X2JIJ6_DROME Loading...

Glutamate receptor interacting protein, isoform B

AlphaFold DB , UniProt , Accession X2JIJ6, Species DROME (Drosophila melanogaster, Fruit fly), Gene Grip, Length 1,057 aa.

						>X2JIJ6_DROME|X2JIJ6|Grip
MKLWKSKKPIGGCVPGKSAALKQDQQQQQQQQQESHNNSFNGHHHPPTDTALAPMLSVDRAMSPAQSEDSGLAPERGTTYATITLPRNALHLAITFAERNDLSYPPVVGSLNPVGHAADFLAPGDRLHQIDGISTIGLSNQKVMNMLCAGGSDACPAIVEIEYSLPECISQNSLCVTSKLAQITVERESGCLGLTLRGGADYPLIVTHVRPHGPVYKTGRIKPGDRLLRVDNVSLIGKTLAEAQQIIKCGGHVSGYTNLTIEYDVSVVQSVEFSMGPLLIEIERPMNDKLGLVLCNYTAAVPASGSGSSTPSSGEKIEESAGVFIASILPASIADRCGALSVGDQVLSIDDTMIEHTAFSPDEVMTILDTSTGRGYTQMQIMPAHALARRGHTTLGSPKYSFSTLESRKSSTAGRQRQRFARKSSLPLENPACGTPGSTGGSMGTGGIHGSSSLGMGLGLCRAESFPVLLDCSHGAGIILSETVSGSGGSGAVAIAQIVPDSVADRSGCIQAGDRIVAINKMYSLDAAAMRQLLEGGSSRNGASNGTPANWLELEIEFDMPDAVVPASGVFSVKLLRAGKCGLGLSVSGSSHGGLVISDVKMGSPAHRSGSLRSGDILLAVDQHPVQHFNVDALLKEEGRSQNPSHSSSDFTTLTIKRIVLPDFLPMSSPIYSNCPASGINLGMGMGVSTSTDHDLYSSAYVTAGKYADCVSLKSRTPQPDYFRVPSMDDASLQSVQLRSGSGSNGGNQAANSWSTGVNSRSYVAPPNTQSLTTELPEEEDEQEQMYPGYELNRYASVDCTALPPPMENKVYGSAASSSSKSSGSSLHQIIFTVRLEPKGGLLGITLAGSEDITKSITISGLVEGGIAHKNGQIHVGDQLLAIDEHSVQGMPLSHATSLLQNLGDLVDLKILRSHDLANGSHLPQTQAIYAKVQRRPRSPSANTEASKESGSGNANGGGAVNGNSGSGKPRVFHVTLYKDKVYDDYGFSVSDGLYERGVFINRIRSGGPADMCGLLKPFDRIMQVNEMKTQDFDCCLTVPLIAAAGDKIEMIMQRSE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.6	Very low	32.9	Very low	237 Å²	237	157.6 Å²	157.6	100%	1.167	80%	0.796	S	S	*	*				0	149.6	0	-76.1	174.6	168	0	0	109
2	K	31.5	Very low	32.3	Very low	189 Å²	189	150.7 Å²	150.7	82%	0.822	79%	0.793	S	S	*	*			trans	51.7	101.9	162.3	-64.6	-177.5	177.6	-179.1	0	118.1
3	L	31	Very low	31.8	Very low	127 Å²	127	149.5 Å²	149.5	67%	0.665	80%	0.803	S	S	*	*				92.7	134.7	64.3	-93.4	67.7	0	0	0	111.5
4	W	30.2	Very low	31.4	Very low	186 Å²	186	148.2 Å²	148.2	71%	0.705	80%	0.802	S	S	*	*			cis	-169.8	140.3	-7.1	-121.3	1.3	0	0	0	113.5
5	K	36.6	Very low	32.2	Very low	157 Å²	157	146.9 Å²	146.9	68%	0.683	80%	0.804	S	S	*	*			trans	59.5	162.2	140.4	-62.6	169.3	179.8	167.1	0	118.8
6	S	30.7	Very low	31.7	Very low	99 Å²	99	142.3 Å²	142.3	69%	0.692	80%	0.801	S	S	*	*			cis	-154.9	148.8	15.7	-156.3	0	0	0	0	115.8
7	K	31.1	Very low	31.5	Very low	193 Å²	193	146.4 Å²	146.4	84%	0.839	81%	0.808	S	S	*	*			trans	21.4	120.3	148.2	-63.4	-177.4	174.1	-174.7	0	123.6
8	K	30.7	Very low	31.2	Very low	199 Å²	199	145.3 Å²	145.3	87%	0.865	81%	0.813	S	S	*	*				-2.8	168.7	114.1	-95.2	-175.8	-178.5	-178.3	0	119.3
9	P	50.3	Low	31.1	Very low	100 Å²	100	142.9 Å²	142.9	65%	0.649	81%	0.813	S	S	*	*			cis	-145.1	-163.5	-8.2	31.1	-4.4	0	0	0	115.8
10	I	29.1	Very low	31.1	Very low	169 Å²	169	139.9 Å²	139.9	87%	0.867	81%	0.807	S	S	*	*			trans	80.5	134.5	157.8	-52.6	172.3	0	0	0	117.9
11	G	28.7	Very low	31.2	Very low	78 Å²	78	140.9 Å²	140.9	80%	0.804	81%	0.808	S	S	*	*			trans	150.9	90.5	162.4	0	0	0	0	0	113.4
12	G	25.9	Very low	31.2	Very low	74 Å²	74	138.4 Å²	138.4	76%	0.763	79%	0.791	S	S	*	*			trans	-123.5	137.2	170.9	0	0	0	0	0	110.9
13	C	26	Very low	31.1	Very low	136 Å²	136	137.4 Å²	137.4	92%	0.919	79%	0.789	S	S	*	*			trans	-162.7	157.4	159.1	-115.6	0	0	0	0	111.9
14	V	26.1	Very low	31.1	Very low	131 Å²	131	137.5 Å²	137.5	79%	0.794	79%	0.79	S	S	*	*			trans	-128.1	167.9	-177.6	169.7	0	0	0	0	105.8
15	P	43.4	Very low	31.3	Very low	128 Å²	128	137.5 Å²	137.5	83%	0.831	80%	0.798	S	S	*	*			cis	-113.9	-150	-23.5	36.3	-18.5	0	0	0	110
16	G	24.1	Very low	31.3	Very low	73 Å²	73	137.7 Å²	137.7	75%	0.753	80%	0.802	S	S	*	*			trans	167.6	101.9	149.4	0	0	0	0	0	116.3
17	K	28.3	Very low	31.6	Very low	212 Å²	212	139.5 Å²	139.5	92%	0.922	80%	0.799	S	S	*	*			trans	-80.5	138.9	165.1	-64.7	176.6	-179.5	177.3	0	109.9
18	S	26.2	Very low	31.7	Very low	128 Å²	128	137.9 Å²	137.9	90%	0.895	80%	0.795	S	S	*	*			trans	-138.7	135.6	154.7	-76.2	0	0	0	0	110.1
19	A	28.9	Very low	31.9	Very low	99 Å²	99	135.8 Å²	135.8	82%	0.818	79%	0.788	S	S	*	*			trans	-126.5	-171.6	169.3	0	0	0	0	0	108.4
20	A	31.1	Very low	31	Very low	82 Å²	82	138.2 Å²	138.2	68%	0.678	79%	0.791	S	S	*	*			trans	85.5	112.6	-167.8	0	0	0	0	0	112.1
21	L	33	Very low	31.2	Very low	162 Å²	162	137 Å²	137	85%	0.848	78%	0.781	S	S	*	*				75.3	142.6	79.4	-67.2	157.9	0	0	0	111.3
22	K	33.3	Very low	31.2	Very low	184 Å²	184	140.4 Å²	140.4	80%	0.8	78%	0.776	S	S	*	*			cis	-160.6	-164	33.2	-146.8	170.4	-175.4	-177.3	0	111.4
23	Q	29.6	Very low	31.4	Very low	169 Å²	169	143.5 Å²	143.5	79%	0.79	77%	0.771	S	S	*	*			trans	89.1	136.8	169.1	-52.4	-152.3	-90.6	0	0	116.7
24	D	30.9	Very low	31.4	Very low	128 Å²	128	144.5 Å²	144.5	68%	0.684	76%	0.762	S	S	*	*			cis	-163	173.7	-21.4	-119.3	-43.3	0	0	0	113.1
25	Q	33.7	Very low	31.4	Very low	186 Å²	186	143.2 Å²	143.2	87%	0.869	76%	0.759	S	S	*	*			trans	87.5	146.7	154	-145.5	153.2	104.3	0	0	120.6
26	Q	36.6	Very low	30.5	Very low	161 Å²	161	144.9 Å²	144.9	75%	0.752	76%	0.755	S	S	*	*			trans	-116.6	176.8	-172.5	-67.9	-179.5	-15	0	0	110
27	Q	37.4	Very low	30.6	Very low	138 Å²	138	147.3 Å²	147.3	65%	0.645	75%	0.751	S	S	*	*			cis	-145	-143.1	8.1	-138.4	174	83.5	0	0	107.3
28	Q	33.2	Very low	30.4	Very low	158 Å²	158	143.8 Å²	143.8	74%	0.738	74%	0.742	S	S	*	*			cis	-143	-103.5	3.7	-163.9	150.7	70.7	0	0	113.7
29	Q	34.5	Very low	30.4	Very low	156 Å²	156	143 Å²	143	73%	0.729	74%	0.737	S	S	*	*			trans	-151.2	172.6	-166.6	-61.2	-177.8	-11	0	0	109.1
30	Q	31.7	Very low	30.2	Very low	151 Å²	151	146.8 Å²	146.8	71%	0.706	74%	0.735	S	S	*	*			cis	-159.7	156.8	18.5	-151.6	164.1	7.1	0	0	114.2
31	Q	32	Very low	30	Very low	144 Å²	144	150.1 Å²	150.1	67%	0.673	74%	0.741	S	S	*	*			trans	8.3	142.4	160.5	-70.4	168.2	-55.7	0	0	126.6
32	Q	29.9	Very low	29.6	Very low	149 Å²	149	145.4 Å²	145.4	70%	0.696	73%	0.732	S	S	*	*			trans	74.4	111.6	132.2	-76.7	178.8	-51.2	0	0	124.9
33	Q	28.6	Very low	29.4	Very low	139 Å²	139	146 Å²	146	65%	0.65	74%	0.737	S	S	*	*				85.1	125.4	110.7	-160.7	162.8	-7.6	0	0	122.1
34	E	26.1	Very low	29.3	Very low	157 Å²	157	147.1 Å²	147.1	73%	0.734	74%	0.742	S	S	*	*			trans	77.6	132.2	150.9	-86.8	163.8	-140.4	0	0	125
35	S	26.1	Very low	29.2	Very low	104 Å²	104	149.6 Å²	149.6	73%	0.727	75%	0.75	S	S	*	*			trans	105	116.1	137.8	75.9	0	0	0	0	121.9
36	H	26.2	Very low	29.5	Very low	163 Å²	163	146.1 Å²	146.1	76%	0.755	74%	0.743	S	S	*	*			trans	61.1	123.3	137.8	-78.2	-67.5	0	0	0	125
37	N	25.4	Very low	29.9	Very low	123 Å²	123	143.2 Å²	143.2	66%	0.658	74%	0.738	S	S	*	*				89	124.2	129.3	-68.4	0.1	0	0	0	122.9
38	N	24.9	Very low	29.3	Very low	139 Å²	139	143.4 Å²	143.4	74%	0.743	75%	0.749	S	S	*	*			trans	81.3	130.6	134.4	-73.8	-1	0	0	0	122.8
39	S	25.5	Very low	29	Very low	112 Å²	112	143 Å²	143	78%	0.783	75%	0.752	S	S	*	*			trans	71.7	160.8	145.8	-62.7	0	0	0	0	119.3
40	F	25	Very low	28.6	Very low	178 Å²	178	141.9 Å²	141.9	78%	0.781	76%	0.756	S	S	*	*			cis	-175.9	157.6	-37.8	-162.8	-104.1	0	0	0	105.8
41	N	26.2	Very low	28.3	Very low	151 Å²	151	139.2 Å²	139.2	81%	0.807	76%	0.76	S	S	*	*			trans	64.9	145.4	174.1	-81.2	-18.9	0	0	0	119.5
42	G	25.5	Very low	28.1	Very low	64 Å²	64	141 Å²	141	66%	0.66	77%	0.773	S	S	*	*			trans	116.8	81.9	144.8	0	0	0	0	0	116.6
43	H	28.2	Very low	28	Very low	196 Å²	196	138.4 Å²	138.4	91%	0.907	78%	0.777	S	S	*	*			trans	-129	129.7	160.4	-94.3	27.8	0	0	0	110.7
44	H	28.5	Very low	28	Very low	193 Å²	193	137.8 Å²	137.8	89%	0.894	79%	0.785	S	S	*	*			trans	-120.2	135.9	173.6	-97.8	-84.3	0	0	0	109
45	H	28	Very low	28	Very low	180 Å²	180	139.4 Å²	139.4	83%	0.833	80%	0.795	S	S	*	*			trans	-67.5	174.2	160.7	-71.4	-75.7	0	0	0	110.7
46	P	40.4	Very low	28	Very low	112 Å²	112	142.3 Å²	142.3	73%	0.727	80%	0.801	S	S	*	*			cis	-142.7	-142.3	18.5	47.2	-26.5	0	0	0	111.9
47	P	43.9	Very low	28.1	Very low	101 Å²	101	140.6 Å²	140.6	66%	0.656	81%	0.808	S	S	*	*			cis	-126.7	170	-33	37.1	-22.8	0	0	0	113.8
48	T	26.4	Very low	28.3	Very low	142 Å²	142	140.1 Å²	140.1	87%	0.871	81%	0.809	S	S	*	*				-179.1	147.3	129.4	18	0	0	0	0	113.1
49	D	25.3	Very low	28.4	Very low	149 Å²	149	140 Å²	140	80%	0.797	81%	0.809	S	S	*	*			trans	-79.7	167	174.7	-53.6	-86.9	0	0	0	111.7
50	T	27.5	Very low	28.7	Very low	132 Å²	132	141.3 Å²	141.3	81%	0.81	80%	0.796	S	S	*	*			cis	-171.5	158.2	45.6	-36.5	0	0	0	0	112.7
51	A	25.7	Very low	28.8	Very low	96 Å²	96	136.3 Å²	136.3	79%	0.793	79%	0.788	S	S	*	*			trans	79.2	141.9	155.5	0	0	0	0	0	120.4
52	L	27	Very low	29	Very low	181 Å²	181	135.3 Å²	135.3	95%	0.948	78%	0.78	S	S	*	*			trans	-139.8	151.6	-176.8	-78.8	164	0	0	0	110.4
53	A	27	Very low	29.1	Very low	95 Å²	95	135.5 Å²	135.5	79%	0.785	77%	0.771	S	S	*	*			trans	-148.8	145.7	155.3	0	0	0	0	0	109.2
54	P	30.2	Very low	29.2	Very low	126 Å²	126	130 Å²	130	82%	0.818	75%	0.753	S	S	*	*			trans	-98.1	158.6	-162.7	37.5	-35.9	0	0	0	114.7
55	M	25.2	Very low	29.2	Very low	191 Å²	191	123.6 Å²	123.6	94%	0.941	73%	0.733	S	S	*	*			trans	-100.8	143	162.2	-82.3	-167.5	144.4	0	0	111.5
56	L	26.7	Very low	29.3	Very low	165 Å²	165	121.9 Å²	121.9	86%	0.864	73%	0.726	S	S	*	*			trans	-105.9	130.4	165.1	-67.7	169.5	0	0	0	107.8
57	S	27.7	Very low	28.8	Very low	126 Å²	126	122 Å²	122	88%	0.881	73%	0.73	S	S	*	*			trans	-84.5	121.5	176.8	51.6	0	0	0	0	110.7
58	V	29.3	Very low	28.3	Very low	113 Å²	113	126.4 Å²	126.4	69%	0.685	74%	0.741	S	S	*	*			trans	-105.1	142	170.4	178.5	0	0	0	0	108.4	R60	V58-R60 PolarHBondContact O-N 3.14Å
59	D	28.1	Very low	28.5	Very low	138 Å²	138	126.5 Å²	126.5	74%	0.738	74%	0.736	S	S	*	*			trans	-65.1	118.6	178.8	-73	-63.8	0	0	0	111.5
60	R	30.7	Very low	28.6	Very low	138 Å²	138	124.7 Å²	124.7	52%	0.521	74%	0.735	S	S	.	*			trans	-95.7	118.4	-169.9	-170.3	179	-176.8	134.2	-6	111.1	V58 M62 E283	V58-R60 PolarHBondContact O-N 3.14Å; R60-M62 PolarHBondContact O-N 2.58Å; R60-E283 IonicContact CZ-OE1 3.34Å; R60-E283 IonicContact NE-OE1 3.18Å; R60-E283 PolarHBondContact NE-OE1 3.21Å; R60-E283 IonicContact NH2-OE1 2.77Å; R60-E283 PolarHBondContact NH2-OE1 2.82Å
61	A	28.3	Very low	28.8	Very low	73 Å²	73	121.6 Å²	121.6	60%	0.603	73%	0.73	S	S	*	*			trans	-74.2	84.1	178.7	0	0	0	0	0	111.7
62	M	28.7	Very low	29.1	Very low	130 Å²	130	125.5 Å²	125.5	64%	0.64	74%	0.736	S	S	*	*			trans	-61.7	136	178.9	-71.8	-70.6	-169.3	0	0	112.9	R60	R60-M62 PolarHBondContact O-N 2.58Å
63	S	28.7	Very low	29.1	Very low	69 Å²	69	120.2 Å²	120.2	48%	0.483	72%	0.718	S	S	.	*			trans	-78.9	135	160.4	-68.6	0	0	0	0	109.9	A65	S63-A65 PolarHBondContact O-N 3.48Å
64	P	29.2	Very low	29.4	Very low	80 Å²	80	121.3 Å²	121.3	52%	0.519	72%	0.718	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.1	4.7	-172.7	-23.6	34.2	0	0	0	117.5	I169	P64-I169 HydrophobicContact CB-CD1 3.43Å; P64-I169 VanDerWaalsContact CB-CD1 3.43Å; P64-I169 HydrophobicContact CG-CD1 4.26Å
65	A	28.9	Very low	29.6	Very low	59 Å²	59	124.8 Å²	124.8	49%	0.488	72%	0.723	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.2	-8.8	-167.5	0	0	0	0	0	115.5	S63	S63-A65 PolarHBondContact O-N 3.48Å
66	Q	30.4	Very low	30.2	Very low	143 Å²	143	123.5 Å²	123.5	67%	0.668	71%	0.708	S	S	*	*			trans	-139.9	54.7	-170.7	-63.4	-160.8	-58.5	0	0	114.7	E68	Q66-E68 PolarHBondContact O-N 2.87Å
67	S	29.8	Very low	31.3	Very low	116 Å²	116	119 Å²	119	81%	0.811	70%	0.701	S	S	*	*			trans	-92.4	73.6	168.2	62.3	0	0	0	0	111.9	D69	S67-D69 VanDerWaalsContact C-N 3.29Å; S67-D69 PolarHBondContact O-N 3.41Å; S67-D69 VanDerWaalsContact O-N 3.08Å
68	E	34	Very low	32.8	Very low	192 Å²	192	116 Å²	116	90%	0.897	68%	0.677	S	S	*	*			trans	-81	61.1	176.4	-67.8	-165.9	131.3	0	0	113.2	Q66	Q66-E68 PolarHBondContact O-N 2.87Å
69	D	29.7	Very low	34.7	Very low	145 Å²	145	112.3 Å²	112.3	78%	0.775	66%	0.655	S	S	*	*			trans	-150.8	106.3	158.2	-166.7	7.2	0	0	0	112.8	S67	S67-D69 VanDerWaalsContact C-N 3.29Å; S67-D69 PolarHBondContact O-N 3.41Å; S67-D69 VanDerWaalsContact O-N 3.08Å
70	S	27.9	Very low	37.1	Very low	111 Å²	111	111 Å²	111	78%	0.776	64%	0.641	S	S	*	*			trans	-172.5	74.7	160.5	-82.1	0	0	0	0	109.7
71	G	31.4	Very low	39.3	Very low	67 Å²	67	104.9 Å²	104.9	69%	0.691	62%	0.619	S	S	*	*			trans	-61	142.3	158	0	0	0	0	0	110.1
72	L	32.3	Very low	41.7	Very low	178 Å²	178	105.6 Å²	105.6	93%	0.932	62%	0.616	S	S	*	*			trans	78	77.9	-176.4	-48	175.6	0	0	0	116
73	A	27.1	Very low	44.1	Very low	69 Å²	69	99.5 Å²	99.5	57%	0.57	59%	0.586	S	S	*	*			trans	-135.9	100.1	158.4	0	0	0	0	0	110.6
74	P	33.7	Very low	46.4	Very low	119 Å²	119	99.1 Å²	99.1	77%	0.773	58%	0.581	S	S	*	*			trans	-73.5	146.4	163.6	31.7	-32.2	0	0	0	110.2
75	E	34.1	Very low	48.7	Very low	199 Å²	199	95.4 Å²	95.4	93%	0.93	56%	0.557	S	S	*	*			trans	56.6	76.7	173.7	-58	-164.6	-169	0	0	116.6
76	R	37	Very low	50.7	Low	164 Å²	164	94.8 Å²	94.8	62%	0.619	55%	0.548	S	S	*	.			trans	-124.4	143.4	152.4	-74.3	178.9	158.3	-144.5	-22.4	108.3	T78 E167	R76-T78 PolarHBondContact O-N 2.93Å; R76-E167 IonicContact CZ-OE1 3.29Å; R76-E167 IonicContact CZ-OE2 3.31Å; R76-E167 IonicContact NH1-OE1 3.08Å; R76-E167 PolarHBondContact NH1-OE1 2.8Å; R76-E167 IonicContact NH1-OE2 2.71Å; R76-E167 PolarHBondContact NH1-OE2 2.79Å; R76-E167 VanDerWaalsContact NH2-CD 3.3Å; R76-E167 IonicContact NH2-OE1 2.74Å; R76-E167 PolarHBondContact NH2-OE1 3.37Å; R76-E167 IonicContact NH2-OE2 3.73Å; R76-E167 PolarHBondContact NH2-OE2 3.32Å
77	G	50.3	Low	52.5	Low	69 Å²	69	90.5 Å²	90.5	71%	0.711	53%	0.525	S	S	*	.			trans	-60	106.7	-165.6	0	0	0	0	0	114.3
78	T	59.5	Low	54.1	Low	63 Å²	63	88.2 Å²	88.2	39%	0.387	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	149.3	170.3	55	0	0	0	0	110.7	R76 E162 Y163	R76-T78 PolarHBondContact O-N 2.93Å; T78-E162 VanDerWaalsContact CB-OE1 3.25Å; T78-E162 WeakPolarHBondContact CB-OE1 3.28Å; T78-E162 HydrophobicContact CG2-CG 4.16Å; T78-E162 WeakPolarHBondContact CG2-OE1 3.19Å; T78-E162 PolarHBondContact OG1-OE1 2.41Å; T78-Y163 WeakPolarHBondContact CA-O 3.34Å
79	T	68.8	Low	55	Low	36 Å²	36	81.6 Å²	81.6	22%	0.221	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	147.4	-178.3	-60.1	0	0	0	0	109.1	E162 Y163	T79-E162 WeakPolarHBondContact O-CA 3.38Å; T79-Y163 HydrophobicContact CG2-CE1 4.16Å; T79-Y163 HydrophobicContact CG2-CE2 4.41Å; T79-Y163 WeakPolarHBondContact CG2-OH 3.46Å; T79-Y163 PolarHBondContact N-O 2.98Å; T79-Y163 WeakPolarHBondContact O-CD1 3.41Å; T79-Y163 VanDerWaalsContact O-CE1 3.3Å; T79-Y163 WeakPolarHBondContact O-CE1 3.47Å; T79-Y163 PolarHBondContact O-N 3.4Å
80	Y	78.8	Confident	56.1	Low	112 Å²	112	82.2 Å²	82.2	44%	0.439	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	146.2	179.1	-64.1	-92	0	0	0	111.3	H128 E160 I161 E162	Y80-H128 HydrophobicContact CE1-CB 4.26Å; Y80-H128 AromaticContact CE1-CG 3.92Å; Y80-H128 AromaticContact CE1-ND1 3.85Å; Y80-E160 HydrophobicContact CD1-CG 4.07Å; Y80-I161 CarbonylContact C-O 3.6Å; Y80-I161 VanDerWaalsContact CA-O 3.3Å; Y80-I161 WeakPolarHBondContact CA-O 3.4Å; Y80-E162 HydrophobicContact CD1-CB 4.01Å; Y80-E162 HydrophobicContact CE1-CB 3.74Å; Y80-E162 HydrophobicContact CE1-CG 4.17Å
81	A	76	Confident	57.4	Low	9 Å²	9	80.9 Å²	80.9	7%	0.074	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	145.8	169.6	0	0	0	0	0	110.5	E160 I161 Y163 L240	A81-E160 WeakPolarHBondContact O-CA 3.03Å; A81-I161 HydrophobicContact CB-CD1 4.48Å; A81-I161 HydrophobicContact CB-CG1 4.01Å; A81-I161 PolarHBondContact N-O 3.28Å; A81-I161 WeakPolarHBondContact O-CG1 3.4Å; A81-I161 PolarHBondContact O-N 2.85Å; A81-Y163 HydrophobicContact CB-CD1 4.31Å; A81-Y163 HydrophobicContact CB-CE1 3.6Å; A81-L240 HydrophobicContact CB-CD2 3.68Å
82	T	80.3	Confident	59	Low	88 Å²	88	77.8 Å²	77.8	54%	0.54	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125.8	170.5	-43.7	0	0	0	0	109.4	I158 V159	T82-I158 HydrophobicContact CG2-CG2 3.45Å; T82-I158 VanDerWaalsContact CG2-CG2 3.45Å; T82-V159 WeakPolarHBondContact CA-O 3.25Å
83	I	79.2	Confident	60.7	Low	2 Å²	2	70.8 Å²	70.8	1%	0.01	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	158.4	176.5	63.7	165.2	0	0	0	111	L85 F120 L121 V159 I161	I83-L85 HydrophobicContact CD1-CD1 4.26Å; I83-L85 HydrophobicContact CD1-CD2 3.98Å; I83-L85 HydrophobicContact CD1-CG 3.99Å; I83-L85 HydrophobicContact CG1-CG 4.5Å; I83-F120 HydrophobicContact CD1-CB 3.93Å; I83-L121 HydrophobicContact CD1-CD2 3.61Å; I83-L121 HydrophobicContact CD1-CG 4Å; I83-V159 HydrophobicContact CG1-CB 3.98Å; I83-V159 PolarHBondContact N-O 3.25Å; I83-V159 PolarHBondContact O-N 2.87Å; I83-I161 HydrophobicContact CD1-CD1 4.21Å; I83-I161 HydrophobicContact CD1-CG2 4.18Å; I83-I161 HydrophobicContact CG1-CD1 4.49Å; I83-I161 HydrophobicContact CG1-CG2 4.37Å; I83-I161 HydrophobicContact CG2-CD1 4.01Å; I83-I161 HydrophobicContact CG2-CG1 4.47Å
84	T	76.8	Confident	63.1	Low	61 Å²	61	68.1 Å²	68.1	37%	0.374	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	114.7	176.6	59.4	0	0	0	0	110.1	A157 K248	T84-A157 WeakPolarHBondContact CA-O 3.32Å; T84-K248 PolarHBondContact OG1-NZ 3.28Å
85	L	76.5	Confident	65.3	Low	1 Å²	1	66.3 Å²	66.3	1%	0.005	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	138.7	178.5	-67.1	-177.8	0	0	0	111.6	I83 L92 I94 F120 L121 L147 P156 A157 V159	I83-L85 HydrophobicContact CD1-CD1 4.26Å; I83-L85 HydrophobicContact CD1-CD2 3.98Å; I83-L85 HydrophobicContact CD1-CG 3.99Å; I83-L85 HydrophobicContact CG1-CG 4.5Å; L85-L92 HydrophobicContact CB-CD2 4.15Å; L85-L92 HydrophobicContact CD1-CD2 4.35Å; L85-I94 HydrophobicContact CD1-CD1 4.38Å; L85-F120 HydrophobicContact CD2-CB 3.88Å; L85-F120 HydrophobicContact CD2-CD2 3.81Å; L85-F120 HydrophobicContact CD2-CG 4.19Å; L85-L121 HydrophobicContact CD1-CD1 4.1Å; L85-L147 HydrophobicContact CD1-CD2 4.36Å; L85-P156 CarbonylContact O-C 3.55Å; L85-P156 WeakPolarHBondContact O-CA 3.24Å; L85-P156 WeakPolarHBondContact O-CB 3.33Å; L85-A157 PolarHBondContact N-O 2.84Å; L85-A157 PolarHBondContact O-N 3.49Å; L85-V159 HydrophobicContact CD1-CG2 3.95Å; L85-V159 HydrophobicContact CG-CG2 4.28Å
86	P	70.9	Confident	67.7	Low	46 Å²	46	57.8 Å²	57.8	30%	0.299	33%	0.325	S	S	.	.			trans	-71.4	131.2	174	29.4	-33.2	0	0	0	110.9	N88 L92 H116	P86-N88 PolarHBondContact O-N 2.6Å; P86-L92 WeakPolarHBondContact O-CD2 3.41Å; P86-L92 WeakPolarHBondContact O-CG 3.09Å; P86-H116 HydrophobicContact CG-CB 3.88Å
87	R	69.4	Low	69.9	Low	53 Å²	53	51.8 Å²	51.8	20%	0.2	31%	0.31	C	S	.	.			trans	-76.8	57.3	-178	-60.3	-166.2	-157.2	-118.9	-13.7	113.9	D131 L147 A149 C155 A157	R87-D131 IonicContact CZ-OD1 2.7Å; R87-D131 IonicContact CZ-OD2 3.27Å; R87-D131 IonicContact NH1-OD2 3.07Å; R87-D131 PolarHBondContact NH1-OD2 3.19Å; R87-D131 IonicContact NH2-OD1 3.9Å; R87-D131 PolarHBondContact NH2-OD1 3.23Å; R87-D131 IonicContact NH2-OD2 3.04Å; R87-D131 PolarHBondContact NH2-OD2 3.33Å; R87-L147 WeakPolarHBondContact CA-O 3.32Å; R87-A149 WeakPolarHBondContact CD-O 3.4Å; R87-A149 PolarHBondContact NH1-O 2.73Å; R87-C155 WeakPolarHBondContact CD-O 3.4Å; R87-C155 WeakPolarHBondContact CG-O 3.42Å; R87-C155 PolarHBondContact NE-O 2.86Å; R87-A157 HydrophobicContact CG-CB 3.98Å
88	N	63.5	Low	71.2	Confident	68 Å²	68	57.9 Å²	57.9	36%	0.364	32%	0.32	S	S	.	.			trans	-122.7	106.8	177.7	-174.8	-18.5	0	0	0	111.1	P86 L90 H91 L92	P86-N88 PolarHBondContact O-N 2.6Å; N88-L90 PolarHBondContact O-N 2.81Å; N88-L90 VanDerWaalsContact O-N 3.14Å; N88-L90 PolarHBondContact OD1-N 2.98Å; N88-H91 HydrophobicContact CB-CB 4.26Å; N88-H91 PolarHBondContact ND2-CD2 3.16Å; N88-H91 PolarHBondContact O-N 2.98Å; N88-L92 WeakPolarHBondContact O-CG 3.37Å; N88-L92 PolarHBondContact O-N 2.94Å
89	A	53	Low	72	Confident	54 Å²	54	57.2 Å²	57.2	45%	0.446	31%	0.31	S	S	.	.	H	α-helix	trans	-51.9	-36.8	-179.1	0	0	0	0	0	114	H91 C148	A89-H91 VanDerWaalsContact C-N 3.34Å; A89-C148 VanDerWaalsContact CA-SG 3.54Å; A89-C148 HydrophobicContact CB-CB 3.99Å; A89-C148 WeakPolarHBondContact CB-SG 3.49Å
90	L	52.8	Low	71.9	Confident	158 Å²	158	63.9 Å²	63.9	83%	0.827	34%	0.344	S	S	*	.	H	α-helix	trans	-77.9	-19.2	-177.6	-63.4	173.1	0	0	0	113	N88	N88-L90 PolarHBondContact O-N 2.81Å; N88-L90 VanDerWaalsContact O-N 3.14Å; N88-L90 PolarHBondContact OD1-N 2.98Å
91	H	55.3	Low	71.6	Confident	83 Å²	83	62.6 Å²	62.6	38%	0.384	35%	0.345	S	S	.	.	H	α-helix	trans	-112.6	-13.1	-177.5	-75.1	-119.2	0	0	0	114.1	N88 A89 G115 H116	N88-H91 HydrophobicContact CB-CB 4.26Å; N88-H91 PolarHBondContact ND2-CD2 3.16Å; N88-H91 PolarHBondContact O-N 2.98Å; A89-H91 VanDerWaalsContact C-N 3.34Å; H91-G115 CarbonylContact O-C 3.53Å; H91-G115 WeakPolarHBondContact O-CA 3.15Å; H91-H116 AromaticContact CG-CD2 3.92Å; H91-H116 AromaticContact ND1-CD2 3.46Å; H91-H116 PolarHBondContact ND1-CD2 2.69Å; H91-H116 AromaticContact ND1-NE2 3.19Å; H91-H116 PolarHBondContact ND1-NE2 2.99Å; H91-H116 VanDerWaalsContact ND1-NE2 3.19Å; H91-H116 PolarHBondContact O-N 2.74Å
92	L	65	Low	71.9	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-71	-53.9	173.4	-77.2	166.1	0	0	0	110.8	L85 P86 N88 I94 A117 M144 L147	L85-L92 HydrophobicContact CB-CD2 4.15Å; L85-L92 HydrophobicContact CD1-CD2 4.35Å; P86-L92 WeakPolarHBondContact O-CD2 3.41Å; P86-L92 WeakPolarHBondContact O-CG 3.09Å; N88-L92 WeakPolarHBondContact O-CG 3.37Å; N88-L92 PolarHBondContact O-N 2.94Å; L92-I94 HydrophobicContact CB-CD1 4.32Å; L92-I94 HydrophobicContact CB-CG1 4.43Å; L92-I94 HydrophobicContact CD2-CD1 4.16Å; L92-I94 PolarHBondContact O-N 3.44Å; L92-I94 VanDerWaalsContact O-N 3.17Å; L92-A117 HydrophobicContact CD2-CB 4.2Å; L92-A117 VanDerWaalsContact O-CB 3.26Å; L92-A117 WeakPolarHBondContact O-CB 3.27Å; L92-M144 HydrophobicContact CB-CE 4.45Å; L92-L147 HydrophobicContact CD1-CB 3.94Å
93	A	67.6	Low	71.6	Confident	30 Å²	30	64 Å²	64	25%	0.248	35%	0.353	C	S	.	.			trans	47.6	43.9	175.1	0	0	0	0	0	114.4	N112	A93-N112 HydrophobicContact CB-CB 3.52Å; A93-N112 PolarHBondContact O-N 2.95Å; A93-N112 VanDerWaalsContact O-N 3.11Å
94	I	76.9	Confident	71.6	Confident	13 Å²	13	70.9 Å²	70.9	7%	0.067	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	134	175.1	-56.5	163	0	0	0	108.9	L85 L92 F96 V108 L111 A117 L121 L147	L85-I94 HydrophobicContact CD1-CD1 4.38Å; L92-I94 HydrophobicContact CB-CD1 4.32Å; L92-I94 HydrophobicContact CB-CG1 4.43Å; L92-I94 HydrophobicContact CD2-CD1 4.16Å; L92-I94 PolarHBondContact O-N 3.44Å; L92-I94 VanDerWaalsContact O-N 3.17Å; I94-F96 HydrophobicContact CG2-CD1 4.26Å; I94-F96 HydrophobicContact CG2-CE1 3.91Å; I94-F96 HydrophobicContact CG2-CZ 4.12Å; I94-V108 HydrophobicContact CG2-CG1 4.35Å; I94-V108 HydrophobicContact CG2-CG2 4.41Å; I94-L111 HydrophobicContact CB-CD2 4.19Å; I94-L111 HydrophobicContact CG1-CD2 3.79Å; I94-L111 HydrophobicContact CG2-CD2 4.04Å; I94-A117 HydrophobicContact CD1-CB 3.82Å; I94-A117 HydrophobicContact CG1-CB 3.57Å; I94-L121 HydrophobicContact CD1-CD1 3.61Å; I94-L121 HydrophobicContact CG1-CD1 4.11Å; I94-L147 HydrophobicContact CD1-CD1 3.95Å
95	T	80.3	Confident	71.9	Confident	81 Å²	81	68.4 Å²	68.4	50%	0.497	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.6	167	-45.7	0	0	0	0	109	G109 S110	T95-G109 WeakPolarHBondContact O-CA 3.47Å; T95-G109 PolarHBondContact O-N 2.79Å; T95-S110 WeakPolarHBondContact CB-OG 3.48Å; T95-S110 PolarHBondContact N-O 2.99Å; T95-S110 PolarHBondContact O-N 3.45Å; T95-S110 PolarHBondContact OG1-OG 2.81Å
96	F	84	Confident	72.2	Confident	21 Å²	21	68.4 Å²	68.4	9%	0.092	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	144.2	172.1	-61.3	-64.2	0	0	0	110.9	I94 P106 V107 L127 N140 V143 M144 L147	I94-F96 HydrophobicContact CG2-CD1 4.26Å; I94-F96 HydrophobicContact CG2-CE1 3.91Å; I94-F96 HydrophobicContact CG2-CZ 4.12Å; F96-P106 HydrophobicContact CD1-CB 4.05Å; F96-P106 HydrophobicContact CE1-CB 4.49Å; F96-P106 HydrophobicContact CG-CB 4.43Å; F96-V107 CarbonylContact C-O 3.52Å; F96-V107 WeakPolarHBondContact CA-O 3.29Å; F96-L127 HydrophobicContact CE1-CD1 3.91Å; F96-L127 HydrophobicContact CE1-CD2 3.93Å; F96-L127 HydrophobicContact CZ-CD2 4.14Å; F96-N140 HydrophobicContact CB-CB 4.22Å; F96-N140 WeakPolarHBondContact CB-ND2 3.28Å; F96-N140 HydrophobicContact CD2-CB 4.22Å; F96-V143 HydrophobicContact CE1-CG1 4.4Å; F96-V143 HydrophobicContact CE2-CG1 3.95Å; F96-V143 HydrophobicContact CZ-CG1 3.75Å; F96-M144 HydrophobicContact CE2-CB 4.09Å; F96-M144 HydrophobicContact CE2-SD 4Å; F96-L147 HydrophobicContact CZ-CD1 3.87Å
97	A	82.9	Confident	73	Confident	38 Å²	38	68 Å²	68	31%	0.314	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-61.2	146.2	170.2	0	0	0	0	0	110.8	R99 V107 N140	A97-R99 PolarHBondContact O-N 3.42Å; A97-V107 HydrophobicContact CB-CB 4.22Å; A97-V107 PolarHBondContact N-O 3.21Å; A97-N140 PolarHBondContact O-ND2 3.41Å
98	E	78.2	Confident	73.7	Confident	197 Å²	197	65.5 Å²	65.5	92%	0.921	35%	0.352	S	S	*	.	P	Polyproline II helix	trans	-65.5	132	174.1	-63	-168.4	163	0	0	110.1
99	R	76.2	Confident	74.4	Confident	49 Å²	49	64.2 Å²	64.2	19%	0.185	35%	0.354	C	S	.	.			trans	-137.8	129.9	174.6	58.9	177.2	166.3	131.1	14.1	110.3	A97 Y104 L138 N140	A97-R99 PolarHBondContact O-N 3.42Å; R99-Y104 PolarHBondContact NH1-O 3.49Å; R99-L138 PolarHBondContact NH2-O 3.16Å; R99-N140 PolarHBondContact NE-OD1 3.12Å; R99-N140 PolarHBondContact NH2-OD1 3.24Å
100	N	66	Low	75.6	Confident	175 Å²	175	64.3 Å²	64.3	94%	0.936	35%	0.352	S	S	*	.	S	Bend	trans	-89.9	-27.6	174.2	-66.1	-44	0	0	0	111.7
101	D	73	Confident	76.7	Confident	86 Å²	86	58 Å²	58	46%	0.46	32%	0.319	S	S	.	.			trans	-92.7	135.6	170.3	-170.1	1.7	0	0	0	110.2	S103	D101-S103 VanDerWaalsContact OD1-CB 3.29Å; D101-S103 WeakPolarHBondContact OD1-CB 3.23Å; D101-S103 PolarHBondContact OD1-N 2.9Å; D101-S103 PolarHBondContact OD1-OG 3.12Å; D101-S103 VanDerWaalsContact OD1-OG 3.13Å; D101-S103 PolarHBondContact OD2-OG 3.41Å
102	L	82.4	Confident	77.5	Confident	65 Å²	65	57.7 Å²	57.7	34%	0.34	32%	0.32	S	S	.	.			trans	-103.9	-0.6	177.8	-60.4	178.7	0	0	0	112.6	Y104 G137	L102-Y104 PolarHBondContact O-N 2.92Å; L102-G137 PolarHBondContact O-N 2.86Å
103	S	74.5	Confident	77.3	Confident	61 Å²	61	60 Å²	60	43%	0.427	34%	0.336	S	S	.	.	S	Bend	trans	-65.1	-23.1	176.5	74.2	0	0	0	0	113.3	D101 I136	D101-S103 VanDerWaalsContact OD1-CB 3.29Å; D101-S103 WeakPolarHBondContact OD1-CB 3.23Å; D101-S103 PolarHBondContact OD1-N 2.9Å; D101-S103 PolarHBondContact OD1-OG 3.12Å; D101-S103 VanDerWaalsContact OD1-OG 3.13Å; D101-S103 PolarHBondContact OD2-OG 3.41Å; S103-I136 WeakPolarHBondContact O-CG2 3.31Å
104	Y	78.6	Confident	77.2	Confident	147 Å²	147	64.4 Å²	64.4	58%	0.576	36%	0.359	S	S	*	.	S	Bend	trans	-104.9	150.1	177.6	-60.3	-78.8	0	0	0	112.5	R99 L102	R99-Y104 PolarHBondContact NH1-O 3.49Å; L102-Y104 PolarHBondContact O-N 2.92Å
105	P	82.4	Confident	76.6	Confident	9 Å²	9	63.9 Å²	63.9	6%	0.058	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-61.1	148	173.9	25.3	-34.9	0	0	0	112.5	R126 L127	P105-R126 HydrophobicContact CB-CB 4.3Å; P105-R126 HydrophobicContact CG-CB 3.96Å; P105-R126 HydrophobicContact CG-CG 4.27Å; P105-L127 VanDerWaalsContact CB-O 3.26Å; P105-L127 WeakPolarHBondContact CB-O 3.26Å
106	P	83.9	Confident	75.9	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-61.8	133.3	175.3	25	-32.7	0	0	0	112.1	F96 R126 L127 T135 V143	F96-P106 HydrophobicContact CD1-CB 4.05Å; F96-P106 HydrophobicContact CE1-CB 4.49Å; F96-P106 HydrophobicContact CG-CB 4.43Å; P106-R126 WeakPolarHBondContact O-CA 3.48Å; P106-L127 WeakPolarHBondContact CD-O 3.43Å; P106-L127 HydrophobicContact CG-CB 4.31Å; P106-L127 PolarHBondContact O-N 2.91Å; P106-T135 WeakPolarHBondContact CD-OG1 3.35Å; P106-T135 HydrophobicContact CG-CG2 4.4Å; P106-V143 HydrophobicContact CG-CG1 4.02Å; P106-V143 HydrophobicContact CG-CG2 4.21Å
107	V	86.4	Confident	75	Confident	37 Å²	37	62.2 Å²	62.2	22%	0.224	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-92.2	138.3	174.6	-177.8	0	0	0	0	110	F96 A97 G109 D125 R126	F96-V107 CarbonylContact C-O 3.52Å; F96-V107 WeakPolarHBondContact CA-O 3.29Å; A97-V107 HydrophobicContact CB-CB 4.22Å; A97-V107 PolarHBondContact N-O 3.21Å; V107-G109 PolarHBondContact O-N 2.7Å; V107-D125 CarbonylContact C-O 3.48Å; V107-D125 VanDerWaalsContact CA-O 3.3Å; V107-D125 WeakPolarHBondContact CA-O 3.5Å; V107-R126 HydrophobicContact CG2-CG 3.92Å
108	V	85.4	Confident	74.1	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.006	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	110.6	166.7	178.5	0	0	0	0	108.8	I94 L111 L121 G124 D125 L127	I94-V108 HydrophobicContact CG2-CG1 4.35Å; I94-V108 HydrophobicContact CG2-CG2 4.41Å; V108-L111 HydrophobicContact CG1-CD1 4.15Å; V108-L111 HydrophobicContact CG1-CD2 3.64Å; V108-L111 HydrophobicContact CG1-CG 3.66Å; V108-L121 HydrophobicContact CG2-CD1 4.09Å; V108-L121 HydrophobicContact CG2-CD2 4.39Å; V108-G124 PolarHBondContact O-N 3.3Å; V108-D125 HydrophobicContact CB-CB 4.32Å; V108-D125 HydrophobicContact CG2-CB 3.93Å; V108-D125 PolarHBondContact N-O 2.83Å; V108-L127 HydrophobicContact CG2-CD1 3.51Å
109	G	78.4	Confident	73.7	Confident	41 Å²	41	51.6 Å²	51.6	42%	0.423	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-44	177.3	0	0	0	0	0	112.3	T95 V107	T95-G109 WeakPolarHBondContact O-CA 3.47Å; T95-G109 PolarHBondContact O-N 2.79Å; V107-G109 PolarHBondContact O-N 2.7Å
110	S	76.8	Confident	73.6	Confident	57 Å²	57	50.5 Å²	50.5	40%	0.399	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	158.2	173.4	70	0	0	0	0	112.5	T95	T95-S110 WeakPolarHBondContact CB-OG 3.48Å; T95-S110 PolarHBondContact N-O 2.99Å; T95-S110 PolarHBondContact O-N 3.45Å; T95-S110 PolarHBondContact OG1-OG 2.81Å
111	L	77	Confident	74.3	Confident	26 Å²	26	42.1 Å²	42.1	14%	0.136	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	134.6	178.6	-63.4	169.9	0	0	0	108.6	I94 V108 A117 A118 L121	I94-L111 HydrophobicContact CB-CD2 4.19Å; I94-L111 HydrophobicContact CG1-CD2 3.79Å; I94-L111 HydrophobicContact CG2-CD2 4.04Å; V108-L111 HydrophobicContact CG1-CD1 4.15Å; V108-L111 HydrophobicContact CG1-CD2 3.64Å; V108-L111 HydrophobicContact CG1-CG 3.66Å; L111-A117 HydrophobicContact CD2-CB 4.33Å; L111-A118 HydrophobicContact CB-CB 4.48Å; L111-L121 HydrophobicContact CD1-CB 3.75Å; L111-L121 WeakPolarHBondContact CD1-O 3.47Å; L111-L121 HydrophobicContact CD2-CB 4.16Å; L111-L121 HydrophobicContact CD2-CD1 4.29Å
112	N	71.9	Confident	74.4	Confident	76 Å²	76	38.5 Å²	38.5	41%	0.406	22%	0.222	S	C	.	.			trans	-70.7	126	169.5	-178.6	-18.7	0	0	0	109.3	A93 V114 G115	A93-N112 HydrophobicContact CB-CB 3.52Å; A93-N112 PolarHBondContact O-N 2.95Å; A93-N112 VanDerWaalsContact O-N 3.11Å; N112-V114 PolarHBondContact O-N 2.84Å; N112-V114 VanDerWaalsContact O-N 3.09Å; N112-V114 WeakPolarHBondContact OD1-CB 3.49Å; N112-V114 PolarHBondContact OD1-N 2.83Å; N112-G115 PolarHBondContact O-N 2.89Å
113	P	61.6	Low	74.3	Confident	51 Å²	51	38.6 Å²	38.6	33%	0.331	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-16	-179.4	26.1	-36	0	0	0	114.2	R210 P211	P113-R210 VanDerWaalsContact O-CD 3.28Å; P113-R210 WeakPolarHBondContact O-CD 3.47Å; P113-R210 WeakPolarHBondContact O-CG 3.38Å; P113-P211 HydrophobicContact CB-CB 3.95Å; P113-P211 HydrophobicContact CB-CG 4.14Å
114	V	63.5	Low	74.4	Confident	121 Å²	121	38 Å²	38	73%	0.733	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-12.9	175	-170.2	0	0	0	0	112.1	N112	N112-V114 PolarHBondContact O-N 2.84Å; N112-V114 VanDerWaalsContact O-N 3.09Å; N112-V114 WeakPolarHBondContact OD1-CB 3.49Å; N112-V114 PolarHBondContact OD1-N 2.83Å
115	G	65.4	Low	74.6	Confident	3 Å²	3	31.3 Å²	31.3	3%	0.031	20%	0.204	C	C	.	.	S	Bend	trans	-78.9	145	-176.9	0	0	0	0	0	114	H91 N112 A117 A118	H91-G115 CarbonylContact O-C 3.53Å; H91-G115 WeakPolarHBondContact O-CA 3.15Å; N112-G115 PolarHBondContact O-N 2.89Å; G115-A117 PolarHBondContact O-N 2.81Å; G115-A118 WeakPolarHBondContact O-CB 3.28Å; G115-A118 PolarHBondContact O-N 2.81Å; G115-A118 VanDerWaalsContact O-N 3.15Å
116	H	65.7	Low	74.8	Confident	67 Å²	67	35.1 Å²	35.1	31%	0.31	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-66.9	-15.7	174.2	-64.8	-48.5	0	0	0	113.1	P86 H91 A118 F120	P86-H116 HydrophobicContact CG-CB 3.88Å; H91-H116 AromaticContact CG-CD2 3.92Å; H91-H116 AromaticContact ND1-CD2 3.46Å; H91-H116 PolarHBondContact ND1-CD2 2.69Å; H91-H116 AromaticContact ND1-NE2 3.19Å; H91-H116 PolarHBondContact ND1-NE2 2.99Å; H91-H116 VanDerWaalsContact ND1-NE2 3.19Å; H91-H116 PolarHBondContact O-N 2.74Å; H116-A118 VanDerWaalsContact C-N 3.28Å; H116-A118 PolarHBondContact O-N 2.74Å; H116-F120 WeakPolarHBondContact O-CD2 3.32Å
117	A	65.8	Low	75	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-68.1	-27.2	172.6	0	0	0	0	0	112.9	L92 I94 L111 G115 D119 F120 L121	L92-A117 HydrophobicContact CD2-CB 4.2Å; L92-A117 VanDerWaalsContact O-CB 3.26Å; L92-A117 WeakPolarHBondContact O-CB 3.27Å; I94-A117 HydrophobicContact CD1-CB 3.82Å; I94-A117 HydrophobicContact CG1-CB 3.57Å; L111-A117 HydrophobicContact CD2-CB 4.33Å; G115-A117 PolarHBondContact O-N 2.81Å; A117-D119 PolarHBondContact O-N 3.38Å; A117-F120 PolarHBondContact O-N 2.9Å; A117-F120 VanDerWaalsContact O-N 3.07Å; A117-L121 HydrophobicContact CB-CD1 4.39Å; A117-L121 PolarHBondContact O-N 3.15Å
118	A	62.9	Low	74.9	Confident	2 Å²	2	35.4 Å²	35.4	2%	0.017	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-73.6	-1.9	-177.8	0	0	0	0	0	114.4	L111 G115 H116 R210	L111-A118 HydrophobicContact CB-CB 4.48Å; G115-A118 WeakPolarHBondContact O-CB 3.28Å; G115-A118 PolarHBondContact O-N 2.81Å; G115-A118 VanDerWaalsContact O-N 3.15Å; H116-A118 VanDerWaalsContact C-N 3.28Å; H116-A118 PolarHBondContact O-N 2.74Å; A118-R210 HydrophobicContact CB-CG 4.09Å
119	D	69.3	Low	75	Confident	10 Å²	10	38.1 Å²	38.1	5%	0.053	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-90	-8.7	168.3	-73.4	-51.5	0	0	0	113	A117 C191 G193 R210	A117-D119 PolarHBondContact O-N 3.38Å; D119-C191 WeakPolarHBondContact OD2-CB 3.44Å; D119-C191 PolarHBondContact OD2-SG 2.74Å; D119-G193 VanDerWaalsContact OD1-CA 3.24Å; D119-G193 WeakPolarHBondContact OD1-CA 3.43Å; D119-G193 PolarHBondContact OD1-N 2.94Å; D119-R210 IonicContact OD1-CZ 3.88Å; D119-R210 IonicContact OD1-NE 3.51Å; D119-R210 IonicContact OD1-NH1 3.28Å; D119-R210 PolarHBondContact OD1-NH1 2.75Å; D119-R210 IonicContact OD1-NH2 3.24Å; D119-R210 PolarHBondContact OD1-NH2 2.85Å; D119-R210 VanDerWaalsContact OD1-NH2 3.15Å; D119-R210 IonicContact OD2-CZ 2.95Å; D119-R210 IonicContact OD2-NH1 3.7Å; D119-R210 PolarHBondContact OD2-NH1 3.2Å; D119-R210 IonicContact OD2-NH2 3.83Å
120	F	75.1	Confident	75.4	Confident	25 Å²	25	36.2 Å²	36.2	11%	0.11	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.5	-34.9	-170.2	-54.3	-63.7	0	0	0	114	I83 L85 H116 A117 T195 R197 K248	I83-F120 HydrophobicContact CD1-CB 3.93Å; L85-F120 HydrophobicContact CD2-CB 3.88Å; L85-F120 HydrophobicContact CD2-CD2 3.81Å; L85-F120 HydrophobicContact CD2-CG 4.19Å; H116-F120 WeakPolarHBondContact O-CD2 3.32Å; A117-F120 PolarHBondContact O-N 2.9Å; A117-F120 VanDerWaalsContact O-N 3.07Å; F120-T195 WeakPolarHBondContact O-CG2 3.48Å; F120-R197 PolarHBondContact O-NH2 2.77Å; F120-K248 VanDerWaalsContact CE1-CE 3.43Å
121	L	79.6	Confident	75.7	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	21%	0.205	C	C	.	.			trans	-97.5	161.2	175.1	-67.2	174.3	0	0	0	111.4	I83 L85 I94 V108 L111 A117 D125 L127 I161 T195	I83-L121 HydrophobicContact CD1-CD2 3.61Å; I83-L121 HydrophobicContact CD1-CG 4Å; L85-L121 HydrophobicContact CD1-CD1 4.1Å; I94-L121 HydrophobicContact CD1-CD1 3.61Å; I94-L121 HydrophobicContact CG1-CD1 4.11Å; V108-L121 HydrophobicContact CG2-CD1 4.09Å; V108-L121 HydrophobicContact CG2-CD2 4.39Å; L111-L121 HydrophobicContact CD1-CB 3.75Å; L111-L121 WeakPolarHBondContact CD1-O 3.47Å; L111-L121 HydrophobicContact CD2-CB 4.16Å; L111-L121 HydrophobicContact CD2-CD1 4.29Å; A117-L121 HydrophobicContact CB-CD1 4.39Å; A117-L121 PolarHBondContact O-N 3.15Å; L121-D125 VanDerWaalsContact CA-OD2 3.3Å; L121-D125 WeakPolarHBondContact CA-OD2 3.48Å; L121-D125 HydrophobicContact CD2-CB 4.25Å; L121-D125 WeakPolarHBondContact CD2-OD2 3.45Å; L121-L127 HydrophobicContact CD2-CD1 4.48Å; L121-I161 HydrophobicContact CD2-CD1 4.37Å; L121-I161 HydrophobicContact CD2-CG2 3.83Å; L121-T195 PolarHBondContact O-OG1 2.83Å
122	A	76.9	Confident	75.9	Confident	9 Å²	9	37.9 Å²	37.9	7%	0.074	23%	0.227	C	C	.	.			trans	-129.4	157.1	165.6	0	0	0	0	0	109.5	D125 H208	A122-D125 PolarHBondContact N-OD2 3.35Å; A122-D125 WeakPolarHBondContact O-CB 3.17Å; A122-D125 VanDerWaalsContact O-CG 3.31Å; A122-D125 PolarHBondContact O-N 2.68Å; A122-H208 HydrophobicContact CB-CB 3.97Å
123	P	78.4	Confident	76.5	Confident	68 Å²	68	38.5 Å²	38.5	44%	0.442	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	142.1	165.1	-21.5	34.1	0	0	0	110.7
124	G	76.4	Confident	77.6	Confident	48 Å²	48	38.5 Å²	38.5	50%	0.495	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.7	-14.4	-175.5	0	0	0	0	0	115.5	V108	V108-G124 PolarHBondContact O-N 3.3Å
125	D	84	Confident	78.7	Confident	6 Å²	6	32.8 Å²	32.8	3%	0.032	20%	0.196	C	C	.	.			trans	-60	137.4	175.4	-78.5	-16.8	0	0	0	112.3	V107 V108 L121 A122 R197	V107-D125 CarbonylContact C-O 3.48Å; V107-D125 VanDerWaalsContact CA-O 3.3Å; V107-D125 WeakPolarHBondContact CA-O 3.5Å; V108-D125 HydrophobicContact CB-CB 4.32Å; V108-D125 HydrophobicContact CG2-CB 3.93Å; V108-D125 PolarHBondContact N-O 2.83Å; L121-D125 VanDerWaalsContact CA-OD2 3.3Å; L121-D125 WeakPolarHBondContact CA-OD2 3.48Å; L121-D125 HydrophobicContact CD2-CB 4.25Å; L121-D125 WeakPolarHBondContact CD2-OD2 3.45Å; A122-D125 PolarHBondContact N-OD2 3.35Å; A122-D125 WeakPolarHBondContact O-CB 3.17Å; A122-D125 VanDerWaalsContact O-CG 3.31Å; A122-D125 PolarHBondContact O-N 2.68Å; D125-R197 IonicContact OD1-CZ 3.05Å; D125-R197 IonicContact OD1-NH1 2.75Å; D125-R197 PolarHBondContact OD1-NH1 2.9Å; D125-R197 IonicContact OD1-NH2 2.77Å; D125-R197 PolarHBondContact OD1-NH2 2.73Å; D125-R197 IonicContact OD2-CZ 3.25Å; D125-R197 IonicContact OD2-NH1 3.41Å; D125-R197 IonicContact OD2-NH2 3.55Å; D125-R197 PolarHBondContact OD2-NH2 3.43Å
126	R	86.3	Confident	79.6	Confident	90 Å²	90	35.9 Å²	35.9	34%	0.34	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	118.2	173	-71.8	168.1	-169.7	-77.5	-0.2	109.6	P105 P106 V107 H128 I161 E162	P105-R126 HydrophobicContact CB-CB 4.3Å; P105-R126 HydrophobicContact CG-CB 3.96Å; P105-R126 HydrophobicContact CG-CG 4.27Å; P106-R126 WeakPolarHBondContact O-CA 3.48Å; V107-R126 HydrophobicContact CG2-CG 3.92Å; R126-H128 PolarHBondContact O-N 2.73Å; R126-I161 CarbonylContact O-C 3.57Å; R126-I161 VanDerWaalsContact O-CA 3.25Å; R126-I161 WeakPolarHBondContact O-CA 3.26Å; R126-E162 HydrophobicContact CB-CB 4Å; R126-E162 WeakPolarHBondContact CD-OE2 3.33Å; R126-E162 PolarHBondContact N-O 3.36Å; R126-E162 PolarHBondContact O-N 3.28Å
127	L	87.7	Confident	80.3	Confident	0 Å²	0	35 Å²	35	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	112.2	173.7	-69.9	69.7	0	0	0	108.1	F96 P105 P106 V108 L121 I130 T135 L147 V159 I161	F96-L127 HydrophobicContact CE1-CD1 3.91Å; F96-L127 HydrophobicContact CE1-CD2 3.93Å; F96-L127 HydrophobicContact CZ-CD2 4.14Å; P105-L127 VanDerWaalsContact CB-O 3.26Å; P105-L127 WeakPolarHBondContact CB-O 3.26Å; P106-L127 WeakPolarHBondContact CD-O 3.43Å; P106-L127 HydrophobicContact CG-CB 4.31Å; P106-L127 PolarHBondContact O-N 2.91Å; V108-L127 HydrophobicContact CG2-CD1 3.51Å; L121-L127 HydrophobicContact CD2-CD1 4.48Å; L127-I130 HydrophobicContact CD2-CD1 4.32Å; L127-T135 HydrophobicContact CB-CG2 4.31Å; L127-T135 WeakPolarHBondContact O-CB 3.29Å; L127-T135 WeakPolarHBondContact O-CG2 3.43Å; L127-T135 PolarHBondContact O-OG1 3.22Å; L127-L147 HydrophobicContact CD2-CD1 4.05Å; L127-V159 HydrophobicContact CB-CG1 4.16Å; L127-V159 HydrophobicContact CD2-CG1 3.87Å; L127-V159 HydrophobicContact CG-CG1 3.82Å; L127-I161 HydrophobicContact CG-CG2 4.23Å
128	H	85.7	Confident	81.3	Confident	43 Å²	43	36.4 Å²	36.4	20%	0.199	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-39	-174.5	-170.1	-112.5	0	0	0	112.7	Y80 R126 T135 E160	Y80-H128 HydrophobicContact CE1-CB 4.26Å; Y80-H128 AromaticContact CE1-CG 3.92Å; Y80-H128 AromaticContact CE1-ND1 3.85Å; R126-H128 PolarHBondContact O-N 2.73Å; H128-T135 PolarHBondContact O-N 2.94Å; H128-T135 VanDerWaalsContact O-N 3.08Å; H128-T135 PolarHBondContact O-OG1 3.26Å; H128-T135 VanDerWaalsContact O-OG1 3.12Å; H128-E160 HydrophobicContact CB-CG 4.47Å; H128-E160 IonicContact CE1-OE2 3.01Å; H128-E160 IonicContact CG-OE2 3.15Å; H128-E160 PolarHBondContact N-O 3.39Å; H128-E160 IonicContact ND1-OE2 2.72Å; H128-E160 PolarHBondContact ND1-OE2 3.13Å
129	Q	86.9	Confident	82.4	Confident	58 Å²	58	38.8 Å²	38.8	27%	0.271	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	151.3	173	-56	-176.8	61.7	0	0	111.7	I133 V159 E160	Q129-I133 CarbonylContact C-O 3.53Å; Q129-I133 VanDerWaalsContact CA-O 3.3Å; Q129-I133 WeakPolarHBondContact CA-O 3.46Å; Q129-V159 CarbonylContact O-C 3.59Å; Q129-V159 WeakPolarHBondContact O-CA 3.22Å; Q129-V159 WeakPolarHBondContact O-CG1 3.25Å; Q129-E160 HydrophobicContact CB-CB 3.93Å; Q129-E160 HydrophobicContact CG-CB 4.39Å; Q129-E160 WeakPolarHBondContact CG-OE2 3.33Å; Q129-E160 PolarHBondContact N-O 3.22Å; Q129-E160 PolarHBondContact NE2-OE2 3.48Å; Q129-E160 PolarHBondContact O-N 2.96Å
130	I	86.8	Confident	83.2	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	121.3	169.2	-62	164.3	0	0	0	107.1	L127 G132 I133 T135 V143 M146 L147 A157 I158 V159	L127-I130 HydrophobicContact CD2-CD1 4.32Å; I130-G132 PolarHBondContact O-N 2.81Å; I130-I133 PolarHBondContact N-O 2.85Å; I130-I133 WeakPolarHBondContact O-CA 3.23Å; I130-I133 VanDerWaalsContact O-CB 3.29Å; I130-I133 WeakPolarHBondContact O-CB 3.46Å; I130-I133 PolarHBondContact O-N 2.77Å; I130-T135 HydrophobicContact CD1-CG2 3.95Å; I130-T135 HydrophobicContact CG1-CG2 4.03Å; I130-V143 HydrophobicContact CD1-CG1 3.71Å; I130-M146 HydrophobicContact CB-CE 4.11Å; I130-M146 HydrophobicContact CD1-CE 3.96Å; I130-M146 HydrophobicContact CG2-CB 4.26Å; I130-L147 HydrophobicContact CD1-CD2 3.65Å; I130-L147 HydrophobicContact CD1-CG 3.84Å; I130-L147 HydrophobicContact CG1-CD2 3.94Å; I130-L147 HydrophobicContact CG2-CD2 3.99Å; I130-A157 HydrophobicContact CG2-CB 4.43Å; I130-I158 CarbonylContact C-O 3.56Å; I130-I158 WeakPolarHBondContact CA-O 3.41Å; I130-V159 HydrophobicContact CG1-CG1 4.16Å; I130-V159 HydrophobicContact CG1-CG2 4.17Å
131	D	83.4	Confident	83.5	Confident	59 Å²	59	46.3 Å²	46.3	32%	0.316	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	31.2	-177.1	-53.7	-41.7	0	0	0	114.3	R87 I133 A157 I158	R87-D131 IonicContact CZ-OD1 2.7Å; R87-D131 IonicContact CZ-OD2 3.27Å; R87-D131 IonicContact NH1-OD2 3.07Å; R87-D131 PolarHBondContact NH1-OD2 3.19Å; R87-D131 IonicContact NH2-OD1 3.9Å; R87-D131 PolarHBondContact NH2-OD1 3.23Å; R87-D131 IonicContact NH2-OD2 3.04Å; R87-D131 PolarHBondContact NH2-OD2 3.33Å; D131-I133 VanDerWaalsContact C-N 3.29Å; D131-A157 WeakPolarHBondContact OD1-CA 3.49Å; D131-I158 PolarHBondContact N-O 3.27Å; D131-I158 PolarHBondContact OD1-N 2.82Å
132	G	79.6	Confident	83.7	Confident	58 Å²	58	52 Å²	52	60%	0.598	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.9	5.4	-173.9	0	0	0	0	0	114.8	I130	I130-G132 PolarHBondContact O-N 2.81Å
133	I	84.8	Confident	84.1	Confident	90 Å²	90	51.6 Å²	51.6	46%	0.462	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.9	172.3	-51.2	176.7	0	0	0	108.3	Q129 I130 D131 L138 M146	Q129-I133 CarbonylContact C-O 3.53Å; Q129-I133 VanDerWaalsContact CA-O 3.3Å; Q129-I133 WeakPolarHBondContact CA-O 3.46Å; I130-I133 PolarHBondContact N-O 2.85Å; I130-I133 WeakPolarHBondContact O-CA 3.23Å; I130-I133 VanDerWaalsContact O-CB 3.29Å; I130-I133 WeakPolarHBondContact O-CB 3.46Å; I130-I133 PolarHBondContact O-N 2.77Å; D131-I133 VanDerWaalsContact C-N 3.29Å; I133-L138 HydrophobicContact CG2-CD1 4.39Å; I133-M146 HydrophobicContact CB-SD 4.41Å; I133-M146 HydrophobicContact CD1-SD 4.12Å; I133-M146 HydrophobicContact CG2-CE 4.38Å; I133-M146 HydrophobicContact CG2-SD 4.11Å
134	S	85.6	Confident	84.2	Confident	51 Å²	51	50.4 Å²	50.4	36%	0.357	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	140.2	174.1	-175	0	0	0	0	111.7	I136 L138	S134-I136 PolarHBondContact OG-N 3.38Å; S134-L138 WeakPolarHBondContact O-CD1 3.4Å
135	T	85.5	Confident	84.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.296	C	S	.	.			trans	-85.2	-12.2	178.3	59.6	0	0	0	0	113.3	P106 L127 H128 I130 L138	P106-T135 WeakPolarHBondContact CD-OG1 3.35Å; P106-T135 HydrophobicContact CG-CG2 4.4Å; L127-T135 HydrophobicContact CB-CG2 4.31Å; L127-T135 WeakPolarHBondContact O-CB 3.29Å; L127-T135 WeakPolarHBondContact O-CG2 3.43Å; L127-T135 PolarHBondContact O-OG1 3.22Å; H128-T135 PolarHBondContact O-N 2.94Å; H128-T135 VanDerWaalsContact O-N 3.08Å; H128-T135 PolarHBondContact O-OG1 3.26Å; H128-T135 VanDerWaalsContact O-OG1 3.12Å; I130-T135 HydrophobicContact CD1-CG2 3.95Å; I130-T135 HydrophobicContact CG1-CG2 4.03Å; T135-L138 WeakPolarHBondContact O-CB 3.39Å; T135-L138 PolarHBondContact O-N 3.27Å
136	I	85.7	Confident	84.3	Confident	68 Å²	68	54.4 Å²	54.4	35%	0.349	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	137.5	177.3	-62.5	170.3	0	0	0	108.7	S103 S134 L138	S103-I136 WeakPolarHBondContact O-CG2 3.31Å; S134-I136 PolarHBondContact OG-N 3.38Å; I136-L138 PolarHBondContact O-N 2.59Å
137	G	81	Confident	83.9	Confident	50 Å²	50	50.1 Å²	50.1	52%	0.515	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	-8.3	-173.6	0	0	0	0	0	115.5	L102	L102-G137 PolarHBondContact O-N 2.86Å
138	L	85.3	Confident	83.2	Confident	29 Å²	29	51.7 Å²	51.7	15%	0.152	30%	0.295	C	S	.	.			trans	-93.3	138.5	176.9	-55.7	-174.1	0	0	0	111.3	R99 I133 S134 T135 I136 K142 V143 M146	R99-L138 PolarHBondContact NH2-O 3.16Å; I133-L138 HydrophobicContact CG2-CD1 4.39Å; S134-L138 WeakPolarHBondContact O-CD1 3.4Å; T135-L138 WeakPolarHBondContact O-CB 3.39Å; T135-L138 PolarHBondContact O-N 3.27Å; I136-L138 PolarHBondContact O-N 2.59Å; L138-K142 HydrophobicContact CD2-CD 4.12Å; L138-V143 HydrophobicContact CB-CG2 3.81Å; L138-M146 HydrophobicContact CD1-CE 3.44Å; L138-M146 VanDerWaalsContact CD1-CE 3.44Å; L138-M146 HydrophobicContact CD1-SD 3.91Å
139	S	85.8	Confident	82.2	Confident	52 Å²	52	52.3 Å²	52.3	36%	0.364	31%	0.308	S	S	.	.			trans	-70.3	154.2	174.7	69.3	0	0	0	0	112.4	Q141 K142 V143	S139-Q141 PolarHBondContact O-N 3.21Å; S139-Q141 VanDerWaalsContact O-N 3.17Å; S139-K142 PolarHBondContact O-N 2.88Å; S139-K142 PolarHBondContact OG-N 3.47Å; S139-V143 WeakPolarHBondContact O-CG2 3.28Å; S139-V143 PolarHBondContact O-N 2.87Å
140	N	85.9	Confident	80.8	Confident	37 Å²	37	51.4 Å²	51.4	20%	0.198	31%	0.313	C	S	.	.	H	α-helix	trans	-55.5	-35.4	179.3	-70.1	2.1	0	0	0	112.8	F96 A97 R99 M144	F96-N140 HydrophobicContact CB-CB 4.22Å; F96-N140 WeakPolarHBondContact CB-ND2 3.28Å; F96-N140 HydrophobicContact CD2-CB 4.22Å; A97-N140 PolarHBondContact O-ND2 3.41Å; R99-N140 PolarHBondContact NE-OD1 3.12Å; R99-N140 PolarHBondContact NH2-OD1 3.24Å; N140-M144 WeakPolarHBondContact O-CB 3.33Å; N140-M144 PolarHBondContact O-N 2.85Å
141	Q	83.3	Confident	79.3	Confident	156 Å²	156	54.1 Å²	54.1	73%	0.729	34%	0.342	S	S	*	.	H	α-helix	trans	-63.9	-43.3	173.2	-68.4	179.1	-7.1	0	0	112.2	S139 M144 N145	S139-Q141 PolarHBondContact O-N 3.21Å; S139-Q141 VanDerWaalsContact O-N 3.17Å; Q141-M144 PolarHBondContact O-N 3.37Å; Q141-N145 WeakPolarHBondContact O-CB 3.44Å; Q141-N145 PolarHBondContact O-N 3.36Å; Q141-N145 PolarHBondContact O-OD1 2.72Å
142	K	82.8	Confident	77.9	Confident	120 Å²	120	57.1 Å²	57.1	52%	0.522	37%	0.367	S	S	.	.	H	α-helix	trans	-70.2	-37.8	179	-170.6	166	175.8	-175.9	0	111.6	L138 S139 N145 M146	L138-K142 HydrophobicContact CD2-CD 4.12Å; S139-K142 PolarHBondContact O-N 2.88Å; S139-K142 PolarHBondContact OG-N 3.47Å; K142-N145 PolarHBondContact O-N 3.39Å; K142-M146 WeakPolarHBondContact O-CG 3.07Å; K142-M146 PolarHBondContact O-N 2.88Å
143	V	84.5	Confident	76.6	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-60.8	-48.7	172.3	172.8	0	0	0	0	111	F96 P106 I130 L138 S139 N145 M146 L147	F96-V143 HydrophobicContact CE1-CG1 4.4Å; F96-V143 HydrophobicContact CE2-CG1 3.95Å; F96-V143 HydrophobicContact CZ-CG1 3.75Å; P106-V143 HydrophobicContact CG-CG1 4.02Å; P106-V143 HydrophobicContact CG-CG2 4.21Å; I130-V143 HydrophobicContact CD1-CG1 3.71Å; L138-V143 HydrophobicContact CB-CG2 3.81Å; S139-V143 WeakPolarHBondContact O-CG2 3.28Å; S139-V143 PolarHBondContact O-N 2.87Å; V143-N145 VanDerWaalsContact C-N 3.31Å; V143-N145 PolarHBondContact O-N 2.8Å; V143-M146 PolarHBondContact O-N 2.73Å; V143-M146 VanDerWaalsContact O-N 3.08Å; V143-L147 PolarHBondContact O-N 2.71Å
144	M	82.3	Confident	75.4	Confident	42 Å²	42	59.2 Å²	59.2	21%	0.207	37%	0.372	C	S	.	.	H	α-helix	trans	-61.1	-41.1	175.9	-166.1	61.9	177.2	0	0	111.4	L92 F96 N140 Q141 M146 L147 C148	L92-M144 HydrophobicContact CB-CE 4.45Å; F96-M144 HydrophobicContact CE2-CB 4.09Å; F96-M144 HydrophobicContact CE2-SD 4Å; N140-M144 WeakPolarHBondContact O-CB 3.33Å; N140-M144 PolarHBondContact O-N 2.85Å; Q141-M144 PolarHBondContact O-N 3.37Å; M144-M146 VanDerWaalsContact C-N 3.25Å; M144-M146 PolarHBondContact O-N 2.7Å; M144-L147 PolarHBondContact O-N 2.77Å; M144-L147 HydrophobicContact SD-CD1 4.44Å; M144-C148 WeakPolarHBondContact O-CB 3.29Å; M144-C148 PolarHBondContact O-N 3.43Å; M144-C148 PolarHBondContact O-SG 3.31Å
145	N	81.4	Confident	74.3	Confident	112 Å²	112	61.6 Å²	61.6	60%	0.599	39%	0.387	S	S	*	.	H	α-helix	trans	-62	-28.9	175.2	-72.9	-7.2	0	0	0	113.1	Q141 K142 V143 C148 A149	Q141-N145 WeakPolarHBondContact O-CB 3.44Å; Q141-N145 PolarHBondContact O-N 3.36Å; Q141-N145 PolarHBondContact O-OD1 2.72Å; K142-N145 PolarHBondContact O-N 3.39Å; V143-N145 VanDerWaalsContact C-N 3.31Å; V143-N145 PolarHBondContact O-N 2.8Å; N145-C148 CarbonylContact O-C 3.54Å; N145-A149 WeakPolarHBondContact O-CA 3.38Å; N145-A149 VanDerWaalsContact O-CB 3.28Å; N145-A149 WeakPolarHBondContact O-CB 3.41Å; N145-A149 PolarHBondContact O-N 3.24Å
146	M	80.3	Confident	73.8	Confident	26 Å²	26	64.9 Å²	64.9	13%	0.128	41%	0.408	C	S	.	.	H	α-helix	trans	-73.5	-43	173.5	-64.8	-168.6	-47.2	0	0	112.1	I130 I133 L138 K142 V143 M144 C148 A149	I130-M146 HydrophobicContact CB-CE 4.11Å; I130-M146 HydrophobicContact CD1-CE 3.96Å; I130-M146 HydrophobicContact CG2-CB 4.26Å; I133-M146 HydrophobicContact CB-SD 4.41Å; I133-M146 HydrophobicContact CD1-SD 4.12Å; I133-M146 HydrophobicContact CG2-CE 4.38Å; I133-M146 HydrophobicContact CG2-SD 4.11Å; L138-M146 HydrophobicContact CD1-CE 3.44Å; L138-M146 VanDerWaalsContact CD1-CE 3.44Å; L138-M146 HydrophobicContact CD1-SD 3.91Å; K142-M146 WeakPolarHBondContact O-CG 3.07Å; K142-M146 PolarHBondContact O-N 2.88Å; V143-M146 PolarHBondContact O-N 2.73Å; V143-M146 VanDerWaalsContact O-N 3.08Å; M144-M146 VanDerWaalsContact C-N 3.25Å; M144-M146 PolarHBondContact O-N 2.7Å; M146-C148 PolarHBondContact O-N 2.84Å; M146-A149 WeakPolarHBondContact O-CB 3.49Å; M146-A149 PolarHBondContact O-N 3.04Å; M146-A149 VanDerWaalsContact O-N 3.09Å
147	L	76.9	Confident	73.4	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.005	39%	0.392	C	S	.	.	H	α-helix	trans	-61.5	-31.9	173.1	-63.3	178.3	0	0	0	112.2	L85 R87 L92 I94 F96 L127 I130 V143 M144 A157 V159	L85-L147 HydrophobicContact CD1-CD2 4.36Å; R87-L147 WeakPolarHBondContact CA-O 3.32Å; L92-L147 HydrophobicContact CD1-CB 3.94Å; I94-L147 HydrophobicContact CD1-CD1 3.95Å; F96-L147 HydrophobicContact CZ-CD1 3.87Å; L127-L147 HydrophobicContact CD2-CD1 4.05Å; I130-L147 HydrophobicContact CD1-CD2 3.65Å; I130-L147 HydrophobicContact CD1-CG 3.84Å; I130-L147 HydrophobicContact CG1-CD2 3.94Å; I130-L147 HydrophobicContact CG2-CD2 3.99Å; V143-L147 PolarHBondContact O-N 2.71Å; M144-L147 PolarHBondContact O-N 2.77Å; M144-L147 HydrophobicContact SD-CD1 4.44Å; L147-A157 HydrophobicContact CD2-CB 4.39Å; L147-V159 HydrophobicContact CD2-CG2 3.75Å
148	C	73.9	Confident	73.5	Confident	33 Å²	33	63.7 Å²	63.7	22%	0.223	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	3.4	176.7	-60.1	0	0	0	0	113.9	A89 M144 N145 M146 G150	A89-C148 VanDerWaalsContact CA-SG 3.54Å; A89-C148 HydrophobicContact CB-CB 3.99Å; A89-C148 WeakPolarHBondContact CB-SG 3.49Å; M144-C148 WeakPolarHBondContact O-CB 3.29Å; M144-C148 PolarHBondContact O-N 3.43Å; M144-C148 PolarHBondContact O-SG 3.31Å; N145-C148 CarbonylContact O-C 3.54Å; M146-C148 PolarHBondContact O-N 2.84Å; C148-G150 VanDerWaalsContact C-N 3.32Å; C148-G150 PolarHBondContact O-N 3.17Å
149	A	65.6	Low	73.4	Confident	56 Å²	56	62.3 Å²	62.3	46%	0.463	38%	0.383	S	S	.	.			trans	-79.2	79.7	-177.6	0	0	0	0	0	110.8	R87 N145 M146	R87-A149 WeakPolarHBondContact CD-O 3.4Å; R87-A149 PolarHBondContact NH1-O 2.73Å; N145-A149 WeakPolarHBondContact O-CA 3.38Å; N145-A149 VanDerWaalsContact O-CB 3.28Å; N145-A149 WeakPolarHBondContact O-CB 3.41Å; N145-A149 PolarHBondContact O-N 3.24Å; M146-A149 WeakPolarHBondContact O-CB 3.49Å; M146-A149 PolarHBondContact O-N 3.04Å; M146-A149 VanDerWaalsContact O-N 3.09Å
150	G	56.3	Low	73.4	Confident	38 Å²	38	62.1 Å²	62.1	39%	0.392	38%	0.376	S	S	.	.			trans	-164.9	146.1	176.3	0	0	0	0	0	112.6	C148	C148-G150 VanDerWaalsContact C-N 3.32Å; C148-G150 PolarHBondContact O-N 3.17Å
151	G	56	Low	73.5	Confident	59 Å²	59	60.4 Å²	60.4	61%	0.608	37%	0.367	S	S	*	.			trans	-74.8	-175.8	156.8	0	0	0	0	0	110.8	D153 A154	G151-D153 PolarHBondContact O-N 2.84Å; G151-A154 WeakPolarHBondContact O-CB 3.47Å; G151-A154 PolarHBondContact O-N 2.92Å
152	S	53.1	Low	73.4	Confident	121 Å²	121	54.3 Å²	54.3	85%	0.846	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-29	175.5	45.8	0	0	0	0	113.7
153	D	52.1	Low	73.1	Confident	152 Å²	152	49.2 Å²	49.2	81%	0.813	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	11.3	-168.5	-47.4	-5.1	0	0	0	111.9	G151	G151-D153 PolarHBondContact O-N 2.84Å
154	A	60	Low	72.2	Confident	41 Å²	41	53.3 Å²	53.3	34%	0.339	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-75.6	136.4	-175.3	0	0	0	0	0	112.8	G151	G151-A154 WeakPolarHBondContact O-CB 3.47Å; G151-A154 PolarHBondContact O-N 2.92Å
155	C	63.1	Low	71.4	Confident	100 Å²	100	52.8 Å²	52.8	68%	0.676	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-55.9	148.4	172.3	-68.9	0	0	0	0	111.4	R87	R87-C155 WeakPolarHBondContact CD-O 3.4Å; R87-C155 WeakPolarHBondContact CG-O 3.42Å; R87-C155 PolarHBondContact NE-O 2.86Å
156	P	73.7	Confident	70.3	Confident	69 Å²	69	50.4 Å²	50.4	45%	0.448	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-56.5	147.6	177.4	24.7	-34.3	0	0	0	111.7	L85	L85-P156 CarbonylContact O-C 3.55Å; L85-P156 WeakPolarHBondContact O-CA 3.24Å; L85-P156 WeakPolarHBondContact O-CB 3.33Å
157	A	77.9	Confident	68.9	Low	1 Å²	1	55.6 Å²	55.6	1%	0.008	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	132.2	172.2	0	0	0	0	0	109.8	T84 L85 R87 I130 D131 L147 V159	T84-A157 WeakPolarHBondContact CA-O 3.32Å; L85-A157 PolarHBondContact N-O 2.84Å; L85-A157 PolarHBondContact O-N 3.49Å; R87-A157 HydrophobicContact CG-CB 3.98Å; I130-A157 HydrophobicContact CG2-CB 4.43Å; D131-A157 WeakPolarHBondContact OD1-CA 3.49Å; L147-A157 HydrophobicContact CD2-CB 4.39Å; A157-V159 HydrophobicContact CB-CG2 4.38Å
158	I	82.6	Confident	67.2	Low	92 Å²	92	59.2 Å²	59.2	47%	0.472	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	115.3	175.1	-60.3	177.5	0	0	0	107	T82 I130 D131	T82-I158 HydrophobicContact CG2-CG2 3.45Å; T82-I158 VanDerWaalsContact CG2-CG2 3.45Å; I130-I158 CarbonylContact C-O 3.56Å; I130-I158 WeakPolarHBondContact CA-O 3.41Å; D131-I158 PolarHBondContact N-O 3.27Å; D131-I158 PolarHBondContact OD1-N 2.82Å
159	V	85.1	Confident	65.7	Low	0 Å²	0	61.2 Å²	61.2	0%	0	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	124.1	-175.3	-173.3	0	0	0	0	109.6	T82 I83 L85 L127 Q129 I130 L147 A157 I161	T82-V159 WeakPolarHBondContact CA-O 3.25Å; I83-V159 HydrophobicContact CG1-CB 3.98Å; I83-V159 PolarHBondContact N-O 3.25Å; I83-V159 PolarHBondContact O-N 2.87Å; L85-V159 HydrophobicContact CD1-CG2 3.95Å; L85-V159 HydrophobicContact CG-CG2 4.28Å; L127-V159 HydrophobicContact CB-CG1 4.16Å; L127-V159 HydrophobicContact CD2-CG1 3.87Å; L127-V159 HydrophobicContact CG-CG1 3.82Å; Q129-V159 CarbonylContact O-C 3.59Å; Q129-V159 WeakPolarHBondContact O-CA 3.22Å; Q129-V159 WeakPolarHBondContact O-CG1 3.25Å; I130-V159 HydrophobicContact CG1-CG1 4.16Å; I130-V159 HydrophobicContact CG1-CG2 4.17Å; L147-V159 HydrophobicContact CD2-CG2 3.75Å; A157-V159 HydrophobicContact CB-CG2 4.38Å; V159-I161 HydrophobicContact CG1-CG2 3.86Å
160	E	84.3	Confident	64.5	Low	49 Å²	49	62.2 Å²	62.2	23%	0.229	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	122.9	166	-174.9	179.8	-106	0	0	108.3	Y80 A81 H128 Q129	Y80-E160 HydrophobicContact CD1-CG 4.07Å; A81-E160 WeakPolarHBondContact O-CA 3.03Å; H128-E160 HydrophobicContact CB-CG 4.47Å; H128-E160 IonicContact CE1-OE2 3.01Å; H128-E160 IonicContact CG-OE2 3.15Å; H128-E160 PolarHBondContact N-O 3.39Å; H128-E160 IonicContact ND1-OE2 2.72Å; H128-E160 PolarHBondContact ND1-OE2 3.13Å; Q129-E160 HydrophobicContact CB-CB 3.93Å; Q129-E160 HydrophobicContact CG-CB 4.39Å; Q129-E160 WeakPolarHBondContact CG-OE2 3.33Å; Q129-E160 PolarHBondContact N-O 3.22Å; Q129-E160 PolarHBondContact NE2-OE2 3.48Å; Q129-E160 PolarHBondContact O-N 2.96Å
161	I	87.4	Confident	63.7	Low	0 Å²	0	66.6 Å²	66.6	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.2	176.8	59.1	173.1	0	0	0	110.7	Y80 A81 I83 L121 R126 L127 V159 R197	Y80-I161 CarbonylContact C-O 3.6Å; Y80-I161 VanDerWaalsContact CA-O 3.3Å; Y80-I161 WeakPolarHBondContact CA-O 3.4Å; A81-I161 HydrophobicContact CB-CD1 4.48Å; A81-I161 HydrophobicContact CB-CG1 4.01Å; A81-I161 PolarHBondContact N-O 3.28Å; A81-I161 WeakPolarHBondContact O-CG1 3.4Å; A81-I161 PolarHBondContact O-N 2.85Å; I83-I161 HydrophobicContact CD1-CD1 4.21Å; I83-I161 HydrophobicContact CD1-CG2 4.18Å; I83-I161 HydrophobicContact CG1-CD1 4.49Å; I83-I161 HydrophobicContact CG1-CG2 4.37Å; I83-I161 HydrophobicContact CG2-CD1 4.01Å; I83-I161 HydrophobicContact CG2-CG1 4.47Å; L121-I161 HydrophobicContact CD2-CD1 4.37Å; L121-I161 HydrophobicContact CD2-CG2 3.83Å; R126-I161 CarbonylContact O-C 3.57Å; R126-I161 VanDerWaalsContact O-CA 3.25Å; R126-I161 WeakPolarHBondContact O-CA 3.26Å; L127-I161 HydrophobicContact CG-CG2 4.23Å; V159-I161 HydrophobicContact CG1-CG2 3.86Å; I161-R197 VanDerWaalsContact CD1-CZ 3.43Å; I161-R197 VanDerWaalsContact CD1-NH2 3.32Å
162	E	81.6	Confident	62.8	Low	28 Å²	28	70.9 Å²	70.9	13%	0.131	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	135.1	167	175.5	-167.9	-159.5	0	0	108.5	T78 T79 Y80 R126	T78-E162 VanDerWaalsContact CB-OE1 3.25Å; T78-E162 WeakPolarHBondContact CB-OE1 3.28Å; T78-E162 HydrophobicContact CG2-CG 4.16Å; T78-E162 WeakPolarHBondContact CG2-OE1 3.19Å; T78-E162 PolarHBondContact OG1-OE1 2.41Å; T79-E162 WeakPolarHBondContact O-CA 3.38Å; Y80-E162 HydrophobicContact CD1-CB 4.01Å; Y80-E162 HydrophobicContact CE1-CB 3.74Å; Y80-E162 HydrophobicContact CE1-CG 4.17Å; R126-E162 HydrophobicContact CB-CB 4Å; R126-E162 WeakPolarHBondContact CD-OE2 3.33Å; R126-E162 PolarHBondContact N-O 3.36Å; R126-E162 PolarHBondContact O-N 3.28Å
163	Y	77.8	Confident	62.4	Low	13 Å²	13	66.6 Å²	66.6	5%	0.051	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	153.7	179.7	64.7	-83.6	0	0	0	111.3	T78 T79 A81 L165 R197 G198	T78-Y163 WeakPolarHBondContact CA-O 3.34Å; T79-Y163 HydrophobicContact CG2-CE1 4.16Å; T79-Y163 HydrophobicContact CG2-CE2 4.41Å; T79-Y163 WeakPolarHBondContact CG2-OH 3.46Å; T79-Y163 PolarHBondContact N-O 2.98Å; T79-Y163 WeakPolarHBondContact O-CD1 3.41Å; T79-Y163 VanDerWaalsContact O-CE1 3.3Å; T79-Y163 WeakPolarHBondContact O-CE1 3.47Å; T79-Y163 PolarHBondContact O-N 3.4Å; A81-Y163 HydrophobicContact CB-CD1 4.31Å; A81-Y163 HydrophobicContact CB-CE1 3.6Å; Y163-L165 HydrophobicContact CE2-CD2 3.82Å; Y163-L165 HydrophobicContact CE2-CG 3.9Å; Y163-R197 VanDerWaalsContact CB-NH1 3.35Å; Y163-R197 HydrophobicContact CD2-CB 4.07Å; Y163-R197 HydrophobicContact CD2-CG 3.86Å; Y163-R197 HydrophobicContact CE2-CB 3.51Å; Y163-R197 HydrophobicContact CE2-CG 3.77Å; Y163-R197 HydrophobicContact CG-CG 4.38Å; Y163-G198 PolarHBondContact OH-N 2.74Å
164	S	65.1	Low	62.4	Low	86 Å²	86	66.8 Å²	66.8	60%	0.601	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83	128.2	166.8	53.2	0	0	0	0	110
165	L	65.3	Low	62.3	Low	31 Å²	31	68.7 Å²	68.7	16%	0.162	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-67.1	136.5	161.2	-76.5	164.3	0	0	0	109	Y163 R197 Y202	Y163-L165 HydrophobicContact CE2-CD2 3.82Å; Y163-L165 HydrophobicContact CE2-CG 3.9Å; L165-R197 HydrophobicContact CD2-CB 4.49Å; L165-Y202 HydrophobicContact CD1-CD1 3.89Å; L165-Y202 HydrophobicContact CD1-CD2 4.32Å; L165-Y202 HydrophobicContact CD1-CE1 4.08Å; L165-Y202 HydrophobicContact CD1-CE2 4.49Å; L165-Y202 HydrophobicContact CD1-CG 4.02Å
166	P	58	Low	62.5	Low	62 Å²	62	64.9 Å²	64.9	40%	0.403	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-56.3	142.5	166.8	-23.1	34	0	0	0	110.4	C168	P166-C168 PolarHBondContact O-N 3.38Å
167	E	50.7	Low	62.7	Low	135 Å²	135	64.9 Å²	64.9	63%	0.631	37%	0.365	S	S	*	.			trans	-60	112.4	172.7	-76.1	-178	127	0	0	108.6	R76 I169	R76-E167 IonicContact CZ-OE1 3.29Å; R76-E167 IonicContact CZ-OE2 3.31Å; R76-E167 IonicContact NH1-OE1 3.08Å; R76-E167 PolarHBondContact NH1-OE1 2.8Å; R76-E167 IonicContact NH1-OE2 2.71Å; R76-E167 PolarHBondContact NH1-OE2 2.79Å; R76-E167 VanDerWaalsContact NH2-CD 3.3Å; R76-E167 IonicContact NH2-OE1 2.74Å; R76-E167 PolarHBondContact NH2-OE1 3.37Å; R76-E167 IonicContact NH2-OE2 3.73Å; R76-E167 PolarHBondContact NH2-OE2 3.32Å; E167-I169 PolarHBondContact O-N 3.46Å
168	C	41.1	Very low	63	Low	78 Å²	78	66.6 Å²	66.6	53%	0.527	38%	0.377	S	S	.	.			trans	-67.3	102	-177.2	-67.9	0	0	0	0	109	P166 S170	P166-C168 PolarHBondContact O-N 3.38Å; C168-S170 PolarHBondContact O-N 2.88Å; C168-S170 VanDerWaalsContact O-N 3.16Å
169	I	42.5	Very low	63.1	Low	75 Å²	75	65.9 Å²	65.9	39%	0.385	37%	0.37	S	S	.	.			trans	-53.8	122	173.1	-59.3	173.6	0	0	0	107.3	P64 E167 Q171 S173	P64-I169 HydrophobicContact CB-CD1 3.43Å; P64-I169 VanDerWaalsContact CB-CD1 3.43Å; P64-I169 HydrophobicContact CG-CD1 4.26Å; E167-I169 PolarHBondContact O-N 3.46Å; I169-Q171 PolarHBondContact O-N 3.32Å; I169-S173 WeakPolarHBondContact CG2-OG 3.47Å
170	S	40.2	Very low	63.3	Low	77 Å²	77	71.4 Å²	71.4	54%	0.538	40%	0.399	S	S	.	.			trans	-62.9	136.6	-176.3	59.1	0	0	0	0	110.1	C168 N172 S173	C168-S170 PolarHBondContact O-N 2.88Å; C168-S170 VanDerWaalsContact O-N 3.16Å; S170-N172 PolarHBondContact O-N 3.24Å; S170-S173 PolarHBondContact O-N 3.42Å; S170-S173 PolarHBondContact O-OG 2.85Å; S170-S173 PolarHBondContact OG-OG 3.03Å
171	Q	40.2	Very low	63.6	Low	130 Å²	130	69.3 Å²	69.3	61%	0.607	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	3.7	177.7	-70.7	170.6	-44.5	0	0	114.2	I169 E262	I169-Q171 PolarHBondContact O-N 3.32Å; Q171-E262 PolarHBondContact NE2-OE1 2.92Å
172	N	37.2	Very low	63.8	Low	149 Å²	149	74.5 Å²	74.5	80%	0.797	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.7	14.1	178.1	-69.4	-19.7	0	0	0	113	S170 L174	S170-N172 PolarHBondContact O-N 3.24Å; N172-L174 PolarHBondContact O-N 2.86Å
173	S	43.8	Very low	64.2	Low	30 Å²	30	73.3 Å²	73.3	21%	0.21	41%	0.409	C	S	.	.			trans	-67.9	116.3	176.6	-59.1	0	0	0	0	110.4	I169 S170 C175 V176	I169-S173 WeakPolarHBondContact CG2-OG 3.47Å; S170-S173 PolarHBondContact O-N 3.42Å; S170-S173 PolarHBondContact O-OG 2.85Å; S170-S173 PolarHBondContact OG-OG 3.03Å; S173-C175 PolarHBondContact O-N 2.92Å; S173-V176 PolarHBondContact O-N 3.16Å
174	L	52.9	Low	64.7	Low	157 Å²	157	76.6 Å²	76.6	82%	0.822	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-14.1	-174.5	-68.8	172.6	0	0	0	115.7	N172	N172-L174 PolarHBondContact O-N 2.86Å
175	C	57.3	Low	65.8	Low	81 Å²	81	72.5 Å²	72.5	55%	0.547	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-1.4	177.4	54.5	0	0	0	0	114.5	S173 S266 V267	S173-C175 PolarHBondContact O-N 2.92Å; C175-S266 CarbonylContact O-C 3.5Å; C175-S266 WeakPolarHBondContact O-CA 3.39Å; C175-V267 PolarHBondContact O-N 3.16Å
176	V	68.1	Low	66.6	Low	20 Å²	20	76.7 Å²	76.7	12%	0.121	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	136.5	-175.1	176.2	0	0	0	0	110.8	S173 D264 V265	S173-V176 PolarHBondContact O-N 3.16Å; V176-D264 HydrophobicContact CG1-CB 3.63Å; V176-V265 CarbonylContact C-O 3.55Å; V176-V265 WeakPolarHBondContact CA-O 3.32Å
177	T	78.8	Confident	67.6	Low	68 Å²	68	75.6 Å²	75.6	42%	0.417	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	137.1	173.1	-171.3	0	0	0	0	110.2	V265 V267	T177-V265 HydrophobicContact CG2-CB 4.12Å; T177-V265 HydrophobicContact CG2-CG1 4.43Å; T177-V265 PolarHBondContact N-O 2.91Å; T177-V265 WeakPolarHBondContact O-CB 3.08Å; T177-V265 PolarHBondContact O-N 2.66Å; T177-V267 HydrophobicContact CG2-CG2 3.86Å
178	S	82.4	Confident	68.4	Low	37 Å²	37	73.5 Å²	73.5	26%	0.259	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	133.4	-177.7	-48	0	0	0	0	110.8	R226 E262 Y263 D264	S178-R226 PolarHBondContact OG-NH2 3.42Å; S178-R226 VanDerWaalsContact OG-NH2 3.12Å; S178-E262 VanDerWaalsContact CB-OE1 3.29Å; S178-E262 WeakPolarHBondContact CB-OE1 3.37Å; S178-Y263 CarbonylContact C-O 3.43Å; S178-Y263 WeakPolarHBondContact CA-O 3.4Å; S178-D264 WeakPolarHBondContact CB-OD1 3.5Å; S178-D264 PolarHBondContact OG-OD1 3.41Å
179	K	85.4	Confident	69.5	Low	77 Å²	77	74.6 Å²	74.6	34%	0.335	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	161	178.3	-65.5	-172.8	-163.6	170.4	0	111	E262 Y263 V265 D335	K179-E262 CarbonylContact O-C 3.53Å; K179-E262 VanDerWaalsContact O-CA 3.29Å; K179-E262 WeakPolarHBondContact O-CA 3.43Å; K179-Y263 HydrophobicContact CB-CD1 4.48Å; K179-Y263 HydrophobicContact CB-CD2 4.5Å; K179-Y263 HydrophobicContact CB-CE1 3.76Å; K179-Y263 HydrophobicContact CB-CE2 3.82Å; K179-Y263 VanDerWaalsContact CB-OH 3.31Å; K179-Y263 WeakPolarHBondContact CB-OH 3.16Å; K179-Y263 HydrophobicContact CD-CE2 4.22Å; K179-Y263 PolarHBondContact N-O 2.89Å; K179-Y263 VanDerWaalsContact O-CD1 3.24Å; K179-Y263 WeakPolarHBondContact O-CD1 3.28Å; K179-Y263 WeakPolarHBondContact O-CE1 3.3Å; K179-Y263 PolarHBondContact O-N 3.15Å; K179-V265 HydrophobicContact CB-CG2 4.41Å; K179-V265 HydrophobicContact CD-CG2 3.77Å; K179-V265 HydrophobicContact CG-CG2 3.97Å; K179-D335 IonicContact NZ-OD1 3.36Å; K179-D335 PolarHBondContact NZ-OD1 3.1Å
180	L	90.3	Very high	70.6	Confident	116 Å²	116	72.9 Å²	72.9	61%	0.607	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.4	140.1	175.1	-60.8	-177.1	0	0	0	111.7	L228 I261 E262	L180-L228 HydrophobicContact CD2-CD1 3.69Å; L180-I261 WeakPolarHBondContact CA-O 3.31Å; L180-E262 HydrophobicContact CD2-CB 3.66Å; L180-E262 HydrophobicContact CD2-CG 3.97Å
181	A	90.1	Very high	72	Confident	6 Å²	6	70.7 Å²	70.7	5%	0.05	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	139.4	173.7	0	0	0	0	0	111	I183 T260 I261 Y263 P330 A331	A181-I183 HydrophobicContact CB-CG1 4.41Å; A181-T260 WeakPolarHBondContact O-CA 3.43Å; A181-I261 HydrophobicContact CB-CG1 4.23Å; A181-I261 PolarHBondContact N-O 2.89Å; A181-I261 PolarHBondContact O-N 2.7Å; A181-Y263 HydrophobicContact CB-CD1 3.99Å; A181-Y263 HydrophobicContact CB-CE1 3.39Å; A181-P330 HydrophobicContact CB-CB 4.08Å; A181-A331 HydrophobicContact CB-CB 3.9Å
182	Q	90.8	Very high	73.8	Confident	108 Å²	108	64.7 Å²	64.7	51%	0.505	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	124.8	167.7	-175	169.2	-34.1	0	0	109	N258 L259	Q182-N258 HydrophobicContact CG-CB 4.23Å; Q182-L259 CarbonylContact C-O 3.56Å; Q182-L259 WeakPolarHBondContact CA-O 3.3Å
183	I	90.2	Very high	75.7	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.021	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	115.9	-174	-61	165.8	0	0	0	107.9	A181 V185 T218 R220 I221 L259 I261 A331	A181-I183 HydrophobicContact CB-CG1 4.41Å; I183-V185 HydrophobicContact CG2-CG2 4.03Å; I183-T218 HydrophobicContact CG2-CG2 4.43Å; I183-R220 HydrophobicContact CD1-CB 3.66Å; I183-R220 HydrophobicContact CG1-CB 4.28Å; I183-R220 HydrophobicContact CG2-CB 4.46Å; I183-I221 HydrophobicContact CD1-CD1 4.19Å; I183-I221 HydrophobicContact CD1-CG1 3.56Å; I183-I221 HydrophobicContact CG2-CG1 4.5Å; I183-L259 PolarHBondContact N-O 3.39Å; I183-L259 PolarHBondContact O-N 2.92Å; I183-I261 HydrophobicContact CD1-CD1 3.56Å; I183-I261 HydrophobicContact CD1-CG1 3.85Å; I183-A331 HydrophobicContact CD1-CB 4.23Å
184	T	88.4	Confident	77.6	Confident	81 Å²	81	56.9 Å²	56.9	50%	0.497	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	127	172	-46.5	0	0	0	0	109.6	Y256 T257 N258	T184-Y256 HydrophobicContact CG2-CD1 4.29Å; T184-Y256 HydrophobicContact CG2-CG 4.45Å; T184-T257 CarbonylContact C-O 3.54Å; T184-T257 VanDerWaalsContact CA-O 3.26Å; T184-T257 WeakPolarHBondContact CA-O 3.11Å; T184-N258 PolarHBondContact OG1-OD1 3.33Å
185	V	87.4	Confident	79	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	133.7	-179.8	-169.1	0	0	0	0	108.9	I183 L192 P214 V215 T218 Y256 T257 L259	I183-V185 HydrophobicContact CG2-CG2 4.03Å; V185-L192 HydrophobicContact CB-CD2 4.41Å; V185-L192 HydrophobicContact CG1-CD2 4.14Å; V185-P214 HydrophobicContact CG1-CB 3.9Å; V185-V215 HydrophobicContact CG1-CG2 3.95Å; V185-V215 HydrophobicContact CG2-CG2 4.39Å; V185-T218 HydrophobicContact CG1-CG2 4.25Å; V185-T218 HydrophobicContact CG2-CG2 4.12Å; V185-Y256 CarbonylContact O-C 3.59Å; V185-Y256 WeakPolarHBondContact O-CA 3.48Å; V185-T257 PolarHBondContact N-O 3Å; V185-T257 PolarHBondContact O-N 2.56Å; V185-T257 PolarHBondContact O-OG1 3.23Å; V185-T257 VanDerWaalsContact O-OG1 3.11Å; V185-L259 HydrophobicContact CG2-CD1 3.82Å; V185-L259 HydrophobicContact CG2-CG 4.13Å
186	E	82.8	Confident	80.2	Confident	118 Å²	118	46 Å²	46	55%	0.551	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	143.8	171.9	-167.2	171.8	-176.8	0	0	110.6	P214 Y256	E186-P214 WeakPolarHBondContact O-CB 3.4Å; E186-Y256 HydrophobicContact CB-CD1 3.87Å; E186-Y256 HydrophobicContact CB-CE1 3.67Å; E186-Y256 HydrophobicContact CG-CD1 4.15Å; E186-Y256 HydrophobicContact CG-CE1 3.68Å
187	R	78.2	Confident	81	Confident	39 Å²	39	45.2 Å²	45.2	15%	0.147	25%	0.252	C	S	.	.			trans	-93.1	122.9	174.2	-71.6	180	174.2	-100.9	-0.6	110.6	G190 L192 I247 H252 G255 T257	R187-G190 PolarHBondContact NH1-O 2.85Å; R187-L192 HydrophobicContact CG-CD2 3.82Å; R187-I247 PolarHBondContact NH1-O 3.31Å; R187-I247 PolarHBondContact NH2-O 2.9Å; R187-H252 PolarHBondContact NE-CD2 3.24Å; R187-H252 VanDerWaalsContact NE-CD2 3.32Å; R187-H252 PolarHBondContact NH2-CD2 3.18Å; R187-H252 PolarHBondContact NH2-NE2 2.94Å; R187-G255 VanDerWaalsContact CB-O 3.29Å; R187-G255 WeakPolarHBondContact CB-O 3.26Å; R187-G255 PolarHBondContact N-O 2.98Å; R187-T257 HydrophobicContact CG-CG2 4.07Å
188	E	69.2	Low	81	Confident	91 Å²	91	42.3 Å²	42.3	43%	0.425	24%	0.236	S	C	.	.	B	Isolated β-bridge	trans	-107.8	125.7	170.9	-166.4	166.8	-157	0	0	107.9	G190 C191 P214 K217	E188-G190 PolarHBondContact O-N 2.87Å; E188-C191 PolarHBondContact N-O 2.8Å; E188-C191 PolarHBondContact O-N 2.95Å; E188-P214 HydrophobicContact CB-CG 3.41Å; E188-P214 VanDerWaalsContact CB-CG 3.41Å; E188-K217 IonicContact OE1-NZ 2.79Å; E188-K217 PolarHBondContact OE1-NZ 3.3Å; E188-K217 IonicContact OE2-NZ 2.73Å; E188-K217 PolarHBondContact OE2-NZ 2.87Å
189	S	63.5	Low	80.6	Confident	102 Å²	102	41.1 Å²	41.1	71%	0.713	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.4	24.3	-173.6	60.6	0	0	0	0	116.2	C191	S189-C191 VanDerWaalsContact C-N 3.29Å; S189-C191 PolarHBondContact O-N 2.88Å
190	G	64.9	Low	80.1	Confident	39 Å²	39	39.7 Å²	39.7	40%	0.402	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	-11	-179.6	0	0	0	0	0	114.9	R187 E188	R187-G190 PolarHBondContact NH1-O 2.85Å; E188-G190 PolarHBondContact O-N 2.87Å
191	C	70.9	Confident	79.1	Confident	30 Å²	30	41.7 Å²	41.7	20%	0.203	24%	0.244	C	C	.	.	B	Isolated β-bridge	trans	-95.7	163.9	176.9	-72.3	0	0	0	0	112.1	D119 E188 S189	D119-C191 WeakPolarHBondContact OD2-CB 3.44Å; D119-C191 PolarHBondContact OD2-SG 2.74Å; E188-C191 PolarHBondContact N-O 2.8Å; E188-C191 PolarHBondContact O-N 2.95Å; S189-C191 VanDerWaalsContact C-N 3.29Å; S189-C191 PolarHBondContact O-N 2.88Å
192	L	77	Confident	78.3	Confident	4 Å²	4	47.6 Å²	47.6	2%	0.021	27%	0.265	C	S	.	.			trans	-108.7	-20.4	176.9	-63.4	176.6	0	0	0	113.2	V185 R187 L194 P214 V215 I247 T257 L259	V185-L192 HydrophobicContact CB-CD2 4.41Å; V185-L192 HydrophobicContact CG1-CD2 4.14Å; R187-L192 HydrophobicContact CG-CD2 3.82Å; L192-L194 HydrophobicContact CB-CD2 3.82Å; L192-L194 HydrophobicContact CB-CG 4.11Å; L192-L194 HydrophobicContact CD1-CD2 3.92Å; L192-P214 WeakPolarHBondContact O-CD 3.36Å; L192-V215 HydrophobicContact CB-CG2 4.06Å; L192-V215 WeakPolarHBondContact O-CB 3.12Å; L192-V215 WeakPolarHBondContact O-CG2 3.32Å; L192-V215 PolarHBondContact O-N 2.78Å; L192-I247 HydrophobicContact CD1-CG2 3.86Å; L192-I247 HydrophobicContact CG-CG2 4.36Å; L192-T257 HydrophobicContact CD2-CG2 4.49Å; L192-T257 WeakPolarHBondContact CD2-OG1 3.43Å; L192-L259 HydrophobicContact CD1-CD1 4.27Å; L192-L259 HydrophobicContact CD1-CD2 4.02Å
193	G	77	Confident	77.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	78.3	34.9	-173.7	0	0	0	0	0	113.9	D119 V209 R210	D119-G193 VanDerWaalsContact OD1-CA 3.24Å; D119-G193 WeakPolarHBondContact OD1-CA 3.43Å; D119-G193 PolarHBondContact OD1-N 2.94Å; G193-V209 WeakPolarHBondContact O-CA 3.41Å; G193-R210 PolarHBondContact O-N 2.93Å
194	L	83.4	Confident	77.5	Confident	16 Å²	16	45.3 Å²	45.3	8%	0.084	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	133.9	176.6	64.9	89.8	0	0	0	110.2	L192 L196 V215 I247 L259	L192-L194 HydrophobicContact CB-CD2 3.82Å; L192-L194 HydrophobicContact CB-CG 4.11Å; L192-L194 HydrophobicContact CD1-CD2 3.92Å; L194-L196 HydrophobicContact CD1-CD1 3.7Å; L194-L196 HydrophobicContact CD1-CD2 3.97Å; L194-L196 HydrophobicContact CD1-CG 3.5Å; L194-V215 HydrophobicContact CB-CG2 4.28Å; L194-V215 HydrophobicContact CD2-CG2 3.8Å; L194-V215 HydrophobicContact CG-CG2 4.5Å; L194-I247 HydrophobicContact CD1-CD1 4.21Å; L194-L259 HydrophobicContact CD2-CD1 3.65Å
195	T	82.3	Confident	77.4	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122.4	174.3	-56.9	0	0	0	0	108.7	F120 L121 V206 T207 H208	F120-T195 WeakPolarHBondContact O-CG2 3.48Å; L121-T195 PolarHBondContact O-OG1 2.83Å; T195-V206 WeakPolarHBondContact O-CA 3.35Å; T195-T207 PolarHBondContact O-N 3.07Å; T195-T207 PolarHBondContact O-OG1 2.86Å; T195-H208 PolarHBondContact N-O 2.83Å
196	L	84.5	Confident	77.4	Confident	6 Å²	6	41.9 Å²	41.9	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	150.2	-179.7	-67.7	169.5	0	0	0	112.2	L194 I205 V206 L227 L240 I247	L194-L196 HydrophobicContact CD1-CD1 3.7Å; L194-L196 HydrophobicContact CD1-CD2 3.97Å; L194-L196 HydrophobicContact CD1-CG 3.5Å; L196-I205 WeakPolarHBondContact CA-O 3.3Å; L196-V206 HydrophobicContact CD2-CG2 3.81Å; L196-L227 HydrophobicContact CD1-CD2 3.81Å; L196-L227 HydrophobicContact CD2-CB 4.13Å; L196-L227 HydrophobicContact CD2-CD2 4.13Å; L196-L240 HydrophobicContact CB-CD1 3.79Å; L196-I247 HydrophobicContact CD1-CD1 3.48Å; L196-I247 VanDerWaalsContact CD1-CD1 3.48Å
197	R	83	Confident	77.4	Confident	4 Å²	4	38 Å²	38	2%	0.015	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	168.4	171	-62.9	-59.1	157.6	81.3	3.5	111.5	F120 D125 I161 Y163 L165 L204 I205 T207	F120-R197 PolarHBondContact O-NH2 2.77Å; D125-R197 IonicContact OD1-CZ 3.05Å; D125-R197 IonicContact OD1-NH1 2.75Å; D125-R197 PolarHBondContact OD1-NH1 2.9Å; D125-R197 IonicContact OD1-NH2 2.77Å; D125-R197 PolarHBondContact OD1-NH2 2.73Å; D125-R197 IonicContact OD2-CZ 3.25Å; D125-R197 IonicContact OD2-NH1 3.41Å; D125-R197 IonicContact OD2-NH2 3.55Å; D125-R197 PolarHBondContact OD2-NH2 3.43Å; I161-R197 VanDerWaalsContact CD1-CZ 3.43Å; I161-R197 VanDerWaalsContact CD1-NH2 3.32Å; Y163-R197 VanDerWaalsContact CB-NH1 3.35Å; Y163-R197 HydrophobicContact CD2-CB 4.07Å; Y163-R197 HydrophobicContact CD2-CG 3.86Å; Y163-R197 HydrophobicContact CE2-CB 3.51Å; Y163-R197 HydrophobicContact CE2-CG 3.77Å; Y163-R197 HydrophobicContact CG-CG 4.38Å; L165-R197 HydrophobicContact CD2-CB 4.49Å; R197-L204 CarbonylContact O-C 3.54Å; R197-L204 WeakPolarHBondContact O-CA 3.36Å; R197-I205 PolarHBondContact N-O 3.27Å; R197-I205 PolarHBondContact O-N 2.79Å; R197-T207 HydrophobicContact CB-CG2 3.82Å; R197-T207 HydrophobicContact CG-CG2 3.64Å
198	G	80.5	Confident	77.6	Confident	8 Å²	8	38.4 Å²	38.4	8%	0.082	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	81.8	-149.2	-168.5	0	0	0	0	0	112.2	Y163	Y163-G198 PolarHBondContact OH-N 2.74Å
199	G	73.4	Confident	78.3	Confident	11 Å²	11	34.8 Å²	34.8	11%	0.113	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	101.6	167.5	-171.3	0	0	0	0	0	113.1	D201 Y202 K238	G199-D201 PolarHBondContact O-N 3.12Å; G199-D201 VanDerWaalsContact O-N 3.1Å; G199-Y202 CarbonylContact C-O 3.55Å; G199-Y202 WeakPolarHBondContact CA-O 3.28Å; G199-Y202 PolarHBondContact N-O 3.37Å; G199-Y202 PolarHBondContact O-N 3.08Å; G199-Y202 VanDerWaalsContact O-N 3.15Å; G199-K238 CarbonylContact C-O 3.58Å; G199-K238 VanDerWaalsContact CA-O 3.26Å; G199-K238 WeakPolarHBondContact CA-O 3.27Å
200	A	73.8	Confident	79	Confident	47 Å²	47	30.9 Å²	30.9	39%	0.388	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	-105	-167.2	0	0	0	0	0	111.8	Y202 K238 T239	A200-Y202 VanDerWaalsContact C-N 3.32Å; A200-K238 PolarHBondContact N-O 2.84Å; A200-T239 HydrophobicContact CB-CG2 4.46Å
201	D	69.5	Low	79.6	Confident	159 Å²	159	31.3 Å²	31.3	85%	0.85	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-14.1	-178.7	-55.1	-55.5	0	0	0	113.5	G199	G199-D201 PolarHBondContact O-N 3.12Å; G199-D201 VanDerWaalsContact O-N 3.1Å
202	Y	73.9	Confident	79.8	Confident	129 Å²	129	36.3 Å²	36.3	51%	0.506	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	145.8	177.9	-66	-82.9	0	0	0	111.7	L165 G199 A200	L165-Y202 HydrophobicContact CD1-CD1 3.89Å; L165-Y202 HydrophobicContact CD1-CD2 4.32Å; L165-Y202 HydrophobicContact CD1-CE1 4.08Å; L165-Y202 HydrophobicContact CD1-CE2 4.49Å; L165-Y202 HydrophobicContact CD1-CG 4.02Å; G199-Y202 CarbonylContact C-O 3.55Å; G199-Y202 WeakPolarHBondContact CA-O 3.28Å; G199-Y202 PolarHBondContact N-O 3.37Å; G199-Y202 PolarHBondContact O-N 3.08Å; G199-Y202 VanDerWaalsContact O-N 3.15Å; A200-Y202 VanDerWaalsContact C-N 3.32Å
203	P	78.4	Confident	79.8	Confident	56 Å²	56	36.3 Å²	36.3	36%	0.364	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	148.7	172.5	27.8	-34.9	0	0	0	111.1	I205 R226	P203-I205 HydrophobicContact CG-CD1 4.29Å; P203-I205 HydrophobicContact CG-CG1 4.39Å; P203-I205 PolarHBondContact O-N 2.86Å; P203-R226 HydrophobicContact CB-CG 4.48Å
204	L	85.5	Confident	80.1	Confident	8 Å²	8	36.6 Å²	36.6	4%	0.042	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	106.2	176.2	-75.2	159.3	0	0	0	109.7	R197 R226 L227 L235 L240 A243	R197-L204 CarbonylContact O-C 3.54Å; R197-L204 WeakPolarHBondContact O-CA 3.36Å; L204-R226 CarbonylContact O-C 3.58Å; L204-R226 WeakPolarHBondContact O-CA 3.35Å; L204-L227 PolarHBondContact O-N 3.29Å; L204-L235 HydrophobicContact CD1-CB 3.6Å; L204-L235 HydrophobicContact CD1-CD1 4.12Å; L204-L235 HydrophobicContact CD1-CG 4.5Å; L204-L240 HydrophobicContact CD2-CD1 3.83Å; L204-A243 HydrophobicContact CD1-CB 3.64Å; L204-A243 HydrophobicContact CD2-CB 4.14Å
205	I	86.7	Confident	80.1	Confident	9 Å²	9	35.8 Å²	35.8	5%	0.046	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	136.3	-175.8	-62.9	163.6	0	0	0	109.8	L196 R197 P203 T207 D225 R226	L196-I205 WeakPolarHBondContact CA-O 3.3Å; R197-I205 PolarHBondContact N-O 3.27Å; R197-I205 PolarHBondContact O-N 2.79Å; P203-I205 HydrophobicContact CG-CD1 4.29Å; P203-I205 HydrophobicContact CG-CG1 4.39Å; P203-I205 PolarHBondContact O-N 2.86Å; I205-T207 PolarHBondContact O-N 3.39Å; I205-D225 WeakPolarHBondContact CA-O 3.29Å; I205-R226 HydrophobicContact CG1-CG 4.09Å
206	V	87.6	Confident	80.2	Confident	1 Å²	1	39 Å²	39	1%	0.006	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	113	167.8	179.8	0	0	0	0	108.5	T195 L196 V209 I221 P223 G224 D225	T195-V206 WeakPolarHBondContact O-CA 3.35Å; L196-V206 HydrophobicContact CD2-CG2 3.81Å; V206-V209 HydrophobicContact CG1-CG2 3.67Å; V206-I221 HydrophobicContact CG1-CG2 4.47Å; V206-I221 HydrophobicContact CG2-CG2 4.13Å; V206-P223 CarbonylContact O-C 3.59Å; V206-P223 WeakPolarHBondContact O-CA 3.29Å; V206-G224 PolarHBondContact O-N 3.32Å; V206-D225 HydrophobicContact CG2-CB 4.42Å; V206-D225 PolarHBondContact N-O 2.84Å
207	T	83.2	Confident	80	Confident	37 Å²	37	44.7 Å²	44.7	23%	0.227	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-26.4	177.8	57.3	0	0	0	0	113	T195 R197 I205	T195-T207 PolarHBondContact O-N 3.07Å; T195-T207 PolarHBondContact O-OG1 2.86Å; R197-T207 HydrophobicContact CB-CG2 3.82Å; R197-T207 HydrophobicContact CG-CG2 3.64Å; I205-T207 PolarHBondContact O-N 3.39Å
208	H	81.1	Confident	79.9	Confident	47 Å²	47	46.5 Å²	46.5	22%	0.218	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	148.4	177.3	-166.4	71.3	0	0	0	111.2	A122 T195	A122-H208 HydrophobicContact CB-CB 3.97Å; T195-H208 PolarHBondContact N-O 2.83Å
209	V	84.8	Confident	79.9	Confident	16 Å²	16	46.9 Å²	46.9	10%	0.097	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	117.9	175.9	177.5	0	0	0	0	107.6	G193 V206 P211 V215	G193-V209 WeakPolarHBondContact O-CA 3.41Å; V206-V209 HydrophobicContact CG1-CG2 3.67Å; V209-P211 WeakPolarHBondContact O-CD 3.32Å; V209-V215 HydrophobicContact CG1-CB 4.22Å; V209-V215 HydrophobicContact CG1-CG1 3.72Å; V209-V215 HydrophobicContact CG2-CG1 4.4Å
210	R	78.4	Confident	80.5	Confident	19 Å²	19	49.8 Å²	49.8	7%	0.072	25%	0.254	C	S	.	.			trans	-65.4	119.9	-173.1	-179.6	174.5	65	-173.6	-12	111	P113 A118 D119 G193 H212 G213 Y216	P113-R210 VanDerWaalsContact O-CD 3.28Å; P113-R210 WeakPolarHBondContact O-CD 3.47Å; P113-R210 WeakPolarHBondContact O-CG 3.38Å; A118-R210 HydrophobicContact CB-CG 4.09Å; D119-R210 IonicContact OD1-CZ 3.88Å; D119-R210 IonicContact OD1-NE 3.51Å; D119-R210 IonicContact OD1-NH1 3.28Å; D119-R210 PolarHBondContact OD1-NH1 2.75Å; D119-R210 IonicContact OD1-NH2 3.24Å; D119-R210 PolarHBondContact OD1-NH2 2.85Å; D119-R210 VanDerWaalsContact OD1-NH2 3.15Å; D119-R210 IonicContact OD2-CZ 2.95Å; D119-R210 IonicContact OD2-NH1 3.7Å; D119-R210 PolarHBondContact OD2-NH1 3.2Å; D119-R210 IonicContact OD2-NH2 3.83Å; G193-R210 PolarHBondContact O-N 2.93Å; R210-H212 PolarHBondContact O-N 3.2Å; R210-G213 PolarHBondContact O-N 3.07Å; R210-Y216 VanDerWaalsContact O-CB 3.31Å; R210-Y216 WeakPolarHBondContact O-CB 3.2Å
211	P	77.1	Confident	81.2	Confident	48 Å²	48	47.8 Å²	47.8	31%	0.312	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	138.2	176.1	-27.1	34.3	0	0	0	112.4	P113 V209 G213	P113-P211 HydrophobicContact CB-CB 3.95Å; P113-P211 HydrophobicContact CB-CG 4.14Å; V209-P211 WeakPolarHBondContact O-CD 3.32Å; P211-G213 PolarHBondContact O-N 3.33Å
212	H	75.6	Confident	82	Confident	136 Å²	136	42 Å²	42	63%	0.63	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	-2.6	-173.2	-48.2	-70.9	0	0	0	116.6	R210 K217	R210-H212 PolarHBondContact O-N 3.2Å; H212-K217 VanDerWaalsContact O-CE 3.27Å; H212-K217 WeakPolarHBondContact O-CE 3.44Å
213	G	77.2	Confident	82.6	Confident	3 Å²	3	38 Å²	38	3%	0.031	19%	0.194	C	C	.	.	S	Bend	trans	-69	169.3	174.3	0	0	0	0	0	113.3	R210 P211 V215 Y216 K217	R210-G213 PolarHBondContact O-N 3.07Å; P211-G213 PolarHBondContact O-N 3.33Å; G213-V215 PolarHBondContact O-N 3.19Å; G213-Y216 WeakPolarHBondContact O-CA 3.4Å; G213-Y216 WeakPolarHBondContact O-CB 3.45Å; G213-Y216 PolarHBondContact O-N 3.49Å; G213-K217 WeakPolarHBondContact O-CG 3.34Å; G213-K217 PolarHBondContact O-N 2.86Å
214	P	81.8	Confident	82.7	Confident	6 Å²	6	37 Å²	37	4%	0.039	19%	0.193	C	C	.	.	H	α-helix	trans	-60.9	-40.5	-172.6	-26.3	34.3	0	0	0	115.5	V185 E186 E188 L192 Y216 K217 T218	V185-P214 HydrophobicContact CG1-CB 3.9Å; E186-P214 WeakPolarHBondContact O-CB 3.4Å; E188-P214 HydrophobicContact CB-CG 3.41Å; E188-P214 VanDerWaalsContact CB-CG 3.41Å; L192-P214 WeakPolarHBondContact O-CD 3.36Å; P214-Y216 VanDerWaalsContact C-N 3.33Å; P214-Y216 PolarHBondContact O-N 3.49Å; P214-K217 WeakPolarHBondContact O-CB 3.29Å; P214-K217 PolarHBondContact O-N 3.3Å; P214-T218 PolarHBondContact O-N 3.05Å
215	V	85	Confident	82.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-60.8	-43.9	172.2	170	0	0	0	0	111.3	V185 L192 L194 V209 G213 K217 T218 I221 L259	V185-V215 HydrophobicContact CG1-CG2 3.95Å; V185-V215 HydrophobicContact CG2-CG2 4.39Å; L192-V215 HydrophobicContact CB-CG2 4.06Å; L192-V215 WeakPolarHBondContact O-CB 3.12Å; L192-V215 WeakPolarHBondContact O-CG2 3.32Å; L192-V215 PolarHBondContact O-N 2.78Å; L194-V215 HydrophobicContact CB-CG2 4.28Å; L194-V215 HydrophobicContact CD2-CG2 3.8Å; L194-V215 HydrophobicContact CG-CG2 4.5Å; V209-V215 HydrophobicContact CG1-CB 4.22Å; V209-V215 HydrophobicContact CG1-CG1 3.72Å; V209-V215 HydrophobicContact CG2-CG1 4.4Å; G213-V215 PolarHBondContact O-N 3.19Å; V215-K217 VanDerWaalsContact C-N 3.32Å; V215-K217 PolarHBondContact O-N 2.88Å; V215-T218 WeakPolarHBondContact O-CB 3.21Å; V215-T218 PolarHBondContact O-N 3.22Å; V215-T218 PolarHBondContact O-OG1 3.47Å; V215-I221 HydrophobicContact CG1-CB 3.64Å; V215-I221 HydrophobicContact CG1-CD1 4.05Å; V215-I221 HydrophobicContact CG1-CG1 4.13Å; V215-I221 HydrophobicContact CG1-CG2 4.25Å; V215-L259 HydrophobicContact CG2-CD1 4.35Å
216	Y	82.8	Confident	82.9	Confident	68 Å²	68	37.6 Å²	37.6	27%	0.267	20%	0.195	S	C	.	.	H	α-helix	trans	-60.8	-40.3	177	-176.6	-88.2	0	0	0	111.7	R210 G213 P214 T218 G219	R210-Y216 VanDerWaalsContact O-CB 3.31Å; R210-Y216 WeakPolarHBondContact O-CB 3.2Å; G213-Y216 WeakPolarHBondContact O-CA 3.4Å; G213-Y216 WeakPolarHBondContact O-CB 3.45Å; G213-Y216 PolarHBondContact O-N 3.49Å; P214-Y216 VanDerWaalsContact C-N 3.33Å; P214-Y216 PolarHBondContact O-N 3.49Å; Y216-T218 PolarHBondContact O-N 3.2Å; Y216-T218 VanDerWaalsContact O-N 3.12Å; Y216-G219 PolarHBondContact O-N 3.02Å
217	K	80.1	Confident	83.1	Confident	127 Å²	127	37.8 Å²	37.8	55%	0.552	20%	0.195	S	C	*	.	H	α-helix	trans	-57.6	-23.7	173.6	-67.2	172.2	-178.3	166.5	0	113.3	E188 H212 G213 P214 V215	E188-K217 IonicContact OE1-NZ 2.79Å; E188-K217 PolarHBondContact OE1-NZ 3.3Å; E188-K217 IonicContact OE2-NZ 2.73Å; E188-K217 PolarHBondContact OE2-NZ 2.87Å; H212-K217 VanDerWaalsContact O-CE 3.27Å; H212-K217 WeakPolarHBondContact O-CE 3.44Å; G213-K217 WeakPolarHBondContact O-CG 3.34Å; G213-K217 PolarHBondContact O-N 2.86Å; P214-K217 WeakPolarHBondContact O-CB 3.29Å; P214-K217 PolarHBondContact O-N 3.3Å; V215-K217 VanDerWaalsContact C-N 3.32Å; V215-K217 PolarHBondContact O-N 2.88Å
218	T	82.6	Confident	83.3	Confident	42 Å²	42	38 Å²	38	26%	0.258	20%	0.195	S	C	.	.	H	α-helix	trans	-80.7	-24.2	174.8	75.4	0	0	0	0	114.2	I183 V185 P214 V215 Y216 R220	I183-T218 HydrophobicContact CG2-CG2 4.43Å; V185-T218 HydrophobicContact CG1-CG2 4.25Å; V185-T218 HydrophobicContact CG2-CG2 4.12Å; P214-T218 PolarHBondContact O-N 3.05Å; V215-T218 WeakPolarHBondContact O-CB 3.21Å; V215-T218 PolarHBondContact O-N 3.22Å; V215-T218 PolarHBondContact O-OG1 3.47Å; Y216-T218 PolarHBondContact O-N 3.2Å; Y216-T218 VanDerWaalsContact O-N 3.12Å; T218-R220 PolarHBondContact O-N 3.46Å; T218-R220 PolarHBondContact OG1-N 3.07Å
219	G	80.7	Confident	83.6	Confident	16 Å²	16	38.4 Å²	38.4	17%	0.165	20%	0.195	C	C	.	.			trans	65.3	-5.3	-175	0	0	0	0	0	116.6	Y216 K222 D288	Y216-G219 PolarHBondContact O-N 3.02Å; G219-K222 WeakPolarHBondContact O-CE 3.46Å; G219-K222 PolarHBondContact O-NZ 3.39Å; G219-D288 WeakPolarHBondContact CA-OD1 3.34Å
220	R	85.7	Confident	83.7	Confident	72 Å²	72	37.8 Å²	37.8	27%	0.272	19%	0.191	S	C	.	.			trans	-94.4	-27.5	-169.9	-66.7	-175.9	-165.6	-160.6	9.8	115.7	I183 T218 A331 R336	I183-R220 HydrophobicContact CD1-CB 3.66Å; I183-R220 HydrophobicContact CG1-CB 4.28Å; I183-R220 HydrophobicContact CG2-CB 4.46Å; T218-R220 PolarHBondContact O-N 3.46Å; T218-R220 PolarHBondContact OG1-N 3.07Å; R220-A331 HydrophobicContact CB-CB 4.5Å; R220-R336 PolarHBondContact O-NH2 3.24Å
221	I	88.6	Confident	84.1	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.021	19%	0.194	C	C	.	.			trans	-95.4	135.1	177.7	-48.8	-175.5	0	0	0	108.8	I183 V206 V215 D225 L259 I261	I183-I221 HydrophobicContact CD1-CD1 4.19Å; I183-I221 HydrophobicContact CD1-CG1 3.56Å; I183-I221 HydrophobicContact CG2-CG1 4.5Å; V206-I221 HydrophobicContact CG1-CG2 4.47Å; V206-I221 HydrophobicContact CG2-CG2 4.13Å; V215-I221 HydrophobicContact CG1-CB 3.64Å; V215-I221 HydrophobicContact CG1-CD1 4.05Å; V215-I221 HydrophobicContact CG1-CG1 4.13Å; V215-I221 HydrophobicContact CG1-CG2 4.25Å; I221-D225 VanDerWaalsContact CA-OD2 3.31Å; I221-D225 WeakPolarHBondContact CA-OD2 3.27Å; I221-D225 HydrophobicContact CG2-CB 4.24Å; I221-D225 WeakPolarHBondContact CG2-OD2 3.21Å; I221-L259 HydrophobicContact CD1-CB 4.29Å; I221-L259 HydrophobicContact CD1-CD1 3.55Å; I221-I261 HydrophobicContact CD1-CG2 4.22Å; I221-I261 HydrophobicContact CG1-CD1 4.28Å
222	K	86.3	Confident	84.2	Confident	38 Å²	38	43.1 Å²	43.1	17%	0.165	22%	0.218	C	C	.	.			trans	-131.1	158.5	-177.4	-58.7	-62.4	169.5	-165	0	110.8	G219 G224 D225 D288	G219-K222 WeakPolarHBondContact O-CE 3.46Å; G219-K222 PolarHBondContact O-NZ 3.39Å; K222-G224 PolarHBondContact O-N 2.79Å; K222-D225 PolarHBondContact N-OD2 3.43Å; K222-D225 WeakPolarHBondContact O-CB 3.49Å; K222-D225 VanDerWaalsContact O-CG 3.28Å; K222-D225 PolarHBondContact O-N 2.8Å; K222-D288 IonicContact NZ-OD1 2.64Å; K222-D288 PolarHBondContact NZ-OD1 2.83Å; K222-D288 IonicContact NZ-OD2 3.94Å; K222-D288 PolarHBondContact NZ-OD2 2.81Å
223	P	85.8	Confident	84.6	Confident	46 Å²	46	40 Å²	40	30%	0.299	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	138.5	166.6	-25.1	35.8	0	0	0	111.3	V206	V206-P223 CarbonylContact O-C 3.59Å; V206-P223 WeakPolarHBondContact O-CA 3.29Å
224	G	80.4	Confident	85	Confident	33 Å²	33	42.6 Å²	42.6	34%	0.34	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.4	-21.9	-173	0	0	0	0	0	114.7	V206 K222	V206-G224 PolarHBondContact O-N 3.32Å; K222-G224 PolarHBondContact O-N 2.79Å
225	D	88.5	Confident	85.1	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.016	23%	0.225	C	C	.	.			trans	-63.5	143.8	177.5	-70.2	-18.8	0	0	0	112.1	I205 V206 I221 K222 I261 Y263 R336	I205-D225 WeakPolarHBondContact CA-O 3.29Å; V206-D225 HydrophobicContact CG2-CB 4.42Å; V206-D225 PolarHBondContact N-O 2.84Å; I221-D225 VanDerWaalsContact CA-OD2 3.31Å; I221-D225 WeakPolarHBondContact CA-OD2 3.27Å; I221-D225 HydrophobicContact CG2-CB 4.24Å; I221-D225 WeakPolarHBondContact CG2-OD2 3.21Å; K222-D225 PolarHBondContact N-OD2 3.43Å; K222-D225 WeakPolarHBondContact O-CB 3.49Å; K222-D225 VanDerWaalsContact O-CG 3.28Å; K222-D225 PolarHBondContact O-N 2.8Å; D225-I261 HydrophobicContact CB-CD1 4.35Å; D225-I261 WeakPolarHBondContact OD2-CD1 3.23Å; D225-Y263 WeakPolarHBondContact OD1-CB 3.46Å; D225-R336 VanDerWaalsContact CG-NH2 3.27Å; D225-R336 IonicContact OD1-CZ 3.19Å; D225-R336 VanDerWaalsContact OD1-CZ 3.31Å; D225-R336 IonicContact OD1-NH1 3.4Å; D225-R336 PolarHBondContact OD1-NH1 3.06Å; D225-R336 IonicContact OD1-NH2 3Å; D225-R336 PolarHBondContact OD1-NH2 2.83Å; D225-R336 IonicContact OD2-CZ 2.66Å; D225-R336 IonicContact OD2-NH1 2.69Å; D225-R336 IonicContact OD2-NH2 3.93Å; D225-R336 PolarHBondContact OD2-NH2 2.94Å
226	R	88.6	Confident	85.1	Confident	28 Å²	28	48.3 Å²	48.3	11%	0.106	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	125.1	178.6	-67.4	176.1	-66.9	-76.5	11	110	S178 P203 L204 I205 I261 E262 D264	S178-R226 PolarHBondContact OG-NH2 3.42Å; S178-R226 VanDerWaalsContact OG-NH2 3.12Å; P203-R226 HydrophobicContact CB-CG 4.48Å; L204-R226 CarbonylContact O-C 3.58Å; L204-R226 WeakPolarHBondContact O-CA 3.35Å; I205-R226 HydrophobicContact CG1-CG 4.09Å; R226-I261 CarbonylContact O-C 3.59Å; R226-I261 VanDerWaalsContact O-CA 3.26Å; R226-I261 WeakPolarHBondContact O-CA 3.3Å; R226-E262 HydrophobicContact CB-CB 4.17Å; R226-E262 IonicContact CZ-OE1 2.63Å; R226-E262 IonicContact CZ-OE2 3.05Å; R226-E262 PolarHBondContact N-O 3.14Å; R226-E262 IonicContact NE-OE1 2.63Å; R226-E262 PolarHBondContact NE-OE1 3.38Å; R226-E262 IonicContact NE-OE2 3.65Å; R226-E262 PolarHBondContact NE-OE2 3.35Å; R226-E262 IonicContact NH2-OE1 2.69Å; R226-E262 PolarHBondContact NH2-OE1 3.17Å; R226-E262 IonicContact NH2-OE2 2.64Å; R226-E262 PolarHBondContact O-N 2.91Å; R226-D264 IonicContact CZ-OD1 2.94Å; R226-D264 IonicContact CZ-OD2 2.78Å; R226-D264 IonicContact NH1-OD1 2.7Å; R226-D264 IonicContact NH1-OD2 3.76Å; R226-D264 PolarHBondContact NH1-OD2 2.73Å; R226-D264 IonicContact NH2-OD1 3.65Å; R226-D264 PolarHBondContact NH2-OD1 2.98Å; R226-D264 IonicContact NH2-OD2 2.73Å; R226-D264 PolarHBondContact NH2-OD2 3.47Å
227	L	89.9	Confident	84.7	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	110.3	-177.5	-174.7	67.8	0	0	0	111.2	L196 L204 V230 L235 I247 L259 I261	L196-L227 HydrophobicContact CD1-CD2 3.81Å; L196-L227 HydrophobicContact CD2-CB 4.13Å; L196-L227 HydrophobicContact CD2-CD2 4.13Å; L204-L227 PolarHBondContact O-N 3.29Å; L227-V230 HydrophobicContact CD2-CG2 4.09Å; L227-L235 HydrophobicContact CD2-CD1 3.65Å; L227-L235 HydrophobicContact CG-CD1 3.87Å; L227-I247 HydrophobicContact CD2-CD1 4.22Å; L227-L259 HydrophobicContact CD1-CB 3.91Å; L227-L259 HydrophobicContact CD1-CD2 4.2Å; L227-L259 HydrophobicContact CD1-CG 4.45Å; L227-I261 HydrophobicContact CD1-CG2 3.77Å
228	L	87.5	Confident	84.8	Confident	42 Å²	42	45 Å²	45	22%	0.22	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-29.4	-173.1	-58.8	-173.5	0	0	0	114.3	L180 S234 L235 I236 T260 E262	L180-L228 HydrophobicContact CD2-CD1 3.69Å; L228-S234 PolarHBondContact O-OG 2.94Å; L228-L235 PolarHBondContact O-N 2.87Å; L228-I236 HydrophobicContact CD2-CG1 4.32Å; L228-T260 PolarHBondContact N-O 2.92Å; L228-E262 HydrophobicContact CD1-CB 3.94Å; L228-E262 HydrophobicContact CG-CB 4.2Å
229	R	87.7	Confident	84.8	Confident	56 Å²	56	45.8 Å²	45.8	21%	0.211	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	141.5	-176.2	-169.5	178.4	59.5	164.6	1.7	111.4	D231 V233 T260	R229-D231 WeakPolarHBondContact CD-O 3.33Å; R229-D231 WeakPolarHBondContact CG-O 3.44Å; R229-D231 PolarHBondContact NE-O 2.89Å; R229-D231 VanDerWaalsContact NE-O 3.14Å; R229-V233 WeakPolarHBondContact CA-O 3.3Å; R229-V233 VanDerWaalsContact CG-O 3.3Å; R229-V233 WeakPolarHBondContact CG-O 3.31Å; R229-T260 PolarHBondContact N-O 2.85Å; R229-T260 PolarHBondContact NE-OG1 2.92Å; R229-T260 PolarHBondContact NH2-OG1 2.8Å; R229-T260 VanDerWaalsContact NH2-OG1 3.1Å; R229-T260 PolarHBondContact O-N 3.47Å
230	V	88.2	Confident	84.8	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.018	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	111.8	168.5	172	0	0	0	0	107.5	L227 N232 V233 L235 I246 I247 L259	L227-V230 HydrophobicContact CD2-CG2 4.09Å; V230-N232 PolarHBondContact O-N 2.91Å; V230-V233 PolarHBondContact N-O 3.07Å; V230-V233 PolarHBondContact O-N 2.89Å; V230-L235 HydrophobicContact CG2-CD1 3.8Å; V230-L235 HydrophobicContact CG2-CD2 4.33Å; V230-L235 HydrophobicContact CG2-CG 4.24Å; V230-I246 HydrophobicContact CB-CG2 4Å; V230-I246 HydrophobicContact CG1-CG2 4.17Å; V230-I247 HydrophobicContact CG2-CD1 4.4Å; V230-I247 HydrophobicContact CG2-CG1 3.79Å; V230-L259 HydrophobicContact CB-CD2 4.5Å; V230-L259 HydrophobicContact CG1-CD2 4.43Å; V230-L259 HydrophobicContact CG2-CD2 3.83Å
231	D	85.1	Confident	84.4	Confident	25 Å²	25	45.6 Å²	45.6	13%	0.134	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	-106.6	-170.6	-69	-86.5	0	0	0	112.1	R229 H252 T257 N258	R229-D231 WeakPolarHBondContact CD-O 3.33Å; R229-D231 WeakPolarHBondContact CG-O 3.44Å; R229-D231 PolarHBondContact NE-O 2.89Å; R229-D231 VanDerWaalsContact NE-O 3.14Å; D231-H252 IonicContact OD2-CE1 3.14Å; D231-H252 PolarHBondContact OD2-CE1 3.09Å; D231-H252 IonicContact OD2-ND1 3.89Å; D231-T257 VanDerWaalsContact OD2-CA 3.25Å; D231-T257 WeakPolarHBondContact OD2-CA 3.4Å; D231-T257 VanDerWaalsContact OD2-CB 3.3Å; D231-T257 WeakPolarHBondContact OD2-CB 3.41Å; D231-N258 WeakPolarHBondContact CA-O 3.26Å; D231-N258 PolarHBondContact N-O 3.07Å; D231-N258 WeakPolarHBondContact OD1-CB 3.48Å; D231-N258 PolarHBondContact OD1-N 3.29Å; D231-N258 PolarHBondContact OD1-ND2 3.41Å; D231-N258 PolarHBondContact OD2-N 3.08Å; D231-N258 VanDerWaalsContact OD2-N 3.12Å
232	N	80.2	Confident	84	Confident	153 Å²	153	48.7 Å²	48.7	82%	0.818	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-1.9	179.3	-65.4	-16.6	0	0	0	113	V230	V230-N232 PolarHBondContact O-N 2.91Å
233	V	84.7	Confident	83.9	Confident	72 Å²	72	46.9 Å²	46.9	44%	0.436	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	113.6	-173.5	-172.4	0	0	0	0	110.3	R229 V230 I246	R229-V233 WeakPolarHBondContact CA-O 3.3Å; R229-V233 VanDerWaalsContact CG-O 3.3Å; R229-V233 WeakPolarHBondContact CG-O 3.31Å; V230-V233 PolarHBondContact N-O 3.07Å; V230-V233 PolarHBondContact O-N 2.89Å; V233-I246 HydrophobicContact CB-CG2 3.95Å; V233-I246 HydrophobicContact CG1-CD1 3.75Å; V233-I246 HydrophobicContact CG1-CG1 4.13Å; V233-I246 HydrophobicContact CG1-CG2 3.96Å; V233-I246 HydrophobicContact CG2-CG2 4.45Å
234	S	85.8	Confident	83.6	Confident	57 Å²	57	45.9 Å²	45.9	40%	0.399	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	140.4	173.7	-174.5	0	0	0	0	111	L228 I236	L228-S234 PolarHBondContact O-OG 2.94Å; S234-I236 WeakPolarHBondContact OG-CG1 3.38Å; S234-I236 PolarHBondContact OG-N 2.96Å
235	L	83.9	Confident	83.4	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.016	28%	0.278	C	S	.	.			trans	-101	0.4	174.3	-53.3	-171.6	0	0	0	112.7	L204 L227 L228 V230 G237 K238 A243 I246	L204-L235 HydrophobicContact CD1-CB 3.6Å; L204-L235 HydrophobicContact CD1-CD1 4.12Å; L204-L235 HydrophobicContact CD1-CG 4.5Å; L227-L235 HydrophobicContact CD2-CD1 3.65Å; L227-L235 HydrophobicContact CG-CD1 3.87Å; L228-L235 PolarHBondContact O-N 2.87Å; V230-L235 HydrophobicContact CG2-CD1 3.8Å; V230-L235 HydrophobicContact CG2-CD2 4.33Å; V230-L235 HydrophobicContact CG2-CG 4.24Å; L235-G237 PolarHBondContact O-N 3.49Å; L235-K238 WeakPolarHBondContact O-CB 3.5Å; L235-K238 PolarHBondContact O-N 2.9Å; L235-A243 HydrophobicContact CD1-CB 4.18Å; L235-A243 HydrophobicContact CD2-CB 4.36Å; L235-I246 HydrophobicContact CD2-CB 4.18Å; L235-I246 HydrophobicContact CD2-CD1 3.65Å; L235-I246 HydrophobicContact CD2-CG2 3.97Å
236	I	83.2	Confident	83	Confident	122 Å²	122	50.9 Å²	50.9	63%	0.626	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	126.9	-179.6	-59.7	171.6	0	0	0	108.9	L228 S234 K238	L228-I236 HydrophobicContact CD2-CG1 4.32Å; S234-I236 WeakPolarHBondContact OG-CG1 3.38Å; S234-I236 PolarHBondContact OG-N 2.96Å; I236-K238 PolarHBondContact O-N 3.08Å
237	G	75.7	Confident	82.6	Confident	56 Å²	56	50.3 Å²	50.3	58%	0.577	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	8.4	-175.3	0	0	0	0	0	115.1	L235	L235-G237 PolarHBondContact O-N 3.49Å
238	K	81.5	Confident	81.7	Confident	69 Å²	69	53.8 Å²	53.8	30%	0.3	30%	0.3	S	S	.	.			trans	-83.2	142.5	174.2	-69.3	-52.3	-158.2	173.7	0	111.8	G199 A200 L235 I236 E242 I246	G199-K238 CarbonylContact C-O 3.58Å; G199-K238 VanDerWaalsContact CA-O 3.26Å; G199-K238 WeakPolarHBondContact CA-O 3.27Å; A200-K238 PolarHBondContact N-O 2.84Å; L235-K238 WeakPolarHBondContact O-CB 3.5Å; L235-K238 PolarHBondContact O-N 2.9Å; I236-K238 PolarHBondContact O-N 3.08Å; K238-E242 HydrophobicContact CB-CB 4.22Å; K238-E242 HydrophobicContact CD-CB 4.31Å; K238-E242 WeakPolarHBondContact CD-OE1 3.34Å; K238-E242 WeakPolarHBondContact CE-OE1 3.44Å; K238-E242 IonicContact NZ-OE1 2.69Å; K238-E242 PolarHBondContact NZ-OE1 3.28Å; K238-I246 HydrophobicContact CG-CD1 4.4Å
239	T	82.8	Confident	80.3	Confident	60 Å²	60	55.8 Å²	55.8	37%	0.368	32%	0.316	S	S	.	.			trans	-64.8	155.9	169.9	60.8	0	0	0	0	110.6	A200 A241 E242 A243	A200-T239 HydrophobicContact CB-CG2 4.46Å; T239-A241 PolarHBondContact O-N 2.87Å; T239-E242 WeakPolarHBondContact CB-OE2 3.36Å; T239-E242 WeakPolarHBondContact CG2-OE2 3.4Å; T239-E242 PolarHBondContact N-OE2 3.28Å; T239-E242 PolarHBondContact O-N 3.23Å; T239-E242 VanDerWaalsContact O-N 3.16Å; T239-E242 WeakPolarHBondContact OG1-CB 3.29Å; T239-E242 VanDerWaalsContact OG1-CG 3.26Å; T239-E242 WeakPolarHBondContact OG1-CG 3.42Å; T239-E242 PolarHBondContact OG1-N 3.35Å; T239-E242 PolarHBondContact OG1-OE2 2.91Å; T239-A243 PolarHBondContact O-N 2.88Å
240	L	81.7	Confident	78.9	Confident	17 Å²	17	54.4 Å²	54.4	9%	0.089	32%	0.32	C	S	.	.	H	α-helix	trans	-56.7	-37	176.5	-174.4	60.4	0	0	0	112.4	A81 L196 L204 A243 Q244	A81-L240 HydrophobicContact CB-CD2 3.68Å; L196-L240 HydrophobicContact CB-CD1 3.79Å; L204-L240 HydrophobicContact CD2-CD1 3.83Å; L240-A243 PolarHBondContact O-N 2.99Å; L240-Q244 HydrophobicContact CD1-CG 4.43Å; L240-Q244 WeakPolarHBondContact O-CB 3.38Å; L240-Q244 WeakPolarHBondContact O-CG 3.29Å; L240-Q244 PolarHBondContact O-N 3.42Å
241	A	75.9	Confident	77.2	Confident	66 Å²	66	57.9 Å²	57.9	55%	0.545	36%	0.356	S	S	.	.	H	α-helix	trans	-65.1	-45	177.1	0	0	0	0	0	112	T239 Q245	T239-A241 PolarHBondContact O-N 2.87Å; A241-Q245 VanDerWaalsContact O-CB 3.28Å; A241-Q245 WeakPolarHBondContact O-CB 3.38Å; A241-Q245 PolarHBondContact O-N 2.83Å
242	E	81.4	Confident	75.6	Confident	70 Å²	70	59 Å²	59	33%	0.327	36%	0.36	S	S	.	.	H	α-helix	trans	-62.9	-43.2	173.2	-72.8	169.2	104	0	0	111.9	K238 T239 Q245 I246	K238-E242 HydrophobicContact CB-CB 4.22Å; K238-E242 HydrophobicContact CD-CB 4.31Å; K238-E242 WeakPolarHBondContact CD-OE1 3.34Å; K238-E242 WeakPolarHBondContact CE-OE1 3.44Å; K238-E242 IonicContact NZ-OE1 2.69Å; K238-E242 PolarHBondContact NZ-OE1 3.28Å; T239-E242 WeakPolarHBondContact CB-OE2 3.36Å; T239-E242 WeakPolarHBondContact CG2-OE2 3.4Å; T239-E242 PolarHBondContact N-OE2 3.28Å; T239-E242 PolarHBondContact O-N 3.23Å; T239-E242 VanDerWaalsContact O-N 3.16Å; T239-E242 WeakPolarHBondContact OG1-CB 3.29Å; T239-E242 VanDerWaalsContact OG1-CG 3.26Å; T239-E242 WeakPolarHBondContact OG1-CG 3.42Å; T239-E242 PolarHBondContact OG1-N 3.35Å; T239-E242 PolarHBondContact OG1-OE2 2.91Å; E242-Q245 CarbonylContact O-C 3.41Å; E242-Q245 PolarHBondContact O-N 2.73Å; E242-Q245 VanDerWaalsContact O-N 3.16Å; E242-I246 WeakPolarHBondContact O-CB 3.45Å; E242-I246 WeakPolarHBondContact O-CD1 3.25Å; E242-I246 VanDerWaalsContact O-CG1 3.24Å; E242-I246 WeakPolarHBondContact O-CG1 3.45Å; E242-I246 PolarHBondContact O-N 3.17Å
243	A	83.3	Confident	74.3	Confident	0 Å²	0	59 Å²	59	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-61.7	-46.7	178.4	0	0	0	0	0	111.8	L204 L235 T239 L240 Q245 I246 I247	L204-A243 HydrophobicContact CD1-CB 3.64Å; L204-A243 HydrophobicContact CD2-CB 4.14Å; L235-A243 HydrophobicContact CD1-CB 4.18Å; L235-A243 HydrophobicContact CD2-CB 4.36Å; T239-A243 PolarHBondContact O-N 2.88Å; L240-A243 PolarHBondContact O-N 2.99Å; A243-Q245 VanDerWaalsContact C-N 3.29Å; A243-Q245 PolarHBondContact O-N 2.73Å; A243-I246 PolarHBondContact O-N 3.11Å; A243-I247 WeakPolarHBondContact O-CD1 3.43Å; A243-I247 VanDerWaalsContact O-CG1 3.29Å; A243-I247 WeakPolarHBondContact O-CG1 3.48Å; A243-I247 PolarHBondContact O-N 3.01Å
244	Q	78.9	Confident	73	Confident	24 Å²	24	59.9 Å²	59.9	11%	0.112	38%	0.375	C	S	.	.	H	α-helix	trans	-62.1	-35.8	173	-72.6	-176.1	18.4	0	0	112.3	L240 I247 K248	L240-Q244 HydrophobicContact CD1-CG 4.43Å; L240-Q244 WeakPolarHBondContact O-CB 3.38Å; L240-Q244 WeakPolarHBondContact O-CG 3.29Å; L240-Q244 PolarHBondContact O-N 3.42Å; Q244-I247 PolarHBondContact O-N 2.89Å; Q244-K248 WeakPolarHBondContact O-CB 3.25Å; Q244-K248 VanDerWaalsContact O-CG 3.29Å; Q244-K248 WeakPolarHBondContact O-CG 3.12Å; Q244-K248 PolarHBondContact O-N 2.94Å
245	Q	77.1	Confident	72.3	Confident	107 Å²	107	58.7 Å²	58.7	50%	0.5	37%	0.371	S	S	.	.	H	α-helix	trans	-72.6	-36.4	177.8	-170.3	68.2	-5.9	0	0	112.4	A241 E242 A243 I247 K248 C249	A241-Q245 VanDerWaalsContact O-CB 3.28Å; A241-Q245 WeakPolarHBondContact O-CB 3.38Å; A241-Q245 PolarHBondContact O-N 2.83Å; E242-Q245 CarbonylContact O-C 3.41Å; E242-Q245 PolarHBondContact O-N 2.73Å; E242-Q245 VanDerWaalsContact O-N 3.16Å; A243-Q245 VanDerWaalsContact C-N 3.29Å; A243-Q245 PolarHBondContact O-N 2.73Å; Q245-I247 VanDerWaalsContact C-N 3.32Å; Q245-K248 PolarHBondContact O-N 2.78Å; Q245-C249 PolarHBondContact NE2-SG 3.39Å; Q245-C249 VanDerWaalsContact NE2-SG 3.37Å; Q245-C249 WeakPolarHBondContact O-CA 3.41Å; Q245-C249 WeakPolarHBondContact O-CB 3.43Å; Q245-C249 PolarHBondContact O-N 3.08Å
246	I	80.5	Confident	72.2	Confident	34 Å²	34	64 Å²	64	17%	0.174	39%	0.392	C	S	.	.	H	α-helix	trans	-63.4	-42	171.6	-69.2	158.2	0	0	0	109.6	V230 V233 L235 K238 E242 A243 G250	V230-I246 HydrophobicContact CB-CG2 4Å; V230-I246 HydrophobicContact CG1-CG2 4.17Å; V233-I246 HydrophobicContact CB-CG2 3.95Å; V233-I246 HydrophobicContact CG1-CD1 3.75Å; V233-I246 HydrophobicContact CG1-CG1 4.13Å; V233-I246 HydrophobicContact CG1-CG2 3.96Å; V233-I246 HydrophobicContact CG2-CG2 4.45Å; L235-I246 HydrophobicContact CD2-CB 4.18Å; L235-I246 HydrophobicContact CD2-CD1 3.65Å; L235-I246 HydrophobicContact CD2-CG2 3.97Å; K238-I246 HydrophobicContact CG-CD1 4.4Å; E242-I246 WeakPolarHBondContact O-CB 3.45Å; E242-I246 WeakPolarHBondContact O-CD1 3.25Å; E242-I246 VanDerWaalsContact O-CG1 3.24Å; E242-I246 WeakPolarHBondContact O-CG1 3.45Å; E242-I246 PolarHBondContact O-N 3.17Å; A243-I246 PolarHBondContact O-N 3.11Å; I246-G250 PolarHBondContact O-N 3.32Å; I246-G250 VanDerWaalsContact O-N 3.08Å
247	I	79.8	Confident	72.2	Confident	17 Å²	17	58.1 Å²	58.1	9%	0.087	36%	0.362	C	S	.	.	H	α-helix	trans	-66.1	-39.6	174.7	-68.1	162.2	0	0	0	111.6	R187 L192 L194 L196 L227 V230 A243 Q244 Q245	R187-I247 PolarHBondContact NH1-O 3.31Å; R187-I247 PolarHBondContact NH2-O 2.9Å; L192-I247 HydrophobicContact CD1-CG2 3.86Å; L192-I247 HydrophobicContact CG-CG2 4.36Å; L194-I247 HydrophobicContact CD1-CD1 4.21Å; L196-I247 HydrophobicContact CD1-CD1 3.48Å; L196-I247 VanDerWaalsContact CD1-CD1 3.48Å; L227-I247 HydrophobicContact CD2-CD1 4.22Å; V230-I247 HydrophobicContact CG2-CD1 4.4Å; V230-I247 HydrophobicContact CG2-CG1 3.79Å; A243-I247 WeakPolarHBondContact O-CD1 3.43Å; A243-I247 VanDerWaalsContact O-CG1 3.29Å; A243-I247 WeakPolarHBondContact O-CG1 3.48Å; A243-I247 PolarHBondContact O-N 3.01Å; Q244-I247 PolarHBondContact O-N 2.89Å; Q245-I247 VanDerWaalsContact C-N 3.32Å
248	K	71.4	Confident	72.8	Confident	77 Å²	77	57.5 Å²	57.5	34%	0.335	35%	0.345	S	S	.	.	H	α-helix	trans	-77.4	-41.1	-179.7	-75.5	169.2	177.8	170.7	0	113.7	T84 F120 Q244 Q245	T84-K248 PolarHBondContact OG1-NZ 3.28Å; F120-K248 VanDerWaalsContact CE1-CE 3.43Å; Q244-K248 WeakPolarHBondContact O-CB 3.25Å; Q244-K248 VanDerWaalsContact O-CG 3.29Å; Q244-K248 WeakPolarHBondContact O-CG 3.12Å; Q244-K248 PolarHBondContact O-N 2.94Å; Q245-K248 PolarHBondContact O-N 2.78Å
249	C	58.2	Low	73.2	Confident	83 Å²	83	54.2 Å²	54.2	56%	0.561	33%	0.331	S	S	*	.	H	α-helix	trans	-116.9	8.3	-164.5	-61.5	0	0	0	0	114.9	Q245 G251	Q245-C249 PolarHBondContact NE2-SG 3.39Å; Q245-C249 VanDerWaalsContact NE2-SG 3.37Å; Q245-C249 WeakPolarHBondContact O-CA 3.41Å; Q245-C249 WeakPolarHBondContact O-CB 3.43Å; Q245-C249 PolarHBondContact O-N 3.08Å; C249-G251 PolarHBondContact O-N 3.07Å
250	G	57	Low	73.6	Confident	28 Å²	28	52.2 Å²	52.2	29%	0.289	32%	0.319	S	S	.	.			trans	-55.9	137.7	166.2	0	0	0	0	0	111.3	I246 H252	I246-G250 PolarHBondContact O-N 3.32Å; I246-G250 VanDerWaalsContact O-N 3.08Å; G250-H252 WeakPolarHBondContact CA-NE2 3.41Å; G250-H252 PolarHBondContact O-CD2 2.86Å; G250-H252 PolarHBondContact O-N 3.31Å
251	G	52.4	Low	74	Confident	75 Å²	75	51.4 Å²	51.4	77%	0.773	31%	0.314	S	S	*	.			trans	-77.2	60.5	-173.4	0	0	0	0	0	114	C249 V253	C249-G251 PolarHBondContact O-N 3.07Å; G251-V253 PolarHBondContact O-N 2.8Å
252	H	53.3	Low	74.7	Confident	48 Å²	48	49.2 Å²	49.2	22%	0.222	29%	0.293	C	S	.	.			trans	-81.4	79	-171.9	-54.5	-77.3	0	0	0	112.9	R187 D231 G250 S254 G255	R187-H252 PolarHBondContact NE-CD2 3.24Å; R187-H252 VanDerWaalsContact NE-CD2 3.32Å; R187-H252 PolarHBondContact NH2-CD2 3.18Å; R187-H252 PolarHBondContact NH2-NE2 2.94Å; D231-H252 IonicContact OD2-CE1 3.14Å; D231-H252 PolarHBondContact OD2-CE1 3.09Å; D231-H252 IonicContact OD2-ND1 3.89Å; G250-H252 WeakPolarHBondContact CA-NE2 3.41Å; G250-H252 PolarHBondContact O-CD2 2.86Å; G250-H252 PolarHBondContact O-N 3.31Å; H252-S254 PolarHBondContact O-N 2.96Å; H252-G255 PolarHBondContact O-N 2.93Å
253	V	51.8	Low	75.1	Confident	154 Å²	154	46.2 Å²	46.2	93%	0.933	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-23.3	174.6	-177.2	0	0	0	0	113.2	G251	G251-V253 PolarHBondContact O-N 2.8Å
254	S	57.7	Low	75.2	Confident	91 Å²	91	48.1 Å²	48.1	64%	0.636	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-1.2	-173	-168.5	0	0	0	0	115.7	H252 Y256	H252-S254 PolarHBondContact O-N 2.96Å; S254-Y256 VanDerWaalsContact O-CD2 3.27Å; S254-Y256 WeakPolarHBondContact O-CD2 3.36Å; S254-Y256 PolarHBondContact O-N 3.04Å
255	G	71.3	Confident	75.5	Confident	32 Å²	32	47.2 Å²	47.2	33%	0.33	29%	0.285	S	S	.	.	S	Bend	trans	70.6	-10.4	-176.9	0	0	0	0	0	116.4	R187 H252	R187-G255 VanDerWaalsContact CB-O 3.29Å; R187-G255 WeakPolarHBondContact CB-O 3.26Å; R187-G255 PolarHBondContact N-O 2.98Å; H252-G255 PolarHBondContact O-N 2.93Å
256	Y	81.1	Confident	75.7	Confident	113 Å²	113	43.8 Å²	43.8	44%	0.443	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	158.1	173.2	-62.8	-81.4	0	0	0	112.3	T184 V185 E186 S254	T184-Y256 HydrophobicContact CG2-CD1 4.29Å; T184-Y256 HydrophobicContact CG2-CG 4.45Å; V185-Y256 CarbonylContact O-C 3.59Å; V185-Y256 WeakPolarHBondContact O-CA 3.48Å; E186-Y256 HydrophobicContact CB-CD1 3.87Å; E186-Y256 HydrophobicContact CB-CE1 3.67Å; E186-Y256 HydrophobicContact CG-CD1 4.15Å; E186-Y256 HydrophobicContact CG-CE1 3.68Å; S254-Y256 VanDerWaalsContact O-CD2 3.27Å; S254-Y256 WeakPolarHBondContact O-CD2 3.36Å; S254-Y256 PolarHBondContact O-N 3.04Å
257	T	84.2	Confident	75.4	Confident	0 Å²	0	45 Å²	45	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	145.7	175.4	48.9	0	0	0	0	111.3	T184 V185 R187 L192 D231	T184-T257 CarbonylContact C-O 3.54Å; T184-T257 VanDerWaalsContact CA-O 3.26Å; T184-T257 WeakPolarHBondContact CA-O 3.11Å; V185-T257 PolarHBondContact N-O 3Å; V185-T257 PolarHBondContact O-N 2.56Å; V185-T257 PolarHBondContact O-OG1 3.23Å; V185-T257 VanDerWaalsContact O-OG1 3.11Å; R187-T257 HydrophobicContact CG-CG2 4.07Å; L192-T257 HydrophobicContact CD2-CG2 4.49Å; L192-T257 WeakPolarHBondContact CD2-OG1 3.43Å; D231-T257 VanDerWaalsContact OD2-CA 3.25Å; D231-T257 WeakPolarHBondContact OD2-CA 3.4Å; D231-T257 VanDerWaalsContact OD2-CB 3.3Å; D231-T257 WeakPolarHBondContact OD2-CB 3.41Å
258	N	87.9	Confident	75.1	Confident	42 Å²	42	46.8 Å²	46.8	23%	0.225	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	97.7	177.3	-62.5	-81.9	0	0	0	110.3	Q182 T184 D231	Q182-N258 HydrophobicContact CG-CB 4.23Å; T184-N258 PolarHBondContact OG1-OD1 3.33Å; D231-N258 WeakPolarHBondContact CA-O 3.26Å; D231-N258 PolarHBondContact N-O 3.07Å; D231-N258 WeakPolarHBondContact OD1-CB 3.48Å; D231-N258 PolarHBondContact OD1-N 3.29Å; D231-N258 PolarHBondContact OD1-ND2 3.41Å; D231-N258 PolarHBondContact OD2-N 3.08Å; D231-N258 VanDerWaalsContact OD2-N 3.12Å
259	L	89.5	Confident	74.8	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	128	174.9	-57.2	-176.1	0	0	0	109	Q182 I183 V185 L192 L194 V215 I221 L227 V230	Q182-L259 CarbonylContact C-O 3.56Å; Q182-L259 WeakPolarHBondContact CA-O 3.3Å; I183-L259 PolarHBondContact N-O 3.39Å; I183-L259 PolarHBondContact O-N 2.92Å; V185-L259 HydrophobicContact CG2-CD1 3.82Å; V185-L259 HydrophobicContact CG2-CG 4.13Å; L192-L259 HydrophobicContact CD1-CD1 4.27Å; L192-L259 HydrophobicContact CD1-CD2 4.02Å; L194-L259 HydrophobicContact CD2-CD1 3.65Å; V215-L259 HydrophobicContact CG2-CD1 4.35Å; I221-L259 HydrophobicContact CD1-CB 4.29Å; I221-L259 HydrophobicContact CD1-CD1 3.55Å; L227-L259 HydrophobicContact CD1-CB 3.91Å; L227-L259 HydrophobicContact CD1-CD2 4.2Å; L227-L259 HydrophobicContact CD1-CG 4.45Å; V230-L259 HydrophobicContact CB-CD2 4.5Å; V230-L259 HydrophobicContact CG1-CD2 4.43Å; V230-L259 HydrophobicContact CG2-CD2 3.83Å
260	T	90.6	Very high	75.1	Confident	18 Å²	18	49.1 Å²	49.1	11%	0.11	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	111.7	168.5	-42.8	0	0	0	0	108.2	A181 L228 R229	A181-T260 WeakPolarHBondContact O-CA 3.43Å; L228-T260 PolarHBondContact N-O 2.92Å; R229-T260 PolarHBondContact N-O 2.85Å; R229-T260 PolarHBondContact NE-OG1 2.92Å; R229-T260 PolarHBondContact NH2-OG1 2.8Å; R229-T260 VanDerWaalsContact NH2-OG1 3.1Å; R229-T260 PolarHBondContact O-N 3.47Å
261	I	91.8	Very high	75.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	152	178.4	62.9	163.3	0	0	0	111.2	L180 A181 I183 I221 D225 R226 L227 Y263 A331	L180-I261 WeakPolarHBondContact CA-O 3.31Å; A181-I261 HydrophobicContact CB-CG1 4.23Å; A181-I261 PolarHBondContact N-O 2.89Å; A181-I261 PolarHBondContact O-N 2.7Å; I183-I261 HydrophobicContact CD1-CD1 3.56Å; I183-I261 HydrophobicContact CD1-CG1 3.85Å; I221-I261 HydrophobicContact CD1-CG2 4.22Å; I221-I261 HydrophobicContact CG1-CD1 4.28Å; D225-I261 HydrophobicContact CB-CD1 4.35Å; D225-I261 WeakPolarHBondContact OD2-CD1 3.23Å; R226-I261 CarbonylContact O-C 3.59Å; R226-I261 VanDerWaalsContact O-CA 3.26Å; R226-I261 WeakPolarHBondContact O-CA 3.3Å; L227-I261 HydrophobicContact CD1-CG2 3.77Å; I261-Y263 HydrophobicContact CD1-CD1 4.11Å; I261-Y263 HydrophobicContact CD1-CG 4.46Å; I261-Y263 HydrophobicContact CG1-CD1 4.18Å; I261-A331 HydrophobicContact CD1-CB 4.04Å
262	E	89.8	Confident	76.4	Confident	21 Å²	21	51.7 Å²	51.7	10%	0.098	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	129.2	157.7	-176.9	-161.7	167.6	0	0	107.6	Q171 S178 K179 L180 R226 L228	Q171-E262 PolarHBondContact NE2-OE1 2.92Å; S178-E262 VanDerWaalsContact CB-OE1 3.29Å; S178-E262 WeakPolarHBondContact CB-OE1 3.37Å; K179-E262 CarbonylContact O-C 3.53Å; K179-E262 VanDerWaalsContact O-CA 3.29Å; K179-E262 WeakPolarHBondContact O-CA 3.43Å; L180-E262 HydrophobicContact CD2-CB 3.66Å; L180-E262 HydrophobicContact CD2-CG 3.97Å; R226-E262 HydrophobicContact CB-CB 4.17Å; R226-E262 IonicContact CZ-OE1 2.63Å; R226-E262 IonicContact CZ-OE2 3.05Å; R226-E262 PolarHBondContact N-O 3.14Å; R226-E262 IonicContact NE-OE1 2.63Å; R226-E262 PolarHBondContact NE-OE1 3.38Å; R226-E262 IonicContact NE-OE2 3.65Å; R226-E262 PolarHBondContact NE-OE2 3.35Å; R226-E262 IonicContact NH2-OE1 2.69Å; R226-E262 PolarHBondContact NH2-OE1 3.17Å; R226-E262 IonicContact NH2-OE2 2.64Å; R226-E262 PolarHBondContact O-N 2.91Å; L228-E262 HydrophobicContact CD1-CB 3.94Å; L228-E262 HydrophobicContact CG-CB 4.2Å
263	Y	88.9	Confident	77.2	Confident	6 Å²	6	56.6 Å²	56.6	2%	0.024	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	151	-177	61.2	-77.5	0	0	0	110.2	S178 K179 A181 D225 I261 V265 A331 D335 R336	S178-Y263 CarbonylContact C-O 3.43Å; S178-Y263 WeakPolarHBondContact CA-O 3.4Å; K179-Y263 HydrophobicContact CB-CD1 4.48Å; K179-Y263 HydrophobicContact CB-CD2 4.5Å; K179-Y263 HydrophobicContact CB-CE1 3.76Å; K179-Y263 HydrophobicContact CB-CE2 3.82Å; K179-Y263 VanDerWaalsContact CB-OH 3.31Å; K179-Y263 WeakPolarHBondContact CB-OH 3.16Å; K179-Y263 HydrophobicContact CD-CE2 4.22Å; K179-Y263 PolarHBondContact N-O 2.89Å; K179-Y263 VanDerWaalsContact O-CD1 3.24Å; K179-Y263 WeakPolarHBondContact O-CD1 3.28Å; K179-Y263 WeakPolarHBondContact O-CE1 3.3Å; K179-Y263 PolarHBondContact O-N 3.15Å; A181-Y263 HydrophobicContact CB-CD1 3.99Å; A181-Y263 HydrophobicContact CB-CE1 3.39Å; D225-Y263 WeakPolarHBondContact OD1-CB 3.46Å; I261-Y263 HydrophobicContact CD1-CD1 4.11Å; I261-Y263 HydrophobicContact CD1-CG 4.46Å; I261-Y263 HydrophobicContact CG1-CD1 4.18Å; Y263-V265 HydrophobicContact CD2-CG2 3.77Å; Y263-V265 HydrophobicContact CE2-CG2 3.54Å; Y263-A331 HydrophobicContact CD1-CB 3.76Å; Y263-A331 HydrophobicContact CD2-CB 4Å; Y263-A331 HydrophobicContact CE1-CB 3.81Å; Y263-A331 HydrophobicContact CE2-CB 4.01Å; Y263-A331 HydrophobicContact CG-CB 3.88Å; Y263-D335 VanDerWaalsContact CE2-OD2 3.31Å; Y263-D335 WeakPolarHBondContact CE2-OD2 3.34Å; Y263-D335 PolarHBondContact OH-OD2 3.47Å; Y263-R336 HydrophobicContact CD2-CG 4.1Å
264	D	85.3	Confident	78.2	Confident	41 Å²	41	49.9 Å²	49.9	22%	0.219	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	141	-176	-66.6	-42.6	0	0	0	111.8	V176 S178 R226	V176-D264 HydrophobicContact CG1-CB 3.63Å; S178-D264 WeakPolarHBondContact CB-OD1 3.5Å; S178-D264 PolarHBondContact OG-OD1 3.41Å; R226-D264 IonicContact CZ-OD1 2.94Å; R226-D264 IonicContact CZ-OD2 2.78Å; R226-D264 IonicContact NH1-OD1 2.7Å; R226-D264 IonicContact NH1-OD2 3.76Å; R226-D264 PolarHBondContact NH1-OD2 2.73Å; R226-D264 IonicContact NH2-OD1 3.65Å; R226-D264 PolarHBondContact NH2-OD1 2.98Å; R226-D264 IonicContact NH2-OD2 2.73Å; R226-D264 PolarHBondContact NH2-OD2 3.47Å
265	V	85.3	Confident	78.9	Confident	4 Å²	4	50.5 Å²	50.5	2%	0.024	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	129.9	-175.6	175.2	0	0	0	0	109.6	V176 T177 K179 Y263 D335 R336	V176-V265 CarbonylContact C-O 3.55Å; V176-V265 WeakPolarHBondContact CA-O 3.32Å; T177-V265 HydrophobicContact CG2-CB 4.12Å; T177-V265 HydrophobicContact CG2-CG1 4.43Å; T177-V265 PolarHBondContact N-O 2.91Å; T177-V265 WeakPolarHBondContact O-CB 3.08Å; T177-V265 PolarHBondContact O-N 2.66Å; K179-V265 HydrophobicContact CB-CG2 4.41Å; K179-V265 HydrophobicContact CD-CG2 3.77Å; K179-V265 HydrophobicContact CG-CG2 3.97Å; Y263-V265 HydrophobicContact CD2-CG2 3.77Å; Y263-V265 HydrophobicContact CE2-CG2 3.54Å; V265-D335 WeakPolarHBondContact CG1-O 3.34Å; V265-R336 WeakPolarHBondContact CA-O 3.1Å
266	S	81.6	Confident	79.2	Confident	36 Å²	36	50.1 Å²	50.1	25%	0.252	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	144.2	179	-61.1	0	0	0	0	112.3	C175 R336 G338	C175-S266 CarbonylContact O-C 3.5Å; C175-S266 WeakPolarHBondContact O-CA 3.39Å; S266-R336 PolarHBondContact N-O 2.81Å; S266-G338 WeakPolarHBondContact O-CA 3.45Å
267	V	74.6	Confident	79.2	Confident	58 Å²	58	48 Å²	48	35%	0.352	26%	0.264	S	S	.	.			trans	-107.2	92.8	179.6	-179	0	0	0	0	109.5	C175 T177 Q269	C175-V267 PolarHBondContact O-N 3.16Å; T177-V267 HydrophobicContact CG2-CG2 3.86Å; V267-Q269 HydrophobicContact CG1-CG 4.36Å; V267-Q269 PolarHBondContact O-N 3.13Å
268	V	73.9	Confident	79.3	Confident	55 Å²	55	49.9 Å²	49.9	33%	0.333	27%	0.274	S	S	.	.			trans	-94.2	79.5	-174.1	-167.2	0	0	0	0	111	S270 V271 A339	V268-S270 PolarHBondContact O-N 2.86Å; V268-V271 HydrophobicContact CB-CG2 4.11Å; V268-V271 HydrophobicContact CG1-CG2 3.86Å; V268-V271 PolarHBondContact O-N 3.05Å; V268-A339 HydrophobicContact CB-CB 4.35Å; V268-A339 HydrophobicContact CG2-CB 4.14Å
269	Q	64.2	Low	79.3	Confident	118 Å²	118	53.1 Å²	53.1	55%	0.551	29%	0.291	S	S	*	.	H	α-helix	trans	-53.2	-31.2	-177.3	-64	-175	4.1	0	0	113.7	V267 V271 E272 F273	V267-Q269 HydrophobicContact CG1-CG 4.36Å; V267-Q269 PolarHBondContact O-N 3.13Å; Q269-V271 PolarHBondContact O-N 2.93Å; Q269-V271 VanDerWaalsContact O-N 3.13Å; Q269-E272 PolarHBondContact O-N 2.86Å; Q269-F273 VanDerWaalsContact O-CD2 3.27Å; Q269-F273 WeakPolarHBondContact O-CD2 3.48Å
270	S	65.8	Low	79.2	Confident	91 Å²	91	54.1 Å²	54.1	64%	0.636	30%	0.296	S	S	*	.	H	α-helix	trans	-56	-27.3	176.7	-47	0	0	0	0	113.7	V268 S274	V268-S270 PolarHBondContact O-N 2.86Å; S270-S274 WeakPolarHBondContact O-CB 3.48Å; S270-S274 PolarHBondContact O-N 3.1Å
271	V	71.5	Confident	79	Confident	15 Å²	15	56 Å²	56	9%	0.091	30%	0.303	C	S	.	.	H	α-helix	trans	-71.2	-45.8	178.5	-178.6	0	0	0	0	111.2	V268 Q269 F273 S274 L278 A339 P383 H385	V268-V271 HydrophobicContact CB-CG2 4.11Å; V268-V271 HydrophobicContact CG1-CG2 3.86Å; V268-V271 PolarHBondContact O-N 3.05Å; Q269-V271 PolarHBondContact O-N 2.93Å; Q269-V271 VanDerWaalsContact O-N 3.13Å; V271-F273 VanDerWaalsContact C-N 3.28Å; V271-F273 PolarHBondContact O-N 3.41Å; V271-S274 WeakPolarHBondContact O-CB 3.41Å; V271-S274 PolarHBondContact O-N 3.26Å; V271-S274 PolarHBondContact O-OG 2.82Å; V271-L278 HydrophobicContact CB-CD1 4.18Å; V271-L278 HydrophobicContact CG1-CD1 4.05Å; V271-L278 HydrophobicContact CG2-CD1 3.86Å; V271-A339 HydrophobicContact CG2-CB 4.03Å; V271-P383 HydrophobicContact CG1-CG 4.49Å; V271-H385 PolarHBondContact O-CE1 2.95Å; V271-H385 PolarHBondContact O-NE2 2.84Å
272	E	65	Low	78.8	Confident	143 Å²	143	56.3 Å²	56.3	67%	0.668	31%	0.305	S	S	*	.	H	α-helix	trans	-62.5	-33.3	-175.9	-172.3	173.2	-167.8	0	0	112.7	Q269 H385	Q269-E272 PolarHBondContact O-N 2.86Å; E272-H385 PolarHBondContact O-NE2 2.81Å
273	F	69.4	Low	78.3	Confident	150 Å²	150	58 Å²	58	66%	0.658	31%	0.313	S	S	*	.	H	α-helix	trans	-91.5	-10.4	-180	-58	-64.7	0	0	0	114.5	Q269 V271	Q269-F273 VanDerWaalsContact O-CD2 3.27Å; Q269-F273 WeakPolarHBondContact O-CD2 3.48Å; V271-F273 VanDerWaalsContact C-N 3.28Å; V271-F273 PolarHBondContact O-N 3.41Å
274	S	72.8	Confident	77.7	Confident	14 Å²	14	57.9 Å²	57.9	10%	0.098	31%	0.312	C	S	.	.			trans	-62.8	144.7	-179.5	69.2	0	0	0	0	112.8	S270 V271 H385	S270-S274 WeakPolarHBondContact O-CB 3.48Å; S270-S274 PolarHBondContact O-N 3.1Å; V271-S274 WeakPolarHBondContact O-CB 3.41Å; V271-S274 PolarHBondContact O-N 3.26Å; V271-S274 PolarHBondContact O-OG 2.82Å; S274-H385 PolarHBondContact O-CD2 3.24Å; S274-H385 PolarHBondContact O-NE2 3.09Å
275	M	71.9	Confident	76.9	Confident	103 Å²	103	58.8 Å²	58.8	51%	0.507	32%	0.321	S	S	.	.			trans	-127.7	16.4	-178.3	-66.4	-82.5	90.1	0	0	112.9	R389	M275-R389 PolarHBondContact SD-NH1 3.36Å; M275-R389 VanDerWaalsContact SD-NH1 3.41Å
276	G	77.3	Confident	75.6	Confident	25 Å²	25	64.7 Å²	64.7	26%	0.258	35%	0.349	S	S	.	.	S	Bend	trans	-158.4	-172.7	-176.7	0	0	0	0	0	111	M382	G276-M382 VanDerWaalsContact C-SD 3.52Å
277	P	82.6	Confident	74.7	Confident	68 Å²	68	69.2 Å²	69.2	44%	0.442	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-68.5	135.4	-177	29.5	-33.9	0	0	0	111	L347 Q380 I381 M382	P277-L347 HydrophobicContact CB-CD1 3.71Å; P277-Q380 HydrophobicContact CB-CG 4.17Å; P277-I381 CarbonylContact C-O 3.58Å; P277-I381 WeakPolarHBondContact CA-O 3.29Å; P277-M382 HydrophobicContact CB-CE 4.03Å; P277-M382 HydrophobicContact CG-CE 4.29Å
278	L	85	Confident	74.6	Confident	40 Å²	40	66.8 Å²	66.8	21%	0.209	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	137	175.5	-65.3	-179.2	0	0	0	109.9	V271 I280 Q380 I381 P383	V271-L278 HydrophobicContact CB-CD1 4.18Å; V271-L278 HydrophobicContact CG1-CD1 4.05Å; V271-L278 HydrophobicContact CG2-CD1 3.86Å; L278-I280 HydrophobicContact CB-CG1 4.34Å; L278-Q380 CarbonylContact O-C 3.49Å; L278-Q380 VanDerWaalsContact O-CA 3.27Å; L278-Q380 WeakPolarHBondContact O-CA 3.42Å; L278-I381 HydrophobicContact CB-CG1 4.14Å; L278-I381 PolarHBondContact N-O 2.87Å; L278-I381 PolarHBondContact O-N 3.1Å; L278-P383 HydrophobicContact CD1-CG 3.8Å; L278-P383 HydrophobicContact CG-CG 4.13Å
279	L	87.7	Confident	74.9	Confident	109 Å²	109	70.3 Å²	70.3	57%	0.571	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	123	166.3	-170.8	65.9	0	0	0	107.7	Q378 Q380	L279-Q378 HydrophobicContact CD1-CG 3.7Å; L279-Q378 HydrophobicContact CG-CG 4.19Å; L279-Q380 HydrophobicContact CD1-CB 4.2Å
280	I	88	Confident	75.8	Confident	22 Å²	22	64.7 Å²	64.7	11%	0.113	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.2	-177.5	-54.3	172.4	0	0	0	107.6	L278 I282 A339 L340 Q378 M379 I381	L278-I280 HydrophobicContact CB-CG1 4.34Å; I280-I282 HydrophobicContact CG2-CD1 4.18Å; I280-I282 HydrophobicContact CG2-CG1 3.67Å; I280-A339 HydrophobicContact CD1-CB 3.88Å; I280-A339 HydrophobicContact CG2-CB 4.21Å; I280-L340 HydrophobicContact CD1-CD2 3.73Å; I280-Q378 CarbonylContact O-C 3.58Å; I280-Q378 WeakPolarHBondContact O-CA 3.3Å; I280-M379 PolarHBondContact N-O 3.07Å; I280-M379 PolarHBondContact O-N 2.97Å; I280-I381 HydrophobicContact CD1-CD1 3.61Å; I280-I381 HydrophobicContact CD1-CG1 3.75Å
281	E	87.1	Confident	76.7	Confident	56 Å²	56	60.6 Å²	60.6	26%	0.262	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122.5	168.2	-170	174	123.4	0	0	108.4	Y376	E281-Y376 HydrophobicContact CG-CD2 3.78Å; E281-Y376 HydrophobicContact CG-CG 4.06Å
282	I	86.9	Confident	77.5	Confident	7 Å²	7	60.1 Å²	60.1	4%	0.036	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	111.4	-178.3	-52	178.5	0	0	0	108.3	I280 L290 I333 C337 L340 Y376 T377 M379	I280-I282 HydrophobicContact CG2-CD1 4.18Å; I280-I282 HydrophobicContact CG2-CG1 3.67Å; I282-L290 HydrophobicContact CB-CD1 4.42Å; I282-L290 HydrophobicContact CD1-CD1 4.23Å; I282-L290 HydrophobicContact CG2-CD1 3.91Å; I282-I333 HydrophobicContact CG2-CG2 3.55Å; I282-C337 HydrophobicContact CG2-CB 4.27Å; I282-L340 HydrophobicContact CD1-CD1 3.78Å; I282-L340 HydrophobicContact CD1-CG 4.26Å; I282-Y376 CarbonylContact O-C 3.57Å; I282-Y376 VanDerWaalsContact O-CA 3.29Å; I282-Y376 WeakPolarHBondContact O-CA 3.47Å; I282-T377 PolarHBondContact N-O 2.72Å; I282-T377 PolarHBondContact O-N 3.31Å; I282-M379 HydrophobicContact CD1-SD 4.48Å
283	E	80.3	Confident	78.5	Confident	58 Å²	58	56.4 Å²	56.4	27%	0.271	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	135.5	175.3	-169.5	161.3	-117.2	0	0	110.7	R60	R60-E283 IonicContact CZ-OE1 3.34Å; R60-E283 IonicContact NE-OE1 3.18Å; R60-E283 PolarHBondContact NE-OE1 3.21Å; R60-E283 IonicContact NH2-OE1 2.77Å; R60-E283 PolarHBondContact NH2-OE1 2.82Å
284	R	76.7	Confident	79.4	Confident	3 Å²	3	50.2 Å²	50.2	1%	0.011	27%	0.27	C	S	.	.			trans	-145.5	110.2	-166.5	-175.7	171.6	178.1	-171.2	-5	111.2	D288 I333 L368 D369 G375 T377	R284-D288 VanDerWaalsContact CZ-O 3.32Å; R284-D288 PolarHBondContact NE-O 2.85Å; R284-D288 PolarHBondContact NH2-O 2.83Å; R284-I333 HydrophobicContact CG-CD1 4.04Å; R284-L368 VanDerWaalsContact CZ-O 3.31Å; R284-L368 PolarHBondContact NH1-O 2.79Å; R284-L368 PolarHBondContact NH2-O 3.34Å; R284-L368 VanDerWaalsContact NH2-O 3.11Å; R284-D369 IonicContact NH2-OD1 3.64Å; R284-G375 CarbonylContact C-O 3.48Å; R284-G375 PolarHBondContact N-O 3.08Å; R284-G375 CarbonylContact O-C 3.6Å; R284-G375 VanDerWaalsContact O-O 3.09Å; R284-T377 WeakPolarHBondContact CD-OG1 3.24Å; R284-T377 PolarHBondContact NH1-OG1 3.4Å
285	P	67.6	Low	79.9	Confident	60 Å²	60	51.7 Å²	51.7	39%	0.39	28%	0.28	S	S	.	.			trans	-58.6	147.2	173.9	-21	32.2	0	0	0	111.6	N287 D288	P285-N287 PolarHBondContact O-N 3.5Å; P285-D288 WeakPolarHBondContact CB-OD2 3.38Å; P285-D288 PolarHBondContact O-N 3.28Å
286	M	58.1	Low	80.3	Confident	128 Å²	128	50.2 Å²	50.2	63%	0.631	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	133.9	-177.5	-65.1	-179.1	179.6	0	0	111.3	D288	M286-D288 VanDerWaalsContact C-N 3.28Å; M286-D288 PolarHBondContact O-N 2.8Å
287	N	62.4	Low	79.5	Confident	130 Å²	130	56 Å²	56	70%	0.695	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.2	0.9	-178.1	-48	-55	0	0	0	117.3	P285	P285-N287 PolarHBondContact O-N 3.5Å
288	D	71.9	Confident	78.1	Confident	8 Å²	8	56.4 Å²	56.4	4%	0.043	29%	0.29	C	S	.	.			trans	-72.1	148.1	168.1	-90.5	-55.3	0	0	0	111.8	G219 K222 R284 P285 M286 I333	G219-D288 WeakPolarHBondContact CA-OD1 3.34Å; K222-D288 IonicContact NZ-OD1 2.64Å; K222-D288 PolarHBondContact NZ-OD1 2.83Å; K222-D288 IonicContact NZ-OD2 3.94Å; K222-D288 PolarHBondContact NZ-OD2 2.81Å; R284-D288 VanDerWaalsContact CZ-O 3.32Å; R284-D288 PolarHBondContact NE-O 2.85Å; R284-D288 PolarHBondContact NH2-O 2.83Å; P285-D288 WeakPolarHBondContact CB-OD2 3.38Å; P285-D288 PolarHBondContact O-N 3.28Å; M286-D288 VanDerWaalsContact C-N 3.28Å; M286-D288 PolarHBondContact O-N 2.8Å; D288-I333 HydrophobicContact CB-CD1 3.73Å
289	K	81	Confident	76	Confident	128 Å²	128	58.5 Å²	58.5	56%	0.557	31%	0.314	S	S	*	.			trans	-89.7	137.2	169.4	-64.9	-150.8	177.3	-153.5	0	110.9	G291 D369	K289-G291 PolarHBondContact O-N 2.7Å; K289-D369 WeakPolarHBondContact CE-OD2 3.3Å; K289-D369 IonicContact NZ-OD1 2.72Å; K289-D369 IonicContact NZ-OD2 3.62Å; K289-D369 PolarHBondContact NZ-OD2 2.81Å
290	L	82.6	Confident	73.5	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.318	C	S	.	.			trans	-61.2	-35	179.8	-169.6	67.1	0	0	0	112.1	I282 L292 I333 A334 L368 M379	I282-L290 HydrophobicContact CB-CD1 4.42Å; I282-L290 HydrophobicContact CD1-CD1 4.23Å; I282-L290 HydrophobicContact CG2-CD1 3.91Å; L290-L292 HydrophobicContact CD2-CD1 3.84Å; L290-L292 HydrophobicContact CD2-CG 4.18Å; L290-L292 HydrophobicContact CG-CG 4.46Å; L290-I333 HydrophobicContact CD1-CB 4.17Å; L290-I333 HydrophobicContact CD1-CG2 3.96Å; L290-I333 PolarHBondContact O-N 3.22Å; L290-A334 HydrophobicContact CG-CB 4.26Å; L290-A334 VanDerWaalsContact O-CB 3.27Å; L290-A334 WeakPolarHBondContact O-CB 3.37Å; L290-A334 PolarHBondContact O-N 2.94Å; L290-L368 HydrophobicContact CD2-CD2 3.79Å; L290-M379 HydrophobicContact CD2-SD 3.64Å
291	G	84.4	Confident	70.9	Confident	5 Å²	5	62 Å²	62	5%	0.052	35%	0.349	C	S	.	.			trans	93.6	20.8	172.1	0	0	0	0	0	115.9	K289 L329	K289-G291 PolarHBondContact O-N 2.7Å; G291-L329 WeakPolarHBondContact O-CB 3.39Å; G291-L329 WeakPolarHBondContact O-CG 3.49Å; G291-L329 PolarHBondContact O-N 2.91Å
292	L	88.7	Confident	68.4	Low	6 Å²	6	64.4 Å²	64.4	3%	0.031	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	152.5	170.8	-62.1	179.7	0	0	0	111.8	L290 L294 I325 I328 A334 L340 L368 M379	L290-L292 HydrophobicContact CD2-CD1 3.84Å; L290-L292 HydrophobicContact CD2-CG 4.18Å; L290-L292 HydrophobicContact CG-CG 4.46Å; L292-L294 HydrophobicContact CB-CD2 4.28Å; L292-L294 HydrophobicContact CD1-CD2 4.39Å; L292-I325 HydrophobicContact CD1-CD1 4.23Å; L292-I325 HydrophobicContact CD2-CD1 4.02Å; L292-I325 HydrophobicContact CD2-CG1 4.47Å; L292-I325 HydrophobicContact CD2-CG2 4.07Å; L292-I328 HydrophobicContact CD2-CD1 4.36Å; L292-I328 HydrophobicContact CD2-CG1 3.92Å; L292-I328 HydrophobicContact CD2-CG2 4.42Å; L292-A334 HydrophobicContact CD2-CB 3.48Å; L292-A334 VanDerWaalsContact CD2-CB 3.48Å; L292-A334 HydrophobicContact CG-CB 3.96Å; L292-L340 HydrophobicContact CD1-CD1 4.1Å; L292-L340 HydrophobicContact CD2-CD1 3.94Å; L292-L340 HydrophobicContact CG-CD1 4.44Å; L292-L368 HydrophobicContact CD1-CD1 4.3Å; L292-M379 HydrophobicContact CD1-CE 4Å; L292-M379 HydrophobicContact CD1-SD 4.46Å
293	V	86.4	Confident	65.9	Low	64 Å²	64	69 Å²	69	39%	0.388	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126.2	159.5	-177.3	0	0	0	0	107.1	A326 S327	V293-A326 HydrophobicContact CG1-CB 4.44Å; V293-A326 WeakPolarHBondContact O-CB 3.32Å; V293-A326 PolarHBondContact O-N 3.32Å; V293-S327 WeakPolarHBondContact CB-OG 3.39Å; V293-S327 WeakPolarHBondContact CG2-OG 3.29Å; V293-S327 PolarHBondContact N-O 3.45Å; V293-S327 PolarHBondContact O-N 2.77Å
294	L	88.6	Confident	63.9	Low	21 Å²	21	72 Å²	72	11%	0.11	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	152.3	-176.6	-57.5	179.6	0	0	0	111.1	L292 V323 F324 I325 V346 P361 V364 L368	L292-L294 HydrophobicContact CB-CD2 4.28Å; L292-L294 HydrophobicContact CD1-CD2 4.39Å; L294-V323 HydrophobicContact CB-CG1 3.97Å; L294-V323 HydrophobicContact CD1-CG1 3.97Å; L294-V323 HydrophobicContact CG-CG1 4.4Å; L294-F324 CarbonylContact C-O 3.49Å; L294-F324 VanDerWaalsContact CA-O 3.31Å; L294-F324 WeakPolarHBondContact CA-O 3.48Å; L294-I325 HydrophobicContact CD2-CG1 4.01Å; L294-V346 HydrophobicContact CD2-CG2 4.18Å; L294-P361 HydrophobicContact CB-CB 4Å; L294-V364 HydrophobicContact CD1-CB 3.89Å; L294-V364 HydrophobicContact CD1-CG1 3.46Å; L294-V364 VanDerWaalsContact CD1-CG1 3.46Å; L294-L368 HydrophobicContact CD1-CD1 4.15Å
295	C	82.5	Confident	61.8	Low	44 Å²	44	75.3 Å²	75.3	30%	0.297	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	162.5	169.1	68	0	0	0	0	111.2	V323 F324 A326	C295-V323 CarbonylContact O-C 3.59Å; C295-V323 WeakPolarHBondContact O-CA 3.29Å; C295-F324 PolarHBondContact N-O 3.05Å; C295-F324 PolarHBondContact O-N 2.83Å; C295-A326 HydrophobicContact CB-CB 3.84Å
296	N	80.4	Confident	60.4	Low	72 Å²	72	78.7 Å²	78.7	39%	0.385	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	128.1	167.5	-175.6	-21.1	0	0	0	107.6	G322 P361	N296-G322 WeakPolarHBondContact CA-O 3.25Å; N296-G322 PolarHBondContact OD1-O 3.32Å; N296-P361 HydrophobicContact CB-CG 3.76Å; N296-P361 VanDerWaalsContact N-CG 3.35Å
297	Y	61.5	Low	59.2	Low	146 Å²	146	76.3 Å²	76.3	57%	0.573	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	109	176.7	-165.2	-91	0	0	0	110.3	G322	Y297-G322 PolarHBondContact N-O 3.03Å
298	T	53.3	Low	57.9	Low	77 Å²	77	76 Å²	76	47%	0.472	51%	0.511	S	S	.	.			trans	-78.1	130.5	165.5	50.5	0	0	0	0	109	A300	T298-A300 VanDerWaalsContact C-N 3.25Å; T298-A300 PolarHBondContact O-N 3.25Å
299	A	40.8	Very low	56	Low	85 Å²	85	81.4 Å²	81.4	70%	0.702	55%	0.55	S	S	*	.			trans	-74.4	75.2	-176.4	0	0	0	0	0	111.7	V301	A299-V301 PolarHBondContact O-N 3.14Å
300	A	33.5	Very low	53.8	Low	79 Å²	79	81.7 Å²	81.7	65%	0.653	56%	0.563	S	S	*	*			trans	-66.9	89.6	-177.3	0	0	0	0	0	112.2	T298 P302	T298-A300 VanDerWaalsContact C-N 3.25Å; T298-A300 PolarHBondContact O-N 3.25Å; A300-P302 WeakPolarHBondContact O-CD 3.47Å
301	V	35.1	Very low	51.5	Low	126 Å²	126	88 Å²	88	76%	0.764	60%	0.603	S	S	*	*			trans	-67.9	119.7	174.5	179.3	0	0	0	0	109.8	A299 A303	A299-V301 PolarHBondContact O-N 3.14Å; V301-A303 PolarHBondContact O-N 2.84Å; V301-A303 VanDerWaalsContact O-N 3.08Å
302	P	33.4	Very low	48.9	Very low	106 Å²	106	92.7 Å²	92.7	69%	0.688	64%	0.635	S	S	*	*			trans	-72.1	105.8	174.8	28.9	-32.8	0	0	0	109.9	A300 S304	A300-P302 WeakPolarHBondContact O-CD 3.47Å; P302-S304 PolarHBondContact O-N 3.33Å
303	A	35.7	Very low	46.3	Very low	103 Å²	103	98 Å²	98	85%	0.851	67%	0.673	S	S	*	*			trans	-72.4	70.1	-178.2	0	0	0	0	0	113.1	V301 G305	V301-A303 PolarHBondContact O-N 2.84Å; V301-A303 VanDerWaalsContact O-N 3.08Å; A303-G305 PolarHBondContact O-N 2.92Å
304	S	37.4	Very low	44.1	Very low	121 Å²	121	99 Å²	99	85%	0.846	70%	0.696	S	S	*	*			trans	-88.2	71.9	176.3	-62.1	0	0	0	0	111.6	P302	P302-S304 PolarHBondContact O-N 3.33Å
305	G	33.5	Very low	41.6	Very low	72 Å²	72	107 Å²	107	74%	0.742	73%	0.733	S	S	*	*			trans	-159.5	107.9	178.3	0	0	0	0	0	113.1	A303 G307	A303-G305 PolarHBondContact O-N 2.92Å; G305-G307 PolarHBondContact O-N 3Å
306	S	37.6	Very low	39.2	Very low	132 Å²	132	114.5 Å²	114.5	92%	0.923	76%	0.76	S	S	*	*			trans	-78.8	116.7	178.1	54.5	0	0	0	0	111.9
307	G	31.8	Very low	37.2	Very low	77 Å²	77	118.4 Å²	118.4	79%	0.794	78%	0.78	S	S	*	*			trans	-164.2	132.1	172.6	0	0	0	0	0	111.3	G305	G305-G307 PolarHBondContact O-N 3Å
308	S	36.6	Very low	36.2	Very low	124 Å²	124	119.9 Å²	119.9	87%	0.867	79%	0.792	S	S	*	*			trans	-101.2	118.5	-169.5	57.1	0	0	0	0	113.8
309	S	32.2	Very low	35.6	Very low	121 Å²	121	123.7 Å²	123.7	85%	0.846	80%	0.804	S	S	*	*			trans	-157	142.9	151.9	53.2	0	0	0	0	110.9
310	T	33.7	Very low	36.1	Very low	135 Å²	135	125.2 Å²	125.2	83%	0.828	81%	0.81	S	S	*	*			trans	-74	148.1	179.2	41.1	0	0	0	0	112.3
311	P	34.4	Very low	37.3	Very low	131 Å²	131	124 Å²	124	85%	0.851	80%	0.8	S	S	*	*			trans	-78.9	149.2	-177.1	32.9	-36	0	0	0	113
312	S	29.3	Very low	39.2	Very low	104 Å²	104	118.2 Å²	118.2	73%	0.727	77%	0.766	S	S	*	*			trans	-136.5	127	167.6	58.8	0	0	0	0	111
313	S	34.7	Very low	41.7	Very low	117 Å²	117	113.4 Å²	113.4	82%	0.818	74%	0.735	S	S	*	*	S	Bend	trans	49.4	81.8	162.8	60.2	0	0	0	0	118.6
314	G	41.3	Very low	44.1	Very low	85 Å²	85	110.3 Å²	110.3	88%	0.876	70%	0.702	S	S	*	*				66.8	59.3	112	0	0	0	0	0	120.1
315	E	35.3	Very low	46.7	Very low	190 Å²	190	104.6 Å²	104.6	89%	0.888	66%	0.662	S	S	*	*			trans	-108.2	135.9	146.1	-71.5	-167.1	127.6	0	0	109.3
316	K	32.6	Very low	49.2	Very low	201 Å²	201	103.2 Å²	103.2	87%	0.874	64%	0.644	S	S	*	*			trans	-78.9	122	169.5	-74.1	-173.8	178.1	-176.7	0	108.4	E318	K316-E318 PolarHBondContact O-N 3.1Å
317	I	37.7	Very low	51.7	Low	155 Å²	155	99.2 Å²	99.2	80%	0.795	62%	0.615	S	S	*	*			trans	-77.6	114.6	164.3	-59.4	175	0	0	0	106.6	E319	I317-E319 PolarHBondContact O-N 3.27Å
318	E	39.8	Very low	54.5	Low	176 Å²	176	97.1 Å²	97.1	82%	0.822	59%	0.586	S	S	*	*			trans	-77.3	102	170.4	-69.8	-178.1	146.6	0	0	108.6	K316 S320	K316-E318 PolarHBondContact O-N 3.1Å; E318-S320 PolarHBondContact O-N 3.05Å
319	E	40.9	Very low	57	Low	157 Å²	157	94.1 Å²	94.1	73%	0.734	56%	0.559	S	S	*	*			trans	-69.3	107.5	170.2	-64.8	-176.6	144.9	0	0	108.7	I317 A321	I317-E319 PolarHBondContact O-N 3.27Å; E319-A321 VanDerWaalsContact C-N 3.31Å; E319-A321 PolarHBondContact O-N 2.8Å
320	S	50.6	Low	59.7	Low	117 Å²	117	91.2 Å²	91.2	82%	0.818	54%	0.538	S	S	*	.			trans	-69	86.9	177.3	-51.6	0	0	0	0	110.7	E318 G322	E318-S320 PolarHBondContact O-N 3.05Å; S320-G322 PolarHBondContact O-N 3.14Å
321	A	59.7	Low	62.2	Low	53 Å²	53	84.8 Å²	84.8	44%	0.438	50%	0.499	S	S	.	.			trans	-63.7	121.7	170.9	0	0	0	0	0	109.9	E319	E319-A321 VanDerWaalsContact C-N 3.31Å; E319-A321 PolarHBondContact O-N 2.8Å
322	G	74.3	Confident	64.9	Low	5 Å²	5	78.9 Å²	78.9	5%	0.052	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	149.2	179	0	0	0	0	0	111.9	N296 Y297 S320 F324	N296-G322 WeakPolarHBondContact CA-O 3.25Å; N296-G322 PolarHBondContact OD1-O 3.32Å; Y297-G322 PolarHBondContact N-O 3.03Å; S320-G322 PolarHBondContact O-N 3.14Å; G322-F324 VanDerWaalsContact C-CE2 3.43Å; G322-F324 WeakPolarHBondContact O-CD2 3.15Å; G322-F324 WeakPolarHBondContact O-CE2 3.5Å
323	V	86	Confident	67.7	Low	6 Å²	6	74.8 Å²	74.8	4%	0.036	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.8	172.7	-178.1	0	0	0	0	109.2	L294 C295 Q345 V346 I354 V364	L294-V323 HydrophobicContact CB-CG1 3.97Å; L294-V323 HydrophobicContact CD1-CG1 3.97Å; L294-V323 HydrophobicContact CG-CG1 4.4Å; C295-V323 CarbonylContact O-C 3.59Å; C295-V323 WeakPolarHBondContact O-CA 3.29Å; V323-Q345 WeakPolarHBondContact O-CA 3.27Å; V323-Q345 WeakPolarHBondContact O-CG 3.34Å; V323-V346 PolarHBondContact O-N 3.12Å; V323-I354 HydrophobicContact CB-CG2 4.31Å; V323-I354 HydrophobicContact CG2-CG2 4.11Å; V323-V364 HydrophobicContact CG1-CB 4.42Å; V323-V364 HydrophobicContact CG1-CG1 4.46Å; V323-V364 HydrophobicContact CG1-CG2 4.3Å; V323-V364 HydrophobicContact CG2-CG2 4.12Å
324	F	87.6	Confident	70.2	Confident	37 Å²	37	69.2 Å²	69.2	16%	0.162	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	153.9	-174	-58.1	-95.9	0	0	0	111.4	L294 C295 G322 A326 D344 Q345 L387	L294-F324 CarbonylContact C-O 3.49Å; L294-F324 VanDerWaalsContact CA-O 3.31Å; L294-F324 WeakPolarHBondContact CA-O 3.48Å; C295-F324 PolarHBondContact N-O 3.05Å; C295-F324 PolarHBondContact O-N 2.83Å; G322-F324 VanDerWaalsContact C-CE2 3.43Å; G322-F324 WeakPolarHBondContact O-CD2 3.15Å; G322-F324 WeakPolarHBondContact O-CE2 3.5Å; F324-A326 PolarHBondContact O-N 2.98Å; F324-D344 CarbonylContact C-O 3.55Å; F324-D344 VanDerWaalsContact CA-O 3.26Å; F324-D344 WeakPolarHBondContact CA-O 3.34Å; F324-Q345 HydrophobicContact CD1-CB 3.65Å; F324-Q345 HydrophobicContact CD1-CG 4.04Å; F324-Q345 HydrophobicContact CE1-CB 3.6Å; F324-Q345 HydrophobicContact CE1-CG 3.79Å; F324-Q345 HydrophobicContact CZ-CB 4.41Å; F324-Q345 HydrophobicContact CZ-CG 4.11Å; F324-L387 HydrophobicContact CD1-CD1 4.41Å; F324-L387 HydrophobicContact CE1-CD1 4.07Å
325	I	90.4	Very high	72.5	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.01	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	111.4	172.7	-59.2	-179.2	0	0	0	109.1	L292 L294 I328 L340 G343 D344 V346	L292-I325 HydrophobicContact CD1-CD1 4.23Å; L292-I325 HydrophobicContact CD2-CD1 4.02Å; L292-I325 HydrophobicContact CD2-CG1 4.47Å; L292-I325 HydrophobicContact CD2-CG2 4.07Å; L294-I325 HydrophobicContact CD2-CG1 4.01Å; I325-I328 HydrophobicContact CG2-CD1 4.29Å; I325-I328 HydrophobicContact CG2-CG1 3.76Å; I325-L340 HydrophobicContact CD1-CB 4.14Å; I325-L340 HydrophobicContact CD1-CD1 4.48Å; I325-L340 HydrophobicContact CD1-CD2 4.38Å; I325-G343 PolarHBondContact O-N 3.05Å; I325-D344 HydrophobicContact CD1-CB 4.2Å; I325-D344 PolarHBondContact N-O 3.36Å; I325-V346 HydrophobicContact CG1-CG2 4.32Å
326	A	86.8	Confident	75	Confident	43 Å²	43	58.9 Å²	58.9	36%	0.355	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-37.4	-179.8	0	0	0	0	0	112.7	V293 C295 F324 V342	V293-A326 HydrophobicContact CG1-CB 4.44Å; V293-A326 WeakPolarHBondContact O-CB 3.32Å; V293-A326 PolarHBondContact O-N 3.32Å; C295-A326 HydrophobicContact CB-CB 3.84Å; F324-A326 PolarHBondContact O-N 2.98Å; A326-V342 WeakPolarHBondContact O-CG1 3.4Å
327	S	89.4	Confident	77.4	Confident	47 Å²	47	50.5 Å²	50.5	33%	0.329	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	166	169	76.7	0	0	0	0	111.4	V293	V293-S327 WeakPolarHBondContact CB-OG 3.39Å; V293-S327 WeakPolarHBondContact CG2-OG 3.29Å; V293-S327 PolarHBondContact N-O 3.45Å; V293-S327 PolarHBondContact O-N 2.77Å
328	I	90.8	Very high	79.5	Confident	33 Å²	33	44.5 Å²	44.5	17%	0.169	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	133.1	175.1	-53.1	-178.4	0	0	0	107.2	L292 I325 A334 D335 L340 V342	L292-I328 HydrophobicContact CD2-CD1 4.36Å; L292-I328 HydrophobicContact CD2-CG1 3.92Å; L292-I328 HydrophobicContact CD2-CG2 4.42Å; I325-I328 HydrophobicContact CG2-CD1 4.29Å; I325-I328 HydrophobicContact CG2-CG1 3.76Å; I328-A334 HydrophobicContact CG2-CB 3.7Å; I328-D335 HydrophobicContact CG2-CB 3.86Å; I328-L340 HydrophobicContact CD1-CB 4.03Å; I328-L340 VanDerWaalsContact CD1-O 3.32Å; I328-L340 WeakPolarHBondContact CD1-O 3.26Å; I328-V342 HydrophobicContact CG1-CG2 4.3Å
329	L	89.5	Confident	81.7	Confident	61 Å²	61	36.4 Å²	36.4	32%	0.319	23%	0.225	S	C	.	.			trans	-75	129	-179.8	-65.2	179.1	0	0	0	110.6	G291 A331 S332	G291-L329 WeakPolarHBondContact O-CB 3.39Å; G291-L329 WeakPolarHBondContact O-CG 3.49Å; G291-L329 PolarHBondContact O-N 2.91Å; L329-A331 PolarHBondContact O-N 3.3Å; L329-S332 WeakPolarHBondContact O-CB 3.45Å; L329-S332 PolarHBondContact O-N 3.03Å; L329-S332 VanDerWaalsContact O-N 3.11Å; L329-S332 PolarHBondContact O-OG 2.71Å
330	P	88.5	Confident	83.9	Confident	61 Å²	61	29.4 Å²	29.4	40%	0.396	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	138.9	178.8	-27.8	35.5	0	0	0	113.2	A181 S332 D335	A181-P330 HydrophobicContact CB-CB 4.08Å; P330-S332 PolarHBondContact O-N 3.14Å; P330-D335 WeakPolarHBondContact CA-OD2 3.46Å
331	A	87.6	Confident	85.7	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	13	-174.9	0	0	0	0	0	115.7	A181 I183 R220 I261 Y263 L329 D335 R336	A181-A331 HydrophobicContact CB-CB 3.9Å; I183-A331 HydrophobicContact CD1-CB 4.23Å; R220-A331 HydrophobicContact CB-CB 4.5Å; I261-A331 HydrophobicContact CD1-CB 4.04Å; Y263-A331 HydrophobicContact CD1-CB 3.76Å; Y263-A331 HydrophobicContact CD2-CB 4Å; Y263-A331 HydrophobicContact CE1-CB 3.81Å; Y263-A331 HydrophobicContact CE2-CB 4.01Å; Y263-A331 HydrophobicContact CG-CB 3.88Å; L329-A331 PolarHBondContact O-N 3.3Å; A331-D335 PolarHBondContact N-OD2 3.03Å; A331-R336 PolarHBondContact O-NE 2.75Å
332	S	89.8	Confident	87	Confident	6 Å²	6	28.3 Å²	28.3	4%	0.042	18%	0.178	C	C	.	.	S	Bend	trans	-74	170.7	170.2	68.5	0	0	0	0	112.6	L329 P330 A334 D335 R336	L329-S332 WeakPolarHBondContact O-CB 3.45Å; L329-S332 PolarHBondContact O-N 3.03Å; L329-S332 VanDerWaalsContact O-N 3.11Å; L329-S332 PolarHBondContact O-OG 2.71Å; P330-S332 PolarHBondContact O-N 3.14Å; S332-A334 VanDerWaalsContact C-N 3.31Å; S332-A334 PolarHBondContact O-N 3.34Å; S332-D335 PolarHBondContact O-N 2.87Å; S332-D335 PolarHBondContact OG-N 3.2Å; S332-R336 WeakPolarHBondContact O-CB 3.43Å; S332-R336 VanDerWaalsContact O-CG 3.25Å; S332-R336 WeakPolarHBondContact O-CG 3.3Å; S332-R336 PolarHBondContact O-N 2.96Å
333	I	87.6	Confident	87.5	Confident	18 Å²	18	29.5 Å²	29.5	9%	0.092	19%	0.19	C	C	.	.	H	α-helix	trans	-61.8	-40.8	176.7	-57.5	176.4	0	0	0	110.6	I282 R284 D288 L290 D335 R336 C337	I282-I333 HydrophobicContact CG2-CG2 3.55Å; R284-I333 HydrophobicContact CG-CD1 4.04Å; D288-I333 HydrophobicContact CB-CD1 3.73Å; L290-I333 HydrophobicContact CD1-CB 4.17Å; L290-I333 HydrophobicContact CD1-CG2 3.96Å; L290-I333 PolarHBondContact O-N 3.22Å; I333-D335 VanDerWaalsContact C-N 3.33Å; I333-D335 PolarHBondContact O-N 2.88Å; I333-R336 PolarHBondContact O-N 3.06Å; I333-C337 WeakPolarHBondContact O-CB 3.49Å; I333-C337 PolarHBondContact O-N 2.95Å
334	A	88.8	Confident	87.6	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-61	-37.6	174.3	0	0	0	0	0	113.4	L290 L292 I328 S332 C337 L340	L290-A334 HydrophobicContact CG-CB 4.26Å; L290-A334 VanDerWaalsContact O-CB 3.27Å; L290-A334 WeakPolarHBondContact O-CB 3.37Å; L290-A334 PolarHBondContact O-N 2.94Å; L292-A334 HydrophobicContact CD2-CB 3.48Å; L292-A334 VanDerWaalsContact CD2-CB 3.48Å; L292-A334 HydrophobicContact CG-CB 3.96Å; I328-A334 HydrophobicContact CG2-CB 3.7Å; S332-A334 VanDerWaalsContact C-N 3.31Å; S332-A334 PolarHBondContact O-N 3.34Å; A334-C337 PolarHBondContact O-SG 2.8Å; A334-L340 HydrophobicContact CB-CD1 3.98Å
335	D	88.9	Confident	87.6	Confident	20 Å²	20	28.5 Å²	28.5	11%	0.107	19%	0.185	C	C	.	.	H	α-helix	trans	-72.7	-41.7	176.9	-173.8	23.8	0	0	0	111.5	K179 Y263 V265 I328 P330 A331 S332 I333 G338	K179-D335 IonicContact NZ-OD1 3.36Å; K179-D335 PolarHBondContact NZ-OD1 3.1Å; Y263-D335 VanDerWaalsContact CE2-OD2 3.31Å; Y263-D335 WeakPolarHBondContact CE2-OD2 3.34Å; Y263-D335 PolarHBondContact OH-OD2 3.47Å; V265-D335 WeakPolarHBondContact CG1-O 3.34Å; I328-D335 HydrophobicContact CG2-CB 3.86Å; P330-D335 WeakPolarHBondContact CA-OD2 3.46Å; A331-D335 PolarHBondContact N-OD2 3.03Å; S332-D335 PolarHBondContact O-N 2.87Å; S332-D335 PolarHBondContact OG-N 3.2Å; I333-D335 VanDerWaalsContact C-N 3.33Å; I333-D335 PolarHBondContact O-N 2.88Å; D335-G338 PolarHBondContact O-N 2.83Å
336	R	87.2	Confident	87.5	Confident	38 Å²	38	28.4 Å²	28.4	14%	0.143	19%	0.185	C	C	.	.	H	α-helix	trans	-67.6	-33.4	179.2	-70.4	167.3	-174	-94.2	5.3	113.9	R220 D225 Y263 V265 S266 A331 S332 I333 G338	R220-R336 PolarHBondContact O-NH2 3.24Å; D225-R336 VanDerWaalsContact CG-NH2 3.27Å; D225-R336 IonicContact OD1-CZ 3.19Å; D225-R336 VanDerWaalsContact OD1-CZ 3.31Å; D225-R336 IonicContact OD1-NH1 3.4Å; D225-R336 PolarHBondContact OD1-NH1 3.06Å; D225-R336 IonicContact OD1-NH2 3Å; D225-R336 PolarHBondContact OD1-NH2 2.83Å; D225-R336 IonicContact OD2-CZ 2.66Å; D225-R336 IonicContact OD2-NH1 2.69Å; D225-R336 IonicContact OD2-NH2 3.93Å; D225-R336 PolarHBondContact OD2-NH2 2.94Å; Y263-R336 HydrophobicContact CD2-CG 4.1Å; V265-R336 WeakPolarHBondContact CA-O 3.1Å; S266-R336 PolarHBondContact N-O 2.81Å; A331-R336 PolarHBondContact O-NE 2.75Å; S332-R336 WeakPolarHBondContact O-CB 3.43Å; S332-R336 VanDerWaalsContact O-CG 3.25Å; S332-R336 WeakPolarHBondContact O-CG 3.3Å; S332-R336 PolarHBondContact O-N 2.96Å; I333-R336 PolarHBondContact O-N 3.06Å; R336-G338 PolarHBondContact O-N 2.89Å
337	C	83.5	Confident	87.5	Confident	24 Å²	24	26.5 Å²	26.5	16%	0.162	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-22.5	178.5	80.9	0	0	0	0	113	I282 I333 A334 A339	I282-C337 HydrophobicContact CG2-CB 4.27Å; I333-C337 WeakPolarHBondContact O-CB 3.49Å; I333-C337 PolarHBondContact O-N 2.95Å; A334-C337 PolarHBondContact O-SG 2.8Å; C337-A339 PolarHBondContact O-N 3.28Å
338	G	82.1	Confident	87.4	Confident	29 Å²	29	24.7 Å²	24.7	30%	0.299	16%	0.156	S	C	.	.			trans	61.8	-1.7	177.8	0	0	0	0	0	116.5	S266 D335 R336	S266-G338 WeakPolarHBondContact O-CA 3.45Å; D335-G338 PolarHBondContact O-N 2.83Å; R336-G338 PolarHBondContact O-N 2.89Å
339	A	84.9	Confident	87.2	Confident	6 Å²	6	23.1 Å²	23.1	5%	0.05	15%	0.148	C	C	.	.			trans	-92.3	-9.2	-177.7	0	0	0	0	0	113.8	V268 V271 I280 C337	V268-A339 HydrophobicContact CB-CB 4.35Å; V268-A339 HydrophobicContact CG2-CB 4.14Å; V271-A339 HydrophobicContact CG2-CB 4.03Å; I280-A339 HydrophobicContact CD1-CB 3.88Å; I280-A339 HydrophobicContact CG2-CB 4.21Å; C337-A339 PolarHBondContact O-N 3.28Å
340	L	88.6	Confident	87	Confident	10 Å²	10	21.1 Å²	21.1	5%	0.052	14%	0.138	C	C	.	.			trans	-108.5	136.7	-179.6	-58.5	-176.9	0	0	0	110.7	I280 I282 L292 I325 I328 A334 I381	I280-L340 HydrophobicContact CD1-CD2 3.73Å; I282-L340 HydrophobicContact CD1-CD1 3.78Å; I282-L340 HydrophobicContact CD1-CG 4.26Å; L292-L340 HydrophobicContact CD1-CD1 4.1Å; L292-L340 HydrophobicContact CD2-CD1 3.94Å; L292-L340 HydrophobicContact CG-CD1 4.44Å; I325-L340 HydrophobicContact CD1-CB 4.14Å; I325-L340 HydrophobicContact CD1-CD1 4.48Å; I325-L340 HydrophobicContact CD1-CD2 4.38Å; I328-L340 HydrophobicContact CD1-CB 4.03Å; I328-L340 VanDerWaalsContact CD1-O 3.32Å; I328-L340 WeakPolarHBondContact CD1-O 3.26Å; A334-L340 HydrophobicContact CB-CD1 3.98Å; L340-I381 HydrophobicContact CD2-CD1 3.98Å; L340-I381 HydrophobicContact CD2-CG2 4.07Å
341	S	87.1	Confident	86.5	Confident	57 Å²	57	24.2 Å²	24.2	40%	0.399	15%	0.151	S	C	.	.			trans	-127	155.9	178.3	-73.4	0	0	0	0	112.7	G343 D344	S341-G343 PolarHBondContact O-N 2.86Å; S341-D344 WeakPolarHBondContact CA-OD2 3.39Å; S341-D344 WeakPolarHBondContact CB-OD2 3.48Å; S341-D344 PolarHBondContact N-OD2 2.83Å; S341-D344 WeakPolarHBondContact O-CB 3.37Å; S341-D344 VanDerWaalsContact O-CG 3.26Å; S341-D344 PolarHBondContact O-N 3.43Å
342	V	88.3	Confident	86.2	Confident	90 Å²	90	26.7 Å²	26.7	55%	0.545	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	128.1	173.2	178.1	0	0	0	0	109.5	A326 I328	A326-V342 WeakPolarHBondContact O-CG1 3.4Å; I328-V342 HydrophobicContact CG1-CG2 4.3Å
343	G	83.1	Confident	85.7	Confident	30 Å²	30	31.1 Å²	31.1	31%	0.309	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	97	-5.1	-174	0	0	0	0	0	115.1	I325 S341	I325-G343 PolarHBondContact O-N 3.05Å; S341-G343 PolarHBondContact O-N 2.86Å
344	D	88.6	Confident	85.4	Confident	2 Å²	2	30.7 Å²	30.7	1%	0.011	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-68.7	140.2	172.8	-63.4	-15.3	0	0	0	110.4	F324 I325 S341 I381 M382 P383 A384	F324-D344 CarbonylContact C-O 3.55Å; F324-D344 VanDerWaalsContact CA-O 3.26Å; F324-D344 WeakPolarHBondContact CA-O 3.34Å; I325-D344 HydrophobicContact CD1-CB 4.2Å; I325-D344 PolarHBondContact N-O 3.36Å; S341-D344 WeakPolarHBondContact CA-OD2 3.39Å; S341-D344 WeakPolarHBondContact CB-OD2 3.48Å; S341-D344 PolarHBondContact N-OD2 2.83Å; S341-D344 WeakPolarHBondContact O-CB 3.37Å; S341-D344 VanDerWaalsContact O-CG 3.26Å; S341-D344 PolarHBondContact O-N 3.43Å; D344-I381 HydrophobicContact CB-CD1 4.29Å; D344-M382 WeakPolarHBondContact CA-O 3.43Å; D344-P383 VanDerWaalsContact OD1-CA 3.31Å; D344-P383 WeakPolarHBondContact OD1-CA 3.26Å; D344-A384 PolarHBondContact OD1-N 3.45Å
345	Q	87.9	Confident	84.2	Confident	20 Å²	20	34 Å²	34	9%	0.093	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	135.3	175.1	-169.9	-175	-16.5	0	0	110.1	V323 F324 L347 I381 M382 L387	V323-Q345 WeakPolarHBondContact O-CA 3.27Å; V323-Q345 WeakPolarHBondContact O-CG 3.34Å; F324-Q345 HydrophobicContact CD1-CB 3.65Å; F324-Q345 HydrophobicContact CD1-CG 4.04Å; F324-Q345 HydrophobicContact CE1-CB 3.6Å; F324-Q345 HydrophobicContact CE1-CG 3.79Å; F324-Q345 HydrophobicContact CZ-CB 4.41Å; F324-Q345 HydrophobicContact CZ-CG 4.11Å; Q345-L347 HydrophobicContact CB-CD2 4.46Å; Q345-L347 HydrophobicContact CG-CD2 4.01Å; Q345-I381 CarbonylContact O-C 3.57Å; Q345-I381 VanDerWaalsContact O-CA 3.24Å; Q345-I381 WeakPolarHBondContact O-CA 3.3Å; Q345-M382 HydrophobicContact CB-CB 4.26Å; Q345-M382 PolarHBondContact N-O 3.02Å; Q345-M382 PolarHBondContact O-N 3.16Å; Q345-L387 HydrophobicContact CB-CD1 3.7Å; Q345-L387 HydrophobicContact CB-CD2 4.42Å
346	V	89.6	Confident	82.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	125.2	171.9	-170	0	0	0	0	109	L294 V323 I325 I349 I354 M379	L294-V346 HydrophobicContact CD2-CG2 4.18Å; V323-V346 PolarHBondContact O-N 3.12Å; I325-V346 HydrophobicContact CG1-CG2 4.32Å; V346-I349 HydrophobicContact CG1-CD1 4Å; V346-I349 HydrophobicContact CG1-CG1 3.75Å; V346-I354 HydrophobicContact CG1-CD1 3.88Å; V346-M379 HydrophobicContact CG1-CE 3.9Å; V346-M379 HydrophobicContact CG2-CE 4.18Å
347	L	86.3	Confident	81	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.016	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	-37	-177.4	-53.3	-176.5	0	0	0	112.5	P277 Q345 I354 E355 Q380 M382	P277-L347 HydrophobicContact CB-CD1 3.71Å; Q345-L347 HydrophobicContact CB-CD2 4.46Å; Q345-L347 HydrophobicContact CG-CD2 4.01Å; L347-I354 WeakPolarHBondContact O-CA 3.42Å; L347-I354 PolarHBondContact O-N 3.3Å; L347-E355 HydrophobicContact CD2-CB 4.36Å; L347-E355 HydrophobicContact CD2-CG 4.25Å; L347-E355 PolarHBondContact O-N 2.9Å; L347-Q380 HydrophobicContact CB-CB 4.33Å; L347-Q380 HydrophobicContact CB-CG 4.41Å; L347-Q380 HydrophobicContact CD1-CG 4.35Å; L347-Q380 PolarHBondContact N-O 2.79Å; L347-M382 HydrophobicContact CD1-CB 4.18Å; L347-M382 HydrophobicContact CD1-CE 4.21Å; L347-M382 HydrophobicContact CD2-CB 4.33Å; L347-M382 HydrophobicContact CG-CB 4.37Å
348	S	87.4	Confident	80	Confident	9 Å²	9	46 Å²	46	6%	0.063	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	159	172.7	76	0	0	0	0	111.8	T352 M379 Q380	S348-T352 CarbonylContact C-O 3.59Å; S348-T352 WeakPolarHBondContact CA-O 3.43Å; S348-T352 WeakPolarHBondContact CB-O 3.44Å; S348-M379 WeakPolarHBondContact O-CA 3.4Å; S348-Q380 PolarHBondContact N-O 3.38Å; S348-Q380 PolarHBondContact O-N 2.94Å; S348-Q380 WeakPolarHBondContact OG-CB 3.38Å
349	I	86.9	Confident	79.5	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	122	173.3	-58.2	179	0	0	0	107.7	V346 D351 T352 I354 V364 I367 L368 T377 Q378 M379	V346-I349 HydrophobicContact CG1-CD1 4Å; V346-I349 HydrophobicContact CG1-CG1 3.75Å; I349-D351 PolarHBondContact O-N 2.73Å; I349-T352 PolarHBondContact N-O 3.48Å; I349-T352 WeakPolarHBondContact O-CA 3.44Å; I349-T352 WeakPolarHBondContact O-CB 3.29Å; I349-T352 PolarHBondContact O-N 2.84Å; I349-T352 PolarHBondContact O-OG1 3.42Å; I349-I354 HydrophobicContact CB-CD1 4.41Å; I349-I354 HydrophobicContact CD1-CD1 3.83Å; I349-I354 HydrophobicContact CG1-CD1 3.69Å; I349-V364 HydrophobicContact CD1-CG1 3.5Å; I349-V364 VanDerWaalsContact CD1-CG1 3.5Å; I349-I367 HydrophobicContact CB-CG2 4.31Å; I349-I367 HydrophobicContact CG2-CG2 4.16Å; I349-L368 HydrophobicContact CD1-CD1 4.25Å; I349-L368 HydrophobicContact CD1-CD2 3.75Å; I349-L368 HydrophobicContact CD1-CG 3.67Å; I349-L368 HydrophobicContact CG2-CD2 4.04Å; I349-T377 HydrophobicContact CG2-CG2 3.96Å; I349-Q378 CarbonylContact C-O 3.58Å; I349-Q378 WeakPolarHBondContact CA-O 3.41Å; I349-M379 HydrophobicContact CD1-CE 4.14Å; I349-M379 HydrophobicContact CG1-CE 4.13Å; I349-M379 HydrophobicContact CG1-CG 4.34Å; I349-M379 HydrophobicContact CG2-CG 4.46Å
350	D	84.3	Confident	79.2	Confident	20 Å²	20	49.1 Å²	49.1	11%	0.107	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	46.3	-124.7	-170.5	-54.9	-61.8	0	0	0	110.1	T352 S371 Q378	D350-T352 VanDerWaalsContact C-N 3.27Å; D350-T352 PolarHBondContact O-N 2.93Å; D350-S371 WeakPolarHBondContact OD2-CB 3.36Å; D350-S371 PolarHBondContact OD2-OG 2.85Å; D350-Q378 PolarHBondContact N-O 2.87Å; D350-Q378 PolarHBondContact OD1-N 2.79Å
351	D	78.3	Confident	78.8	Confident	126 Å²	126	49.8 Å²	49.8	67%	0.674	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	7.4	178.3	-56.3	-70.1	0	0	0	114	I349 R374	I349-D351 PolarHBondContact O-N 2.73Å; D351-R374 IonicContact OD2-CZ 3.72Å; D351-R374 VanDerWaalsContact OD2-CZ 3.29Å; D351-R374 IonicContact OD2-NH1 3.83Å; D351-R374 PolarHBondContact OD2-NH1 2.85Å; D351-R374 IonicContact OD2-NH2 2.74Å; D351-R374 PolarHBondContact OD2-NH2 3.05Å
352	T	81.7	Confident	78.5	Confident	52 Å²	52	53.1 Å²	53.1	32%	0.319	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	118.6	-172.5	69.8	0	0	0	0	113.3	S348 I349 D350	S348-T352 CarbonylContact C-O 3.59Å; S348-T352 WeakPolarHBondContact CA-O 3.43Å; S348-T352 WeakPolarHBondContact CB-O 3.44Å; I349-T352 PolarHBondContact N-O 3.48Å; I349-T352 WeakPolarHBondContact O-CA 3.44Å; I349-T352 WeakPolarHBondContact O-CB 3.29Å; I349-T352 PolarHBondContact O-N 2.84Å; I349-T352 PolarHBondContact O-OG1 3.42Å; D350-T352 VanDerWaalsContact C-N 3.27Å; D350-T352 PolarHBondContact O-N 2.93Å
353	M	79.6	Confident	78.2	Confident	99 Å²	99	53.1 Å²	53.1	49%	0.488	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	136.8	176.5	-64	-64.8	-66.7	0	0	111.7	T357	M353-T357 PolarHBondContact O-OG1 3.46Å
354	I	79.9	Confident	78.2	Confident	8 Å²	8	51.7 Å²	51.7	4%	0.041	29%	0.285	C	S	.	.			trans	-115.8	-28.3	-175.7	-63.1	160.1	0	0	0	112.3	V323 V346 L347 I349 H356 T357 F359 V364	V323-I354 HydrophobicContact CB-CG2 4.31Å; V323-I354 HydrophobicContact CG2-CG2 4.11Å; V346-I354 HydrophobicContact CG1-CD1 3.88Å; L347-I354 WeakPolarHBondContact O-CA 3.42Å; L347-I354 PolarHBondContact O-N 3.3Å; I349-I354 HydrophobicContact CB-CD1 4.41Å; I349-I354 HydrophobicContact CD1-CD1 3.83Å; I349-I354 HydrophobicContact CG1-CD1 3.69Å; I354-H356 PolarHBondContact O-N 3.07Å; I354-T357 VanDerWaalsContact CA-OG1 3.32Å; I354-T357 WeakPolarHBondContact CA-OG1 3.47Å; I354-T357 PolarHBondContact O-N 3.49Å; I354-T357 PolarHBondContact O-OG1 3.43Å; I354-F359 HydrophobicContact CG1-CD2 4.17Å; I354-V364 HydrophobicContact CD1-CG1 3.74Å; I354-V364 HydrophobicContact CD1-CG2 4.07Å; I354-V364 HydrophobicContact CG1-CG2 4.29Å; I354-V364 HydrophobicContact CG2-CG2 4.1Å
355	E	63	Low	78	Confident	70 Å²	70	53.7 Å²	53.7	33%	0.327	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-16.4	-175.7	-165.1	178.4	174.4	0	0	114.5	L347	L347-E355 HydrophobicContact CD2-CB 4.36Å; L347-E355 HydrophobicContact CD2-CG 4.25Å; L347-E355 PolarHBondContact O-N 2.9Å
356	H	54.3	Low	77.7	Confident	159 Å²	159	56.7 Å²	56.7	74%	0.736	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.2	16.8	-173.2	-59.3	-17.3	0	0	0	113.7	I354	I354-H356 PolarHBondContact O-N 3.07Å
357	T	55.6	Low	77.4	Confident	64 Å²	64	58.3 Å²	58.3	39%	0.393	32%	0.323	S	S	.	.	S	Bend	trans	-133.8	135.6	-172	30.3	0	0	0	0	108.6	M353 I354 F359	M353-T357 PolarHBondContact O-OG1 3.46Å; I354-T357 VanDerWaalsContact CA-OG1 3.32Å; I354-T357 WeakPolarHBondContact CA-OG1 3.47Å; I354-T357 PolarHBondContact O-N 3.49Å; I354-T357 PolarHBondContact O-OG1 3.43Å; T357-F359 HydrophobicContact CG2-CE2 4.1Å; T357-F359 PolarHBondContact O-N 3.48Å; T357-F359 VanDerWaalsContact OG1-CD2 3.27Å; T357-F359 WeakPolarHBondContact OG1-CD2 3.4Å; T357-F359 WeakPolarHBondContact OG1-CE2 3.47Å
358	A	62.2	Low	77.3	Confident	113 Å²	113	58.2 Å²	58.2	93%	0.934	32%	0.323	S	S	*	.			trans	-78.1	43.4	-173.9	0	0	0	0	0	113.2
359	F	71.1	Confident	76.8	Confident	61 Å²	61	60 Å²	60	27%	0.268	33%	0.332	S	S	.	.			trans	-67.9	131.6	177.7	-70.4	-60	0	0	0	111.1	I354 T357 E363 V364 I367	I354-F359 HydrophobicContact CG1-CD2 4.17Å; T357-F359 HydrophobicContact CG2-CE2 4.1Å; T357-F359 PolarHBondContact O-N 3.48Å; T357-F359 VanDerWaalsContact OG1-CD2 3.27Å; T357-F359 WeakPolarHBondContact OG1-CD2 3.4Å; T357-F359 WeakPolarHBondContact OG1-CE2 3.47Å; F359-E363 HydrophobicContact CB-CB 4.48Å; F359-E363 HydrophobicContact CD1-CB 4.04Å; F359-V364 HydrophobicContact CB-CG2 3.81Å; F359-I367 HydrophobicContact CE1-CD1 4.36Å; F359-I367 HydrophobicContact CZ-CD1 4.32Å
360	S	78.9	Confident	76.3	Confident	38 Å²	38	65.3 Å²	65.3	27%	0.266	36%	0.364	S	S	.	.			trans	-69	155.8	164.6	62.2	0	0	0	0	111.2	D362 E363 V364	S360-D362 PolarHBondContact O-N 2.99Å; S360-E363 WeakPolarHBondContact CB-OE2 3.41Å; S360-E363 PolarHBondContact N-OE2 2.91Å; S360-E363 PolarHBondContact O-N 2.68Å; S360-E363 VanDerWaalsContact O-N 3.11Å; S360-E363 VanDerWaalsContact OG-CD 3.3Å; S360-E363 VanDerWaalsContact OG-CG 3.27Å; S360-E363 WeakPolarHBondContact OG-CG 3.46Å; S360-E363 PolarHBondContact OG-N 2.79Å; S360-E363 PolarHBondContact OG-OE2 3Å; S360-V364 PolarHBondContact O-N 3.42Å
361	P	80.6	Confident	75.4	Confident	25 Å²	25	65.6 Å²	65.6	16%	0.162	37%	0.368	C	S	.	.	H	α-helix	trans	-57.1	-31.4	173.4	-25	35.8	0	0	0	113	L294 N296 V364 M365	L294-P361 HydrophobicContact CB-CB 4Å; N296-P361 HydrophobicContact CB-CG 3.76Å; N296-P361 VanDerWaalsContact N-CG 3.35Å; P361-V364 PolarHBondContact O-N 3.16Å; P361-M365 WeakPolarHBondContact O-CB 3.26Å; P361-M365 PolarHBondContact O-N 2.94Å
362	D	80.3	Confident	74.6	Confident	127 Å²	127	60.9 Å²	60.9	68%	0.679	34%	0.344	S	S	*	.	H	α-helix	trans	-68.3	-41.1	176.1	-58.8	-57.1	0	0	0	111.9	S360 M365 T366	S360-D362 PolarHBondContact O-N 2.99Å; D362-M365 PolarHBondContact O-N 3.05Å; D362-T366 WeakPolarHBondContact O-CG2 3.42Å; D362-T366 PolarHBondContact O-N 2.72Å; D362-T366 PolarHBondContact O-OG1 3.4Å
363	E	83.3	Confident	73.6	Confident	89 Å²	89	61.6 Å²	61.6	42%	0.416	36%	0.361	S	S	.	.	H	α-helix	trans	-64.3	-43.7	173.2	-74.2	161.5	128	0	0	111.3	F359 S360 M365 T366 I367	F359-E363 HydrophobicContact CB-CB 4.48Å; F359-E363 HydrophobicContact CD1-CB 4.04Å; S360-E363 WeakPolarHBondContact CB-OE2 3.41Å; S360-E363 PolarHBondContact N-OE2 2.91Å; S360-E363 PolarHBondContact O-N 2.68Å; S360-E363 VanDerWaalsContact O-N 3.11Å; S360-E363 VanDerWaalsContact OG-CD 3.3Å; S360-E363 VanDerWaalsContact OG-CG 3.27Å; S360-E363 WeakPolarHBondContact OG-CG 3.46Å; S360-E363 PolarHBondContact OG-N 2.79Å; S360-E363 PolarHBondContact OG-OE2 3Å; E363-M365 VanDerWaalsContact C-N 3.27Å; E363-M365 PolarHBondContact O-N 3.31Å; E363-T366 WeakPolarHBondContact CA-OG1 3.33Å; E363-T366 PolarHBondContact O-N 3.16Å; E363-T366 VanDerWaalsContact O-N 3.12Å; E363-T366 PolarHBondContact O-OG1 2.93Å; E363-I367 WeakPolarHBondContact O-CG1 3.27Å; E363-I367 PolarHBondContact O-N 2.73Å
364	V	83.5	Confident	72.9	Confident	0 Å²	0	63 Å²	63	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-62	-36.5	174.5	-177.9	0	0	0	0	111.4	L294 V323 I349 I354 F359 S360 P361 I367 L368	L294-V364 HydrophobicContact CD1-CB 3.89Å; L294-V364 HydrophobicContact CD1-CG1 3.46Å; L294-V364 VanDerWaalsContact CD1-CG1 3.46Å; V323-V364 HydrophobicContact CG1-CB 4.42Å; V323-V364 HydrophobicContact CG1-CG1 4.46Å; V323-V364 HydrophobicContact CG1-CG2 4.3Å; V323-V364 HydrophobicContact CG2-CG2 4.12Å; I349-V364 HydrophobicContact CD1-CG1 3.5Å; I349-V364 VanDerWaalsContact CD1-CG1 3.5Å; I354-V364 HydrophobicContact CD1-CG1 3.74Å; I354-V364 HydrophobicContact CD1-CG2 4.07Å; I354-V364 HydrophobicContact CG1-CG2 4.29Å; I354-V364 HydrophobicContact CG2-CG2 4.1Å; F359-V364 HydrophobicContact CB-CG2 3.81Å; S360-V364 PolarHBondContact O-N 3.42Å; P361-V364 PolarHBondContact O-N 3.16Å; V364-I367 PolarHBondContact O-N 3.14Å; V364-L368 PolarHBondContact O-N 3.05Å
365	M	83.5	Confident	72.6	Confident	45 Å²	45	63.7 Å²	63.7	22%	0.222	37%	0.37	C	S	.	.	H	α-helix	trans	-68.9	-34.9	174	-167.6	64.5	-164.4	0	0	112.7	P361 D362 E363 L368 D369	P361-M365 WeakPolarHBondContact O-CB 3.26Å; P361-M365 PolarHBondContact O-N 2.94Å; D362-M365 PolarHBondContact O-N 3.05Å; E363-M365 VanDerWaalsContact C-N 3.27Å; E363-M365 PolarHBondContact O-N 3.31Å; M365-L368 WeakPolarHBondContact O-CB 3.46Å; M365-L368 PolarHBondContact O-N 3.21Å; M365-L368 HydrophobicContact SD-CB 4.46Å; M365-L368 HydrophobicContact SD-CD1 4.05Å; M365-D369 PolarHBondContact O-N 2.97Å
366	T	82.1	Confident	73.5	Confident	83 Å²	83	63.6 Å²	63.6	51%	0.509	37%	0.368	S	S	.	.	H	α-helix	trans	-71	-32	173.2	58.1	0	0	0	0	112.3	D362 E363 D369 T370	D362-T366 WeakPolarHBondContact O-CG2 3.42Å; D362-T366 PolarHBondContact O-N 2.72Å; D362-T366 PolarHBondContact O-OG1 3.4Å; E363-T366 WeakPolarHBondContact CA-OG1 3.33Å; E363-T366 PolarHBondContact O-N 3.16Å; E363-T366 VanDerWaalsContact O-N 3.12Å; E363-T366 PolarHBondContact O-OG1 2.93Å; T366-D369 PolarHBondContact O-N 3.18Å; T366-T370 WeakPolarHBondContact O-CB 3.29Å; T366-T370 PolarHBondContact O-N 3.27Å; T366-T370 PolarHBondContact O-OG1 3.41Å
367	I	83.6	Confident	74.9	Confident	34 Å²	34	56 Å²	56	17%	0.174	33%	0.332	C	S	.	.	H	α-helix	trans	-60.6	-49.9	168.8	-67.1	166.9	0	0	0	109.9	I349 F359 E363 V364 D369 T370 S371	I349-I367 HydrophobicContact CB-CG2 4.31Å; I349-I367 HydrophobicContact CG2-CG2 4.16Å; F359-I367 HydrophobicContact CE1-CD1 4.36Å; F359-I367 HydrophobicContact CZ-CD1 4.32Å; E363-I367 WeakPolarHBondContact O-CG1 3.27Å; E363-I367 PolarHBondContact O-N 2.73Å; V364-I367 PolarHBondContact O-N 3.14Å; I367-D369 PolarHBondContact O-N 2.71Å; I367-T370 PolarHBondContact O-N 2.88Å; I367-T370 VanDerWaalsContact O-N 3.12Å; I367-S371 PolarHBondContact O-N 2.86Å
368	L	82.2	Confident	76.4	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-57	-42.9	175.7	-79.3	172.3	0	0	0	113.3	R284 L290 L292 L294 I349 V364 M365 T370 T377 M379	R284-L368 VanDerWaalsContact CZ-O 3.31Å; R284-L368 PolarHBondContact NH1-O 2.79Å; R284-L368 PolarHBondContact NH2-O 3.34Å; R284-L368 VanDerWaalsContact NH2-O 3.11Å; L290-L368 HydrophobicContact CD2-CD2 3.79Å; L292-L368 HydrophobicContact CD1-CD1 4.3Å; L294-L368 HydrophobicContact CD1-CD1 4.15Å; I349-L368 HydrophobicContact CD1-CD1 4.25Å; I349-L368 HydrophobicContact CD1-CD2 3.75Å; I349-L368 HydrophobicContact CD1-CG 3.67Å; I349-L368 HydrophobicContact CG2-CD2 4.04Å; V364-L368 PolarHBondContact O-N 3.05Å; M365-L368 WeakPolarHBondContact O-CB 3.46Å; M365-L368 PolarHBondContact O-N 3.21Å; M365-L368 HydrophobicContact SD-CB 4.46Å; M365-L368 HydrophobicContact SD-CD1 4.05Å; L368-T370 VanDerWaalsContact C-N 3.33Å; L368-T377 HydrophobicContact CD2-CG2 4.09Å; L368-M379 HydrophobicContact CD2-CE 4.27Å; L368-M379 HydrophobicContact CD2-SD 4.08Å
369	D	78.7	Confident	77.6	Confident	47 Å²	47	50.4 Å²	50.4	25%	0.251	28%	0.282	S	S	.	.	H	α-helix	trans	-76	-21.3	178.9	-80.7	-19.4	0	0	0	112.9	R284 K289 M365 T366 I367	R284-D369 IonicContact NH2-OD1 3.64Å; K289-D369 WeakPolarHBondContact CE-OD2 3.3Å; K289-D369 IonicContact NZ-OD1 2.72Å; K289-D369 IonicContact NZ-OD2 3.62Å; K289-D369 PolarHBondContact NZ-OD2 2.81Å; M365-D369 PolarHBondContact O-N 2.97Å; T366-D369 PolarHBondContact O-N 3.18Å; I367-D369 PolarHBondContact O-N 2.71Å
370	T	75.1	Confident	78.4	Confident	110 Å²	110	50 Å²	50	68%	0.675	28%	0.281	S	S	*	.	H	α-helix	trans	-88.9	-30.5	179.7	-54.5	0	0	0	0	113.4	T366 I367 L368 T372	T366-T370 WeakPolarHBondContact O-CB 3.29Å; T366-T370 PolarHBondContact O-N 3.27Å; T366-T370 PolarHBondContact O-OG1 3.41Å; I367-T370 PolarHBondContact O-N 2.88Å; I367-T370 VanDerWaalsContact O-N 3.12Å; L368-T370 VanDerWaalsContact C-N 3.33Å; T370-T372 PolarHBondContact O-N 2.72Å; T370-T372 VanDerWaalsContact O-N 3.08Å
371	S	65.1	Low	79	Confident	27 Å²	27	48.2 Å²	48.2	19%	0.189	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-77.4	9.8	-174.1	78	0	0	0	0	115.8	D350 I367 G373	D350-S371 WeakPolarHBondContact OD2-CB 3.36Å; D350-S371 PolarHBondContact OD2-OG 2.85Å; I367-S371 PolarHBondContact O-N 2.86Å; S371-G373 PolarHBondContact O-N 3.01Å
372	T	62.9	Low	79.2	Confident	27 Å²	27	48.2 Å²	48.2	17%	0.166	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-59.2	-9.4	-178.7	51.2	0	0	0	0	116	T370 R374	T370-T372 PolarHBondContact O-N 2.72Å; T370-T372 VanDerWaalsContact O-N 3.08Å; T372-R374 PolarHBondContact O-N 3.26Å
373	G	60.4	Low	79.5	Confident	67 Å²	67	42.2 Å²	42.2	69%	0.691	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-71.1	-14.9	-174.3	0	0	0	0	0	116.9	S371	S371-G373 PolarHBondContact O-N 3.01Å
374	R	65.7	Low	79.4	Confident	127 Å²	127	39.5 Å²	39.5	48%	0.479	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-91.8	-10	-178.9	-67.2	-171	-177.6	170.1	8.9	114.8	D351 T372 Y376	D351-R374 IonicContact OD2-CZ 3.72Å; D351-R374 VanDerWaalsContact OD2-CZ 3.29Å; D351-R374 IonicContact OD2-NH1 3.83Å; D351-R374 PolarHBondContact OD2-NH1 2.85Å; D351-R374 IonicContact OD2-NH2 2.74Å; D351-R374 PolarHBondContact OD2-NH2 3.05Å; T372-R374 PolarHBondContact O-N 3.26Å; R374-Y376 HydrophobicContact CB-CD1 4.24Å; R374-Y376 HydrophobicContact CB-CE1 4Å; R374-Y376 HydrophobicContact CB-CE2 4.41Å; R374-Y376 WeakPolarHBondContact O-CD1 3.31Å; R374-Y376 PolarHBondContact O-N 3.29Å
375	G	73.1	Confident	79	Confident	23 Å²	23	42.1 Å²	42.1	24%	0.237	24%	0.24	C	C	.	.	S	Bend	trans	76.3	-4.3	-172.9	0	0	0	0	0	114.7	R284	R284-G375 CarbonylContact C-O 3.48Å; R284-G375 PolarHBondContact N-O 3.08Å; R284-G375 CarbonylContact O-C 3.6Å; R284-G375 VanDerWaalsContact O-O 3.09Å
376	Y	80.9	Confident	78.7	Confident	68 Å²	68	40.5 Å²	40.5	27%	0.267	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	160.9	167.5	58.9	-90.3	0	0	0	108.5	E281 I282 R374	E281-Y376 HydrophobicContact CG-CD2 3.78Å; E281-Y376 HydrophobicContact CG-CG 4.06Å; I282-Y376 CarbonylContact O-C 3.57Å; I282-Y376 VanDerWaalsContact O-CA 3.29Å; I282-Y376 WeakPolarHBondContact O-CA 3.47Å; R374-Y376 HydrophobicContact CB-CD1 4.24Å; R374-Y376 HydrophobicContact CB-CE1 4Å; R374-Y376 HydrophobicContact CB-CE2 4.41Å; R374-Y376 WeakPolarHBondContact O-CD1 3.31Å; R374-Y376 PolarHBondContact O-N 3.29Å
377	T	84.3	Confident	78.2	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122	167.3	-59.2	0	0	0	0	107.4	I282 R284 I349 L368 M379	I282-T377 PolarHBondContact N-O 2.72Å; I282-T377 PolarHBondContact O-N 3.31Å; R284-T377 WeakPolarHBondContact CD-OG1 3.24Å; R284-T377 PolarHBondContact NH1-OG1 3.4Å; I349-T377 HydrophobicContact CG2-CG2 3.96Å; L368-T377 HydrophobicContact CD2-CG2 4.09Å; T377-M379 HydrophobicContact CG2-CG 4.04Å
378	Q	87.1	Confident	77.1	Confident	59 Å²	59	40 Å²	40	28%	0.276	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	137.4	173.5	-173.7	169.3	75	0	0	108.9	L279 I280 I349 D350	L279-Q378 HydrophobicContact CD1-CG 3.7Å; L279-Q378 HydrophobicContact CG-CG 4.19Å; I280-Q378 CarbonylContact O-C 3.58Å; I280-Q378 WeakPolarHBondContact O-CA 3.3Å; I349-Q378 CarbonylContact C-O 3.58Å; I349-Q378 WeakPolarHBondContact CA-O 3.41Å; D350-Q378 PolarHBondContact N-O 2.87Å; D350-Q378 PolarHBondContact OD1-N 2.79Å
379	M	88.1	Confident	75.8	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	133.9	-179.4	-63.4	-175.5	68.8	0	0	110.3	I280 I282 L290 L292 V346 S348 I349 L368 T377	I280-M379 PolarHBondContact N-O 3.07Å; I280-M379 PolarHBondContact O-N 2.97Å; I282-M379 HydrophobicContact CD1-SD 4.48Å; L290-M379 HydrophobicContact CD2-SD 3.64Å; L292-M379 HydrophobicContact CD1-CE 4Å; L292-M379 HydrophobicContact CD1-SD 4.46Å; V346-M379 HydrophobicContact CG1-CE 3.9Å; V346-M379 HydrophobicContact CG2-CE 4.18Å; S348-M379 WeakPolarHBondContact O-CA 3.4Å; I349-M379 HydrophobicContact CD1-CE 4.14Å; I349-M379 HydrophobicContact CG1-CE 4.13Å; I349-M379 HydrophobicContact CG1-CG 4.34Å; I349-M379 HydrophobicContact CG2-CG 4.46Å; L368-M379 HydrophobicContact CD2-CE 4.27Å; L368-M379 HydrophobicContact CD2-SD 4.08Å; T377-M379 HydrophobicContact CG2-CG 4.04Å
380	Q	87.9	Confident	74.5	Confident	53 Å²	53	53.6 Å²	53.6	25%	0.248	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	121.8	165.3	-162.6	179.2	30.6	0	0	109.3	P277 L278 L279 L347 S348	P277-Q380 HydrophobicContact CB-CG 4.17Å; L278-Q380 CarbonylContact O-C 3.49Å; L278-Q380 VanDerWaalsContact O-CA 3.27Å; L278-Q380 WeakPolarHBondContact O-CA 3.42Å; L279-Q380 HydrophobicContact CD1-CB 4.2Å; L347-Q380 HydrophobicContact CB-CB 4.33Å; L347-Q380 HydrophobicContact CB-CG 4.41Å; L347-Q380 HydrophobicContact CD1-CG 4.35Å; L347-Q380 PolarHBondContact N-O 2.79Å; S348-Q380 PolarHBondContact N-O 3.38Å; S348-Q380 PolarHBondContact O-N 2.94Å; S348-Q380 WeakPolarHBondContact OG-CB 3.38Å
381	I	90.2	Very high	72.9	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	154.7	177.6	67.7	158.9	0	0	0	111.6	P277 L278 I280 L340 D344 Q345 P383	P277-I381 CarbonylContact C-O 3.58Å; P277-I381 WeakPolarHBondContact CA-O 3.29Å; L278-I381 HydrophobicContact CB-CG1 4.14Å; L278-I381 PolarHBondContact N-O 2.87Å; L278-I381 PolarHBondContact O-N 3.1Å; I280-I381 HydrophobicContact CD1-CD1 3.61Å; I280-I381 HydrophobicContact CD1-CG1 3.75Å; L340-I381 HydrophobicContact CD2-CD1 3.98Å; L340-I381 HydrophobicContact CD2-CG2 4.07Å; D344-I381 HydrophobicContact CB-CD1 4.29Å; Q345-I381 CarbonylContact O-C 3.57Å; Q345-I381 VanDerWaalsContact O-CA 3.24Å; Q345-I381 WeakPolarHBondContact O-CA 3.3Å; I381-P383 HydrophobicContact CD1-CG 4.25Å
382	M	85.8	Confident	71.4	Confident	26 Å²	26	58.2 Å²	58.2	13%	0.128	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	115.4	160.4	-171.4	74.3	66.8	0	0	108.7	G276 P277 D344 Q345 L347 A386 L387	G276-M382 VanDerWaalsContact C-SD 3.52Å; P277-M382 HydrophobicContact CB-CE 4.03Å; P277-M382 HydrophobicContact CG-CE 4.29Å; D344-M382 WeakPolarHBondContact CA-O 3.43Å; Q345-M382 HydrophobicContact CB-CB 4.26Å; Q345-M382 PolarHBondContact N-O 3.02Å; Q345-M382 PolarHBondContact O-N 3.16Å; L347-M382 HydrophobicContact CD1-CB 4.18Å; L347-M382 HydrophobicContact CD1-CE 4.21Å; L347-M382 HydrophobicContact CD2-CB 4.33Å; L347-M382 HydrophobicContact CG-CB 4.37Å; M382-A386 HydrophobicContact CG-CB 4.42Å; M382-A386 HydrophobicContact SD-CB 4.12Å; M382-L387 HydrophobicContact CB-CD1 4.26Å; M382-L387 HydrophobicContact CB-CD2 4.18Å; M382-L387 HydrophobicContact CB-CG 4.16Å; M382-L387 HydrophobicContact CG-CD1 4.21Å; M382-L387 HydrophobicContact CG-CD2 3.68Å; M382-L387 HydrophobicContact CG-CG 3.59Å; M382-L387 VanDerWaalsContact O-CD1 3.27Å; M382-L387 WeakPolarHBondContact O-CD1 3.43Å
383	P	87.2	Confident	70	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	34%	0.338	C	S	.	.			trans	-63.7	145.4	-179.1	-28.9	39.1	0	0	0	114.3	V271 L278 D344 I381 H385 A386 L387	V271-P383 HydrophobicContact CG1-CG 4.49Å; L278-P383 HydrophobicContact CD1-CG 3.8Å; L278-P383 HydrophobicContact CG-CG 4.13Å; D344-P383 VanDerWaalsContact OD1-CA 3.31Å; D344-P383 WeakPolarHBondContact OD1-CA 3.26Å; I381-P383 HydrophobicContact CD1-CG 4.25Å; P383-H385 VanDerWaalsContact C-N 3.26Å; P383-H385 WeakPolarHBondContact CB-CE1 2.99Å; P383-H385 PolarHBondContact O-N 2.93Å; P383-H385 VanDerWaalsContact O-N 3.17Å; P383-A386 WeakPolarHBondContact O-CB 3.42Å; P383-A386 PolarHBondContact O-N 3.14Å; P383-L387 PolarHBondContact O-N 2.89Å; P383-L387 VanDerWaalsContact O-N 3.08Å
384	A	80.9	Confident	68.5	Low	32 Å²	32	65.5 Å²	65.5	26%	0.264	34%	0.344	S	S	.	.	H	α-helix	trans	-53.7	-38.3	-176.1	0	0	0	0	0	113.4	D344 A386 L387 A388	D344-A384 PolarHBondContact OD1-N 3.45Å; A384-A386 VanDerWaalsContact C-N 3.34Å; A384-A386 PolarHBondContact O-N 3.46Å; A384-L387 PolarHBondContact O-N 2.89Å; A384-A388 WeakPolarHBondContact O-CB 3.34Å; A384-A388 PolarHBondContact O-N 3.17Å
385	H	75.1	Confident	66.8	Low	56 Å²	56	67.9 Å²	67.9	26%	0.259	37%	0.365	S	S	.	.	H	α-helix	trans	-75.6	-18.4	179.1	61.3	-82.7	0	0	0	114.1	V271 E272 S274 P383 R389	V271-H385 PolarHBondContact O-CE1 2.95Å; V271-H385 PolarHBondContact O-NE2 2.84Å; E272-H385 PolarHBondContact O-NE2 2.81Å; S274-H385 PolarHBondContact O-CD2 3.24Å; S274-H385 PolarHBondContact O-NE2 3.09Å; P383-H385 VanDerWaalsContact C-N 3.26Å; P383-H385 WeakPolarHBondContact CB-CE1 2.99Å; P383-H385 PolarHBondContact O-N 2.93Å; P383-H385 VanDerWaalsContact O-N 3.17Å; H385-R389 WeakPolarHBondContact O-CG 3.47Å; H385-R389 PolarHBondContact O-NE 2.76Å
386	A	75.9	Confident	64.5	Low	10 Å²	10	70.4 Å²	70.4	8%	0.083	39%	0.391	C	S	.	.	H	α-helix	trans	-80.2	-44.5	168.3	0	0	0	0	0	110.5	M382 P383 A384 A388 R389 R390	M382-A386 HydrophobicContact CG-CB 4.42Å; M382-A386 HydrophobicContact SD-CB 4.12Å; P383-A386 WeakPolarHBondContact O-CB 3.42Å; P383-A386 PolarHBondContact O-N 3.14Å; A384-A386 VanDerWaalsContact C-N 3.34Å; A384-A386 PolarHBondContact O-N 3.46Å; A386-A388 PolarHBondContact O-N 2.83Å; A386-R389 PolarHBondContact O-N 2.89Å; A386-R390 PolarHBondContact O-N 3Å
387	L	71.5	Confident	62.1	Low	32 Å²	32	72.6 Å²	72.6	17%	0.168	42%	0.416	C	S	.	.	H	α-helix	trans	-57.9	-47.6	175.7	-70.4	160.5	0	0	0	112.4	F324 Q345 M382 P383 A384 R389 R390 G391	F324-L387 HydrophobicContact CD1-CD1 4.41Å; F324-L387 HydrophobicContact CE1-CD1 4.07Å; Q345-L387 HydrophobicContact CB-CD1 3.7Å; Q345-L387 HydrophobicContact CB-CD2 4.42Å; M382-L387 HydrophobicContact CB-CD1 4.26Å; M382-L387 HydrophobicContact CB-CD2 4.18Å; M382-L387 HydrophobicContact CB-CG 4.16Å; M382-L387 HydrophobicContact CG-CD1 4.21Å; M382-L387 HydrophobicContact CG-CD2 3.68Å; M382-L387 HydrophobicContact CG-CG 3.59Å; M382-L387 VanDerWaalsContact O-CD1 3.27Å; M382-L387 WeakPolarHBondContact O-CD1 3.43Å; P383-L387 PolarHBondContact O-N 2.89Å; P383-L387 VanDerWaalsContact O-N 3.08Å; A384-L387 PolarHBondContact O-N 2.89Å; L387-R389 PolarHBondContact O-N 2.93Å; L387-R389 VanDerWaalsContact O-N 3.14Å; L387-R390 WeakPolarHBondContact O-CB 3.4Å; L387-R390 PolarHBondContact O-N 3.19Å; L387-G391 PolarHBondContact O-N 2.83Å; L387-G391 VanDerWaalsContact O-N 3.16Å
388	A	61.7	Low	59.5	Low	74 Å²	74	78.4 Å²	78.4	61%	0.612	45%	0.454	S	S	*	.	H	α-helix	trans	-58.2	-28.6	179.3	0	0	0	0	0	113.3	A384 A386	A384-A388 WeakPolarHBondContact O-CB 3.34Å; A384-A388 PolarHBondContact O-N 3.17Å; A386-A388 PolarHBondContact O-N 2.83Å
389	R	54.8	Low	56.6	Low	169 Å²	169	84.8 Å²	84.8	64%	0.638	48%	0.481	S	S	*	.	H	α-helix	trans	-81.8	-29.4	175.7	-64	178.3	-166.7	-155.6	5	112.6	M275 H385 A386 L387 G391	M275-R389 PolarHBondContact SD-NH1 3.36Å; M275-R389 VanDerWaalsContact SD-NH1 3.41Å; H385-R389 WeakPolarHBondContact O-CG 3.47Å; H385-R389 PolarHBondContact O-NE 2.76Å; A386-R389 PolarHBondContact O-N 2.89Å; L387-R389 PolarHBondContact O-N 2.93Å; L387-R389 VanDerWaalsContact O-N 3.14Å; R389-G391 VanDerWaalsContact C-N 3.33Å
390	R	50.6	Low	53.7	Low	166 Å²	166	96 Å²	96	63%	0.626	53%	0.525	S	S	*	.	H	α-helix	trans	-68.9	-30.2	174.7	-159.5	-177.2	-170.6	-164.8	6.3	112.2	A386 L387 H392	A386-R390 PolarHBondContact O-N 3Å; L387-R390 WeakPolarHBondContact O-CB 3.4Å; L387-R390 PolarHBondContact O-N 3.19Å; R390-H392 VanDerWaalsContact C-N 3.33Å; R390-H392 PolarHBondContact O-N 2.9Å
391	G	41.7	Very low	50.8	Low	60 Å²	60	97.7 Å²	97.7	62%	0.619	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-13.9	-176.4	0	0	0	0	0	116.6	L387 R389	L387-G391 PolarHBondContact O-N 2.83Å; L387-G391 VanDerWaalsContact O-N 3.16Å; R389-G391 VanDerWaalsContact C-N 3.33Å
392	H	34.6	Very low	47.8	Very low	173 Å²	173	108.1 Å²	108.1	80%	0.801	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	13.6	-169	-143.7	-55	0	0	0	115.3	R390	R390-H392 VanDerWaalsContact C-N 3.33Å; R390-H392 PolarHBondContact O-N 2.9Å
393	T	31.8	Very low	45	Very low	114 Å²	114	111.5 Å²	111.5	70%	0.699	62%	0.615	S	S	*	*			trans	-134.1	78.1	-178.5	57.1	0	0	0	0	113.4
394	T	30.4	Very low	42.4	Very low	133 Å²	133	117.3 Å²	117.3	82%	0.816	65%	0.651	S	S	*	*			trans	-116.2	56.3	178.1	44.6	0	0	0	0	113.4
395	L	29.1	Very low	40.1	Very low	178 Å²	178	123.4 Å²	123.4	93%	0.932	68%	0.678	S	S	*	*	S	Bend	trans	-137.2	103.6	162.3	-97.1	174.6	0	0	0	110.9
396	G	25.4	Very low	37.8	Very low	75 Å²	75	128.8 Å²	128.8	77%	0.773	70%	0.703	S	S	*	*			trans	88.6	67.7	163.3	0	0	0	0	0	117	P398	G396-P398 WeakPolarHBondContact O-CD 3.31Å
397	S	30.1	Very low	35.5	Very low	114 Å²	114	131.4 Å²	131.4	80%	0.797	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-81.6	128.5	163.1	-53.8	0	0	0	0	111.6
398	P	28.8	Very low	33.4	Very low	123 Å²	123	140.5 Å²	140.5	80%	0.799	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-90.9	121.7	151.6	-2.6	22.7	0	0	0	108.8	G396	G396-P398 WeakPolarHBondContact O-CD 3.31Å
399	K	26.5	Very low	31.8	Very low	192 Å²	192	146.8 Å²	146.8	84%	0.835	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-68.6	138.4	174	-59.4	175	-179	179.2	0	109.9
400	Y	28.4	Very low	30.4	Very low	235 Å²	235	143.6 Å²	143.6	92%	0.922	77%	0.77	S	S	*	*			trans	-146.7	109.5	137.5	-103.5	-68.4	0	0	0	110.6
401	S	26.8	Very low	29.2	Very low	90 Å²	90	140 Å²	140	63%	0.629	77%	0.771	S	S	*	*			trans	-75.1	144.3	166.7	45.6	0	0	0	0	110.3	S403	S401-S403 PolarHBondContact O-N 3.02Å
402	F	26	Very low	28.5	Very low	218 Å²	218	143.4 Å²	143.4	96%	0.956	78%	0.779	S	S	*	*			trans	-83.1	105.3	161.7	-106	-89.4	0	0	0	109.2
403	S	28.2	Very low	28.3	Very low	98 Å²	98	140.3 Å²	140.3	69%	0.685	78%	0.784	S	S	*	*			trans	-132.1	124.9	165.2	55.3	0	0	0	0	107.6	S401	S401-S403 PolarHBondContact O-N 3.02Å
404	T	32.4	Very low	28.2	Very low	122 Å²	122	138.4 Å²	138.4	75%	0.748	79%	0.787	S	S	*	*			trans	-74.3	148.8	-173.7	44.9	0	0	0	0	112.9
405	L	32.3	Very low	28.2	Very low	160 Å²	160	144.4 Å²	144.4	84%	0.838	79%	0.794	S	S	*	*			trans	69	112.2	170.7	-56.5	159.8	0	0	0	115.8
406	E	26.6	Very low	28.2	Very low	168 Å²	168	144 Å²	144	79%	0.785	79%	0.788	S	S	*	*				-171.9	171.4	97.8	-158.5	41.1	-102.5	0	0	112.3
407	S	27.1	Very low	28.3	Very low	65 Å²	65	152.6 Å²	152.6	46%	0.455	80%	0.797	S	S	.	*			trans	-67.7	136.9	-163.7	-74.1	0	0	0	0	120.4
408	R	29.1	Very low	28.3	Very low	223 Å²	223	154.3 Å²	154.3	84%	0.842	79%	0.792	S	S	*	*				52.9	114.2	129.9	-59.3	177.1	-103.4	-167.6	-6.4	121.4
409	K	27	Very low	28.2	Very low	206 Å²	206	159.9 Å²	159.9	90%	0.896	80%	0.797	S	S	*	*				-174.3	130.8	116.9	-111	177.6	179.1	177.2	0	117
410	S	26	Very low	28.1	Very low	102 Å²	102	160.7 Å²	160.7	71%	0.713	80%	0.801	S	S	*	*			trans	63.6	133.7	133	-155.3	0	0	0	0	124.6
411	S	25.9	Very low	28.1	Very low	92 Å²	92	153.1 Å²	153.1	64%	0.643	79%	0.787	S	S	*	*			trans	78.4	104.2	137.6	45.3	0	0	0	0	123.9
412	T	27.1	Very low	28.2	Very low	131 Å²	131	160.5 Å²	160.5	80%	0.804	80%	0.801	S	S	*	*				74.4	109.2	126	56.4	0	0	0	0	123.8
413	A	28.8	Very low	28.4	Very low	108 Å²	108	155.3 Å²	155.3	89%	0.893	78%	0.778	S	S	*	*				67.1	143.4	127.7	0	0	0	0	0	121.5
414	G	29.4	Very low	28.3	Very low	74 Å²	74	156.7 Å²	156.7	76%	0.763	79%	0.788	S	S	*	*			trans	-177.4	-16.4	175	0	0	0	0	0	122.5
415	R	30.9	Very low	28.1	Very low	259 Å²	259	155.5 Å²	155.5	98%	0.977	78%	0.784	S	S	*	*			trans	65.3	160.4	-175.5	-81.1	-178.4	165.9	179.2	-3.9	116.9
416	Q	29	Very low	28	Very low	170 Å²	170	155.8 Å²	155.8	79%	0.794	79%	0.786	S	S	*	*			trans	-106.2	157.4	-170.9	-56.1	158.4	-57.2	0	0	112.8
417	R	28.2	Very low	28.1	Very low	254 Å²	254	153.8 Å²	153.8	96%	0.958	79%	0.787	S	S	*	*			trans	-143.8	152.5	138.1	-115	178.6	179.9	-166.1	-2.1	110.8
418	Q	30.1	Very low	28.1	Very low	150 Å²	150	157.9 Å²	157.9	70%	0.701	80%	0.804	S	S	*	*			trans	-94.8	144.8	-157	-67.2	-98.8	-6.5	0	0	113.6
419	R	25.8	Very low	27.8	Very low	241 Å²	241	156.5 Å²	156.5	91%	0.909	81%	0.807	S	S	*	*			trans	-139	141.6	152.1	-97.1	-171.7	173	179.1	-1.6	109.4
420	F	25.9	Very low	27.9	Very low	208 Å²	208	153.3 Å²	153.3	91%	0.912	80%	0.799	S	S	*	*			trans	-77.2	134.8	-175.8	-67.5	-97.4	0	0	0	111.4
421	A	27.9	Very low	27.9	Very low	76 Å²	76	154.6 Å²	154.6	63%	0.628	81%	0.806	S	S	*	*			trans	-120.8	132.9	163.7	0	0	0	0	0	108.4
422	R	29.1	Very low	28	Very low	246 Å²	246	154.8 Å²	154.8	93%	0.928	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-72.1	129.6	166.8	-66.3	177.5	176.2	178.8	-3.6	107.1
423	K	29.2	Very low	28	Very low	109 Å²	109	154.9 Å²	154.9	47%	0.474	82%	0.817	S	S	.	*	P	Polyproline II helix	trans	-98.5	140.2	176.1	-70.7	100.5	158.8	-58.5	0	110.6	S487 G488	K423-S487 WeakPolarHBondContact CB-O 3.38Å; K423-S487 WeakPolarHBondContact CD-OG 3.37Å; K423-S487 WeakPolarHBondContact CG-OG 3.46Å; K423-S487 PolarHBondContact NZ-OG 3.01Å; K423-G488 PolarHBondContact N-O 3.09Å
424	S	26.9	Very low	27.9	Very low	126 Å²	126	153.1 Å²	153.1	88%	0.881	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-73.9	141.1	148.1	42.5	0	0	0	0	108.6
425	S	28.1	Very low	27.9	Very low	97 Å²	97	156.4 Å²	156.4	68%	0.678	82%	0.815	S	S	*	*			trans	-116.7	115.4	-175.8	51.8	0	0	0	0	111.2
426	L	29.8	Very low	28.1	Very low	166 Å²	166	150.3 Å²	150.3	87%	0.869	81%	0.809	S	S	*	*			trans	-114.7	139.9	153.3	-69.2	176.2	0	0	0	107.6
427	P	29.1	Very low	27.9	Very low	126 Å²	126	145.9 Å²	145.9	82%	0.818	81%	0.808	S	S	*	*			trans	-73.7	160.9	-178.5	31.2	-35.1	0	0	0	111.9
428	L	26.7	Very low	27.9	Very low	152 Å²	152	139 Å²	139	80%	0.796	80%	0.799	S	S	*	*			trans	-130.5	122.5	180	-157.7	98.9	0	0	0	108.9
429	E	24.2	Very low	27.7	Very low	194 Å²	194	138.5 Å²	138.5	91%	0.907	81%	0.807	S	S	*	*			trans	-125.8	139.9	164.3	-73	-154.2	118.5	0	0	110.4
430	N	27.2	Very low	27.7	Very low	138 Å²	138	131.2 Å²	131.2	74%	0.738	81%	0.806	S	S	*	*			trans	-93.2	157.6	175.4	-64.7	-47.6	0	0	0	109.4
431	P	27.3	Very low	27.7	Very low	130 Å²	130	125.2 Å²	125.2	84%	0.844	80%	0.804	S	S	*	*				-137.6	154.2	104.2	35.3	-23.9	0	0	0	115.6
432	A	27.8	Very low	27.7	Very low	96 Å²	96	126.7 Å²	126.7	79%	0.793	81%	0.809	S	S	*	*			trans	-77	167.2	163.1	0	0	0	0	0	110.3
433	C	27.5	Very low	27.5	Very low	132 Å²	132	123.8 Å²	123.8	89%	0.892	81%	0.809	S	S	*	*			cis	-178.5	156.7	-17	168.9	0	0	0	0	106.7
434	G	26.9	Very low	27.3	Very low	71 Å²	71	121.9 Å²	121.9	73%	0.732	82%	0.82	S	S	*	*			trans	130.9	117.6	151.9	0	0	0	0	0	117.7
435	T	28.6	Very low	27.3	Very low	144 Å²	144	123 Å²	123	88%	0.883	82%	0.821	S	S	*	*			trans	-92.2	165.9	160.8	19.2	0	0	0	0	110.9
436	P	34.7	Very low	27.3	Very low	131 Å²	131	122.1 Å²	122.1	85%	0.851	83%	0.828	S	S	*	*			trans	-92.1	159.3	-149.2	35.2	-38.7	0	0	0	116.7
437	G	25.8	Very low	27.1	Very low	76 Å²	76	118.1 Å²	118.1	78%	0.784	83%	0.826	S	S	*	*			trans	178.6	91.9	167.6	0	0	0	0	0	117
438	S	27.4	Very low	26.9	Very low	109 Å²	109	119.8 Å²	119.8	76%	0.762	83%	0.827	S	S	*	*			trans	40.3	105.1	147.6	177.7	0	0	0	0	120.7
439	T	26.7	Very low	26.8	Very low	141 Å²	141	122.1 Å²	122.1	87%	0.865	83%	0.833	S	S	*	*				-178.5	153.2	108.2	28.5	0	0	0	0	111.7
440	G	24.8	Very low	26.8	Very low	87 Å²	87	116.4 Å²	116.4	90%	0.897	83%	0.826	S	S	*	*			trans	-64.1	167.9	-163.2	0	0	0	0	0	119.8
441	G	27.1	Very low	26.8	Very low	83 Å²	83	115.7 Å²	115.7	86%	0.856	83%	0.832	S	S	*	*			trans	174.3	130.3	175.6	0	0	0	0	0	110.5
442	S	26.6	Very low	26.7	Very low	107 Å²	107	114.5 Å²	114.5	75%	0.748	83%	0.827	S	S	*	*			trans	-96.9	152.4	-170.9	-147.8	0	0	0	0	113
443	M	25.1	Very low	26.7	Very low	185 Å²	185	116 Å²	116	91%	0.911	83%	0.832	S	S	*	*			trans	67.6	147.2	155.1	-62.5	157.1	64.2	0	0	119.8
444	G	25.5	Very low	26.8	Very low	69 Å²	69	117.3 Å²	117.3	71%	0.711	83%	0.829	S	S	*	*			trans	137.8	49	147.9	0	0	0	0	0	121
445	T	27.7	Very low	26.9	Very low	149 Å²	149	117.3 Å²	117.3	91%	0.914	83%	0.829	S	S	*	*			trans	20.4	123.6	145.4	54	0	0	0	0	121
446	G	26.6	Very low	27	Very low	79 Å²	79	119.4 Å²	119.4	81%	0.814	83%	0.831	S	S	*	*			trans	161.3	101.7	150.9	0	0	0	0	0	119.1
447	G	25.7	Very low	26.8	Very low	81 Å²	81	116.6 Å²	116.6	84%	0.835	83%	0.826	S	S	*	*			trans	61.4	111.6	145	0	0	0	0	0	120.5
448	I	25.1	Very low	27.2	Very low	162 Å²	162	122.2 Å²	122.2	83%	0.831	84%	0.837	S	S	*	*			trans	-116.3	130.7	165.3	-54.5	172.1	0	0	0	108.8
449	H	25.7	Very low	27.7	Very low	200 Å²	200	120 Å²	120	93%	0.926	83%	0.831	S	S	*	*			trans	-135.5	114	158.8	-88.5	-82.7	0	0	0	108.9
450	G	23.5	Very low	28.5	Very low	74 Å²	74	119.9 Å²	119.9	76%	0.763	82%	0.824	S	S	*	*			trans	-137.7	144.3	169.7	0	0	0	0	0	109.4
451	S	26.4	Very low	29.8	Very low	124 Å²	124	119.8 Å²	119.8	87%	0.867	81%	0.809	S	S	*	*			trans	-120.7	111.1	174.2	54.5	0	0	0	0	108.6
452	S	25.3	Very low	31.6	Very low	104 Å²	104	123.3 Å²	123.3	73%	0.727	80%	0.797	S	S	*	*			trans	-98.8	119.2	-173.5	53.1	0	0	0	0	112.3
453	S	29	Very low	33.6	Very low	128 Å²	128	120.6 Å²	120.6	90%	0.895	78%	0.781	S	S	*	*			trans	-84.9	111.7	161.5	43.1	0	0	0	0	109.5
454	L	28.1	Very low	35.9	Very low	159 Å²	159	114.1 Å²	114.1	83%	0.832	75%	0.748	S	S	*	*			trans	-115.3	127.4	-178.4	-94.4	165.2	0	0	0	111.5
455	G	29.5	Very low	38.6	Very low	72 Å²	72	113.7 Å²	113.7	74%	0.742	73%	0.734	S	S	*	*			trans	76.4	88.7	148.9	0	0	0	0	0	118.4
456	M	31.1	Very low	41.1	Very low	188 Å²	188	106.7 Å²	106.7	93%	0.926	69%	0.691	S	S	*	*			trans	-125.7	154.6	137.8	-72.1	-148.1	74.8	0	0	109.4
457	G	29.8	Very low	43.7	Very low	71 Å²	71	107 Å²	107	73%	0.732	68%	0.679	S	S	*	*			trans	-73	164.7	-163.9	0	0	0	0	0	115.6	G459	G457-G459 PolarHBondContact O-N 2.78Å
458	L	35.5	Very low	46.4	Very low	194 Å²	194	103.8 Å²	103.8	100%	1.016	64%	0.643	S	S	*	*			trans	-72.8	69.9	174.1	-69.2	166.5	0	0	0	111.2
459	G	36.1	Very low	49	Very low	62 Å²	62	101 Å²	101	64%	0.639	63%	0.63	S	S	*	*			trans	-76.7	151.4	171.7	0	0	0	0	0	112.2	G457	G457-G459 PolarHBondContact O-N 2.78Å
460	L	45.2	Very low	51.5	Low	139 Å²	139	91.8 Å²	91.8	73%	0.728	59%	0.587	S	S	*	*			trans	-66.7	134.1	158.7	-67.5	169.2	0	0	0	107.9	D562	L460-D562 HydrophobicContact CB-CB 4.36Å; L460-D562 VanDerWaalsContact O-CB 3.3Å; L460-D562 WeakPolarHBondContact O-CB 3.41Å; L460-D562 PolarHBondContact O-N 3.02Å
461	C	52.1	Low	53.7	Low	86 Å²	86	91 Å²	91	58%	0.581	57%	0.565	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-113.8	143.6	174.4	55	0	0	0	0	110.4	D559 M560	C461-D559 HydrophobicContact CB-CB 4.22Å; C461-M560 CarbonylContact C-O 3.58Å; C461-M560 WeakPolarHBondContact CA-O 3.22Å
462	R	65.2	Low	55.5	Low	157 Å²	157	86 Å²	86	59%	0.592	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.6	128	175.4	170.2	174.8	158.4	160.5	-8	108.7	E464 M560	R462-E464 HydrophobicContact CG-CG 4.38Å; R462-E464 IonicContact CZ-OE1 3.34Å; R462-E464 IonicContact NE-OE1 3.17Å; R462-E464 PolarHBondContact NE-OE1 3.06Å; R462-E464 IonicContact NH2-OE1 2.73Å; R462-E464 PolarHBondContact NH2-OE1 2.79Å; R462-E464 PolarHBondContact O-N 2.83Å; R462-M560 PolarHBondContact N-O 2.88Å; R462-M560 PolarHBondContact O-N 2.81Å
463	A	67.2	Low	57.3	Low	50 Å²	50	84.1 Å²	84.1	41%	0.413	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	126.8	168.6	0	0	0	0	0	110	E557 F558	A463-E557 HydrophobicContact CB-CG 3.88Å; A463-F558 WeakPolarHBondContact CA-O 3.49Å
464	E	74.1	Confident	58.7	Low	48 Å²	48	86.6 Å²	86.6	22%	0.224	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	135.9	170.2	-66.1	-117.5	120.4	0	0	108.9	R462 E557 F558 M560 H607	R462-E464 HydrophobicContact CG-CG 4.38Å; R462-E464 IonicContact CZ-OE1 3.34Å; R462-E464 IonicContact NE-OE1 3.17Å; R462-E464 PolarHBondContact NE-OE1 3.06Å; R462-E464 IonicContact NH2-OE1 2.73Å; R462-E464 PolarHBondContact NH2-OE1 2.79Å; R462-E464 PolarHBondContact O-N 2.83Å; E464-E557 VanDerWaalsContact O-CA 3.31Å; E464-E557 WeakPolarHBondContact O-CA 3.24Å; E464-F558 HydrophobicContact CB-CD1 4.42Å; E464-F558 HydrophobicContact CB-CE1 3.81Å; E464-F558 HydrophobicContact CB-CZ 3.92Å; E464-F558 PolarHBondContact N-O 3.11Å; E464-F558 VanDerWaalsContact O-CD1 3.29Å; E464-F558 WeakPolarHBondContact O-CD1 3.42Å; E464-F558 PolarHBondContact O-N 2.8Å; E464-M560 HydrophobicContact CG-CB 4.34Å; E464-M560 HydrophobicContact CG-CE 3.99Å; E464-M560 WeakPolarHBondContact OE2-CE 3.34Å; E464-H607 IonicContact OE2-NE2 3.62Å
465	S	80.8	Confident	60.4	Low	60 Å²	60	79.7 Å²	79.7	42%	0.42	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	146.7	173.6	73.9	0	0	0	0	112.2	E555 I556	S465-E555 WeakPolarHBondContact CB-OE1 3.44Å; S465-E555 PolarHBondContact OG-OE1 2.69Å; S465-I556 CarbonylContact C-O 3.53Å; S465-I556 VanDerWaalsContact CA-O 3.26Å; S465-I556 WeakPolarHBondContact CA-O 3.49Å
466	F	81.2	Confident	62.2	Low	2 Å²	2	76.2 Å²	76.2	1%	0.009	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	144.2	176.2	68.4	-72.3	0	0	0	111	V468 C509 I556 F558 M602 G603	F466-V468 HydrophobicContact CD2-CG2 3.64Å; F466-V468 HydrophobicContact CE2-CG2 3.19Å; F466-V468 HydrophobicContact CZ-CG2 4.02Å; F466-C509 HydrophobicContact CE2-CB 4.09Å; F466-C509 WeakPolarHBondContact CZ-O 3.29Å; F466-I556 HydrophobicContact CD1-CB 4.44Å; F466-I556 WeakPolarHBondContact CD1-O 3.36Å; F466-I556 HydrophobicContact CE1-CB 3.92Å; F466-I556 HydrophobicContact CE1-CG2 3.92Å; F466-I556 HydrophobicContact CZ-CB 4.09Å; F466-I556 HydrophobicContact CZ-CG2 4.12Å; F466-I556 PolarHBondContact N-O 3.29Å; F466-I556 PolarHBondContact O-N 3.42Å; F466-F558 AromaticContact CD1-CD1 3.61Å; F466-F558 HydrophobicContact CD1-CD1 3.61Å; F466-F558 AromaticContact CD1-CE1 3.64Å; F466-F558 HydrophobicContact CD1-CE1 3.64Å; F466-F558 AromaticContact CE1-CD1 3.51Å; F466-F558 HydrophobicContact CE1-CD1 3.51Å; F466-F558 AromaticContact CE1-CE1 3.89Å; F466-F558 HydrophobicContact CE1-CE1 3.89Å; F466-M602 HydrophobicContact CB-CE 3.85Å; F466-M602 HydrophobicContact CD2-CB 4.35Å; F466-G603 VanDerWaalsContact CE2-CA 3.47Å
467	P	82.1	Confident	64.1	Low	85 Å²	85	68.2 Å²	68.2	55%	0.552	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	138.1	175.4	31.8	-33.4	0	0	0	111.2	L554	P467-L554 CarbonylContact C-O 3.56Å; P467-L554 WeakPolarHBondContact CA-O 3.28Å
468	V	80.9	Confident	66.4	Low	14 Å²	14	65.7 Å²	65.7	9%	0.085	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	127.2	169.8	-175.5	0	0	0	0	109.3	F466 L470 C509 I510 L554 I556	F466-V468 HydrophobicContact CD2-CG2 3.64Å; F466-V468 HydrophobicContact CE2-CG2 3.19Å; F466-V468 HydrophobicContact CZ-CG2 4.02Å; V468-L470 HydrophobicContact CG1-CD2 3.7Å; V468-L470 HydrophobicContact CG1-CG 4.14Å; V468-C509 HydrophobicContact CG2-CB 4.41Å; V468-I510 HydrophobicContact CG1-CD1 4.19Å; V468-I510 HydrophobicContact CG1-CG1 4.43Å; V468-I510 HydrophobicContact CG2-CG1 4.47Å; V468-L554 PolarHBondContact N-O 3.23Å; V468-L554 PolarHBondContact O-N 3.28Å; V468-I556 HydrophobicContact CB-CD1 4.08Å; V468-I556 HydrophobicContact CG2-CD1 3.79Å; V468-I556 HydrophobicContact CG2-CG1 4.44Å
469	L	80	Confident	68.4	Low	105 Å²	105	60 Å²	60	55%	0.55	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	114	176.7	-169.2	60.9	0	0	0	109	W551 E553	L469-W551 HydrophobicContact CD1-CB 4.19Å; L469-W551 HydrophobicContact CD1-CE3 4.3Å; L469-W551 HydrophobicContact CD2-CE3 3.69Å; L469-W551 HydrophobicContact CD2-CZ3 3.81Å; L469-W551 HydrophobicContact CG-CE3 4.05Å; L469-E553 HydrophobicContact CD1-CB 4.26Å
470	L	77.6	Confident	70.5	Confident	5 Å²	5	57.4 Å²	57.4	3%	0.026	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	137.1	177.1	-58.2	-177.4	0	0	0	110.2	V468 C472 A476 I478 V503 A504 I510 W551 L552 L554	V468-L470 HydrophobicContact CG1-CD2 3.7Å; V468-L470 HydrophobicContact CG1-CG 4.14Å; L470-C472 PolarHBondContact O-N 2.94Å; L470-A476 HydrophobicContact CD1-CB 4.4Å; L470-I478 HydrophobicContact CD1-CD1 4.1Å; L470-V503 HydrophobicContact CB-CG1 4.27Å; L470-V503 HydrophobicContact CD2-CG1 4.25Å; L470-A504 HydrophobicContact CD1-CB 4.34Å; L470-I510 HydrophobicContact CD1-CD1 3.97Å; L470-I510 HydrophobicContact CD2-CD1 4.32Å; L470-W551 CarbonylContact O-C 3.59Å; L470-W551 WeakPolarHBondContact O-CA 3.33Å; L470-L552 PolarHBondContact N-O 3.5Å; L470-L552 PolarHBondContact O-N 2.89Å; L470-L554 HydrophobicContact CD1-CD1 3.68Å; L470-L554 HydrophobicContact CG-CD1 4.38Å
471	D	71.2	Confident	71.8	Confident	59 Å²	59	52.6 Å²	52.6	32%	0.316	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	106.3	163.9	-169.1	-41.9	0	0	0	108.4	S473 W551	D471-S473 WeakPolarHBondContact OD1-CB 3.45Å; D471-S473 PolarHBondContact OD1-N 2.93Å; D471-S473 PolarHBondContact OD1-OG 2.84Å; D471-W551 VanDerWaalsContact CG-NE1 3.34Å; D471-W551 PolarHBondContact OD2-NE1 2.83Å
472	C	64.3	Low	72.1	Confident	19 Å²	19	56.7 Å²	56.7	13%	0.128	31%	0.311	C	S	.	.			trans	-96.5	21.7	-176.1	-66.6	0	0	0	0	113	L470 H474 G475 N550 L552	L470-C472 PolarHBondContact O-N 2.94Å; C472-H474 PolarHBondContact O-N 2.91Å; C472-G475 PolarHBondContact O-N 3.46Å; C472-N550 PolarHBondContact N-O 2.63Å; C472-L552 HydrophobicContact CB-CB 4.32Å; C472-L552 VanDerWaalsContact SG-CB 3.54Å
473	S	62.8	Low	71.2	Confident	64 Å²	64	55.2 Å²	55.2	45%	0.448	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-22.7	173.6	50.3	0	0	0	0	114.7	D471	D471-S473 WeakPolarHBondContact OD1-CB 3.45Å; D471-S473 PolarHBondContact OD1-N 2.93Å; D471-S473 PolarHBondContact OD1-OG 2.84Å
474	H	57.2	Low	70	Confident	179 Å²	179	59 Å²	59	83%	0.829	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121	22.8	172.7	-63.5	-55.8	0	0	0	113.5	C472	C472-H474 PolarHBondContact O-N 2.91Å
475	G	65.1	Low	68.3	Low	14 Å²	14	62.4 Å²	62.4	14%	0.144	37%	0.366	C	S	.	.			trans	82.3	155.7	-174.3	0	0	0	0	0	113.3	C472	C472-G475 PolarHBondContact O-N 3.46Å
476	A	67.3	Low	66.1	Low	0 Å²	0	63 Å²	63	0%	0	38%	0.382	C	S	.	.			trans	-72.3	-30.4	-175.4	0	0	0	0	0	114	L470 I478 A504 L534	L470-A476 HydrophobicContact CD1-CB 4.4Å; A476-I478 HydrophobicContact CB-CD1 4.3Å; A476-I478 HydrophobicContact CB-CG1 4.16Å; A476-A504 VanDerWaalsContact O-CB 3.26Å; A476-A504 WeakPolarHBondContact O-CB 3.34Å; A476-A504 PolarHBondContact O-N 2.64Å; A476-L534 HydrophobicContact CB-CB 4.29Å; A476-L534 HydrophobicContact CB-CD2 3.66Å; A476-L534 PolarHBondContact N-O 2.89Å
477	G	70.6	Confident	63.8	Low	20 Å²	20	66 Å²	66	21%	0.206	40%	0.403	C	S	.	.			trans	76.7	18.5	-173.6	0	0	0	0	0	114.9	V499	G477-V499 WeakPolarHBondContact O-CG2 3.13Å; G477-V499 PolarHBondContact O-N 3.12Å
478	I	78.9	Confident	61.8	Low	17 Å²	17	64.5 Å²	64.5	9%	0.087	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	122.6	-178.5	-59.7	179.2	0	0	0	109.5	L470 A476 L480 I495 A504 I510 I516 L534 L554	L470-I478 HydrophobicContact CD1-CD1 4.1Å; A476-I478 HydrophobicContact CB-CD1 4.3Å; A476-I478 HydrophobicContact CB-CG1 4.16Å; I478-L480 HydrophobicContact CG2-CD2 3.88Å; I478-I495 HydrophobicContact CD1-CD1 4.41Å; I478-I495 HydrophobicContact CG2-CB 4.31Å; I478-I495 HydrophobicContact CG2-CD1 3.73Å; I478-I495 HydrophobicContact CG2-CG1 3.66Å; I478-I495 HydrophobicContact CG2-CG2 3.85Å; I478-A504 HydrophobicContact CD1-CB 4.04Å; I478-A504 HydrophobicContact CG1-CB 3.53Å; I478-I510 HydrophobicContact CD1-CD1 3.98Å; I478-I516 HydrophobicContact CG2-CD1 4.38Å; I478-L534 HydrophobicContact CB-CD2 4.44Å; I478-L534 HydrophobicContact CD1-CD2 4.16Å; I478-L534 HydrophobicContact CG2-CD1 4.49Å; I478-L554 HydrophobicContact CD1-CD1 3.55Å
479	I	77.4	Confident	59.6	Low	76 Å²	76	66.4 Å²	66.4	39%	0.39	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	114.5	176	-55.4	177.6	0	0	0	108.7	A496 Q497 V499	I479-A496 PolarHBondContact O-N 3.3Å; I479-Q497 WeakPolarHBondContact CA-O 3.3Å; I479-Q497 HydrophobicContact CB-CB 4.24Å; I479-Q497 WeakPolarHBondContact CB-O 3.43Å; I479-Q497 HydrophobicContact CD1-CB 4.34Å; I479-Q497 PolarHBondContact N-O 2.74Å; I479-Q497 PolarHBondContact O-N 2.9Å; I479-V499 HydrophobicContact CD1-CG2 3.93Å; I479-V499 HydrophobicContact CG1-CG2 4.11Å
480	L	80.2	Confident	57.8	Low	7 Å²	7	67.5 Å²	67.5	4%	0.037	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	141.6	178.6	-58.5	-175.3	0	0	0	111.8	I478 V493 I495 I516 M530 R531 L534	I478-L480 HydrophobicContact CG2-CD2 3.88Å; L480-V493 HydrophobicContact CB-CG1 3.95Å; L480-V493 HydrophobicContact CD1-CB 4.5Å; L480-V493 HydrophobicContact CD1-CG1 3.94Å; L480-V493 HydrophobicContact CD2-CG1 4.36Å; L480-V493 HydrophobicContact CG-CG1 4.31Å; L480-I495 HydrophobicContact CD2-CG1 4.09Å; L480-I516 HydrophobicContact CD2-CD1 3.8Å; L480-I516 HydrophobicContact CD2-CG1 4.49Å; L480-M530 HydrophobicContact CD1-CB 3.64Å; L480-M530 HydrophobicContact CD1-SD 4.34Å; L480-R531 HydrophobicContact CD1-CG 4.31Å; L480-R531 PolarHBondContact O-NH1 3.31Å; L480-L534 HydrophobicContact CD1-CD1 3.68Å; L480-L534 HydrophobicContact CD2-CD1 4.08Å; L480-L534 HydrophobicContact CG-CD1 3.89Å
481	S	71.6	Confident	56.5	Low	38 Å²	38	69.5 Å²	69.5	27%	0.266	46%	0.464	S	S	.	.			trans	-59.4	151.3	-179.5	-165.1	0	0	0	0	113.3	T483 A494 R531	S481-T483 PolarHBondContact OG-OG1 2.8Å; S481-A494 PolarHBondContact N-O 3.15Å; S481-R531 PolarHBondContact O-NH2 3.02Å
482	E	58	Low	55.8	Low	172 Å²	172	68.3 Å²	68.3	80%	0.804	46%	0.462	S	S	*	.			trans	-112.8	52.3	-178.2	-162.2	169.5	-140.1	0	0	111.9
483	T	46	Very low	56.1	Low	126 Å²	126	68.5 Å²	68.5	77%	0.773	46%	0.463	S	S	*	.			trans	-116.3	78.9	179.8	45.5	0	0	0	0	112.5	S481	S481-T483 PolarHBondContact OG-OG1 2.8Å
484	V	43.7	Very low	56.9	Low	129 Å²	129	67.3 Å²	67.3	78%	0.782	46%	0.457	S	S	*	.			trans	-85	140.9	169.2	-174.4	0	0	0	0	110
485	S	38.2	Very low	58.1	Low	119 Å²	119	58.9 Å²	58.9	83%	0.832	42%	0.418	S	S	*	.			trans	91.6	70.5	172.3	-43.6	0	0	0	0	117.6
486	G	33.3	Very low	58.5	Low	73 Å²	73	60.9 Å²	60.9	75%	0.753	43%	0.433	S	S	*	.	S	Bend	trans	-162.5	103.8	167.9	0	0	0	0	0	115.7	G488	G486-G488 PolarHBondContact O-N 2.72Å
487	S	34.1	Very low	59	Low	64 Å²	64	66.3 Å²	66.3	45%	0.448	46%	0.458	S	S	.	.	S	Bend	trans	62.8	34.9	154.6	-162.5	0	0	0	0	119.9	K423	K423-S487 WeakPolarHBondContact CB-O 3.38Å; K423-S487 WeakPolarHBondContact CD-OG 3.37Å; K423-S487 WeakPolarHBondContact CG-OG 3.46Å; K423-S487 PolarHBondContact NZ-OG 3.01Å
488	G	38.8	Very low	59.4	Low	55 Å²	55	66.6 Å²	66.6	57%	0.567	46%	0.455	S	S	*	.			trans	45	81.3	144.7	0	0	0	0	0	120.3	K423 G486	K423-G488 PolarHBondContact N-O 3.09Å; G486-G488 PolarHBondContact O-N 2.72Å
489	G	36	Very low	59.4	Low	54 Å²	54	68.7 Å²	68.7	56%	0.557	47%	0.469	S	S	*	.			trans	-163.6	116.4	165.1	0	0	0	0	0	112.4
490	S	40.9	Very low	58.9	Low	127 Å²	127	69.5 Å²	69.5	89%	0.888	48%	0.479	S	S	*	.			trans	59.6	157.3	179.9	-141.6	0	0	0	0	117.7
491	G	50.3	Low	58.3	Low	47 Å²	47	73 Å²	73	49%	0.485	50%	0.497	S	S	.	.			trans	-109.7	40.3	-174.9	0	0	0	0	0	113.6
492	A	57.4	Low	58.3	Low	35 Å²	35	72 Å²	72	29%	0.289	49%	0.49	S	S	.	.			trans	-98.6	136.3	178.4	0	0	0	0	0	110.2	R515 I516	A492-R515 HydrophobicContact CB-CB 4.18Å; A492-I516 WeakPolarHBondContact CA-O 3.45Å
493	V	71.3	Confident	59.1	Low	22 Å²	22	66.1 Å²	66.1	13%	0.133	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	124.5	-175.5	-173.3	0	0	0	0	110.1	L480 I516 A527 M530	L480-V493 HydrophobicContact CB-CG1 3.95Å; L480-V493 HydrophobicContact CD1-CB 4.5Å; L480-V493 HydrophobicContact CD1-CG1 3.94Å; L480-V493 HydrophobicContact CD2-CG1 4.36Å; L480-V493 HydrophobicContact CG-CG1 4.31Å; V493-I516 PolarHBondContact N-O 2.8Å; V493-I516 PolarHBondContact O-N 3.07Å; V493-A527 HydrophobicContact CG1-CB 4.28Å; V493-A527 HydrophobicContact CG2-CB 3.98Å; V493-M530 HydrophobicContact CB-CE 4.41Å; V493-M530 HydrophobicContact CB-SD 3.71Å; V493-M530 HydrophobicContact CG2-CE 3.91Å; V493-M530 HydrophobicContact CG2-SD 3.55Å; V493-M530 VanDerWaalsContact CG2-SD 3.55Å
494	A	78.6	Confident	60.4	Low	40 Å²	40	60.1 Å²	60.1	33%	0.331	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	140	-178.3	0	0	0	0	0	112.9	S481 A496 D514	S481-A494 PolarHBondContact N-O 3.15Å; A494-A496 PolarHBondContact O-N 3.21Å; A494-D514 CarbonylContact C-O 3.51Å; A494-D514 WeakPolarHBondContact CA-O 3.33Å
495	I	81.5	Confident	61.9	Low	2 Å²	2	56.4 Å²	56.4	1%	0.01	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	114.4	172.3	-60.8	179.2	0	0	0	108.2	I478 L480 I498 I510 G513 D514 I516	I478-I495 HydrophobicContact CD1-CD1 4.41Å; I478-I495 HydrophobicContact CG2-CB 4.31Å; I478-I495 HydrophobicContact CG2-CD1 3.73Å; I478-I495 HydrophobicContact CG2-CG1 3.66Å; I478-I495 HydrophobicContact CG2-CG2 3.85Å; L480-I495 HydrophobicContact CD2-CG1 4.09Å; I495-I498 HydrophobicContact CG2-CG1 3.96Å; I495-I510 HydrophobicContact CD1-CG2 3.4Å; I495-I510 VanDerWaalsContact CD1-CG2 3.4Å; I495-G513 PolarHBondContact O-N 2.83Å; I495-D514 HydrophobicContact CD1-CB 4.24Å; I495-D514 PolarHBondContact N-O 3.01Å; I495-I516 HydrophobicContact CD1-CD1 4.21Å; I495-I516 HydrophobicContact CD1-CG1 4.07Å; I495-I516 HydrophobicContact CG1-CD1 4.22Å; I495-I516 HydrophobicContact CG1-CG1 4.07Å
496	A	75.4	Confident	63.4	Low	55 Å²	55	59.4 Å²	59.4	46%	0.455	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-38.6	178	0	0	0	0	0	112.1	I479 A494	I479-A496 PolarHBondContact O-N 3.3Å; A494-A496 PolarHBondContact O-N 3.21Å
497	Q	75.8	Confident	65.2	Low	115 Å²	115	56.8 Å²	56.8	54%	0.537	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	150.2	-179.2	-171.9	171.7	11.5	0	0	110.8	I479	I479-Q497 WeakPolarHBondContact CA-O 3.3Å; I479-Q497 HydrophobicContact CB-CB 4.24Å; I479-Q497 WeakPolarHBondContact CB-O 3.43Å; I479-Q497 HydrophobicContact CD1-CB 4.34Å; I479-Q497 PolarHBondContact N-O 2.74Å; I479-Q497 PolarHBondContact O-N 2.9Å
498	I	80.6	Confident	66.9	Low	25 Å²	25	54.2 Å²	54.2	13%	0.128	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	135.3	169.2	-58.4	175.2	0	0	0	107.5	I495 A504 D505 I510	I495-I498 HydrophobicContact CG2-CG1 3.96Å; I498-A504 HydrophobicContact CG2-CB 3.84Å; I498-D505 HydrophobicContact CG2-CB 3.9Å; I498-I510 VanDerWaalsContact CD1-C 3.47Å; I498-I510 HydrophobicContact CD1-CB 3.99Å; I498-I510 HydrophobicContact CD1-CG2 3.85Å; I498-I510 WeakPolarHBondContact CD1-O 3.38Å
499	V	77.7	Confident	68.5	Low	62 Å²	62	52 Å²	52	38%	0.376	33%	0.328	S	S	.	.			trans	-73.4	125.7	178.5	177.9	0	0	0	0	109.1	G477 I479 S502	G477-V499 WeakPolarHBondContact O-CG2 3.13Å; G477-V499 PolarHBondContact O-N 3.12Å; I479-V499 HydrophobicContact CD1-CG2 3.93Å; I479-V499 HydrophobicContact CG1-CG2 4.11Å; V499-S502 WeakPolarHBondContact O-CB 3.39Å; V499-S502 PolarHBondContact O-N 2.88Å; V499-S502 PolarHBondContact O-OG 3.2Å
500	P	67.3	Low	70.5	Confident	93 Å²	93	49.9 Å²	49.9	60%	0.604	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	143.9	177.9	-26.4	35.3	0	0	0	113	S502	P500-S502 PolarHBondContact O-N 2.87Å; P500-S502 VanDerWaalsContact O-N 3.1Å
501	D	66.9	Low	72.1	Confident	80 Å²	80	46.4 Å²	46.4	43%	0.428	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	13.5	-176.7	-70.9	-57.9	0	0	0	115.4	D505 R506 K580	D501-D505 PolarHBondContact N-OD2 3.22Å; D501-R506 VanDerWaalsContact O-CZ 3.23Å; D501-R506 PolarHBondContact O-NE 3.15Å; D501-R506 PolarHBondContact O-NH2 3.19Å; D501-K580 IonicContact OD1-NZ 2.72Å; D501-K580 PolarHBondContact OD1-NZ 3.49Å; D501-K580 IonicContact OD2-NZ 2.71Å; D501-K580 PolarHBondContact OD2-NZ 2.84Å
502	S	72.8	Confident	73.2	Confident	17 Å²	17	47.3 Å²	47.3	12%	0.119	28%	0.276	C	S	.	.	S	Bend	trans	-76.9	175.2	171.5	71.3	0	0	0	0	113.5	V499 P500 D505 R506	V499-S502 WeakPolarHBondContact O-CB 3.39Å; V499-S502 PolarHBondContact O-N 2.88Å; V499-S502 PolarHBondContact O-OG 3.2Å; P500-S502 PolarHBondContact O-N 2.87Å; P500-S502 VanDerWaalsContact O-N 3.1Å; S502-D505 PolarHBondContact O-N 3.17Å; S502-D505 PolarHBondContact OG-N 2.69Å; S502-R506 WeakPolarHBondContact O-CB 3.47Å; S502-R506 WeakPolarHBondContact O-CG 3.38Å; S502-R506 PolarHBondContact O-N 2.85Å
503	V	74.3	Confident	73.8	Confident	49 Å²	49	48.1 Å²	48.1	30%	0.297	29%	0.287	S	S	.	.	H	α-helix	trans	-66	-38.2	177.4	-169.6	0	0	0	0	111.4	L470 S507	L470-V503 HydrophobicContact CB-CG1 4.27Å; L470-V503 HydrophobicContact CD2-CG1 4.25Å; V503-S507 PolarHBondContact O-N 2.93Å
504	A	73.9	Confident	74.3	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-64.6	-43	173.1	0	0	0	0	0	112.8	L470 A476 I478 I498 S507 I510	L470-A504 HydrophobicContact CD1-CB 4.34Å; A476-A504 VanDerWaalsContact O-CB 3.26Å; A476-A504 WeakPolarHBondContact O-CB 3.34Å; A476-A504 PolarHBondContact O-N 2.64Å; I478-A504 HydrophobicContact CD1-CB 4.04Å; I478-A504 HydrophobicContact CG1-CB 3.53Å; I498-A504 HydrophobicContact CG2-CB 3.84Å; A504-S507 VanDerWaalsContact O-CB 3.32Å; A504-S507 WeakPolarHBondContact O-CB 3.39Å; A504-S507 PolarHBondContact O-N 3.17Å; A504-S507 PolarHBondContact O-OG 2.86Å; A504-I510 HydrophobicContact CB-CD1 4.13Å
505	D	74.4	Confident	74.5	Confident	50 Å²	50	48.1 Å²	48.1	27%	0.267	28%	0.277	S	S	.	.	H	α-helix	trans	-62.7	-49.3	176.6	-173.8	44.3	0	0	0	111.3	I498 D501 S502 S507 G508	I498-D505 HydrophobicContact CG2-CB 3.9Å; D501-D505 PolarHBondContact N-OD2 3.22Å; S502-D505 PolarHBondContact O-N 3.17Å; S502-D505 PolarHBondContact OG-N 2.69Å; D505-S507 PolarHBondContact O-N 3.25Å; D505-S507 VanDerWaalsContact O-N 3.15Å; D505-G508 PolarHBondContact O-N 2.86Å; D505-G508 VanDerWaalsContact O-N 3.14Å
506	R	69.2	Low	74.5	Confident	183 Å²	183	48 Å²	48	69%	0.691	28%	0.277	S	S	*	.	H	α-helix	trans	-62.9	-20.4	176.6	-67.3	174	-156.1	-150	4	113.8	D501 S502 G508	D501-R506 VanDerWaalsContact O-CZ 3.23Å; D501-R506 PolarHBondContact O-NE 3.15Å; D501-R506 PolarHBondContact O-NH2 3.19Å; S502-R506 WeakPolarHBondContact O-CB 3.47Å; S502-R506 WeakPolarHBondContact O-CG 3.38Å; S502-R506 PolarHBondContact O-N 2.85Å; R506-G508 VanDerWaalsContact C-N 3.25Å; R506-G508 PolarHBondContact O-N 3.23Å
507	S	71.5	Confident	74.8	Confident	18 Å²	18	46.9 Å²	46.9	13%	0.126	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-33	176	81.8	0	0	0	0	112	V503 A504 D505 C509 K601	V503-S507 PolarHBondContact O-N 2.93Å; A504-S507 VanDerWaalsContact O-CB 3.32Å; A504-S507 WeakPolarHBondContact O-CB 3.39Å; A504-S507 PolarHBondContact O-N 3.17Å; A504-S507 PolarHBondContact O-OG 2.86Å; D505-S507 PolarHBondContact O-N 3.25Å; D505-S507 VanDerWaalsContact O-N 3.15Å; S507-C509 PolarHBondContact O-N 3.09Å; S507-C509 VanDerWaalsContact O-N 3.13Å; S507-C509 PolarHBondContact O-SG 3.04Å; S507-C509 VanDerWaalsContact O-SG 3.39Å; S507-C509 PolarHBondContact OG-N 3.11Å; S507-K601 PolarHBondContact O-NZ 3.18Å
508	G	69.4	Low	74.8	Confident	9 Å²	9	41.4 Å²	41.4	9%	0.093	24%	0.238	C	C	.	.	S	Bend	trans	61.4	10.2	-173.2	0	0	0	0	0	115.2	D505 R506 C581	D505-G508 PolarHBondContact O-N 2.86Å; D505-G508 VanDerWaalsContact O-N 3.14Å; R506-G508 VanDerWaalsContact C-N 3.25Å; R506-G508 PolarHBondContact O-N 3.23Å; G508-C581 WeakPolarHBondContact CA-SG 3.39Å
509	C	72.9	Confident	74.8	Confident	10 Å²	10	40.2 Å²	40.2	7%	0.068	23%	0.232	C	C	.	.	S	Bend	trans	-110.1	-21.9	-175.4	-68.4	0	0	0	0	112.8	F466 V468 S507 K601 M602 G603 R608	F466-C509 HydrophobicContact CE2-CB 4.09Å; F466-C509 WeakPolarHBondContact CZ-O 3.29Å; V468-C509 HydrophobicContact CG2-CB 4.41Å; S507-C509 PolarHBondContact O-N 3.09Å; S507-C509 VanDerWaalsContact O-N 3.13Å; S507-C509 PolarHBondContact O-SG 3.04Å; S507-C509 VanDerWaalsContact O-SG 3.39Å; S507-C509 PolarHBondContact OG-N 3.11Å; C509-K601 WeakPolarHBondContact SG-CE 3.37Å; C509-K601 PolarHBondContact SG-NZ 3.3Å; C509-M602 PolarHBondContact SG-O 2.93Å; C509-G603 VanDerWaalsContact O-O 3.07Å; C509-R608 PolarHBondContact O-NH2 2.87Å
510	I	78.3	Confident	74.9	Confident	9 Å²	9	40.1 Å²	40.1	5%	0.046	23%	0.23	C	C	.	.			trans	-105.8	139.6	-176.2	-45.9	-179.1	0	0	0	108.7	V468 L470 I478 I495 I498 A504 L554 I556	V468-I510 HydrophobicContact CG1-CD1 4.19Å; V468-I510 HydrophobicContact CG1-CG1 4.43Å; V468-I510 HydrophobicContact CG2-CG1 4.47Å; L470-I510 HydrophobicContact CD1-CD1 3.97Å; L470-I510 HydrophobicContact CD2-CD1 4.32Å; I478-I510 HydrophobicContact CD1-CD1 3.98Å; I495-I510 HydrophobicContact CD1-CG2 3.4Å; I495-I510 VanDerWaalsContact CD1-CG2 3.4Å; I498-I510 VanDerWaalsContact CD1-C 3.47Å; I498-I510 HydrophobicContact CD1-CB 3.99Å; I498-I510 HydrophobicContact CD1-CG2 3.85Å; I498-I510 WeakPolarHBondContact CD1-O 3.38Å; A504-I510 HydrophobicContact CB-CD1 4.13Å; I510-L554 HydrophobicContact CD1-CD1 4.44Å; I510-I556 HydrophobicContact CB-CD1 4.41Å; I510-I556 HydrophobicContact CD1-CD1 3.55Å; I510-I556 HydrophobicContact CG1-CD1 3.58Å; I510-I556 HydrophobicContact CG2-CD1 4.08Å
511	Q	74.6	Confident	75.3	Confident	53 Å²	53	42 Å²	42	25%	0.248	23%	0.228	C	C	.	.			trans	-133.4	158.2	179.5	-61.5	-174.6	-2	0	0	111.2	D514	Q511-D514 PolarHBondContact N-OD2 3.47Å; Q511-D514 WeakPolarHBondContact O-CB 3.44Å; Q511-D514 PolarHBondContact O-N 3.31Å
512	A	72.4	Confident	75.6	Confident	67 Å²	67	42.1 Å²	42.1	55%	0.554	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	133.1	172.1	0	0	0	0	0	109.8
513	G	71.9	Confident	75.6	Confident	51 Å²	51	47.8 Å²	47.8	53%	0.526	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.3	-20.4	-170.1	0	0	0	0	0	114.6	I495	I495-G513 PolarHBondContact O-N 2.83Å
514	D	80.1	Confident	75.3	Confident	7 Å²	7	50.5 Å²	50.5	4%	0.037	27%	0.268	C	S	.	.			trans	-61.4	150.9	174.3	-72.2	-15.5	0	0	0	111.8	A494 I495 Q511 I556 F558 R608	A494-D514 CarbonylContact C-O 3.51Å; A494-D514 WeakPolarHBondContact CA-O 3.33Å; I495-D514 HydrophobicContact CD1-CB 4.24Å; I495-D514 PolarHBondContact N-O 3.01Å; Q511-D514 PolarHBondContact N-OD2 3.47Å; Q511-D514 WeakPolarHBondContact O-CB 3.44Å; Q511-D514 PolarHBondContact O-N 3.31Å; D514-I556 HydrophobicContact CB-CG2 3.75Å; D514-F558 WeakPolarHBondContact OD1-CB 3.46Å; D514-R608 IonicContact OD1-CZ 2.73Å; D514-R608 IonicContact OD1-NH1 3.6Å; D514-R608 PolarHBondContact OD1-NH1 2.8Å; D514-R608 IonicContact OD1-NH2 3.4Å; D514-R608 PolarHBondContact OD1-NH2 2.96Å; D514-R608 IonicContact OD2-CZ 2.78Å; D514-R608 IonicContact OD2-NH1 3.51Å; D514-R608 IonicContact OD2-NH2 3.59Å; D514-R608 PolarHBondContact OD2-NH2 3.44Å
515	R	83.8	Confident	74.9	Confident	56 Å²	56	52.1 Å²	52.1	21%	0.211	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.1	-179.5	-62.3	-173	-72.7	-88.3	7.6	110.9	A492 I556 E557 D559	A492-R515 HydrophobicContact CB-CB 4.18Å; R515-I556 WeakPolarHBondContact O-CA 3.5Å; R515-E557 HydrophobicContact CB-CB 4.31Å; R515-E557 IonicContact CZ-OE1 3.46Å; R515-E557 PolarHBondContact N-O 3.48Å; R515-E557 IonicContact NE-OE1 3.27Å; R515-E557 PolarHBondContact NE-OE1 3.05Å; R515-E557 IonicContact NH2-OE1 2.72Å; R515-E557 PolarHBondContact NH2-OE1 2.64Å; R515-E557 PolarHBondContact O-N 2.78Å; R515-D559 IonicContact CZ-OD1 3.43Å; R515-D559 IonicContact CZ-OD2 2.71Å; R515-D559 IonicContact NH1-OD1 2.68Å; R515-D559 PolarHBondContact NH1-OD1 2.85Å; R515-D559 IonicContact NH1-OD2 3.04Å; R515-D559 PolarHBondContact NH1-OD2 2.86Å; R515-D559 IonicContact NH2-OD1 3.29Å; R515-D559 PolarHBondContact NH2-OD1 2.8Å; R515-D559 IonicContact NH2-OD2 2.76Å
516	I	81.8	Confident	74.8	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	123.9	170.5	-55.7	-174.3	0	0	0	109.1	I478 L480 A492 V493 I495 I519 M530 L534	I478-I516 HydrophobicContact CG2-CD1 4.38Å; L480-I516 HydrophobicContact CD2-CD1 3.8Å; L480-I516 HydrophobicContact CD2-CG1 4.49Å; A492-I516 WeakPolarHBondContact CA-O 3.45Å; V493-I516 PolarHBondContact N-O 2.8Å; V493-I516 PolarHBondContact O-N 3.07Å; I495-I516 HydrophobicContact CD1-CD1 4.21Å; I495-I516 HydrophobicContact CD1-CG1 4.07Å; I495-I516 HydrophobicContact CG1-CD1 4.22Å; I495-I516 HydrophobicContact CG1-CG1 4.07Å; I516-I519 HydrophobicContact CG2-CD1 4.42Å; I516-I519 HydrophobicContact CG2-CG1 3.9Å; I516-M530 HydrophobicContact CB-SD 4.31Å; I516-M530 HydrophobicContact CG2-CE 4.48Å; I516-M530 HydrophobicContact CG2-SD 4.23Å; I516-L534 HydrophobicContact CD1-CD1 4.13Å
517	V	80.6	Confident	74.7	Confident	30 Å²	30	47.2 Å²	47.2	18%	0.182	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-39.4	-179.9	176.9	0	0	0	0	111.4	Y523 E555 E557	V517-Y523 HydrophobicContact CG1-CD1 4.08Å; V517-Y523 HydrophobicContact CG1-CE1 4.29Å; V517-E555 PolarHBondContact N-O 3.41Å; V517-E557 HydrophobicContact CG2-CB 3.49Å; V517-E557 VanDerWaalsContact CG2-CB 3.49Å; V517-E557 HydrophobicContact CG2-CG 4.38Å; V517-E557 WeakPolarHBondContact CG2-OE2 3.32Å
518	A	77.1	Confident	74.5	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.008	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	156.2	177.3	0	0	0	0	0	112.6	M522 Y523 E555	A518-M522 WeakPolarHBondContact CA-O 3.45Å; A518-Y523 HydrophobicContact CB-CD1 3.69Å; A518-Y523 HydrophobicContact CB-CE1 3.69Å; A518-Y523 HydrophobicContact CB-CG 4.11Å; A518-E555 HydrophobicContact CB-CB 4.04Å; A518-E555 PolarHBondContact N-O 2.92Å; A518-E555 PolarHBondContact O-N 2.87Å
519	I	80.8	Confident	74.6	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	123.5	170.6	-52.8	-173	0	0	0	107.5	I516 K521 M522 L525 M530 L533 L534 L552 E553 L554	I516-I519 HydrophobicContact CG2-CD1 4.42Å; I516-I519 HydrophobicContact CG2-CG1 3.9Å; I519-K521 PolarHBondContact O-N 3.38Å; I519-M522 PolarHBondContact N-O 2.99Å; I519-M522 VanDerWaalsContact O-CB 3.25Å; I519-M522 WeakPolarHBondContact O-CB 3.49Å; I519-M522 WeakPolarHBondContact O-CE 3.32Å; I519-M522 PolarHBondContact O-N 3.33Å; I519-L525 HydrophobicContact CB-CD1 3.76Å; I519-L525 HydrophobicContact CD1-CD1 4.19Å; I519-L525 HydrophobicContact CG1-CD1 3.9Å; I519-M530 HydrophobicContact CD1-CB 3.89Å; I519-M530 HydrophobicContact CD1-CG 3.89Å; I519-L533 HydrophobicContact CB-CD1 4.45Å; I519-L533 HydrophobicContact CD1-CB 4.33Å; I519-L533 HydrophobicContact CG2-CB 4.27Å; I519-L533 HydrophobicContact CG2-CD1 4.37Å; I519-L534 HydrophobicContact CD1-CD1 4.38Å; I519-L534 HydrophobicContact CD1-CD2 4.48Å; I519-L534 HydrophobicContact CD1-CG 4.11Å; I519-L552 HydrophobicContact CG2-CD1 3.6Å; I519-L552 HydrophobicContact CG2-CD2 3.95Å; I519-L552 HydrophobicContact CG2-CG 3.73Å; I519-E553 CarbonylContact C-O 3.49Å; I519-L554 HydrophobicContact CB-CD2 4.21Å; I519-L554 HydrophobicContact CD1-CD2 4.12Å; I519-L554 HydrophobicContact CG1-CD2 3.7Å; I519-L554 HydrophobicContact CG2-CD2 3.96Å
520	N	78.9	Confident	74.5	Confident	60 Å²	60	49.6 Å²	49.6	32%	0.321	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	44.4	-172.8	-64.7	-8.1	0	0	0	112.4	M522 L552 E553	N520-M522 PolarHBondContact O-N 3.46Å; N520-M522 VanDerWaalsContact O-N 3.11Å; N520-L552 WeakPolarHBondContact OD1-CA 3.49Å; N520-E553 PolarHBondContact N-O 2.82Å; N520-E553 PolarHBondContact OD1-N 2.63Å
521	K	75.1	Confident	74.2	Confident	132 Å²	132	52.2 Å²	52.2	57%	0.574	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	15.4	-176.2	-46.8	-176.4	-166.3	-169.7	0	114.7	I519 Y523 E553	I519-K521 PolarHBondContact O-N 3.38Å; K521-Y523 HydrophobicContact CB-CE2 4.38Å; K521-Y523 WeakPolarHBondContact O-CD2 3.37Å; K521-Y523 WeakPolarHBondContact O-CE2 3.39Å; K521-Y523 PolarHBondContact O-N 3.09Å; K521-E553 WeakPolarHBondContact CE-OE1 3.23Å; K521-E553 WeakPolarHBondContact CE-OE2 3.43Å; K521-E553 IonicContact NZ-OE1 3.57Å; K521-E553 PolarHBondContact NZ-OE1 3.14Å; K521-E553 IonicContact NZ-OE2 3.68Å
522	M	73.1	Confident	73.9	Confident	83 Å²	83	56.9 Å²	56.9	41%	0.409	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	102.4	168.9	-58.1	-175.2	-68.9	0	0	109.6	A518 I519 N520 L525 L533	A518-M522 WeakPolarHBondContact CA-O 3.45Å; I519-M522 PolarHBondContact N-O 2.99Å; I519-M522 VanDerWaalsContact O-CB 3.25Å; I519-M522 WeakPolarHBondContact O-CB 3.49Å; I519-M522 WeakPolarHBondContact O-CE 3.32Å; I519-M522 PolarHBondContact O-N 3.33Å; N520-M522 PolarHBondContact O-N 3.46Å; N520-M522 VanDerWaalsContact O-N 3.11Å; M522-L525 HydrophobicContact CB-CD1 4.08Å; M522-L525 HydrophobicContact CB-CD2 4.04Å; M522-L525 HydrophobicContact CB-CG 4.08Å; M522-L525 HydrophobicContact CE-CD1 4.41Å; M522-L525 HydrophobicContact CE-CD2 4.4Å; M522-L533 HydrophobicContact CE-CD1 3.56Å; M522-L533 HydrophobicContact CE-CD2 4.22Å
523	Y	73.4	Confident	73.9	Confident	135 Å²	135	56.5 Å²	56.5	53%	0.529	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	155.2	174.9	-57.5	-89.5	0	0	0	111.1	V517 A518 K521 L525 E555	V517-Y523 HydrophobicContact CG1-CD1 4.08Å; V517-Y523 HydrophobicContact CG1-CE1 4.29Å; A518-Y523 HydrophobicContact CB-CD1 3.69Å; A518-Y523 HydrophobicContact CB-CE1 3.69Å; A518-Y523 HydrophobicContact CB-CG 4.11Å; K521-Y523 HydrophobicContact CB-CE2 4.38Å; K521-Y523 WeakPolarHBondContact O-CD2 3.37Å; K521-Y523 WeakPolarHBondContact O-CE2 3.39Å; K521-Y523 PolarHBondContact O-N 3.09Å; Y523-L525 VanDerWaalsContact C-N 3.33Å; Y523-L525 PolarHBondContact O-N 2.91Å; Y523-E555 VanDerWaalsContact CE1-OE2 3.28Å; Y523-E555 WeakPolarHBondContact CE1-OE2 3.24Å; Y523-E555 PolarHBondContact OH-OE2 3.48Å; Y523-E555 VanDerWaalsContact OH-OE2 3.07Å
524	S	67.6	Low	73.9	Confident	106 Å²	106	54.4 Å²	54.4	74%	0.741	28%	0.284	S	S	*	.	S	Bend	trans	60.5	34.8	176.1	-171.1	0	0	0	0	114.8
525	L	66.6	Low	73.2	Confident	34 Å²	34	60.5 Å²	60.5	18%	0.178	31%	0.312	C	S	.	.			trans	-66.4	145.1	166.9	-66.2	167.9	0	0	0	110.7	I519 M522 Y523 A529 M530 L533	I519-L525 HydrophobicContact CB-CD1 3.76Å; I519-L525 HydrophobicContact CD1-CD1 4.19Å; I519-L525 HydrophobicContact CG1-CD1 3.9Å; M522-L525 HydrophobicContact CB-CD1 4.08Å; M522-L525 HydrophobicContact CB-CD2 4.04Å; M522-L525 HydrophobicContact CB-CG 4.08Å; M522-L525 HydrophobicContact CE-CD1 4.41Å; M522-L525 HydrophobicContact CE-CD2 4.4Å; Y523-L525 VanDerWaalsContact C-N 3.33Å; Y523-L525 PolarHBondContact O-N 2.91Å; L525-A529 HydrophobicContact CD2-CB 4.39Å; L525-M530 HydrophobicContact CB-CE 3.91Å; L525-M530 HydrophobicContact CB-CG 3.67Å; L525-M530 HydrophobicContact CD1-CG 4.11Å; L525-L533 HydrophobicContact CD1-CD1 3.75Å; L525-L533 HydrophobicContact CD2-CD1 4.25Å
526	D	71.8	Confident	71.7	Confident	112 Å²	112	59.2 Å²	59.2	60%	0.599	32%	0.316	S	S	*	.			trans	-74.6	154.4	167.9	177.5	46.6	0	0	0	111.2	A528 A529 M530	D526-A528 PolarHBondContact O-N 3.48Å; D526-A528 WeakPolarHBondContact OD2-CB 3.34Å; D526-A528 PolarHBondContact OD2-N 2.87Å; D526-A529 WeakPolarHBondContact O-CA 3.31Å; D526-A529 WeakPolarHBondContact O-CB 3.46Å; D526-A529 PolarHBondContact O-N 3.38Å; D526-M530 PolarHBondContact O-N 3.07Å
527	A	67.3	Low	70.3	Confident	19 Å²	19	63.5 Å²	63.5	16%	0.157	36%	0.36	C	S	.	.	H	α-helix	trans	-61.1	-27.1	-179.1	0	0	0	0	0	113.2	V493 R531	V493-A527 HydrophobicContact CG1-CB 4.28Å; V493-A527 HydrophobicContact CG2-CB 3.98Å; A527-R531 VanDerWaalsContact O-CG 3.29Å; A527-R531 WeakPolarHBondContact O-CG 3.41Å; A527-R531 PolarHBondContact O-N 3.49Å; A527-R531 PolarHBondContact O-NE 3.48Å
528	A	66.9	Low	68.5	Low	52 Å²	52	67.9 Å²	67.9	43%	0.43	39%	0.392	S	S	.	.	H	α-helix	trans	-73.1	-37.2	171.7	0	0	0	0	0	112.3	D526 Q532	D526-A528 PolarHBondContact O-N 3.48Å; D526-A528 WeakPolarHBondContact OD2-CB 3.34Å; D526-A528 PolarHBondContact OD2-N 2.87Å; A528-Q532 WeakPolarHBondContact O-CG 3.42Å; A528-Q532 PolarHBondContact O-N 2.89Å
529	A	70.7	Confident	67.1	Low	34 Å²	34	73.1 Å²	73.1	28%	0.281	43%	0.429	S	S	.	.	H	α-helix	trans	-70.4	-38.7	176.1	0	0	0	0	0	111.8	L525 D526 Q532 L533	L525-A529 HydrophobicContact CD2-CB 4.39Å; D526-A529 WeakPolarHBondContact O-CA 3.31Å; D526-A529 WeakPolarHBondContact O-CB 3.46Å; D526-A529 PolarHBondContact O-N 3.38Å; A529-Q532 PolarHBondContact O-N 3.46Å; A529-L533 WeakPolarHBondContact O-CG 3.48Å; A529-L533 PolarHBondContact O-N 2.83Å; A529-L533 VanDerWaalsContact O-N 3.16Å
530	M	71.3	Confident	65.2	Low	0 Å²	0	84.8 Å²	84.8	0%	0	47%	0.473	C	S	.	.	H	α-helix	trans	-61.2	-43.7	173.8	-67.8	-167.7	-176.7	0	0	112	L480 V493 I516 I519 L525 D526 L533 L534	L480-M530 HydrophobicContact CD1-CB 3.64Å; L480-M530 HydrophobicContact CD1-SD 4.34Å; V493-M530 HydrophobicContact CB-CE 4.41Å; V493-M530 HydrophobicContact CB-SD 3.71Å; V493-M530 HydrophobicContact CG2-CE 3.91Å; V493-M530 HydrophobicContact CG2-SD 3.55Å; V493-M530 VanDerWaalsContact CG2-SD 3.55Å; I516-M530 HydrophobicContact CB-SD 4.31Å; I516-M530 HydrophobicContact CG2-CE 4.48Å; I516-M530 HydrophobicContact CG2-SD 4.23Å; I519-M530 HydrophobicContact CD1-CB 3.89Å; I519-M530 HydrophobicContact CD1-CG 3.89Å; L525-M530 HydrophobicContact CB-CE 3.91Å; L525-M530 HydrophobicContact CB-CG 3.67Å; L525-M530 HydrophobicContact CD1-CG 4.11Å; D526-M530 PolarHBondContact O-N 3.07Å; M530-L533 PolarHBondContact O-N 3.26Å; M530-L534 WeakPolarHBondContact O-CB 3.25Å; M530-L534 WeakPolarHBondContact O-CG 3.31Å; M530-L534 PolarHBondContact O-N 2.99Å
531	R	72.9	Confident	63.3	Low	64 Å²	64	90 Å²	90	24%	0.242	50%	0.501	C	S	.	.	H	α-helix	trans	-57.8	-50.2	175	-72.4	169.6	-140.4	-90.3	-5	111.6	L480 S481 A527 L533 L534 E535	L480-R531 HydrophobicContact CD1-CG 4.31Å; L480-R531 PolarHBondContact O-NH1 3.31Å; S481-R531 PolarHBondContact O-NH2 3.02Å; A527-R531 VanDerWaalsContact O-CG 3.29Å; A527-R531 WeakPolarHBondContact O-CG 3.41Å; A527-R531 PolarHBondContact O-N 3.49Å; A527-R531 PolarHBondContact O-NE 3.48Å; R531-L533 PolarHBondContact O-N 2.58Å; R531-L533 VanDerWaalsContact O-N 3.13Å; R531-L534 PolarHBondContact O-N 2.94Å; R531-L534 VanDerWaalsContact O-N 3.08Å; R531-E535 WeakPolarHBondContact O-CB 3.45Å; R531-E535 VanDerWaalsContact O-CG 3.28Å; R531-E535 WeakPolarHBondContact O-CG 3.11Å; R531-E535 PolarHBondContact O-N 3.26Å
532	Q	68.7	Low	61.7	Low	151 Å²	151	87.3 Å²	87.3	71%	0.706	51%	0.51	S	S	*	.	H	α-helix	trans	-60.4	-24.3	178.1	-72	-177.3	1.4	0	0	114.3	A528 A529	A528-Q532 WeakPolarHBondContact O-CG 3.42Å; A528-Q532 PolarHBondContact O-N 2.89Å; A529-Q532 PolarHBondContact O-N 3.46Å
533	L	71.9	Confident	60.2	Low	60 Å²	60	88.4 Å²	88.4	31%	0.314	53%	0.532	S	S	.	.	H	α-helix	trans	-86.6	-31.3	175.3	-68.8	165.3	0	0	0	113	I519 M522 L525 A529 M530 R531	I519-L533 HydrophobicContact CB-CD1 4.45Å; I519-L533 HydrophobicContact CD1-CB 4.33Å; I519-L533 HydrophobicContact CG2-CB 4.27Å; I519-L533 HydrophobicContact CG2-CD1 4.37Å; M522-L533 HydrophobicContact CE-CD1 3.56Å; M522-L533 HydrophobicContact CE-CD2 4.22Å; L525-L533 HydrophobicContact CD1-CD1 3.75Å; L525-L533 HydrophobicContact CD2-CD1 4.25Å; A529-L533 WeakPolarHBondContact O-CG 3.48Å; A529-L533 PolarHBondContact O-N 2.83Å; A529-L533 VanDerWaalsContact O-N 3.16Å; M530-L533 PolarHBondContact O-N 3.26Å; R531-L533 PolarHBondContact O-N 2.58Å; R531-L533 VanDerWaalsContact O-N 3.13Å
534	L	72.5	Confident	58.4	Low	7 Å²	7	87.7 Å²	87.7	4%	0.037	55%	0.547	C	S	.	.	H	α-helix	trans	-82.6	-30.6	180	-72.4	165.1	0	0	0	113.7	A476 I478 L480 I516 I519 M530 R531 L552 L554	A476-L534 HydrophobicContact CB-CB 4.29Å; A476-L534 HydrophobicContact CB-CD2 3.66Å; A476-L534 PolarHBondContact N-O 2.89Å; I478-L534 HydrophobicContact CB-CD2 4.44Å; I478-L534 HydrophobicContact CD1-CD2 4.16Å; I478-L534 HydrophobicContact CG2-CD1 4.49Å; L480-L534 HydrophobicContact CD1-CD1 3.68Å; L480-L534 HydrophobicContact CD2-CD1 4.08Å; L480-L534 HydrophobicContact CG-CD1 3.89Å; I516-L534 HydrophobicContact CD1-CD1 4.13Å; I519-L534 HydrophobicContact CD1-CD1 4.38Å; I519-L534 HydrophobicContact CD1-CD2 4.48Å; I519-L534 HydrophobicContact CD1-CG 4.11Å; M530-L534 WeakPolarHBondContact O-CB 3.25Å; M530-L534 WeakPolarHBondContact O-CG 3.31Å; M530-L534 PolarHBondContact O-N 2.99Å; R531-L534 PolarHBondContact O-N 2.94Å; R531-L534 VanDerWaalsContact O-N 3.08Å; L534-L552 HydrophobicContact CD2-CD2 3.76Å; L534-L554 HydrophobicContact CD2-CD1 4.26Å; L534-L554 HydrophobicContact CD2-CD2 4.04Å
535	E	64.8	Low	57.2	Low	135 Å²	135	91.3 Å²	91.3	63%	0.631	56%	0.558	S	S	*	*	S	Bend	trans	-77.5	-18.2	-176.1	-73.4	168.3	-175.2	0	0	113.5	R531	R531-E535 WeakPolarHBondContact O-CB 3.45Å; R531-E535 VanDerWaalsContact O-CG 3.28Å; R531-E535 WeakPolarHBondContact O-CG 3.11Å; R531-E535 PolarHBondContact O-N 3.26Å
536	G	53.1	Low	55.6	Low	29 Å²	29	92.9 Å²	92.9	30%	0.299	58%	0.582	S	S	.	*			trans	81.4	146.7	-176.5	0	0	0	0	0	113.2	S538	G536-S538 PolarHBondContact O-N 2.87Å
537	G	51.8	Low	54.1	Low	89 Å²	89	94.1 Å²	94.1	92%	0.918	59%	0.594	S	S	*	*			trans	-69.5	81	-165.8	0	0	0	0	0	115.9
538	S	42.8	Very low	53	Low	123 Å²	123	98.1 Å²	98.1	86%	0.86	62%	0.619	S	S	*	*			trans	-98.1	14	175.8	-63	0	0	0	0	114.7	G536	G536-S538 PolarHBondContact O-N 2.87Å
539	S	47.5	Very low	52.1	Low	111 Å²	111	99.6 Å²	99.6	78%	0.776	63%	0.631	S	S	*	*			trans	-155.7	97.6	169.4	-171.3	0	0	0	0	113.4
540	R	41.5	Very low	51.7	Low	245 Å²	245	102.2 Å²	102.2	93%	0.925	64%	0.64	S	S	*	*			trans	-161	109.2	148.9	-119	171.6	-175.4	-176.2	1	112.9
541	N	39.1	Very low	51.4	Low	170 Å²	170	109.1 Å²	109.1	91%	0.909	67%	0.666	S	S	*	*			trans	-69.9	137.7	158.2	-79.1	-38.9	0	0	0	109.5
542	G	40	Very low	51.6	Low	75 Å²	75	106.6 Å²	106.6	77%	0.773	66%	0.657	S	S	*	*	S	Bend	trans	94.1	102.9	156.1	0	0	0	0	0	117.7
543	A	41.8	Very low	52.1	Low	106 Å²	106	102.4 Å²	102.4	88%	0.876	64%	0.638	S	S	*	*			trans	58.5	85.2	141.5	0	0	0	0	0	120.2
544	S	36.5	Very low	52.6	Low	119 Å²	119	99.6 Å²	99.6	83%	0.832	62%	0.623	S	S	*	*				-154.2	143	125.6	54.5	0	0	0	0	110.7	G546	S544-G546 PolarHBondContact O-N 2.69Å
545	N	41.4	Very low	53.1	Low	182 Å²	182	101.5 Å²	101.5	97%	0.973	63%	0.632	S	S	*	*			trans	-83.1	109.1	176.9	-94.8	-2.9	0	0	0	110
546	G	34	Very low	54	Low	67 Å²	67	95 Å²	95	69%	0.691	60%	0.602	S	S	*	*			trans	-162	134.8	168	0	0	0	0	0	108.9	S544	S544-G546 PolarHBondContact O-N 2.69Å
547	T	39.6	Very low	55.3	Low	139 Å²	139	95.9 Å²	95.9	85%	0.853	60%	0.598	S	S	*	*			trans	-63.2	133	177.2	40.5	0	0	0	0	110.3	A549	T547-A549 PolarHBondContact O-N 2.92Å
548	P	43.4	Very low	56.6	Low	103 Å²	103	91.8 Å²	91.8	67%	0.669	56%	0.555	S	S	*	*			trans	-64	129	176.1	27.3	-33.6	0	0	0	109.7	N550	P548-N550 PolarHBondContact O-N 3.22Å; P548-N550 VanDerWaalsContact O-N 3.1Å
549	A	48.8	Very low	58	Low	82 Å²	82	89.8 Å²	89.8	68%	0.678	53%	0.534	S	S	*	.			trans	-73.4	98.8	166.4	0	0	0	0	0	107.8	T547 W551	T547-A549 PolarHBondContact O-N 2.92Å; A549-W551 PolarHBondContact O-N 3.16Å
550	N	61.8	Low	59.1	Low	89 Å²	89	85.5 Å²	85.5	48%	0.476	50%	0.502	S	S	.	.			trans	-63.7	-16.8	176.4	-68.1	-8.5	0	0	0	112.6	C472 P548	C472-N550 PolarHBondContact N-O 2.63Å; P548-N550 PolarHBondContact O-N 3.22Å; P548-N550 VanDerWaalsContact O-N 3.1Å
551	W	66.6	Low	60.1	Low	145 Å²	145	77.3 Å²	77.3	55%	0.549	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.7	-175	-69	9.8	0	0	0	111	L469 L470 D471 A549	L469-W551 HydrophobicContact CD1-CB 4.19Å; L469-W551 HydrophobicContact CD1-CE3 4.3Å; L469-W551 HydrophobicContact CD2-CE3 3.69Å; L469-W551 HydrophobicContact CD2-CZ3 3.81Å; L469-W551 HydrophobicContact CG-CE3 4.05Å; L470-W551 CarbonylContact O-C 3.59Å; L470-W551 WeakPolarHBondContact O-CA 3.33Å; D471-W551 VanDerWaalsContact CG-NE1 3.34Å; D471-W551 PolarHBondContact OD2-NE1 2.83Å; A549-W551 PolarHBondContact O-N 3.16Å
552	L	76.2	Confident	60.8	Low	11 Å²	11	74.6 Å²	74.6	6%	0.058	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	119.5	-174.7	-156.1	77.1	0	0	0	109.5	L470 C472 I519 N520 L534 L554	L470-L552 PolarHBondContact N-O 3.5Å; L470-L552 PolarHBondContact O-N 2.89Å; C472-L552 HydrophobicContact CB-CB 4.32Å; C472-L552 VanDerWaalsContact SG-CB 3.54Å; I519-L552 HydrophobicContact CG2-CD1 3.6Å; I519-L552 HydrophobicContact CG2-CD2 3.95Å; I519-L552 HydrophobicContact CG2-CG 3.73Å; N520-L552 WeakPolarHBondContact OD1-CA 3.49Å; L534-L552 HydrophobicContact CD2-CD2 3.76Å; L552-L554 HydrophobicContact CD2-CD2 3.77Å; L552-L554 HydrophobicContact CD2-CG 4.26Å; L552-L554 HydrophobicContact CG-CD2 4.22Å
553	E	79.8	Confident	61.5	Low	64 Å²	64	72.6 Å²	72.6	30%	0.299	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	101.4	176.8	-175.4	-177.1	-164.6	0	0	108.6	L469 I519 N520 K521	L469-E553 HydrophobicContact CD1-CB 4.26Å; I519-E553 CarbonylContact C-O 3.49Å; N520-E553 PolarHBondContact N-O 2.82Å; N520-E553 PolarHBondContact OD1-N 2.63Å; K521-E553 WeakPolarHBondContact CE-OE1 3.23Å; K521-E553 WeakPolarHBondContact CE-OE2 3.43Å; K521-E553 IonicContact NZ-OE1 3.57Å; K521-E553 PolarHBondContact NZ-OE1 3.14Å; K521-E553 IonicContact NZ-OE2 3.68Å
554	L	82.3	Confident	62.1	Low	0 Å²	0	73.1 Å²	73.1	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	126	177.8	-62.8	177.6	0	0	0	109.7	P467 V468 L470 I478 I510 I519 L534 L552 I556	P467-L554 CarbonylContact C-O 3.56Å; P467-L554 WeakPolarHBondContact CA-O 3.28Å; V468-L554 PolarHBondContact N-O 3.23Å; V468-L554 PolarHBondContact O-N 3.28Å; L470-L554 HydrophobicContact CD1-CD1 3.68Å; L470-L554 HydrophobicContact CG-CD1 4.38Å; I478-L554 HydrophobicContact CD1-CD1 3.55Å; I510-L554 HydrophobicContact CD1-CD1 4.44Å; I519-L554 HydrophobicContact CB-CD2 4.21Å; I519-L554 HydrophobicContact CD1-CD2 4.12Å; I519-L554 HydrophobicContact CG1-CD2 3.7Å; I519-L554 HydrophobicContact CG2-CD2 3.96Å; L534-L554 HydrophobicContact CD2-CD1 4.26Å; L534-L554 HydrophobicContact CD2-CD2 4.04Å; L552-L554 HydrophobicContact CD2-CD2 3.77Å; L552-L554 HydrophobicContact CD2-CG 4.26Å; L552-L554 HydrophobicContact CG-CD2 4.22Å; L554-I556 HydrophobicContact CB-CD1 4.03Å; L554-I556 HydrophobicContact CB-CG1 3.86Å; L554-I556 HydrophobicContact CD1-CD1 4.35Å
555	E	82	Confident	63.1	Low	47 Å²	47	69 Å²	69	22%	0.22	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	115	164	-167.6	177.6	166.5	0	0	108.9	S465 V517 A518 Y523	S465-E555 WeakPolarHBondContact CB-OE1 3.44Å; S465-E555 PolarHBondContact OG-OE1 2.69Å; V517-E555 PolarHBondContact N-O 3.41Å; A518-E555 HydrophobicContact CB-CB 4.04Å; A518-E555 PolarHBondContact N-O 2.92Å; A518-E555 PolarHBondContact O-N 2.87Å; Y523-E555 VanDerWaalsContact CE1-OE2 3.28Å; Y523-E555 WeakPolarHBondContact CE1-OE2 3.24Å; Y523-E555 PolarHBondContact OH-OE2 3.48Å; Y523-E555 VanDerWaalsContact OH-OE2 3.07Å
556	I	83.1	Confident	63.9	Low	0 Å²	0	62.8 Å²	62.8	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	126	-171.1	-55.7	-177.5	0	0	0	108.7	S465 F466 V468 I510 D514 R515 L554	S465-I556 CarbonylContact C-O 3.53Å; S465-I556 VanDerWaalsContact CA-O 3.26Å; S465-I556 WeakPolarHBondContact CA-O 3.49Å; F466-I556 HydrophobicContact CD1-CB 4.44Å; F466-I556 WeakPolarHBondContact CD1-O 3.36Å; F466-I556 HydrophobicContact CE1-CB 3.92Å; F466-I556 HydrophobicContact CE1-CG2 3.92Å; F466-I556 HydrophobicContact CZ-CB 4.09Å; F466-I556 HydrophobicContact CZ-CG2 4.12Å; F466-I556 PolarHBondContact N-O 3.29Å; F466-I556 PolarHBondContact O-N 3.42Å; V468-I556 HydrophobicContact CB-CD1 4.08Å; V468-I556 HydrophobicContact CG2-CD1 3.79Å; V468-I556 HydrophobicContact CG2-CG1 4.44Å; I510-I556 HydrophobicContact CB-CD1 4.41Å; I510-I556 HydrophobicContact CD1-CD1 3.55Å; I510-I556 HydrophobicContact CG1-CD1 3.58Å; I510-I556 HydrophobicContact CG2-CD1 4.08Å; D514-I556 HydrophobicContact CB-CG2 3.75Å; R515-I556 WeakPolarHBondContact O-CA 3.5Å; L554-I556 HydrophobicContact CB-CD1 4.03Å; L554-I556 HydrophobicContact CB-CG1 3.86Å; L554-I556 HydrophobicContact CD1-CD1 4.35Å
557	E	81.4	Confident	64.8	Low	46 Å²	46	63 Å²	63	22%	0.215	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	131.1	178.3	-177.9	-167.2	118.3	0	0	109.7	A463 E464 R515 V517	A463-E557 HydrophobicContact CB-CG 3.88Å; E464-E557 VanDerWaalsContact O-CA 3.31Å; E464-E557 WeakPolarHBondContact O-CA 3.24Å; R515-E557 HydrophobicContact CB-CB 4.31Å; R515-E557 IonicContact CZ-OE1 3.46Å; R515-E557 PolarHBondContact N-O 3.48Å; R515-E557 IonicContact NE-OE1 3.27Å; R515-E557 PolarHBondContact NE-OE1 3.05Å; R515-E557 IonicContact NH2-OE1 2.72Å; R515-E557 PolarHBondContact NH2-OE1 2.64Å; R515-E557 PolarHBondContact O-N 2.78Å; V517-E557 HydrophobicContact CG2-CB 3.49Å; V517-E557 VanDerWaalsContact CG2-CB 3.49Å; V517-E557 HydrophobicContact CG2-CG 4.38Å; V517-E557 WeakPolarHBondContact CG2-OE2 3.32Å
558	F	79.9	Confident	66	Low	4 Å²	4	59.8 Å²	59.8	2%	0.018	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	152.9	177.3	70.5	-79.5	0	0	0	110.6	A463 E464 F466 D514 M560 H607 R608	A463-F558 WeakPolarHBondContact CA-O 3.49Å; E464-F558 HydrophobicContact CB-CD1 4.42Å; E464-F558 HydrophobicContact CB-CE1 3.81Å; E464-F558 HydrophobicContact CB-CZ 3.92Å; E464-F558 PolarHBondContact N-O 3.11Å; E464-F558 VanDerWaalsContact O-CD1 3.29Å; E464-F558 WeakPolarHBondContact O-CD1 3.42Å; E464-F558 PolarHBondContact O-N 2.8Å; F466-F558 AromaticContact CD1-CD1 3.61Å; F466-F558 HydrophobicContact CD1-CD1 3.61Å; F466-F558 AromaticContact CD1-CE1 3.64Å; F466-F558 HydrophobicContact CD1-CE1 3.64Å; F466-F558 AromaticContact CE1-CD1 3.51Å; F466-F558 HydrophobicContact CE1-CD1 3.51Å; F466-F558 AromaticContact CE1-CE1 3.89Å; F466-F558 HydrophobicContact CE1-CE1 3.89Å; D514-F558 WeakPolarHBondContact OD1-CB 3.46Å; F558-M560 HydrophobicContact CD2-CB 4.42Å; F558-M560 HydrophobicContact CE2-CB 3.86Å; F558-M560 HydrophobicContact CE2-CE 3.76Å; F558-M560 HydrophobicContact CE2-CG 4.26Å; F558-M560 HydrophobicContact CZ-CE 3.58Å; F558-M560 PolarHBondContact O-N 2.81Å; F558-H607 AromaticContact CE1-CE1 3.52Å; F558-H607 AromaticContact CE1-NE2 3.45Å; F558-H607 WeakPolarHBondContact CE1-NE2 3.23Å; F558-H607 AromaticContact CZ-CE1 3.25Å; F558-H607 WeakPolarHBondContact CZ-CE1 3.38Å; F558-H607 AromaticContact CZ-ND1 3.7Å; F558-H607 AromaticContact CZ-NE2 3.42Å; F558-H607 WeakPolarHBondContact CZ-NE2 3.29Å; F558-R608 HydrophobicContact CD2-CG 3.94Å; F558-R608 HydrophobicContact CE2-CB 4.31Å; F558-R608 HydrophobicContact CE2-CG 3.77Å; F558-R608 HydrophobicContact CZ-CG 4.39Å
559	D	71.2	Confident	67.4	Low	81 Å²	81	56.6 Å²	56.6	43%	0.433	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	109.6	174.2	-64.8	-45.6	0	0	0	109.6	C461 R515	C461-D559 HydrophobicContact CB-CB 4.22Å; R515-D559 IonicContact CZ-OD1 3.43Å; R515-D559 IonicContact CZ-OD2 2.71Å; R515-D559 IonicContact NH1-OD1 2.68Å; R515-D559 PolarHBondContact NH1-OD1 2.85Å; R515-D559 IonicContact NH1-OD2 3.04Å; R515-D559 PolarHBondContact NH1-OD2 2.86Å; R515-D559 IonicContact NH2-OD1 3.29Å; R515-D559 PolarHBondContact NH2-OD1 2.8Å; R515-D559 IonicContact NH2-OD2 2.76Å
560	M	70.5	Confident	68.8	Low	21 Å²	21	57 Å²	57	10%	0.103	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	135.8	169.3	-164.1	-176.5	-68.4	0	0	109.1	C461 R462 E464 F558 G610	C461-M560 CarbonylContact C-O 3.58Å; C461-M560 WeakPolarHBondContact CA-O 3.22Å; R462-M560 PolarHBondContact N-O 2.88Å; R462-M560 PolarHBondContact O-N 2.81Å; E464-M560 HydrophobicContact CG-CB 4.34Å; E464-M560 HydrophobicContact CG-CE 3.99Å; E464-M560 WeakPolarHBondContact OE2-CE 3.34Å; F558-M560 HydrophobicContact CD2-CB 4.42Å; F558-M560 HydrophobicContact CE2-CB 3.86Å; F558-M560 HydrophobicContact CE2-CE 3.76Å; F558-M560 HydrophobicContact CE2-CG 4.26Å; F558-M560 HydrophobicContact CZ-CE 3.58Å; F558-M560 PolarHBondContact O-N 2.81Å; M560-G610 VanDerWaalsContact SD-CA 3.53Å
561	P	61.9	Low	69.6	Low	72 Å²	72	54 Å²	54	47%	0.468	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	142.1	167.5	29	-34.3	0	0	0	109.9	A563	P561-A563 PolarHBondContact O-N 3.34Å
562	D	55.3	Low	70.2	Confident	113 Å²	113	50.8 Å²	50.8	60%	0.604	31%	0.314	S	S	*	.			trans	-74.5	72.6	175.5	-158.9	17	0	0	0	110.2	L460 V564	L460-D562 HydrophobicContact CB-CB 4.36Å; L460-D562 VanDerWaalsContact O-CB 3.3Å; L460-D562 WeakPolarHBondContact O-CB 3.41Å; L460-D562 PolarHBondContact O-N 3.02Å; D562-V564 PolarHBondContact O-N 3.42Å
563	A	54.4	Low	70.4	Confident	34 Å²	34	50.7 Å²	50.7	28%	0.281	31%	0.314	S	S	.	.			trans	-75.4	119.5	-171.6	0	0	0	0	0	111.1	P561 V565	P561-A563 PolarHBondContact O-N 3.34Å; A563-V565 WeakPolarHBondContact O-CG2 3.48Å; A563-V565 PolarHBondContact O-N 2.91Å
564	V	53.7	Low	70.3	Confident	117 Å²	117	55 Å²	55	71%	0.709	33%	0.332	S	S	*	.			trans	-68.2	95.2	175.1	-177.7	0	0	0	0	109.3	D562	D562-V564 PolarHBondContact O-N 3.42Å
565	V	58.6	Low	70.1	Confident	33 Å²	33	55.1 Å²	55.1	20%	0.2	33%	0.332	C	S	.	.			trans	-89	125.4	-177.6	-150.1	0	0	0	0	111	A563 A567 G610 S611	A563-V565 WeakPolarHBondContact O-CG2 3.48Å; A563-V565 PolarHBondContact O-N 2.91Å; V565-A567 PolarHBondContact O-N 2.98Å; V565-G610 WeakPolarHBondContact CG2-O 3.49Å; V565-S611 WeakPolarHBondContact CG1-O 3.22Å
566	P	57.6	Low	69.6	Low	51 Å²	51	56.9 Å²	56.9	33%	0.331	34%	0.343	S	S	.	.			trans	-57.3	134.9	176.6	-27.3	36.3	0	0	0	112.7	S568 F571 R658	P566-S568 VanDerWaalsContact C-N 3.3Å; P566-S568 PolarHBondContact O-N 3Å; P566-F571 HydrophobicContact CB-CD1 4.17Å; P566-F571 HydrophobicContact CG-CB 4.08Å; P566-F571 HydrophobicContact CG-CD1 4.03Å; P566-F571 HydrophobicContact CG-CG 3.97Å; P566-R658 PolarHBondContact O-NH1 3.1Å
567	A	53.3	Low	68.7	Low	70 Å²	70	60.5 Å²	60.5	58%	0.579	36%	0.356	S	S	*	.	S	Bend	trans	-66.8	-33.6	178.1	0	0	0	0	0	112.3	V565 R658	V565-A567 PolarHBondContact O-N 2.98Å; A567-R658 WeakPolarHBondContact O-CD 3.27Å
568	S	64.3	Low	67.4	Low	72 Å²	72	59.8 Å²	59.8	50%	0.503	36%	0.359	S	S	.	.	S	Bend	trans	-155.3	174.6	173.3	57.8	0	0	0	0	109.4	P566 R658 I659	P566-S568 VanDerWaalsContact C-N 3.3Å; P566-S568 PolarHBondContact O-N 3Å; S568-R658 CarbonylContact C-O 3.51Å; S568-R658 WeakPolarHBondContact CA-O 3.32Å; S568-I659 VanDerWaalsContact CB-O 3.3Å; S568-I659 WeakPolarHBondContact CB-O 3.33Å
569	G	71.9	Confident	66.3	Low	36 Å²	36	62.3 Å²	62.3	37%	0.371	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	107	-169.1	178.4	0	0	0	0	0	113.8	K657 R658	G569-K657 CarbonylContact O-C 3.57Å; G569-K657 WeakPolarHBondContact O-CA 3.46Å; G569-R658 PolarHBondContact N-O 2.9Å; G569-R658 PolarHBondContact O-N 3.42Å
570	V	79.3	Confident	65.5	Low	90 Å²	90	65.9 Å²	65.9	55%	0.545	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129	177.8	-176.5	0	0	0	0	109.5	L619 T655 I656 K657	V570-L619 HydrophobicContact CG1-CD1 4.2Å; V570-L619 HydrophobicContact CG2-CD1 4.43Å; V570-T655 HydrophobicContact CG1-CG2 4Å; V570-I656 CarbonylContact C-O 3.47Å; V570-I656 VanDerWaalsContact CA-O 3.23Å; V570-I656 WeakPolarHBondContact CA-O 3.44Å; V570-K657 HydrophobicContact CG2-CB 4.03Å; V570-K657 HydrophobicContact CG2-CD 4.29Å; V570-K657 HydrophobicContact CG2-CG 3.98Å
571	F	78.8	Confident	64.8	Low	28 Å²	28	66.5 Å²	66.5	12%	0.123	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	162.5	-178.3	61.8	-81.4	0	0	0	111.7	P566 V573 I656 R658	P566-F571 HydrophobicContact CB-CD1 4.17Å; P566-F571 HydrophobicContact CG-CB 4.08Å; P566-F571 HydrophobicContact CG-CD1 4.03Å; P566-F571 HydrophobicContact CG-CG 3.97Å; F571-V573 HydrophobicContact CD2-CG2 3.66Å; F571-V573 HydrophobicContact CE2-CG2 3.5Å; F571-I656 HydrophobicContact CE1-CG2 3.92Å; F571-I656 HydrophobicContact CE2-CG2 4.42Å; F571-I656 HydrophobicContact CZ-CB 4.38Å; F571-I656 HydrophobicContact CZ-CG2 3.78Å; F571-I656 PolarHBondContact N-O 2.82Å; F571-I656 PolarHBondContact O-N 2.89Å; F571-R658 HydrophobicContact CE1-CB 3.99Å
572	S	78.4	Confident	65	Low	76 Å²	76	64.8 Å²	64.8	53%	0.531	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.4	-177.4	-61.9	0	0	0	0	111.2	L654	S572-L654 CarbonylContact C-O 3.59Å; S572-L654 VanDerWaalsContact CA-O 3.32Å; S572-L654 WeakPolarHBondContact CA-O 3.42Å
573	V	81.1	Confident	65.8	Low	10 Å²	10	59.8 Å²	59.8	6%	0.061	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129.4	179.3	-177.9	0	0	0	0	110	F571 L575 L612 T653 L654	F571-V573 HydrophobicContact CD2-CG2 3.66Å; F571-V573 HydrophobicContact CE2-CG2 3.5Å; V573-L575 HydrophobicContact CG1-CD2 3.84Å; V573-L575 HydrophobicContact CG1-CG 4.4Å; V573-L612 HydrophobicContact CB-CD2 3.99Å; V573-L612 HydrophobicContact CG1-CD1 4.33Å; V573-L612 HydrophobicContact CG1-CD2 4.17Å; V573-L612 HydrophobicContact CG1-CG 4.17Å; V573-L612 HydrophobicContact CG2-CD2 3.71Å; V573-L612 HydrophobicContact CG2-CG 4.45Å; V573-T653 CarbonylContact O-C 3.53Å; V573-T653 WeakPolarHBondContact O-CA 3.33Å; V573-L654 PolarHBondContact N-O 3.13Å; V573-L654 PolarHBondContact O-N 3.39Å
574	K	77.9	Confident	66.6	Low	154 Å²	154	59 Å²	59	67%	0.67	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	117.8	173.2	-67.9	-176.3	176.5	-179.5	0	109.9	T653	K574-T653 HydrophobicContact CG-CG2 4.09Å
575	L	78.3	Confident	67.7	Low	2 Å²	2	54.6 Å²	54.6	1%	0.01	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135	175.9	-60.7	-174.1	0	0	0	110.5	V573 L583 A606 L612 F651 T652 L654	V573-L575 HydrophobicContact CG1-CD2 3.84Å; V573-L575 HydrophobicContact CG1-CG 4.4Å; L575-L583 HydrophobicContact CB-CD2 3.99Å; L575-L583 HydrophobicContact CD1-CB 4.04Å; L575-L583 HydrophobicContact CD1-CD1 4.29Å; L575-L583 HydrophobicContact CD1-CD2 4.07Å; L575-L583 HydrophobicContact CD1-CG 4.35Å; L575-A606 HydrophobicContact CD1-CB 4.07Å; L575-L612 HydrophobicContact CD1-CD1 3.74Å; L575-L612 HydrophobicContact CD2-CD1 3.83Å; L575-L612 HydrophobicContact CG-CD1 4.16Å; L575-F651 CarbonylContact O-C 3.54Å; L575-F651 VanDerWaalsContact O-CA 3.26Å; L575-F651 WeakPolarHBondContact O-CA 3.39Å; L575-T652 PolarHBondContact N-O 2.8Å; L575-T652 PolarHBondContact O-N 2.82Å; L575-L654 HydrophobicContact CD1-CD1 3.7Å; L575-L654 HydrophobicContact CG-CD1 4.33Å
576	L	70.1	Confident	68.6	Low	85 Å²	85	56 Å²	56	45%	0.445	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	122.3	170.3	175.5	60.1	0	0	0	109.8	A578 P605 F651	L576-A578 PolarHBondContact O-N 3.47Å; L576-A578 VanDerWaalsContact O-N 3.13Å; L576-P605 WeakPolarHBondContact O-CB 3.26Å; L576-F651 HydrophobicContact CB-CD1 4.09Å; L576-F651 HydrophobicContact CB-CE1 3.94Å; L576-F651 HydrophobicContact CD1-CD1 4.19Å; L576-F651 HydrophobicContact CD1-CE1 3.87Å; L576-F651 HydrophobicContact CD1-CZ 4.07Å; L576-F651 HydrophobicContact CG-CE1 4.41Å
577	R	65.7	Low	69.6	Low	75 Å²	75	55.6 Å²	55.6	28%	0.283	35%	0.347	S	S	.	.			trans	-81.5	92.5	-179.9	-168	172.9	-179.8	177.5	-2.7	110.8	G579 K636 E637 D650	R577-G579 PolarHBondContact O-N 3.43Å; R577-K636 PolarHBondContact NH2-O 3.09Å; R577-E637 PolarHBondContact NH1-O 2.97Å; R577-E637 PolarHBondContact NH2-O 3.29Å; R577-D650 HydrophobicContact CB-CB 4.32Å; R577-D650 WeakPolarHBondContact CB-O 3.23Å; R577-D650 PolarHBondContact N-O 2.85Å
578	A	53.7	Low	70.6	Confident	32 Å²	32	55 Å²	55	26%	0.264	34%	0.339	S	S	.	.			trans	-85.1	99	-179.8	0	0	0	0	0	112.5	L576 C581 P605	L576-A578 PolarHBondContact O-N 3.47Å; L576-A578 VanDerWaalsContact O-N 3.13Å; A578-C581 PolarHBondContact O-SG 2.74Å; A578-P605 HydrophobicContact CB-CG 4.41Å
579	G	56.5	Low	70.8	Confident	56 Å²	56	54.6 Å²	54.6	58%	0.577	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	-157.7	166.5	0	0	0	0	0	115.8	R577 C581	R577-G579 PolarHBondContact O-N 3.43Å; G579-C581 PolarHBondContact O-N 2.94Å
580	K	55.2	Low	70.2	Confident	157 Å²	157	55.3 Å²	55.3	68%	0.683	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-11.2	-174.3	-58.3	-177.8	-169.9	179.3	0	113.9	D501	D501-K580 IonicContact OD1-NZ 2.72Å; D501-K580 PolarHBondContact OD1-NZ 3.49Å; D501-K580 IonicContact OD2-NZ 2.71Å; D501-K580 PolarHBondContact OD2-NZ 2.84Å
581	C	54.3	Low	68.8	Low	34 Å²	34	56.3 Å²	56.3	23%	0.23	36%	0.356	C	S	.	.	S	Bend	trans	-84.9	140.6	178.3	67.8	0	0	0	0	111.7	G508 A578 G579	G508-C581 WeakPolarHBondContact CA-SG 3.39Å; A578-C581 PolarHBondContact O-SG 2.74Å; G579-C581 PolarHBondContact O-N 2.94Å
582	G	66.1	Low	67.4	Low	35 Å²	35	62.9 Å²	62.9	36%	0.361	39%	0.387	S	S	.	.			trans	-68.7	172.8	173.7	0	0	0	0	0	112.4	G584	G582-G584 PolarHBondContact O-N 3.08Å
583	L	72.4	Confident	66.3	Low	8 Å²	8	62.1 Å²	62.1	4%	0.042	39%	0.391	C	S	.	.			trans	-59.2	-15	-170.1	-60.9	170.2	0	0	0	115.5	L575 A606 L635 T652	L575-L583 HydrophobicContact CB-CD2 3.99Å; L575-L583 HydrophobicContact CD1-CB 4.04Å; L575-L583 HydrophobicContact CD1-CD1 4.29Å; L575-L583 HydrophobicContact CD1-CD2 4.07Å; L575-L583 HydrophobicContact CD1-CG 4.35Å; L583-A606 WeakPolarHBondContact O-CB 3.19Å; L583-A606 PolarHBondContact O-N 3.03Å; L583-A606 VanDerWaalsContact O-N 3.07Å; L583-L635 HydrophobicContact CD1-CD2 4.12Å; L583-T652 HydrophobicContact CD1-CG2 3.7Å
584	G	71.4	Confident	65.6	Low	18 Å²	18	62.9 Å²	62.9	19%	0.186	40%	0.401	C	S	.	.	S	Bend	trans	93	11.5	176.5	0	0	0	0	0	115.3	G582 K601	G582-G584 PolarHBondContact O-N 3.08Å; G584-K601 WeakPolarHBondContact O-CB 3.3Å; G584-K601 PolarHBondContact O-N 3.25Å
585	L	77.8	Confident	65.6	Low	24 Å²	24	57.1 Å²	57.1	13%	0.126	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	135.4	178.6	-62.8	175.4	0	0	0	111.5	I597 V600 A606 L612 L654	L585-I597 HydrophobicContact CD1-CD1 4.18Å; L585-I597 HydrophobicContact CD2-CD1 4.19Å; L585-I597 HydrophobicContact CD2-CG2 3.96Å; L585-V600 HydrophobicContact CD2-CB 4.47Å; L585-V600 HydrophobicContact CD2-CG1 4.2Å; L585-V600 HydrophobicContact CD2-CG2 3.87Å; L585-A606 HydrophobicContact CD2-CB 3.54Å; L585-A606 HydrophobicContact CG-CB 3.82Å; L585-L612 HydrophobicContact CD1-CD1 4.29Å; L585-L612 HydrophobicContact CD2-CD1 4.23Å; L585-L654 HydrophobicContact CD1-CD1 3.42Å; L585-L654 VanDerWaalsContact CD1-CD1 3.42Å
586	S	76.4	Confident	65.7	Low	64 Å²	64	58.6 Å²	58.6	45%	0.448	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	129.1	163.8	-59.5	0	0	0	0	108.9	I597 S598 D599	S586-I597 CarbonylContact O-C 3.53Å; S586-S598 PolarHBondContact O-N 2.85Å; S586-D599 PolarHBondContact N-O 2.84Å; S586-D599 PolarHBondContact O-N 2.96Å
587	V	78.3	Confident	66.4	Low	41 Å²	41	54.6 Å²	54.6	25%	0.248	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	136.3	-176.4	-175.6	0	0	0	0	109.6	L595 V596 I597 L635	V587-L595 HydrophobicContact CG1-CB 3.83Å; V587-L595 HydrophobicContact CG1-CD2 3.88Å; V587-L595 HydrophobicContact CG1-CG 4.48Å; V587-V596 WeakPolarHBondContact CA-O 3.36Å; V587-I597 HydrophobicContact CG2-CG1 4.39Å; V587-L635 HydrophobicContact CG2-CD1 3.82Å
588	S	74.3	Confident	67.1	Low	59 Å²	59	53.6 Å²	53.6	41%	0.413	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	151.1	172.8	63.4	0	0	0	0	111.5	V596 S598	S588-V596 PolarHBondContact N-O 3.28Å; S588-V596 PolarHBondContact O-N 3.28Å; S588-S598 VanDerWaalsContact CB-OG 3.29Å; S588-S598 WeakPolarHBondContact CB-OG 3.18Å; S588-S598 PolarHBondContact N-OG 2.8Å; S588-S598 PolarHBondContact OG-OG 2.89Å
589	G	68.4	Low	68.2	Low	63 Å²	63	56.6 Å²	56.6	65%	0.649	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	123.2	173.2	0	0	0	0	0	111
590	S	59.9	Low	69.5	Low	50 Å²	50	54.8 Å²	54.8	35%	0.35	36%	0.359	S	S	.	.			trans	-76.2	151.2	168.4	178.8	0	0	0	0	110.9	H592 G593 G594	S590-H592 PolarHBondContact O-N 2.71Å; S590-G593 PolarHBondContact O-N 3.08Å; S590-G594 VanDerWaalsContact CB-O 3.26Å; S590-G594 WeakPolarHBondContact CB-O 3.43Å; S590-G594 PolarHBondContact N-O 2.77Å
591	S	49.3	Very low	70.5	Confident	111 Å²	111	52.1 Å²	52.1	78%	0.776	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-11.5	174.6	45.6	0	0	0	0	114.9
592	H	49.9	Very low	71.4	Confident	167 Å²	167	55.4 Å²	55.4	77%	0.773	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	17.7	-179.9	-52.2	-66.3	0	0	0	113.4	S590 G594	S590-H592 PolarHBondContact O-N 2.71Å; H592-G594 PolarHBondContact O-N 3.47Å
593	G	56.1	Low	71.6	Confident	60 Å²	60	53.7 Å²	53.7	62%	0.619	34%	0.343	S	S	*	.	S	Bend	trans	76	3.8	176	0	0	0	0	0	115.4	S590	S590-G593 PolarHBondContact O-N 3.08Å
594	G	66.6	Low	71.7	Confident	26 Å²	26	53.4 Å²	53.4	27%	0.268	34%	0.342	S	S	.	.			trans	-85.8	145.3	170.3	0	0	0	0	0	111.9	S590 H592	S590-G594 VanDerWaalsContact CB-O 3.26Å; S590-G594 WeakPolarHBondContact CB-O 3.43Å; S590-G594 PolarHBondContact N-O 2.77Å; H592-G594 PolarHBondContact O-N 3.47Å
595	L	76.4	Confident	72	Confident	33 Å²	33	53.1 Å²	53.1	17%	0.173	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	122.9	178.9	-78.2	154.7	0	0	0	109.9	V587 I617 L618 V626 V631	V587-L595 HydrophobicContact CG1-CB 3.83Å; V587-L595 HydrophobicContact CG1-CD2 3.88Å; V587-L595 HydrophobicContact CG1-CG 4.48Å; L595-I617 CarbonylContact O-C 3.51Å; L595-I617 WeakPolarHBondContact O-CA 3.27Å; L595-I617 WeakPolarHBondContact O-CG2 3.45Å; L595-L618 PolarHBondContact O-N 2.92Å; L595-V626 HydrophobicContact CD1-CB 3.65Å; L595-V626 HydrophobicContact CD1-CG2 3.77Å; L595-V631 HydrophobicContact CD1-CG2 3.4Å; L595-V631 HydrophobicContact CD2-CG2 3.88Å; L595-V631 HydrophobicContact CG-CG2 4.27Å
596	V	81.4	Confident	72	Confident	33 Å²	33	52 Å²	52	20%	0.2	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	124.7	-169.8	-169	0	0	0	0	110.3	V587 S588 S598 I617	V587-V596 WeakPolarHBondContact CA-O 3.36Å; S588-V596 PolarHBondContact N-O 3.28Å; S588-V596 PolarHBondContact O-N 3.28Å; V596-S598 PolarHBondContact O-N 2.87Å; V596-S598 PolarHBondContact O-OG 2.87Å; V596-I617 HydrophobicContact CG2-CG1 4.39Å
597	I	84.9	Confident	72.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	112.8	169.9	-63	176.4	0	0	0	107	L585 S586 V587 V600 S614 G615 D616 I656	L585-I597 HydrophobicContact CD1-CD1 4.18Å; L585-I597 HydrophobicContact CD2-CD1 4.19Å; L585-I597 HydrophobicContact CD2-CG2 3.96Å; S586-I597 CarbonylContact O-C 3.53Å; V587-I597 HydrophobicContact CG2-CG1 4.39Å; I597-V600 HydrophobicContact CG2-CG2 3.75Å; I597-S614 CarbonylContact O-C 3.54Å; I597-S614 WeakPolarHBondContact O-CA 3.39Å; I597-G615 PolarHBondContact O-N 3.36Å; I597-D616 HydrophobicContact CB-CB 4.34Å; I597-D616 WeakPolarHBondContact CB-O 3.44Å; I597-D616 HydrophobicContact CD1-CB 4.01Å; I597-D616 HydrophobicContact CG1-CB 4.47Å; I597-D616 PolarHBondContact N-O 2.95Å; I597-I656 HydrophobicContact CD1-CD1 4.1Å
598	S	78.9	Confident	72	Confident	55 Å²	55	50.2 Å²	50.2	39%	0.385	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	-33.5	-173.3	-53.3	0	0	0	0	111.4	S586 S588 V596 S614	S586-S598 PolarHBondContact O-N 2.85Å; S588-S598 VanDerWaalsContact CB-OG 3.29Å; S588-S598 WeakPolarHBondContact CB-OG 3.18Å; S588-S598 PolarHBondContact N-OG 2.8Å; S588-S598 PolarHBondContact OG-OG 2.89Å; V596-S598 PolarHBondContact O-N 2.87Å; V596-S598 PolarHBondContact O-OG 2.87Å; S598-S614 WeakPolarHBondContact O-CB 3.39Å
599	D	77.9	Confident	72	Confident	95 Å²	95	48.3 Å²	48.3	51%	0.508	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	153.4	176.6	-173.8	27.6	0	0	0	111	S586	S586-D599 PolarHBondContact N-O 2.84Å; S586-D599 PolarHBondContact O-N 2.96Å
600	V	83.3	Confident	72.1	Confident	18 Å²	18	46.2 Å²	46.2	11%	0.109	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	106.1	179.9	-175.6	0	0	0	0	108.3	L585 I597 M602 A606 H607	L585-V600 HydrophobicContact CD2-CB 4.47Å; L585-V600 HydrophobicContact CD2-CG1 4.2Å; L585-V600 HydrophobicContact CD2-CG2 3.87Å; I597-V600 HydrophobicContact CG2-CG2 3.75Å; V600-M602 PolarHBondContact O-N 2.84Å; V600-A606 HydrophobicContact CG1-CB 3.85Å; V600-H607 HydrophobicContact CG1-CB 4.25Å
601	K	76.3	Confident	72.9	Confident	101 Å²	101	44.8 Å²	44.8	44%	0.439	27%	0.266	S	S	.	.			trans	-59.6	126.3	-174.1	-168.9	-166.5	-174.2	-165.7	0	111.1	S507 C509 G584 S604	S507-K601 PolarHBondContact O-NZ 3.18Å; C509-K601 WeakPolarHBondContact SG-CE 3.37Å; C509-K601 PolarHBondContact SG-NZ 3.3Å; G584-K601 WeakPolarHBondContact O-CB 3.3Å; G584-K601 PolarHBondContact O-N 3.25Å; K601-S604 WeakPolarHBondContact O-CB 3.5Å; K601-S604 PolarHBondContact O-N 3.38Å; K601-S604 PolarHBondContact O-OG 2.97Å
602	M	73.9	Confident	74.3	Confident	102 Å²	102	40 Å²	40	50%	0.502	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	146.8	175.6	-60.9	-172.3	82.6	0	0	111.8	F466 C509 V600 S604	F466-M602 HydrophobicContact CB-CE 3.85Å; F466-M602 HydrophobicContact CD2-CB 4.35Å; C509-M602 PolarHBondContact SG-O 2.93Å; V600-M602 PolarHBondContact O-N 2.84Å; M602-S604 PolarHBondContact O-N 3.26Å; M602-S604 VanDerWaalsContact O-N 3.1Å
603	G	68.9	Low	75.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.5	-8.9	-174.4	0	0	0	0	0	116.4	F466 C509 H607 R608	F466-G603 VanDerWaalsContact CE2-CA 3.47Å; C509-G603 VanDerWaalsContact O-O 3.07Å; G603-H607 WeakPolarHBondContact CA-CE1 3.49Å; G603-H607 PolarHBondContact N-CE1 3.41Å; G603-H607 PolarHBondContact N-ND1 2.89Å; G603-R608 PolarHBondContact O-NE 3.11Å
604	S	76.4	Confident	76.6	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.014	20%	0.202	C	C	.	.	S	Bend	trans	-71.6	164.9	-178.8	70.6	0	0	0	0	113.6	K601 M602 A606 H607 R608	K601-S604 WeakPolarHBondContact O-CB 3.5Å; K601-S604 PolarHBondContact O-N 3.38Å; K601-S604 PolarHBondContact O-OG 2.97Å; M602-S604 PolarHBondContact O-N 3.26Å; M602-S604 VanDerWaalsContact O-N 3.1Å; S604-A606 PolarHBondContact O-N 3.01Å; S604-A606 PolarHBondContact OG-N 3.42Å; S604-H607 PolarHBondContact O-N 3.02Å; S604-H607 VanDerWaalsContact O-N 3.12Å; S604-H607 PolarHBondContact OG-N 2.89Å; S604-R608 WeakPolarHBondContact O-CG 3.36Å; S604-R608 PolarHBondContact O-N 3.44Å
605	P	76.4	Confident	76.9	Confident	11 Å²	11	36.7 Å²	36.7	7%	0.071	21%	0.208	C	C	.	.	H	α-helix	trans	-53.9	-37.6	171.4	-27.3	36.3	0	0	0	113.6	L576 A578 R608 S609	L576-P605 WeakPolarHBondContact O-CB 3.26Å; A578-P605 HydrophobicContact CB-CG 4.41Å; P605-R608 PolarHBondContact O-N 2.65Å; P605-S609 PolarHBondContact O-N 3.33Å
606	A	78.8	Confident	77.2	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.5	-45.3	175.1	0	0	0	0	0	112.7	L575 L583 L585 V600 S604 S609 L612	L575-A606 HydrophobicContact CD1-CB 4.07Å; L583-A606 WeakPolarHBondContact O-CB 3.19Å; L583-A606 PolarHBondContact O-N 3.03Å; L583-A606 VanDerWaalsContact O-N 3.07Å; L585-A606 HydrophobicContact CD2-CB 3.54Å; L585-A606 HydrophobicContact CG-CB 3.82Å; V600-A606 HydrophobicContact CG1-CB 3.85Å; S604-A606 PolarHBondContact O-N 3.01Å; S604-A606 PolarHBondContact OG-N 3.42Å; A606-S609 WeakPolarHBondContact O-CB 3.39Å; A606-S609 PolarHBondContact O-N 2.75Å; A606-S609 PolarHBondContact O-OG 3.49Å; A606-L612 HydrophobicContact CB-CD1 3.77Å
607	H	77.9	Confident	77.3	Confident	34 Å²	34	35.3 Å²	35.3	16%	0.157	20%	0.2	C	C	.	.	H	α-helix	trans	-63.4	-44.9	176	-178	-129.8	0	0	0	111.7	E464 F558 V600 G603 S604 S609 G610	E464-H607 IonicContact OE2-NE2 3.62Å; F558-H607 AromaticContact CE1-CE1 3.52Å; F558-H607 AromaticContact CE1-NE2 3.45Å; F558-H607 WeakPolarHBondContact CE1-NE2 3.23Å; F558-H607 AromaticContact CZ-CE1 3.25Å; F558-H607 WeakPolarHBondContact CZ-CE1 3.38Å; F558-H607 AromaticContact CZ-ND1 3.7Å; F558-H607 AromaticContact CZ-NE2 3.42Å; F558-H607 WeakPolarHBondContact CZ-NE2 3.29Å; V600-H607 HydrophobicContact CG1-CB 4.25Å; G603-H607 WeakPolarHBondContact CA-CE1 3.49Å; G603-H607 PolarHBondContact N-CE1 3.41Å; G603-H607 PolarHBondContact N-ND1 2.89Å; S604-H607 PolarHBondContact O-N 3.02Å; S604-H607 VanDerWaalsContact O-N 3.12Å; S604-H607 PolarHBondContact OG-N 2.89Å; H607-S609 PolarHBondContact O-N 3.04Å; H607-G610 PolarHBondContact O-N 3.12Å
608	R	75.2	Confident	77.3	Confident	34 Å²	34	35.5 Å²	35.5	13%	0.128	20%	0.2	C	C	.	.	H	α-helix	trans	-61.9	-15.6	179.5	-69.5	171.5	-176.2	-99.6	-1.7	114.1	C509 D514 F558 G603 S604 P605 G610	C509-R608 PolarHBondContact O-NH2 2.87Å; D514-R608 IonicContact OD1-CZ 2.73Å; D514-R608 IonicContact OD1-NH1 3.6Å; D514-R608 PolarHBondContact OD1-NH1 2.8Å; D514-R608 IonicContact OD1-NH2 3.4Å; D514-R608 PolarHBondContact OD1-NH2 2.96Å; D514-R608 IonicContact OD2-CZ 2.78Å; D514-R608 IonicContact OD2-NH1 3.51Å; D514-R608 IonicContact OD2-NH2 3.59Å; D514-R608 PolarHBondContact OD2-NH2 3.44Å; F558-R608 HydrophobicContact CD2-CG 3.94Å; F558-R608 HydrophobicContact CE2-CB 4.31Å; F558-R608 HydrophobicContact CE2-CG 3.77Å; F558-R608 HydrophobicContact CZ-CG 4.39Å; G603-R608 PolarHBondContact O-NE 3.11Å; S604-R608 WeakPolarHBondContact O-CG 3.36Å; S604-R608 PolarHBondContact O-N 3.44Å; P605-R608 PolarHBondContact O-N 2.65Å; R608-G610 VanDerWaalsContact C-N 3.34Å
609	S	74.8	Confident	77.4	Confident	19 Å²	19	36.1 Å²	36.1	13%	0.133	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-14.3	173.9	78.7	0	0	0	0	114.7	P605 A606 H607 S611	P605-S609 PolarHBondContact O-N 3.33Å; A606-S609 WeakPolarHBondContact O-CB 3.39Å; A606-S609 PolarHBondContact O-N 2.75Å; A606-S609 PolarHBondContact O-OG 3.49Å; H607-S609 PolarHBondContact O-N 3.04Å; S609-S611 PolarHBondContact O-N 3.03Å; S609-S611 PolarHBondContact O-OG 3.31Å; S609-S611 PolarHBondContact OG-N 3.3Å
610	G	69.9	Low	77.5	Confident	19 Å²	19	32.1 Å²	32.1	20%	0.196	18%	0.179	C	C	.	.	S	Bend	trans	63	-15.3	-173.3	0	0	0	0	0	116	M560 V565 H607 R608	M560-G610 VanDerWaalsContact SD-CA 3.53Å; V565-G610 WeakPolarHBondContact CG2-O 3.49Å; H607-G610 PolarHBondContact O-N 3.12Å; R608-G610 VanDerWaalsContact C-N 3.34Å
611	S	77.3	Confident	77.5	Confident	20 Å²	20	31.4 Å²	31.4	14%	0.14	18%	0.175	C	C	.	.			trans	-93.4	-22.3	-162.3	-58.8	0	0	0	0	113.8	V565 S609 R658	V565-S611 WeakPolarHBondContact CG1-O 3.22Å; S609-S611 PolarHBondContact O-N 3.03Å; S609-S611 PolarHBondContact O-OG 3.31Å; S609-S611 PolarHBondContact OG-N 3.3Å; S611-R658 PolarHBondContact O-NH2 2.86Å
612	L	79.4	Confident	77.5	Confident	11 Å²	11	29.3 Å²	29.3	6%	0.058	17%	0.169	C	C	.	.			trans	-101.4	134.2	-170.6	-59.2	-179.8	0	0	0	111.4	V573 L575 L585 A606 L654 I656	V573-L612 HydrophobicContact CB-CD2 3.99Å; V573-L612 HydrophobicContact CG1-CD1 4.33Å; V573-L612 HydrophobicContact CG1-CD2 4.17Å; V573-L612 HydrophobicContact CG1-CG 4.17Å; V573-L612 HydrophobicContact CG2-CD2 3.71Å; V573-L612 HydrophobicContact CG2-CG 4.45Å; L575-L612 HydrophobicContact CD1-CD1 3.74Å; L575-L612 HydrophobicContact CD2-CD1 3.83Å; L575-L612 HydrophobicContact CG-CD1 4.16Å; L585-L612 HydrophobicContact CD1-CD1 4.29Å; L585-L612 HydrophobicContact CD2-CD1 4.23Å; A606-L612 HydrophobicContact CB-CD1 3.77Å; L612-L654 HydrophobicContact CD1-CD1 4.08Å; L612-I656 HydrophobicContact CD2-CD1 3.12Å
613	R	76.7	Confident	77.3	Confident	80 Å²	80	33.1 Å²	33.1	30%	0.302	19%	0.185	S	C	.	.			trans	-138.8	156.4	-175.5	-58.5	-175.7	-176.2	-179.2	2.2	111.4	D616	R613-D616 PolarHBondContact N-OD2 3.34Å; R613-D616 WeakPolarHBondContact O-CB 3.15Å; R613-D616 PolarHBondContact O-N 2.93Å
614	S	77.8	Confident	77.5	Confident	65 Å²	65	37.3 Å²	37.3	46%	0.455	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	135.9	166.1	50.6	0	0	0	0	110.4	I597 S598	I597-S614 CarbonylContact O-C 3.54Å; I597-S614 WeakPolarHBondContact O-CA 3.39Å; S598-S614 WeakPolarHBondContact O-CB 3.39Å
615	G	72.3	Confident	77.3	Confident	39 Å²	39	40 Å²	40	40%	0.402	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.5	-12	-173	0	0	0	0	0	114.7	I597	I597-G615 PolarHBondContact O-N 3.36Å
616	D	83.5	Confident	77.1	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.016	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-69	135.3	174.6	-77	-25	0	0	0	111.6	I597 R613 I656 R658	I597-D616 HydrophobicContact CB-CB 4.34Å; I597-D616 WeakPolarHBondContact CB-O 3.44Å; I597-D616 HydrophobicContact CD1-CB 4.01Å; I597-D616 HydrophobicContact CG1-CB 4.47Å; I597-D616 PolarHBondContact N-O 2.95Å; R613-D616 PolarHBondContact N-OD2 3.34Å; R613-D616 WeakPolarHBondContact O-CB 3.15Å; R613-D616 PolarHBondContact O-N 2.93Å; D616-I656 HydrophobicContact CB-CG2 3.74Å; D616-R658 VanDerWaalsContact CG-NH2 3.31Å; D616-R658 IonicContact OD1-CZ 3.4Å; D616-R658 VanDerWaalsContact OD1-CZ 3.31Å; D616-R658 IonicContact OD1-NE 2.68Å; D616-R658 PolarHBondContact OD1-NE 2.79Å; D616-R658 IonicContact OD1-NH2 2.72Å; D616-R658 PolarHBondContact OD1-NH2 3.19Å; D616-R658 VanDerWaalsContact OD1-NH2 3.08Å; D616-R658 IonicContact OD2-CZ 3.53Å; D616-R658 IonicContact OD2-NE 3.21Å; D616-R658 IonicContact OD2-NH2 3.49Å; D616-R658 PolarHBondContact OD2-NH2 2.87Å
617	I	83.9	Confident	76.3	Confident	34 Å²	34	47 Å²	47	17%	0.174	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	121.2	179.7	-51.6	-177.7	0	0	0	109.7	L595 V596 L619 I656 K657 I659	L595-I617 CarbonylContact O-C 3.51Å; L595-I617 WeakPolarHBondContact O-CA 3.27Å; L595-I617 WeakPolarHBondContact O-CG2 3.45Å; V596-I617 HydrophobicContact CG2-CG1 4.39Å; I617-L619 HydrophobicContact CG2-CD2 4.21Å; I617-I656 CarbonylContact O-C 3.56Å; I617-I656 VanDerWaalsContact O-CA 3.29Å; I617-I656 WeakPolarHBondContact O-CA 3.41Å; I617-K657 HydrophobicContact CB-CB 4.37Å; I617-K657 WeakPolarHBondContact CB-O 3.44Å; I617-K657 PolarHBondContact N-O 3.05Å; I617-K657 PolarHBondContact O-N 2.6Å; I617-I659 HydrophobicContact CD1-CD1 3.55Å; I617-I659 HydrophobicContact CD1-CG1 4.04Å
618	L	84.1	Confident	75.1	Confident	3 Å²	3	52.8 Å²	52.8	2%	0.016	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	123.5	175.8	-175	64.4	0	0	0	110.2	L595 V621 V626 V631 L654 I656	L595-L618 PolarHBondContact O-N 2.92Å; L618-V621 HydrophobicContact CD1-CG2 4.28Å; L618-V621 HydrophobicContact CD2-CG2 3.9Å; L618-V621 HydrophobicContact CG-CG2 4.4Å; L618-V626 HydrophobicContact CD2-CG1 4.38Å; L618-V626 HydrophobicContact CG-CG2 4.17Å; L618-V626 WeakPolarHBondContact O-CG2 2.99Å; L618-V631 HydrophobicContact CD2-CG1 4.35Å; L618-L654 HydrophobicContact CD1-CB 4.09Å; L618-L654 HydrophobicContact CD1-CD2 4.12Å; L618-I656 HydrophobicContact CD1-CG1 4.09Å
619	L	81.1	Confident	74.3	Confident	69 Å²	69	55.9 Å²	55.9	36%	0.361	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-37.3	179	-61.4	-174.1	0	0	0	112.9	V570 I617 P625 V626 T655 K657	V570-L619 HydrophobicContact CG1-CD1 4.2Å; V570-L619 HydrophobicContact CG2-CD1 4.43Å; I617-L619 HydrophobicContact CG2-CD2 4.21Å; L619-P625 WeakPolarHBondContact O-CA 3.5Å; L619-V626 WeakPolarHBondContact O-CG2 3.39Å; L619-V626 PolarHBondContact O-N 3.43Å; L619-T655 PolarHBondContact N-O 3.07Å; L619-K657 HydrophobicContact CD1-CB 3.88Å; L619-K657 HydrophobicContact CD2-CB 4.45Å; L619-K657 HydrophobicContact CG-CB 4.12Å
620	A	79.8	Confident	73.7	Confident	11 Å²	11	60.1 Å²	60.1	9%	0.091	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	155.2	177.7	0	0	0	0	0	112.8	H624 T655	A620-H624 CarbonylContact C-O 3.53Å; A620-H624 WeakPolarHBondContact CA-O 3.35Å; A620-H624 VanDerWaalsContact CB-O 3.3Å; A620-H624 WeakPolarHBondContact CB-O 3.02Å; A620-T655 PolarHBondContact N-O 2.92Å; A620-T655 PolarHBondContact O-N 3.49Å
621	V	82.5	Confident	73.4	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.012	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	123.1	171.3	-177.3	0	0	0	0	107.7	L618 Q623 H624 V626 L634 L635 T652 L654	L618-V621 HydrophobicContact CD1-CG2 4.28Å; L618-V621 HydrophobicContact CD2-CG2 3.9Å; L618-V621 HydrophobicContact CG-CG2 4.4Å; V621-Q623 PolarHBondContact O-N 3.45Å; V621-H624 PolarHBondContact N-O 3.19Å; V621-H624 WeakPolarHBondContact O-CB 3.45Å; V621-H624 PolarHBondContact O-N 3.45Å; V621-V626 HydrophobicContact CG2-CG1 3.96Å; V621-L634 HydrophobicContact CB-CB 4.36Å; V621-L634 HydrophobicContact CB-CD1 4.33Å; V621-L634 HydrophobicContact CG1-CB 4.31Å; V621-L635 HydrophobicContact CG2-CD2 4.25Å; V621-T652 HydrophobicContact CG1-CG2 3.69Å; V621-L654 HydrophobicContact CB-CD2 4.3Å; V621-L654 HydrophobicContact CG1-CD2 3.98Å; V621-L654 HydrophobicContact CG2-CD2 3.87Å
622	D	77.4	Confident	72.6	Confident	58 Å²	58	63.8 Å²	63.8	31%	0.31	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.3	49.3	-176.9	-70.5	-48.3	0	0	0	113.1	H624 T652 T653	D622-H624 PolarHBondContact O-N 2.72Å; D622-H624 PolarHBondContact O-ND1 3.02Å; D622-T652 WeakPolarHBondContact OD1-CA 3.15Å; D622-T652 WeakPolarHBondContact OD2-CA 3.35Å; D622-T652 WeakPolarHBondContact OD2-CB 3.36Å; D622-T652 WeakPolarHBondContact OD2-CG2 3.38Å; D622-T652 PolarHBondContact OD2-OG1 3.37Å; D622-T653 PolarHBondContact N-O 2.71Å; D622-T653 PolarHBondContact OD1-N 3.28Å
623	Q	68.7	Low	71.8	Confident	182 Å²	182	65.1 Å²	65.1	85%	0.85	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	0.2	-177	-52.7	173.6	106	0	0	116	V621	V621-Q623 PolarHBondContact O-N 3.45Å
624	H	73.3	Confident	71	Confident	88 Å²	88	62.9 Å²	62.9	41%	0.407	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	120	174.7	-61	76.4	0	0	0	110.4	A620 V621 D622 V626 F629	A620-H624 CarbonylContact C-O 3.53Å; A620-H624 WeakPolarHBondContact CA-O 3.35Å; A620-H624 VanDerWaalsContact CB-O 3.3Å; A620-H624 WeakPolarHBondContact CB-O 3.02Å; V621-H624 PolarHBondContact N-O 3.19Å; V621-H624 WeakPolarHBondContact O-CB 3.45Å; V621-H624 PolarHBondContact O-N 3.45Å; D622-H624 PolarHBondContact O-N 2.72Å; D622-H624 PolarHBondContact O-ND1 3.02Å; H624-V626 PolarHBondContact O-N 3Å; H624-F629 HydrophobicContact CB-CD2 4.4Å; H624-F629 HydrophobicContact CB-CE2 4.35Å; H624-F629 AromaticContact CD2-CZ 3.9Å
625	P	73	Confident	70.5	Confident	57 Å²	57	60.7 Å²	60.7	37%	0.37	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	125.6	-179.5	28.4	-33.8	0	0	0	110.7	L619 Q627 H628 F629	L619-P625 WeakPolarHBondContact O-CA 3.5Å; P625-Q627 PolarHBondContact O-N 2.66Å; P625-H628 PolarHBondContact O-N 2.93Å; P625-F629 WeakPolarHBondContact O-CD2 2.82Å
626	V	71.8	Confident	69.7	Low	7 Å²	7	64.8 Å²	64.8	4%	0.042	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-2.7	-172.3	-87.7	0	0	0	0	114.9	L595 L618 L619 V621 H624 H628 V631 L634	L595-V626 HydrophobicContact CD1-CB 3.65Å; L595-V626 HydrophobicContact CD1-CG2 3.77Å; L618-V626 HydrophobicContact CD2-CG1 4.38Å; L618-V626 HydrophobicContact CG-CG2 4.17Å; L618-V626 WeakPolarHBondContact O-CG2 2.99Å; L619-V626 WeakPolarHBondContact O-CG2 3.39Å; L619-V626 PolarHBondContact O-N 3.43Å; V621-V626 HydrophobicContact CG2-CG1 3.96Å; H624-V626 PolarHBondContact O-N 3Å; V626-H628 VanDerWaalsContact C-N 3.25Å; V626-H628 PolarHBondContact O-N 3.28Å; V626-V631 HydrophobicContact CB-CG2 4.43Å; V626-V631 HydrophobicContact CG1-CG1 4.35Å; V626-V631 HydrophobicContact CG1-CG2 4.34Å; V626-L634 HydrophobicContact CG1-CD1 4.1Å
627	Q	61.8	Low	68.1	Low	151 Å²	151	69.1 Å²	69.1	71%	0.706	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-19.5	176	-68.2	170	-25.6	0	0	114.2	P625	P625-Q627 PolarHBondContact O-N 2.66Å
628	H	52.7	Low	66.4	Low	157 Å²	157	76 Å²	76	73%	0.727	38%	0.379	S	S	*	.	S	Bend	trans	-125.1	5.1	-175.8	-63.1	-54.2	0	0	0	114.4	P625 V626	P625-H628 PolarHBondContact O-N 2.93Å; V626-H628 VanDerWaalsContact C-N 3.25Å; V626-H628 PolarHBondContact O-N 3.28Å
629	F	58.3	Low	64.5	Low	99 Å²	99	79.7 Å²	79.7	43%	0.434	42%	0.417	S	S	.	.	S	Bend	trans	-128.7	150.1	-173.8	-72	-94	0	0	0	111.6	H624 P625 V631 L634	H624-F629 HydrophobicContact CB-CD2 4.4Å; H624-F629 HydrophobicContact CB-CE2 4.35Å; H624-F629 AromaticContact CD2-CZ 3.9Å; P625-F629 WeakPolarHBondContact O-CD2 2.82Å; F629-V631 PolarHBondContact O-N 2.69Å; F629-V631 VanDerWaalsContact O-N 3.14Å; F629-L634 HydrophobicContact CB-CD1 3.52Å; F629-L634 HydrophobicContact CB-CG 4.27Å; F629-L634 HydrophobicContact CG-CD1 4.17Å
630	N	62.8	Low	62.4	Low	107 Å²	107	87.8 Å²	87.8	57%	0.572	44%	0.443	S	S	*	.			trans	-70.8	110.8	174.2	-175.5	-9.5	0	0	0	109.8	D632 A633 L634	N630-D632 VanDerWaalsContact C-N 3.29Å; N630-D632 PolarHBondContact O-N 2.81Å; N630-D632 WeakPolarHBondContact OD1-CB 3.37Å; N630-D632 PolarHBondContact OD1-N 3.38Å; N630-D632 VanDerWaalsContact OD1-N 3.09Å; N630-A633 HydrophobicContact CB-CB 3.96Å; N630-A633 WeakPolarHBondContact O-CA 3.45Å; N630-A633 WeakPolarHBondContact O-CB 3.47Å; N630-A633 PolarHBondContact O-N 3.19Å; N630-L634 PolarHBondContact O-N 2.84Å
631	V	64.3	Low	60.1	Low	23 Å²	23	91.7 Å²	91.7	14%	0.139	47%	0.469	C	S	.	.	H	α-helix	trans	-59.9	-39.3	-178.2	-162.5	0	0	0	0	111.8	L595 L618 V626 F629 A633 L634 L635	L595-V631 HydrophobicContact CD1-CG2 3.4Å; L595-V631 HydrophobicContact CD2-CG2 3.88Å; L595-V631 HydrophobicContact CG-CG2 4.27Å; L618-V631 HydrophobicContact CD2-CG1 4.35Å; V626-V631 HydrophobicContact CB-CG2 4.43Å; V626-V631 HydrophobicContact CG1-CG1 4.35Å; V626-V631 HydrophobicContact CG1-CG2 4.34Å; F629-V631 PolarHBondContact O-N 2.69Å; F629-V631 VanDerWaalsContact O-N 3.14Å; V631-A633 VanDerWaalsContact C-N 3.28Å; V631-A633 PolarHBondContact O-N 3.41Å; V631-L634 PolarHBondContact O-N 3.15Å; V631-L635 HydrophobicContact CG1-CD1 3.84Å; V631-L635 HydrophobicContact CG1-CG 4.27Å; V631-L635 WeakPolarHBondContact O-CB 3.15Å; V631-L635 WeakPolarHBondContact O-CG 3.47Å; V631-L635 PolarHBondContact O-N 3.1Å
632	D	60.7	Low	57.8	Low	93 Å²	93	101 Å²	101	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-65.8	-33	176	-95.3	-48.5	0	0	0	111.7	N630 K636	N630-D632 VanDerWaalsContact C-N 3.29Å; N630-D632 PolarHBondContact O-N 2.81Å; N630-D632 WeakPolarHBondContact OD1-CB 3.37Å; N630-D632 PolarHBondContact OD1-N 3.38Å; N630-D632 VanDerWaalsContact OD1-N 3.09Å; D632-K636 WeakPolarHBondContact O-CB 3.36Å; D632-K636 WeakPolarHBondContact O-CD 3.16Å; D632-K636 VanDerWaalsContact O-CG 3.26Å; D632-K636 WeakPolarHBondContact O-CG 3.35Å; D632-K636 PolarHBondContact O-N 3.41Å; D632-K636 WeakPolarHBondContact OD1-CE 3.42Å; D632-K636 IonicContact OD1-NZ 2.69Å; D632-K636 PolarHBondContact OD1-NZ 3.33Å
633	A	60.6	Low	55.6	Low	40 Å²	40	103.9 Å²	103.9	33%	0.331	53%	0.528	S	S	.	.	H	α-helix	trans	-68.5	-54	172.8	0	0	0	0	0	110.1	N630 V631 L635 K636 E637	N630-A633 HydrophobicContact CB-CB 3.96Å; N630-A633 WeakPolarHBondContact O-CA 3.45Å; N630-A633 WeakPolarHBondContact O-CB 3.47Å; N630-A633 PolarHBondContact O-N 3.19Å; V631-A633 VanDerWaalsContact C-N 3.28Å; V631-A633 PolarHBondContact O-N 3.41Å; A633-L635 VanDerWaalsContact C-N 3.31Å; A633-L635 PolarHBondContact O-N 2.81Å; A633-K636 CarbonylContact O-C 3.59Å; A633-K636 PolarHBondContact O-N 3.31Å; A633-K636 VanDerWaalsContact O-N 3.1Å; A633-E637 VanDerWaalsContact O-CA 3.29Å; A633-E637 WeakPolarHBondContact O-CA 3.16Å; A633-E637 VanDerWaalsContact O-CB 3.23Å; A633-E637 WeakPolarHBondContact O-CB 3.33Å; A633-E637 PolarHBondContact O-N 2.83Å
634	L	61.7	Low	54.2	Low	32 Å²	32	102 Å²	102	17%	0.168	53%	0.531	C	S	.	.	H	α-helix	trans	-60.3	-34.6	-178.1	-70.6	174.7	0	0	0	113.9	V621 V626 F629 N630 V631	V621-L634 HydrophobicContact CB-CB 4.36Å; V621-L634 HydrophobicContact CB-CD1 4.33Å; V621-L634 HydrophobicContact CG1-CB 4.31Å; V626-L634 HydrophobicContact CG1-CD1 4.1Å; F629-L634 HydrophobicContact CB-CD1 3.52Å; F629-L634 HydrophobicContact CB-CG 4.27Å; F629-L634 HydrophobicContact CG-CD1 4.17Å; N630-L634 PolarHBondContact O-N 2.84Å; V631-L634 PolarHBondContact O-N 3.15Å
635	L	66.2	Low	52.3	Low	19 Å²	19	101.5 Å²	101.5	10%	0.099	54%	0.538	C	S	.	.	H	α-helix	trans	-84.3	-10.7	178.9	-65.3	178.7	0	0	0	114.2	L583 V587 V621 V631 A633 L654	L583-L635 HydrophobicContact CD1-CD2 4.12Å; V587-L635 HydrophobicContact CG2-CD1 3.82Å; V621-L635 HydrophobicContact CG2-CD2 4.25Å; V631-L635 HydrophobicContact CG1-CD1 3.84Å; V631-L635 HydrophobicContact CG1-CG 4.27Å; V631-L635 WeakPolarHBondContact O-CB 3.15Å; V631-L635 WeakPolarHBondContact O-CG 3.47Å; V631-L635 PolarHBondContact O-N 3.1Å; A633-L635 VanDerWaalsContact C-N 3.31Å; A633-L635 PolarHBondContact O-N 2.81Å; L635-L654 HydrophobicContact CD2-CD2 4.35Å
636	K	56.1	Low	50.2	Low	126 Å²	126	107.1 Å²	107.1	55%	0.548	56%	0.559	S	S	.	*	H	α-helix	trans	-120.8	-11.8	-178.6	-61.6	169.8	175.5	159.2	0	114.1	R577 D632 A633 E638	R577-K636 PolarHBondContact NH2-O 3.09Å; D632-K636 WeakPolarHBondContact O-CB 3.36Å; D632-K636 WeakPolarHBondContact O-CD 3.16Å; D632-K636 VanDerWaalsContact O-CG 3.26Å; D632-K636 WeakPolarHBondContact O-CG 3.35Å; D632-K636 PolarHBondContact O-N 3.41Å; D632-K636 WeakPolarHBondContact OD1-CE 3.42Å; D632-K636 IonicContact OD1-NZ 2.69Å; D632-K636 PolarHBondContact OD1-NZ 3.33Å; A633-K636 CarbonylContact O-C 3.59Å; A633-K636 PolarHBondContact O-N 3.31Å; A633-K636 VanDerWaalsContact O-N 3.1Å; K636-E638 PolarHBondContact O-N 3.2Å
637	E	48.8	Very low	48.6	Very low	93 Å²	93	113 Å²	113	44%	0.435	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-51.4	122.6	-156.8	-138.3	-177.1	159.7	0	0	112.7	R577 A633	R577-E637 PolarHBondContact NH1-O 2.97Å; R577-E637 PolarHBondContact NH2-O 3.29Å; A633-E637 VanDerWaalsContact O-CA 3.29Å; A633-E637 WeakPolarHBondContact O-CA 3.16Å; A633-E637 VanDerWaalsContact O-CB 3.23Å; A633-E637 WeakPolarHBondContact O-CB 3.33Å; A633-E637 PolarHBondContact O-N 2.83Å
638	E	48.2	Very low	47.4	Very low	180 Å²	180	110 Å²	110	84%	0.841	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-75.6	144.5	173.7	-65.8	-175.2	116.6	0	0	109.6	K636 R640	K636-E638 PolarHBondContact O-N 3.2Å; E638-R640 PolarHBondContact O-N 2.62Å
639	G	44.3	Very low	47.1	Very low	79 Å²	79	106 Å²	106	81%	0.814	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-61.7	124	-154.9	0	0	0	0	0	116.2	S641	G639-S641 PolarHBondContact O-N 3.12Å
640	R	37.3	Very low	47.3	Very low	239 Å²	239	106.2 Å²	106.2	90%	0.902	59%	0.592	S	S	*	*			trans	-90.1	70.1	159.5	-95.7	-175.4	163.6	179.3	-2.4	112	E638	E638-R640 PolarHBondContact O-N 2.62Å
641	S	32.7	Very low	47.7	Very low	93 Å²	93	106.4 Å²	106.4	65%	0.65	59%	0.588	S	S	*	*			trans	-131.6	97	154	-173.1	0	0	0	0	110.3	G639 N643	G639-S641 PolarHBondContact O-N 3.12Å; S641-N643 PolarHBondContact O-N 3.24Å; S641-N643 VanDerWaalsContact O-N 3.11Å
642	Q	33	Very low	48.3	Very low	198 Å²	198	105.9 Å²	105.9	93%	0.925	58%	0.584	S	S	*	*			trans	-82.2	59.9	165.1	-72.3	-171.7	-12.6	0	0	110.1
643	N	31.9	Very low	49.2	Very low	119 Å²	119	103 Å²	103	64%	0.636	57%	0.57	S	S	*	*			trans	-152.8	114.9	167.9	-94.5	-43.6	0	0	0	110.1	S641 S645	S641-N643 PolarHBondContact O-N 3.24Å; S641-N643 VanDerWaalsContact O-N 3.11Å; N643-S645 VanDerWaalsContact C-N 3.28Å; N643-S645 PolarHBondContact O-N 3.34Å
644	P	38.5	Very low	50.2	Low	141 Å²	141	101.1 Å²	101.1	92%	0.916	56%	0.555	S	S	*	*			trans	-84.6	63.9	-177.1	35.2	-35.9	0	0	0	111.9
645	S	32.7	Very low	51.2	Low	78 Å²	78	101.2 Å²	101.2	55%	0.545	56%	0.557	S	S	.	*			trans	-147.5	141.6	170.7	54.2	0	0	0	0	111.9	N643	N643-S645 VanDerWaalsContact C-N 3.28Å; N643-S645 PolarHBondContact O-N 3.34Å
646	H	30.5	Very low	52.1	Low	175 Å²	175	100.3 Å²	100.3	81%	0.81	55%	0.552	S	S	*	*			trans	70.9	105.1	-176.9	-51.1	-77.6	0	0	0	116.1	S648	H646-S648 PolarHBondContact O-N 2.66Å
647	S	38.2	Very low	53.2	Low	131 Å²	131	98.7 Å²	98.7	92%	0.916	55%	0.545	S	S	*	.			trans	-81.4	82.7	163.9	55.6	0	0	0	0	110.3
648	S	36.1	Very low	54.7	Low	88 Å²	88	94.6 Å²	94.6	62%	0.615	53%	0.525	S	S	*	.			trans	-86.4	145.7	163.3	46.6	0	0	0	0	110.4	H646 D650	H646-S648 PolarHBondContact O-N 2.66Å; S648-D650 PolarHBondContact O-N 3.1Å
649	S	47.1	Very low	55.5	Low	73 Å²	73	90.9 Å²	90.9	51%	0.51	51%	0.51	S	S	.	.			trans	-73	115.4	170.4	45.1	0	0	0	0	110.4	F651	S649-F651 WeakPolarHBondContact O-CD2 3.32Å; S649-F651 PolarHBondContact O-N 2.76Å; S649-F651 VanDerWaalsContact OG-CE2 3.31Å; S649-F651 WeakPolarHBondContact OG-CE2 3.12Å
650	D	62.7	Low	55.9	Low	104 Å²	104	92.6 Å²	92.6	56%	0.556	51%	0.505	S	S	*	.			trans	-68.3	121.7	176.9	-65.9	-30.5	0	0	0	110.4	R577 S648	R577-D650 HydrophobicContact CB-CB 4.32Å; R577-D650 WeakPolarHBondContact CB-O 3.23Å; R577-D650 PolarHBondContact N-O 2.85Å; S648-D650 PolarHBondContact O-N 3.1Å
651	F	70.8	Confident	56.1	Low	110 Å²	110	84.6 Å²	84.6	48%	0.482	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127.4	173.2	-68.3	-88.4	0	0	0	109.5	L575 L576 S649	L575-F651 CarbonylContact O-C 3.54Å; L575-F651 VanDerWaalsContact O-CA 3.26Å; L575-F651 WeakPolarHBondContact O-CA 3.39Å; L576-F651 HydrophobicContact CB-CD1 4.09Å; L576-F651 HydrophobicContact CB-CE1 3.94Å; L576-F651 HydrophobicContact CD1-CD1 4.19Å; L576-F651 HydrophobicContact CD1-CE1 3.87Å; L576-F651 HydrophobicContact CD1-CZ 4.07Å; L576-F651 HydrophobicContact CG-CE1 4.41Å; S649-F651 WeakPolarHBondContact O-CD2 3.32Å; S649-F651 PolarHBondContact O-N 2.76Å; S649-F651 VanDerWaalsContact OG-CE2 3.31Å; S649-F651 WeakPolarHBondContact OG-CE2 3.12Å
652	T	75.7	Confident	56.4	Low	12 Å²	12	84.1 Å²	84.1	7%	0.074	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	128.7	171.6	-63.8	0	0	0	0	109.8	L575 L583 V621 D622 L654	L575-T652 PolarHBondContact N-O 2.8Å; L575-T652 PolarHBondContact O-N 2.82Å; L583-T652 HydrophobicContact CD1-CG2 3.7Å; V621-T652 HydrophobicContact CG1-CG2 3.69Å; D622-T652 WeakPolarHBondContact OD1-CA 3.15Å; D622-T652 WeakPolarHBondContact OD2-CA 3.35Å; D622-T652 WeakPolarHBondContact OD2-CB 3.36Å; D622-T652 WeakPolarHBondContact OD2-CG2 3.38Å; D622-T652 PolarHBondContact OD2-OG1 3.37Å; T652-L654 HydrophobicContact CG2-CD2 3.87Å; T652-L654 HydrophobicContact CG2-CG 4.44Å
653	T	80	Confident	56.2	Low	33 Å²	33	82.6 Å²	82.6	20%	0.202	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.8	176.8	-49.3	0	0	0	0	110.4	V573 K574 D622	V573-T653 CarbonylContact O-C 3.53Å; V573-T653 WeakPolarHBondContact O-CA 3.33Å; K574-T653 HydrophobicContact CG-CG2 4.09Å; D622-T653 PolarHBondContact N-O 2.71Å; D622-T653 PolarHBondContact OD1-N 3.28Å
654	L	82.8	Confident	56.2	Low	0 Å²	0	84.8 Å²	84.8	0%	0	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	120.3	178.5	-56.8	178	0	0	0	110	S572 V573 L575 L585 L612 L618 V621 L635 T652 I656	S572-L654 CarbonylContact C-O 3.59Å; S572-L654 VanDerWaalsContact CA-O 3.32Å; S572-L654 WeakPolarHBondContact CA-O 3.42Å; V573-L654 PolarHBondContact N-O 3.13Å; V573-L654 PolarHBondContact O-N 3.39Å; L575-L654 HydrophobicContact CD1-CD1 3.7Å; L575-L654 HydrophobicContact CG-CD1 4.33Å; L585-L654 HydrophobicContact CD1-CD1 3.42Å; L585-L654 VanDerWaalsContact CD1-CD1 3.42Å; L612-L654 HydrophobicContact CD1-CD1 4.08Å; L618-L654 HydrophobicContact CD1-CB 4.09Å; L618-L654 HydrophobicContact CD1-CD2 4.12Å; V621-L654 HydrophobicContact CB-CD2 4.3Å; V621-L654 HydrophobicContact CG1-CD2 3.98Å; V621-L654 HydrophobicContact CG2-CD2 3.87Å; L635-L654 HydrophobicContact CD2-CD2 4.35Å; T652-L654 HydrophobicContact CG2-CD2 3.87Å; T652-L654 HydrophobicContact CG2-CG 4.44Å; L654-I656 HydrophobicContact CB-CD1 3.93Å; L654-I656 HydrophobicContact CB-CG1 4.32Å
655	T	82.4	Confident	55.7	Low	34 Å²	34	85.5 Å²	85.5	21%	0.209	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	121.9	172.6	-51.2	0	0	0	0	109.3	V570 L619 A620	V570-T655 HydrophobicContact CG1-CG2 4Å; L619-T655 PolarHBondContact N-O 3.07Å; A620-T655 PolarHBondContact N-O 2.92Å; A620-T655 PolarHBondContact O-N 3.49Å
656	I	84.9	Confident	55.4	Low	0 Å²	0	87.4 Å²	87.4	0%	0	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	143	-165.9	-74	163.7	0	0	0	110.9	V570 F571 I597 L612 D616 I617 L618 L654	V570-I656 CarbonylContact C-O 3.47Å; V570-I656 VanDerWaalsContact CA-O 3.23Å; V570-I656 WeakPolarHBondContact CA-O 3.44Å; F571-I656 HydrophobicContact CE1-CG2 3.92Å; F571-I656 HydrophobicContact CE2-CG2 4.42Å; F571-I656 HydrophobicContact CZ-CB 4.38Å; F571-I656 HydrophobicContact CZ-CG2 3.78Å; F571-I656 PolarHBondContact N-O 2.82Å; F571-I656 PolarHBondContact O-N 2.89Å; I597-I656 HydrophobicContact CD1-CD1 4.1Å; L612-I656 HydrophobicContact CD2-CD1 3.12Å; D616-I656 HydrophobicContact CB-CG2 3.74Å; I617-I656 CarbonylContact O-C 3.56Å; I617-I656 VanDerWaalsContact O-CA 3.29Å; I617-I656 WeakPolarHBondContact O-CA 3.41Å; L618-I656 HydrophobicContact CD1-CG1 4.09Å; L654-I656 HydrophobicContact CB-CD1 3.93Å; L654-I656 HydrophobicContact CB-CG1 4.32Å
657	K	79.4	Confident	55.1	Low	93 Å²	93	88 Å²	88	40%	0.404	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	117.5	171.3	-178.4	174.2	-178.1	176.1	0	110.2	G569 V570 I617 L619 I659	G569-K657 CarbonylContact O-C 3.57Å; G569-K657 WeakPolarHBondContact O-CA 3.46Å; V570-K657 HydrophobicContact CG2-CB 4.03Å; V570-K657 HydrophobicContact CG2-CD 4.29Å; V570-K657 HydrophobicContact CG2-CG 3.98Å; I617-K657 HydrophobicContact CB-CB 4.37Å; I617-K657 WeakPolarHBondContact CB-O 3.44Å; I617-K657 PolarHBondContact N-O 3.05Å; I617-K657 PolarHBondContact O-N 2.6Å; L619-K657 HydrophobicContact CD1-CB 3.88Å; L619-K657 HydrophobicContact CD2-CB 4.45Å; L619-K657 HydrophobicContact CG-CB 4.12Å; K657-I659 HydrophobicContact CG-CG1 4.32Å
658	R	79.9	Confident	54.6	Low	6 Å²	6	87 Å²	87	2%	0.023	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	121.4	168.4	-176.6	171.5	-65.6	153.6	4.3	108.7	P566 A567 S568 G569 F571 S611 D616	P566-R658 PolarHBondContact O-NH1 3.1Å; A567-R658 WeakPolarHBondContact O-CD 3.27Å; S568-R658 CarbonylContact C-O 3.51Å; S568-R658 WeakPolarHBondContact CA-O 3.32Å; G569-R658 PolarHBondContact N-O 2.9Å; G569-R658 PolarHBondContact O-N 3.42Å; F571-R658 HydrophobicContact CE1-CB 3.99Å; S611-R658 PolarHBondContact O-NH2 2.86Å; D616-R658 VanDerWaalsContact CG-NH2 3.31Å; D616-R658 IonicContact OD1-CZ 3.4Å; D616-R658 VanDerWaalsContact OD1-CZ 3.31Å; D616-R658 IonicContact OD1-NE 2.68Å; D616-R658 PolarHBondContact OD1-NE 2.79Å; D616-R658 IonicContact OD1-NH2 2.72Å; D616-R658 PolarHBondContact OD1-NH2 3.19Å; D616-R658 VanDerWaalsContact OD1-NH2 3.08Å; D616-R658 IonicContact OD2-CZ 3.53Å; D616-R658 IonicContact OD2-NE 3.21Å; D616-R658 IonicContact OD2-NH2 3.49Å; D616-R658 PolarHBondContact OD2-NH2 2.87Å
659	I	64.8	Low	54.1	Low	103 Å²	103	87.3 Å²	87.3	53%	0.528	48%	0.483	S	S	.	.			trans	-83.8	-59.7	-177.3	-63.6	-173.8	0	0	0	109.9	S568 I617 K657	S568-I659 VanDerWaalsContact CB-O 3.3Å; S568-I659 WeakPolarHBondContact CB-O 3.33Å; I617-I659 HydrophobicContact CD1-CD1 3.55Å; I617-I659 HydrophobicContact CD1-CG1 4.04Å; K657-I659 HydrophobicContact CG-CG1 4.32Å
660	V	52.3	Low	53.3	Low	114 Å²	114	90.1 Å²	90.1	69%	0.691	50%	0.499	S	S	*	.	S	Bend	trans	-147.1	158.9	166	-173.7	0	0	0	0	107.1
661	L	42.6	Very low	51.6	Low	71 Å²	71	91.9 Å²	91.9	37%	0.372	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-65.5	130.5	166.8	-74.3	168.9	0	0	0	110.8
662	P	38.3	Very low	49.4	Very low	83 Å²	83	96.5 Å²	96.5	54%	0.539	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-72	156.5	159.1	32.3	-33.3	0	0	0	110.4
663	D	29.4	Very low	46.9	Very low	166 Å²	166	101 Å²	101	89%	0.888	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-60.8	140.7	-178.6	-71	-59.6	0	0	0	113.4	L665	D663-L665 PolarHBondContact O-N 3.2Å; D663-L665 VanDerWaalsContact O-N 3.09Å
664	F	30.4	Very low	44.3	Very low	166 Å²	166	106.9 Å²	106.9	73%	0.728	59%	0.585	S	S	*	*	S	Bend	trans	-77.1	91.5	-178.8	-89.8	-90.1	0	0	0	112.8
665	L	28	Very low	41.6	Very low	156 Å²	156	112.8 Å²	112.8	82%	0.817	63%	0.625	S	S	*	*	S	Bend	trans	-149.7	150.9	141.6	-82.6	-167.4	0	0	0	110.2	D663 M667	D663-L665 PolarHBondContact O-N 3.2Å; D663-L665 VanDerWaalsContact O-N 3.09Å; L665-M667 PolarHBondContact O-N 3.23Å
666	P	28.1	Very low	38.9	Very low	118 Å²	118	117.2 Å²	117.2	77%	0.766	65%	0.654	S	S	*	*			trans	-69.3	118.2	-178.9	27.9	-34	0	0	0	111.5	S668	P666-S668 PolarHBondContact O-N 2.9Å
667	M	24.3	Very low	36.2	Very low	188 Å²	188	122 Å²	122	93%	0.926	69%	0.694	S	S	*	*			trans	-69.2	91.8	170.1	-80.6	-72.3	-170.4	0	0	110.5	L665 S669	L665-M667 PolarHBondContact O-N 3.23Å; M667-S669 PolarHBondContact O-N 3.45Å; M667-S669 VanDerWaalsContact O-N 3.16Å
668	S	25.9	Very low	33.8	Very low	110 Å²	110	123.3 Å²	123.3	77%	0.769	72%	0.715	S	S	*	*			trans	-61.1	113.6	162.2	56.8	0	0	0	0	108.9	P666	P666-S668 PolarHBondContact O-N 2.9Å
669	S	27.4	Very low	31.1	Very low	94 Å²	94	126.8 Å²	126.8	66%	0.657	75%	0.752	S	S	*	*			trans	-65.1	132.5	-174.4	48.2	0	0	0	0	111.9	M667 I671	M667-S669 PolarHBondContact O-N 3.45Å; M667-S669 VanDerWaalsContact O-N 3.16Å; S669-I671 PolarHBondContact O-N 3.22Å
670	P	28.4	Very low	29.5	Very low	131 Å²	131	129.9 Å²	129.9	85%	0.851	77%	0.768	S	S	*	*			trans	-79.2	81.3	-176.7	31.5	-35.5	0	0	0	111.5	Y672	P670-Y672 VanDerWaalsContact C-N 3.33Å; P670-Y672 PolarHBondContact O-N 2.78Å; P670-Y672 VanDerWaalsContact O-N 3.07Å
671	I	27.1	Very low	28.2	Very low	141 Å²	141	131.5 Å²	131.5	72%	0.723	77%	0.773	S	S	*	*			trans	-74.4	90.8	159.8	-56.1	178.1	0	0	0	107.9	S669	S669-I671 PolarHBondContact O-N 3.22Å
672	Y	25.6	Very low	27.6	Very low	208 Å²	208	136.4 Å²	136.4	82%	0.816	80%	0.798	S	S	*	*				-175.8	116.1	128.9	-106.7	-69	0	0	0	111.1	P670	P670-Y672 VanDerWaalsContact C-N 3.33Å; P670-Y672 PolarHBondContact O-N 2.78Å; P670-Y672 VanDerWaalsContact O-N 3.07Å
673	S	23.8	Very low	27	Very low	106 Å²	106	135.5 Å²	135.5	74%	0.741	81%	0.805	S	S	*	*			trans	-75.1	131.8	163	40.5	0	0	0	0	110.2
674	N	25.4	Very low	27	Very low	157 Å²	157	137.4 Å²	137.4	84%	0.84	81%	0.81	S	S	*	*			trans	-173.6	93.5	150.1	-98.4	-31.2	0	0	0	111.2
675	C	25	Very low	26.9	Very low	123 Å²	123	133.1 Å²	133.1	83%	0.831	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-94.4	130.5	155.1	-72.7	0	0	0	0	108.1	A677	C675-A677 PolarHBondContact O-N 3.3Å
676	P	26.2	Very low	26.7	Very low	127 Å²	127	135 Å²	135	83%	0.825	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-67.9	131.9	173.4	28.8	-33.2	0	0	0	109.8
677	A	27.4	Very low	26.6	Very low	101 Å²	101	132.7 Å²	132.7	84%	0.835	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-73.8	134	-176	0	0	0	0	0	112.5	C675 G679	C675-A677 PolarHBondContact O-N 3.3Å; A677-G679 PolarHBondContact O-N 3.27Å; A677-G679 VanDerWaalsContact O-N 3.14Å
678	S	29	Very low	26.7	Very low	121 Å²	121	129.9 Å²	129.9	85%	0.846	81%	0.811	S	S	*	*			trans	-65.6	106.7	166.9	-61	0	0	0	0	110.1	I680	S678-I680 PolarHBondContact O-N 3.2Å
679	G	24.9	Very low	26.5	Very low	78 Å²	78	129.2 Å²	129.2	80%	0.804	81%	0.806	S	S	*	*			trans	-74.2	105.8	-179.6	0	0	0	0	0	113	A677	A677-G679 PolarHBondContact O-N 3.27Å; A677-G679 VanDerWaalsContact O-N 3.14Å
680	I	29.2	Very low	26.4	Very low	168 Å²	168	130.4 Å²	130.4	86%	0.862	81%	0.81	S	S	*	*			trans	-121.2	137.9	157.1	-55.2	-178.3	0	0	0	107.2	S678	S678-I680 PolarHBondContact O-N 3.2Å
681	N	25.4	Very low	26.1	Very low	149 Å²	149	128.9 Å²	128.9	80%	0.797	80%	0.802	S	S	*	*			trans	-96.8	177.5	-166.4	-158.6	-8.2	0	0	0	111.9
682	L	30.3	Very low	26.1	Very low	173 Å²	173	128.4 Å²	128.4	91%	0.906	81%	0.806	S	S	*	*			trans	84.6	130.8	-172.6	-49.7	160.2	0	0	0	113.5
683	G	26.7	Very low	26	Very low	65 Å²	65	125.2 Å²	125.2	67%	0.67	80%	0.803	S	S	*	*			cis	156.9	113.4	-13.4	0	0	0	0	0	114.1
684	M	28.6	Very low	26.1	Very low	205 Å²	205	128.6 Å²	128.6	100%	1.01	81%	0.807	S	S	*	*			trans	65.9	151.2	177	-56.2	169.6	171.6	0	0	115.4
685	G	27.5	Very low	26.1	Very low	76 Å²	76	127.1 Å²	127.1	78%	0.784	80%	0.799	S	S	*	*			cis	-174	163.2	-5.5	0	0	0	0	0	113.3
686	M	25.6	Very low	26.1	Very low	196 Å²	196	128.8 Å²	128.8	97%	0.966	80%	0.799	S	S	*	*			trans	-30.6	148.7	-178	-79.1	-75.7	-162.6	0	0	121.5
687	G	25.8	Very low	26	Very low	70 Å²	70	132.8 Å²	132.8	72%	0.722	80%	0.799	S	S	*	*			trans	140.5	101.1	159.8	0	0	0	0	0	113
688	V	25.2	Very low	25.7	Very low	129 Å²	129	132.1 Å²	132.1	78%	0.782	79%	0.788	S	S	*	*				91.8	95	55.2	178.1	0	0	0	0	114.6
689	S	22.6	Very low	25.5	Very low	96 Å²	96	131.6 Å²	131.6	67%	0.671	79%	0.785	S	S	*	*			trans	75.3	159.8	142.5	75.7	0	0	0	0	124.5
690	T	23.8	Very low	25.5	Very low	118 Å²	118	131.6 Å²	131.6	72%	0.724	78%	0.777	S	S	*	*			trans	74.9	94.7	152.3	45.9	0	0	0	0	122.2
691	S	22.7	Very low	25.2	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	78%	0.776	S	S	*	*				69.3	167.6	115.1	68.2	0	0	0	0	123.2
692	T	26.5	Very low	25.2	Very low	132 Å²	132	132.2 Å²	132.2	81%	0.81	77%	0.771	S	S	*	*			trans	89.8	135.9	166.4	62.2	0	0	0	0	118.8
693	D	24.9	Very low	24.9	Very low	141 Å²	141	131 Å²	131	75%	0.754	77%	0.771	S	S	*	*			trans	-80.5	153.9	179.2	-39.6	-103	0	0	0	111.5
694	H	25.9	Very low	24.9	Very low	177 Å²	177	132.7 Å²	132.7	82%	0.819	78%	0.779	S	S	*	*				-174.1	163.7	111.1	-107.1	-61.4	0	0	0	114.1
695	D	24.7	Very low	24.6	Very low	126 Å²	126	126.1 Å²	126.1	67%	0.674	76%	0.764	S	S	*	*			trans	-70	156.9	176.1	-34.4	-107.9	0	0	0	112.9
696	L	25.3	Very low	24.6	Very low	157 Å²	157	131.4 Å²	131.4	82%	0.822	77%	0.765	S	S	*	*				156.6	119.1	118.5	-84.2	-177.8	0	0	0	115.4
697	Y	23.3	Very low	24.7	Very low	211 Å²	211	131.6 Å²	131.6	83%	0.827	76%	0.756	S	S	*	*				74.3	130	123.7	-128.4	-119.4	0	0	0	123.8
698	S	22	Very low	24.6	Very low	88 Å²	88	132.1 Å²	132.1	62%	0.615	75%	0.754	S	S	*	*			trans	66.3	111.2	142.5	-76.3	0	0	0	0	123.8
699	S	24	Very low	24.6	Very low	110 Å²	110	132.5 Å²	132.5	77%	0.769	75%	0.752	S	S	*	*				56.5	112.8	102.1	-157.4	0	0	0	0	121.1
700	A	25	Very low	24.7	Very low	78 Å²	78	133.8 Å²	133.8	65%	0.645	76%	0.759	S	S	*	*			trans	48.7	133.3	138.2	0	0	0	0	0	122
701	Y	24.5	Very low	24.8	Very low	216 Å²	216	134.7 Å²	134.7	85%	0.847	76%	0.764	S	S	*	*				-173.3	129.1	98.9	-115.6	-102.6	0	0	0	114.5
702	V	24.5	Very low	24.8	Very low	114 Å²	114	134.7 Å²	134.7	69%	0.691	76%	0.764	S	S	*	*			trans	24.4	130.6	140.1	-177.5	0	0	0	0	121.6
703	T	24.3	Very low	24.8	Very low	146 Å²	146	135.1 Å²	135.1	90%	0.896	76%	0.761	S	S	*	*				-151.1	158.6	128.3	-18.5	0	0	0	0	111.2
704	A	25.7	Very low	24.7	Very low	101 Å²	101	136.7 Å²	136.7	84%	0.835	76%	0.761	S	S	*	*			trans	-147.2	156	-168	0	0	0	0	0	115.2
705	G	23.6	Very low	24.6	Very low	67 Å²	67	133.3 Å²	133.3	69%	0.691	76%	0.758	S	S	*	*			trans	179.6	100.5	174	0	0	0	0	0	110.3
706	K	26.6	Very low	24.6	Very low	188 Å²	188	138.8 Å²	138.8	82%	0.817	77%	0.769	S	S	*	*				70.4	128.9	73.9	-64	-147.6	177.8	-174.3	0	113.6
707	Y	27.5	Very low	24.6	Very low	199 Å²	199	137.6 Å²	137.6	78%	0.78	77%	0.768	S	S	*	*			cis	-164.7	-178.8	-0.7	-138.2	-101.8	0	0	0	111.9
708	A	24.6	Very low	24.9	Very low	82 Å²	82	133.4 Å²	133.4	68%	0.678	77%	0.767	S	S	*	*			trans	92.1	76.4	153.5	0	0	0	0	0	122.1
709	D	25.6	Very low	24.9	Very low	137 Å²	137	138 Å²	138	73%	0.733	78%	0.778	S	S	*	*				26.1	135.1	120.7	-47.7	-63.8	0	0	0	123
710	C	23.8	Very low	25.3	Very low	122 Å²	122	138.8 Å²	138.8	82%	0.824	78%	0.781	S	S	*	*				-174.1	122.7	101.3	50.3	0	0	0	0	117.2
711	V	25.3	Very low	25.3	Very low	137 Å²	137	142.2 Å²	142.2	83%	0.83	79%	0.789	S	S	*	*			trans	37.8	105.7	136.1	-169.1	0	0	0	0	122.2
712	S	24.2	Very low	25.4	Very low	99 Å²	99	141.8 Å²	141.8	69%	0.692	79%	0.787	S	S	*	*				47.5	123	129.4	-157.7	0	0	0	0	123.1
713	L	24.6	Very low	25.5	Very low	142 Å²	142	144.4 Å²	144.4	74%	0.743	79%	0.789	S	S	*	*				172.1	140.5	107.7	-89.8	170.7	0	0	0	115.1
714	K	23.5	Very low	25.5	Very low	174 Å²	174	147.5 Å²	147.5	76%	0.757	78%	0.784	S	S	*	*			trans	55.9	104	145.2	-71.8	172	178.1	175.5	0	122.9
715	S	24	Very low	25.4	Very low	106 Å²	106	149 Å²	149	74%	0.741	78%	0.783	S	S	*	*				89.7	151.5	109.1	81	0	0	0	0	123.8
716	R	24.1	Very low	26	Very low	241 Å²	241	150.7 Å²	150.7	91%	0.909	78%	0.782	S	S	*	*			trans	86.1	153.3	154.8	-82.3	-171.9	170.9	-145.7	-3.6	121.2
717	T	26.1	Very low	25.9	Very low	132 Å²	132	146.2 Å²	146.2	81%	0.81	77%	0.774	S	S	*	*			trans	-94.4	153.4	-168.6	45.9	0	0	0	0	113.3
718	P	29.5	Very low	25.8	Very low	123 Å²	123	144.5 Å²	144.5	80%	0.799	78%	0.775	S	S	*	*			trans	-101.9	148.8	164.6	36.4	-29.9	0	0	0	113.4
719	Q	23	Very low	26	Very low	184 Å²	184	146.7 Å²	146.7	86%	0.86	78%	0.775	S	S	*	*			trans	-114.8	155.6	151.8	-91.5	-171	-30	0	0	108.2
720	P	32.2	Very low	26	Very low	126 Å²	126	148 Å²	148	82%	0.818	78%	0.782	S	S	*	*			trans	-92.2	150	175.9	35.4	-33.2	0	0	0	113.8
721	D	24.5	Very low	26.1	Very low	151 Å²	151	145.5 Å²	145.5	81%	0.807	77%	0.771	S	S	*	*			trans	-88.8	178.6	-171.2	-47.2	-91.1	0	0	0	116
722	Y	25.7	Very low	26.1	Very low	207 Å²	207	144.2 Å²	144.2	81%	0.812	77%	0.768	S	S	*	*			trans	-145.5	140.3	150.5	-107.8	-68.8	0	0	0	114.2
723	F	27.5	Very low	26.3	Very low	168 Å²	168	146.3 Å²	146.3	74%	0.737	77%	0.77	S	S	*	*			trans	74.3	62.8	162	-73.6	-70.3	0	0	0	123
724	R	23.5	Very low	26.3	Very low	212 Å²	212	147.6 Å²	147.6	80%	0.8	77%	0.773	S	S	*	*				61.4	101.7	102.2	-173.6	176.8	-112.9	-173.6	-1.8	121.9
725	V	23.7	Very low	26.4	Very low	131 Å²	131	144.5 Å²	144.5	79%	0.794	77%	0.773	S	S	*	*				68.3	154.9	120.9	167.9	0	0	0	0	119.2
726	P	37.3	Very low	26.4	Very low	104 Å²	104	145.2 Å²	145.2	68%	0.675	77%	0.772	S	S	*	*			cis	-130.9	178.8	8.3	25.8	-1.3	0	0	0	119.3
727	S	23.7	Very low	26.4	Very low	94 Å²	94	141 Å²	141	66%	0.657	76%	0.763	S	S	*	*			trans	74.2	114.7	147	52.2	0	0	0	0	120.6
728	M	26.3	Very low	26.3	Very low	162 Å²	162	142 Å²	142	80%	0.798	76%	0.763	S	S	*	*				85.1	132	90.2	-70.3	171.7	89.7	0	0	113.1
729	D	26.8	Very low	26	Very low	128 Å²	128	146.8 Å²	146.8	68%	0.684	77%	0.765	S	S	*	*			cis	-152.1	152.7	-0.4	-87.3	-35.1	0	0	0	112.4
730	D	26.3	Very low	26	Very low	164 Å²	164	143.1 Å²	143.1	88%	0.877	76%	0.76	S	S	*	*			trans	39.8	171.6	144	-144.8	4	0	0	0	124.7
731	A	26.9	Very low	25.6	Very low	71 Å²	71	140.5 Å²	140.5	59%	0.587	76%	0.755	S	S	*	*			trans	79.1	76.4	155.3	0	0	0	0	0	121.5
732	S	25.5	Very low	25.8	Very low	109 Å²	109	139.8 Å²	139.8	76%	0.762	76%	0.763	S	S	*	*				46.1	141.3	116.8	65.4	0	0	0	0	124.8
733	L	27.4	Very low	25.8	Very low	143 Å²	143	132.8 Å²	132.8	75%	0.749	75%	0.753	S	S	*	*			trans	78.1	114.5	153.5	-67.9	169.1	0	0	0	122.7
734	Q	24.3	Very low	26	Very low	169 Å²	169	130.1 Å²	130.1	79%	0.79	76%	0.755	S	S	*	*			trans	55.7	135.3	131.3	-67.5	-177.3	-13.2	0	0	123.7
735	S	25.3	Very low	26.4	Very low	109 Å²	109	127.7 Å²	127.7	76%	0.762	76%	0.758	S	S	*	*			trans	104.8	124.9	136.7	80.8	0	0	0	0	121.6
736	V	24.8	Very low	26.7	Very low	121 Å²	121	124.9 Å²	124.9	73%	0.733	76%	0.755	S	S	*	*				64.9	116.3	126	176.8	0	0	0	0	121.4
737	Q	23.5	Very low	26.4	Very low	152 Å²	152	123.6 Å²	123.6	71%	0.71	76%	0.761	S	S	*	*			trans	51.2	128.6	148.5	-93.1	77.7	-28.9	0	0	124.3
738	L	25.4	Very low	27	Very low	154 Å²	154	125.7 Å²	125.7	81%	0.806	77%	0.765	S	S	*	*			trans	80.7	127.2	130.3	-73.7	166.9	0	0	0	123.5
739	R	22.1	Very low	27.5	Very low	223 Å²	223	126 Å²	126	84%	0.842	76%	0.764	S	S	*	*			trans	92.4	114.1	135.4	-111.3	-172.7	-178.4	-164.1	0.3	122
740	S	23.8	Very low	28	Very low	107 Å²	107	124.2 Å²	124.2	75%	0.748	77%	0.768	S	S	*	*			trans	57.1	115.5	131.7	61.1	0	0	0	0	122.4
741	G	23.6	Very low	28.4	Very low	71 Å²	71	120.8 Å²	120.8	73%	0.732	76%	0.762	S	S	*	*				118.6	124.4	97.7	0	0	0	0	0	119.4
742	S	28.4	Very low	28.6	Very low	137 Å²	137	124.5 Å²	124.5	96%	0.958	77%	0.772	S	S	*	*			trans	63.1	150.1	163.3	-64.9	0	0	0	0	118.9
743	G	26.7	Very low	28.8	Very low	59 Å²	59	123.1 Å²	123.1	61%	0.608	76%	0.763	S	S	*	*			cis	152	167.4	-8.1	0	0	0	0	0	113.7
744	S	31.7	Very low	28.6	Very low	112 Å²	112	127.8 Å²	127.8	78%	0.783	77%	0.77	S	S	*	*			trans	67.5	160.2	175.3	84	0	0	0	0	115.6
745	N	30.9	Very low	28.7	Very low	162 Å²	162	123.8 Å²	123.8	87%	0.866	76%	0.761	S	S	*	*			cis	-162.5	162.7	-16.8	-110.2	-4.7	0	0	0	107
746	G	30.8	Very low	28.7	Very low	71 Å²	71	125.3 Å²	125.3	73%	0.732	77%	0.766	S	S	*	*			cis	158.3	162.1	-3.8	0	0	0	0	0	111.9
747	G	30.1	Very low	28.7	Very low	77 Å²	77	123 Å²	123	79%	0.794	77%	0.766	S	S	*	*			trans	98.9	157.7	167.6	0	0	0	0	0	117.4
748	N	37.3	Very low	28.7	Very low	139 Å²	139	122.2 Å²	122.2	74%	0.743	77%	0.771	S	S	*	*			cis	-163.4	155.8	-5	-150.4	0.7	0	0	0	114.8
749	Q	36.8	Very low	28.7	Very low	167 Å²	167	121.6 Å²	121.6	78%	0.78	77%	0.769	S	S	*	*			trans	65.7	151	160.7	-70.8	170.2	61.6	0	0	119.9
750	A	35.8	Very low	28.9	Very low	92 Å²	92	115.5 Å²	115.5	76%	0.76	76%	0.761	S	S	*	*			cis	-177.3	159.8	-19.9	0	0	0	0	0	108.5
751	A	35	Very low	28.9	Very low	91 Å²	91	121.9 Å²	121.9	75%	0.752	77%	0.768	S	S	*	*			cis	-132.3	-125	-15.1	0	0	0	0	0	106.5
752	N	31.7	Very low	29	Very low	149 Å²	149	122 Å²	122	80%	0.797	76%	0.758	S	S	*	*			cis	-168.1	155	-17.8	-139.4	-2.4	0	0	0	104.8
753	S	29.5	Very low	28.8	Very low	81 Å²	81	125.8 Å²	125.8	57%	0.566	75%	0.753	S	S	*	*			cis	-157.9	-164.3	-8.3	-137.2	0	0	0	0	106.1
754	W	23.7	Very low	28.6	Very low	240 Å²	240	129.3 Å²	129.3	91%	0.909	76%	0.762	S	S	*	*			cis	-155.6	-143.7	8.8	-140.3	-20.3	0	0	0	111.9
755	S	26.4	Very low	28.3	Very low	85 Å²	85	128 Å²	128	59%	0.594	76%	0.758	S	S	*	*			trans	-76.2	162.6	179.3	47.6	0	0	0	0	117.5
756	T	25.3	Very low	29.5	Very low	142 Å²	142	126 Å²	126	87%	0.871	75%	0.754	S	S	*	*			cis	-174.9	146.1	-13.2	34.6	0	0	0	0	111.4
757	G	23.5	Very low	30.6	Very low	71 Å²	71	127.5 Å²	127.5	73%	0.732	75%	0.751	S	S	*	*			trans	117.7	138	134.7	0	0	0	0	0	122
758	V	25.3	Very low	30.3	Very low	136 Å²	136	130.1 Å²	130.1	82%	0.824	75%	0.747	S	S	*	*			trans	70.2	123.4	153.5	-136.7	0	0	0	0	121.6
759	N	24.7	Very low	29.8	Very low	141 Å²	141	128 Å²	128	75%	0.754	74%	0.739	S	S	*	*			trans	32.5	149.7	149.1	-75.9	-25.6	0	0	0	123.7
760	S	24.9	Very low	29.2	Very low	96 Å²	96	128.6 Å²	128.6	67%	0.671	74%	0.742	S	S	*	*			cis	-177.9	145.6	-22.4	-110	0	0	0	0	109.9
761	R	24.6	Very low	28.8	Very low	240 Å²	240	129.4 Å²	129.4	91%	0.906	74%	0.742	S	S	*	*			trans	64	150.7	165.9	-76.1	-171.4	168.9	173	-4.6	118.8
762	S	25.1	Very low	28.3	Very low	74 Å²	74	132.3 Å²	132.3	52%	0.517	74%	0.744	S	S	.	*			cis	-178.1	146.6	-25.3	51.4	0	0	0	0	112.7
763	Y	24.1	Very low	28	Very low	217 Å²	217	130.4 Å²	130.4	85%	0.851	74%	0.738	S	S	*	*			trans	66.1	156.8	147.9	-59.7	-34.2	0	0	0	118.3
764	V	24.4	Very low	27.8	Very low	132 Å²	132	131.9 Å²	131.9	80%	0.8	74%	0.744	S	S	*	*			cis	-144.2	168.1	-10.7	110.2	0	0	0	0	110.1
765	A	25.4	Very low	27.8	Very low	84 Å²	84	128.6 Å²	128.6	69%	0.694	74%	0.738	S	S	*	*			trans	-93.4	-160.7	-177.5	0	0	0	0	0	111.7
766	P	55.9	Low	28	Very low	120 Å²	120	131.1 Å²	131.1	78%	0.779	74%	0.744	S	S	*	*			trans	-98.9	-137.2	-160.1	31.6	-10.2	0	0	0	109.6
767	P	53.4	Low	28.5	Very low	103 Å²	103	129.7 Å²	129.7	67%	0.669	74%	0.738	S	S	*	*			cis	-139.9	-131.1	-4.9	34.3	-7.1	0	0	0	112.8
768	N	24.3	Very low	28.7	Very low	132 Å²	132	134.2 Å²	134.2	71%	0.706	74%	0.74	S	S	*	*			trans	84.6	143	162.2	-70.1	1.8	0	0	0	118.5
769	T	25.2	Very low	28.9	Very low	96 Å²	96	136.1 Å²	136.1	59%	0.589	74%	0.739	S	S	*	*			cis	-166.3	165.8	-20.3	13.4	0	0	0	0	111.1
770	Q	25.1	Very low	29.1	Very low	179 Å²	179	137.3 Å²	137.3	84%	0.836	74%	0.74	S	S	*	*			trans	74.1	148.2	144.5	-78.9	163.8	22.8	0	0	120.7
771	S	27	Very low	29.2	Very low	108 Å²	108	139.2 Å²	139.2	76%	0.755	74%	0.743	S	S	*	*			trans	-100.9	149.7	163.4	-36.4	0	0	0	0	109.3
772	L	24.9	Very low	29.3	Very low	153 Å²	153	135.2 Å²	135.2	80%	0.801	74%	0.735	S	S	*	*			trans	-175.8	120.1	146	-117.4	75.3	0	0	0	105.6
773	T	25.2	Very low	29.4	Very low	108 Å²	108	138.8 Å²	138.8	66%	0.663	74%	0.743	S	S	*	*				66.2	172.2	96	68.1	0	0	0	0	116.6
774	T	25	Very low	29.4	Very low	113 Å²	113	136 Å²	136	69%	0.693	74%	0.738	S	S	*	*			trans	81.8	110.4	159.5	36.3	0	0	0	0	120.7
775	E	23.7	Very low	29.4	Very low	171 Å²	171	136.6 Å²	136.6	80%	0.799	73%	0.732	S	S	*	*			trans	71.8	150.5	140	-46	-35.9	100.7	0	0	124.7
776	L	31.6	Very low	29.3	Very low	137 Å²	137	140.3 Å²	140.3	72%	0.717	74%	0.737	S	S	*	*			trans	-82.8	169.6	165.1	-65.4	160.8	0	0	0	110.4
777	P	34.7	Very low	28.1	Very low	113 Å²	113	145 Å²	145	73%	0.734	74%	0.741	S	S	*	*				-125.1	165.5	80.3	18.7	1.6	0	0	0	112
778	E	28.3	Very low	27.6	Very low	165 Å²	165	146 Å²	146	77%	0.771	75%	0.748	S	S	*	*			cis	77.2	157.5	32.4	-62.6	-166	160.5	0	0	115.6
779	E	28.8	Very low	27.5	Very low	176 Å²	176	142.4 Å²	142.4	82%	0.822	74%	0.741	S	S	*	*			trans	71	137.2	-169.7	-61.9	176.8	-158.5	0	0	117.2
780	E	29.3	Very low	27.7	Very low	166 Å²	166	148.2 Å²	148.2	78%	0.776	75%	0.754	S	S	*	*			cis	-165.6	179.1	-30	-127.7	165.6	-168.5	0	0	111.1
781	D	27.2	Very low	27.6	Very low	136 Å²	136	147.8 Å²	147.8	73%	0.727	75%	0.752	S	S	*	*			trans	61.2	125.4	170.9	-60.4	-18.2	0	0	0	119.3
782	E	27.8	Very low	27.5	Very low	157 Å²	157	149 Å²	149	73%	0.734	75%	0.749	S	S	*	*				76	142.5	52.4	-63	-153.9	162.3	0	0	113.7
783	Q	25.3	Very low	27.6	Very low	148 Å²	148	148.1 Å²	148.1	69%	0.692	75%	0.746	S	S	*	*			cis	-161.5	144	24.3	-138.9	160.7	59.4	0	0	111.5
784	E	25	Very low	27.6	Very low	159 Å²	159	153.8 Å²	153.8	74%	0.743	76%	0.755	S	S	*	*			trans	52.7	165.4	147.7	-70.2	-163.3	141.5	0	0	122.3
785	Q	24.2	Very low	27.7	Very low	145 Å²	145	159.2 Å²	159.2	68%	0.678	76%	0.764	S	S	*	*			cis	-159.3	168.7	11.3	-139.3	171.9	74.7	0	0	113.2
786	M	22.7	Very low	27.7	Very low	161 Å²	161	155.4 Å²	155.4	79%	0.793	76%	0.762	S	S	*	*			trans	73.2	129	156.6	-68.2	-159.3	69.9	0	0	124.7
787	Y	31	Very low	27.6	Very low	219 Å²	219	154.7 Å²	154.7	86%	0.859	77%	0.768	S	S	*	*			trans	-102.5	-172	156.3	-84.5	-85.4	0	0	0	109.7
788	P	42.4	Very low	27.3	Very low	125 Å²	125	156.4 Å²	156.4	81%	0.812	78%	0.776	S	S	*	*			cis	-136.6	-172.2	-1.2	43.3	-25.6	0	0	0	116.1
789	G	23.8	Very low	27.1	Very low	56 Å²	56	155.5 Å²	155.5	58%	0.577	78%	0.777	S	S	*	*			trans	155	123.1	148.8	0	0	0	0	0	120.5
790	Y	28	Very low	26.9	Very low	218 Å²	218	151.7 Å²	151.7	86%	0.855	77%	0.769	S	S	*	*			trans	40.1	132.1	154.6	62.3	-94	0	0	0	122.2
791	E	24	Very low	26.8	Very low	169 Å²	169	150.6 Å²	150.6	79%	0.79	77%	0.774	S	S	*	*				69.3	140.5	58.4	-80.2	-153.9	159.8	0	0	115.8
792	L	25.6	Very low	26.7	Very low	133 Å²	133	148.9 Å²	148.9	70%	0.696	78%	0.778	S	S	*	*			cis	-163.9	151.6	-9.4	-171.2	72.7	0	0	0	110.7
793	N	27.2	Very low	26.8	Very low	136 Å²	136	149.5 Å²	149.5	73%	0.727	79%	0.786	S	S	*	*			trans	3.3	135.5	164.4	-76	-48.4	0	0	0	122.1
794	R	23.2	Very low	27.1	Very low	227 Å²	227	148 Å²	148	86%	0.857	79%	0.789	S	S	*	*				-173.7	123.6	117.6	-110.4	173.3	-83.7	-177.4	-6.7	118.3
795	Y	27.1	Very low	27.3	Very low	226 Å²	226	145 Å²	145	89%	0.886	78%	0.783	S	S	*	*			trans	61.7	134.7	132.3	-96	-103.5	0	0	0	124.8
796	A	24.8	Very low	27.5	Very low	91 Å²	91	144.2 Å²	144.2	75%	0.752	79%	0.79	S	S	*	*			trans	114.1	128.9	131.5	0	0	0	0	0	118.8
797	S	29.6	Very low	27.5	Very low	122 Å²	122	143.8 Å²	143.8	85%	0.853	79%	0.789	S	S	*	*			trans	-74	150.6	-176.7	-34.4	0	0	0	0	114.4
798	V	27.6	Very low	27.4	Very low	149 Å²	149	140.1 Å²	140.1	90%	0.903	78%	0.779	S	S	*	*			trans	-135.7	152.9	153	-169.2	0	0	0	0	107.3
799	D	23.9	Very low	26.5	Very low	146 Å²	146	139.3 Å²	139.3	78%	0.781	77%	0.768	S	S	*	*			trans	-124	166.2	-168.1	-148.7	-18	0	0	0	112.1
800	C	25.5	Very low	26.5	Very low	97 Å²	97	146.4 Å²	146.4	66%	0.655	78%	0.783	S	S	*	*			trans	74.6	123	162.4	-70.5	0	0	0	0	122.4
801	T	26.8	Very low	26.5	Very low	143 Å²	143	141 Å²	141	88%	0.877	77%	0.773	S	S	*	*			trans	88.5	150.7	138.1	60.7	0	0	0	0	123.4
802	A	25.8	Very low	26.5	Very low	100 Å²	100	144.3 Å²	144.3	83%	0.826	78%	0.779	S	S	*	*			trans	89.9	95.1	168.1	0	0	0	0	0	119.9
803	L	30	Very low	26.4	Very low	169 Å²	169	141 Å²	141	89%	0.885	78%	0.777	S	S	*	*			trans	-81.6	147.5	144.8	-78.9	166.8	0	0	0	108.7
804	P	30.2	Very low	26.4	Very low	116 Å²	116	140.2 Å²	140.2	75%	0.753	78%	0.782	S	S	*	*				-152	-159.3	89.1	37.6	-15.3	0	0	0	112.9
805	P	30.4	Very low	26.4	Very low	96 Å²	96	134.4 Å²	134.4	62%	0.623	78%	0.783	S	S	*	*				-128.6	174.3	-66.7	39.1	-25.1	0	0	0	113.4
806	P	27.5	Very low	26.3	Very low	129 Å²	129	128.9 Å²	128.9	84%	0.838	78%	0.784	S	S	*	*			trans	-96.7	128.5	162.7	34.4	-28.7	0	0	0	113
807	M	23.3	Very low	26.3	Very low	153 Å²	153	130.3 Å²	130.3	75%	0.754	79%	0.789	S	S	*	*			trans	-156.3	152.9	175	-75.2	-152.7	-51.1	0	0	108.9
808	E	27.8	Very low	26	Very low	142 Å²	142	130.7 Å²	130.7	66%	0.664	79%	0.791	S	S	*	*			cis	-162.5	157	1.2	-126.7	-166.9	136.4	0	0	114.6
809	N	24.8	Very low	25.9	Very low	108 Å²	108	129.2 Å²	129.2	58%	0.578	79%	0.788	S	S	*	*			trans	30.4	135.9	138.5	-81.1	-36.1	0	0	0	125.3	V811	N809-V811 HydrophobicContact CB-CG2 4.37Å; N809-V811 WeakPolarHBondContact OD1-CG2 3.27Å
810	K	24.5	Very low	26	Very low	204 Å²	204	127.9 Å²	127.9	89%	0.887	79%	0.79	S	S	*	*				-174.8	130.7	112.7	-95.6	154.3	-173.4	171.2	0	110.3
811	V	26.5	Very low	26.2	Very low	106 Å²	106	133.5 Å²	133.5	64%	0.642	80%	0.803	S	S	*	*			cis	90.3	106.2	13.1	-170.6	0	0	0	0	117.2	N809	N809-V811 HydrophobicContact CB-CG2 4.37Å; N809-V811 WeakPolarHBondContact OD1-CG2 3.27Å
812	Y	24.3	Very low	26.2	Very low	237 Å²	237	132.1 Å²	132.1	93%	0.929	80%	0.8	S	S	*	*			trans	-174.5	145.5	146.3	-93.5	-73.7	0	0	0	106.5
813	G	23.9	Very low	26.4	Very low	63 Å²	63	133.5 Å²	133.5	65%	0.649	80%	0.803	S	S	*	*			cis	140.5	133	-11.2	0	0	0	0	0	112.2
814	S	26.4	Very low	26.4	Very low	120 Å²	120	129.3 Å²	129.3	84%	0.839	80%	0.8	S	S	*	*			cis	-165.1	153.8	-3.3	-71.1	0	0	0	0	112.7
815	A	24.7	Very low	26.4	Very low	105 Å²	105	128.9 Å²	128.9	87%	0.868	80%	0.8	S	S	*	*			trans	69.7	128.7	151.5	0	0	0	0	0	123.4
816	A	23	Very low	26.4	Very low	110 Å²	110	130 Å²	130	91%	0.909	81%	0.81	S	S	*	*			trans	-160.4	153.9	139.6	0	0	0	0	0	110
817	S	25.8	Very low	27	Very low	121 Å²	121	130.7 Å²	130.7	85%	0.846	81%	0.806	S	S	*	*			trans	-114.2	135.4	-174.5	52.7	0	0	0	0	113.9
818	S	24	Very low	28.2	Very low	130 Å²	130	131 Å²	131	91%	0.909	81%	0.805	S	S	*	*			trans	-160.3	167.4	155.2	59.7	0	0	0	0	110.5
819	S	25.7	Very low	29.7	Very low	118 Å²	118	129.2 Å²	129.2	83%	0.825	80%	0.797	S	S	*	*			trans	-117.9	134.1	-164.3	51.7	0	0	0	0	114
820	S	25	Very low	32.2	Very low	119 Å²	119	128.3 Å²	128.3	83%	0.832	79%	0.791	S	S	*	*			trans	-154.5	139.7	161	53.5	0	0	0	0	111
821	K	30.6	Very low	35	Very low	214 Å²	214	123.3 Å²	123.3	93%	0.93	77%	0.773	S	S	*	*			trans	-83.9	137.8	177.4	-57.9	172.4	-177.7	176.3	0	110.1
822	S	25.9	Very low	37.7	Very low	115 Å²	115	120.5 Å²	120.5	80%	0.804	75%	0.753	S	S	*	*			trans	-152.3	138.1	160.6	55.7	0	0	0	0	110.6
823	S	30.3	Very low	40.6	Very low	129 Å²	129	113.1 Å²	113.1	90%	0.902	73%	0.732	S	S	*	*			trans	-76.4	128.3	-177.2	-51.9	0	0	0	0	111.7	S825	S823-S825 PolarHBondContact O-N 2.66Å
824	G	28.9	Very low	43.6	Very low	80 Å²	80	110.1 Å²	110.1	83%	0.825	70%	0.701	S	S	*	*			trans	-91.9	92.3	177.2	0	0	0	0	0	112.8
825	S	30.3	Very low	46.3	Very low	108 Å²	108	111.7 Å²	111.7	76%	0.755	69%	0.689	S	S	*	*			trans	-84.4	116	156.4	-177.7	0	0	0	0	108	S823	S823-S825 PolarHBondContact O-N 2.66Å
826	S	31.6	Very low	49.1	Very low	118 Å²	118	106.9 Å²	106.9	83%	0.825	65%	0.648	S	S	*	*			trans	-104.5	68	-175.5	61.6	0	0	0	0	112.2
827	L	38.8	Very low	51.8	Low	145 Å²	145	106.6 Å²	106.6	76%	0.759	63%	0.628	S	S	*	*	S	Bend	trans	-105.8	149.7	155.8	-68.9	177.1	0	0	0	108.7	Q829	L827-Q829 PolarHBondContact O-N 3.19Å
828	H	49.1	Very low	53.8	Low	159 Å²	159	101.2 Å²	101.2	74%	0.736	59%	0.59	S	S	*	*			trans	-60.9	97.2	-162.2	-64.3	99.2	0	0	0	114.2	H915	H828-H915 HydrophobicContact CB-CB 3.96Å; H828-H915 PolarHBondContact O-N 3.33Å
829	Q	59.8	Low	55.7	Low	105 Å²	105	102.1 Å²	102.1	49%	0.491	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.6	124.8	170.7	-110.9	-179.1	5.6	0	0	110.2	L827 L912 S914	L827-Q829 PolarHBondContact O-N 3.19Å; Q829-L912 HydrophobicContact CB-CD1 3.93Å; Q829-L912 HydrophobicContact CG-CD1 3.77Å; Q829-L912 HydrophobicContact CG-CG 4.15Å; Q829-S914 PolarHBondContact NE2-OG 3.13Å
830	I	76.4	Confident	57.3	Low	89 Å²	89	100.2 Å²	100.2	46%	0.456	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.9	116.8	-178.1	-55.6	177.9	0	0	0	108.3	F832 R913	I830-F832 HydrophobicContact CG2-CD1 4.23Å; I830-R913 PolarHBondContact N-O 3.35Å; I830-R913 PolarHBondContact O-N 3Å
831	I	84.6	Confident	59.1	Low	98 Å²	98	96.3 Å²	96.3	50%	0.503	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.2	128.2	170.6	-63.3	171.9	0	0	0	108.6	L881 K910 I911 L912	I831-L881 HydrophobicContact CD1-CD1 4.24Å; I831-L881 HydrophobicContact CG1-CD1 4.29Å; I831-K910 HydrophobicContact CG2-CG 4.21Å; I831-I911 WeakPolarHBondContact CA-O 3.26Å; I831-L912 HydrophobicContact CD1-CD1 4.13Å; I831-L912 HydrophobicContact CG1-CD1 3.4Å
832	F	83.6	Confident	61.1	Low	48 Å²	48	93.8 Å²	93.8	21%	0.211	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-145.5	157.5	175.4	61.9	-73.8	0	0	0	110	I830 V834 Q873 I911 R913	I830-F832 HydrophobicContact CG2-CD1 4.23Å; F832-V834 HydrophobicContact CD2-CG2 3.61Å; F832-V834 HydrophobicContact CE2-CG2 3.38Å; F832-Q873 WeakPolarHBondContact CE2-O 3.26Å; F832-I911 HydrophobicContact CE1-CB 4.15Å; F832-I911 HydrophobicContact CE1-CG2 3.72Å; F832-I911 HydrophobicContact CE2-CB 4.28Å; F832-I911 HydrophobicContact CE2-CG2 4.33Å; F832-I911 HydrophobicContact CZ-CB 3.92Å; F832-I911 HydrophobicContact CZ-CG2 3.52Å; F832-I911 PolarHBondContact N-O 2.85Å; F832-I911 PolarHBondContact O-N 2.93Å; F832-R913 HydrophobicContact CE1-CB 3.92Å
833	T	85.1	Confident	63.5	Low	81 Å²	81	88.8 Å²	88.8	50%	0.497	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	133.3	176.9	-54.8	0	0	0	0	109.2	D908 L909	T833-D908 HydrophobicContact CG2-CB 4.01Å; T833-L909 CarbonylContact C-O 3.59Å; T833-L909 WeakPolarHBondContact CA-O 3.32Å
834	V	85.7	Confident	65.7	Low	0 Å²	0	83.2 Å²	83.2	0%	0	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	115.3	178.8	178.6	0	0	0	0	109.5	F832 L836 N871 Q873 I874 L909 I911	F832-V834 HydrophobicContact CD2-CG2 3.61Å; F832-V834 HydrophobicContact CE2-CG2 3.38Å; V834-L836 HydrophobicContact CG1-CD2 3.91Å; V834-L836 HydrophobicContact CG1-CG 4.08Å; V834-N871 WeakPolarHBondContact CG1-ND2 3.46Å; V834-Q873 HydrophobicContact CG1-CB 4.14Å; V834-Q873 HydrophobicContact CG2-CB 3.87Å; V834-I874 HydrophobicContact CB-CD1 4.25Å; V834-I874 HydrophobicContact CB-CG1 4.22Å; V834-I874 HydrophobicContact CG1-CD1 3.87Å; V834-I874 HydrophobicContact CG1-CG1 3.87Å; V834-I874 HydrophobicContact CG2-CG1 4.08Å; V834-L909 PolarHBondContact N-O 2.83Å; V834-L909 PolarHBondContact O-N 3.11Å; V834-I911 HydrophobicContact CB-CD1 4.26Å; V834-I911 HydrophobicContact CG2-CD1 3.95Å
835	R	83.6	Confident	68.3	Low	153 Å²	153	80.6 Å²	80.6	58%	0.577	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	124.2	177.5	-174.7	157.3	165.6	141.2	-3.2	110.3	L906 V907 D908	R835-L906 HydrophobicContact CG-CD1 3.79Å; R835-L906 HydrophobicContact CG-CG 4.46Å; R835-L906 VanDerWaalsContact CZ-CD2 3.44Å; R835-V907 CarbonylContact C-O 3.33Å; R835-V907 WeakPolarHBondContact CA-O 3.49Å; R835-D908 WeakPolarHBondContact CA-OD1 3.44Å; R835-D908 WeakPolarHBondContact CB-OD1 3.15Å; R835-D908 VanDerWaalsContact CD-OD1 3.3Å; R835-D908 WeakPolarHBondContact CD-OD1 3.18Å; R835-D908 WeakPolarHBondContact CG-OD1 3.25Å
836	L	82.6	Confident	70.6	Confident	4 Å²	4	78.8 Å²	78.8	2%	0.021	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	141.7	-179	-61.4	177.2	0	0	0	110.4	V834 P838 L843 A868 N871 I874 L906 V907 L909	V834-L836 HydrophobicContact CG1-CD2 3.91Å; V834-L836 HydrophobicContact CG1-CG 4.08Å; L836-P838 WeakPolarHBondContact O-CD 3.26Å; L836-L843 HydrophobicContact CB-CD2 4.07Å; L836-L843 HydrophobicContact CD1-CD2 3.85Å; L836-A868 HydrophobicContact CD1-CB 4.41Å; L836-N871 HydrophobicContact CD2-CB 3.75Å; L836-N871 WeakPolarHBondContact CD2-ND2 3.28Å; L836-I874 HydrophobicContact CD1-CD1 3.94Å; L836-L906 CarbonylContact O-C 3.57Å; L836-L906 WeakPolarHBondContact O-CA 3.35Å; L836-V907 PolarHBondContact N-O 2.7Å; L836-V907 PolarHBondContact O-N 3.27Å; L836-L909 HydrophobicContact CD1-CD1 3.86Å
837	E	80.2	Confident	73	Confident	104 Å²	104	74.5 Å²	74.5	49%	0.486	40%	0.397	S	S	.	.			trans	-108	86.4	173.6	-69.6	-179.4	175.5	0	0	109.6	K839 D905 L906	E837-K839 VanDerWaalsContact C-N 3.27Å; E837-K839 HydrophobicContact CB-CD 4.4Å; E837-K839 HydrophobicContact CB-CG 4.42Å; E837-K839 PolarHBondContact O-N 2.89Å; E837-K839 VanDerWaalsContact OE2-CE 3.25Å; E837-K839 WeakPolarHBondContact OE2-CE 3.18Å; E837-K839 IonicContact OE2-NZ 2.68Å; E837-K839 PolarHBondContact OE2-NZ 2.9Å; E837-D905 WeakPolarHBondContact CA-O 3.33Å; E837-L906 HydrophobicContact CG-CD1 3.79Å
838	P	69	Low	74.8	Confident	8 Å²	8	69.3 Å²	69.3	5%	0.052	38%	0.376	C	S	.	.			trans	-60.8	-30.8	-179.7	22.1	-35	0	0	0	114.3	L836 G840 G841 L843 I867 G904 D905 V907	L836-P838 WeakPolarHBondContact O-CD 3.26Å; P838-G840 VanDerWaalsContact C-N 3.26Å; P838-G840 PolarHBondContact O-N 2.91Å; P838-G841 VanDerWaalsContact CB-O 3.23Å; P838-G841 WeakPolarHBondContact CB-O 3.49Å; P838-G841 WeakPolarHBondContact O-CA 3.45Å; P838-G841 PolarHBondContact O-N 2.87Å; P838-L843 HydrophobicContact CB-CD2 4.09Å; P838-L843 HydrophobicContact CG-CD2 4.39Å; P838-I867 HydrophobicContact CB-CD1 4.48Å; P838-I867 WeakPolarHBondContact O-CD1 3.35Å; P838-G904 WeakPolarHBondContact CG-O 3.42Å; P838-D905 VanDerWaalsContact CD-O 3.32Å; P838-D905 WeakPolarHBondContact CD-O 3.3Å; P838-V907 HydrophobicContact CG-CG2 3.88Å
839	K	63.9	Low	75.9	Confident	150 Å²	150	63.6 Å²	63.6	65%	0.652	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	44.9	-179.5	-70.8	163.4	169.3	153.1	0	112.7	E837 G841	E837-K839 VanDerWaalsContact C-N 3.27Å; E837-K839 HydrophobicContact CB-CD 4.4Å; E837-K839 HydrophobicContact CB-CG 4.42Å; E837-K839 PolarHBondContact O-N 2.89Å; E837-K839 VanDerWaalsContact OE2-CE 3.25Å; E837-K839 WeakPolarHBondContact OE2-CE 3.18Å; E837-K839 IonicContact OE2-NZ 2.68Å; E837-K839 PolarHBondContact OE2-NZ 2.9Å; K839-G841 VanDerWaalsContact C-N 3.28Å; K839-G841 PolarHBondContact O-N 3.11Å
840	G	57.4	Low	76.1	Confident	78 Å²	78	60.4 Å²	60.4	80%	0.804	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	-1	-175.1	0	0	0	0	0	116.2	P838	P838-G840 VanDerWaalsContact C-N 3.26Å; P838-G840 PolarHBondContact O-N 2.91Å
841	G	64.4	Low	75.9	Confident	37 Å²	37	63.3 Å²	63.3	38%	0.381	36%	0.36	S	S	.	.	S	Bend	trans	-95	161.6	176.7	0	0	0	0	0	114.2	P838 K839	P838-G841 VanDerWaalsContact CB-O 3.23Å; P838-G841 WeakPolarHBondContact CB-O 3.49Å; P838-G841 WeakPolarHBondContact O-CA 3.45Å; P838-G841 PolarHBondContact O-N 2.87Å; K839-G841 VanDerWaalsContact C-N 3.28Å; K839-G841 PolarHBondContact O-N 3.11Å
842	L	71.6	Confident	74.9	Confident	160 Å²	160	62.1 Å²	62.1	84%	0.838	36%	0.355	S	S	*	.			trans	-67.9	137.3	174.3	-63.1	175.9	0	0	0	111.3	G844	L842-G844 PolarHBondContact O-N 3.06Å; L842-G844 VanDerWaalsContact O-N 3.16Å
843	L	76.7	Confident	74.1	Confident	11 Å²	11	65 Å²	65	6%	0.058	37%	0.372	C	S	.	.			trans	-57.8	-29.3	176.8	-64.7	176.2	0	0	0	113.4	L836 P838 I845 I867 A868 L900 L903 V907 L909	L836-L843 HydrophobicContact CB-CD2 4.07Å; L836-L843 HydrophobicContact CD1-CD2 3.85Å; P838-L843 HydrophobicContact CB-CD2 4.09Å; P838-L843 HydrophobicContact CG-CD2 4.39Å; L843-I845 HydrophobicContact CB-CG1 4.33Å; L843-I845 HydrophobicContact CD1-CD1 4.15Å; L843-I867 PolarHBondContact O-N 2.96Å; L843-A868 WeakPolarHBondContact O-CB 3.47Å; L843-A868 PolarHBondContact O-N 2.87Å; L843-L900 HydrophobicContact CD1-CD2 3.93Å; L843-L903 HydrophobicContact CD1-CD1 3.55Å; L843-L903 HydrophobicContact CG-CD1 3.89Å; L843-V907 HydrophobicContact CD2-CG2 4.37Å; L843-L909 HydrophobicContact CD1-CD1 4.37Å
844	G	76	Confident	73	Confident	11 Å²	11	67.4 Å²	67.4	11%	0.113	39%	0.386	C	S	.	.			trans	77.2	30.1	-177.6	0	0	0	0	0	114.1	L842 L862 V863	L842-G844 PolarHBondContact O-N 3.06Å; L842-G844 VanDerWaalsContact O-N 3.16Å; G844-L862 WeakPolarHBondContact O-CA 3.18Å; G844-V863 PolarHBondContact O-N 2.84Å
845	I	83.1	Confident	72.2	Confident	25 Å²	25	72.9 Å²	72.9	13%	0.128	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	142	171.2	65.5	-178.8	0	0	0	110.3	L843 L847 L862 A868 L900 L909	L843-I845 HydrophobicContact CB-CG1 4.33Å; L843-I845 HydrophobicContact CD1-CD1 4.15Å; I845-L847 HydrophobicContact CD1-CD2 4.38Å; I845-L862 HydrophobicContact CB-CD2 4.47Å; I845-L862 HydrophobicContact CG2-CD2 3.82Å; I845-A868 HydrophobicContact CG2-CB 3.34Å; I845-L900 HydrophobicContact CD1-CD1 3.89Å; I845-L900 HydrophobicContact CD1-CD2 4.44Å; I845-L900 HydrophobicContact CG1-CD1 4.26Å; I845-L909 HydrophobicContact CD1-CD1 4.07Å
846	T	80.5	Confident	71.9	Confident	70 Å²	70	68.4 Å²	68.4	43%	0.429	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129	168.4	-50.3	0	0	0	0	108.4	I859 S860 G861	T846-I859 CarbonylContact O-C 3.52Å; T846-I859 WeakPolarHBondContact O-CA 3.44Å; T846-S860 WeakPolarHBondContact CG2-OG 3.31Å; T846-S860 PolarHBondContact O-N 2.98Å; T846-S860 PolarHBondContact O-OG 2.93Å; T846-G861 PolarHBondContact N-O 3.21Å; T846-G861 PolarHBondContact O-N 2.69Å
847	L	81.9	Confident	71.9	Confident	28 Å²	28	68.5 Å²	68.5	15%	0.147	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	142.5	175	-60.8	-175.7	0	0	0	111	I845 I857 T858 I859 S860 L880 L893 A896 L900	I845-L847 HydrophobicContact CD1-CD2 4.38Å; L847-I857 HydrophobicContact CB-CG2 4.23Å; L847-I857 HydrophobicContact CD1-CG2 3.96Å; L847-I857 HydrophobicContact CD2-CG2 4.2Å; L847-I857 HydrophobicContact CG-CG2 4.37Å; L847-T858 CarbonylContact C-O 3.53Å; L847-T858 WeakPolarHBondContact CA-O 3.29Å; L847-I859 HydrophobicContact CD2-CG1 4.15Å; L847-S860 PolarHBondContact O-OG 3.27Å; L847-L880 HydrophobicContact CD1-CD2 4.33Å; L847-L880 HydrophobicContact CD2-CD2 4.02Å; L847-L893 HydrophobicContact CB-CD1 3.78Å; L847-L893 HydrophobicContact CD1-CD1 4.11Å; L847-A896 HydrophobicContact CD1-CB 4.18Å; L847-L900 HydrophobicContact CD1-CD1 3.6Å; L847-L900 HydrophobicContact CD2-CD1 4.5Å; L847-L900 HydrophobicContact CG-CD1 4.02Å
848	A	74.9	Confident	72.3	Confident	37 Å²	37	65.6 Å²	65.6	31%	0.306	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	142.8	158	0	0	0	0	0	109.7	I857 T858 S860	A848-I857 WeakPolarHBondContact O-CA 3.34Å; A848-T858 PolarHBondContact N-O 3.35Å; A848-T858 PolarHBondContact O-N 2.72Å; A848-S860 PolarHBondContact N-OG 3.28Å
849	G	71.9	Confident	73.2	Confident	38 Å²	38	65.3 Å²	65.3	39%	0.392	39%	0.39	S	S	.	.			trans	-175.9	176.1	178.8	0	0	0	0	0	109
850	S	65.7	Low	73.9	Confident	39 Å²	39	60.9 Å²	60.9	27%	0.273	38%	0.378	S	S	.	.			trans	-114.4	175.3	169.2	-165.3	0	0	0	0	109.6	D852 L893	S850-D852 VanDerWaalsContact CB-OD2 3.24Å; S850-D852 WeakPolarHBondContact CB-OD2 3.25Å; S850-D852 VanDerWaalsContact OG-CG 3.26Å; S850-D852 PolarHBondContact OG-N 2.93Å; S850-D852 PolarHBondContact OG-OD2 3.38Å; S850-L893 PolarHBondContact O-N 3.17Å; S850-L893 VanDerWaalsContact O-N 3.14Å
851	E	71.4	Confident	74.8	Confident	149 Å²	149	57.9 Å²	57.9	70%	0.696	35%	0.347	S	S	*	.	S	Bend	trans	-76.9	-11.9	158	-58.8	-164.5	134.7	0	0	111.4	I853 P892	E851-I853 PolarHBondContact O-N 3.11Å; E851-P892 HydrophobicContact CB-CB 4.5Å
852	D	63.3	Low	75.7	Confident	73 Å²	73	58.1 Å²	58.1	39%	0.39	34%	0.34	S	S	.	.			trans	-63.5	106	170.6	-51.4	-64.1	0	0	0	111.2	S850 T854 K855	S850-D852 VanDerWaalsContact CB-OD2 3.24Å; S850-D852 WeakPolarHBondContact CB-OD2 3.25Å; S850-D852 VanDerWaalsContact OG-CG 3.26Å; S850-D852 PolarHBondContact OG-N 2.93Å; S850-D852 PolarHBondContact OG-OD2 3.38Å; D852-T854 PolarHBondContact O-N 3.44Å; D852-K855 HydrophobicContact CB-CD 4.07Å; D852-K855 HydrophobicContact CB-CG 4.29Å; D852-K855 PolarHBondContact O-N 3.07Å; D852-K855 WeakPolarHBondContact OD2-CE 3.33Å; D852-K855 IonicContact OD2-NZ 2.67Å; D852-K855 PolarHBondContact OD2-NZ 3.27Å
853	I	67.9	Low	76.1	Confident	110 Å²	110	54.3 Å²	54.3	56%	0.564	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-19.3	171.9	-76.5	165.6	0	0	0	113.8	E851 G890	E851-I853 PolarHBondContact O-N 3.11Å; I853-G890 WeakPolarHBondContact CG2-O 3.31Å
854	T	62	Low	75.7	Confident	131 Å²	131	62 Å²	62	80%	0.804	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-7.1	178.7	54.7	0	0	0	0	114.7	D852	D852-T854 PolarHBondContact O-N 3.44Å
855	K	67	Low	75.4	Confident	114 Å²	114	63.2 Å²	63.2	50%	0.496	37%	0.37	S	S	.	.	S	Bend	trans	-107.4	141.4	178.7	-67.6	171.2	-175.3	159.5	0	110.3	D852	D852-K855 HydrophobicContact CB-CD 4.07Å; D852-K855 HydrophobicContact CB-CG 4.29Å; D852-K855 PolarHBondContact O-N 3.07Å; D852-K855 WeakPolarHBondContact OD2-CE 3.33Å; D852-K855 IonicContact OD2-NZ 2.67Å; D852-K855 PolarHBondContact OD2-NZ 3.27Å
856	S	78.1	Confident	75.1	Confident	60 Å²	60	62.6 Å²	62.6	42%	0.42	37%	0.371	S	S	.	.			trans	-77.4	155.9	173.6	52.7	0	0	0	0	112.1	Q879	S856-Q879 PolarHBondContact OG-OE1 3.15Å
857	I	83.6	Confident	75.1	Confident	5 Å²	5	61.5 Å²	61.5	3%	0.026	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	124.5	176.6	-60.7	176.2	0	0	0	108.2	L847 A848 Q879 L880 V888 L893 A896	L847-I857 HydrophobicContact CB-CG2 4.23Å; L847-I857 HydrophobicContact CD1-CG2 3.96Å; L847-I857 HydrophobicContact CD2-CG2 4.2Å; L847-I857 HydrophobicContact CG-CG2 4.37Å; A848-I857 WeakPolarHBondContact O-CA 3.34Å; I857-Q879 WeakPolarHBondContact O-CG 3.32Å; I857-L880 PolarHBondContact O-N 2.95Å; I857-V888 HydrophobicContact CD1-CB 4.37Å; I857-L893 HydrophobicContact CG2-CD1 4.08Å; I857-A896 HydrophobicContact CD1-CB 3.61Å
858	T	87.7	Confident	75	Confident	44 Å²	44	60.1 Å²	60.1	27%	0.27	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	160.9	-177.7	59.6	0	0	0	0	111.5	L847 A848 D878 Q879	L847-T858 CarbonylContact C-O 3.53Å; L847-T858 WeakPolarHBondContact CA-O 3.29Å; A848-T858 PolarHBondContact N-O 3.35Å; A848-T858 PolarHBondContact O-N 2.72Å; T858-D878 CarbonylContact C-O 3.57Å; T858-D878 WeakPolarHBondContact CA-O 3.41Å; T858-Q879 HydrophobicContact CG2-CB 4.16Å; T858-Q879 HydrophobicContact CG2-CG 4.2Å
859	I	87.4	Confident	75.3	Confident	1 Å²	1	62.6 Å²	62.6	1%	0.005	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	111	177.4	-60.4	178.5	0	0	0	108.1	T846 L847 L862 I874 V876 G877 D878 I911	T846-I859 CarbonylContact O-C 3.52Å; T846-I859 WeakPolarHBondContact O-CA 3.44Å; L847-I859 HydrophobicContact CD2-CG1 4.15Å; I859-L862 HydrophobicContact CG2-CD2 4.04Å; I859-I874 HydrophobicContact CD1-CG2 3.39Å; I859-V876 WeakPolarHBondContact O-CA 3.4Å; I859-G877 PolarHBondContact O-N 3.49Å; I859-D878 HydrophobicContact CD1-CB 4.26Å; I859-D878 PolarHBondContact N-O 3Å; I859-I911 HydrophobicContact CD1-CD1 4.47Å
860	S	78.4	Confident	75.5	Confident	57 Å²	57	68.4 Å²	68.4	40%	0.399	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	-12	-175.2	54.1	0	0	0	0	114.1	T846 L847 A848	T846-S860 WeakPolarHBondContact CG2-OG 3.31Å; T846-S860 PolarHBondContact O-N 2.98Å; T846-S860 PolarHBondContact O-OG 2.93Å; L847-S860 PolarHBondContact O-OG 3.27Å; A848-S860 PolarHBondContact N-OG 3.28Å
861	G	77.4	Confident	76.1	Confident	15 Å²	15	69.3 Å²	69.3	16%	0.155	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	156.1	179.7	0	0	0	0	0	112.3	T846	T846-G861 PolarHBondContact N-O 3.21Å; T846-G861 PolarHBondContact O-N 2.69Å
862	L	82.6	Confident	76.4	Confident	43 Å²	43	64.3 Å²	64.3	23%	0.225	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	132.5	171.7	-65.1	173.2	0	0	0	107.8	G844 I845 I859 E864 A868 I874 V876	G844-L862 WeakPolarHBondContact O-CA 3.18Å; I845-L862 HydrophobicContact CB-CD2 4.47Å; I845-L862 HydrophobicContact CG2-CD2 3.82Å; I859-L862 HydrophobicContact CG2-CD2 4.04Å; L862-E864 PolarHBondContact O-N 2.77Å; L862-A868 HydrophobicContact CD2-CB 4.06Å; L862-I874 VanDerWaalsContact CD1-O 3.29Å; L862-I874 WeakPolarHBondContact CD1-O 3.42Å; L862-I874 HydrophobicContact CD2-CG2 4.1Å; L862-V876 HydrophobicContact CD1-CG2 4.31Å; L862-V876 HydrophobicContact CG-CG2 4.03Å
863	V	80.1	Confident	77.1	Confident	79 Å²	79	65.3 Å²	65.3	48%	0.479	37%	0.366	S	S	.	.			trans	-76.5	123	177.1	-179.6	0	0	0	0	108.5	G844 G865 G866 H869	G844-V863 PolarHBondContact O-N 2.84Å; V863-G865 PolarHBondContact O-N 2.97Å; V863-G866 WeakPolarHBondContact O-CA 3.21Å; V863-G866 PolarHBondContact O-N 2.9Å; V863-H869 VanDerWaalsContact O-CB 3.28Å; V863-H869 WeakPolarHBondContact O-CB 3.48Å
864	E	68.2	Low	77.9	Confident	174 Å²	174	60.2 Å²	60.2	81%	0.813	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	127.9	178.1	-169.1	176.2	179.2	0	0	110.6	L862 G866	L862-E864 PolarHBondContact O-N 2.77Å; E864-G866 PolarHBondContact O-N 2.95Å
865	G	69.1	Low	78.9	Confident	35 Å²	35	58.5 Å²	58.5	36%	0.361	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.8	1.8	-173.1	0	0	0	0	0	115.6	V863 K870	V863-G865 PolarHBondContact O-N 2.97Å; G865-K870 WeakPolarHBondContact O-CD 3.41Å; G865-K870 WeakPolarHBondContact O-CE 3.4Å; G865-K870 PolarHBondContact O-NZ 3.27Å
866	G	77.6	Confident	79.6	Confident	13 Å²	13	57.3 Å²	57.3	13%	0.134	33%	0.325	C	S	.	.	S	Bend	trans	-66.9	172.7	169.8	0	0	0	0	0	113.2	V863 E864 H869 K870	V863-G866 WeakPolarHBondContact O-CA 3.21Å; V863-G866 PolarHBondContact O-N 2.9Å; E864-G866 PolarHBondContact O-N 2.95Å; G866-H869 PolarHBondContact O-N 2.8Å; G866-K870 WeakPolarHBondContact O-CB 3.39Å; G866-K870 WeakPolarHBondContact O-CG 3.34Å; G866-K870 PolarHBondContact O-N 2.89Å
867	I	79.6	Confident	79.5	Confident	46 Å²	46	57.2 Å²	57.2	24%	0.236	33%	0.334	C	S	.	.	H	α-helix	trans	-71.9	-43.9	-170.8	-59.5	-179.5	0	0	0	111.5	P838 L843 H869 K870 N871	P838-I867 HydrophobicContact CB-CD1 4.48Å; P838-I867 WeakPolarHBondContact O-CD1 3.35Å; L843-I867 PolarHBondContact O-N 2.96Å; I867-H869 PolarHBondContact O-N 3.02Å; I867-K870 PolarHBondContact O-N 2.8Å; I867-N871 PolarHBondContact O-N 2.92Å
868	A	80.8	Confident	79.6	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-41.4	172.6	0	0	0	0	0	112.4	L836 L843 I845 L862 N871 G872 I874	L836-A868 HydrophobicContact CD1-CB 4.41Å; L843-A868 WeakPolarHBondContact O-CB 3.47Å; L843-A868 PolarHBondContact O-N 2.87Å; I845-A868 HydrophobicContact CG2-CB 3.34Å; L862-A868 HydrophobicContact CD2-CB 4.06Å; A868-N871 PolarHBondContact O-N 2.93Å; A868-G872 PolarHBondContact O-N 2.81Å; A868-I874 HydrophobicContact CB-CD1 4.07Å
869	H	80.6	Confident	79.6	Confident	89 Å²	89	57 Å²	57	41%	0.412	33%	0.33	S	S	.	.	H	α-helix	trans	-63.5	-41	175.4	-174.6	-71.8	0	0	0	112	V863 G866 I867 N871 G872	V863-H869 VanDerWaalsContact O-CB 3.28Å; V863-H869 WeakPolarHBondContact O-CB 3.48Å; G866-H869 PolarHBondContact O-N 2.8Å; I867-H869 PolarHBondContact O-N 3.02Å; H869-N871 VanDerWaalsContact C-N 3.33Å; H869-N871 PolarHBondContact O-N 3.06Å; H869-G872 PolarHBondContact O-N 2.82Å
870	K	76.5	Confident	79.6	Confident	160 Å²	160	57.1 Å²	57.1	70%	0.696	33%	0.33	S	S	*	.	H	α-helix	trans	-67.2	-29.5	175.9	-80.9	166.7	171.1	149.4	0	113.5	G865 G866 I867	G865-K870 WeakPolarHBondContact O-CD 3.41Å; G865-K870 WeakPolarHBondContact O-CE 3.4Å; G865-K870 PolarHBondContact O-NZ 3.27Å; G866-K870 WeakPolarHBondContact O-CB 3.39Å; G866-K870 WeakPolarHBondContact O-CG 3.34Å; G866-K870 PolarHBondContact O-N 2.89Å; I867-K870 PolarHBondContact O-N 2.8Å
871	N	79	Confident	80	Confident	57 Å²	57	54.8 Å²	54.8	31%	0.305	31%	0.313	S	S	.	.	H	α-helix	trans	-78.8	-23.8	176.6	-167.2	37	0	0	0	112.8	V834 L836 I867 A868 H869 Q873	V834-N871 WeakPolarHBondContact CG1-ND2 3.46Å; L836-N871 HydrophobicContact CD2-CB 3.75Å; L836-N871 WeakPolarHBondContact CD2-ND2 3.28Å; I867-N871 PolarHBondContact O-N 2.92Å; A868-N871 PolarHBondContact O-N 2.93Å; H869-N871 VanDerWaalsContact C-N 3.33Å; H869-N871 PolarHBondContact O-N 3.06Å; N871-Q873 PolarHBondContact ND2-OE1 3.48Å; N871-Q873 PolarHBondContact O-N 3.29Å
872	G	77.8	Confident	80.4	Confident	45 Å²	45	54.7 Å²	54.7	46%	0.464	31%	0.311	S	S	.	.			trans	65.7	-5	174.2	0	0	0	0	0	116.4	A868 H869 H875	A868-G872 PolarHBondContact O-N 2.81Å; H869-G872 PolarHBondContact O-N 2.82Å; G872-H875 PolarHBondContact O-CE1 2.9Å
873	Q	78.6	Confident	80.6	Confident	93 Å²	93	52.7 Å²	52.7	44%	0.435	30%	0.3	S	S	.	.	S	Bend	trans	-79.4	-21.2	179.5	-66.6	175.3	1.4	0	0	112.9	F832 V834 N871 R913	F832-Q873 WeakPolarHBondContact CE2-O 3.26Å; V834-Q873 HydrophobicContact CG1-CB 4.14Å; V834-Q873 HydrophobicContact CG2-CB 3.87Å; N871-Q873 PolarHBondContact ND2-OE1 3.48Å; N871-Q873 PolarHBondContact O-N 3.29Å; Q873-R913 PolarHBondContact O-NH2 2.91Å
874	I	84.3	Confident	80.7	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.015	30%	0.295	C	S	.	.			trans	-104.5	136.4	-176.8	-53.4	-173.4	0	0	0	109.3	V834 L836 I859 L862 A868 L909 I911	V834-I874 HydrophobicContact CB-CD1 4.25Å; V834-I874 HydrophobicContact CB-CG1 4.22Å; V834-I874 HydrophobicContact CG1-CD1 3.87Å; V834-I874 HydrophobicContact CG1-CG1 3.87Å; V834-I874 HydrophobicContact CG2-CG1 4.08Å; L836-I874 HydrophobicContact CD1-CD1 3.94Å; I859-I874 HydrophobicContact CD1-CG2 3.39Å; L862-I874 VanDerWaalsContact CD1-O 3.29Å; L862-I874 WeakPolarHBondContact CD1-O 3.42Å; L862-I874 HydrophobicContact CD2-CG2 4.1Å; A868-I874 HydrophobicContact CB-CD1 4.07Å; I874-L909 HydrophobicContact CD1-CD1 3.96Å; I874-I911 HydrophobicContact CB-CD1 4.4Å; I874-I911 HydrophobicContact CD1-CD1 3.74Å; I874-I911 HydrophobicContact CG1-CD1 3.64Å; I874-I911 HydrophobicContact CG2-CD1 4.13Å
875	H	81.8	Confident	81.1	Confident	95 Å²	95	52.9 Å²	52.9	44%	0.44	30%	0.298	S	S	.	.			trans	-127.3	158.6	179.8	-67	78.9	0	0	0	111.5	G872 D878 R913	G872-H875 PolarHBondContact O-CE1 2.9Å; H875-D878 PolarHBondContact N-OD2 3.2Å; H875-D878 VanDerWaalsContact O-CB 3.3Å; H875-D878 WeakPolarHBondContact O-CB 3.46Å; H875-D878 PolarHBondContact O-N 3.05Å; H875-R913 PolarHBondContact ND1-NH2 3.32Å
876	V	82.6	Confident	81.5	Confident	89 Å²	89	56.3 Å²	56.3	54%	0.539	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	135.3	169.4	178.3	0	0	0	0	108.9	I859 L862	I859-V876 WeakPolarHBondContact O-CA 3.4Å; L862-V876 HydrophobicContact CD1-CG2 4.31Å; L862-V876 HydrophobicContact CG-CG2 4.03Å
877	G	76	Confident	81.7	Confident	58 Å²	58	58.9 Å²	58.9	60%	0.598	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	96.4	-16.2	-172.1	0	0	0	0	0	114.5	I859	I859-G877 PolarHBondContact O-N 3.49Å
878	D	86.5	Confident	81.8	Confident	5 Å²	5	56.8 Å²	56.8	3%	0.027	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-59.9	137.4	172.9	-80.2	-19	0	0	0	111.2	T858 I859 H875 I911 R913	T858-D878 CarbonylContact C-O 3.57Å; T858-D878 WeakPolarHBondContact CA-O 3.41Å; I859-D878 HydrophobicContact CD1-CB 4.26Å; I859-D878 PolarHBondContact N-O 3Å; H875-D878 PolarHBondContact N-OD2 3.2Å; H875-D878 VanDerWaalsContact O-CB 3.3Å; H875-D878 WeakPolarHBondContact O-CB 3.46Å; H875-D878 PolarHBondContact O-N 3.05Å; D878-I911 HydrophobicContact CB-CG2 3.66Å; D878-R913 IonicContact OD1-CZ 3.9Å; D878-R913 IonicContact OD1-NE 2.72Å; D878-R913 PolarHBondContact OD1-NE 2.63Å; D878-R913 IonicContact OD1-NH2 2.71Å; D878-R913 PolarHBondContact OD1-NH2 3.39Å; D878-R913 IonicContact OD2-CZ 3.42Å; D878-R913 IonicContact OD2-NE 3.65Å; D878-R913 IonicContact OD2-NH2 3.17Å; D878-R913 PolarHBondContact OD2-NH2 2.83Å
879	Q	86.9	Confident	81.6	Confident	41 Å²	41	62 Å²	62	19%	0.192	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	130.8	176.7	-174.4	-174.1	-62.1	0	0	110.9	S856 I857 T858 L881 L912	S856-Q879 PolarHBondContact OG-OE1 3.15Å; I857-Q879 WeakPolarHBondContact O-CG 3.32Å; T858-Q879 HydrophobicContact CG2-CB 4.16Å; T858-Q879 HydrophobicContact CG2-CG 4.2Å; Q879-L881 HydrophobicContact CG-CD2 4.21Å; Q879-L912 HydrophobicContact CB-CB 4.18Å; Q879-L912 HydrophobicContact CB-CD2 4.42Å; Q879-L912 PolarHBondContact N-O 3.26Å; Q879-L912 PolarHBondContact O-N 3.07Å
880	L	87.7	Confident	81.1	Confident	2 Å²	2	59.3 Å²	59.3	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	129.3	177.8	-171.6	63.1	0	0	0	110.3	L847 I857 I883 V888 L909 I911	L847-L880 HydrophobicContact CD1-CD2 4.33Å; L847-L880 HydrophobicContact CD2-CD2 4.02Å; I857-L880 PolarHBondContact O-N 2.95Å; L880-I883 HydrophobicContact CD2-CD1 4.06Å; L880-I883 HydrophobicContact CD2-CG1 3.88Å; L880-I883 HydrophobicContact CG-CG1 4.46Å; L880-V888 HydrophobicContact CB-CG2 4.45Å; L880-V888 HydrophobicContact CD2-CG2 4.24Å; L880-V888 HydrophobicContact CG-CG2 3.94Å; L880-L909 HydrophobicContact CD1-CB 4.26Å; L880-L909 HydrophobicContact CD1-CD2 4.29Å; L880-I911 HydrophobicContact CD1-CG1 4.37Å
881	L	85.4	Confident	81.1	Confident	9 Å²	9	55.6 Å²	55.6	5%	0.047	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-39.9	-179.7	-55.2	-162.7	0	0	0	113.2	I831 Q879 S887 V888 Q889 K910 L912	I831-L881 HydrophobicContact CD1-CD1 4.24Å; I831-L881 HydrophobicContact CG1-CD1 4.29Å; Q879-L881 HydrophobicContact CG-CD2 4.21Å; L881-S887 PolarHBondContact O-OG 3.37Å; L881-V888 WeakPolarHBondContact O-CG2 3.4Å; L881-V888 PolarHBondContact O-N 2.82Å; L881-Q889 HydrophobicContact CB-CG 4.3Å; L881-Q889 HydrophobicContact CD2-CG 4.15Å; L881-Q889 PolarHBondContact O-N 2.67Å; L881-K910 HydrophobicContact CB-CB 4.43Å; L881-K910 HydrophobicContact CB-CG 4.34Å; L881-K910 WeakPolarHBondContact CB-O 3.35Å; L881-K910 PolarHBondContact N-O 2.85Å; L881-L912 HydrophobicContact CD1-CB 3.92Å; L881-L912 HydrophobicContact CD2-CB 3.69Å; L881-L912 HydrophobicContact CD2-CD2 3.91Å; L881-L912 HydrophobicContact CD2-CG 4.43Å; L881-L912 HydrophobicContact CG-CB 3.77Å
882	A	85.9	Confident	81.1	Confident	12 Å²	12	54.3 Å²	54.3	10%	0.099	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	153.5	177.6	0	0	0	0	0	111	H886 K910	A882-H886 CarbonylContact C-O 3.58Å; A882-H886 VanDerWaalsContact CA-O 3.23Å; A882-H886 WeakPolarHBondContact CA-O 3.31Å; A882-H886 WeakPolarHBondContact CB-O 3.28Å; A882-K910 HydrophobicContact CB-CB 3.85Å; A882-K910 PolarHBondContact N-O 3.14Å; A882-K910 PolarHBondContact O-N 3.21Å
883	I	86.8	Confident	81.3	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	115.5	169.2	-58.4	163.3	0	0	0	105.2	L880 E885 H886 V888 A896 L899 L900 L903 V907 L909	L880-I883 HydrophobicContact CD2-CD1 4.06Å; L880-I883 HydrophobicContact CD2-CG1 3.88Å; L880-I883 HydrophobicContact CG-CG1 4.46Å; I883-E885 PolarHBondContact O-N 3.13Å; I883-H886 PolarHBondContact N-O 2.82Å; I883-H886 WeakPolarHBondContact O-CB 3.38Å; I883-H886 PolarHBondContact O-N 3.39Å; I883-V888 HydrophobicContact CD1-CG1 3.89Å; I883-V888 HydrophobicContact CG1-CG1 4.19Å; I883-A896 HydrophobicContact CD1-CB 4.21Å; I883-A896 WeakPolarHBondContact CD1-O 3.5Å; I883-L899 HydrophobicContact CB-CB 4.4Å; I883-L899 HydrophobicContact CD1-CB 3.76Å; I883-L899 HydrophobicContact CD1-CD1 4.22Å; I883-L899 HydrophobicContact CG2-CB 4.29Å; I883-L900 HydrophobicContact CD1-CD2 3.68Å; I883-L900 HydrophobicContact CD1-CG 3.77Å; I883-L900 HydrophobicContact CG1-CD2 4.07Å; I883-L900 HydrophobicContact CG2-CD2 4.07Å; I883-L903 HydrophobicContact CG2-CD2 3.96Å; I883-V907 HydrophobicContact CG2-CG1 4.28Å; I883-L909 HydrophobicContact CB-CD2 4.36Å; I883-L909 HydrophobicContact CG1-CD2 4.08Å; I883-L909 HydrophobicContact CG2-CD2 4.08Å
884	D	83.3	Confident	81.3	Confident	67 Å²	67	52.4 Å²	52.4	36%	0.358	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	-128.7	-171.2	-52.7	-50	0	0	0	110.8	H886 V907 D908	D884-H886 VanDerWaalsContact C-N 3.29Å; D884-H886 PolarHBondContact O-N 2.8Å; D884-V907 VanDerWaalsContact OD1-CA 3.28Å; D884-V907 WeakPolarHBondContact OD1-CA 3.49Å; D884-D908 WeakPolarHBondContact CA-O 3.26Å; D884-D908 PolarHBondContact N-O 2.9Å; D884-D908 PolarHBondContact OD1-N 2.74Å
885	E	76.4	Confident	81	Confident	191 Å²	191	56 Å²	56	89%	0.893	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-5	176.3	-58.8	-166.6	156.9	0	0	113.5	I883	I883-E885 PolarHBondContact O-N 3.13Å
886	H	78.1	Confident	81	Confident	107 Å²	107	51.5 Å²	51.5	50%	0.495	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	110.1	-174.1	-63.6	-59.4	0	0	0	112.6	A882 I883 D884 V888 L899	A882-H886 CarbonylContact C-O 3.58Å; A882-H886 VanDerWaalsContact CA-O 3.23Å; A882-H886 WeakPolarHBondContact CA-O 3.31Å; A882-H886 WeakPolarHBondContact CB-O 3.28Å; I883-H886 PolarHBondContact N-O 2.82Å; I883-H886 WeakPolarHBondContact O-CB 3.38Å; I883-H886 PolarHBondContact O-N 3.39Å; D884-H886 VanDerWaalsContact C-N 3.29Å; D884-H886 PolarHBondContact O-N 2.8Å; H886-V888 PolarHBondContact O-N 3.34Å; H886-L899 HydrophobicContact CB-CD1 3.79Å; H886-L899 HydrophobicContact CB-CD2 4.22Å
887	S	81.6	Confident	80.9	Confident	67 Å²	67	49.7 Å²	49.7	47%	0.469	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	130.4	171.7	-173.9	0	0	0	0	111.5	L881 Q889	L881-S887 PolarHBondContact O-OG 3.37Å; S887-Q889 PolarHBondContact OG-N 3.33Å
888	V	82.2	Confident	81	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.012	27%	0.273	C	S	.	.			trans	-104.6	2.2	174.3	-61.2	0	0	0	0	112.8	I857 L880 L881 I883 H886 G890 M891 A896 L899	I857-V888 HydrophobicContact CD1-CB 4.37Å; L880-V888 HydrophobicContact CB-CG2 4.45Å; L880-V888 HydrophobicContact CD2-CG2 4.24Å; L880-V888 HydrophobicContact CG-CG2 3.94Å; L881-V888 WeakPolarHBondContact O-CG2 3.4Å; L881-V888 PolarHBondContact O-N 2.82Å; I883-V888 HydrophobicContact CD1-CG1 3.89Å; I883-V888 HydrophobicContact CG1-CG1 4.19Å; H886-V888 PolarHBondContact O-N 3.34Å; V888-G890 PolarHBondContact O-N 3.25Å; V888-M891 PolarHBondContact O-N 2.94Å; V888-A896 HydrophobicContact CB-CB 4.22Å; V888-A896 HydrophobicContact CG1-CB 3.86Å; V888-L899 HydrophobicContact CG1-CD1 3.9Å
889	Q	76.4	Confident	80.6	Confident	109 Å²	109	50.9 Å²	50.9	51%	0.509	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	123.4	172.5	-67.9	-173.4	-34.6	0	0	110.7	L881 S887 M891	L881-Q889 HydrophobicContact CB-CG 4.3Å; L881-Q889 HydrophobicContact CD2-CG 4.15Å; L881-Q889 PolarHBondContact O-N 2.67Å; S887-Q889 PolarHBondContact OG-N 3.33Å; Q889-M891 VanDerWaalsContact C-N 3.3Å; Q889-M891 PolarHBondContact O-N 3.35Å
890	G	69.6	Low	80.1	Confident	32 Å²	32	50.7 Å²	50.7	33%	0.33	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	18.1	-179.2	0	0	0	0	0	114.5	I853 V888	I853-G890 WeakPolarHBondContact CG2-O 3.31Å; V888-G890 PolarHBondContact O-N 3.25Å
891	M	77.2	Confident	79.2	Confident	82 Å²	82	57.4 Å²	57.4	40%	0.404	31%	0.311	S	S	.	.	S	Bend	trans	-108.2	148.2	173.3	-65.7	-63	130.9	0	0	110.4	V888 Q889 H895	V888-M891 PolarHBondContact O-N 2.94Å; Q889-M891 VanDerWaalsContact C-N 3.3Å; Q889-M891 PolarHBondContact O-N 3.35Å; M891-H895 HydrophobicContact CB-CB 4.29Å
892	P	78.5	Confident	78.4	Confident	31 Å²	31	63.7 Å²	63.7	20%	0.201	35%	0.345	C	S	.	.			trans	-66.7	151.9	177	29.5	-35.8	0	0	0	111	E851 S894 H895	E851-P892 HydrophobicContact CB-CB 4.5Å; P892-S894 PolarHBondContact O-N 2.93Å; P892-S894 VanDerWaalsContact O-N 3.09Å; P892-H895 HydrophobicContact CG-CB 4.31Å; P892-H895 WeakPolarHBondContact O-CB 3.48Å; P892-H895 PolarHBondContact O-N 3.4Å
893	L	81.4	Confident	77.5	Confident	40 Å²	40	65.4 Å²	65.4	21%	0.209	35%	0.352	C	S	.	.	H	α-helix	trans	-50.5	-39.1	-179	-179.6	62.8	0	0	0	113.1	L847 S850 I857 H895 A896 T897	L847-L893 HydrophobicContact CB-CD1 3.78Å; L847-L893 HydrophobicContact CD1-CD1 4.11Å; S850-L893 PolarHBondContact O-N 3.17Å; S850-L893 VanDerWaalsContact O-N 3.14Å; I857-L893 HydrophobicContact CG2-CD1 4.08Å; L893-H895 PolarHBondContact O-N 3.49Å; L893-A896 PolarHBondContact O-N 3.3Å; L893-A896 VanDerWaalsContact O-N 3.17Å; L893-T897 PolarHBondContact O-N 2.85Å; L893-T897 PolarHBondContact O-OG1 3.45Å; L893-T897 VanDerWaalsContact O-OG1 3.08Å
894	S	78.7	Confident	76.5	Confident	58 Å²	58	67.6 Å²	67.6	41%	0.406	38%	0.375	S	S	.	.	H	α-helix	trans	-57.7	-31.6	177.9	50	0	0	0	0	113.9	P892 S898	P892-S894 PolarHBondContact O-N 2.93Å; P892-S894 VanDerWaalsContact O-N 3.09Å; S894-S898 WeakPolarHBondContact O-CB 3.42Å; S894-S898 PolarHBondContact O-N 3.3Å; S894-S898 PolarHBondContact O-OG 3.48Å
895	H	78.8	Confident	75.9	Confident	79 Å²	79	70 Å²	70	37%	0.366	39%	0.388	S	S	.	.	H	α-helix	trans	-72.2	-46	175.4	-170.8	63.9	0	0	0	111.6	M891 P892 L893 T897 S898 L899	M891-H895 HydrophobicContact CB-CB 4.29Å; P892-H895 HydrophobicContact CG-CB 4.31Å; P892-H895 WeakPolarHBondContact O-CB 3.48Å; P892-H895 PolarHBondContact O-N 3.4Å; L893-H895 PolarHBondContact O-N 3.49Å; H895-T897 VanDerWaalsContact C-N 3.34Å; H895-T897 PolarHBondContact O-N 2.85Å; H895-S898 WeakPolarHBondContact O-CB 3.29Å; H895-S898 PolarHBondContact O-N 2.79Å; H895-S898 VanDerWaalsContact O-N 3.16Å; H895-L899 PolarHBondContact O-N 2.94Å
896	A	80.4	Confident	76	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-62.2	-40.8	174.8	0	0	0	0	0	111.9	L847 I857 I883 V888 L893 S898 L899 L900	L847-A896 HydrophobicContact CD1-CB 4.18Å; I857-A896 HydrophobicContact CD1-CB 3.61Å; I883-A896 HydrophobicContact CD1-CB 4.21Å; I883-A896 WeakPolarHBondContact CD1-O 3.5Å; V888-A896 HydrophobicContact CB-CB 4.22Å; V888-A896 HydrophobicContact CG1-CB 3.86Å; L893-A896 PolarHBondContact O-N 3.3Å; L893-A896 VanDerWaalsContact O-N 3.17Å; A896-S898 VanDerWaalsContact C-N 3.32Å; A896-S898 PolarHBondContact O-N 2.87Å; A896-L899 PolarHBondContact O-N 3.22Å; A896-L900 WeakPolarHBondContact O-CG 3.37Å; A896-L900 PolarHBondContact O-N 2.93Å
897	T	80.4	Confident	76.2	Confident	51 Å²	51	58.8 Å²	58.8	31%	0.313	34%	0.337	S	S	.	.	H	α-helix	trans	-62.6	-37.7	173.6	-54.8	0	0	0	0	112.1	L893 H895 L899 L900 Q901	L893-T897 PolarHBondContact O-N 2.85Å; L893-T897 PolarHBondContact O-OG1 3.45Å; L893-T897 VanDerWaalsContact O-OG1 3.08Å; H895-T897 VanDerWaalsContact C-N 3.34Å; H895-T897 PolarHBondContact O-N 2.85Å; T897-L899 VanDerWaalsContact C-N 3.35Å; T897-L900 PolarHBondContact O-N 3.35Å; T897-Q901 VanDerWaalsContact O-CG 3.31Å; T897-Q901 WeakPolarHBondContact O-CG 3.41Å; T897-Q901 PolarHBondContact O-N 3.12Å
898	S	78.7	Confident	76.3	Confident	56 Å²	56	58 Å²	58	39%	0.392	33%	0.328	S	S	.	.	H	α-helix	trans	-66.1	-36.3	176.6	-59.3	0	0	0	0	112.3	S894 H895 A896 Q901 N902	S894-S898 WeakPolarHBondContact O-CB 3.42Å; S894-S898 PolarHBondContact O-N 3.3Å; S894-S898 PolarHBondContact O-OG 3.48Å; H895-S898 WeakPolarHBondContact O-CB 3.29Å; H895-S898 PolarHBondContact O-N 2.79Å; H895-S898 VanDerWaalsContact O-N 3.16Å; A896-S898 VanDerWaalsContact C-N 3.32Å; A896-S898 PolarHBondContact O-N 2.87Å; S898-Q901 PolarHBondContact O-N 3.41Å; S898-N902 PolarHBondContact O-ND2 2.64Å
899	L	78.8	Confident	76.5	Confident	32 Å²	32	58 Å²	58	17%	0.168	33%	0.327	C	S	.	.	H	α-helix	trans	-66.6	-46.5	172.1	-67.3	168.5	0	0	0	110.8	I883 H886 V888 H895 A896 T897 Q901 N902 L903	I883-L899 HydrophobicContact CB-CB 4.4Å; I883-L899 HydrophobicContact CD1-CB 3.76Å; I883-L899 HydrophobicContact CD1-CD1 4.22Å; I883-L899 HydrophobicContact CG2-CB 4.29Å; H886-L899 HydrophobicContact CB-CD1 3.79Å; H886-L899 HydrophobicContact CB-CD2 4.22Å; V888-L899 HydrophobicContact CG1-CD1 3.9Å; H895-L899 PolarHBondContact O-N 2.94Å; A896-L899 PolarHBondContact O-N 3.22Å; T897-L899 VanDerWaalsContact C-N 3.35Å; L899-Q901 PolarHBondContact O-N 3.4Å; L899-Q901 VanDerWaalsContact O-N 3.1Å; L899-N902 PolarHBondContact O-N 2.78Å; L899-N902 VanDerWaalsContact O-N 3.1Å; L899-L903 WeakPolarHBondContact O-CD2 3.48Å
900	L	74.9	Confident	76.9	Confident	36 Å²	36	57.1 Å²	57.1	19%	0.188	32%	0.322	C	S	.	.	H	α-helix	trans	-65	-10.5	175.8	-66	-172	0	0	0	115	L843 I845 L847 I883 A896 T897 L903 L909	L843-L900 HydrophobicContact CD1-CD2 3.93Å; I845-L900 HydrophobicContact CD1-CD1 3.89Å; I845-L900 HydrophobicContact CD1-CD2 4.44Å; I845-L900 HydrophobicContact CG1-CD1 4.26Å; L847-L900 HydrophobicContact CD1-CD1 3.6Å; L847-L900 HydrophobicContact CD2-CD1 4.5Å; L847-L900 HydrophobicContact CG-CD1 4.02Å; I883-L900 HydrophobicContact CD1-CD2 3.68Å; I883-L900 HydrophobicContact CD1-CG 3.77Å; I883-L900 HydrophobicContact CG1-CD2 4.07Å; I883-L900 HydrophobicContact CG2-CD2 4.07Å; A896-L900 WeakPolarHBondContact O-CG 3.37Å; A896-L900 PolarHBondContact O-N 2.93Å; T897-L900 PolarHBondContact O-N 3.35Å; L900-L903 HydrophobicContact CB-CD1 4.43Å; L900-L903 HydrophobicContact CD2-CD1 4.18Å; L900-L903 HydrophobicContact CD2-CD2 4.32Å; L900-L903 VanDerWaalsContact O-CD1 3.23Å; L900-L903 WeakPolarHBondContact O-CD1 3.35Å; L900-L909 HydrophobicContact CD2-CD2 4.34Å
901	Q	70.8	Confident	77.9	Confident	144 Å²	144	55.6 Å²	55.6	67%	0.673	31%	0.306	S	S	*	.	H	α-helix	trans	-94.3	-16.6	174.5	-76.4	174	-0.8	0	0	113.6	T897 S898 L899	T897-Q901 VanDerWaalsContact O-CG 3.31Å; T897-Q901 WeakPolarHBondContact O-CG 3.41Å; T897-Q901 PolarHBondContact O-N 3.12Å; S898-Q901 PolarHBondContact O-N 3.41Å; L899-Q901 PolarHBondContact O-N 3.4Å; L899-Q901 VanDerWaalsContact O-N 3.1Å
902	N	67.2	Low	78.3	Confident	140 Å²	140	52.2 Å²	52.2	75%	0.749	29%	0.29	S	S	*	.	S	Bend	trans	-116.3	35.6	-175.9	-66.6	-78.6	0	0	0	112	S898 L899	S898-N902 PolarHBondContact O-ND2 2.64Å; L899-N902 PolarHBondContact O-N 2.78Å; L899-N902 VanDerWaalsContact O-N 3.1Å
903	L	67.2	Low	78.6	Confident	48 Å²	48	54.2 Å²	54.2	25%	0.251	29%	0.293	S	S	.	.			trans	-76.8	143.7	-175.8	-60.9	171.1	0	0	0	112.3	L843 I883 L899 L900 V907	L843-L903 HydrophobicContact CD1-CD1 3.55Å; L843-L903 HydrophobicContact CG-CD1 3.89Å; I883-L903 HydrophobicContact CG2-CD2 3.96Å; L899-L903 WeakPolarHBondContact O-CD2 3.48Å; L900-L903 HydrophobicContact CB-CD1 4.43Å; L900-L903 HydrophobicContact CD2-CD1 4.18Å; L900-L903 HydrophobicContact CD2-CD2 4.32Å; L900-L903 VanDerWaalsContact O-CD1 3.23Å; L900-L903 WeakPolarHBondContact O-CD1 3.35Å; L903-V907 HydrophobicContact CB-CG2 3.85Å; L903-V907 HydrophobicContact CD1-CG2 4.07Å; L903-V907 HydrophobicContact CD2-CB 4.5Å; L903-V907 HydrophobicContact CD2-CG1 3.85Å; L903-V907 HydrophobicContact CD2-CG2 3.78Å; L903-V907 HydrophobicContact CG-CG2 4.1Å
904	G	65.7	Low	78.1	Confident	47 Å²	47	55.1 Å²	55.1	49%	0.485	30%	0.303	S	S	.	.			trans	-81	-172.6	170	0	0	0	0	0	113	P838 L906	P838-G904 WeakPolarHBondContact CG-O 3.42Å; G904-L906 PolarHBondContact O-N 3.33Å; G904-L906 VanDerWaalsContact O-N 3.07Å
905	D	70.9	Confident	76.6	Confident	119 Å²	119	57.7 Å²	57.7	64%	0.636	31%	0.309	S	S	*	.	S	Bend	trans	-63.8	-9.5	174.6	-78.3	-49.5	0	0	0	114.4	E837 P838	E837-D905 WeakPolarHBondContact CA-O 3.33Å; P838-D905 VanDerWaalsContact CD-O 3.32Å; P838-D905 WeakPolarHBondContact CD-O 3.3Å
906	L	78.3	Confident	74.7	Confident	62 Å²	62	60.7 Å²	60.7	33%	0.325	33%	0.327	S	S	.	.			trans	-139.6	140.4	-178.6	-173.4	78.1	0	0	0	109.4	R835 L836 E837 G904	R835-L906 HydrophobicContact CG-CD1 3.79Å; R835-L906 HydrophobicContact CG-CG 4.46Å; R835-L906 VanDerWaalsContact CZ-CD2 3.44Å; L836-L906 CarbonylContact O-C 3.57Å; L836-L906 WeakPolarHBondContact O-CA 3.35Å; E837-L906 HydrophobicContact CG-CD1 3.79Å; G904-L906 PolarHBondContact O-N 3.33Å; G904-L906 VanDerWaalsContact O-N 3.07Å
907	V	82	Confident	72.5	Confident	0 Å²	0	68 Å²	68	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	128.7	179.8	-172.7	0	0	0	0	110.6	R835 L836 P838 L843 I883 D884 L903 L909	R835-V907 CarbonylContact C-O 3.33Å; R835-V907 WeakPolarHBondContact CA-O 3.49Å; L836-V907 PolarHBondContact N-O 2.7Å; L836-V907 PolarHBondContact O-N 3.27Å; P838-V907 HydrophobicContact CG-CG2 3.88Å; L843-V907 HydrophobicContact CD2-CG2 4.37Å; I883-V907 HydrophobicContact CG2-CG1 4.28Å; D884-V907 VanDerWaalsContact OD1-CA 3.28Å; D884-V907 WeakPolarHBondContact OD1-CA 3.49Å; L903-V907 HydrophobicContact CB-CG2 3.85Å; L903-V907 HydrophobicContact CD1-CG2 4.07Å; L903-V907 HydrophobicContact CD2-CB 4.5Å; L903-V907 HydrophobicContact CD2-CG1 3.85Å; L903-V907 HydrophobicContact CD2-CG2 3.78Å; L903-V907 HydrophobicContact CG-CG2 4.1Å; V907-L909 HydrophobicContact CG1-CD2 3.67Å; V907-L909 HydrophobicContact CG1-CG 4.05Å
908	D	83.7	Confident	70.1	Confident	51 Å²	51	70.7 Å²	70.7	27%	0.273	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	100.4	175.3	-80.9	-27.3	0	0	0	110.3	T833 R835 D884	T833-D908 HydrophobicContact CG2-CB 4.01Å; R835-D908 WeakPolarHBondContact CA-OD1 3.44Å; R835-D908 WeakPolarHBondContact CB-OD1 3.15Å; R835-D908 VanDerWaalsContact CD-OD1 3.3Å; R835-D908 WeakPolarHBondContact CD-OD1 3.18Å; R835-D908 WeakPolarHBondContact CG-OD1 3.25Å; D884-D908 WeakPolarHBondContact CA-O 3.26Å; D884-D908 PolarHBondContact N-O 2.9Å; D884-D908 PolarHBondContact OD1-N 2.74Å
909	L	87.4	Confident	67.7	Low	0 Å²	0	73.8 Å²	73.8	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	118.9	179.7	-60.9	-178.9	0	0	0	111	T833 V834 L836 L843 I845 I874 L880 I883 L900 V907 I911	T833-L909 CarbonylContact C-O 3.59Å; T833-L909 WeakPolarHBondContact CA-O 3.32Å; V834-L909 PolarHBondContact N-O 2.83Å; V834-L909 PolarHBondContact O-N 3.11Å; L836-L909 HydrophobicContact CD1-CD1 3.86Å; L843-L909 HydrophobicContact CD1-CD1 4.37Å; I845-L909 HydrophobicContact CD1-CD1 4.07Å; I874-L909 HydrophobicContact CD1-CD1 3.96Å; L880-L909 HydrophobicContact CD1-CB 4.26Å; L880-L909 HydrophobicContact CD1-CD2 4.29Å; I883-L909 HydrophobicContact CB-CD2 4.36Å; I883-L909 HydrophobicContact CG1-CD2 4.08Å; I883-L909 HydrophobicContact CG2-CD2 4.08Å; L900-L909 HydrophobicContact CD2-CD2 4.34Å; V907-L909 HydrophobicContact CG1-CD2 3.67Å; V907-L909 HydrophobicContact CG1-CG 4.05Å; L909-I911 HydrophobicContact CB-CD1 4.3Å; L909-I911 HydrophobicContact CB-CG1 4.33Å
910	K	85.4	Confident	65.2	Low	91 Å²	91	76.2 Å²	76.2	40%	0.396	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	116.5	175.2	-167.3	174.6	-176.1	173.7	0	110.4	I831 L881 A882	I831-K910 HydrophobicContact CG2-CG 4.21Å; L881-K910 HydrophobicContact CB-CB 4.43Å; L881-K910 HydrophobicContact CB-CG 4.34Å; L881-K910 WeakPolarHBondContact CB-O 3.35Å; L881-K910 PolarHBondContact N-O 2.85Å; A882-K910 HydrophobicContact CB-CB 3.85Å; A882-K910 PolarHBondContact N-O 3.14Å; A882-K910 PolarHBondContact O-N 3.21Å
911	I	90.5	Very high	63	Low	0 Å²	0	79.7 Å²	79.7	0%	0	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	146	-168.5	-65.2	175.7	0	0	0	110.7	I831 F832 V834 I859 I874 D878 L880 L909	I831-I911 WeakPolarHBondContact CA-O 3.26Å; F832-I911 HydrophobicContact CE1-CB 4.15Å; F832-I911 HydrophobicContact CE1-CG2 3.72Å; F832-I911 HydrophobicContact CE2-CB 4.28Å; F832-I911 HydrophobicContact CE2-CG2 4.33Å; F832-I911 HydrophobicContact CZ-CB 3.92Å; F832-I911 HydrophobicContact CZ-CG2 3.52Å; F832-I911 PolarHBondContact N-O 2.85Å; F832-I911 PolarHBondContact O-N 2.93Å; V834-I911 HydrophobicContact CB-CD1 4.26Å; V834-I911 HydrophobicContact CG2-CD1 3.95Å; I859-I911 HydrophobicContact CD1-CD1 4.47Å; I874-I911 HydrophobicContact CB-CD1 4.4Å; I874-I911 HydrophobicContact CD1-CD1 3.74Å; I874-I911 HydrophobicContact CG1-CD1 3.64Å; I874-I911 HydrophobicContact CG2-CD1 4.13Å; D878-I911 HydrophobicContact CB-CG2 3.66Å; L880-I911 HydrophobicContact CD1-CG1 4.37Å; L909-I911 HydrophobicContact CB-CD1 4.3Å; L909-I911 HydrophobicContact CB-CG1 4.33Å
912	L	85.6	Confident	61.1	Low	11 Å²	11	79.8 Å²	79.8	6%	0.058	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	114.8	176.5	178.5	72.6	0	0	0	109.1	Q829 I831 Q879 L881	Q829-L912 HydrophobicContact CB-CD1 3.93Å; Q829-L912 HydrophobicContact CG-CD1 3.77Å; Q829-L912 HydrophobicContact CG-CG 4.15Å; I831-L912 HydrophobicContact CD1-CD1 4.13Å; I831-L912 HydrophobicContact CG1-CD1 3.4Å; Q879-L912 HydrophobicContact CB-CB 4.18Å; Q879-L912 HydrophobicContact CB-CD2 4.42Å; Q879-L912 PolarHBondContact N-O 3.26Å; Q879-L912 PolarHBondContact O-N 3.07Å; L881-L912 HydrophobicContact CD1-CB 3.92Å; L881-L912 HydrophobicContact CD2-CB 3.69Å; L881-L912 HydrophobicContact CD2-CD2 3.91Å; L881-L912 HydrophobicContact CD2-CG 4.43Å; L881-L912 HydrophobicContact CG-CB 3.77Å
913	R	83.9	Confident	59	Low	73 Å²	73	80.3 Å²	80.3	28%	0.275	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	111.4	172.9	-175	172.1	-63.1	144.7	7	109.4	I830 F832 Q873 H875 D878	I830-R913 PolarHBondContact N-O 3.35Å; I830-R913 PolarHBondContact O-N 3Å; F832-R913 HydrophobicContact CE1-CB 3.92Å; Q873-R913 PolarHBondContact O-NH2 2.91Å; H875-R913 PolarHBondContact ND1-NH2 3.32Å; D878-R913 IonicContact OD1-CZ 3.9Å; D878-R913 IonicContact OD1-NE 2.72Å; D878-R913 PolarHBondContact OD1-NE 2.63Å; D878-R913 IonicContact OD1-NH2 2.71Å; D878-R913 PolarHBondContact OD1-NH2 3.39Å; D878-R913 IonicContact OD2-CZ 3.42Å; D878-R913 IonicContact OD2-NE 3.65Å; D878-R913 IonicContact OD2-NH2 3.17Å; D878-R913 PolarHBondContact OD2-NH2 2.83Å
914	S	71.5	Confident	57.1	Low	59 Å²	59	83.7 Å²	83.7	41%	0.413	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65	130.4	161.9	-59.8	0	0	0	0	108.2	Q829 D916	Q829-S914 PolarHBondContact NE2-OG 3.13Å; S914-D916 VanDerWaalsContact C-N 3.26Å; S914-D916 PolarHBondContact O-N 3.49Å
915	H	46.8	Very low	55.2	Low	113 Å²	113	88.9 Å²	88.9	52%	0.523	50%	0.504	S	S	.	.			trans	-82.6	73.3	178.3	-173.3	-65.2	0	0	0	110.5	H828	H828-H915 HydrophobicContact CB-CB 3.96Å; H828-H915 PolarHBondContact O-N 3.33Å
916	D	39.4	Very low	53	Low	142 Å²	142	88.3 Å²	88.3	76%	0.759	51%	0.505	S	S	*	.			trans	-70.2	143.2	160.4	-80.7	-51.7	0	0	0	110.1	S914 A918	S914-D916 VanDerWaalsContact C-N 3.26Å; S914-D916 PolarHBondContact O-N 3.49Å; D916-A918 PolarHBondContact O-N 2.77Å
917	L	33.2	Very low	50.5	Low	153 Å²	153	93.8 Å²	93.8	80%	0.801	53%	0.529	S	S	*	.			trans	-69.3	123.3	-177.8	-74.9	160.5	0	0	0	110.3	N919	L917-N919 PolarHBondContact O-N 2.72Å; L917-N919 VanDerWaalsContact O-N 3.14Å
918	A	29.4	Very low	47.9	Very low	107 Å²	107	97.4 Å²	97.4	88%	0.884	56%	0.559	S	S	*	*			trans	-61.8	113.7	-172	0	0	0	0	0	112.8	D916	D916-A918 PolarHBondContact O-N 2.77Å
919	N	28.6	Very low	45.1	Very low	121 Å²	121	102.9 Å²	102.9	65%	0.647	59%	0.586	S	S	*	*			trans	-112.2	77.2	175	-157.5	20.3	0	0	0	110.1	L917 S921	L917-N919 PolarHBondContact O-N 2.72Å; L917-N919 VanDerWaalsContact O-N 3.14Å; N919-S921 PolarHBondContact O-N 2.85Å
920	G	26.3	Very low	42.2	Very low	84 Å²	84	111.9 Å²	111.9	87%	0.866	62%	0.621	S	S	*	*			trans	-81.1	57	-166.1	0	0	0	0	0	116.6
921	S	30.1	Very low	39.4	Very low	109 Å²	109	111 Å²	111	76%	0.762	63%	0.631	S	S	*	*			trans	-165.3	73.6	161.5	64.1	0	0	0	0	113.1	N919	N919-S921 PolarHBondContact O-N 2.85Å
922	H	29.3	Very low	36.4	Very low	145 Å²	145	120.8 Å²	120.8	67%	0.671	67%	0.674	S	S	*	*			trans	-136.7	111.8	168	-161.6	-93.3	0	0	0	109.5
923	L	24.3	Very low	33.7	Very low	151 Å²	151	125.4 Å²	125.4	79%	0.791	70%	0.702	S	S	*	*			trans	-61.5	144.5	163.3	-85.3	68.4	0	0	0	107.7	Q925	L923-Q925 PolarHBondContact O-N 3.44Å
924	P	27.7	Very low	31	Very low	120 Å²	120	131 Å²	131	78%	0.779	73%	0.731	S	S	*	*			trans	-72.1	77.7	-177.7	30.2	-35.6	0	0	0	111.6	T926	P924-T926 PolarHBondContact O-N 2.88Å; P924-T926 VanDerWaalsContact O-N 3.07Å; P924-T926 PolarHBondContact O-OG1 3.22Å
925	Q	24.1	Very low	28.8	Very low	156 Å²	156	134.5 Å²	134.5	73%	0.729	74%	0.736	S	S	*	*			trans	-62.7	110.7	168.1	-163.1	171.4	22	0	0	107.6	L923 Q927	L923-Q925 PolarHBondContact O-N 3.44Å; Q925-Q927 PolarHBondContact O-N 2.88Å
926	T	26.2	Very low	27.8	Very low	107 Å²	107	140.2 Å²	140.2	66%	0.656	75%	0.752	S	S	*	*			trans	-72.9	96.7	-165.7	-64.7	0	0	0	0	109.9	P924 A928	P924-T926 PolarHBondContact O-N 2.88Å; P924-T926 VanDerWaalsContact O-N 3.07Å; P924-T926 PolarHBondContact O-OG1 3.22Å; T926-A928 PolarHBondContact O-N 3.03Å; T926-A928 VanDerWaalsContact O-N 3.14Å
927	Q	25.5	Very low	27.1	Very low	177 Å²	177	139.7 Å²	139.7	83%	0.827	76%	0.757	S	S	*	*			trans	-62.4	116.2	174.5	-70.6	-172.2	-5.9	0	0	109.6	Q925 I929	Q925-Q927 PolarHBondContact O-N 2.88Å; Q927-I929 PolarHBondContact O-N 2.79Å
928	A	26.3	Very low	26.8	Very low	75 Å²	75	143.9 Å²	143.9	62%	0.62	76%	0.762	S	S	*	*			trans	-58.6	129.3	174.6	0	0	0	0	0	109.9	T926 Y930	T926-A928 PolarHBondContact O-N 3.03Å; T926-A928 VanDerWaalsContact O-N 3.14Å; A928-Y930 VanDerWaalsContact C-N 3.34Å; A928-Y930 WeakPolarHBondContact O-CD2 3.2Å; A928-Y930 PolarHBondContact O-N 3.45Å
929	I	25.9	Very low	26.7	Very low	166 Å²	166	143.6 Å²	143.6	85%	0.851	75%	0.754	S	S	*	*			trans	-71.7	90	-176.5	-57.2	173.9	0	0	0	109.4	Q927 A931	Q927-I929 PolarHBondContact O-N 2.79Å; I929-A931 VanDerWaalsContact C-N 3.33Å; I929-A931 PolarHBondContact O-N 2.86Å
930	Y	25.8	Very low	26.7	Very low	189 Å²	189	143.7 Å²	143.7	74%	0.741	76%	0.761	S	S	*	*			trans	-66.7	91	167.7	-83.3	-83.9	0	0	0	109.8	A928 K932	A928-Y930 VanDerWaalsContact C-N 3.34Å; A928-Y930 WeakPolarHBondContact O-CD2 3.2Å; A928-Y930 PolarHBondContact O-N 3.45Å; Y930-K932 PolarHBondContact O-N 3.08Å
931	A	27.6	Very low	26.7	Very low	72 Å²	72	145.3 Å²	145.3	60%	0.595	76%	0.759	S	S	*	*			trans	-59.8	119.5	167.9	0	0	0	0	0	109	I929 V933	I929-A931 VanDerWaalsContact C-N 3.33Å; I929-A931 PolarHBondContact O-N 2.86Å; A931-V933 HydrophobicContact CB-CG2 4.41Å; A931-V933 PolarHBondContact O-N 2.99Å
932	K	26.3	Very low	26.6	Very low	207 Å²	207	144.7 Å²	144.7	90%	0.9	76%	0.761	S	S	*	*			trans	-72	72.8	-179.8	-168.1	168.2	-176.4	169.2	0	110.9	Y930 Q934	Y930-K932 PolarHBondContact O-N 3.08Å; K932-Q934 PolarHBondContact O-N 3.19Å; K932-Q934 VanDerWaalsContact O-N 3.16Å
933	V	28.4	Very low	26.4	Very low	108 Å²	108	145.2 Å²	145.2	66%	0.655	77%	0.768	S	S	*	*			trans	-67.9	109.4	-178.3	178.3	0	0	0	0	109.7	A931 R935	A931-V933 HydrophobicContact CB-CG2 4.41Å; A931-V933 PolarHBondContact O-N 2.99Å; V933-R935 HydrophobicContact CG1-CG 4.28Å; V933-R935 PolarHBondContact O-N 3.13Å
934	Q	27.8	Very low	26.6	Very low	190 Å²	190	144.6 Å²	144.6	89%	0.888	77%	0.771	S	S	*	*			trans	-64	116.2	172	-63.8	174.9	-7.9	0	0	110.1	K932	K932-Q934 PolarHBondContact O-N 3.19Å; K932-Q934 VanDerWaalsContact O-N 3.16Å
935	R	25.3	Very low	26.7	Very low	133 Å²	133	147.5 Å²	147.5	50%	0.502	77%	0.774	S	S	.	*			trans	-115.8	124.2	165	-70.5	-170.9	172.1	-155.1	-6.4	109.5	V933 D992 G993	V933-R935 HydrophobicContact CG1-CG 4.28Å; V933-R935 PolarHBondContact O-N 3.13Å; R935-D992 PolarHBondContact NH2-O 3.21Å; R935-D992 VanDerWaalsContact NH2-O 3.09Å; R935-G993 PolarHBondContact NH1-O 2.91Å; R935-G993 PolarHBondContact NH2-O 3.5Å
936	R	25.4	Very low	26.8	Very low	232 Å²	232	145 Å²	145	88%	0.875	78%	0.78	S	S	*	*			trans	-76.1	142.9	162.5	-68.8	176.9	177.2	150.9	-0.7	108	R938	R936-R938 PolarHBondContact O-N 2.8Å
937	P	26	Very low	27	Very low	132 Å²	132	145.6 Å²	145.6	86%	0.857	79%	0.789	S	S	*	*			trans	-60.7	135.1	167.3	27.1	-33.5	0	0	0	109.7
938	R	27.2	Very low	27.2	Very low	240 Å²	240	147 Å²	147	91%	0.906	79%	0.792	S	S	*	*			trans	-117.7	141.2	162.5	-78.6	-172.1	170.7	119.5	-6.6	107.7	R936	R936-R938 PolarHBondContact O-N 2.8Å
939	S	26.8	Very low	27.3	Very low	101 Å²	101	153 Å²	153	71%	0.706	81%	0.808	S	S	*	*			trans	-65.4	150.9	179.2	40.7	0	0	0	0	111.9	S941	S939-S941 PolarHBondContact O-N 2.72Å
940	P	28.3	Very low	27.5	Very low	124 Å²	124	150.8 Å²	150.8	81%	0.805	81%	0.807	S	S	*	*			trans	-64.9	123.5	172.3	-14.8	29.1	0	0	0	109.9
941	S	27	Very low	27.6	Very low	118 Å²	118	145.7 Å²	145.7	83%	0.825	81%	0.812	S	S	*	*			trans	-98.9	103.5	164.3	-62	0	0	0	0	107.7	S939	S939-S941 PolarHBondContact O-N 2.72Å
942	A	26.5	Very low	27.6	Very low	96 Å²	96	148.7 Å²	148.7	79%	0.793	83%	0.828	S	S	*	*			trans	-74.9	124.7	175.4	0	0	0	0	0	109.7
943	N	26.5	Very low	27.6	Very low	156 Å²	156	141.9 Å²	141.9	83%	0.834	82%	0.817	S	S	*	*			trans	-160.7	104.6	166.6	-116.6	-11.6	0	0	0	111
944	T	28.4	Very low	27.5	Very low	137 Å²	137	145.3 Å²	145.3	84%	0.84	83%	0.832	S	S	*	*			trans	155.4	107	136.6	-62.8	0	0	0	0	108.1
945	E	28.4	Very low	27.7	Very low	181 Å²	181	140.6 Å²	140.6	85%	0.846	83%	0.825	S	S	*	*			trans	-75.4	150.5	171.4	-64	177.2	125.7	0	0	110.9	S947	E945-S947 PolarHBondContact O-N 3.27Å
946	A	27.8	Very low	27.8	Very low	104 Å²	104	142.4 Å²	142.4	86%	0.86	85%	0.845	S	S	*	*			trans	-92.8	96.5	175.2	0	0	0	0	0	110.9	K948	A946-K948 PolarHBondContact O-N 2.72Å
947	S	29.3	Very low	27.9	Very low	120 Å²	120	135 Å²	135	84%	0.839	84%	0.84	S	S	*	*			trans	-78.7	111.7	171.5	-49.4	0	0	0	0	111	E945	E945-S947 PolarHBondContact O-N 3.27Å
948	K	30.5	Very low	27.9	Very low	207 Å²	207	132.9 Å²	132.9	90%	0.9	84%	0.843	S	S	*	*			trans	-108.3	124.6	158.6	-78.9	-176.9	178.6	175.8	0	108.6	A946	A946-K948 PolarHBondContact O-N 2.72Å
949	E	27.6	Very low	27.9	Very low	201 Å²	201	125.4 Å²	125.4	94%	0.939	84%	0.84	S	S	*	*			trans	-145.6	167.8	154.5	-139.4	168.8	-144.6	0	0	110.8
950	S	31.4	Very low	28.3	Very low	119 Å²	119	125.5 Å²	125.5	83%	0.832	85%	0.847	S	S	*	*			trans	-110.2	152.5	-157.1	54.9	0	0	0	0	113.8
951	G	27.4	Very low	28.5	Very low	82 Å²	82	126.2 Å²	126.2	85%	0.845	85%	0.849	S	S	*	*			trans	-159	138	175.3	0	0	0	0	0	111.2
952	S	27.9	Very low	28.8	Very low	134 Å²	134	128.2 Å²	128.2	94%	0.937	85%	0.85	S	S	*	*			trans	-119.3	150.1	-177.6	-179	0	0	0	0	110.7
953	G	26.2	Very low	29	Very low	65 Å²	65	127.2 Å²	127.2	67%	0.67	85%	0.849	S	S	*	*			trans	136.6	100.2	154.7	0	0	0	0	0	118
954	N	26.1	Very low	29.3	Very low	180 Å²	180	127.4 Å²	127.4	96%	0.963	85%	0.85	S	S	*	*			trans	59.3	168.2	148.3	-78.8	0.7	0	0	0	120.7
955	A	31.8	Very low	29.7	Very low	90 Å²	90	126.1 Å²	126.1	74%	0.744	85%	0.847	S	S	*	*			trans	-130.2	150.2	-169.5	0	0	0	0	0	112.2
956	N	27.2	Very low	30	Very low	172 Å²	172	121.6 Å²	121.6	92%	0.92	85%	0.848	S	S	*	*			trans	-174.6	161.9	135.4	-113.5	-27.3	0	0	0	113.2
957	G	26.6	Very low	30.6	Very low	75 Å²	75	122 Å²	122	77%	0.773	85%	0.845	S	S	*	*			trans	84	108.6	152.4	0	0	0	0	0	116.8
958	G	27.4	Very low	31.4	Very low	89 Å²	89	118.6 Å²	118.6	92%	0.918	83%	0.829	S	S	*	*			trans	-83.9	167	174.5	0	0	0	0	0	114.4
959	G	27.3	Very low	32.5	Very low	83 Å²	83	117.2 Å²	117.2	86%	0.856	82%	0.823	S	S	*	*			trans	175.6	117.5	172.5	0	0	0	0	0	110
960	A	34.5	Very low	34.6	Very low	102 Å²	102	110.9 Å²	110.9	84%	0.843	80%	0.799	S	S	*	*			trans	-100.6	143.6	-179.9	0	0	0	0	0	111.3
961	V	32.2	Very low	37	Very low	140 Å²	140	112.2 Å²	112.2	85%	0.848	79%	0.786	S	S	*	*			trans	-163.6	148.5	146.4	136	0	0	0	0	109.8
962	N	33.7	Very low	40	Very low	160 Å²	160	112.6 Å²	112.6	86%	0.856	77%	0.772	S	S	*	*			trans	-46	155.4	-174.1	-52.8	-33	0	0	0	117.5
963	G	30.4	Very low	42.9	Very low	74 Å²	74	108.5 Å²	108.5	76%	0.763	74%	0.737	S	S	*	*			trans	-162.7	-5.3	177.5	0	0	0	0	0	122.4
964	N	33.8	Very low	45.9	Very low	160 Å²	160	109.9 Å²	109.9	86%	0.856	73%	0.726	S	S	*	*			trans	45.4	96.8	167.5	-175.1	79.6	0	0	0	119.6
965	S	35	Very low	49.1	Very low	111 Å²	111	101.3 Å²	101.3	78%	0.776	68%	0.68	S	S	*	*				-173.6	124.1	125.8	42.5	0	0	0	0	110.1	S967	S965-S967 PolarHBondContact O-N 2.81Å
966	G	35.7	Very low	51.9	Low	85 Å²	85	99.4 Å²	99.4	88%	0.876	66%	0.659	S	S	*	*			trans	-90.5	101.2	-175.5	0	0	0	0	0	112.1	G968	G966-G968 PolarHBondContact O-N 3.04Å
967	S	40.3	Very low	54.9	Low	113 Å²	113	91.4 Å²	91.4	79%	0.79	62%	0.616	S	S	*	*			trans	-73.9	108	161.9	45.7	0	0	0	0	109.1	S965 K969	S965-S967 PolarHBondContact O-N 2.81Å; S967-K969 PolarHBondContact O-N 3.24Å
968	G	45.4	Very low	57.9	Low	48 Å²	48	95 Å²	95	50%	0.495	61%	0.608	S	S	.	*	P	Polyproline II helix	trans	-57.4	118.5	177.5	0	0	0	0	0	110.6	G966	G966-G968 PolarHBondContact O-N 3.04Å
969	K	54.7	Low	60.7	Low	179 Å²	179	93.1 Å²	93.1	78%	0.778	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-71.9	124.6	172.7	-70.2	-175.6	179.3	-179.3	0	107.9	S967 R971	S967-K969 PolarHBondContact O-N 3.24Å; K969-R971 PolarHBondContact O-N 3.27Å
970	P	70.6	Confident	63.4	Low	67 Å²	67	90.5 Å²	90.5	44%	0.435	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-58.6	126.6	-178.8	22.2	-32.3	0	0	0	110.4	Q1054	P970-Q1054 HydrophobicContact CB-CG 3.79Å
971	R	83.6	Confident	65.4	Low	147 Å²	147	95.4 Å²	95.4	56%	0.555	54%	0.543	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	112.6	-175.4	-62.3	-178.7	74.2	170.9	5	108.8	K969 R1055 E1057	K969-R971 PolarHBondContact O-N 3.27Å; R971-R1055 PolarHBondContact N-O 3.49Å; R971-R1055 PolarHBondContact O-N 3.41Å; R971-E1057 WeakPolarHBondContact CD-OE1 3.45Å; R971-E1057 WeakPolarHBondContact CD-OE2 3.45Å; R971-E1057 IonicContact CZ-OE1 3.12Å; R971-E1057 IonicContact NE-OE1 3.64Å; R971-E1057 IonicContact NH1-OE1 3.83Å; R971-E1057 PolarHBondContact NH1-OE1 2.64Å; R971-E1057 IonicContact NH1-OE2 3.61Å
972	V	88.8	Confident	67.3	Low	91 Å²	91	94.5 Å²	94.5	55%	0.552	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	133.1	179	-176	0	0	0	0	109.6	I1052 M1053 Q1054	V972-I1052 HydrophobicContact CG1-CG2 3.4Å; V972-M1053 CarbonylContact C-O 3.6Å; V972-M1053 VanDerWaalsContact CA-O 3.27Å; V972-M1053 WeakPolarHBondContact CA-O 3.12Å; V972-Q1054 HydrophobicContact CG2-CB 4.34Å; V972-Q1054 HydrophobicContact CG2-CG 4.48Å
973	F	89.4	Confident	69.2	Low	47 Å²	47	92.9 Å²	92.9	21%	0.206	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	151.8	-178.9	60.1	-78	0	0	0	111.4	V975 L1015 M1053 R1055	F973-V975 HydrophobicContact CD2-CG2 3.66Å; F973-V975 HydrophobicContact CE2-CG2 3.53Å; F973-L1015 HydrophobicContact CE2-CB 4.35Å; F973-M1053 HydrophobicContact CD1-CB 4.24Å; F973-M1053 HydrophobicContact CD2-CB 4.2Å; F973-M1053 HydrophobicContact CE1-CB 3.8Å; F973-M1053 HydrophobicContact CE2-CB 3.78Å; F973-M1053 HydrophobicContact CE2-CG 4.23Å; F973-M1053 HydrophobicContact CG-CB 4.42Å; F973-M1053 HydrophobicContact CZ-CB 3.56Å; F973-M1053 HydrophobicContact CZ-CG 4.35Å; F973-M1053 PolarHBondContact N-O 3.23Å; F973-M1053 PolarHBondContact O-N 2.89Å; F973-R1055 HydrophobicContact CE1-CB 3.92Å
974	H	90.3	Very high	71.7	Confident	94 Å²	94	94.5 Å²	94.5	44%	0.435	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	142.1	176.1	-172.6	104.6	0	0	0	110.3	T976 E1050 M1051	H974-T976 PolarHBondContact NE2-OG1 2.78Å; H974-E1050 WeakPolarHBondContact CE1-CB 3.16Å; H974-E1050 VanDerWaalsContact CE1-CD 3.47Å; H974-E1050 IonicContact CE1-OE2 2.6Å; H974-E1050 PolarHBondContact CE1-OE2 3.36Å; H974-E1050 WeakPolarHBondContact NE2-CB 3.39Å; H974-E1050 WeakPolarHBondContact NE2-CG 3.39Å; H974-E1050 IonicContact NE2-OE2 3.28Å; H974-E1050 PolarHBondContact NE2-OE2 2.91Å; H974-M1051 CarbonylContact C-O 3.52Å; H974-M1051 WeakPolarHBondContact CA-O 3.49Å
975	V	92.1	Very high	74.3	Confident	1 Å²	1	89.3 Å²	89.3	1%	0.006	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	134.6	174	-177.2	0	0	0	0	108.5	F973 L977 L1015 L1016 M1051 M1053	F973-V975 HydrophobicContact CD2-CG2 3.66Å; F973-V975 HydrophobicContact CE2-CG2 3.53Å; V975-L977 HydrophobicContact CG1-CD2 3.87Å; V975-L977 HydrophobicContact CG1-CG 4.06Å; V975-L1015 HydrophobicContact CG2-CB 4.1Å; V975-L1015 HydrophobicContact CG2-CD1 4.3Å; V975-L1016 HydrophobicContact CG1-CD1 4.21Å; V975-L1016 HydrophobicContact CG1-CD2 4.45Å; V975-L1016 HydrophobicContact CG1-CG 4.09Å; V975-L1016 HydrophobicContact CG2-CD2 4.03Å; V975-L1016 HydrophobicContact CG2-CG 4.31Å; V975-M1051 PolarHBondContact N-O 3.34Å; V975-M1051 PolarHBondContact O-N 3.1Å; V975-M1053 HydrophobicContact CB-CG 4.4Å; V975-M1053 HydrophobicContact CG2-CG 3.81Å
976	T	90.9	Very high	76.8	Confident	50 Å²	50	84.6 Å²	84.6	31%	0.307	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	125.9	170.8	-53	0	0	0	0	108.1	H974 Y978 K1048 I1049 E1050	H974-T976 PolarHBondContact NE2-OG1 2.78Å; T976-Y978 HydrophobicContact CG2-CE2 4.32Å; T976-K1048 HydrophobicContact CG2-CD 4.4Å; T976-K1048 HydrophobicContact CG2-CG 4.1Å; T976-I1049 WeakPolarHBondContact CA-O 3.27Å; T976-E1050 HydrophobicContact CG2-CG 4.04Å
977	L	90.4	Very high	79.2	Confident	4 Å²	4	80.6 Å²	80.6	2%	0.021	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	154	174.1	-54.5	177.9	0	0	0	110.7	V975 Y986 F988 A1010 C1013 L1016 K1048 I1049	V975-L977 HydrophobicContact CG1-CD2 3.87Å; V975-L977 HydrophobicContact CG1-CG 4.06Å; L977-Y986 HydrophobicContact CB-CD1 3.76Å; L977-Y986 HydrophobicContact CB-CE1 4.37Å; L977-F988 HydrophobicContact CD1-CD1 3.89Å; L977-F988 HydrophobicContact CD1-CE1 3.79Å; L977-A1010 HydrophobicContact CD1-CB 3.96Å; L977-C1013 HydrophobicContact CD2-CB 3.57Å; L977-L1016 HydrophobicContact CD1-CD1 3.82Å; L977-L1016 HydrophobicContact CD2-CD1 4.44Å; L977-K1048 WeakPolarHBondContact O-CA 3.4Å; L977-I1049 HydrophobicContact CB-CG2 3.8Å; L977-I1049 HydrophobicContact CG-CG2 4.45Å; L977-I1049 PolarHBondContact N-O 2.85Å; L977-I1049 PolarHBondContact O-N 2.85Å
978	Y	89.1	Confident	81.7	Confident	150 Å²	150	76.8 Å²	76.8	59%	0.588	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	144.2	171.6	-66.5	-88.1	0	0	0	109.1	T976 P1009 D1047 K1048	T976-Y978 HydrophobicContact CG2-CE2 4.32Å; Y978-P1009 VanDerWaalsContact O-CB 3.23Å; Y978-P1009 WeakPolarHBondContact O-CB 3.03Å; Y978-P1009 VanDerWaalsContact O-CG 3.28Å; Y978-P1009 WeakPolarHBondContact O-CG 3.47Å; Y978-D1047 WeakPolarHBondContact CA-O 3.44Å; Y978-K1048 HydrophobicContact CD1-CB 4.13Å; Y978-K1048 HydrophobicContact CD1-CG 4.09Å; Y978-K1048 HydrophobicContact CE1-CB 4.11Å; Y978-K1048 HydrophobicContact CE1-CD 4.19Å; Y978-K1048 HydrophobicContact CE1-CG 3.74Å
979	K	87.3	Confident	83.7	Confident	50 Å²	50	76.8 Å²	76.8	22%	0.217	37%	0.369	C	S	.	.			trans	-70	138.2	-176	-153.6	-171.6	-160.7	-161.8	0	110.9	K981 D984 Y986 G1046 D1047	K979-K981 PolarHBondContact O-N 3.35Å; K979-D984 WeakPolarHBondContact CE-O 3.27Å; K979-D984 VanDerWaalsContact CE-OD1 3.28Å; K979-D984 WeakPolarHBondContact CE-OD1 3.38Å; K979-D984 IonicContact NZ-OD1 2.74Å; K979-D984 PolarHBondContact NZ-OD1 2.78Å; K979-D984 IonicContact NZ-OD2 2.7Å; K979-D984 PolarHBondContact NZ-OD2 3.11Å; K979-Y986 HydrophobicContact CB-CD1 4.47Å; K979-Y986 HydrophobicContact CB-CE1 3.95Å; K979-Y986 HydrophobicContact CG-CE1 4.41Å; K979-G1046 WeakPolarHBondContact CD-O 3.46Å; K979-D1047 PolarHBondContact N-O 3.19Å
980	D	83.3	Confident	85.4	Confident	27 Å²	27	69.8 Å²	69.8	14%	0.144	34%	0.342	C	S	.	.			trans	-72.2	117.8	177.4	-167.8	-33.6	0	0	0	110.2	V982 Y983 D984 D985 R1005 P1009	D980-V982 PolarHBondContact O-N 3.23Å; D980-V982 WeakPolarHBondContact OD1-CB 3.19Å; D980-V982 PolarHBondContact OD1-N 3.35Å; D980-Y983 PolarHBondContact O-N 2.98Å; D980-Y983 PolarHBondContact OD1-N 3.18Å; D980-Y983 WeakPolarHBondContact OD2-CD2 3.16Å; D980-D984 VanDerWaalsContact O-CA 3.29Å; D980-D984 WeakPolarHBondContact O-CA 3.44Å; D980-D984 PolarHBondContact O-N 3.2Å; D980-D985 VanDerWaalsContact CB-O 3.31Å; D980-D985 WeakPolarHBondContact CB-O 3.39Å; D980-D985 PolarHBondContact N-O 3.48Å; D980-R1005 IonicContact OD2-NH2 3.31Å; D980-R1005 PolarHBondContact OD2-NH2 3.16Å; D980-R1005 VanDerWaalsContact OD2-NH2 3.12Å; D980-P1009 HydrophobicContact CB-CG 3.78Å
981	K	76	Confident	86.1	Confident	206 Å²	206	68.6 Å²	68.6	90%	0.896	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-11.8	-178.8	-64.4	-171.2	177	-172.7	0	114.1	K979	K979-K981 PolarHBondContact O-N 3.35Å
982	V	72.4	Confident	86.3	Confident	121 Å²	121	63.2 Å²	63.2	73%	0.733	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	-37.4	179.3	-177	0	0	0	0	111.3	D980	D980-V982 PolarHBondContact O-N 3.23Å; D980-V982 WeakPolarHBondContact OD1-CB 3.19Å; D980-V982 PolarHBondContact OD1-N 3.35Å
983	Y	74.8	Confident	85.7	Confident	125 Å²	125	59.5 Å²	59.5	49%	0.49	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-8	-175.1	-69.8	-78.1	0	0	0	114.9	D980 D985	D980-Y983 PolarHBondContact O-N 2.98Å; D980-Y983 PolarHBondContact OD1-N 3.18Å; D980-Y983 WeakPolarHBondContact OD2-CD2 3.16Å; Y983-D985 VanDerWaalsContact C-N 3.26Å; Y983-D985 PolarHBondContact O-N 3.14Å
984	D	82.1	Confident	84.6	Confident	108 Å²	108	64 Å²	64	58%	0.578	32%	0.323	S	S	*	.	S	Bend	trans	53.8	36.6	-177	-156.3	55.3	0	0	0	114.1	K979 D980	K979-D984 WeakPolarHBondContact CE-O 3.27Å; K979-D984 VanDerWaalsContact CE-OD1 3.28Å; K979-D984 WeakPolarHBondContact CE-OD1 3.38Å; K979-D984 IonicContact NZ-OD1 2.74Å; K979-D984 PolarHBondContact NZ-OD1 2.78Å; K979-D984 IonicContact NZ-OD2 2.7Å; K979-D984 PolarHBondContact NZ-OD2 3.11Å; D980-D984 VanDerWaalsContact O-CA 3.29Å; D980-D984 WeakPolarHBondContact O-CA 3.44Å; D980-D984 PolarHBondContact O-N 3.2Å
985	D	87.4	Confident	83.2	Confident	52 Å²	52	70.2 Å²	70.2	28%	0.278	34%	0.344	S	S	.	.	S	Bend	trans	-144.7	-178.5	176.8	76.8	17.8	0	0	0	113.1	D980 Y983 G987 R1005	D980-D985 VanDerWaalsContact CB-O 3.31Å; D980-D985 WeakPolarHBondContact CB-O 3.39Å; D980-D985 PolarHBondContact N-O 3.48Å; Y983-D985 VanDerWaalsContact C-N 3.26Å; Y983-D985 PolarHBondContact O-N 3.14Å; D985-G987 WeakPolarHBondContact OD1-CA 3.39Å; D985-G987 PolarHBondContact OD1-N 2.86Å; D985-R1005 IonicContact OD1-CZ 2.81Å; D985-R1005 VanDerWaalsContact OD1-CZ 3.26Å; D985-R1005 IonicContact OD1-NH1 2.59Å; D985-R1005 PolarHBondContact OD1-NH1 3.38Å; D985-R1005 IonicContact OD1-NH2 3.26Å; D985-R1005 PolarHBondContact OD1-NH2 2.88Å; D985-R1005 IonicContact OD2-CZ 3.85Å; D985-R1005 IonicContact OD2-NH1 3.68Å; D985-R1005 PolarHBondContact OD2-NH1 2.83Å; D985-R1005 IonicContact OD2-NH2 3.77Å
986	Y	89.1	Confident	82.2	Confident	12 Å²	12	75.4 Å²	75.4	5%	0.047	37%	0.368	C	S	.	.			trans	-98.4	7.9	178.1	-66.7	-73	0	0	0	114	L977 K979 F988 A1010 I1042 G1046 K1048 I1049	L977-Y986 HydrophobicContact CB-CD1 3.76Å; L977-Y986 HydrophobicContact CB-CE1 4.37Å; K979-Y986 HydrophobicContact CB-CD1 4.47Å; K979-Y986 HydrophobicContact CB-CE1 3.95Å; K979-Y986 HydrophobicContact CG-CE1 4.41Å; Y986-F988 VanDerWaalsContact CB-CE1 3.47Å; Y986-F988 HydrophobicContact CG-CE1 4.31Å; Y986-F988 PolarHBondContact O-N 2.88Å; Y986-A1010 VanDerWaalsContact O-CB 3.29Å; Y986-A1010 WeakPolarHBondContact O-CB 3.45Å; Y986-A1010 PolarHBondContact O-N 3.12Å; Y986-I1042 HydrophobicContact CD2-CG2 4.11Å; Y986-G1046 PolarHBondContact OH-O 3.08Å; Y986-K1048 PolarHBondContact OH-N 2.78Å; Y986-I1049 HydrophobicContact CD1-CB 4.46Å; Y986-I1049 HydrophobicContact CD1-CG2 3.55Å; Y986-I1049 HydrophobicContact CD2-CG2 4.1Å; Y986-I1049 HydrophobicContact CE1-CB 3.86Å; Y986-I1049 HydrophobicContact CE1-CG2 3.38Å; Y986-I1049 HydrophobicContact CE2-CB 4.01Å; Y986-I1049 HydrophobicContact CE2-CD1 4.29Å; Y986-I1049 HydrophobicContact CE2-CG2 3.98Å; Y986-I1049 HydrophobicContact CG-CG2 3.89Å; Y986-I1049 PolarHBondContact OH-N 3.19Å
987	G	86	Confident	81.3	Confident	1 Å²	1	81.6 Å²	81.6	1%	0.01	39%	0.386	C	S	.	.	S	Bend	trans	72.7	16.7	178.4	0	0	0	0	0	115.9	D985 R1005	D985-G987 WeakPolarHBondContact OD1-CA 3.39Å; D985-G987 PolarHBondContact OD1-N 2.86Å; G987-R1005 PolarHBondContact O-N 2.95Å
988	F	91.4	Very high	81	Confident	32 Å²	32	81.4 Å²	81.4	14%	0.14	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	160	175.5	72.3	-88.9	0	0	0	112.9	L977 Y986 V990 I1001 I1004 A1010 I1022 I1042 M1051	L977-F988 HydrophobicContact CD1-CD1 3.89Å; L977-F988 HydrophobicContact CD1-CE1 3.79Å; Y986-F988 VanDerWaalsContact CB-CE1 3.47Å; Y986-F988 HydrophobicContact CG-CE1 4.31Å; Y986-F988 PolarHBondContact O-N 2.88Å; F988-V990 HydrophobicContact CD2-CG1 3.86Å; F988-V990 HydrophobicContact CE2-CG1 3.61Å; F988-I1001 HydrophobicContact CD2-CD1 3.41Å; F988-I1001 VanDerWaalsContact CD2-CD1 3.41Å; F988-I1001 HydrophobicContact CE2-CD1 3.71Å; F988-I1001 HydrophobicContact CG-CD1 4.12Å; F988-I1004 HydrophobicContact CB-CG1 4.3Å; F988-A1010 HydrophobicContact CB-CB 3.82Å; F988-A1010 HydrophobicContact CD1-CB 3.97Å; F988-A1010 HydrophobicContact CG-CB 4.34Å; F988-I1022 HydrophobicContact CE2-CD1 4.39Å; F988-I1042 HydrophobicContact CE2-CD1 4.06Å; F988-I1042 HydrophobicContact CZ-CD1 4.12Å; F988-I1042 HydrophobicContact CZ-CG2 4.12Å; F988-M1051 HydrophobicContact CE1-SD 3.99Å; F988-M1051 HydrophobicContact CE2-CE 4.1Å; F988-M1051 HydrophobicContact CZ-CE 3.68Å; F988-M1051 HydrophobicContact CZ-SD 3.66Å
989	S	87.5	Confident	81	Confident	48 Å²	48	74.3 Å²	74.3	34%	0.336	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	154.1	176	58.8	0	0	0	0	110.3	N1002 R1003	S989-N1002 PolarHBondContact O-N 3.36Å; S989-R1003 PolarHBondContact N-O 2.94Å; S989-R1003 PolarHBondContact OG-N 3.38Å; S989-R1003 PolarHBondContact OG-O 3.12Å
990	V	91.4	Very high	81.2	Confident	33 Å²	33	73.5 Å²	73.5	20%	0.2	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	163.6	-173.8	-61.3	0	0	0	0	113	F988 V999 F1000 I1001 I1022 V1039 I1042	F988-V990 HydrophobicContact CD2-CG1 3.86Å; F988-V990 HydrophobicContact CE2-CG1 3.61Å; V990-V999 HydrophobicContact CB-CG1 3.58Å; V990-V999 HydrophobicContact CG1-CG1 4.06Å; V990-V999 HydrophobicContact CG2-CG1 4.04Å; V990-F1000 CarbonylContact C-O 3.56Å; V990-F1000 VanDerWaalsContact CA-O 3.27Å; V990-F1000 WeakPolarHBondContact CA-O 3.11Å; V990-I1001 HydrophobicContact CG1-CD1 4.5Å; V990-I1022 HydrophobicContact CG1-CD1 3.69Å; V990-V1039 HydrophobicContact CG2-CG2 3.52Å; V990-I1042 HydrophobicContact CG1-CD1 4.23Å
991	S	85.4	Confident	81.6	Confident	42 Å²	42	72.2 Å²	72.2	29%	0.294	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	147.5	173.9	52.8	0	0	0	0	111.9	F1000	S991-F1000 PolarHBondContact N-O 2.82Å; S991-F1000 PolarHBondContact O-N 2.81Å
992	D	86.9	Confident	82.1	Confident	33 Å²	33	65.3 Å²	65.3	18%	0.176	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	143.4	171.8	-51.6	-37.8	0	0	0	111.6	R935 C1035	R935-D992 PolarHBondContact NH2-O 3.21Å; R935-D992 VanDerWaalsContact NH2-O 3.09Å; D992-C1035 VanDerWaalsContact CG-SG 3.58Å; D992-C1035 WeakPolarHBondContact OD1-CA 3.41Å; D992-C1035 WeakPolarHBondContact OD1-CB 3.31Å; D992-C1035 PolarHBondContact OD1-N 2.81Å; D992-C1035 PolarHBondContact OD1-SG 3.48Å; D992-C1035 PolarHBondContact OD2-SG 2.79Å; D992-C1035 VanDerWaalsContact OD2-SG 3.34Å
993	G	77.3	Confident	82.7	Confident	14 Å²	14	68 Å²	68	14%	0.144	32%	0.317	C	S	.	.			trans	-53.4	151.9	169.9	0	0	0	0	0	113.3	R935 E996 G998	R935-G993 PolarHBondContact NH1-O 2.91Å; R935-G993 PolarHBondContact NH2-O 3.5Å; G993-E996 WeakPolarHBondContact CA-O 3.49Å; G993-G998 PolarHBondContact N-O 2.94Å
994	L	64.7	Low	83.3	Confident	140 Å²	140	63.7 Å²	63.7	73%	0.733	30%	0.302	S	S	*	.	S	Bend	trans	-96.6	-17.9	176.6	-72.6	169.3	0	0	0	113
995	Y	61.9	Low	83.5	Confident	226 Å²	226	61.9 Å²	61.9	89%	0.886	29%	0.287	S	S	*	.	S	Bend	trans	-136.7	-38.5	-172.4	-59	-75.6	0	0	0	112.3
996	E	71.4	Confident	83.1	Confident	109 Å²	109	64.4 Å²	64.4	51%	0.509	31%	0.309	S	S	.	.	S	Bend	trans	-103.8	152.2	169.1	-63.9	-178.1	-168.2	0	0	110.4	G993 F1000 R1021	G993-E996 WeakPolarHBondContact CA-O 3.49Å; E996-F1000 HydrophobicContact CB-CZ 4.44Å; E996-R1021 IonicContact OE2-NH1 2.69Å; E996-R1021 PolarHBondContact OE2-NH1 2.88Å
997	R	72.4	Confident	82.6	Confident	181 Å²	181	66.2 Å²	66.2	68%	0.683	33%	0.33	S	S	*	.	S	Bend	trans	-70.3	157.4	165.7	-75.3	-178.8	171.3	161.5	-4.2	110.8	R1021	R997-R1021 PolarHBondContact O-NH1 3.2Å; R997-R1021 PolarHBondContact O-NH2 3.27Å
998	G	83.2	Confident	82.6	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.33	C	S	.	.	S	Bend	trans	111	165.3	-178.5	0	0	0	0	0	113.1	G993 F1000 Q1031 F1033	G993-G998 PolarHBondContact N-O 2.94Å; G998-F1000 WeakPolarHBondContact O-CD2 3.48Å; G998-F1000 VanDerWaalsContact O-CE2 3.29Å; G998-F1000 WeakPolarHBondContact O-CE2 3.47Å; G998-Q1031 WeakPolarHBondContact CA-O 3.24Å; G998-F1033 CarbonylContact C-O 3.57Å; G998-F1033 VanDerWaalsContact CA-O 3.27Å; G998-F1033 WeakPolarHBondContact CA-O 3.5Å
999	V	90	Very high	82.5	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	138	-177.6	-177.3	0	0	0	0	111.3	V990 I1022 F1033 C1035 T1038	V990-V999 HydrophobicContact CB-CG1 3.58Å; V990-V999 HydrophobicContact CG1-CG1 4.06Å; V990-V999 HydrophobicContact CG2-CG1 4.04Å; V999-I1022 HydrophobicContact CG1-CD1 4.02Å; V999-I1022 PolarHBondContact O-N 2.83Å; V999-F1033 WeakPolarHBondContact CG2-O 3.21Å; V999-C1035 HydrophobicContact CG2-CB 4.44Å; V999-T1038 HydrophobicContact CB-CG2 4.22Å; V999-T1038 HydrophobicContact CG1-CG2 4.29Å; V999-T1038 HydrophobicContact CG2-CG2 4.19Å; V999-T1038 WeakPolarHBondContact CG2-OG1 3.27Å
1000	F	91.3	Very high	82.5	Confident	34 Å²	34	63 Å²	63	15%	0.149	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	150.4	-176.2	-60.9	-103.1	0	0	0	111.1	V990 S991 E996 G998 N1002 D1020 R1021	V990-F1000 CarbonylContact C-O 3.56Å; V990-F1000 VanDerWaalsContact CA-O 3.27Å; V990-F1000 WeakPolarHBondContact CA-O 3.11Å; S991-F1000 PolarHBondContact N-O 2.82Å; S991-F1000 PolarHBondContact O-N 2.81Å; E996-F1000 HydrophobicContact CB-CZ 4.44Å; G998-F1000 WeakPolarHBondContact O-CD2 3.48Å; G998-F1000 VanDerWaalsContact O-CE2 3.29Å; G998-F1000 WeakPolarHBondContact O-CE2 3.47Å; F1000-N1002 PolarHBondContact O-N 3.01Å; F1000-D1020 CarbonylContact C-O 3.58Å; F1000-D1020 VanDerWaalsContact CA-O 3.29Å; F1000-D1020 WeakPolarHBondContact CA-O 3.49Å; F1000-R1021 HydrophobicContact CD1-CB 3.75Å; F1000-R1021 HydrophobicContact CD1-CG 4.2Å; F1000-R1021 HydrophobicContact CE1-CB 3.61Å; F1000-R1021 HydrophobicContact CE1-CG 3.84Å; F1000-R1021 HydrophobicContact CE2-CG 4.45Å; F1000-R1021 HydrophobicContact CZ-CB 4.27Å; F1000-R1021 HydrophobicContact CZ-CG 3.97Å
1001	I	91.1	Very high	82.3	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	124	171.4	-55	-64.2	0	0	0	109.2	F988 V990 I1004 F1019 D1020 I1022 M1053	F988-I1001 HydrophobicContact CD2-CD1 3.41Å; F988-I1001 VanDerWaalsContact CD2-CD1 3.41Å; F988-I1001 HydrophobicContact CE2-CD1 3.71Å; F988-I1001 HydrophobicContact CG-CD1 4.12Å; V990-I1001 HydrophobicContact CG1-CD1 4.5Å; I1001-I1004 HydrophobicContact CG2-CD1 4.22Å; I1001-I1004 HydrophobicContact CG2-CG1 3.84Å; I1001-F1019 PolarHBondContact O-N 3.39Å; I1001-D1020 HydrophobicContact CG1-CB 4.09Å; I1001-D1020 PolarHBondContact N-O 3.19Å; I1001-I1022 HydrophobicContact CD1-CD1 4.1Å; I1001-I1022 HydrophobicContact CD1-CG1 4.2Å; I1001-M1053 HydrophobicContact CD1-CE 4.09Å; I1001-M1053 HydrophobicContact CG1-CE 3.71Å
1002	N	86.5	Confident	82.2	Confident	60 Å²	60	69.4 Å²	69.4	32%	0.321	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-61.7	-178.3	-176.4	-16.4	0	0	0	110.9	S989 F1000	S989-N1002 PolarHBondContact O-N 3.36Å; F1000-N1002 PolarHBondContact O-N 3.01Å
1003	R	84.4	Confident	82	Confident	178 Å²	178	69.7 Å²	69.7	67%	0.672	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.3	146.5	177	-75.8	-178.7	-82.4	-179.2	-3.7	111	S989	S989-R1003 PolarHBondContact N-O 2.94Å; S989-R1003 PolarHBondContact OG-N 3.38Å; S989-R1003 PolarHBondContact OG-O 3.12Å
1004	I	88.4	Confident	82.2	Confident	35 Å²	35	71.7 Å²	71.7	18%	0.179	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	138.3	174.9	-61.9	174.8	0	0	0	107.6	F988 I1001 A1010 D1011 L1016	F988-I1004 HydrophobicContact CB-CG1 4.3Å; I1001-I1004 HydrophobicContact CG2-CD1 4.22Å; I1001-I1004 HydrophobicContact CG2-CG1 3.84Å; I1004-A1010 HydrophobicContact CG2-CB 3.93Å; I1004-D1011 HydrophobicContact CG2-CB 3.77Å; I1004-L1016 HydrophobicContact CD1-CB 3.77Å
1005	R	86.4	Confident	83	Confident	70 Å²	70	69.3 Å²	69.3	26%	0.264	35%	0.351	S	S	.	.			trans	-83.1	119.4	176.4	177.2	177.4	70.9	-109.5	1.7	109.3	D980 D985 G987 G1007 G1008 D1011	D980-R1005 IonicContact OD2-NH2 3.31Å; D980-R1005 PolarHBondContact OD2-NH2 3.16Å; D980-R1005 VanDerWaalsContact OD2-NH2 3.12Å; D985-R1005 IonicContact OD1-CZ 2.81Å; D985-R1005 VanDerWaalsContact OD1-CZ 3.26Å; D985-R1005 IonicContact OD1-NH1 2.59Å; D985-R1005 PolarHBondContact OD1-NH1 3.38Å; D985-R1005 IonicContact OD1-NH2 3.26Å; D985-R1005 PolarHBondContact OD1-NH2 2.88Å; D985-R1005 IonicContact OD2-CZ 3.85Å; D985-R1005 IonicContact OD2-NH1 3.68Å; D985-R1005 PolarHBondContact OD2-NH1 2.83Å; D985-R1005 IonicContact OD2-NH2 3.77Å; G987-R1005 PolarHBondContact O-N 2.95Å; R1005-G1007 PolarHBondContact O-N 2.93Å; R1005-G1008 PolarHBondContact O-N 2.93Å; R1005-D1011 WeakPolarHBondContact O-CB 3.47Å
1006	S	77.8	Confident	84.3	Confident	105 Å²	105	59 Å²	59	73%	0.734	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	129.7	174.2	-55.9	0	0	0	0	111.6	G1008 D1011	S1006-G1008 VanDerWaalsContact C-N 3.26Å; S1006-G1008 PolarHBondContact O-N 3.27Å; S1006-D1011 WeakPolarHBondContact CA-OD2 3.38Å
1007	G	79.4	Confident	85	Confident	49 Å²	49	59.3 Å²	59.3	51%	0.505	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.3	-3.7	-173.9	0	0	0	0	0	116	R1005 D1011	R1005-G1007 PolarHBondContact O-N 2.93Å; G1007-D1011 PolarHBondContact N-OD2 2.84Å
1008	G	86.2	Confident	85.6	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.298	C	S	.	.	S	Bend	trans	-79.8	169.1	172.6	0	0	0	0	0	112.9	R1005 S1006 A1010 D1011 M1012	R1005-G1008 PolarHBondContact O-N 2.93Å; S1006-G1008 VanDerWaalsContact C-N 3.26Å; S1006-G1008 PolarHBondContact O-N 3.27Å; G1008-A1010 VanDerWaalsContact C-N 3.35Å; G1008-A1010 PolarHBondContact O-N 2.66Å; G1008-D1011 WeakPolarHBondContact O-CB 3.21Å; G1008-D1011 PolarHBondContact O-N 3.39Å; G1008-M1012 PolarHBondContact O-N 2.69Å
1009	P	87.7	Confident	85.8	Confident	13 Å²	13	61.8 Å²	61.8	8%	0.084	33%	0.333	C	S	.	.	H	α-helix	trans	-54.6	-42.1	-175.7	-28	34	0	0	0	115.1	Y978 D980 D1011 M1012 C1013	Y978-P1009 VanDerWaalsContact O-CB 3.23Å; Y978-P1009 WeakPolarHBondContact O-CB 3.03Å; Y978-P1009 VanDerWaalsContact O-CG 3.28Å; Y978-P1009 WeakPolarHBondContact O-CG 3.47Å; D980-P1009 HydrophobicContact CB-CG 3.78Å; P1009-D1011 VanDerWaalsContact C-N 3.3Å; P1009-D1011 PolarHBondContact O-N 3.45Å; P1009-M1012 HydrophobicContact CG-CE 4.49Å; P1009-M1012 PolarHBondContact O-N 2.93Å; P1009-C1013 PolarHBondContact O-N 3.08Å
1010	A	88.1	Confident	85.8	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-67.1	-24.7	175.9	0	0	0	0	0	114.5	L977 Y986 F988 I1004 G1008 C1013 L1016	L977-A1010 HydrophobicContact CD1-CB 3.96Å; Y986-A1010 VanDerWaalsContact O-CB 3.29Å; Y986-A1010 WeakPolarHBondContact O-CB 3.45Å; Y986-A1010 PolarHBondContact O-N 3.12Å; F988-A1010 HydrophobicContact CB-CB 3.82Å; F988-A1010 HydrophobicContact CD1-CB 3.97Å; F988-A1010 HydrophobicContact CG-CB 4.34Å; I1004-A1010 HydrophobicContact CG2-CB 3.93Å; G1008-A1010 VanDerWaalsContact C-N 3.35Å; G1008-A1010 PolarHBondContact O-N 2.66Å; A1010-C1013 PolarHBondContact O-SG 2.96Å; A1010-L1016 HydrophobicContact CB-CD1 3.73Å
1011	D	86.9	Confident	85.8	Confident	76 Å²	76	61.4 Å²	61.4	41%	0.406	33%	0.331	S	S	.	.	H	α-helix	trans	-80	-47.8	173.3	-167	55.9	0	0	0	110.1	I1004 R1005 S1006 G1007 G1008 P1009 C1013 G1014	I1004-D1011 HydrophobicContact CG2-CB 3.77Å; R1005-D1011 WeakPolarHBondContact O-CB 3.47Å; S1006-D1011 WeakPolarHBondContact CA-OD2 3.38Å; G1007-D1011 PolarHBondContact N-OD2 2.84Å; G1008-D1011 WeakPolarHBondContact O-CB 3.21Å; G1008-D1011 PolarHBondContact O-N 3.39Å; P1009-D1011 VanDerWaalsContact C-N 3.3Å; P1009-D1011 PolarHBondContact O-N 3.45Å; D1011-C1013 PolarHBondContact O-N 2.77Å; D1011-C1013 VanDerWaalsContact O-N 3.16Å; D1011-G1014 PolarHBondContact O-N 3.4Å
1012	M	83.4	Confident	85.9	Confident	135 Å²	135	61.4 Å²	61.4	67%	0.665	33%	0.331	S	S	*	.	H	α-helix	trans	-59.1	-26.6	176.1	-68.8	-168.3	-73.6	0	0	113.4	G1008 P1009 G1014	G1008-M1012 PolarHBondContact O-N 2.69Å; P1009-M1012 HydrophobicContact CG-CE 4.49Å; P1009-M1012 PolarHBondContact O-N 2.93Å; M1012-G1014 VanDerWaalsContact C-N 3.34Å
1013	C	82.9	Confident	86.1	Confident	38 Å²	38	59.6 Å²	59.6	26%	0.257	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-25.6	175.4	89.3	0	0	0	0	113.5	L977 P1009 A1010 D1011 L1015	L977-C1013 HydrophobicContact CD2-CB 3.57Å; P1009-C1013 PolarHBondContact O-N 3.08Å; A1010-C1013 PolarHBondContact O-SG 2.96Å; D1011-C1013 PolarHBondContact O-N 2.77Å; D1011-C1013 VanDerWaalsContact O-N 3.16Å; C1013-L1015 PolarHBondContact O-N 2.73Å; C1013-L1015 PolarHBondContact SG-N 2.87Å; C1013-L1015 VanDerWaalsContact SG-N 3.45Å
1014	G	81.8	Confident	86.4	Confident	57 Å²	57	53.1 Å²	53.1	59%	0.588	30%	0.298	S	S	*	.			trans	62	-8.9	-177.7	0	0	0	0	0	117	D1011 M1012	D1011-G1014 PolarHBondContact O-N 3.4Å; M1012-G1014 VanDerWaalsContact C-N 3.34Å
1015	L	82.6	Confident	86.6	Confident	89 Å²	89	51.6 Å²	51.6	47%	0.466	29%	0.291	S	S	.	.	S	Bend	trans	-81.4	-38.9	-177.3	-65.2	176.7	0	0	0	112.5	F973 V975 C1013 R1055	F973-L1015 HydrophobicContact CE2-CB 4.35Å; V975-L1015 HydrophobicContact CG2-CB 4.1Å; V975-L1015 HydrophobicContact CG2-CD1 4.3Å; C1013-L1015 PolarHBondContact O-N 2.73Å; C1013-L1015 PolarHBondContact SG-N 2.87Å; C1013-L1015 VanDerWaalsContact SG-N 3.45Å; L1015-R1055 PolarHBondContact O-NH2 2.88Å
1016	L	88.4	Confident	86.8	Confident	9 Å²	9	51 Å²	51	5%	0.047	29%	0.293	C	S	.	.			trans	-78.8	147.6	-178.5	-69.7	172.7	0	0	0	112.1	V975 L977 I1004 A1010 M1053	V975-L1016 HydrophobicContact CG1-CD1 4.21Å; V975-L1016 HydrophobicContact CG1-CD2 4.45Å; V975-L1016 HydrophobicContact CG1-CG 4.09Å; V975-L1016 HydrophobicContact CG2-CD2 4.03Å; V975-L1016 HydrophobicContact CG2-CG 4.31Å; L977-L1016 HydrophobicContact CD1-CD1 3.82Å; L977-L1016 HydrophobicContact CD2-CD1 4.44Å; I1004-L1016 HydrophobicContact CD1-CB 3.77Å; A1010-L1016 HydrophobicContact CB-CD1 3.73Å; L1016-M1053 HydrophobicContact CD2-CE 3.8Å; L1016-M1053 HydrophobicContact CD2-CG 3.69Å; L1016-M1053 HydrophobicContact CD2-SD 3.98Å
1017	K	85	Confident	87.2	Confident	117 Å²	117	54.9 Å²	54.9	51%	0.509	30%	0.299	S	S	.	.			trans	-139	157.3	172.4	-67	-175.2	-178.3	-175.8	0	110.3	D1020	K1017-D1020 PolarHBondContact N-OD2 2.71Å; K1017-D1020 VanDerWaalsContact O-CG 3.3Å; K1017-D1020 PolarHBondContact O-N 3.16Å
1018	P	86.8	Confident	87.5	Confident	63 Å²	63	57 Å²	57	41%	0.409	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	144.5	162.4	-26	36	0	0	0	111.3	D1020	P1018-D1020 VanDerWaalsContact C-N 3.28Å; P1018-D1020 PolarHBondContact O-N 2.95Å
1019	F	86.6	Confident	87.5	Confident	170 Å²	170	64.2 Å²	64.2	75%	0.746	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	5.3	-177.6	-42.3	-71.2	0	0	0	116.8	I1001	I1001-F1019 PolarHBondContact O-N 3.39Å
1020	D	90.8	Very high	87.5	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.011	33%	0.325	C	S	.	.			trans	-65.2	136.1	164.9	-67.6	-23.7	0	0	0	110.7	F1000 I1001 K1017 P1018 M1053 R1055	F1000-D1020 CarbonylContact C-O 3.58Å; F1000-D1020 VanDerWaalsContact CA-O 3.29Å; F1000-D1020 WeakPolarHBondContact CA-O 3.49Å; I1001-D1020 HydrophobicContact CG1-CB 4.09Å; I1001-D1020 PolarHBondContact N-O 3.19Å; K1017-D1020 PolarHBondContact N-OD2 2.71Å; K1017-D1020 VanDerWaalsContact O-CG 3.3Å; K1017-D1020 PolarHBondContact O-N 3.16Å; P1018-D1020 VanDerWaalsContact C-N 3.28Å; P1018-D1020 PolarHBondContact O-N 2.95Å; D1020-M1053 HydrophobicContact CB-CE 3.5Å; D1020-M1053 VanDerWaalsContact CB-CE 3.5Å; D1020-R1055 VanDerWaalsContact CG-NH2 3.27Å; D1020-R1055 IonicContact OD1-CZ 2.88Å; D1020-R1055 VanDerWaalsContact OD1-CZ 3.27Å; D1020-R1055 IonicContact OD1-NE 3.68Å; D1020-R1055 PolarHBondContact OD1-NE 3.25Å; D1020-R1055 IonicContact OD1-NH2 2.73Å; D1020-R1055 PolarHBondContact OD1-NH2 3.41Å; D1020-R1055 IonicContact OD2-CZ 2.72Å; D1020-R1055 IonicContact OD2-NE 3.75Å; D1020-R1055 IonicContact OD2-NH2 3.94Å; D1020-R1055 PolarHBondContact OD2-NH2 3.41Å
1021	R	90.5	Very high	87.2	Confident	23 Å²	23	67.8 Å²	67.8	9%	0.087	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	132.8	178.1	-174.7	176.4	174.6	162.6	-4	111.1	E996 R997 F1000 M1023 Q1031 M1053 Q1054	E996-R1021 IonicContact OE2-NH1 2.69Å; E996-R1021 PolarHBondContact OE2-NH1 2.88Å; R997-R1021 PolarHBondContact O-NH1 3.2Å; R997-R1021 PolarHBondContact O-NH2 3.27Å; F1000-R1021 HydrophobicContact CD1-CB 3.75Å; F1000-R1021 HydrophobicContact CD1-CG 4.2Å; F1000-R1021 HydrophobicContact CE1-CB 3.61Å; F1000-R1021 HydrophobicContact CE1-CG 3.84Å; F1000-R1021 HydrophobicContact CE2-CG 4.45Å; F1000-R1021 HydrophobicContact CZ-CB 4.27Å; F1000-R1021 HydrophobicContact CZ-CG 3.97Å; R1021-M1023 HydrophobicContact CG-SD 3.99Å; R1021-Q1031 PolarHBondContact NH2-O 2.93Å; R1021-M1053 CarbonylContact O-C 3.56Å; R1021-M1053 WeakPolarHBondContact O-CA 3.49Å; R1021-Q1054 HydrophobicContact CB-CB 4.28Å; R1021-Q1054 PolarHBondContact N-O 3.35Å; R1021-Q1054 PolarHBondContact O-N 3.41Å
1022	I	93.2	Very high	86.8	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	112.2	175.9	-50.6	172.8	0	0	0	108.8	F988 V990 V999 I1001 V1025 T1030 T1038 I1042 M1051 M1053	F988-I1022 HydrophobicContact CE2-CD1 4.39Å; V990-I1022 HydrophobicContact CG1-CD1 3.69Å; V999-I1022 HydrophobicContact CG1-CD1 4.02Å; V999-I1022 PolarHBondContact O-N 2.83Å; I1001-I1022 HydrophobicContact CD1-CD1 4.1Å; I1001-I1022 HydrophobicContact CD1-CG1 4.2Å; I1022-V1025 HydrophobicContact CG2-CG2 3.62Å; I1022-T1030 PolarHBondContact O-OG1 3.45Å; I1022-T1038 HydrophobicContact CD1-CG2 4.49Å; I1022-I1042 HydrophobicContact CD1-CD1 4.21Å; I1022-M1051 HydrophobicContact CB-CE 4.38Å; I1022-M1051 HydrophobicContact CD1-CE 3.64Å; I1022-M1051 HydrophobicContact CG1-CE 3.79Å; I1022-M1051 HydrophobicContact CG2-CE 3.65Å; I1022-M1053 HydrophobicContact CB-SD 4.36Å; I1022-M1053 HydrophobicContact CG1-CE 3.8Å; I1022-M1053 HydrophobicContact CG1-SD 4Å; I1022-M1053 HydrophobicContact CG2-SD 4.39Å
1023	M	90.7	Very high	86.9	Confident	23 Å²	23	65.9 Å²	65.9	11%	0.113	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-29.2	-177.9	-61.8	-64.9	-74.3	0	0	112.9	R1021 T1030 Q1031 I1052 Q1054	R1021-M1023 HydrophobicContact CG-SD 3.99Å; M1023-T1030 VanDerWaalsContact C-OG1 3.26Å; M1023-T1030 PolarHBondContact O-N 3.22Å; M1023-T1030 PolarHBondContact O-OG1 3Å; M1023-Q1031 HydrophobicContact CE-CB 4.05Å; M1023-Q1031 HydrophobicContact CE-CG 3.65Å; M1023-Q1031 PolarHBondContact O-N 2.96Å; M1023-Q1031 HydrophobicContact SD-CB 4.3Å; M1023-Q1031 HydrophobicContact SD-CG 4.11Å; M1023-I1052 WeakPolarHBondContact CA-O 3.33Å; M1023-I1052 HydrophobicContact CB-CG2 4.39Å; M1023-I1052 WeakPolarHBondContact CB-O 3.28Å; M1023-I1052 PolarHBondContact N-O 3.3Å; M1023-Q1054 HydrophobicContact CG-CB 3.57Å; M1023-Q1054 HydrophobicContact SD-CB 4.08Å; M1023-Q1054 PolarHBondContact SD-OE1 2.79Å
1024	Q	91.1	Very high	87	Confident	42 Å²	42	67.7 Å²	67.7	20%	0.196	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	143.4	177	-157.4	175.2	-68.9	0	0	110	N1026 M1028 K1029 T1030 M1051 I1052	Q1024-N1026 PolarHBondContact NE2-O 3.28Å; Q1024-M1028 CarbonylContact C-O 3.53Å; Q1024-M1028 WeakPolarHBondContact CA-O 3.37Å; Q1024-M1028 WeakPolarHBondContact CG-O 3.5Å; Q1024-K1029 HydrophobicContact CG-CG 4.13Å; Q1024-T1030 PolarHBondContact N-OG1 2.81Å; Q1024-M1051 VanDerWaalsContact O-CA 3.32Å; Q1024-M1051 WeakPolarHBondContact O-CA 3.33Å; Q1024-I1052 HydrophobicContact CB-CB 3.76Å; Q1024-I1052 HydrophobicContact CB-CD1 4.02Å; Q1024-I1052 HydrophobicContact CB-CG1 3.92Å; Q1024-I1052 HydrophobicContact CG-CD1 4.48Å; Q1024-I1052 PolarHBondContact N-O 2.8Å; Q1024-I1052 PolarHBondContact O-N 3.26Å
1025	V	92.8	Very high	87.1	Confident	3 Å²	3	66.5 Å²	66.5	2%	0.018	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	120.4	169.1	174	0	0	0	0	107.9	I1022 E1027 M1028 T1030 T1038 L1041 I1042 I1049 M1051	I1022-V1025 HydrophobicContact CG2-CG2 3.62Å; V1025-E1027 PolarHBondContact O-N 2.85Å; V1025-M1028 PolarHBondContact N-O 3.23Å; V1025-M1028 PolarHBondContact O-N 2.86Å; V1025-T1030 HydrophobicContact CB-CG2 4.13Å; V1025-T1030 HydrophobicContact CG2-CG2 3.92Å; V1025-T1038 HydrophobicContact CG2-CG2 4.3Å; V1025-L1041 HydrophobicContact CG1-CB 4.12Å; V1025-I1042 HydrophobicContact CG1-CG1 4.29Å; V1025-I1042 HydrophobicContact CG2-CG1 4.11Å; V1025-I1049 HydrophobicContact CG1-CD1 3.85Å; V1025-I1049 HydrophobicContact CG1-CG1 4.07Å; V1025-M1051 HydrophobicContact CG2-CE 4.4Å
1026	N	89.9	Confident	87	Confident	58 Å²	58	67.2 Å²	67.2	31%	0.31	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	47	-119.1	-166.7	-61.9	-17.9	0	0	0	110.2	Q1024 E1050	Q1024-N1026 PolarHBondContact NE2-O 3.28Å; N1026-E1050 PolarHBondContact N-O 2.83Å; N1026-E1050 PolarHBondContact OD1-N 3.38Å; N1026-E1050 PolarHBondContact OD1-O 3.02Å
1027	E	85.8	Confident	86.9	Confident	185 Å²	185	71.5 Å²	71.5	86%	0.864	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-10.4	178.4	-58.1	-173.1	160.7	0	0	113.6	V1025	V1025-E1027 PolarHBondContact O-N 2.85Å
1028	M	86.1	Confident	86.9	Confident	94 Å²	94	66 Å²	66	46%	0.463	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	124.5	-170.4	-67.7	-178.3	64.6	0	0	112.5	Q1024 V1025 F1033 L1041	Q1024-M1028 CarbonylContact C-O 3.53Å; Q1024-M1028 WeakPolarHBondContact CA-O 3.37Å; Q1024-M1028 WeakPolarHBondContact CG-O 3.5Å; V1025-M1028 PolarHBondContact N-O 3.23Å; V1025-M1028 PolarHBondContact O-N 2.86Å; M1028-F1033 HydrophobicContact CE-CE2 4.46Å; M1028-L1041 HydrophobicContact CB-CD1 4.27Å; M1028-L1041 HydrophobicContact CE-CD1 3.74Å; M1028-L1041 HydrophobicContact CE-CD2 3.74Å; M1028-L1041 HydrophobicContact CE-CG 4.4Å; M1028-L1041 HydrophobicContact SD-CD1 4.11Å; M1028-L1041 HydrophobicContact SD-CD2 3.56Å; M1028-L1041 VanDerWaalsContact SD-CD2 3.56Å; M1028-L1041 HydrophobicContact SD-CG 4.45Å
1029	K	87.3	Confident	87	Confident	152 Å²	152	65 Å²	65	66%	0.661	33%	0.326	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	127.6	177.2	-66	178.4	-177.2	176.3	0	110.8	Q1024	Q1024-K1029 HydrophobicContact CG-CG 4.13Å
1030	T	88.1	Confident	86.9	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.313	C	S	.	.			trans	-113.6	9.6	-175	58.9	0	0	0	0	112.7	I1022 M1023 Q1024 V1025 D1032 F1033 T1038 L1041	I1022-T1030 PolarHBondContact O-OG1 3.45Å; M1023-T1030 VanDerWaalsContact C-OG1 3.26Å; M1023-T1030 PolarHBondContact O-N 3.22Å; M1023-T1030 PolarHBondContact O-OG1 3Å; Q1024-T1030 PolarHBondContact N-OG1 2.81Å; V1025-T1030 HydrophobicContact CB-CG2 4.13Å; V1025-T1030 HydrophobicContact CG2-CG2 3.92Å; T1030-D1032 VanDerWaalsContact C-N 3.25Å; T1030-D1032 PolarHBondContact O-N 3.24Å; T1030-F1033 HydrophobicContact CG2-CD2 3.95Å; T1030-F1033 HydrophobicContact CG2-CE2 4.44Å; T1030-F1033 PolarHBondContact O-N 3.08Å; T1030-F1033 VanDerWaalsContact O-N 3.08Å; T1030-T1038 HydrophobicContact CG2-CG2 4.1Å; T1030-L1041 HydrophobicContact CG2-CD1 4.28Å
1031	Q	79.9	Confident	86.7	Confident	88 Å²	88	62 Å²	62	41%	0.411	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-40.1	-174.3	177.8	171.6	-11.5	0	0	113.6	G998 R1021 M1023	G998-Q1031 WeakPolarHBondContact CA-O 3.24Å; R1021-Q1031 PolarHBondContact NH2-O 2.93Å; M1023-Q1031 HydrophobicContact CE-CB 4.05Å; M1023-Q1031 HydrophobicContact CE-CG 3.65Å; M1023-Q1031 PolarHBondContact O-N 2.96Å; M1023-Q1031 HydrophobicContact SD-CB 4.3Å; M1023-Q1031 HydrophobicContact SD-CG 4.11Å
1032	D	79.9	Confident	86.6	Confident	111 Å²	111	62 Å²	62	59%	0.594	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	11.4	-178.7	-61	-65.3	0	0	0	113.2	T1030	T1030-D1032 VanDerWaalsContact C-N 3.25Å; T1030-D1032 PolarHBondContact O-N 3.24Å
1033	F	84.9	Confident	86.2	Confident	59 Å²	59	65.5 Å²	65.5	26%	0.259	35%	0.352	S	S	.	.			trans	-87.9	149.9	178.7	-72.3	5.6	0	0	0	111.4	G998 V999 M1028 T1030 L1037 T1038 L1041	G998-F1033 CarbonylContact C-O 3.57Å; G998-F1033 VanDerWaalsContact CA-O 3.27Å; G998-F1033 WeakPolarHBondContact CA-O 3.5Å; V999-F1033 WeakPolarHBondContact CG2-O 3.21Å; M1028-F1033 HydrophobicContact CE-CE2 4.46Å; T1030-F1033 HydrophobicContact CG2-CD2 3.95Å; T1030-F1033 HydrophobicContact CG2-CE2 4.44Å; T1030-F1033 PolarHBondContact O-N 3.08Å; T1030-F1033 VanDerWaalsContact O-N 3.08Å; F1033-L1037 HydrophobicContact CB-CB 4.13Å; F1033-L1037 HydrophobicContact CB-CD1 4.48Å; F1033-L1037 HydrophobicContact CD1-CD1 4.19Å; F1033-L1037 HydrophobicContact CD2-CB 3.94Å; F1033-L1037 HydrophobicContact CG-CB 4.07Å; F1033-L1037 HydrophobicContact CG-CD1 4.21Å; F1033-T1038 WeakPolarHBondContact CB-OG1 3.35Å; F1033-L1041 HydrophobicContact CD2-CD1 4.2Å; F1033-L1041 HydrophobicContact CE2-CD1 3.9Å
1034	D	84.4	Confident	85.8	Confident	76 Å²	76	68.3 Å²	68.3	41%	0.406	38%	0.379	S	S	.	.			trans	-93.1	173	165.6	-64.9	-40.5	0	0	0	110.6	C1036 L1037 T1038	D1034-C1036 VanDerWaalsContact C-N 3.28Å; D1034-C1036 PolarHBondContact O-N 3.18Å; D1034-L1037 PolarHBondContact O-N 2.89Å; D1034-T1038 PolarHBondContact O-N 3.11Å; D1034-T1038 PolarHBondContact O-OG1 2.8Å; D1034-T1038 VanDerWaalsContact O-OG1 3.11Å
1035	C	84.5	Confident	85.4	Confident	33 Å²	33	67 Å²	67	22%	0.223	38%	0.376	C	S	.	.	H	α-helix	trans	-61.2	-34.4	-175.6	64	0	0	0	0	112.9	D992 V999 L1037 T1038 V1039	D992-C1035 VanDerWaalsContact CG-SG 3.58Å; D992-C1035 WeakPolarHBondContact OD1-CA 3.41Å; D992-C1035 WeakPolarHBondContact OD1-CB 3.31Å; D992-C1035 PolarHBondContact OD1-N 2.81Å; D992-C1035 PolarHBondContact OD1-SG 3.48Å; D992-C1035 PolarHBondContact OD2-SG 2.79Å; D992-C1035 VanDerWaalsContact OD2-SG 3.34Å; V999-C1035 HydrophobicContact CG2-CB 4.44Å; C1035-L1037 PolarHBondContact O-N 3.37Å; C1035-T1038 PolarHBondContact O-N 2.64Å; C1035-V1039 HydrophobicContact CB-CG2 4.34Å; C1035-V1039 WeakPolarHBondContact O-CB 3.33Å; C1035-V1039 VanDerWaalsContact O-CG2 3.31Å; C1035-V1039 WeakPolarHBondContact O-CG2 3.5Å; C1035-V1039 PolarHBondContact O-N 2.85Å
1036	C	80.9	Confident	85	Confident	104 Å²	104	68.6 Å²	68.6	70%	0.703	39%	0.392	S	S	*	.	H	α-helix	trans	-57.9	-29.6	175.1	-58.6	0	0	0	0	113.3	D1034 P1040	D1034-C1036 VanDerWaalsContact C-N 3.28Å; D1034-C1036 PolarHBondContact O-N 3.18Å; C1036-P1040 VanDerWaalsContact O-CD 3.27Å; C1036-P1040 WeakPolarHBondContact O-CD 3.32Å; C1036-P1040 WeakPolarHBondContact O-CG 3.27Å
1037	L	85.5	Confident	84.9	Confident	99 Å²	99	71.6 Å²	71.6	52%	0.518	41%	0.409	S	S	.	.	H	α-helix	trans	-94.7	-32.7	176.9	-60.5	178.7	0	0	0	112.2	F1033 D1034 C1035 L1041	F1033-L1037 HydrophobicContact CB-CB 4.13Å; F1033-L1037 HydrophobicContact CB-CD1 4.48Å; F1033-L1037 HydrophobicContact CD1-CD1 4.19Å; F1033-L1037 HydrophobicContact CD2-CB 3.94Å; F1033-L1037 HydrophobicContact CG-CB 4.07Å; F1033-L1037 HydrophobicContact CG-CD1 4.21Å; D1034-L1037 PolarHBondContact O-N 2.89Å; C1035-L1037 PolarHBondContact O-N 3.37Å; L1037-L1041 WeakPolarHBondContact O-CG 3.48Å
1038	T	85.1	Confident	85.1	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-83.4	-35.7	-174.5	-55.1	0	0	0	0	113.3	V999 I1022 V1025 T1030 F1033 D1034 C1035 L1041 I1042	V999-T1038 HydrophobicContact CB-CG2 4.22Å; V999-T1038 HydrophobicContact CG1-CG2 4.29Å; V999-T1038 HydrophobicContact CG2-CG2 4.19Å; V999-T1038 WeakPolarHBondContact CG2-OG1 3.27Å; I1022-T1038 HydrophobicContact CD1-CG2 4.49Å; V1025-T1038 HydrophobicContact CG2-CG2 4.3Å; T1030-T1038 HydrophobicContact CG2-CG2 4.1Å; F1033-T1038 WeakPolarHBondContact CB-OG1 3.35Å; D1034-T1038 PolarHBondContact O-N 3.11Å; D1034-T1038 PolarHBondContact O-OG1 2.8Å; D1034-T1038 VanDerWaalsContact O-OG1 3.11Å; C1035-T1038 PolarHBondContact O-N 2.64Å; T1038-L1041 PolarHBondContact O-N 3.06Å; T1038-I1042 HydrophobicContact CG2-CD1 3.99Å; T1038-I1042 WeakPolarHBondContact O-CG1 3.44Å; T1038-I1042 PolarHBondContact O-N 3.29Å; T1038-I1042 VanDerWaalsContact O-N 3.13Å
1039	V	88.1	Confident	85.4	Confident	44 Å²	44	62.3 Å²	62.3	27%	0.267	36%	0.363	S	S	.	.	H	α-helix	trans	-63.8	-43.1	-179.9	172.1	0	0	0	0	112.5	V990 C1035 L1041 I1042 A1043	V990-V1039 HydrophobicContact CG2-CG2 3.52Å; C1035-V1039 HydrophobicContact CB-CG2 4.34Å; C1035-V1039 WeakPolarHBondContact O-CB 3.33Å; C1035-V1039 VanDerWaalsContact O-CG2 3.31Å; C1035-V1039 WeakPolarHBondContact O-CG2 3.5Å; C1035-V1039 PolarHBondContact O-N 2.85Å; V1039-L1041 PolarHBondContact O-N 2.89Å; V1039-I1042 PolarHBondContact O-N 2.67Å; V1039-A1043 PolarHBondContact O-N 3.18Å
1040	P	85.3	Confident	85.6	Confident	73 Å²	73	58 Å²	58	47%	0.474	35%	0.345	S	S	.	.	H	α-helix	trans	-57.1	-35.3	172.9	-27.8	36.5	0	0	0	113.8	C1036 A1043 A1044	C1036-P1040 VanDerWaalsContact O-CD 3.27Å; C1036-P1040 WeakPolarHBondContact O-CD 3.32Å; C1036-P1040 WeakPolarHBondContact O-CG 3.27Å; P1040-A1043 PolarHBondContact O-N 3.36Å; P1040-A1044 VanDerWaalsContact O-CB 3.22Å; P1040-A1044 WeakPolarHBondContact O-CB 3.21Å; P1040-A1044 PolarHBondContact O-N 2.68Å
1041	L	86.4	Confident	85.9	Confident	36 Å²	36	58 Å²	58	19%	0.188	35%	0.345	C	S	.	.	H	α-helix	trans	-72	-37.2	178.8	-57.9	176.6	0	0	0	112.3	V1025 M1028 T1030 F1033 L1037 T1038 V1039 A1043 A1044 A1045	V1025-L1041 HydrophobicContact CG1-CB 4.12Å; M1028-L1041 HydrophobicContact CB-CD1 4.27Å; M1028-L1041 HydrophobicContact CE-CD1 3.74Å; M1028-L1041 HydrophobicContact CE-CD2 3.74Å; M1028-L1041 HydrophobicContact CE-CG 4.4Å; M1028-L1041 HydrophobicContact SD-CD1 4.11Å; M1028-L1041 HydrophobicContact SD-CD2 3.56Å; M1028-L1041 VanDerWaalsContact SD-CD2 3.56Å; M1028-L1041 HydrophobicContact SD-CG 4.45Å; T1030-L1041 HydrophobicContact CG2-CD1 4.28Å; F1033-L1041 HydrophobicContact CD2-CD1 4.2Å; F1033-L1041 HydrophobicContact CE2-CD1 3.9Å; L1037-L1041 WeakPolarHBondContact O-CG 3.48Å; T1038-L1041 PolarHBondContact O-N 3.06Å; V1039-L1041 PolarHBondContact O-N 2.89Å; L1041-A1043 VanDerWaalsContact C-N 3.35Å; L1041-A1044 PolarHBondContact O-N 2.86Å; L1041-A1045 PolarHBondContact O-N 3.04Å
1042	I	88.3	Confident	86.5	Confident	21 Å²	21	56 Å²	56	11%	0.108	34%	0.336	C	S	.	.	H	α-helix	trans	-65.3	-40.8	172.6	-65.8	165.9	0	0	0	110.3	Y986 F988 V990 I1022 V1025 T1038 V1039 A1045 I1049	Y986-I1042 HydrophobicContact CD2-CG2 4.11Å; F988-I1042 HydrophobicContact CE2-CD1 4.06Å; F988-I1042 HydrophobicContact CZ-CD1 4.12Å; F988-I1042 HydrophobicContact CZ-CG2 4.12Å; V990-I1042 HydrophobicContact CG1-CD1 4.23Å; I1022-I1042 HydrophobicContact CD1-CD1 4.21Å; V1025-I1042 HydrophobicContact CG1-CG1 4.29Å; V1025-I1042 HydrophobicContact CG2-CG1 4.11Å; T1038-I1042 HydrophobicContact CG2-CD1 3.99Å; T1038-I1042 WeakPolarHBondContact O-CG1 3.44Å; T1038-I1042 PolarHBondContact O-N 3.29Å; T1038-I1042 VanDerWaalsContact O-N 3.13Å; V1039-I1042 PolarHBondContact O-N 2.67Å; I1042-A1045 WeakPolarHBondContact O-CB 3.14Å; I1042-I1049 HydrophobicContact CB-CD1 4.03Å; I1042-I1049 HydrophobicContact CG1-CD1 3.89Å; I1042-I1049 HydrophobicContact CG2-CD1 3.85Å
1043	A	84.4	Confident	87.1	Confident	75 Å²	75	50.7 Å²	50.7	62%	0.62	31%	0.308	S	S	*	.	H	α-helix	trans	-68.6	-38	176.7	0	0	0	0	0	112.8	V1039 P1040 L1041 A1045	V1039-A1043 PolarHBondContact O-N 3.18Å; P1040-A1043 PolarHBondContact O-N 3.36Å; L1041-A1043 VanDerWaalsContact C-N 3.35Å; A1043-A1045 VanDerWaalsContact C-N 3.25Å; A1043-A1045 PolarHBondContact O-N 3.29Å
1044	A	83.5	Confident	87.3	Confident	82 Å²	82	49.3 Å²	49.3	68%	0.678	30%	0.303	S	S	*	.	H	α-helix	trans	-74.5	-7.7	179.3	0	0	0	0	0	114.3	P1040 L1041 G1046	P1040-A1044 VanDerWaalsContact O-CB 3.22Å; P1040-A1044 WeakPolarHBondContact O-CB 3.21Å; P1040-A1044 PolarHBondContact O-N 2.68Å; L1041-A1044 PolarHBondContact O-N 2.86Å; A1044-G1046 PolarHBondContact O-N 3.28Å; A1044-G1046 VanDerWaalsContact O-N 3.15Å
1045	A	81.8	Confident	87.5	Confident	15 Å²	15	48.6 Å²	48.6	12%	0.124	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-8.2	-178.7	0	0	0	0	0	114.8	L1041 I1042 A1043 I1049	L1041-A1045 PolarHBondContact O-N 3.04Å; I1042-A1045 WeakPolarHBondContact O-CB 3.14Å; A1043-A1045 VanDerWaalsContact C-N 3.25Å; A1043-A1045 PolarHBondContact O-N 3.29Å; A1045-I1049 HydrophobicContact CB-CB 3.81Å; A1045-I1049 HydrophobicContact CB-CD1 4.01Å; A1045-I1049 HydrophobicContact CB-CG1 3.73Å
1046	G	84.7	Confident	87.1	Confident	36 Å²	36	51.1 Å²	51.1	37%	0.371	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	-134.2	-178.5	0	0	0	0	0	112	K979 Y986 A1044	K979-G1046 WeakPolarHBondContact CD-O 3.46Å; Y986-G1046 PolarHBondContact OH-O 3.08Å; A1044-G1046 PolarHBondContact O-N 3.28Å; A1044-G1046 VanDerWaalsContact O-N 3.15Å
1047	D	86.9	Confident	86.1	Confident	121 Å²	121	54.6 Å²	54.6	65%	0.647	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-12.8	-176.5	-74.7	-13.9	0	0	0	114.7	Y978 K979	Y978-D1047 WeakPolarHBondContact CA-O 3.44Å; K979-D1047 PolarHBondContact N-O 3.19Å
1048	K	90.2	Very high	86.1	Confident	84 Å²	84	52.4 Å²	52.4	37%	0.365	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	123.7	-175.1	-176.1	-155.5	-177.8	-162.3	0	110.1	T976 L977 Y978 Y986 E1050	T976-K1048 HydrophobicContact CG2-CD 4.4Å; T976-K1048 HydrophobicContact CG2-CG 4.1Å; L977-K1048 WeakPolarHBondContact O-CA 3.4Å; Y978-K1048 HydrophobicContact CD1-CB 4.13Å; Y978-K1048 HydrophobicContact CD1-CG 4.09Å; Y978-K1048 HydrophobicContact CE1-CB 4.11Å; Y978-K1048 HydrophobicContact CE1-CD 4.19Å; Y978-K1048 HydrophobicContact CE1-CG 3.74Å; Y986-K1048 PolarHBondContact OH-N 2.78Å; K1048-E1050 WeakPolarHBondContact CE-OE1 3.29Å; K1048-E1050 IonicContact NZ-OE1 2.58Å; K1048-E1050 PolarHBondContact NZ-OE1 2.82Å
1049	I	93.3	Very high	86.1	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	136.4	174.4	-163.9	172	0	0	0	110.4	T976 L977 Y986 V1025 I1042 A1045 M1051	T976-I1049 WeakPolarHBondContact CA-O 3.27Å; L977-I1049 HydrophobicContact CB-CG2 3.8Å; L977-I1049 HydrophobicContact CG-CG2 4.45Å; L977-I1049 PolarHBondContact N-O 2.85Å; L977-I1049 PolarHBondContact O-N 2.85Å; Y986-I1049 HydrophobicContact CD1-CB 4.46Å; Y986-I1049 HydrophobicContact CD1-CG2 3.55Å; Y986-I1049 HydrophobicContact CD2-CG2 4.1Å; Y986-I1049 HydrophobicContact CE1-CB 3.86Å; Y986-I1049 HydrophobicContact CE1-CG2 3.38Å; Y986-I1049 HydrophobicContact CE2-CB 4.01Å; Y986-I1049 HydrophobicContact CE2-CD1 4.29Å; Y986-I1049 HydrophobicContact CE2-CG2 3.98Å; Y986-I1049 HydrophobicContact CG-CG2 3.89Å; Y986-I1049 PolarHBondContact OH-N 3.19Å; V1025-I1049 HydrophobicContact CG1-CD1 3.85Å; V1025-I1049 HydrophobicContact CG1-CG1 4.07Å; I1042-I1049 HydrophobicContact CB-CD1 4.03Å; I1042-I1049 HydrophobicContact CG1-CD1 3.89Å; I1042-I1049 HydrophobicContact CG2-CD1 3.85Å; A1045-I1049 HydrophobicContact CB-CB 3.81Å; A1045-I1049 HydrophobicContact CB-CD1 4.01Å; A1045-I1049 HydrophobicContact CB-CG1 3.73Å; I1049-M1051 HydrophobicContact CD1-CG 4.06Å; I1049-M1051 HydrophobicContact CD1-SD 3.95Å; I1049-M1051 HydrophobicContact CG1-CG 3.87Å; I1049-M1051 HydrophobicContact CG1-SD 4.31Å; I1049-M1051 HydrophobicContact CG2-CG 4.44Å; I1049-M1051 HydrophobicContact CG2-SD 4.28Å
1050	E	91.3	Very high	86	Confident	61 Å²	61	55.7 Å²	55.7	29%	0.285	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	136	168.5	-72.4	-176.7	-153.1	0	0	108.8	H974 T976 N1026 K1048	H974-E1050 WeakPolarHBondContact CE1-CB 3.16Å; H974-E1050 VanDerWaalsContact CE1-CD 3.47Å; H974-E1050 IonicContact CE1-OE2 2.6Å; H974-E1050 PolarHBondContact CE1-OE2 3.36Å; H974-E1050 WeakPolarHBondContact NE2-CB 3.39Å; H974-E1050 WeakPolarHBondContact NE2-CG 3.39Å; H974-E1050 IonicContact NE2-OE2 3.28Å; H974-E1050 PolarHBondContact NE2-OE2 2.91Å; T976-E1050 HydrophobicContact CG2-CG 4.04Å; N1026-E1050 PolarHBondContact N-O 2.83Å; N1026-E1050 PolarHBondContact OD1-N 3.38Å; N1026-E1050 PolarHBondContact OD1-O 3.02Å; K1048-E1050 WeakPolarHBondContact CE-OE1 3.29Å; K1048-E1050 IonicContact NZ-OE1 2.58Å; K1048-E1050 PolarHBondContact NZ-OE1 2.82Å
1051	M	93.9	Very high	86.1	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	135.2	-173.7	-60.2	179.1	71.1	0	0	110.2	H974 V975 F988 I1022 Q1024 V1025 I1049 M1053	H974-M1051 CarbonylContact C-O 3.52Å; H974-M1051 WeakPolarHBondContact CA-O 3.49Å; V975-M1051 PolarHBondContact N-O 3.34Å; V975-M1051 PolarHBondContact O-N 3.1Å; F988-M1051 HydrophobicContact CE1-SD 3.99Å; F988-M1051 HydrophobicContact CE2-CE 4.1Å; F988-M1051 HydrophobicContact CZ-CE 3.68Å; F988-M1051 HydrophobicContact CZ-SD 3.66Å; I1022-M1051 HydrophobicContact CB-CE 4.38Å; I1022-M1051 HydrophobicContact CD1-CE 3.64Å; I1022-M1051 HydrophobicContact CG1-CE 3.79Å; I1022-M1051 HydrophobicContact CG2-CE 3.65Å; Q1024-M1051 VanDerWaalsContact O-CA 3.32Å; Q1024-M1051 WeakPolarHBondContact O-CA 3.33Å; V1025-M1051 HydrophobicContact CG2-CE 4.4Å; I1049-M1051 HydrophobicContact CD1-CG 4.06Å; I1049-M1051 HydrophobicContact CD1-SD 3.95Å; I1049-M1051 HydrophobicContact CG1-CG 3.87Å; I1049-M1051 HydrophobicContact CG1-SD 4.31Å; I1049-M1051 HydrophobicContact CG2-CG 4.44Å; I1049-M1051 HydrophobicContact CG2-SD 4.28Å; M1051-M1053 HydrophobicContact CB-CG 4.48Å; M1051-M1053 HydrophobicContact CB-SD 4.07Å; M1051-M1053 HydrophobicContact CE-SD 3.93Å
1052	I	92.4	Very high	86	Confident	44 Å²	44	55.9 Å²	55.9	23%	0.226	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121	167.7	-56.9	-178.8	0	0	0	107.6	V972 M1023 Q1024	V972-I1052 HydrophobicContact CG1-CG2 3.4Å; M1023-I1052 WeakPolarHBondContact CA-O 3.33Å; M1023-I1052 HydrophobicContact CB-CG2 4.39Å; M1023-I1052 WeakPolarHBondContact CB-O 3.28Å; M1023-I1052 PolarHBondContact N-O 3.3Å; Q1024-I1052 HydrophobicContact CB-CB 3.76Å; Q1024-I1052 HydrophobicContact CB-CD1 4.02Å; Q1024-I1052 HydrophobicContact CB-CG1 3.92Å; Q1024-I1052 HydrophobicContact CG-CD1 4.48Å; Q1024-I1052 PolarHBondContact N-O 2.8Å; Q1024-I1052 PolarHBondContact O-N 3.26Å
1053	M	92.6	Very high	85.9	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	143.6	-174.5	-59.1	-56.8	-58.4	0	0	110.4	V972 F973 V975 I1001 L1016 D1020 R1021 I1022 M1051	V972-M1053 CarbonylContact C-O 3.6Å; V972-M1053 VanDerWaalsContact CA-O 3.27Å; V972-M1053 WeakPolarHBondContact CA-O 3.12Å; F973-M1053 HydrophobicContact CD1-CB 4.24Å; F973-M1053 HydrophobicContact CD2-CB 4.2Å; F973-M1053 HydrophobicContact CE1-CB 3.8Å; F973-M1053 HydrophobicContact CE2-CB 3.78Å; F973-M1053 HydrophobicContact CE2-CG 4.23Å; F973-M1053 HydrophobicContact CG-CB 4.42Å; F973-M1053 HydrophobicContact CZ-CB 3.56Å; F973-M1053 HydrophobicContact CZ-CG 4.35Å; F973-M1053 PolarHBondContact N-O 3.23Å; F973-M1053 PolarHBondContact O-N 2.89Å; V975-M1053 HydrophobicContact CB-CG 4.4Å; V975-M1053 HydrophobicContact CG2-CG 3.81Å; I1001-M1053 HydrophobicContact CD1-CE 4.09Å; I1001-M1053 HydrophobicContact CG1-CE 3.71Å; L1016-M1053 HydrophobicContact CD2-CE 3.8Å; L1016-M1053 HydrophobicContact CD2-CG 3.69Å; L1016-M1053 HydrophobicContact CD2-SD 3.98Å; D1020-M1053 HydrophobicContact CB-CE 3.5Å; D1020-M1053 VanDerWaalsContact CB-CE 3.5Å; R1021-M1053 CarbonylContact O-C 3.56Å; R1021-M1053 WeakPolarHBondContact O-CA 3.49Å; I1022-M1053 HydrophobicContact CB-SD 4.36Å; I1022-M1053 HydrophobicContact CG1-CE 3.8Å; I1022-M1053 HydrophobicContact CG1-SD 4Å; I1022-M1053 HydrophobicContact CG2-SD 4.39Å; M1051-M1053 HydrophobicContact CB-CG 4.48Å; M1051-M1053 HydrophobicContact CB-SD 4.07Å; M1051-M1053 HydrophobicContact CE-SD 3.93Å
1054	Q	90	Very high	86	Confident	31 Å²	31	57 Å²	57	15%	0.145	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	125.6	171.6	170.8	176.9	-35.4	0	0	109.6	P970 V972 R1021 M1023	P970-Q1054 HydrophobicContact CB-CG 3.79Å; V972-Q1054 HydrophobicContact CG2-CB 4.34Å; V972-Q1054 HydrophobicContact CG2-CG 4.48Å; R1021-Q1054 HydrophobicContact CB-CB 4.28Å; R1021-Q1054 PolarHBondContact N-O 3.35Å; R1021-Q1054 PolarHBondContact O-N 3.41Å; M1023-Q1054 HydrophobicContact CG-CB 3.57Å; M1023-Q1054 HydrophobicContact SD-CB 4.08Å; M1023-Q1054 PolarHBondContact SD-OE1 2.79Å
1055	R	87.8	Confident	86.2	Confident	61 Å²	61	55.1 Å²	55.1	23%	0.23	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122.5	170.5	-177.8	174.9	-63.3	142	4.8	109.7	R971 F973 L1015 D1020	R971-R1055 PolarHBondContact N-O 3.49Å; R971-R1055 PolarHBondContact O-N 3.41Å; F973-R1055 HydrophobicContact CE1-CB 3.92Å; L1015-R1055 PolarHBondContact O-NH2 2.88Å; D1020-R1055 VanDerWaalsContact CG-NH2 3.27Å; D1020-R1055 IonicContact OD1-CZ 2.88Å; D1020-R1055 VanDerWaalsContact OD1-CZ 3.27Å; D1020-R1055 IonicContact OD1-NE 3.68Å; D1020-R1055 PolarHBondContact OD1-NE 3.25Å; D1020-R1055 IonicContact OD1-NH2 2.73Å; D1020-R1055 PolarHBondContact OD1-NH2 3.41Å; D1020-R1055 IonicContact OD2-CZ 2.72Å; D1020-R1055 IonicContact OD2-NE 3.75Å; D1020-R1055 IonicContact OD2-NH2 3.94Å; D1020-R1055 PolarHBondContact OD2-NH2 3.41Å
1056	S	77.7	Confident	86.6	Confident	85 Å²	85	58.4 Å²	58.4	59%	0.594	31%	0.308	S	S	*	.			trans	-79.5	140.4	161.3	-58.1	0	0	0	0	108.5
1057	E	58.1	Low	86.7	Confident	177 Å²	177	60.5 Å²	60.5	83%	0.827	30%	0.302	S	S	*	.			trans	-99	0	176.6	-65.4	-170.4	141.8	0	0	111.6	R971	R971-E1057 WeakPolarHBondContact CD-OE1 3.45Å; R971-E1057 WeakPolarHBondContact CD-OE2 3.45Å; R971-E1057 IonicContact CZ-OE1 3.12Å; R971-E1057 IonicContact NE-OE1 3.64Å; R971-E1057 IonicContact NH1-OE1 3.83Å; R971-E1057 PolarHBondContact NH1-OE1 2.64Å; R971-E1057 IonicContact NH1-OE2 3.61Å

Retrieved 1,057 of 1,057 residues in 880.4 ms (Link to these results)

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