident	54 Å²	54	80.6 Å²	80.6	33%	0.327	44%	0.44	S	S	.	.	H	α-helix	trans	-65.4	-39.8	174.6	169.8	0	0	0	0	111.4	V659 V660 L665 L666 V667	V659-V663 WeakPolarHBondContact O-CG2 3.43Å; V659-V663 PolarHBondContact O-N 2.82Å; V660-V663 PolarHBondContact O-N 3.22Å; V663-L665 VanDerWaalsContact C-N 3.33Å; V663-L665 PolarHBondContact O-N 3.06Å; V663-L666 PolarHBondContact O-N 3.38Å; V663-V667 HydrophobicContact CG1-CG2 4.15Å; V663-V667 WeakPolarHBondContact O-CB 3.19Å; V663-V667 VanDerWaalsContact O-CG2 3.29Å; V663-V667 WeakPolarHBondContact O-CG2 3.48Å; V663-V667 PolarHBondContact O-N 2.88Å
664	T	88.8	Confident	87.9	Confident	25 Å²	25	85.3 Å²	85.3	15%	0.153	46%	0.457	C	S	.	.	H	α-helix	trans	-58.7	-46	175.7	-61	0	0	0	0	110.8	V660 E661 V667 G668 S682 Q683	V660-T664 WeakPolarHBondContact O-CB 3.48Å; V660-T664 PolarHBondContact O-N 3.02Å; V660-T664 PolarHBondContact O-OG1 3.35Å; E661-T664 WeakPolarHBondContact O-CB 3.48Å; E661-T664 PolarHBondContact O-N 2.95Å; T664-V667 PolarHBondContact O-N 2.93Å; T664-G668 PolarHBondContact O-N 2.73Å; T664-S682 WeakPolarHBondContact OG1-CB 3.4Å; T664-Q683 HydrophobicContact CG2-CG 4.34Å
665	L	89.3	Confident	87.1	Confident	135 Å²	135	89.4 Å²	89.4	71%	0.707	48%	0.476	S	S	*	.	H	α-helix	trans	-61.9	-43.4	176.6	-174.7	67.5	0	0	0	111.6	E661 E662 V663 G668	E661-L665 PolarHBondContact O-N 3.4Å; E662-L665 PolarHBondContact O-N 3.33Å; V663-L665 VanDerWaalsContact C-N 3.33Å; V663-L665 PolarHBondContact O-N 3.06Å; L665-G668 PolarHBondContact O-N 3.37Å
666	L	88.5	Confident	86.3	Confident	117 Å²	117	90.1 Å²	90.1	61%	0.613	48%	0.484	S	S	*	.	H	α-helix	trans	-67.1	-42	178.6	-174.7	63.7	0	0	0	112.3	E662 V663 G668 T669	E662-L666 PolarHBondContact O-N 3Å; V663-L666 PolarHBondContact O-N 3.38Å; L666-G668 PolarHBondContact O-N 3.34Å; L666-T669 PolarHBondContact O-N 2.92Å; L666-T669 PolarHBondContact O-OG1 2.84Å
667	V	87	Confident	85.6	Confident	14 Å²	14	90.2 Å²	90.2	9%	0.085	48%	0.484	C	S	.	.	H	α-helix	trans	-60.2	-36.9	174.6	168.1	0	0	0	0	110.8	V663 T664 T669 L670 L677 N678 T679	V663-V667 HydrophobicContact CG1-CG2 4.15Å; V663-V667 WeakPolarHBondContact O-CB 3.19Å; V663-V667 VanDerWaalsContact O-CG2 3.29Å; V663-V667 WeakPolarHBondContact O-CG2 3.48Å; V663-V667 PolarHBondContact O-N 2.88Å; T664-V667 PolarHBondContact O-N 2.93Å; V667-T669 PolarHBondContact O-N 2.9Å; V667-T669 VanDerWaalsContact O-N 3.11Å; V667-L670 HydrophobicContact CB-CD1 4.48Å; V667-L670 HydrophobicContact CG1-CD1 4.38Å; V667-L670 HydrophobicContact CG2-CD1 4.42Å; V667-L670 WeakPolarHBondContact O-CB 3.23Å; V667-L670 WeakPolarHBondContact O-CG 3.41Å; V667-L670 PolarHBondContact O-N 2.85Å; V667-L670 VanDerWaalsContact O-N 3.1Å; V667-L677 HydrophobicContact CG2-CD1 3.68Å; V667-L677 HydrophobicContact CG2-CG 4.01Å; V667-N678 VanDerWaalsContact CG1-C 3.46Å; V667-T679 HydrophobicContact CG1-CG2 4.41Å
668	G	85	Confident	85.1	Confident	52 Å²	52	91.3 Å²	91.3	54%	0.536	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-10.6	172.1	0	0	0	0	0	115.8	T664 L665 L666	T664-G668 PolarHBondContact O-N 2.73Å; L665-G668 PolarHBondContact O-N 3.37Å; L666-G668 PolarHBondContact O-N 3.34Å
669	T	89.5	Confident	84.6	Confident	94 Å²	94	91.6 Å²	91.6	58%	0.577	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	-4.6	174.3	71.1	0	0	0	0	114.4	L666 V667	L666-T669 PolarHBondContact O-N 2.92Å; L666-T669 PolarHBondContact O-OG1 2.84Å; V667-T669 PolarHBondContact O-N 2.9Å; V667-T669 VanDerWaalsContact O-N 3.11Å
670	L	83.3	Confident	84.2	Confident	77 Å²	77	92.6 Å²	92.6	40%	0.403	50%	0.496	S	S	.	.			trans	-72.2	132.3	-177.8	-64.1	176.1	0	0	0	111.6	V667 Y674 L677	V667-L670 HydrophobicContact CB-CD1 4.48Å; V667-L670 HydrophobicContact CG1-CD1 4.38Å; V667-L670 HydrophobicContact CG2-CD1 4.42Å; V667-L670 WeakPolarHBondContact O-CB 3.23Å; V667-L670 WeakPolarHBondContact O-CG 3.41Å; V667-L670 PolarHBondContact O-N 2.85Å; V667-L670 VanDerWaalsContact O-N 3.1Å; L670-Y674 HydrophobicContact CB-CE2 4.32Å; L670-Y674 HydrophobicContact CD1-CD2 4.17Å; L670-Y674 HydrophobicContact CD1-CE2 4.17Å; L670-L677 HydrophobicContact CD1-CD2 4.05Å; L670-L677 HydrophobicContact CD1-CG 4.31Å
671	Q	79.4	Confident	83.9	Confident	206 Å²	206	93.4 Å²	93.4	96%	0.963	50%	0.501	S	S	*	.			trans	-88.3	-3.9	179.9	-62.7	179.8	-6.1	0	0	113.7
672	G	76.8	Confident	83.7	Confident	32 Å²	32	89.2 Å²	89.2	33%	0.33	48%	0.482	S	S	.	.	S	Bend	trans	-108.7	149.3	-179.8	0	0	0	0	0	112.1	Y674	G672-Y674 WeakPolarHBondContact O-CD2 3.16Å; G672-Y674 VanDerWaalsContact O-CE2 3.32Å; G672-Y674 WeakPolarHBondContact O-CE2 3.27Å
673	I	74.9	Confident	83.4	Confident	179 Å²	179	87.4 Å²	87.4	92%	0.918	47%	0.473	S	S	*	.			trans	-87.4	116.9	174.5	-56.5	175	0	0	0	108.5
674	Y	83.2	Confident	83.3	Confident	123 Å²	123	88 Å²	88	48%	0.482	47%	0.474	S	S	.	.			trans	-121.2	125.5	178	-54.4	-82.9	0	0	0	110.2	L670 G672 N676 L677 N678	L670-Y674 HydrophobicContact CB-CE2 4.32Å; L670-Y674 HydrophobicContact CD1-CD2 4.17Å; L670-Y674 HydrophobicContact CD1-CE2 4.17Å; G672-Y674 WeakPolarHBondContact O-CD2 3.16Å; G672-Y674 VanDerWaalsContact O-CE2 3.32Å; G672-Y674 WeakPolarHBondContact O-CE2 3.27Å; Y674-N676 VanDerWaalsContact C-N 3.31Å; Y674-N676 PolarHBondContact O-N 2.85Å; Y674-L677 PolarHBondContact O-N 2.85Å; Y674-N678 PolarHBondContact O-ND2 3.49Å; Y674-N678 VanDerWaalsContact O-ND2 3.1Å
675	Q	72.9	Confident	83.2	Confident	176 Å²	176	92.6 Å²	92.6	82%	0.822	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-39.3	-176.2	-73.6	176	-44.5	0	0	113.1	N678	Q675-N678 PolarHBondContact O-ND2 2.81Å
676	N	76.7	Confident	83.2	Confident	139 Å²	139	86.8 Å²	86.8	74%	0.743	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	9.2	-173.8	-59.3	-20.8	0	0	0	113.4	Y674	Y674-N676 VanDerWaalsContact C-N 3.31Å; Y674-N676 PolarHBondContact O-N 2.85Å
677	L	78.9	Confident	83.2	Confident	78 Å²	78	86 Å²	86	41%	0.408	46%	0.455	S	S	.	.	S	Bend	trans	-146.8	74.8	-178.9	-171.8	67.7	0	0	0	109.9	V667 L670 Y674	V667-L677 HydrophobicContact CG2-CD1 3.68Å; V667-L677 HydrophobicContact CG2-CG 4.01Å; L670-L677 HydrophobicContact CD1-CD2 4.05Å; L670-L677 HydrophobicContact CD1-CG 4.31Å; Y674-L677 PolarHBondContact O-N 2.85Å
678	N	83.1	Confident	83.2	Confident	45 Å²	45	87.6 Å²	87.6	24%	0.241	47%	0.47	C	S	.	.	S	Bend	trans	-136.9	168.2	-179.3	53.9	53	0	0	0	109.9	V667 Y674 Q675 T680 V681 S682	V667-N678 VanDerWaalsContact CG1-C 3.46Å; Y674-N678 PolarHBondContact O-ND2 3.49Å; Y674-N678 VanDerWaalsContact O-ND2 3.1Å; Q675-N678 PolarHBondContact O-ND2 2.81Å; N678-T680 VanDerWaalsContact C-N 3.3Å; N678-T680 PolarHBondContact O-N 3.22Å; N678-T680 PolarHBondContact OD1-OG1 3.19Å; N678-V681 PolarHBondContact O-N 3.14Å; N678-V681 VanDerWaalsContact OD1-CG2 3.3Å; N678-V681 WeakPolarHBondContact OD1-CG2 3.38Å; N678-V681 PolarHBondContact OD1-N 3.22Å; N678-V681 VanDerWaalsContact OD1-N 3.08Å; N678-S682 PolarHBondContact O-N 3.15Å; N678-S682 PolarHBondContact O-OG 2.93Å
679	T	83.2	Confident	83.5	Confident	62 Å²	62	86.2 Å²	86.2	38%	0.38	45%	0.451	S	S	.	.	H	α-helix	trans	-62.6	-33.3	-172.1	45.1	0	0	0	0	113.6	V667 S682 Q683	V667-T679 HydrophobicContact CG1-CG2 4.41Å; T679-S682 WeakPolarHBondContact CA-OG 3.47Å; T679-S682 PolarHBondContact O-N 3.12Å; T679-S682 PolarHBondContact O-OG 3.2Å; T679-Q683 WeakPolarHBondContact O-CB 3.48Å; T679-Q683 WeakPolarHBondContact O-CG 3.45Å; T679-Q683 PolarHBondContact O-N 2.78Å
680	T	84.7	Confident	83.5	Confident	82 Å²	82	86 Å²	86	50%	0.503	44%	0.443	S	S	.	.	H	α-helix	trans	-70.7	-44.1	179.3	51.4	0	0	0	0	111.9	N678 S682 Q683 D684	N678-T680 VanDerWaalsContact C-N 3.3Å; N678-T680 PolarHBondContact O-N 3.22Å; N678-T680 PolarHBondContact OD1-OG1 3.19Å; T680-S682 VanDerWaalsContact C-N 3.29Å; T680-S682 PolarHBondContact O-N 3.49Å; T680-Q683 PolarHBondContact O-N 3.14Å; T680-Q683 VanDerWaalsContact O-N 3.16Å; T680-D684 PolarHBondContact O-N 3.02Å
681	V	86.9	Confident	83.6	Confident	40 Å²	40	85.7 Å²	85.7	24%	0.242	44%	0.436	C	S	.	.	H	α-helix	trans	-60.5	-39	174.9	170.1	0	0	0	0	111.5	N678 D684 W685	N678-V681 PolarHBondContact O-N 3.14Å; N678-V681 VanDerWaalsContact OD1-CG2 3.3Å; N678-V681 WeakPolarHBondContact OD1-CG2 3.38Å; N678-V681 PolarHBondContact OD1-N 3.22Å; N678-V681 VanDerWaalsContact OD1-N 3.08Å; V681-D684 PolarHBondContact O-N 2.82Å; V681-W685 HydrophobicContact CG1-CZ2 3.77Å; V681-W685 PolarHBondContact O-N 2.83Å; V681-W685 VanDerWaalsContact O-N 3.16Å
682	S	84.3	Confident	84	Confident	4 Å²	4	79.8 Å²	79.8	3%	0.028	41%	0.411	C	S	.	.	H	α-helix	trans	-72.2	-32.5	176.1	54.6	0	0	0	0	113.2	T664 N678 T679 T680 W685 C686	T664-S682 WeakPolarHBondContact OG1-CB 3.4Å; N678-S682 PolarHBondContact O-N 3.15Å; N678-S682 PolarHBondContact O-OG 2.93Å; T679-S682 WeakPolarHBondContact CA-OG 3.47Å; T679-S682 PolarHBondContact O-N 3.12Å; T679-S682 PolarHBondContact O-OG 3.2Å; T680-S682 VanDerWaalsContact C-N 3.29Å; T680-S682 PolarHBondContact O-N 3.49Å; S682-W685 PolarHBondContact O-N 3.04Å; S682-C686 PolarHBondContact O-N 2.91Å; S682-C686 PolarHBondContact O-SG 3.37Å
683	Q	86.3	Confident	84.4	Confident	102 Å²	102	79.1 Å²	79.1	48%	0.477	40%	0.4	S	S	.	.	H	α-helix	trans	-66.8	-40.6	171.6	-76	165	-15.7	0	0	112	T664 T679 T680 W685 C686 L687	T664-Q683 HydrophobicContact CG2-CG 4.34Å; T679-Q683 WeakPolarHBondContact O-CB 3.48Å; T679-Q683 WeakPolarHBondContact O-CG 3.45Å; T679-Q683 PolarHBondContact O-N 2.78Å; T680-Q683 PolarHBondContact O-N 3.14Å; T680-Q683 VanDerWaalsContact O-N 3.16Å; Q683-W685 VanDerWaalsContact C-N 3.25Å; Q683-W685 PolarHBondContact O-N 2.9Å; Q683-C686 WeakPolarHBondContact O-CB 3.29Å; Q683-C686 PolarHBondContact O-N 3.46Å; Q683-C686 VanDerWaalsContact O-N 3.17Å; Q683-L687 WeakPolarHBondContact O-CG 3.43Å; Q683-L687 PolarHBondContact O-N 3.28Å
684	D	86.4	Confident	84.6	Confident	65 Å²	65	76.9 Å²	76.9	35%	0.348	38%	0.38	S	S	.	.	H	α-helix	trans	-59.1	-37.3	172.4	-78.7	-24.9	0	0	0	111.6	T680 V681 L687 A688 L1181	T680-D684 PolarHBondContact O-N 3.02Å; V681-D684 PolarHBondContact O-N 2.82Å; D684-L687 PolarHBondContact O-N 2.8Å; D684-A688 VanDerWaalsContact O-CB 3.29Å; D684-A688 WeakPolarHBondContact O-CB 3.43Å; D684-A688 PolarHBondContact O-N 3.45Å; D684-L1181 HydrophobicContact CB-CD1 4.07Å
685	W	87.1	Confident	84.5	Confident	122 Å²	122	73.7 Å²	73.7	46%	0.462	37%	0.371	S	S	.	.	H	α-helix	trans	-67.4	-41.2	174.3	-63.7	-4.1	0	0	0	112.4	V660 V681 S682 Q683 A688 L689	V660-W685 HydrophobicContact CG1-CB 3.75Å; V660-W685 HydrophobicContact CG1-CE3 4.35Å; V681-W685 HydrophobicContact CG1-CZ2 3.77Å; V681-W685 PolarHBondContact O-N 2.83Å; V681-W685 VanDerWaalsContact O-N 3.16Å; S682-W685 PolarHBondContact O-N 3.04Å; Q683-W685 VanDerWaalsContact C-N 3.25Å; Q683-W685 PolarHBondContact O-N 2.9Å; W685-A688 PolarHBondContact O-N 3.24Å; W685-L689 WeakPolarHBondContact O-CB 3.48Å; W685-L689 WeakPolarHBondContact O-CG 3.18Å; W685-L689 PolarHBondContact O-N 2.86Å
686	C	89.4	Confident	85.1	Confident	14 Å²	14	67.3 Å²	67.3	10%	0.095	34%	0.34	C	S	.	.	H	α-helix	trans	-58.7	-48.3	172.2	-67.7	0	0	0	0	111.6	L657 S682 Q683 A688 L689 Q690	L657-C686 HydrophobicContact CD1-CB 3.96Å; S682-C686 PolarHBondContact O-N 2.91Å; S682-C686 PolarHBondContact O-SG 3.37Å; Q683-C686 WeakPolarHBondContact O-CB 3.29Å; Q683-C686 PolarHBondContact O-N 3.46Å; Q683-C686 VanDerWaalsContact O-N 3.17Å; C686-A688 VanDerWaalsContact C-N 3.34Å; C686-A688 PolarHBondContact O-N 2.95Å; C686-L689 PolarHBondContact O-N 3.33Å; C686-Q690 WeakPolarHBondContact O-CB 3.43Å; C686-Q690 VanDerWaalsContact O-CG 3.28Å; C686-Q690 WeakPolarHBondContact O-CG 3.29Å; C686-Q690 PolarHBondContact O-N 3.02Å
687	L	88.2	Confident	85.2	Confident	99 Å²	99	65 Å²	65	52%	0.518	33%	0.325	S	S	.	.	H	α-helix	trans	-63.1	-38.4	178.1	-68.3	172.8	0	0	0	112.1	Q683 D684 R691	Q683-L687 WeakPolarHBondContact O-CG 3.43Å; Q683-L687 PolarHBondContact O-N 3.28Å; D684-L687 PolarHBondContact O-N 2.8Å; L687-R691 VanDerWaalsContact O-CB 3.31Å; L687-R691 WeakPolarHBondContact O-CB 3.47Å; L687-R691 PolarHBondContact O-N 2.72Å
688	A	87.9	Confident	84.9	Confident	48 Å²	48	65 Å²	65	40%	0.397	32%	0.323	S	S	.	.	H	α-helix	trans	-65.4	-41.4	174.7	0	0	0	0	0	112.4	D684 W685 C686 R691 L692	D684-A688 VanDerWaalsContact O-CB 3.29Å; D684-A688 WeakPolarHBondContact O-CB 3.43Å; D684-A688 PolarHBondContact O-N 3.45Å; W685-A688 PolarHBondContact O-N 3.24Å; C686-A688 VanDerWaalsContact C-N 3.34Å; C686-A688 PolarHBondContact O-N 2.95Å; A688-R691 WeakPolarHBondContact O-CB 3.41Å; A688-R691 PolarHBondContact O-N 2.8Å; A688-L692 WeakPolarHBondContact O-CG 3.49Å; A688-L692 PolarHBondContact O-N 2.89Å
689	L	90	Very high	84.5	Confident	24 Å²	24	66.7 Å²	66.7	13%	0.126	33%	0.329	C	S	.	.	H	α-helix	trans	-68.8	-43.6	176.3	-75.1	167.7	0	0	0	111.8	L653 D656 L657 V660 W685 C686 R691 L692 I693	L653-L689 HydrophobicContact CD2-CD2 3.77Å; D656-L689 HydrophobicContact CB-CD1 4.27Å; D656-L689 HydrophobicContact CB-CD2 4.11Å; L657-L689 HydrophobicContact CB-CB 4.23Å; L657-L689 HydrophobicContact CB-CD1 4.47Å; L657-L689 HydrophobicContact CD1-CB 4.12Å; V660-L689 HydrophobicContact CB-CD1 4.03Å; V660-L689 HydrophobicContact CG1-CD1 4.46Å; V660-L689 HydrophobicContact CG2-CD1 3.75Å; W685-L689 WeakPolarHBondContact O-CB 3.48Å; W685-L689 WeakPolarHBondContact O-CG 3.18Å; W685-L689 PolarHBondContact O-N 2.86Å; C686-L689 PolarHBondContact O-N 3.33Å; L689-R691 VanDerWaalsContact C-N 3.28Å; L689-R691 PolarHBondContact O-N 3.39Å; L689-L692 HydrophobicContact CD2-CD1 4.48Å; L689-L692 PolarHBondContact O-N 3.24Å; L689-L692 VanDerWaalsContact O-N 3.08Å; L689-I693 WeakPolarHBondContact O-CB 3.4Å; L689-I693 VanDerWaalsContact O-CG1 3.29Å; L689-I693 WeakPolarHBondContact O-CG1 3.27Å; L689-I693 PolarHBondContact O-N 2.88Å
690	Q	90.1	Very high	84.1	Confident	90 Å²	90	64.1 Å²	64.1	42%	0.421	31%	0.313	S	S	.	.	H	α-helix	trans	-58	-40	171.9	-71.3	172.4	3.3	0	0	111.8	L657 C686 I693 R694	L657-Q690 HydrophobicContact CD1-CG 4.13Å; L657-Q690 HydrophobicContact CD2-CG 3.73Å; C686-Q690 WeakPolarHBondContact O-CB 3.43Å; C686-Q690 VanDerWaalsContact O-CG 3.28Å; C686-Q690 WeakPolarHBondContact O-CG 3.29Å; C686-Q690 PolarHBondContact O-N 3.02Å; Q690-I693 PolarHBondContact O-N 3.32Å; Q690-R694 WeakPolarHBondContact O-CB 3.38Å; Q690-R694 PolarHBondContact O-N 2.93Å
691	R	85.9	Confident	83.6	Confident	69 Å²	69	64.5 Å²	64.5	26%	0.26	31%	0.309	S	S	.	.	H	α-helix	trans	-64.1	-40.1	173.3	-175	177.3	-177.6	161.7	6.8	112.3	L687 A688 L689 I695 T1173	L687-R691 VanDerWaalsContact O-CB 3.31Å; L687-R691 WeakPolarHBondContact O-CB 3.47Å; L687-R691 PolarHBondContact O-N 2.72Å; A688-R691 WeakPolarHBondContact O-CB 3.41Å; A688-R691 PolarHBondContact O-N 2.8Å; L689-R691 VanDerWaalsContact C-N 3.28Å; L689-R691 PolarHBondContact O-N 3.39Å; R691-I695 HydrophobicContact CG-CD1 4.14Å; R691-I695 WeakPolarHBondContact O-CD1 3.3Å; R691-I695 VanDerWaalsContact O-CG1 3.25Å; R691-I695 WeakPolarHBondContact O-CG1 3.16Å; R691-I695 PolarHBondContact O-N 2.98Å; R691-T1173 PolarHBondContact NH2-O 3.29Å
692	L	87.5	Confident	83	Confident	83 Å²	83	64.9 Å²	64.9	44%	0.435	31%	0.313	S	S	.	.	H	α-helix	trans	-69	-41.2	176.4	-73.9	169.1	0	0	0	112.3	L653 A688 L689 I695 K696	L653-L692 HydrophobicContact CD1-CB 3.93Å; L653-L692 HydrophobicContact CD2-CB 4.07Å; L653-L692 HydrophobicContact CD2-CD1 4.19Å; A688-L692 WeakPolarHBondContact O-CG 3.49Å; A688-L692 PolarHBondContact O-N 2.89Å; L689-L692 HydrophobicContact CD2-CD1 4.48Å; L689-L692 PolarHBondContact O-N 3.24Å; L689-L692 VanDerWaalsContact O-N 3.08Å; L692-I695 PolarHBondContact O-N 2.65Å; L692-K696 WeakPolarHBondContact O-CG 3.3Å; L692-K696 PolarHBondContact O-N 3.48Å
693	I	84.7	Confident	82.5	Confident	17 Å²	17	66.3 Å²	66.3	9%	0.087	33%	0.325	C	S	.	.	H	α-helix	trans	-54.8	-53.8	172.3	-74.3	167.3	0	0	0	109.6	L650 L653 Q654 L657 L689 Q690 I695 K696 E697	L650-I693 HydrophobicContact CD1-CB 4.33Å; L650-I693 HydrophobicContact CD1-CG1 4.47Å; L650-I693 HydrophobicContact CD1-CG2 3.83Å; L653-I693 HydrophobicContact CB-CD1 4.47Å; L653-I693 HydrophobicContact CB-CG1 3.73Å; Q654-I693 HydrophobicContact CG-CD1 4.01Å; Q654-I693 HydrophobicContact CG-CG1 4.31Å; L657-I693 HydrophobicContact CB-CD1 4.09Å; L657-I693 HydrophobicContact CD2-CD1 3.69Å; L689-I693 WeakPolarHBondContact O-CB 3.4Å; L689-I693 VanDerWaalsContact O-CG1 3.29Å; L689-I693 WeakPolarHBondContact O-CG1 3.27Å; L689-I693 PolarHBondContact O-N 2.88Å; Q690-I693 PolarHBondContact O-N 3.32Å; I693-I695 VanDerWaalsContact C-N 3.33Å; I693-I695 PolarHBondContact O-N 2.92Å; I693-K696 CarbonylContact O-C 3.6Å; I693-K696 WeakPolarHBondContact O-CA 3.41Å; I693-K696 WeakPolarHBondContact O-CB 3.34Å; I693-K696 PolarHBondContact O-N 3.28Å; I693-E697 WeakPolarHBondContact O-CG 3.41Å; I693-E697 PolarHBondContact O-N 3.12Å
694	R	79.9	Confident	82.1	Confident	132 Å²	132	62.5 Å²	62.5	50%	0.498	31%	0.308	S	S	.	.	H	α-helix	trans	-56.7	-43.6	177	-179.2	175.3	176.3	149.9	3.6	112.7	Q690 K696 E697 E698	Q690-R694 WeakPolarHBondContact O-CB 3.38Å; Q690-R694 PolarHBondContact O-N 2.93Å; R694-K696 VanDerWaalsContact C-N 3.3Å; R694-K696 PolarHBondContact O-N 3.28Å; R694-E697 PolarHBondContact O-N 2.88Å; R694-E698 WeakPolarHBondContact CG-OE1 3.47Å; R694-E698 IonicContact NE-OE1 2.68Å; R694-E698 PolarHBondContact NE-OE1 3.4Å; R694-E698 WeakPolarHBondContact O-CG 3.3Å; R694-E698 PolarHBondContact O-N 3.22Å
695	I	81.1	Confident	81.9	Confident	57 Å²	57	60.9 Å²	60.9	29%	0.292	30%	0.298	S	S	.	.	H	α-helix	trans	-62.9	-35.2	175.7	-71.4	165.1	0	0	0	111.6	R691 L692 I693 Q699	R691-I695 HydrophobicContact CG-CD1 4.14Å; R691-I695 WeakPolarHBondContact O-CD1 3.3Å; R691-I695 VanDerWaalsContact O-CG1 3.25Å; R691-I695 WeakPolarHBondContact O-CG1 3.16Å; R691-I695 PolarHBondContact O-N 2.98Å; L692-I695 PolarHBondContact O-N 2.65Å; I693-I695 VanDerWaalsContact C-N 3.33Å; I693-I695 PolarHBondContact O-N 2.92Å; I695-Q699 WeakPolarHBondContact O-CB 3.4Å; I695-Q699 VanDerWaalsContact O-CG 3.24Å; I695-Q699 WeakPolarHBondContact O-CG 3.49Å; I695-Q699 PolarHBondContact O-N 3.29Å
696	K	84.1	Confident	81.7	Confident	41 Å²	41	56.8 Å²	56.8	18%	0.178	29%	0.287	C	S	.	.	H	α-helix	trans	-71.3	-38.3	173.8	-71	-60.4	-179.5	179.8	0	112.7	E649 L650 L653 L692 I693 R694 Q699 I700	E649-K696 HydrophobicContact CB-CD 4.45Å; E649-K696 WeakPolarHBondContact OE2-CE 3.46Å; E649-K696 IonicContact OE2-NZ 3.95Å; E649-K696 PolarHBondContact OE2-NZ 2.84Å; L650-K696 HydrophobicContact CB-CB 4.4Å; L650-K696 HydrophobicContact CD1-CB 4.12Å; L653-K696 HydrophobicContact CD1-CG 3.62Å; L692-K696 WeakPolarHBondContact O-CG 3.3Å; L692-K696 PolarHBondContact O-N 3.48Å; I693-K696 CarbonylContact O-C 3.6Å; I693-K696 WeakPolarHBondContact O-CA 3.41Å; I693-K696 WeakPolarHBondContact O-CB 3.34Å; I693-K696 PolarHBondContact O-N 3.28Å; R694-K696 VanDerWaalsContact C-N 3.3Å; R694-K696 PolarHBondContact O-N 3.28Å; K696-Q699 PolarHBondContact O-N 2.94Å; K696-I700 WeakPolarHBondContact O-CB 3.44Å; K696-I700 VanDerWaalsContact O-CG1 3.29Å; K696-I700 WeakPolarHBondContact O-CG1 3.44Å; K696-I700 PolarHBondContact O-N 3.41Å
697	E	78.6	Confident	81.6	Confident	90 Å²	90	57.5 Å²	57.5	42%	0.421	29%	0.288	S	S	.	.	H	α-helix	trans	-63.8	-43	174.1	-69	175.6	152	0	0	111.6	L650 I693 R694 I700 Q701	L650-E697 HydrophobicContact CD1-CG 3.88Å; L650-E697 HydrophobicContact CD2-CG 4.08Å; I693-E697 WeakPolarHBondContact O-CG 3.41Å; I693-E697 PolarHBondContact O-N 3.12Å; R694-E697 PolarHBondContact O-N 2.88Å; E697-I700 WeakPolarHBondContact O-CB 3.43Å; E697-I700 PolarHBondContact O-N 3.35Å; E697-Q701 WeakPolarHBondContact O-CB 3.34Å; E697-Q701 PolarHBondContact O-N 3.22Å
698	E	72.5	Confident	81.7	Confident	80 Å²	80	52.9 Å²	52.9	37%	0.374	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-43.4	172.6	-72	171.9	-166.8	0	0	111.5	R694 I700 Q701 C702	R694-E698 WeakPolarHBondContact CG-OE1 3.47Å; R694-E698 IonicContact NE-OE1 2.68Å; R694-E698 PolarHBondContact NE-OE1 3.4Å; R694-E698 WeakPolarHBondContact O-CG 3.3Å; R694-E698 PolarHBondContact O-N 3.22Å; E698-I700 PolarHBondContact O-N 3.04Å; E698-Q701 PolarHBondContact O-N 3.04Å; E698-C702 WeakPolarHBondContact O-CB 3.48Å; E698-C702 PolarHBondContact O-N 3.01Å
699	Q	75.2	Confident	81.7	Confident	79 Å²	79	51.1 Å²	51.1	37%	0.369	25%	0.247	S	C	.	.	H	α-helix	trans	-61.1	-41	173.4	-75.3	171.4	20.3	0	0	112.4	L646 I695 K696 A703	L646-Q699 HydrophobicContact CD1-CB 4.29Å; I695-Q699 WeakPolarHBondContact O-CB 3.4Å; I695-Q699 VanDerWaalsContact O-CG 3.24Å; I695-Q699 WeakPolarHBondContact O-CG 3.49Å; I695-Q699 PolarHBondContact O-N 3.29Å; K696-Q699 PolarHBondContact O-N 2.94Å; Q699-A703 WeakPolarHBondContact O-CB 3.39Å; Q699-A703 PolarHBondContact O-N 3.17Å
700	I	75.6	Confident	81.7	Confident	9 Å²	9	50 Å²	50	5%	0.046	24%	0.241	C	C	.	.	H	α-helix	trans	-64.2	-44	174.8	-80.1	165	0	0	0	111.3	L646 Y647 L650 K696 E697 E698 A703 N704	L646-I700 HydrophobicContact CB-CD1 4.14Å; L646-I700 HydrophobicContact CB-CG1 3.64Å; L646-I700 HydrophobicContact CD1-CG1 4.23Å; Y647-I700 HydrophobicContact CD1-CD1 4.35Å; Y647-I700 HydrophobicContact CD2-CD1 3.76Å; Y647-I700 HydrophobicContact CD2-CG1 4.02Å; Y647-I700 HydrophobicContact CD2-CG2 4.45Å; Y647-I700 HydrophobicContact CE1-CD1 4.35Å; Y647-I700 HydrophobicContact CE2-CB 4.26Å; Y647-I700 HydrophobicContact CE2-CD1 3.77Å; Y647-I700 HydrophobicContact CE2-CG1 3.83Å; Y647-I700 HydrophobicContact CE2-CG2 3.45Å; Y647-I700 VanDerWaalsContact CE2-CG2 3.45Å; Y647-I700 HydrophobicContact CG-CD1 4.08Å; Y647-I700 WeakPolarHBondContact OH-CG2 3.29Å; L650-I700 HydrophobicContact CB-CD1 4.22Å; L650-I700 HydrophobicContact CD2-CD1 3.74Å; K696-I700 WeakPolarHBondContact O-CB 3.44Å; K696-I700 VanDerWaalsContact O-CG1 3.29Å; K696-I700 WeakPolarHBondContact O-CG1 3.44Å; K696-I700 PolarHBondContact O-N 3.41Å; E697-I700 WeakPolarHBondContact O-CB 3.43Å; E697-I700 PolarHBondContact O-N 3.35Å; E698-I700 PolarHBondContact O-N 3.04Å; I700-A703 PolarHBondContact O-N 2.89Å; I700-N704 WeakPolarHBondContact O-CB 3.45Å; I700-N704 PolarHBondContact O-N 3.16Å; I700-N704 PolarHBondContact O-ND2 3.29Å
701	Q	74.7	Confident	81.7	Confident	89 Å²	89	48.2 Å²	48.2	42%	0.416	23%	0.233	S	C	.	.	H	α-helix	trans	-64.1	-46.4	179.2	-164.1	-172.3	37	0	0	110.5	E697 E698 A703 N704 K705	E697-Q701 WeakPolarHBondContact O-CB 3.34Å; E697-Q701 PolarHBondContact O-N 3.22Å; E698-Q701 PolarHBondContact O-N 3.04Å; Q701-A703 PolarHBondContact O-N 3.4Å; Q701-N704 CarbonylContact O-C 3.57Å; Q701-N704 WeakPolarHBondContact O-CA 3.48Å; Q701-N704 WeakPolarHBondContact O-CB 3.46Å; Q701-N704 PolarHBondContact O-N 2.88Å; Q701-K705 PolarHBondContact O-N 3.3Å
702	C	73.1	Confident	81.9	Confident	48 Å²	48	45 Å²	45	32%	0.324	22%	0.221	S	C	.	.	H	α-helix	trans	-61	-41.2	173.7	-79.2	0	0	0	0	112.6	E698 N704 K705	E698-C702 WeakPolarHBondContact O-CB 3.48Å; E698-C702 PolarHBondContact O-N 3.01Å; C702-N704 PolarHBondContact O-N 3.46Å; C702-K705 WeakPolarHBondContact O-CB 3.18Å; C702-K705 PolarHBondContact O-N 3.21Å
703	A	74.4	Confident	81.9	Confident	34 Å²	34	43.2 Å²	43.2	28%	0.281	21%	0.214	S	C	.	.	H	α-helix	trans	-64.6	-22.3	172.4	0	0	0	0	0	113.6	P643 L646 Q699 I700 Q701	P643-A703 HydrophobicContact CG-CB 3.81Å; L646-A703 HydrophobicContact CD1-CB 4.43Å; Q699-A703 WeakPolarHBondContact O-CB 3.39Å; Q699-A703 PolarHBondContact O-N 3.17Å; I700-A703 PolarHBondContact O-N 2.89Å; Q701-A703 PolarHBondContact O-N 3.4Å
704	N	78.4	Confident	81.8	Confident	23 Å²	23	43.9 Å²	43.9	12%	0.123	23%	0.225	C	C	.	.	H	α-helix	trans	-88.3	-16.1	174.9	-78.9	-45.5	0	0	0	114.1	I700 Q701 C702 C706 R707 R709 K737	I700-N704 WeakPolarHBondContact O-CB 3.45Å; I700-N704 PolarHBondContact O-N 3.16Å; I700-N704 PolarHBondContact O-ND2 3.29Å; Q701-N704 CarbonylContact O-C 3.57Å; Q701-N704 WeakPolarHBondContact O-CA 3.48Å; Q701-N704 WeakPolarHBondContact O-CB 3.46Å; Q701-N704 PolarHBondContact O-N 2.88Å; C702-N704 PolarHBondContact O-N 3.46Å; N704-C706 VanDerWaalsContact C-N 3.28Å; N704-C706 PolarHBondContact O-N 3.05Å; N704-R707 PolarHBondContact O-N 3.48Å; N704-R709 VanDerWaalsContact OD1-CZ 3.32Å; N704-R709 PolarHBondContact OD1-NH1 3.18Å; N704-R709 PolarHBondContact OD1-NH2 2.89Å; N704-K737 PolarHBondContact O-NZ 3.21Å
705	K	80.6	Confident	81.6	Confident	31 Å²	31	48.5 Å²	48.5	14%	0.135	24%	0.242	C	C	.	.	H	α-helix	trans	-58.9	-36.2	176.8	-73.6	-177.2	179.7	-177.1	0	112.5	Q701 C702 P734 K737 F808 L1119	Q701-K705 PolarHBondContact O-N 3.3Å; C702-K705 WeakPolarHBondContact O-CB 3.18Å; C702-K705 PolarHBondContact O-N 3.21Å; K705-P734 HydrophobicContact CB-CG 4.49Å; K705-K737 WeakPolarHBondContact O-CD 3.12Å; K705-F808 HydrophobicContact CB-CD1 4.48Å; K705-F808 HydrophobicContact CB-CE1 3.83Å; K705-F808 HydrophobicContact CG-CE1 3.91Å; K705-F808 HydrophobicContact CG-CZ 4.3Å; K705-L1119 PolarHBondContact NZ-O 2.88Å
706	C	84.7	Confident	81.5	Confident	35 Å²	35	49.8 Å²	49.8	24%	0.236	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	24.6	179.8	-55.9	0	0	0	0	113.8	N704 N730 T731 N733	N704-C706 VanDerWaalsContact C-N 3.28Å; N704-C706 PolarHBondContact O-N 3.05Å; C706-N730 CarbonylContact O-C 3.59Å; C706-N730 WeakPolarHBondContact O-CA 3.34Å; C706-T731 VanDerWaalsContact CA-OG1 3.3Å; C706-T731 WeakPolarHBondContact CA-OG1 3.4Å; C706-T731 PolarHBondContact O-N 2.6Å; C706-T731 PolarHBondContact O-OG1 3.22Å; C706-N733 VanDerWaalsContact SG-C 3.57Å
707	R	86	Confident	81.3	Confident	29 Å²	29	50.8 Å²	50.8	11%	0.109	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	113.3	-178	-170	175.6	-71	163	12.7	112.6	Y550 N704 V728 N730 K737	Y550-R707 PolarHBondContact OH-NH1 3.37Å; N704-R707 PolarHBondContact O-N 3.48Å; R707-V728 HydrophobicContact CG-CG1 3.57Å; R707-N730 PolarHBondContact NE-OD1 3.38Å; R707-K737 WeakPolarHBondContact O-CE 3.46Å
708	L	89.9	Confident	81.5	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.016	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	128.1	172.8	179	69.4	0	0	0	109.1	L545 L710 F729 T731 W740 V741	L545-L708 HydrophobicContact CD1-CD2 4.41Å; L708-L710 HydrophobicContact CD1-CD2 4.05Å; L708-L710 HydrophobicContact CD2-CD1 4.28Å; L708-L710 HydrophobicContact CD2-CD2 4.48Å; L708-L710 HydrophobicContact CD2-CG 4.34Å; L708-L710 HydrophobicContact CG-CD2 4.17Å; L708-L710 HydrophobicContact CG-CG 4.16Å; L708-F729 HydrophobicContact CB-CB 4.32Å; L708-F729 HydrophobicContact CD2-CD2 4.45Å; L708-F729 PolarHBondContact N-O 3.41Å; L708-F729 PolarHBondContact O-N 3.44Å; L708-F729 VanDerWaalsContact O-O 3.14Å; L708-T731 HydrophobicContact CB-CG2 4.48Å; L708-W740 HydrophobicContact CD1-CB 4.4Å; L708-W740 HydrophobicContact CD2-CB 3.79Å; L708-W740 HydrophobicContact CD2-CD2 4.24Å; L708-W740 HydrophobicContact CD2-CE3 4.44Å; L708-W740 HydrophobicContact CD2-CG 3.94Å; L708-V741 HydrophobicContact CD1-CG2 3.6Å
709	R	87.9	Confident	81.8	Confident	10 Å²	10	57.1 Å²	57.1	4%	0.038	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	127.1	173.9	-56	171.2	176.2	71.4	-3.5	108.4	V607 V608 V610 L641 N704 M726 V728	V607-R709 WeakPolarHBondContact CA-O 3.38Å; V608-R709 HydrophobicContact CB-CB 4.27Å; V608-R709 PolarHBondContact N-O 3.45Å; V608-R709 WeakPolarHBondContact O-CB 3.41Å; V610-R709 VanDerWaalsContact CG2-NH2 3.27Å; L641-R709 PolarHBondContact O-NE 3.1Å; L641-R709 PolarHBondContact O-NH2 2.81Å; N704-R709 VanDerWaalsContact OD1-CZ 3.32Å; N704-R709 PolarHBondContact OD1-NH1 3.18Å; N704-R709 PolarHBondContact OD1-NH2 2.89Å; R709-M726 HydrophobicContact CB-SD 4.31Å; R709-V728 HydrophobicContact CG-CG1 4.27Å; R709-V728 HydrophobicContact CG-CG2 4.17Å
710	L	91.2	Very high	81.8	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	126	178.9	-59.1	-178.9	0	0	0	109.6	L571 V605 Q606 V607 L708 V712 M726 V727 F729 L744	L571-L710 HydrophobicContact CD2-CD1 3.61Å; V605-L710 HydrophobicContact CG1-CB 4.29Å; V605-L710 HydrophobicContact CG1-CD1 4.4Å; V605-L710 HydrophobicContact CG1-CD2 4.28Å; Q606-L710 CarbonylContact O-C 3.56Å; Q606-L710 WeakPolarHBondContact O-CA 3.47Å; V607-L710 HydrophobicContact CB-CD2 4.43Å; V607-L710 HydrophobicContact CG2-CD2 3.65Å; L708-L710 HydrophobicContact CD1-CD2 4.05Å; L708-L710 HydrophobicContact CD2-CD1 4.28Å; L708-L710 HydrophobicContact CD2-CD2 4.48Å; L708-L710 HydrophobicContact CD2-CG 4.34Å; L708-L710 HydrophobicContact CG-CD2 4.17Å; L708-L710 HydrophobicContact CG-CG 4.16Å; L710-V712 HydrophobicContact CB-CG2 4.07Å; L710-M726 CarbonylContact O-C 3.58Å; L710-M726 WeakPolarHBondContact O-CA 3.48Å; L710-V727 PolarHBondContact N-O 2.93Å; L710-V727 PolarHBondContact O-N 3.29Å; L710-F729 HydrophobicContact CD1-CD2 4.34Å; L710-F729 HydrophobicContact CD1-CE2 4.15Å; L710-L744 HydrophobicContact CD1-CD1 4.5Å; L710-L744 HydrophobicContact CD2-CD1 3.88Å
711	Q	90.2	Very high	81.8	Confident	54 Å²	54	63.5 Å²	63.5	25%	0.252	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	124.4	163.2	-178	170.5	11	0	0	107.9	V605 Q606 V608 S724	V605-Q711 WeakPolarHBondContact CA-O 3.24Å; Q606-Q711 HydrophobicContact CB-CB 4.32Å; Q606-Q711 PolarHBondContact N-O 3.5Å; Q606-Q711 PolarHBondContact O-N 3.47Å; V608-Q711 HydrophobicContact CG2-CB 3.67Å; Q711-S724 PolarHBondContact NE2-OG 3.49Å
712	V	90.5	Very high	81.6	Confident	1 Å²	1	65.4 Å²	65.4	1%	0.006	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	138.3	-170.1	-176.9	0	0	0	0	108.5	W598 A600 L710 G714 S724 F725 V727	W598-V712 HydrophobicContact CD2-CG1 4.44Å; W598-V712 HydrophobicContact CE3-CG1 4.03Å; W598-V712 HydrophobicContact CH2-CG1 4.4Å; W598-V712 HydrophobicContact CH2-CG2 4.03Å; W598-V712 HydrophobicContact CZ2-CG2 4.31Å; W598-V712 HydrophobicContact CZ3-CG1 4.02Å; W598-V712 HydrophobicContact CZ3-CG2 4.4Å; A600-V712 HydrophobicContact CB-CG1 3.65Å; L710-V712 HydrophobicContact CB-CG2 4.07Å; V712-G714 PolarHBondContact O-N 3.24Å; V712-S724 CarbonylContact O-C 3.54Å; V712-S724 VanDerWaalsContact O-CA 3.27Å; V712-S724 WeakPolarHBondContact O-CA 3.44Å; V712-S724 WeakPolarHBondContact O-CB 3.48Å; V712-F725 HydrophobicContact CB-CD1 4.33Å; V712-F725 HydrophobicContact CB-CE1 3.87Å; V712-F725 HydrophobicContact CB-CE2 4.42Å; V712-F725 HydrophobicContact CB-CZ 3.92Å; V712-F725 HydrophobicContact CG1-CE1 3.82Å; V712-F725 HydrophobicContact CG1-CZ 3.83Å; V712-F725 PolarHBondContact N-O 2.86Å; V712-F725 VanDerWaalsContact O-CD1 3.29Å; V712-F725 WeakPolarHBondContact O-CD1 3.34Å; V712-F725 PolarHBondContact O-N 2.72Å; V712-V727 HydrophobicContact CG2-CG2 4.06Å
713	P	87.5	Confident	82	Confident	46 Å²	46	66.3 Å²	66.3	30%	0.299	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	126.3	174	26.7	-36.1	0	0	0	110.5	A600 H604 F725	A600-P713 HydrophobicContact CB-CG 3.81Å; H604-P713 HydrophobicContact CB-CB 4.38Å; H604-P713 HydrophobicContact CB-CG 3.84Å; P713-F725 WeakPolarHBondContact O-CE1 3.43Å
714	G	81.4	Confident	82.4	Confident	30 Å²	30	67.3 Å²	67.3	31%	0.309	36%	0.363	S	S	.	.			trans	-88.3	-170.2	171.8	0	0	0	0	0	111.8	V712 V723	V712-G714 PolarHBondContact O-N 3.24Å; G714-V723 WeakPolarHBondContact CA-O 3.37Å; G714-V723 PolarHBondContact N-O 2.93Å
715	R	76.6	Confident	82.7	Confident	229 Å²	229	69.7 Å²	69.7	86%	0.864	37%	0.372	S	S	*	.			trans	-71.4	144.3	162	-67.4	-176.1	177.2	-169.9	-2.9	108.7
716	P	77.9	Confident	83	Confident	84 Å²	84	71.9 Å²	71.9	55%	0.545	38%	0.384	S	S	.	.			trans	-60.9	157.9	173.9	26.9	-34.6	0	0	0	111.3	R721	P716-R721 CarbonylContact C-O 3.55Å; P716-R721 WeakPolarHBondContact CA-O 3.43Å; P716-R721 VanDerWaalsContact CB-O 3.28Å; P716-R721 WeakPolarHBondContact CB-O 3.44Å
717	D	81	Confident	83.2	Confident	62 Å²	62	70.5 Å²	70.5	33%	0.332	37%	0.374	S	S	.	.			trans	-72.7	177.9	176.9	73.8	16.6	0	0	0	112.6	S719 G720 R721 V723	D717-S719 PolarHBondContact O-N 3.3Å; D717-S719 WeakPolarHBondContact OD1-CA 3.47Å; D717-S719 WeakPolarHBondContact OD1-CB 3.47Å; D717-S719 PolarHBondContact OD1-N 3.1Å; D717-S719 PolarHBondContact OD1-OG 2.82Å; D717-S719 PolarHBondContact OD2-OG 3.48Å; D717-G720 PolarHBondContact O-N 3.36Å; D717-G720 PolarHBondContact OD1-N 3.21Å; D717-G720 VanDerWaalsContact OD1-N 3.09Å; D717-R721 PolarHBondContact N-O 3.34Å; D717-R721 PolarHBondContact OD1-N 3.12Å; D717-R721 WeakPolarHBondContact OD2-CD 3.43Å; D717-V723 HydrophobicContact CB-CG2 3.8Å
718	K	82.3	Confident	83.4	Confident	228 Å²	228	69.6 Å²	69.6	99%	0.991	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-8.4	177.9	-65.3	-174	179.5	-178	0	114.1
719	S	79.6	Confident	83.5	Confident	76 Å²	76	69.5 Å²	69.5	53%	0.531	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	12.3	172.7	67.7	0	0	0	0	113.1	D717 R721	D717-S719 PolarHBondContact O-N 3.3Å; D717-S719 WeakPolarHBondContact OD1-CA 3.47Å; D717-S719 WeakPolarHBondContact OD1-CB 3.47Å; D717-S719 PolarHBondContact OD1-N 3.1Å; D717-S719 PolarHBondContact OD1-OG 2.82Å; D717-S719 PolarHBondContact OD2-OG 3.48Å; S719-R721 VanDerWaalsContact C-N 3.29Å; S719-R721 PolarHBondContact O-N 3.38Å; S719-R721 WeakPolarHBondContact OG-CG 3.29Å; S719-R721 PolarHBondContact OG-NE 3.15Å
720	G	74.8	Confident	83.6	Confident	55 Å²	55	71 Å²	71	57%	0.567	38%	0.38	S	S	*	.			trans	79.2	1.5	177.3	0	0	0	0	0	115.1	D717	D717-G720 PolarHBondContact O-N 3.36Å; D717-G720 PolarHBondContact OD1-N 3.21Å; D717-G720 VanDerWaalsContact OD1-N 3.09Å
721	R	75	Confident	83.7	Confident	167 Å²	167	71.6 Å²	71.6	63%	0.63	38%	0.383	S	S	*	.			trans	-71.4	140.6	-176.5	-56.8	175.3	-161.3	-136.6	-2.1	110.7	P716 D717 S719 V723	P716-R721 CarbonylContact C-O 3.55Å; P716-R721 WeakPolarHBondContact CA-O 3.43Å; P716-R721 VanDerWaalsContact CB-O 3.28Å; P716-R721 WeakPolarHBondContact CB-O 3.44Å; D717-R721 PolarHBondContact N-O 3.34Å; D717-R721 PolarHBondContact OD1-N 3.12Å; D717-R721 WeakPolarHBondContact OD2-CD 3.43Å; S719-R721 VanDerWaalsContact C-N 3.29Å; S719-R721 PolarHBondContact O-N 3.38Å; S719-R721 WeakPolarHBondContact OG-CG 3.29Å; S719-R721 PolarHBondContact OG-NE 3.15Å; R721-V723 PolarHBondContact O-N 3.27Å; R721-V723 VanDerWaalsContact O-N 3.11Å
722	P	70.8	Confident	83.5	Confident	128 Å²	128	72.2 Å²	72.2	83%	0.831	39%	0.392	S	S	*	.			trans	-66.6	111.3	174	27.6	-33.6	0	0	0	110.4
723	V	80.7	Confident	83.3	Confident	68 Å²	68	75.2 Å²	75.2	41%	0.412	41%	0.408	S	S	.	.			trans	-93.5	139.2	171.3	-177	0	0	0	0	108.6	G714 D717 R721	G714-V723 WeakPolarHBondContact CA-O 3.37Å; G714-V723 PolarHBondContact N-O 2.93Å; D717-V723 HydrophobicContact CB-CG2 3.8Å; R721-V723 PolarHBondContact O-N 3.27Å; R721-V723 VanDerWaalsContact O-N 3.11Å
724	S	83	Confident	83.1	Confident	55 Å²	55	73.4 Å²	73.4	39%	0.385	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	152.4	167.9	54.7	0	0	0	0	110.3	Q711 V712	Q711-S724 PolarHBondContact NE2-OG 3.49Å; V712-S724 CarbonylContact O-C 3.54Å; V712-S724 VanDerWaalsContact O-CA 3.27Å; V712-S724 WeakPolarHBondContact O-CA 3.44Å; V712-S724 WeakPolarHBondContact O-CB 3.48Å
725	F	85.5	Confident	83.4	Confident	73 Å²	73	73.3 Å²	73.3	32%	0.32	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	147.9	178.2	68.3	-77.8	0	0	0	110.4	W598 V712 P713 V727	W598-F725 HydrophobicContact CD2-CZ 4.46Å; W598-F725 HydrophobicContact CG-CZ 4.23Å; V712-F725 HydrophobicContact CB-CD1 4.33Å; V712-F725 HydrophobicContact CB-CE1 3.87Å; V712-F725 HydrophobicContact CB-CE2 4.42Å; V712-F725 HydrophobicContact CB-CZ 3.92Å; V712-F725 HydrophobicContact CG1-CE1 3.82Å; V712-F725 HydrophobicContact CG1-CZ 3.83Å; V712-F725 PolarHBondContact N-O 2.86Å; V712-F725 VanDerWaalsContact O-CD1 3.29Å; V712-F725 WeakPolarHBondContact O-CD1 3.34Å; V712-F725 PolarHBondContact O-N 2.72Å; P713-F725 WeakPolarHBondContact O-CE1 3.43Å; F725-V727 HydrophobicContact CD2-CG2 3.74Å; F725-V727 HydrophobicContact CE2-CG2 3.34Å; F725-V727 HydrophobicContact CZ-CG2 4.26Å
726	M	86.8	Confident	83.9	Confident	77 Å²	77	62.8 Å²	62.8	38%	0.379	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	132.3	177.2	-168.9	173.8	-64.4	0	0	110.9	V608 L641 R709 L710 V728	V608-M726 HydrophobicContact CB-CE 4.08Å; V608-M726 HydrophobicContact CG1-CE 3.8Å; V608-M726 HydrophobicContact CG2-CE 4.18Å; L641-M726 HydrophobicContact CD2-CE 3.52Å; L641-M726 HydrophobicContact CD2-SD 3.58Å; L641-M726 VanDerWaalsContact CD2-SD 3.58Å; R709-M726 HydrophobicContact CB-SD 4.31Å; L710-M726 CarbonylContact O-C 3.58Å; L710-M726 WeakPolarHBondContact O-CA 3.48Å; M726-V728 HydrophobicContact CG-CG2 4.19Å; M726-V728 HydrophobicContact SD-CG2 4.25Å
727	V	89.4	Confident	84.4	Confident	6 Å²	6	59.8 Å²	59.8	4%	0.036	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	129.8	169	-171.2	0	0	0	0	108.2	E547 W598 L710 V712 F725 F729	E547-V727 HydrophobicContact CG-CG1 4.27Å; W598-V727 HydrophobicContact CZ2-CB 4.43Å; W598-V727 HydrophobicContact CZ2-CG1 4.33Å; W598-V727 HydrophobicContact CZ2-CG2 3.93Å; L710-V727 PolarHBondContact N-O 2.93Å; L710-V727 PolarHBondContact O-N 3.29Å; V712-V727 HydrophobicContact CG2-CG2 4.06Å; F725-V727 HydrophobicContact CD2-CG2 3.74Å; F725-V727 HydrophobicContact CE2-CG2 3.34Å; F725-V727 HydrophobicContact CZ-CG2 4.26Å; V727-F729 HydrophobicContact CB-CE2 4.19Å; V727-F729 HydrophobicContact CG1-CD2 4Å; V727-F729 HydrophobicContact CG1-CE1 4.16Å; V727-F729 HydrophobicContact CG1-CE2 3.47Å; V727-F729 VanDerWaalsContact CG1-CE2 3.47Å; V727-F729 HydrophobicContact CG1-CZ 3.56Å
728	V	90.3	Very high	84.6	Confident	9 Å²	9	56.9 Å²	56.9	6%	0.055	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	118.4	178.3	-176.1	0	0	0	0	108.8	E547 T548 Y550 R707 R709 M726	E547-V728 WeakPolarHBondContact CA-O 3.44Å; T548-V728 PolarHBondContact N-O 3.5Å; Y550-V728 HydrophobicContact CD2-CB 4.46Å; Y550-V728 HydrophobicContact CD2-CG2 4.18Å; Y550-V728 HydrophobicContact CE2-CB 3.8Å; Y550-V728 HydrophobicContact CE2-CG1 3.95Å; Y550-V728 HydrophobicContact CE2-CG2 3.78Å; R707-V728 HydrophobicContact CG-CG1 3.57Å; R709-V728 HydrophobicContact CG-CG1 4.27Å; R709-V728 HydrophobicContact CG-CG2 4.17Å; M726-V728 HydrophobicContact CG-CG2 4.19Å; M726-V728 HydrophobicContact SD-CG2 4.25Å
729	F	91.9	Very high	84.8	Confident	1 Å²	1	47.1 Å²	47.1	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	131.7	175.5	-67	-74	0	0	0	109.7	L545 I546 E547 R562 V564 W598 L708 L710 V727	L545-F729 HydrophobicContact CB-CB 4.1Å; L545-F729 HydrophobicContact CB-CD1 3.62Å; L545-F729 HydrophobicContact CB-CE1 4.34Å; L545-F729 HydrophobicContact CB-CG 4.12Å; L545-F729 HydrophobicContact CD1-CB 3.88Å; L545-F729 HydrophobicContact CD1-CD1 4.11Å; L545-F729 HydrophobicContact CD1-CD2 4.37Å; L545-F729 HydrophobicContact CD1-CG 3.89Å; I546-F729 WeakPolarHBondContact O-CA 3.36Å; E547-F729 HydrophobicContact CB-CD1 4.16Å; E547-F729 HydrophobicContact CB-CE1 4Å; R562-F729 HydrophobicContact CB-CE1 4.04Å; R562-F729 HydrophobicContact CG-CE1 4.06Å; V564-F729 HydrophobicContact CG2-CD1 4.4Å; V564-F729 HydrophobicContact CG2-CE1 3.69Å; V564-F729 HydrophobicContact CG2-CE2 4.48Å; V564-F729 HydrophobicContact CG2-CZ 3.74Å; W598-F729 HydrophobicContact CZ2-CE2 4.33Å; W598-F729 HydrophobicContact CZ2-CZ 4.13Å; L708-F729 HydrophobicContact CB-CB 4.32Å; L708-F729 HydrophobicContact CD2-CD2 4.45Å; L708-F729 PolarHBondContact N-O 3.41Å; L708-F729 PolarHBondContact O-N 3.44Å; L708-F729 VanDerWaalsContact O-O 3.14Å; L710-F729 HydrophobicContact CD1-CD2 4.34Å; L710-F729 HydrophobicContact CD1-CE2 4.15Å; V727-F729 HydrophobicContact CB-CE2 4.19Å; V727-F729 HydrophobicContact CG1-CD2 4Å; V727-F729 HydrophobicContact CG1-CE1 4.16Å; V727-F729 HydrophobicContact CG1-CE2 3.47Å; V727-F729 VanDerWaalsContact CG1-CE2 3.47Å; V727-F729 HydrophobicContact CG1-CZ 3.56Å
730	N	90.3	Very high	85.3	Confident	43 Å²	43	43.6 Å²	43.6	23%	0.23	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	132.2	161.3	-51.4	-53.7	0	0	0	108.5	I546 T548 C706 R707	I546-N730 HydrophobicContact CB-CB 4.49Å; I546-N730 PolarHBondContact N-O 3.2Å; I546-N730 VanDerWaalsContact N-O 3.17Å; I546-N730 PolarHBondContact O-N 2.86Å; T548-N730 PolarHBondContact OG1-ND2 3Å; C706-N730 CarbonylContact O-C 3.59Å; C706-N730 WeakPolarHBondContact O-CA 3.34Å; R707-N730 PolarHBondContact NE-OD1 3.38Å
731	T	91.3	Very high	85.9	Confident	11 Å²	11	41 Å²	41	7%	0.067	22%	0.222	C	C	.	.			trans	-90.8	154.6	176.2	57.5	0	0	0	0	110.3	L545 C706 L708 N733 S736 K737	L545-T731 HydrophobicContact CD2-CG2 3.96Å; C706-T731 VanDerWaalsContact CA-OG1 3.3Å; C706-T731 WeakPolarHBondContact CA-OG1 3.4Å; C706-T731 PolarHBondContact O-N 2.6Å; C706-T731 PolarHBondContact O-OG1 3.22Å; L708-T731 HydrophobicContact CB-CG2 4.48Å; T731-N733 VanDerWaalsContact C-N 3.27Å; T731-N733 PolarHBondContact O-N 3.31Å; T731-N733 PolarHBondContact OG1-O 2.94Å; T731-S736 VanDerWaalsContact CB-OG 3.31Å; T731-S736 WeakPolarHBondContact CB-OG 3.3Å; T731-S736 WeakPolarHBondContact CG2-OG 3.41Å; T731-K737 HydrophobicContact CG2-CB 4.06Å
732	P	87.5	Confident	86.5	Confident	67 Å²	67	33.3 Å²	33.3	44%	0.435	19%	0.193	S	C	.	.	S	Bend	trans	-64.5	-30.9	180	24.5	-34	0	0	0	113.2	E543 R1122	E543-P732 WeakPolarHBondContact OE1-CD 3.46Å; E543-P732 WeakPolarHBondContact OE1-CG 3.4Å; P732-R1122 PolarHBondContact O-NH1 3.05Å
733	N	86.3	Confident	87.2	Confident	64 Å²	64	31.5 Å²	31.5	34%	0.342	17%	0.17	S	C	.	.	S	Bend	trans	-149.1	173.8	179.9	63.9	21.9	0	0	0	111.2	C706 T731 L735 S736	C706-N733 VanDerWaalsContact SG-C 3.57Å; T731-N733 VanDerWaalsContact C-N 3.27Å; T731-N733 PolarHBondContact O-N 3.31Å; T731-N733 PolarHBondContact OG1-O 2.94Å; N733-L735 PolarHBondContact OD1-N 3.05Å; N733-S736 VanDerWaalsContact OD1-CB 3.3Å; N733-S736 WeakPolarHBondContact OD1-CB 3.29Å; N733-S736 PolarHBondContact OD1-N 2.99Å
734	P	83.7	Confident	87.6	Confident	8 Å²	8	28.4 Å²	28.4	5%	0.052	15%	0.151	C	C	.	.	H	α-helix	trans	-62.7	-40.2	175.8	-25.8	36.8	0	0	0	113.5	K705 S736 K737 I738 F808	K705-P734 HydrophobicContact CB-CG 4.49Å; P734-S736 VanDerWaalsContact C-N 3.32Å; P734-S736 PolarHBondContact O-N 3.17Å; P734-K737 WeakPolarHBondContact O-CB 3.48Å; P734-K737 PolarHBondContact O-N 3.07Å; P734-I738 WeakPolarHBondContact O-CG1 3.47Å; P734-I738 PolarHBondContact O-N 3.36Å; P734-F808 HydrophobicContact CB-CE1 3.92Å; P734-F808 HydrophobicContact CB-CZ 4.02Å
735	L	86	Confident	87.8	Confident	29 Å²	29	27.5 Å²	27.5	15%	0.152	14%	0.141	C	C	.	.	H	α-helix	trans	-58.6	-39.5	-178.7	-68.4	175.1	0	0	0	113	N733 I738 S739 L1120 D1229 V1231 V1274	N733-L735 PolarHBondContact OD1-N 3.05Å; L735-I738 WeakPolarHBondContact O-CB 3.49Å; L735-I738 PolarHBondContact O-N 3.33Å; L735-S739 WeakPolarHBondContact O-CB 3.43Å; L735-S739 PolarHBondContact O-N 2.88Å; L735-L1120 HydrophobicContact CD2-CD1 4.05Å; L735-L1120 HydrophobicContact CD2-CD2 3.37Å; L735-L1120 HydrophobicContact CD2-CG 4.31Å; L735-L1120 HydrophobicContact CG-CD2 4Å; L735-D1229 HydrophobicContact CD1-CB 4.26Å; L735-V1231 HydrophobicContact CD2-CG2 3.39Å; L735-V1274 HydrophobicContact CD1-CG1 4.46Å; L735-V1274 HydrophobicContact CD2-CG1 3.91Å
736	S	88.1	Confident	87.8	Confident	8 Å²	8	24.3 Å²	24.3	6%	0.056	13%	0.127	C	C	.	.	H	α-helix	trans	-60.2	-46.6	173.3	160.1	0	0	0	0	111.1	E543 T731 N733 P734 I738 S739 W740	E543-S736 WeakPolarHBondContact OE1-CB 3.41Å; E543-S736 PolarHBondContact OE1-OG 2.81Å; E543-S736 VanDerWaalsContact OE1-OG 3.07Å; E543-S736 PolarHBondContact OE2-OG 2.93Å; T731-S736 VanDerWaalsContact CB-OG 3.31Å; T731-S736 WeakPolarHBondContact CB-OG 3.3Å; T731-S736 WeakPolarHBondContact CG2-OG 3.41Å; N733-S736 VanDerWaalsContact OD1-CB 3.3Å; N733-S736 WeakPolarHBondContact OD1-CB 3.29Å; N733-S736 PolarHBondContact OD1-N 2.99Å; P734-S736 VanDerWaalsContact C-N 3.32Å; P734-S736 PolarHBondContact O-N 3.17Å; S736-I738 VanDerWaalsContact C-N 3.31Å; S736-I738 PolarHBondContact O-N 2.94Å; S736-S739 PolarHBondContact O-N 3.2Å; S736-W740 PolarHBondContact O-N 3.38Å
737	K	88	Confident	87.9	Confident	21 Å²	21	20.6 Å²	20.6	9%	0.091	11%	0.108	C	C	.	.	H	α-helix	trans	-58.9	-45.4	176.3	-173.7	-167.4	171.7	-170.1	0	110.9	N704 K705 R707 T731 P734 S739 W740 V741 F808	N704-K737 PolarHBondContact O-NZ 3.21Å; K705-K737 WeakPolarHBondContact O-CD 3.12Å; R707-K737 WeakPolarHBondContact O-CE 3.46Å; T731-K737 HydrophobicContact CG2-CB 4.06Å; P734-K737 WeakPolarHBondContact O-CB 3.48Å; P734-K737 PolarHBondContact O-N 3.07Å; K737-S739 PolarHBondContact O-N 3.18Å; K737-W740 PolarHBondContact O-N 3.01Å; K737-V741 HydrophobicContact CG-CG2 4.33Å; K737-V741 WeakPolarHBondContact O-CG2 3.13Å; K737-V741 PolarHBondContact O-N 3.32Å; K737-F808 HydrophobicContact CD-CD1 4.27Å; K737-F808 WeakPolarHBondContact CE-O 3.37Å; K737-F808 PolarHBondContact NZ-O 2.92Å
738	I	85.4	Confident	87.8	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.6	-48.7	177.3	-67.6	170.5	0	0	0	110.9	P734 L735 S736 W740 N742 G807 F808 L1115 L1120 V1231 L1272	P734-I738 WeakPolarHBondContact O-CG1 3.47Å; P734-I738 PolarHBondContact O-N 3.36Å; L735-I738 WeakPolarHBondContact O-CB 3.49Å; L735-I738 PolarHBondContact O-N 3.33Å; S736-I738 VanDerWaalsContact C-N 3.31Å; S736-I738 PolarHBondContact O-N 2.94Å; I738-W740 PolarHBondContact O-N 3.33Å; I738-N742 VanDerWaalsContact O-CB 3.26Å; I738-N742 WeakPolarHBondContact O-CB 3.38Å; I738-N742 PolarHBondContact O-N 2.97Å; I738-G807 WeakPolarHBondContact CA-O 3.38Å; I738-F808 HydrophobicContact CD1-CE1 4.35Å; I738-F808 HydrophobicContact CD1-CE2 4.04Å; I738-F808 HydrophobicContact CD1-CZ 3.96Å; I738-F808 HydrophobicContact CG1-CD1 4.49Å; I738-F808 HydrophobicContact CG1-CE1 4.42Å; I738-F808 HydrophobicContact CG1-CZ 4.48Å; I738-L1115 HydrophobicContact CD1-CD2 3.71Å; I738-L1120 HydrophobicContact CD1-CD2 4.12Å; I738-V1231 HydrophobicContact CD1-CG2 4.34Å; I738-V1231 HydrophobicContact CG2-CG1 4.03Å; I738-L1272 HydrophobicContact CG2-CD1 3.57Å
739	S	87.4	Confident	87.6	Confident	23 Å²	23	23.2 Å²	23.2	16%	0.161	12%	0.119	C	C	.	.	H	α-helix	trans	-60.4	-44.2	176.5	-171.4	0	0	0	0	112.2	L735 S736 K737 R743	L735-S739 WeakPolarHBondContact O-CB 3.43Å; L735-S739 PolarHBondContact O-N 2.88Å; S736-S739 PolarHBondContact O-N 3.2Å; K737-S739 PolarHBondContact O-N 3.18Å; S739-R743 VanDerWaalsContact O-CB 3.25Å; S739-R743 WeakPolarHBondContact O-CB 3.25Å; S739-R743 VanDerWaalsContact O-CG 3.27Å; S739-R743 WeakPolarHBondContact O-CG 3.47Å; S739-R743 PolarHBondContact O-N 3.15Å; S739-R743 PolarHBondContact OG-NE 3.36Å
740	W	89.4	Confident	87.4	Confident	2 Å²	2	24 Å²	24	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-62.6	-50	177.6	-87.3	100.8	0	0	0	113	L541 E543 L545 V564 L566 L571 L708 S736 K737 I738 L744	L541-W740 HydrophobicContact CD2-CB 4.45Å; L541-W740 HydrophobicContact CD2-CD2 3.44Å; L541-W740 VanDerWaalsContact CD2-CD2 3.44Å; L541-W740 HydrophobicContact CD2-CE3 3.92Å; L541-W740 HydrophobicContact CD2-CG 3.73Å; L541-W740 HydrophobicContact CD2-CH2 4.19Å; L541-W740 HydrophobicContact CD2-CZ2 3.77Å; L541-W740 HydrophobicContact CD2-CZ3 4.28Å; L541-W740 HydrophobicContact CG-CD2 4.47Å; L541-W740 HydrophobicContact CG-CH2 4.28Å; L541-W740 HydrophobicContact CG-CZ2 3.93Å; E543-W740 HydrophobicContact CB-CZ2 3.84Å; E543-W740 PolarHBondContact OE2-NE1 3.13Å; L545-W740 HydrophobicContact CD1-CD2 4.28Å; L545-W740 HydrophobicContact CD1-CZ2 4.12Å; V564-W740 HydrophobicContact CB-CH2 3.71Å; V564-W740 HydrophobicContact CB-CZ2 4.04Å; V564-W740 HydrophobicContact CB-CZ3 4.48Å; V564-W740 HydrophobicContact CG1-CH2 3.52Å; V564-W740 HydrophobicContact CG1-CZ2 4.29Å; V564-W740 HydrophobicContact CG1-CZ3 3.85Å; L566-W740 HydrophobicContact CB-CH2 4.3Å; L566-W740 HydrophobicContact CB-CZ3 3.9Å; L571-W740 HydrophobicContact CD1-CZ3 3.94Å; L708-W740 HydrophobicContact CD1-CB 4.4Å; L708-W740 HydrophobicContact CD2-CB 3.79Å; L708-W740 HydrophobicContact CD2-CD2 4.24Å; L708-W740 HydrophobicContact CD2-CE3 4.44Å; L708-W740 HydrophobicContact CD2-CG 3.94Å; S736-W740 PolarHBondContact O-N 3.38Å; K737-W740 PolarHBondContact O-N 3.01Å; I738-W740 PolarHBondContact O-N 3.33Å; W740-L744 WeakPolarHBondContact O-CB 3.33Å; W740-L744 PolarHBondContact O-N 2.98Å; W740-L744 VanDerWaalsContact O-N 3.1Å
741	V	87.8	Confident	87.3	Confident	2 Å²	2	24.7 Å²	24.7	1%	0.012	13%	0.129	C	C	.	.	H	α-helix	trans	-67.6	-43.5	-177.8	-174.5	0	0	0	0	110.4	V607 L708 K737 H745 T813	V607-V741 HydrophobicContact CG1-CG1 4.2Å; V607-V741 HydrophobicContact CG1-CG2 4.26Å; V607-V741 HydrophobicContact CG2-CG1 4.33Å; L708-V741 HydrophobicContact CD1-CG2 3.6Å; K737-V741 HydrophobicContact CG-CG2 4.33Å; K737-V741 WeakPolarHBondContact O-CG2 3.13Å; K737-V741 PolarHBondContact O-N 3.32Å; V741-H745 WeakPolarHBondContact O-CB 3.42Å; V741-H745 PolarHBondContact O-N 3.05Å; V741-T813 HydrophobicContact CB-CG2 3.93Å; V741-T813 HydrophobicContact CG1-CG2 3.51Å; V741-T813 WeakPolarHBondContact CG1-OG1 3.41Å
742	N	86.5	Confident	87.1	Confident	5 Å²	5	28.8 Å²	28.8	3%	0.027	14%	0.143	C	C	.	.	H	α-helix	trans	-66.6	-46	179.2	175.5	-101.4	0	0	0	113.3	I738 L744 H745 L746 L1272	I738-N742 VanDerWaalsContact O-CB 3.26Å; I738-N742 WeakPolarHBondContact O-CB 3.38Å; I738-N742 PolarHBondContact O-N 2.97Å; N742-L744 VanDerWaalsContact C-N 3.34Å; N742-L744 PolarHBondContact O-N 2.97Å; N742-H745 WeakPolarHBondContact O-CB 3.32Å; N742-H745 PolarHBondContact O-N 3.17Å; N742-L746 PolarHBondContact O-N 3.31Å; N742-L746 VanDerWaalsContact OD1-CD1 3.24Å; N742-L746 WeakPolarHBondContact OD1-CD1 3.41Å; N742-L1272 HydrophobicContact CB-CD1 3.53Å; N742-L1272 HydrophobicContact CB-CG 4.12Å; N742-L1272 VanDerWaalsContact CG-CD1 3.48Å; N742-L1272 VanDerWaalsContact CG-CG 3.47Å; N742-L1272 WeakPolarHBondContact OD1-CG 3.41Å
743	R	87	Confident	87	Confident	89 Å²	89	32.2 Å²	32.2	34%	0.336	15%	0.153	S	C	.	.	H	α-helix	trans	-67.1	-35.4	179.5	-69.5	178.3	-172.5	-108	-12.3	112.1	V540 L566 S739 H745 L746 A747	V540-R743 HydrophobicContact CG1-CB 4.12Å; V540-R743 HydrophobicContact CG1-CG 4.44Å; V540-R743 PolarHBondContact O-NH1 3.43Å; L566-R743 HydrophobicContact CD2-CB 3.7Å; S739-R743 VanDerWaalsContact O-CB 3.25Å; S739-R743 WeakPolarHBondContact O-CB 3.25Å; S739-R743 VanDerWaalsContact O-CG 3.27Å; S739-R743 WeakPolarHBondContact O-CG 3.47Å; S739-R743 PolarHBondContact O-N 3.15Å; S739-R743 PolarHBondContact OG-NE 3.36Å; R743-H745 VanDerWaalsContact C-N 3.35Å; R743-L746 PolarHBondContact O-N 2.94Å; R743-A747 WeakPolarHBondContact O-CB 3.44Å; R743-A747 PolarHBondContact O-N 3.03Å
744	L	88.7	Confident	86.9	Confident	4 Å²	4	31.8 Å²	31.8	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-65.8	-37.5	172.8	-170.6	157	0	0	0	111.5	L602 V605 V607 L710 W740 N742 K748	L602-L744 HydrophobicContact CD2-CG 4.47Å; V605-L744 HydrophobicContact CG1-CD1 4.16Å; V607-L744 HydrophobicContact CG2-CD1 4.27Å; V607-L744 HydrophobicContact CG2-CD2 4.01Å; L710-L744 HydrophobicContact CD1-CD1 4.5Å; L710-L744 HydrophobicContact CD2-CD1 3.88Å; W740-L744 WeakPolarHBondContact O-CB 3.33Å; W740-L744 PolarHBondContact O-N 2.98Å; W740-L744 VanDerWaalsContact O-N 3.1Å; N742-L744 VanDerWaalsContact C-N 3.34Å; N742-L744 PolarHBondContact O-N 2.97Å; L744-K748 HydrophobicContact CD2-CD 4.21Å; L744-K748 WeakPolarHBondContact O-CG 3.31Å; L744-K748 PolarHBondContact O-N 2.85Å
745	H	85.9	Confident	87.1	Confident	36 Å²	36	32.1 Å²	32.1	17%	0.167	15%	0.151	C	C	.	.	H	α-helix	trans	-65.8	-49.6	173.3	-169.1	110.2	0	0	0	112	V741 N742 R743 A747 K748 I749 T813 S814	V741-H745 WeakPolarHBondContact O-CB 3.42Å; V741-H745 PolarHBondContact O-N 3.05Å; N742-H745 WeakPolarHBondContact O-CB 3.32Å; N742-H745 PolarHBondContact O-N 3.17Å; R743-H745 VanDerWaalsContact C-N 3.35Å; H745-A747 VanDerWaalsContact C-N 3.32Å; H745-A747 PolarHBondContact O-N 3.31Å; H745-K748 WeakPolarHBondContact O-CB 3.37Å; H745-K748 PolarHBondContact O-N 2.8Å; H745-I749 PolarHBondContact O-N 2.89Å; H745-T813 VanDerWaalsContact CG-O 3.24Å; H745-T813 PolarHBondContact ND1-O 2.91Å; H745-S814 WeakPolarHBondContact NE2-CB 3.25Å; H745-S814 PolarHBondContact NE2-OG 2.93Å
746	L	86.7	Confident	86.7	Confident	5 Å²	5	33.3 Å²	33.3	3%	0.026	16%	0.161	C	C	.	.	H	α-helix	trans	-58.7	-41.2	177.3	-76.9	165.7	0	0	0	112	N742 R743 K748 I749 A750 F772 L776 Q1269 P1271	N742-L746 PolarHBondContact O-N 3.31Å; N742-L746 VanDerWaalsContact OD1-CD1 3.24Å; N742-L746 WeakPolarHBondContact OD1-CD1 3.41Å; R743-L746 PolarHBondContact O-N 2.94Å; L746-K748 VanDerWaalsContact C-N 3.32Å; L746-K748 PolarHBondContact O-N 2.69Å; L746-I749 PolarHBondContact O-N 3.18Å; L746-A750 PolarHBondContact O-N 3.16Å; L746-F772 HydrophobicContact CB-CD1 4.49Å; L746-F772 HydrophobicContact CB-CE1 4.26Å; L746-L776 HydrophobicContact CB-CD1 4.39Å; L746-L776 HydrophobicContact CD2-CD1 4.04Å; L746-L776 WeakPolarHBondContact O-CD1 3.4Å; L746-Q1269 HydrophobicContact CD2-CB 4.47Å; L746-Q1269 VanDerWaalsContact CD2-CD 3.46Å; L746-Q1269 HydrophobicContact CD2-CG 4.2Å; L746-P1271 HydrophobicContact CD1-CB 4.45Å
747	A	87.6	Confident	86.1	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-60.2	-41.6	177.8	0	0	0	0	0	112.2	L602 R743 H745 I749 A750 L751 F772	L602-A747 HydrophobicContact CD1-CB 3.89Å; R743-A747 WeakPolarHBondContact O-CB 3.44Å; R743-A747 PolarHBondContact O-N 3.03Å; H745-A747 VanDerWaalsContact C-N 3.32Å; H745-A747 PolarHBondContact O-N 3.31Å; A747-I749 VanDerWaalsContact C-N 3.28Å; A747-I749 PolarHBondContact O-N 3.02Å; A747-A750 PolarHBondContact O-N 3.03Å; A747-L751 WeakPolarHBondContact O-CG 3.42Å; A747-L751 PolarHBondContact O-N 3.25Å; A747-L751 VanDerWaalsContact O-N 3.08Å; A747-F772 HydrophobicContact CB-CE1 3.84Å; A747-F772 HydrophobicContact CB-CZ 3.6Å
748	K	87.7	Confident	85.7	Confident	67 Å²	67	40 Å²	40	29%	0.291	19%	0.186	S	C	.	.	H	α-helix	trans	-64.8	-27.9	173.7	-70.8	175.8	167.6	-164.8	0	114	L602 V605 L744 H745 L746	L602-K748 WeakPolarHBondContact O-CE 3.46Å; V605-K748 WeakPolarHBondContact O-CE 3.41Å; V605-K748 PolarHBondContact O-NZ 2.97Å; L744-K748 HydrophobicContact CD2-CD 4.21Å; L744-K748 WeakPolarHBondContact O-CG 3.31Å; L744-K748 PolarHBondContact O-N 2.85Å; H745-K748 WeakPolarHBondContact O-CB 3.37Å; H745-K748 PolarHBondContact O-N 2.8Å; L746-K748 VanDerWaalsContact C-N 3.32Å; L746-K748 PolarHBondContact O-N 2.69Å
749	I	87.3	Confident	85.7	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	19%	0.189	C	C	.	.	H	α-helix	trans	-75.5	-42.5	173.8	-65	177.4	0	0	0	110.1	H745 L746 A747 L751 R752 N755 L776 L777 A778 Q1269	H745-I749 PolarHBondContact O-N 2.89Å; L746-I749 PolarHBondContact O-N 3.18Å; A747-I749 VanDerWaalsContact C-N 3.28Å; A747-I749 PolarHBondContact O-N 3.02Å; I749-L751 PolarHBondContact O-N 3.15Å; I749-R752 WeakPolarHBondContact O-CB 3.5Å; I749-R752 WeakPolarHBondContact O-CG 3.37Å; I749-R752 PolarHBondContact O-N 2.91Å; I749-R752 VanDerWaalsContact O-N 3.11Å; I749-N755 WeakPolarHBondContact CG2-ND2 3.21Å; I749-N755 PolarHBondContact O-ND2 2.82Å; I749-L776 HydrophobicContact CB-CD1 4.36Å; I749-L776 HydrophobicContact CG2-CB 3.76Å; I749-L776 HydrophobicContact CG2-CD1 4.32Å; I749-L777 WeakPolarHBondContact CG2-O 3.2Å; I749-A778 HydrophobicContact CD1-CB 3.99Å; I749-Q1269 VanDerWaalsContact CD1-OE1 3.31Å
750	A	87.6	Confident	85.4	Confident	18 Å²	18	40.9 Å²	40.9	15%	0.149	19%	0.188	C	C	.	.	H	α-helix	trans	-60	-33.2	176.9	0	0	0	0	0	112.9	L746 A747 R752 F772 L776	L746-A750 PolarHBondContact O-N 3.16Å; A747-A750 PolarHBondContact O-N 3.03Å; A750-R752 VanDerWaalsContact C-N 3.27Å; A750-R752 PolarHBondContact O-N 3.22Å; A750-F772 HydrophobicContact CB-CZ 4.45Å; A750-L776 HydrophobicContact CB-CD1 3.89Å; A750-L776 HydrophobicContact CB-CD2 4.17Å
751	L	87.8	Confident	84.6	Confident	58 Å²	58	44.6 Å²	44.6	30%	0.304	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-3.1	176.6	-70.9	174.3	0	0	0	115.3	D568 D569 L602 Q603 A747 I749	D568-L751 WeakPolarHBondContact O-CD1 3.44Å; D568-L751 WeakPolarHBondContact O-CG 3.37Å; D569-L751 HydrophobicContact CB-CD2 4.18Å; L602-L751 HydrophobicContact CB-CD1 4.03Å; Q603-L751 HydrophobicContact CG-CD1 4.21Å; A747-L751 WeakPolarHBondContact O-CG 3.42Å; A747-L751 PolarHBondContact O-N 3.25Å; A747-L751 VanDerWaalsContact O-N 3.08Å; I749-L751 PolarHBondContact O-N 3.15Å
752	R	87.1	Confident	83.4	Confident	96 Å²	96	45.8 Å²	45.8	36%	0.362	21%	0.214	S	C	.	.	S	Bend	trans	-81.5	157.8	177.6	-53.7	-173.3	-169	166	7.9	112.1	I749 A750 E754 N755 S756 A778	I749-R752 WeakPolarHBondContact O-CB 3.5Å; I749-R752 WeakPolarHBondContact O-CG 3.37Å; I749-R752 PolarHBondContact O-N 2.91Å; I749-R752 VanDerWaalsContact O-N 3.11Å; A750-R752 VanDerWaalsContact C-N 3.27Å; A750-R752 PolarHBondContact O-N 3.22Å; R752-E754 VanDerWaalsContact C-N 3.3Å; R752-E754 WeakPolarHBondContact CB-OE2 3.4Å; R752-E754 PolarHBondContact O-N 3.48Å; R752-N755 PolarHBondContact O-N 2.77Å; R752-N755 VanDerWaalsContact O-N 3.11Å; R752-S756 PolarHBondContact O-N 3.22Å; R752-A778 PolarHBondContact NH1-O 3.12Å; R752-A778 PolarHBondContact NH2-O 3.42Å
753	E	84.8	Confident	81.9	Confident	139 Å²	139	53.2 Å²	53.2	65%	0.65	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-37.4	-174.7	-150.8	-152.2	129.8	0	0	112.4	N755 S756 R1245	E753-N755 PolarHBondContact O-N 2.99Å; E753-S756 WeakPolarHBondContact O-CB 3.44Å; E753-S756 PolarHBondContact O-N 3.03Å; E753-S756 VanDerWaalsContact O-N 3.12Å; E753-S756 PolarHBondContact O-OG 2.97Å; E753-R1245 PolarHBondContact O-NH1 3.47Å; E753-R1245 PolarHBondContact O-NH2 2.89Å; E753-R1245 IonicContact OE1-CZ 3.49Å; E753-R1245 IonicContact OE1-NH1 3.28Å; E753-R1245 PolarHBondContact OE1-NH1 3.3Å
754	E	84.5	Confident	79.9	Confident	55 Å²	55	55.4 Å²	55.4	26%	0.257	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-28.5	179.8	-43.2	89.9	147.7	0	0	112.4	R752 L777 N1099	R752-E754 VanDerWaalsContact C-N 3.3Å; R752-E754 WeakPolarHBondContact CB-OE2 3.4Å; R752-E754 PolarHBondContact O-N 3.48Å; E754-L777 HydrophobicContact CB-CD2 4.12Å; E754-N1099 PolarHBondContact O-ND2 3.26Å
755	N	87.9	Confident	77.6	Confident	16 Å²	16	63.5 Å²	63.5	9%	0.086	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-12.5	177	-65.3	-60.4	0	0	0	113	I749 R752 E753 R757 G758 L776 L777	I749-N755 WeakPolarHBondContact CG2-ND2 3.21Å; I749-N755 PolarHBondContact O-ND2 2.82Å; R752-N755 PolarHBondContact O-N 2.77Å; R752-N755 VanDerWaalsContact O-N 3.11Å; E753-N755 PolarHBondContact O-N 2.99Å; N755-R757 PolarHBondContact O-N 3.33Å; N755-G758 PolarHBondContact O-N 2.97Å; N755-L776 HydrophobicContact CB-CD2 4.44Å; N755-L777 PolarHBondContact ND2-O 2.89Å; N755-L777 PolarHBondContact OD1-N 2.9Å
756	S	78.6	Confident	75.4	Confident	53 Å²	53	65.4 Å²	65.4	37%	0.371	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	109.8	171.5	72.5	0	0	0	0	110.1	R752 E753 G758 R1245	R752-S756 PolarHBondContact O-N 3.22Å; E753-S756 WeakPolarHBondContact O-CB 3.44Å; E753-S756 PolarHBondContact O-N 3.03Å; E753-S756 VanDerWaalsContact O-N 3.12Å; E753-S756 PolarHBondContact O-OG 2.97Å; S756-G758 PolarHBondContact O-N 3.01Å; S756-R1245 PolarHBondContact O-NH2 3.14Å; S756-R1245 PolarHBondContact OG-NH2 3.25Å
757	R	75.2	Confident	73.4	Confident	166 Å²	166	74.3 Å²	74.3	63%	0.626	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	33.7	-168.6	-57.8	179.3	67	-149.6	-8.5	113.8	N755 W759 L1098 E1248	N755-R757 PolarHBondContact O-N 3.33Å; R757-W759 PolarHBondContact O-N 2.75Å; R757-L1098 WeakPolarHBondContact O-CD1 3.42Å; R757-E1248 IonicContact CZ-OE1 3.5Å; R757-E1248 IonicContact CZ-OE2 3.69Å; R757-E1248 VanDerWaalsContact CZ-OE2 3.28Å; R757-E1248 IonicContact NH1-OE1 3.26Å; R757-E1248 IonicContact NH1-OE2 3.95Å; R757-E1248 PolarHBondContact NH1-OE2 2.91Å; R757-E1248 IonicContact NH2-OE1 2.83Å; R757-E1248 PolarHBondContact NH2-OE1 3.06Å; R757-E1248 IonicContact NH2-OE2 3.61Å; R757-E1248 PolarHBondContact NH2-OE2 3.37Å
758	G	79.3	Confident	71.3	Confident	4 Å²	4	78.9 Å²	78.9	4%	0.041	40%	0.401	C	S	.	.			trans	-58.9	-15.5	-170.4	0	0	0	0	0	117	N755 S756 L1098	N755-G758 PolarHBondContact O-N 2.97Å; S756-G758 PolarHBondContact O-N 3.01Å; G758-L1098 PolarHBondContact O-N 3.46Å
759	W	85.6	Confident	69.4	Low	17 Å²	17	80 Å²	80	6%	0.064	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	136.7	173.9	-63.8	86.3	0	0	0	111.3	R757 C774 P775 W1068 I1076 T1078 M1095 I1096 S1097 W1268	R757-W759 PolarHBondContact O-N 2.75Å; W759-C774 HydrophobicContact CG-CB 4.2Å; W759-P775 HydrophobicContact CZ2-CB 4.09Å; W759-P775 HydrophobicContact CZ2-CG 3.92Å; W759-P775 PolarHBondContact NE1-O 2.83Å; W759-W1068 HydrophobicContact CH2-CH2 4.37Å; W759-W1068 HydrophobicContact CH2-CZ3 4.08Å; W759-W1068 HydrophobicContact CZ2-CH2 4.3Å; W759-W1068 HydrophobicContact CZ2-CZ3 4.38Å; W759-I1076 HydrophobicContact CH2-CG2 4.31Å; W759-T1078 HydrophobicContact CH2-CG2 3.64Å; W759-T1078 HydrophobicContact CZ3-CG2 3.93Å; W759-T1078 WeakPolarHBondContact CZ3-OG1 3.25Å; W759-M1095 HydrophobicContact CD2-CB 4.36Å; W759-M1095 HydrophobicContact CE3-CB 3.69Å; W759-M1095 HydrophobicContact CZ3-CB 4.37Å; W759-I1096 CarbonylContact C-O 3.59Å; W759-I1096 WeakPolarHBondContact CA-O 3.45Å; W759-S1097 VanDerWaalsContact CE3-N 3.33Å; W759-W1268 AromaticContact CE2-CZ3 3.76Å; W759-W1268 HydrophobicContact CZ2-CD2 4.46Å; W759-W1268 AromaticContact CZ2-CE3 3.84Å; W759-W1268 HydrophobicContact CZ2-CE3 3.84Å; W759-W1268 AromaticContact CZ2-CH2 3.94Å; W759-W1268 HydrophobicContact CZ2-CH2 3.94Å; W759-W1268 AromaticContact CZ2-CZ3 3.55Å; W759-W1268 HydrophobicContact CZ2-CZ3 3.55Å; W759-W1268 AromaticContact NE1-CZ3 3.65Å
760	L	81.1	Confident	67.7	Low	25 Å²	25	82.1 Å²	82.1	13%	0.131	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	144.5	165	-64.3	179.1	0	0	0	110.4	M1095 I1096 L1098	L760-M1095 CarbonylContact O-C 3.59Å; L760-M1095 VanDerWaalsContact O-CA 3.3Å; L760-M1095 WeakPolarHBondContact O-CA 3.42Å; L760-I1096 PolarHBondContact N-O 2.65Å; L760-I1096 PolarHBondContact O-N 3.4Å; L760-L1098 HydrophobicContact CD1-CD2 3.64Å; L760-L1098 HydrophobicContact CD2-CD2 4.16Å; L760-L1098 HydrophobicContact CG-CD2 3.6Å; L760-L1098 HydrophobicContact CG-CG 4.18Å
761	Y	72.9	Confident	65.9	Low	80 Å²	80	83.7 Å²	83.7	31%	0.314	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	145.9	172.8	-67	-101.9	0	0	0	109.3	E763 I769 M1095	Y761-E763 PolarHBondContact O-N 2.93Å; Y761-I769 HydrophobicContact CD1-CD1 3.63Å; Y761-I769 HydrophobicContact CE1-CD1 3.42Å; Y761-I769 VanDerWaalsContact CE1-CD1 3.42Å; Y761-I769 HydrophobicContact CE1-CG2 4.42Å; Y761-I769 HydrophobicContact CE2-CD1 4.45Å; Y761-I769 HydrophobicContact CG-CD1 4.24Å; Y761-M1095 HydrophobicContact CD1-CG 3.77Å; Y761-M1095 HydrophobicContact CD1-SD 4.26Å; Y761-M1095 HydrophobicContact CE1-CG 3.47Å; Y761-M1095 VanDerWaalsContact CE1-CG 3.47Å; Y761-M1095 HydrophobicContact CE1-SD 3.35Å; Y761-M1095 WeakPolarHBondContact CE1-SD 3.06Å; Y761-M1095 VanDerWaalsContact CZ-SD 3.55Å; Y761-M1095 PolarHBondContact OH-SD 3.05Å; Y761-M1095 VanDerWaalsContact OH-SD 3.4Å
762	G	62.7	Low	64.3	Low	26 Å²	26	82.4 Å²	82.4	27%	0.268	42%	0.423	S	S	.	.			trans	-63.8	124	170.6	0	0	0	0	0	111.1	D764 K1093	G762-D764 PolarHBondContact O-N 2.81Å; G762-K1093 WeakPolarHBondContact O-CD 3.39Å
763	E	54.2	Low	63.1	Low	162 Å²	162	81.1 Å²	81.1	76%	0.757	43%	0.429	S	S	*	.			trans	-43.4	124.7	-167.3	-58.7	179.6	131.1	0	0	114.9	Y761 L1047 K1093	Y761-E763 PolarHBondContact O-N 2.93Å; E763-L1047 HydrophobicContact CG-CD2 4.32Å; E763-K1093 PolarHBondContact O-NZ 2.86Å
764	D	44.8	Very low	62.7	Low	134 Å²	134	75.3 Å²	75.3	72%	0.717	40%	0.403	S	S	*	.			trans	-156.4	166.9	144.8	-113.5	-41.4	0	0	0	111.1	G762 G766 K1093	G762-D764 PolarHBondContact O-N 2.81Å; D764-G766 PolarHBondContact O-N 3.05Å; D764-K1093 VanDerWaalsContact CG-NZ 3.27Å; D764-K1093 IonicContact OD2-NZ 3.86Å; D764-K1093 PolarHBondContact OD2-NZ 3.25Å
765	E	40.8	Very low	62.9	Low	174 Å²	174	72.7 Å²	72.7	81%	0.813	39%	0.391	S	S	*	.	S	Bend	trans	-48	108.8	-161.7	-58.1	-169.8	154.9	0	0	117.8	K767	E765-K767 VanDerWaalsContact C-N 3.25Å; E765-K767 PolarHBondContact O-N 3.23Å
766	G	39.6	Very low	63	Low	76 Å²	76	72.3 Å²	72.3	78%	0.784	39%	0.389	S	S	*	.	S	Bend	trans	71.3	-25.7	138.1	0	0	0	0	0	119.6	D764 T768	D764-G766 PolarHBondContact O-N 3.05Å; G766-T768 PolarHBondContact O-N 2.75Å
767	K	44.4	Very low	63.6	Low	193 Å²	193	70 Å²	70	84%	0.839	37%	0.372	S	S	*	.			trans	-80.5	99.4	-174.5	-68.8	176.7	176.5	173.2	0	110.8	E765 I769	E765-K767 VanDerWaalsContact C-N 3.25Å; E765-K767 PolarHBondContact O-N 3.23Å; K767-I769 PolarHBondContact O-N 2.77Å
768	T	43.3	Very low	64.3	Low	95 Å²	95	62.4 Å²	62.4	58%	0.583	35%	0.345	S	S	*	.			trans	-59.3	115.6	174.4	38.5	0	0	0	0	111.2	G766	G766-T768 PolarHBondContact O-N 2.75Å
769	I	48.6	Very low	64.8	Low	90 Å²	90	63.1 Å²	63.1	46%	0.462	35%	0.349	S	S	.	.			trans	-73.5	142	-179.8	-68.9	169.5	0	0	0	110.4	Y761 K767 S773	Y761-I769 HydrophobicContact CD1-CD1 3.63Å; Y761-I769 HydrophobicContact CE1-CD1 3.42Å; Y761-I769 VanDerWaalsContact CE1-CD1 3.42Å; Y761-I769 HydrophobicContact CE1-CG2 4.42Å; Y761-I769 HydrophobicContact CE2-CD1 4.45Å; Y761-I769 HydrophobicContact CG-CD1 4.24Å; K767-I769 PolarHBondContact O-N 2.77Å; I769-S773 VanDerWaalsContact CG2-OG 3.24Å; I769-S773 WeakPolarHBondContact CG2-OG 3.48Å
770	V	51.8	Low	65	Low	48 Å²	48	66 Å²	66	29%	0.291	36%	0.363	S	S	.	.			trans	-57.1	124.1	179.7	164.9	0	0	0	0	111.6	S538 F772 S773	S538-V770 VanDerWaalsContact OG-CG1 3.23Å; S538-V770 WeakPolarHBondContact OG-CG1 3.5Å; V770-F772 HydrophobicContact CG1-CB 4.07Å; V770-F772 HydrophobicContact CG1-CD2 4.38Å; V770-F772 PolarHBondContact O-N 3.31Å; V770-S773 WeakPolarHBondContact O-CB 3.16Å; V770-S773 PolarHBondContact O-N 3.04Å; V770-S773 VanDerWaalsContact O-N 3.08Å; V770-S773 PolarHBondContact O-OG 3.1Å
771	P	48.8	Very low	65.5	Low	51 Å²	51	66 Å²	66	33%	0.331	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-13.4	-178.2	-28.1	35.6	0	0	0	116.5	C774	P771-C774 PolarHBondContact O-SG 2.97Å; P771-C774 VanDerWaalsContact O-SG 3.38Å
772	F	55.2	Low	66.2	Low	31 Å²	31	65.6 Å²	65.6	14%	0.136	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	3.6	-179.4	-66.2	-97.3	0	0	0	113.6	V540 D568 L746 A747 A750 V770	V540-F772 HydrophobicContact CB-CE1 4.41Å; V540-F772 HydrophobicContact CB-CE2 4.35Å; V540-F772 HydrophobicContact CB-CZ 4.27Å; V540-F772 HydrophobicContact CG1-CD1 3.54Å; V540-F772 HydrophobicContact CG1-CD2 4.19Å; V540-F772 HydrophobicContact CG1-CE1 3.49Å; V540-F772 VanDerWaalsContact CG1-CE1 3.49Å; V540-F772 HydrophobicContact CG1-CE2 4.18Å; V540-F772 HydrophobicContact CG1-CG 3.9Å; V540-F772 HydrophobicContact CG1-CZ 3.83Å; V540-F772 HydrophobicContact CG2-CD1 4.41Å; V540-F772 HydrophobicContact CG2-CD2 3.7Å; V540-F772 HydrophobicContact CG2-CE1 4Å; V540-F772 HydrophobicContact CG2-CE2 3.25Å; V540-F772 HydrophobicContact CG2-CG 4.27Å; V540-F772 HydrophobicContact CG2-CZ 3.4Å; V540-F772 VanDerWaalsContact CG2-CZ 3.4Å; D568-F772 HydrophobicContact CB-CE2 4.03Å; L746-F772 HydrophobicContact CB-CD1 4.49Å; L746-F772 HydrophobicContact CB-CE1 4.26Å; A747-F772 HydrophobicContact CB-CE1 3.84Å; A747-F772 HydrophobicContact CB-CZ 3.6Å; A750-F772 HydrophobicContact CB-CZ 4.45Å; V770-F772 HydrophobicContact CG1-CB 4.07Å; V770-F772 HydrophobicContact CG1-CD2 4.38Å; V770-F772 PolarHBondContact O-N 3.31Å
773	S	62.3	Low	67.3	Low	69 Å²	69	64.5 Å²	64.5	48%	0.483	36%	0.358	S	S	.	.	S	Bend	trans	-90.6	-18.4	175.1	63.9	0	0	0	0	113.5	I769 V770	I769-S773 VanDerWaalsContact CG2-OG 3.24Å; I769-S773 WeakPolarHBondContact CG2-OG 3.48Å; V770-S773 WeakPolarHBondContact O-CB 3.16Å; V770-S773 PolarHBondContact O-N 3.04Å; V770-S773 VanDerWaalsContact O-N 3.08Å; V770-S773 PolarHBondContact O-OG 3.1Å
774	C	74.6	Confident	68.7	Low	16 Å²	16	57.7 Å²	57.7	11%	0.108	33%	0.326	C	S	.	.	S	Bend	trans	-102.5	154.4	179.3	59.6	0	0	0	0	112.1	W759 P771 M1095	W759-C774 HydrophobicContact CG-CB 4.2Å; P771-C774 PolarHBondContact O-SG 2.97Å; P771-C774 VanDerWaalsContact O-SG 3.38Å; C774-M1095 HydrophobicContact CB-SD 4.38Å
775	P	88.5	Confident	69.8	Low	1 Å²	1	56.3 Å²	56.3	1%	0.006	33%	0.333	C	S	.	.			trans	-64.7	143.4	173.6	-15.9	29	0	0	0	111.3	W759 L1066 W1068 W1268 L1270	W759-P775 HydrophobicContact CZ2-CB 4.09Å; W759-P775 HydrophobicContact CZ2-CG 3.92Å; W759-P775 PolarHBondContact NE1-O 2.83Å; P775-L1066 HydrophobicContact CG-CD1 3.67Å; P775-W1068 HydrophobicContact CB-CH2 3.55Å; P775-W1068 HydrophobicContact CB-CZ2 3.71Å; P775-W1068 HydrophobicContact CG-CH2 3.58Å; P775-W1068 HydrophobicContact CG-CZ2 3.39Å; P775-W1268 HydrophobicContact CB-CB 4.41Å; P775-W1268 HydrophobicContact CB-CE3 4.2Å; P775-L1270 HydrophobicContact CB-CD2 3.97Å; P775-L1270 HydrophobicContact CG-CD2 3.86Å
776	L	90.2	Very high	71	Confident	8 Å²	8	52.2 Å²	52.2	4%	0.042	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	134	-177	-59.7	178.1	0	0	0	111.5	L746 I749 A750 N755 A778 W1268 Q1269	L746-L776 HydrophobicContact CB-CD1 4.39Å; L746-L776 HydrophobicContact CD2-CD1 4.04Å; L746-L776 WeakPolarHBondContact O-CD1 3.4Å; I749-L776 HydrophobicContact CB-CD1 4.36Å; I749-L776 HydrophobicContact CG2-CB 3.76Å; I749-L776 HydrophobicContact CG2-CD1 4.32Å; A750-L776 HydrophobicContact CB-CD1 3.89Å; A750-L776 HydrophobicContact CB-CD2 4.17Å; N755-L776 HydrophobicContact CB-CD2 4.44Å; L776-A778 PolarHBondContact O-N 2.91Å; L776-A778 VanDerWaalsContact O-N 3.14Å; L776-W1268 CarbonylContact O-C 3.58Å; L776-W1268 WeakPolarHBondContact O-CA 3.29Å; L776-Q1269 PolarHBondContact N-O 3.07Å; L776-Q1269 PolarHBondContact O-N 3.38Å
777	L	91.6	Very high	72	Confident	3 Å²	3	56.2 Å²	56.2	2%	0.016	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	107.9	174.5	-176.2	62.5	0	0	0	109.3	I749 E754 N755 C779 N1099 F1243 M1266 W1268	I749-L777 WeakPolarHBondContact CG2-O 3.2Å; E754-L777 HydrophobicContact CB-CD2 4.12Å; N755-L777 PolarHBondContact ND2-O 2.89Å; N755-L777 PolarHBondContact OD1-N 2.9Å; L777-C779 WeakPolarHBondContact CD1-O 3.5Å; L777-N1099 HydrophobicContact CD2-CB 3.98Å; L777-F1243 HydrophobicContact CD2-CE2 3.93Å; L777-F1243 HydrophobicContact CD2-CZ 4.47Å; L777-M1266 HydrophobicContact CD1-CB 3.85Å; L777-M1266 HydrophobicContact CD1-CE 4.04Å; L777-M1266 HydrophobicContact CD1-CG 4.43Å; L777-M1266 HydrophobicContact CD2-CE 4.11Å; L777-W1268 HydrophobicContact CB-CE3 4.12Å; L777-W1268 HydrophobicContact CB-CH2 4.27Å; L777-W1268 HydrophobicContact CB-CZ3 3.98Å; L777-W1268 HydrophobicContact CD1-CD2 4.37Å
778	A	89.6	Confident	72.6	Confident	7 Å²	7	48.1 Å²	48.1	6%	0.058	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	-34	-176.9	0	0	0	0	0	112.6	I749 R752 L776 L815 V1267 Q1269	I749-A778 HydrophobicContact CD1-CB 3.99Å; R752-A778 PolarHBondContact NH1-O 3.12Å; R752-A778 PolarHBondContact NH2-O 3.42Å; L776-A778 PolarHBondContact O-N 2.91Å; L776-A778 VanDerWaalsContact O-N 3.14Å; A778-L815 HydrophobicContact CB-CD2 4.47Å; A778-V1267 PolarHBondContact N-O 3.34Å; A778-Q1269 HydrophobicContact CB-CB 4.16Å
779	C	89.4	Confident	73.1	Confident	19 Å²	19	48.7 Å²	48.7	13%	0.128	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	166.3	170.1	56.6	0	0	0	0	111.4	L777 M781 V1267	L777-C779 WeakPolarHBondContact CD1-O 3.5Å; C779-M781 VanDerWaalsContact SG-CE 3.51Å; C779-V1267 PolarHBondContact O-N 3.17Å
780	H	90.8	Very high	73.7	Confident	78 Å²	78	51.5 Å²	51.5	36%	0.361	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	152.5	161	63.2	81.4	0	0	0	109.7	F1243 T1264 L1265 M1266	H780-F1243 HydrophobicContact CB-CD2 4.38Å; H780-F1243 AromaticContact CD2-CE2 3.87Å; H780-F1243 AromaticContact CD2-CZ 3.91Å; H780-F1243 AromaticContact NE2-CD1 3.97Å; H780-F1243 AromaticContact NE2-CE1 3.8Å; H780-T1264 HydrophobicContact CB-CG2 4.2Å; H780-L1265 CarbonylContact C-O 3.53Å; H780-L1265 WeakPolarHBondContact CA-O 3.35Å; H780-L1265 WeakPolarHBondContact CB-O 3.34Å; H780-M1266 HydrophobicContact CB-CG 4Å
781	M	90.4	Very high	74.7	Confident	25 Å²	25	51 Å²	51	12%	0.123	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	152.3	-177.5	73.1	-155.7	74.3	0	0	112.4	C779 F836 P843 T1264 L1265 V1267	C779-M781 VanDerWaalsContact SG-CE 3.51Å; M781-F836 HydrophobicContact CG-CE1 4.5Å; M781-F836 HydrophobicContact SD-CD1 4.12Å; M781-F836 HydrophobicContact SD-CE1 4.02Å; M781-P843 HydrophobicContact CE-CB 3.99Å; M781-P843 HydrophobicContact CE-CG 3.92Å; M781-P843 HydrophobicContact SD-CB 3.94Å; M781-T1264 CarbonylContact O-C 3.58Å; M781-T1264 WeakPolarHBondContact O-CA 3.29Å; M781-L1265 HydrophobicContact CG-CB 4.22Å; M781-L1265 HydrophobicContact CG-CD1 4.41Å; M781-L1265 PolarHBondContact N-O 3.47Å; M781-L1265 PolarHBondContact O-N 3.01Å; M781-L1265 HydrophobicContact SD-CD1 4.45Å; M781-V1267 HydrophobicContact CE-CG2 3.9Å
782	P	88.7	Confident	76.4	Confident	71 Å²	71	52.8 Å²	52.8	46%	0.461	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	146.1	170.5	29.4	-35.1	0	0	0	111.5	N1263	P782-N1263 CarbonylContact C-O 3.56Å; P782-N1263 WeakPolarHBondContact CA-O 3.36Å
783	V	86.8	Confident	78	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.018	29%	0.289	C	S	.	.	S	Bend	trans	-77.2	-47.5	178.6	177.9	0	0	0	0	111.6	L793 V822 F836 N1263 L1265	V783-L793 HydrophobicContact CB-CD2 4.4Å; V783-L793 HydrophobicContact CG1-CD2 4.07Å; V783-L793 HydrophobicContact CG2-CD1 4.31Å; V783-L793 HydrophobicContact CG2-CD2 4.09Å; V783-V822 HydrophobicContact CG1-CB 4.37Å; V783-V822 HydrophobicContact CG1-CG1 3.78Å; V783-V822 HydrophobicContact CG2-CG1 4.48Å; V783-F836 WeakPolarHBondContact O-CZ 3.46Å; V783-N1263 HydrophobicContact CB-CB 4.16Å; V783-N1263 HydrophobicContact CG2-CB 4.16Å; V783-N1263 PolarHBondContact N-O 2.75Å; V783-L1265 HydrophobicContact CG2-CD2 3.65Å; V783-L1265 HydrophobicContact CG2-CG 3.69Å
784	F	82.3	Confident	79.2	Confident	19 Å²	19	49.9 Å²	49.9	8%	0.083	28%	0.275	C	S	.	.			trans	-109.4	132.4	-173.8	-56.2	-66.5	0	0	0	110.3	T786 R791 L793 H832 E834 N1263	F784-T786 VanDerWaalsContact C-N 3.27Å; F784-T786 PolarHBondContact O-N 3.22Å; F784-R791 HydrophobicContact CD2-CB 4.23Å; F784-R791 HydrophobicContact CE2-CB 4.01Å; F784-L793 HydrophobicContact CE2-CD2 3.98Å; F784-L793 HydrophobicContact CZ-CD2 4.2Å; F784-H832 AromaticContact CD1-CD2 3.66Å; F784-H832 AromaticContact CD1-NE2 3.87Å; F784-H832 AromaticContact CE1-CD2 3.37Å; F784-H832 WeakPolarHBondContact CE1-CD2 3.46Å; F784-E834 HydrophobicContact CD1-CG 3.58Å; F784-E834 HydrophobicContact CE1-CG 3.73Å; F784-N1263 HydrophobicContact CD2-CB 4.28Å; F784-N1263 HydrophobicContact CE2-CB 4.31Å
785	A	68.6	Low	80.1	Confident	105 Å²	105	50.3 Å²	50.3	87%	0.868	28%	0.277	S	S	*	.	S	Bend	trans	-69	-24.4	-179.6	0	0	0	0	0	113.4
786	T	65.6	Low	80.3	Confident	89 Å²	89	50.8 Å²	50.8	55%	0.546	28%	0.281	S	S	.	.	S	Bend	trans	-96.9	125.6	175.9	43.1	0	0	0	0	111.4	F784 S788	F784-T786 VanDerWaalsContact C-N 3.27Å; F784-T786 PolarHBondContact O-N 3.22Å; T786-S788 PolarHBondContact O-N 3.42Å; T786-S788 PolarHBondContact O-OG 3.18Å
787	K	59.9	Low	80.4	Confident	159 Å²	159	51.3 Å²	51.3	69%	0.691	28%	0.284	S	S	*	.			trans	-71.7	71.1	-179.8	-64.9	179.2	-177.3	-86.4	0	112.1	E1262	K787-E1262 VanDerWaalsContact NZ-CD 3.26Å; K787-E1262 IonicContact NZ-OE1 3.05Å; K787-E1262 PolarHBondContact NZ-OE1 2.79Å; K787-E1262 IonicContact NZ-OE2 3.18Å; K787-E1262 PolarHBondContact NZ-OE2 2.74Å; K787-E1262 VanDerWaalsContact NZ-OE2 3.13Å
788	S	58.4	Low	80.4	Confident	24 Å²	24	51.9 Å²	51.9	17%	0.168	29%	0.286	C	S	.	.			trans	-100	112.7	172.6	41.3	0	0	0	0	109	T786 E790 R791	T786-S788 PolarHBondContact O-N 3.42Å; T786-S788 PolarHBondContact O-OG 3.18Å; S788-E790 VanDerWaalsContact C-N 3.3Å; S788-E790 PolarHBondContact O-N 3.38Å; S788-R791 WeakPolarHBondContact OG-CD 3.4Å; S788-R791 PolarHBondContact OG-NE 2.85Å
789	P	53.8	Low	80.3	Confident	107 Å²	107	51.7 Å²	51.7	70%	0.695	28%	0.284	S	S	*	.	S	Bend	trans	-73.9	-18.6	-168.8	28.4	-34.9	0	0	0	114.1	K1241	P789-K1241 PolarHBondContact O-NZ 3.17Å
790	E	60.2	Low	80	Confident	149 Å²	149	52.4 Å²	52.4	70%	0.696	29%	0.289	S	S	*	.	S	Bend	trans	-86.3	-24.3	-170.1	-56.1	-156.2	158.8	0	0	114.2	S788 K792	S788-E790 VanDerWaalsContact C-N 3.3Å; S788-E790 PolarHBondContact O-N 3.38Å; E790-K792 PolarHBondContact O-N 2.75Å
791	R	74.1	Confident	79.3	Confident	36 Å²	36	50 Å²	50	14%	0.136	28%	0.279	C	S	.	.			trans	-54.7	133	-178.4	-64.2	-175.3	178.8	-168.1	-7.8	111.1	F784 S788 A825 H832 K1241 N1263	F784-R791 HydrophobicContact CD2-CB 4.23Å; F784-R791 HydrophobicContact CE2-CB 4.01Å; S788-R791 WeakPolarHBondContact OG-CD 3.4Å; S788-R791 PolarHBondContact OG-NE 2.85Å; R791-A825 WeakPolarHBondContact CA-O 3.28Å; R791-H832 PolarHBondContact NH1-CD2 2.79Å; R791-H832 PolarHBondContact NH1-NE2 3.38Å; R791-K1241 PolarHBondContact O-NZ 2.87Å; R791-N1263 PolarHBondContact O-ND2 3.13Å
792	K	83.7	Confident	78.2	Confident	89 Å²	89	52.2 Å²	52.2	39%	0.387	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	137.3	178.8	179.4	-179.7	174.2	-61	0	109.9	E790 E794 G824 A825	E790-K792 PolarHBondContact O-N 2.75Å; K792-E794 WeakPolarHBondContact CD-OE1 3.18Å; K792-E794 WeakPolarHBondContact CE-OE1 3.48Å; K792-E794 IonicContact NZ-OE1 2.6Å; K792-E794 PolarHBondContact NZ-OE1 2.92Å; K792-G824 CarbonylContact O-C 3.56Å; K792-G824 WeakPolarHBondContact O-CA 3.49Å; K792-A825 PolarHBondContact N-O 3.38Å; K792-A825 PolarHBondContact O-N 3.19Å
793	L	88.7	Confident	77	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	136.3	169.6	-59.6	179.5	0	0	0	110	V783 F784 V822 D1106 F1107 N1263	V783-L793 HydrophobicContact CB-CD2 4.4Å; V783-L793 HydrophobicContact CG1-CD2 4.07Å; V783-L793 HydrophobicContact CG2-CD1 4.31Å; V783-L793 HydrophobicContact CG2-CD2 4.09Å; F784-L793 HydrophobicContact CE2-CD2 3.98Å; F784-L793 HydrophobicContact CZ-CD2 4.2Å; L793-V822 HydrophobicContact CD2-CG1 4.11Å; L793-D1106 HydrophobicContact CB-CB 4.1Å; L793-F1107 HydrophobicContact CB-CD1 4.49Å; L793-F1107 HydrophobicContact CB-CE1 4.23Å; L793-F1107 HydrophobicContact CD1-CE1 4.08Å; L793-N1263 HydrophobicContact CD1-CB 4.15Å; L793-N1263 HydrophobicContact CD2-CB 4.12Å; L793-N1263 HydrophobicContact CG-CB 4.07Å
794	E	88.4	Confident	75.9	Confident	40 Å²	40	50.7 Å²	50.7	19%	0.187	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	-46.8	178.7	-64.8	-73.2	123.1	0	0	110.9	K792 A823 A825 I855 R856	K792-E794 WeakPolarHBondContact CD-OE1 3.18Å; K792-E794 WeakPolarHBondContact CE-OE1 3.48Å; K792-E794 IonicContact NZ-OE1 2.6Å; K792-E794 PolarHBondContact NZ-OE1 2.92Å; E794-A823 PolarHBondContact N-O 3.22Å; E794-A825 HydrophobicContact CG-CB 4.49Å; E794-I855 WeakPolarHBondContact CB-O 3.46Å; E794-I855 WeakPolarHBondContact CG-O 3.43Å; E794-R856 IonicContact OE1-NH1 2.63Å; E794-R856 IonicContact OE2-CZ 2.85Å; E794-R856 IonicContact OE2-NH1 3.67Å; E794-R856 PolarHBondContact OE2-NH1 3.13Å
795	T	92	Very high	75	Confident	25 Å²	25	54 Å²	54	15%	0.153	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	166.7	-174.3	-171.2	0	0	0	0	111.9	A823 I855 L858	T795-A823 HydrophobicContact CG2-CB 3.82Å; T795-A823 PolarHBondContact N-O 3.29Å; T795-A823 PolarHBondContact O-N 3.11Å; T795-I855 HydrophobicContact CG2-CG2 4.26Å; T795-L858 HydrophobicContact CG2-CB 4.38Å; T795-L858 HydrophobicContact CG2-CD1 3.99Å; T795-L858 HydrophobicContact CG2-CG 3.76Å
796	A	94	Very high	74.9	Confident	11 Å²	11	49 Å²	49	9%	0.091	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	159.8	172.5	0	0	0	0	0	111.5	L820 W821 V822 F1107 V1109	A796-L820 HydrophobicContact CB-CD1 4.5Å; A796-W821 CarbonylContact C-O 3.56Å; A796-W821 WeakPolarHBondContact CA-O 3.41Å; A796-W821 WeakPolarHBondContact CB-O 3.38Å; A796-V822 HydrophobicContact CB-CB 4.48Å; A796-V822 HydrophobicContact CB-CG1 4.49Å; A796-V822 HydrophobicContact CB-CG2 4.19Å; A796-F1107 HydrophobicContact CB-CD1 4.14Å; A796-F1107 HydrophobicContact CB-CD2 3.85Å; A796-F1107 HydrophobicContact CB-CE1 3.79Å; A796-F1107 HydrophobicContact CB-CE2 3.49Å; A796-F1107 VanDerWaalsContact CB-CE2 3.49Å; A796-F1107 HydrophobicContact CB-CG 4.17Å; A796-F1107 HydrophobicContact CB-CZ 3.45Å; A796-F1107 VanDerWaalsContact CB-CZ 3.45Å; A796-V1109 HydrophobicContact CB-CG2 3.79Å; A796-V1109 VanDerWaalsContact O-CG2 3.27Å; A796-V1109 WeakPolarHBondContact O-CG2 3.32Å
797	L	92.2	Very high	74.6	Confident	19 Å²	19	44.9 Å²	44.9	10%	0.099	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	139.2	-173.8	-178.9	69.5	0	0	0	111.4	L820 W821 L858 E859 I885	L797-L820 WeakPolarHBondContact O-CA 3.36Å; L797-W821 PolarHBondContact N-O 3.44Å; L797-W821 PolarHBondContact O-N 3.04Å; L797-L858 HydrophobicContact CB-CB 3.72Å; L797-L858 HydrophobicContact CB-CD1 3.92Å; L797-L858 HydrophobicContact CB-CG 4.48Å; L797-L858 HydrophobicContact CD2-CB 3.98Å; L797-L858 HydrophobicContact CG-CB 4.36Å; L797-E859 VanDerWaalsContact CD2-C 3.5Å; L797-I885 HydrophobicContact CD2-CG1 4.31Å; L797-I885 HydrophobicContact CD2-CG2 3.79Å
798	H	90.9	Very high	74.9	Confident	14 Å²	14	38.2 Å²	38.2	7%	0.065	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	127.1	169.4	-177.1	-137.4	0	0	0	110.9	P800 Q817 Y819 V1109 T1111 T1112	H798-P800 WeakPolarHBondContact O-CD 3.44Å; H798-Q817 PolarHBondContact NE2-O 3.46Å; H798-Q817 VanDerWaalsContact NE2-O 3.12Å; H798-Y819 PolarHBondContact CD2-O 2.79Å; H798-V1109 HydrophobicContact CB-CG1 4.15Å; H798-T1111 HydrophobicContact CB-CG2 3.87Å; H798-T1111 VanDerWaalsContact ND1-CA 3.34Å; H798-T1111 WeakPolarHBondContact ND1-CA 3.4Å; H798-T1111 WeakPolarHBondContact ND1-CB 3.31Å; H798-T1112 PolarHBondContact CE1-O 2.84Å; H798-T1112 VanDerWaalsContact CE1-O 3.31Å; H798-T1112 PolarHBondContact ND1-N 3.17Å
799	N	87.9	Confident	75.3	Confident	3 Å²	3	37.8 Å²	37.8	2%	0.016	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	97.9	167.4	177.8	19.7	0	0	0	108	G818 Y819 Y860 I885 S899	N799-G818 CarbonylContact O-C 3.57Å; N799-G818 WeakPolarHBondContact O-CA 3.27Å; N799-Y819 WeakPolarHBondContact CB-O 3.46Å; N799-Y819 PolarHBondContact N-O 3.46Å; N799-Y819 PolarHBondContact O-N 2.92Å; N799-Y860 WeakPolarHBondContact OD1-CE2 3.42Å; N799-I885 HydrophobicContact CB-CD1 4.18Å; N799-S899 PolarHBondContact ND2-OG 3.3Å; N799-S899 PolarHBondContact OD1-OG 3.43Å
800	P	83	Confident	75.6	Confident	35 Å²	35	34.1 Å²	34.1	23%	0.227	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	142.8	-175.3	29.7	-36.4	0	0	0	112.5	H798 Y860	H798-P800 WeakPolarHBondContact O-CD 3.44Å; P800-Y860 VanDerWaalsContact CD-CE1 3.47Å; P800-Y860 HydrophobicContact CG-CD1 4.33Å; P800-Y860 HydrophobicContact CG-CE1 3.67Å
801	V	75.2	Confident	75.4	Confident	26 Å²	26	29.2 Å²	29.2	16%	0.158	17%	0.168	C	C	.	.			trans	-118.6	137.4	173.5	170.8	0	0	0	0	110.1	C803 Q817 G818 Y819 S1113 V1216	V801-C803 PolarHBondContact O-N 3.29Å; V801-Q817 PolarHBondContact N-O 3.17Å; V801-G818 VanDerWaalsContact CG2-CA 3.48Å; V801-Y819 HydrophobicContact CG2-CD2 4.41Å; V801-Y819 HydrophobicContact CG2-CE2 4.4Å; V801-S1113 PolarHBondContact O-OG 3Å; V801-V1216 HydrophobicContact CG1-CG1 3.8Å; V801-V1216 HydrophobicContact CG1-CG2 4.34Å
802	N	66.9	Low	74.7	Confident	73 Å²	73	28 Å²	28	39%	0.39	17%	0.165	S	C	.	.			trans	-67	118.4	176.7	-77.8	-15.7	0	0	0	110.2	G1218	N802-G1218 PolarHBondContact ND2-O 2.84Å
803	C	65.3	Low	73.5	Confident	5 Å²	5	23.9 Å²	23.9	3%	0.034	15%	0.148	C	C	.	.			trans	-102.5	105.9	-175.4	-177.4	0	0	0	0	111.8	V801 L805 L806 Q817 L1115	V801-C803 PolarHBondContact O-N 3.29Å; C803-L805 PolarHBondContact O-N 2.79Å; C803-L805 VanDerWaalsContact O-N 3.14Å; C803-L806 HydrophobicContact CB-CB 3.97Å; C803-L806 HydrophobicContact CB-CD1 4.48Å; C803-L806 PolarHBondContact O-N 3.25Å; C803-L806 PolarHBondContact SG-N 3.18Å; C803-Q817 HydrophobicContact CB-CB 4.23Å; C803-Q817 HydrophobicContact CB-CG 4.12Å; C803-Q817 PolarHBondContact SG-OE1 2.72Å; C803-L1115 WeakPolarHBondContact O-CD1 3.47Å
804	A	62	Low	72.1	Confident	36 Å²	36	24.2 Å²	24.2	30%	0.298	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-2.9	175.6	0	0	0	0	0	114.7	L1119	A804-L1119 HydrophobicContact CB-CD1 4.05Å; A804-L1119 WeakPolarHBondContact O-CD1 3.43Å
805	L	63.3	Low	71.2	Confident	88 Å²	88	22.7 Å²	22.7	46%	0.461	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-126.8	10.3	-177.9	-64.6	176.1	0	0	0	113.2	C803 G807 F808 S812	C803-L805 PolarHBondContact O-N 2.79Å; C803-L805 VanDerWaalsContact O-N 3.14Å; L805-G807 PolarHBondContact O-N 3.33Å; L805-F808 WeakPolarHBondContact O-CB 3.29Å; L805-F808 PolarHBondContact O-N 3.26Å; L805-S812 WeakPolarHBondContact O-CB 3.26Å; L805-S812 PolarHBondContact O-OG 2.94Å
806	L	66.6	Low	70.6	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.01	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	127	-174.5	-168.1	68.1	0	0	0	110.4	C803 F808 S1113 L1115 V1231	C803-L806 HydrophobicContact CB-CB 3.97Å; C803-L806 HydrophobicContact CB-CD1 4.48Å; C803-L806 PolarHBondContact O-N 3.25Å; C803-L806 PolarHBondContact SG-N 3.18Å; L806-F808 WeakPolarHBondContact O-CD2 3.46Å; L806-F808 PolarHBondContact O-N 3.06Å; L806-S1113 WeakPolarHBondContact CD2-O 3.29Å; L806-L1115 HydrophobicContact CB-CB 4.31Å; L806-L1115 HydrophobicContact CB-CD1 4.02Å; L806-L1115 HydrophobicContact CD2-CB 4.31Å; L806-V1231 HydrophobicContact CD2-CG1 4.49Å
807	G	60.7	Low	70	Confident	1 Å²	1	22.6 Å²	22.6	1%	0.01	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.7	-18.9	-178.9	0	0	0	0	0	115.9	I738 L805 T813	I738-G807 WeakPolarHBondContact CA-O 3.38Å; L805-G807 PolarHBondContact O-N 3.33Å; G807-T813 VanDerWaalsContact O-CG2 3.32Å; G807-T813 WeakPolarHBondContact O-CG2 3.45Å
808	F	66.1	Low	69.7	Low	19 Å²	19	21.7 Å²	21.7	8%	0.083	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-16.2	-172	-73.1	-74.4	0	0	0	115.3	K705 P734 K737 I738 L805 L806 L1115	K705-F808 HydrophobicContact CB-CD1 4.48Å; K705-F808 HydrophobicContact CB-CE1 3.83Å; K705-F808 HydrophobicContact CG-CE1 3.91Å; K705-F808 HydrophobicContact CG-CZ 4.3Å; P734-F808 HydrophobicContact CB-CE1 3.92Å; P734-F808 HydrophobicContact CB-CZ 4.02Å; K737-F808 HydrophobicContact CD-CD1 4.27Å; K737-F808 WeakPolarHBondContact CE-O 3.37Å; K737-F808 PolarHBondContact NZ-O 2.92Å; I738-F808 HydrophobicContact CD1-CE1 4.35Å; I738-F808 HydrophobicContact CD1-CE2 4.04Å; I738-F808 HydrophobicContact CD1-CZ 3.96Å; I738-F808 HydrophobicContact CG1-CD1 4.49Å; I738-F808 HydrophobicContact CG1-CE1 4.42Å; I738-F808 HydrophobicContact CG1-CZ 4.48Å; L805-F808 WeakPolarHBondContact O-CB 3.29Å; L805-F808 PolarHBondContact O-N 3.26Å; L806-F808 WeakPolarHBondContact O-CD2 3.46Å; L806-F808 PolarHBondContact O-N 3.06Å; F808-L1115 HydrophobicContact CE2-CD1 4.1Å; F808-L1115 HydrophobicContact CE2-CD2 4.04Å
809	S	66.9	Low	69.5	Low	16 Å²	16	23 Å²	23	11%	0.112	14%	0.139	C	C	.	.	S	Bend	trans	-138.9	142.6	-171.6	150	0	0	0	0	110.2	E609 A811 S812 T813	E609-S809 VanDerWaalsContact CD-CB 3.48Å; E609-S809 PolarHBondContact OE1-OG 2.82Å; E609-S809 WeakPolarHBondContact OE2-CB 3.2Å; E609-S809 PolarHBondContact OE2-OG 3.08Å; S809-A811 PolarHBondContact O-N 2.94Å; S809-A811 PolarHBondContact OG-N 3.25Å; S809-A811 VanDerWaalsContact OG-N 3.09Å; S809-S812 WeakPolarHBondContact CB-OG 3.38Å; S809-S812 PolarHBondContact N-OG 2.99Å; S809-S812 VanDerWaalsContact N-OG 3.16Å; S809-S812 CarbonylContact O-C 3.5Å; S809-S812 WeakPolarHBondContact O-CA 3.24Å; S809-S812 PolarHBondContact O-N 3.36Å; S809-S812 PolarHBondContact O-OG 3.39Å; S809-S812 VanDerWaalsContact O-OG 3.05Å; S809-S812 PolarHBondContact OG-N 2.96Å; S809-T813 WeakPolarHBondContact O-CB 3.49Å; S809-T813 WeakPolarHBondContact O-CG2 3.41Å; S809-T813 PolarHBondContact O-N 3.47Å; S809-T813 PolarHBondContact O-OG1 3.47Å
810	A	59.9	Low	69.7	Low	29 Å²	29	23 Å²	23	24%	0.24	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-24.2	175.9	0	0	0	0	0	112.9	V607 E609 T813	V607-A810 HydrophobicContact CB-CB 3.96Å; V607-A810 HydrophobicContact CG1-CB 4.03Å; E609-A810 WeakPolarHBondContact OE1-CB 3.16Å; E609-A810 PolarHBondContact OE1-N 2.86Å; A810-T813 WeakPolarHBondContact CA-OG1 3.49Å; A810-T813 PolarHBondContact O-OG1 3.44Å
811	A	56.1	Low	70.1	Confident	46 Å²	46	21.9 Å²	21.9	38%	0.38	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-20	172	0	0	0	0	0	113.3	S809	S809-A811 PolarHBondContact O-N 2.94Å; S809-A811 PolarHBondContact OG-N 3.25Å; S809-A811 VanDerWaalsContact OG-N 3.09Å
812	S	59	Low	71	Confident	10 Å²	10	20.7 Å²	20.7	7%	0.07	12%	0.123	C	C	.	.	S	Bend	trans	-104.5	6.1	177	73.8	0	0	0	0	114.6	L805 S809	L805-S812 WeakPolarHBondContact O-CB 3.26Å; L805-S812 PolarHBondContact O-OG 2.94Å; S809-S812 WeakPolarHBondContact CB-OG 3.38Å; S809-S812 PolarHBondContact N-OG 2.99Å; S809-S812 VanDerWaalsContact N-OG 3.16Å; S809-S812 CarbonylContact O-C 3.5Å; S809-S812 WeakPolarHBondContact O-CA 3.24Å; S809-S812 PolarHBondContact O-N 3.36Å; S809-S812 PolarHBondContact O-OG 3.39Å; S809-S812 VanDerWaalsContact O-OG 3.05Å; S809-S812 PolarHBondContact OG-N 2.96Å
813	T	57.6	Low	72.1	Confident	3 Å²	3	17.2 Å²	17.2	2%	0.018	10%	0.104	C	C	.	.	S	Bend	trans	-113.4	75.5	-174.1	57.8	0	0	0	0	114.4	V741 H745 G807 S809 A810	V741-T813 HydrophobicContact CB-CG2 3.93Å; V741-T813 HydrophobicContact CG1-CG2 3.51Å; V741-T813 WeakPolarHBondContact CG1-OG1 3.41Å; H745-T813 VanDerWaalsContact CG-O 3.24Å; H745-T813 PolarHBondContact ND1-O 2.91Å; G807-T813 VanDerWaalsContact O-CG2 3.32Å; G807-T813 WeakPolarHBondContact O-CG2 3.45Å; S809-T813 WeakPolarHBondContact O-CB 3.49Å; S809-T813 WeakPolarHBondContact O-CG2 3.41Å; S809-T813 PolarHBondContact O-N 3.47Å; S809-T813 PolarHBondContact O-OG1 3.47Å; A810-T813 WeakPolarHBondContact CA-OG1 3.49Å; A810-T813 PolarHBondContact O-OG1 3.44Å
814	S	59.9	Low	73.2	Confident	7 Å²	7	17 Å²	17	5%	0.049	10%	0.103	C	C	.	.	S	Bend	trans	-167.2	-66.2	150.3	38	0	0	0	0	111.9	H745 S1233 Q1269	H745-S814 WeakPolarHBondContact NE2-CB 3.25Å; H745-S814 PolarHBondContact NE2-OG 2.93Å; S814-S1233 PolarHBondContact O-OG 3.16Å; S814-Q1269 VanDerWaalsContact CB-CD 3.44Å; S814-Q1269 PolarHBondContact O-NE2 2.99Å
815	L	70.7	Confident	74.2	Confident	9 Å²	9	16.3 Å²	16.3	5%	0.047	10%	0.097	C	C	.	.	S	Bend	trans	-82.7	144.7	-172.9	-57.8	-179.5	0	0	0	111.6	A778 Q817 P843 A1235 V1267 Q1269	A778-L815 HydrophobicContact CB-CD2 4.47Å; L815-Q817 PolarHBondContact O-N 3.07Å; L815-P843 HydrophobicContact CD1-CG 3.8Å; L815-A1235 HydrophobicContact CD2-CB 4.25Å; L815-V1267 HydrophobicContact CD1-CG1 4.21Å; L815-V1267 HydrophobicContact CD2-CG1 3.53Å; L815-Q1269 HydrophobicContact CD2-CG 4.47Å
816	P	78.1	Confident	74.5	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	8%	0.084	C	C	.	.	P	Polyproline II helix	trans	-55.6	130.3	165.7	-31.3	41.4	0	0	0	112	L838 T1111 A1235	P816-L838 WeakPolarHBondContact O-CB 3.35Å; P816-L838 WeakPolarHBondContact O-CD1 3.29Å; P816-T1111 WeakPolarHBondContact CG-O 3.31Å; P816-T1111 VanDerWaalsContact CG-OG1 3.3Å; P816-T1111 WeakPolarHBondContact CG-OG1 3.34Å; P816-A1235 HydrophobicContact CG-CB 4.35Å
817	Q	82.2	Confident	74.4	Confident	33 Å²	33	18.3 Å²	18.3	15%	0.154	11%	0.109	C	C	.	.	P	Polyproline II helix	trans	-76.2	162.3	-179.1	-68.2	-158.2	-16	0	0	112.9	H798 V801 C803 L815 N839	H798-Q817 PolarHBondContact NE2-O 3.46Å; H798-Q817 VanDerWaalsContact NE2-O 3.12Å; V801-Q817 PolarHBondContact N-O 3.17Å; C803-Q817 HydrophobicContact CB-CB 4.23Å; C803-Q817 HydrophobicContact CB-CG 4.12Å; C803-Q817 PolarHBondContact SG-OE1 2.72Å; L815-Q817 PolarHBondContact O-N 3.07Å; Q817-N839 WeakPolarHBondContact CB-OD1 3.44Å
818	G	84.6	Confident	74.6	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	115.4	-151.8	-176	0	0	0	0	0	112.8	N799 V801 L838 N839	N799-G818 CarbonylContact O-C 3.57Å; N799-G818 WeakPolarHBondContact O-CA 3.27Å; V801-G818 VanDerWaalsContact CG2-CA 3.48Å; G818-L838 PolarHBondContact O-N 2.7Å; G818-N839 PolarHBondContact N-OD1 2.87Å
819	Y	88.1	Confident	74.6	Confident	43 Å²	43	28.7 Å²	28.7	17%	0.169	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	134	-170.8	-60.1	-79.7	0	0	0	111.4	H798 N799 V801 I835 F836	H798-Y819 PolarHBondContact CD2-O 2.79Å; N799-Y819 WeakPolarHBondContact CB-O 3.46Å; N799-Y819 PolarHBondContact N-O 3.46Å; N799-Y819 PolarHBondContact O-N 2.92Å; V801-Y819 HydrophobicContact CG2-CD2 4.41Å; V801-Y819 HydrophobicContact CG2-CE2 4.4Å; Y819-I835 HydrophobicContact CD1-CG2 4.26Å; Y819-F836 CarbonylContact C-O 3.58Å; Y819-F836 VanDerWaalsContact CA-O 3.27Å; Y819-F836 WeakPolarHBondContact CA-O 3.43Å
820	L	91.3	Very high	75.5	Confident	2 Å²	2	32.8 Å²	32.8	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	118.9	170.9	179	78.3	0	0	0	108.7	A796 L797 V822 I835 F836 L838 V1109 I1237 L1265	A796-L820 HydrophobicContact CB-CD1 4.5Å; L797-L820 WeakPolarHBondContact O-CA 3.36Å; L820-V822 HydrophobicContact CD2-CG2 3.62Å; L820-V822 HydrophobicContact CG-CG2 3.79Å; L820-I835 WeakPolarHBondContact O-CA 3.36Å; L820-F836 HydrophobicContact CB-CB 4.32Å; L820-F836 PolarHBondContact N-O 2.82Å; L820-F836 PolarHBondContact O-N 2.68Å; L820-L838 HydrophobicContact CB-CD1 4.45Å; L820-L838 HydrophobicContact CB-CD2 4.25Å; L820-L838 HydrophobicContact CB-CG 4.45Å; L820-V1109 HydrophobicContact CD1-CG1 4.26Å; L820-I1237 HydrophobicContact CD1-CD1 4.21Å; L820-I1237 HydrophobicContact CD2-CD1 3.83Å; L820-I1237 HydrophobicContact CD2-CG2 4.09Å; L820-L1265 HydrophobicContact CD2-CD1 3.87Å
821	W	92.5	Very high	76.7	Confident	12 Å²	12	31.4 Å²	31.4	5%	0.045	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	121.2	172.9	-71.2	50.5	0	0	0	108	A796 L797 V833 I835 L849 L858 I885 Y897 A904	A796-W821 CarbonylContact C-O 3.56Å; A796-W821 WeakPolarHBondContact CA-O 3.41Å; A796-W821 WeakPolarHBondContact CB-O 3.38Å; L797-W821 PolarHBondContact N-O 3.44Å; L797-W821 PolarHBondContact O-N 3.04Å; W821-V833 HydrophobicContact CB-CG1 4.16Å; W821-V833 HydrophobicContact CD2-CG1 4.36Å; W821-V833 HydrophobicContact CE3-CG1 3.86Å; W821-I835 HydrophobicContact CD2-CD1 3.94Å; W821-I835 HydrophobicContact CD2-CG1 3.91Å; W821-I835 HydrophobicContact CE3-CD1 4.22Å; W821-I835 HydrophobicContact CE3-CG1 4.37Å; W821-I835 HydrophobicContact CG-CG1 4.13Å; W821-I835 HydrophobicContact CH2-CD1 3.86Å; W821-I835 HydrophobicContact CZ2-CD1 3.55Å; W821-I835 HydrophobicContact CZ2-CG1 4.4Å; W821-I835 HydrophobicContact CZ3-CD1 4.18Å; W821-L849 HydrophobicContact CH2-CD1 4.19Å; W821-L849 HydrophobicContact CZ3-CD1 3.95Å; W821-L858 HydrophobicContact CB-CD1 4.3Å; W821-I885 HydrophobicContact CD2-CD1 3.9Å; W821-I885 VanDerWaalsContact CE2-CD1 3.44Å; W821-I885 HydrophobicContact CE3-CD1 4.43Å; W821-I885 HydrophobicContact CE3-CG2 4.24Å; W821-I885 HydrophobicContact CG-CD1 4.35Å; W821-I885 HydrophobicContact CH2-CD1 4.25Å; W821-I885 HydrophobicContact CZ2-CD1 3.65Å; W821-I885 HydrophobicContact CZ3-CG2 4.4Å; W821-Y897 HydrophobicContact CH2-CG 4.38Å; W821-A904 HydrophobicContact CH2-CB 4.34Å
822	V	92.8	Very high	78.3	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	116.7	-179.4	-177	0	0	0	0	109	V783 L793 A796 L820 V833 E834 F836 F1107 L1265	V783-V822 HydrophobicContact CG1-CB 4.37Å; V783-V822 HydrophobicContact CG1-CG1 3.78Å; V783-V822 HydrophobicContact CG2-CG1 4.48Å; L793-V822 HydrophobicContact CD2-CG1 4.11Å; A796-V822 HydrophobicContact CB-CB 4.48Å; A796-V822 HydrophobicContact CB-CG1 4.49Å; A796-V822 HydrophobicContact CB-CG2 4.19Å; L820-V822 HydrophobicContact CD2-CG2 3.62Å; L820-V822 HydrophobicContact CG-CG2 3.79Å; V822-V833 WeakPolarHBondContact O-CA 3.45Å; V822-E834 PolarHBondContact N-O 2.83Å; V822-E834 PolarHBondContact O-N 2.71Å; V822-F836 HydrophobicContact CB-CE2 4.43Å; V822-F836 HydrophobicContact CG2-CD2 4.07Å; V822-F836 HydrophobicContact CG2-CE2 4.07Å; V822-F1107 HydrophobicContact CG1-CE1 4.04Å; V822-F1107 HydrophobicContact CG1-CZ 3.97Å; V822-L1265 HydrophobicContact CG1-CD2 4.42Å; V822-L1265 HydrophobicContact CG2-CD1 4.2Å; V822-L1265 HydrophobicContact CG2-CD2 4.3Å
823	A	91.3	Very high	79.7	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	140.1	-178.4	0	0	0	0	0	112.6	E794 T795 H832 V833 I855 L858	E794-A823 PolarHBondContact N-O 3.22Å; T795-A823 HydrophobicContact CG2-CB 3.82Å; T795-A823 PolarHBondContact N-O 3.29Å; T795-A823 PolarHBondContact O-N 3.11Å; A823-H832 CarbonylContact C-O 3.6Å; A823-H832 VanDerWaalsContact CA-O 3.3Å; A823-H832 WeakPolarHBondContact CA-O 3.28Å; A823-V833 HydrophobicContact CB-CG2 4.39Å; A823-I855 HydrophobicContact CB-CB 4.06Å; A823-I855 HydrophobicContact CB-CD1 3.92Å; A823-I855 HydrophobicContact CB-CG2 3.75Å; A823-L858 HydrophobicContact CB-CD1 3.99Å; A823-L858 HydrophobicContact CB-CG 4.48Å
824	G	87.3	Confident	81.3	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	164.7	172.6	0	0	0	0	0	112.8	K792 H832	K792-G824 CarbonylContact O-C 3.56Å; K792-G824 WeakPolarHBondContact O-CA 3.49Å; G824-H832 PolarHBondContact N-O 2.98Å; G824-H832 PolarHBondContact O-N 3.33Å
825	A	82.5	Confident	82.8	Confident	22 Å²	22	29.9 Å²	29.9	18%	0.182	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	129	169.8	0	0	0	0	0	110	R791 K792 E794	R791-A825 WeakPolarHBondContact CA-O 3.28Å; K792-A825 PolarHBondContact N-O 3.38Å; K792-A825 PolarHBondContact O-N 3.19Å; E794-A825 HydrophobicContact CG-CB 4.49Å
826	G	70.1	Confident	83.7	Confident	17 Å²	17	29.8 Å²	29.8	18%	0.175	16%	0.161	C	C	.	.			trans	-86	176.5	168.7	0	0	0	0	0	112.6	Q830	G826-Q830 PolarHBondContact N-O 3.1Å
827	E	64.9	Low	84.2	Confident	116 Å²	116	30.5 Å²	30.5	54%	0.542	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-62.5	136.5	169.4	-70.2	152.4	-137.9	0	0	109.5
828	G	64	Low	84.4	Confident	66 Å²	66	29.1 Å²	29.1	68%	0.68	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	75.5	33.3	177.9	0	0	0	0	0	116.3	Q830	G828-Q830 PolarHBondContact O-N 2.79Å; G828-Q830 VanDerWaalsContact O-N 3.15Å
829	F	67.8	Low	84.1	Confident	172 Å²	172	31.4 Å²	31.4	75%	0.754	17%	0.172	S	C	*	.	G	3₁₀ helix	trans	64.2	9	176.7	-57.9	-88.1	0	0	0	116.4	S853 A854	F829-S853 CarbonylContact O-C 3.41Å; F829-A854 PolarHBondContact O-N 2.69Å
830	Q	84.1	Confident	83.4	Confident	101 Å²	101	37.3 Å²	37.3	47%	0.472	19%	0.194	S	C	.	.			trans	-75.3	146.5	174.3	-65.3	-175.9	-0.7	0	0	111.3	G826 G828	G826-Q830 PolarHBondContact N-O 3.1Å; G828-Q830 PolarHBondContact O-N 2.79Å; G828-Q830 VanDerWaalsContact O-N 3.15Å
831	G	86.1	Confident	82.4	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	142.5	175	0	0	0	0	0	111.2	I851 S853	G831-I851 PolarHBondContact N-O 3.13Å; G831-I851 PolarHBondContact O-N 3.22Å; G831-S853 VanDerWaalsContact CA-O 3.29Å; G831-S853 WeakPolarHBondContact CA-O 3.44Å; G831-S853 PolarHBondContact N-O 3.26Å; G831-S853 VanDerWaalsContact N-O 3.14Å
832	H	88.8	Confident	81.7	Confident	4 Å²	4	43 Å²	43	2%	0.019	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	135	-177.7	-169	40.2	0	0	0	110.9	F784 R791 A823 G824 E834 S848 L849 Q850	F784-H832 AromaticContact CD1-CD2 3.66Å; F784-H832 AromaticContact CD1-NE2 3.87Å; F784-H832 AromaticContact CE1-CD2 3.37Å; F784-H832 WeakPolarHBondContact CE1-CD2 3.46Å; R791-H832 PolarHBondContact NH1-CD2 2.79Å; R791-H832 PolarHBondContact NH1-NE2 3.38Å; A823-H832 CarbonylContact C-O 3.6Å; A823-H832 VanDerWaalsContact CA-O 3.3Å; A823-H832 WeakPolarHBondContact CA-O 3.28Å; G824-H832 PolarHBondContact N-O 2.98Å; G824-H832 PolarHBondContact O-N 3.33Å; H832-E834 IonicContact CE1-OE1 3.53Å; H832-E834 IonicContact NE2-OE1 2.76Å; H832-S848 PolarHBondContact CE1-OG 3.49Å; H832-L849 WeakPolarHBondContact CA-O 3.42Å; H832-L849 PolarHBondContact ND1-O 3.23Å; H832-Q850 PolarHBondContact CE1-NE2 3.44Å; H832-Q850 PolarHBondContact ND1-NE2 2.91Å; H832-Q850 PolarHBondContact ND1-OE1 3.12Å; H832-Q850 VanDerWaalsContact ND1-OE1 3.08Å
833	V	90.1	Very high	81.4	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	127.4	176.4	-171.6	0	0	0	0	110.5	W821 V822 A823 I835 S848 L849 I851 I855	W821-V833 HydrophobicContact CB-CG1 4.16Å; W821-V833 HydrophobicContact CD2-CG1 4.36Å; W821-V833 HydrophobicContact CE3-CG1 3.86Å; V822-V833 WeakPolarHBondContact O-CA 3.45Å; A823-V833 HydrophobicContact CB-CG2 4.39Å; V833-I835 HydrophobicContact CG1-CG1 4.1Å; V833-S848 CarbonylContact O-C 3.6Å; V833-S848 WeakPolarHBondContact O-CA 3.33Å; V833-L849 HydrophobicContact CB-CB 4.21Å; V833-L849 HydrophobicContact CB-CD1 4.48Å; V833-L849 PolarHBondContact N-O 3.46Å; V833-L849 PolarHBondContact O-N 3.37Å; V833-I851 HydrophobicContact CG2-CD1 4.2Å; V833-I855 HydrophobicContact CG2-CD1 3.37Å
834	E	90.9	Very high	81.2	Confident	19 Å²	19	51.8 Å²	51.8	9%	0.089	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.5	164.5	-72	-67.3	166.9	0	0	109.7	F784 V822 H832 F836 S848	F784-E834 HydrophobicContact CD1-CG 3.58Å; F784-E834 HydrophobicContact CE1-CG 3.73Å; V822-E834 PolarHBondContact N-O 2.83Å; V822-E834 PolarHBondContact O-N 2.71Å; H832-E834 IonicContact CE1-OE1 3.53Å; H832-E834 IonicContact NE2-OE1 2.76Å; E834-F836 HydrophobicContact CB-CD2 4.4Å; E834-F836 HydrophobicContact CB-CE2 3.69Å; E834-F836 HydrophobicContact CB-CZ 4.38Å; E834-S848 VanDerWaalsContact CD-OG 3.26Å; E834-S848 VanDerWaalsContact OE1-CB 3.26Å; E834-S848 WeakPolarHBondContact OE1-CB 3.5Å; E834-S848 PolarHBondContact OE1-OG 3.48Å; E834-S848 WeakPolarHBondContact OE2-CB 3.48Å
835	I	90.9	Very high	81.2	Confident	12 Å²	12	54.5 Å²	54.5	6%	0.062	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	114.2	-178.3	-57.3	173.7	0	0	0	108.8	Y819 L820 W821 V833 V846 K847 L849	Y819-I835 HydrophobicContact CD1-CG2 4.26Å; L820-I835 WeakPolarHBondContact O-CA 3.36Å; W821-I835 HydrophobicContact CD2-CD1 3.94Å; W821-I835 HydrophobicContact CD2-CG1 3.91Å; W821-I835 HydrophobicContact CE3-CD1 4.22Å; W821-I835 HydrophobicContact CE3-CG1 4.37Å; W821-I835 HydrophobicContact CG-CG1 4.13Å; W821-I835 HydrophobicContact CH2-CD1 3.86Å; W821-I835 HydrophobicContact CZ2-CD1 3.55Å; W821-I835 HydrophobicContact CZ2-CG1 4.4Å; W821-I835 HydrophobicContact CZ3-CD1 4.18Å; V833-I835 HydrophobicContact CG1-CG1 4.1Å; I835-V846 PolarHBondContact O-N 3.13Å; I835-K847 HydrophobicContact CB-CB 4.44Å; I835-K847 WeakPolarHBondContact CB-O 3.29Å; I835-K847 HydrophobicContact CD1-CB 4.4Å; I835-K847 PolarHBondContact N-O 2.79Å; I835-K847 PolarHBondContact O-N 3.23Å; I835-L849 HydrophobicContact CD1-CD1 3.95Å; I835-L849 HydrophobicContact CD1-CG 4.32Å
836	F	89.9	Confident	81.4	Confident	7 Å²	7	57.8 Å²	57.8	3%	0.031	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	132.8	178	-64.3	-104.1	0	0	0	110.9	M781 V783 Y819 L820 V822 E834 P843 R844 A845 L1265	M781-F836 HydrophobicContact CG-CE1 4.5Å; M781-F836 HydrophobicContact SD-CD1 4.12Å; M781-F836 HydrophobicContact SD-CE1 4.02Å; V783-F836 WeakPolarHBondContact O-CZ 3.46Å; Y819-F836 CarbonylContact C-O 3.58Å; Y819-F836 VanDerWaalsContact CA-O 3.27Å; Y819-F836 WeakPolarHBondContact CA-O 3.43Å; L820-F836 HydrophobicContact CB-CB 4.32Å; L820-F836 PolarHBondContact N-O 2.82Å; L820-F836 PolarHBondContact O-N 2.68Å; V822-F836 HydrophobicContact CB-CE2 4.43Å; V822-F836 HydrophobicContact CG2-CD2 4.07Å; V822-F836 HydrophobicContact CG2-CE2 4.07Å; E834-F836 HydrophobicContact CB-CD2 4.4Å; E834-F836 HydrophobicContact CB-CE2 3.69Å; E834-F836 HydrophobicContact CB-CZ 4.38Å; F836-P843 HydrophobicContact CB-CB 4.49Å; F836-R844 CarbonylContact C-O 3.52Å; F836-R844 VanDerWaalsContact CA-O 3.23Å; F836-R844 WeakPolarHBondContact CA-O 3.25Å; F836-A845 HydrophobicContact CD1-CB 4.28Å; F836-A845 HydrophobicContact CE1-CB 4.09Å; F836-A845 HydrophobicContact CZ-CB 4.43Å; F836-L1265 HydrophobicContact CD2-CD1 4.4Å; F836-L1265 HydrophobicContact CE1-CD1 4.46Å; F836-L1265 HydrophobicContact CE2-CD1 4.15Å; F836-L1265 HydrophobicContact CZ-CD1 4.19Å
837	S	87.9	Confident	82.2	Confident	15 Å²	15	60 Å²	60	11%	0.105	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	131.6	166.2	-175.7	0	0	0	0	110.5	N839 P843 R844	S837-N839 WeakPolarHBondContact OG-CB 3.4Å; S837-N839 PolarHBondContact OG-N 2.8Å; S837-N839 PolarHBondContact OG-ND2 3.11Å; S837-P843 WeakPolarHBondContact O-CA 3.47Å; S837-R844 PolarHBondContact N-O 3.37Å; S837-R844 PolarHBondContact O-N 3.28Å
838	L	85.6	Confident	83.3	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.021	30%	0.304	C	S	.	.			trans	-94.4	4.9	172.3	-51.9	-177.1	0	0	0	112.1	P816 G818 L820 R840 P843 T1111 I1237	P816-L838 WeakPolarHBondContact O-CB 3.35Å; P816-L838 WeakPolarHBondContact O-CD1 3.29Å; G818-L838 PolarHBondContact O-N 2.7Å; L820-L838 HydrophobicContact CB-CD1 4.45Å; L820-L838 HydrophobicContact CB-CD2 4.25Å; L820-L838 HydrophobicContact CB-CG 4.45Å; L838-R840 PolarHBondContact O-N 3.45Å; L838-P843 HydrophobicContact CD2-CB 3.88Å; L838-P843 HydrophobicContact CD2-CG 3.68Å; L838-T1111 HydrophobicContact CD1-CG2 4.28Å; L838-I1237 HydrophobicContact CD2-CD1 4.45Å
839	N	78.6	Confident	84.4	Confident	47 Å²	47	55.1 Å²	55.1	25%	0.251	28%	0.277	S	S	.	.	S	Bend	trans	-75.8	18.9	-176.8	-57.8	-18.1	0	0	0	113.3	Q817 G818 S837	Q817-N839 WeakPolarHBondContact CB-OD1 3.44Å; G818-N839 PolarHBondContact N-OD1 2.87Å; S837-N839 WeakPolarHBondContact OG-CB 3.4Å; S837-N839 PolarHBondContact OG-N 2.8Å; S837-N839 PolarHBondContact OG-ND2 3.11Å
840	R	74.4	Confident	85.4	Confident	168 Å²	168	52.4 Å²	52.4	63%	0.634	27%	0.267	S	S	*	.	S	Bend	trans	-144.4	152.4	-177.3	-60.1	-66.5	-177	166.5	0.1	109	L838 T842	L838-R840 PolarHBondContact O-N 3.45Å; R840-T842 WeakPolarHBondContact CB-O 3.21Å; R840-T842 PolarHBondContact O-N 2.95Å; R840-T842 VanDerWaalsContact O-N 3.08Å
841	P	69.8	Low	85.6	Confident	57 Å²	57	48 Å²	48	37%	0.37	25%	0.246	S	C	.	.	S	Bend	trans	-59.2	-21.5	179.1	-27	35.8	0	0	0	115.3
842	T	78.4	Confident	85.6	Confident	76 Å²	76	52 Å²	52	47%	0.466	27%	0.274	S	S	.	.	S	Bend	trans	-120.4	126.4	165	49.6	0	0	0	0	108.9	R840	R840-T842 WeakPolarHBondContact CB-O 3.21Å; R840-T842 PolarHBondContact O-N 2.95Å; R840-T842 VanDerWaalsContact O-N 3.08Å
843	P	86	Confident	85.7	Confident	14 Å²	14	52.6 Å²	52.6	9%	0.091	28%	0.279	C	S	.	.			trans	-57.7	149.8	174.3	-27.9	36.9	0	0	0	112.6	M781 L815 F836 S837 L838	M781-P843 HydrophobicContact CE-CB 3.99Å; M781-P843 HydrophobicContact CE-CG 3.92Å; M781-P843 HydrophobicContact SD-CB 3.94Å; L815-P843 HydrophobicContact CD1-CG 3.8Å; F836-P843 HydrophobicContact CB-CB 4.49Å; S837-P843 WeakPolarHBondContact O-CA 3.47Å; L838-P843 HydrophobicContact CD2-CB 3.88Å; L838-P843 HydrophobicContact CD2-CG 3.68Å
844	R	86.3	Confident	85.7	Confident	171 Å²	171	52.8 Å²	52.8	65%	0.645	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.6	134.9	178	-65.5	-174.3	175.8	-151.7	-4.1	110.3	F836 S837 V846	F836-R844 CarbonylContact C-O 3.52Å; F836-R844 VanDerWaalsContact CA-O 3.23Å; F836-R844 WeakPolarHBondContact CA-O 3.25Å; S837-R844 PolarHBondContact N-O 3.37Å; S837-R844 PolarHBondContact O-N 3.28Å; R844-V846 PolarHBondContact O-N 2.94Å
845	A	87.4	Confident	85.8	Confident	57 Å²	57	51.9 Å²	51.9	47%	0.471	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	133.8	166.6	0	0	0	0	0	109.6	F836	F836-A845 HydrophobicContact CD1-CB 4.28Å; F836-A845 HydrophobicContact CE1-CB 4.09Å; F836-A845 HydrophobicContact CZ-CB 4.43Å
846	V	87.8	Confident	85.8	Confident	90 Å²	90	54.5 Å²	54.5	55%	0.545	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	-40	179.7	178.8	0	0	0	0	110.4	I835 R844	I835-V846 PolarHBondContact O-N 3.13Å; R844-V846 PolarHBondContact O-N 2.94Å
847	K	86.9	Confident	85.9	Confident	64 Å²	64	54.6 Å²	54.6	28%	0.278	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	144.3	-176.7	-169.6	172.8	-167	178.9	0	111.6	I835 L849 T902 A903 A904	I835-K847 HydrophobicContact CB-CB 4.44Å; I835-K847 WeakPolarHBondContact CB-O 3.29Å; I835-K847 HydrophobicContact CD1-CB 4.4Å; I835-K847 PolarHBondContact N-O 2.79Å; I835-K847 PolarHBondContact O-N 3.23Å; K847-L849 HydrophobicContact CD-CD2 3.98Å; K847-L849 HydrophobicContact CG-CD2 4.14Å; K847-T902 VanDerWaalsContact CD-O 3.24Å; K847-T902 WeakPolarHBondContact CD-O 3.45Å; K847-T902 PolarHBondContact NZ-O 3.23Å; K847-A903 VanDerWaalsContact NZ-CA 3.34Å; K847-A903 PolarHBondContact NZ-O 2.98Å; K847-A904 HydrophobicContact CD-CB 4.5Å
848	S	87.8	Confident	86.2	Confident	57 Å²	57	54.5 Å²	54.5	40%	0.399	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	133.9	177.1	-168.8	0	0	0	0	108.8	H832 V833 E834	H832-S848 PolarHBondContact CE1-OG 3.49Å; V833-S848 CarbonylContact O-C 3.6Å; V833-S848 WeakPolarHBondContact O-CA 3.33Å; E834-S848 VanDerWaalsContact CD-OG 3.26Å; E834-S848 VanDerWaalsContact OE1-CB 3.26Å; E834-S848 WeakPolarHBondContact OE1-CB 3.5Å; E834-S848 PolarHBondContact OE1-OG 3.48Å; E834-S848 WeakPolarHBondContact OE2-CB 3.48Å
849	L	87.4	Confident	86.6	Confident	23 Å²	23	55 Å²	55	12%	0.12	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	142.7	-178.3	-55.5	176.9	0	0	0	110.5	W821 H832 V833 I835 K847 A904	W821-L849 HydrophobicContact CH2-CD1 4.19Å; W821-L849 HydrophobicContact CZ3-CD1 3.95Å; H832-L849 WeakPolarHBondContact CA-O 3.42Å; H832-L849 PolarHBondContact ND1-O 3.23Å; V833-L849 HydrophobicContact CB-CB 4.21Å; V833-L849 HydrophobicContact CB-CD1 4.48Å; V833-L849 PolarHBondContact N-O 3.46Å; V833-L849 PolarHBondContact O-N 3.37Å; I835-L849 HydrophobicContact CD1-CD1 3.95Å; I835-L849 HydrophobicContact CD1-CG 4.32Å; K847-L849 HydrophobicContact CD-CD2 3.98Å; K847-L849 HydrophobicContact CG-CD2 4.14Å; L849-A904 HydrophobicContact CD1-CB 4.09Å; L849-A904 HydrophobicContact CD2-CB 4.15Å
850	Q	87.8	Confident	87.2	Confident	114 Å²	114	54.1 Å²	54.1	53%	0.533	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	136.7	168.5	-58.4	-63.3	-0.8	0	0	109.3	H832	H832-Q850 PolarHBondContact CE1-NE2 3.44Å; H832-Q850 PolarHBondContact ND1-NE2 2.91Å; H832-Q850 PolarHBondContact ND1-OE1 3.12Å; H832-Q850 VanDerWaalsContact ND1-OE1 3.08Å
851	I	88.5	Confident	87.8	Confident	9 Å²	9	46.1 Å²	46.1	5%	0.046	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	140.9	-179.5	-54.7	-168.1	0	0	0	108.5	G831 V833 S853 I855 V887 L889 L895 Y897	G831-I851 PolarHBondContact N-O 3.13Å; G831-I851 PolarHBondContact O-N 3.22Å; V833-I851 HydrophobicContact CG2-CD1 4.2Å; I851-S853 PolarHBondContact O-N 3.28Å; I851-S853 VanDerWaalsContact O-N 3.13Å; I851-I855 HydrophobicContact CD1-CD1 3.84Å; I851-I855 HydrophobicContact CD1-CG1 4.26Å; I851-I855 HydrophobicContact CG1-CD1 4.38Å; I851-V887 HydrophobicContact CD1-CG1 4.26Å; I851-L889 HydrophobicContact CG2-CD1 3.87Å; I851-L889 HydrophobicContact CG2-CD2 3.92Å; I851-L895 HydrophobicContact CD1-CD1 4.33Å; I851-L895 HydrophobicContact CG2-CD1 3.79Å; I851-Y897 HydrophobicContact CD1-CE2 4.42Å
852	S	86	Confident	88.1	Confident	84 Å²	84	49 Å²	49	59%	0.587	26%	0.259	S	S	*	.	S	Bend	trans	-64.2	-16.4	-170.6	46.8	0	0	0	0	115.8
853	S	90.3	Very high	87.6	Confident	16 Å²	16	47.1 Å²	47.1	11%	0.112	25%	0.251	C	S	.	.	S	Bend	trans	-141.2	156.7	179	-176.4	0	0	0	0	110.3	F829 G831 I851 D891	F829-S853 CarbonylContact O-C 3.41Å; G831-S853 VanDerWaalsContact CA-O 3.29Å; G831-S853 WeakPolarHBondContact CA-O 3.44Å; G831-S853 PolarHBondContact N-O 3.26Å; G831-S853 VanDerWaalsContact N-O 3.14Å; I851-S853 PolarHBondContact O-N 3.28Å; I851-S853 VanDerWaalsContact O-N 3.13Å; S853-D891 WeakPolarHBondContact CB-OD2 3.4Å; S853-D891 PolarHBondContact OG-N 2.83Å
854	A	90.6	Very high	86.4	Confident	4 Å²	4	49.2 Å²	49.2	3%	0.033	27%	0.265	C	S	.	.			trans	-62.8	136.6	-176.4	0	0	0	0	0	111.6	F829 L889 D890	F829-A854 PolarHBondContact O-N 2.69Å; A854-L889 WeakPolarHBondContact O-CA 3.34Å; A854-D890 HydrophobicContact CB-CB 4.17Å; A854-D890 PolarHBondContact O-N 3.08Å
855	I	92.6	Very high	84.5	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	132.1	-178.6	-57.6	157.5	0	0	0	108.7	E794 T795 A823 V833 I851 L858 V887 L889	E794-I855 WeakPolarHBondContact CB-O 3.46Å; E794-I855 WeakPolarHBondContact CG-O 3.43Å; T795-I855 HydrophobicContact CG2-CG2 4.26Å; A823-I855 HydrophobicContact CB-CB 4.06Å; A823-I855 HydrophobicContact CB-CD1 3.92Å; A823-I855 HydrophobicContact CB-CG2 3.75Å; V833-I855 HydrophobicContact CG2-CD1 3.37Å; I851-I855 HydrophobicContact CD1-CD1 3.84Å; I851-I855 HydrophobicContact CD1-CG1 4.26Å; I851-I855 HydrophobicContact CG1-CD1 4.38Å; I855-L858 HydrophobicContact CG2-CD2 4.23Å; I855-L858 HydrophobicContact CG2-CG 4.46Å; I855-V887 HydrophobicContact CB-CG1 4.46Å; I855-V887 HydrophobicContact CD1-CG1 4.43Å; I855-V887 HydrophobicContact CG1-CG1 4Å; I855-V887 HydrophobicContact CG2-CG1 3.71Å; I855-L889 HydrophobicContact CB-CD2 4.41Å; I855-L889 HydrophobicContact CG1-CD2 3.77Å
856	R	91.9	Very high	82.4	Confident	68 Å²	68	47.2 Å²	47.2	26%	0.257	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-38.1	178.5	-63.7	-58.8	-175.6	-157.9	-7.8	113	E794 G888 D890 V918	E794-R856 IonicContact OE1-NH1 2.63Å; E794-R856 IonicContact OE2-CZ 2.85Å; E794-R856 IonicContact OE2-NH1 3.67Å; E794-R856 PolarHBondContact OE2-NH1 3.13Å; R856-G888 PolarHBondContact N-O 3.2Å; R856-D890 IonicContact CZ-OD1 3.84Å; R856-D890 IonicContact CZ-OD2 2.74Å; R856-D890 IonicContact NE-OD1 2.66Å; R856-D890 PolarHBondContact NE-OD1 3.32Å; R856-D890 IonicContact NE-OD2 3.66Å; R856-D890 IonicContact NH2-OD1 2.68Å; R856-D890 PolarHBondContact NH2-OD1 3.46Å; R856-D890 IonicContact NH2-OD2 3.13Å; R856-D890 PolarHBondContact NH2-OD2 3.31Å; R856-V918 WeakPolarHBondContact CB-O 3.41Å
857	C	93	Very high	79.9	Confident	9 Å²	9	47.7 Å²	47.7	6%	0.061	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	150.6	-176.9	57.3	0	0	0	0	112.8	G888 C920	C857-G888 PolarHBondContact O-N 2.74Å; C857-C920 VanDerWaalsContact SG-CA 3.59Å
858	L	94.2	Very high	77.4	Confident	12 Å²	12	54 Å²	54	6%	0.063	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	140.5	174.8	-65.8	173.3	0	0	0	109	T795 L797 W821 A823 I855 C886 V887	T795-L858 HydrophobicContact CG2-CB 4.38Å; T795-L858 HydrophobicContact CG2-CD1 3.99Å; T795-L858 HydrophobicContact CG2-CG 3.76Å; L797-L858 HydrophobicContact CB-CB 3.72Å; L797-L858 HydrophobicContact CB-CD1 3.92Å; L797-L858 HydrophobicContact CB-CG 4.48Å; L797-L858 HydrophobicContact CD2-CB 3.98Å; L797-L858 HydrophobicContact CG-CB 4.36Å; W821-L858 HydrophobicContact CB-CD1 4.3Å; A823-L858 HydrophobicContact CB-CD1 3.99Å; A823-L858 HydrophobicContact CB-CG 4.48Å; I855-L858 HydrophobicContact CG2-CD2 4.23Å; I855-L858 HydrophobicContact CG2-CG 4.46Å; L858-C886 WeakPolarHBondContact CA-O 3.28Å; L858-V887 HydrophobicContact CD2-CB 4.09Å; L858-V887 HydrophobicContact CD2-CG1 3.83Å; L858-V887 HydrophobicContact CD2-CG2 3.66Å
859	E	93.4	Very high	74.8	Confident	14 Å²	14	60 Å²	60	7%	0.065	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	133	174	176.3	70.1	155.4	0	0	110.7	L797 V861 C886 L921 K922 H923	L797-E859 VanDerWaalsContact CD2-C 3.5Å; E859-V861 HydrophobicContact CG-CG2 4.36Å; E859-C886 HydrophobicContact CB-CB 4.47Å; E859-C886 PolarHBondContact N-O 3.45Å; E859-C886 PolarHBondContact O-N 3.05Å; E859-L921 HydrophobicContact CB-CB 3.83Å; E859-K922 WeakPolarHBondContact OE1-CA 3.26Å; E859-K922 IonicContact OE1-NZ 2.69Å; E859-K922 IonicContact OE2-NZ 3.54Å; E859-K922 PolarHBondContact OE2-NZ 2.84Å; E859-H923 IonicContact OE1-CE1 3.08Å; E859-H923 IonicContact OE1-CG 2.69Å; E859-H923 PolarHBondContact OE1-N 2.9Å; E859-H923 IonicContact OE1-ND1 3.99Å; E859-H923 PolarHBondContact OE1-ND1 2.84Å
860	Y	89.9	Confident	72.2	Confident	30 Å²	30	62.6 Å²	62.6	12%	0.118	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	121.6	173.5	176.7	-119.1	0	0	0	109.2	N799 P800 Q862 T883 I885 H923	N799-Y860 WeakPolarHBondContact OD1-CE2 3.42Å; P800-Y860 VanDerWaalsContact CD-CE1 3.47Å; P800-Y860 HydrophobicContact CG-CD1 4.33Å; P800-Y860 HydrophobicContact CG-CE1 3.67Å; Y860-Q862 HydrophobicContact CD1-CG 4.11Å; Y860-Q862 HydrophobicContact CE1-CG 3.58Å; Y860-T883 WeakPolarHBondContact OH-CB 3.34Å; Y860-T883 WeakPolarHBondContact OH-CG2 3.31Å; Y860-T883 PolarHBondContact OH-OG1 2.67Å; Y860-I885 HydrophobicContact CD2-CG1 4.15Å; Y860-H923 PolarHBondContact O-CE1 3.32Å; Y860-H923 PolarHBondContact O-ND1 3.1Å
861	V	86.9	Confident	69.4	Low	0 Å²	0	64.9 Å²	64.9	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	116.9	-177.9	176	0	0	0	0	109	E859 N884 H923 W949	E859-V861 HydrophobicContact CG-CG2 4.36Å; V861-N884 HydrophobicContact CB-CB 4.26Å; V861-N884 PolarHBondContact N-O 3.04Å; V861-N884 PolarHBondContact O-N 2.73Å; V861-H923 HydrophobicContact CG2-CB 4.15Å; V861-W949 HydrophobicContact CB-CZ2 4.42Å; V861-W949 HydrophobicContact CG1-CH2 4.4Å; V861-W949 HydrophobicContact CG1-CZ2 3.61Å; V861-W949 HydrophobicContact CG2-CZ2 3.91Å
862	Q	77	Confident	66.9	Low	116 Å²	116	71.1 Å²	71.1	54%	0.542	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-76.9	145.7	173	-67.4	-173.4	1.4	0	0	111.1	Y860 H923 R942	Y860-Q862 HydrophobicContact CD1-CG 4.11Å; Y860-Q862 HydrophobicContact CE1-CG 3.58Å; Q862-H923 PolarHBondContact N-NE2 2.86Å; Q862-R942 PolarHBondContact O-NH2 3.17Å
863	A	67.3	Low	64.3	Low	38 Å²	38	69.4 Å²	69.4	31%	0.314	41%	0.408	S	S	.	.	P	Polyproline II helix	trans	-68.3	139.8	170.2	0	0	0	0	0	108.5	S865 T883	A863-S865 PolarHBondContact O-N 2.89Å; A863-T883 HydrophobicContact CB-CG2 4.14Å
864	P	61.1	Low	61.9	Low	58 Å²	58	77.1 Å²	77.1	38%	0.377	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-64.3	134.2	178.5	28.3	-32.6	0	0	0	109.9	D947	P864-D947 WeakPolarHBondContact CG-OD1 3.22Å
865	S	45.7	Very low	59	Low	70 Å²	70	84.9 Å²	84.9	49%	0.49	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-67.5	129.4	166.4	56.8	0	0	0	0	108.7	A863 T867	A863-S865 PolarHBondContact O-N 2.89Å; S865-T867 PolarHBondContact O-N 3.26Å
866	P	44.1	Very low	56	Low	116 Å²	116	94.8 Å²	94.8	75%	0.753	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-60.5	124.8	173.8	25.8	-33.5	0	0	0	109.3
867	T	36.2	Very low	53	Low	100 Å²	100	96.6 Å²	96.6	61%	0.613	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-74.1	129.5	171.6	37	0	0	0	0	109.6	S865 E869	S865-T867 PolarHBondContact O-N 3.26Å; T867-E869 PolarHBondContact O-N 3.33Å
868	E	33.8	Very low	50.1	Low	196 Å²	196	100.3 Å²	100.3	92%	0.916	59%	0.586	S	S	*	*	S	Bend	trans	-78.1	59.5	179.3	-64.3	-169.9	164	0	0	112.4
869	E	33.6	Very low	47.3	Very low	182 Å²	182	105.5 Å²	105.5	85%	0.85	63%	0.631	S	S	*	*			trans	-139.2	121.2	166.4	-69.6	-173.5	179.9	0	0	108.9	T867	T867-E869 PolarHBondContact O-N 3.33Å
870	G	31.1	Very low	44.8	Very low	78 Å²	78	107.2 Å²	107.2	80%	0.804	65%	0.652	S	S	*	*	S	Bend	trans	117.2	76.9	167	0	0	0	0	0	118.3
871	D	29.5	Very low	42.7	Very low	163 Å²	163	108.4 Å²	108.4	87%	0.872	67%	0.668	S	S	*	*			trans	71.4	163.4	144.6	-144.6	0.7	0	0	0	121
872	V	37	Very low	41.4	Very low	139 Å²	139	109.4 Å²	109.4	84%	0.842	68%	0.679	S	S	*	*			trans	-102.2	88.1	-164.8	-176	0	0	0	0	111.8
873	G	30.8	Very low	41.3	Very low	48 Å²	48	105.6 Å²	105.6	50%	0.495	66%	0.663	S	S	.	*			trans	-118.3	121.1	173.4	0	0	0	0	0	113.1	H875	G873-H875 VanDerWaalsContact C-N 3.31Å; G873-H875 PolarHBondContact O-N 2.73Å
874	I	38.9	Very low	42.3	Very low	179 Å²	179	104.3 Å²	104.3	92%	0.918	65%	0.651	S	S	*	*			trans	-78.1	82.5	173.4	-58	169.8	0	0	0	109.5
875	H	31.3	Very low	43.6	Very low	167 Å²	167	101.5 Å²	101.5	77%	0.773	63%	0.633	S	S	*	*			trans	-88.4	129.4	170.9	-69.4	-85.5	0	0	0	110.6	G873 A877	G873-H875 VanDerWaalsContact C-N 3.31Å; G873-H875 PolarHBondContact O-N 2.73Å; H875-A877 PolarHBondContact O-N 2.98Å
876	K	28.4	Very low	45.9	Very low	207 Å²	207	98.2 Å²	98.2	90%	0.9	61%	0.61	S	S	*	*			trans	-56.2	130.2	168.3	-77	-179.2	174.2	179.5	0	108.6	A878	K876-A878 PolarHBondContact O-N 2.95Å
877	A	28.7	Very low	48.2	Very low	107 Å²	107	92.7 Å²	92.7	88%	0.884	57%	0.574	S	S	*	*			trans	-65.3	98.7	172.6	0	0	0	0	0	109.7	H875	H875-A877 PolarHBondContact O-N 2.98Å
878	A	31.9	Very low	51	Low	86 Å²	86	87.9 Å²	87.9	71%	0.711	55%	0.545	S	S	*	.			trans	-64.6	137.1	173.2	0	0	0	0	0	109.8	K876 G880	K876-A878 PolarHBondContact O-N 2.95Å; A878-G880 PolarHBondContact O-N 2.9Å
879	A	37.1	Very low	53.9	Low	122 Å²	122	78.6 Å²	78.6	100%	1.008	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	62.2	177.5	0	0	0	0	0	111.2
880	G	40.1	Very low	56.7	Low	50 Å²	50	71.9 Å²	71.9	52%	0.515	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.9	-28.1	-175.9	0	0	0	0	0	115.1	A878 G882	A878-G880 PolarHBondContact O-N 2.9Å; G880-G882 VanDerWaalsContact C-N 3.3Å; G880-G882 PolarHBondContact O-N 3.18Å
881	A	46.3	Very low	59.5	Low	54 Å²	54	70.5 Å²	70.5	45%	0.446	45%	0.445	S	S	.	.			trans	-70	81.4	178.9	0	0	0	0	0	112.1
882	G	59.7	Low	62.5	Low	22 Å²	22	62.8 Å²	62.8	23%	0.227	40%	0.404	C	S	.	.			trans	-120.9	155.7	179.1	0	0	0	0	0	112.5	G880	G880-G882 VanDerWaalsContact C-N 3.3Å; G880-G882 PolarHBondContact O-N 3.18Å
883	T	75.2	Confident	65.2	Low	36 Å²	36	60 Å²	60	22%	0.221	38%	0.379	C	S	.	.			trans	-71.9	146.7	165.3	53.2	0	0	0	0	109	Y860 A863 S899	Y860-T883 WeakPolarHBondContact OH-CB 3.34Å; Y860-T883 WeakPolarHBondContact OH-CG2 3.31Å; Y860-T883 PolarHBondContact OH-OG1 2.67Å; A863-T883 HydrophobicContact CB-CG2 4.14Å; T883-S899 WeakPolarHBondContact O-CB 3.47Å; T883-S899 PolarHBondContact O-N 3.33Å; T883-S899 WeakPolarHBondContact OG1-CB 3.26Å; T883-S899 PolarHBondContact OG1-OG 3.29Å
884	N	87.1	Confident	68.2	Low	10 Å²	10	57.7 Å²	57.7	5%	0.053	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	155.1	-168.6	-73.1	-35.1	0	0	0	111.5	V861 V896 Y897	V861-N884 HydrophobicContact CB-CB 4.26Å; V861-N884 PolarHBondContact N-O 3.04Å; V861-N884 PolarHBondContact O-N 2.73Å; N884-V896 HydrophobicContact CB-CG1 3.97Å; N884-Y897 CarbonylContact C-O 3.51Å; N884-Y897 WeakPolarHBondContact CA-O 3.42Å
885	I	90	Very high	70.8	Confident	0 Å²	0	50 Å²	50	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	119.2	175.9	-66.1	171.6	0	0	0	108.2	L797 N799 W821 Y860 V887 V896 Y897	L797-I885 HydrophobicContact CD2-CG1 4.31Å; L797-I885 HydrophobicContact CD2-CG2 3.79Å; N799-I885 HydrophobicContact CB-CD1 4.18Å; W821-I885 HydrophobicContact CD2-CD1 3.9Å; W821-I885 VanDerWaalsContact CE2-CD1 3.44Å; W821-I885 HydrophobicContact CE3-CD1 4.43Å; W821-I885 HydrophobicContact CE3-CG2 4.24Å; W821-I885 HydrophobicContact CG-CD1 4.35Å; W821-I885 HydrophobicContact CH2-CD1 4.25Å; W821-I885 HydrophobicContact CZ2-CD1 3.65Å; W821-I885 HydrophobicContact CZ3-CG2 4.4Å; Y860-I885 HydrophobicContact CD2-CG1 4.15Å; I885-V887 HydrophobicContact CG2-CG2 4.25Å; I885-V896 WeakPolarHBondContact O-CA 3.37Å; I885-Y897 PolarHBondContact N-O 3.47Å; I885-Y897 PolarHBondContact O-N 2.94Å
886	C	92.8	Very high	73.6	Confident	0 Å²	0	42 Å²	42	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	133.1	178.2	-62.9	0	0	0	0	110.2	L858 E859 I894 L895 L921	L858-C886 WeakPolarHBondContact CA-O 3.28Å; E859-C886 HydrophobicContact CB-CB 4.47Å; E859-C886 PolarHBondContact N-O 3.45Å; E859-C886 PolarHBondContact O-N 3.05Å; C886-I894 HydrophobicContact CB-CG2 4.18Å; C886-L895 CarbonylContact C-O 3.47Å; C886-L895 WeakPolarHBondContact CA-O 3.42Å; C886-L921 HydrophobicContact CB-CD1 4.13Å
887	V	93.7	Very high	76.4	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	112	-173.9	-173.8	0	0	0	0	109.1	I851 I855 L858 I885 L889 I894 L895 Y897	I851-V887 HydrophobicContact CD1-CG1 4.26Å; I855-V887 HydrophobicContact CB-CG1 4.46Å; I855-V887 HydrophobicContact CD1-CG1 4.43Å; I855-V887 HydrophobicContact CG1-CG1 4Å; I855-V887 HydrophobicContact CG2-CG1 3.71Å; L858-V887 HydrophobicContact CD2-CB 4.09Å; L858-V887 HydrophobicContact CD2-CG1 3.83Å; L858-V887 HydrophobicContact CD2-CG2 3.66Å; I885-V887 HydrophobicContact CG2-CG2 4.25Å; V887-L889 HydrophobicContact CG1-CD2 3.95Å; V887-I894 CarbonylContact O-C 3.49Å; V887-I894 VanDerWaalsContact O-CA 3.3Å; V887-I894 WeakPolarHBondContact O-CA 3.39Å; V887-L895 HydrophobicContact CB-CB 4.3Å; V887-L895 PolarHBondContact N-O 3.09Å; V887-L895 PolarHBondContact O-N 3.13Å; V887-Y897 HydrophobicContact CB-CE2 4.46Å; V887-Y897 HydrophobicContact CG2-CD2 3.71Å; V887-Y897 HydrophobicContact CG2-CE2 3.79Å
888	G	94.3	Very high	78.9	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	129.6	179.8	0	0	0	0	0	112	R856 C857	R856-G888 PolarHBondContact N-O 3.2Å; C857-G888 PolarHBondContact O-N 2.74Å
889	L	94.1	Very high	80.8	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	159.3	-173.2	-55.4	-173.7	0	0	0	113.4	I851 A854 I855 V887 D891 G892 R893 L895 V918	I851-L889 HydrophobicContact CG2-CD1 3.87Å; I851-L889 HydrophobicContact CG2-CD2 3.92Å; A854-L889 WeakPolarHBondContact O-CA 3.34Å; I855-L889 HydrophobicContact CB-CD2 4.41Å; I855-L889 HydrophobicContact CG1-CD2 3.77Å; V887-L889 HydrophobicContact CG1-CD2 3.95Å; L889-D891 WeakPolarHBondContact CB-OD1 3.39Å; L889-D891 PolarHBondContact O-N 3.09Å; L889-G892 PolarHBondContact O-N 2.64Å; L889-R893 WeakPolarHBondContact CB-O 3.43Å; L889-R893 HydrophobicContact CD1-CB 4.34Å; L889-R893 PolarHBondContact N-O 3.03Å; L889-L895 HydrophobicContact CD1-CD1 3.98Å; L889-L895 HydrophobicContact CD1-CG 4.03Å; L889-V918 PolarHBondContact O-N 3.03Å; L889-V918 VanDerWaalsContact O-N 3.1Å
890	D	92	Very high	81.9	Confident	41 Å²	41	23.4 Å²	23.4	22%	0.219	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-9.7	177	-141.4	43.6	0	0	0	113.3	A854 R856 P917	A854-D890 HydrophobicContact CB-CB 4.17Å; A854-D890 PolarHBondContact O-N 3.08Å; R856-D890 IonicContact CZ-OD1 3.84Å; R856-D890 IonicContact CZ-OD2 2.74Å; R856-D890 IonicContact NE-OD1 2.66Å; R856-D890 PolarHBondContact NE-OD1 3.32Å; R856-D890 IonicContact NE-OD2 3.66Å; R856-D890 IonicContact NH2-OD1 2.68Å; R856-D890 PolarHBondContact NH2-OD1 3.46Å; R856-D890 IonicContact NH2-OD2 3.13Å; R856-D890 PolarHBondContact NH2-OD2 3.31Å; D890-P917 WeakPolarHBondContact O-CG 3.45Å
891	D	91.8	Very high	82.6	Confident	49 Å²	49	24.2 Å²	24.2	26%	0.262	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	10.2	177.1	69.7	3	0	0	0	114.1	S853 L889 R893	S853-D891 WeakPolarHBondContact CB-OD2 3.4Å; S853-D891 PolarHBondContact OG-N 2.83Å; L889-D891 WeakPolarHBondContact CB-OD1 3.39Å; L889-D891 PolarHBondContact O-N 3.09Å; D891-R893 VanDerWaalsContact C-N 3.34Å; D891-R893 PolarHBondContact O-N 2.8Å; D891-R893 WeakPolarHBondContact OD1-CB 3.48Å; D891-R893 PolarHBondContact OD1-N 3.42Å; D891-R893 VanDerWaalsContact OD1-N 3.15Å; D891-R893 IonicContact OD1-NE 3.59Å; D891-R893 PolarHBondContact OD1-NE 2.95Å; D891-R893 IonicContact OD2-CZ 2.74Å; D891-R893 IonicContact OD2-NE 3.2Å; D891-R893 PolarHBondContact OD2-NE 3.36Å; D891-R893 IonicContact OD2-NH2 3.44Å; D891-R893 PolarHBondContact OD2-NH2 2.78Å
892	G	90.9	Very high	82.9	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.01	16%	0.156	C	C	.	.	S	Bend	trans	84.1	-0.3	178.2	0	0	0	0	0	115.7	L889 N912 C916	L889-G892 PolarHBondContact O-N 2.64Å; G892-N912 WeakPolarHBondContact CA-OD1 3.26Å; G892-N912 VanDerWaalsContact O-CG 3.27Å; G892-N912 PolarHBondContact O-N 2.9Å; G892-N912 PolarHBondContact O-OD1 3.44Å; G892-C916 WeakPolarHBondContact CA-O 3.47Å
893	R	93.8	Very high	82.8	Confident	81 Å²	81	27.2 Å²	27.2	31%	0.306	17%	0.165	S	C	.	.			trans	-85.8	151.5	174.6	-64.6	-174.8	-75.3	-167.8	-7.6	112.7	L889 D891 T909 L910	L889-R893 WeakPolarHBondContact CB-O 3.43Å; L889-R893 HydrophobicContact CD1-CB 4.34Å; L889-R893 PolarHBondContact N-O 3.03Å; D891-R893 VanDerWaalsContact C-N 3.34Å; D891-R893 PolarHBondContact O-N 2.8Å; D891-R893 WeakPolarHBondContact OD1-CB 3.48Å; D891-R893 PolarHBondContact OD1-N 3.42Å; D891-R893 VanDerWaalsContact OD1-N 3.15Å; D891-R893 IonicContact OD1-NE 3.59Å; D891-R893 PolarHBondContact OD1-NE 2.95Å; D891-R893 IonicContact OD2-CZ 2.74Å; D891-R893 IonicContact OD2-NE 3.2Å; D891-R893 PolarHBondContact OD2-NE 3.36Å; D891-R893 IonicContact OD2-NH2 3.44Å; D891-R893 PolarHBondContact OD2-NH2 2.78Å; R893-T909 HydrophobicContact CB-CG2 4.27Å; R893-T909 HydrophobicContact CG-CG2 4.36Å; R893-L910 WeakPolarHBondContact CA-O 3.42Å
894	I	94.4	Very high	82.3	Confident	0 Å²	0	26 Å²	26	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	115.7	168.7	-51.2	161	0	0	0	108.1	C886 V887 T909 L910 V918 L921 A930 Y940	C886-I894 HydrophobicContact CB-CG2 4.18Å; V887-I894 CarbonylContact O-C 3.49Å; V887-I894 VanDerWaalsContact O-CA 3.3Å; V887-I894 WeakPolarHBondContact O-CA 3.39Å; I894-T909 WeakPolarHBondContact O-CA 3.24Å; I894-L910 HydrophobicContact CB-CB 4.16Å; I894-L910 HydrophobicContact CB-CD1 4.46Å; I894-L910 HydrophobicContact CD1-CB 4.47Å; I894-L910 HydrophobicContact CD1-CD1 4.31Å; I894-L910 PolarHBondContact N-O 2.94Å; I894-L910 PolarHBondContact O-N 3.33Å; I894-V918 HydrophobicContact CG1-CG1 4.41Å; I894-V918 HydrophobicContact CG1-CG2 4.03Å; I894-L921 HydrophobicContact CD1-CD2 3.87Å; I894-L921 HydrophobicContact CG1-CD2 4.3Å; I894-L921 HydrophobicContact CG2-CD1 3.94Å; I894-L921 HydrophobicContact CG2-CD2 4.32Å; I894-A930 HydrophobicContact CD1-CB 3.79Å; I894-Y940 HydrophobicContact CD1-CD2 4.48Å; I894-Y940 HydrophobicContact CD1-CE2 3.65Å
895	L	92.5	Very high	81.6	Confident	17 Å²	17	31.3 Å²	31.3	9%	0.089	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	136.8	175.7	-53.3	-178.9	0	0	0	109.9	I851 C886 V887 L889 Y897 T909	I851-L895 HydrophobicContact CD1-CD1 4.33Å; I851-L895 HydrophobicContact CG2-CD1 3.79Å; C886-L895 CarbonylContact C-O 3.47Å; C886-L895 WeakPolarHBondContact CA-O 3.42Å; V887-L895 HydrophobicContact CB-CB 4.3Å; V887-L895 PolarHBondContact N-O 3.09Å; V887-L895 PolarHBondContact O-N 3.13Å; L889-L895 HydrophobicContact CD1-CD1 3.98Å; L889-L895 HydrophobicContact CD1-CG 4.03Å; L895-Y897 HydrophobicContact CB-CD2 4.31Å; L895-Y897 HydrophobicContact CB-CE2 3.68Å; L895-Y897 HydrophobicContact CD1-CE2 4.13Å; L895-T909 HydrophobicContact CD2-CG2 3.79Å; L895-T909 WeakPolarHBondContact CD2-OG1 3.28Å
896	V	90.4	Very high	81.3	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	117.2	177.4	-171.8	0	0	0	0	109	N884 I885 C906 L907 L908	N884-V896 HydrophobicContact CB-CG1 3.97Å; I885-V896 WeakPolarHBondContact O-CA 3.37Å; V896-C906 CarbonylContact O-C 3.58Å; V896-L907 PolarHBondContact O-N 3.31Å; V896-L908 HydrophobicContact CB-CB 4.05Å; V896-L908 HydrophobicContact CG2-CB 4.1Å; V896-L908 HydrophobicContact CG2-CG 4.49Å; V896-L908 PolarHBondContact N-O 2.92Å; V896-L908 PolarHBondContact O-N 2.91Å
897	Y	87.9	Confident	80.9	Confident	22 Å²	22	38.5 Å²	38.5	9%	0.086	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	142.5	177.8	-67.8	-88	0	0	0	111.1	W821 I851 N884 I885 V887 L895 A904 Q905 C906	W821-Y897 HydrophobicContact CH2-CG 4.38Å; I851-Y897 HydrophobicContact CD1-CE2 4.42Å; N884-Y897 CarbonylContact C-O 3.51Å; N884-Y897 WeakPolarHBondContact CA-O 3.42Å; I885-Y897 PolarHBondContact N-O 3.47Å; I885-Y897 PolarHBondContact O-N 2.94Å; V887-Y897 HydrophobicContact CB-CE2 4.46Å; V887-Y897 HydrophobicContact CG2-CD2 3.71Å; V887-Y897 HydrophobicContact CG2-CE2 3.79Å; L895-Y897 HydrophobicContact CB-CD2 4.31Å; L895-Y897 HydrophobicContact CB-CE2 3.68Å; L895-Y897 HydrophobicContact CD1-CE2 4.13Å; Y897-A904 VanDerWaalsContact CD1-O 3.26Å; Y897-A904 WeakPolarHBondContact CD1-O 3.5Å; Y897-A904 VanDerWaalsContact CE1-O 3.29Å; Y897-A904 WeakPolarHBondContact CE1-O 3.26Å; Y897-Q905 WeakPolarHBondContact CD1-O 3.33Å; Y897-C906 HydrophobicContact CD1-CB 4.28Å; Y897-C906 HydrophobicContact CE1-CB 3.91Å
898	G	81.8	Confident	80.7	Confident	13 Å²	13	40.2 Å²	40.2	13%	0.134	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	131.4	171.7	0	0	0	0	0	111.4	A900	G898-A900 VanDerWaalsContact C-N 3.34Å
899	S	70.9	Confident	80.5	Confident	22 Å²	22	42.4 Å²	42.4	15%	0.154	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-31.5	178.2	175.1	0	0	0	0	113.4	N799 T883	N799-S899 PolarHBondContact ND2-OG 3.3Å; N799-S899 PolarHBondContact OD1-OG 3.43Å; T883-S899 WeakPolarHBondContact O-CB 3.47Å; T883-S899 PolarHBondContact O-N 3.33Å; T883-S899 WeakPolarHBondContact OG1-CB 3.26Å; T883-S899 PolarHBondContact OG1-OG 3.29Å
900	A	60.7	Low	80.3	Confident	74 Å²	74	42.4 Å²	42.4	61%	0.612	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-12.4	-168.5	0	0	0	0	0	114.9	G898	G898-A900 VanDerWaalsContact C-N 3.34Å
901	D	54.1	Low	80.1	Confident	67 Å²	67	45.8 Å²	45.8	36%	0.358	26%	0.261	S	S	.	.			trans	-116	116.1	-175	-179.2	8.5	0	0	0	111	A903 A904 Q905	D901-A903 PolarHBondContact O-N 3.2Å; D901-A903 WeakPolarHBondContact OD1-CA 3.44Å; D901-A903 WeakPolarHBondContact OD1-CB 3.36Å; D901-A903 PolarHBondContact OD1-N 3.06Å; D901-A903 WeakPolarHBondContact OD2-CB 3.48Å; D901-A904 PolarHBondContact O-N 3.26Å; D901-Q905 PolarHBondContact OD2-NE2 2.87Å
902	T	53.6	Low	79.9	Confident	89 Å²	89	44.1 Å²	44.1	55%	0.546	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-11.6	175.6	63.3	0	0	0	0	113.1	K847 A904	K847-T902 VanDerWaalsContact CD-O 3.24Å; K847-T902 WeakPolarHBondContact CD-O 3.45Å; K847-T902 PolarHBondContact NZ-O 3.23Å; T902-A904 PolarHBondContact O-N 2.91Å
903	A	56.2	Low	79.3	Confident	49 Å²	49	49.2 Å²	49.2	41%	0.405	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-15.7	165.2	0	0	0	0	0	112.5	K847 D901 Q905	K847-A903 VanDerWaalsContact NZ-CA 3.34Å; K847-A903 PolarHBondContact NZ-O 2.98Å; D901-A903 PolarHBondContact O-N 3.2Å; D901-A903 WeakPolarHBondContact OD1-CA 3.44Å; D901-A903 WeakPolarHBondContact OD1-CB 3.36Å; D901-A903 PolarHBondContact OD1-N 3.06Å; D901-A903 WeakPolarHBondContact OD2-CB 3.48Å; A903-Q905 HydrophobicContact CB-CG 4.13Å; A903-Q905 PolarHBondContact O-N 2.9Å
904	A	64.9	Low	78.7	Confident	11 Å²	11	50 Å²	50	9%	0.091	29%	0.293	C	S	.	.			trans	52.4	51	172.6	0	0	0	0	0	112.5	W821 K847 L849 Y897 D901 T902	W821-A904 HydrophobicContact CH2-CB 4.34Å; K847-A904 HydrophobicContact CD-CB 4.5Å; L849-A904 HydrophobicContact CD1-CB 4.09Å; L849-A904 HydrophobicContact CD2-CB 4.15Å; Y897-A904 VanDerWaalsContact CD1-O 3.26Å; Y897-A904 WeakPolarHBondContact CD1-O 3.5Å; Y897-A904 VanDerWaalsContact CE1-O 3.29Å; Y897-A904 WeakPolarHBondContact CE1-O 3.26Å; D901-A904 PolarHBondContact O-N 3.26Å; T902-A904 PolarHBondContact O-N 2.91Å
905	Q	72.3	Confident	78.3	Confident	122 Å²	122	52.2 Å²	52.2	57%	0.57	32%	0.315	S	S	*	.			trans	-75.4	138.1	178.2	-56.1	-175	56.3	0	0	110.2	Y897 D901 A903 L907	Y897-Q905 WeakPolarHBondContact CD1-O 3.33Å; D901-Q905 PolarHBondContact OD2-NE2 2.87Å; A903-Q905 HydrophobicContact CB-CG 4.13Å; A903-Q905 PolarHBondContact O-N 2.9Å; Q905-L907 PolarHBondContact O-N 3.17Å
906	C	83.9	Confident	78.3	Confident	58 Å²	58	52.9 Å²	52.9	39%	0.392	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	112.7	174.7	-173.7	0	0	0	0	108.6	V896 Y897 L908	V896-C906 CarbonylContact O-C 3.58Å; Y897-C906 HydrophobicContact CD1-CB 4.28Å; Y897-C906 HydrophobicContact CE1-CB 3.91Å; C906-L908 PolarHBondContact SG-O 3.06Å
907	L	85.3	Confident	78.5	Confident	92 Å²	92	53.9 Å²	53.9	48%	0.482	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	-37.4	-177.4	-56.2	-179	0	0	0	112.1	V896 Q905	V896-L907 PolarHBondContact O-N 3.31Å; Q905-L907 PolarHBondContact O-N 3.17Å
908	L	88.3	Confident	78.8	Confident	36 Å²	36	52.9 Å²	52.9	19%	0.188	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	148.3	-175.9	179.8	62.8	0	0	0	110.4	V896 C906 L910 L948 W949	V896-L908 HydrophobicContact CB-CB 4.05Å; V896-L908 HydrophobicContact CG2-CB 4.1Å; V896-L908 HydrophobicContact CG2-CG 4.49Å; V896-L908 PolarHBondContact N-O 2.92Å; V896-L908 PolarHBondContact O-N 2.91Å; C906-L908 PolarHBondContact SG-O 3.06Å; L908-L910 HydrophobicContact CD2-CD2 3.73Å; L908-L910 HydrophobicContact CD2-CG 4.39Å; L908-L910 HydrophobicContact CG-CD2 4.12Å; L908-L948 HydrophobicContact CD2-CB 4.39Å; L908-W949 HydrophobicContact CD2-CB 4.28Å; L908-W949 VanDerWaalsContact CD2-O 3.23Å; L908-W949 WeakPolarHBondContact CD2-O 3.3Å
909	T	90.8	Very high	79.4	Confident	46 Å²	46	54 Å²	54	28%	0.282	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	109.2	168.8	-62.4	0	0	0	0	109.1	R893 I894 L895 H911	R893-T909 HydrophobicContact CB-CG2 4.27Å; R893-T909 HydrophobicContact CG-CG2 4.36Å; I894-T909 WeakPolarHBondContact O-CA 3.24Å; L895-T909 HydrophobicContact CD2-CG2 3.79Å; L895-T909 WeakPolarHBondContact CD2-OG1 3.28Å; T909-H911 VanDerWaalsContact CG2-CE1 3.48Å; T909-H911 WeakPolarHBondContact CG2-CE1 3.26Å; T909-H911 PolarHBondContact O-ND1 3.21Å
910	L	90.2	Very high	80.6	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	144.9	168.6	-50.2	171.3	0	0	0	108.6	R893 I894 L908 L928 Y940 W949 P951	R893-L910 WeakPolarHBondContact CA-O 3.42Å; I894-L910 HydrophobicContact CB-CB 4.16Å; I894-L910 HydrophobicContact CB-CD1 4.46Å; I894-L910 HydrophobicContact CD1-CB 4.47Å; I894-L910 HydrophobicContact CD1-CD1 4.31Å; I894-L910 PolarHBondContact N-O 2.94Å; I894-L910 PolarHBondContact O-N 3.33Å; L908-L910 HydrophobicContact CD2-CD2 3.73Å; L908-L910 HydrophobicContact CD2-CG 4.39Å; L908-L910 HydrophobicContact CG-CD2 4.12Å; L910-L928 HydrophobicContact CD1-CD2 3.84Å; L910-Y940 HydrophobicContact CB-CD1 4.47Å; L910-Y940 HydrophobicContact CB-CE1 3.91Å; L910-Y940 HydrophobicContact CD1-CD1 3.92Å; L910-Y940 HydrophobicContact CD1-CD2 4.03Å; L910-Y940 HydrophobicContact CD1-CE1 4.1Å; L910-Y940 HydrophobicContact CD1-CE2 4.2Å; L910-Y940 HydrophobicContact CD1-CG 3.88Å; L910-Y940 HydrophobicContact CD2-CD1 4.13Å; L910-Y940 HydrophobicContact CD2-CE1 4.31Å; L910-Y940 HydrophobicContact CG-CD1 4.41Å; L910-Y940 HydrophobicContact CG-CE1 4.33Å; L910-W949 HydrophobicContact CD1-CB 4.07Å; L910-W949 HydrophobicContact CD1-CG 4.44Å; L910-W949 HydrophobicContact CD2-CB 4.2Å; L910-P951 HydrophobicContact CD2-CB 3.95Å
911	H	88.3	Confident	82.2	Confident	112 Å²	112	50.3 Å²	50.3	52%	0.519	30%	0.296	S	S	.	.			trans	-116	154.1	174.1	-64	79.8	0	0	0	109	T909 Y940	T909-H911 VanDerWaalsContact CG2-CE1 3.48Å; T909-H911 WeakPolarHBondContact CG2-CE1 3.26Å; T909-H911 PolarHBondContact O-ND1 3.21Å; H911-Y940 PolarHBondContact O-OH 2.86Å
912	N	86.4	Confident	84.1	Confident	15 Å²	15	50.2 Å²	50.2	8%	0.08	29%	0.292	C	S	.	.			trans	-99.6	145.2	158.4	65.4	13	0	0	0	110.4	G892 E914 G915 C916 L932 M938	G892-N912 WeakPolarHBondContact CA-OD1 3.26Å; G892-N912 VanDerWaalsContact O-CG 3.27Å; G892-N912 PolarHBondContact O-N 2.9Å; G892-N912 PolarHBondContact O-OD1 3.44Å; N912-E914 PolarHBondContact O-N 3.02Å; N912-G915 WeakPolarHBondContact OD1-CA 3.32Å; N912-G915 PolarHBondContact OD1-N 2.95Å; N912-C916 PolarHBondContact ND2-N 3.17Å; N912-C916 PolarHBondContact ND2-O 3.23Å; N912-C916 PolarHBondContact OD1-N 3.39Å; N912-L932 HydrophobicContact CB-CD1 4.45Å; N912-L932 WeakPolarHBondContact ND2-CD2 3.49Å; N912-M938 HydrophobicContact CB-CE 4.1Å; N912-M938 HydrophobicContact CB-SD 3.24Å; N912-M938 WeakPolarHBondContact CB-SD 3.49Å
913	P	79.6	Confident	86	Confident	108 Å²	108	48 Å²	48	70%	0.701	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-14.3	179.8	28.4	-34.1	0	0	0	112.9
914	E	80.6	Confident	87.5	Confident	98 Å²	98	46.5 Å²	46.5	46%	0.458	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-4.8	-175.2	-56.6	-175.5	115	0	0	114.1	N912 C916 N934	N912-E914 PolarHBondContact O-N 3.02Å; E914-C916 HydrophobicContact CB-CB 4.37Å; E914-C916 PolarHBondContact O-N 3.44Å; E914-C916 PolarHBondContact O-SG 3Å; E914-C916 VanDerWaalsContact O-SG 3.39Å; E914-N934 PolarHBondContact OE1-ND2 2.88Å; E914-N934 PolarHBondContact OE2-ND2 2.8Å
915	G	86.3	Confident	88.4	Confident	46 Å²	46	49.7 Å²	49.7	47%	0.474	29%	0.288	S	S	.	.			trans	59.9	15.2	-176.5	0	0	0	0	0	115.2	N912	N912-G915 WeakPolarHBondContact OD1-CA 3.32Å; N912-G915 PolarHBondContact OD1-N 2.95Å
916	C	91.9	Very high	88.9	Confident	30 Å²	30	51 Å²	51	20%	0.203	29%	0.288	C	S	.	.			trans	-84.5	138.4	-169.1	-77.8	0	0	0	0	112.2	G892 N912 E914 V918 L932	G892-C916 WeakPolarHBondContact CA-O 3.47Å; N912-C916 PolarHBondContact ND2-N 3.17Å; N912-C916 PolarHBondContact ND2-O 3.23Å; N912-C916 PolarHBondContact OD1-N 3.39Å; E914-C916 HydrophobicContact CB-CB 4.37Å; E914-C916 PolarHBondContact O-N 3.44Å; E914-C916 PolarHBondContact O-SG 3Å; E914-C916 VanDerWaalsContact O-SG 3.39Å; C916-V918 PolarHBondContact O-N 3.12Å; C916-L932 HydrophobicContact CB-CB 4.49Å; C916-L932 HydrophobicContact CB-CD1 4.39Å
917	P	94.3	Very high	89.2	Confident	21 Å²	21	49.9 Å²	49.9	14%	0.136	28%	0.276	C	S	.	.			trans	-50.4	129	179.3	-28.8	31.7	0	0	0	114.1	D890 L919 L932 R933	D890-P917 WeakPolarHBondContact O-CG 3.45Å; P917-L919 HydrophobicContact CB-CD2 4.23Å; P917-L919 PolarHBondContact O-N 3.09Å; P917-L932 WeakPolarHBondContact O-CA 3.33Å; P917-R933 HydrophobicContact CB-CB 4.11Å; P917-R933 HydrophobicContact CG-CB 4.26Å; P917-R933 PolarHBondContact O-N 2.83Å
918	V	95.4	Very high	89.6	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	112	173.3	-174.1	0	0	0	0	108.1	R856 L889 I894 C916 L921 A930 L932	R856-V918 WeakPolarHBondContact CB-O 3.41Å; L889-V918 PolarHBondContact O-N 3.03Å; L889-V918 VanDerWaalsContact O-N 3.1Å; I894-V918 HydrophobicContact CG1-CG1 4.41Å; I894-V918 HydrophobicContact CG1-CG2 4.03Å; C916-V918 PolarHBondContact O-N 3.12Å; V918-L921 HydrophobicContact CG1-CD2 4.15Å; V918-L921 HydrophobicContact CG1-CG 4.08Å; V918-A930 HydrophobicContact CG1-CB 4.12Å; V918-L932 HydrophobicContact CB-CD2 4.34Å; V918-L932 HydrophobicContact CG2-CD2 3.85Å
919	L	94.4	Very high	89.9	Confident	38 Å²	38	43.8 Å²	43.8	20%	0.199	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	-32.2	-172.8	-62.5	-175.8	0	0	0	113.3	P917 G931 R933 P963 I964	P917-L919 HydrophobicContact CB-CD2 4.23Å; P917-L919 PolarHBondContact O-N 3.09Å; L919-G931 PolarHBondContact N-O 2.66Å; L919-R933 HydrophobicContact CD1-CB 4.04Å; L919-R933 HydrophobicContact CG-CB 4.28Å; L919-P963 HydrophobicContact CD1-CB 3.65Å; L919-I964 WeakPolarHBondContact CB-O 3.4Å
920	C	94.6	Very high	90.1	Very high	14 Å²	14	41.6 Å²	41.6	10%	0.095	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	146.9	176.5	57.8	0	0	0	0	112.1	C857 G931	C857-C920 VanDerWaalsContact SG-CA 3.59Å; C920-G931 PolarHBondContact N-O 2.68Å; C920-G931 PolarHBondContact O-N 3.07Å
921	L	95.8	Very high	90.4	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.2	176.8	-74.8	164.3	0	0	0	110.1	E859 C886 I894 V918 L928 F929 A930	E859-L921 HydrophobicContact CB-CB 3.83Å; C886-L921 HydrophobicContact CB-CD1 4.13Å; I894-L921 HydrophobicContact CD1-CD2 3.87Å; I894-L921 HydrophobicContact CG1-CD2 4.3Å; I894-L921 HydrophobicContact CG2-CD1 3.94Å; I894-L921 HydrophobicContact CG2-CD2 4.32Å; V918-L921 HydrophobicContact CG1-CD2 4.15Å; V918-L921 HydrophobicContact CG1-CG 4.08Å; L921-L928 HydrophobicContact CD2-CD1 4.32Å; L921-L928 HydrophobicContact CD2-CD2 4.36Å; L921-L928 HydrophobicContact CD2-CG 4.3Å; L921-F929 WeakPolarHBondContact CA-O 3.27Å; L921-A930 HydrophobicContact CD2-CB 3.65Å
922	K	94.3	Very high	90.8	Very high	65 Å²	65	36.3 Å²	36.3	28%	0.283	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	149.4	166.8	-76.7	-65.6	130.7	-152.4	0	110.6	E859 F929 L967 V969	E859-K922 WeakPolarHBondContact OE1-CA 3.26Å; E859-K922 IonicContact OE1-NZ 2.69Å; E859-K922 IonicContact OE2-NZ 3.54Å; E859-K922 PolarHBondContact OE2-NZ 2.84Å; K922-F929 PolarHBondContact N-O 3.26Å; K922-F929 PolarHBondContact O-N 3.49Å; K922-L967 HydrophobicContact CB-CB 4.19Å; K922-L967 HydrophobicContact CG-CB 3.71Å; K922-L967 WeakPolarHBondContact CG-O 2.98Å; K922-V969 HydrophobicContact CB-CG2 3.65Å; K922-V969 HydrophobicContact CG-CG2 4.28Å
923	H	91.6	Very high	91.2	Very high	42 Å²	42	42.5 Å²	42.5	19%	0.194	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	156.3	174.6	78.4	-64.5	0	0	0	113.5	E859 Y860 V861 Q862 F927 L928 W949	E859-H923 IonicContact OE1-CE1 3.08Å; E859-H923 IonicContact OE1-CG 2.69Å; E859-H923 PolarHBondContact OE1-N 2.9Å; E859-H923 IonicContact OE1-ND1 3.99Å; E859-H923 PolarHBondContact OE1-ND1 2.84Å; Y860-H923 PolarHBondContact O-CE1 3.32Å; Y860-H923 PolarHBondContact O-ND1 3.1Å; V861-H923 HydrophobicContact CG2-CB 4.15Å; Q862-H923 PolarHBondContact N-NE2 2.86Å; H923-F927 CarbonylContact C-O 3.49Å; H923-F927 WeakPolarHBondContact CA-O 3.24Å; H923-L928 HydrophobicContact CB-CD1 4.1Å; H923-W949 HydrophobicContact CB-CH2 4.16Å; H923-W949 HydrophobicContact CB-CZ2 4.18Å
924	S	89.6	Confident	91.9	Very high	18 Å²	18	39.4 Å²	39.4	13%	0.126	21%	0.206	C	C	.	.			trans	-120.7	-178.6	160.8	78.2	0	0	0	0	109.4	R926 F927	S924-R926 PolarHBondContact O-N 2.85Å; S924-R926 VanDerWaalsContact O-N 3.12Å; S924-F927 PolarHBondContact N-O 3.34Å; S924-F927 PolarHBondContact OG-N 2.68Å
925	A	82	Confident	92.5	Very high	78 Å²	78	34.7 Å²	34.7	65%	0.645	18%	0.184	S	C	*	.	S	Bend	trans	-58.4	-26	-179.8	0	0	0	0	0	114.4	R942	A925-R942 PolarHBondContact O-NH1 3.48Å
926	R	84	Confident	92.9	Very high	148 Å²	148	33.1 Å²	33.1	56%	0.558	17%	0.166	S	C	*	.	S	Bend	trans	-120.3	-16.7	-176.8	-57.7	-167.2	-56.7	174.1	3.5	115.3	S924 R942	S924-R926 PolarHBondContact O-N 2.85Å; S924-R926 VanDerWaalsContact O-N 3.12Å; R926-R942 PolarHBondContact O-N 3.01Å; R926-R942 VanDerWaalsContact O-N 3.14Å
927	F	90.3	Very high	93.1	Very high	35 Å²	35	31.7 Å²	31.7	15%	0.154	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	141.9	-168.4	-61.2	-63.6	0	0	0	113.3	H923 S924 F929 V939 Y940 I987	H923-F927 CarbonylContact C-O 3.49Å; H923-F927 WeakPolarHBondContact CA-O 3.24Å; S924-F927 PolarHBondContact N-O 3.34Å; S924-F927 PolarHBondContact OG-N 2.68Å; F927-F929 HydrophobicContact CB-CD2 4.32Å; F927-F929 HydrophobicContact CB-CE2 3.59Å; F927-F929 HydrophobicContact CB-CZ 3.74Å; F927-F929 HydrophobicContact CD2-CZ 4.31Å; F927-F929 HydrophobicContact CG-CZ 4.35Å; F927-V939 HydrophobicContact CB-CG1 3.79Å; F927-V939 HydrophobicContact CD1-CG1 3.83Å; F927-V939 HydrophobicContact CG-CG1 3.9Å; F927-Y940 CarbonylContact C-O 3.51Å; F927-Y940 VanDerWaalsContact CA-O 3.27Å; F927-Y940 WeakPolarHBondContact CA-O 3.46Å; F927-I987 HydrophobicContact CD2-CG2 4.09Å; F927-I987 HydrophobicContact CE2-CG2 4.37Å
928	L	92.9	Very high	93.1	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	123.6	166.3	-177.2	70	0	0	0	109.3	L910 L921 H923 V939 Y940 W949	L910-L928 HydrophobicContact CD1-CD2 3.84Å; L921-L928 HydrophobicContact CD2-CD1 4.32Å; L921-L928 HydrophobicContact CD2-CD2 4.36Å; L921-L928 HydrophobicContact CD2-CG 4.3Å; H923-L928 HydrophobicContact CB-CD1 4.1Å; L928-V939 WeakPolarHBondContact O-CA 3.35Å; L928-Y940 HydrophobicContact CD2-CD2 4.5Å; L928-Y940 PolarHBondContact N-O 3.45Å; L928-Y940 PolarHBondContact O-N 3.47Å; L928-W949 HydrophobicContact CB-CD2 3.77Å; L928-W949 HydrophobicContact CB-CE3 3.82Å; L928-W949 HydrophobicContact CB-CG 4.44Å; L928-W949 HydrophobicContact CB-CH2 3.89Å; L928-W949 HydrophobicContact CB-CZ2 3.81Å; L928-W949 HydrophobicContact CB-CZ3 3.89Å; L928-W949 HydrophobicContact CD1-CZ2 4.16Å; L928-W949 HydrophobicContact CD2-CD2 4.36Å; L928-W949 HydrophobicContact CD2-CG 4.3Å; L928-W949 HydrophobicContact CG-CZ2 4.44Å; L928-W949 VanDerWaalsContact N-CZ3 3.33Å
929	F	94.9	Very high	93	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.8	179.2	-59.4	-94.1	0	0	0	110	L921 K922 F927 V937 M938 V939 L967 V974 I987	L921-F929 WeakPolarHBondContact CA-O 3.27Å; K922-F929 PolarHBondContact N-O 3.26Å; K922-F929 PolarHBondContact O-N 3.49Å; F927-F929 HydrophobicContact CB-CD2 4.32Å; F927-F929 HydrophobicContact CB-CE2 3.59Å; F927-F929 HydrophobicContact CB-CZ 3.74Å; F927-F929 HydrophobicContact CD2-CZ 4.31Å; F927-F929 HydrophobicContact CG-CZ 4.35Å; F929-V937 HydrophobicContact CB-CG1 4.28Å; F929-V937 HydrophobicContact CD1-CG1 4.18Å; F929-M938 CarbonylContact C-O 3.53Å; F929-M938 WeakPolarHBondContact CA-O 3.32Å; F929-V939 HydrophobicContact CD1-CB 4.4Å; F929-V939 HydrophobicContact CD1-CG1 4Å; F929-V939 HydrophobicContact CD1-CG2 3.71Å; F929-V939 HydrophobicContact CE1-CB 4.42Å; F929-V939 HydrophobicContact CE1-CG1 3.68Å; F929-V939 HydrophobicContact CE1-CG2 3.84Å; F929-V939 HydrophobicContact CZ-CG1 4.11Å; F929-L967 HydrophobicContact CB-CD1 4.09Å; F929-V974 HydrophobicContact CD1-CG2 4.04Å; F929-V974 HydrophobicContact CD2-CG2 4.01Å; F929-V974 HydrophobicContact CE1-CG2 3.75Å; F929-V974 HydrophobicContact CE2-CG2 3.71Å; F929-V974 HydrophobicContact CG-CG1 4.47Å; F929-V974 HydrophobicContact CG-CG2 4.17Å; F929-V974 HydrophobicContact CZ-CG2 3.58Å; F929-I987 HydrophobicContact CZ-CG1 4.34Å
930	A	96	Very high	92.9	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	115.1	179.2	0	0	0	0	0	110.3	I894 V918 L921 V937 M938 Y940	I894-A930 HydrophobicContact CD1-CB 3.79Å; V918-A930 HydrophobicContact CG1-CB 4.12Å; L921-A930 HydrophobicContact CD2-CB 3.65Å; A930-V937 CarbonylContact O-C 3.55Å; A930-V937 WeakPolarHBondContact O-CA 3.38Å; A930-M938 HydrophobicContact CB-CB 4.42Å; A930-M938 PolarHBondContact N-O 3Å; A930-M938 PolarHBondContact O-N 2.93Å; A930-Y940 HydrophobicContact CB-CE2 4.3Å
931	G	96.1	Very high	92.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	122.2	178.4	0	0	0	0	0	111.3	L919 C920	L919-G931 PolarHBondContact N-O 2.66Å; C920-G931 PolarHBondContact N-O 2.68Å; C920-G931 PolarHBondContact O-N 3.07Å
932	L	95.9	Very high	92.1	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	158.9	-175	-55.4	-174.3	0	0	0	113.3	N912 C916 P917 V918 N934 G935 T936 M938 I964	N912-L932 HydrophobicContact CB-CD1 4.45Å; N912-L932 WeakPolarHBondContact ND2-CD2 3.49Å; C916-L932 HydrophobicContact CB-CB 4.49Å; C916-L932 HydrophobicContact CB-CD1 4.39Å; P917-L932 WeakPolarHBondContact O-CA 3.33Å; V918-L932 HydrophobicContact CB-CD2 4.34Å; V918-L932 HydrophobicContact CG2-CD2 3.85Å; L932-N934 VanDerWaalsContact CB-OD1 3.23Å; L932-N934 WeakPolarHBondContact CB-OD1 3.33Å; L932-N934 PolarHBondContact O-N 2.93Å; L932-G935 PolarHBondContact O-N 2.66Å; L932-T936 VanDerWaalsContact CB-O 3.3Å; L932-T936 WeakPolarHBondContact CB-O 3.26Å; L932-T936 WeakPolarHBondContact CG-O 3.28Å; L932-T936 PolarHBondContact N-O 3.15Å; L932-M938 HydrophobicContact CD1-CG 4.08Å; L932-M938 HydrophobicContact CD1-SD 4.01Å; L932-I964 PolarHBondContact O-N 3.48Å; L932-I964 VanDerWaalsContact O-N 3.12Å
933	R	94.8	Very high	91.3	Very high	146 Å²	146	31.1 Å²	31.1	55%	0.551	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-23.1	175.5	171.9	178	-90.5	-94	7.1	114.7	P917 L919 P963	P917-R933 HydrophobicContact CB-CB 4.11Å; P917-R933 HydrophobicContact CG-CB 4.26Å; P917-R933 PolarHBondContact O-N 2.83Å; L919-R933 HydrophobicContact CD1-CB 4.04Å; L919-R933 HydrophobicContact CG-CB 4.28Å; R933-P963 VanDerWaalsContact O-CA 3.24Å; R933-P963 WeakPolarHBondContact O-CA 3.33Å; R933-P963 WeakPolarHBondContact O-CB 3.46Å
934	N	93.8	Very high	90	Very high	42 Å²	42	36.9 Å²	36.9	23%	0.225	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-2.6	-178.3	65.8	-11.6	0	0	0	114.4	E914 L932 T936	E914-N934 PolarHBondContact OE1-ND2 2.88Å; E914-N934 PolarHBondContact OE2-ND2 2.8Å; L932-N934 VanDerWaalsContact CB-OD1 3.23Å; L932-N934 WeakPolarHBondContact CB-OD1 3.33Å; L932-N934 PolarHBondContact O-N 2.93Å; N934-T936 WeakPolarHBondContact OD1-CB 3.24Å; N934-T936 PolarHBondContact OD1-N 3.32Å
935	G	93.6	Very high	88.5	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	92.7	9.2	-178	0	0	0	0	0	115.4	L932 L959 G960 E962 I964	L932-G935 PolarHBondContact O-N 2.66Å; G935-L959 PolarHBondContact O-N 2.95Å; G935-G960 WeakPolarHBondContact CA-O 3.38Å; G935-E962 WeakPolarHBondContact CA-O 3.38Å; G935-I964 WeakPolarHBondContact O-CD1 3.27Å
936	T	94.9	Very high	87.4	Confident	13 Å²	13	44.6 Å²	44.6	8%	0.08	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	134	171.5	-60.4	0	0	0	0	111.8	L932 N934 C956 I964	L932-T936 VanDerWaalsContact CB-O 3.3Å; L932-T936 WeakPolarHBondContact CB-O 3.26Å; L932-T936 WeakPolarHBondContact CG-O 3.28Å; L932-T936 PolarHBondContact N-O 3.15Å; N934-T936 WeakPolarHBondContact OD1-CB 3.24Å; N934-T936 PolarHBondContact OD1-N 3.32Å; T936-C956 HydrophobicContact CG2-CB 4.05Å; T936-I964 WeakPolarHBondContact O-CD1 3.14Å
937	V	95.6	Very high	86.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	125.6	162.6	178.5	0	0	0	0	108.3	F929 A930 V939 V957 L959 I964 L967 A976 I985	F929-V937 HydrophobicContact CB-CG1 4.28Å; F929-V937 HydrophobicContact CD1-CG1 4.18Å; A930-V937 CarbonylContact O-C 3.55Å; A930-V937 WeakPolarHBondContact O-CA 3.38Å; V937-V939 HydrophobicContact CG1-CG2 4.21Å; V937-V957 PolarHBondContact N-O 3.34Å; V937-V957 PolarHBondContact O-N 2.67Å; V937-L959 HydrophobicContact CG2-CD1 3.64Å; V937-L959 HydrophobicContact CG2-CG 4.28Å; V937-I964 HydrophobicContact CG2-CD1 3.57Å; V937-L967 HydrophobicContact CG2-CD2 4.23Å; V937-A976 HydrophobicContact CG2-CB 4.33Å; V937-I985 HydrophobicContact CB-CD1 4.49Å; V937-I985 HydrophobicContact CG2-CD1 4.22Å
938	M	94.1	Very high	86.1	Confident	1 Å²	1	41 Å²	41	1%	0.005	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	144	165.7	-69.2	-174.5	70.2	0	0	110.7	N912 F929 A930 L932 Y940 P954 I955	N912-M938 HydrophobicContact CB-CE 4.1Å; N912-M938 HydrophobicContact CB-SD 3.24Å; N912-M938 WeakPolarHBondContact CB-SD 3.49Å; F929-M938 CarbonylContact C-O 3.53Å; F929-M938 WeakPolarHBondContact CA-O 3.32Å; A930-M938 HydrophobicContact CB-CB 4.42Å; A930-M938 PolarHBondContact N-O 3Å; A930-M938 PolarHBondContact O-N 2.93Å; L932-M938 HydrophobicContact CD1-CG 4.08Å; L932-M938 HydrophobicContact CD1-SD 4.01Å; M938-Y940 HydrophobicContact CB-CE2 3.98Å; M938-Y940 HydrophobicContact CE-CE1 4.18Å; M938-Y940 HydrophobicContact CE-CE2 4.45Å; M938-Y940 WeakPolarHBondContact CE-OH 3.4Å; M938-P954 HydrophobicContact CE-CB 3.52Å; M938-P954 HydrophobicContact CE-CG 3.92Å; M938-I955 CarbonylContact C-O 3.56Å; M938-I955 WeakPolarHBondContact CA-O 3.35Å
939	V	94.1	Very high	85.8	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.006	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	114	-178.7	-167	0	0	0	0	108.9	F927 L928 F929 V937 I955 V957	F927-V939 HydrophobicContact CB-CG1 3.79Å; F927-V939 HydrophobicContact CD1-CG1 3.83Å; F927-V939 HydrophobicContact CG-CG1 3.9Å; L928-V939 WeakPolarHBondContact O-CA 3.35Å; F929-V939 HydrophobicContact CD1-CB 4.4Å; F929-V939 HydrophobicContact CD1-CG1 4Å; F929-V939 HydrophobicContact CD1-CG2 3.71Å; F929-V939 HydrophobicContact CE1-CB 4.42Å; F929-V939 HydrophobicContact CE1-CG1 3.68Å; F929-V939 HydrophobicContact CE1-CG2 3.84Å; F929-V939 HydrophobicContact CZ-CG1 4.11Å; V937-V939 HydrophobicContact CG1-CG2 4.21Å; V939-I955 HydrophobicContact CB-CB 4.31Å; V939-I955 PolarHBondContact N-O 2.94Å; V939-I955 PolarHBondContact O-N 2.92Å; V939-V957 HydrophobicContact CG2-CG2 4.39Å
940	Y	91.9	Very high	85.3	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.008	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	131.4	177.4	-56	-96.4	0	0	0	109.4	I894 L910 H911 F927 L928 A930 M938 D950 P954	I894-Y940 HydrophobicContact CD1-CD2 4.48Å; I894-Y940 HydrophobicContact CD1-CE2 3.65Å; L910-Y940 HydrophobicContact CB-CD1 4.47Å; L910-Y940 HydrophobicContact CB-CE1 3.91Å; L910-Y940 HydrophobicContact CD1-CD1 3.92Å; L910-Y940 HydrophobicContact CD1-CD2 4.03Å; L910-Y940 HydrophobicContact CD1-CE1 4.1Å; L910-Y940 HydrophobicContact CD1-CE2 4.2Å; L910-Y940 HydrophobicContact CD1-CG 3.88Å; L910-Y940 HydrophobicContact CD2-CD1 4.13Å; L910-Y940 HydrophobicContact CD2-CE1 4.31Å; L910-Y940 HydrophobicContact CG-CD1 4.41Å; L910-Y940 HydrophobicContact CG-CE1 4.33Å; H911-Y940 PolarHBondContact O-OH 2.86Å; F927-Y940 CarbonylContact C-O 3.51Å; F927-Y940 VanDerWaalsContact CA-O 3.27Å; F927-Y940 WeakPolarHBondContact CA-O 3.46Å; L928-Y940 HydrophobicContact CD2-CD2 4.5Å; L928-Y940 PolarHBondContact N-O 3.45Å; L928-Y940 PolarHBondContact O-N 3.47Å; A930-Y940 HydrophobicContact CB-CE2 4.3Å; M938-Y940 HydrophobicContact CB-CE2 3.98Å; M938-Y940 HydrophobicContact CE-CE1 4.18Å; M938-Y940 HydrophobicContact CE-CE2 4.45Å; M938-Y940 WeakPolarHBondContact CE-OH 3.4Å; Y940-D950 WeakPolarHBondContact CD1-O 3.49Å; Y940-P954 HydrophobicContact CD1-CB 3.82Å; Y940-P954 HydrophobicContact CE1-CB 3.71Å; Y940-P954 HydrophobicContact CE1-CG 4.39Å
941	G	88.3	Confident	84.7	Confident	18 Å²	18	44.1 Å²	44.1	19%	0.186	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	168.9	173.8	0	0	0	0	0	112.9	W949 D950	G941-W949 CarbonylContact O-C 3.55Å; G941-W949 VanDerWaalsContact O-CA 3.29Å; G941-W949 WeakPolarHBondContact O-CA 3.35Å; G941-D950 PolarHBondContact O-N 2.83Å
942	R	85.4	Confident	84.1	Confident	44 Å²	44	51.9 Å²	51.9	17%	0.166	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-87.5	141.8	162.4	-81.6	-175.2	154.7	139.5	-5.2	110.7	Q862 A925 R926 D947 L948 W949	Q862-R942 PolarHBondContact O-NH2 3.17Å; A925-R942 PolarHBondContact O-NH1 3.48Å; R926-R942 PolarHBondContact O-N 3.01Å; R926-R942 VanDerWaalsContact O-N 3.14Å; R942-D947 PolarHBondContact NE-O 3.26Å; R942-L948 WeakPolarHBondContact CA-O 3.5Å; R942-W949 HydrophobicContact CG-CE3 3.66Å; R942-W949 HydrophobicContact CG-CH2 4.31Å; R942-W949 HydrophobicContact CG-CZ3 3.54Å
943	N	77	Confident	83.4	Confident	65 Å²	65	55.6 Å²	55.6	35%	0.348	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-83.7	136.2	171.7	-88.5	-30.8	0	0	0	111.3	N945 L948 D950	N943-N945 PolarHBondContact O-N 2.89Å; N943-N945 VanDerWaalsContact O-N 3.15Å; N943-L948 PolarHBondContact N-O 3.01Å; N943-D950 WeakPolarHBondContact ND2-CA 3.39Å; N943-D950 PolarHBondContact ND2-OD1 2.69Å
944	N	65	Low	83.1	Confident	163 Å²	163	50.5 Å²	50.5	87%	0.872	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-15.4	-172.1	-69.1	-11	0	0	0	115.2
945	N	57.9	Low	83	Confident	147 Å²	147	52.3 Å²	52.3	79%	0.786	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	-30.7	-170.6	-64.7	-4.1	0	0	0	114	N943	N943-N945 PolarHBondContact O-N 2.89Å; N943-N945 VanDerWaalsContact O-N 3.15Å
946	D	58.5	Low	82.9	Confident	111 Å²	111	55.6 Å²	55.6	59%	0.594	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.3	6.7	-164.3	-61.9	-61.8	0	0	0	114.2	L948	D946-L948 PolarHBondContact O-N 3.31Å
947	D	68.2	Low	82.8	Confident	60 Å²	60	56 Å²	56	32%	0.321	31%	0.31	S	S	.	.	S	Bend	trans	58.6	-8.3	-175.5	-96	-32	0	0	0	116.8	P864 R942	P864-D947 WeakPolarHBondContact CG-OD1 3.22Å; R942-D947 PolarHBondContact NE-O 3.26Å
948	L	78.8	Confident	82.7	Confident	46 Å²	46	60.2 Å²	60.2	24%	0.241	34%	0.339	C	S	.	.	S	Bend	trans	-77	163.6	178.1	-71	173.5	0	0	0	112.9	L908 R942 N943 D946	L908-L948 HydrophobicContact CD2-CB 4.39Å; R942-L948 WeakPolarHBondContact CA-O 3.5Å; N943-L948 PolarHBondContact N-O 3.01Å; D946-L948 PolarHBondContact O-N 3.31Å
949	W	86.7	Confident	82.6	Confident	3 Å²	3	60.8 Å²	60.8	1%	0.011	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-72	145.4	174.4	-53.8	116.6	0	0	0	111.3	V861 L908 L910 H923 L928 G941 R942 P951	V861-W949 HydrophobicContact CB-CZ2 4.42Å; V861-W949 HydrophobicContact CG1-CH2 4.4Å; V861-W949 HydrophobicContact CG1-CZ2 3.61Å; V861-W949 HydrophobicContact CG2-CZ2 3.91Å; L908-W949 HydrophobicContact CD2-CB 4.28Å; L908-W949 VanDerWaalsContact CD2-O 3.23Å; L908-W949 WeakPolarHBondContact CD2-O 3.3Å; L910-W949 HydrophobicContact CD1-CB 4.07Å; L910-W949 HydrophobicContact CD1-CG 4.44Å; L910-W949 HydrophobicContact CD2-CB 4.2Å; H923-W949 HydrophobicContact CB-CH2 4.16Å; H923-W949 HydrophobicContact CB-CZ2 4.18Å; L928-W949 HydrophobicContact CB-CD2 3.77Å; L928-W949 HydrophobicContact CB-CE3 3.82Å; L928-W949 HydrophobicContact CB-CG 4.44Å; L928-W949 HydrophobicContact CB-CH2 3.89Å; L928-W949 HydrophobicContact CB-CZ2 3.81Å; L928-W949 HydrophobicContact CB-CZ3 3.89Å; L928-W949 HydrophobicContact CD1-CZ2 4.16Å; L928-W949 HydrophobicContact CD2-CD2 4.36Å; L928-W949 HydrophobicContact CD2-CG 4.3Å; L928-W949 HydrophobicContact CG-CZ2 4.44Å; L928-W949 VanDerWaalsContact N-CZ3 3.33Å; G941-W949 CarbonylContact O-C 3.55Å; G941-W949 VanDerWaalsContact O-CA 3.29Å; G941-W949 WeakPolarHBondContact O-CA 3.35Å; R942-W949 HydrophobicContact CG-CE3 3.66Å; R942-W949 HydrophobicContact CG-CH2 4.31Å; R942-W949 HydrophobicContact CG-CZ3 3.54Å; W949-P951 WeakPolarHBondContact O-CD 3.39Å
950	D	84.8	Confident	82.4	Confident	16 Å²	16	62.1 Å²	62.1	9%	0.086	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-80.4	120.8	175.2	-178.6	35.4	0	0	0	111.7	Y940 G941 N943 E952 S953	Y940-D950 WeakPolarHBondContact CD1-O 3.49Å; G941-D950 PolarHBondContact O-N 2.83Å; N943-D950 WeakPolarHBondContact ND2-CA 3.39Å; N943-D950 PolarHBondContact ND2-OD1 2.69Å; D950-E952 PolarHBondContact OD1-N 2.78Å; D950-E952 VanDerWaalsContact OD1-N 3.14Å; D950-S953 VanDerWaalsContact OD2-CB 3.31Å; D950-S953 WeakPolarHBondContact OD2-CB 3.37Å; D950-S953 PolarHBondContact OD2-N 3.32Å; D950-S953 PolarHBondContact OD2-OG 3.41Å
951	P	84	Confident	82.3	Confident	47 Å²	47	66.5 Å²	66.5	31%	0.305	39%	0.393	S	S	.	.	S	Bend	trans	-80.3	-20.5	172.9	32	-33.7	0	0	0	113.8	L910 W949	L910-P951 HydrophobicContact CD2-CB 3.95Å; W949-P951 WeakPolarHBondContact O-CD 3.39Å
952	E	81.9	Confident	82.6	Confident	163 Å²	163	70.5 Å²	70.5	76%	0.762	41%	0.407	S	S	*	.	S	Bend	trans	-88.8	-28.2	-165.7	-58.3	-58	136.1	0	0	114.1	D950 P954	D950-E952 PolarHBondContact OD1-N 2.78Å; D950-E952 VanDerWaalsContact OD1-N 3.14Å; E952-P954 WeakPolarHBondContact O-CD 3.14Å
953	S	83	Confident	83	Confident	79 Å²	79	69.4 Å²	69.4	55%	0.552	41%	0.406	S	S	*	.			trans	-119.1	48.4	-177.7	71.2	0	0	0	0	116.7	D950 I955	D950-S953 VanDerWaalsContact OD2-CB 3.31Å; D950-S953 WeakPolarHBondContact OD2-CB 3.37Å; D950-S953 PolarHBondContact OD2-N 3.32Å; D950-S953 PolarHBondContact OD2-OG 3.41Å; S953-I955 PolarHBondContact O-N 2.89Å
954	P	88.3	Confident	83.9	Confident	39 Å²	39	66.3 Å²	66.3	25%	0.253	39%	0.389	S	S	.	.			trans	-66.8	127.2	179.5	28.6	-34.8	0	0	0	113.1	M938 Y940 E952	M938-P954 HydrophobicContact CE-CB 3.52Å; M938-P954 HydrophobicContact CE-CG 3.92Å; Y940-P954 HydrophobicContact CD1-CB 3.82Å; Y940-P954 HydrophobicContact CE1-CB 3.71Å; Y940-P954 HydrophobicContact CE1-CG 4.39Å; E952-P954 WeakPolarHBondContact O-CD 3.14Å
955	I	91.2	Very high	85.3	Confident	81 Å²	81	63.8 Å²	63.8	42%	0.415	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	132.2	176.3	-54.6	171.2	0	0	0	109.3	M938 V939 S953 L990	M938-I955 CarbonylContact C-O 3.56Å; M938-I955 WeakPolarHBondContact CA-O 3.35Å; V939-I955 HydrophobicContact CB-CB 4.31Å; V939-I955 PolarHBondContact N-O 2.94Å; V939-I955 PolarHBondContact O-N 2.92Å; S953-I955 PolarHBondContact O-N 2.89Å; I955-L990 HydrophobicContact CB-CD1 4.48Å; I955-L990 HydrophobicContact CD1-CD1 3.92Å; I955-L990 HydrophobicContact CG2-CD1 3.86Å
956	C	91.3	Very high	87.1	Confident	69 Å²	69	57.8 Å²	57.8	47%	0.466	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.4	179.9	-62.6	0	0	0	0	111.4	T936	T936-C956 HydrophobicContact CG2-CB 4.05Å
957	V	93.2	Very high	88.9	Confident	20 Å²	20	52.8 Å²	52.8	12%	0.121	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	105	-179.5	-174	0	0	0	0	109.4	V937 V939 L959 I985 T992	V937-V957 PolarHBondContact N-O 3.34Å; V937-V957 PolarHBondContact O-N 2.67Å; V939-V957 HydrophobicContact CG2-CG2 4.39Å; V957-L959 HydrophobicContact CG1-CD2 3.93Å; V957-I985 HydrophobicContact CG1-CD1 4.48Å; V957-T992 HydrophobicContact CG1-CG2 3.96Å
958	S	93	Very high	90.2	Very high	89 Å²	89	51.1 Å²	51.1	62%	0.622	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	131.8	178.8	-173.2	0	0	0	0	111.6
959	L	92.5	Very high	90.8	Very high	14 Å²	14	51 Å²	51	7%	0.073	30%	0.301	C	S	.	.			trans	-113.1	-16.7	-175.3	-52.7	-176.4	0	0	0	113.8	G935 V937 V957 I964 A976 C978 T983 I985 T992 K994	G935-L959 PolarHBondContact O-N 2.95Å; V937-L959 HydrophobicContact CG2-CD1 3.64Å; V937-L959 HydrophobicContact CG2-CG 4.28Å; V957-L959 HydrophobicContact CG1-CD2 3.93Å; L959-I964 HydrophobicContact CD1-CD1 4.15Å; L959-I964 HydrophobicContact CD1-CG1 4.27Å; L959-A976 HydrophobicContact CD1-CB 3.4Å; L959-A976 VanDerWaalsContact CD1-CB 3.4Å; L959-C978 HydrophobicContact CB-CB 4.24Å; L959-T983 HydrophobicContact CD2-CG2 3.95Å; L959-I985 HydrophobicContact CD1-CD1 4.41Å; L959-I985 HydrophobicContact CD2-CD1 4.15Å; L959-T992 HydrophobicContact CD2-CG2 4.34Å; L959-K994 PolarHBondContact O-NZ 2.87Å
960	G	89.7	Confident	91	Very high	29 Å²	29	52.1 Å²	52.1	30%	0.299	31%	0.307	S	S	.	.			trans	161.3	-169.3	-175	0	0	0	0	0	110.8	G935	G935-G960 WeakPolarHBondContact CA-O 3.38Å
961	A	89.8	Confident	90.9	Very high	93 Å²	93	59 Å²	59	77%	0.769	34%	0.344	S	S	*	.	S	Bend	trans	-101.2	-5.7	176.5	0	0	0	0	0	113.8
962	E	93.5	Very high	91	Very high	102 Å²	102	62.1 Å²	62.1	48%	0.477	35%	0.354	S	S	.	.	S	Bend	trans	-87.9	147.2	178.3	-77	-67.5	129	0	0	111.2	G935 C978	G935-E962 WeakPolarHBondContact CA-O 3.38Å; E962-C978 PolarHBondContact O-SG 3.5Å
963	P	94.6	Very high	91.5	Very high	22 Å²	22	55.1 Å²	55.1	14%	0.143	32%	0.323	C	S	.	.			trans	-61.6	139	-176.8	25	-34.9	0	0	0	112.6	L919 R933 R965	L919-P963 HydrophobicContact CD1-CB 3.65Å; R933-P963 VanDerWaalsContact O-CA 3.24Å; R933-P963 WeakPolarHBondContact O-CA 3.33Å; R933-P963 WeakPolarHBondContact O-CB 3.46Å; P963-R965 PolarHBondContact O-N 2.88Å
964	I	96.1	Very high	92.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	104.1	172.3	-66.1	147.5	0	0	0	109	L919 L932 G935 T936 V937 L959 L967 S977	L919-I964 WeakPolarHBondContact CB-O 3.4Å; L932-I964 PolarHBondContact O-N 3.48Å; L932-I964 VanDerWaalsContact O-N 3.12Å; G935-I964 WeakPolarHBondContact O-CD1 3.27Å; T936-I964 WeakPolarHBondContact O-CD1 3.14Å; V937-I964 HydrophobicContact CG2-CD1 3.57Å; L959-I964 HydrophobicContact CD1-CD1 4.15Å; L959-I964 HydrophobicContact CD1-CG1 4.27Å; I964-L967 HydrophobicContact CG2-CD2 4.39Å; I964-L967 HydrophobicContact CG2-CG 4.22Å; I964-S977 VanDerWaalsContact CA-O 3.27Å; I964-S977 WeakPolarHBondContact CA-O 3.31Å
965	R	94.1	Very high	92.5	Very high	109 Å²	109	49.6 Å²	49.6	41%	0.411	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-35.8	-174.4	-64.9	-175.2	179.1	-72.5	-0.9	113.5	P963 S977 S1004 V1005	P963-R965 PolarHBondContact O-N 2.88Å; R965-S977 PolarHBondContact N-OG 3.49Å; R965-S1004 PolarHBondContact NE-OG 2.83Å; R965-V1005 VanDerWaalsContact CD-O 3.28Å; R965-V1005 WeakPolarHBondContact CD-O 3.4Å
966	T	95.1	Very high	92.8	Very high	21 Å²	21	45.7 Å²	45.7	13%	0.129	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	140.6	-177.2	175.4	0	0	0	0	111.5	S977 T1006 M1008	T966-S977 VanDerWaalsContact CG2-OG 3.26Å; T966-S977 WeakPolarHBondContact CG2-OG 3.5Å; T966-S977 PolarHBondContact N-OG 3.32Å; T966-S977 PolarHBondContact O-N 3.37Å; T966-S977 VanDerWaalsContact O-N 3.09Å; T966-S977 PolarHBondContact O-OG 2.91Å; T966-T1006 WeakPolarHBondContact CG2-O 3.43Å; T966-M1008 HydrophobicContact CG2-CE 4.15Å; T966-M1008 HydrophobicContact CG2-CG 3.96Å
967	L	96.6	Very high	93	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.037	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	140.3	171.4	-75.4	166.9	0	0	0	109	K922 F929 V937 I964 V974 W975 A976	K922-L967 HydrophobicContact CB-CB 4.19Å; K922-L967 HydrophobicContact CG-CB 3.71Å; K922-L967 WeakPolarHBondContact CG-O 2.98Å; F929-L967 HydrophobicContact CB-CD1 4.09Å; V937-L967 HydrophobicContact CG2-CD2 4.23Å; I964-L967 HydrophobicContact CG2-CD2 4.39Å; I964-L967 HydrophobicContact CG2-CG 4.22Å; L967-V974 HydrophobicContact CD2-CG1 3.87Å; L967-W975 WeakPolarHBondContact CA-O 3.44Å; L967-A976 HydrophobicContact CD2-CB 3.54Å
968	L	95.2	Very high	93.1	Very high	24 Å²	24	41.7 Å²	41.7	13%	0.126	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	117.4	177	173.9	66.6	0	0	0	108.9	L970 V974 W975 M1008 C1010 V1015	L968-L970 HydrophobicContact CD2-CD2 4.37Å; L968-L970 HydrophobicContact CG-CD2 4.22Å; L968-V974 CarbonylContact O-C 3.59Å; L968-V974 WeakPolarHBondContact O-CA 3.34Å; L968-W975 HydrophobicContact CB-CB 4.33Å; L968-W975 PolarHBondContact N-O 3.36Å; L968-W975 PolarHBondContact O-N 2.95Å; L968-M1008 HydrophobicContact CB-CB 4.3Å; L968-M1008 HydrophobicContact CB-CE 4.07Å; L968-M1008 HydrophobicContact CD2-CB 3.93Å; L968-C1010 HydrophobicContact CD1-CB 4.32Å; L968-C1010 HydrophobicContact CD2-CB 4.2Å; L968-V1015 HydrophobicContact CD2-CB 4.42Å; L968-V1015 HydrophobicContact CD2-CG1 3.61Å; L968-V1015 HydrophobicContact CD2-CG2 3.9Å
969	V	93.2	Very high	93.1	Very high	43 Å²	43	37.9 Å²	37.9	26%	0.261	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	130.2	175.5	174.5	0	0	0	0	109.2	K922 V974 I987	K922-V969 HydrophobicContact CB-CG2 3.65Å; K922-V969 HydrophobicContact CG-CG2 4.28Å; V969-V974 HydrophobicContact CG2-CG1 4.01Å; V969-V974 HydrophobicContact CG2-CG2 4.03Å; V969-I987 HydrophobicContact CG1-CD1 4.23Å
970	L	90.2	Very high	93.1	Very high	28 Å²	28	37.9 Å²	37.9	15%	0.147	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	162.4	164.8	-50.6	-178.7	0	0	0	107.7	L968 E972 S973 W975 C1010 T1030	L968-L970 HydrophobicContact CD2-CD2 4.37Å; L968-L970 HydrophobicContact CG-CD2 4.22Å; L970-E972 PolarHBondContact O-N 3.3Å; L970-S973 CarbonylContact C-O 3.54Å; L970-S973 WeakPolarHBondContact CA-O 3.46Å; L970-S973 PolarHBondContact N-O 3.16Å; L970-S973 PolarHBondContact O-N 3.16Å; L970-W975 HydrophobicContact CD1-CD2 4.49Å; L970-W975 HydrophobicContact CD1-CG 4.47Å; L970-W975 HydrophobicContact CD1-CZ2 4.47Å; L970-C1010 HydrophobicContact CD2-CB 3.81Å; L970-C1010 VanDerWaalsContact CD2-SG 3.53Å; L970-T1030 HydrophobicContact CD1-CG2 3.9Å
971	D	82.4	Confident	93.4	Very high	160 Å²	160	37.1 Å²	37.1	86%	0.856	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-39.8	-48	-170	-44.6	-30.4	0	0	0	114.8
972	E	86.3	Confident	93.7	Very high	112 Å²	112	32.7 Å²	32.7	52%	0.523	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-5.7	-175.6	-71.3	-63.8	150.1	0	0	114.1	L970 Q986 I987	L970-E972 PolarHBondContact O-N 3.3Å; E972-Q986 VanDerWaalsContact O-CD 3.24Å; E972-Q986 PolarHBondContact O-NE2 2.72Å; E972-Q986 VanDerWaalsContact O-NE2 3.14Å; E972-Q986 PolarHBondContact O-OE1 2.93Å; E972-Q986 PolarHBondContact OE2-NE2 2.69Å; E972-I987 PolarHBondContact O-N 2.97Å
973	S	92.7	Very high	93.8	Very high	16 Å²	16	28 Å²	28	11%	0.112	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	147.5	-171	69.4	0	0	0	0	114.2	L970 I985	L970-S973 CarbonylContact C-O 3.54Å; L970-S973 WeakPolarHBondContact CA-O 3.46Å; L970-S973 PolarHBondContact N-O 3.16Å; L970-S973 PolarHBondContact O-N 3.16Å; S973-I985 CarbonylContact C-O 3.48Å; S973-I985 VanDerWaalsContact CA-O 3.24Å; S973-I985 WeakPolarHBondContact CA-O 3.42Å
974	V	95.4	Very high	93.8	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	122.3	173.8	-166.1	0	0	0	0	109.6	F929 L967 L968 V969 I985 I987	F929-V974 HydrophobicContact CD1-CG2 4.04Å; F929-V974 HydrophobicContact CD2-CG2 4.01Å; F929-V974 HydrophobicContact CE1-CG2 3.75Å; F929-V974 HydrophobicContact CE2-CG2 3.71Å; F929-V974 HydrophobicContact CG-CG1 4.47Å; F929-V974 HydrophobicContact CG-CG2 4.17Å; F929-V974 HydrophobicContact CZ-CG2 3.58Å; L967-V974 HydrophobicContact CD2-CG1 3.87Å; L968-V974 CarbonylContact O-C 3.59Å; L968-V974 WeakPolarHBondContact O-CA 3.34Å; V969-V974 HydrophobicContact CG2-CG1 4.01Å; V969-V974 HydrophobicContact CG2-CG2 4.03Å; V974-I985 PolarHBondContact N-O 3.47Å; V974-I985 PolarHBondContact O-N 2.97Å; V974-I987 HydrophobicContact CG2-CD1 4.01Å; V974-I987 HydrophobicContact CG2-CG1 3.71Å
975	W	96.4	Very high	93.8	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.008	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	125.8	174.8	-71.8	39.7	0	0	0	108.6	L967 L968 L970 V982 V984 F995 M1008 V1015 M1017 L1033	L967-W975 WeakPolarHBondContact CA-O 3.44Å; L968-W975 HydrophobicContact CB-CB 4.33Å; L968-W975 PolarHBondContact N-O 3.36Å; L968-W975 PolarHBondContact O-N 2.95Å; L970-W975 HydrophobicContact CD1-CD2 4.49Å; L970-W975 HydrophobicContact CD1-CG 4.47Å; L970-W975 HydrophobicContact CD1-CZ2 4.47Å; W975-V982 HydrophobicContact CB-CG1 4.24Å; W975-V982 HydrophobicContact CD2-CG1 4.38Å; W975-V982 HydrophobicContact CE3-CG1 3.91Å; W975-V984 HydrophobicContact CD2-CG2 3.93Å; W975-V984 HydrophobicContact CG-CG2 4.13Å; W975-V984 HydrophobicContact CZ2-CG2 3.98Å; W975-F995 HydrophobicContact CE3-CZ 4.34Å; W975-F995 HydrophobicContact CH2-CE1 4.47Å; W975-F995 HydrophobicContact CH2-CZ 4.19Å; W975-F995 HydrophobicContact CZ3-CE1 4.21Å; W975-F995 AromaticContact CZ3-CZ 3.74Å; W975-F995 HydrophobicContact CZ3-CZ 3.74Å; W975-M1008 HydrophobicContact CB-CE 3.91Å; W975-M1008 HydrophobicContact CB-SD 4.47Å; W975-M1008 VanDerWaalsContact O-CE 3.28Å; W975-M1008 WeakPolarHBondContact O-CE 3.17Å; W975-V1015 HydrophobicContact CD2-CG2 4.37Å; W975-V1015 HydrophobicContact CE3-CB 4.29Å; W975-V1015 HydrophobicContact CE3-CG1 4.34Å; W975-V1015 HydrophobicContact CE3-CG2 3.96Å; W975-V1015 HydrophobicContact CH2-CG2 4.23Å; W975-V1015 HydrophobicContact CZ3-CB 4.02Å; W975-V1015 HydrophobicContact CZ3-CG1 4.47Å; W975-V1015 HydrophobicContact CZ3-CG2 3.87Å; W975-M1017 HydrophobicContact CE3-CE 3.68Å; W975-M1017 HydrophobicContact CZ3-CE 3.53Å; W975-L1033 HydrophobicContact CH2-CD2 3.5Å; W975-L1033 VanDerWaalsContact CH2-CD2 3.5Å; W975-L1033 HydrophobicContact CZ2-CD2 3.53Å
976	A	97.1	Very high	93.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	122.2	-178.5	0	0	0	0	0	110.5	V937 L959 L967 V982 T983 I985	V937-A976 HydrophobicContact CG2-CB 4.33Å; L959-A976 HydrophobicContact CD1-CB 3.4Å; L959-A976 VanDerWaalsContact CD1-CB 3.4Å; L967-A976 HydrophobicContact CD2-CB 3.54Å; A976-V982 WeakPolarHBondContact O-CA 3.44Å; A976-T983 PolarHBondContact N-O 3.12Å; A976-T983 PolarHBondContact O-N 3.34Å; A976-I985 HydrophobicContact CB-CD1 4.47Å
977	S	96.3	Very high	93.4	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.007	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	134.5	172.4	64	0	0	0	0	110.8	I964 R965 T966	I964-S977 VanDerWaalsContact CA-O 3.27Å; I964-S977 WeakPolarHBondContact CA-O 3.31Å; R965-S977 PolarHBondContact N-OG 3.49Å; T966-S977 VanDerWaalsContact CG2-OG 3.26Å; T966-S977 WeakPolarHBondContact CG2-OG 3.5Å; T966-S977 PolarHBondContact N-OG 3.32Å; T966-S977 PolarHBondContact O-N 3.37Å; T966-S977 VanDerWaalsContact O-N 3.09Å; T966-S977 PolarHBondContact O-OG 2.91Å
978	C	95.3	Very high	93	Very high	4 Å²	4	28.3 Å²	28.3	3%	0.027	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	104.9	173.7	-179.9	0	0	0	0	108	L959 E962 N980 S981	L959-C978 HydrophobicContact CB-CB 4.24Å; E962-C978 PolarHBondContact O-SG 3.5Å; C978-N980 PolarHBondContact O-N 3.27Å; C978-S981 CarbonylContact C-O 3.51Å; C978-S981 PolarHBondContact N-O 3.01Å; C978-S981 PolarHBondContact O-N 3.25Å; C978-S981 VanDerWaalsContact O-O 3.08Å; C978-S981 PolarHBondContact O-OG 3.35Å
979	G	93.3	Very high	92.7	Very high	8 Å²	8	31.2 Å²	31.2	8%	0.082	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	-133.1	-171.5	0	0	0	0	0	112.5	S981 S1004 V1005	G979-S981 PolarHBondContact O-N 3.46Å; G979-S1004 CarbonylContact O-C 3.58Å; G979-S1004 WeakPolarHBondContact O-CA 3.41Å; G979-S1004 WeakPolarHBondContact O-CB 3.22Å; G979-V1005 PolarHBondContact O-N 3.22Å
980	N	92.7	Very high	92.4	Very high	15 Å²	15	31 Å²	31	8%	0.08	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-8.9	173.6	-178.4	32.6	0	0	0	114	C978 V997 H998	C978-N980 PolarHBondContact O-N 3.27Å; N980-V997 PolarHBondContact O-N 3.07Å; N980-H998 PolarHBondContact ND2-O 3.06Å; N980-H998 VanDerWaalsContact OD1-CA 3.26Å; N980-H998 WeakPolarHBondContact OD1-CA 3.48Å; N980-H998 WeakPolarHBondContact OD1-CB 3.23Å; N980-H998 PolarHBondContact OD1-N 2.95Å; N980-H998 PolarHBondContact OD1-O 2.97Å; N980-H998 VanDerWaalsContact OD1-O 3.09Å
981	S	94.3	Very high	92.4	Very high	12 Å²	12	33.9 Å²	33.9	8%	0.084	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	152	-174.2	59.5	0	0	0	0	112.8	C978 G979 K994 F995	C978-S981 CarbonylContact C-O 3.51Å; C978-S981 PolarHBondContact N-O 3.01Å; C978-S981 PolarHBondContact O-N 3.25Å; C978-S981 VanDerWaalsContact O-O 3.08Å; C978-S981 PolarHBondContact O-OG 3.35Å; G979-S981 PolarHBondContact O-N 3.46Å; S981-K994 WeakPolarHBondContact OG-CE 3.29Å; S981-K994 PolarHBondContact OG-NZ 3.43Å; S981-F995 VanDerWaalsContact CA-O 3.26Å; S981-F995 WeakPolarHBondContact CA-O 3.41Å; S981-F995 WeakPolarHBondContact CB-O 3.33Å
982	V	96.6	Very high	92.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.5	165.9	168.4	0	0	0	0	108.3	W975 A976 F995 V997 V1005 M1008 M1017	W975-V982 HydrophobicContact CB-CG1 4.24Å; W975-V982 HydrophobicContact CD2-CG1 4.38Å; W975-V982 HydrophobicContact CE3-CG1 3.91Å; A976-V982 WeakPolarHBondContact O-CA 3.44Å; V982-F995 HydrophobicContact CB-CD1 4.47Å; V982-F995 HydrophobicContact CB-CE1 3.85Å; V982-F995 HydrophobicContact CB-CZ 3.94Å; V982-F995 HydrophobicContact CG1-CE1 3.77Å; V982-F995 HydrophobicContact CG1-CZ 4.03Å; V982-F995 PolarHBondContact N-O 3.01Å; V982-F995 VanDerWaalsContact O-CD1 3.31Å; V982-F995 WeakPolarHBondContact O-CD1 3.44Å; V982-F995 PolarHBondContact O-N 3.08Å; V982-V997 HydrophobicContact CB-CG2 4.02Å; V982-V997 HydrophobicContact CG2-CG2 3.74Å; V982-V1005 HydrophobicContact CG2-CG2 4.39Å; V982-M1008 HydrophobicContact CG1-SD 4.17Å; V982-M1008 HydrophobicContact CG2-SD 3.79Å; V982-M1017 HydrophobicContact CG1-CE 4.41Å; V982-M1017 HydrophobicContact CG2-CE 4.08Å; V982-M1017 HydrophobicContact CG2-SD 4.05Å
983	T	96	Very high	93.2	Very high	3 Å²	3	30.5 Å²	30.5	2%	0.018	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.3	174.5	-53.3	0	0	0	0	109.3	L959 A976 T992 Q993 K994	L959-T983 HydrophobicContact CD2-CG2 3.95Å; A976-T983 PolarHBondContact N-O 3.12Å; A976-T983 PolarHBondContact O-N 3.34Å; T983-T992 HydrophobicContact CG2-CG2 4.06Å; T983-Q993 CarbonylContact C-O 3.48Å; T983-Q993 WeakPolarHBondContact CA-O 3.46Å; T983-K994 HydrophobicContact CG2-CB 4.43Å
984	V	95.3	Very high	93.3	Very high	17 Å²	17	35.1 Å²	35.1	10%	0.103	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	124	171.6	-175.5	0	0	0	0	108.2	W975 T992 Q993 F995 L1033	W975-V984 HydrophobicContact CD2-CG2 3.93Å; W975-V984 HydrophobicContact CG-CG2 4.13Å; W975-V984 HydrophobicContact CZ2-CG2 3.98Å; V984-T992 CarbonylContact O-C 3.59Å; V984-T992 VanDerWaalsContact O-CA 3.29Å; V984-T992 WeakPolarHBondContact O-CA 3.19Å; V984-Q993 PolarHBondContact N-O 3.28Å; V984-Q993 PolarHBondContact O-N 3.3Å; V984-F995 HydrophobicContact CG2-CE1 4.16Å; V984-L1033 HydrophobicContact CG2-CD2 4.16Å
985	I	94.8	Very high	93.2	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	117.3	179.7	-46.1	179.5	0	0	0	108.1	V937 V957 L959 S973 V974 A976 I987 L990 T992	V937-I985 HydrophobicContact CB-CD1 4.49Å; V937-I985 HydrophobicContact CG2-CD1 4.22Å; V957-I985 HydrophobicContact CG1-CD1 4.48Å; L959-I985 HydrophobicContact CD1-CD1 4.41Å; L959-I985 HydrophobicContact CD2-CD1 4.15Å; S973-I985 CarbonylContact C-O 3.48Å; S973-I985 VanDerWaalsContact CA-O 3.24Å; S973-I985 WeakPolarHBondContact CA-O 3.42Å; V974-I985 PolarHBondContact N-O 3.47Å; V974-I985 PolarHBondContact O-N 2.97Å; A976-I985 HydrophobicContact CB-CD1 4.47Å; I985-I987 PolarHBondContact O-N 3.5Å; I985-L990 HydrophobicContact CG2-CD2 4.24Å; I985-T992 HydrophobicContact CG1-CG2 4.23Å; I985-T992 HydrophobicContact CG2-CG2 4.43Å
986	Q	93	Very high	93.1	Very high	58 Å²	58	43.6 Å²	43.6	27%	0.271	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	126	178.7	-177.8	62.2	27	0	0	110.6	E972 S988 T989 L990 T991	E972-Q986 VanDerWaalsContact O-CD 3.24Å; E972-Q986 PolarHBondContact O-NE2 2.72Å; E972-Q986 VanDerWaalsContact O-NE2 3.14Å; E972-Q986 PolarHBondContact O-OE1 2.93Å; E972-Q986 PolarHBondContact OE2-NE2 2.69Å; Q986-S988 VanDerWaalsContact C-N 3.3Å; Q986-S988 PolarHBondContact NE2-OG 3.27Å; Q986-S988 PolarHBondContact O-N 3.13Å; Q986-T989 WeakPolarHBondContact CB-OG1 3.4Å; Q986-T989 VanDerWaalsContact CG-OG1 3.28Å; Q986-T989 WeakPolarHBondContact CG-OG1 3.32Å; Q986-T989 PolarHBondContact O-N 3.08Å; Q986-L990 WeakPolarHBondContact O-CA 3.19Å; Q986-L990 PolarHBondContact O-N 3.36Å; Q986-T991 PolarHBondContact N-O 2.74Å
987	I	89.6	Confident	92.9	Very high	19 Å²	19	43.9 Å²	43.9	10%	0.097	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-29.4	-171.1	-68.8	169.7	0	0	0	112.6	F927 F929 V969 E972 V974 I985	F927-I987 HydrophobicContact CD2-CG2 4.09Å; F927-I987 HydrophobicContact CE2-CG2 4.37Å; F929-I987 HydrophobicContact CZ-CG1 4.34Å; V969-I987 HydrophobicContact CG1-CD1 4.23Å; E972-I987 PolarHBondContact O-N 2.97Å; V974-I987 HydrophobicContact CG2-CD1 4.01Å; V974-I987 HydrophobicContact CG2-CG1 3.71Å; I985-I987 PolarHBondContact O-N 3.5Å
988	S	87.6	Confident	92.7	Very high	72 Å²	72	45.2 Å²	45.2	50%	0.503	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-26.6	-177.2	49.1	0	0	0	0	114.6	Q986	Q986-S988 VanDerWaalsContact C-N 3.3Å; Q986-S988 PolarHBondContact NE2-OG 3.27Å; Q986-S988 PolarHBondContact O-N 3.13Å
989	T	87.6	Confident	92.4	Very high	84 Å²	84	50.4 Å²	50.4	52%	0.515	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.7	-10.3	-172.1	54.7	0	0	0	0	114.2	Q986 T991	Q986-T989 WeakPolarHBondContact CB-OG1 3.4Å; Q986-T989 VanDerWaalsContact CG-OG1 3.28Å; Q986-T989 WeakPolarHBondContact CG-OG1 3.32Å; Q986-T989 PolarHBondContact O-N 3.08Å; T989-T991 PolarHBondContact O-N 2.76Å; T989-T991 VanDerWaalsContact O-N 3.07Å; T989-T991 PolarHBondContact OG1-OG1 3.08Å
990	L	87.6	Confident	92.2	Very high	38 Å²	38	53.1 Å²	53.1	20%	0.199	29%	0.288	C	S	.	.			trans	54.4	16.6	-170.7	-55.6	-179.9	0	0	0	114.9	I955 I985 Q986	I955-L990 HydrophobicContact CB-CD1 4.48Å; I955-L990 HydrophobicContact CD1-CD1 3.92Å; I955-L990 HydrophobicContact CG2-CD1 3.86Å; I985-L990 HydrophobicContact CG2-CD2 4.24Å; Q986-L990 WeakPolarHBondContact O-CA 3.19Å; Q986-L990 PolarHBondContact O-N 3.36Å
991	T	90.8	Very high	92	Very high	89 Å²	89	57 Å²	57	55%	0.546	32%	0.315	S	S	.	.			trans	-69.6	139.3	174.3	50.4	0	0	0	0	111	Q986 T989	Q986-T991 PolarHBondContact N-O 2.74Å; T989-T991 PolarHBondContact O-N 2.76Å; T989-T991 VanDerWaalsContact O-N 3.07Å; T989-T991 PolarHBondContact OG1-OG1 3.08Å
992	T	93	Very high	91.7	Very high	81 Å²	81	64.4 Å²	64.4	50%	0.497	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	137	-172.4	56.8	0	0	0	0	113.5	V957 L959 T983 V984 I985	V957-T992 HydrophobicContact CG1-CG2 3.96Å; L959-T992 HydrophobicContact CD2-CG2 4.34Å; T983-T992 HydrophobicContact CG2-CG2 4.06Å; V984-T992 CarbonylContact O-C 3.59Å; V984-T992 VanDerWaalsContact O-CA 3.29Å; V984-T992 WeakPolarHBondContact O-CA 3.19Å; I985-T992 HydrophobicContact CG1-CG2 4.23Å; I985-T992 HydrophobicContact CG2-CG2 4.43Å
993	Q	92.8	Very high	91.5	Very high	120 Å²	120	65.4 Å²	65.4	56%	0.561	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.5	125	170.6	-177.2	179.5	5.3	0	0	110	T983 V984 L1033	T983-Q993 CarbonylContact C-O 3.48Å; T983-Q993 WeakPolarHBondContact CA-O 3.46Å; V984-Q993 PolarHBondContact N-O 3.28Å; V984-Q993 PolarHBondContact O-N 3.3Å; Q993-L1033 HydrophobicContact CG-CD1 4.19Å
994	K	93.6	Very high	91.4	Very high	113 Å²	113	65.7 Å²	65.7	49%	0.491	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	138.6	-171.9	-173.5	170.9	-172.4	166.1	0	111.8	L959 S981 T983	L959-K994 PolarHBondContact O-NZ 2.87Å; S981-K994 WeakPolarHBondContact OG-CE 3.29Å; S981-K994 PolarHBondContact OG-NZ 3.43Å; T983-K994 HydrophobicContact CG2-CB 4.43Å
995	F	94.6	Very high	91.4	Very high	31 Å²	31	65 Å²	65	14%	0.136	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	161.4	174.5	69.5	-77	0	0	0	112	W975 S981 V982 V984 V997 M1017 F1028 L1033	W975-F995 HydrophobicContact CE3-CZ 4.34Å; W975-F995 HydrophobicContact CH2-CE1 4.47Å; W975-F995 HydrophobicContact CH2-CZ 4.19Å; W975-F995 HydrophobicContact CZ3-CE1 4.21Å; W975-F995 AromaticContact CZ3-CZ 3.74Å; W975-F995 HydrophobicContact CZ3-CZ 3.74Å; S981-F995 VanDerWaalsContact CA-O 3.26Å; S981-F995 WeakPolarHBondContact CA-O 3.41Å; S981-F995 WeakPolarHBondContact CB-O 3.33Å; V982-F995 HydrophobicContact CB-CD1 4.47Å; V982-F995 HydrophobicContact CB-CE1 3.85Å; V982-F995 HydrophobicContact CB-CZ 3.94Å; V982-F995 HydrophobicContact CG1-CE1 3.77Å; V982-F995 HydrophobicContact CG1-CZ 4.03Å; V982-F995 PolarHBondContact N-O 3.01Å; V982-F995 VanDerWaalsContact O-CD1 3.31Å; V982-F995 WeakPolarHBondContact O-CD1 3.44Å; V982-F995 PolarHBondContact O-N 3.08Å; V984-F995 HydrophobicContact CG2-CE1 4.16Å; F995-V997 HydrophobicContact CD2-CG2 4.35Å; F995-V997 HydrophobicContact CE2-CG2 4.04Å; F995-M1017 HydrophobicContact CZ-CE 4.13Å; F995-F1028 AromaticContact CE2-CD1 3.97Å; F995-F1028 HydrophobicContact CE2-CD1 3.97Å; F995-F1028 HydrophobicContact CE2-CE1 4.32Å; F995-F1028 HydrophobicContact CE2-CG 4.4Å; F995-L1033 HydrophobicContact CD1-CB 4.25Å; F995-L1033 HydrophobicContact CD1-CD1 3.74Å; F995-L1033 HydrophobicContact CD1-CD2 4.43Å; F995-L1033 HydrophobicContact CD1-CG 4.36Å; F995-L1033 HydrophobicContact CD2-CB 4.27Å; F995-L1033 HydrophobicContact CE1-CB 4.31Å; F995-L1033 HydrophobicContact CE1-CD1 4.12Å; F995-L1033 HydrophobicContact CE1-CD2 3.97Å; F995-L1033 HydrophobicContact CE1-CG 4.36Å; F995-L1033 HydrophobicContact CE2-CB 4.34Å; F995-L1033 HydrophobicContact CG-CB 4.22Å; F995-L1033 HydrophobicContact CG-CD1 4.26Å; F995-L1033 HydrophobicContact CZ-CB 4.35Å; F995-L1033 HydrophobicContact CZ-CD2 4.34Å
996	E	93.9	Very high	91.3	Very high	150 Å²	150	66 Å²	66	70%	0.701	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	143.1	178.9	-62.4	-170.9	154.9	0	0	111.4
997	V	92.7	Very high	91.4	Very high	6 Å²	6	65.9 Å²	65.9	4%	0.036	36%	0.359	C	S	.	.			trans	-113.1	-27.2	-168	-168.6	0	0	0	0	112.1	N980 V982 F995 V1005 M1017 F1019 R1026 F1028	N980-V997 PolarHBondContact O-N 3.07Å; V982-V997 HydrophobicContact CB-CG2 4.02Å; V982-V997 HydrophobicContact CG2-CG2 3.74Å; F995-V997 HydrophobicContact CD2-CG2 4.35Å; F995-V997 HydrophobicContact CE2-CG2 4.04Å; V997-V1005 HydrophobicContact CB-CG2 3.82Å; V997-V1005 HydrophobicContact CG1-CG2 3.84Å; V997-V1005 HydrophobicContact CG2-CG2 4.02Å; V997-M1017 HydrophobicContact CB-SD 4.49Å; V997-M1017 HydrophobicContact CG1-SD 3.45Å; V997-M1017 WeakPolarHBondContact CG1-SD 3.26Å; V997-M1017 HydrophobicContact CG2-SD 4.17Å; V997-F1019 HydrophobicContact CB-CE1 4.24Å; V997-F1019 HydrophobicContact CG1-CE1 3.65Å; V997-F1019 HydrophobicContact CG1-CZ 3.77Å; V997-R1026 PolarHBondContact O-NH1 3.41Å; V997-F1028 HydrophobicContact CB-CZ 4.31Å; V997-F1028 HydrophobicContact CG1-CD2 4.21Å; V997-F1028 HydrophobicContact CG1-CE1 4.4Å; V997-F1028 HydrophobicContact CG1-CE2 3.34Å; V997-F1028 HydrophobicContact CG1-CZ 3.46Å; V997-F1028 VanDerWaalsContact CG1-CZ 3.46Å
998	H	91.3	Very high	91.8	Very high	29 Å²	29	65.7 Å²	65.7	13%	0.134	36%	0.358	C	S	.	.			trans	-126	141.9	176	-154.9	-89.8	0	0	0	111.7	N980 D1000 I1003 F1019 R1026	N980-H998 PolarHBondContact ND2-O 3.06Å; N980-H998 VanDerWaalsContact OD1-CA 3.26Å; N980-H998 WeakPolarHBondContact OD1-CA 3.48Å; N980-H998 WeakPolarHBondContact OD1-CB 3.23Å; N980-H998 PolarHBondContact OD1-N 2.95Å; N980-H998 PolarHBondContact OD1-O 2.97Å; N980-H998 VanDerWaalsContact OD1-O 3.09Å; H998-D1000 WeakPolarHBondContact ND1-CB 3.32Å; H998-D1000 PolarHBondContact ND1-N 2.93Å; H998-D1000 VanDerWaalsContact ND1-N 3.18Å; H998-D1000 PolarHBondContact O-N 3.3Å; H998-I1003 HydrophobicContact CB-CB 4.36Å; H998-I1003 HydrophobicContact CB-CG2 4.37Å; H998-F1019 HydrophobicContact CB-CD1 4.34Å; H998-F1019 HydrophobicContact CB-CE1 4.04Å; H998-R1026 VanDerWaalsContact CD2-CZ 3.43Å; H998-R1026 PolarHBondContact CD2-NH1 2.85Å; H998-R1026 PolarHBondContact CD2-NH2 3.17Å; H998-R1026 VanDerWaalsContact CD2-NH2 3.31Å; H998-R1026 PolarHBondContact NE2-NH2 2.64Å
999	P	89	Confident	92.1	Very high	112 Å²	112	62.8 Å²	62.8	73%	0.727	34%	0.338	S	S	*	.	S	Bend	trans	-74.2	-6.2	176.2	30.8	-37.7	0	0	0	114
1000	D	89.3	Confident	92.3	Very high	65 Å²	65	60.7 Å²	60.7	35%	0.348	33%	0.326	S	S	.	.	S	Bend	trans	-105.9	116.3	171.7	-176.5	-22.2	0	0	0	108.2	H998 M1002 I1003	H998-D1000 WeakPolarHBondContact ND1-CB 3.32Å; H998-D1000 PolarHBondContact ND1-N 2.93Å; H998-D1000 VanDerWaalsContact ND1-N 3.18Å; H998-D1000 PolarHBondContact O-N 3.3Å; D1000-M1002 PolarHBondContact O-N 2.83Å; D1000-M1002 WeakPolarHBondContact OD1-CB 3.39Å; D1000-M1002 PolarHBondContact OD1-N 3.35Å; D1000-I1003 HydrophobicContact CB-CD1 4.12Å; D1000-I1003 HydrophobicContact CB-CG1 4.19Å; D1000-I1003 PolarHBondContact O-N 3.1Å
1001	P	88.4	Confident	92.3	Very high	98 Å²	98	59.7 Å²	59.7	64%	0.636	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-16.9	-176.4	29.1	-36.1	0	0	0	114	I1003	P1001-I1003 VanDerWaalsContact C-N 3.27Å; P1001-I1003 PolarHBondContact O-N 3.11Å
1002	M	89.1	Confident	92	Very high	166 Å²	166	57.5 Å²	57.5	82%	0.818	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-19	176.6	-60.7	-64.2	176.3	0	0	112.5	D1000 S1004	D1000-M1002 PolarHBondContact O-N 2.83Å; D1000-M1002 WeakPolarHBondContact OD1-CB 3.39Å; D1000-M1002 PolarHBondContact OD1-N 3.35Å; M1002-S1004 PolarHBondContact O-N 3.25Å
1003	I	91.8	Very high	91.8	Very high	21 Å²	21	53.9 Å²	53.9	11%	0.108	30%	0.297	C	S	.	.			trans	-91.7	97.2	-172.2	-64.2	-174.6	0	0	0	110.3	H998 D1000 P1001 F1019 E1021	H998-I1003 HydrophobicContact CB-CB 4.36Å; H998-I1003 HydrophobicContact CB-CG2 4.37Å; D1000-I1003 HydrophobicContact CB-CD1 4.12Å; D1000-I1003 HydrophobicContact CB-CG1 4.19Å; D1000-I1003 PolarHBondContact O-N 3.1Å; P1001-I1003 VanDerWaalsContact C-N 3.27Å; P1001-I1003 PolarHBondContact O-N 3.11Å; I1003-F1019 HydrophobicContact CG2-CB 3.66Å; I1003-F1019 HydrophobicContact CG2-CD1 3.93Å; I1003-F1019 HydrophobicContact CG2-CG 4.04Å; I1003-E1021 HydrophobicContact CD1-CB 4.35Å; I1003-E1021 HydrophobicContact CG1-CB 4.39Å
1004	S	93	Very high	91.7	Very high	10 Å²	10	48.2 Å²	48.2	7%	0.07	27%	0.271	C	S	.	.			trans	-77.1	146	177	64.1	0	0	0	0	113.7	R965 G979 M1002 F1019 S1020	R965-S1004 PolarHBondContact NE-OG 2.83Å; G979-S1004 CarbonylContact O-C 3.58Å; G979-S1004 WeakPolarHBondContact O-CA 3.41Å; G979-S1004 WeakPolarHBondContact O-CB 3.22Å; M1002-S1004 PolarHBondContact O-N 3.25Å; S1004-F1019 CarbonylContact O-C 3.55Å; S1004-S1020 WeakPolarHBondContact CA-OG 3.47Å; S1004-S1020 PolarHBondContact N-OG 2.98Å; S1004-S1020 WeakPolarHBondContact O-CB 3.37Å; S1004-S1020 PolarHBondContact O-N 3.49Å; S1004-S1020 PolarHBondContact O-OG 3.41Å; S1004-S1020 PolarHBondContact OG-OG 3.21Å
1005	V	95.5	Very high	91.7	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	127.1	174.5	176.7	0	0	0	0	110	R965 G979 V982 V997 M1008 M1017 F1019	R965-V1005 VanDerWaalsContact CD-O 3.28Å; R965-V1005 WeakPolarHBondContact CD-O 3.4Å; G979-V1005 PolarHBondContact O-N 3.22Å; V982-V1005 HydrophobicContact CG2-CG2 4.39Å; V997-V1005 HydrophobicContact CB-CG2 3.82Å; V997-V1005 HydrophobicContact CG1-CG2 3.84Å; V997-V1005 HydrophobicContact CG2-CG2 4.02Å; V1005-M1008 HydrophobicContact CG1-CG 4.03Å; V1005-M1017 HydrophobicContact CG1-CB 4.42Å; V1005-M1017 HydrophobicContact CG1-SD 4.37Å; V1005-F1019 HydrophobicContact CG2-CD1 4.14Å; V1005-F1019 HydrophobicContact CG2-CE1 3.91Å
1006	T	94.1	Very high	91.8	Very high	24 Å²	24	41.3 Å²	41.3	15%	0.147	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-36.3	-176.9	55.7	0	0	0	0	114.1	T966 A1018 F1019 S1020	T966-T1006 WeakPolarHBondContact CG2-O 3.43Å; T1006-A1018 PolarHBondContact N-O 3.1Å; T1006-A1018 PolarHBondContact OG1-O 3.24Å; T1006-F1019 PolarHBondContact OG1-O 3.48Å; T1006-S1020 VanDerWaalsContact CG2-CA 3.49Å
1007	H	95.1	Very high	91.9	Very high	55 Å²	55	34.2 Å²	34.2	26%	0.255	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	145.6	-174.9	-60.4	85.1	0	0	0	111	M1017 A1018 T1058 L1060	H1007-M1017 WeakPolarHBondContact O-CA 3.33Å; H1007-A1018 HydrophobicContact CB-CB 4.2Å; H1007-A1018 PolarHBondContact N-O 2.96Å; H1007-A1018 PolarHBondContact O-N 3.37Å; H1007-T1058 VanDerWaalsContact CE1-C 3.49Å; H1007-T1058 PolarHBondContact CE1-O 3.08Å; H1007-T1058 PolarHBondContact NE2-O 3.37Å; H1007-L1060 HydrophobicContact CB-CB 3.74Å; H1007-L1060 HydrophobicContact CB-CD2 4.38Å
1008	M	96.4	Very high	92	Very high	15 Å²	15	33.9 Å²	33.9	7%	0.074	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	139.3	173.3	-59.3	-167.9	-68.1	0	0	110.1	T966 L968 W975 V982 V1005 V1015 W1016 M1017	T966-M1008 HydrophobicContact CG2-CE 4.15Å; T966-M1008 HydrophobicContact CG2-CG 3.96Å; L968-M1008 HydrophobicContact CB-CB 4.3Å; L968-M1008 HydrophobicContact CB-CE 4.07Å; L968-M1008 HydrophobicContact CD2-CB 3.93Å; W975-M1008 HydrophobicContact CB-CE 3.91Å; W975-M1008 HydrophobicContact CB-SD 4.47Å; W975-M1008 VanDerWaalsContact O-CE 3.28Å; W975-M1008 WeakPolarHBondContact O-CE 3.17Å; V982-M1008 HydrophobicContact CG1-SD 4.17Å; V982-M1008 HydrophobicContact CG2-SD 3.79Å; V1005-M1008 HydrophobicContact CG1-CG 4.03Å; M1008-V1015 HydrophobicContact CB-CG1 3.97Å; M1008-V1015 HydrophobicContact CG-CG1 4.49Å; M1008-W1016 CarbonylContact C-O 3.46Å; M1008-W1016 WeakPolarHBondContact CA-O 3.34Å; M1008-M1017 HydrophobicContact CG-CG 4.05Å; M1008-M1017 HydrophobicContact CG-SD 4.39Å; M1008-M1017 HydrophobicContact SD-CE 3.8Å; M1008-M1017 HydrophobicContact SD-CG 4.47Å; M1008-M1017 HydrophobicContact SD-SD 4.14Å
1009	A	94.3	Very high	92.2	Very high	10 Å²	10	32.8 Å²	32.8	8%	0.083	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	131.2	177	0	0	0	0	0	110.9	W1016 L1060 I1062	A1009-W1016 PolarHBondContact N-O 3.37Å; A1009-W1016 PolarHBondContact O-N 3.27Å; A1009-L1060 HydrophobicContact CB-CD2 4.01Å; A1009-L1060 HydrophobicContact CB-CG 4.22Å; A1009-I1062 HydrophobicContact CB-CD1 3.77Å; A1009-I1062 HydrophobicContact CB-CG1 3.96Å
1010	C	91.6	Very high	92.3	Very high	41 Å²	41	28.6 Å²	28.6	28%	0.277	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	144.4	-177.6	-163.4	0	0	0	0	113	L968 L970 I1062	L968-C1010 HydrophobicContact CD1-CB 4.32Å; L968-C1010 HydrophobicContact CD2-CB 4.2Å; L970-C1010 HydrophobicContact CD2-CB 3.81Å; L970-C1010 VanDerWaalsContact CD2-SG 3.53Å; C1010-I1062 WeakPolarHBondContact O-CD1 3.3Å
1011	A	87.6	Confident	92.2	Very high	16 Å²	16	30.9 Å²	30.9	13%	0.132	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	128	159.6	0	0	0	0	0	109.9	G1013 G1014 I1062 P1088	A1011-G1013 PolarHBondContact O-N 3.09Å; A1011-G1014 PolarHBondContact N-O 2.88Å; A1011-G1014 PolarHBondContact O-N 3.49Å; A1011-G1014 VanDerWaalsContact O-O 3.13Å; A1011-I1062 HydrophobicContact CB-CD1 3.89Å; A1011-I1062 HydrophobicContact CB-CG2 4.26Å; A1011-P1088 HydrophobicContact CB-CB 3.61Å; A1011-P1088 HydrophobicContact CB-CG 4.05Å; A1011-P1088 VanDerWaalsContact O-CD 3.24Å; A1011-P1088 WeakPolarHBondContact O-CD 3.21Å; A1011-P1088 WeakPolarHBondContact O-CG 3.49Å
1012	G	85.4	Confident	92.1	Very high	43 Å²	43	28.1 Å²	28.1	44%	0.443	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.7	-129.7	-179	0	0	0	0	0	112.2	G1014 E1085 G1086	G1012-G1014 VanDerWaalsContact C-N 3.25Å; G1012-G1014 PolarHBondContact O-N 3.14Å; G1012-G1014 VanDerWaalsContact O-N 3.17Å; G1012-E1085 WeakPolarHBondContact CA-O 3.4Å; G1012-G1086 WeakPolarHBondContact CA-O 3.48Å
1013	G	87.5	Confident	91.9	Very high	6 Å²	6	21.3 Å²	21.3	6%	0.062	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	17.9	178.7	0	0	0	0	0	116.7	A1011 H1029 T1030 E1085 G1086	A1011-G1013 PolarHBondContact O-N 3.09Å; G1013-H1029 PolarHBondContact O-CD2 2.9Å; G1013-H1029 VanDerWaalsContact O-CD2 3.22Å; G1013-T1030 PolarHBondContact O-N 2.97Å; G1013-T1030 PolarHBondContact O-OG1 3.06Å; G1013-E1085 PolarHBondContact N-O 3.04Å; G1013-G1086 PolarHBondContact N-O 2.85Å
1014	G	91.3	Very high	91.9	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	150.5	-175.2	0	0	0	0	0	117.7	A1011 G1012 F1028	A1011-G1014 PolarHBondContact N-O 2.88Å; A1011-G1014 PolarHBondContact O-N 3.49Å; A1011-G1014 VanDerWaalsContact O-O 3.13Å; G1012-G1014 VanDerWaalsContact C-N 3.25Å; G1012-G1014 PolarHBondContact O-N 3.14Å; G1012-G1014 VanDerWaalsContact O-N 3.17Å; G1014-F1028 CarbonylContact C-O 3.41Å; G1014-F1028 VanDerWaalsContact CA-O 3.27Å; G1014-F1028 WeakPolarHBondContact CA-O 3.28Å
1015	V	94.8	Very high	91.9	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.8	179.4	-178.8	0	0	0	0	110.2	L968 W975 M1008 M1017 L1027 F1028 T1030	L968-V1015 HydrophobicContact CD2-CB 4.42Å; L968-V1015 HydrophobicContact CD2-CG1 3.61Å; L968-V1015 HydrophobicContact CD2-CG2 3.9Å; W975-V1015 HydrophobicContact CD2-CG2 4.37Å; W975-V1015 HydrophobicContact CE3-CB 4.29Å; W975-V1015 HydrophobicContact CE3-CG1 4.34Å; W975-V1015 HydrophobicContact CE3-CG2 3.96Å; W975-V1015 HydrophobicContact CH2-CG2 4.23Å; W975-V1015 HydrophobicContact CZ3-CB 4.02Å; W975-V1015 HydrophobicContact CZ3-CG1 4.47Å; W975-V1015 HydrophobicContact CZ3-CG2 3.87Å; M1008-V1015 HydrophobicContact CB-CG1 3.97Å; M1008-V1015 HydrophobicContact CG-CG1 4.49Å; V1015-M1017 HydrophobicContact CB-CE 4.37Å; V1015-M1017 HydrophobicContact CG1-CE 3.94Å; V1015-M1017 HydrophobicContact CG1-CG 4.09Å; V1015-L1027 WeakPolarHBondContact O-CA 3.43Å; V1015-F1028 PolarHBondContact N-O 3.25Å; V1015-F1028 PolarHBondContact O-N 2.89Å; V1015-T1030 HydrophobicContact CG2-CG2 3.98Å
1016	W	95.6	Very high	91.9	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	129.7	167.6	-77.8	100.7	0	0	0	110.2	M1008 A1009 I1025 R1026 L1027 Q1037 I1039 L1060 L1067 P1088 I1090	M1008-W1016 CarbonylContact C-O 3.46Å; M1008-W1016 WeakPolarHBondContact CA-O 3.34Å; A1009-W1016 PolarHBondContact N-O 3.37Å; A1009-W1016 PolarHBondContact O-N 3.27Å; W1016-I1025 HydrophobicContact CE3-CB 4.26Å; W1016-I1025 HydrophobicContact CE3-CD1 3.79Å; W1016-I1025 HydrophobicContact CE3-CG1 4Å; W1016-I1025 HydrophobicContact CZ3-CD1 3.97Å; W1016-I1025 HydrophobicContact CZ3-CG1 3.96Å; W1016-R1026 CarbonylContact C-O 3.6Å; W1016-R1026 WeakPolarHBondContact CA-O 3.38Å; W1016-L1027 HydrophobicContact CD2-CB 3.91Å; W1016-L1027 HydrophobicContact CD2-CD1 4.21Å; W1016-L1027 HydrophobicContact CE3-CB 3.88Å; W1016-L1027 HydrophobicContact CG-CD1 4.21Å; W1016-L1027 HydrophobicContact CH2-CB 3.66Å; W1016-L1027 HydrophobicContact CH2-CD2 4.42Å; W1016-L1027 HydrophobicContact CZ2-CB 3.69Å; W1016-L1027 HydrophobicContact CZ2-CD2 3.79Å; W1016-L1027 HydrophobicContact CZ2-CG 4.2Å; W1016-L1027 HydrophobicContact CZ3-CB 3.76Å; W1016-Q1037 HydrophobicContact CH2-CB 4.05Å; W1016-Q1037 HydrophobicContact CH2-CG 4.13Å; W1016-I1039 HydrophobicContact CH2-CD1 3.44Å; W1016-I1039 VanDerWaalsContact CH2-CD1 3.44Å; W1016-I1039 HydrophobicContact CH2-CG1 3.88Å; W1016-I1039 HydrophobicContact CZ2-CD1 4.21Å; W1016-I1039 HydrophobicContact CZ3-CD1 3.97Å; W1016-I1039 HydrophobicContact CZ3-CG1 4.13Å; W1016-L1060 HydrophobicContact CB-CD2 4.26Å; W1016-L1060 WeakPolarHBondContact O-CD2 3.39Å; W1016-L1067 HydrophobicContact CB-CD1 4.34Å; W1016-L1067 HydrophobicContact CB-CD2 4.31Å; W1016-L1067 HydrophobicContact CD2-CD2 3.79Å; W1016-L1067 HydrophobicContact CE3-CD2 4.29Å; W1016-L1067 HydrophobicContact CG-CD1 4.43Å; W1016-L1067 HydrophobicContact CG-CD2 3.78Å; W1016-P1088 PolarHBondContact NE1-O 2.91Å; W1016-I1090 HydrophobicContact CH2-CD1 3.93Å; W1016-I1090 HydrophobicContact CZ2-CD1 3.48Å; W1016-I1090 VanDerWaalsContact CZ2-CD1 3.48Å; W1016-I1090 HydrophobicContact CZ2-CG1 3.85Å
1017	M	96.3	Very high	91.9	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	143.3	-179.8	-57	-166	-175.6	0	0	111.4	W975 V982 F995 V997 V1005 H1007 M1008 V1015 I1025 R1026 F1028	W975-M1017 HydrophobicContact CE3-CE 3.68Å; W975-M1017 HydrophobicContact CZ3-CE 3.53Å; V982-M1017 HydrophobicContact CG1-CE 4.41Å; V982-M1017 HydrophobicContact CG2-CE 4.08Å; V982-M1017 HydrophobicContact CG2-SD 4.05Å; F995-M1017 HydrophobicContact CZ-CE 4.13Å; V997-M1017 HydrophobicContact CB-SD 4.49Å; V997-M1017 HydrophobicContact CG1-SD 3.45Å; V997-M1017 WeakPolarHBondContact CG1-SD 3.26Å; V997-M1017 HydrophobicContact CG2-SD 4.17Å; V1005-M1017 HydrophobicContact CG1-CB 4.42Å; V1005-M1017 HydrophobicContact CG1-SD 4.37Å; H1007-M1017 WeakPolarHBondContact O-CA 3.33Å; M1008-M1017 HydrophobicContact CG-CG 4.05Å; M1008-M1017 HydrophobicContact CG-SD 4.39Å; M1008-M1017 HydrophobicContact SD-CE 3.8Å; M1008-M1017 HydrophobicContact SD-CG 4.47Å; M1008-M1017 HydrophobicContact SD-SD 4.14Å; V1015-M1017 HydrophobicContact CB-CE 4.37Å; V1015-M1017 HydrophobicContact CG1-CE 3.94Å; V1015-M1017 HydrophobicContact CG1-CG 4.09Å; M1017-I1025 VanDerWaalsContact O-CA 3.29Å; M1017-I1025 WeakPolarHBondContact O-CA 3.33Å; M1017-I1025 WeakPolarHBondContact O-CB 3.24Å; M1017-R1026 PolarHBondContact N-O 2.68Å; M1017-R1026 PolarHBondContact O-N 3.18Å; M1017-F1028 HydrophobicContact CE-CB 4.37Å; M1017-F1028 HydrophobicContact CE-CD2 4.08Å; M1017-F1028 HydrophobicContact CE-CG 4.37Å; M1017-F1028 HydrophobicContact CG-CD2 4.06Å; M1017-F1028 HydrophobicContact CG-CE2 4.48Å; M1017-F1028 HydrophobicContact SD-CD2 3.84Å; M1017-F1028 HydrophobicContact SD-CE2 4.11Å
1018	A	95.4	Very high	91.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	153.6	172	0	0	0	0	0	111.1	T1006 H1007 I1025 V1057 L1060	T1006-A1018 PolarHBondContact N-O 3.1Å; T1006-A1018 PolarHBondContact OG1-O 3.24Å; H1007-A1018 HydrophobicContact CB-CB 4.2Å; H1007-A1018 PolarHBondContact N-O 2.96Å; H1007-A1018 PolarHBondContact O-N 3.37Å; A1018-I1025 HydrophobicContact CB-CG2 4.02Å; A1018-V1057 HydrophobicContact CB-CB 3.89Å; A1018-V1057 HydrophobicContact CB-CG1 3.72Å; A1018-V1057 HydrophobicContact CB-CG2 4.35Å; A1018-L1060 HydrophobicContact CB-CD2 4.36Å
1019	F	94.7	Very high	91.7	Very high	5 Å²	5	17.6 Å²	17.6	2%	0.022	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	172	-170.1	-59.2	-79.3	0	0	0	112.5	V997 H998 I1003 S1004 V1005 T1006 E1021 R1026	V997-F1019 HydrophobicContact CB-CE1 4.24Å; V997-F1019 HydrophobicContact CG1-CE1 3.65Å; V997-F1019 HydrophobicContact CG1-CZ 3.77Å; H998-F1019 HydrophobicContact CB-CD1 4.34Å; H998-F1019 HydrophobicContact CB-CE1 4.04Å; I1003-F1019 HydrophobicContact CG2-CB 3.66Å; I1003-F1019 HydrophobicContact CG2-CD1 3.93Å; I1003-F1019 HydrophobicContact CG2-CG 4.04Å; S1004-F1019 CarbonylContact O-C 3.55Å; V1005-F1019 HydrophobicContact CG2-CD1 4.14Å; V1005-F1019 HydrophobicContact CG2-CE1 3.91Å; T1006-F1019 PolarHBondContact OG1-O 3.48Å; F1019-E1021 WeakPolarHBondContact CB-O 3.34Å; F1019-R1026 HydrophobicContact CE2-CB 4.12Å; F1019-R1026 HydrophobicContact CE2-CG 3.94Å; F1019-R1026 HydrophobicContact CZ-CB 4.22Å; F1019-R1026 HydrophobicContact CZ-CG 4.22Å
1020	S	91.9	Very high	91.5	Very high	24 Å²	24	18.8 Å²	18.8	17%	0.168	13%	0.127	C	C	.	.	S	Bend	trans	-80.9	-31.4	178.7	37.3	0	0	0	0	113	S1004 T1006 R1056	S1004-S1020 WeakPolarHBondContact CA-OG 3.47Å; S1004-S1020 PolarHBondContact N-OG 2.98Å; S1004-S1020 WeakPolarHBondContact O-CB 3.37Å; S1004-S1020 PolarHBondContact O-N 3.49Å; S1004-S1020 PolarHBondContact O-OG 3.41Å; S1004-S1020 PolarHBondContact OG-OG 3.21Å; T1006-S1020 VanDerWaalsContact CG2-CA 3.49Å; S1020-R1056 WeakPolarHBondContact O-CD 3.17Å
1021	E	87.6	Confident	91.3	Very high	114 Å²	114	19.2 Å²	19.2	53%	0.533	13%	0.125	S	C	.	.	S	Bend	trans	-125.7	166.6	172	-57.9	-139.7	150.7	0	0	111.2	I1003 F1019	I1003-E1021 HydrophobicContact CD1-CB 4.35Å; I1003-E1021 HydrophobicContact CG1-CB 4.39Å; F1019-E1021 WeakPolarHBondContact CB-O 3.34Å
1022	G	84.9	Confident	91.3	Very high	40 Å²	40	21 Å²	21	41%	0.412	13%	0.134	S	C	.	.	S	Bend	trans	78	173.8	-175.8	0	0	0	0	0	114.1	M1055 R1056	G1022-M1055 CarbonylContact C-O 3.55Å; G1022-R1056 WeakPolarHBondContact O-CA 3.48Å
1023	S	86.2	Confident	91.5	Very high	23 Å²	23	20 Å²	20	16%	0.161	12%	0.119	C	C	.	.	S	Bend	trans	-115.5	11.3	-176.1	53.7	0	0	0	0	113.3	N1040 I1041 S1042 M1055	S1023-N1040 PolarHBondContact OG-OD1 3.29Å; S1023-N1040 VanDerWaalsContact OG-OD1 3.07Å; S1023-I1041 VanDerWaalsContact O-CB 3.3Å; S1023-I1041 WeakPolarHBondContact O-CB 3.42Å; S1023-I1041 WeakPolarHBondContact O-CG1 3.47Å; S1023-I1041 PolarHBondContact O-N 3.18Å; S1023-S1042 PolarHBondContact OG-OG 3.3Å; S1023-M1055 VanDerWaalsContact CB-O 3.29Å; S1023-M1055 WeakPolarHBondContact CB-O 3.44Å
1024	S	89.8	Confident	91.7	Very high	19 Å²	19	24.9 Å²	24.9	13%	0.133	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	154	177.5	62.7	0	0	0	0	113.6	E1038 I1039	S1024-E1038 WeakPolarHBondContact CB-OE1 3.23Å; S1024-E1038 PolarHBondContact OG-OE1 2.78Å; S1024-I1039 CarbonylContact C-O 3.44Å; S1024-I1039 VanDerWaalsContact CA-O 3.23Å; S1024-I1039 WeakPolarHBondContact CA-O 3.17Å
1025	I	93.9	Very high	91.8	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	150.2	165.4	56.7	168.6	0	0	0	108.7	W1016 M1017 A1018 E1038 I1039 I1041 V1057 L1067 V1069 L1079	W1016-I1025 HydrophobicContact CE3-CB 4.26Å; W1016-I1025 HydrophobicContact CE3-CD1 3.79Å; W1016-I1025 HydrophobicContact CE3-CG1 4Å; W1016-I1025 HydrophobicContact CZ3-CD1 3.97Å; W1016-I1025 HydrophobicContact CZ3-CG1 3.96Å; M1017-I1025 VanDerWaalsContact O-CA 3.29Å; M1017-I1025 WeakPolarHBondContact O-CA 3.33Å; M1017-I1025 WeakPolarHBondContact O-CB 3.24Å; A1018-I1025 HydrophobicContact CB-CG2 4.02Å; I1025-E1038 WeakPolarHBondContact O-CA 3.49Å; I1025-I1039 HydrophobicContact CG1-CB 4Å; I1025-I1039 PolarHBondContact N-O 3.07Å; I1025-I1039 PolarHBondContact O-N 3.4Å; I1025-I1041 HydrophobicContact CD1-CD1 4.01Å; I1025-I1041 HydrophobicContact CG1-CD1 4.11Å; I1025-I1041 HydrophobicContact CG1-CG1 4.48Å; I1025-V1057 HydrophobicContact CG2-CG2 3.86Å; I1025-L1067 HydrophobicContact CD1-CD2 3.64Å; I1025-V1069 HydrophobicContact CD1-CG2 4.4Å; I1025-L1079 HydrophobicContact CD1-CD1 3.96Å
1026	R	95.1	Very high	91.6	Very high	19 Å²	19	30.2 Å²	30.2	7%	0.072	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	141.6	-176.3	-74.8	-174.8	-170.2	151.4	12.4	111.9	V997 H998 W1016 M1017 F1019 F1028 L1035 Q1037 E1038	V997-R1026 PolarHBondContact O-NH1 3.41Å; H998-R1026 VanDerWaalsContact CD2-CZ 3.43Å; H998-R1026 PolarHBondContact CD2-NH1 2.85Å; H998-R1026 PolarHBondContact CD2-NH2 3.17Å; H998-R1026 VanDerWaalsContact CD2-NH2 3.31Å; H998-R1026 PolarHBondContact NE2-NH2 2.64Å; W1016-R1026 CarbonylContact C-O 3.6Å; W1016-R1026 WeakPolarHBondContact CA-O 3.38Å; M1017-R1026 PolarHBondContact N-O 2.68Å; M1017-R1026 PolarHBondContact O-N 3.18Å; F1019-R1026 HydrophobicContact CE2-CB 4.12Å; F1019-R1026 HydrophobicContact CE2-CG 3.94Å; F1019-R1026 HydrophobicContact CZ-CB 4.22Å; F1019-R1026 HydrophobicContact CZ-CG 4.22Å; R1026-F1028 HydrophobicContact CB-CD2 4.24Å; R1026-F1028 HydrophobicContact CB-CE2 3.53Å; R1026-F1028 HydrophobicContact CB-CZ 4.25Å; R1026-L1035 HydrophobicContact CB-CD1 3.66Å; R1026-L1035 HydrophobicContact CG-CD1 3.79Å; R1026-Q1037 CarbonylContact C-O 3.58Å; R1026-Q1037 WeakPolarHBondContact CA-O 3.49Å; R1026-E1038 HydrophobicContact CG-CB 4Å; R1026-E1038 HydrophobicContact CG-CG 3.88Å; R1026-E1038 IonicContact CZ-OE1 2.68Å; R1026-E1038 VanDerWaalsContact CZ-OE1 3.26Å; R1026-E1038 IonicContact CZ-OE2 2.73Å; R1026-E1038 IonicContact NE-OE1 3.79Å; R1026-E1038 PolarHBondContact NE-OE1 3.42Å; R1026-E1038 IonicContact NE-OE2 3.53Å; R1026-E1038 PolarHBondContact NE-OE2 3.38Å; R1026-E1038 IonicContact NH2-OE1 3.14Å; R1026-E1038 PolarHBondContact NH2-OE1 2.95Å; R1026-E1038 IonicContact NH2-OE2 2.66Å
1027	L	95.2	Very high	91.5	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	121.1	175.9	176.1	57.9	0	0	0	109.9	V1015 W1016 L1036 Q1037 I1087 P1088 K1089	V1015-L1027 WeakPolarHBondContact O-CA 3.43Å; W1016-L1027 HydrophobicContact CD2-CB 3.91Å; W1016-L1027 HydrophobicContact CD2-CD1 4.21Å; W1016-L1027 HydrophobicContact CE3-CB 3.88Å; W1016-L1027 HydrophobicContact CG-CD1 4.21Å; W1016-L1027 HydrophobicContact CH2-CB 3.66Å; W1016-L1027 HydrophobicContact CH2-CD2 4.42Å; W1016-L1027 HydrophobicContact CZ2-CB 3.69Å; W1016-L1027 HydrophobicContact CZ2-CD2 3.79Å; W1016-L1027 HydrophobicContact CZ2-CG 4.2Å; W1016-L1027 HydrophobicContact CZ3-CB 3.76Å; L1027-L1036 HydrophobicContact CD2-CB 4.27Å; L1027-L1036 HydrophobicContact CG-CB 4.16Å; L1027-L1036 PolarHBondContact O-N 2.82Å; L1027-Q1037 HydrophobicContact CB-CB 4.1Å; L1027-Q1037 HydrophobicContact CD2-CB 4.44Å; L1027-Q1037 PolarHBondContact N-O 2.86Å; L1027-I1087 HydrophobicContact CD2-CG2 4.11Å; L1027-P1088 HydrophobicContact CD1-CG 3.63Å; L1027-P1088 HydrophobicContact CD2-CG 4.01Å; L1027-P1088 HydrophobicContact CG-CG 4.48Å; L1027-K1089 HydrophobicContact CD2-CG 4.01Å
1028	F	94.4	Very high	91.3	Very high	8 Å²	8	36.6 Å²	36.6	4%	0.035	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	145	174.4	-69	-92.7	0	0	0	111.3	F995 V997 G1014 V1015 M1017 R1026 L1033 E1034 L1035	F995-F1028 AromaticContact CE2-CD1 3.97Å; F995-F1028 HydrophobicContact CE2-CD1 3.97Å; F995-F1028 HydrophobicContact CE2-CE1 4.32Å; F995-F1028 HydrophobicContact CE2-CG 4.4Å; V997-F1028 HydrophobicContact CB-CZ 4.31Å; V997-F1028 HydrophobicContact CG1-CD2 4.21Å; V997-F1028 HydrophobicContact CG1-CE1 4.4Å; V997-F1028 HydrophobicContact CG1-CE2 3.34Å; V997-F1028 HydrophobicContact CG1-CZ 3.46Å; V997-F1028 VanDerWaalsContact CG1-CZ 3.46Å; G1014-F1028 CarbonylContact C-O 3.41Å; G1014-F1028 VanDerWaalsContact CA-O 3.27Å; G1014-F1028 WeakPolarHBondContact CA-O 3.28Å; V1015-F1028 PolarHBondContact N-O 3.25Å; V1015-F1028 PolarHBondContact O-N 2.89Å; M1017-F1028 HydrophobicContact CE-CB 4.37Å; M1017-F1028 HydrophobicContact CE-CD2 4.08Å; M1017-F1028 HydrophobicContact CE-CG 4.37Å; M1017-F1028 HydrophobicContact CG-CD2 4.06Å; M1017-F1028 HydrophobicContact CG-CE2 4.48Å; M1017-F1028 HydrophobicContact SD-CD2 3.84Å; M1017-F1028 HydrophobicContact SD-CE2 4.11Å; R1026-F1028 HydrophobicContact CB-CD2 4.24Å; R1026-F1028 HydrophobicContact CB-CE2 3.53Å; R1026-F1028 HydrophobicContact CB-CZ 4.25Å; F1028-L1033 WeakPolarHBondContact CD1-O 2.92Å; F1028-E1034 WeakPolarHBondContact CA-O 3.39Å; F1028-L1035 HydrophobicContact CD1-CB 4.36Å; F1028-L1035 HydrophobicContact CE1-CB 3.92Å; F1028-L1035 HydrophobicContact CE1-CD1 4.31Å; F1028-L1035 HydrophobicContact CE2-CD1 4.21Å; F1028-L1035 HydrophobicContact CZ-CB 4.38Å; F1028-L1035 HydrophobicContact CZ-CD1 4.01Å
1029	H	92.1	Very high	91.1	Very high	1 Å²	1	37 Å²	37	1%	0.005	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	136.2	175.5	-168.9	-146.4	0	0	0	111.1	Q490 G1013 E1031 T1032 L1033 E1034 L1036	Q490-H1029 PolarHBondContact OE1-NE2 2.82Å; G1013-H1029 PolarHBondContact O-CD2 2.9Å; G1013-H1029 VanDerWaalsContact O-CD2 3.22Å; H1029-E1031 VanDerWaalsContact C-N 3.33Å; H1029-E1031 PolarHBondContact O-N 3.3Å; H1029-T1032 WeakPolarHBondContact CB-OG1 3.37Å; H1029-T1032 PolarHBondContact ND1-N 2.79Å; H1029-T1032 PolarHBondContact ND1-OG1 3.22Å; H1029-L1033 WeakPolarHBondContact O-CA 3.26Å; H1029-L1033 PolarHBondContact O-N 2.97Å; H1029-L1033 VanDerWaalsContact O-N 3.11Å; H1029-E1034 PolarHBondContact N-O 3.39Å; H1029-L1036 HydrophobicContact CB-CD1 3.77Å; H1029-L1036 HydrophobicContact CB-CD2 4.15Å; H1029-L1036 HydrophobicContact CB-CG 3.97Å
1030	T	89.9	Confident	90.7	Very high	36 Å²	36	39.8 Å²	39.8	22%	0.221	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-26.5	-179.9	49	0	0	0	0	114	L970 G1013 V1015	L970-T1030 HydrophobicContact CD1-CG2 3.9Å; G1013-T1030 PolarHBondContact O-N 2.97Å; G1013-T1030 PolarHBondContact O-OG1 3.06Å; V1015-T1030 HydrophobicContact CG2-CG2 3.98Å
1031	E	87.9	Confident	90.5	Very high	49 Å²	49	38.7 Å²	38.7	23%	0.229	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-35.3	-177.6	-60.8	-171	173.6	0	0	114.8	K481 R486 H1029	K481-E1031 HydrophobicContact CD-CG 4.31Å; K481-E1031 VanDerWaalsContact CE-OE1 3.31Å; K481-E1031 WeakPolarHBondContact CE-OE1 3.31Å; R486-E1031 WeakPolarHBondContact CG-OE2 3.26Å; R486-E1031 IonicContact CZ-OE1 3.42Å; R486-E1031 IonicContact CZ-OE2 3.7Å; R486-E1031 IonicContact NE-OE1 2.83Å; R486-E1031 PolarHBondContact NE-OE1 3.23Å; R486-E1031 IonicContact NE-OE2 3.26Å; R486-E1031 PolarHBondContact NE-OE2 3.19Å; R486-E1031 IonicContact NH2-OE1 2.72Å; R486-E1031 PolarHBondContact NH2-OE1 3.18Å; R486-E1031 IonicContact NH2-OE2 3.76Å; H1029-E1031 VanDerWaalsContact C-N 3.33Å; H1029-E1031 PolarHBondContact O-N 3.3Å
1032	T	87.2	Confident	89.9	Confident	53 Å²	53	34.6 Å²	34.6	33%	0.325	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-9	-179.2	62.3	0	0	0	0	113.8	H1029 E1034	H1029-T1032 WeakPolarHBondContact CB-OG1 3.37Å; H1029-T1032 PolarHBondContact ND1-N 2.79Å; H1029-T1032 PolarHBondContact ND1-OG1 3.22Å; T1032-E1034 VanDerWaalsContact CB-OE2 3.22Å; T1032-E1034 WeakPolarHBondContact CB-OE2 3.18Å; T1032-E1034 PolarHBondContact O-N 3.28Å; T1032-E1034 VanDerWaalsContact O-N 3.1Å; T1032-E1034 PolarHBondContact OG1-OE2 2.88Å
1033	L	90.8	Very high	88.8	Confident	24 Å²	24	37 Å²	37	13%	0.126	20%	0.198	C	C	.	.			trans	60.3	13	-177.1	-44.8	178.5	0	0	0	114.1	W975 V984 Q993 F995 F1028 H1029	W975-L1033 HydrophobicContact CH2-CD2 3.5Å; W975-L1033 VanDerWaalsContact CH2-CD2 3.5Å; W975-L1033 HydrophobicContact CZ2-CD2 3.53Å; V984-L1033 HydrophobicContact CG2-CD2 4.16Å; Q993-L1033 HydrophobicContact CG-CD1 4.19Å; F995-L1033 HydrophobicContact CD1-CB 4.25Å; F995-L1033 HydrophobicContact CD1-CD1 3.74Å; F995-L1033 HydrophobicContact CD1-CD2 4.43Å; F995-L1033 HydrophobicContact CD1-CG 4.36Å; F995-L1033 HydrophobicContact CD2-CB 4.27Å; F995-L1033 HydrophobicContact CE1-CB 4.31Å; F995-L1033 HydrophobicContact CE1-CD1 4.12Å; F995-L1033 HydrophobicContact CE1-CD2 3.97Å; F995-L1033 HydrophobicContact CE1-CG 4.36Å; F995-L1033 HydrophobicContact CE2-CB 4.34Å; F995-L1033 HydrophobicContact CG-CB 4.22Å; F995-L1033 HydrophobicContact CG-CD1 4.26Å; F995-L1033 HydrophobicContact CZ-CB 4.35Å; F995-L1033 HydrophobicContact CZ-CD2 4.34Å; F1028-L1033 WeakPolarHBondContact CD1-O 2.92Å; H1029-L1033 WeakPolarHBondContact O-CA 3.26Å; H1029-L1033 PolarHBondContact O-N 2.97Å; H1029-L1033 VanDerWaalsContact O-N 3.11Å
1034	E	90.7	Very high	87.6	Confident	108 Å²	108	39.4 Å²	39.4	51%	0.505	20%	0.203	S	C	.	.			trans	-80.9	149.6	-179.6	-66.7	170.4	120.9	0	0	112.6	F1028 H1029 T1032 L1036	F1028-E1034 WeakPolarHBondContact CA-O 3.39Å; H1029-E1034 PolarHBondContact N-O 3.39Å; T1032-E1034 VanDerWaalsContact CB-OE2 3.22Å; T1032-E1034 WeakPolarHBondContact CB-OE2 3.18Å; T1032-E1034 PolarHBondContact O-N 3.28Å; T1032-E1034 VanDerWaalsContact O-N 3.1Å; T1032-E1034 PolarHBondContact OG1-OE2 2.88Å; E1034-L1036 PolarHBondContact O-N 2.78Å
1035	L	93.2	Very high	86	Confident	85 Å²	85	38.9 Å²	38.9	45%	0.445	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	113.1	172.9	177	59.1	0	0	0	111.1	R1026 F1028 Q1037	R1026-L1035 HydrophobicContact CB-CD1 3.66Å; R1026-L1035 HydrophobicContact CG-CD1 3.79Å; F1028-L1035 HydrophobicContact CD1-CB 4.36Å; F1028-L1035 HydrophobicContact CE1-CB 3.92Å; F1028-L1035 HydrophobicContact CE1-CD1 4.31Å; F1028-L1035 HydrophobicContact CE2-CD1 4.21Å; F1028-L1035 HydrophobicContact CZ-CB 4.38Å; F1028-L1035 HydrophobicContact CZ-CD1 4.01Å; L1035-Q1037 WeakPolarHBondContact CD1-O 3.48Å
1036	L	91.9	Very high	83.8	Confident	26 Å²	26	45.4 Å²	45.4	14%	0.136	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-27	-176.9	-59.5	-173.4	0	0	0	114.6	L487 L1027 H1029 E1034 I1087 K1089	L487-L1036 HydrophobicContact CD1-CD1 4.02Å; L487-L1036 HydrophobicContact CD1-CD2 3.99Å; L487-L1036 HydrophobicContact CD2-CD2 3.68Å; L487-L1036 HydrophobicContact CG-CD2 4.49Å; L1027-L1036 HydrophobicContact CD2-CB 4.27Å; L1027-L1036 HydrophobicContact CG-CB 4.16Å; L1027-L1036 PolarHBondContact O-N 2.82Å; H1029-L1036 HydrophobicContact CB-CD1 3.77Å; H1029-L1036 HydrophobicContact CB-CD2 4.15Å; H1029-L1036 HydrophobicContact CB-CG 3.97Å; E1034-L1036 PolarHBondContact O-N 2.78Å; L1036-I1087 HydrophobicContact CD1-CD1 4.41Å; L1036-I1087 HydrophobicContact CD1-CG2 3.51Å; L1036-K1089 VanDerWaalsContact O-CE 3.31Å; L1036-K1089 WeakPolarHBondContact O-CE 3.41Å
1037	Q	92.6	Very high	81.6	Confident	46 Å²	46	48.6 Å²	48.6	22%	0.215	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	142.7	179.5	-166.6	173.8	14.1	0	0	110.8	W1016 R1026 L1027 L1035 I1039 I1090	W1016-Q1037 HydrophobicContact CH2-CB 4.05Å; W1016-Q1037 HydrophobicContact CH2-CG 4.13Å; R1026-Q1037 CarbonylContact C-O 3.58Å; R1026-Q1037 WeakPolarHBondContact CA-O 3.49Å; L1027-Q1037 HydrophobicContact CB-CB 4.1Å; L1027-Q1037 HydrophobicContact CD2-CB 4.44Å; L1027-Q1037 PolarHBondContact N-O 2.86Å; L1035-Q1037 WeakPolarHBondContact CD1-O 3.48Å; Q1037-I1039 HydrophobicContact CG-CG1 4.12Å; Q1037-I1090 PolarHBondContact NE2-O 2.96Å
1038	E	92.9	Very high	79.5	Confident	88 Å²	88	51 Å²	51	41%	0.411	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	140.5	163.7	-179.8	163.1	-142.8	0	0	109.7	S1024 I1025 R1026	S1024-E1038 WeakPolarHBondContact CB-OE1 3.23Å; S1024-E1038 PolarHBondContact OG-OE1 2.78Å; I1025-E1038 WeakPolarHBondContact O-CA 3.49Å; R1026-E1038 HydrophobicContact CG-CB 4Å; R1026-E1038 HydrophobicContact CG-CG 3.88Å; R1026-E1038 IonicContact CZ-OE1 2.68Å; R1026-E1038 VanDerWaalsContact CZ-OE1 3.26Å; R1026-E1038 IonicContact CZ-OE2 2.73Å; R1026-E1038 IonicContact NE-OE1 3.79Å; R1026-E1038 PolarHBondContact NE-OE1 3.42Å; R1026-E1038 IonicContact NE-OE2 3.53Å; R1026-E1038 PolarHBondContact NE-OE2 3.38Å; R1026-E1038 IonicContact NH2-OE1 3.14Å; R1026-E1038 PolarHBondContact NH2-OE1 2.95Å; R1026-E1038 IonicContact NH2-OE2 2.66Å
1039	I	89.6	Confident	77.1	Confident	9 Å²	9	58.6 Å²	58.6	5%	0.046	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	118.6	177.4	-55.5	179.3	0	0	0	108.9	W1016 S1024 I1025 Q1037 I1041 I1090	W1016-I1039 HydrophobicContact CH2-CD1 3.44Å; W1016-I1039 VanDerWaalsContact CH2-CD1 3.44Å; W1016-I1039 HydrophobicContact CH2-CG1 3.88Å; W1016-I1039 HydrophobicContact CZ2-CD1 4.21Å; W1016-I1039 HydrophobicContact CZ3-CD1 3.97Å; W1016-I1039 HydrophobicContact CZ3-CG1 4.13Å; S1024-I1039 CarbonylContact C-O 3.44Å; S1024-I1039 VanDerWaalsContact CA-O 3.23Å; S1024-I1039 WeakPolarHBondContact CA-O 3.17Å; I1025-I1039 HydrophobicContact CG1-CB 4Å; I1025-I1039 PolarHBondContact N-O 3.07Å; I1025-I1039 PolarHBondContact O-N 3.4Å; Q1037-I1039 HydrophobicContact CG-CG1 4.12Å; I1039-I1041 HydrophobicContact CG2-CD1 4.35Å; I1039-I1090 HydrophobicContact CD1-CB 3.72Å; I1039-I1090 HydrophobicContact CD1-CD1 3.52Å; I1039-I1090 HydrophobicContact CD1-CG1 4.15Å; I1039-I1090 HydrophobicContact CD1-CG2 4.14Å
1040	N	88.1	Confident	75	Confident	63 Å²	63	61.4 Å²	61.4	34%	0.337	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	120	168.8	-171.4	-39.3	0	0	0	109.6	S1023 S1042 T1043	S1023-N1040 PolarHBondContact OG-OD1 3.29Å; S1023-N1040 VanDerWaalsContact OG-OD1 3.07Å; N1040-S1042 WeakPolarHBondContact OD1-CB 3.42Å; N1040-S1042 PolarHBondContact OD1-N 3.4Å; N1040-S1042 PolarHBondContact OD1-OG 3.49Å; N1040-T1043 HydrophobicContact CB-CG2 4.34Å; N1040-T1043 PolarHBondContact O-OG1 3.29Å; N1040-T1043 VanDerWaalsContact O-OG1 3.11Å
1041	I	85.9	Confident	72.9	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-75	-31.6	-179.5	-57.7	-60.9	0	0	0	111.3	S1023 I1025 I1039 T1043 R1044 S1045 V1069 I1077 L1079	S1023-I1041 VanDerWaalsContact O-CB 3.3Å; S1023-I1041 WeakPolarHBondContact O-CB 3.42Å; S1023-I1041 WeakPolarHBondContact O-CG1 3.47Å; S1023-I1041 PolarHBondContact O-N 3.18Å; I1025-I1041 HydrophobicContact CD1-CD1 4.01Å; I1025-I1041 HydrophobicContact CG1-CD1 4.11Å; I1025-I1041 HydrophobicContact CG1-CG1 4.48Å; I1039-I1041 HydrophobicContact CG2-CD1 4.35Å; I1041-T1043 PolarHBondContact O-N 3.15Å; I1041-R1044 PolarHBondContact O-N 2.96Å; I1041-S1045 PolarHBondContact O-N 2.89Å; I1041-V1069 HydrophobicContact CD1-CG1 4.42Å; I1041-V1069 HydrophobicContact CD1-CG2 4.37Å; I1041-V1069 HydrophobicContact CG1-CG1 4.4Å; I1041-I1077 HydrophobicContact CG2-CD1 3.47Å; I1041-I1077 VanDerWaalsContact CG2-CD1 3.47Å; I1041-L1079 HydrophobicContact CD1-CD1 3.96Å
1042	S	75.8	Confident	71	Confident	27 Å²	27	67.5 Å²	67.5	19%	0.189	37%	0.365	C	S	.	.	H	α-helix	trans	-65	-36.9	-177.5	70.4	0	0	0	0	113.4	S1023 N1040 R1044 S1045 M1046	S1023-S1042 PolarHBondContact OG-OG 3.3Å; N1040-S1042 WeakPolarHBondContact OD1-CB 3.42Å; N1040-S1042 PolarHBondContact OD1-N 3.4Å; N1040-S1042 PolarHBondContact OD1-OG 3.49Å; S1042-R1044 PolarHBondContact O-N 2.95Å; S1042-S1045 PolarHBondContact O-N 2.94Å; S1042-M1046 WeakPolarHBondContact O-CG 3.19Å; S1042-M1046 PolarHBondContact O-N 2.87Å
1043	T	62.3	Low	69.3	Low	91 Å²	91	72.8 Å²	72.8	56%	0.558	38%	0.384	S	S	*	.	H	α-helix	trans	-63.9	-29.7	177.6	61	0	0	0	0	112.7	N1040 I1041 S1045	N1040-T1043 HydrophobicContact CB-CG2 4.34Å; N1040-T1043 PolarHBondContact O-OG1 3.29Å; N1040-T1043 VanDerWaalsContact O-OG1 3.11Å; I1041-T1043 PolarHBondContact O-N 3.15Å; T1043-S1045 VanDerWaalsContact C-N 3.34Å
1044	R	61.5	Low	68	Low	73 Å²	73	78 Å²	78	28%	0.275	41%	0.412	S	S	.	.	H	α-helix	trans	-77.9	-20.1	175	-59.5	-173.2	179.3	-142.5	-7	112.4	I1041 S1042 G1092 G1094 I1096	I1041-R1044 PolarHBondContact O-N 2.96Å; S1042-R1044 PolarHBondContact O-N 2.95Å; R1044-G1092 PolarHBondContact NH1-O 3.43Å; R1044-G1092 PolarHBondContact NH2-O 2.9Å; R1044-G1094 VanDerWaalsContact NH1-N 3.11Å; R1044-I1096 VanDerWaalsContact O-CD1 3.25Å; R1044-I1096 WeakPolarHBondContact O-CD1 3.3Å
1045	S	54.5	Low	67.4	Low	9 Å²	9	73.8 Å²	73.8	6%	0.063	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-2.1	-179	-166.9	0	0	0	0	115	I1041 S1042 T1043 L1047 Q1048	I1041-S1045 PolarHBondContact O-N 2.89Å; S1042-S1045 PolarHBondContact O-N 2.94Å; T1043-S1045 VanDerWaalsContact C-N 3.34Å; S1045-L1047 PolarHBondContact O-N 2.76Å; S1045-Q1048 PolarHBondContact O-N 2.79Å
1046	M	49	Very low	67.2	Low	137 Å²	137	75.5 Å²	75.5	68%	0.675	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-3.8	-176.5	-67.8	-64.5	177.4	0	0	115	S1042 Q1048	S1042-M1046 WeakPolarHBondContact O-CG 3.19Å; S1042-M1046 PolarHBondContact O-N 2.87Å; M1046-Q1048 PolarHBondContact O-N 3.48Å
1047	L	48.1	Very low	67.2	Low	85 Å²	85	74.6 Å²	74.6	45%	0.445	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-10.9	171.4	-81.8	161	0	0	0	113.9	E763 S1045	E763-L1047 HydrophobicContact CG-CD2 4.32Å; S1045-L1047 PolarHBondContact O-N 2.76Å
1048	Q	50.7	Low	67.3	Low	51 Å²	51	73.6 Å²	73.6	24%	0.238	39%	0.385	C	S	.	.	S	Bend	trans	-127.4	128	170.8	-66.1	-177.5	10.6	0	0	110.2	S1045 M1046 T1050	S1045-Q1048 PolarHBondContact O-N 2.79Å; M1046-Q1048 PolarHBondContact O-N 3.48Å; Q1048-T1050 PolarHBondContact O-N 3.1Å
1049	N	44.2	Very low	67.4	Low	168 Å²	168	69.6 Å²	69.6	90%	0.898	37%	0.367	S	S	*	.			trans	-82.1	61.9	-170.3	-141.1	-1	0	0	0	111.2	G1051	N1049-G1051 PolarHBondContact O-N 3.43Å
1050	T	49.1	Very low	67.7	Low	59 Å²	59	70 Å²	70	36%	0.362	37%	0.369	S	S	.	.			trans	-76.2	84.1	-176.2	45.6	0	0	0	0	111.6	Q1048 Q1052	Q1048-T1050 PolarHBondContact O-N 3.1Å; T1050-Q1052 PolarHBondContact O-N 3.3Å
1051	G	44.6	Very low	68	Low	74 Å²	74	68.3 Å²	68.3	76%	0.763	36%	0.36	S	S	*	.			trans	-69.5	52.3	-177.5	0	0	0	0	0	117	N1049	N1049-G1051 PolarHBondContact O-N 3.43Å
1052	Q	48.1	Very low	68.3	Low	139 Å²	139	70 Å²	70	65%	0.65	37%	0.369	S	S	*	.	S	Bend	trans	-175.1	147.8	146.6	-111.1	-177.6	54.1	0	0	115	T1050	T1050-Q1052 PolarHBondContact O-N 3.3Å
1053	K	51.8	Low	68.9	Low	164 Å²	164	69.2 Å²	69.2	71%	0.713	36%	0.363	S	S	*	.	S	Bend	trans	68.2	139.2	152.2	-70.9	169	177.5	154.8	0	119.9	M1055	K1053-M1055 PolarHBondContact O-N 2.79Å; K1053-M1055 VanDerWaalsContact O-N 3.13Å
1054	N	63.9	Low	69.9	Low	133 Å²	133	67.4 Å²	67.4	71%	0.711	35%	0.349	S	S	*	.			trans	-31.9	101.5	-176.3	-57	8.2	0	0	0	114.6	R1056	N1054-R1056 PolarHBondContact O-N 2.8Å
1055	M	77	Confident	71	Confident	20 Å²	20	64.6 Å²	64.6	10%	0.099	34%	0.342	C	S	.	.			trans	-72.7	125.9	163.8	179.9	161.6	55.8	0	0	109.5	G1022 S1023 K1053 T1071 L1075	G1022-M1055 CarbonylContact C-O 3.55Å; S1023-M1055 VanDerWaalsContact CB-O 3.29Å; S1023-M1055 WeakPolarHBondContact CB-O 3.44Å; K1053-M1055 PolarHBondContact O-N 2.79Å; K1053-M1055 VanDerWaalsContact O-N 3.13Å; M1055-T1071 HydrophobicContact CG-CG2 4.37Å; M1055-T1071 HydrophobicContact SD-CG2 3.95Å; M1055-L1075 HydrophobicContact SD-CD1 4.38Å
1056	R	88.8	Confident	72.6	Confident	122 Å²	122	65.1 Å²	65.1	46%	0.46	34%	0.344	S	S	.	.			trans	-125.8	160	171.7	66.6	178.1	180	-147.7	-2.6	110.8	S1020 G1022 N1054 T1058 T1071 A1072	S1020-R1056 WeakPolarHBondContact O-CD 3.17Å; G1022-R1056 WeakPolarHBondContact O-CA 3.48Å; N1054-R1056 PolarHBondContact O-N 2.8Å; R1056-T1058 HydrophobicContact CG-CG2 4.39Å; R1056-T1071 WeakPolarHBondContact O-CA 3.43Å; R1056-A1072 HydrophobicContact CG-CB 3.67Å; R1056-A1072 PolarHBondContact O-N 3.28Å
1057	V	93.5	Very high	74.7	Confident	7 Å²	7	58.6 Å²	58.6	4%	0.042	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	138.5	170	179.7	0	0	0	0	109.2	A1018 I1025 S1059 L1060 V1069 G1070	A1018-V1057 HydrophobicContact CB-CB 3.89Å; A1018-V1057 HydrophobicContact CB-CG1 3.72Å; A1018-V1057 HydrophobicContact CB-CG2 4.35Å; I1025-V1057 HydrophobicContact CG2-CG2 3.86Å; V1057-S1059 WeakPolarHBondContact CG1-O 3.44Å; V1057-L1060 HydrophobicContact CG1-CD1 4.46Å; V1057-V1069 HydrophobicContact CB-CG1 4.32Å; V1057-V1069 HydrophobicContact CG1-CG1 3.86Å; V1057-V1069 HydrophobicContact CG2-CG1 3.61Å; V1057-G1070 WeakPolarHBondContact CA-O 3.35Å
1058	T	93.8	Very high	77	Confident	24 Å²	24	54.6 Å²	54.6	15%	0.147	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	-11.7	177.4	54.1	0	0	0	0	113.8	H1007 R1056 G1070 T1071 A1072 P1104 V1105	H1007-T1058 VanDerWaalsContact CE1-C 3.49Å; H1007-T1058 PolarHBondContact CE1-O 3.08Å; H1007-T1058 PolarHBondContact NE2-O 3.37Å; R1056-T1058 HydrophobicContact CG-CG2 4.39Å; T1058-G1070 PolarHBondContact N-O 2.99Å; T1058-T1071 PolarHBondContact OG1-O 2.72Å; T1058-A1072 HydrophobicContact CG2-CB 3.7Å; T1058-P1104 HydrophobicContact CG2-CB 4.39Å; T1058-V1105 WeakPolarHBondContact CB-O 3.45Å; T1058-V1105 PolarHBondContact OG1-O 2.92Å
1059	S	94.6	Very high	79.1	Confident	4 Å²	4	52.1 Å²	52.1	3%	0.028	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	147.3	170.1	42	0	0	0	0	110.2	V1057 G1070 V1105	V1057-S1059 WeakPolarHBondContact CG1-O 3.44Å; S1059-G1070 PolarHBondContact N-O 3.2Å; S1059-G1070 PolarHBondContact O-N 2.98Å; S1059-V1105 WeakPolarHBondContact OG-CG1 3.48Å; S1059-V1105 PolarHBondContact OG-O 3.1Å; S1059-V1105 VanDerWaalsContact OG-O 3.1Å
1060	L	95.6	Very high	81.5	Confident	18 Å²	18	44.1 Å²	44.1	9%	0.094	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	131.3	-177.1	-163	73.7	0	0	0	109.3	H1007 A1009 W1016 A1018 V1057 L1067 V1069	H1007-L1060 HydrophobicContact CB-CB 3.74Å; H1007-L1060 HydrophobicContact CB-CD2 4.38Å; A1009-L1060 HydrophobicContact CB-CD2 4.01Å; A1009-L1060 HydrophobicContact CB-CG 4.22Å; W1016-L1060 HydrophobicContact CB-CD2 4.26Å; W1016-L1060 WeakPolarHBondContact O-CD2 3.39Å; A1018-L1060 HydrophobicContact CB-CD2 4.36Å; V1057-L1060 HydrophobicContact CG1-CD1 4.46Å; L1060-L1067 HydrophobicContact CD1-CD1 3.85Å; L1060-L1067 HydrophobicContact CD1-CG 4.44Å; L1060-L1067 HydrophobicContact CG-CD1 4.01Å; L1060-V1069 HydrophobicContact CD1-CG2 3.96Å
1061	L	95.3	Very high	83.6	Confident	27 Å²	27	41.4 Å²	41.4	14%	0.141	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	146.3	-177.6	174.2	68.3	0	0	0	110.3	W1068 L1108 A1110 V1236	L1061-W1068 HydrophobicContact CB-CB 4.26Å; L1061-W1068 PolarHBondContact N-O 3.47Å; L1061-W1068 PolarHBondContact O-N 3.48Å; L1061-L1108 HydrophobicContact CB-CB 3.84Å; L1061-L1108 HydrophobicContact CB-CD1 4.33Å; L1061-L1108 HydrophobicContact CD2-CB 3.92Å; L1061-A1110 HydrophobicContact CD1-CB 3.96Å; L1061-A1110 HydrophobicContact CD2-CB 4.04Å; L1061-A1110 HydrophobicContact CG-CB 4.44Å; L1061-V1236 HydrophobicContact CD2-CB 4.48Å; L1061-V1236 HydrophobicContact CD2-CG1 3.73Å; L1061-V1236 HydrophobicContact CD2-CG2 3.99Å
1062	I	92	Very high	85.8	Confident	38 Å²	38	39.1 Å²	39.1	20%	0.195	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	130.8	170.7	-66	170.1	0	0	0	109	A1009 C1010 A1011 L1066 L1067 V1081	A1009-I1062 HydrophobicContact CB-CD1 3.77Å; A1009-I1062 HydrophobicContact CB-CG1 3.96Å; C1010-I1062 WeakPolarHBondContact O-CD1 3.3Å; A1011-I1062 HydrophobicContact CB-CD1 3.89Å; A1011-I1062 HydrophobicContact CB-CG2 4.26Å; I1062-L1066 WeakPolarHBondContact CA-O 3.42Å; I1062-L1067 HydrophobicContact CD1-CD1 3.89Å; I1062-L1067 HydrophobicContact CG1-CB 4.27Å; I1062-L1067 HydrophobicContact CG1-CD1 3.39Å; I1062-L1067 HydrophobicContact CG1-CG 4.44Å; I1062-V1081 HydrophobicContact CG2-CG2 4.42Å
1063	C	89.4	Confident	87.7	Confident	11 Å²	11	34.6 Å²	34.6	7%	0.074	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	130	179.3	-167.5	0	0	0	0	110.9	G1065 L1066 A1110 V1236 L1270	C1063-G1065 VanDerWaalsContact C-N 3.29Å; C1063-G1065 PolarHBondContact O-N 3.46Å; C1063-G1065 VanDerWaalsContact O-N 3.11Å; C1063-L1066 PolarHBondContact N-O 3.11Å; C1063-L1066 PolarHBondContact O-N 3.25Å; C1063-A1110 HydrophobicContact CB-CB 4.33Å; C1063-V1236 HydrophobicContact CB-CG2 3.89Å; C1063-L1270 HydrophobicContact CB-CD1 4.5Å
1064	Q	83.1	Confident	89.5	Confident	53 Å²	53	26.8 Å²	26.8	25%	0.248	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.1	39.2	176.8	-68.8	-166.3	-15.6	0	0	116.4	K1083 A1234 L1270 P1271	Q1064-K1083 WeakPolarHBondContact O-CE 3.11Å; Q1064-A1234 HydrophobicContact CG-CB 4.12Å; Q1064-L1270 HydrophobicContact CB-CD1 4.37Å; Q1064-L1270 HydrophobicContact CG-CD1 4.26Å; Q1064-L1270 VanDerWaalsContact OE1-CB 3.31Å; Q1064-P1271 PolarHBondContact NE2-O 2.56Å; Q1064-P1271 PolarHBondContact OE1-O 3.32Å
1065	G	83.8	Confident	90.8	Very high	13 Å²	13	20.8 Å²	20.8	13%	0.134	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	14.1	-179.2	0	0	0	0	0	114.9	C1063 V1081	C1063-G1065 VanDerWaalsContact C-N 3.29Å; C1063-G1065 PolarHBondContact O-N 3.46Å; C1063-G1065 VanDerWaalsContact O-N 3.11Å; G1065-V1081 VanDerWaalsContact C-CG2 3.48Å; G1065-V1081 WeakPolarHBondContact O-CG2 3.24Å; G1065-V1081 PolarHBondContact O-N 3.35Å
1066	L	89.1	Confident	91.6	Very high	21 Å²	21	19.8 Å²	19.8	11%	0.11	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	127.8	169.8	-62.9	175.4	0	0	0	109.8	P775 I1062 C1063 M1095 L1270	P775-L1066 HydrophobicContact CG-CD1 3.67Å; I1062-L1066 WeakPolarHBondContact CA-O 3.42Å; C1063-L1066 PolarHBondContact N-O 3.11Å; C1063-L1066 PolarHBondContact O-N 3.25Å; L1066-M1095 HydrophobicContact CD2-CE 4.1Å; L1066-L1270 HydrophobicContact CD1-CD2 4.32Å
1067	L	93	Very high	91.7	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	113	161.9	174.4	67.9	0	0	0	108	W1016 I1025 L1060 I1062 V1069 T1078 L1079 V1081 I1090	W1016-L1067 HydrophobicContact CB-CD1 4.34Å; W1016-L1067 HydrophobicContact CB-CD2 4.31Å; W1016-L1067 HydrophobicContact CD2-CD2 3.79Å; W1016-L1067 HydrophobicContact CE3-CD2 4.29Å; W1016-L1067 HydrophobicContact CG-CD1 4.43Å; W1016-L1067 HydrophobicContact CG-CD2 3.78Å; I1025-L1067 HydrophobicContact CD1-CD2 3.64Å; L1060-L1067 HydrophobicContact CD1-CD1 3.85Å; L1060-L1067 HydrophobicContact CD1-CG 4.44Å; L1060-L1067 HydrophobicContact CG-CD1 4.01Å; I1062-L1067 HydrophobicContact CD1-CD1 3.89Å; I1062-L1067 HydrophobicContact CG1-CB 4.27Å; I1062-L1067 HydrophobicContact CG1-CD1 3.39Å; I1062-L1067 HydrophobicContact CG1-CG 4.44Å; L1067-V1069 HydrophobicContact CG-CG2 4.28Å; L1067-T1078 CarbonylContact O-C 3.58Å; L1067-T1078 WeakPolarHBondContact O-CA 3.5Å; L1067-L1079 HydrophobicContact CB-CB 4.28Å; L1067-L1079 HydrophobicContact CD2-CD1 4.2Å; L1067-L1079 PolarHBondContact N-O 2.89Å; L1067-L1079 PolarHBondContact O-N 3.08Å; L1067-V1081 HydrophobicContact CB-CG1 4Å; L1067-I1090 HydrophobicContact CD2-CD1 3.76Å
1068	W	94.6	Very high	91.6	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	130.2	176.2	-66.2	71	0	0	0	110	W759 P775 L1061 I1076 T1078 L1108 V1236 W1268 L1270	W759-W1068 HydrophobicContact CH2-CH2 4.37Å; W759-W1068 HydrophobicContact CH2-CZ3 4.08Å; W759-W1068 HydrophobicContact CZ2-CH2 4.3Å; W759-W1068 HydrophobicContact CZ2-CZ3 4.38Å; P775-W1068 HydrophobicContact CB-CH2 3.55Å; P775-W1068 HydrophobicContact CB-CZ2 3.71Å; P775-W1068 HydrophobicContact CG-CH2 3.58Å; P775-W1068 HydrophobicContact CG-CZ2 3.39Å; L1061-W1068 HydrophobicContact CB-CB 4.26Å; L1061-W1068 PolarHBondContact N-O 3.47Å; L1061-W1068 PolarHBondContact O-N 3.48Å; W1068-I1076 HydrophobicContact CE3-CG2 3.66Å; W1068-I1076 HydrophobicContact CZ3-CG2 3.9Å; W1068-T1078 HydrophobicContact CB-CG2 4.45Å; W1068-T1078 HydrophobicContact CD2-CG2 3.41Å; W1068-T1078 VanDerWaalsContact CD2-CG2 3.41Å; W1068-T1078 HydrophobicContact CE3-CG2 3.62Å; W1068-T1078 HydrophobicContact CG-CG2 3.8Å; W1068-T1078 HydrophobicContact CH2-CG2 4.33Å; W1068-T1078 HydrophobicContact CZ2-CG2 4.17Å; W1068-T1078 HydrophobicContact CZ3-CG2 4.08Å; W1068-L1108 HydrophobicContact CB-CD1 4Å; W1068-V1236 HydrophobicContact CD2-CB 4.35Å; W1068-V1236 HydrophobicContact CD2-CG1 3.99Å; W1068-V1236 HydrophobicContact CD2-CG2 4.24Å; W1068-V1236 HydrophobicContact CE3-CB 4.44Å; W1068-V1236 HydrophobicContact CE3-CG1 3.91Å; W1068-V1236 HydrophobicContact CH2-CB 4.04Å; W1068-V1236 HydrophobicContact CH2-CG1 4.35Å; W1068-V1236 HydrophobicContact CH2-CG2 4.46Å; W1068-V1236 HydrophobicContact CZ2-CB 3.92Å; W1068-V1236 HydrophobicContact CZ2-CG1 4.41Å; W1068-V1236 HydrophobicContact CZ2-CG2 3.84Å; W1068-V1236 HydrophobicContact CZ3-CB 4.3Å; W1068-V1236 HydrophobicContact CZ3-CG1 4.1Å; W1068-W1268 HydrophobicContact CH2-CB 3.65Å; W1068-W1268 HydrophobicContact CH2-CD2 4.2Å; W1068-W1268 AromaticContact CH2-CG 3.79Å; W1068-W1268 HydrophobicContact CH2-CG 3.79Å; W1068-W1268 HydrophobicContact CZ3-CB 4.21Å; W1068-W1268 HydrophobicContact CZ3-CD2 4.23Å; W1068-W1268 AromaticContact CZ3-CG 3.9Å; W1068-W1268 HydrophobicContact CZ3-CG 3.9Å; W1068-L1270 HydrophobicContact CZ2-CD2 4.37Å
1069	V	94.9	Very high	91.4	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	111.4	-178.5	-172.2	0	0	0	0	108.2	I1025 I1041 V1057 L1060 L1067 I1077 L1079	I1025-V1069 HydrophobicContact CD1-CG2 4.4Å; I1041-V1069 HydrophobicContact CD1-CG1 4.42Å; I1041-V1069 HydrophobicContact CD1-CG2 4.37Å; I1041-V1069 HydrophobicContact CG1-CG1 4.4Å; V1057-V1069 HydrophobicContact CB-CG1 4.32Å; V1057-V1069 HydrophobicContact CG1-CG1 3.86Å; V1057-V1069 HydrophobicContact CG2-CG1 3.61Å; L1060-V1069 HydrophobicContact CD1-CG2 3.96Å; L1067-V1069 HydrophobicContact CG-CG2 4.28Å; V1069-I1077 HydrophobicContact CB-CB 4.38Å; V1069-I1077 PolarHBondContact N-O 3.42Å; V1069-I1077 PolarHBondContact O-N 3.18Å; V1069-L1079 HydrophobicContact CG2-CD1 4.01Å
1070	G	94.8	Very high	91	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	141.5	169.8	0	0	0	0	0	110.6	V1057 T1058 S1059	V1057-G1070 WeakPolarHBondContact CA-O 3.35Å; T1058-G1070 PolarHBondContact N-O 2.99Å; S1059-G1070 PolarHBondContact N-O 3.2Å; S1059-G1070 PolarHBondContact O-N 2.98Å
1071	T	93.1	Very high	90.5	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.006	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	157.3	-174	65.6	0	0	0	0	113.1	M1055 R1056 T1058 Q1073 G1074 L1075 I1077 V1105	M1055-T1071 HydrophobicContact CG-CG2 4.37Å; M1055-T1071 HydrophobicContact SD-CG2 3.95Å; R1056-T1071 WeakPolarHBondContact O-CA 3.43Å; T1058-T1071 PolarHBondContact OG1-O 2.72Å; T1071-Q1073 PolarHBondContact O-N 2.9Å; T1071-Q1073 VanDerWaalsContact O-N 3.11Å; T1071-G1074 PolarHBondContact O-N 2.93Å; T1071-L1075 HydrophobicContact CG2-CB 4.47Å; T1071-L1075 PolarHBondContact N-O 2.9Å; T1071-L1075 WeakPolarHBondContact OG1-CA 3.21Å; T1071-L1075 WeakPolarHBondContact OG1-CB 3.27Å; T1071-L1075 PolarHBondContact OG1-N 3.12Å; T1071-L1075 PolarHBondContact OG1-O 3Å; T1071-I1077 HydrophobicContact CG2-CD1 4.34Å; T1071-V1105 PolarHBondContact O-N 2.88Å; T1071-V1105 VanDerWaalsContact O-N 3.14Å
1072	A	91.3	Very high	89.6	Confident	26 Å²	26	14.1 Å²	14.1	22%	0.215	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-16.1	173.8	0	0	0	0	0	114.2	R1056 T1058	R1056-A1072 HydrophobicContact CG-CB 3.67Å; R1056-A1072 PolarHBondContact O-N 3.28Å; T1058-A1072 HydrophobicContact CG2-CB 3.7Å
1073	Q	88.2	Confident	88.4	Confident	45 Å²	45	19 Å²	19	21%	0.21	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-4.5	174.3	-64.3	-169.6	0.1	0	0	113	T1071 L1075 R1244	T1071-Q1073 PolarHBondContact O-N 2.9Å; T1071-Q1073 VanDerWaalsContact O-N 3.11Å; Q1073-L1075 HydrophobicContact CB-CG 4.3Å; Q1073-R1244 PolarHBondContact O-NH2 3.07Å
1074	G	89.9	Confident	87.3	Confident	0 Å²	0	22 Å²	22	0%	0	12%	0.118	C	C	.	.	S	Bend	trans	87.9	0.4	-177.4	0	0	0	0	0	115.1	T1071 A1100 H1101 G1103	T1071-G1074 PolarHBondContact O-N 2.93Å; G1074-A1100 WeakPolarHBondContact O-CA 3.42Å; G1074-A1100 WeakPolarHBondContact O-CB 3.37Å; G1074-H1101 PolarHBondContact O-N 2.78Å; G1074-G1103 WeakPolarHBondContact CA-O 3.22Å; G1074-G1103 PolarHBondContact N-O 3.29Å
1075	L	91.3	Very high	86.5	Confident	6 Å²	6	27.8 Å²	27.8	3%	0.031	15%	0.146	C	C	.	.			trans	-73.6	140.5	174.6	-49	177.5	0	0	0	110.2	M1055 T1071 Q1073 A1100 L1246	M1055-L1075 HydrophobicContact SD-CD1 4.38Å; T1071-L1075 HydrophobicContact CG2-CB 4.47Å; T1071-L1075 PolarHBondContact N-O 2.9Å; T1071-L1075 WeakPolarHBondContact OG1-CA 3.21Å; T1071-L1075 WeakPolarHBondContact OG1-CB 3.27Å; T1071-L1075 PolarHBondContact OG1-N 3.12Å; T1071-L1075 PolarHBondContact OG1-O 3Å; Q1073-L1075 HydrophobicContact CB-CG 4.3Å; L1075-A1100 HydrophobicContact CD2-CB 4.31Å; L1075-L1246 HydrophobicContact CD2-CD1 3.57Å
1076	I	93.3	Very high	86.2	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	126.9	171.2	-59.6	171.3	0	0	0	107.8	W759 W1068 S1097 V1105 S1238 W1268	W759-I1076 HydrophobicContact CH2-CG2 4.31Å; W1068-I1076 HydrophobicContact CE3-CG2 3.66Å; W1068-I1076 HydrophobicContact CZ3-CG2 3.9Å; I1076-S1097 WeakPolarHBondContact O-CB 3.45Å; I1076-S1097 PolarHBondContact O-N 2.94Å; I1076-V1105 HydrophobicContact CG1-CG2 4.06Å; I1076-S1238 WeakPolarHBondContact CD1-OG 3.46Å; I1076-W1268 HydrophobicContact CD1-CZ2 4.37Å
1077	I	91.4	Very high	86.1	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	133.6	-176.4	-59.5	178.7	0	0	0	108.1	I1041 V1069 T1071 M1095 I1096	I1041-I1077 HydrophobicContact CG2-CD1 3.47Å; I1041-I1077 VanDerWaalsContact CG2-CD1 3.47Å; V1069-I1077 HydrophobicContact CB-CB 4.38Å; V1069-I1077 PolarHBondContact N-O 3.42Å; V1069-I1077 PolarHBondContact O-N 3.18Å; T1071-I1077 HydrophobicContact CG2-CD1 4.34Å; I1077-M1095 CarbonylContact C-O 3.53Å; I1077-M1095 WeakPolarHBondContact CA-O 3.13Å; I1077-I1096 HydrophobicContact CD1-CD1 4.02Å; I1077-I1096 HydrophobicContact CD1-CG1 4.25Å; I1077-I1096 HydrophobicContact CG1-CB 4.46Å; I1077-I1096 HydrophobicContact CG1-CD1 4.28Å; I1077-I1096 HydrophobicContact CG1-CG1 3.98Å; I1077-I1096 HydrophobicContact CG1-CG2 4.21Å; I1077-I1096 HydrophobicContact CG2-CG1 4.31Å
1078	T	91.8	Very high	85.7	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	140.9	176.1	49.9	0	0	0	0	111.3	W759 L1067 W1068 G1094 M1095	W759-T1078 HydrophobicContact CH2-CG2 3.64Å; W759-T1078 HydrophobicContact CZ3-CG2 3.93Å; W759-T1078 WeakPolarHBondContact CZ3-OG1 3.25Å; L1067-T1078 CarbonylContact O-C 3.58Å; L1067-T1078 WeakPolarHBondContact O-CA 3.5Å; W1068-T1078 HydrophobicContact CB-CG2 4.45Å; W1068-T1078 HydrophobicContact CD2-CG2 3.41Å; W1068-T1078 VanDerWaalsContact CD2-CG2 3.41Å; W1068-T1078 HydrophobicContact CE3-CG2 3.62Å; W1068-T1078 HydrophobicContact CG-CG2 3.8Å; W1068-T1078 HydrophobicContact CH2-CG2 4.33Å; W1068-T1078 HydrophobicContact CZ2-CG2 4.17Å; W1068-T1078 HydrophobicContact CZ3-CG2 4.08Å; T1078-G1094 WeakPolarHBondContact O-CA 3.39Å; T1078-M1095 PolarHBondContact N-O 3.09Å; T1078-M1095 PolarHBondContact O-N 3.48Å; T1078-M1095 WeakPolarHBondContact OG1-CE 3.42Å
1079	L	88.8	Confident	85.3	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	125.7	-176	-63.9	162	0	0	0	108.7	I1025 I1041 L1067 V1069 V1081 I1090	I1025-L1079 HydrophobicContact CD1-CD1 3.96Å; I1041-L1079 HydrophobicContact CD1-CD1 3.96Å; L1067-L1079 HydrophobicContact CB-CB 4.28Å; L1067-L1079 HydrophobicContact CD2-CD1 4.2Å; L1067-L1079 PolarHBondContact N-O 2.89Å; L1067-L1079 PolarHBondContact O-N 3.08Å; V1069-L1079 HydrophobicContact CG2-CD1 4.01Å; L1079-V1081 PolarHBondContact O-N 2.94Å; L1079-I1090 HydrophobicContact CB-CD1 3.68Å; L1079-I1090 HydrophobicContact CB-CG1 4.32Å; L1079-I1090 HydrophobicContact CB-CG2 4.2Å; L1079-I1090 HydrophobicContact CD1-CD1 3.99Å; L1079-I1090 HydrophobicContact CD2-CG2 4.38Å; L1079-I1090 HydrophobicContact CG-CD1 4.36Å
1080	P	85.7	Confident	84.7	Confident	51 Å²	51	29.4 Å²	29.4	33%	0.331	15%	0.15	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	123.3	-179.7	28.2	-33.7	0	0	0	110.5
1081	V	85.1	Confident	83.5	Confident	9 Å²	9	33.8 Å²	33.8	6%	0.055	18%	0.177	C	C	.	.			trans	-113	145.4	171.1	-69.7	0	0	0	0	109.5	I1062 G1065 L1067 L1079 P1088 I1090	I1062-V1081 HydrophobicContact CG2-CG2 4.42Å; G1065-V1081 VanDerWaalsContact C-CG2 3.48Å; G1065-V1081 WeakPolarHBondContact O-CG2 3.24Å; G1065-V1081 PolarHBondContact O-N 3.35Å; L1067-V1081 HydrophobicContact CB-CG1 4Å; L1079-V1081 PolarHBondContact O-N 2.94Å; V1081-P1088 HydrophobicContact CB-CB 4.32Å; V1081-P1088 HydrophobicContact CG1-CB 4.38Å; V1081-I1090 HydrophobicContact CG1-CD1 3.97Å; V1081-I1090 HydrophobicContact CG1-CG1 3.55Å
1082	P	76.5	Confident	82.2	Confident	23 Å²	23	34.9 Å²	34.9	15%	0.149	19%	0.188	C	C	.	.			trans	-47.2	139.8	169.7	-28.6	34.3	0	0	0	112.4	T494	T494-P1082 HydrophobicContact CG2-CB 3.99Å; T494-P1082 HydrophobicContact CG2-CG 3.53Å
1083	K	66.6	Low	81.4	Confident	139 Å²	139	38.4 Å²	38.4	60%	0.604	20%	0.198	S	C	*	.	S	Bend	trans	-87.4	-8.6	-177.6	-73.8	177.8	175.1	-178.9	0	114.4	Q1064	Q1064-K1083 WeakPolarHBondContact O-CE 3.11Å
1084	L	66.7	Low	80.9	Confident	74 Å²	74	36.5 Å²	36.5	39%	0.387	19%	0.191	S	C	.	.	S	Bend	trans	-108.8	169.4	-172.1	-68.5	157.4	0	0	0	110.2	E497 G1086	E497-L1084 HydrophobicContact CB-CD1 3.7Å; E497-L1084 HydrophobicContact CG-CD1 3.96Å; E497-L1084 WeakPolarHBondContact OE2-CB 3.47Å; L1084-G1086 PolarHBondContact O-N 2.98Å
1085	E	66.3	Low	80.7	Confident	176 Å²	176	37.3 Å²	37.3	82%	0.822	20%	0.195	S	C	*	.	S	Bend	trans	-68.3	-0.2	-164	-62.5	174.9	-179.2	0	0	115.4	G1012 G1013	G1012-E1085 WeakPolarHBondContact CA-O 3.4Å; G1013-E1085 PolarHBondContact N-O 3.04Å
1086	G	77.3	Confident	80.5	Confident	6 Å²	6	37.8 Å²	37.8	6%	0.062	20%	0.198	C	C	.	.	S	Bend	trans	-65.7	-165.1	176.8	0	0	0	0	0	115.3	T494 G1012 G1013 L1084	T494-G1086 WeakPolarHBondContact OG1-CA 3.47Å; G1012-G1086 WeakPolarHBondContact CA-O 3.48Å; G1013-G1086 PolarHBondContact N-O 2.85Å; L1084-G1086 PolarHBondContact O-N 2.98Å
1087	I	87.5	Confident	80.3	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.198	C	C	.	.			trans	-80.6	128.1	179.2	-54	-54.8	0	0	0	109	L487 Q490 L491 T494 L1027 L1036 K1089	L487-I1087 HydrophobicContact CD1-CD1 3.87Å; L487-I1087 HydrophobicContact CD1-CG1 3.94Å; Q490-I1087 HydrophobicContact CB-CD1 3.74Å; Q490-I1087 HydrophobicContact CB-CG1 3.76Å; Q490-I1087 HydrophobicContact CG-CD1 4.45Å; L491-I1087 HydrophobicContact CD2-CB 3.89Å; L491-I1087 HydrophobicContact CD2-CG1 3.86Å; L491-I1087 HydrophobicContact CD2-CG2 4.12Å; L491-I1087 HydrophobicContact CG-CG1 4.06Å; T494-I1087 WeakPolarHBondContact CG2-O 3.43Å; T494-I1087 PolarHBondContact OG1-N 3.02Å; L1027-I1087 HydrophobicContact CD2-CG2 4.11Å; L1036-I1087 HydrophobicContact CD1-CD1 4.41Å; L1036-I1087 HydrophobicContact CD1-CG2 3.51Å; I1087-K1089 HydrophobicContact CG2-CD 4.47Å; I1087-K1089 HydrophobicContact CG2-CG 3.95Å; I1087-K1089 PolarHBondContact O-N 3.21Å
1088	P	85.6	Confident	80.2	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.013	20%	0.2	C	C	.	.			trans	-82.2	49.4	-171.7	37.8	-41.9	0	0	0	112.9	A1011 W1016 L1027 V1081 I1090	A1011-P1088 HydrophobicContact CB-CB 3.61Å; A1011-P1088 HydrophobicContact CB-CG 4.05Å; A1011-P1088 VanDerWaalsContact O-CD 3.24Å; A1011-P1088 WeakPolarHBondContact O-CD 3.21Å; A1011-P1088 WeakPolarHBondContact O-CG 3.49Å; W1016-P1088 PolarHBondContact NE1-O 2.91Å; L1027-P1088 HydrophobicContact CD1-CG 3.63Å; L1027-P1088 HydrophobicContact CD2-CG 4.01Å; L1027-P1088 HydrophobicContact CG-CG 4.48Å; V1081-P1088 HydrophobicContact CB-CB 4.32Å; V1081-P1088 HydrophobicContact CG1-CB 4.38Å; P1088-I1090 PolarHBondContact O-N 2.93Å
1089	K	84.8	Confident	80.2	Confident	55 Å²	55	38.3 Å²	38.3	24%	0.239	20%	0.2	C	C	.	.			trans	-69	127.5	178.5	-82.7	-176.5	-179	-179.1	0	110.8	L491 L1027 L1036 I1087 T1091	L491-K1089 HydrophobicContact CD2-CD 3.73Å; L1027-K1089 HydrophobicContact CD2-CG 4.01Å; L1036-K1089 VanDerWaalsContact O-CE 3.31Å; L1036-K1089 WeakPolarHBondContact O-CE 3.41Å; I1087-K1089 HydrophobicContact CG2-CD 4.47Å; I1087-K1089 HydrophobicContact CG2-CG 3.95Å; I1087-K1089 PolarHBondContact O-N 3.21Å; K1089-T1091 PolarHBondContact O-N 3.02Å
1090	I	83.1	Confident	80.3	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.026	20%	0.2	C	C	.	.			trans	-85.6	101.4	179.2	-63.6	161.1	0	0	0	107.8	W1016 Q1037 I1039 L1067 L1079 V1081 P1088	W1016-I1090 HydrophobicContact CH2-CD1 3.93Å; W1016-I1090 HydrophobicContact CZ2-CD1 3.48Å; W1016-I1090 VanDerWaalsContact CZ2-CD1 3.48Å; W1016-I1090 HydrophobicContact CZ2-CG1 3.85Å; Q1037-I1090 PolarHBondContact NE2-O 2.96Å; I1039-I1090 HydrophobicContact CD1-CB 3.72Å; I1039-I1090 HydrophobicContact CD1-CD1 3.52Å; I1039-I1090 HydrophobicContact CD1-CG1 4.15Å; I1039-I1090 HydrophobicContact CD1-CG2 4.14Å; L1067-I1090 HydrophobicContact CD2-CD1 3.76Å; L1079-I1090 HydrophobicContact CB-CD1 3.68Å; L1079-I1090 HydrophobicContact CB-CG1 4.32Å; L1079-I1090 HydrophobicContact CB-CG2 4.2Å; L1079-I1090 HydrophobicContact CD1-CD1 3.99Å; L1079-I1090 HydrophobicContact CD2-CG2 4.38Å; L1079-I1090 HydrophobicContact CG-CD1 4.36Å; V1081-I1090 HydrophobicContact CG1-CD1 3.97Å; V1081-I1090 HydrophobicContact CG1-CG1 3.55Å; P1088-I1090 PolarHBondContact O-N 2.93Å
1091	T	69.2	Low	80.6	Confident	92 Å²	92	35.9 Å²	35.9	56%	0.564	18%	0.184	S	C	*	.			trans	-88.3	-16.7	174.1	54.2	0	0	0	0	112.6	K1089	K1089-T1091 PolarHBondContact O-N 3.02Å
1092	G	67	Low	80.8	Confident	23 Å²	23	37 Å²	37	24%	0.237	19%	0.192	C	C	.	.	S	Bend	trans	-87.4	162.2	-178.2	0	0	0	0	0	115.6	R1044	R1044-G1092 PolarHBondContact NH1-O 3.43Å; R1044-G1092 PolarHBondContact NH2-O 2.9Å
1093	K	72.8	Confident	81.4	Confident	100 Å²	100	36.7 Å²	36.7	44%	0.435	19%	0.193	S	C	.	.	P	Polyproline II helix	trans	-69.8	153.6	161.7	-63.3	-173.3	-175.1	175.1	0	109.8	G762 E763 D764	G762-K1093 WeakPolarHBondContact O-CD 3.39Å; E763-K1093 PolarHBondContact O-NZ 2.86Å; D764-K1093 VanDerWaalsContact CG-NZ 3.27Å; D764-K1093 IonicContact OD2-NZ 3.86Å; D764-K1093 PolarHBondContact OD2-NZ 3.25Å
1094	G	78.4	Confident	82.5	Confident	6 Å²	6	32.3 Å²	32.3	6%	0.062	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-87.8	160.1	179.4	0	0	0	0	0	112.3	R1044 T1078	R1044-G1094 VanDerWaalsContact NH1-N 3.11Å; T1078-G1094 WeakPolarHBondContact O-CA 3.39Å
1095	M	85.1	Confident	83.8	Confident	17 Å²	17	28.8 Å²	28.8	8%	0.084	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	136.6	172	-50.1	-178	-65.4	0	0	108.7	W759 L760 Y761 C774 L1066 I1077 T1078	W759-M1095 HydrophobicContact CD2-CB 4.36Å; W759-M1095 HydrophobicContact CE3-CB 3.69Å; W759-M1095 HydrophobicContact CZ3-CB 4.37Å; L760-M1095 CarbonylContact O-C 3.59Å; L760-M1095 VanDerWaalsContact O-CA 3.3Å; L760-M1095 WeakPolarHBondContact O-CA 3.42Å; Y761-M1095 HydrophobicContact CD1-CG 3.77Å; Y761-M1095 HydrophobicContact CD1-SD 4.26Å; Y761-M1095 HydrophobicContact CE1-CG 3.47Å; Y761-M1095 VanDerWaalsContact CE1-CG 3.47Å; Y761-M1095 HydrophobicContact CE1-SD 3.35Å; Y761-M1095 WeakPolarHBondContact CE1-SD 3.06Å; Y761-M1095 VanDerWaalsContact CZ-SD 3.55Å; Y761-M1095 PolarHBondContact OH-SD 3.05Å; Y761-M1095 VanDerWaalsContact OH-SD 3.4Å; C774-M1095 HydrophobicContact CB-SD 4.38Å; L1066-M1095 HydrophobicContact CD2-CE 4.1Å; I1077-M1095 CarbonylContact C-O 3.53Å; I1077-M1095 WeakPolarHBondContact CA-O 3.13Å; T1078-M1095 PolarHBondContact N-O 3.09Å; T1078-M1095 PolarHBondContact O-N 3.48Å; T1078-M1095 WeakPolarHBondContact OG1-CE 3.42Å
1096	I	88	Confident	85.1	Confident	15 Å²	15	22.2 Å²	22.2	8%	0.077	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	126.4	177.7	-55.9	-166.2	0	0	0	108.8	W759 L760 R1044 I1077	W759-I1096 CarbonylContact C-O 3.59Å; W759-I1096 WeakPolarHBondContact CA-O 3.45Å; L760-I1096 PolarHBondContact N-O 2.65Å; L760-I1096 PolarHBondContact O-N 3.4Å; R1044-I1096 VanDerWaalsContact O-CD1 3.25Å; R1044-I1096 WeakPolarHBondContact O-CD1 3.3Å; I1077-I1096 HydrophobicContact CD1-CD1 4.02Å; I1077-I1096 HydrophobicContact CD1-CG1 4.25Å; I1077-I1096 HydrophobicContact CG1-CB 4.46Å; I1077-I1096 HydrophobicContact CG1-CD1 4.28Å; I1077-I1096 HydrophobicContact CG1-CG1 3.98Å; I1077-I1096 HydrophobicContact CG1-CG2 4.21Å; I1077-I1096 HydrophobicContact CG2-CG1 4.31Å
1097	S	89.8	Confident	86	Confident	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	133.5	177.8	175.4	0	0	0	0	111.1	W759 I1076 N1099 W1268	W759-S1097 VanDerWaalsContact CE3-N 3.33Å; I1076-S1097 WeakPolarHBondContact O-CB 3.45Å; I1076-S1097 PolarHBondContact O-N 2.94Å; S1097-N1099 VanDerWaalsContact C-N 3.26Å; S1097-N1099 WeakPolarHBondContact CB-O 3.41Å; S1097-N1099 WeakPolarHBondContact OG-CA 3.43Å; S1097-N1099 PolarHBondContact OG-N 3.41Å; S1097-N1099 PolarHBondContact OG-O 2.78Å; S1097-W1268 WeakPolarHBondContact OG-CH2 3.42Å; S1097-W1268 VanDerWaalsContact OG-CZ2 3.3Å; S1097-W1268 WeakPolarHBondContact OG-CZ2 3.49Å
1098	L	88.6	Confident	86.4	Confident	11 Å²	11	23.3 Å²	23.3	6%	0.058	14%	0.135	C	C	.	.	S	Bend	trans	-72.9	-21.6	165.1	-71.6	-169.3	0	0	0	112.1	R757 G758 L760 R1245 L1246	R757-L1098 WeakPolarHBondContact O-CD1 3.42Å; G758-L1098 PolarHBondContact O-N 3.46Å; L760-L1098 HydrophobicContact CD1-CD2 3.64Å; L760-L1098 HydrophobicContact CD2-CD2 4.16Å; L760-L1098 HydrophobicContact CG-CD2 3.6Å; L760-L1098 HydrophobicContact CG-CG 4.18Å; L1098-R1245 CarbonylContact O-C 3.6Å; L1098-R1245 WeakPolarHBondContact O-CA 3.34Å; L1098-L1246 HydrophobicContact CD2-CB 4.08Å; L1098-L1246 WeakPolarHBondContact O-CB 3.21Å; L1098-L1246 WeakPolarHBondContact O-CG 3.41Å; L1098-L1246 PolarHBondContact O-N 3.44Å
1099	N	90.8	Very high	86.9	Confident	0 Å²	0	24 Å²	24	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	120.8	176	-59.1	-50.5	0	0	0	109.4	E754 L777 S1097 F1243 R1245 M1266 W1268	E754-N1099 PolarHBondContact O-ND2 3.26Å; L777-N1099 HydrophobicContact CD2-CB 3.98Å; S1097-N1099 VanDerWaalsContact C-N 3.26Å; S1097-N1099 WeakPolarHBondContact CB-O 3.41Å; S1097-N1099 WeakPolarHBondContact OG-CA 3.43Å; S1097-N1099 PolarHBondContact OG-N 3.41Å; S1097-N1099 PolarHBondContact OG-O 2.78Å; N1099-F1243 HydrophobicContact CB-CE2 4.06Å; N1099-R1245 WeakPolarHBondContact OD1-CD 3.42Å; N1099-M1266 HydrophobicContact CB-CE 3.56Å; N1099-W1268 HydrophobicContact CB-CH2 4.03Å; N1099-W1268 HydrophobicContact CB-CZ2 4.08Å
1100	A	91.8	Very high	87.2	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	158.2	-169.7	0	0	0	0	0	111.7	G1074 L1075 R1244 L1246	G1074-A1100 WeakPolarHBondContact O-CA 3.42Å; G1074-A1100 WeakPolarHBondContact O-CB 3.37Å; L1075-A1100 HydrophobicContact CD2-CB 4.31Å; A1100-R1244 HydrophobicContact CB-CG 4.23Å; A1100-R1244 PolarHBondContact N-O 3.29Å; A1100-R1244 PolarHBondContact O-N 2.91Å; A1100-R1244 VanDerWaalsContact O-O 3.06Å; A1100-L1246 HydrophobicContact CB-CD1 4.29Å; A1100-L1246 HydrophobicContact CB-CG 4.36Å
1101	H	91.8	Very high	87.6	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.14	C	C	.	.			trans	-77.7	157.8	166.2	-68.2	-69.8	0	0	0	110.6	G1074 G1103 S1238 G1240 G1242 R1244 T1264	G1074-H1101 PolarHBondContact O-N 2.78Å; H1101-G1103 WeakPolarHBondContact CB-O 3.46Å; H1101-S1238 PolarHBondContact NE2-OG 3.47Å; H1101-G1240 PolarHBondContact CE1-N 2.94Å; H1101-G1242 PolarHBondContact ND1-O 3.01Å; H1101-R1244 PolarHBondContact O-NE 3.49Å; H1101-R1244 PolarHBondContact O-NH1 2.96Å; H1101-R1244 PolarHBondContact O-NH2 2.82Å; H1101-T1264 PolarHBondContact CE1-O 3.29Å; H1101-T1264 VanDerWaalsContact CE1-O 3.29Å
1102	C	89.4	Confident	88.4	Confident	32 Å²	32	21.6 Å²	21.6	22%	0.216	13%	0.133	C	C	.	.	S	Bend	trans	-79.6	-33.3	177	-63.4	0	0	0	0	112.1	K1241 R1244	C1102-K1241 WeakPolarHBondContact CA-O 3.17Å; C1102-K1241 VanDerWaalsContact CB-O 3.3Å; C1102-K1241 WeakPolarHBondContact CB-O 3.22Å; C1102-K1241 PolarHBondContact N-O 3.04Å; C1102-R1244 PolarHBondContact O-NH1 3.27Å; C1102-R1244 VanDerWaalsContact O-NH1 3.11Å
1103	G	88.3	Confident	89	Confident	17 Å²	17	20.7 Å²	20.7	18%	0.175	12%	0.123	C	C	.	.	S	Bend	trans	-106.1	-163.6	167.6	0	0	0	0	0	112.7	G1074 H1101 K1241	G1074-G1103 WeakPolarHBondContact CA-O 3.22Å; G1074-G1103 PolarHBondContact N-O 3.29Å; H1101-G1103 WeakPolarHBondContact CB-O 3.46Å; G1103-K1241 PolarHBondContact N-O 3.41Å
1104	P	90.8	Very high	89.3	Confident	47 Å²	47	18.7 Å²	18.7	31%	0.305	12%	0.119	S	C	.	.			trans	-52.4	155.1	174.6	-27.5	36.1	0	0	0	114.2	T1058 D1106 G1240	T1058-P1104 HydrophobicContact CG2-CB 4.39Å; P1104-D1106 PolarHBondContact O-N 2.87Å; P1104-G1240 WeakPolarHBondContact O-CA 3.28Å
1105	V	94.4	Very high	89.1	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	97.7	162.3	-167.5	0	0	0	0	107.5	T1058 S1059 T1071 I1076 L1108 G1239	T1058-V1105 WeakPolarHBondContact CB-O 3.45Å; T1058-V1105 PolarHBondContact OG1-O 2.92Å; S1059-V1105 WeakPolarHBondContact OG-CG1 3.48Å; S1059-V1105 PolarHBondContact OG-O 3.1Å; S1059-V1105 VanDerWaalsContact OG-O 3.1Å; T1071-V1105 PolarHBondContact O-N 2.88Å; T1071-V1105 VanDerWaalsContact O-N 3.14Å; I1076-V1105 HydrophobicContact CG1-CG2 4.06Å; V1105-L1108 HydrophobicContact CG1-CD2 4.29Å; V1105-L1108 HydrophobicContact CG1-CG 4.22Å; V1105-G1239 CarbonylContact C-O 3.58Å
1106	D	93.5	Very high	88.3	Confident	38 Å²	38	19.9 Å²	19.9	20%	0.203	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	-34.1	-172.6	-69	-51.4	0	0	0	112.3	L793 P1104 G1239	L793-D1106 HydrophobicContact CB-CB 4.1Å; P1104-D1106 PolarHBondContact O-N 2.87Å; D1106-G1239 PolarHBondContact N-O 3.34Å
1107	F	95	Very high	87.2	Confident	12 Å²	12	22.1 Å²	22.1	5%	0.053	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	161.4	172.4	62.9	-108	0	0	0	113.3	L793 A796 V822 V1109 S1238 G1239 L1265	L793-F1107 HydrophobicContact CB-CD1 4.49Å; L793-F1107 HydrophobicContact CB-CE1 4.23Å; L793-F1107 HydrophobicContact CD1-CE1 4.08Å; A796-F1107 HydrophobicContact CB-CD1 4.14Å; A796-F1107 HydrophobicContact CB-CD2 3.85Å; A796-F1107 HydrophobicContact CB-CE1 3.79Å; A796-F1107 HydrophobicContact CB-CE2 3.49Å; A796-F1107 VanDerWaalsContact CB-CE2 3.49Å; A796-F1107 HydrophobicContact CB-CG 4.17Å; A796-F1107 HydrophobicContact CB-CZ 3.45Å; A796-F1107 VanDerWaalsContact CB-CZ 3.45Å; V822-F1107 HydrophobicContact CG1-CE1 4.04Å; V822-F1107 HydrophobicContact CG1-CZ 3.97Å; F1107-V1109 HydrophobicContact CD2-CG2 3.97Å; F1107-V1109 HydrophobicContact CE2-CG2 4.39Å; F1107-S1238 WeakPolarHBondContact O-CA 3.38Å; F1107-G1239 PolarHBondContact O-N 3.31Å; F1107-G1239 VanDerWaalsContact O-N 3.15Å; F1107-L1265 HydrophobicContact CE2-CD2 4.27Å; F1107-L1265 HydrophobicContact CZ-CD2 3.7Å
1108	L	96.6	Very high	86	Confident	18 Å²	18	26.9 Å²	26.9	9%	0.094	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	123	168.3	-74.5	167.9	0	0	0	108.9	L1061 W1068 V1105 V1236	L1061-L1108 HydrophobicContact CB-CB 3.84Å; L1061-L1108 HydrophobicContact CB-CD1 4.33Å; L1061-L1108 HydrophobicContact CD2-CB 3.92Å; W1068-L1108 HydrophobicContact CB-CD1 4Å; V1105-L1108 HydrophobicContact CG1-CD2 4.29Å; V1105-L1108 HydrophobicContact CG1-CG 4.22Å; L1108-V1236 HydrophobicContact CD2-CG1 3.99Å
1109	V	94.9	Very high	84.8	Confident	15 Å²	15	28.1 Å²	28.1	9%	0.091	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.7	178.8	175.6	0	0	0	0	109.8	A796 H798 L820 F1107 T1111 V1236 I1237	A796-V1109 HydrophobicContact CB-CG2 3.79Å; A796-V1109 VanDerWaalsContact O-CG2 3.27Å; A796-V1109 WeakPolarHBondContact O-CG2 3.32Å; H798-V1109 HydrophobicContact CB-CG1 4.15Å; L820-V1109 HydrophobicContact CD1-CG1 4.26Å; F1107-V1109 HydrophobicContact CD2-CG2 3.97Å; F1107-V1109 HydrophobicContact CE2-CG2 4.39Å; V1109-T1111 HydrophobicContact CG1-CG2 4.27Å; V1109-V1236 CarbonylContact O-C 3.56Å; V1109-V1236 WeakPolarHBondContact O-CA 3.48Å; V1109-I1237 PolarHBondContact N-O 3.08Å; V1109-I1237 PolarHBondContact O-N 3.06Å
1110	A	92.9	Very high	83.5	Confident	33 Å²	33	29.2 Å²	29.2	27%	0.273	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	134.4	163.9	0	0	0	0	0	109.2	L1061 C1063	L1061-A1110 HydrophobicContact CD1-CB 3.96Å; L1061-A1110 HydrophobicContact CD2-CB 4.04Å; L1061-A1110 HydrophobicContact CG-CB 4.44Å; C1063-A1110 HydrophobicContact CB-CB 4.33Å
1111	T	90.1	Very high	82.1	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.006	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	140	170.3	71.9	0	0	0	0	108.4	H798 P816 L838 V1109 A1234 A1235 I1237	H798-T1111 HydrophobicContact CB-CG2 3.87Å; H798-T1111 VanDerWaalsContact ND1-CA 3.34Å; H798-T1111 WeakPolarHBondContact ND1-CA 3.4Å; H798-T1111 WeakPolarHBondContact ND1-CB 3.31Å; P816-T1111 WeakPolarHBondContact CG-O 3.31Å; P816-T1111 VanDerWaalsContact CG-OG1 3.3Å; P816-T1111 WeakPolarHBondContact CG-OG1 3.34Å; L838-T1111 HydrophobicContact CD1-CG2 4.28Å; V1109-T1111 HydrophobicContact CG1-CG2 4.27Å; T1111-A1234 VanDerWaalsContact O-CA 3.29Å; T1111-A1234 WeakPolarHBondContact O-CA 3.24Å; T1111-A1235 PolarHBondContact N-O 2.9Å; T1111-A1235 PolarHBondContact O-N 3.44Å; T1111-A1235 VanDerWaalsContact O-N 3.09Å; T1111-A1235 PolarHBondContact OG1-O 3.44Å; T1111-I1237 HydrophobicContact CG2-CD1 3.79Å; T1111-I1237 HydrophobicContact CG2-CG1 4.09Å
1112	T	86	Confident	80.1	Confident	68 Å²	68	44.2 Å²	44.2	42%	0.417	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	146	179.5	53.5	0	0	0	0	112	H798 S1233 A1234	H798-T1112 PolarHBondContact CE1-O 2.84Å; H798-T1112 VanDerWaalsContact CE1-O 3.31Å; H798-T1112 PolarHBondContact ND1-N 3.17Å; T1112-S1233 VanDerWaalsContact CA-O 3.3Å; T1112-S1233 WeakPolarHBondContact CA-O 3.4Å; T1112-A1234 HydrophobicContact CG2-CB 4.19Å
1113	S	80.8	Confident	77.9	Confident	5 Å²	5	47 Å²	47	4%	0.035	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	128.8	176.5	-177.2	0	0	0	0	109	V801 L806 S1233	V801-S1113 PolarHBondContact O-OG 3Å; L806-S1113 WeakPolarHBondContact CD2-O 3.29Å; S1113-S1233 PolarHBondContact N-O 3.25Å; S1113-S1233 PolarHBondContact O-N 3.12Å
1114	T	77.4	Confident	75.4	Confident	58 Å²	58	50.4 Å²	50.4	36%	0.356	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	141	-178.3	46.5	0	0	0	0	110.2	I1232	T1114-I1232 HydrophobicContact CG2-CB 4.49Å; T1114-I1232 HydrophobicContact CG2-CD1 4.38Å; T1114-I1232 HydrophobicContact CG2-CG1 4.12Å; T1114-I1232 HydrophobicContact CG2-CG2 3.99Å
1115	L	74.4	Confident	72.6	Confident	6 Å²	6	55 Å²	55	3%	0.031	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-77.5	140.9	165.9	-177.4	67.7	0	0	0	109.2	I738 C803 L806 F808 L1119 L1120 V1231	I738-L1115 HydrophobicContact CD1-CD2 3.71Å; C803-L1115 WeakPolarHBondContact O-CD1 3.47Å; L806-L1115 HydrophobicContact CB-CB 4.31Å; L806-L1115 HydrophobicContact CB-CD1 4.02Å; L806-L1115 HydrophobicContact CD2-CB 4.31Å; F808-L1115 HydrophobicContact CE2-CD1 4.1Å; F808-L1115 HydrophobicContact CE2-CD2 4.04Å; L1115-L1119 HydrophobicContact CD1-CB 4.37Å; L1115-L1119 HydrophobicContact CD1-CD1 3.8Å; L1115-L1120 HydrophobicContact CD2-CD1 4.39Å; L1115-L1120 HydrophobicContact CD2-CD2 3.45Å; L1115-L1120 VanDerWaalsContact CD2-CD2 3.45Å; L1115-L1120 HydrophobicContact CD2-CG 3.81Å; L1115-V1231 HydrophobicContact CB-CB 4.06Å; L1115-V1231 HydrophobicContact CD2-CB 4.39Å; L1115-V1231 HydrophobicContact CD2-CG2 4.37Å; L1115-V1231 PolarHBondContact N-O 3.08Å
1116	S	68.4	Low	69.5	Low	41 Å²	41	57.9 Å²	57.9	29%	0.287	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-68.9	135.9	176.4	63	0	0	0	0	111.6	D1118 L1119	S1116-D1118 PolarHBondContact O-N 2.72Å; S1116-L1119 PolarHBondContact O-N 2.79Å; S1116-L1119 VanDerWaalsContact OG-CD1 3.27Å; S1116-L1119 WeakPolarHBondContact OG-CD1 3.24Å; S1116-L1119 WeakPolarHBondContact OG-CG 3.48Å
1117	P	65.2	Low	66.4	Low	63 Å²	63	63.9 Å²	63.9	41%	0.409	36%	0.364	S	S	.	.	H	α-helix	trans	-59.4	-31.1	-174.9	-27.7	36	0	0	0	114.6	L1119 L1120 K1121	P1117-L1119 PolarHBondContact O-N 2.86Å; P1117-L1120 WeakPolarHBondContact O-CB 3.24Å; P1117-L1120 PolarHBondContact O-N 2.92Å; P1117-L1120 VanDerWaalsContact O-N 3.12Å; P1117-K1121 PolarHBondContact O-N 3.47Å
1118	D	64.1	Low	63.1	Low	99 Å²	99	66.1 Å²	66.1	53%	0.529	39%	0.39	S	S	.	.	H	α-helix	trans	-67.1	-19.3	-178.2	-59.7	-63.4	0	0	0	113.8	S1116 K1121	S1116-D1118 PolarHBondContact O-N 2.72Å; D1118-K1121 WeakPolarHBondContact OD1-CE 3.36Å; D1118-K1121 IonicContact OD1-NZ 2.76Å; D1118-K1121 PolarHBondContact OD1-NZ 2.86Å
1119	L	64.2	Low	59.9	Low	37 Å²	37	71.5 Å²	71.5	19%	0.194	43%	0.426	C	S	.	.	H	α-helix	trans	-80.5	-22.1	175.4	-65.7	173.3	0	0	0	113.2	K705 A804 L1115 S1116 P1117	K705-L1119 PolarHBondContact NZ-O 2.88Å; A804-L1119 HydrophobicContact CB-CD1 4.05Å; A804-L1119 WeakPolarHBondContact O-CD1 3.43Å; L1115-L1119 HydrophobicContact CD1-CB 4.37Å; L1115-L1119 HydrophobicContact CD1-CD1 3.8Å; S1116-L1119 PolarHBondContact O-N 2.79Å; S1116-L1119 VanDerWaalsContact OG-CD1 3.27Å; S1116-L1119 WeakPolarHBondContact OG-CD1 3.24Å; S1116-L1119 WeakPolarHBondContact OG-CG 3.48Å; P1117-L1119 PolarHBondContact O-N 2.86Å
1120	L	64.3	Low	56.6	Low	23 Å²	23	78.7 Å²	78.7	12%	0.12	46%	0.464	C	S	.	.	H	α-helix	trans	-81.3	-28.7	176.3	-65.6	179.6	0	0	0	112.6	L735 I738 L1115 P1117 R1122 D1229 V1231	L735-L1120 HydrophobicContact CD2-CD1 4.05Å; L735-L1120 HydrophobicContact CD2-CD2 3.37Å; L735-L1120 HydrophobicContact CD2-CG 4.31Å; L735-L1120 HydrophobicContact CG-CD2 4Å; I738-L1120 HydrophobicContact CD1-CD2 4.12Å; L1115-L1120 HydrophobicContact CD2-CD1 4.39Å; L1115-L1120 HydrophobicContact CD2-CD2 3.45Å; L1115-L1120 VanDerWaalsContact CD2-CD2 3.45Å; L1115-L1120 HydrophobicContact CD2-CG 3.81Å; P1117-L1120 WeakPolarHBondContact O-CB 3.24Å; P1117-L1120 PolarHBondContact O-N 2.92Å; P1117-L1120 VanDerWaalsContact O-N 3.12Å; L1120-R1122 PolarHBondContact O-N 2.8Å; L1120-R1122 VanDerWaalsContact O-N 3.1Å; L1120-D1229 HydrophobicContact CD1-CB 4.21Å; L1120-D1229 WeakPolarHBondContact CD1-O 3.45Å; L1120-V1231 HydrophobicContact CD1-CG2 4.32Å; L1120-V1231 HydrophobicContact CD2-CG2 4.35Å
1121	K	61.5	Low	53.6	Low	129 Å²	129	82.9 Å²	82.9	56%	0.561	49%	0.492	S	S	*	.			trans	-55.3	116.8	172.1	-66.4	176.6	-175.4	167.8	0	109.4	P1117 D1118	P1117-K1121 PolarHBondContact O-N 3.47Å; D1118-K1121 WeakPolarHBondContact OD1-CE 3.36Å; D1118-K1121 IonicContact OD1-NZ 2.76Å; D1118-K1121 PolarHBondContact OD1-NZ 2.86Å
1122	R	50.6	Low	50.5	Low	186 Å²	186	87.2 Å²	87.2	70%	0.702	53%	0.527	S	S	*	.			trans	-67.1	137.1	159.3	-176.8	175.7	-176.1	144	-3.8	106.7	P732 L1120 S1124	P732-R1122 PolarHBondContact O-NH1 3.05Å; L1120-R1122 PolarHBondContact O-N 2.8Å; L1120-R1122 VanDerWaalsContact O-N 3.1Å; R1122-S1124 PolarHBondContact O-N 2.8Å
1123	D	43.3	Very low	47.6	Very low	90 Å²	90	90.3 Å²	90.3	48%	0.481	55%	0.55	S	S	.	*			trans	-67	79.2	167.9	-76.9	-62.4	0	0	0	109.6	V1125 R1171	D1123-V1125 PolarHBondContact O-N 2.95Å; D1123-R1171 IonicContact OD1-CZ 2.75Å; D1123-R1171 IonicContact OD1-NH1 3.78Å; D1123-R1171 PolarHBondContact OD1-NH1 3.32Å; D1123-R1171 IonicContact OD1-NH2 2.7Å; D1123-R1171 PolarHBondContact OD1-NH2 3.12Å; D1123-R1171 IonicContact OD2-NH1 3.21Å
1124	S	35.5	Very low	44.9	Very low	90 Å²	90	94.1 Å²	94.1	63%	0.629	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-68.4	119.1	166.5	47.7	0	0	0	0	108.2	R1122 G1126	R1122-S1124 PolarHBondContact O-N 2.8Å; S1124-G1126 PolarHBondContact O-N 2.75Å; S1124-G1126 VanDerWaalsContact O-N 3.15Å
1125	V	32.4	Very low	42.4	Very low	142 Å²	142	95 Å²	95	86%	0.861	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-58.3	116.8	153.8	179.8	0	0	0	0	105.3	D1123 D1127	D1123-V1125 PolarHBondContact O-N 2.95Å; V1125-D1127 PolarHBondContact O-N 3.28Å
1126	G	29.4	Very low	40.1	Very low	62 Å²	62	104.3 Å²	104.3	64%	0.639	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-73.5	121.6	-179.6	0	0	0	0	0	110.1	S1124	S1124-G1126 PolarHBondContact O-N 2.75Å; S1124-G1126 VanDerWaalsContact O-N 3.15Å
1127	D	26.6	Very low	38	Very low	164 Å²	164	108.5 Å²	108.5	88%	0.877	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-63.8	131.3	141.4	-71	-44.1	0	0	0	106.7	V1125	V1125-D1127 PolarHBondContact O-N 3.28Å
1128	G	26	Very low	36.1	Very low	58 Å²	58	116.2 Å²	116.2	60%	0.598	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-71.3	158.7	170.9	0	0	0	0	0	110.3	D1130	G1128-D1130 PolarHBondContact O-N 2.84Å
1129	P	30.6	Very low	34.2	Very low	132 Å²	132	116.1 Å²	116.1	86%	0.857	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-65.7	124.3	170.8	28.4	-32.8	0	0	0	109.6	S1131	P1129-S1131 PolarHBondContact O-N 3.49Å
1130	D	25.5	Very low	32.2	Very low	165 Å²	165	121.2 Å²	121.2	88%	0.882	73%	0.729	S	S	*	*			trans	-62.9	108.1	169.1	-82	-42.3	0	0	0	109.4	G1128 A1132	G1128-D1130 PolarHBondContact O-N 2.84Å; D1130-A1132 PolarHBondContact O-N 2.82Å
1131	S	30	Very low	30.2	Very low	122 Å²	122	125.8 Å²	125.8	85%	0.853	76%	0.763	S	S	*	*			trans	-82.4	111.1	170.2	-175.6	0	0	0	0	109.1	P1129	P1129-S1131 PolarHBondContact O-N 3.49Å
1132	A	24.6	Very low	28.5	Very low	91 Å²	91	124.5 Å²	124.5	75%	0.752	77%	0.771	S	S	*	*			trans	-110.6	86.4	-176.4	0	0	0	0	0	112.2	D1130	D1130-A1132 PolarHBondContact O-N 2.82Å
1133	C	23.8	Very low	27.3	Very low	134 Å²	134	119.8 Å²	119.8	91%	0.905	77%	0.766	S	S	*	*			trans	57.3	103.5	147.3	-60	0	0	0	0	120.5
1134	G	24.9	Very low	26.5	Very low	84 Å²	84	123.2 Å²	123.2	87%	0.866	78%	0.779	S	S	*	*			trans	-169.3	131.5	141.9	0	0	0	0	0	109
1135	G	26.1	Very low	25.9	Very low	78 Å²	78	126 Å²	126	80%	0.804	78%	0.782	S	S	*	*			cis	-157.9	160.8	-10.7	0	0	0	0	0	108.7
1136	E	24.1	Very low	25.6	Very low	200 Å²	200	123.1 Å²	123.1	94%	0.935	77%	0.768	S	S	*	*			trans	-78.4	135.1	-175.5	-62.7	-179.6	117.8	0	0	112.7
1137	D	24.9	Very low	25.4	Very low	129 Å²	129	127.8 Å²	127.8	69%	0.69	78%	0.778	S	S	*	*			trans	-152.6	120.4	137	-134.3	-9.6	0	0	0	111.6
1138	R	26.1	Very low	25.1	Very low	225 Å²	225	128.3 Å²	128.3	85%	0.849	78%	0.775	S	S	*	*			trans	42.5	138.5	146	-68.6	166.6	-149.1	-119.7	-4.3	120.6
1139	S	24.1	Very low	25.4	Very low	98 Å²	98	130.8 Å²	130.8	69%	0.685	78%	0.78	S	S	*	*			cis	-159.7	154.2	18.9	50.6	0	0	0	0	114.9
1140	D	22.6	Very low	25	Very low	144 Å²	144	129 Å²	129	77%	0.77	77%	0.771	S	S	*	*			trans	73.7	129.7	144.2	-64.1	-8.9	0	0	0	123.6
1141	S	22.5	Very low	24.9	Very low	118 Å²	118	126 Å²	126	83%	0.825	76%	0.763	S	S	*	*			trans	75.8	135.8	151.3	75.3	0	0	0	0	118.6
1142	S	24	Very low	24.4	Very low	103 Å²	103	124.5 Å²	124.5	72%	0.72	75%	0.751	S	S	*	*			cis	-152.9	164.2	-10.2	61.9	0	0	0	0	114.1
1143	S	26.5	Very low	24.4	Very low	87 Å²	87	130.1 Å²	130.1	61%	0.608	76%	0.755	S	S	*	*			trans	59.5	106.5	142.6	60	0	0	0	0	119.9
1144	Q	25.5	Very low	24.3	Very low	161 Å²	161	132.9 Å²	132.9	75%	0.752	75%	0.751	S	S	*	*				93	110.6	119.1	-75.9	-169.4	-69.2	0	0	120.6
1145	E	23.7	Very low	24.2	Very low	150 Å²	150	133 Å²	133	70%	0.701	74%	0.744	S	S	*	*				61.5	140.9	108.9	-69.4	-164.1	82.6	0	0	120.6
1146	S	27.1	Very low	24	Very low	81 Å²	81	138.2 Å²	138.2	57%	0.566	75%	0.748	S	S	*	*			cis	-161.7	167.7	6.3	-125.5	0	0	0	0	115.1
1147	L	24	Very low	23.8	Very low	160 Å²	160	135.8 Å²	135.8	84%	0.838	74%	0.736	S	S	*	*			trans	69.3	102.8	148	-69.4	165.2	0	0	0	120.9
1148	Q	21.4	Very low	23.8	Very low	175 Å²	175	137.6 Å²	137.6	82%	0.818	74%	0.738	S	S	*	*			trans	-58	-166.8	135.8	-42.2	176.5	-8.3	0	0	111.3
1149	P	32.2	Very low	23.9	Very low	109 Å²	109	130.5 Å²	130.5	71%	0.708	73%	0.734	S	S	*	*			cis	-125.2	-169.6	-9.9	34.1	-11.1	0	0	0	111.2
1150	S	22.5	Very low	24	Very low	94 Å²	94	135.7 Å²	135.7	66%	0.657	75%	0.745	S	S	*	*			cis	-177.5	149.5	43.3	62.3	0	0	0	0	109.4
1151	S	21.6	Very low	24.5	Very low	104 Å²	104	132.8 Å²	132.8	73%	0.727	75%	0.749	S	S	*	*				61.3	144.4	102.3	101.8	0	0	0	0	117.4
1152	C	20.9	Very low	24.7	Very low	89 Å²	89	138.9 Å²	138.9	60%	0.601	75%	0.754	S	S	*	*			cis	-172.1	149.4	-7.2	-126.2	0	0	0	0	112.9
1153	Y	23.2	Very low	24.8	Very low	209 Å²	209	137.3 Å²	137.3	82%	0.82	75%	0.753	S	S	*	*			trans	62.7	160.5	164.8	-51.5	-58.4	0	0	0	117.6
1154	K	23.3	Very low	24.8	Very low	192 Å²	192	139.4 Å²	139.4	84%	0.835	76%	0.762	S	S	*	*			cis	-159.5	148	7	-142.2	174	-174	-178.2	0	112.4
1155	A	21.5	Very low	24.7	Very low	86 Å²	86	139.6 Å²	139.6	71%	0.711	77%	0.768	S	S	*	*			trans	67.3	137.2	147	0	0	0	0	0	125.6
1156	E	21.7	Very low	24.8	Very low	189 Å²	189	138.9 Å²	138.9	88%	0.883	77%	0.768	S	S	*	*			trans	90.4	127.9	140.5	-81.4	177.1	-177.1	0	0	126.7
1157	E	21.6	Very low	24.6	Very low	149 Å²	149	143.7 Å²	143.7	70%	0.696	78%	0.781	S	S	*	*			trans	59.3	139.9	149.2	-76.2	-127.6	105.1	0	0	126.8
1158	K	23.9	Very low	24.6	Very low	167 Å²	167	145.3 Å²	145.3	73%	0.726	78%	0.778	S	S	*	*			trans	61.3	83.2	150.3	-71.4	176.8	171.2	71.8	0	120.8
1159	G	27.7	Very low	24.7	Very low	75 Å²	75	148.3 Å²	148.3	77%	0.773	78%	0.782	S	S	*	*				64.4	105.9	113	0	0	0	0	0	120.8
1160	K	25.8	Very low	24.4	Very low	208 Å²	208	151.1 Å²	151.1	90%	0.904	79%	0.79	S	S	*	*			trans	-156.8	139.4	151.3	-109.6	157.8	-174.5	168.7	0	110.1
1161	G	34	Very low	24.6	Very low	83 Å²	83	155.2 Å²	155.2	86%	0.856	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-69.8	131.7	173.6	0	0	0	0	0	111
1162	R	27.7	Very low	25.1	Very low	246 Å²	246	154.7 Å²	154.7	93%	0.928	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-88.2	129.9	171.6	-71.3	-173	175.4	-128.5	0.4	109.7
1163	G	25.4	Very low	25.8	Very low	69 Å²	69	153.9 Å²	153.9	71%	0.711	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-71.8	149.7	168.2	0	0	0	0	0	110.9	L1165	G1163-L1165 PolarHBondContact O-N 3.31Å
1164	V	25.6	Very low	26.2	Very low	131 Å²	131	148.7 Å²	148.7	79%	0.794	77%	0.774	S	S	*	*			trans	-69.3	112.2	172.4	178.9	0	0	0	0	108.6	L1166	V1164-L1166 PolarHBondContact O-N 2.93Å
1165	L	24.3	Very low	26.8	Very low	166 Å²	166	142.9 Å²	142.9	87%	0.869	77%	0.769	S	S	*	*			trans	-76.4	111.2	168	-126.3	84	0	0	0	108.1	G1163 Q1167	G1163-L1165 PolarHBondContact O-N 3.31Å; L1165-Q1167 PolarHBondContact O-N 2.79Å
1166	L	24.6	Very low	27.4	Very low	135 Å²	135	143 Å²	143	71%	0.707	76%	0.757	S	S	*	*			trans	-78.2	98.6	171.3	-74.3	169.1	0	0	0	109	V1164 Y1168	V1164-L1166 PolarHBondContact O-N 2.93Å; L1166-Y1168 WeakPolarHBondContact O-CD2 3.44Å; L1166-Y1168 PolarHBondContact O-N 2.83Å
1167	Q	23.8	Very low	27.7	Very low	181 Å²	181	140.2 Å²	140.2	85%	0.846	76%	0.755	S	S	*	*			trans	-79.4	103.7	174.4	-170.4	170.4	5.4	0	0	109.5	L1165 R1169	L1165-Q1167 PolarHBondContact O-N 2.79Å; Q1167-R1169 PolarHBondContact O-N 2.91Å
1168	Y	24.6	Very low	28.4	Very low	195 Å²	195	136.1 Å²	136.1	77%	0.765	75%	0.753	S	S	*	*			trans	-69	121.9	177.5	-70.5	-97.4	0	0	0	110.6	L1166	L1166-Y1168 WeakPolarHBondContact O-CD2 3.44Å; L1166-Y1168 PolarHBondContact O-N 2.83Å
1169	R	22.5	Very low	28.9	Very low	237 Å²	237	139.7 Å²	139.7	89%	0.894	76%	0.762	S	S	*	*			trans	-104.2	130.6	157.9	-83.7	-177.8	166	170.3	-4.6	108.3	Q1167	Q1167-R1169 PolarHBondContact O-N 2.91Å
1170	L	25.8	Very low	29.2	Very low	168 Å²	168	139.5 Å²	139.5	88%	0.88	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-68.6	144.8	168.7	-72	89.6	0	0	0	109.4
1171	R	27.9	Very low	29.7	Very low	181 Å²	181	136.2 Å²	136.2	68%	0.683	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-75.1	146.4	163.1	-79.6	-175.7	162.7	165.9	-3.2	109.2	D1123	D1123-R1171 IonicContact OD1-CZ 2.75Å; D1123-R1171 IonicContact OD1-NH1 3.78Å; D1123-R1171 PolarHBondContact OD1-NH1 3.32Å; D1123-R1171 IonicContact OD1-NH2 2.7Å; D1123-R1171 PolarHBondContact OD1-NH2 3.12Å; D1123-R1171 IonicContact OD2-NH1 3.21Å
1172	S	32.2	Very low	29.7	Very low	93 Å²	93	137.4 Å²	137.4	65%	0.65	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-58.7	139.4	176.4	-176.5	0	0	0	0	111.2	S1174	S1172-S1174 PolarHBondContact O-N 2.92Å; S1172-S1174 WeakPolarHBondContact OG-CB 3.35Å; S1172-S1174 PolarHBondContact OG-N 3.38Å; S1172-S1174 PolarHBondContact OG-OG 2.85Å
1173	T	35.1	Very low	29.9	Very low	72 Å²	72	131 Å²	131	44%	0.442	73%	0.728	S	S	.	*	S	Bend	trans	-79.2	-3.3	175.8	45.2	0	0	0	0	113.5	R691 G1175	R691-T1173 PolarHBondContact NH2-O 3.29Å; T1173-G1175 PolarHBondContact O-N 3.21Å; T1173-G1175 VanDerWaalsContact O-N 3.1Å
1174	S	31.6	Very low	30.1	Very low	100 Å²	100	136.2 Å²	136.2	70%	0.699	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.2	2.7	-171.9	61.4	0	0	0	0	116.5	S1172	S1172-S1174 PolarHBondContact O-N 2.92Å; S1172-S1174 WeakPolarHBondContact OG-CB 3.35Å; S1172-S1174 PolarHBondContact OG-N 3.38Å; S1172-S1174 PolarHBondContact OG-OG 2.85Å
1175	G	35.2	Very low	30.4	Very low	70 Å²	70	133.5 Å²	133.5	72%	0.722	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	6.7	-176.5	0	0	0	0	0	115.9	T1173	T1173-G1175 PolarHBondContact O-N 3.21Å; T1173-G1175 VanDerWaalsContact O-N 3.1Å
1176	L	34.2	Very low	30.6	Very low	88 Å²	88	133.5 Å²	133.5	46%	0.461	73%	0.733	S	S	.	*	S	Bend	trans	-115.8	151.5	174.8	-59.9	-174.4	0	0	0	110.2
1177	P	28.2	Very low	30.9	Very low	130 Å²	130	136.6 Å²	136.6	84%	0.844	74%	0.744	S	S	*	*	S	Bend	trans	-57.5	142	171.4	-22.5	33.8	0	0	0	112
1178	G	37	Very low	31.3	Very low	63 Å²	63	132.4 Å²	132.4	65%	0.649	74%	0.741	S	S	*	*	S	Bend	trans	107.8	139.7	-179.5	0	0	0	0	0	113.7
1179	R	33.5	Very low	31.5	Very low	243 Å²	243	128.4 Å²	128.4	92%	0.917	74%	0.742	S	S	*	*			trans	-71.5	133.2	179.5	-122.6	-178.9	-176.9	-172.9	0.7	110.1
1180	P	34.5	Very low	31.8	Very low	70 Å²	70	124.1 Å²	124.1	46%	0.455	74%	0.736	S	S	.	*			trans	-71.3	138.3	170.2	29.9	-33.4	0	0	0	110.5	T1182	P1180-T1182 PolarHBondContact O-N 3.41Å
1181	L	36.3	Very low	32	Very low	139 Å²	139	121.4 Å²	121.4	73%	0.728	73%	0.731	S	S	*	*			trans	-75.2	101.2	175.2	-65.9	174	0	0	0	110.4	D684	D684-L1181 HydrophobicContact CB-CD1 4.07Å
1182	T	33.4	Very low	32	Very low	109 Å²	109	117.6 Å²	117.6	67%	0.669	73%	0.732	S	S	*	*			trans	-107.6	109.1	168.8	52.4	0	0	0	0	109.8	P1180 H1184	P1180-T1182 PolarHBondContact O-N 3.41Å; T1182-H1184 PolarHBondContact O-N 2.83Å
1183	A	32.3	Very low	31.9	Very low	110 Å²	110	120.1 Å²	120.1	91%	0.909	74%	0.738	S	S	*	*			trans	-73.8	106.5	170.7	0	0	0	0	0	109.9
1184	H	30	Very low	31.6	Very low	179 Å²	179	124.5 Å²	124.5	83%	0.829	75%	0.753	S	S	*	*			trans	-105.4	135.9	159.6	-90.8	-86.5	0	0	0	108.3	T1182	T1182-H1184 PolarHBondContact O-N 2.83Å
1185	G	30.6	Very low	31.5	Very low	75 Å²	75	124.6 Å²	124.6	77%	0.773	75%	0.754	S	S	*	*			trans	-82.9	162.2	176.7	0	0	0	0	0	112.4
1186	D	29.4	Very low	31.2	Very low	165 Å²	165	127.9 Å²	127.9	88%	0.882	75%	0.754	S	S	*	*			trans	-65.2	128.6	177.9	-59.4	-68.1	0	0	0	112.6
1187	E	30.3	Very low	30.9	Very low	200 Å²	200	131.8 Å²	131.8	94%	0.935	77%	0.77	S	S	*	*			trans	-128.8	136.7	138.2	-73.6	-163	146.9	0	0	107.6
1188	A	31.7	Very low	31	Very low	93 Å²	93	134.6 Å²	134.6	77%	0.769	77%	0.772	S	S	*	*			trans	-122.2	138.7	-166.8	0	0	0	0	0	112.5
1189	S	30.4	Very low	30.4	Very low	112 Å²	112	136.7 Å²	136.7	78%	0.783	78%	0.776	S	S	*	*			trans	-155.8	132.9	153.8	-45.2	0	0	0	0	112
1190	D	27.4	Very low	30.5	Very low	147 Å²	147	131.5 Å²	131.5	79%	0.786	77%	0.771	S	S	*	*			trans	57.9	84.4	140.2	-57.8	-2.3	0	0	0	121.4
1191	S	29.8	Very low	30.1	Very low	111 Å²	111	136.4 Å²	136.4	78%	0.776	79%	0.788	S	S	*	*				57.9	141.7	117.1	81.1	0	0	0	0	120.7
1192	S	29.8	Very low	29.7	Very low	100 Å²	100	136.8 Å²	136.8	70%	0.699	79%	0.791	S	S	*	*			cis	-167.6	159.4	40.6	50.2	0	0	0	0	115.2
1193	L	29.9	Very low	29.7	Very low	147 Å²	147	135.9 Å²	135.9	77%	0.77	80%	0.803	S	S	*	*			trans	79.5	131.4	154.8	-72.3	160.8	0	0	0	122.9
1194	E	28.3	Very low	29.6	Very low	163 Å²	163	136 Å²	136	76%	0.762	80%	0.797	S	S	*	*			trans	73.9	69.4	144.3	-71.4	174.4	170	0	0	122.9
1195	S	30	Very low	29.5	Very low	102 Å²	102	134.1 Å²	134.1	71%	0.713	79%	0.792	S	S	*	*				77.7	145.2	102.3	69.5	0	0	0	0	124.1
1196	L	28.1	Very low	29.6	Very low	140 Å²	140	140.7 Å²	140.7	73%	0.733	80%	0.795	S	S	*	*			trans	90.6	113	154.1	-103.8	73.3	0	0	0	121.4
1197	E	28.7	Very low	29.4	Very low	170 Å²	170	142.2 Å²	142.2	79%	0.794	80%	0.797	S	S	*	*			trans	75.2	147.5	137.3	-78.7	165.4	-160.8	0	0	122.1
1198	H	28.8	Very low	29.5	Very low	189 Å²	189	140.5 Å²	140.5	88%	0.875	79%	0.793	S	S	*	*			trans	-94.7	138.5	177.7	-64.9	17.3	0	0	0	109.4
1199	S	24.3	Very low	29.2	Very low	107 Å²	107	140.6 Å²	140.6	75%	0.748	79%	0.788	S	S	*	*			trans	-110.9	146.2	153.9	-170.6	0	0	0	0	109.3
1200	V	36.4	Very low	29.1	Very low	134 Å²	134	143 Å²	143	81%	0.812	79%	0.793	S	S	*	*			trans	-124.2	101.4	179.1	179.9	0	0	0	0	107.8
1201	E	26.9	Very low	28.9	Very low	173 Å²	173	140.1 Å²	140.1	81%	0.808	78%	0.777	S	S	*	*			trans	-153.7	163.3	175.9	-117.2	156	-152	0	0	111.7
1202	D	27.9	Very low	29	Very low	147 Å²	147	140 Å²	140	79%	0.786	77%	0.774	S	S	*	*			trans	57.8	62.3	174.2	-68.9	-3.4	0	0	0	119.3	S1204	D1202-S1204 PolarHBondContact O-N 2.83Å
1203	G	32.2	Very low	28.9	Very low	90 Å²	90	140.7 Å²	140.7	93%	0.928	77%	0.766	S	S	*	*			trans	-79	85.6	152	0	0	0	0	0	112.5
1204	S	31.1	Very low	28.8	Very low	112 Å²	112	141.6 Å²	141.6	78%	0.783	77%	0.768	S	S	*	*			trans	-163.7	80.3	169.6	-179.4	0	0	0	0	113.6	D1202	D1202-S1204 PolarHBondContact O-N 2.83Å
1205	I	26.5	Very low	29.2	Very low	139 Å²	139	142 Å²	142	71%	0.713	76%	0.763	S	S	*	*			trans	-138.8	9.4	178.4	-26	179.7	0	0	0	114.5
1206	Y	33.1	Very low	29.2	Very low	213 Å²	213	140.1 Å²	140.1	84%	0.835	75%	0.747	S	S	*	*			trans	-138.3	69.9	-178.4	-60.9	-68	0	0	0	112.5
1207	E	25.7	Very low	29.3	Very low	198 Å²	198	143.1 Å²	143.1	93%	0.925	75%	0.748	S	S	*	*			trans	-88.1	125.8	163.7	-167.5	164.5	-132.8	0	0	109.2
1208	L	32.7	Very low	29.3	Very low	163 Å²	163	136.7 Å²	136.7	85%	0.853	73%	0.728	S	S	*	*			trans	-79.7	122.6	-176.5	-78.2	158.2	0	0	0	110.5
1209	S	25	Very low	29.3	Very low	95 Å²	95	138.8 Å²	138.8	66%	0.664	73%	0.728	S	S	*	*			trans	-117.7	101.2	169.9	-170	0	0	0	0	109.7	D1211	S1209-D1211 PolarHBondContact O-N 3.17Å
1210	D	27.3	Very low	29.3	Very low	164 Å²	164	138.5 Å²	138.5	88%	0.877	72%	0.724	S	S	*	*			trans	-75.1	59.9	173.6	-80.8	-46.7	0	0	0	111.2
1211	D	24.9	Very low	28.8	Very low	86 Å²	86	136.8 Å²	136.8	46%	0.46	72%	0.716	S	S	.	*			trans	-104.2	113.4	-178.3	-163.7	-26.5	0	0	0	112.2	S1209 E1213	S1209-D1211 PolarHBondContact O-N 3.17Å; D1211-E1213 PolarHBondContact O-N 3.18Å; D1211-E1213 WeakPolarHBondContact OD1-CB 3.38Å; D1211-E1213 WeakPolarHBondContact OD1-CG 3.27Å; D1211-E1213 PolarHBondContact OD1-N 3.22Å
1212	P	31	Very low	29	Very low	109 Å²	109	134.3 Å²	134.3	71%	0.708	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-71	-7	179.1	30	-35.5	0	0	0	114.7	M1214	P1212-M1214 VanDerWaalsContact C-N 3.33Å; P1212-M1214 PolarHBondContact O-N 3.23Å
1213	E	28.2	Very low	29.2	Very low	113 Å²	113	134.7 Å²	134.7	53%	0.528	70%	0.7	S	S	.	*	G	3₁₀ helix	trans	-77.4	-9	-173.8	-62.7	-154.9	157.5	0	0	115.2	D1211 W1215 V1216	D1211-E1213 PolarHBondContact O-N 3.18Å; D1211-E1213 WeakPolarHBondContact OD1-CB 3.38Å; D1211-E1213 WeakPolarHBondContact OD1-CG 3.27Å; D1211-E1213 PolarHBondContact OD1-N 3.22Å; E1213-W1215 PolarHBondContact O-N 3.02Å; E1213-V1216 WeakPolarHBondContact O-CG2 3.34Å; E1213-V1216 PolarHBondContact O-N 3.22Å
1214	M	27.8	Very low	28.9	Very low	166 Å²	166	136.7 Å²	136.7	82%	0.818	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-61.5	-12.5	-174.6	-155.8	-178.9	-67	0	0	115.1	P1212 V1216	P1212-M1214 VanDerWaalsContact C-N 3.33Å; P1212-M1214 PolarHBondContact O-N 3.23Å; M1214-V1216 PolarHBondContact O-N 3.01Å
1215	W	35.9	Very low	29	Very low	173 Å²	173	135.9 Å²	135.9	66%	0.655	69%	0.689	S	S	*	*	G	3₁₀ helix	trans	-82.6	-0.4	-179.3	-66.1	93.9	0	0	0	115.6	E1213	E1213-W1215 PolarHBondContact O-N 3.02Å
1216	V	31.1	Very low	29.2	Very low	62 Å²	62	135.1 Å²	135.1	38%	0.376	69%	0.691	S	S	.	*			trans	-84.4	-31.3	-171	174.6	0	0	0	0	114.5	V801 E1213 M1214 G1218	V801-V1216 HydrophobicContact CG1-CG1 3.8Å; V801-V1216 HydrophobicContact CG1-CG2 4.34Å; E1213-V1216 WeakPolarHBondContact O-CG2 3.34Å; E1213-V1216 PolarHBondContact O-N 3.22Å; M1214-V1216 PolarHBondContact O-N 3.01Å; V1216-G1218 PolarHBondContact O-N 3.32Å
1217	R	28.7	Very low	29.5	Very low	202 Å²	202	136.6 Å²	136.6	76%	0.762	70%	0.695	S	S	*	*			trans	-85.6	66.5	-172.8	-68.6	-158.1	-173	-137.8	7.4	114.5
1218	G	30.2	Very low	30.3	Very low	36 Å²	36	134.1 Å²	134.1	37%	0.371	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-69.9	130.4	156.8	0	0	0	0	0	111	N802 V1216	N802-G1218 PolarHBondContact ND2-O 2.84Å; V1216-G1218 PolarHBondContact O-N 3.32Å
1219	R	27.3	Very low	31.3	Very low	232 Å²	232	131 Å²	131	88%	0.875	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-68.4	128.2	175.7	-74.6	-169.5	178.8	-152.4	1	110.7
1220	P	26.3	Very low	33.4	Very low	101 Å²	101	131.4 Å²	131.4	66%	0.656	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-75.1	133.6	163.8	31.2	-31.3	0	0	0	109.8
1221	C	25.1	Very low	35.8	Very low	98 Å²	98	123.6 Å²	123.6	66%	0.662	61%	0.606	S	S	*	*			trans	-124.8	104.5	169.3	175.6	0	0	0	0	107.1
1222	E	31.6	Very low	38.5	Very low	122 Å²	122	121.7 Å²	121.7	57%	0.57	60%	0.596	S	S	*	*			trans	-127.8	89	-178.6	-65.4	-147.4	118.1	0	0	111.5	R1230	E1222-R1230 IonicContact OE1-CZ 3.48Å; E1222-R1230 IonicContact OE1-NH1 3.59Å; E1222-R1230 PolarHBondContact OE1-NH1 3.36Å; E1222-R1230 IonicContact OE1-NH2 3.41Å; E1222-R1230 PolarHBondContact OE1-NH2 3.5Å
1223	K	30.6	Very low	41.1	Very low	155 Å²	155	116.5 Å²	116.5	67%	0.674	56%	0.562	S	S	*	*	S	Bend	trans	-151.3	165.2	143.7	-100	146.2	-173.6	-177.7	0	107.6
1224	D	27.1	Very low	44	Very low	132 Å²	132	111.2 Å²	111.2	71%	0.706	54%	0.538	S	S	*	.			trans	56.3	66.5	-171.4	-58.6	-18.1	0	0	0	114.8	V1226 R1228	D1224-V1226 PolarHBondContact O-N 2.69Å; D1224-R1228 PolarHBondContact O-NH2 3.43Å
1225	A	32.2	Very low	47	Very low	95 Å²	95	103.3 Å²	103.3	79%	0.785	50%	0.499	S	S	*	.			trans	-76.3	45.6	177.1	0	0	0	0	0	114.1	R1227	A1225-R1227 PolarHBondContact O-N 3.28Å
1226	V	31.3	Very low	49.8	Very low	123 Å²	123	95 Å²	95	75%	0.745	47%	0.467	S	S	*	.	S	Bend	trans	-72.2	100.7	164.8	-178.5	0	0	0	0	108.3	D1224 R1228	D1224-V1226 PolarHBondContact O-N 2.69Å; V1226-R1228 PolarHBondContact O-N 2.92Å; V1226-R1228 VanDerWaalsContact O-N 3.07Å
1227	R	38.7	Very low	52.9	Low	244 Å²	244	92.2 Å²	92.2	92%	0.921	45%	0.45	S	S	*	.			trans	8.1	82.9	171.9	-68.3	-177.5	177.9	161.1	1	115.4	A1225	A1225-R1227 PolarHBondContact O-N 3.28Å
1228	R	43.3	Very low	56.1	Low	145 Å²	145	82.6 Å²	82.6	55%	0.547	41%	0.414	S	S	.	.			trans	-100.1	141.3	163	-52.3	-176.9	-157.2	161.2	11.9	108.5	D1224 V1226 R1230	D1224-R1228 PolarHBondContact O-NH2 3.43Å; V1226-R1228 PolarHBondContact O-N 2.92Å; V1226-R1228 VanDerWaalsContact O-N 3.07Å; R1228-R1230 WeakPolarHBondContact O-CG 3.48Å; R1228-R1230 PolarHBondContact O-N 3.5Å
1229	D	54.4	Low	59.2	Low	99 Å²	99	80.9 Å²	80.9	53%	0.529	40%	0.396	S	S	.	.			trans	-51.6	121.9	178.8	-57.1	-13.7	0	0	0	111	L735 L1120	L735-D1229 HydrophobicContact CD1-CB 4.26Å; L1120-D1229 HydrophobicContact CD1-CB 4.21Å; L1120-D1229 WeakPolarHBondContact CD1-O 3.45Å
1230	R	69.3	Low	62.3	Low	102 Å²	102	69.8 Å²	69.8	39%	0.385	35%	0.354	S	S	.	.			trans	-135	96.3	-174.8	-83.6	-179.2	175	-145.3	-3.2	110.2	E1222 R1228 I1232	E1222-R1230 IonicContact OE1-CZ 3.48Å; E1222-R1230 IonicContact OE1-NH1 3.59Å; E1222-R1230 PolarHBondContact OE1-NH1 3.36Å; E1222-R1230 IonicContact OE1-NH2 3.41Å; E1222-R1230 PolarHBondContact OE1-NH2 3.5Å; R1228-R1230 WeakPolarHBondContact O-CG 3.48Å; R1228-R1230 PolarHBondContact O-N 3.5Å; R1230-I1232 HydrophobicContact CB-CG1 4.5Å; R1230-I1232 WeakPolarHBondContact O-CG1 3.23Å; R1230-I1232 PolarHBondContact O-N 3.13Å
1231	V	77.4	Confident	65.3	Low	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.336	C	S	.	.			trans	-70.3	116.1	170.1	-177.8	0	0	0	0	109.1	L735 I738 L806 L1115 L1120 L1272 T1273 V1274	L735-V1231 HydrophobicContact CD2-CG2 3.39Å; I738-V1231 HydrophobicContact CD1-CG2 4.34Å; I738-V1231 HydrophobicContact CG2-CG1 4.03Å; L806-V1231 HydrophobicContact CD2-CG1 4.49Å; L1115-V1231 HydrophobicContact CB-CB 4.06Å; L1115-V1231 HydrophobicContact CD2-CB 4.39Å; L1115-V1231 HydrophobicContact CD2-CG2 4.37Å; L1115-V1231 PolarHBondContact N-O 3.08Å; L1120-V1231 HydrophobicContact CD1-CG2 4.32Å; L1120-V1231 HydrophobicContact CD2-CG2 4.35Å; V1231-L1272 HydrophobicContact CG1-CD1 4.1Å; V1231-L1272 HydrophobicContact CG1-CD2 4.3Å; V1231-T1273 WeakPolarHBondContact CA-O 3.35Å; V1231-V1274 HydrophobicContact CG2-CG1 4.3Å; V1231-V1274 HydrophobicContact CG2-CG2 4.36Å
1232	I	81.6	Confident	68.3	Low	46 Å²	46	63.2 Å²	63.2	24%	0.236	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	124.6	174.6	-36.1	-172.8	0	0	0	108.9	T1114 R1230 T1273	T1114-I1232 HydrophobicContact CG2-CB 4.49Å; T1114-I1232 HydrophobicContact CG2-CD1 4.38Å; T1114-I1232 HydrophobicContact CG2-CG1 4.12Å; T1114-I1232 HydrophobicContact CG2-CG2 3.99Å; R1230-I1232 HydrophobicContact CB-CG1 4.5Å; R1230-I1232 WeakPolarHBondContact O-CG1 3.23Å; R1230-I1232 PolarHBondContact O-N 3.13Å; I1232-T1273 WeakPolarHBondContact CB-OG1 3.31Å; I1232-T1273 PolarHBondContact N-O 3.11Å; I1232-T1273 PolarHBondContact O-N 3.49Å
1233	S	85.3	Confident	71	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.007	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	142.4	164.3	-165.9	0	0	0	0	110.4	S814 T1112 S1113	S814-S1233 PolarHBondContact O-OG 3.16Å; T1112-S1233 VanDerWaalsContact CA-O 3.3Å; T1112-S1233 WeakPolarHBondContact CA-O 3.4Å; S1113-S1233 PolarHBondContact N-O 3.25Å; S1113-S1233 PolarHBondContact O-N 3.12Å
1234	A	88.8	Confident	73.8	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.008	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	148.2	175.7	0	0	0	0	0	111.7	Q1064 T1111 T1112 L1270	Q1064-A1234 HydrophobicContact CG-CB 4.12Å; T1111-A1234 VanDerWaalsContact O-CA 3.29Å; T1111-A1234 WeakPolarHBondContact O-CA 3.24Å; T1112-A1234 HydrophobicContact CG2-CB 4.19Å; A1234-L1270 HydrophobicContact CB-CB 4.35Å; A1234-L1270 HydrophobicContact CB-CD1 3.87Å; A1234-L1270 WeakPolarHBondContact O-CB 3.5Å; A1234-L1270 PolarHBondContact O-N 2.82Å; A1234-L1270 VanDerWaalsContact O-N 3.12Å
1235	A	91.4	Very high	76.6	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	160	166.2	0	0	0	0	0	109.6	L815 P816 T1111 W1268	L815-A1235 HydrophobicContact CD2-CB 4.25Å; P816-A1235 HydrophobicContact CG-CB 4.35Å; T1111-A1235 PolarHBondContact N-O 2.9Å; T1111-A1235 PolarHBondContact O-N 3.44Å; T1111-A1235 VanDerWaalsContact O-N 3.09Å; T1111-A1235 PolarHBondContact OG1-O 3.44Å; A1235-W1268 CarbonylContact C-O 3.49Å; A1235-W1268 WeakPolarHBondContact CA-O 3.41Å; A1235-W1268 VanDerWaalsContact CB-O 3.26Å; A1235-W1268 WeakPolarHBondContact CB-O 3.32Å
1236	V	94.5	Very high	79	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.4	171.6	172.8	0	0	0	0	108.5	L1061 C1063 W1068 L1108 V1109 W1268 L1270	L1061-V1236 HydrophobicContact CD2-CB 4.48Å; L1061-V1236 HydrophobicContact CD2-CG1 3.73Å; L1061-V1236 HydrophobicContact CD2-CG2 3.99Å; C1063-V1236 HydrophobicContact CB-CG2 3.89Å; W1068-V1236 HydrophobicContact CD2-CB 4.35Å; W1068-V1236 HydrophobicContact CD2-CG1 3.99Å; W1068-V1236 HydrophobicContact CD2-CG2 4.24Å; W1068-V1236 HydrophobicContact CE3-CB 4.44Å; W1068-V1236 HydrophobicContact CE3-CG1 3.91Å; W1068-V1236 HydrophobicContact CH2-CB 4.04Å; W1068-V1236 HydrophobicContact CH2-CG1 4.35Å; W1068-V1236 HydrophobicContact CH2-CG2 4.46Å; W1068-V1236 HydrophobicContact CZ2-CB 3.92Å; W1068-V1236 HydrophobicContact CZ2-CG1 4.41Å; W1068-V1236 HydrophobicContact CZ2-CG2 3.84Å; W1068-V1236 HydrophobicContact CZ3-CB 4.3Å; W1068-V1236 HydrophobicContact CZ3-CG1 4.1Å; L1108-V1236 HydrophobicContact CD2-CG1 3.99Å; V1109-V1236 CarbonylContact O-C 3.56Å; V1109-V1236 WeakPolarHBondContact O-CA 3.48Å; V1236-W1268 HydrophobicContact CB-CB 4.42Å; V1236-W1268 PolarHBondContact N-O 3.48Å; V1236-W1268 WeakPolarHBondContact O-CA 3.4Å; V1236-W1268 WeakPolarHBondContact O-CB 3.35Å; V1236-W1268 PolarHBondContact O-N 2.94Å; V1236-L1270 HydrophobicContact CG2-CD1 4.32Å
1237	I	95.3	Very high	80.7	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	121.8	179.2	-56	-175.9	0	0	0	108.3	L820 L838 V1109 T1111 L1265 M1266 V1267	L820-I1237 HydrophobicContact CD1-CD1 4.21Å; L820-I1237 HydrophobicContact CD2-CD1 3.83Å; L820-I1237 HydrophobicContact CD2-CG2 4.09Å; L838-I1237 HydrophobicContact CD2-CD1 4.45Å; V1109-I1237 PolarHBondContact N-O 3.08Å; V1109-I1237 PolarHBondContact O-N 3.06Å; T1111-I1237 HydrophobicContact CG2-CD1 3.79Å; T1111-I1237 HydrophobicContact CG2-CG1 4.09Å; I1237-L1265 HydrophobicContact CG2-CB 4.31Å; I1237-L1265 HydrophobicContact CG2-CD2 4.41Å; I1237-M1266 WeakPolarHBondContact CA-O 3.47Å; I1237-V1267 HydrophobicContact CD1-CG1 4.44Å; I1237-V1267 HydrophobicContact CD1-CG2 4.24Å; I1237-V1267 HydrophobicContact CG1-CG1 4.22Å; I1237-V1267 HydrophobicContact CG1-CG2 4.2Å; I1237-V1267 HydrophobicContact CG2-CG2 4.41Å
1238	S	96.3	Very high	81.5	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	140.5	172.7	67.9	0	0	0	0	110.7	I1076 H1101 F1107 L1265 M1266	I1076-S1238 WeakPolarHBondContact CD1-OG 3.46Å; H1101-S1238 PolarHBondContact NE2-OG 3.47Å; F1107-S1238 WeakPolarHBondContact O-CA 3.38Å; S1238-L1265 WeakPolarHBondContact O-CA 3.47Å; S1238-M1266 PolarHBondContact N-O 3.36Å; S1238-M1266 PolarHBondContact O-N 3Å
1239	G	95	Very high	81.6	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141.2	171.9	0	0	0	0	0	111	V1105 D1106 F1107	V1105-G1239 CarbonylContact C-O 3.58Å; D1106-G1239 PolarHBondContact N-O 3.34Å; F1107-G1239 PolarHBondContact O-N 3.31Å; F1107-G1239 VanDerWaalsContact O-N 3.15Å
1240	G	92.6	Very high	80.9	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.3	174.3	173.7	0	0	0	0	0	112.5	H1101 P1104 G1242 T1264	H1101-G1240 PolarHBondContact CE1-N 2.94Å; P1104-G1240 WeakPolarHBondContact O-CA 3.28Å; G1240-G1242 PolarHBondContact O-N 3.46Å; G1240-T1264 PolarHBondContact N-O 3.5Å; G1240-T1264 PolarHBondContact O-N 3.19Å
1241	K	89.3	Confident	79.5	Confident	60 Å²	60	38.3 Å²	38.3	26%	0.261	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	121.6	175.6	-63.2	-144.7	167.6	-162.9	0	111	P789 R791 C1102 G1103 N1263	P789-K1241 PolarHBondContact O-NZ 3.17Å; R791-K1241 PolarHBondContact O-NZ 2.87Å; C1102-K1241 WeakPolarHBondContact CA-O 3.17Å; C1102-K1241 VanDerWaalsContact CB-O 3.3Å; C1102-K1241 WeakPolarHBondContact CB-O 3.22Å; C1102-K1241 PolarHBondContact N-O 3.04Å; G1103-K1241 PolarHBondContact N-O 3.41Å; K1241-N1263 WeakPolarHBondContact CE-OD1 3.43Å
1242	G	88.4	Confident	77.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.25	C	C	.	.			trans	67.6	177.1	176.7	0	0	0	0	0	115.8	H1101 G1240 S1260 E1262	H1101-G1242 PolarHBondContact ND1-O 3.01Å; G1240-G1242 PolarHBondContact O-N 3.46Å; G1242-S1260 WeakPolarHBondContact CA-O 3.28Å; G1242-E1262 WeakPolarHBondContact CA-O 3.42Å; G1242-E1262 PolarHBondContact N-O 2.59Å
1243	F	89.6	Confident	75.8	Confident	40 Å²	40	46 Å²	46	18%	0.175	28%	0.277	C	S	.	.			trans	-133.5	137.1	171.3	166.4	-92.6	0	0	0	109.2	L777 H780 N1099 T1264 M1266	L777-F1243 HydrophobicContact CD2-CE2 3.93Å; L777-F1243 HydrophobicContact CD2-CZ 4.47Å; H780-F1243 HydrophobicContact CB-CD2 4.38Å; H780-F1243 AromaticContact CD2-CE2 3.87Å; H780-F1243 AromaticContact CD2-CZ 3.91Å; H780-F1243 AromaticContact NE2-CD1 3.97Å; H780-F1243 AromaticContact NE2-CE1 3.8Å; N1099-F1243 HydrophobicContact CB-CE2 4.06Å; F1243-T1264 HydrophobicContact CB-CG2 4.11Å; F1243-M1266 HydrophobicContact CD2-CE 4.15Å; F1243-M1266 HydrophobicContact CD2-CG 4.18Å; F1243-M1266 HydrophobicContact CD2-SD 3.82Å; F1243-M1266 HydrophobicContact CE2-CE 4.11Å; F1243-M1266 HydrophobicContact CE2-SD 4.39Å
1244	R	88.2	Confident	73.6	Confident	68 Å²	68	50.3 Å²	50.3	26%	0.257	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	150.9	171.6	64.1	177.8	-165.1	-124.3	-12.7	110.7	Q1073 A1100 H1101 C1102	Q1073-R1244 PolarHBondContact O-NH2 3.07Å; A1100-R1244 HydrophobicContact CB-CG 4.23Å; A1100-R1244 PolarHBondContact N-O 3.29Å; A1100-R1244 PolarHBondContact O-N 2.91Å; A1100-R1244 VanDerWaalsContact O-O 3.06Å; H1101-R1244 PolarHBondContact O-NE 3.49Å; H1101-R1244 PolarHBondContact O-NH1 2.96Å; H1101-R1244 PolarHBondContact O-NH2 2.82Å; C1102-R1244 PolarHBondContact O-NH1 3.27Å; C1102-R1244 VanDerWaalsContact O-NH1 3.11Å
1245	R	86.7	Confident	71.5	Confident	70 Å²	70	60.5 Å²	60.5	26%	0.264	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	119.9	172.5	-173.5	166.7	168.5	-127.3	-0.3	110	E753 S756 L1098 N1099	E753-R1245 PolarHBondContact O-NH1 3.47Å; E753-R1245 PolarHBondContact O-NH2 2.89Å; E753-R1245 IonicContact OE1-CZ 3.49Å; E753-R1245 IonicContact OE1-NH1 3.28Å; E753-R1245 PolarHBondContact OE1-NH1 3.3Å; S756-R1245 PolarHBondContact O-NH2 3.14Å; S756-R1245 PolarHBondContact OG-NH2 3.25Å; L1098-R1245 CarbonylContact O-C 3.6Å; L1098-R1245 WeakPolarHBondContact O-CA 3.34Å; N1099-R1245 WeakPolarHBondContact OD1-CD 3.42Å
1246	L	81.1	Confident	69.1	Low	23 Å²	23	64.7 Å²	64.7	12%	0.12	37%	0.371	C	S	.	.			trans	-70.4	129.2	-179.5	-55.7	170.2	0	0	0	109.3	L1075 L1098 A1100	L1075-L1246 HydrophobicContact CD2-CD1 3.57Å; L1098-L1246 HydrophobicContact CD2-CB 4.08Å; L1098-L1246 WeakPolarHBondContact O-CB 3.21Å; L1098-L1246 WeakPolarHBondContact O-CG 3.41Å; L1098-L1246 PolarHBondContact O-N 3.44Å; A1100-L1246 HydrophobicContact CB-CD1 4.29Å; A1100-L1246 HydrophobicContact CB-CG 4.36Å
1247	K	68.6	Low	66.4	Low	137 Å²	137	71.4 Å²	71.4	60%	0.596	42%	0.418	S	S	*	.			trans	-107.5	137.3	176.9	-66.4	-175.6	178.5	-178	0	110.1	I1250	K1247-I1250 HydrophobicContact CB-CD1 4.43Å; K1247-I1250 HydrophobicContact CD-CD1 4.21Å
1248	E	54	Low	64	Low	107 Å²	107	74.3 Å²	74.3	50%	0.5	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	134.4	172	-66.4	176.9	150.8	0	0	110.2	R757 I1250	R757-E1248 IonicContact CZ-OE1 3.5Å; R757-E1248 IonicContact CZ-OE2 3.69Å; R757-E1248 VanDerWaalsContact CZ-OE2 3.28Å; R757-E1248 IonicContact NH1-OE1 3.26Å; R757-E1248 IonicContact NH1-OE2 3.95Å; R757-E1248 PolarHBondContact NH1-OE2 2.91Å; R757-E1248 IonicContact NH2-OE1 2.83Å; R757-E1248 PolarHBondContact NH2-OE1 3.06Å; R757-E1248 IonicContact NH2-OE2 3.61Å; R757-E1248 PolarHBondContact NH2-OE2 3.37Å; E1248-I1250 PolarHBondContact O-N 3.14Å
1249	G	46.5	Very low	62	Low	88 Å²	88	77 Å²	77	91%	0.907	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	-8.9	169.3	0	0	0	0	0	118.1
1250	I	38.9	Very low	60.4	Low	106 Å²	106	79.4 Å²	79.4	54%	0.544	48%	0.48	S	S	.	.			trans	-97.5	126.4	178	-60.5	177.8	0	0	0	110.7	K1247 E1248	K1247-I1250 HydrophobicContact CB-CD1 4.43Å; K1247-I1250 HydrophobicContact CD-CD1 4.21Å; E1248-I1250 PolarHBondContact O-N 3.14Å
1251	G	40.9	Very low	59.5	Low	56 Å²	56	85.8 Å²	85.8	58%	0.577	51%	0.513	S	S	*	.			trans	-68	146.3	175.9	0	0	0	0	0	113.1	G1253 S1254	G1251-G1253 PolarHBondContact O-N 2.82Å; G1251-S1254 PolarHBondContact O-N 2.88Å
1252	V	41.3	Very low	59.3	Low	129 Å²	129	86 Å²	86	78%	0.782	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	2.9	-168.8	-169.6	0	0	0	0	114.8
1253	G	40.1	Very low	59.3	Low	78 Å²	78	86.5 Å²	86.5	80%	0.804	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-27.7	175.1	0	0	0	0	0	114.8	G1251 R1255	G1251-G1253 PolarHBondContact O-N 2.82Å; G1253-R1255 PolarHBondContact O-N 2.89Å; G1253-R1255 VanDerWaalsContact O-N 3.16Å
1254	S	38.8	Very low	59.4	Low	92 Å²	92	84.9 Å²	84.9	64%	0.643	51%	0.511	S	S	*	.			trans	-86.8	87.4	-177.9	-166.2	0	0	0	0	111.2	G1251 T1256	G1251-S1254 PolarHBondContact O-N 2.88Å; S1254-T1256 PolarHBondContact O-N 3.14Å
1255	R	43.2	Very low	59.7	Low	215 Å²	215	81.7 Å²	81.7	81%	0.811	50%	0.499	S	S	*	.			trans	-64.5	124.3	165	-73.7	-177.9	176.9	175.1	-1.7	108.9	G1253	G1253-R1255 PolarHBondContact O-N 2.89Å; G1253-R1255 VanDerWaalsContact O-N 3.16Å
1256	T	41.7	Very low	60	Low	87 Å²	87	78.4 Å²	78.4	53%	0.534	49%	0.487	S	S	.	.			trans	-62.8	140	166.1	25.1	0	0	0	0	109.9	S1254 G1258 D1259	S1254-T1256 PolarHBondContact O-N 3.14Å; T1256-G1258 PolarHBondContact O-N 3.31Å; T1256-D1259 PolarHBondContact O-N 2.87Å; T1256-D1259 PolarHBondContact OG1-OD1 2.91Å
1257	S	39	Very low	60.6	Low	141 Å²	141	77.3 Å²	77.3	99%	0.986	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	26.7	-171.9	48.3	0	0	0	0	114.8
1258	G	44.5	Very low	61.8	Low	63 Å²	63	70.8 Å²	70.8	65%	0.649	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142	6.9	-178.5	0	0	0	0	0	115.1	T1256 S1260	T1256-G1258 PolarHBondContact O-N 3.31Å; G1258-S1260 PolarHBondContact O-N 3.15Å
1259	D	54.2	Low	63.4	Low	56 Å²	56	65.7 Å²	65.7	30%	0.299	43%	0.429	S	S	.	.			trans	-65.2	94.6	-179.1	-66.3	14.9	0	0	0	111.1	T1256	T1256-D1259 PolarHBondContact O-N 2.87Å; T1256-D1259 PolarHBondContact OG1-OD1 2.91Å
1260	S	60.8	Low	65.4	Low	52 Å²	52	61.8 Å²	61.8	36%	0.364	39%	0.387	S	S	.	.			trans	-73.3	133.4	177.2	65	0	0	0	0	111.3	G1242 G1258 E1262	G1242-S1260 WeakPolarHBondContact CA-O 3.28Å; G1258-S1260 PolarHBondContact O-N 3.15Å; S1260-E1262 PolarHBondContact O-N 3.34Å
1261	L	73.7	Confident	67.3	Low	134 Å²	134	59 Å²	59	70%	0.702	38%	0.376	S	S	*	.			trans	-85.6	13.3	177.1	-67.9	171.1	0	0	0	113
1262	E	85.2	Confident	68.9	Low	63 Å²	63	57.2 Å²	57.2	29%	0.294	35%	0.353	S	S	.	.	S	Bend	trans	-74.2	140.8	-177.3	-74.8	162.5	-147.5	0	0	111.2	K787 G1242 S1260 T1264	K787-E1262 VanDerWaalsContact NZ-CD 3.26Å; K787-E1262 IonicContact NZ-OE1 3.05Å; K787-E1262 PolarHBondContact NZ-OE1 2.79Å; K787-E1262 IonicContact NZ-OE2 3.18Å; K787-E1262 PolarHBondContact NZ-OE2 2.74Å; K787-E1262 VanDerWaalsContact NZ-OE2 3.13Å; G1242-E1262 WeakPolarHBondContact CA-O 3.42Å; G1242-E1262 PolarHBondContact N-O 2.59Å; S1260-E1262 PolarHBondContact O-N 3.34Å; E1262-T1264 PolarHBondContact O-N 2.65Å; E1262-T1264 VanDerWaalsContact O-N 3.17Å; E1262-T1264 PolarHBondContact O-OG1 2.81Å
1263	N	88.7	Confident	70.3	Confident	11 Å²	11	53.8 Å²	53.8	6%	0.059	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	121.4	175.6	-66.8	-38.2	0	0	0	109.4	P782 V783 F784 R791 L793 K1241	P782-N1263 CarbonylContact C-O 3.56Å; P782-N1263 WeakPolarHBondContact CA-O 3.36Å; V783-N1263 HydrophobicContact CB-CB 4.16Å; V783-N1263 HydrophobicContact CG2-CB 4.16Å; V783-N1263 PolarHBondContact N-O 2.75Å; F784-N1263 HydrophobicContact CD2-CB 4.28Å; F784-N1263 HydrophobicContact CE2-CB 4.31Å; R791-N1263 PolarHBondContact O-ND2 3.13Å; L793-N1263 HydrophobicContact CD1-CB 4.15Å; L793-N1263 HydrophobicContact CD2-CB 4.12Å; L793-N1263 HydrophobicContact CG-CB 4.07Å; K1241-N1263 WeakPolarHBondContact CE-OD1 3.43Å
1264	T	91.6	Very high	71.2	Confident	6 Å²	6	54.9 Å²	54.9	4%	0.037	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	136	-168	-62.7	0	0	0	0	110.6	H780 M781 H1101 G1240 F1243 E1262	H780-T1264 HydrophobicContact CB-CG2 4.2Å; M781-T1264 CarbonylContact O-C 3.58Å; M781-T1264 WeakPolarHBondContact O-CA 3.29Å; H1101-T1264 PolarHBondContact CE1-O 3.29Å; H1101-T1264 VanDerWaalsContact CE1-O 3.29Å; G1240-T1264 PolarHBondContact N-O 3.5Å; G1240-T1264 PolarHBondContact O-N 3.19Å; F1243-T1264 HydrophobicContact CB-CG2 4.11Å; E1262-T1264 PolarHBondContact O-N 2.65Å; E1262-T1264 VanDerWaalsContact O-N 3.17Å; E1262-T1264 PolarHBondContact O-OG1 2.81Å
1265	L	93.8	Very high	72.8	Confident	2 Å²	2	53 Å²	53	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	142.1	165.9	-54.4	179.9	0	0	0	109.9	H780 M781 V783 L820 V822 F836 F1107 I1237 S1238	H780-L1265 CarbonylContact C-O 3.53Å; H780-L1265 WeakPolarHBondContact CA-O 3.35Å; H780-L1265 WeakPolarHBondContact CB-O 3.34Å; M781-L1265 HydrophobicContact CG-CB 4.22Å; M781-L1265 HydrophobicContact CG-CD1 4.41Å; M781-L1265 PolarHBondContact N-O 3.47Å; M781-L1265 PolarHBondContact O-N 3.01Å; M781-L1265 HydrophobicContact SD-CD1 4.45Å; V783-L1265 HydrophobicContact CG2-CD2 3.65Å; V783-L1265 HydrophobicContact CG2-CG 3.69Å; L820-L1265 HydrophobicContact CD2-CD1 3.87Å; V822-L1265 HydrophobicContact CG1-CD2 4.42Å; V822-L1265 HydrophobicContact CG2-CD1 4.2Å; V822-L1265 HydrophobicContact CG2-CD2 4.3Å; F836-L1265 HydrophobicContact CD2-CD1 4.4Å; F836-L1265 HydrophobicContact CE1-CD1 4.46Å; F836-L1265 HydrophobicContact CE2-CD1 4.15Å; F836-L1265 HydrophobicContact CZ-CD1 4.19Å; F1107-L1265 HydrophobicContact CE2-CD2 4.27Å; F1107-L1265 HydrophobicContact CZ-CD2 3.7Å; I1237-L1265 HydrophobicContact CG2-CB 4.31Å; I1237-L1265 HydrophobicContact CG2-CD2 4.41Å; S1238-L1265 WeakPolarHBondContact O-CA 3.47Å
1266	M	94.3	Very high	74.4	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	127.9	165.9	-65	170.4	57.5	0	0	109.2	L777 H780 N1099 I1237 S1238 F1243 W1268	L777-M1266 HydrophobicContact CD1-CB 3.85Å; L777-M1266 HydrophobicContact CD1-CE 4.04Å; L777-M1266 HydrophobicContact CD1-CG 4.43Å; L777-M1266 HydrophobicContact CD2-CE 4.11Å; H780-M1266 HydrophobicContact CB-CG 4Å; N1099-M1266 HydrophobicContact CB-CE 3.56Å; I1237-M1266 WeakPolarHBondContact CA-O 3.47Å; S1238-M1266 PolarHBondContact N-O 3.36Å; S1238-M1266 PolarHBondContact O-N 3Å; F1243-M1266 HydrophobicContact CD2-CE 4.15Å; F1243-M1266 HydrophobicContact CD2-CG 4.18Å; F1243-M1266 HydrophobicContact CD2-SD 3.82Å; F1243-M1266 HydrophobicContact CE2-CE 4.11Å; F1243-M1266 HydrophobicContact CE2-SD 4.39Å; M1266-W1268 HydrophobicContact CE-CZ2 3.63Å
1267	V	93.4	Very high	76.2	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.006	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	108	-174.4	-177.3	0	0	0	0	109.8	A778 C779 M781 L815 I1237	A778-V1267 PolarHBondContact N-O 3.34Å; C779-V1267 PolarHBondContact O-N 3.17Å; M781-V1267 HydrophobicContact CE-CG2 3.9Å; L815-V1267 HydrophobicContact CD1-CG1 4.21Å; L815-V1267 HydrophobicContact CD2-CG1 3.53Å; I1237-V1267 HydrophobicContact CD1-CG1 4.44Å; I1237-V1267 HydrophobicContact CD1-CG2 4.24Å; I1237-V1267 HydrophobicContact CG1-CG1 4.22Å; I1237-V1267 HydrophobicContact CG1-CG2 4.2Å; I1237-V1267 HydrophobicContact CG2-CG2 4.41Å
1268	W	92.6	Very high	78.4	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	108.4	179.9	-63.7	91.3	0	0	0	110.8	W759 P775 L776 L777 W1068 I1076 S1097 N1099 A1235 V1236 M1266	W759-W1268 AromaticContact CE2-CZ3 3.76Å; W759-W1268 HydrophobicContact CZ2-CD2 4.46Å; W759-W1268 AromaticContact CZ2-CE3 3.84Å; W759-W1268 HydrophobicContact CZ2-CE3 3.84Å; W759-W1268 AromaticContact CZ2-CH2 3.94Å; W759-W1268 HydrophobicContact CZ2-CH2 3.94Å; W759-W1268 AromaticContact CZ2-CZ3 3.55Å; W759-W1268 HydrophobicContact CZ2-CZ3 3.55Å; W759-W1268 AromaticContact NE1-CZ3 3.65Å; P775-W1268 HydrophobicContact CB-CB 4.41Å; P775-W1268 HydrophobicContact CB-CE3 4.2Å; L776-W1268 CarbonylContact O-C 3.58Å; L776-W1268 WeakPolarHBondContact O-CA 3.29Å; L777-W1268 HydrophobicContact CB-CE3 4.12Å; L777-W1268 HydrophobicContact CB-CH2 4.27Å; L777-W1268 HydrophobicContact CB-CZ3 3.98Å; L777-W1268 HydrophobicContact CD1-CD2 4.37Å; W1068-W1268 HydrophobicContact CH2-CB 3.65Å; W1068-W1268 HydrophobicContact CH2-CD2 4.2Å; W1068-W1268 AromaticContact CH2-CG 3.79Å; W1068-W1268 HydrophobicContact CH2-CG 3.79Å; W1068-W1268 HydrophobicContact CZ3-CB 4.21Å; W1068-W1268 HydrophobicContact CZ3-CD2 4.23Å; W1068-W1268 AromaticContact CZ3-CG 3.9Å; W1068-W1268 HydrophobicContact CZ3-CG 3.9Å; I1076-W1268 HydrophobicContact CD1-CZ2 4.37Å; S1097-W1268 WeakPolarHBondContact OG-CH2 3.42Å; S1097-W1268 VanDerWaalsContact OG-CZ2 3.3Å; S1097-W1268 WeakPolarHBondContact OG-CZ2 3.49Å; N1099-W1268 HydrophobicContact CB-CH2 4.03Å; N1099-W1268 HydrophobicContact CB-CZ2 4.08Å; A1235-W1268 CarbonylContact C-O 3.49Å; A1235-W1268 WeakPolarHBondContact CA-O 3.41Å; A1235-W1268 VanDerWaalsContact CB-O 3.26Å; A1235-W1268 WeakPolarHBondContact CB-O 3.32Å; V1236-W1268 HydrophobicContact CB-CB 4.42Å; V1236-W1268 PolarHBondContact N-O 3.48Å; V1236-W1268 WeakPolarHBondContact O-CA 3.4Å; V1236-W1268 WeakPolarHBondContact O-CB 3.35Å; V1236-W1268 PolarHBondContact O-N 2.94Å; M1266-W1268 HydrophobicContact CE-CZ2 3.63Å
1269	Q	89.2	Confident	80.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	139.2	176.1	-161.5	-162.4	-25.3	0	0	110.9	L746 I749 L776 A778 S814 L815	L746-Q1269 HydrophobicContact CD2-CB 4.47Å; L746-Q1269 VanDerWaalsContact CD2-CD 3.46Å; L746-Q1269 HydrophobicContact CD2-CG 4.2Å; I749-Q1269 VanDerWaalsContact CD1-OE1 3.31Å; L776-Q1269 PolarHBondContact N-O 3.07Å; L776-Q1269 PolarHBondContact O-N 3.38Å; A778-Q1269 HydrophobicContact CB-CB 4.16Å; S814-Q1269 VanDerWaalsContact CB-CD 3.44Å; S814-Q1269 PolarHBondContact O-NE2 2.99Å; L815-Q1269 HydrophobicContact CD2-CG 4.47Å
1270	L	86.8	Confident	82.3	Confident	5 Å²	5	33.2 Å²	33.2	3%	0.026	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-103.5	160.3	171.1	-66.5	158.1	0	0	0	110.9	P775 C1063 Q1064 L1066 W1068 A1234 V1236	P775-L1270 HydrophobicContact CB-CD2 3.97Å; P775-L1270 HydrophobicContact CG-CD2 3.86Å; C1063-L1270 HydrophobicContact CB-CD1 4.5Å; Q1064-L1270 HydrophobicContact CB-CD1 4.37Å; Q1064-L1270 HydrophobicContact CG-CD1 4.26Å; Q1064-L1270 VanDerWaalsContact OE1-CB 3.31Å; L1066-L1270 HydrophobicContact CD1-CD2 4.32Å; W1068-L1270 HydrophobicContact CZ2-CD2 4.37Å; A1234-L1270 HydrophobicContact CB-CB 4.35Å; A1234-L1270 HydrophobicContact CB-CD1 3.87Å; A1234-L1270 WeakPolarHBondContact O-CB 3.5Å; A1234-L1270 PolarHBondContact O-N 2.82Å; A1234-L1270 VanDerWaalsContact O-N 3.12Å; V1236-L1270 HydrophobicContact CG2-CD1 4.32Å
1271	P	79	Confident	83.8	Confident	47 Å²	47	31.9 Å²	31.9	31%	0.305	18%	0.179	S	C	.	.	P	Polyproline II helix	trans	-59.7	150.2	168.5	-22.8	34.8	0	0	0	112.8	L746 Q1064 T1273	L746-P1271 HydrophobicContact CD1-CB 4.45Å; Q1064-P1271 PolarHBondContact NE2-O 2.56Å; Q1064-P1271 PolarHBondContact OE1-O 3.32Å; P1271-T1273 PolarHBondContact O-N 2.96Å
1272	L	75.5	Confident	84.6	Confident	20 Å²	20	24 Å²	24	11%	0.105	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-62.8	132.6	168.1	-67.8	178.6	0	0	0	110.2	I738 N742 V1231 V1274	I738-L1272 HydrophobicContact CG2-CD1 3.57Å; N742-L1272 HydrophobicContact CB-CD1 3.53Å; N742-L1272 HydrophobicContact CB-CG 4.12Å; N742-L1272 VanDerWaalsContact CG-CD1 3.48Å; N742-L1272 VanDerWaalsContact CG-CG 3.47Å; N742-L1272 WeakPolarHBondContact OD1-CG 3.41Å; V1231-L1272 HydrophobicContact CG1-CD1 4.1Å; V1231-L1272 HydrophobicContact CG1-CD2 4.3Å; L1272-V1274 HydrophobicContact CB-CG2 4.12Å
1273	T	70.9	Confident	84.5	Confident	57 Å²	57	20.8 Å²	20.8	35%	0.35	13%	0.125	S	C	.	.	B	Isolated β-bridge	trans	-84.5	137	155.6	49.6	0	0	0	0	108.4	V1231 I1232 P1271	V1231-T1273 WeakPolarHBondContact CA-O 3.35Å; I1232-T1273 WeakPolarHBondContact CB-OG1 3.31Å; I1232-T1273 PolarHBondContact N-O 3.11Å; I1232-T1273 PolarHBondContact O-N 3.49Å; P1271-T1273 PolarHBondContact O-N 2.96Å
1274	V	58.4	Low	84.1	Confident	100 Å²	100	21.6 Å²	21.6	61%	0.606	13%	0.131	S	C	*	.			trans	-135.5	0	-174.3	178.6	0	0	0	0	108.4	L735 V1231 L1272	L735-V1274 HydrophobicContact CD1-CG1 4.46Å; L735-V1274 HydrophobicContact CD2-CG1 3.91Å; V1231-V1274 HydrophobicContact CG2-CG1 4.3Å; V1231-V1274 HydrophobicContact CG2-CG2 4.36Å; L1272-V1274 HydrophobicContact CB-CG2 4.12Å

Retrieved 1,274 of 1,274 residues in 1744.1 ms (Link to these results)

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