A0A087Y6C7_POEFO Loading...

EMAP like 3

AlphaFold DB , UniProt , Accession A0A087Y6C7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 816 aa.

						>A0A087Y6C7_POEFO|A0A087Y6C7
MEDEEEEDQVDEEVRGDQEKETSWASSVEEPIQPTTVRSLQREECLDRSCSPDEPGSAPASLGSDQNLSLRSGPLSPIQEGERTLVRRNSEKLANPERQRKRLDKKAASSANLLTRSPSLESRAKELIASAGSPGSRRGTYSQEQSIKMFIRGRPITMYVPSNIQNYDNLKMELPSERLELDWLVYGYRGRDCRANLFFLPSGEAVYFIACVIVLYHIKNRTQRHYRKHTDSVRCLAVHPDNVRVASGQTAGVDKDGKPMQACVHIWDSATLVTLQQIGLGTFQRGVGMGSLAFSIADSGTFLCVIDDSNEHILSVWDCTKGTKHAEIKTTNEAVFAVDFNPSDSNNIITCGKSHVYFWTLSAGQFTKKQGIFGKYKKPKFIHCFVFSLTGDVLTGDSEGNILPWAKSAADTKTLGKGAKETYQIVRPIKAHEGSVFTLCTLKCGALLSGGGKDRKIIRWSADLAPERECEIPEKFGAVRTVAVVDDEGLLVGTTRNAILRGSFSDGFVAIVQGHLDEMWGLATHPSQSIFLTCSHDRQVCLWNTEEHNLDWCITLEEYGLCADFCPSGSVVSVGLSTGRWVVLDLVTKEVISESTDGNEQLSVMKYSPDGRFLAVGSHDNFIYIYSVTESGRRYSRFGRCNGHSSFITHLDWSKDGCYIVSNSGDYEILYWDIAGGCKLLRNRFESKDREWASFTCVLGFHVIGVWLEGSDGTDINALCRSHNEKVVAVADDFCKVHLFQYPCPKPKAPSYKYEGHGSHVTNVCFTHNDSHLLSIGGKDTCILQWKVTGGGVGESRETLASTSSTSTSSPEPPAS
					

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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	30.2	Very low	32	Very low	248 Å²	248	183.2 Å²	183.2	100%	1.222	91%	0.909	S	S	*	*				0	134.9	0	-87.7	176.9	-179.9	0	0	105.7
2	E	31.2	Very low	31.9	Very low	191 Å²	191	183.2 Å²	183.2	89%	0.893	90%	0.904	S	S	*	*			trans	-65.2	157.6	-146.4	-75.7	144.3	160	0	0	116.7
3	D	34.3	Very low	31.7	Very low	152 Å²	152	184.6 Å²	184.6	81%	0.813	91%	0.907	S	S	*	*			trans	-65.4	155.3	168.4	-53.7	-66	0	0	0	112.1
4	E	37.4	Very low	31.6	Very low	201 Å²	201	179.2 Å²	179.2	94%	0.939	89%	0.89	S	S	*	*			trans	-138.2	131.2	148.8	-78.2	-168.5	160.1	0	0	110.9
5	E	36.5	Very low	31.5	Very low	188 Å²	188	183.7 Å²	183.7	88%	0.879	89%	0.893	S	S	*	*			trans	-85.8	154.5	172.6	-62	173.1	148.6	0	0	110.3
6	E	30.4	Very low	31.1	Very low	196 Å²	196	177.1 Å²	177.1	92%	0.916	89%	0.887	S	S	*	*			trans	-152.2	120.8	148.1	-111.3	177.6	-170.2	0	0	109.9
7	E	29.6	Very low	31.1	Very low	192 Å²	192	176.2 Å²	176.2	90%	0.897	89%	0.886	S	S	*	*	P	Polyproline II helix	trans	-100.6	132.9	170.3	-78.8	-173.5	153.9	0	0	109.2
8	D	31.7	Very low	30.8	Very low	166 Å²	166	177.5 Å²	177.5	89%	0.888	89%	0.888	S	S	*	*	P	Polyproline II helix	trans	-101.5	139	175.3	-94.3	-32.4	0	0	0	112.8
9	Q	28.3	Very low	30.8	Very low	182 Å²	182	177.8 Å²	177.8	85%	0.85	89%	0.887	S	S	*	*	P	Polyproline II helix	trans	-77.6	152.5	179.3	-64.9	170.6	20.9	0	0	112.1
10	V	32.5	Very low	30.7	Very low	144 Å²	144	179.3 Å²	179.3	87%	0.873	89%	0.887	S	S	*	*			trans	-123.9	121.8	170.3	-179.3	0	0	0	0	109.5
11	D	30.2	Very low	30.5	Very low	155 Å²	155	179.5 Å²	179.5	83%	0.829	89%	0.886	S	S	*	*			trans	-75.6	145.8	176.9	-79.1	-42.7	0	0	0	113.3
12	E	31	Very low	30.4	Very low	183 Å²	183	174.7 Å²	174.7	86%	0.855	87%	0.871	S	S	*	*			trans	-87.1	134.9	165.1	-73.7	-170.9	152.5	0	0	110.8
13	E	28.6	Very low	30	Very low	202 Å²	202	170 Å²	170	94%	0.944	86%	0.859	S	S	*	*			trans	-139.6	156.8	154.7	-102.8	-165.2	171.8	0	0	112.3
14	V	31.1	Very low	29.7	Very low	109 Å²	109	174.2 Å²	174.2	66%	0.661	86%	0.864	S	S	*	*			trans	-123.9	142.5	-143.3	162.1	0	0	0	0	111.7
15	R	29.5	Very low	29.1	Very low	247 Å²	247	168.4 Å²	168.4	93%	0.932	85%	0.85	S	S	*	*			trans	69.8	139.2	153	-78	166.9	-169.3	-125	1.6	122.2
16	G	25.5	Very low	28.6	Very low	78 Å²	78	164.7 Å²	164.7	80%	0.804	85%	0.845	S	S	*	*			trans	165.4	99.7	147.6	0	0	0	0	0	114.4
17	D	30.2	Very low	28.5	Very low	162 Å²	162	161 Å²	161	87%	0.866	84%	0.841	S	S	*	*			trans	-59	151.3	176.4	-66.4	-47.9	0	0	0	114.6
18	Q	26.9	Very low	28.4	Very low	199 Å²	199	157.8 Å²	157.8	93%	0.93	83%	0.834	S	S	*	*			trans	-165.7	114.3	130.4	-109.3	172.2	26.3	0	0	113
19	E	30.3	Very low	28.3	Very low	184 Å²	184	159 Å²	159	86%	0.86	83%	0.834	S	S	*	*			trans	-63.1	139.5	165.1	-66.8	172.1	145.5	0	0	111.5
20	K	28.1	Very low	28.3	Very low	207 Å²	207	158.9 Å²	158.9	90%	0.9	83%	0.834	S	S	*	*			trans	-140.7	101.3	151.2	-102.6	-174.9	-179.7	177.4	0	109.4
21	E	27.2	Very low	28.5	Very low	183 Å²	183	157.7 Å²	157.7	86%	0.855	83%	0.829	S	S	*	*			trans	-58.9	133.8	160.5	-69.7	-178.8	135.9	0	0	110.4
22	T	27.5	Very low	28.3	Very low	148 Å²	148	158.8 Å²	158.8	91%	0.908	83%	0.833	S	S	*	*			trans	-133.6	131	148.3	37.7	0	0	0	0	108
23	S	23.6	Very low	28.1	Very low	91 Å²	91	158.3 Å²	158.3	64%	0.636	83%	0.831	S	S	*	*			trans	-119.2	167.2	-164.7	45.1	0	0	0	0	111
24	W	27.2	Very low	28.1	Very low	241 Å²	241	154.6 Å²	154.6	91%	0.913	82%	0.824	S	S	*	*			trans	87.9	132.3	167.5	-62.4	75.6	0	0	0	116.8
25	A	25.3	Very low	27.9	Very low	79 Å²	79	156.2 Å²	156.2	65%	0.653	83%	0.834	S	S	*	*			cis	-159.9	146.8	-1.6	0	0	0	0	0	110.7
26	S	26.1	Very low	27.6	Very low	111 Å²	111	150.7 Å²	150.7	78%	0.776	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-70	137	166.7	160.2	0	0	0	0	110.3
27	S	27.3	Very low	27.6	Very low	119 Å²	119	152.7 Å²	152.7	83%	0.832	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-99.1	120.1	169.1	-60.7	0	0	0	0	109.4
28	V	28.1	Very low	27.3	Very low	123 Å²	123	155.5 Å²	155.5	75%	0.745	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-50	130.1	-179.9	173.8	0	0	0	0	113.4	E30	V28-E30 HydrophobicContact CG1-CG 4.39Å
29	E	29.5	Very low	27.3	Very low	192 Å²	192	151.2 Å²	151.2	90%	0.897	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-74.4	133	154.9	-74.3	177.3	141.1	0	0	109.4
30	E	28.9	Very low	27	Very low	180 Å²	180	150.8 Å²	150.8	84%	0.841	82%	0.818	S	S	*	*			trans	-126.7	146.3	155.7	-95.5	-166.2	170.3	0	0	110.9	V28	V28-E30 HydrophobicContact CG1-CG 4.39Å
31	P	35.9	Very low	27.1	Very low	118 Å²	118	150.1 Å²	150.1	77%	0.766	82%	0.818	S	S	*	*			trans	-99.7	141.8	-166.7	37.1	-29.7	0	0	0	112.5
32	I	27.4	Very low	27	Very low	179 Å²	179	151.9 Å²	151.9	92%	0.918	82%	0.817	S	S	*	*			trans	-135.8	139.8	165.7	-57.9	-179.2	0	0	0	111
33	Q	26.8	Very low	27	Very low	173 Å²	173	150.9 Å²	150.9	81%	0.808	80%	0.802	S	S	*	*			trans	-62.3	163.6	-160.6	-71.6	-176.5	-17.3	0	0	119.1
34	P	28.1	Very low	27.3	Very low	124 Å²	124	154.9 Å²	154.9	81%	0.805	81%	0.811	S	S	*	*			trans	-77.4	128.7	176	32	-32.5	0	0	0	111.5
35	T	25.6	Very low	27.2	Very low	142 Å²	142	148.7 Å²	148.7	87%	0.871	80%	0.803	S	S	*	*			trans	-101.8	115.8	167.8	24.8	0	0	0	0	109.9
36	T	25.2	Very low	27.3	Very low	132 Å²	132	151.8 Å²	151.8	81%	0.81	81%	0.807	S	S	*	*			trans	-73.7	140.5	161.7	-36.4	0	0	0	0	108.6
37	V	25.5	Very low	27.4	Very low	120 Å²	120	153.3 Å²	153.3	73%	0.727	81%	0.807	S	S	*	*			trans	176.3	119.7	134.3	150.9	0	0	0	0	112
38	R	24	Very low	27.3	Very low	220 Å²	220	158.9 Å²	158.9	83%	0.83	81%	0.81	S	S	*	*			trans	71.5	113.6	141	-69.9	176.8	-174.1	176.2	-2	122.7
39	S	25.2	Very low	27.3	Very low	109 Å²	109	157.9 Å²	157.9	76%	0.762	81%	0.808	S	S	*	*			trans	-29.6	146.1	139.7	42.4	0	0	0	0	117.6
40	L	25.6	Very low	27.2	Very low	175 Å²	175	154.8 Å²	154.8	92%	0.916	81%	0.806	S	S	*	*			trans	-127.8	110.4	150.7	-87.6	164	0	0	0	108.4
41	Q	28.9	Very low	27.1	Very low	193 Å²	193	151.4 Å²	151.4	90%	0.902	80%	0.803	S	S	*	*			trans	-107.7	146.1	155.7	-90.4	-179.8	-23.2	0	0	107.8
42	R	26.2	Very low	27.9	Very low	220 Å²	220	151 Å²	151	83%	0.83	80%	0.8	S	S	*	*			trans	-147.8	138.4	169.7	-113.4	-164.5	139.4	167.5	-8.4	104.8
43	E	26.3	Very low	27.8	Very low	128 Å²	128	150.4 Å²	150.4	60%	0.598	80%	0.799	S	S	*	*			cis	-151.9	134.8	4.7	-82.6	179.5	154.8	0	0	107.1
44	E	31.3	Very low	28	Very low	175 Å²	175	150.6 Å²	150.6	82%	0.818	80%	0.799	S	S	*	*				68.7	119.4	109.3	-63.7	-169.5	156.5	0	0	119.1
45	C	24.6	Very low	28.7	Very low	111 Å²	111	150.8 Å²	150.8	75%	0.75	80%	0.801	S	S	*	*				-172.9	114.9	105.4	-117.4	0	0	0	0	114.7
46	L	27.5	Very low	28.7	Very low	143 Å²	143	146.8 Å²	146.8	75%	0.749	79%	0.788	S	S	*	*			trans	73.1	102.7	133.2	-60.2	171	0	0	0	124.5
47	D	27	Very low	28.9	Very low	144 Å²	144	146.3 Å²	146.3	77%	0.77	79%	0.79	S	S	*	*				56.6	120.3	115.5	-72	-10.9	0	0	0	124.9
48	R	26.6	Very low	29.1	Very low	235 Å²	235	145.1 Å²	145.1	89%	0.887	79%	0.793	S	S	*	*				-170.9	118.7	110.6	-105.2	-179.8	178.9	-168	0	114.2
49	S	28.3	Very low	30	Very low	102 Å²	102	141.2 Å²	141.2	71%	0.713	80%	0.796	S	S	*	*			trans	15.9	146.2	140.2	60.1	0	0	0	0	120.6
50	C	25.5	Very low	30.3	Very low	127 Å²	127	140.4 Å²	140.4	86%	0.858	80%	0.796	S	S	*	*			cis	-167.9	171.5	22.6	-117.9	0	0	0	0	110.5
51	S	28.5	Very low	30.4	Very low	110 Å²	110	137.1 Å²	137.1	77%	0.769	79%	0.788	S	S	*	*			trans	-100.4	-153.8	-153.7	50.9	0	0	0	0	116.4
52	P	51.9	Low	30.4	Very low	108 Å²	108	136.3 Å²	136.3	70%	0.701	79%	0.788	S	S	*	*				-126.7	-174.1	-103.9	39.1	-18.6	0	0	0	113.9
53	D	25.8	Very low	30.4	Very low	167 Å²	167	129.3 Å²	129.3	89%	0.893	79%	0.785	S	S	*	*			trans	-165.1	127.7	146	-94.5	-27.4	0	0	0	113.1
54	E	30.3	Very low	30.6	Very low	177 Å²	177	129.1 Å²	129.1	83%	0.827	80%	0.798	S	S	*	*			trans	-129.2	153.4	158.7	-116.8	-153.7	-176.8	0	0	106.1
55	P	43.2	Very low	30.5	Very low	128 Å²	128	128 Å²	128	83%	0.831	80%	0.797	S	S	*	*				-153	174.9	97.2	34.2	-13.7	0	0	0	112.5
56	G	26.5	Very low	30.7	Very low	59 Å²	59	132.4 Å²	132.4	61%	0.608	81%	0.807	S	S	*	*			cis	158.3	137.1	5.3	0	0	0	0	0	109.9
57	S	28.4	Very low	30.8	Very low	121 Å²	121	132.5 Å²	132.5	85%	0.846	81%	0.808	S	S	*	*			trans	49.6	123.5	145.6	56.4	0	0	0	0	125.7
58	A	29.7	Very low	30.8	Very low	96 Å²	96	133 Å²	133	79%	0.793	81%	0.81	S	S	*	*				33.6	156.2	126.7	0	0	0	0	0	122.4
59	P	42.5	Very low	30.8	Very low	137 Å²	137	126.1 Å²	126.1	89%	0.89	80%	0.798	S	S	*	*			cis	-151.7	-166.8	47.7	40.4	-15.1	0	0	0	118.7
60	A	30.9	Very low	30.8	Very low	92 Å²	92	128.9 Å²	128.9	76%	0.76	80%	0.804	S	S	*	*			trans	-85.2	166.5	-161.6	0	0	0	0	0	119.3
61	S	29	Very low	30.9	Very low	107 Å²	107	133.6 Å²	133.6	75%	0.748	80%	0.804	S	S	*	*				164	147.2	118.4	57.3	0	0	0	0	117.1
62	L	29	Very low	30.7	Very low	175 Å²	175	133.7 Å²	133.7	92%	0.916	80%	0.804	S	S	*	*			trans	93.4	122.1	142.4	-75.8	154.6	0	0	0	125.5
63	G	26.2	Very low	29.4	Very low	74 Å²	74	132 Å²	132	76%	0.763	81%	0.807	S	S	*	*			trans	98.8	132.7	141.9	0	0	0	0	0	117
64	S	29.9	Very low	30.1	Very low	123 Å²	123	129.7 Å²	129.7	86%	0.86	80%	0.801	S	S	*	*			cis	-169.5	156.2	8.6	49.5	0	0	0	0	110.8
65	D	28.9	Very low	29.8	Very low	151 Å²	151	129.1 Å²	129.1	81%	0.807	80%	0.803	S	S	*	*			trans	-58.5	154.4	-178.4	-63.7	-60.7	0	0	0	118
66	Q	30	Very low	29	Very low	204 Å²	204	127.8 Å²	127.8	95%	0.953	80%	0.796	S	S	*	*				-168.6	149.8	111.6	-100.3	179	30.7	0	0	112.7
67	N	29.2	Very low	29.5	Very low	145 Å²	145	129.8 Å²	129.8	78%	0.775	80%	0.798	S	S	*	*			trans	-132.2	165.6	-152.3	-157.9	2.5	0	0	0	109.8
68	L	27.6	Very low	29.4	Very low	156 Å²	156	130.6 Å²	130.6	82%	0.817	79%	0.792	S	S	*	*			trans	117.5	150.2	150.7	-60.9	168.3	0	0	0	120.2
69	S	26.5	Very low	29.2	Very low	90 Å²	90	132.6 Å²	132.6	63%	0.629	79%	0.785	S	S	*	*			trans	-137.4	158.7	-145	55.8	0	0	0	0	113
70	L	27.1	Very low	28.3	Very low	159 Å²	159	134 Å²	134	83%	0.832	78%	0.779	S	S	*	*			trans	65	124.5	143	-74	158.1	0	0	0	121.8
71	R	27	Very low	28	Very low	227 Å²	227	133.3 Å²	133.3	86%	0.857	78%	0.781	S	S	*	*				153.8	138.5	103.9	-111.7	179.7	-177.1	-145.4	1.8	116.6
72	S	26	Very low	27.7	Very low	111 Å²	111	135.8 Å²	135.8	78%	0.776	78%	0.781	S	S	*	*			trans	57.8	137.8	142.4	57.7	0	0	0	0	125.2
73	G	23.7	Very low	27.5	Very low	73 Å²	73	139.5 Å²	139.5	75%	0.753	78%	0.783	S	S	*	*			trans	-71.8	-153.7	-179.6	0	0	0	0	0	117.5
74	P	39.7	Very low	27.3	Very low	119 Å²	119	140.3 Å²	140.3	77%	0.773	77%	0.773	S	S	*	*			cis	-145.7	178	24.6	43.8	-23	0	0	0	119.1
75	L	24.9	Very low	27.1	Very low	165 Å²	165	141.4 Å²	141.4	86%	0.864	77%	0.768	S	S	*	*			trans	74	140.8	146.7	-71.7	159	0	0	0	125.6
76	S	26.8	Very low	26.8	Very low	99 Å²	99	141.1 Å²	141.1	69%	0.692	77%	0.772	S	S	*	*			trans	-72.9	-172.6	-172.4	54.6	0	0	0	0	116.5
77	P	36.4	Very low	26.4	Very low	101 Å²	101	140.8 Å²	140.8	66%	0.656	76%	0.762	S	S	*	*			cis	-161	-167.6	32.6	45.8	-20.6	0	0	0	120.9
78	I	26.2	Very low	26.1	Very low	139 Å²	139	145.8 Å²	145.8	71%	0.713	77%	0.77	S	S	*	*			trans	82.2	137.2	152.6	-71.6	168.5	0	0	0	117.5
79	Q	25.3	Very low	25.8	Very low	138 Å²	138	143.8 Å²	143.8	65%	0.645	76%	0.76	S	S	*	*			cis	-165.5	137.5	3.9	-121.6	178.3	-26.6	0	0	109.1
80	E	24.1	Very low	25.7	Very low	165 Å²	165	145.3 Å²	145.3	77%	0.771	77%	0.771	S	S	*	*				85.3	135.7	102.2	-91.5	172.2	-144.9	0	0	118.3
81	G	24.3	Very low	25.6	Very low	78 Å²	78	145.5 Å²	145.5	80%	0.804	77%	0.767	S	S	*	*			trans	168.9	58.3	172.2	0	0	0	0	0	113
82	E	23.5	Very low	25.4	Very low	159 Å²	159	144.5 Å²	144.5	74%	0.743	77%	0.769	S	S	*	*			trans	-65.5	153.2	174.9	-68.7	-179.7	126	0	0	114
83	R	23.2	Very low	25.4	Very low	254 Å²	254	147.1 Å²	147.1	96%	0.958	77%	0.774	S	S	*	*				-158.3	143.7	120.4	-106.5	174.4	-169.4	-169.1	3.5	113.1
84	T	23.5	Very low	25.5	Very low	91 Å²	91	148.4 Å²	148.4	56%	0.558	78%	0.777	S	S	*	*			trans	-118.2	142.8	-148.8	10.8	0	0	0	0	112.7
85	L	24.3	Very low	24.9	Very low	145 Å²	145	149.2 Å²	149.2	76%	0.759	78%	0.775	S	S	*	*				56.3	136	128.5	-65	163.9	0	0	0	121.4
86	V	23.2	Very low	25	Very low	145 Å²	145	147.1 Å²	147.1	88%	0.879	77%	0.771	S	S	*	*				-149.8	126.4	114.1	171.1	0	0	0	0	110.3
87	R	22	Very low	25.1	Very low	197 Å²	197	150.6 Å²	150.6	74%	0.743	78%	0.777	S	S	*	*			trans	-74.3	151	165.3	-106	175.3	164.2	168.3	-4.7	111.2
88	R	22.1	Very low	24.7	Very low	250 Å²	250	157 Å²	157	94%	0.943	79%	0.788	S	S	*	*			trans	-135.5	114.1	144	-118.6	-179.6	-176	176.8	1.4	109.8
89	N	22.2	Very low	24.8	Very low	115 Å²	115	159.2 Å²	159.2	62%	0.615	80%	0.795	S	S	*	*			trans	-77.3	144.3	165.2	-76.1	-4.4	0	0	0	109.4
90	S	24.1	Very low	25.1	Very low	122 Å²	122	163.6 Å²	163.6	85%	0.853	81%	0.806	S	S	*	*				-142.5	121.5	128.6	71.3	0	0	0	0	109.2
91	E	24.3	Very low	25.5	Very low	162 Å²	162	165 Å²	165	76%	0.757	81%	0.809	S	S	*	*			trans	-87.8	141.5	168.6	-69.9	174.3	157.2	0	0	108.7
92	K	24	Very low	25.8	Very low	207 Å²	207	172.5 Å²	172.5	90%	0.9	81%	0.813	S	S	*	*			trans	-136.1	113.7	145.4	-97.5	-171.1	176.6	-176.4	0	108
93	L	26.2	Very low	26.3	Very low	166 Å²	166	172.8 Å²	172.8	87%	0.869	82%	0.819	S	S	*	*			trans	-58.8	132	166.7	-86.4	90.5	0	0	0	110
94	A	25	Very low	26.5	Very low	100 Å²	100	167.6 Å²	167.6	83%	0.826	81%	0.81	S	S	*	*			trans	-130.1	136.7	161	0	0	0	0	0	109.3
95	N	26.3	Very low	26.8	Very low	136 Å²	136	173 Å²	173	73%	0.727	83%	0.826	S	S	*	*			trans	-52.7	140.9	-168.4	-144.4	0.7	0	0	0	115.4	E97	N95-E97 VanDerWaalsContact C-N 3.26Å; N95-E97 PolarHBondContact O-N 3.32Å; N95-E97 VanDerWaalsContact O-N 3.09Å
96	P	27.5	Very low	27.1	Very low	120 Å²	120	176.2 Å²	176.2	78%	0.779	83%	0.834	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	10.2	-175.3	-13.9	29.7	0	0	0	117.1
97	E	28.6	Very low	27.5	Very low	173 Å²	173	174.3 Å²	174.3	81%	0.808	83%	0.834	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	7.2	-175.2	-74.3	-162.9	142.7	0	0	115.7	N95	N95-E97 VanDerWaalsContact C-N 3.26Å; N95-E97 PolarHBondContact O-N 3.32Å; N95-E97 VanDerWaalsContact O-N 3.09Å
98	R	29.5	Very low	27.5	Very low	235 Å²	235	169.2 Å²	169.2	89%	0.887	83%	0.834	S	S	*	*	S	Bend	trans	-117.2	6.9	175.6	-91.2	-176.5	174	-176.9	-0.6	116.3
99	Q	28.2	Very low	27.7	Very low	185 Å²	185	161.7 Å²	161.7	86%	0.864	82%	0.819	S	S	*	*	S	Bend	trans	-104.9	11.5	173.8	-92.5	-178.1	-11.2	0	0	115.3
100	R	30.8	Very low	28	Very low	231 Å²	231	162.9 Å²	162.9	87%	0.872	84%	0.837	S	S	*	*	S	Bend	trans	-92.7	10.8	166.7	-102.5	179.1	176.1	167	-1.1	114.6
101	K	33.6	Very low	28.2	Very low	194 Å²	194	160.1 Å²	160.1	84%	0.843	82%	0.821	S	S	*	*	S	Bend	trans	-120.4	23.3	-177.9	-91.6	-174.2	176.6	178.2	0	115.4
102	R	30.7	Very low	28.4	Very low	236 Å²	236	160 Å²	160	89%	0.891	83%	0.825	S	S	*	*	S	Bend	trans	-138.9	24.5	176	-135	-179.4	-179.2	-169.9	-0.4	116.1
103	L	32.1	Very low	28.7	Very low	164 Å²	164	158.3 Å²	158.3	86%	0.859	83%	0.825	S	S	*	*	S	Bend	trans	-133.3	26.3	171.4	-75.8	172.5	0	0	0	113.8
104	D	29	Very low	28.9	Very low	146 Å²	146	158.3 Å²	158.3	78%	0.781	83%	0.825	S	S	*	*			trans	-120.8	51.2	172.2	-72.1	-43.3	0	0	0	111.7
105	K	30.3	Very low	28.9	Very low	204 Å²	204	159.9 Å²	159.9	89%	0.887	83%	0.825	S	S	*	*			trans	-146.7	72	169.1	-76.6	-166.5	178.6	-179	0	111.1
106	K	29.4	Very low	29	Very low	212 Å²	212	165 Å²	165	92%	0.922	83%	0.834	S	S	*	*	S	Bend	trans	-173.7	61.7	152.5	-107.4	176.1	-178	-171.6	0	110.6
107	A	30.8	Very low	29	Very low	106 Å²	106	163.1 Å²	163.1	88%	0.876	82%	0.824	S	S	*	*	S	Bend	trans	-167.9	60.9	161.6	0	0	0	0	0	108.3
108	A	23.7	Very low	29	Very low	90 Å²	90	160.7 Å²	160.7	74%	0.744	82%	0.823	S	S	*	*			trans	-152.8	130.8	171.5	0	0	0	0	0	110.4
109	S	26.3	Very low	29.1	Very low	92 Å²	92	153.4 Å²	153.4	64%	0.643	81%	0.808	S	S	*	*			trans	68.7	101	162.8	69	0	0	0	0	118.6	A111	S109-A111 PolarHBondContact O-N 2.97Å; S109-A111 VanDerWaalsContact O-N 3.09Å
110	S	27.6	Very low	29.4	Very low	140 Å²	140	151 Å²	151	98%	0.979	80%	0.8	S	S	*	*	S	Bend	trans	-70.9	43.5	143	40.6	0	0	0	0	111.5
111	A	28.7	Very low	29.5	Very low	64 Å²	64	147.8 Å²	147.8	53%	0.529	80%	0.795	S	S	.	*			trans	-141.9	74.6	177.1	0	0	0	0	0	108.2	S109	S109-A111 PolarHBondContact O-N 2.97Å; S109-A111 VanDerWaalsContact O-N 3.09Å
112	N	28.9	Very low	29.3	Very low	158 Å²	158	142.7 Å²	142.7	85%	0.845	78%	0.784	S	S	*	*			trans	173.7	67.5	152.5	-87.1	-29.2	0	0	0	110.2
113	L	28.7	Very low	29.4	Very low	172 Å²	172	140.9 Å²	140.9	90%	0.901	78%	0.777	S	S	*	*			trans	-145.9	65.3	158.8	-93.7	170.5	0	0	0	108.4
114	L	31.6	Very low	29.4	Very low	166 Å²	166	136.4 Å²	136.4	87%	0.869	76%	0.764	S	S	*	*			trans	-122.1	84.4	166	-75.8	173.1	0	0	0	109.1
115	T	25.6	Very low	29.6	Very low	134 Å²	134	138 Å²	138	82%	0.822	76%	0.764	S	S	*	*			trans	-134.1	91.7	149.7	40.7	0	0	0	0	107.6	S117	T115-S117 PolarHBondContact O-N 3.35Å
116	R	28.5	Very low	29.5	Very low	244 Å²	244	135.9 Å²	135.9	92%	0.921	76%	0.757	S	S	*	*			trans	-62	115	167.1	-93	-179.3	162.6	-178.8	-5.1	108.4
117	S	26.2	Very low	29.6	Very low	80 Å²	80	132.8 Å²	132.8	56%	0.559	75%	0.75	S	S	*	*			trans	-90.3	125.9	163.2	45.3	0	0	0	0	109.2	T115 S119	T115-S117 PolarHBondContact O-N 3.35Å; S117-S119 PolarHBondContact O-N 3.09Å
118	P	28.6	Very low	29.8	Very low	122 Å²	122	134.8 Å²	134.8	79%	0.792	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	21.2	-172.7	31.2	-35.5	0	0	0	114.5
119	S	31.9	Very low	30.1	Very low	82 Å²	82	134.9 Å²	134.9	57%	0.573	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	2.9	-170.9	63.3	0	0	0	0	115.7	S117	S117-S119 PolarHBondContact O-N 3.09Å
120	L	34.1	Very low	30.3	Very low	134 Å²	134	135.6 Å²	135.6	70%	0.702	75%	0.75	S	S	*	*	S	Bend	trans	-102.7	-13	178.7	-70.1	171.3	0	0	0	114.2
121	E	33.3	Very low	30.8	Very low	164 Å²	164	134 Å²	134	77%	0.766	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-19.2	177.4	-105.9	175.8	166.5	0	0	113.9
122	S	28.8	Very low	30.9	Very low	87 Å²	87	134.3 Å²	134.3	61%	0.608	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-22.9	178.1	65.1	0	0	0	0	113.4
123	R	32.6	Very low	30.9	Very low	198 Å²	198	132.6 Å²	132.6	75%	0.747	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-15.7	-174.3	-139.1	173.4	-178.1	175.8	-0.5	114.1
124	A	32.3	Very low	31.7	Very low	70 Å²	70	130.9 Å²	130.9	58%	0.579	75%	0.754	S	S	*	*	S	Bend	trans	-81.1	-17.3	175.3	0	0	0	0	0	113.2
125	K	32.8	Very low	31.5	Very low	178 Å²	178	126.6 Å²	126.6	77%	0.774	75%	0.751	S	S	*	*	S	Bend	trans	-86.8	-13.8	179.8	-76.9	-176.3	177	176.1	0	114.7
126	E	29.7	Very low	31.9	Very low	160 Å²	160	125.7 Å²	125.7	75%	0.748	75%	0.75	S	S	*	*	S	Bend	trans	-91.1	-8.5	-179.6	-90.2	-175.4	156.3	0	0	115.1
127	L	31.2	Very low	31.9	Very low	147 Å²	147	125.8 Å²	125.8	77%	0.77	75%	0.75	S	S	*	*	S	Bend	trans	-98.9	6.7	-179.9	-74.4	166.7	0	0	0	114.4
128	I	34.5	Very low	32.2	Very low	149 Å²	149	134.2 Å²	134.2	76%	0.764	77%	0.77	S	S	*	*	S	Bend	trans	-98.1	-4.9	177.9	-60.9	176.8	0	0	0	111.8
129	A	30.3	Very low	32.2	Very low	92 Å²	92	131.2 Å²	131.2	76%	0.76	76%	0.761	S	S	*	*	S	Bend	trans	-106	26.6	-172.8	0	0	0	0	0	115.8
130	S	29.6	Very low	32.2	Very low	106 Å²	106	134.4 Å²	134.4	74%	0.741	78%	0.777	S	S	*	*			trans	-134.1	55.7	174.9	61.8	0	0	0	0	113.6
131	A	38.6	Very low	32.1	Very low	107 Å²	107	137.8 Å²	137.8	88%	0.884	78%	0.782	S	S	*	*			trans	-107.3	105.5	161	0	0	0	0	0	109.3
132	G	31.7	Very low	32.2	Very low	71 Å²	71	134.5 Å²	134.5	73%	0.732	78%	0.777	S	S	*	*			trans	178.2	92.1	171.2	0	0	0	0	0	115.1
133	S	28.1	Very low	33	Very low	121 Å²	121	139.2 Å²	139.2	85%	0.846	79%	0.79	S	S	*	*				170.4	140.5	127.8	-77.3	0	0	0	0	112
134	P	44.9	Very low	34.5	Very low	136 Å²	136	134.7 Å²	134.7	88%	0.883	78%	0.777	S	S	*	*			trans	-92.7	128.2	-177.2	34.8	-28.7	0	0	0	111.6
135	G	28.5	Very low	36.7	Very low	77 Å²	77	136.5 Å²	136.5	79%	0.794	77%	0.773	S	S	*	*			trans	-140.2	110	179.9	0	0	0	0	0	112.4
136	S	33.3	Very low	39.2	Very low	115 Å²	115	130.8 Å²	130.8	80%	0.804	76%	0.756	S	S	*	*			trans	-38.4	128.5	178	-175.4	0	0	0	0	116.7
137	R	29.6	Very low	41.9	Very low	246 Å²	246	124.4 Å²	124.4	93%	0.928	73%	0.727	S	S	*	*			trans	-158.2	113.5	132.9	-101.5	172.6	-152.5	-165.1	5.6	109.3	G139	R137-G139 PolarHBondContact O-N 2.92Å
138	R	33	Very low	44.7	Very low	257 Å²	257	123.4 Å²	123.4	97%	0.97	72%	0.716	S	S	*	*			trans	-63	117.3	168.8	-80.2	-179.7	179.1	178.9	-0.8	109.2
139	G	27.3	Very low	47.2	Very low	58 Å²	58	117.3 Å²	117.3	60%	0.598	69%	0.685	S	S	*	*			trans	-143.1	114	158.9	0	0	0	0	0	106.6	R137 Y141	R137-G139 PolarHBondContact O-N 2.92Å; G139-Y141 PolarHBondContact O-N 3.27Å
140	T	32.5	Very low	49.9	Very low	150 Å²	150	119.5 Å²	119.5	92%	0.92	68%	0.677	S	S	*	*			trans	-62.8	92.8	175.3	32.1	0	0	0	0	110.1
141	Y	30.7	Very low	52.6	Low	204 Å²	204	114.5 Å²	114.5	80%	0.8	64%	0.642	S	S	*	*			trans	-115.4	124.5	154.8	-80.2	-91.1	0	0	0	105.9	G139 Q143	G139-Y141 PolarHBondContact O-N 3.27Å; Y141-Q143 PolarHBondContact O-N 3.11Å
142	S	37.1	Very low	54.7	Low	96 Å²	96	116.6 Å²	116.6	67%	0.671	63%	0.627	S	S	*	*			trans	-51.6	129.6	168.9	53.8	0	0	0	0	108.3	E144	S142-E144 PolarHBondContact O-N 3.19Å
143	Q	45.7	Very low	57.1	Low	186 Å²	186	116.3 Å²	116.3	87%	0.869	62%	0.624	S	S	*	*			trans	-57.4	102.6	174.4	-84.4	173.8	-40.4	0	0	109.3	Y141 Q145	Y141-Q143 PolarHBondContact O-N 3.11Å; Q143-Q145 PolarHBondContact O-N 3.1Å
144	E	63.8	Low	59.8	Low	103 Å²	103	116.6 Å²	116.6	48%	0.481	61%	0.607	S	S	.	*			trans	-67.1	92.6	172.4	-64.6	175.8	-179	0	0	108.2	S142 S146 F685	S142-E144 PolarHBondContact O-N 3.19Å; E144-S146 PolarHBondContact O-N 2.74Å; E144-F685 HydrophobicContact CB-CD2 4.35Å; E144-F685 HydrophobicContact CB-CE2 4.05Å; E144-F685 HydrophobicContact CG-CD2 4.16Å; E144-F685 HydrophobicContact CG-CE2 3.82Å; E144-F685 HydrophobicContact CG-CZ 4.34Å
145	Q	78.3	Confident	61.9	Low	107 Å²	107	113.8 Å²	113.8	50%	0.5	59%	0.589	S	S	.	*			trans	-62.8	107.6	176.3	-79.8	-175.6	-13.8	0	0	109.3	Q143 V160	Q143-Q145 PolarHBondContact O-N 3.1Å; Q145-V160 HydrophobicContact CB-CB 4.18Å; Q145-V160 HydrophobicContact CB-CG2 3.97Å; Q145-V160 WeakPolarHBondContact O-CG2 3.39Å; Q145-V160 PolarHBondContact O-N 2.72Å
146	S	84.8	Confident	64.8	Low	59 Å²	59	110.8 Å²	110.8	41%	0.413	55%	0.554	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.4	148.6	176.8	59.8	0	0	0	0	110.2	E144 M158	E144-S146 PolarHBondContact O-N 2.74Å; S146-M158 CarbonylContact C-O 3.58Å; S146-M158 VanDerWaalsContact CA-O 3.27Å; S146-M158 WeakPolarHBondContact CA-O 3.37Å; S146-M158 WeakPolarHBondContact CB-O 3.31Å
147	I	87.4	Confident	67.5	Low	26 Å²	26	106.8 Å²	106.8	13%	0.133	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	140.6	179.9	-57.8	-176.5	0	0	0	108	T157 M158 V160 Y167 F701 I704	I147-T157 WeakPolarHBondContact O-CA 3.27Å; I147-M158 PolarHBondContact N-O 3.21Å; I147-M158 PolarHBondContact O-N 2.98Å; I147-V160 HydrophobicContact CD1-CG2 3.91Å; I147-V160 HydrophobicContact CG1-CG2 3.91Å; I147-Y167 HydrophobicContact CD1-CD1 3.96Å; I147-Y167 HydrophobicContact CD1-CD2 4Å; I147-Y167 HydrophobicContact CD1-CE1 3.4Å; I147-Y167 HydrophobicContact CD1-CE2 3.46Å; I147-Y167 VanDerWaalsContact CD1-CE2 3.46Å; I147-Y167 HydrophobicContact CD1-CG 4.23Å; I147-Y167 WeakPolarHBondContact CD1-OH 3.49Å; I147-Y167 HydrophobicContact CG1-CE1 4.34Å; I147-F701 HydrophobicContact CD1-CD2 4.1Å; I147-F701 HydrophobicContact CD1-CE2 3.58Å; I147-I704 HydrophobicContact CG2-CD1 4.13Å
148	K	88.5	Confident	70.4	Confident	125 Å²	125	95.3 Å²	95.3	54%	0.543	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	123.3	175.7	-66.2	-178.2	-179.4	178.1	0	109.8	F150 I156 T157	K148-F150 HydrophobicContact CB-CE2 4.25Å; K148-I156 WeakPolarHBondContact CA-O 3.44Å; K148-T157 HydrophobicContact CG-CG2 4.47Å
149	M	88.3	Confident	73.2	Confident	22 Å²	22	85.2 Å²	85.2	11%	0.108	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	150.4	164.7	-176.9	173.4	70.1	0	0	108.5	I151 P155 I156 M158 L699 I704 W707	M149-I151 HydrophobicContact CE-CD1 3.67Å; M149-I151 HydrophobicContact CE-CG1 4.05Å; M149-P155 CarbonylContact O-C 3.5Å; M149-P155 WeakPolarHBondContact O-CA 3.46Å; M149-I156 HydrophobicContact CE-CD1 3.94Å; M149-I156 PolarHBondContact N-O 3.3Å; M149-I156 PolarHBondContact O-N 3Å; M149-M158 HydrophobicContact CB-CE 3.57Å; M149-M158 HydrophobicContact CE-CE 4.3Å; M149-L699 HydrophobicContact CE-CD2 3.72Å; M149-I704 HydrophobicContact SD-CG2 4.04Å; M149-W707 HydrophobicContact CE-CG 4.44Å; M149-W707 HydrophobicContact SD-CB 4.12Å; M149-W707 HydrophobicContact SD-CG 4.03Å
150	F	87.4	Confident	76.2	Confident	137 Å²	137	83 Å²	83	60%	0.601	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.7	122.6	177.2	-66.2	-95.3	0	0	0	109.6	K148 R154 P155	K148-F150 HydrophobicContact CB-CE2 4.25Å; F150-R154 WeakPolarHBondContact CA-O 3.33Å; F150-P155 HydrophobicContact CD1-CB 4.1Å; F150-P155 HydrophobicContact CE1-CB 3.73Å; F150-P155 HydrophobicContact CZ-CB 4.3Å
151	I	85.8	Confident	78.9	Confident	2 Å²	2	76.1 Å²	76.1	1%	0.01	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	124.1	170.9	-65.7	-175.2	0	0	0	107.1	M149 G153 R154 I156 Y667 L699 W707	M149-I151 HydrophobicContact CE-CD1 3.67Å; M149-I151 HydrophobicContact CE-CG1 4.05Å; I151-G153 PolarHBondContact O-N 3.44Å; I151-R154 PolarHBondContact N-O 3.31Å; I151-R154 VanDerWaalsContact N-O 3.13Å; I151-R154 WeakPolarHBondContact O-CB 2.78Å; I151-R154 PolarHBondContact O-N 2.97Å; I151-I156 HydrophobicContact CB-CD1 4.15Å; I151-I156 HydrophobicContact CD1-CD1 3.7Å; I151-I156 HydrophobicContact CG1-CD1 3.9Å; I151-Y667 HydrophobicContact CG2-CD1 4.26Å; I151-Y667 HydrophobicContact CG2-CD2 3.96Å; I151-Y667 HydrophobicContact CG2-CE1 4.2Å; I151-Y667 HydrophobicContact CG2-CE2 3.89Å; I151-Y667 HydrophobicContact CG2-CG 4.15Å; I151-L699 HydrophobicContact CD1-CD2 3.63Å; I151-W707 HydrophobicContact CD1-CD2 4.33Å; I151-W707 HydrophobicContact CD1-CE3 4.43Å; I151-W707 HydrophobicContact CD1-CH2 4.47Å; I151-W707 HydrophobicContact CD1-CZ2 4.37Å
152	R	82.1	Confident	81.6	Confident	151 Å²	151	69.8 Å²	69.8	57%	0.57	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.2	35.3	-174.6	-64.6	-176.7	168.6	161.4	6.2	113.7	R154 Y667 D712	R152-R154 PolarHBondContact O-N 3.26Å; R152-Y667 PolarHBondContact NH1-OH 3.32Å; R152-D712 VanDerWaalsContact CD-O 3.25Å; R152-D712 WeakPolarHBondContact CD-O 3.41Å; R152-D712 HydrophobicContact CG-CB 4.44Å; R152-D712 WeakPolarHBondContact CG-O 3.21Å; R152-D712 IonicContact CZ-OD2 2.75Å; R152-D712 PolarHBondContact NE-O 3.37Å; R152-D712 IonicContact NH2-OD2 3.75Å; R152-D712 PolarHBondContact NH2-OD2 3.33Å
153	G	81.3	Confident	83.9	Confident	64 Å²	64	71.4 Å²	71.4	66%	0.66	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	-3	-177.9	0	0	0	0	0	115.6	I151	I151-G153 PolarHBondContact O-N 3.44Å
154	R	85.2	Confident	85.7	Confident	127 Å²	127	64 Å²	64	48%	0.479	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	127.8	173.2	-67.9	-174	177.3	175.2	0.4	110.6	F150 I151 R152 D666	F150-R154 WeakPolarHBondContact CA-O 3.33Å; I151-R154 PolarHBondContact N-O 3.31Å; I151-R154 VanDerWaalsContact N-O 3.13Å; I151-R154 WeakPolarHBondContact O-CB 2.78Å; I151-R154 PolarHBondContact O-N 2.97Å; R152-R154 PolarHBondContact O-N 3.26Å; R154-D666 IonicContact CZ-OD1 3.15Å; R154-D666 PolarHBondContact NH1-O 3.08Å; R154-D666 IonicContact NH1-OD1 3.99Å; R154-D666 PolarHBondContact NH1-OD1 3.06Å; R154-D666 IonicContact NH2-OD1 2.75Å
155	P	89.3	Confident	86.1	Confident	78 Å²	78	66.8 Å²	66.8	51%	0.506	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	120.6	178.3	30.2	-32.2	0	0	0	111.8	M149 F150	M149-P155 CarbonylContact O-C 3.5Å; M149-P155 WeakPolarHBondContact O-CA 3.46Å; F150-P155 HydrophobicContact CD1-CB 4.1Å; F150-P155 HydrophobicContact CE1-CB 3.73Å; F150-P155 HydrophobicContact CZ-CB 4.3Å
156	I	90.3	Very high	86.2	Confident	13 Å²	13	67 Å²	67	7%	0.067	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	112.7	173.4	-55.8	170.5	0	0	0	107.6	K148 M149 I151 M158 I669 L699	K148-I156 WeakPolarHBondContact CA-O 3.44Å; M149-I156 HydrophobicContact CE-CD1 3.94Å; M149-I156 PolarHBondContact N-O 3.3Å; M149-I156 PolarHBondContact O-N 3Å; I151-I156 HydrophobicContact CB-CD1 4.15Å; I151-I156 HydrophobicContact CD1-CD1 3.7Å; I151-I156 HydrophobicContact CG1-CD1 3.9Å; I156-M158 HydrophobicContact CG2-CE 4.32Å; I156-I669 HydrophobicContact CG2-CD1 3.88Å; I156-I669 HydrophobicContact CG2-CG1 4.33Å; I156-L699 HydrophobicContact CD1-CD1 4.28Å; I156-L699 HydrophobicContact CD1-CD2 4.17Å
157	T	90.4	Very high	86.1	Confident	31 Å²	31	65.6 Å²	65.6	19%	0.19	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	120.3	-176.5	-54.3	0	0	0	0	110.9	I147 K148	I147-T157 WeakPolarHBondContact O-CA 3.27Å; K148-T157 HydrophobicContact CG-CG2 4.47Å
158	M	90.4	Very high	85.7	Confident	6 Å²	6	70.8 Å²	70.8	3%	0.03	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	153.7	178.9	-68.6	167.7	-80.8	0	0	110	S146 I147 M149 I156 I669 F701 I704	S146-M158 CarbonylContact C-O 3.58Å; S146-M158 VanDerWaalsContact CA-O 3.27Å; S146-M158 WeakPolarHBondContact CA-O 3.37Å; S146-M158 WeakPolarHBondContact CB-O 3.31Å; I147-M158 PolarHBondContact N-O 3.21Å; I147-M158 PolarHBondContact O-N 2.98Å; M149-M158 HydrophobicContact CB-CE 3.57Å; M149-M158 HydrophobicContact CE-CE 4.3Å; I156-M158 HydrophobicContact CG2-CE 4.32Å; M158-I669 HydrophobicContact CG-CD1 3.89Å; M158-I669 HydrophobicContact SD-CD1 4.19Å; M158-F701 HydrophobicContact CB-CB 4.29Å; M158-I704 HydrophobicContact CE-CD1 3.46Å; M158-I704 VanDerWaalsContact CE-CD1 3.46Å; M158-I704 HydrophobicContact CE-CG1 3.59Å; M158-I704 HydrophobicContact SD-CD1 3.69Å; M158-I704 HydrophobicContact SD-CG1 3.62Å
159	Y	90.4	Very high	85.4	Confident	45 Å²	45	70.8 Å²	70.8	18%	0.176	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	141.1	-176.6	-64.8	-80.6	0	0	0	110.7	P161 R684 F685	Y159-P161 WeakPolarHBondContact O-CD 3.43Å; Y159-R684 HydrophobicContact CD2-CB 4.18Å; Y159-R684 HydrophobicContact CE2-CB 3.64Å; Y159-F685 AromaticContact CD1-CD2 3.67Å; Y159-F685 HydrophobicContact CD1-CD2 3.67Å; Y159-F685 HydrophobicContact CD1-CE2 4.48Å; Y159-F685 HydrophobicContact CE1-CB 4.37Å; Y159-F685 HydrophobicContact CE1-CD2 4.02Å; Y159-F685 HydrophobicContact CG-CD2 4.19Å
160	V	89.9	Confident	85.1	Confident	12 Å²	12	72.8 Å²	72.8	7%	0.073	38%	0.378	C	S	.	.			trans	-74.8	124.3	177.1	-173.7	0	0	0	0	108.9	Q145 I147 I164 F701	Q145-V160 HydrophobicContact CB-CB 4.18Å; Q145-V160 HydrophobicContact CB-CG2 3.97Å; Q145-V160 WeakPolarHBondContact O-CG2 3.39Å; Q145-V160 PolarHBondContact O-N 2.72Å; I147-V160 HydrophobicContact CD1-CG2 3.91Å; I147-V160 HydrophobicContact CG1-CG2 3.91Å; V160-I164 HydrophobicContact CG1-CB 3.98Å; V160-I164 HydrophobicContact CG1-CG2 4.12Å; V160-F701 HydrophobicContact CB-CE2 4.22Å; V160-F701 HydrophobicContact CG1-CE2 4.2Å; V160-F701 HydrophobicContact CG1-CZ 4.09Å; V160-F701 HydrophobicContact CG2-CE2 3.91Å
161	P	90.2	Very high	85	Confident	5 Å²	5	74.4 Å²	74.4	3%	0.032	39%	0.385	C	S	.	.			trans	-58.9	146.6	172.3	-27	37.1	0	0	0	112.7	Y159 N163 I164 K688 D689 F701	Y159-P161 WeakPolarHBondContact O-CD 3.43Å; P161-N163 WeakPolarHBondContact CB-OD1 3.49Å; P161-N163 PolarHBondContact O-N 3.47Å; P161-I164 HydrophobicContact CG-CD1 4.47Å; P161-I164 PolarHBondContact O-N 2.93Å; P161-K688 WeakPolarHBondContact CG-O 3.45Å; P161-D689 WeakPolarHBondContact CA-OD1 3.48Å; P161-F701 HydrophobicContact CG-CD1 3.68Å; P161-F701 HydrophobicContact CG-CE1 3.82Å; P161-F701 HydrophobicContact CG-CG 4.39Å
162	S	88	Confident	85.2	Confident	71 Å²	71	76.1 Å²	76.1	50%	0.497	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-27.8	-177.7	-66.6	0	0	0	0	113.4	I164 K688 D689	S162-I164 PolarHBondContact O-N 3.3Å; S162-K688 PolarHBondContact OG-NZ 2.82Å; S162-D689 WeakPolarHBondContact CB-OD1 3.37Å; S162-D689 PolarHBondContact N-OD1 2.79Å; S162-D689 PolarHBondContact OG-OD1 3.46Å; S162-D689 PolarHBondContact OG-OD2 2.98Å
163	N	84.8	Confident	85.6	Confident	130 Å²	130	75.2 Å²	75.2	70%	0.695	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.9	179.2	64.6	-21.9	0	0	0	113.1	P161	P161-N163 WeakPolarHBondContact CB-OD1 3.49Å; P161-N163 PolarHBondContact O-N 3.47Å
164	I	83.1	Confident	86.1	Confident	29 Å²	29	75.7 Å²	75.7	15%	0.149	38%	0.382	C	S	.	.			trans	-107.1	90.4	178.7	-60.2	171	0	0	0	109.1	V160 P161 S162 F701	V160-I164 HydrophobicContact CG1-CB 3.98Å; V160-I164 HydrophobicContact CG1-CG2 4.12Å; P161-I164 HydrophobicContact CG-CD1 4.47Å; P161-I164 PolarHBondContact O-N 2.93Å; S162-I164 PolarHBondContact O-N 3.3Å; I164-F701 HydrophobicContact CD1-CE1 3.4Å; I164-F701 HydrophobicContact CD1-CZ 3.69Å
165	Q	72.4	Confident	86.6	Confident	162 Å²	162	69.8 Å²	69.8	76%	0.757	36%	0.36	S	S	*	.	S	Bend	trans	-82.5	-24.5	-177.6	-63.5	-175	-1.1	0	0	113.6
166	N	79.6	Confident	86.8	Confident	112 Å²	112	70 Å²	70	60%	0.599	36%	0.364	S	S	*	.			trans	-125.8	62.3	-176	-73	-38.1	0	0	0	111.8	D168 N169	N166-D168 PolarHBondContact O-N 2.98Å; N166-N169 HydrophobicContact CB-CB 4.34Å; N166-N169 PolarHBondContact O-N 2.98Å
167	Y	82.4	Confident	87	Confident	29 Å²	29	69.7 Å²	69.7	11%	0.114	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-53.3	-41.7	179.9	178.9	-105.6	0	0	0	112.3	I147 N169 L170 F701 P745 K746	I147-Y167 HydrophobicContact CD1-CD1 3.96Å; I147-Y167 HydrophobicContact CD1-CD2 4Å; I147-Y167 HydrophobicContact CD1-CE1 3.4Å; I147-Y167 HydrophobicContact CD1-CE2 3.46Å; I147-Y167 VanDerWaalsContact CD1-CE2 3.46Å; I147-Y167 HydrophobicContact CD1-CG 4.23Å; I147-Y167 WeakPolarHBondContact CD1-OH 3.49Å; I147-Y167 HydrophobicContact CG1-CE1 4.34Å; Y167-N169 VanDerWaalsContact C-N 3.29Å; Y167-N169 PolarHBondContact O-N 2.77Å; Y167-L170 VanDerWaalsContact O-CB 3.29Å; Y167-L170 WeakPolarHBondContact O-CB 3.48Å; Y167-L170 PolarHBondContact O-N 2.91Å; Y167-L170 VanDerWaalsContact O-N 3.17Å; Y167-F701 HydrophobicContact CD2-CE2 4.27Å; Y167-F701 HydrophobicContact CD2-CZ 4.13Å; Y167-F701 HydrophobicContact CE2-CE2 4.08Å; Y167-F701 HydrophobicContact CE2-CZ 4.16Å; Y167-P745 HydrophobicContact CE2-CB 4.19Å; Y167-P745 HydrophobicContact CE2-CG 4.32Å; Y167-P745 WeakPolarHBondContact CE2-O 3.31Å; Y167-P745 PolarHBondContact OH-O 3.24Å; Y167-K746 HydrophobicContact CE1-CD 3.97Å; Y167-K746 VanDerWaalsContact CE1-CE 3.48Å; Y167-K746 HydrophobicContact CE2-CD 3.99Å; Y167-K746 HydrophobicContact CE2-CG 4.21Å; Y167-K746 WeakPolarHBondContact O-CE 3.44Å; Y167-K746 PolarHBondContact O-NZ 2.95Å; Y167-K746 WeakPolarHBondContact OH-CD 3.32Å
168	D	80.7	Confident	87.2	Confident	135 Å²	135	74.2 Å²	74.2	72%	0.722	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-65.8	-27.2	-176.4	-65.9	-33.3	0	0	0	114.5	N166 K746	N166-D168 PolarHBondContact O-N 2.98Å; D168-K746 IonicContact OD1-NZ 2.71Å
169	N	80.9	Confident	87.4	Confident	125 Å²	125	74.4 Å²	74.4	67%	0.668	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-88.8	-4.9	178.6	-65.9	-27.4	0	0	0	113.3	N166 Y167 K171	N166-N169 HydrophobicContact CB-CB 4.34Å; N166-N169 PolarHBondContact O-N 2.98Å; Y167-N169 VanDerWaalsContact C-N 3.29Å; Y167-N169 PolarHBondContact O-N 2.77Å; N169-K171 PolarHBondContact O-N 3.49Å
170	L	83.3	Confident	87.4	Confident	65 Å²	65	77.5 Å²	77.5	34%	0.34	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-69.4	116.8	-179.7	-164.1	79.6	0	0	0	110	Y167 M172 P745 K746	Y167-L170 VanDerWaalsContact O-CB 3.29Å; Y167-L170 WeakPolarHBondContact O-CB 3.48Å; Y167-L170 PolarHBondContact O-N 2.91Å; Y167-L170 VanDerWaalsContact O-N 3.17Å; L170-M172 HydrophobicContact CD2-CE 3.49Å; L170-M172 VanDerWaalsContact CD2-CE 3.49Å; L170-M172 HydrophobicContact CG-CE 3.62Å; L170-P745 HydrophobicContact CD2-CG 3.31Å; L170-K746 HydrophobicContact CD2-CG 4.42Å
171	K	83.7	Confident	87.1	Confident	171 Å²	171	78.1 Å²	78.1	74%	0.743	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-97	138.3	173.7	-66.1	-176.2	-178.5	179.3	0	109.7	N169	N169-K171 PolarHBondContact O-N 3.49Å
172	M	89.8	Confident	86.2	Confident	38 Å²	38	81.1 Å²	81.1	19%	0.187	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-95.1	128.5	172.9	-54.6	-70.7	76.1	0	0	109.3	L170 C744 K746 A749 P750	L170-M172 HydrophobicContact CD2-CE 3.49Å; L170-M172 VanDerWaalsContact CD2-CE 3.49Å; L170-M172 HydrophobicContact CG-CE 3.62Å; M172-C744 HydrophobicContact SD-CB 4.19Å; M172-K746 HydrophobicContact CG-CB 3.57Å; M172-K746 HydrophobicContact CG-CG 4.19Å; M172-K746 HydrophobicContact SD-CB 3.95Å; M172-K746 HydrophobicContact SD-CG 4.31Å; M172-A749 HydrophobicContact CB-CB 4.25Å; M172-A749 HydrophobicContact CG-CB 4.2Å; M172-P750 HydrophobicContact CB-CG 4.46Å
173	E	91.3	Very high	85.1	Confident	131 Å²	131	78.9 Å²	78.9	61%	0.612	39%	0.392	S	S	*	.			trans	-115.3	165.7	177.4	-63.5	-173.7	174.5	0	0	109.8	Q741 P750	E173-Q741 PolarHBondContact O-OE1 2.72Å; E173-P750 VanDerWaalsContact C-CG 3.5Å
174	L	92.8	Very high	83.8	Confident	75 Å²	75	72.7 Å²	72.7	39%	0.393	36%	0.359	S	S	.	.			trans	-67.4	145.6	170.6	-75.1	164.4	0	0	0	108.9	P750 Y752	L174-P750 HydrophobicContact CD2-CB 3.82Å; L174-P750 HydrophobicContact CD2-CG 4.45Å; L174-P750 HydrophobicContact CG-CB 4.01Å; L174-P750 HydrophobicContact CG-CG 4.33Å; L174-Y752 HydrophobicContact CB-CE1 4.49Å; L174-Y752 HydrophobicContact CB-CE2 4.21Å; L174-Y752 HydrophobicContact CD1-CE1 3.87Å; L174-Y752 HydrophobicContact CD2-CD1 4.18Å; L174-Y752 HydrophobicContact CD2-CE1 3.98Å; L174-Y752 HydrophobicContact CD2-CE2 4.46Å; L174-Y752 HydrophobicContact CD2-CG 4.46Å; L174-Y752 HydrophobicContact CG-CE1 4.35Å
175	P	94.5	Very high	82.7	Confident	3 Å²	3	71.4 Å²	71.4	2%	0.019	35%	0.353	C	S	.	.			trans	-60.4	148.5	175.3	26.3	-33	0	0	0	110.8	V727 L739 Q741 Y752	P175-V727 HydrophobicContact CB-CG1 3.69Å; P175-L739 HydrophobicContact CG-CD2 4.12Å; P175-L739 HydrophobicContact CG-CG 4.11Å; P175-Q741 HydrophobicContact CB-CB 4.46Å; P175-Y752 HydrophobicContact CG-CD2 3.75Å; P175-Y752 HydrophobicContact CG-CE2 3.9Å; P175-Y752 WeakPolarHBondContact O-CE2 3.39Å
176	S	93.1	Very high	82.9	Confident	83 Å²	83	64.1 Å²	64.1	58%	0.58	32%	0.318	S	S	*	.	S	Bend	trans	-65.2	-34.1	171	31.3	0	0	0	0	111.7
177	E	94.7	Very high	83.2	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.028	29%	0.29	C	S	.	.			trans	-78.3	147.6	179.8	-62.6	81.5	170.8	0	0	111.4	K726 V727 L739 V788 T789	E177-K726 WeakPolarHBondContact OE1-CD 3.45Å; E177-V727 HydrophobicContact CB-CG1 4.11Å; E177-V727 HydrophobicContact CG-CG1 4.33Å; E177-V727 WeakPolarHBondContact OE2-CG1 3.31Å; E177-L739 HydrophobicContact CB-CD2 4.37Å; E177-L739 WeakPolarHBondContact O-CD2 3.48Å; E177-V788 HydrophobicContact CB-CG1 3.93Å; E177-V788 HydrophobicContact CG-CG1 4.1Å; E177-T789 CarbonylContact C-O 3.54Å; E177-T789 WeakPolarHBondContact CA-O 3.45Å
178	R	95.1	Very high	83.8	Confident	125 Å²	125	57.4 Å²	57.4	47%	0.472	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	160.3	176.4	-67.1	-175.4	178.5	-118.4	6.2	109.9	Y752 V788 T789	R178-Y752 HydrophobicContact CG-CD2 4.14Å; R178-Y752 HydrophobicContact CG-CE2 3.82Å; R178-Y752 VanDerWaalsContact CZ-CZ 3.45Å; R178-Y752 PolarHBondContact NH2-OH 2.9Å; R178-V788 CarbonylContact O-C 3.57Å; R178-V788 WeakPolarHBondContact O-CA 3.26Å; R178-T789 PolarHBondContact N-O 2.92Å; R178-T789 PolarHBondContact O-N 2.93Å
179	L	93.8	Very high	84.4	Confident	10 Å²	10	52.3 Å²	52.3	5%	0.052	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	126.6	172.8	-56.4	-178.1	0	0	0	109.1	V737 L739 Y754 L773 W786 K787 V788	L179-V737 HydrophobicContact CD1-CG1 4.24Å; L179-L739 HydrophobicContact CD2-CD2 4.3Å; L179-L739 HydrophobicContact CG-CD2 4.13Å; L179-Y754 HydrophobicContact CB-CD1 4.02Å; L179-Y754 HydrophobicContact CB-CD2 4.2Å; L179-Y754 HydrophobicContact CB-CE1 3.62Å; L179-Y754 HydrophobicContact CB-CE2 3.81Å; L179-Y754 HydrophobicContact CB-CG 4.29Å; L179-Y754 VanDerWaalsContact CB-CZ 3.49Å; L179-Y754 HydrophobicContact CD1-CD2 3.72Å; L179-Y754 HydrophobicContact CD1-CE2 3.63Å; L179-Y754 HydrophobicContact CD1-CG 4.35Å; L179-Y754 HydrophobicContact CG-CD2 4.25Å; L179-Y754 HydrophobicContact CG-CE1 4.44Å; L179-Y754 HydrophobicContact CG-CE2 3.73Å; L179-Y754 PolarHBondContact N-OH 3.18Å; L179-Y754 WeakPolarHBondContact O-CE1 3.38Å; L179-L773 HydrophobicContact CD1-CD2 3.49Å; L179-L773 VanDerWaalsContact CD1-CD2 3.49Å; L179-L773 HydrophobicContact CD2-CB 4.2Å; L179-L773 HydrophobicContact CD2-CD2 4.43Å; L179-W786 HydrophobicContact CB-CB 4.02Å; L179-W786 HydrophobicContact CB-CE3 4.31Å; L179-W786 HydrophobicContact CD1-CB 4.23Å; L179-W786 HydrophobicContact CD1-CG 4.28Å; L179-W786 HydrophobicContact CD2-CB 4.25Å; L179-W786 HydrophobicContact CG-CB 4.4Å; L179-K787 WeakPolarHBondContact CA-O 3.27Å; L179-V788 HydrophobicContact CD2-CG2 3.87Å
180	E	90.8	Very high	84.9	Confident	110 Å²	110	46.3 Å²	46.3	51%	0.514	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	143.6	168.5	-74.9	174.5	-150.5	0	0	109	D182 W786 K787 T789	E180-D182 PolarHBondContact O-N 3.47Å; E180-D182 VanDerWaalsContact O-N 3.08Å; E180-W786 CarbonylContact O-C 3.48Å; E180-W786 WeakPolarHBondContact O-CA 3.45Å; E180-K787 PolarHBondContact N-O 2.82Å; E180-K787 PolarHBondContact O-N 3.21Å; E180-T789 HydrophobicContact CB-CG2 4.25Å; E180-T789 HydrophobicContact CG-CG2 4.15Å; E180-T789 PolarHBondContact OE1-OG1 2.75Å
181	L	83.8	Confident	85.3	Confident	26 Å²	26	49.3 Å²	49.3	14%	0.136	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	97.3	177.8	-153.7	79.4	0	0	0	107.6	L184 H225 R227 W786	L181-L184 HydrophobicContact CD1-CB 4.02Å; L181-L184 HydrophobicContact CD1-CD1 3.25Å; L181-L184 HydrophobicContact CD1-CD2 3.47Å; L181-L184 VanDerWaalsContact CD1-CD2 3.47Å; L181-L184 HydrophobicContact CD1-CG 3.72Å; L181-L184 HydrophobicContact CD2-CB 3.82Å; L181-L184 HydrophobicContact CD2-CD2 3.86Å; L181-L184 HydrophobicContact CD2-CG 4.29Å; L181-L184 HydrophobicContact CG-CB 3.58Å; L181-L184 HydrophobicContact CG-CD1 3.66Å; L181-L184 HydrophobicContact CG-CD2 3.86Å; L181-L184 HydrophobicContact CG-CG 3.89Å; L181-H225 HydrophobicContact CD2-CB 4.12Å; L181-R227 VanDerWaalsContact CD2-CD 3.5Å; L181-W786 HydrophobicContact CD1-CD2 3.93Å; L181-W786 HydrophobicContact CD1-CE3 3.34Å; L181-W786 HydrophobicContact CD1-CH2 3.8Å; L181-W786 HydrophobicContact CD1-CZ2 4.36Å; L181-W786 HydrophobicContact CD1-CZ3 3.25Å
182	D	71.7	Confident	85.6	Confident	67 Å²	67	44.1 Å²	44.1	36%	0.358	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-52.4	-172.7	-170	53.7	0	0	0	111.1	E180 H772 K787	E180-D182 PolarHBondContact O-N 3.47Å; E180-D182 VanDerWaalsContact O-N 3.08Å; D182-H772 IonicContact OD2-NE2 3.31Å; D182-H772 PolarHBondContact OD2-NE2 3Å; D182-K787 HydrophobicContact CB-CB 3.43Å; D182-K787 VanDerWaalsContact CB-CB 3.43Å; D182-K787 HydrophobicContact CB-CD 4.07Å; D182-K787 HydrophobicContact CB-CG 4.45Å; D182-K787 WeakPolarHBondContact OD1-CD 3.12Å; D182-K787 IonicContact OD1-NZ 2.73Å
183	W	64.6	Low	85.6	Confident	24 Å²	24	42.3 Å²	42.3	9%	0.091	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	121.1	179.2	-172.6	-87.9	0	0	0	109.9	Y216 R221 Q223 H548	W183-Y216 HydrophobicContact CH2-CE2 4.27Å; W183-Y216 HydrophobicContact CZ2-CE2 4.16Å; W183-R221 HydrophobicContact CH2-CB 4.31Å; W183-R221 WeakPolarHBondContact CH2-O 3.31Å; W183-R221 WeakPolarHBondContact CZ3-O 3.45Å; W183-Q223 HydrophobicContact CD2-CG 4.49Å; W183-Q223 HydrophobicContact CH2-CG 4.37Å; W183-Q223 HydrophobicContact CZ2-CG 4.01Å; W183-H548 WeakPolarHBondContact CB-CE1 3.4Å; W183-H548 AromaticContact CD1-CD2 3.99Å; W183-H548 AromaticContact CD1-CE1 3.86Å; W183-H548 AromaticContact CD1-CG 3.38Å; W183-H548 AromaticContact CD1-ND1 3.3Å; W183-H548 VanDerWaalsContact CD1-ND1 3.3Å; W183-H548 HydrophobicContact CD2-CB 4.06Å; W183-H548 AromaticContact CD2-CD2 3.22Å; W183-H548 AromaticContact CD2-CE1 3.78Å; W183-H548 AromaticContact CD2-CG 3.45Å; W183-H548 VanDerWaalsContact CD2-CG 3.45Å; W183-H548 AromaticContact CD2-ND1 3.8Å; W183-H548 AromaticContact CD2-NE2 3.44Å; W183-H548 VanDerWaalsContact CE2-CB 3.45Å; W183-H548 AromaticContact CE2-CD2 3.46Å; W183-H548 VanDerWaalsContact CE2-CD2 3.46Å; W183-H548 AromaticContact CE2-CG 3.4Å; W183-H548 AromaticContact CE3-CD2 3.43Å; W183-H548 VanDerWaalsContact CE3-CD2 3.43Å; W183-H548 AromaticContact CE3-NE2 3.47Å; W183-H548 HydrophobicContact CG-CB 4.15Å; W183-H548 AromaticContact CG-CD2 3.59Å; W183-H548 AromaticContact CG-CE1 3.33Å; W183-H548 AromaticContact CG-CG 3.43Å; W183-H548 VanDerWaalsContact CG-CG 3.43Å; W183-H548 AromaticContact CG-ND1 3.27Å; W183-H548 VanDerWaalsContact CG-ND1 3.27Å; W183-H548 AromaticContact CG-NE2 3.51Å; W183-H548 AromaticContact CH2-CD2 3.9Å; W183-H548 HydrophobicContact CZ2-CB 3.81Å; W183-H548 AromaticContact CZ2-CD2 3.82Å; W183-H548 AromaticContact CZ2-CG 3.99Å; W183-H548 AromaticContact CZ3-CD2 3.73Å; W183-H548 AromaticContact NE1-CD2 3.95Å; W183-H548 AromaticContact NE1-CG 3.4Å; W183-H548 AromaticContact NE1-ND1 3.84Å
184	L	58.7	Low	85.5	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	86.4	-165.5	-136.1	116.6	0	0	0	118.9	L181 Q223 H225 L784 Q785	L181-L184 HydrophobicContact CD1-CB 4.02Å; L181-L184 HydrophobicContact CD1-CD1 3.25Å; L181-L184 HydrophobicContact CD1-CD2 3.47Å; L181-L184 VanDerWaalsContact CD1-CD2 3.47Å; L181-L184 HydrophobicContact CD1-CG 3.72Å; L181-L184 HydrophobicContact CD2-CB 3.82Å; L181-L184 HydrophobicContact CD2-CD2 3.86Å; L181-L184 HydrophobicContact CD2-CG 4.29Å; L181-L184 HydrophobicContact CG-CB 3.58Å; L181-L184 HydrophobicContact CG-CD1 3.66Å; L181-L184 HydrophobicContact CG-CD2 3.86Å; L181-L184 HydrophobicContact CG-CG 3.89Å; L184-Q223 PolarHBondContact O-OE1 3.13Å; L184-H225 PolarHBondContact O-CD2 3.41Å; L184-H225 PolarHBondContact O-NE2 3.17Å; L184-L784 VanDerWaalsContact CD1-CA 3.43Å; L184-L784 HydrophobicContact CD1-CB 3.64Å; L184-L784 HydrophobicContact CD2-CB 3.45Å; L184-L784 VanDerWaalsContact CD2-CB 3.45Å; L184-L784 HydrophobicContact CD2-CD1 3.92Å; L184-L784 HydrophobicContact CD2-CD2 3Å; L184-L784 HydrophobicContact CD2-CG 3.49Å; L184-L784 VanDerWaalsContact CD2-CG 3.49Å; L184-L784 VanDerWaalsContact CG-CA 3.49Å; L184-L784 HydrophobicContact CG-CB 3.74Å; L184-L784 HydrophobicContact CG-CD2 3.98Å; L184-L784 HydrophobicContact CG-CG 4.28Å; L184-Q785 HydrophobicContact CD1-CB 4.39Å; L184-Q785 WeakPolarHBondContact CD1-O 3.35Å
185	V	59.2	Low	85.3	Confident	3 Å²	3	37.3 Å²	37.3	2%	0.018	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)		-172.2	118.1	121.1	150.9	0	0	0	0	105.3	G187 Y207 I209 V214	V185-G187 WeakPolarHBondContact CG1-O 3.42Å; V185-Y207 HydrophobicContact CG1-CE2 4.31Å; V185-I209 HydrophobicContact CB-CG2 3.95Å; V185-I209 HydrophobicContact CG1-CB 4.29Å; V185-I209 HydrophobicContact CG1-CD1 4.43Å; V185-I209 HydrophobicContact CG1-CG2 3.22Å; V185-I209 HydrophobicContact CG2-CG2 3.43Å; V185-I209 VanDerWaalsContact CG2-CG2 3.43Å; V185-V214 HydrophobicContact CB-CG2 3.69Å; V185-V214 HydrophobicContact CG1-CG2 4.23Å; V185-V214 HydrophobicContact CG2-CG2 3.6Å
186	Y	77.3	Confident	85.2	Confident	8 Å²	8	37.1 Å²	37.1	3%	0.031	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	114.5	156	-56.5	-97.8	0	0	0	106.4	Q513 F531 W543 N544 H548 I783 Q785	Y186-Q513 CarbonylContact C-O 3.52Å; Y186-F531 HydrophobicContact CD2-CZ 4.38Å; Y186-F531 HydrophobicContact CE2-CE1 4.36Å; Y186-F531 HydrophobicContact CE2-CZ 4.02Å; Y186-W543 HydrophobicContact CD1-CD2 4.24Å; Y186-W543 AromaticContact CD1-CE3 3.44Å; Y186-W543 HydrophobicContact CD1-CE3 3.44Å; Y186-W543 VanDerWaalsContact CD1-CE3 3.44Å; Y186-W543 AromaticContact CD1-CZ3 3.64Å; Y186-W543 HydrophobicContact CD1-CZ3 3.64Å; Y186-W543 AromaticContact CE1-CE3 3.85Å; Y186-W543 HydrophobicContact CE1-CE3 3.85Å; Y186-W543 HydrophobicContact CE1-CZ3 4.44Å; Y186-W543 HydrophobicContact CG-CE3 4.26Å; Y186-W543 HydrophobicContact CG-CZ3 4.32Å; Y186-N544 PolarHBondContact OH-O 3.47Å; Y186-H548 HydrophobicContact CE1-CB 4.42Å; Y186-H548 WeakPolarHBondContact OH-CA 3.48Å; Y186-H548 PolarHBondContact OH-ND1 3Å; Y186-I783 HydrophobicContact CD2-CB 4.01Å; Y186-I783 HydrophobicContact CD2-CG2 4.13Å; Y186-I783 HydrophobicContact CG-CB 4.4Å; Y186-I783 PolarHBondContact N-O 2.9Å; Y186-I783 PolarHBondContact O-N 2.65Å; Y186-Q785 PolarHBondContact OH-OE1 2.68Å
187	G	85.4	Confident	85.4	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.01	16%	0.155	C	C	.	.			trans	127.8	160.2	178	0	0	0	0	0	113.8	V185 V512 Q513	V185-G187 WeakPolarHBondContact CG1-O 3.42Å; G187-V512 WeakPolarHBondContact O-CG1 3.22Å; G187-Q513 WeakPolarHBondContact CA-O 3.14Å; G187-Q513 PolarHBondContact N-O 2.75Å
188	Y	94.4	Very high	85.5	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.165	C	C	.	.			trans	-141.2	136.2	174.8	155.8	-108.9	0	0	0	107	G190 N196 Y207 T481 N497 A498 I499	Y188-G190 PolarHBondContact O-N 2.91Å; Y188-N196 WeakPolarHBondContact CE2-ND2 3.46Å; Y188-N196 PolarHBondContact OH-OD1 3.37Å; Y188-Y207 HydrophobicContact CD2-CD2 4.01Å; Y188-Y207 HydrophobicContact CD2-CG 4.23Å; Y188-T481 WeakPolarHBondContact OH-CG2 3.33Å; Y188-N497 PolarHBondContact N-O 3.5Å; Y188-N497 WeakPolarHBondContact O-CA 3.44Å; Y188-N497 WeakPolarHBondContact O-CB 3.25Å; Y188-N497 PolarHBondContact O-OD1 3.26Å; Y188-A498 WeakPolarHBondContact CD1-O 3.49Å; Y188-I499 HydrophobicContact CD1-CG1 3.98Å; Y188-I499 HydrophobicContact CD2-CD1 3.84Å; Y188-I499 HydrophobicContact CD2-CG1 3.9Å; Y188-I499 HydrophobicContact CG-CD1 3.94Å; Y188-I499 HydrophobicContact CG-CG1 3.59Å
189	R	93.6	Very high	85.5	Confident	27 Å²	27	32.4 Å²	32.4	10%	0.102	15%	0.154	C	C	.	.			trans	-82	82.4	179.7	-165.9	174.9	-173.7	145.7	25	110.8	D192 C193 N196 F208 I209 R234	R189-D192 VanDerWaalsContact CG-OD1 3.23Å; R189-D192 WeakPolarHBondContact CG-OD1 3.29Å; R189-D192 IonicContact CZ-OD1 3.72Å; R189-D192 IonicContact CZ-OD2 3.75Å; R189-D192 IonicContact NE-OD1 3.18Å; R189-D192 PolarHBondContact NE-OD1 3.06Å; R189-D192 IonicContact NE-OD2 2.79Å; R189-D192 PolarHBondContact NE-OD2 2.9Å; R189-D192 IonicContact NH2-OD1 2.83Å; R189-D192 IonicContact NH2-OD2 3.7Å; R189-D192 PolarHBondContact NH2-OD2 2.86Å; R189-C193 WeakPolarHBondContact CD-SG 3.27Å; R189-C193 HydrophobicContact CG-CB 4.05Å; R189-C193 VanDerWaalsContact O-CB 3.27Å; R189-C193 WeakPolarHBondContact O-CB 3.5Å; R189-N196 PolarHBondContact O-ND2 3.43Å; R189-F208 WeakPolarHBondContact CB-O 3.21Å; R189-F208 PolarHBondContact N-O 2.87Å; R189-I209 HydrophobicContact CB-CB 4.47Å; R189-I209 HydrophobicContact CB-CG1 4.49Å; R189-R234 VanDerWaalsContact NE-NH1 3.14Å
190	G	92.1	Very high	85.6	Confident	0 Å²	0	32 Å²	32	0%	0	15%	0.152	C	C	.	.			trans	-106.9	-21.9	-178.7	0	0	0	0	0	115.1	Y188 R480 T494 N497	Y188-G190 PolarHBondContact O-N 2.91Å; G190-R480 WeakPolarHBondContact O-CG 3.1Å; G190-R480 PolarHBondContact O-NE 3.14Å; G190-T494 CarbonylContact C-O 3.55Å; G190-T494 VanDerWaalsContact CA-O 3.29Å; G190-T494 WeakPolarHBondContact CA-O 3.36Å; G190-N497 PolarHBondContact N-OD1 2.88Å
191	R	91.7	Very high	85.7	Confident	127 Å²	127	31.7 Å²	31.7	48%	0.479	16%	0.16	S	C	.	.	S	Bend	trans	-61	-56.6	-176.9	-179.3	178.2	175.2	139.5	0.4	112.2	R480 T495 N497 L516 D517	R191-R480 PolarHBondContact O-NH2 3.37Å; R191-T495 WeakPolarHBondContact CA-O 3.19Å; R191-N497 WeakPolarHBondContact CB-OD1 3.35Å; R191-N497 PolarHBondContact N-OD1 2.85Å; R191-L516 WeakPolarHBondContact CD-O 3.46Å; R191-L516 PolarHBondContact NH1-O 2.96Å; R191-D517 IonicContact NH1-OD2 3.02Å
192	D	89.2	Confident	86.1	Confident	63 Å²	63	33.3 Å²	33.3	34%	0.337	17%	0.173	S	C	.	.	S	Bend	trans	-102	-25.8	-176.2	65.8	-25.2	0	0	0	113.2	R189 R234 M289	R189-D192 VanDerWaalsContact CG-OD1 3.23Å; R189-D192 WeakPolarHBondContact CG-OD1 3.29Å; R189-D192 IonicContact CZ-OD1 3.72Å; R189-D192 IonicContact CZ-OD2 3.75Å; R189-D192 IonicContact NE-OD1 3.18Å; R189-D192 PolarHBondContact NE-OD1 3.06Å; R189-D192 IonicContact NE-OD2 2.79Å; R189-D192 PolarHBondContact NE-OD2 2.9Å; R189-D192 IonicContact NH2-OD1 2.83Å; R189-D192 IonicContact NH2-OD2 3.7Å; R189-D192 PolarHBondContact NH2-OD2 2.86Å; D192-R234 IonicContact OD2-CZ 3.36Å; D192-R234 IonicContact OD2-NH1 4Å; D192-R234 PolarHBondContact OD2-NH1 2.78Å; D192-R234 VanDerWaalsContact OD2-NH1 3.15Å; D192-R234 IonicContact OD2-NH2 3.83Å; D192-M289 VanDerWaalsContact C-CE 3.4Å; D192-M289 WeakPolarHBondContact O-CE 3.3Å
193	C	89.2	Confident	87.2	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.			trans	-87.8	162.8	-179.2	-75.8	0	0	0	0	115.7	R189 N196 F208 M289 R480	R189-C193 WeakPolarHBondContact CD-SG 3.27Å; R189-C193 HydrophobicContact CG-CB 4.05Å; R189-C193 VanDerWaalsContact O-CB 3.27Å; R189-C193 WeakPolarHBondContact O-CB 3.5Å; C193-N196 WeakPolarHBondContact CB-ND2 3.42Å; C193-F208 HydrophobicContact CB-CE2 4.34Å; C193-F208 HydrophobicContact CB-CZ 4.27Å; C193-M289 HydrophobicContact CB-CE 3.9Å; C193-M289 WeakPolarHBondContact SG-CE 3.46Å; C193-R480 WeakPolarHBondContact O-CD 3.41Å; C193-R480 VanDerWaalsContact O-CG 3.28Å; C193-R480 WeakPolarHBondContact O-CG 3.4Å; C193-R480 PolarHBondContact O-NE 2.93Å
194	R	89.9	Confident	88.6	Confident	51 Å²	51	30.5 Å²	30.5	19%	0.192	16%	0.164	C	C	.	.			trans	-147.1	160.1	179.6	67.5	-172	68.4	118.6	0.3	110.1	N196 F336	R194-N196 VanDerWaalsContact C-N 3.26Å; R194-N196 VanDerWaalsContact C-OD1 3.28Å; R194-N196 PolarHBondContact O-N 3.12Å; R194-F336 WeakPolarHBondContact CD-O 3.42Å
195	A	87.8	Confident	90.4	Very high	49 Å²	49	30.5 Å²	30.5	41%	0.405	16%	0.164	S	C	.	.	S	Bend	trans	47.5	49.2	178.3	0	0	0	0	0	112.4	F198	A195-F198 WeakPolarHBondContact O-CE2 3.33Å
196	N	94.3	Very high	92.2	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.163	C	C	.	.			trans	-136.1	23.8	-168.2	63.2	-46.4	0	0	0	113.3	Y188 R189 C193 R194 Y207 F208	Y188-N196 WeakPolarHBondContact CE2-ND2 3.46Å; Y188-N196 PolarHBondContact OH-OD1 3.37Å; R189-N196 PolarHBondContact O-ND2 3.43Å; C193-N196 WeakPolarHBondContact CB-ND2 3.42Å; R194-N196 VanDerWaalsContact C-N 3.26Å; R194-N196 VanDerWaalsContact C-OD1 3.28Å; R194-N196 PolarHBondContact O-N 3.12Å; N196-Y207 WeakPolarHBondContact O-CA 3.14Å; N196-Y207 WeakPolarHBondContact O-CB 3.31Å; N196-F208 HydrophobicContact CB-CD1 4.04Å; N196-F208 HydrophobicContact CB-CE1 3.27Å; N196-F208 HydrophobicContact CB-CZ 3.57Å
197	L	96.5	Very high	93.1	Very high	4 Å²	4	30 Å²	30	2%	0.021	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	120.3	172.3	-179.8	62.7	0	0	0	108.1	A205 V206 Y207 T481 A483 L491 I499	L197-A205 HydrophobicContact CD1-CB 4.44Å; L197-V206 WeakPolarHBondContact CA-O 3.46Å; L197-Y207 HydrophobicContact CD1-CD1 4.23Å; L197-T481 HydrophobicContact CB-CG2 3.59Å; L197-T481 HydrophobicContact CD2-CG2 4.13Å; L197-A483 HydrophobicContact CG-CB 4.36Å; L197-L491 HydrophobicContact CD2-CB 3.94Å; L197-I499 HydrophobicContact CD1-CD1 3.9Å; L197-I499 HydrophobicContact CD1-CG1 4.46Å; L197-I499 HydrophobicContact CD1-CG2 4.37Å; L197-I499 HydrophobicContact CD2-CG2 3.98Å
198	F	96	Very high	93.6	Very high	58 Å²	58	29.9 Å²	29.9	25%	0.254	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	157.4	178.4	-59.8	-89.4	0	0	0	109.8	A195 A205 V206 L236 V238	A195-F198 WeakPolarHBondContact O-CE2 3.33Å; F198-A205 CarbonylContact O-C 3.3Å; F198-A205 WeakPolarHBondContact O-CA 3.42Å; F198-V206 PolarHBondContact N-O 3.04Å; F198-V206 PolarHBondContact O-N 2.83Å; F198-L236 HydrophobicContact CD2-CD2 3.63Å; F198-L236 HydrophobicContact CD2-CG 4.08Å; F198-L236 HydrophobicContact CE2-CB 4.09Å; F198-L236 HydrophobicContact CE2-CD2 3.93Å; F198-L236 HydrophobicContact CE2-CG 3.99Å; F198-L236 WeakPolarHBondContact CE2-O 3.43Å; F198-V238 HydrophobicContact CB-CG2 3.73Å; F198-V238 HydrophobicContact CD1-CG2 3.96Å; F198-V238 HydrophobicContact CD2-CG2 4.1Å; F198-V238 HydrophobicContact CG-CG2 3.66Å
199	F	95.9	Very high	93.5	Very high	52 Å²	52	29.9 Å²	29.9	23%	0.228	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123	174.8	-172.6	-107.4	0	0	0	109.5	I218 V485 L491	F199-I218 HydrophobicContact CD2-CD1 4.23Å; F199-I218 HydrophobicContact CE2-CD1 3.8Å; F199-I218 HydrophobicContact CE2-CG1 4.49Å; F199-V485 HydrophobicContact CD1-CB 4.32Å; F199-V485 HydrophobicContact CD1-CG1 4.2Å; F199-V485 HydrophobicContact CD1-CG2 4.48Å; F199-V485 HydrophobicContact CD2-CG2 4.39Å; F199-V485 HydrophobicContact CE1-CB 4.27Å; F199-V485 HydrophobicContact CE1-CG1 3.66Å; F199-V485 HydrophobicContact CE2-CG1 4.24Å; F199-V485 HydrophobicContact CG-CG2 4.33Å; F199-V485 HydrophobicContact CZ-CG1 3.67Å; F199-L491 HydrophobicContact CB-CD1 4.37Å; F199-L491 HydrophobicContact CD2-CD1 3.96Å
200	L	95.4	Very high	93.4	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.01	16%	0.156	C	C	.	.			trans	-90.8	152.4	-179.2	-63.5	-177.6	0	0	0	111.2	S202 G203 E204 V206 L215 V238	L200-S202 WeakPolarHBondContact CB-OG 3.3Å; L200-S202 PolarHBondContact O-N 3.27Å; L200-G203 PolarHBondContact O-N 2.71Å; L200-E204 PolarHBondContact N-O 2.78Å; L200-V206 HydrophobicContact CD1-CG2 3.44Å; L200-V206 VanDerWaalsContact CD1-CG2 3.44Å; L200-V206 HydrophobicContact CD2-CG2 4.41Å; L200-V206 HydrophobicContact CG-CG2 3.59Å; L200-L215 HydrophobicContact CD1-CD2 4.33Å; L200-V238 HydrophobicContact CD2-CG1 3.87Å; L200-V238 HydrophobicContact CD2-CG2 4.25Å
201	P	92.6	Very high	93.4	Very high	104 Å²	104	29 Å²	29	68%	0.675	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-19.6	173.6	-25.1	34.7	0	0	0	114.4	G203 N242	P201-G203 PolarHBondContact O-N 3Å; P201-N242 HydrophobicContact CG-CB 3.62Å
202	S	92.9	Very high	93.5	Very high	60 Å²	60	23 Å²	23	42%	0.42	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-10.7	172.9	57.7	0	0	0	0	113.8	L200 E204	L200-S202 WeakPolarHBondContact CB-OG 3.3Å; L200-S202 PolarHBondContact O-N 3.27Å; S202-E204 WeakPolarHBondContact CB-OE2 3.21Å; S202-E204 WeakPolarHBondContact OG-CB 3.17Å; S202-E204 WeakPolarHBondContact OG-CG 3.43Å; S202-E204 PolarHBondContact OG-OE2 3.49Å
203	G	93.8	Very high	93.7	Very high	19 Å²	19	20 Å²	20	20%	0.196	12%	0.12	C	C	.	.	S	Bend	trans	90.2	11.6	-173.5	0	0	0	0	0	113.7	L200 P201 I218	L200-G203 PolarHBondContact O-N 2.71Å; P201-G203 PolarHBondContact O-N 3Å; G203-I218 PolarHBondContact O-N 3.28Å
204	E	95.8	Very high	94	Very high	12 Å²	12	20 Å²	20	6%	0.056	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129.7	-174.9	-63.1	171.9	126.9	0	0	111.7	L200 S202 L215 Y216 H217 R224	L200-E204 PolarHBondContact N-O 2.78Å; S202-E204 WeakPolarHBondContact CB-OE2 3.21Å; S202-E204 WeakPolarHBondContact OG-CB 3.17Å; S202-E204 WeakPolarHBondContact OG-CG 3.43Å; S202-E204 PolarHBondContact OG-OE2 3.49Å; E204-L215 HydrophobicContact CB-CB 4.42Å; E204-Y216 CarbonylContact C-O 3.45Å; E204-Y216 WeakPolarHBondContact CA-O 3.33Å; E204-H217 HydrophobicContact CG-CB 3.94Å; E204-R224 VanDerWaalsContact CD-NH2 3.26Å; E204-R224 IonicContact OE1-CZ 2.86Å; E204-R224 VanDerWaalsContact OE1-CZ 3.25Å; E204-R224 IonicContact OE1-NE 2.93Å; E204-R224 PolarHBondContact OE1-NE 2.83Å; E204-R224 IonicContact OE1-NH2 3.6Å; E204-R224 PolarHBondContact OE1-NH2 2.86Å; E204-R224 IonicContact OE2-CZ 3.14Å; E204-R224 IonicContact OE2-NH2 3.91Å; E204-R224 PolarHBondContact OE2-NH2 2.98Å
205	A	96.3	Very high	94.3	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	125.5	165.5	0	0	0	0	0	109.5	L197 F198 Y216 I218 L491	L197-A205 HydrophobicContact CD1-CB 4.44Å; F198-A205 CarbonylContact O-C 3.3Å; F198-A205 WeakPolarHBondContact O-CA 3.42Å; A205-Y216 PolarHBondContact N-O 3.48Å; A205-Y216 PolarHBondContact O-N 3.17Å; A205-I218 HydrophobicContact CB-CD1 4.3Å; A205-I218 HydrophobicContact CB-CG1 4.42Å; A205-L491 HydrophobicContact CB-CD1 3.74Å
206	V	96.9	Very high	94.6	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123	-179.9	-171.1	0	0	0	0	110	L197 F198 L200 I213 V214 L215 L236	L197-V206 WeakPolarHBondContact CA-O 3.46Å; F198-V206 PolarHBondContact N-O 3.04Å; F198-V206 PolarHBondContact O-N 2.83Å; L200-V206 HydrophobicContact CD1-CG2 3.44Å; L200-V206 VanDerWaalsContact CD1-CG2 3.44Å; L200-V206 HydrophobicContact CD2-CG2 4.41Å; L200-V206 HydrophobicContact CG-CG2 3.59Å; V206-I213 HydrophobicContact CG1-CG2 3.75Å; V206-V214 VanDerWaalsContact CA-O 3.31Å; V206-V214 WeakPolarHBondContact CA-O 3.44Å; V206-L215 HydrophobicContact CG1-CG 4.45Å; V206-L215 HydrophobicContact CG2-CD2 4.24Å; V206-L215 HydrophobicContact CG2-CG 4.06Å; V206-L236 HydrophobicContact CB-CD2 4.46Å; V206-L236 HydrophobicContact CG1-CD2 3.81Å
207	Y	96.3	Very high	94.6	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	178	177.8	61	-86.1	0	0	0	109.7	V185 Y188 N196 L197 I213 V214 I499	V185-Y207 HydrophobicContact CG1-CE2 4.31Å; Y188-Y207 HydrophobicContact CD2-CD2 4.01Å; Y188-Y207 HydrophobicContact CD2-CG 4.23Å; N196-Y207 WeakPolarHBondContact O-CA 3.14Å; N196-Y207 WeakPolarHBondContact O-CB 3.31Å; L197-Y207 HydrophobicContact CD1-CD1 4.23Å; Y207-I213 CarbonylContact O-C 3.51Å; Y207-I213 WeakPolarHBondContact O-CA 3.12Å; Y207-I213 VanDerWaalsContact O-CG2 3.3Å; Y207-I213 WeakPolarHBondContact O-CG2 3.33Å; Y207-V214 HydrophobicContact CD1-CB 4.45Å; Y207-V214 HydrophobicContact CD2-CB 4.21Å; Y207-V214 HydrophobicContact CD2-CG2 4.38Å; Y207-V214 HydrophobicContact CE1-CB 4.07Å; Y207-V214 HydrophobicContact CE1-CG1 4.01Å; Y207-V214 HydrophobicContact CE2-CB 3.81Å; Y207-V214 HydrophobicContact CE2-CG1 4.2Å; Y207-V214 HydrophobicContact CE2-CG2 3.89Å; Y207-V214 PolarHBondContact N-O 2.85Å; Y207-V214 VanDerWaalsContact N-O 3.07Å; Y207-V214 PolarHBondContact O-N 2.93Å; Y207-I499 HydrophobicContact CD1-CD1 3.47Å; Y207-I499 VanDerWaalsContact CD1-CD1 3.47Å; Y207-I499 HydrophobicContact CD2-CD1 3.99Å; Y207-I499 HydrophobicContact CE1-CD1 3.6Å; Y207-I499 HydrophobicContact CE2-CD1 4.09Å; Y207-I499 HydrophobicContact CG-CD1 3.68Å
208	F	94.7	Very high	94.3	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	160.1	178.2	62.6	-101.2	0	0	0	112.4	R189 C193 N196 V212 I213 V233 R234 L236	R189-F208 WeakPolarHBondContact CB-O 3.21Å; R189-F208 PolarHBondContact N-O 2.87Å; C193-F208 HydrophobicContact CB-CE2 4.34Å; C193-F208 HydrophobicContact CB-CZ 4.27Å; N196-F208 HydrophobicContact CB-CD1 4.04Å; N196-F208 HydrophobicContact CB-CE1 3.27Å; N196-F208 HydrophobicContact CB-CZ 3.57Å; F208-V212 VanDerWaalsContact CA-O 3.32Å; F208-V212 WeakPolarHBondContact CA-O 3.31Å; F208-V212 WeakPolarHBondContact CB-O 3.26Å; F208-I213 HydrophobicContact CB-CG1 4.13Å; F208-V233 HydrophobicContact CB-CB 4.04Å; F208-V233 HydrophobicContact CB-CG1 3.88Å; F208-V233 HydrophobicContact CD1-CG1 3.74Å; F208-V233 HydrophobicContact CD2-CB 3.8Å; F208-V233 HydrophobicContact CD2-CG1 3.82Å; F208-V233 WeakPolarHBondContact CD2-O 3.5Å; F208-V233 HydrophobicContact CE1-CG1 4.18Å; F208-V233 HydrophobicContact CE2-CB 4.43Å; F208-V233 HydrophobicContact CE2-CG1 4.28Å; F208-V233 WeakPolarHBondContact CE2-O 3.41Å; F208-V233 HydrophobicContact CG-CB 3.9Å; F208-V233 HydrophobicContact CG-CG1 3.54Å; F208-V233 HydrophobicContact CZ-CG1 4.46Å; F208-R234 VanDerWaalsContact CZ-C 3.44Å; F208-R234 WeakPolarHBondContact CZ-O 3.47Å; F208-L236 HydrophobicContact CD1-CB 3.92Å; F208-L236 HydrophobicContact CD1-CD2 4.39Å; F208-L236 HydrophobicContact CE1-CB 3.83Å
209	I	93.1	Very high	93.9	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	152.6	169.3	-173	165.9	0	0	0	107.3	V185 R189 C211 V212 C782	V185-I209 HydrophobicContact CB-CG2 3.95Å; V185-I209 HydrophobicContact CG1-CB 4.29Å; V185-I209 HydrophobicContact CG1-CD1 4.43Å; V185-I209 HydrophobicContact CG1-CG2 3.22Å; V185-I209 HydrophobicContact CG2-CG2 3.43Å; V185-I209 VanDerWaalsContact CG2-CG2 3.43Å; R189-I209 HydrophobicContact CB-CB 4.47Å; R189-I209 HydrophobicContact CB-CG1 4.49Å; I209-C211 PolarHBondContact O-N 3.21Å; I209-V212 PolarHBondContact N-O 2.95Å; I209-V212 VanDerWaalsContact N-O 3.1Å; I209-V212 PolarHBondContact O-N 2.97Å; I209-C782 HydrophobicContact CD1-CB 3.91Å; I209-C782 HydrophobicContact CG1-CB 3.98Å; I209-C782 HydrophobicContact CG2-CB 4.41Å; I209-C782 VanDerWaalsContact CG2-SG 3.52Å
210	A	91.9	Very high	93.6	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	-131.8	-177.7	0	0	0	0	0	111.1	S232 V233 G756 D780 C782	A210-S232 WeakPolarHBondContact O-CA 3.44Å; A210-V233 PolarHBondContact O-N 2.83Å; A210-G756 WeakPolarHBondContact CB-O 3.47Å; A210-D780 HydrophobicContact CB-CB 3.91Å; A210-D780 WeakPolarHBondContact CB-OD2 3.12Å; A210-C782 HydrophobicContact CB-CB 4.1Å
211	C	91.9	Very high	93.3	Very high	7 Å²	7	31.5 Å²	31.5	5%	0.047	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	8	176.9	-59.5	0	0	0	0	113.3	I209 D231 S232 G756 H757 G758	I209-C211 PolarHBondContact O-N 3.21Å; C211-D231 WeakPolarHBondContact SG-CA 3.42Å; C211-S232 PolarHBondContact SG-N 2.84Å; C211-G756 WeakPolarHBondContact CB-O 3.36Å; C211-G756 PolarHBondContact N-O 3.17Å; C211-G756 VanDerWaalsContact N-O 3.09Å; C211-H757 PolarHBondContact SG-O 3.1Å; C211-G758 WeakPolarHBondContact SG-CA 3.45Å
212	V	92.3	Very high	93.2	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	136.3	-169.1	-177	0	0	0	0	111	F208 I209 V214 H225 R227	F208-V212 VanDerWaalsContact CA-O 3.32Å; F208-V212 WeakPolarHBondContact CA-O 3.31Å; F208-V212 WeakPolarHBondContact CB-O 3.26Å; I209-V212 PolarHBondContact N-O 2.95Å; I209-V212 VanDerWaalsContact N-O 3.1Å; I209-V212 PolarHBondContact O-N 2.97Å; V212-V214 HydrophobicContact CG1-CG2 4.4Å; V212-H225 HydrophobicContact CG1-CB 3.9Å; V212-R227 HydrophobicContact CG1-CG 4.23Å; V212-R227 HydrophobicContact CG2-CG 4.36Å
213	I	94.9	Very high	93	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	128.9	166.5	-49.8	175.6	0	0	0	108	V206 Y207 F208 H225 Y226 V233 L236 S247 W267	V206-I213 HydrophobicContact CG1-CG2 3.75Å; Y207-I213 CarbonylContact O-C 3.51Å; Y207-I213 WeakPolarHBondContact O-CA 3.12Å; Y207-I213 VanDerWaalsContact O-CG2 3.3Å; Y207-I213 WeakPolarHBondContact O-CG2 3.33Å; F208-I213 HydrophobicContact CB-CG1 4.13Å; I213-H225 WeakPolarHBondContact O-CA 3.22Å; I213-Y226 HydrophobicContact CD1-CD1 3.82Å; I213-Y226 HydrophobicContact CG1-CD1 4.39Å; I213-Y226 PolarHBondContact N-O 3.26Å; I213-Y226 VanDerWaalsContact N-O 3.1Å; I213-Y226 PolarHBondContact O-N 2.83Å; I213-V233 HydrophobicContact CD1-CG1 4.5Å; I213-V233 HydrophobicContact CG1-CG1 4.3Å; I213-V233 HydrophobicContact CG1-CG2 4.18Å; I213-L236 HydrophobicContact CD1-CD1 4.14Å; I213-L236 HydrophobicContact CG2-CD1 4.29Å; I213-S247 WeakPolarHBondContact CD1-OG 3.42Å; I213-W267 HydrophobicContact CB-CZ2 4.31Å; I213-W267 HydrophobicContact CD1-CZ2 3.62Å; I213-W267 HydrophobicContact CG2-CH2 4.07Å; I213-W267 HydrophobicContact CG2-CZ2 3.88Å
214	V	94.9	Very high	93	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.6	-175.2	-172	0	0	0	0	108.7	V185 V206 Y207 V212 Q223	V185-V214 HydrophobicContact CB-CG2 3.69Å; V185-V214 HydrophobicContact CG1-CG2 4.23Å; V185-V214 HydrophobicContact CG2-CG2 3.6Å; V206-V214 VanDerWaalsContact CA-O 3.31Å; V206-V214 WeakPolarHBondContact CA-O 3.44Å; Y207-V214 HydrophobicContact CD1-CB 4.45Å; Y207-V214 HydrophobicContact CD2-CB 4.21Å; Y207-V214 HydrophobicContact CD2-CG2 4.38Å; Y207-V214 HydrophobicContact CE1-CB 4.07Å; Y207-V214 HydrophobicContact CE1-CG1 4.01Å; Y207-V214 HydrophobicContact CE2-CB 3.81Å; Y207-V214 HydrophobicContact CE2-CG1 4.2Å; Y207-V214 HydrophobicContact CE2-CG2 3.89Å; Y207-V214 PolarHBondContact N-O 2.85Å; Y207-V214 VanDerWaalsContact N-O 3.07Å; Y207-V214 PolarHBondContact O-N 2.93Å; V212-V214 HydrophobicContact CG1-CG2 4.4Å; V214-Q223 HydrophobicContact CG1-CB 4.44Å; V214-Q223 HydrophobicContact CG1-CG 4.17Å
215	L	95.7	Very high	92.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	100.8	167.6	-58.3	88.5	0	0	0	106.9	L200 E204 V206 Q223 R224 W267 L272	L200-L215 HydrophobicContact CD1-CD2 4.33Å; E204-L215 HydrophobicContact CB-CB 4.42Å; V206-L215 HydrophobicContact CG1-CG 4.45Å; V206-L215 HydrophobicContact CG2-CD2 4.24Å; V206-L215 HydrophobicContact CG2-CG 4.06Å; L215-Q223 CarbonylContact O-C 3.52Å; L215-Q223 WeakPolarHBondContact O-CA 3.49Å; L215-R224 HydrophobicContact CB-CB 4.31Å; L215-R224 WeakPolarHBondContact CD1-O 3.36Å; L215-R224 PolarHBondContact N-O 2.66Å; L215-R224 PolarHBondContact O-N 2.93Å; L215-W267 HydrophobicContact CD1-CH2 4.02Å; L215-W267 HydrophobicContact CD1-CZ3 4.14Å; L215-W267 HydrophobicContact CD2-CH2 4.42Å; L215-W267 HydrophobicContact CD2-CZ3 4.3Å; L215-W267 HydrophobicContact CG-CH2 4.49Å; L215-L272 HydrophobicContact CD1-CD2 3.79Å; L215-L272 HydrophobicContact CD2-CD2 4.19Å
216	Y	94.8	Very high	92.7	Very high	16 Å²	16	30.9 Å²	30.9	6%	0.063	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	108.5	-176.3	177.7	-134.6	0	0	0	111.1	W183 E204 A205 I218 T222 Q223 I511 V512	W183-Y216 HydrophobicContact CH2-CE2 4.27Å; W183-Y216 HydrophobicContact CZ2-CE2 4.16Å; E204-Y216 CarbonylContact C-O 3.45Å; E204-Y216 WeakPolarHBondContact CA-O 3.33Å; A205-Y216 PolarHBondContact N-O 3.48Å; A205-Y216 PolarHBondContact O-N 3.17Å; Y216-I218 HydrophobicContact CD1-CG1 4.35Å; Y216-I218 HydrophobicContact CE1-CG1 4.5Å; Y216-I218 PolarHBondContact O-N 2.67Å; Y216-T222 WeakPolarHBondContact CD2-O 3.47Å; Y216-Q223 HydrophobicContact CD2-CG 3.7Å; Y216-Q223 HydrophobicContact CE2-CG 4.47Å; Y216-Q223 HydrophobicContact CG-CG 4.44Å; Y216-I511 HydrophobicContact CD1-CD1 4.33Å; Y216-I511 HydrophobicContact CE1-CB 4.34Å; Y216-I511 HydrophobicContact CE1-CD1 4.04Å; Y216-V512 HydrophobicContact CD1-CG2 4.19Å; Y216-V512 HydrophobicContact CE1-CG2 4.3Å
217	H	93.9	Very high	92.4	Very high	32 Å²	32	36.5 Å²	36.5	15%	0.148	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	106.5	176.1	-169.8	-69.4	0	0	0	110.3	E204 K219 N220 R221 T222	E204-H217 HydrophobicContact CG-CB 3.94Å; H217-K219 PolarHBondContact O-N 3.4Å; H217-N220 PolarHBondContact CE1-ND2 2.9Å; H217-N220 PolarHBondContact CE1-OD1 2.9Å; H217-N220 VanDerWaalsContact CE1-OD1 3.23Å; H217-N220 WeakPolarHBondContact ND1-CB 3.43Å; H217-N220 VanDerWaalsContact ND1-CG 3.34Å; H217-N220 PolarHBondContact ND1-N 3.04Å; H217-N220 VanDerWaalsContact ND1-N 3.13Å; H217-R221 WeakPolarHBondContact O-CA 3.46Å; H217-R221 PolarHBondContact O-N 2.81Å; H217-T222 PolarHBondContact N-O 2.88Å; H217-T222 PolarHBondContact O-N 2.93Å
218	I	89.4	Confident	92.2	Very high	15 Å²	15	42.7 Å²	42.7	8%	0.077	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-43.2	-166.8	-61.8	180	0	0	0	112.7	F199 G203 A205 Y216 L491 I511	F199-I218 HydrophobicContact CD2-CD1 4.23Å; F199-I218 HydrophobicContact CE2-CD1 3.8Å; F199-I218 HydrophobicContact CE2-CG1 4.49Å; G203-I218 PolarHBondContact O-N 3.28Å; A205-I218 HydrophobicContact CB-CD1 4.3Å; A205-I218 HydrophobicContact CB-CG1 4.42Å; Y216-I218 HydrophobicContact CD1-CG1 4.35Å; Y216-I218 HydrophobicContact CE1-CG1 4.5Å; Y216-I218 PolarHBondContact O-N 2.67Å; I218-L491 HydrophobicContact CD1-CD1 3.97Å; I218-L491 HydrophobicContact CD1-CD2 3.79Å; I218-L491 HydrophobicContact CD1-CG 4.43Å; I218-I511 HydrophobicContact CD1-CD1 4.31Å; I218-I511 HydrophobicContact CG1-CD1 4.45Å
219	K	89.6	Confident	92.1	Very high	175 Å²	175	42.9 Å²	42.9	76%	0.761	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-49.9	-175.1	-65.2	-179.1	179	177.1	0	111.9	H217 R221	H217-K219 PolarHBondContact O-N 3.4Å; K219-R221 PolarHBondContact O-N 2.76Å
220	N	88.9	Confident	91.8	Very high	109 Å²	109	45.8 Å²	45.8	58%	0.583	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-14.9	-179.6	-58.8	0.3	0	0	0	113.4	H217 T222	H217-N220 PolarHBondContact CE1-ND2 2.9Å; H217-N220 PolarHBondContact CE1-OD1 2.9Å; H217-N220 VanDerWaalsContact CE1-OD1 3.23Å; H217-N220 WeakPolarHBondContact ND1-CB 3.43Å; H217-N220 VanDerWaalsContact ND1-CG 3.34Å; H217-N220 PolarHBondContact ND1-N 3.04Å; H217-N220 VanDerWaalsContact ND1-N 3.13Å; N220-T222 HydrophobicContact CB-CG2 4.16Å
221	R	88.3	Confident	91.6	Very high	112 Å²	112	47 Å²	47	42%	0.423	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	67.8	-168.2	-60.7	176.6	69.5	179	2.7	108.9	W183 H217 K219 E547	W183-R221 HydrophobicContact CH2-CB 4.31Å; W183-R221 WeakPolarHBondContact CH2-O 3.31Å; W183-R221 WeakPolarHBondContact CZ3-O 3.45Å; H217-R221 WeakPolarHBondContact O-CA 3.46Å; H217-R221 PolarHBondContact O-N 2.81Å; K219-R221 PolarHBondContact O-N 2.76Å; R221-E547 PolarHBondContact NH2-O 2.84Å
222	T	90.1	Very high	91.5	Very high	63 Å²	63	47.2 Å²	47.2	39%	0.387	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	151	174	57.3	0	0	0	0	110.2	Y216 H217 N220	Y216-T222 WeakPolarHBondContact CD2-O 3.47Å; H217-T222 PolarHBondContact N-O 2.88Å; H217-T222 PolarHBondContact O-N 2.93Å; N220-T222 HydrophobicContact CB-CG2 4.16Å
223	Q	90.8	Very high	91.5	Very high	22 Å²	22	47.1 Å²	47.1	10%	0.103	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	146.4	177.9	-65.8	-175	-1.1	0	0	112	W183 L184 V214 L215 Y216 H225	W183-Q223 HydrophobicContact CD2-CG 4.49Å; W183-Q223 HydrophobicContact CH2-CG 4.37Å; W183-Q223 HydrophobicContact CZ2-CG 4.01Å; L184-Q223 PolarHBondContact O-OE1 3.13Å; V214-Q223 HydrophobicContact CG1-CB 4.44Å; V214-Q223 HydrophobicContact CG1-CG 4.17Å; L215-Q223 CarbonylContact O-C 3.52Å; L215-Q223 WeakPolarHBondContact O-CA 3.49Å; Y216-Q223 HydrophobicContact CD2-CG 3.7Å; Y216-Q223 HydrophobicContact CE2-CG 4.47Å; Y216-Q223 HydrophobicContact CG-CG 4.44Å; Q223-H225 PolarHBondContact OE1-NE2 2.99Å
224	R	92.6	Very high	91.3	Very high	69 Å²	69	49.5 Å²	49.5	26%	0.26	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	153.2	165.1	-53.7	-172.8	-65.5	137.2	1.2	109.1	E204 L215 S269 A270 L272	E204-R224 VanDerWaalsContact CD-NH2 3.26Å; E204-R224 IonicContact OE1-CZ 2.86Å; E204-R224 VanDerWaalsContact OE1-CZ 3.25Å; E204-R224 IonicContact OE1-NE 2.93Å; E204-R224 PolarHBondContact OE1-NE 2.83Å; E204-R224 IonicContact OE1-NH2 3.6Å; E204-R224 PolarHBondContact OE1-NH2 2.86Å; E204-R224 IonicContact OE2-CZ 3.14Å; E204-R224 IonicContact OE2-NH2 3.91Å; E204-R224 PolarHBondContact OE2-NH2 2.98Å; L215-R224 HydrophobicContact CB-CB 4.31Å; L215-R224 WeakPolarHBondContact CD1-O 3.36Å; L215-R224 PolarHBondContact N-O 2.66Å; L215-R224 PolarHBondContact O-N 2.93Å; R224-S269 PolarHBondContact NH1-O 3.07Å; R224-S269 VanDerWaalsContact NH1-O 3.17Å; R224-S269 PolarHBondContact NH2-O 3.21Å; R224-A270 PolarHBondContact NH1-O 2.7Å; R224-L272 HydrophobicContact CB-CD1 4.11Å
225	H	92.1	Very high	91.2	Very high	24 Å²	24	49.6 Å²	49.6	11%	0.111	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	127.2	-169.4	-47	91.8	0	0	0	112.4	L181 L184 V212 I213 Q223 R227	L181-H225 HydrophobicContact CD2-CB 4.12Å; L184-H225 PolarHBondContact O-CD2 3.41Å; L184-H225 PolarHBondContact O-NE2 3.17Å; V212-H225 HydrophobicContact CG1-CB 3.9Å; I213-H225 WeakPolarHBondContact O-CA 3.22Å; Q223-H225 PolarHBondContact OE1-NE2 2.99Å; H225-R227 HydrophobicContact CB-CG 3.84Å
226	Y	94.3	Very high	91.2	Very high	3 Å²	3	49.9 Å²	49.9	1%	0.012	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	116	165.8	-179.5	-95.9	0	0	0	109.6	I213 K228 H229 H265 W267 T274	I213-Y226 HydrophobicContact CD1-CD1 3.82Å; I213-Y226 HydrophobicContact CG1-CD1 4.39Å; I213-Y226 PolarHBondContact N-O 3.26Å; I213-Y226 VanDerWaalsContact N-O 3.1Å; I213-Y226 PolarHBondContact O-N 2.83Å; Y226-K228 HydrophobicContact CD2-CG 4.33Å; Y226-K228 HydrophobicContact CE1-CB 3.87Å; Y226-K228 HydrophobicContact CE1-CG 4.37Å; Y226-K228 HydrophobicContact CE2-CB 4.07Å; Y226-K228 HydrophobicContact CE2-CG 3.67Å; Y226-K228 WeakPolarHBondContact OH-CB 3.48Å; Y226-H229 AromaticContact CE1-CD2 3.82Å; Y226-H229 AromaticContact CE1-NE2 3.85Å; Y226-H265 HydrophobicContact CE1-CB 4.16Å; Y226-H265 AromaticContact CE1-ND1 3.88Å; Y226-H265 VanDerWaalsContact OH-CB 3.31Å; Y226-H265 WeakPolarHBondContact OH-CB 3.31Å; Y226-H265 PolarHBondContact OH-ND1 3.4Å; Y226-W267 HydrophobicContact CD1-CD2 4.15Å; Y226-W267 AromaticContact CD1-CE2 3.95Å; Y226-W267 HydrophobicContact CD1-CG 4.33Å; Y226-W267 HydrophobicContact CD1-CZ2 4.43Å; Y226-W267 AromaticContact CD1-NE1 3.95Å; Y226-W267 HydrophobicContact CD2-CB 4.17Å; Y226-W267 AromaticContact CD2-CD2 3.73Å; Y226-W267 HydrophobicContact CD2-CD2 3.73Å; Y226-W267 AromaticContact CD2-CE3 3.79Å; Y226-W267 HydrophobicContact CD2-CE3 3.79Å; Y226-W267 AromaticContact CD2-CG 3.9Å; Y226-W267 HydrophobicContact CD2-CG 3.9Å; Y226-W267 HydrophobicContact CD2-CZ3 4.45Å; Y226-W267 AromaticContact CE1-CD1 3.74Å; Y226-W267 HydrophobicContact CE1-CD2 4.34Å; Y226-W267 HydrophobicContact CE1-CG 4.03Å; Y226-W267 AromaticContact CE1-NE1 3.87Å; Y226-W267 HydrophobicContact CE2-CB 3.54Å; Y226-W267 AromaticContact CE2-CD2 3.95Å; Y226-W267 HydrophobicContact CE2-CD2 3.95Å; Y226-W267 HydrophobicContact CE2-CE3 4.36Å; Y226-W267 AromaticContact CE2-CG 3.59Å; Y226-W267 HydrophobicContact CE2-CG 3.59Å; Y226-W267 AromaticContact CG-CD2 3.82Å; Y226-W267 HydrophobicContact CG-CD2 3.82Å; Y226-W267 AromaticContact CG-CE2 3.96Å; Y226-W267 HydrophobicContact CG-CE3 4Å; Y226-W267 HydrophobicContact CG-CG 4.24Å; Y226-W267 HydrophobicContact CG-CZ2 4.33Å; Y226-W267 HydrophobicContact CG-CZ3 4.32Å; Y226-W267 AromaticContact CZ-CD1 3.67Å; Y226-W267 AromaticContact CZ-CG 3.63Å; Y226-T274 PolarHBondContact OH-OG1 2.86Å
227	R	91.3	Very high	91.3	Very high	118 Å²	118	49.4 Å²	49.4	45%	0.445	23%	0.227	S	C	.	.			trans	-125.3	30.7	-166.4	-55.3	-179.6	-62.8	171.4	-4.2	113.5	L181 V212 H225	L181-R227 VanDerWaalsContact CD2-CD 3.5Å; V212-R227 HydrophobicContact CG1-CG 4.23Å; V212-R227 HydrophobicContact CG2-CG 4.36Å; H225-R227 HydrophobicContact CB-CG 3.84Å
228	K	92.1	Very high	91.4	Very high	131 Å²	131	49.4 Å²	49.4	57%	0.57	23%	0.229	S	C	*	.			trans	-89.2	-11	-178.9	-61.6	-66	-172.6	-179.6	0	113.1	Y226 H265	Y226-K228 HydrophobicContact CD2-CG 4.33Å; Y226-K228 HydrophobicContact CE1-CB 3.87Å; Y226-K228 HydrophobicContact CE1-CG 4.37Å; Y226-K228 HydrophobicContact CE2-CB 4.07Å; Y226-K228 HydrophobicContact CE2-CG 3.67Å; Y226-K228 WeakPolarHBondContact OH-CB 3.48Å; K228-H265 PolarHBondContact O-CE1 2.79Å; K228-H265 VanDerWaalsContact O-CE1 3.26Å
229	H	90.8	Very high	91.7	Very high	3 Å²	3	49 Å²	49	1%	0.014	23%	0.227	C	C	.	.			trans	-72	135.5	174.3	-73.3	-71.6	0	0	0	110.6	Y226 V233 S247 Q249 H265	Y226-H229 AromaticContact CE1-CD2 3.82Å; Y226-H229 AromaticContact CE1-NE2 3.85Å; H229-V233 HydrophobicContact CB-CG2 3.97Å; H229-S247 PolarHBondContact CE1-O 3.44Å; H229-S247 VanDerWaalsContact CE1-O 3.29Å; H229-S247 WeakPolarHBondContact NE2-CB 3.49Å; H229-S247 PolarHBondContact NE2-OG 3.37Å; H229-Q249 PolarHBondContact ND1-OE1 2.77Å; H229-H265 AromaticContact CD2-ND1 3.85Å; H229-H265 AromaticContact CE1-CE1 3.95Å; H229-H265 AromaticContact CE1-CG 3.76Å; H229-H265 AromaticContact CE1-ND1 3.22Å; H229-H265 PolarHBondContact CE1-ND1 2.73Å; H229-H265 AromaticContact CG-ND1 3.81Å; H229-H265 AromaticContact ND1-CE1 3.74Å; H229-H265 AromaticContact ND1-ND1 3.41Å; H229-H265 PolarHBondContact ND1-ND1 2.78Å; H229-H265 AromaticContact NE2-ND1 3.47Å; H229-H265 PolarHBondContact NE2-ND1 2.95Å
230	T	86.8	Confident	91.9	Very high	62 Å²	62	43 Å²	43	38%	0.38	21%	0.206	S	C	.	.	S	Bend	trans	-94.5	-11.3	-179.1	58.2	0	0	0	0	112.5	Q249	T230-Q249 VanDerWaalsContact N-OE1 3.16Å; T230-Q249 PolarHBondContact OG1-NE2 2.92Å
231	D	87.9	Confident	92.2	Very high	25 Å²	25	40.7 Å²	40.7	13%	0.134	19%	0.193	C	C	.	.	S	Bend	trans	-147.9	172.7	179.3	-155.4	-22.6	0	0	0	109.7	C211 V233 T250 G252	C211-D231 WeakPolarHBondContact SG-CA 3.42Å; D231-V233 PolarHBondContact O-N 2.64Å; D231-T250 HydrophobicContact CB-CG2 4.03Å; D231-T250 WeakPolarHBondContact OD1-CG2 3.33Å; D231-G252 WeakPolarHBondContact OD2-CA 3.43Å; D231-G252 PolarHBondContact OD2-N 3.24Å
232	S	89.6	Confident	92.4	Very high	11 Å²	11	39.2 Å²	39.2	8%	0.077	19%	0.194	C	C	.	.			trans	-47.9	123.9	-174	-79	0	0	0	0	113	A210 C211 Q249 T250 G758	A210-S232 WeakPolarHBondContact O-CA 3.44Å; C211-S232 PolarHBondContact SG-N 2.84Å; S232-Q249 WeakPolarHBondContact O-CA 3.43Å; S232-T250 PolarHBondContact O-N 2.9Å; S232-T250 VanDerWaalsContact O-N 3.09Å; S232-G758 PolarHBondContact OG-O 2.86Å
233	V	93	Very high	92.6	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	134.3	171.8	-175.1	0	0	0	0	109.2	F208 A210 I213 H229 D231 G248	F208-V233 HydrophobicContact CB-CB 4.04Å; F208-V233 HydrophobicContact CB-CG1 3.88Å; F208-V233 HydrophobicContact CD1-CG1 3.74Å; F208-V233 HydrophobicContact CD2-CB 3.8Å; F208-V233 HydrophobicContact CD2-CG1 3.82Å; F208-V233 WeakPolarHBondContact CD2-O 3.5Å; F208-V233 HydrophobicContact CE1-CG1 4.18Å; F208-V233 HydrophobicContact CE2-CB 4.43Å; F208-V233 HydrophobicContact CE2-CG1 4.28Å; F208-V233 WeakPolarHBondContact CE2-O 3.41Å; F208-V233 HydrophobicContact CG-CB 3.9Å; F208-V233 HydrophobicContact CG-CG1 3.54Å; F208-V233 HydrophobicContact CZ-CG1 4.46Å; A210-V233 PolarHBondContact O-N 2.83Å; I213-V233 HydrophobicContact CD1-CG1 4.5Å; I213-V233 HydrophobicContact CG1-CG1 4.3Å; I213-V233 HydrophobicContact CG1-CG2 4.18Å; H229-V233 HydrophobicContact CB-CG2 3.97Å; D231-V233 PolarHBondContact O-N 2.64Å; V233-G248 WeakPolarHBondContact CA-O 3.22Å
234	R	91.6	Very high	92.9	Very high	50 Å²	50	41.1 Å²	41.1	19%	0.189	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	-24.8	-173.4	-104.6	48	-179.9	84.9	-1.8	114.8	R189 D192 F208 G248 M289	R189-R234 VanDerWaalsContact NE-NH1 3.14Å; D192-R234 IonicContact OD2-CZ 3.36Å; D192-R234 IonicContact OD2-NH1 4Å; D192-R234 PolarHBondContact OD2-NH1 2.78Å; D192-R234 VanDerWaalsContact OD2-NH1 3.15Å; D192-R234 IonicContact OD2-NH2 3.83Å; F208-R234 VanDerWaalsContact CZ-C 3.44Å; F208-R234 WeakPolarHBondContact CZ-O 3.47Å; R234-G248 PolarHBondContact N-O 3.14Å; R234-M289 HydrophobicContact CG-CG 4.36Å
235	C	92.8	Very high	93.1	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.007	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	156.4	-177.9	50.4	0	0	0	0	111.1	S247 G248 V287 G288 L292	C235-S247 WeakPolarHBondContact O-CA 3.49Å; C235-G248 PolarHBondContact O-N 2.98Å; C235-G248 VanDerWaalsContact O-N 3.07Å; C235-V287 WeakPolarHBondContact SG-CG1 3.48Å; C235-G288 WeakPolarHBondContact CB-O 3.19Å; C235-G288 PolarHBondContact SG-O 3.42Å; C235-L292 HydrophobicContact CB-CD1 4.09Å; C235-L292 HydrophobicContact CB-CG 4.17Å; C235-L292 WeakPolarHBondContact SG-CD1 3.49Å
236	L	95.7	Very high	93.3	Very high	6 Å²	6	36.7 Å²	36.7	3%	0.031	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	138.6	-174.9	-174.4	71.4	0	0	0	108.2	F198 V206 F208 I213 V245 A246	F198-L236 HydrophobicContact CD2-CD2 3.63Å; F198-L236 HydrophobicContact CD2-CG 4.08Å; F198-L236 HydrophobicContact CE2-CB 4.09Å; F198-L236 HydrophobicContact CE2-CD2 3.93Å; F198-L236 HydrophobicContact CE2-CG 3.99Å; F198-L236 WeakPolarHBondContact CE2-O 3.43Å; V206-L236 HydrophobicContact CB-CD2 4.46Å; V206-L236 HydrophobicContact CG1-CD2 3.81Å; F208-L236 HydrophobicContact CD1-CB 3.92Å; F208-L236 HydrophobicContact CD1-CD2 4.39Å; F208-L236 HydrophobicContact CE1-CB 3.83Å; I213-L236 HydrophobicContact CD1-CD1 4.14Å; I213-L236 HydrophobicContact CG2-CD1 4.29Å; L236-V245 HydrophobicContact CD1-CG1 3.34Å; L236-V245 HydrophobicContact CG-CG1 4.22Å; L236-A246 CarbonylContact C-O 3.58Å; L236-A246 WeakPolarHBondContact CA-O 3.44Å
237	A	95.9	Very high	93.4	Very high	7 Å²	7	36.6 Å²	36.6	6%	0.058	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	139.4	172.2	0	0	0	0	0	109.8	V245 A246 L292 F294	A237-V245 WeakPolarHBondContact O-CA 3.49Å; A237-A246 PolarHBondContact N-O 3.24Å; A237-A246 PolarHBondContact O-N 2.93Å; A237-L292 HydrophobicContact CB-CB 3.74Å; A237-F294 HydrophobicContact CB-CD2 4.19Å; A237-F294 HydrophobicContact CB-CE2 4.3Å
238	V	95.7	Very high	93.5	Very high	32 Å²	32	31 Å²	31	19%	0.194	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	133.7	177	-178.8	0	0	0	0	108.9	F198 L200	F198-V238 HydrophobicContact CB-CG2 3.73Å; F198-V238 HydrophobicContact CD1-CG2 3.96Å; F198-V238 HydrophobicContact CD2-CG2 4.1Å; F198-V238 HydrophobicContact CG-CG2 3.66Å; L200-V238 HydrophobicContact CD2-CG1 3.87Å; L200-V238 HydrophobicContact CD2-CG2 4.25Å
239	H	96.4	Very high	93.5	Very high	5 Å²	5	24.9 Å²	24.9	2%	0.023	13%	0.134	C	C	.	.			trans	-69.8	150.7	177.7	-175.1	-79.4	0	0	0	110.6	D241 N242 R244 F294 S299 G300	H239-D241 WeakPolarHBondContact CB-OD1 3.26Å; H239-D241 IonicContact CE1-OD2 3.8Å; H239-D241 PolarHBondContact CE1-OD2 2.85Å; H239-D241 IonicContact CG-OD1 2.92Å; H239-D241 IonicContact CG-OD2 3.8Å; H239-D241 PolarHBondContact ND1-N 2.89Å; H239-D241 VanDerWaalsContact ND1-N 3.12Å; H239-D241 IonicContact ND1-OD1 3.3Å; H239-D241 PolarHBondContact ND1-OD1 2.85Å; H239-D241 VanDerWaalsContact ND1-OD1 3.14Å; H239-D241 IonicContact ND1-OD2 2.78Å; H239-D241 PolarHBondContact ND1-OD2 3.31Å; H239-D241 PolarHBondContact O-N 3.41Å; H239-N242 WeakPolarHBondContact O-CA 3.44Å; H239-N242 PolarHBondContact O-N 3.33Å; H239-R244 HydrophobicContact CB-CB 3.56Å; H239-R244 WeakPolarHBondContact CB-O 3.42Å; H239-R244 PolarHBondContact CE1-NH2 2.81Å; H239-R244 PolarHBondContact N-O 2.98Å; H239-R244 PolarHBondContact NE2-NH2 2.91Å; H239-F294 HydrophobicContact CB-CD2 4.03Å; H239-F294 HydrophobicContact CB-CE1 4.49Å; H239-F294 HydrophobicContact CB-CE2 3.9Å; H239-F294 HydrophobicContact CB-CG 4.36Å; H239-F294 HydrophobicContact CB-CZ 4.12Å; H239-F294 AromaticContact CD2-CD1 3.63Å; H239-F294 AromaticContact CD2-CE1 3.68Å; H239-S299 PolarHBondContact CE1-O 3.49Å; H239-S299 PolarHBondContact NE2-O 3.04Å; H239-G300 VanDerWaalsContact NE2-CA 3.27Å; H239-G300 WeakPolarHBondContact NE2-CA 2.91Å; H239-G300 PolarHBondContact NE2-O 3.47Å
240	P	93.9	Very high	93.4	Very high	50 Å²	50	26.2 Å²	26.2	33%	0.325	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-15.8	178.7	-29.2	35	0	0	0	116.6	N242 F294 I296	P240-N242 PolarHBondContact O-ND2 3.22Å; P240-F294 HydrophobicContact CG-CB 4.46Å; P240-I296 HydrophobicContact CG-CG1 4.23Å
241	D	94	Very high	93.3	Very high	60 Å²	60	24.9 Å²	24.9	32%	0.321	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-6.7	174.5	62.7	15.6	0	0	0	112.9	H239 V243 R244	H239-D241 WeakPolarHBondContact CB-OD1 3.26Å; H239-D241 IonicContact CE1-OD2 3.8Å; H239-D241 PolarHBondContact CE1-OD2 2.85Å; H239-D241 IonicContact CG-OD1 2.92Å; H239-D241 IonicContact CG-OD2 3.8Å; H239-D241 PolarHBondContact ND1-N 2.89Å; H239-D241 VanDerWaalsContact ND1-N 3.12Å; H239-D241 IonicContact ND1-OD1 3.3Å; H239-D241 PolarHBondContact ND1-OD1 2.85Å; H239-D241 VanDerWaalsContact ND1-OD1 3.14Å; H239-D241 IonicContact ND1-OD2 2.78Å; H239-D241 PolarHBondContact ND1-OD2 3.31Å; H239-D241 PolarHBondContact O-N 3.41Å; D241-V243 PolarHBondContact O-N 3.34Å; D241-V243 PolarHBondContact OD1-N 3.37Å; D241-R244 PolarHBondContact OD1-N 3.31Å; D241-R244 IonicContact OD2-CZ 2.75Å; D241-R244 VanDerWaalsContact OD2-CZ 3.25Å; D241-R244 IonicContact OD2-NE 3.36Å; D241-R244 PolarHBondContact OD2-NE 3.11Å; D241-R244 IonicContact OD2-NH2 3.4Å; D241-R244 PolarHBondContact OD2-NH2 3.07Å
242	N	93.3	Very high	93	Very high	81 Å²	81	24.5 Å²	24.5	43%	0.433	14%	0.139	S	C	.	.	S	Bend	trans	59.8	19.9	-176.9	-50.3	-74.7	0	0	0	114.5	P201 H239 P240	P201-N242 HydrophobicContact CG-CB 3.62Å; H239-N242 WeakPolarHBondContact O-CA 3.44Å; H239-N242 PolarHBondContact O-N 3.33Å; P240-N242 PolarHBondContact O-ND2 3.22Å
243	V	94.2	Very high	92.5	Very high	56 Å²	56	29.3 Å²	29.3	34%	0.339	17%	0.168	S	C	.	.	S	Bend	trans	-122.7	-46.6	178.7	179.9	0	0	0	0	110.6	D241 D268 S269	D241-V243 PolarHBondContact O-N 3.34Å; D241-V243 PolarHBondContact OD1-N 3.37Å; V243-D268 VanDerWaalsContact CG1-OD2 3.31Å; V243-D268 WeakPolarHBondContact CG1-OD2 3.15Å; V243-S269 WeakPolarHBondContact O-CB 3.31Å; V243-S269 PolarHBondContact O-N 2.81Å; V243-S269 PolarHBondContact O-OG 3.17Å
244	R	95.9	Very high	91.7	Very high	70 Å²	70	31.2 Å²	31.2	26%	0.264	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	145.2	178	-75.7	179.1	-72.2	169.9	-4.6	111	H239 D241 W267 L275	H239-R244 HydrophobicContact CB-CB 3.56Å; H239-R244 WeakPolarHBondContact CB-O 3.42Å; H239-R244 PolarHBondContact CE1-NH2 2.81Å; H239-R244 PolarHBondContact N-O 2.98Å; H239-R244 PolarHBondContact NE2-NH2 2.91Å; D241-R244 PolarHBondContact OD1-N 3.31Å; D241-R244 IonicContact OD2-CZ 2.75Å; D241-R244 VanDerWaalsContact OD2-CZ 3.25Å; D241-R244 IonicContact OD2-NE 3.36Å; D241-R244 PolarHBondContact OD2-NE 3.11Å; D241-R244 IonicContact OD2-NH2 3.4Å; D241-R244 PolarHBondContact OD2-NH2 3.07Å; R244-W267 WeakPolarHBondContact CA-O 3.49Å; R244-L275 HydrophobicContact CG-CD1 3.77Å
245	V	97.2	Very high	90.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	137.2	-178.4	-177.1	0	0	0	0	108.9	L236 A237 I266 W267	L236-V245 HydrophobicContact CD1-CG1 3.34Å; L236-V245 HydrophobicContact CG-CG1 4.22Å; A237-V245 WeakPolarHBondContact O-CA 3.49Å; V245-I266 WeakPolarHBondContact O-CA 3.38Å; V245-W267 HydrophobicContact CB-CD2 4.09Å; V245-W267 HydrophobicContact CB-CH2 4.08Å; V245-W267 HydrophobicContact CB-CZ2 3.61Å; V245-W267 HydrophobicContact CG1-CH2 4.13Å; V245-W267 HydrophobicContact CG1-CZ2 3.37Å; V245-W267 HydrophobicContact CG2-CH2 4.21Å; V245-W267 HydrophobicContact CG2-CZ2 4.22Å; V245-W267 PolarHBondContact N-O 2.75Å; V245-W267 VanDerWaalsContact O-CD1 3.29Å; V245-W267 PolarHBondContact O-N 2.8Å
246	A	96.9	Very high	90.2	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	137.3	169.2	0	0	0	0	0	110.1	L236 A237 V264 H265 I266 L292 F294 L303	L236-A246 CarbonylContact C-O 3.58Å; L236-A246 WeakPolarHBondContact CA-O 3.44Å; A237-A246 PolarHBondContact N-O 3.24Å; A237-A246 PolarHBondContact O-N 2.93Å; A246-V264 HydrophobicContact CB-CG1 4.22Å; A246-H265 CarbonylContact C-O 3.57Å; A246-H265 VanDerWaalsContact CA-O 3.26Å; A246-H265 WeakPolarHBondContact CA-O 3.39Å; A246-I266 HydrophobicContact CB-CG1 4.43Å; A246-L292 HydrophobicContact CB-CD1 4.36Å; A246-F294 HydrophobicContact CB-CE1 4.49Å; A246-F294 HydrophobicContact CB-CE2 3.57Å; A246-F294 HydrophobicContact CB-CZ 3.47Å; A246-F294 VanDerWaalsContact CB-CZ 3.47Å; A246-L303 HydrophobicContact CB-CD1 4.15Å; A246-L303 HydrophobicContact CB-CD2 3.99Å
247	S	96.6	Very high	89.2	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	135.5	178.5	51.4	0	0	0	0	111.7	I213 H229 C235 V264 H265 W267	I213-S247 WeakPolarHBondContact CD1-OG 3.42Å; H229-S247 PolarHBondContact CE1-O 3.44Å; H229-S247 VanDerWaalsContact CE1-O 3.29Å; H229-S247 WeakPolarHBondContact NE2-CB 3.49Å; H229-S247 PolarHBondContact NE2-OG 3.37Å; C235-S247 WeakPolarHBondContact O-CA 3.49Å; S247-V264 CarbonylContact O-C 3.48Å; S247-V264 WeakPolarHBondContact O-CA 3.24Å; S247-H265 PolarHBondContact N-O 3.04Å; S247-H265 PolarHBondContact O-N 3.15Å; S247-W267 PolarHBondContact OG-NE1 3.22Å
248	G	94.1	Very high	88.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	142.3	-177.2	0	0	0	0	0	112.6	V233 R234 C235	V233-G248 WeakPolarHBondContact CA-O 3.22Å; R234-G248 PolarHBondContact N-O 3.14Å; C235-G248 PolarHBondContact O-N 2.98Å; C235-G248 VanDerWaalsContact O-N 3.07Å
249	Q	91.2	Very high	87.6	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.019	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	159.2	173.8	66.8	-177.5	44	0	0	112.9	H229 T230 S232 Q261 C263 V287	H229-Q249 PolarHBondContact ND1-OE1 2.77Å; T230-Q249 VanDerWaalsContact N-OE1 3.16Å; T230-Q249 PolarHBondContact OG1-NE2 2.92Å; S232-Q249 WeakPolarHBondContact O-CA 3.43Å; Q249-Q261 PolarHBondContact NE2-O 3.2Å; Q249-C263 VanDerWaalsContact CD-SG 3.51Å; Q249-C263 PolarHBondContact N-O 3.26Å; Q249-V287 PolarHBondContact O-N 2.82Å
250	T	87.6	Confident	86.8	Confident	31 Å²	31	52.3 Å²	52.3	19%	0.19	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-72.5	161.5	168.5	-169.1	0	0	0	0	111.7	D231 S232 R285	D231-T250 HydrophobicContact CB-CG2 4.03Å; D231-T250 WeakPolarHBondContact OD1-CG2 3.33Å; S232-T250 PolarHBondContact O-N 2.9Å; S232-T250 VanDerWaalsContact O-N 3.09Å; T250-R285 PolarHBondContact OG1-O 2.82Å
251	A	85.6	Confident	86.4	Confident	34 Å²	34	54.8 Å²	54.8	28%	0.281	31%	0.306	S	S	.	.			trans	-78	148.6	162.2	0	0	0	0	0	109.5	M260 A262 R285	A251-M260 WeakPolarHBondContact CA-O 3.35Å; A251-M260 WeakPolarHBondContact CB-O 3.37Å; A251-A262 HydrophobicContact CB-CB 4.17Å; A251-R285 VanDerWaalsContact CB-O 3.3Å; A251-R285 WeakPolarHBondContact CB-O 3.35Å; A251-R285 PolarHBondContact N-O 3.4Å
252	G	81.1	Confident	86.1	Confident	16 Å²	16	52 Å²	52	17%	0.165	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	-171.1	-174.1	0	0	0	0	0	113.3	D231 P259 M260	D231-G252 WeakPolarHBondContact OD2-CA 3.43Å; D231-G252 PolarHBondContact OD2-N 3.24Å; G252-P259 WeakPolarHBondContact O-CA 3.45Å; G252-M260 PolarHBondContact N-O 2.91Å; G252-M260 VanDerWaalsContact N-O 3.14Å; G252-M260 PolarHBondContact O-N 3.42Å
253	V	79.2	Confident	86	Confident	112 Å²	112	48.2 Å²	48.2	68%	0.679	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.7	138	168.9	-68.4	0	0	0	0	109.1	K258	V253-K258 WeakPolarHBondContact CA-O 3.5Å
254	D	77.3	Confident	86.1	Confident	40 Å²	40	45.5 Å²	45.5	21%	0.214	26%	0.256	C	S	.	.			trans	-79.5	176.2	170.4	78.3	5.1	0	0	0	111.3	D256 G257 K258 M260	D254-D256 PolarHBondContact O-N 3.11Å; D254-D256 VanDerWaalsContact O-N 3.16Å; D254-D256 WeakPolarHBondContact OD1-CA 3.39Å; D254-D256 WeakPolarHBondContact OD1-CB 3.43Å; D254-D256 PolarHBondContact OD1-N 3.39Å; D254-G257 WeakPolarHBondContact O-CA 3.37Å; D254-G257 PolarHBondContact O-N 2.86Å; D254-G257 PolarHBondContact OD1-N 3.1Å; D254-G257 VanDerWaalsContact OD1-N 3.09Å; D254-K258 PolarHBondContact N-O 3.25Å; D254-K258 WeakPolarHBondContact OD1-CB 3.47Å; D254-K258 PolarHBondContact OD1-N 2.82Å; D254-M260 HydrophobicContact CB-CE 3.55Å; D254-M260 HydrophobicContact CB-CG 4.34Å
255	K	73.6	Confident	86.1	Confident	113 Å²	113	42.6 Å²	42.6	49%	0.491	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.5	176.4	60.3	164.2	-167.6	158.6	0	114.8	G257 F734	K255-G257 VanDerWaalsContact C-N 3.26Å; K255-F734 HydrophobicContact CB-CB 4.45Å; K255-F734 HydrophobicContact CB-CD1 3.71Å; K255-F734 HydrophobicContact CB-CD2 4.13Å; K255-F734 HydrophobicContact CB-CE1 3.91Å; K255-F734 HydrophobicContact CB-CE2 4.31Å; K255-F734 HydrophobicContact CB-CG 3.83Å; K255-F734 HydrophobicContact CB-CZ 4.21Å
256	D	77.9	Confident	86.1	Confident	95 Å²	95	42.8 Å²	42.8	51%	0.508	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	2.5	178.8	-59.3	-24.3	0	0	0	110.7	D254 K258	D254-D256 PolarHBondContact O-N 3.11Å; D254-D256 VanDerWaalsContact O-N 3.16Å; D254-D256 WeakPolarHBondContact OD1-CA 3.39Å; D254-D256 WeakPolarHBondContact OD1-CB 3.43Å; D254-D256 PolarHBondContact OD1-N 3.39Å; D256-K258 VanDerWaalsContact C-N 3.27Å; D256-K258 HydrophobicContact CB-CD 4.31Å; D256-K258 HydrophobicContact CB-CG 4.2Å; D256-K258 PolarHBondContact O-N 3.48Å; D256-K258 IonicContact OD2-NZ 3.5Å; D256-K258 PolarHBondContact OD2-NZ 2.83Å
257	G	74.9	Confident	86.1	Confident	54 Å²	54	42.8 Å²	42.8	56%	0.557	25%	0.246	S	C	*	.	S	Bend	trans	73.9	14.1	-173.6	0	0	0	0	0	113.7	D254 K255	D254-G257 WeakPolarHBondContact O-CA 3.37Å; D254-G257 PolarHBondContact O-N 2.86Å; D254-G257 PolarHBondContact OD1-N 3.1Å; D254-G257 VanDerWaalsContact OD1-N 3.09Å; K255-G257 VanDerWaalsContact C-N 3.26Å
258	K	81.1	Confident	86.1	Confident	115 Å²	115	44.3 Å²	44.3	50%	0.5	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-78.3	139.1	176.8	-61.6	170.4	-174.9	139	0	109.8	V253 D254 D256 M260	V253-K258 WeakPolarHBondContact CA-O 3.5Å; D254-K258 PolarHBondContact N-O 3.25Å; D254-K258 WeakPolarHBondContact OD1-CB 3.47Å; D254-K258 PolarHBondContact OD1-N 2.82Å; D256-K258 VanDerWaalsContact C-N 3.27Å; D256-K258 HydrophobicContact CB-CD 4.31Å; D256-K258 HydrophobicContact CB-CG 4.2Å; D256-K258 PolarHBondContact O-N 3.48Å; D256-K258 IonicContact OD2-NZ 3.5Å; D256-K258 PolarHBondContact OD2-NZ 2.83Å; K258-M260 PolarHBondContact O-N 3.27Å
259	P	77.9	Confident	86.2	Confident	112 Å²	112	44.6 Å²	44.6	73%	0.727	26%	0.256	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	123.6	-179.9	26.2	-32.8	0	0	0	110.8	G252	G252-P259 WeakPolarHBondContact O-CA 3.45Å
260	M	80	Confident	86.4	Confident	55 Å²	55	47.4 Å²	47.4	27%	0.271	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	133.5	164.8	-67.4	-160	177	0	0	109.5	A251 G252 D254 K258	A251-M260 WeakPolarHBondContact CA-O 3.35Å; A251-M260 WeakPolarHBondContact CB-O 3.37Å; G252-M260 PolarHBondContact N-O 2.91Å; G252-M260 VanDerWaalsContact N-O 3.14Å; G252-M260 PolarHBondContact O-N 3.42Å; D254-M260 HydrophobicContact CB-CE 3.55Å; D254-M260 HydrophobicContact CB-CG 4.34Å; K258-M260 PolarHBondContact O-N 3.27Å
261	Q	83.9	Confident	86.7	Confident	102 Å²	102	50.2 Å²	50.2	48%	0.477	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-82.1	139.8	-174.8	-63.7	-176.1	-4.4	0	0	111.6	Q249 L280	Q249-Q261 PolarHBondContact NE2-O 3.2Å; Q261-L280 HydrophobicContact CB-CD2 4.16Å
262	A	88.6	Confident	87.2	Confident	2 Å²	2	50.6 Å²	50.6	2%	0.017	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-66.9	139.6	165.4	0	0	0	0	0	109.6	A251 F283	A251-A262 HydrophobicContact CB-CB 4.17Å; A262-F283 HydrophobicContact CB-CB 3.88Å
263	C	91.8	Very high	87.9	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.007	31%	0.31	C	S	.	.			trans	-153.9	166	177.6	65.6	0	0	0	0	110.9	Q249 Q277 L280	Q249-C263 VanDerWaalsContact CD-SG 3.51Å; Q249-C263 PolarHBondContact N-O 3.26Å; C263-Q277 HydrophobicContact CB-CG 4.17Å; C263-Q277 PolarHBondContact SG-NE2 3.22Å; C263-L280 HydrophobicContact CB-CD2 3.92Å; C263-L280 HydrophobicContact CB-CG 4.37Å
264	V	95	Very high	88.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	132	168.7	175.8	0	0	0	0	108.4	A246 S247 Q277 I278 F283 V287 L292 L303 V305	A246-V264 HydrophobicContact CB-CG1 4.22Å; S247-V264 CarbonylContact O-C 3.48Å; S247-V264 WeakPolarHBondContact O-CA 3.24Å; V264-Q277 WeakPolarHBondContact O-CA 3.48Å; V264-I278 HydrophobicContact CB-CD1 4.06Å; V264-I278 HydrophobicContact CB-CG1 3.63Å; V264-I278 HydrophobicContact CG1-CD1 4.26Å; V264-I278 HydrophobicContact CG1-CG1 4.21Å; V264-I278 HydrophobicContact CG2-CG1 4.48Å; V264-I278 PolarHBondContact N-O 3.15Å; V264-I278 VanDerWaalsContact N-O 3.11Å; V264-I278 PolarHBondContact O-N 2.97Å; V264-F283 HydrophobicContact CB-CE2 4.5Å; V264-F283 HydrophobicContact CG2-CE2 3.83Å; V264-F283 HydrophobicContact CG2-CZ 4.25Å; V264-V287 HydrophobicContact CG2-CG1 4.22Å; V264-V287 HydrophobicContact CG2-CG2 3.66Å; V264-L292 HydrophobicContact CG1-CD1 4.35Å; V264-L292 HydrophobicContact CG1-CD2 4.28Å; V264-L292 HydrophobicContact CG2-CD2 3.92Å; V264-L303 HydrophobicContact CG1-CD2 4.01Å; V264-V305 HydrophobicContact CG2-CG1 4.13Å; V264-V305 HydrophobicContact CG2-CG2 4.38Å
265	H	96	Very high	89.6	Confident	8 Å²	8	53.1 Å²	53.1	4%	0.037	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	133.7	170.6	-67.3	155.1	0	0	0	109.7	Y226 K228 H229 A246 S247 Q277	Y226-H265 HydrophobicContact CE1-CB 4.16Å; Y226-H265 AromaticContact CE1-ND1 3.88Å; Y226-H265 VanDerWaalsContact OH-CB 3.31Å; Y226-H265 WeakPolarHBondContact OH-CB 3.31Å; Y226-H265 PolarHBondContact OH-ND1 3.4Å; K228-H265 PolarHBondContact O-CE1 2.79Å; K228-H265 VanDerWaalsContact O-CE1 3.26Å; H229-H265 AromaticContact CD2-ND1 3.85Å; H229-H265 AromaticContact CE1-CE1 3.95Å; H229-H265 AromaticContact CE1-CG 3.76Å; H229-H265 AromaticContact CE1-ND1 3.22Å; H229-H265 PolarHBondContact CE1-ND1 2.73Å; H229-H265 AromaticContact CG-ND1 3.81Å; H229-H265 AromaticContact ND1-CE1 3.74Å; H229-H265 AromaticContact ND1-ND1 3.41Å; H229-H265 PolarHBondContact ND1-ND1 2.78Å; H229-H265 AromaticContact NE2-ND1 3.47Å; H229-H265 PolarHBondContact NE2-ND1 2.95Å; A246-H265 CarbonylContact C-O 3.57Å; A246-H265 VanDerWaalsContact CA-O 3.26Å; A246-H265 WeakPolarHBondContact CA-O 3.39Å; S247-H265 PolarHBondContact N-O 3.04Å; S247-H265 PolarHBondContact O-N 3.15Å; H265-Q277 PolarHBondContact NE2-NE2 3.31Å
266	I	96.8	Very high	90.6	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.026	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.6	166.8	-54	177	0	0	0	106.5	V245 A246 L275 Q276 L303 C319	V245-I266 WeakPolarHBondContact O-CA 3.38Å; A246-I266 HydrophobicContact CB-CG1 4.43Å; I266-L275 WeakPolarHBondContact O-CA 3.32Å; I266-L275 WeakPolarHBondContact O-CB 3.41Å; I266-L275 PolarHBondContact O-N 2.92Å; I266-Q276 HydrophobicContact CB-CB 4.18Å; I266-Q276 HydrophobicContact CD1-CB 4.36Å; I266-Q276 PolarHBondContact N-O 2.94Å; I266-Q276 PolarHBondContact O-N 3.1Å; I266-L303 HydrophobicContact CD1-CD2 4.36Å; I266-C319 HydrophobicContact CD1-CB 3.78Å
267	W	97.4	Very high	91.3	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	161.6	-171.2	54.8	-81.2	0	0	0	111.2	I213 L215 Y226 R244 V245 S247 L272 V273	I213-W267 HydrophobicContact CB-CZ2 4.31Å; I213-W267 HydrophobicContact CD1-CZ2 3.62Å; I213-W267 HydrophobicContact CG2-CH2 4.07Å; I213-W267 HydrophobicContact CG2-CZ2 3.88Å; L215-W267 HydrophobicContact CD1-CH2 4.02Å; L215-W267 HydrophobicContact CD1-CZ3 4.14Å; L215-W267 HydrophobicContact CD2-CH2 4.42Å; L215-W267 HydrophobicContact CD2-CZ3 4.3Å; L215-W267 HydrophobicContact CG-CH2 4.49Å; Y226-W267 HydrophobicContact CD1-CD2 4.15Å; Y226-W267 AromaticContact CD1-CE2 3.95Å; Y226-W267 HydrophobicContact CD1-CG 4.33Å; Y226-W267 HydrophobicContact CD1-CZ2 4.43Å; Y226-W267 AromaticContact CD1-NE1 3.95Å; Y226-W267 HydrophobicContact CD2-CB 4.17Å; Y226-W267 AromaticContact CD2-CD2 3.73Å; Y226-W267 HydrophobicContact CD2-CD2 3.73Å; Y226-W267 AromaticContact CD2-CE3 3.79Å; Y226-W267 HydrophobicContact CD2-CE3 3.79Å; Y226-W267 AromaticContact CD2-CG 3.9Å; Y226-W267 HydrophobicContact CD2-CG 3.9Å; Y226-W267 HydrophobicContact CD2-CZ3 4.45Å; Y226-W267 AromaticContact CE1-CD1 3.74Å; Y226-W267 HydrophobicContact CE1-CD2 4.34Å; Y226-W267 HydrophobicContact CE1-CG 4.03Å; Y226-W267 AromaticContact CE1-NE1 3.87Å; Y226-W267 HydrophobicContact CE2-CB 3.54Å; Y226-W267 AromaticContact CE2-CD2 3.95Å; Y226-W267 HydrophobicContact CE2-CD2 3.95Å; Y226-W267 HydrophobicContact CE2-CE3 4.36Å; Y226-W267 AromaticContact CE2-CG 3.59Å; Y226-W267 HydrophobicContact CE2-CG 3.59Å; Y226-W267 AromaticContact CG-CD2 3.82Å; Y226-W267 HydrophobicContact CG-CD2 3.82Å; Y226-W267 AromaticContact CG-CE2 3.96Å; Y226-W267 HydrophobicContact CG-CE3 4Å; Y226-W267 HydrophobicContact CG-CG 4.24Å; Y226-W267 HydrophobicContact CG-CZ2 4.33Å; Y226-W267 HydrophobicContact CG-CZ3 4.32Å; Y226-W267 AromaticContact CZ-CD1 3.67Å; Y226-W267 AromaticContact CZ-CG 3.63Å; R244-W267 WeakPolarHBondContact CA-O 3.49Å; V245-W267 HydrophobicContact CB-CD2 4.09Å; V245-W267 HydrophobicContact CB-CH2 4.08Å; V245-W267 HydrophobicContact CB-CZ2 3.61Å; V245-W267 HydrophobicContact CG1-CH2 4.13Å; V245-W267 HydrophobicContact CG1-CZ2 3.37Å; V245-W267 HydrophobicContact CG2-CH2 4.21Å; V245-W267 HydrophobicContact CG2-CZ2 4.22Å; V245-W267 PolarHBondContact N-O 2.75Å; V245-W267 VanDerWaalsContact O-CD1 3.29Å; V245-W267 PolarHBondContact O-N 2.8Å; S247-W267 PolarHBondContact OG-NE1 3.22Å; W267-L272 HydrophobicContact CE3-CD2 4.38Å; W267-L272 HydrophobicContact CZ3-CD2 3.88Å; W267-V273 VanDerWaalsContact CA-O 3.26Å; W267-V273 WeakPolarHBondContact CA-O 3.49Å; W267-V273 VanDerWaalsContact CB-O 3.31Å; W267-V273 WeakPolarHBondContact CB-O 3.4Å
268	D	96.7	Very high	92.2	Very high	31 Å²	31	47.4 Å²	47.4	17%	0.166	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	123.7	-179.5	178.4	-81.5	0	0	0	110.2	V243 A270 T271 L272 V273 L275	V243-D268 VanDerWaalsContact CG1-OD2 3.31Å; V243-D268 WeakPolarHBondContact CG1-OD2 3.15Å; D268-A270 VanDerWaalsContact C-N 3.32Å; D268-A270 PolarHBondContact O-N 2.77Å; D268-A270 WeakPolarHBondContact OD1-CA 3.19Å; D268-A270 WeakPolarHBondContact OD1-CB 3.27Å; D268-A270 PolarHBondContact OD1-N 2.92Å; D268-T271 WeakPolarHBondContact CB-OG1 3.31Å; D268-T271 WeakPolarHBondContact OD1-CB 3.4Å; D268-T271 PolarHBondContact OD1-N 2.8Å; D268-T271 PolarHBondContact OD1-OG1 3.04Å; D268-L272 WeakPolarHBondContact O-CA 3.37Å; D268-L272 PolarHBondContact O-N 3.4Å; D268-V273 PolarHBondContact N-O 3.03Å; D268-L275 HydrophobicContact CB-CD1 4.25Å; D268-L275 HydrophobicContact CB-CD2 4.42Å; D268-L275 HydrophobicContact CB-CG 4.38Å
269	S	96.4	Very high	92.3	Very high	6 Å²	6	42.2 Å²	42.2	4%	0.042	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-22.2	-176.6	61.2	0	0	0	0	114.1	R224 V243	R224-S269 PolarHBondContact NH1-O 3.07Å; R224-S269 VanDerWaalsContact NH1-O 3.17Å; R224-S269 PolarHBondContact NH2-O 3.21Å; V243-S269 WeakPolarHBondContact O-CB 3.31Å; V243-S269 PolarHBondContact O-N 2.81Å; V243-S269 PolarHBondContact O-OG 3.17Å
270	A	95	Very high	92.6	Very high	64 Å²	64	41 Å²	41	53%	0.529	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-44.7	178.6	0	0	0	0	0	111.1	R224 D268	R224-A270 PolarHBondContact NH1-O 2.7Å; D268-A270 VanDerWaalsContact C-N 3.32Å; D268-A270 PolarHBondContact O-N 2.77Å; D268-A270 WeakPolarHBondContact OD1-CA 3.19Å; D268-A270 WeakPolarHBondContact OD1-CB 3.27Å; D268-A270 PolarHBondContact OD1-N 2.92Å
271	T	95.4	Very high	92.6	Very high	89 Å²	89	41.2 Å²	41.2	55%	0.546	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-16.2	-174.4	62.4	0	0	0	0	114	D268 V273	D268-T271 WeakPolarHBondContact CB-OG1 3.31Å; D268-T271 WeakPolarHBondContact OD1-CB 3.4Å; D268-T271 PolarHBondContact OD1-N 2.8Å; D268-T271 PolarHBondContact OD1-OG1 3.04Å; T271-V273 PolarHBondContact O-N 2.96Å; T271-V273 PolarHBondContact OG1-N 3.15Å
272	L	95.4	Very high	92.6	Very high	43 Å²	43	38.9 Å²	38.9	23%	0.225	24%	0.236	C	C	.	.			trans	61.1	19.6	-174.3	-49.1	176.4	0	0	0	113.9	L215 R224 W267 D268	L215-L272 HydrophobicContact CD1-CD2 3.79Å; L215-L272 HydrophobicContact CD2-CD2 4.19Å; R224-L272 HydrophobicContact CB-CD1 4.11Å; W267-L272 HydrophobicContact CE3-CD2 4.38Å; W267-L272 HydrophobicContact CZ3-CD2 3.88Å; D268-L272 WeakPolarHBondContact O-CA 3.37Å; D268-L272 PolarHBondContact O-N 3.4Å
273	V	96.1	Very high	92.4	Very high	82 Å²	82	39.5 Å²	39.5	50%	0.497	24%	0.239	S	C	.	.			trans	-83.5	132.4	177.8	174.9	0	0	0	0	110	W267 D268 T271 L275	W267-V273 VanDerWaalsContact CA-O 3.26Å; W267-V273 WeakPolarHBondContact CA-O 3.49Å; W267-V273 VanDerWaalsContact CB-O 3.31Å; W267-V273 WeakPolarHBondContact CB-O 3.4Å; D268-V273 PolarHBondContact N-O 3.03Å; T271-V273 PolarHBondContact O-N 2.96Å; T271-V273 PolarHBondContact OG1-N 3.15Å; V273-L275 PolarHBondContact O-N 2.96Å
274	T	96.6	Very high	91.8	Very high	48 Å²	48	45.6 Å²	45.6	29%	0.294	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	118.6	169.1	-48	0	0	0	0	109.4	Y226	Y226-T274 PolarHBondContact OH-OG1 2.86Å
275	L	95.1	Very high	91	Very high	90 Å²	90	52.8 Å²	52.8	47%	0.471	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-42.4	178.8	-58	177.5	0	0	0	111	R244 I266 D268 V273	R244-L275 HydrophobicContact CG-CD1 3.77Å; I266-L275 WeakPolarHBondContact O-CA 3.32Å; I266-L275 WeakPolarHBondContact O-CB 3.41Å; I266-L275 PolarHBondContact O-N 2.92Å; D268-L275 HydrophobicContact CB-CD1 4.25Å; D268-L275 HydrophobicContact CB-CD2 4.42Å; D268-L275 HydrophobicContact CB-CG 4.38Å; V273-L275 PolarHBondContact O-N 2.96Å
276	Q	94.4	Very high	90.1	Very high	60 Å²	60	52.4 Å²	52.4	28%	0.28	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	148.5	-177.2	-172.5	62.6	55.6	0	0	110.9	I266 I278	I266-Q276 HydrophobicContact CB-CB 4.18Å; I266-Q276 HydrophobicContact CD1-CB 4.36Å; I266-Q276 PolarHBondContact N-O 2.94Å; I266-Q276 PolarHBondContact O-N 3.1Å; Q276-I278 HydrophobicContact CG-CG2 3.75Å
277	Q	93.4	Very high	89.1	Confident	80 Å²	80	52.3 Å²	52.3	37%	0.374	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	131.8	167	-176.9	172.5	21.8	0	0	108.6	C263 V264 H265 L280	C263-Q277 HydrophobicContact CB-CG 4.17Å; C263-Q277 PolarHBondContact SG-NE2 3.22Å; V264-Q277 WeakPolarHBondContact O-CA 3.48Å; H265-Q277 PolarHBondContact NE2-NE2 3.31Å; Q277-L280 HydrophobicContact CG-CD1 4.17Å; Q277-L280 HydrophobicContact CG-CG 4.23Å
278	I	92.4	Very high	87.4	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.015	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	156.2	-177.2	67.4	172.6	0	0	0	112.2	V264 Q276 L280 L303 V305 W317	V264-I278 HydrophobicContact CB-CD1 4.06Å; V264-I278 HydrophobicContact CB-CG1 3.63Å; V264-I278 HydrophobicContact CG1-CD1 4.26Å; V264-I278 HydrophobicContact CG1-CG1 4.21Å; V264-I278 HydrophobicContact CG2-CG1 4.48Å; V264-I278 PolarHBondContact N-O 3.15Å; V264-I278 VanDerWaalsContact N-O 3.11Å; V264-I278 PolarHBondContact O-N 2.97Å; Q276-I278 HydrophobicContact CG-CG2 3.75Å; I278-L280 VanDerWaalsContact C-N 3.34Å; I278-L280 PolarHBondContact O-N 2.74Å; I278-L303 HydrophobicContact CD1-CD2 3.81Å; I278-V305 HydrophobicContact CD1-CG2 4.35Å; I278-W317 HydrophobicContact CB-CD2 4.38Å; I278-W317 HydrophobicContact CB-CE3 3.96Å; I278-W317 HydrophobicContact CB-CZ3 4.27Å; I278-W317 HydrophobicContact CD1-CB 3.94Å; I278-W317 HydrophobicContact CD1-CD2 4.06Å; I278-W317 HydrophobicContact CD1-CE3 4.45Å; I278-W317 HydrophobicContact CD1-CG 3.82Å; I278-W317 HydrophobicContact CG2-CE3 4.4Å
279	G	83.8	Confident	85.5	Confident	5 Å²	5	52.8 Å²	52.8	5%	0.052	30%	0.295	C	S	.	.			trans	72.4	17	170.5	0	0	0	0	0	116.7	G281 T282 F283	G279-G281 PolarHBondContact O-N 2.7Å; G279-T282 WeakPolarHBondContact O-CB 3.38Å; G279-T282 PolarHBondContact O-N 2.72Å; G279-F283 VanDerWaalsContact CA-CE2 3.45Å; G279-F283 WeakPolarHBondContact O-CD2 3.48Å; G279-F283 PolarHBondContact O-N 3.26Å
280	L	83.9	Confident	83.9	Confident	88 Å²	88	53 Å²	53	46%	0.461	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	124.6	168.6	-74.1	171.4	0	0	0	110.3	Q261 C263 Q277 I278 T282	Q261-L280 HydrophobicContact CB-CD2 4.16Å; C263-L280 HydrophobicContact CB-CD2 3.92Å; C263-L280 HydrophobicContact CB-CG 4.37Å; Q277-L280 HydrophobicContact CG-CD1 4.17Å; Q277-L280 HydrophobicContact CG-CG 4.23Å; I278-L280 VanDerWaalsContact C-N 3.34Å; I278-L280 PolarHBondContact O-N 2.74Å; L280-T282 PolarHBondContact O-N 2.86Å; L280-T282 VanDerWaalsContact O-N 3.13Å
281	G	79.8	Confident	83.2	Confident	59 Å²	59	50 Å²	50	61%	0.608	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	3.1	-176.9	0	0	0	0	0	115.6	G279	G279-G281 PolarHBondContact O-N 2.7Å
282	T	84.9	Confident	83	Confident	52 Å²	52	46.4 Å²	46.4	32%	0.319	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-45.2	179.3	-54.1	0	0	0	0	111.7	G279 L280 W317 K324	G279-T282 WeakPolarHBondContact O-CB 3.38Å; G279-T282 PolarHBondContact O-N 2.72Å; L280-T282 PolarHBondContact O-N 2.86Å; L280-T282 VanDerWaalsContact O-N 3.13Å; T282-W317 HydrophobicContact CG2-CH2 4.28Å; T282-W317 HydrophobicContact CG2-CZ2 3.98Å; T282-K324 HydrophobicContact CG2-CD 4.37Å
283	F	84.8	Confident	83	Confident	15 Å²	15	44.7 Å²	44.7	7%	0.066	24%	0.243	C	C	.	.	S	Bend	trans	-77.5	129.5	-177.5	-54	-49.1	0	0	0	111.3	A262 V264 G279 V287 V305 D307 W317	A262-F283 HydrophobicContact CB-CB 3.88Å; V264-F283 HydrophobicContact CB-CE2 4.5Å; V264-F283 HydrophobicContact CG2-CE2 3.83Å; V264-F283 HydrophobicContact CG2-CZ 4.25Å; G279-F283 VanDerWaalsContact CA-CE2 3.45Å; G279-F283 WeakPolarHBondContact O-CD2 3.48Å; G279-F283 PolarHBondContact O-N 3.26Å; F283-V287 HydrophobicContact CD2-CG2 3.94Å; F283-V287 HydrophobicContact CE2-CG2 4.22Å; F283-V287 HydrophobicContact CG-CG2 4.42Å; F283-V305 HydrophobicContact CD1-CG1 4.36Å; F283-V305 HydrophobicContact CE1-CB 4.06Å; F283-V305 HydrophobicContact CE1-CG1 3.64Å; F283-V305 HydrophobicContact CE2-CG1 4.38Å; F283-V305 HydrophobicContact CZ-CB 4.11Å; F283-V305 HydrophobicContact CZ-CG1 3.66Å; F283-V305 HydrophobicContact CZ-CG2 4.27Å; F283-D307 HydrophobicContact CB-CB 4.23Å; F283-D307 HydrophobicContact CD1-CB 4.16Å; F283-W317 HydrophobicContact CE1-CZ2 4.07Å; F283-W317 AromaticContact CE1-NE1 3.94Å; F283-W317 HydrophobicContact CZ-CZ2 4.01Å; F283-W317 AromaticContact CZ-NE1 3.94Å
284	Q	79.6	Confident	83	Confident	129 Å²	129	41.2 Å²	41.2	60%	0.603	22%	0.221	S	C	*	.	S	Bend	trans	-93.3	136	175.8	-61.4	-177.8	0.3	0	0	110.6	G286 S309	Q284-G286 PolarHBondContact O-N 3.07Å; Q284-S309 PolarHBondContact O-N 2.71Å
285	R	77.8	Confident	82.9	Confident	151 Å²	151	39 Å²	39	57%	0.57	21%	0.207	S	C	*	.	S	Bend	trans	62.9	-29.6	-178.9	-60.2	-177.2	175	174.5	2.2	116.8	T250 A251 N310	T250-R285 PolarHBondContact OG1-O 2.82Å; A251-R285 VanDerWaalsContact CB-O 3.3Å; A251-R285 WeakPolarHBondContact CB-O 3.35Å; A251-R285 PolarHBondContact N-O 3.4Å; R285-N310 PolarHBondContact NH1-OD1 2.78Å; R285-N310 PolarHBondContact NH2-OD1 3.28Å
286	G	76.3	Confident	82.8	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.01	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	159.8	173.9	-176.8	0	0	0	0	0	112.3	Q284 D307 D308	Q284-G286 PolarHBondContact O-N 3.07Å; G286-D307 WeakPolarHBondContact O-CA 3.45Å; G286-D308 PolarHBondContact O-N 2.9Å
287	V	75.9	Confident	82.7	Confident	2 Å²	2	38 Å²	38	1%	0.012	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	130.8	162.4	-170.8	0	0	0	0	108.2	C235 Q249 V264 F283 L292 V305	C235-V287 WeakPolarHBondContact SG-CG1 3.48Å; Q249-V287 PolarHBondContact O-N 2.82Å; V264-V287 HydrophobicContact CG2-CG1 4.22Å; V264-V287 HydrophobicContact CG2-CG2 3.66Å; F283-V287 HydrophobicContact CD2-CG2 3.94Å; F283-V287 HydrophobicContact CE2-CG2 4.22Å; F283-V287 HydrophobicContact CG-CG2 4.42Å; V287-L292 HydrophobicContact CG1-CD2 4.13Å; V287-L292 HydrophobicContact CG1-CG 4.4Å; V287-V305 HydrophobicContact CG1-CG1 3.66Å
288	G	60.9	Low	82.6	Confident	3 Å²	3	36.4 Å²	36.4	3%	0.031	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	172.1	-177.3	0	0	0	0	0	113.6	C235 S291 I306	C235-G288 WeakPolarHBondContact CB-O 3.19Å; C235-G288 PolarHBondContact SG-O 3.42Å; G288-S291 VanDerWaalsContact C-CB 3.47Å; G288-S291 WeakPolarHBondContact CA-OG 3.31Å; G288-S291 VanDerWaalsContact O-CB 3.27Å; G288-S291 WeakPolarHBondContact O-CB 3.3Å; G288-S291 PolarHBondContact O-OG 2.87Å; G288-I306 PolarHBondContact N-O 2.85Å
289	M	57.7	Low	82.5	Confident	38 Å²	38	40.5 Å²	40.5	19%	0.187	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	123.5	-176.1	-52.6	-178.9	66.6	0	0	110.7	D192 C193 R234 S291	D192-M289 VanDerWaalsContact C-CE 3.4Å; D192-M289 WeakPolarHBondContact O-CE 3.3Å; C193-M289 HydrophobicContact CB-CE 3.9Å; C193-M289 WeakPolarHBondContact SG-CE 3.46Å; R234-M289 HydrophobicContact CG-CG 4.36Å; M289-S291 VanDerWaalsContact C-N 3.28Å; M289-S291 PolarHBondContact N-OG 3.01Å
290	G	62.2	Low	82.9	Confident	11 Å²	11	40.3 Å²	40.3	11%	0.113	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	71.9	24.9	-171.3	0	0	0	0	0	113	A337 V338	G290-A337 WeakPolarHBondContact O-CA 3.13Å; G290-V338 PolarHBondContact O-N 2.82Å
291	S	81.8	Confident	83.3	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.007	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	14.7	-167	-62.4	0	0	0	0	114.5	G288 M289 V305 I306 V338	G288-S291 VanDerWaalsContact C-CB 3.47Å; G288-S291 WeakPolarHBondContact CA-OG 3.31Å; G288-S291 VanDerWaalsContact O-CB 3.27Å; G288-S291 WeakPolarHBondContact O-CB 3.3Å; G288-S291 PolarHBondContact O-OG 2.87Å; M289-S291 VanDerWaalsContact C-N 3.28Å; M289-S291 PolarHBondContact N-OG 3.01Å; S291-V305 CarbonylContact O-C 3.5Å; S291-V305 VanDerWaalsContact O-CA 3.24Å; S291-V305 WeakPolarHBondContact O-CA 3.22Å; S291-I306 WeakPolarHBondContact CB-O 3.42Å; S291-I306 PolarHBondContact O-N 3.38Å; S291-I306 PolarHBondContact OG-O 3.03Å; S291-V338 VanDerWaalsContact C-CG1 3.41Å
292	L	91.3	Very high	84.1	Confident	13 Å²	13	38.1 Å²	38.1	7%	0.068	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.6	-179.3	-64.9	178.4	0	0	0	110	C235 A237 A246 V264 V287 L303 C304 V305	C235-L292 HydrophobicContact CB-CD1 4.09Å; C235-L292 HydrophobicContact CB-CG 4.17Å; C235-L292 WeakPolarHBondContact SG-CD1 3.49Å; A237-L292 HydrophobicContact CB-CB 3.74Å; A246-L292 HydrophobicContact CB-CD1 4.36Å; V264-L292 HydrophobicContact CG1-CD1 4.35Å; V264-L292 HydrophobicContact CG1-CD2 4.28Å; V264-L292 HydrophobicContact CG2-CD2 3.92Å; V287-L292 HydrophobicContact CG1-CD2 4.13Å; V287-L292 HydrophobicContact CG1-CG 4.4Å; L292-L303 HydrophobicContact CB-CD1 4.4Å; L292-L303 HydrophobicContact CD2-CD1 4.44Å; L292-L303 HydrophobicContact CD2-CD2 4.39Å; L292-C304 WeakPolarHBondContact CA-O 3.31Å; L292-V305 HydrophobicContact CD2-CB 4.15Å; L292-V305 HydrophobicContact CD2-CG1 3.85Å; L292-V305 HydrophobicContact CD2-CG2 3.68Å
293	A	94.4	Very high	84.6	Confident	8 Å²	8	35.7 Å²	35.7	7%	0.066	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	138.9	167.7	0	0	0	0	0	112	L303 C304 V338 D339 F340	A293-L303 WeakPolarHBondContact O-CA 3.39Å; A293-L303 WeakPolarHBondContact O-CD1 3.12Å; A293-C304 PolarHBondContact N-O 2.85Å; A293-C304 PolarHBondContact O-N 2.9Å; A293-C304 PolarHBondContact O-SG 2.97Å; A293-C304 VanDerWaalsContact O-SG 3.34Å; A293-V338 WeakPolarHBondContact CB-O 3.49Å; A293-D339 HydrophobicContact CB-CB 4.31Å; A293-D339 WeakPolarHBondContact CB-OD1 3.42Å; A293-F340 VanDerWaalsContact O-CE2 3.29Å; A293-F340 WeakPolarHBondContact O-CE2 3.33Å
294	F	95.9	Very high	85.1	Confident	9 Å²	9	35 Å²	35	4%	0.039	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	146.1	176.5	-75.3	-78.4	0	0	0	111.1	A237 H239 P240 A246 I296 F302 L303	A237-F294 HydrophobicContact CB-CD2 4.19Å; A237-F294 HydrophobicContact CB-CE2 4.3Å; H239-F294 HydrophobicContact CB-CD2 4.03Å; H239-F294 HydrophobicContact CB-CE1 4.49Å; H239-F294 HydrophobicContact CB-CE2 3.9Å; H239-F294 HydrophobicContact CB-CG 4.36Å; H239-F294 HydrophobicContact CB-CZ 4.12Å; H239-F294 AromaticContact CD2-CD1 3.63Å; H239-F294 AromaticContact CD2-CE1 3.68Å; P240-F294 HydrophobicContact CG-CB 4.46Å; A246-F294 HydrophobicContact CB-CE1 4.49Å; A246-F294 HydrophobicContact CB-CE2 3.57Å; A246-F294 HydrophobicContact CB-CZ 3.47Å; A246-F294 VanDerWaalsContact CB-CZ 3.47Å; F294-I296 PolarHBondContact O-N 2.67Å; F294-F302 CarbonylContact C-O 3.59Å; F294-F302 WeakPolarHBondContact CA-O 3.19Å; F294-L303 HydrophobicContact CD1-CB 4.26Å; F294-L303 HydrophobicContact CD1-CD1 4.02Å; F294-L303 HydrophobicContact CD2-CD1 4.23Å; F294-L303 HydrophobicContact CE1-CB 4.32Å; F294-L303 HydrophobicContact CE1-CD1 4.06Å; F294-L303 HydrophobicContact CE2-CD1 4.29Å; F294-L303 HydrophobicContact CG-CD1 4.12Å; F294-L303 HydrophobicContact CZ-CD1 4.22Å
295	S	95.3	Very high	85.8	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.158	C	C	.	.			trans	-73.8	109.8	176.9	70.3	0	0	0	0	111.3	D298 G300 F302	S295-D298 WeakPolarHBondContact CB-OD2 3.38Å; S295-D298 PolarHBondContact OG-OD2 2.99Å; S295-G300 WeakPolarHBondContact O-CA 3.35Å; S295-G300 PolarHBondContact O-N 3.07Å; S295-F302 PolarHBondContact N-O 3.32Å; S295-F302 PolarHBondContact OG-N 2.89Å
296	I	92.1	Very high	86.6	Confident	85 Å²	85	21.7 Å²	21.7	44%	0.436	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-41	-179.5	-58.7	173.4	0	0	0	110.7	P240 F294 D298 S299 P342	P240-I296 HydrophobicContact CG-CG1 4.23Å; F294-I296 PolarHBondContact O-N 2.67Å; I296-D298 VanDerWaalsContact C-N 3.3Å; I296-D298 PolarHBondContact O-N 2.98Å; I296-S299 PolarHBondContact O-N 3.11Å; I296-S299 VanDerWaalsContact O-N 3.1Å; I296-P342 HydrophobicContact CD1-CB 4.34Å; I296-P342 HydrophobicContact CD1-CG 4.43Å
297	A	91.6	Very high	87.4	Confident	44 Å²	44	21.9 Å²	21.9	36%	0.364	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-33.5	-177.6	0	0	0	0	0	113.9	P342	A297-P342 PolarHBondContact N-O 2.78Å
298	D	91.3	Very high	87.9	Confident	47 Å²	47	25.4 Å²	25.4	25%	0.251	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	26.5	177.9	-29.4	-81	0	0	0	112.6	S295 I296 G300 T301 F302 S345	S295-D298 WeakPolarHBondContact CB-OD2 3.38Å; S295-D298 PolarHBondContact OG-OD2 2.99Å; I296-D298 VanDerWaalsContact C-N 3.3Å; I296-D298 PolarHBondContact O-N 2.98Å; D298-G300 PolarHBondContact O-N 3.04Å; D298-T301 WeakPolarHBondContact O-CB 3.49Å; D298-T301 PolarHBondContact O-N 2.89Å; D298-T301 PolarHBondContact O-OG1 3.29Å; D298-F302 HydrophobicContact CB-CD2 4.31Å; D298-F302 WeakPolarHBondContact OD2-CD2 3.37Å; D298-S345 VanDerWaalsContact CG-OG 3.23Å; D298-S345 PolarHBondContact OD1-OG 3.32Å; D298-S345 WeakPolarHBondContact OD2-CB 3.47Å; D298-S345 PolarHBondContact OD2-OG 3.3Å
299	S	91.7	Very high	89.2	Confident	90 Å²	90	25.4 Å²	25.4	63%	0.629	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	34.2	179.7	-53.5	0	0	0	0	113.8	H239 I296	H239-S299 PolarHBondContact CE1-O 3.49Å; H239-S299 PolarHBondContact NE2-O 3.04Å; I296-S299 PolarHBondContact O-N 3.11Å; I296-S299 VanDerWaalsContact O-N 3.1Å
300	G	91.3	Very high	90.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	19.3	176.9	0	0	0	0	0	115.3	H239 S295 D298 F302	H239-G300 VanDerWaalsContact NE2-CA 3.27Å; H239-G300 WeakPolarHBondContact NE2-CA 2.91Å; H239-G300 PolarHBondContact NE2-O 3.47Å; S295-G300 WeakPolarHBondContact O-CA 3.35Å; S295-G300 PolarHBondContact O-N 3.07Å; D298-G300 PolarHBondContact O-N 3.04Å; G300-F302 PolarHBondContact O-N 3.49Å
301	T	93.8	Very high	92	Very high	53 Å²	53	31.1 Å²	31.1	33%	0.325	18%	0.177	S	C	.	.			trans	-58.3	-36	175.9	-59.6	0	0	0	0	112.3	D298 C319	D298-T301 WeakPolarHBondContact O-CB 3.49Å; D298-T301 PolarHBondContact O-N 2.89Å; D298-T301 PolarHBondContact O-OG1 3.29Å; T301-C319 WeakPolarHBondContact O-CB 3.26Å; T301-C319 PolarHBondContact O-N 2.99Å; T301-C319 PolarHBondContact O-SG 3.21Å
302	F	95.2	Very high	92.5	Very high	49 Å²	49	32.1 Å²	32.1	22%	0.215	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	149.9	-180	-58.6	-71.1	0	0	0	112.5	F294 S295 D298 G300 V316 W317 D318 F340	F294-F302 CarbonylContact C-O 3.59Å; F294-F302 WeakPolarHBondContact CA-O 3.19Å; S295-F302 PolarHBondContact N-O 3.32Å; S295-F302 PolarHBondContact OG-N 2.89Å; D298-F302 HydrophobicContact CB-CD2 4.31Å; D298-F302 WeakPolarHBondContact OD2-CD2 3.37Å; G300-F302 PolarHBondContact O-N 3.49Å; F302-V316 HydrophobicContact CB-CG1 4.09Å; F302-V316 HydrophobicContact CD1-CG1 4.25Å; F302-V316 HydrophobicContact CG-CG1 4.38Å; F302-W317 CarbonylContact C-O 3.57Å; F302-W317 VanDerWaalsContact CA-O 3.25Å; F302-W317 WeakPolarHBondContact CA-O 3.3Å; F302-D318 HydrophobicContact CD1-CB 4.44Å; F302-D318 HydrophobicContact CE1-CB 4.33Å; F302-F340 HydrophobicContact CB-CZ 4.27Å
303	L	96.1	Very high	92.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	127.5	173.4	177.1	72	0	0	0	108.8	A246 V264 I266 I278 L292 A293 F294 V305 V316 W317 C319	A246-L303 HydrophobicContact CB-CD1 4.15Å; A246-L303 HydrophobicContact CB-CD2 3.99Å; V264-L303 HydrophobicContact CG1-CD2 4.01Å; I266-L303 HydrophobicContact CD1-CD2 4.36Å; I278-L303 HydrophobicContact CD1-CD2 3.81Å; L292-L303 HydrophobicContact CB-CD1 4.4Å; L292-L303 HydrophobicContact CD2-CD1 4.44Å; L292-L303 HydrophobicContact CD2-CD2 4.39Å; A293-L303 WeakPolarHBondContact O-CA 3.39Å; A293-L303 WeakPolarHBondContact O-CD1 3.12Å; F294-L303 HydrophobicContact CD1-CB 4.26Å; F294-L303 HydrophobicContact CD1-CD1 4.02Å; F294-L303 HydrophobicContact CD2-CD1 4.23Å; F294-L303 HydrophobicContact CE1-CB 4.32Å; F294-L303 HydrophobicContact CE1-CD1 4.06Å; F294-L303 HydrophobicContact CE2-CD1 4.29Å; F294-L303 HydrophobicContact CG-CD1 4.12Å; F294-L303 HydrophobicContact CZ-CD1 4.22Å; L303-V305 HydrophobicContact CD2-CG2 4.13Å; L303-V305 HydrophobicContact CG-CG2 4.06Å; L303-V316 WeakPolarHBondContact O-CA 3.38Å; L303-W317 PolarHBondContact N-O 3.44Å; L303-W317 PolarHBondContact O-N 3.26Å; L303-C319 WeakPolarHBondContact CB-SG 3.46Å
304	C	95.3	Very high	92.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	140.4	169.3	65	0	0	0	0	109.7	L292 A293 L314 S315 V316 V338 F340 I348	L292-C304 WeakPolarHBondContact CA-O 3.31Å; A293-C304 PolarHBondContact N-O 2.85Å; A293-C304 PolarHBondContact O-N 2.9Å; A293-C304 PolarHBondContact O-SG 2.97Å; A293-C304 VanDerWaalsContact O-SG 3.34Å; C304-L314 HydrophobicContact CB-CD1 4.06Å; C304-S315 CarbonylContact C-O 3.59Å; C304-S315 VanDerWaalsContact CA-O 3.31Å; C304-S315 WeakPolarHBondContact CA-O 3.35Å; C304-V316 HydrophobicContact CB-CG2 4.24Å; C304-V338 HydrophobicContact CB-CG2 4.38Å; C304-V338 VanDerWaalsContact SG-CG2 3.59Å; C304-F340 HydrophobicContact CB-CD2 4.43Å; C304-F340 HydrophobicContact CB-CE2 3.55Å; C304-F340 HydrophobicContact CB-CZ 3.75Å; C304-F340 VanDerWaalsContact SG-CE2 3.53Å; C304-I348 HydrophobicContact CB-CD1 4.44Å
305	V	94.9	Very high	92.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	127.4	-178	-171.3	0	0	0	0	108.8	V264 I278 F283 V287 S291 L292 L303 S315	V264-V305 HydrophobicContact CG2-CG1 4.13Å; V264-V305 HydrophobicContact CG2-CG2 4.38Å; I278-V305 HydrophobicContact CD1-CG2 4.35Å; F283-V305 HydrophobicContact CD1-CG1 4.36Å; F283-V305 HydrophobicContact CE1-CB 4.06Å; F283-V305 HydrophobicContact CE1-CG1 3.64Å; F283-V305 HydrophobicContact CE2-CG1 4.38Å; F283-V305 HydrophobicContact CZ-CB 4.11Å; F283-V305 HydrophobicContact CZ-CG1 3.66Å; F283-V305 HydrophobicContact CZ-CG2 4.27Å; V287-V305 HydrophobicContact CG1-CG1 3.66Å; S291-V305 CarbonylContact O-C 3.5Å; S291-V305 VanDerWaalsContact O-CA 3.24Å; S291-V305 WeakPolarHBondContact O-CA 3.22Å; L292-V305 HydrophobicContact CD2-CB 4.15Å; L292-V305 HydrophobicContact CD2-CG1 3.85Å; L292-V305 HydrophobicContact CD2-CG2 3.68Å; L303-V305 HydrophobicContact CD2-CG2 4.13Å; L303-V305 HydrophobicContact CG-CG2 4.06Å; V305-S315 PolarHBondContact N-O 2.59Å; V305-S315 PolarHBondContact O-N 3.26Å; V305-S315 PolarHBondContact O-OG 3.32Å; V305-S315 VanDerWaalsContact O-OG 3.14Å
306	I	94.4	Very high	92.7	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.3	167.7	-58	-177.3	0	0	0	109.5	G288 S291 H312 I313 L314 V335 V338 T350	G288-I306 PolarHBondContact N-O 2.85Å; S291-I306 WeakPolarHBondContact CB-O 3.42Å; S291-I306 PolarHBondContact O-N 3.38Å; S291-I306 PolarHBondContact OG-O 3.03Å; I306-H312 HydrophobicContact CG2-CB 3.95Å; I306-I313 VanDerWaalsContact CA-O 3.31Å; I306-I313 WeakPolarHBondContact CA-O 3.38Å; I306-L314 HydrophobicContact CD1-CD1 4.4Å; I306-L314 HydrophobicContact CG1-CB 4.26Å; I306-L314 HydrophobicContact CG1-CD1 3.88Å; I306-V335 HydrophobicContact CD1-CB 4.4Å; I306-V335 HydrophobicContact CD1-CG1 3.61Å; I306-V335 HydrophobicContact CG2-CB 4.4Å; I306-V338 HydrophobicContact CD1-CB 3.66Å; I306-V338 HydrophobicContact CD1-CG1 4.12Å; I306-V338 HydrophobicContact CD1-CG2 4.02Å; I306-V338 HydrophobicContact CG1-CB 4.22Å; I306-V338 HydrophobicContact CG1-CG1 4.2Å; I306-V338 HydrophobicContact CG1-CG2 4.42Å; I306-T350 HydrophobicContact CD1-CG2 3.72Å
307	D	91.4	Very high	92.8	Very high	5 Å²	5	28.9 Å²	28.9	3%	0.027	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	165.2	175.7	77.3	8.5	0	0	0	112.9	F283 G286 S309 H312 I313	F283-D307 HydrophobicContact CB-CB 4.23Å; F283-D307 HydrophobicContact CD1-CB 4.16Å; G286-D307 WeakPolarHBondContact O-CA 3.45Å; D307-S309 PolarHBondContact O-N 3.09Å; D307-S309 WeakPolarHBondContact OD1-CB 3.2Å; D307-S309 PolarHBondContact OD1-N 2.83Å; D307-S309 VanDerWaalsContact OD1-N 3.15Å; D307-S309 PolarHBondContact OD1-OG 3.09Å; D307-H312 PolarHBondContact O-ND1 2.81Å; D307-I313 PolarHBondContact N-O 3.5Å; D307-I313 VanDerWaalsContact N-O 3.11Å; D307-I313 PolarHBondContact OD1-N 2.91Å
308	D	87.1	Confident	92.9	Very high	77 Å²	77	27.4 Å²	27.4	41%	0.412	15%	0.149	S	C	.	.			trans	-93.1	27.1	177.4	-156.8	39.4	0	0	0	112.2	G286 H312	G286-D308 PolarHBondContact O-N 2.9Å; D308-H312 IonicContact OD1-CE1 2.78Å
309	S	89.4	Confident	92.9	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.014	14%	0.14	C	C	.	.	S	Bend	trans	-68	163.4	171.4	75.1	0	0	0	0	110.6	Q284 D307 E311 H312	Q284-S309 PolarHBondContact O-N 2.71Å; D307-S309 PolarHBondContact O-N 3.09Å; D307-S309 WeakPolarHBondContact OD1-CB 3.2Å; D307-S309 PolarHBondContact OD1-N 2.83Å; D307-S309 VanDerWaalsContact OD1-N 3.15Å; D307-S309 PolarHBondContact OD1-OG 3.09Å; S309-E311 PolarHBondContact O-N 2.8Å; S309-E311 VanDerWaalsContact O-N 3.08Å; S309-E311 PolarHBondContact OG-N 2.89Å; S309-H312 PolarHBondContact O-CE1 3.43Å; S309-H312 PolarHBondContact O-N 3.49Å; S309-H312 VanDerWaalsContact O-N 3.11Å; S309-H312 PolarHBondContact O-ND1 3.15Å; S309-H312 PolarHBondContact OG-N 3.14Å; S309-H312 VanDerWaalsContact OG-N 3.08Å
310	N	88.3	Confident	92.7	Very high	102 Å²	102	26 Å²	26	55%	0.545	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.8	174.6	-73.8	-18.4	0	0	0	113.5	R285 N332	R285-N310 PolarHBondContact NH1-OD1 2.78Å; R285-N310 PolarHBondContact NH2-OD1 3.28Å; N310-N332 VanDerWaalsContact O-CA 3.3Å; N310-N332 WeakPolarHBondContact O-CA 3.24Å
311	E	90.3	Very high	92.6	Very high	68 Å²	68	32.9 Å²	32.9	32%	0.318	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	0.8	-178.4	-57.5	-173.6	138.8	0	0	112.5	S309 I313 K329 T330 T331	S309-E311 PolarHBondContact O-N 2.8Å; S309-E311 VanDerWaalsContact O-N 3.08Å; S309-E311 PolarHBondContact OG-N 2.89Å; E311-I313 HydrophobicContact CB-CD1 3.97Å; E311-I313 PolarHBondContact O-N 2.81Å; E311-K329 HydrophobicContact CB-CB 4.5Å; E311-K329 HydrophobicContact CB-CD 4.49Å; E311-K329 HydrophobicContact CB-CG 4.41Å; E311-K329 IonicContact OE1-NZ 3.81Å; E311-K329 PolarHBondContact OE1-NZ 2.77Å; E311-K329 VanDerWaalsContact OE2-CD 3.26Å; E311-K329 WeakPolarHBondContact OE2-CD 3.34Å; E311-K329 WeakPolarHBondContact OE2-CE 3.3Å; E311-K329 IonicContact OE2-NZ 3.06Å; E311-K329 PolarHBondContact OE2-NZ 2.9Å; E311-T330 PolarHBondContact O-N 2.83Å; E311-T331 CarbonylContact C-O 3.5Å; E311-T331 WeakPolarHBondContact CA-O 3.38Å; E311-T331 VanDerWaalsContact O-O 3.05Å
312	H	92.2	Very high	92.4	Very high	22 Å²	22	31.2 Å²	31.2	10%	0.102	16%	0.162	C	C	.	.			trans	40.7	72.2	-178.8	-64.4	-59.5	0	0	0	112.1	I306 D307 D308 S309 L314 T330 T331 E333 V335	I306-H312 HydrophobicContact CG2-CB 3.95Å; D307-H312 PolarHBondContact O-ND1 2.81Å; D308-H312 IonicContact OD1-CE1 2.78Å; S309-H312 PolarHBondContact O-CE1 3.43Å; S309-H312 PolarHBondContact O-N 3.49Å; S309-H312 VanDerWaalsContact O-N 3.11Å; S309-H312 PolarHBondContact O-ND1 3.15Å; S309-H312 PolarHBondContact OG-N 3.14Å; S309-H312 VanDerWaalsContact OG-N 3.08Å; H312-L314 PolarHBondContact O-N 2.59Å; H312-T330 VanDerWaalsContact CB-OG1 3.3Å; H312-T330 WeakPolarHBondContact CB-OG1 3.35Å; H312-T330 VanDerWaalsContact O-CB 3.31Å; H312-T330 WeakPolarHBondContact O-CB 3.24Å; H312-T330 WeakPolarHBondContact O-CG2 3.47Å; H312-T330 PolarHBondContact O-N 2.84Å; H312-T330 PolarHBondContact O-OG1 2.85Å; H312-T331 PolarHBondContact CD2-O 3.44Å; H312-E333 PolarHBondContact CD2-O 2.83Å; H312-V335 HydrophobicContact CB-CG2 3.77Å
313	I	94.4	Very high	92.3	Very high	28 Å²	28	32.3 Å²	32.3	14%	0.144	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	120.7	-174.3	-54.7	-56.9	0	0	0	109.5	I306 D307 E311 E327 K329	I306-I313 VanDerWaalsContact CA-O 3.31Å; I306-I313 WeakPolarHBondContact CA-O 3.38Å; D307-I313 PolarHBondContact N-O 3.5Å; D307-I313 VanDerWaalsContact N-O 3.11Å; D307-I313 PolarHBondContact OD1-N 2.91Å; E311-I313 HydrophobicContact CB-CD1 3.97Å; E311-I313 PolarHBondContact O-N 2.81Å; I313-E327 HydrophobicContact CG2-CB 4.11Å; I313-K329 HydrophobicContact CD1-CB 4.19Å; I313-K329 HydrophobicContact CD1-CG 3.6Å
314	L	95.6	Very high	92.2	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	124.5	166.7	169.8	63.4	0	0	0	108.5	C304 I306 H312 E327 I328 T330 V338 I348 T350 W359 F366	C304-L314 HydrophobicContact CB-CD1 4.06Å; I306-L314 HydrophobicContact CD1-CD1 4.4Å; I306-L314 HydrophobicContact CG1-CB 4.26Å; I306-L314 HydrophobicContact CG1-CD1 3.88Å; H312-L314 PolarHBondContact O-N 2.59Å; L314-E327 CarbonylContact O-C 3.59Å; L314-E327 WeakPolarHBondContact O-CA 3.32Å; L314-I328 HydrophobicContact CB-CG2 4.17Å; L314-I328 HydrophobicContact CD2-CG2 4.31Å; L314-I328 PolarHBondContact N-O 3.42Å; L314-I328 PolarHBondContact O-N 3.34Å; L314-T330 HydrophobicContact CB-CG2 3.35Å; L314-T330 HydrophobicContact CD2-CG2 4.46Å; L314-V338 HydrophobicContact CD1-CG2 4.07Å; L314-I348 HydrophobicContact CD2-CG2 4.32Å; L314-T350 HydrophobicContact CD2-CG2 4.48Å; L314-W359 HydrophobicContact CD2-CD2 4.36Å; L314-W359 HydrophobicContact CD2-CG 4.21Å; L314-F366 HydrophobicContact CD2-CE1 4.16Å; L314-F366 HydrophobicContact CD2-CZ 4.28Å; L314-F366 HydrophobicContact CG-CZ 4.41Å
315	S	94.9	Very high	92	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.014	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	146	176.4	59.1	0	0	0	0	110.9	C304 V305 W317 A326	C304-S315 CarbonylContact C-O 3.59Å; C304-S315 VanDerWaalsContact CA-O 3.31Å; C304-S315 WeakPolarHBondContact CA-O 3.35Å; V305-S315 PolarHBondContact N-O 2.59Å; V305-S315 PolarHBondContact O-N 3.26Å; V305-S315 PolarHBondContact O-OG 3.32Å; V305-S315 VanDerWaalsContact O-OG 3.14Å; S315-W317 PolarHBondContact OG-NE1 3.08Å; S315-A326 CarbonylContact C-O 3.58Å; S315-A326 WeakPolarHBondContact CA-O 3.24Å
316	V	95.3	Very high	92	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.018	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	131.4	176.5	174.2	0	0	0	0	108.8	F302 L303 C304 H325 A326 F340 I348 F366	F302-V316 HydrophobicContact CB-CG1 4.09Å; F302-V316 HydrophobicContact CD1-CG1 4.25Å; F302-V316 HydrophobicContact CG-CG1 4.38Å; L303-V316 WeakPolarHBondContact O-CA 3.38Å; C304-V316 HydrophobicContact CB-CG2 4.24Å; V316-H325 HydrophobicContact CG1-CB 4.44Å; V316-H325 WeakPolarHBondContact O-CB 3.48Å; V316-H325 PolarHBondContact O-N 3.24Å; V316-A326 PolarHBondContact N-O 2.95Å; V316-A326 PolarHBondContact O-N 2.82Å; V316-F340 HydrophobicContact CG1-CZ 4.32Å; V316-F340 HydrophobicContact CG2-CZ 4.3Å; V316-I348 HydrophobicContact CG2-CD1 3.69Å; V316-F366 HydrophobicContact CG2-CZ 3.75Å
317	W	95.2	Very high	92	Very high	13 Å²	13	46.3 Å²	46.3	5%	0.049	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	141	-172.9	-64.2	78.8	0	0	0	110.8	I278 T282 F283 F302 L303 S315 C319 T323 K324	I278-W317 HydrophobicContact CB-CD2 4.38Å; I278-W317 HydrophobicContact CB-CE3 3.96Å; I278-W317 HydrophobicContact CB-CZ3 4.27Å; I278-W317 HydrophobicContact CD1-CB 3.94Å; I278-W317 HydrophobicContact CD1-CD2 4.06Å; I278-W317 HydrophobicContact CD1-CE3 4.45Å; I278-W317 HydrophobicContact CD1-CG 3.82Å; I278-W317 HydrophobicContact CG2-CE3 4.4Å; T282-W317 HydrophobicContact CG2-CH2 4.28Å; T282-W317 HydrophobicContact CG2-CZ2 3.98Å; F283-W317 HydrophobicContact CE1-CZ2 4.07Å; F283-W317 AromaticContact CE1-NE1 3.94Å; F283-W317 HydrophobicContact CZ-CZ2 4.01Å; F283-W317 AromaticContact CZ-NE1 3.94Å; F302-W317 CarbonylContact C-O 3.57Å; F302-W317 VanDerWaalsContact CA-O 3.25Å; F302-W317 WeakPolarHBondContact CA-O 3.3Å; L303-W317 PolarHBondContact N-O 3.44Å; L303-W317 PolarHBondContact O-N 3.26Å; S315-W317 PolarHBondContact OG-NE1 3.08Å; W317-C319 PolarHBondContact O-N 3.33Å; W317-T323 WeakPolarHBondContact CA-O 3.46Å; W317-K324 HydrophobicContact CD2-CB 4.07Å; W317-K324 HydrophobicContact CD2-CG 4.37Å; W317-K324 HydrophobicContact CE3-CB 3.92Å; W317-K324 HydrophobicContact CH2-CB 3.84Å; W317-K324 HydrophobicContact CH2-CD 4.28Å; W317-K324 HydrophobicContact CH2-CG 4.38Å; W317-K324 HydrophobicContact CZ2-CB 4.01Å; W317-K324 HydrophobicContact CZ2-CD 3.87Å; W317-K324 HydrophobicContact CZ2-CG 4.06Å; W317-K324 HydrophobicContact CZ3-CB 3.81Å
318	D	93.6	Very high	92.2	Very high	13 Å²	13	48.3 Å²	48.3	7%	0.07	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	111.7	165.6	-178.7	-36.6	0	0	0	107.7	F302 T320 K321 G322 T323	F302-D318 HydrophobicContact CD1-CB 4.44Å; F302-D318 HydrophobicContact CE1-CB 4.33Å; D318-T320 PolarHBondContact O-N 3.08Å; D318-T320 PolarHBondContact OD1-N 3.13Å; D318-K321 HydrophobicContact CB-CB 4.24Å; D318-K321 PolarHBondContact O-N 3.03Å; D318-K321 PolarHBondContact OD1-N 2.83Å; D318-K321 VanDerWaalsContact OD2-CD 3.27Å; D318-K321 WeakPolarHBondContact OD2-CD 3.34Å; D318-K321 WeakPolarHBondContact OD2-CE 3.44Å; D318-K321 IonicContact OD2-NZ 2.97Å; D318-K321 PolarHBondContact OD2-NZ 3.39Å; D318-G322 WeakPolarHBondContact O-CA 3.32Å; D318-G322 PolarHBondContact O-N 3.13Å; D318-T323 PolarHBondContact N-O 3.11Å
319	C	90.3	Very high	92.6	Very high	7 Å²	7	50.3 Å²	50.3	5%	0.047	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-29.6	-174.6	-62.7	0	0	0	0	112.9	I266 T301 L303 W317	I266-C319 HydrophobicContact CD1-CB 3.78Å; T301-C319 WeakPolarHBondContact O-CB 3.26Å; T301-C319 PolarHBondContact O-N 2.99Å; T301-C319 PolarHBondContact O-SG 3.21Å; L303-C319 WeakPolarHBondContact CB-SG 3.46Å; W317-C319 PolarHBondContact O-N 3.33Å
320	T	87.9	Confident	92.7	Very high	101 Å²	101	50.4 Å²	50.4	62%	0.62	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-39.1	-175.3	-51	0	0	0	0	110.5	D318	D318-T320 PolarHBondContact O-N 3.08Å; D318-T320 PolarHBondContact OD1-N 3.13Å
321	K	89.7	Confident	93	Very high	144 Å²	144	46.6 Å²	46.6	63%	0.626	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-18.4	179.9	-61.7	-179.7	-165.9	134.4	0	113.5	D318 T323	D318-K321 HydrophobicContact CB-CB 4.24Å; D318-K321 PolarHBondContact O-N 3.03Å; D318-K321 PolarHBondContact OD1-N 2.83Å; D318-K321 VanDerWaalsContact OD2-CD 3.27Å; D318-K321 WeakPolarHBondContact OD2-CD 3.34Å; D318-K321 WeakPolarHBondContact OD2-CE 3.44Å; D318-K321 IonicContact OD2-NZ 2.97Å; D318-K321 PolarHBondContact OD2-NZ 3.39Å; K321-T323 HydrophobicContact CB-CG2 4.09Å; K321-T323 PolarHBondContact O-N 3.23Å
322	G	89.6	Confident	93.1	Very high	18 Å²	18	49.2 Å²	49.2	19%	0.186	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.7	17	-172.5	0	0	0	0	0	113.8	D318	D318-G322 WeakPolarHBondContact O-CA 3.32Å; D318-G322 PolarHBondContact O-N 3.13Å
323	T	92.4	Very high	93.1	Very high	73 Å²	73	51.9 Å²	51.9	45%	0.448	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	139	-175.5	55.2	0	0	0	0	111.9	W317 D318 K321	W317-T323 WeakPolarHBondContact CA-O 3.46Å; D318-T323 PolarHBondContact N-O 3.11Å; K321-T323 HydrophobicContact CB-CG2 4.09Å; K321-T323 PolarHBondContact O-N 3.23Å
324	K	93.6	Very high	93	Very high	79 Å²	79	52.3 Å²	52.3	34%	0.343	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	126.5	173.1	-168.9	171.9	68.6	179.6	0	110.4	T282 W317 E327	T282-K324 HydrophobicContact CG2-CD 4.37Å; W317-K324 HydrophobicContact CD2-CB 4.07Å; W317-K324 HydrophobicContact CD2-CG 4.37Å; W317-K324 HydrophobicContact CE3-CB 3.92Å; W317-K324 HydrophobicContact CH2-CB 3.84Å; W317-K324 HydrophobicContact CH2-CD 4.28Å; W317-K324 HydrophobicContact CH2-CG 4.38Å; W317-K324 HydrophobicContact CZ2-CB 4.01Å; W317-K324 HydrophobicContact CZ2-CD 3.87Å; W317-K324 HydrophobicContact CZ2-CG 4.06Å; W317-K324 HydrophobicContact CZ3-CB 3.81Å; K324-E327 HydrophobicContact CD-CB 4.37Å; K324-E327 WeakPolarHBondContact CE-OE2 3.45Å; K324-E327 IonicContact NZ-OE1 3.25Å; K324-E327 PolarHBondContact NZ-OE1 3.31Å; K324-E327 IonicContact NZ-OE2 2.75Å; K324-E327 PolarHBondContact NZ-OE2 2.83Å
325	H	92.3	Very high	92.9	Very high	107 Å²	107	52.8 Å²	52.8	50%	0.495	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	-46.2	179.5	-173	79.2	0	0	0	112.4	V316	V316-H325 HydrophobicContact CG1-CB 4.44Å; V316-H325 WeakPolarHBondContact O-CB 3.48Å; V316-H325 PolarHBondContact O-N 3.24Å
326	A	93.8	Very high	92.9	Very high	8 Å²	8	53.7 Å²	53.7	7%	0.066	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	157.8	-179.4	0	0	0	0	0	110.9	S315 V316 L361 F366	S315-A326 CarbonylContact C-O 3.58Å; S315-A326 WeakPolarHBondContact CA-O 3.24Å; V316-A326 PolarHBondContact N-O 2.95Å; V316-A326 PolarHBondContact O-N 2.82Å; A326-L361 HydrophobicContact CB-CD1 3.71Å; A326-F366 HydrophobicContact CB-CD2 4.26Å; A326-F366 HydrophobicContact CB-CE2 3.58Å; A326-F366 HydrophobicContact CB-CZ 4.21Å
327	E	94.4	Very high	92.9	Very high	100 Å²	100	54.4 Å²	54.4	47%	0.467	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	153.2	171.3	73	-170.8	158.2	0	0	112.4	I313 L314 K324	I313-E327 HydrophobicContact CG2-CB 4.11Å; L314-E327 CarbonylContact O-C 3.59Å; L314-E327 WeakPolarHBondContact O-CA 3.32Å; K324-E327 HydrophobicContact CD-CB 4.37Å; K324-E327 WeakPolarHBondContact CE-OE2 3.45Å; K324-E327 IonicContact NZ-OE1 3.25Å; K324-E327 PolarHBondContact NZ-OE1 3.31Å; K324-E327 IonicContact NZ-OE2 2.75Å; K324-E327 PolarHBondContact NZ-OE2 2.83Å
328	I	95.5	Very high	92.9	Very high	47 Å²	47	54.1 Å²	54.1	24%	0.241	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	149.1	174.4	-168.4	159	0	0	0	111.5	L314 T330 W359 F366	L314-I328 HydrophobicContact CB-CG2 4.17Å; L314-I328 HydrophobicContact CD2-CG2 4.31Å; L314-I328 PolarHBondContact N-O 3.42Å; L314-I328 PolarHBondContact O-N 3.34Å; I328-T330 PolarHBondContact O-N 2.9Å; I328-W359 HydrophobicContact CD1-CZ3 3.88Å; I328-W359 HydrophobicContact CG1-CZ3 4.3Å; I328-W359 HydrophobicContact CG2-CE3 4.24Å; I328-W359 HydrophobicContact CG2-CH2 4.4Å; I328-W359 HydrophobicContact CG2-CZ3 3.96Å; I328-F366 HydrophobicContact CB-CB 4.04Å; I328-F366 HydrophobicContact CB-CD2 3.69Å; I328-F366 HydrophobicContact CB-CG 4.15Å; I328-F366 HydrophobicContact CD1-CB 3.54Å; I328-F366 HydrophobicContact CG1-CB 4.38Å; I328-F366 HydrophobicContact CG2-CB 3.79Å; I328-F366 HydrophobicContact CG2-CD1 4.41Å; I328-F366 HydrophobicContact CG2-CD2 3.41Å; I328-F366 VanDerWaalsContact CG2-CD2 3.41Å; I328-F366 HydrophobicContact CG2-CE2 4.03Å; I328-F366 HydrophobicContact CG2-CG 3.62Å
329	K	95	Very high	93	Very high	120 Å²	120	55.7 Å²	55.7	52%	0.522	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	124.4	169.1	-56.2	-177.6	179.1	-156.2	0	109.8	E311 I313	E311-K329 HydrophobicContact CB-CB 4.5Å; E311-K329 HydrophobicContact CB-CD 4.49Å; E311-K329 HydrophobicContact CB-CG 4.41Å; E311-K329 IonicContact OE1-NZ 3.81Å; E311-K329 PolarHBondContact OE1-NZ 2.77Å; E311-K329 VanDerWaalsContact OE2-CD 3.26Å; E311-K329 WeakPolarHBondContact OE2-CD 3.34Å; E311-K329 WeakPolarHBondContact OE2-CE 3.3Å; E311-K329 IonicContact OE2-NZ 3.06Å; E311-K329 PolarHBondContact OE2-NZ 2.9Å; I313-K329 HydrophobicContact CD1-CB 4.19Å; I313-K329 HydrophobicContact CD1-CG 3.6Å
330	T	93.3	Very high	93.2	Very high	4 Å²	4	55.4 Å²	55.4	3%	0.025	29%	0.29	C	S	.	.			trans	-84.3	-62.3	-179.7	63.2	0	0	0	0	111.5	E311 H312 L314 I328 W359	E311-T330 PolarHBondContact O-N 2.83Å; H312-T330 VanDerWaalsContact CB-OG1 3.3Å; H312-T330 WeakPolarHBondContact CB-OG1 3.35Å; H312-T330 VanDerWaalsContact O-CB 3.31Å; H312-T330 WeakPolarHBondContact O-CB 3.24Å; H312-T330 WeakPolarHBondContact O-CG2 3.47Å; H312-T330 PolarHBondContact O-N 2.84Å; H312-T330 PolarHBondContact O-OG1 2.85Å; L314-T330 HydrophobicContact CB-CG2 3.35Å; L314-T330 HydrophobicContact CD2-CG2 4.46Å; I328-T330 PolarHBondContact O-N 2.9Å; T330-W359 HydrophobicContact CG2-CH2 4.41Å; T330-W359 HydrophobicContact CG2-CZ2 3.88Å
331	T	93.3	Very high	93.5	Very high	21 Å²	21	51.5 Å²	51.5	13%	0.129	27%	0.266	C	S	.	.			trans	-168.1	162.6	-172.3	179.2	0	0	0	0	110.3	E311 H312 E333 V335 Y357	E311-T331 CarbonylContact C-O 3.5Å; E311-T331 WeakPolarHBondContact CA-O 3.38Å; E311-T331 VanDerWaalsContact O-O 3.05Å; H312-T331 PolarHBondContact CD2-O 3.44Å; T331-E333 VanDerWaalsContact C-N 3.27Å; T331-E333 WeakPolarHBondContact CG2-O 3.32Å; T331-E333 PolarHBondContact OG1-N 3.17Å; T331-V335 HydrophobicContact CG2-CG2 3.55Å; T331-Y357 HydrophobicContact CG2-CE2 4.34Å
332	N	92.4	Very high	93.5	Very high	124 Å²	124	46.8 Å²	46.8	66%	0.663	25%	0.25	S	C	*	.	S	Bend	trans	-93.9	12.5	174.1	-58.9	-7.5	0	0	0	112.6	N310	N310-N332 VanDerWaalsContact O-CA 3.3Å; N310-N332 WeakPolarHBondContact O-CA 3.24Å
333	E	93.2	Very high	93.6	Very high	77 Å²	77	50.9 Å²	50.9	36%	0.36	28%	0.275	S	S	.	.	S	Bend	trans	-118.5	147.9	-177.8	-68.5	-71.8	-171.7	0	0	109.3	H312 T331 V335 K353	H312-E333 PolarHBondContact CD2-O 2.83Å; T331-E333 VanDerWaalsContact C-N 3.27Å; T331-E333 WeakPolarHBondContact CG2-O 3.32Å; T331-E333 PolarHBondContact OG1-N 3.17Å; E333-V335 PolarHBondContact O-N 2.84Å; E333-K353 HydrophobicContact CB-CB 4.32Å; E333-K353 IonicContact OE1-NZ 3.89Å; E333-K353 WeakPolarHBondContact OE2-CD 3.13Å; E333-K353 WeakPolarHBondContact OE2-CE 2.9Å; E333-K353 IonicContact OE2-NZ 3.82Å; E333-K353 PolarHBondContact OE2-NZ 3.3Å
334	A	91.9	Very high	93.5	Very high	37 Å²	37	50 Å²	50	31%	0.306	27%	0.268	S	S	.	.			trans	-54.5	124.8	-173.2	0	0	0	0	0	112.9	F336 G352 K353 H355	A334-F336 HydrophobicContact CB-CD1 4.2Å; A334-F336 HydrophobicContact CB-CE1 3.51Å; A334-F336 HydrophobicContact CB-CZ 4.24Å; A334-G352 WeakPolarHBondContact O-CA 3.46Å; A334-K353 PolarHBondContact O-N 3.07Å; A334-H355 PolarHBondContact O-CE1 2.91Å
335	V	94.4	Very high	93.4	Very high	10 Å²	10	47 Å²	47	6%	0.061	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	133.9	173.1	-171.9	0	0	0	0	109.1	I306 H312 T331 E333	I306-V335 HydrophobicContact CD1-CB 4.4Å; I306-V335 HydrophobicContact CD1-CG1 3.61Å; I306-V335 HydrophobicContact CG2-CB 4.4Å; H312-V335 HydrophobicContact CB-CG2 3.77Å; T331-V335 HydrophobicContact CG2-CG2 3.55Å; E333-V335 PolarHBondContact O-N 2.84Å
336	F	93.9	Very high	93.4	Very high	21 Å²	21	45.3 Å²	45.3	9%	0.092	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	-27.7	-171.3	-62.9	-18.6	0	0	0	114.2	R194 A334 C351 F381 I382 H383	R194-F336 WeakPolarHBondContact CD-O 3.42Å; A334-F336 HydrophobicContact CB-CD1 4.2Å; A334-F336 HydrophobicContact CB-CE1 3.51Å; A334-F336 HydrophobicContact CB-CZ 4.24Å; F336-C351 PolarHBondContact N-O 2.8Å; F336-F381 HydrophobicContact CE2-CB 3.97Å; F336-F381 AromaticContact CE2-CD1 3.52Å; F336-F381 HydrophobicContact CE2-CD1 3.52Å; F336-F381 HydrophobicContact CE2-CE1 4.33Å; F336-F381 HydrophobicContact CE2-CG 4.06Å; F336-F381 AromaticContact CZ-CD1 3.7Å; F336-F381 HydrophobicContact CZ-CD1 3.7Å; F336-F381 HydrophobicContact CZ-CE1 4.07Å; F336-I382 WeakPolarHBondContact CD2-O 3.11Å; F336-H383 AromaticContact CD2-ND1 3.97Å; F336-H383 AromaticContact CE2-ND1 3.89Å
337	A	94.7	Very high	93.4	Very high	19 Å²	19	45.9 Å²	45.9	16%	0.157	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	148.7	176.7	0	0	0	0	0	111	G290 T350 C351 F385	G290-A337 WeakPolarHBondContact O-CA 3.13Å; A337-T350 VanDerWaalsContact O-CA 3.31Å; A337-T350 WeakPolarHBondContact O-CA 3.36Å; A337-C351 PolarHBondContact N-O 3.07Å; A337-C351 PolarHBondContact O-N 2.78Å; A337-F385 HydrophobicContact CB-CD1 3.83Å; A337-F385 HydrophobicContact CB-CE1 3.67Å
338	V	95.9	Very high	93.4	Very high	7 Å²	7	41.1 Å²	41.1	4%	0.042	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	142.8	169.1	63.7	0	0	0	0	109.3	G290 S291 A293 C304 I306 L314 I348 I349 T350	G290-V338 PolarHBondContact O-N 2.82Å; S291-V338 VanDerWaalsContact C-CG1 3.41Å; A293-V338 WeakPolarHBondContact CB-O 3.49Å; C304-V338 HydrophobicContact CB-CG2 4.38Å; C304-V338 VanDerWaalsContact SG-CG2 3.59Å; I306-V338 HydrophobicContact CD1-CB 3.66Å; I306-V338 HydrophobicContact CD1-CG1 4.12Å; I306-V338 HydrophobicContact CD1-CG2 4.02Å; I306-V338 HydrophobicContact CG1-CB 4.22Å; I306-V338 HydrophobicContact CG1-CG1 4.2Å; I306-V338 HydrophobicContact CG1-CG2 4.42Å; L314-V338 HydrophobicContact CD1-CG2 4.07Å; V338-I348 HydrophobicContact CG2-CG2 3.62Å; V338-I349 VanDerWaalsContact CA-O 3.31Å; V338-I349 WeakPolarHBondContact CA-O 3.37Å; V338-T350 HydrophobicContact CB-CG2 4.15Å; V338-T350 HydrophobicContact CG2-CG2 3.77Å
339	D	95.6	Very high	93.4	Very high	45 Å²	45	39 Å²	39	24%	0.241	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	153.2	175	-155.5	-3.6	0	0	0	111.1	A293 I348 I349 F385 F387	A293-D339 HydrophobicContact CB-CB 4.31Å; A293-D339 WeakPolarHBondContact CB-OD1 3.42Å; D339-I348 WeakPolarHBondContact O-CA 3.3Å; D339-I349 PolarHBondContact N-O 3.49Å; D339-I349 VanDerWaalsContact N-O 3.11Å; D339-I349 PolarHBondContact O-N 3.4Å; D339-F385 HydrophobicContact CB-CE2 3.69Å; D339-F385 HydrophobicContact CB-CZ 3.47Å; D339-F385 VanDerWaalsContact CB-CZ 3.47Å; D339-F387 HydrophobicContact CB-CE2 4.07Å
340	F	95.2	Very high	93.5	Very high	1 Å²	1	33.3 Å²	33.3	0%	0.004	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	148.5	171.2	-73.7	-86.8	0	0	0	110.2	A293 F302 C304 V316 P342 S345 I348 F387	A293-F340 VanDerWaalsContact O-CE2 3.29Å; A293-F340 WeakPolarHBondContact O-CE2 3.33Å; F302-F340 HydrophobicContact CB-CZ 4.27Å; C304-F340 HydrophobicContact CB-CD2 4.43Å; C304-F340 HydrophobicContact CB-CE2 3.55Å; C304-F340 HydrophobicContact CB-CZ 3.75Å; C304-F340 VanDerWaalsContact SG-CE2 3.53Å; V316-F340 HydrophobicContact CG1-CZ 4.32Å; V316-F340 HydrophobicContact CG2-CZ 4.3Å; F340-P342 WeakPolarHBondContact O-CD 3.48Å; F340-S345 VanDerWaalsContact CD1-O 3.27Å; F340-S345 WeakPolarHBondContact CD1-O 3.41Å; F340-S345 WeakPolarHBondContact CE1-O 3.34Å; F340-I348 HydrophobicContact CD1-CD1 3.99Å; F340-I348 HydrophobicContact CD1-CG1 3.62Å; F340-I348 HydrophobicContact CE1-CD1 3.46Å; F340-I348 VanDerWaalsContact CE1-CD1 3.46Å; F340-I348 HydrophobicContact CE1-CG1 3.65Å; F340-I348 HydrophobicContact CG-CG1 4.41Å; F340-I348 HydrophobicContact CZ-CD1 3.93Å; F340-I348 HydrophobicContact CZ-CG1 4.45Å; F340-F387 WeakPolarHBondContact O-CE2 3.45Å; F340-F387 WeakPolarHBondContact O-CZ 3.4Å
341	N	92.8	Very high	93.6	Very high	20 Å²	20	33.1 Å²	33.1	11%	0.107	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	127.7	165.3	-173.4	-52.4	0	0	0	108.9	S343 D344 N347 F387	N341-S343 PolarHBondContact O-N 2.95Å; N341-S343 VanDerWaalsContact O-N 3.1Å; N341-S343 PolarHBondContact OD1-N 2.8Å; N341-D344 WeakPolarHBondContact CB-O 3.11Å; N341-D344 CarbonylContact O-C 3.48Å; N341-D344 PolarHBondContact O-N 3.21Å; N341-N347 HydrophobicContact CB-CB 3.91Å; N341-N347 WeakPolarHBondContact CB-O 2.95Å; N341-N347 PolarHBondContact N-O 2.82Å; N341-F387 HydrophobicContact CB-CE1 4.13Å; N341-F387 HydrophobicContact CB-CZ 4.38Å
342	P	91.4	Very high	93.7	Very high	44 Å²	44	32.1 Å²	32.1	29%	0.286	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.9	-176.5	-26.8	34.7	0	0	0	114.2	I296 A297 F340 F387	I296-P342 HydrophobicContact CD1-CB 4.34Å; I296-P342 HydrophobicContact CD1-CG 4.43Å; A297-P342 PolarHBondContact N-O 2.78Å; F340-P342 WeakPolarHBondContact O-CD 3.48Å; P342-F387 VanDerWaalsContact CD-CD2 3.44Å; P342-F387 VanDerWaalsContact CD-CG 3.41Å; P342-F387 HydrophobicContact CG-CB 3.94Å; P342-F387 HydrophobicContact CG-CD2 3.74Å; P342-F387 HydrophobicContact CG-CE2 4.38Å; P342-F387 HydrophobicContact CG-CG 3.83Å
343	S	90.7	Very high	93.8	Very high	104 Å²	104	29.5 Å²	29.5	73%	0.727	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98	-15.6	-177.5	-54.2	0	0	0	0	113.7	N341	N341-S343 PolarHBondContact O-N 2.95Å; N341-S343 VanDerWaalsContact O-N 3.1Å; N341-S343 PolarHBondContact OD1-N 2.8Å
344	D	90.4	Very high	93.6	Very high	54 Å²	54	27.8 Å²	27.8	29%	0.289	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	107.3	-176.6	179.5	12.3	0	0	0	112.1	N341 N346 N347	N341-D344 WeakPolarHBondContact CB-O 3.11Å; N341-D344 CarbonylContact O-C 3.48Å; N341-D344 PolarHBondContact O-N 3.21Å; D344-N346 PolarHBondContact O-N 3.17Å; D344-N346 VanDerWaalsContact O-N 3.17Å; D344-N346 VanDerWaalsContact OD1-CB 3.31Å; D344-N346 WeakPolarHBondContact OD1-CB 3.43Å; D344-N346 PolarHBondContact OD1-N 3.41Å; D344-N346 PolarHBondContact OD1-ND2 3.05Å; D344-N347 PolarHBondContact O-N 3.13Å; D344-N347 PolarHBondContact OD2-ND2 2.97Å
345	S	90.9	Very high	93.6	Very high	16 Å²	16	26.2 Å²	26.2	11%	0.112	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	-13.4	-179.7	52.9	0	0	0	0	114.9	D298 F340 N347	D298-S345 VanDerWaalsContact CG-OG 3.23Å; D298-S345 PolarHBondContact OD1-OG 3.32Å; D298-S345 WeakPolarHBondContact OD2-CB 3.47Å; D298-S345 PolarHBondContact OD2-OG 3.3Å; F340-S345 VanDerWaalsContact CD1-O 3.27Å; F340-S345 WeakPolarHBondContact CD1-O 3.41Å; F340-S345 WeakPolarHBondContact CE1-O 3.34Å; S345-N347 PolarHBondContact O-N 3.25Å
346	N	92.5	Very high	93.7	Very high	72 Å²	72	25.8 Å²	25.8	39%	0.385	15%	0.151	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	-18.7	172.8	-60.7	-62.6	0	0	0	112	D344 T360 L361	D344-N346 PolarHBondContact O-N 3.17Å; D344-N346 VanDerWaalsContact O-N 3.17Å; D344-N346 VanDerWaalsContact OD1-CB 3.31Å; D344-N346 WeakPolarHBondContact OD1-CB 3.43Å; D344-N346 PolarHBondContact OD1-N 3.41Å; D344-N346 PolarHBondContact OD1-ND2 3.05Å; N346-T360 CarbonylContact O-C 3.53Å; N346-T360 VanDerWaalsContact O-CA 3.3Å; N346-T360 WeakPolarHBondContact O-CA 3.38Å; N346-L361 WeakPolarHBondContact CB-O 3.35Å; N346-L361 PolarHBondContact O-N 3.42Å; N346-L361 PolarHBondContact OD1-O 2.92Å
347	N	93.3	Very high	93.8	Very high	20 Å²	20	25.9 Å²	25.9	11%	0.107	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	118.7	-178.8	-76.3	-58.2	0	0	0	110.8	N341 D344 S345 W359 T360	N341-N347 HydrophobicContact CB-CB 3.91Å; N341-N347 WeakPolarHBondContact CB-O 2.95Å; N341-N347 PolarHBondContact N-O 2.82Å; D344-N347 PolarHBondContact O-N 3.13Å; D344-N347 PolarHBondContact OD2-ND2 2.97Å; S345-N347 PolarHBondContact O-N 3.25Å; N347-W359 CarbonylContact C-O 3.58Å; N347-W359 VanDerWaalsContact CA-O 3.31Å; N347-W359 WeakPolarHBondContact CA-O 3.41Å; N347-T360 PolarHBondContact OD1-OG1 2.94Å
348	I	95.6	Very high	93.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	138.4	-179.8	-56	-179.6	0	0	0	108.8	C304 L314 V316 V338 D339 F340 W359 F366	C304-I348 HydrophobicContact CB-CD1 4.44Å; L314-I348 HydrophobicContact CD2-CG2 4.32Å; V316-I348 HydrophobicContact CG2-CD1 3.69Å; V338-I348 HydrophobicContact CG2-CG2 3.62Å; D339-I348 WeakPolarHBondContact O-CA 3.3Å; F340-I348 HydrophobicContact CD1-CD1 3.99Å; F340-I348 HydrophobicContact CD1-CG1 3.62Å; F340-I348 HydrophobicContact CE1-CD1 3.46Å; F340-I348 VanDerWaalsContact CE1-CD1 3.46Å; F340-I348 HydrophobicContact CE1-CG1 3.65Å; F340-I348 HydrophobicContact CG-CG1 4.41Å; F340-I348 HydrophobicContact CZ-CD1 3.93Å; F340-I348 HydrophobicContact CZ-CG1 4.45Å; I348-W359 HydrophobicContact CB-CB 4.22Å; I348-W359 PolarHBondContact N-O 2.8Å; I348-W359 WeakPolarHBondContact O-CB 3.37Å; I348-W359 PolarHBondContact O-N 2.96Å; I348-F366 HydrophobicContact CD1-CE1 3.95Å; I348-F366 HydrophobicContact CD1-CZ 4.35Å
349	I	95.9	Very high	93.7	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.021	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	138.4	178.3	-65.1	61.1	0	0	0	108.2	V338 D339 V356 Y357 F358 F385 F387 V393	V338-I349 VanDerWaalsContact CA-O 3.31Å; V338-I349 WeakPolarHBondContact CA-O 3.37Å; D339-I349 PolarHBondContact N-O 3.49Å; D339-I349 VanDerWaalsContact N-O 3.11Å; D339-I349 PolarHBondContact O-N 3.4Å; I349-V356 HydrophobicContact CG2-CG1 4.33Å; I349-Y357 WeakPolarHBondContact CA-O 3.39Å; I349-F358 HydrophobicContact CG1-CD1 3.89Å; I349-F358 HydrophobicContact CG1-CE1 4.18Å; I349-F385 HydrophobicContact CB-CD2 4.37Å; I349-F385 HydrophobicContact CB-CE1 4.41Å; I349-F385 HydrophobicContact CB-CE2 3.62Å; I349-F385 HydrophobicContact CB-CZ 3.63Å; I349-F385 HydrophobicContact CG1-CE2 4.45Å; I349-F385 HydrophobicContact CG2-CD1 4.27Å; I349-F385 HydrophobicContact CG2-CD2 3.96Å; I349-F385 HydrophobicContact CG2-CE1 3.96Å; I349-F385 HydrophobicContact CG2-CE2 3.65Å; I349-F385 HydrophobicContact CG2-CG 4.25Å; I349-F385 HydrophobicContact CG2-CZ 3.63Å; I349-F385 WeakPolarHBondContact O-CZ 3.09Å; I349-F387 HydrophobicContact CD1-CE1 3.72Å; I349-F387 HydrophobicContact CD1-CZ 3.67Å; I349-F387 HydrophobicContact CG1-CE1 4.19Å; I349-F387 HydrophobicContact CG1-CZ 4.12Å; I349-V393 HydrophobicContact CG1-CG2 4.07Å; I349-V393 HydrophobicContact CG2-CG1 4.44Å
350	T	96.6	Very high	93.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	138.7	170.4	61.8	0	0	0	0	110.4	I306 L314 A337 V338 V356 Y357 W359	I306-T350 HydrophobicContact CD1-CG2 3.72Å; L314-T350 HydrophobicContact CD2-CG2 4.48Å; A337-T350 VanDerWaalsContact O-CA 3.31Å; A337-T350 WeakPolarHBondContact O-CA 3.36Å; V338-T350 HydrophobicContact CB-CG2 4.15Å; V338-T350 HydrophobicContact CG2-CG2 3.77Å; T350-V356 CarbonylContact O-C 3.59Å; T350-V356 WeakPolarHBondContact O-CA 3.41Å; T350-Y357 PolarHBondContact N-O 3.09Å; T350-Y357 PolarHBondContact O-N 3.27Å; T350-W359 PolarHBondContact OG1-NE1 3.1Å
351	C	95.8	Very high	93.6	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	157.6	174.4	82.6	0	0	0	0	112.4	F336 A337 H355 V356 I382 F385	F336-C351 PolarHBondContact N-O 2.8Å; A337-C351 PolarHBondContact N-O 3.07Å; A337-C351 PolarHBondContact O-N 2.78Å; C351-H355 WeakPolarHBondContact CA-O 3.42Å; C351-V356 HydrophobicContact CB-CG2 4.32Å; C351-I382 HydrophobicContact CB-CB 4.02Å; C351-I382 HydrophobicContact CB-CG2 3.62Å; C351-I382 PolarHBondContact SG-O 3.29Å; C351-F385 HydrophobicContact CB-CD1 4.14Å
352	G	95.3	Very high	93.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	176.6	-144.5	176.6	0	0	0	0	0	113.3	A334 S354 H355 I382	A334-G352 WeakPolarHBondContact O-CA 3.46Å; G352-S354 PolarHBondContact O-N 3.1Å; G352-S354 VanDerWaalsContact O-N 3.11Å; G352-H355 VanDerWaalsContact CA-CE1 3.41Å; G352-H355 WeakPolarHBondContact CA-CE1 3.02Å; G352-H355 PolarHBondContact N-CE1 3.29Å; G352-H355 PolarHBondContact N-NE2 3.36Å; G352-H355 PolarHBondContact N-O 2.92Å; G352-H355 VanDerWaalsContact N-O 3.1Å; G352-I382 WeakPolarHBondContact CA-O 3.47Å; G352-I382 PolarHBondContact N-O 3.5Å; G352-I382 PolarHBondContact O-N 3.48Å
353	K	94.8	Very high	93.4	Very high	68 Å²	68	30.9 Å²	30.9	30%	0.296	20%	0.195	S	C	.	.	B	Isolated β-bridge	trans	-62	116	179	-177.5	174.3	165.1	-149.1	0	110.1	E333 A334 H355 F381	E333-K353 HydrophobicContact CB-CB 4.32Å; E333-K353 IonicContact OE1-NZ 3.89Å; E333-K353 WeakPolarHBondContact OE2-CD 3.13Å; E333-K353 WeakPolarHBondContact OE2-CE 2.9Å; E333-K353 IonicContact OE2-NZ 3.82Å; E333-K353 PolarHBondContact OE2-NZ 3.3Å; A334-K353 PolarHBondContact O-N 3.07Å; K353-H355 PolarHBondContact O-N 3.09Å; K353-H355 VanDerWaalsContact O-N 3.09Å; K353-H355 PolarHBondContact O-ND1 2.92Å; K353-F381 HydrophobicContact CB-CD1 3.77Å; K353-F381 HydrophobicContact CB-CE1 3.9Å; K353-F381 HydrophobicContact CD-CE1 3.81Å; K353-F381 HydrophobicContact CG-CD1 3.87Å; K353-F381 HydrophobicContact CG-CE1 3.66Å
354	S	88.6	Confident	93.2	Very high	42 Å²	42	27.4 Å²	27.4	29%	0.294	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	24.6	177.9	-62.2	0	0	0	0	116.1	G352 K378 K380	G352-S354 PolarHBondContact O-N 3.1Å; G352-S354 VanDerWaalsContact O-N 3.11Å; S354-K378 WeakPolarHBondContact O-CE 3.3Å; S354-K378 PolarHBondContact O-NZ 2.91Å; S354-K380 PolarHBondContact N-O 2.89Å; S354-K380 PolarHBondContact OG-O 3.48Å
355	H	92.2	Very high	93.2	Very high	3 Å²	3	31.9 Å²	31.9	1%	0.014	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	150.2	-179.3	73.9	-87	0	0	0	114.8	A334 C351 G352 K353 Y357	A334-H355 PolarHBondContact O-CE1 2.91Å; C351-H355 WeakPolarHBondContact CA-O 3.42Å; G352-H355 VanDerWaalsContact CA-CE1 3.41Å; G352-H355 WeakPolarHBondContact CA-CE1 3.02Å; G352-H355 PolarHBondContact N-CE1 3.29Å; G352-H355 PolarHBondContact N-NE2 3.36Å; G352-H355 PolarHBondContact N-O 2.92Å; G352-H355 VanDerWaalsContact N-O 3.1Å; K353-H355 PolarHBondContact O-N 3.09Å; K353-H355 VanDerWaalsContact O-N 3.09Å; K353-H355 PolarHBondContact O-ND1 2.92Å; H355-Y357 HydrophobicContact CB-CD2 4.33Å; H355-Y357 HydrophobicContact CB-CE1 4.24Å; H355-Y357 HydrophobicContact CB-CE2 3.78Å; H355-Y357 AromaticContact CD2-CD2 3.49Å; H355-Y357 VanDerWaalsContact CD2-CD2 3.49Å; H355-Y357 WeakPolarHBondContact CD2-CD2 3.05Å; H355-Y357 AromaticContact CD2-CE2 3.53Å; H355-Y357 AromaticContact CG-CE2 3.75Å
356	V	95.4	Very high	93.3	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.006	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	120	159.9	-173	0	0	0	0	105.9	I349 T350 C351 F358 G371 I382 T395 W405	I349-V356 HydrophobicContact CG2-CG1 4.33Å; T350-V356 CarbonylContact O-C 3.59Å; T350-V356 WeakPolarHBondContact O-CA 3.41Å; C351-V356 HydrophobicContact CB-CG2 4.32Å; V356-F358 HydrophobicContact CG1-CE2 3.83Å; V356-F358 HydrophobicContact CG1-CZ 4.02Å; V356-G371 PolarHBondContact O-N 2.91Å; V356-I382 HydrophobicContact CG2-CB 4.19Å; V356-I382 HydrophobicContact CG2-CD1 4.35Å; V356-I382 HydrophobicContact CG2-CG1 3.71Å; V356-I382 HydrophobicContact CG2-CG2 4Å; V356-T395 HydrophobicContact CG1-CG2 4.45Å; V356-T395 HydrophobicContact CG2-CG2 4.35Å; V356-W405 HydrophobicContact CB-CZ2 4.34Å; V356-W405 HydrophobicContact CG2-CH2 4.44Å; V356-W405 HydrophobicContact CG2-CZ2 3.85Å
357	Y	95.5	Very high	93.3	Very high	24 Å²	24	32.2 Å²	32.2	9%	0.094	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	138.9	178.5	-60.1	-50.4	0	0	0	110.4	T331 I349 T350 H355 W359 K368 K369 Q370	T331-Y357 HydrophobicContact CG2-CE2 4.34Å; I349-Y357 WeakPolarHBondContact CA-O 3.39Å; T350-Y357 PolarHBondContact N-O 3.09Å; T350-Y357 PolarHBondContact O-N 3.27Å; H355-Y357 HydrophobicContact CB-CD2 4.33Å; H355-Y357 HydrophobicContact CB-CE1 4.24Å; H355-Y357 HydrophobicContact CB-CE2 3.78Å; H355-Y357 AromaticContact CD2-CD2 3.49Å; H355-Y357 VanDerWaalsContact CD2-CD2 3.49Å; H355-Y357 WeakPolarHBondContact CD2-CD2 3.05Å; H355-Y357 AromaticContact CD2-CE2 3.53Å; H355-Y357 AromaticContact CG-CE2 3.75Å; Y357-W359 AromaticContact CD2-CZ2 3.85Å; Y357-W359 HydrophobicContact CD2-CZ2 3.85Å; Y357-W359 HydrophobicContact CG-CZ2 4.14Å; Y357-K368 HydrophobicContact CD1-CD 3.89Å; Y357-K368 HydrophobicContact CD1-CG 4.1Å; Y357-K368 HydrophobicContact CD2-CD 4.4Å; Y357-K368 HydrophobicContact CE1-CD 4.09Å; Y357-K368 HydrophobicContact CG-CD 4.07Å; Y357-K368 HydrophobicContact CG-CG 4.29Å; Y357-K369 WeakPolarHBondContact CA-O 3.36Å; Y357-Q370 HydrophobicContact CD1-CB 4.05Å; Y357-Q370 HydrophobicContact CD1-CG 4.1Å; Y357-Q370 HydrophobicContact CE1-CB 4.05Å; Y357-Q370 HydrophobicContact CE1-CG 3.83Å
358	F	94.9	Very high	93.3	Very high	3 Å²	3	36.5 Å²	36.5	1%	0.013	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	109.3	174.9	-59	-98.1	0	0	0	106.7	I349 V356 K369 V393 W405 Y423	I349-F358 HydrophobicContact CG1-CD1 3.89Å; I349-F358 HydrophobicContact CG1-CE1 4.18Å; V356-F358 HydrophobicContact CG1-CE2 3.83Å; V356-F358 HydrophobicContact CG1-CZ 4.02Å; F358-K369 HydrophobicContact CB-CB 4.25Å; F358-K369 PolarHBondContact N-O 3.47Å; F358-K369 PolarHBondContact O-N 3.41Å; F358-V393 HydrophobicContact CE1-CB 4.23Å; F358-V393 HydrophobicContact CE1-CG2 3.89Å; F358-W405 HydrophobicContact CE2-CE3 4.41Å; F358-W405 HydrophobicContact CZ-CB 4.12Å; F358-W405 HydrophobicContact CZ-CD2 4.28Å; F358-W405 HydrophobicContact CZ-CE3 4.36Å; F358-W405 HydrophobicContact CZ-CG 4.2Å; F358-Y423 HydrophobicContact CB-CD2 3.8Å; F358-Y423 HydrophobicContact CB-CE2 3.59Å; F358-Y423 AromaticContact CD1-CD1 3.75Å; F358-Y423 HydrophobicContact CD1-CD1 3.75Å; F358-Y423 AromaticContact CD1-CD2 3.75Å; F358-Y423 HydrophobicContact CD1-CD2 3.75Å; F358-Y423 AromaticContact CD1-CE1 3.69Å; F358-Y423 HydrophobicContact CD1-CE1 3.69Å; F358-Y423 AromaticContact CD1-CE2 3.69Å; F358-Y423 HydrophobicContact CD1-CE2 3.69Å; F358-Y423 AromaticContact CD1-CG 3.76Å; F358-Y423 HydrophobicContact CD1-CG 3.76Å; F358-Y423 AromaticContact CD1-CZ 3.66Å; F358-Y423 AromaticContact CD2-CD2 3.6Å; F358-Y423 HydrophobicContact CD2-CD2 3.6Å; F358-Y423 HydrophobicContact CD2-CE2 4.24Å; F358-Y423 AromaticContact CD2-CG 3.75Å; F358-Y423 HydrophobicContact CD2-CG 3.75Å; F358-Y423 AromaticContact CE1-CD1 3.49Å; F358-Y423 HydrophobicContact CE1-CD1 3.49Å; F358-Y423 VanDerWaalsContact CE1-CD1 3.49Å; F358-Y423 HydrophobicContact CE1-CD2 4.18Å; F358-Y423 AromaticContact CE1-CE1 3.77Å; F358-Y423 HydrophobicContact CE1-CE1 3.77Å; F358-Y423 HydrophobicContact CE1-CE2 4.42Å; F358-Y423 AromaticContact CE1-CG 3.71Å; F358-Y423 HydrophobicContact CE1-CG 3.71Å; F358-Y423 VanDerWaalsContact CE2-CB 3.47Å; F358-Y423 HydrophobicContact CE2-CD1 4.32Å; F358-Y423 HydrophobicContact CE2-CD2 4.08Å; F358-Y423 AromaticContact CE2-CG 3.72Å; F358-Y423 HydrophobicContact CE2-CG 3.72Å; F358-Y423 HydrophobicContact CG-CD1 4.26Å; F358-Y423 AromaticContact CG-CD2 3.43Å; F358-Y423 HydrophobicContact CG-CD2 3.43Å; F358-Y423 VanDerWaalsContact CG-CD2 3.43Å; F358-Y423 HydrophobicContact CG-CE1 4.38Å; F358-Y423 AromaticContact CG-CE2 3.58Å; F358-Y423 HydrophobicContact CG-CE2 3.58Å; F358-Y423 AromaticContact CG-CG 3.79Å; F358-Y423 HydrophobicContact CG-CG 3.79Å; F358-Y423 AromaticContact CZ-CD1 3.81Å; F358-Y423 HydrophobicContact CZ-CD1 3.81Å; F358-Y423 HydrophobicContact CZ-CD2 4.35Å; F358-Y423 AromaticContact CZ-CG 3.7Å; F358-Y423 HydrophobicContact CZ-CG 3.7Å
359	W	95.3	Very high	93.2	Very high	1 Å²	1	38.8 Å²	38.8	0%	0.004	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	135.4	-177.9	-54.3	93.5	0	0	0	109.3	L314 I328 T330 N347 I348 T350 Y357 F366 T367 K368	L314-W359 HydrophobicContact CD2-CD2 4.36Å; L314-W359 HydrophobicContact CD2-CG 4.21Å; I328-W359 HydrophobicContact CD1-CZ3 3.88Å; I328-W359 HydrophobicContact CG1-CZ3 4.3Å; I328-W359 HydrophobicContact CG2-CE3 4.24Å; I328-W359 HydrophobicContact CG2-CH2 4.4Å; I328-W359 HydrophobicContact CG2-CZ3 3.96Å; T330-W359 HydrophobicContact CG2-CH2 4.41Å; T330-W359 HydrophobicContact CG2-CZ2 3.88Å; N347-W359 CarbonylContact C-O 3.58Å; N347-W359 VanDerWaalsContact CA-O 3.31Å; N347-W359 WeakPolarHBondContact CA-O 3.41Å; I348-W359 HydrophobicContact CB-CB 4.22Å; I348-W359 PolarHBondContact N-O 2.8Å; I348-W359 WeakPolarHBondContact O-CB 3.37Å; I348-W359 PolarHBondContact O-N 2.96Å; T350-W359 PolarHBondContact OG1-NE1 3.1Å; Y357-W359 AromaticContact CD2-CZ2 3.85Å; Y357-W359 HydrophobicContact CD2-CZ2 3.85Å; Y357-W359 HydrophobicContact CG-CZ2 4.14Å; W359-F366 HydrophobicContact CB-CD1 4.12Å; W359-F366 HydrophobicContact CE3-CB 4.22Å; W359-T367 CarbonylContact C-O 3.48Å; W359-T367 WeakPolarHBondContact CA-O 2.96Å; W359-K368 HydrophobicContact CE3-CB 3.81Å; W359-K368 HydrophobicContact CE3-CG 4.09Å; W359-K368 HydrophobicContact CH2-CB 4.17Å; W359-K368 HydrophobicContact CH2-CD 3.46Å; W359-K368 VanDerWaalsContact CH2-CD 3.46Å; W359-K368 HydrophobicContact CH2-CG 3.89Å; W359-K368 HydrophobicContact CZ2-CD 3.95Å; W359-K368 HydrophobicContact CZ2-CG 4.26Å; W359-K368 HydrophobicContact CZ3-CB 3.56Å; W359-K368 HydrophobicContact CZ3-CD 3.79Å; W359-K368 HydrophobicContact CZ3-CG 3.78Å
360	T	94.3	Very high	93	Very high	38 Å²	38	43.3 Å²	43.3	23%	0.233	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117.9	168.7	-52.6	0	0	0	0	108.9	N346 N347 T367	N346-T360 CarbonylContact O-C 3.53Å; N346-T360 VanDerWaalsContact O-CA 3.3Å; N346-T360 WeakPolarHBondContact O-CA 3.38Å; N347-T360 PolarHBondContact OD1-OG1 2.94Å; T360-T367 WeakPolarHBondContact CB-OG1 3.46Å; T360-T367 PolarHBondContact N-O 3.34Å; T360-T367 PolarHBondContact O-N 3.43Å; T360-T367 PolarHBondContact O-OG1 3.4Å; T360-T367 VanDerWaalsContact O-OG1 3.07Å
361	L	93.1	Very high	92.7	Very high	12 Å²	12	43.4 Å²	43.4	6%	0.063	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	119.9	175.4	-179.8	61.2	0	0	0	109	A326 N346 Q365 F366	A326-L361 HydrophobicContact CB-CD1 3.71Å; N346-L361 WeakPolarHBondContact CB-O 3.35Å; N346-L361 PolarHBondContact O-N 3.42Å; N346-L361 PolarHBondContact OD1-O 2.92Å; L361-Q365 WeakPolarHBondContact CA-O 3.28Å; L361-F366 HydrophobicContact CB-CD1 4.11Å; L361-F366 HydrophobicContact CB-CE1 3.84Å; L361-F366 HydrophobicContact CD1-CD1 4.16Å; L361-F366 HydrophobicContact CD1-CD2 4.24Å; L361-F366 HydrophobicContact CD1-CE1 3.95Å; L361-F366 HydrophobicContact CD1-CE2 4.07Å; L361-F366 HydrophobicContact CD1-CG 4.3Å; L361-F366 HydrophobicContact CD1-CZ 3.91Å; L361-F366 HydrophobicContact CD2-CE1 4.43Å; L361-F366 HydrophobicContact CD2-CZ 4.36Å; L361-F366 HydrophobicContact CG-CE1 4.29Å; L361-F366 HydrophobicContact CG-CZ 4.5Å
362	S	92.6	Very high	92.5	Very high	80 Å²	80	46.7 Å²	46.7	56%	0.559	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.9	127	175.4	-175.8	0	0	0	0	109.3	G364 Q365	S362-G364 PolarHBondContact O-N 3.19Å; S362-Q365 PolarHBondContact N-O 3.32Å; S362-Q365 PolarHBondContact O-N 2.78Å
363	A	87.4	Confident	92.1	Very high	106 Å²	106	47.7 Å²	47.7	88%	0.876	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	41.1	-178	0	0	0	0	0	113.9	Q365	A363-Q365 VanDerWaalsContact C-N 3.26Å; A363-Q365 PolarHBondContact O-N 3.28Å
364	G	86.2	Confident	91.6	Very high	31 Å²	31	47.5 Å²	47.5	32%	0.32	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.6	3.9	-179.5	0	0	0	0	0	115.2	S362	S362-G364 PolarHBondContact O-N 3.19Å
365	Q	90.5	Very high	91.5	Very high	149 Å²	149	54.1 Å²	54.1	70%	0.696	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.1	137.1	177.8	-65.3	-170.2	-18.9	0	0	111.8	L361 S362 A363	L361-Q365 WeakPolarHBondContact CA-O 3.28Å; S362-Q365 PolarHBondContact N-O 3.32Å; S362-Q365 PolarHBondContact O-N 2.78Å; A363-Q365 VanDerWaalsContact C-N 3.26Å; A363-Q365 PolarHBondContact O-N 3.28Å
366	F	93.8	Very high	91.3	Very high	21 Å²	21	57.4 Å²	57.4	9%	0.092	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	131	176.2	-76.4	-74.3	0	0	0	111.7	L314 V316 A326 I328 I348 W359 L361	L314-F366 HydrophobicContact CD2-CE1 4.16Å; L314-F366 HydrophobicContact CD2-CZ 4.28Å; L314-F366 HydrophobicContact CG-CZ 4.41Å; V316-F366 HydrophobicContact CG2-CZ 3.75Å; A326-F366 HydrophobicContact CB-CD2 4.26Å; A326-F366 HydrophobicContact CB-CE2 3.58Å; A326-F366 HydrophobicContact CB-CZ 4.21Å; I328-F366 HydrophobicContact CB-CB 4.04Å; I328-F366 HydrophobicContact CB-CD2 3.69Å; I328-F366 HydrophobicContact CB-CG 4.15Å; I328-F366 HydrophobicContact CD1-CB 3.54Å; I328-F366 HydrophobicContact CG1-CB 4.38Å; I328-F366 HydrophobicContact CG2-CB 3.79Å; I328-F366 HydrophobicContact CG2-CD1 4.41Å; I328-F366 HydrophobicContact CG2-CD2 3.41Å; I328-F366 VanDerWaalsContact CG2-CD2 3.41Å; I328-F366 HydrophobicContact CG2-CE2 4.03Å; I328-F366 HydrophobicContact CG2-CG 3.62Å; I348-F366 HydrophobicContact CD1-CE1 3.95Å; I348-F366 HydrophobicContact CD1-CZ 4.35Å; W359-F366 HydrophobicContact CB-CD1 4.12Å; W359-F366 HydrophobicContact CE3-CB 4.22Å; L361-F366 HydrophobicContact CB-CD1 4.11Å; L361-F366 HydrophobicContact CB-CE1 3.84Å; L361-F366 HydrophobicContact CD1-CD1 4.16Å; L361-F366 HydrophobicContact CD1-CD2 4.24Å; L361-F366 HydrophobicContact CD1-CE1 3.95Å; L361-F366 HydrophobicContact CD1-CE2 4.07Å; L361-F366 HydrophobicContact CD1-CG 4.3Å; L361-F366 HydrophobicContact CD1-CZ 3.91Å; L361-F366 HydrophobicContact CD2-CE1 4.43Å; L361-F366 HydrophobicContact CD2-CZ 4.36Å; L361-F366 HydrophobicContact CG-CE1 4.29Å; L361-F366 HydrophobicContact CG-CZ 4.5Å
367	T	93.1	Very high	90.9	Very high	74 Å²	74	65.1 Å²	65.1	45%	0.454	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	126.9	168.6	58.4	0	0	0	0	109.9	W359 T360	W359-T367 CarbonylContact C-O 3.48Å; W359-T367 WeakPolarHBondContact CA-O 2.96Å; T360-T367 WeakPolarHBondContact CB-OG1 3.46Å; T360-T367 PolarHBondContact N-O 3.34Å; T360-T367 PolarHBondContact O-N 3.43Å; T360-T367 PolarHBondContact O-OG1 3.4Å; T360-T367 VanDerWaalsContact O-OG1 3.07Å
368	K	92.8	Very high	90.5	Very high	110 Å²	110	68.6 Å²	68.6	48%	0.478	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	129.5	-176.9	-173	173.1	68.5	-177.7	0	111.3	Y357 W359	Y357-K368 HydrophobicContact CD1-CD 3.89Å; Y357-K368 HydrophobicContact CD1-CG 4.1Å; Y357-K368 HydrophobicContact CD2-CD 4.4Å; Y357-K368 HydrophobicContact CE1-CD 4.09Å; Y357-K368 HydrophobicContact CG-CD 4.07Å; Y357-K368 HydrophobicContact CG-CG 4.29Å; W359-K368 HydrophobicContact CE3-CB 3.81Å; W359-K368 HydrophobicContact CE3-CG 4.09Å; W359-K368 HydrophobicContact CH2-CB 4.17Å; W359-K368 HydrophobicContact CH2-CD 3.46Å; W359-K368 VanDerWaalsContact CH2-CD 3.46Å; W359-K368 HydrophobicContact CH2-CG 3.89Å; W359-K368 HydrophobicContact CZ2-CD 3.95Å; W359-K368 HydrophobicContact CZ2-CG 4.26Å; W359-K368 HydrophobicContact CZ3-CB 3.56Å; W359-K368 HydrophobicContact CZ3-CD 3.79Å; W359-K368 HydrophobicContact CZ3-CG 3.78Å
369	K	92.5	Very high	90.4	Very high	48 Å²	48	68.6 Å²	68.6	21%	0.209	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	130.3	164	-64.5	179.9	179.9	-173.9	0	109.4	Y357 F358 E421 Y423	Y357-K369 WeakPolarHBondContact CA-O 3.36Å; F358-K369 HydrophobicContact CB-CB 4.25Å; F358-K369 PolarHBondContact N-O 3.47Å; F358-K369 PolarHBondContact O-N 3.41Å; K369-E421 WeakPolarHBondContact CD-O 3.43Å; K369-E421 WeakPolarHBondContact CE-O 3.27Å; K369-E421 PolarHBondContact NZ-O 3.1Å; K369-E421 IonicContact NZ-OE2 2.83Å; K369-Y423 HydrophobicContact CD-CE2 4.24Å
370	Q	92	Very high	90.4	Very high	99 Å²	99	74.8 Å²	74.8	46%	0.463	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	136.2	178.1	-177.9	173.6	-24.6	0	0	110.8	Y357 I372	Y357-Q370 HydrophobicContact CD1-CB 4.05Å; Y357-Q370 HydrophobicContact CD1-CG 4.1Å; Y357-Q370 HydrophobicContact CE1-CB 4.05Å; Y357-Q370 HydrophobicContact CE1-CG 3.83Å; Q370-I372 PolarHBondContact O-N 3.44Å
371	G	91.1	Very high	90.5	Very high	2 Å²	2	75.4 Å²	75.4	2%	0.021	40%	0.397	C	S	.	.			trans	-61.2	129.9	171.7	0	0	0	0	0	111.5	V356	V356-G371 PolarHBondContact O-N 2.91Å
372	I	90.1	Very high	90.6	Very high	69 Å²	69	74.8 Å²	74.8	35%	0.354	39%	0.394	S	S	.	.	B	Isolated β-bridge	trans	-98.4	112.4	-179.3	-58.1	175.8	0	0	0	109	Q370 G374 T422 Y423 Q424	Q370-I372 PolarHBondContact O-N 3.44Å; I372-G374 PolarHBondContact O-N 3.16Å; I372-T422 HydrophobicContact CD1-CG2 3.94Å; I372-Y423 PolarHBondContact N-O 2.8Å; I372-Q424 HydrophobicContact CB-CG 4.02Å; I372-Q424 HydrophobicContact CG2-CG 4.32Å
373	F	87.3	Confident	90.7	Very high	21 Å²	21	72.1 Å²	72.1	9%	0.092	37%	0.373	C	S	.	.			trans	-72.1	-19.4	176.6	-70.2	-96.1	0	0	0	112.8	K375 Y376 K378 P379 I382 L403 W405 I425	F373-K375 PolarHBondContact O-N 2.92Å; F373-Y376 WeakPolarHBondContact O-CB 3.22Å; F373-Y376 WeakPolarHBondContact O-CD2 3.36Å; F373-Y376 PolarHBondContact O-N 3.38Å; F373-Y376 VanDerWaalsContact O-N 3.13Å; F373-K378 HydrophobicContact CD2-CD 4.49Å; F373-K378 HydrophobicContact CD2-CG 4.09Å; F373-K378 HydrophobicContact CE2-CG 4.06Å; F373-K378 HydrophobicContact CG-CB 4.45Å; F373-K378 HydrophobicContact CG-CG 4.37Å; F373-K378 HydrophobicContact CZ-CG 4.33Å; F373-P379 HydrophobicContact CE1-CG 3.83Å; F373-P379 HydrophobicContact CZ-CG 4.33Å; F373-I382 HydrophobicContact CE1-CD1 4.32Å; F373-I382 HydrophobicContact CZ-CD1 4.19Å; F373-L403 HydrophobicContact CE1-CD1 4.02Å; F373-W405 HydrophobicContact CD1-CH2 4.19Å; F373-W405 HydrophobicContact CD2-CH2 4.11Å; F373-W405 AromaticContact CE1-CH2 3.89Å; F373-W405 HydrophobicContact CE1-CH2 3.89Å; F373-W405 AromaticContact CE1-CZ2 3.97Å; F373-W405 HydrophobicContact CE1-CZ2 3.97Å; F373-W405 AromaticContact CE2-CH2 3.85Å; F373-W405 HydrophobicContact CE2-CH2 3.85Å; F373-W405 HydrophobicContact CE2-CZ2 4.48Å; F373-W405 HydrophobicContact CG-CH2 4.27Å; F373-W405 AromaticContact CZ-CH2 3.72Å; F373-W405 HydrophobicContact CZ-CH2 3.72Å; F373-W405 AromaticContact CZ-CZ2 3.92Å; F373-W405 HydrophobicContact CZ-CZ2 3.92Å; F373-I425 HydrophobicContact CB-CD1 4.16Å; F373-I425 HydrophobicContact CD1-CD1 3.4Å; F373-I425 HydrophobicContact CE1-CD1 3.98Å; F373-I425 HydrophobicContact CG-CD1 4.03Å
374	G	84.8	Confident	91.1	Very high	63 Å²	63	67.8 Å²	67.8	65%	0.649	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	-125	179	0	0	0	0	0	111.7	I372 Y376	I372-G374 PolarHBondContact O-N 3.16Å; G374-Y376 VanDerWaalsContact C-N 3.27Å; G374-Y376 PolarHBondContact O-N 3.21Å
375	K	86	Confident	91.6	Very high	181 Å²	181	67.1 Å²	67.1	79%	0.787	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-9.8	179.4	66.2	-177.9	178	-176.7	0	114.5	F373	F373-K375 PolarHBondContact O-N 2.92Å
376	Y	88.6	Confident	91.8	Very high	73 Å²	73	60.9 Å²	60.9	29%	0.286	30%	0.296	S	S	.	.	S	Bend	trans	-86.1	142.5	-175.4	-58	-68.7	0	0	0	111	F373 G374 K378 I425 P428	F373-Y376 WeakPolarHBondContact O-CB 3.22Å; F373-Y376 WeakPolarHBondContact O-CD2 3.36Å; F373-Y376 PolarHBondContact O-N 3.38Å; F373-Y376 VanDerWaalsContact O-N 3.13Å; G374-Y376 VanDerWaalsContact C-N 3.27Å; G374-Y376 PolarHBondContact O-N 3.21Å; Y376-K378 PolarHBondContact O-N 3.21Å; Y376-I425 HydrophobicContact CD2-CB 3.96Å; Y376-I425 HydrophobicContact CD2-CD1 4.36Å; Y376-I425 HydrophobicContact CD2-CG2 3.93Å; Y376-I425 HydrophobicContact CE2-CB 4.2Å; Y376-I425 HydrophobicContact CE2-CG2 3.99Å; Y376-P428 HydrophobicContact CD1-CG 3.49Å; Y376-P428 VanDerWaalsContact CD1-CG 3.49Å; Y376-P428 HydrophobicContact CD2-CG 4.11Å; Y376-P428 HydrophobicContact CE1-CG 3.58Å; Y376-P428 HydrophobicContact CE2-CG 4.21Å; Y376-P428 HydrophobicContact CG-CG 3.77Å
377	K	86.5	Confident	91.8	Very high	163 Å²	163	60.6 Å²	60.6	71%	0.709	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-58.3	128	175.5	-177.4	-174.4	175.5	-166.2	0	109.2	P379 E399	K377-P379 WeakPolarHBondContact O-CD 3.41Å; K377-E399 IonicContact NZ-OE2 3.81Å
378	K	88.6	Confident	91.6	Very high	97 Å²	97	58.4 Å²	58.4	42%	0.422	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-69.5	120	175.6	-172.8	177.5	179.7	-177.5	0	109.7	S354 F373 Y376	S354-K378 WeakPolarHBondContact O-CE 3.3Å; S354-K378 PolarHBondContact O-NZ 2.91Å; F373-K378 HydrophobicContact CD2-CD 4.49Å; F373-K378 HydrophobicContact CD2-CG 4.09Å; F373-K378 HydrophobicContact CE2-CG 4.06Å; F373-K378 HydrophobicContact CG-CB 4.45Å; F373-K378 HydrophobicContact CG-CG 4.37Å; F373-K378 HydrophobicContact CZ-CG 4.33Å; Y376-K378 PolarHBondContact O-N 3.21Å
379	P	91.8	Very high	91.1	Very high	3 Å²	3	59.6 Å²	59.6	2%	0.019	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-71.4	156.4	176.9	31.5	-34.6	0	0	0	110.6	F373 K377 I382 D397 E399	F373-P379 HydrophobicContact CE1-CG 3.83Å; F373-P379 HydrophobicContact CZ-CG 4.33Å; K377-P379 WeakPolarHBondContact O-CD 3.41Å; P379-I382 HydrophobicContact CG-CD1 3.4Å; P379-I382 HydrophobicContact CG-CG1 4.39Å; P379-D397 HydrophobicContact CB-CB 3.75Å; P379-D397 HydrophobicContact CG-CB 3.76Å; P379-E399 HydrophobicContact CB-CG 4.18Å
380	K	94.8	Very high	90.7	Very high	130 Å²	130	62.6 Å²	62.6	57%	0.565	32%	0.316	S	S	*	.	S	Bend	trans	-68.4	-38.4	180	-172.1	177.6	177.2	179.5	0	111.6	S354 S398	S354-K380 PolarHBondContact N-O 2.89Å; S354-K380 PolarHBondContact OG-O 3.48Å; K380-S398 PolarHBondContact N-OG 2.74Å
381	F	96.1	Very high	90.2	Very high	51 Å²	51	59 Å²	59	22%	0.224	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-134.8	143.9	178.8	-55	-79	0	0	0	111.4	F336 K353 D397 S398	F336-F381 HydrophobicContact CE2-CB 3.97Å; F336-F381 AromaticContact CE2-CD1 3.52Å; F336-F381 HydrophobicContact CE2-CD1 3.52Å; F336-F381 HydrophobicContact CE2-CE1 4.33Å; F336-F381 HydrophobicContact CE2-CG 4.06Å; F336-F381 AromaticContact CZ-CD1 3.7Å; F336-F381 HydrophobicContact CZ-CD1 3.7Å; F336-F381 HydrophobicContact CZ-CE1 4.07Å; K353-F381 HydrophobicContact CB-CD1 3.77Å; K353-F381 HydrophobicContact CB-CE1 3.9Å; K353-F381 HydrophobicContact CD-CE1 3.81Å; K353-F381 HydrophobicContact CG-CD1 3.87Å; K353-F381 HydrophobicContact CG-CE1 3.66Å; F381-D397 CarbonylContact O-C 3.6Å; F381-D397 WeakPolarHBondContact O-CA 3.44Å; F381-S398 PolarHBondContact N-OG 3.08Å; F381-S398 PolarHBondContact O-N 3.12Å
382	I	96.6	Very high	90.1	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	109.8	162.5	-54	-67.4	0	0	0	106.5	F336 C351 G352 V356 F373 P379 T395 D397 L403	F336-I382 WeakPolarHBondContact CD2-O 3.11Å; C351-I382 HydrophobicContact CB-CB 4.02Å; C351-I382 HydrophobicContact CB-CG2 3.62Å; C351-I382 PolarHBondContact SG-O 3.29Å; G352-I382 WeakPolarHBondContact CA-O 3.47Å; G352-I382 PolarHBondContact N-O 3.5Å; G352-I382 PolarHBondContact O-N 3.48Å; V356-I382 HydrophobicContact CG2-CB 4.19Å; V356-I382 HydrophobicContact CG2-CD1 4.35Å; V356-I382 HydrophobicContact CG2-CG1 3.71Å; V356-I382 HydrophobicContact CG2-CG2 4Å; F373-I382 HydrophobicContact CE1-CD1 4.32Å; F373-I382 HydrophobicContact CZ-CD1 4.19Å; P379-I382 HydrophobicContact CG-CD1 3.4Å; P379-I382 HydrophobicContact CG-CG1 4.39Å; I382-T395 HydrophobicContact CG2-CG2 4.06Å; I382-D397 HydrophobicContact CD1-CB 3.82Å; I382-L403 HydrophobicContact CD1-CD1 4.22Å
383	H	94.9	Very high	90.3	Very high	24 Å²	24	59 Å²	59	11%	0.111	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-38.1	-167.4	-76.1	-63.5	0	0	0	113.7	F336 G396 V436 F437	F336-H383 AromaticContact CD2-ND1 3.97Å; F336-H383 AromaticContact CE2-ND1 3.89Å; H383-G396 PolarHBondContact N-O 3.38Å; H383-V436 WeakPolarHBondContact CB-O 3.34Å; H383-F437 HydrophobicContact CB-CD1 4.28Å; H383-F437 AromaticContact CE1-CE1 3.66Å; H383-F437 AromaticContact CG-CD1 3.8Å; H383-F437 AromaticContact ND1-CD1 3.86Å; H383-F437 AromaticContact ND1-CE1 3.86Å; H383-F437 AromaticContact NE2-CE1 3.79Å
384	C	95.4	Very high	90.8	Very high	15 Å²	15	58.5 Å²	58.5	10%	0.101	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	163.4	-174.8	60	0	0	0	0	110.2	T395 G396 V436	C384-T395 WeakPolarHBondContact O-CA 3.43Å; C384-G396 PolarHBondContact O-N 2.89Å; C384-V436 PolarHBondContact SG-O 3.09Å
385	F	96.3	Very high	91.4	Very high	17 Å²	17	55.5 Å²	55.5	8%	0.075	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	160.2	170	73.6	-87.7	0	0	0	110.9	A337 D339 I349 C351 F387 V393 L394 T395	A337-F385 HydrophobicContact CB-CD1 3.83Å; A337-F385 HydrophobicContact CB-CE1 3.67Å; D339-F385 HydrophobicContact CB-CE2 3.69Å; D339-F385 HydrophobicContact CB-CZ 3.47Å; D339-F385 VanDerWaalsContact CB-CZ 3.47Å; I349-F385 HydrophobicContact CB-CD2 4.37Å; I349-F385 HydrophobicContact CB-CE1 4.41Å; I349-F385 HydrophobicContact CB-CE2 3.62Å; I349-F385 HydrophobicContact CB-CZ 3.63Å; I349-F385 HydrophobicContact CG1-CE2 4.45Å; I349-F385 HydrophobicContact CG2-CD1 4.27Å; I349-F385 HydrophobicContact CG2-CD2 3.96Å; I349-F385 HydrophobicContact CG2-CE1 3.96Å; I349-F385 HydrophobicContact CG2-CE2 3.65Å; I349-F385 HydrophobicContact CG2-CG 4.25Å; I349-F385 HydrophobicContact CG2-CZ 3.63Å; I349-F385 WeakPolarHBondContact O-CZ 3.09Å; C351-F385 HydrophobicContact CB-CD1 4.14Å; F385-F387 HydrophobicContact CD2-CE2 4.42Å; F385-F387 AromaticContact CE2-CE2 3.82Å; F385-F387 HydrophobicContact CE2-CE2 3.82Å; F385-F387 AromaticContact CE2-CZ 3.89Å; F385-F387 HydrophobicContact CE2-CZ 3.89Å; F385-V393 HydrophobicContact CB-CG1 4.27Å; F385-V393 HydrophobicContact CD2-CG1 4.08Å; F385-V393 HydrophobicContact CG-CG1 4.49Å; F385-L394 CarbonylContact C-O 3.6Å; F385-L394 WeakPolarHBondContact CA-O 3.34Å; F385-L394 WeakPolarHBondContact CB-O 3.26Å; F385-T395 HydrophobicContact CB-CG2 3.76Å
386	V	95.5	Very high	91.9	Very high	17 Å²	17	46.9 Å²	46.9	10%	0.103	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	165.1	174.3	-68.3	0	0	0	0	109.7	L394 L439 T441 L447	V386-L394 HydrophobicContact CG2-CB 4.07Å; V386-L394 HydrophobicContact CG2-CD1 4.5Å; V386-L394 PolarHBondContact N-O 2.77Å; V386-L394 PolarHBondContact O-N 3.43Å; V386-L439 HydrophobicContact CB-CB 4.44Å; V386-L439 HydrophobicContact CG1-CB 3.8Å; V386-L439 VanDerWaalsContact CG1-O 3.3Å; V386-L439 WeakPolarHBondContact CG1-O 3.19Å; V386-L439 HydrophobicContact CG2-CB 3.8Å; V386-L439 HydrophobicContact CG2-CD1 4.17Å; V386-T441 HydrophobicContact CB-CG2 4.05Å; V386-T441 HydrophobicContact CG2-CG2 3.82Å; V386-L447 HydrophobicContact CG2-CD1 3.71Å
387	F	93	Very high	92.3	Very high	15 Å²	15	43.5 Å²	43.5	7%	0.066	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	132.8	172.8	-59	-90.4	0	0	0	110.2	D339 F340 N341 P342 I349 F385 D392 V393 T441	D339-F387 HydrophobicContact CB-CE2 4.07Å; F340-F387 WeakPolarHBondContact O-CE2 3.45Å; F340-F387 WeakPolarHBondContact O-CZ 3.4Å; N341-F387 HydrophobicContact CB-CE1 4.13Å; N341-F387 HydrophobicContact CB-CZ 4.38Å; P342-F387 VanDerWaalsContact CD-CD2 3.44Å; P342-F387 VanDerWaalsContact CD-CG 3.41Å; P342-F387 HydrophobicContact CG-CB 3.94Å; P342-F387 HydrophobicContact CG-CD2 3.74Å; P342-F387 HydrophobicContact CG-CE2 4.38Å; P342-F387 HydrophobicContact CG-CG 3.83Å; I349-F387 HydrophobicContact CD1-CE1 3.72Å; I349-F387 HydrophobicContact CD1-CZ 3.67Å; I349-F387 HydrophobicContact CG1-CE1 4.19Å; I349-F387 HydrophobicContact CG1-CZ 4.12Å; F385-F387 HydrophobicContact CD2-CE2 4.42Å; F385-F387 AromaticContact CE2-CE2 3.82Å; F385-F387 HydrophobicContact CE2-CE2 3.82Å; F385-F387 AromaticContact CE2-CZ 3.89Å; F385-F387 HydrophobicContact CE2-CZ 3.89Å; F387-D392 CarbonylContact C-O 3.55Å; F387-D392 WeakPolarHBondContact CA-O 3.36Å; F387-V393 HydrophobicContact CD1-CG2 3.89Å; F387-V393 HydrophobicContact CE1-CG2 3.7Å; F387-T441 WeakPolarHBondContact O-CG2 2.98Å
388	S	88.9	Confident	92.7	Very high	29 Å²	29	36.4 Å²	36.4	20%	0.203	19%	0.194	C	C	.	.			trans	-68.4	168.9	168.3	69.6	0	0	0	0	111	T390 G391 D392	S388-T390 PolarHBondContact O-N 2.73Å; S388-T390 PolarHBondContact OG-N 3.25Å; S388-T390 PolarHBondContact OG-OG1 3.02Å; S388-G391 PolarHBondContact O-N 3.41Å; S388-G391 PolarHBondContact OG-N 2.96Å; S388-D392 PolarHBondContact N-O 3.4Å; S388-D392 WeakPolarHBondContact OG-CB 3.33Å; S388-D392 PolarHBondContact OG-N 3.37Å; S388-D392 PolarHBondContact OG-O 2.73Å
389	L	83.2	Confident	93.1	Very high	135 Å²	135	35.7 Å²	35.7	71%	0.707	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-26.5	171.6	-70.4	178.8	0	0	0	113.2	G391	L389-G391 VanDerWaalsContact C-N 3.26Å
390	T	82.7	Confident	93.3	Very high	110 Å²	110	35.5 Å²	35.5	68%	0.675	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-7.3	176	54	0	0	0	0	112.9	S388 D392	S388-T390 PolarHBondContact O-N 2.73Å; S388-T390 PolarHBondContact OG-N 3.25Å; S388-T390 PolarHBondContact OG-OG1 3.02Å; T390-D392 PolarHBondContact OG1-OD2 2.99Å
391	G	82.6	Confident	93.4	Very high	24 Å²	24	31 Å²	31	25%	0.247	17%	0.172	C	C	.	.	S	Bend	trans	84.6	8.5	-176.9	0	0	0	0	0	114.4	S388 L389	S388-G391 PolarHBondContact O-N 3.41Å; S388-G391 PolarHBondContact OG-N 2.96Å; L389-G391 VanDerWaalsContact C-N 3.26Å
392	D	88.8	Confident	93.4	Very high	65 Å²	65	28.5 Å²	28.5	35%	0.348	16%	0.162	S	C	.	.			trans	-74.9	146.8	173.4	-61.5	-52.6	0	0	0	110.3	F387 S388 T390	F387-D392 CarbonylContact C-O 3.55Å; F387-D392 WeakPolarHBondContact CA-O 3.36Å; S388-D392 PolarHBondContact N-O 3.4Å; S388-D392 WeakPolarHBondContact OG-CB 3.33Å; S388-D392 PolarHBondContact OG-N 3.37Å; S388-D392 PolarHBondContact OG-O 2.73Å; T390-D392 PolarHBondContact OG1-OD2 2.99Å
393	V	94.9	Very high	93.4	Very high	5 Å²	5	28.8 Å²	28.8	3%	0.03	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	127.3	179.6	178.8	0	0	0	0	108.9	I349 F358 F385 F387 T395 W405	I349-V393 HydrophobicContact CG1-CG2 4.07Å; I349-V393 HydrophobicContact CG2-CG1 4.44Å; F358-V393 HydrophobicContact CE1-CB 4.23Å; F358-V393 HydrophobicContact CE1-CG2 3.89Å; F385-V393 HydrophobicContact CB-CG1 4.27Å; F385-V393 HydrophobicContact CD2-CG1 4.08Å; F385-V393 HydrophobicContact CG-CG1 4.49Å; F387-V393 HydrophobicContact CD1-CG2 3.89Å; F387-V393 HydrophobicContact CE1-CG2 3.7Å; V393-T395 HydrophobicContact CG1-CG2 4.07Å; V393-W405 HydrophobicContact CB-CB 4.2Å; V393-W405 PolarHBondContact N-O 2.81Å; V393-W405 WeakPolarHBondContact O-CB 3.41Å; V393-W405 VanDerWaalsContact O-CD1 3.3Å; V393-W405 PolarHBondContact O-N 3.4Å
394	L	96.3	Very high	93.4	Very high	11 Å²	11	28.5 Å²	28.5	6%	0.058	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	123.8	174.4	-54	-178.5	0	0	0	108.6	F385 V386 I402 P404 L439 L447 L464	F385-L394 CarbonylContact C-O 3.6Å; F385-L394 WeakPolarHBondContact CA-O 3.34Å; F385-L394 WeakPolarHBondContact CB-O 3.26Å; V386-L394 HydrophobicContact CG2-CB 4.07Å; V386-L394 HydrophobicContact CG2-CD1 4.5Å; V386-L394 PolarHBondContact N-O 2.77Å; V386-L394 PolarHBondContact O-N 3.43Å; L394-I402 HydrophobicContact CB-CG2 4.49Å; L394-P404 HydrophobicContact CD2-CB 3.65Å; L394-P404 HydrophobicContact CD2-CG 4.05Å; L394-L439 HydrophobicContact CB-CD1 4.49Å; L394-L447 HydrophobicContact CD1-CD2 3.99Å; L394-L464 HydrophobicContact CD1-CD2 4.04Å; L394-L464 HydrophobicContact CD2-CD1 4.14Å
395	T	97.3	Very high	93.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	141.7	180	64.9	0	0	0	0	112.2	V356 I382 C384 F385 V393 I402 L403 W405	V356-T395 HydrophobicContact CG1-CG2 4.45Å; V356-T395 HydrophobicContact CG2-CG2 4.35Å; I382-T395 HydrophobicContact CG2-CG2 4.06Å; C384-T395 WeakPolarHBondContact O-CA 3.43Å; F385-T395 HydrophobicContact CB-CG2 3.76Å; V393-T395 HydrophobicContact CG1-CG2 4.07Å; T395-I402 CarbonylContact O-C 3.59Å; T395-I402 WeakPolarHBondContact O-CA 3.43Å; T395-L403 PolarHBondContact N-O 3.18Å; T395-L403 PolarHBondContact O-N 3.2Å; T395-L403 WeakPolarHBondContact OG1-CB 3.26Å; T395-L403 PolarHBondContact OG1-O 2.83Å; T395-W405 PolarHBondContact OG1-NE1 3.18Å
396	G	97.1	Very high	92.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.2	169.8	0	0	0	0	0	111.8	H383 C384	H383-G396 PolarHBondContact N-O 3.38Å; C384-G396 PolarHBondContact O-N 2.89Å
397	D	96.5	Very high	92.3	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.016	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	174.7	-174.9	80.3	12.3	0	0	0	114.8	P379 F381 I382 E399 G400 N401 L403 S435 V436	P379-D397 HydrophobicContact CB-CB 3.75Å; P379-D397 HydrophobicContact CG-CB 3.76Å; F381-D397 CarbonylContact O-C 3.6Å; F381-D397 WeakPolarHBondContact O-CA 3.44Å; I382-D397 HydrophobicContact CD1-CB 3.82Å; D397-E399 VanDerWaalsContact C-N 3.27Å; D397-E399 PolarHBondContact O-N 2.93Å; D397-E399 WeakPolarHBondContact OD1-CA 3.43Å; D397-E399 PolarHBondContact OD1-N 2.74Å; D397-G400 PolarHBondContact OD1-N 2.88Å; D397-N401 PolarHBondContact N-O 2.82Å; D397-N401 PolarHBondContact OD1-N 2.75Å; D397-N401 PolarHBondContact OD1-ND2 2.75Å; D397-N401 WeakPolarHBondContact OD2-CB 3.26Å; D397-N401 PolarHBondContact OD2-ND2 2.91Å; D397-L403 HydrophobicContact CB-CD1 4.31Å; D397-S435 WeakPolarHBondContact O-CA 3.38Å; D397-V436 PolarHBondContact O-N 3.42Å
398	S	96.5	Very high	91.6	Very high	14 Å²	14	34.6 Å²	34.6	10%	0.098	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.7	178.5	59.5	0	0	0	0	114.6	K380 F381 S435	K380-S398 PolarHBondContact N-OG 2.74Å; F381-S398 PolarHBondContact N-OG 3.08Å; F381-S398 PolarHBondContact O-N 3.12Å; S398-S435 WeakPolarHBondContact CA-OG 3.26Å; S398-S435 WeakPolarHBondContact O-CA 3.38Å; S398-S435 PolarHBondContact O-N 3.16Å; S398-S435 PolarHBondContact O-OG 2.77Å
399	E	95.7	Very high	90.5	Very high	81 Å²	81	37.3 Å²	37.3	38%	0.379	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	0.7	-176.2	-54.7	-66.2	119.1	0	0	112	K377 P379 D397 K430	K377-E399 IonicContact NZ-OE2 3.81Å; P379-E399 HydrophobicContact CB-CG 4.18Å; D397-E399 VanDerWaalsContact C-N 3.27Å; D397-E399 PolarHBondContact O-N 2.93Å; D397-E399 WeakPolarHBondContact OD1-CA 3.43Å; D397-E399 PolarHBondContact OD1-N 2.74Å; E399-K430 PolarHBondContact O-NZ 3.28Å
400	G	96.3	Very high	89.4	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	85.1	25.4	178.4	0	0	0	0	0	114.8	D397 A431 H432 G434	D397-G400 PolarHBondContact OD1-N 2.88Å; G400-A431 PolarHBondContact O-N 3.18Å; G400-H432 PolarHBondContact O-N 3.47Å; G400-G434 WeakPolarHBondContact CA-O 3.3Å; G400-G434 PolarHBondContact N-O 2.81Å
401	N	96.9	Very high	87.9	Confident	34 Å²	34	30.4 Å²	30.4	18%	0.182	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	146.1	176.6	-45.3	-60.1	0	0	0	111.8	D397 L403 I429 K430	D397-N401 PolarHBondContact N-O 2.82Å; D397-N401 PolarHBondContact OD1-N 2.75Å; D397-N401 PolarHBondContact OD1-ND2 2.75Å; D397-N401 WeakPolarHBondContact OD2-CB 3.26Å; D397-N401 PolarHBondContact OD2-ND2 2.91Å; N401-L403 HydrophobicContact CB-CD2 3.84Å; N401-L403 HydrophobicContact CB-CG 4.45Å; N401-I429 CarbonylContact C-O 3.58Å; N401-I429 WeakPolarHBondContact CA-O 3.37Å; N401-K430 WeakPolarHBondContact OD1-CD 3.4Å
402	I	97.1	Very high	86.5	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	124.5	160	-61	170.4	0	0	0	106.9	L394 T395 I429 A431 L439 L447 W460	L394-I402 HydrophobicContact CB-CG2 4.49Å; T395-I402 CarbonylContact O-C 3.59Å; T395-I402 WeakPolarHBondContact O-CA 3.43Å; I402-I429 HydrophobicContact CB-CB 4.36Å; I402-I429 PolarHBondContact N-O 3.49Å; I402-I429 PolarHBondContact O-N 2.82Å; I402-A431 HydrophobicContact CD1-CB 3.74Å; I402-A431 HydrophobicContact CG1-CB 3.78Å; I402-L439 HydrophobicContact CD1-CD2 4.19Å; I402-L439 HydrophobicContact CG1-CD2 4.24Å; I402-L447 HydrophobicContact CD1-CD2 4.05Å; I402-L447 HydrophobicContact CG2-CD2 4.47Å; I402-W460 HydrophobicContact CD1-CD2 4.33Å; I402-W460 HydrophobicContact CD1-CZ2 4.14Å
403	L	95.7	Very high	84.8	Confident	5 Å²	5	40.4 Å²	40.4	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	108.6	-178.8	-47.2	172.7	0	0	0	109.2	F373 I382 T395 D397 N401 W405 I425 P428	F373-L403 HydrophobicContact CE1-CD1 4.02Å; I382-L403 HydrophobicContact CD1-CD1 4.22Å; T395-L403 PolarHBondContact N-O 3.18Å; T395-L403 PolarHBondContact O-N 3.2Å; T395-L403 WeakPolarHBondContact OG1-CB 3.26Å; T395-L403 PolarHBondContact OG1-O 2.83Å; D397-L403 HydrophobicContact CB-CD1 4.31Å; N401-L403 HydrophobicContact CB-CD2 3.84Å; N401-L403 HydrophobicContact CB-CG 4.45Å; L403-W405 HydrophobicContact CD1-CZ2 4.46Å; L403-W405 PolarHBondContact O-NE1 3.11Å; L403-I425 HydrophobicContact CB-CD1 4.48Å; L403-I425 HydrophobicContact CB-CG2 4.47Å; L403-I425 HydrophobicContact CD1-CD1 4.07Å; L403-I425 HydrophobicContact CD2-CD1 4.47Å; L403-P428 HydrophobicContact CD2-CB 3.63Å; L403-P428 HydrophobicContact CD2-CG 3.95Å
404	P	94.8	Very high	82.9	Confident	18 Å²	18	45.4 Å²	45.4	12%	0.117	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	129.1	170.3	-14.2	30.6	0	0	0	111.1	L394 I425 V426 R427 I429 L464	L394-P404 HydrophobicContact CD2-CB 3.65Å; L394-P404 HydrophobicContact CD2-CG 4.05Å; P404-I425 WeakPolarHBondContact O-CA 3.37Å; P404-V426 PolarHBondContact O-N 2.7Å; P404-R427 WeakPolarHBondContact CD-O 3.29Å; P404-I429 HydrophobicContact CG-CD1 4.46Å; P404-L464 HydrophobicContact CG-CD1 3.78Å
405	W	93.3	Very high	80.8	Confident	3 Å²	3	50 Å²	50	1%	0.011	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	117.5	179.7	-60.1	82.3	0	0	0	110.1	V356 F358 F373 V393 T395 L403 I425	V356-W405 HydrophobicContact CB-CZ2 4.34Å; V356-W405 HydrophobicContact CG2-CH2 4.44Å; V356-W405 HydrophobicContact CG2-CZ2 3.85Å; F358-W405 HydrophobicContact CE2-CE3 4.41Å; F358-W405 HydrophobicContact CZ-CB 4.12Å; F358-W405 HydrophobicContact CZ-CD2 4.28Å; F358-W405 HydrophobicContact CZ-CE3 4.36Å; F358-W405 HydrophobicContact CZ-CG 4.2Å; F373-W405 HydrophobicContact CD1-CH2 4.19Å; F373-W405 HydrophobicContact CD2-CH2 4.11Å; F373-W405 AromaticContact CE1-CH2 3.89Å; F373-W405 HydrophobicContact CE1-CH2 3.89Å; F373-W405 AromaticContact CE1-CZ2 3.97Å; F373-W405 HydrophobicContact CE1-CZ2 3.97Å; F373-W405 AromaticContact CE2-CH2 3.85Å; F373-W405 HydrophobicContact CE2-CH2 3.85Å; F373-W405 HydrophobicContact CE2-CZ2 4.48Å; F373-W405 HydrophobicContact CG-CH2 4.27Å; F373-W405 AromaticContact CZ-CH2 3.72Å; F373-W405 HydrophobicContact CZ-CH2 3.72Å; F373-W405 AromaticContact CZ-CZ2 3.92Å; F373-W405 HydrophobicContact CZ-CZ2 3.92Å; V393-W405 HydrophobicContact CB-CB 4.2Å; V393-W405 PolarHBondContact N-O 2.81Å; V393-W405 WeakPolarHBondContact O-CB 3.41Å; V393-W405 VanDerWaalsContact O-CD1 3.3Å; V393-W405 PolarHBondContact O-N 3.4Å; T395-W405 PolarHBondContact OG1-NE1 3.18Å; L403-W405 HydrophobicContact CD1-CZ2 4.46Å; L403-W405 PolarHBondContact O-NE1 3.11Å; W405-I425 HydrophobicContact CD2-CG1 4.17Å; W405-I425 HydrophobicContact CE3-CG1 3.96Å; W405-I425 HydrophobicContact CH2-CD1 3.93Å; W405-I425 HydrophobicContact CH2-CG1 3.72Å; W405-I425 HydrophobicContact CZ2-CD1 4.1Å; W405-I425 HydrophobicContact CZ2-CG1 3.93Å; W405-I425 HydrophobicContact CZ3-CD1 4.39Å; W405-I425 HydrophobicContact CZ3-CG1 3.71Å
406	A	86.9	Confident	78.6	Confident	29 Å²	29	51.8 Å²	51.8	24%	0.24	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	152	175.1	0	0	0	0	0	111.1	S408 Y423 Q424 V426	A406-S408 PolarHBondContact O-N 2.87Å; A406-Y423 WeakPolarHBondContact O-CA 3.43Å; A406-Q424 PolarHBondContact N-O 2.92Å; A406-Q424 PolarHBondContact O-N 3.25Å; A406-Q424 VanDerWaalsContact O-N 3.09Å; A406-V426 HydrophobicContact CB-CG2 3.35Å
407	K	84.6	Confident	75.8	Confident	119 Å²	119	62.4 Å²	62.4	52%	0.517	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	122.6	167.4	-68.4	179.3	-177.5	-179.3	0	108.6	Y423	K407-Y423 HydrophobicContact CD-CE1 4.29Å; K407-Y423 VanDerWaalsContact CE-OH 3.22Å; K407-Y423 WeakPolarHBondContact CE-OH 3.01Å; K407-Y423 HydrophobicContact CG-CD1 4.01Å; K407-Y423 HydrophobicContact CG-CE1 3.41Å; K407-Y423 VanDerWaalsContact CG-CE1 3.41Å
408	S	76.6	Confident	73.5	Confident	41 Å²	41	65.6 Å²	65.6	29%	0.287	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	128.4	173.9	-172.5	0	0	0	0	109.4	A406 A410 T422	A406-S408 PolarHBondContact O-N 2.87Å; S408-A410 PolarHBondContact O-N 2.9Å; S408-T422 PolarHBondContact N-O 2.99Å; S408-T422 PolarHBondContact O-N 2.94Å; S408-T422 VanDerWaalsContact O-N 3.1Å
409	A	66.9	Low	71.4	Confident	87 Å²	87	66.3 Å²	66.3	72%	0.719	39%	0.387	S	S	*	.			trans	-57.6	132.7	170.8	0	0	0	0	0	108.3	D411	A409-D411 PolarHBondContact O-N 2.9Å
410	A	59	Low	69.9	Low	18 Å²	18	70.1 Å²	70.1	15%	0.149	40%	0.402	C	S	.	.			trans	-64	128	-172	0	0	0	0	0	110.1	S408 T412 A419 K420	S408-A410 PolarHBondContact O-N 2.9Å; A410-T412 PolarHBondContact O-N 2.88Å; A410-A419 HydrophobicContact CB-CB 3.27Å; A410-A419 WeakPolarHBondContact CB-O 3.17Å; A410-K420 WeakPolarHBondContact CB-O 3.31Å
411	D	52.8	Low	68.8	Low	81 Å²	81	75.3 Å²	75.3	43%	0.433	43%	0.426	S	S	.	.			trans	-68.8	100.1	-178.2	-175.3	13	0	0	0	110	A409 K413 T414 L415	A409-D411 PolarHBondContact O-N 2.9Å; D411-K413 PolarHBondContact O-N 3.2Å; D411-K413 WeakPolarHBondContact OD1-CB 3.44Å; D411-K413 PolarHBondContact OD1-N 3.24Å; D411-T414 PolarHBondContact O-N 2.81Å; D411-T414 VanDerWaalsContact O-N 3.15Å; D411-T414 PolarHBondContact O-OG1 3.46Å; D411-T414 PolarHBondContact OD2-OG1 2.9Å; D411-T414 VanDerWaalsContact OD2-OG1 3.13Å; D411-L415 PolarHBondContact O-N 2.88Å; D411-L415 VanDerWaalsContact O-N 3.15Å
412	T	51.7	Low	68.2	Low	109 Å²	109	74.8 Å²	74.8	67%	0.669	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-16.7	178.2	33.6	0	0	0	0	113.6	A410	A410-T412 PolarHBondContact O-N 2.88Å
413	K	53.9	Low	67.7	Low	191 Å²	191	75.7 Å²	75.7	83%	0.83	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-26	178.2	-70.9	-176.3	175.6	178.7	0	113.8	D411	D411-K413 PolarHBondContact O-N 3.2Å; D411-K413 WeakPolarHBondContact OD1-CB 3.44Å; D411-K413 PolarHBondContact OD1-N 3.24Å
414	T	55.1	Low	67.4	Low	109 Å²	109	79.3 Å²	79.3	67%	0.669	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	-24.1	-176	39.8	0	0	0	0	113.6	D411	D411-T414 PolarHBondContact O-N 2.81Å; D411-T414 VanDerWaalsContact O-N 3.15Å; D411-T414 PolarHBondContact O-OG1 3.46Å; D411-T414 PolarHBondContact OD2-OG1 2.9Å; D411-T414 VanDerWaalsContact OD2-OG1 3.13Å
415	L	51.9	Low	67.3	Low	107 Å²	107	79.1 Å²	79.1	56%	0.56	44%	0.442	S	S	*	.	S	Bend	trans	-110.1	2.2	-171.1	-77.7	148.3	0	0	0	115.3	D411 A419	D411-L415 PolarHBondContact O-N 2.88Å; D411-L415 VanDerWaalsContact O-N 3.15Å; L415-A419 HydrophobicContact CB-CB 3.55Å
416	G	50.4	Low	67.1	Low	39 Å²	39	83.3 Å²	83.3	40%	0.402	47%	0.468	S	S	.	.			trans	71.3	176.2	178.5	0	0	0	0	0	114.8	G418 A419	G416-G418 PolarHBondContact O-N 2.86Å; G416-A419 PolarHBondContact O-N 3.02Å
417	K	38.8	Very low	67.2	Low	223 Å²	223	88.4 Å²	88.4	97%	0.97	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	111.4	177.1	-74.8	-175.9	177.3	-179.8	0	109.5
418	G	49.4	Very low	67.6	Low	69 Å²	69	84.4 Å²	84.4	71%	0.711	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	122.7	7.5	-176.8	0	0	0	0	0	114.8	G416 K420	G416-G418 PolarHBondContact O-N 2.86Å; G418-K420 PolarHBondContact O-N 3.5Å
419	A	52.2	Low	68.5	Low	30 Å²	30	83.1 Å²	83.1	25%	0.248	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-57.5	118.6	-178.1	0	0	0	0	0	111.7	A410 L415 G416	A410-A419 HydrophobicContact CB-CB 3.27Å; A410-A419 WeakPolarHBondContact CB-O 3.17Å; L415-A419 HydrophobicContact CB-CB 3.55Å; G416-A419 PolarHBondContact O-N 3.02Å
420	K	63.9	Low	69.8	Low	161 Å²	161	84.9 Å²	84.9	70%	0.7	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-84.2	144.9	-178.5	-66.9	-178.8	178.2	-179.7	0	110.5	A410 G418 T422	A410-K420 WeakPolarHBondContact CB-O 3.31Å; G418-K420 PolarHBondContact O-N 3.5Å; K420-T422 WeakPolarHBondContact O-CG2 3.38Å; K420-T422 PolarHBondContact O-N 2.77Å
421	E	73.3	Confident	71.6	Confident	108 Å²	108	84.6 Å²	84.6	51%	0.505	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-47.6	135.1	175.1	-61.9	175.6	147.4	0	0	111.9	K369	K369-E421 WeakPolarHBondContact CD-O 3.43Å; K369-E421 WeakPolarHBondContact CE-O 3.27Å; K369-E421 PolarHBondContact NZ-O 3.1Å; K369-E421 IonicContact NZ-OE2 2.83Å
422	T	83.3	Confident	73.7	Confident	23 Å²	23	81 Å²	81	14%	0.141	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	160.5	-179	64.5	0	0	0	0	111.1	I372 S408 K420	I372-T422 HydrophobicContact CD1-CG2 3.94Å; S408-T422 PolarHBondContact N-O 2.99Å; S408-T422 PolarHBondContact O-N 2.94Å; S408-T422 VanDerWaalsContact O-N 3.1Å; K420-T422 WeakPolarHBondContact O-CG2 3.38Å; K420-T422 PolarHBondContact O-N 2.77Å
423	Y	88.1	Confident	75.7	Confident	20 Å²	20	82.4 Å²	82.4	8%	0.078	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.4	173.8	-69	-90	0	0	0	109.2	F358 K369 I372 A406 K407	F358-Y423 HydrophobicContact CB-CD2 3.8Å; F358-Y423 HydrophobicContact CB-CE2 3.59Å; F358-Y423 AromaticContact CD1-CD1 3.75Å; F358-Y423 HydrophobicContact CD1-CD1 3.75Å; F358-Y423 AromaticContact CD1-CD2 3.75Å; F358-Y423 HydrophobicContact CD1-CD2 3.75Å; F358-Y423 AromaticContact CD1-CE1 3.69Å; F358-Y423 HydrophobicContact CD1-CE1 3.69Å; F358-Y423 AromaticContact CD1-CE2 3.69Å; F358-Y423 HydrophobicContact CD1-CE2 3.69Å; F358-Y423 AromaticContact CD1-CG 3.76Å; F358-Y423 HydrophobicContact CD1-CG 3.76Å; F358-Y423 AromaticContact CD1-CZ 3.66Å; F358-Y423 AromaticContact CD2-CD2 3.6Å; F358-Y423 HydrophobicContact CD2-CD2 3.6Å; F358-Y423 HydrophobicContact CD2-CE2 4.24Å; F358-Y423 AromaticContact CD2-CG 3.75Å; F358-Y423 HydrophobicContact CD2-CG 3.75Å; F358-Y423 AromaticContact CE1-CD1 3.49Å; F358-Y423 HydrophobicContact CE1-CD1 3.49Å; F358-Y423 VanDerWaalsContact CE1-CD1 3.49Å; F358-Y423 HydrophobicContact CE1-CD2 4.18Å; F358-Y423 AromaticContact CE1-CE1 3.77Å; F358-Y423 HydrophobicContact CE1-CE1 3.77Å; F358-Y423 HydrophobicContact CE1-CE2 4.42Å; F358-Y423 AromaticContact CE1-CG 3.71Å; F358-Y423 HydrophobicContact CE1-CG 3.71Å; F358-Y423 VanDerWaalsContact CE2-CB 3.47Å; F358-Y423 HydrophobicContact CE2-CD1 4.32Å; F358-Y423 HydrophobicContact CE2-CD2 4.08Å; F358-Y423 AromaticContact CE2-CG 3.72Å; F358-Y423 HydrophobicContact CE2-CG 3.72Å; F358-Y423 HydrophobicContact CG-CD1 4.26Å; F358-Y423 AromaticContact CG-CD2 3.43Å; F358-Y423 HydrophobicContact CG-CD2 3.43Å; F358-Y423 VanDerWaalsContact CG-CD2 3.43Å; F358-Y423 HydrophobicContact CG-CE1 4.38Å; F358-Y423 AromaticContact CG-CE2 3.58Å; F358-Y423 HydrophobicContact CG-CE2 3.58Å; F358-Y423 AromaticContact CG-CG 3.79Å; F358-Y423 HydrophobicContact CG-CG 3.79Å; F358-Y423 AromaticContact CZ-CD1 3.81Å; F358-Y423 HydrophobicContact CZ-CD1 3.81Å; F358-Y423 HydrophobicContact CZ-CD2 4.35Å; F358-Y423 AromaticContact CZ-CG 3.7Å; F358-Y423 HydrophobicContact CZ-CG 3.7Å; K369-Y423 HydrophobicContact CD-CE2 4.24Å; I372-Y423 PolarHBondContact N-O 2.8Å; A406-Y423 WeakPolarHBondContact O-CA 3.43Å; K407-Y423 HydrophobicContact CD-CE1 4.29Å; K407-Y423 VanDerWaalsContact CE-OH 3.22Å; K407-Y423 WeakPolarHBondContact CE-OH 3.01Å; K407-Y423 HydrophobicContact CG-CD1 4.01Å; K407-Y423 HydrophobicContact CG-CE1 3.41Å; K407-Y423 VanDerWaalsContact CG-CE1 3.41Å
424	Q	89.4	Confident	77.6	Confident	80 Å²	80	73.8 Å²	73.8	37%	0.374	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	149.3	-176.6	-70.8	-178.5	0.5	0	0	110.7	I372 A406 V426	I372-Q424 HydrophobicContact CB-CG 4.02Å; I372-Q424 HydrophobicContact CG2-CG 4.32Å; A406-Q424 PolarHBondContact N-O 2.92Å; A406-Q424 PolarHBondContact O-N 3.25Å; A406-Q424 VanDerWaalsContact O-N 3.09Å; Q424-V426 PolarHBondContact O-N 2.77Å
425	I	91.2	Very high	79.6	Confident	15 Å²	15	69.9 Å²	69.9	8%	0.077	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	126.1	175.1	-60	175.5	0	0	0	108.9	F373 Y376 L403 P404 W405 P428	F373-I425 HydrophobicContact CB-CD1 4.16Å; F373-I425 HydrophobicContact CD1-CD1 3.4Å; F373-I425 HydrophobicContact CE1-CD1 3.98Å; F373-I425 HydrophobicContact CG-CD1 4.03Å; Y376-I425 HydrophobicContact CD2-CB 3.96Å; Y376-I425 HydrophobicContact CD2-CD1 4.36Å; Y376-I425 HydrophobicContact CD2-CG2 3.93Å; Y376-I425 HydrophobicContact CE2-CB 4.2Å; Y376-I425 HydrophobicContact CE2-CG2 3.99Å; L403-I425 HydrophobicContact CB-CD1 4.48Å; L403-I425 HydrophobicContact CB-CG2 4.47Å; L403-I425 HydrophobicContact CD1-CD1 4.07Å; L403-I425 HydrophobicContact CD2-CD1 4.47Å; P404-I425 WeakPolarHBondContact O-CA 3.37Å; W405-I425 HydrophobicContact CD2-CG1 4.17Å; W405-I425 HydrophobicContact CE3-CG1 3.96Å; W405-I425 HydrophobicContact CH2-CD1 3.93Å; W405-I425 HydrophobicContact CH2-CG1 3.72Å; W405-I425 HydrophobicContact CZ2-CD1 4.1Å; W405-I425 HydrophobicContact CZ2-CG1 3.93Å; W405-I425 HydrophobicContact CZ3-CD1 4.39Å; W405-I425 HydrophobicContact CZ3-CG1 3.71Å; I425-P428 HydrophobicContact CG2-CG 4.01Å
426	V	89.1	Confident	81.8	Confident	90 Å²	90	64.8 Å²	64.8	55%	0.545	34%	0.341	S	S	.	.			trans	-73.9	-62.6	176.5	-177.2	0	0	0	0	109.9	P404 A406 Q424	P404-V426 PolarHBondContact O-N 2.7Å; A406-V426 HydrophobicContact CB-CG2 3.35Å; Q424-V426 PolarHBondContact O-N 2.77Å
427	R	90	Very high	84	Confident	137 Å²	137	65 Å²	65	52%	0.517	33%	0.331	S	S	.	.			trans	-158.4	117.6	-180	-178.3	178	62	78.3	-0.7	110.1	P404	P404-R427 WeakPolarHBondContact CD-O 3.29Å
428	P	92.6	Very high	86.7	Confident	35 Å²	35	55 Å²	55	23%	0.227	29%	0.289	C	S	.	.			trans	-60.8	141.7	171.6	-22.1	32.7	0	0	0	111.8	Y376 L403 I425	Y376-P428 HydrophobicContact CD1-CG 3.49Å; Y376-P428 VanDerWaalsContact CD1-CG 3.49Å; Y376-P428 HydrophobicContact CD2-CG 4.11Å; Y376-P428 HydrophobicContact CE1-CG 3.58Å; Y376-P428 HydrophobicContact CE2-CG 4.21Å; Y376-P428 HydrophobicContact CG-CG 3.77Å; L403-P428 HydrophobicContact CD2-CB 3.63Å; L403-P428 HydrophobicContact CD2-CG 3.95Å; I425-P428 HydrophobicContact CG2-CG 4.01Å
429	I	95.2	Very high	89	Confident	14 Å²	14	52.3 Å²	52.3	7%	0.072	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117.3	176.4	-52.7	-178.2	0	0	0	107.3	N401 I402 P404 A431 W460 L464	N401-I429 CarbonylContact C-O 3.58Å; N401-I429 WeakPolarHBondContact CA-O 3.37Å; I402-I429 HydrophobicContact CB-CB 4.36Å; I402-I429 PolarHBondContact N-O 3.49Å; I402-I429 PolarHBondContact O-N 2.82Å; P404-I429 HydrophobicContact CG-CD1 4.46Å; I429-A431 PolarHBondContact O-N 3.2Å; I429-W460 HydrophobicContact CG2-CH2 4.36Å; I429-W460 HydrophobicContact CG2-CZ3 3.97Å; I429-L464 HydrophobicContact CD1-CB 3.31Å; I429-L464 HydrophobicContact CD1-CD1 3.44Å; I429-L464 VanDerWaalsContact CD1-CD1 3.44Å; I429-L464 HydrophobicContact CD1-CG 3.98Å
430	K	95.4	Very high	91	Very high	123 Å²	123	52.1 Å²	52.1	54%	0.535	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	110.9	175	-175.6	58	165.4	163.7	0	108.2	E399 N401 H432	E399-K430 PolarHBondContact O-NZ 3.28Å; N401-K430 WeakPolarHBondContact OD1-CD 3.4Å; K430-H432 VanDerWaalsContact CE-O 3.23Å; K430-H432 WeakPolarHBondContact CE-O 3.29Å; K430-H432 PolarHBondContact NZ-O 3.05Å
431	A	95.4	Very high	92.4	Very high	12 Å²	12	47.4 Å²	47.4	10%	0.099	24%	0.239	C	C	.	.			trans	-104.4	-42	-174.7	0	0	0	0	0	112.3	G400 I402 I429 I458 W460	G400-A431 PolarHBondContact O-N 3.18Å; I402-A431 HydrophobicContact CD1-CB 3.74Å; I402-A431 HydrophobicContact CG1-CB 3.78Å; I429-A431 PolarHBondContact O-N 3.2Å; A431-I458 WeakPolarHBondContact O-CD1 3.35Å; A431-W460 HydrophobicContact CB-CH2 3.86Å; A431-W460 HydrophobicContact CB-CZ2 3.45Å; A431-W460 VanDerWaalsContact CB-CZ2 3.45Å
432	H	97.3	Very high	93.2	Very high	5 Å²	5	43.5 Å²	43.5	2%	0.023	22%	0.222	C	C	.	.			trans	-137.2	159.2	-170	-70.1	-74.2	0	0	0	111.7	G400 K430 G434 V436 S449 G451 D454 K456	G400-H432 PolarHBondContact O-N 3.47Å; K430-H432 VanDerWaalsContact CE-O 3.23Å; K430-H432 WeakPolarHBondContact CE-O 3.29Å; K430-H432 PolarHBondContact NZ-O 3.05Å; H432-G434 WeakPolarHBondContact CB-O 3.29Å; H432-G434 PolarHBondContact O-N 2.72Å; H432-V436 HydrophobicContact CB-CG2 4.43Å; H432-S449 WeakPolarHBondContact NE2-CB 3.43Å; H432-S449 PolarHBondContact NE2-OG 2.9Å; H432-G451 PolarHBondContact CE1-N 3.27Å; H432-G451 WeakPolarHBondContact ND1-CA 3.27Å; H432-D454 WeakPolarHBondContact CA-OD2 3.42Å; H432-D454 WeakPolarHBondContact CB-OD2 2.92Å; H432-D454 IonicContact CG-OD2 3.86Å; H432-D454 IonicContact ND1-OD1 3.71Å; H432-D454 PolarHBondContact ND1-OD1 2.88Å; H432-D454 IonicContact ND1-OD2 2.85Å; H432-D454 PolarHBondContact ND1-OD2 2.53Å; H432-K456 PolarHBondContact CE1-O 3.39Å
433	E	94.4	Very high	93.3	Very high	140 Å²	140	52.7 Å²	52.7	65%	0.654	26%	0.26	S	S	*	.	S	Bend	trans	-71.6	-17.4	175.9	-67	-167.8	177.7	0	0	113.7	D454	E433-D454 HydrophobicContact CB-CB 4.31Å; E433-D454 HydrophobicContact CG-CB 4.4Å; E433-D454 PolarHBondContact N-OD2 3.14Å
434	G	94	Very high	93.1	Very high	9 Å²	9	55.9 Å²	55.9	9%	0.093	28%	0.284	C	S	.	.	S	Bend	trans	-148.9	-161.4	176.8	0	0	0	0	0	111.1	G400 H432 V436	G400-G434 WeakPolarHBondContact CA-O 3.3Å; G400-G434 PolarHBondContact N-O 2.81Å; H432-G434 WeakPolarHBondContact CB-O 3.29Å; H432-G434 PolarHBondContact O-N 2.72Å; G434-V436 PolarHBondContact O-N 2.89Å
435	S	96.4	Very high	93	Very high	27 Å²	27	52.7 Å²	52.7	19%	0.189	27%	0.273	C	S	.	.			trans	-53.4	135.6	-168	-50.9	0	0	0	0	114.6	D397 S398 F437 G452	D397-S435 WeakPolarHBondContact O-CA 3.38Å; S398-S435 WeakPolarHBondContact CA-OG 3.26Å; S398-S435 WeakPolarHBondContact O-CA 3.38Å; S398-S435 PolarHBondContact O-N 3.16Å; S398-S435 PolarHBondContact O-OG 2.77Å; S435-F437 PolarHBondContact O-N 3.15Å; S435-G452 WeakPolarHBondContact O-CA 2.82Å; S435-G452 PolarHBondContact O-N 2.97Å
436	V	97.8	Very high	93	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	101.7	171.8	-170.5	0	0	0	0	108.4	H383 C384 D397 H432 G434 L439	H383-V436 WeakPolarHBondContact CB-O 3.34Å; C384-V436 PolarHBondContact SG-O 3.09Å; D397-V436 PolarHBondContact O-N 3.42Å; H432-V436 HydrophobicContact CB-CG2 4.43Å; G434-V436 PolarHBondContact O-N 2.89Å; V436-L439 HydrophobicContact CG1-CD2 3.9Å; V436-L439 HydrophobicContact CG1-CG 4.28Å
437	F	96.1	Very high	93.3	Very high	43 Å²	43	48.1 Å²	48.1	19%	0.189	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-25.4	-172.3	-74.7	-52.5	0	0	0	114.3	H383 S435 G450 G452 V479	H383-F437 HydrophobicContact CB-CD1 4.28Å; H383-F437 AromaticContact CE1-CE1 3.66Å; H383-F437 AromaticContact CG-CD1 3.8Å; H383-F437 AromaticContact ND1-CD1 3.86Å; H383-F437 AromaticContact ND1-CE1 3.86Å; H383-F437 AromaticContact NE2-CE1 3.79Å; S435-F437 PolarHBondContact O-N 3.15Å; F437-G450 PolarHBondContact N-O 2.88Å; F437-G452 VanDerWaalsContact CE2-CA 3.46Å; F437-V479 WeakPolarHBondContact CD2-O 3.39Å
438	T	96.4	Very high	93.6	Very high	15 Å²	15	41.7 Å²	41.7	9%	0.092	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	141.5	-177.7	-169.9	0	0	0	0	110.4	G450 V479 V482	T438-G450 PolarHBondContact O-N 2.84Å; T438-V479 HydrophobicContact CG2-CG1 3.91Å; T438-V482 HydrophobicContact CG2-CB 4.25Å; T438-V482 HydrophobicContact CG2-CG2 3.81Å
439	L	96.7	Very high	93.9	Very high	12 Å²	12	40 Å²	40	6%	0.063	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	140.8	168.5	-70.8	179.7	0	0	0	107.2	V386 L394 I402 V436 L447 L448	V386-L439 HydrophobicContact CB-CB 4.44Å; V386-L439 HydrophobicContact CG1-CB 3.8Å; V386-L439 VanDerWaalsContact CG1-O 3.3Å; V386-L439 WeakPolarHBondContact CG1-O 3.19Å; V386-L439 HydrophobicContact CG2-CB 3.8Å; V386-L439 HydrophobicContact CG2-CD1 4.17Å; L394-L439 HydrophobicContact CB-CD1 4.49Å; I402-L439 HydrophobicContact CD1-CD2 4.19Å; I402-L439 HydrophobicContact CG1-CD2 4.24Å; V436-L439 HydrophobicContact CG1-CD2 3.9Å; V436-L439 HydrophobicContact CG1-CG 4.28Å; L439-L447 HydrophobicContact CB-CD1 4.23Å; L439-L447 HydrophobicContact CD2-CD1 4.32Å; L439-L447 HydrophobicContact CD2-CD2 4.16Å; L439-L447 HydrophobicContact CD2-CG 4.38Å; L439-L448 CarbonylContact C-O 3.55Å; L439-L448 VanDerWaalsContact CA-O 3.31Å; L439-L448 WeakPolarHBondContact CA-O 3.4Å
440	C	94.9	Very high	94	Very high	26 Å²	26	39.3 Å²	39.3	18%	0.176	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	122.9	178.3	-179.6	0	0	0	0	109.4	L448	C440-L448 HydrophobicContact CB-CB 4.27Å; C440-L448 PolarHBondContact N-O 3.37Å; C440-L448 PolarHBondContact O-N 3.26Å
441	T	92.7	Very high	93.9	Very high	62 Å²	62	33.5 Å²	33.5	38%	0.38	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	135	177.9	43.8	0	0	0	0	111.2	V386 F387 L447	V386-T441 HydrophobicContact CB-CG2 4.05Å; V386-T441 HydrophobicContact CG2-CG2 3.82Å; F387-T441 WeakPolarHBondContact O-CG2 2.98Å; T441-L447 HydrophobicContact CG2-CD1 3.88Å
442	L	91	Very high	93.8	Very high	25 Å²	25	33.5 Å²	33.5	13%	0.131	18%	0.184	C	C	.	.			trans	-89.7	155.9	176.1	-58.8	-176.5	0	0	0	110.2	C444 G445 A446 L448 V484	L442-C444 PolarHBondContact O-N 2.8Å; L442-C444 VanDerWaalsContact O-N 3.15Å; L442-G445 PolarHBondContact O-N 2.83Å; L442-A446 HydrophobicContact CB-CB 4.26Å; L442-A446 WeakPolarHBondContact CB-O 3.33Å; L442-A446 HydrophobicContact CD1-CB 3.92Å; L442-A446 HydrophobicContact CG-CB 4.41Å; L442-A446 PolarHBondContact N-O 3.2Å; L442-L448 HydrophobicContact CD1-CD2 4.37Å; L442-L448 HydrophobicContact CD1-CG 4.21Å; L442-L448 HydrophobicContact CD2-CD1 3.83Å; L442-L448 HydrophobicContact CD2-CG 4.14Å; L442-L448 HydrophobicContact CG-CD1 4.45Å; L442-L448 HydrophobicContact CG-CG 4.22Å; L442-V484 HydrophobicContact CD2-CB 4.49Å; L442-V484 HydrophobicContact CD2-CG1 4.25Å; L442-V484 HydrophobicContact CD2-CG2 3.43Å; L442-V484 VanDerWaalsContact CD2-CG2 3.43Å
443	K	85.6	Confident	93.6	Very high	217 Å²	217	40.4 Å²	40.4	94%	0.943	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-29.3	178.6	-67.8	-178.9	-180	174	0	113.2	G445	K443-G445 PolarHBondContact O-N 3.33Å
444	C	84.4	Confident	93.7	Very high	87 Å²	87	34.6 Å²	34.6	59%	0.588	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	0.6	176.4	59.4	0	0	0	0	114.2	L442 A446	L442-C444 PolarHBondContact O-N 2.8Å; L442-C444 VanDerWaalsContact O-N 3.15Å; C444-A446 VanDerWaalsContact C-N 3.3Å; C444-A446 PolarHBondContact O-N 3.15Å
445	G	85.9	Confident	93.8	Very high	13 Å²	13	36.8 Å²	36.8	13%	0.134	19%	0.192	C	C	.	.	S	Bend	trans	87.2	-8.5	-177.8	0	0	0	0	0	115.2	L442 K443	L442-G445 PolarHBondContact O-N 2.83Å; K443-G445 PolarHBondContact O-N 3.33Å
446	A	92.6	Very high	93.8	Very high	5 Å²	5	38.1 Å²	38.1	4%	0.041	20%	0.195	C	C	.	.			trans	-63.6	157.4	169.2	0	0	0	0	0	111.2	L442 C444 W460	L442-A446 HydrophobicContact CB-CB 4.26Å; L442-A446 WeakPolarHBondContact CB-O 3.33Å; L442-A446 HydrophobicContact CD1-CB 3.92Å; L442-A446 HydrophobicContact CG-CB 4.41Å; L442-A446 PolarHBondContact N-O 3.2Å; C444-A446 VanDerWaalsContact C-N 3.3Å; C444-A446 PolarHBondContact O-N 3.15Å; A446-W460 CarbonylContact C-O 3.54Å; A446-W460 VanDerWaalsContact CA-O 3.24Å; A446-W460 WeakPolarHBondContact CA-O 3.44Å; A446-W460 WeakPolarHBondContact CB-O 3.15Å
447	L	95.5	Very high	93.7	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.016	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	139.9	-177.5	176.6	73.1	0	0	0	109.7	V386 L394 I402 L439 T441 R459 W460 L464	V386-L447 HydrophobicContact CG2-CD1 3.71Å; L394-L447 HydrophobicContact CD1-CD2 3.99Å; I402-L447 HydrophobicContact CD1-CD2 4.05Å; I402-L447 HydrophobicContact CG2-CD2 4.47Å; L439-L447 HydrophobicContact CB-CD1 4.23Å; L439-L447 HydrophobicContact CD2-CD1 4.32Å; L439-L447 HydrophobicContact CD2-CD2 4.16Å; L439-L447 HydrophobicContact CD2-CG 4.38Å; T441-L447 HydrophobicContact CG2-CD1 3.88Å; L447-R459 CarbonylContact O-C 3.59Å; L447-R459 WeakPolarHBondContact O-CA 3.41Å; L447-W460 HydrophobicContact CB-CB 4.18Å; L447-W460 PolarHBondContact N-O 2.92Å; L447-W460 PolarHBondContact O-N 3.33Å; L447-L464 HydrophobicContact CB-CD2 4.39Å; L447-L464 HydrophobicContact CD2-CD2 3.58Å
448	L	96.3	Very high	93.8	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	135.5	166.7	-62.9	176.2	0	0	0	109.3	L439 C440 L442 I458 R459 V482 V484 L490 F504	L439-L448 CarbonylContact C-O 3.55Å; L439-L448 VanDerWaalsContact CA-O 3.31Å; L439-L448 WeakPolarHBondContact CA-O 3.4Å; C440-L448 HydrophobicContact CB-CB 4.27Å; C440-L448 PolarHBondContact N-O 3.37Å; C440-L448 PolarHBondContact O-N 3.26Å; L442-L448 HydrophobicContact CD1-CD2 4.37Å; L442-L448 HydrophobicContact CD1-CG 4.21Å; L442-L448 HydrophobicContact CD2-CD1 3.83Å; L442-L448 HydrophobicContact CD2-CG 4.14Å; L442-L448 HydrophobicContact CG-CD1 4.45Å; L442-L448 HydrophobicContact CG-CG 4.22Å; L448-I458 CarbonylContact C-O 3.15Å; L448-I458 WeakPolarHBondContact CA-O 3.45Å; L448-R459 HydrophobicContact CD2-CB 3.78Å; L448-R459 HydrophobicContact CD2-CG 4.11Å; L448-V482 HydrophobicContact CD1-CG1 3.99Å; L448-V484 HydrophobicContact CD1-CG2 4.18Å; L448-L490 HydrophobicContact CD1-CD1 4.13Å; L448-L490 HydrophobicContact CD1-CD2 3.6Å; L448-F504 HydrophobicContact CD2-CE2 3.99Å; L448-F504 HydrophobicContact CD2-CZ 3.81Å
449	S	97.6	Very high	93.8	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	139	170	69.4	0	0	0	0	111.2	H432 I457 I458 W460	H432-S449 WeakPolarHBondContact NE2-CB 3.43Å; H432-S449 PolarHBondContact NE2-OG 2.9Å; S449-I457 VanDerWaalsContact O-CA 3.31Å; S449-I457 WeakPolarHBondContact O-CA 3.32Å; S449-I458 PolarHBondContact N-O 3.49Å; S449-I458 PolarHBondContact O-N 3.05Å; S449-W460 PolarHBondContact OG-NE1 3.44Å
450	G	97.3	Very high	93.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	121.4	175.5	0	0	0	0	0	111.7	F437 T438	F437-G450 PolarHBondContact N-O 2.88Å; T438-G450 PolarHBondContact O-N 2.84Å
451	G	94.8	Very high	93.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	139.7	-175.9	0	0	0	0	0	114	H432 D454 K456 V479	H432-G451 PolarHBondContact CE1-N 3.27Å; H432-G451 WeakPolarHBondContact ND1-CA 3.27Å; G451-D454 VanDerWaalsContact CA-OD1 3.22Å; G451-D454 WeakPolarHBondContact CA-OD1 3.44Å; G451-K456 PolarHBondContact N-O 3.11Å; G451-V479 PolarHBondContact O-N 3.49Å
452	G	92	Very high	93.5	Very high	13 Å²	13	37.5 Å²	37.5	13%	0.134	20%	0.196	C	C	.	.	S	Bend	trans	-80.3	-52.2	-178.4	0	0	0	0	0	113.7	S435 F437 A478	S435-G452 WeakPolarHBondContact O-CA 2.82Å; S435-G452 PolarHBondContact O-N 2.97Å; F437-G452 VanDerWaalsContact CE2-CA 3.46Å; G452-A478 WeakPolarHBondContact O-CB 3.33Å
453	K	93.9	Very high	93.4	Very high	150 Å²	150	43 Å²	43	65%	0.652	23%	0.225	S	C	*	.	S	Bend	trans	-86.8	-40.5	-173	-173.2	-178.7	175.7	-166.9	0	112.7
454	D	95.3	Very high	93.7	Very high	18 Å²	18	33.8 Å²	33.8	10%	0.096	19%	0.186	C	C	.	.	S	Bend	trans	-84	-12	-178.5	54.4	8.9	0	0	0	113.3	H432 E433 G451 K456	H432-D454 WeakPolarHBondContact CA-OD2 3.42Å; H432-D454 WeakPolarHBondContact CB-OD2 2.92Å; H432-D454 IonicContact CG-OD2 3.86Å; H432-D454 IonicContact ND1-OD1 3.71Å; H432-D454 PolarHBondContact ND1-OD1 2.88Å; H432-D454 IonicContact ND1-OD2 2.85Å; H432-D454 PolarHBondContact ND1-OD2 2.53Å; E433-D454 HydrophobicContact CB-CB 4.31Å; E433-D454 HydrophobicContact CG-CB 4.4Å; E433-D454 PolarHBondContact N-OD2 3.14Å; G451-D454 VanDerWaalsContact CA-OD1 3.22Å; G451-D454 WeakPolarHBondContact CA-OD1 3.44Å; D454-K456 HydrophobicContact CB-CD 4.5Å; D454-K456 HydrophobicContact CB-CG 4.21Å; D454-K456 PolarHBondContact O-N 3.08Å; D454-K456 VanDerWaalsContact O-N 3.11Å; D454-K456 PolarHBondContact OD1-N 2.97Å
455	R	96.3	Very high	94.2	Very high	55 Å²	55	32 Å²	32	21%	0.208	18%	0.177	C	C	.	.			trans	59.4	19.2	-179.4	-46.2	173.3	-68	-144.5	7.5	113.4	E471 I472 E474	R455-E471 HydrophobicContact CB-CG 4.36Å; R455-E471 IonicContact CZ-OE1 3.64Å; R455-E471 IonicContact NE-OE1 3.84Å; R455-E471 PolarHBondContact NE-OE1 3.41Å; R455-E471 IonicContact NH2-OE1 2.68Å; R455-E471 PolarHBondContact NH2-OE1 3.49Å; R455-I472 HydrophobicContact CB-CB 4.38Å; R455-I472 WeakPolarHBondContact O-CB 2.85Å; R455-I472 PolarHBondContact O-N 3.37Å; R455-E474 IonicContact CZ-OE2 2.72Å; R455-E474 IonicContact NH1-OE1 3.44Å; R455-E474 IonicContact NH1-OE2 3.77Å; R455-E474 PolarHBondContact NH1-OE2 3.39Å; R455-E474 IonicContact NH2-OE2 3.3Å
456	K	96.5	Very high	94.6	Very high	54 Å²	54	35.8 Å²	35.8	24%	0.235	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	146.4	-176.8	-68.3	-173.2	178.9	-168.9	0	111.8	H432 G451 D454 I458 E469 C470 E471	H432-K456 PolarHBondContact CE1-O 3.39Å; G451-K456 PolarHBondContact N-O 3.11Å; D454-K456 HydrophobicContact CB-CD 4.5Å; D454-K456 HydrophobicContact CB-CG 4.21Å; D454-K456 PolarHBondContact O-N 3.08Å; D454-K456 VanDerWaalsContact O-N 3.11Å; D454-K456 PolarHBondContact OD1-N 2.97Å; K456-I458 HydrophobicContact CB-CG1 4.37Å; K456-E469 IonicContact NZ-OE1 3.13Å; K456-E469 PolarHBondContact NZ-OE1 2.91Å; K456-E469 IonicContact NZ-OE2 2.83Å; K456-C470 CarbonylContact C-O 3.41Å; K456-C470 WeakPolarHBondContact CA-O 3.28Å; K456-E471 HydrophobicContact CG-CB 4.24Å; K456-E471 HydrophobicContact CG-CG 4.28Å
457	I	96.9	Very high	94.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	126.3	162.2	-57.4	175.3	0	0	0	106.6	S449 E469 C470 I472 V479 V482 V492 F504 F508	S449-I457 VanDerWaalsContact O-CA 3.31Å; S449-I457 WeakPolarHBondContact O-CA 3.32Å; I457-E469 CarbonylContact O-C 3.56Å; I457-E469 VanDerWaalsContact O-CA 3.27Å; I457-E469 WeakPolarHBondContact O-CA 3.27Å; I457-C470 PolarHBondContact N-O 3.01Å; I457-C470 PolarHBondContact O-N 3.03Å; I457-I472 HydrophobicContact CD1-CD1 3.94Å; I457-I472 HydrophobicContact CD1-CG1 4.3Å; I457-I472 HydrophobicContact CG1-CG1 4.49Å; I457-V479 HydrophobicContact CD1-CG2 4.32Å; I457-V479 HydrophobicContact CG1-CG1 4.41Å; I457-V479 HydrophobicContact CG1-CG2 3.77Å; I457-V482 HydrophobicContact CD1-CG2 4.26Å; I457-V492 HydrophobicContact CD1-CB 4.36Å; I457-V492 HydrophobicContact CD1-CG1 4.06Å; I457-V492 HydrophobicContact CD1-CG2 3.34Å; I457-F504 HydrophobicContact CG2-CE1 4.21Å; I457-F504 HydrophobicContact CG2-CZ 3.89Å; I457-F508 HydrophobicContact CD1-CE1 4.41Å; I457-F508 HydrophobicContact CD1-CE2 4.04Å; I457-F508 HydrophobicContact CD1-CZ 3.8Å
458	I	96.9	Very high	94.6	Very high	8 Å²	8	43.7 Å²	43.7	4%	0.041	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.7	179.4	-54.4	173.3	0	0	0	108.5	A431 L448 S449 K456 W460 P466 R468 E469	A431-I458 WeakPolarHBondContact O-CD1 3.35Å; L448-I458 CarbonylContact C-O 3.15Å; L448-I458 WeakPolarHBondContact CA-O 3.45Å; S449-I458 PolarHBondContact N-O 3.49Å; S449-I458 PolarHBondContact O-N 3.05Å; K456-I458 HydrophobicContact CB-CG1 4.37Å; I458-W460 HydrophobicContact CB-CZ2 4.01Å; I458-W460 HydrophobicContact CD1-CZ2 3.96Å; I458-W460 HydrophobicContact CG2-CD2 4.11Å; I458-W460 VanDerWaalsContact CG2-CE2 3.49Å; I458-W460 HydrophobicContact CG2-CG 4.49Å; I458-W460 HydrophobicContact CG2-CH2 4.31Å; I458-W460 HydrophobicContact CG2-CZ2 3.6Å; I458-W460 PolarHBondContact O-NE1 3.13Å; I458-P466 HydrophobicContact CG2-CB 4.24Å; I458-R468 CarbonylContact C-O 3.6Å; I458-R468 WeakPolarHBondContact CA-O 3.44Å; I458-E469 HydrophobicContact CG1-CB 3.98Å
459	R	95.9	Very high	94.6	Very high	43 Å²	43	48.9 Å²	48.9	16%	0.162	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	129.6	168.6	178.4	175	166.2	151.5	1.6	109	L447 L448 E467 R468 E488 F504	L447-R459 CarbonylContact O-C 3.59Å; L447-R459 WeakPolarHBondContact O-CA 3.41Å; L448-R459 HydrophobicContact CD2-CB 3.78Å; L448-R459 HydrophobicContact CD2-CG 4.11Å; R459-E467 HydrophobicContact CG-CB 4.5Å; R459-E467 IonicContact CZ-OE2 3.25Å; R459-E467 IonicContact NE-OE2 2.92Å; R459-E467 PolarHBondContact NE-OE2 3.3Å; R459-E467 IonicContact NH2-OE2 3.86Å; R459-E467 PolarHBondContact O-N 2.96Å; R459-R468 HydrophobicContact CB-CB 4.35Å; R459-R468 PolarHBondContact N-O 2.75Å; R459-R468 PolarHBondContact O-N 3.17Å; R459-E488 IonicContact NH1-OE1 3.69Å; R459-F504 HydrophobicContact CB-CE1 4.3Å; R459-F504 HydrophobicContact CB-CE2 4.16Å; R459-F504 HydrophobicContact CB-CZ 3.73Å
460	W	95.7	Very high	94.4	Very high	8 Å²	8	49.9 Å²	49.9	3%	0.03	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	144.8	179.8	-49.6	79.9	0	0	0	109.7	I402 I429 A431 A446 L447 S449 I458 A465 P466	I402-W460 HydrophobicContact CD1-CD2 4.33Å; I402-W460 HydrophobicContact CD1-CZ2 4.14Å; I429-W460 HydrophobicContact CG2-CH2 4.36Å; I429-W460 HydrophobicContact CG2-CZ3 3.97Å; A431-W460 HydrophobicContact CB-CH2 3.86Å; A431-W460 HydrophobicContact CB-CZ2 3.45Å; A431-W460 VanDerWaalsContact CB-CZ2 3.45Å; A446-W460 CarbonylContact C-O 3.54Å; A446-W460 VanDerWaalsContact CA-O 3.24Å; A446-W460 WeakPolarHBondContact CA-O 3.44Å; A446-W460 WeakPolarHBondContact CB-O 3.15Å; L447-W460 HydrophobicContact CB-CB 4.18Å; L447-W460 PolarHBondContact N-O 2.92Å; L447-W460 PolarHBondContact O-N 3.33Å; S449-W460 PolarHBondContact OG-NE1 3.44Å; I458-W460 HydrophobicContact CB-CZ2 4.01Å; I458-W460 HydrophobicContact CD1-CZ2 3.96Å; I458-W460 HydrophobicContact CG2-CD2 4.11Å; I458-W460 VanDerWaalsContact CG2-CE2 3.49Å; I458-W460 HydrophobicContact CG2-CG 4.49Å; I458-W460 HydrophobicContact CG2-CH2 4.31Å; I458-W460 HydrophobicContact CG2-CZ2 3.6Å; I458-W460 PolarHBondContact O-NE1 3.13Å; W460-A465 CarbonylContact C-O 3.56Å; W460-A465 VanDerWaalsContact CA-O 3.26Å; W460-A465 WeakPolarHBondContact CA-O 3.46Å; W460-P466 HydrophobicContact CE3-CB 3.97Å; W460-P466 HydrophobicContact CH2-CB 4.25Å; W460-P466 HydrophobicContact CZ3-CB 3.78Å; W460-P466 HydrophobicContact CZ3-CG 4.08Å
461	S	93.8	Very high	94.3	Very high	20 Å²	20	54.4 Å²	54.4	14%	0.14	29%	0.285	C	S	.	.			trans	-65.5	170.6	168.9	74.4	0	0	0	0	111.2	D463 L464 A465 E467	S461-D463 PolarHBondContact O-N 2.68Å; S461-D463 PolarHBondContact OG-N 3.24Å; S461-L464 WeakPolarHBondContact O-CA 3.29Å; S461-L464 PolarHBondContact O-N 2.67Å; S461-A465 PolarHBondContact N-O 3.31Å; S461-A465 WeakPolarHBondContact OG-CB 3.27Å; S461-A465 PolarHBondContact OG-N 3.5Å; S461-A465 VanDerWaalsContact OG-N 3.11Å; S461-E467 WeakPolarHBondContact CA-OE1 3.38Å; S461-E467 VanDerWaalsContact CB-OE1 3.27Å; S461-E467 WeakPolarHBondContact CB-OE1 3.36Å
462	A	89.5	Confident	94.4	Very high	67 Å²	67	54.4 Å²	54.4	55%	0.554	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-28.5	175.2	0	0	0	0	0	112.9	L464	A462-L464 PolarHBondContact O-N 3.46Å
463	D	89.3	Confident	94.6	Very high	140 Å²	140	56.3 Å²	56.3	75%	0.749	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	7.6	175.4	-60.4	-46	0	0	0	113.2	S461 A465	S461-D463 PolarHBondContact O-N 2.68Å; S461-D463 PolarHBondContact OG-N 3.24Å; D463-A465 VanDerWaalsContact C-N 3.32Å; D463-A465 PolarHBondContact O-N 2.77Å
464	L	92	Very high	94.5	Very high	24 Å²	24	55.2 Å²	55.2	13%	0.126	29%	0.292	C	S	.	.			trans	61.5	36.8	-178.4	-52.7	170.8	0	0	0	113.1	L394 P404 I429 L447 S461 A462	L394-L464 HydrophobicContact CD1-CD2 4.04Å; L394-L464 HydrophobicContact CD2-CD1 4.14Å; P404-L464 HydrophobicContact CG-CD1 3.78Å; I429-L464 HydrophobicContact CD1-CB 3.31Å; I429-L464 HydrophobicContact CD1-CD1 3.44Å; I429-L464 VanDerWaalsContact CD1-CD1 3.44Å; I429-L464 HydrophobicContact CD1-CG 3.98Å; L447-L464 HydrophobicContact CB-CD2 4.39Å; L447-L464 HydrophobicContact CD2-CD2 3.58Å; S461-L464 WeakPolarHBondContact O-CA 3.29Å; S461-L464 PolarHBondContact O-N 2.67Å; A462-L464 PolarHBondContact O-N 3.46Å
465	A	94.1	Very high	94.4	Very high	48 Å²	48	61 Å²	61	40%	0.397	32%	0.316	S	S	.	.			trans	-90.7	134.4	166	0	0	0	0	0	109.8	W460 S461 D463 E467	W460-A465 CarbonylContact C-O 3.56Å; W460-A465 VanDerWaalsContact CA-O 3.26Å; W460-A465 WeakPolarHBondContact CA-O 3.46Å; S461-A465 PolarHBondContact N-O 3.31Å; S461-A465 WeakPolarHBondContact OG-CB 3.27Å; S461-A465 PolarHBondContact OG-N 3.5Å; S461-A465 VanDerWaalsContact OG-N 3.11Å; D463-A465 VanDerWaalsContact C-N 3.32Å; D463-A465 PolarHBondContact O-N 2.77Å; A465-E467 PolarHBondContact O-N 3.23Å
466	P	95	Very high	94.3	Very high	94 Å²	94	59 Å²	59	61%	0.61	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.4	129.9	179.7	28.4	-32.6	0	0	0	110.5	I458 W460	I458-P466 HydrophobicContact CG2-CB 4.24Å; W460-P466 HydrophobicContact CE3-CB 3.97Å; W460-P466 HydrophobicContact CH2-CB 4.25Å; W460-P466 HydrophobicContact CZ3-CB 3.78Å; W460-P466 HydrophobicContact CZ3-CG 4.08Å
467	E	94.5	Very high	94.2	Very high	98 Å²	98	56.9 Å²	56.9	46%	0.458	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	-52.1	-178.6	-64.3	-177.1	161.5	0	0	112.1	R459 S461 A465	R459-E467 HydrophobicContact CG-CB 4.5Å; R459-E467 IonicContact CZ-OE2 3.25Å; R459-E467 IonicContact NE-OE2 2.92Å; R459-E467 PolarHBondContact NE-OE2 3.3Å; R459-E467 IonicContact NH2-OE2 3.86Å; R459-E467 PolarHBondContact O-N 2.96Å; S461-E467 WeakPolarHBondContact CA-OE1 3.38Å; S461-E467 VanDerWaalsContact CB-OE1 3.27Å; S461-E467 WeakPolarHBondContact CB-OE1 3.36Å; A465-E467 PolarHBondContact O-N 3.23Å
468	R	93.9	Very high	94.1	Very high	75 Å²	75	57.4 Å²	57.4	28%	0.283	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	147.4	-176.8	-68.7	-169.2	-82.3	174.8	-5.8	109.9	I458 R459 E488 F504	I458-R468 CarbonylContact C-O 3.6Å; I458-R468 WeakPolarHBondContact CA-O 3.44Å; R459-R468 HydrophobicContact CB-CB 4.35Å; R459-R468 PolarHBondContact N-O 2.75Å; R459-R468 PolarHBondContact O-N 3.17Å; R468-E488 IonicContact CZ-OE1 3.16Å; R468-E488 IonicContact CZ-OE2 2.81Å; R468-E488 IonicContact NH1-OE1 3.69Å; R468-E488 IonicContact NH1-OE2 2.94Å; R468-E488 PolarHBondContact NH1-OE2 3.33Å; R468-E488 IonicContact NH2-OE1 3.63Å; R468-E488 PolarHBondContact NH2-OE1 3.29Å; R468-E488 IonicContact NH2-OE2 3.77Å; R468-E488 PolarHBondContact NH2-OE2 3.08Å; R468-E488 VanDerWaalsContact NH2-OE2 3.17Å; R468-F504 HydrophobicContact CB-CD1 3.93Å; R468-F504 HydrophobicContact CB-CE1 4.27Å; R468-F504 HydrophobicContact CB-CG 4.29Å
469	E	94.5	Very high	94.1	Very high	112 Å²	112	57 Å²	57	52%	0.523	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	151.1	170.8	64.5	172.7	-137.5	0	0	111.2	K456 I457 I458	K456-E469 IonicContact NZ-OE1 3.13Å; K456-E469 PolarHBondContact NZ-OE1 2.91Å; K456-E469 IonicContact NZ-OE2 2.83Å; I457-E469 CarbonylContact O-C 3.56Å; I457-E469 VanDerWaalsContact O-CA 3.27Å; I457-E469 WeakPolarHBondContact O-CA 3.27Å; I458-E469 HydrophobicContact CG1-CB 3.98Å
470	C	94.8	Very high	94.1	Very high	20 Å²	20	56.5 Å²	56.5	14%	0.135	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	140.4	174.5	-176.3	0	0	0	0	108.8	K456 I457 F504 F508	K456-C470 CarbonylContact C-O 3.41Å; K456-C470 WeakPolarHBondContact CA-O 3.28Å; I457-C470 PolarHBondContact N-O 3.01Å; I457-C470 PolarHBondContact O-N 3.03Å; C470-F504 HydrophobicContact CB-CD1 3.75Å; C470-F504 HydrophobicContact CB-CE1 4.25Å; C470-F508 HydrophobicContact CB-CE2 4.27Å
471	E	95.8	Very high	94.1	Very high	95 Å²	95	56.4 Å²	56.4	44%	0.444	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	135.9	179.3	-169.5	179	157.4	0	0	111.4	R455 K456	R455-E471 HydrophobicContact CB-CG 4.36Å; R455-E471 IonicContact CZ-OE1 3.64Å; R455-E471 IonicContact NE-OE1 3.84Å; R455-E471 PolarHBondContact NE-OE1 3.41Å; R455-E471 IonicContact NH2-OE1 2.68Å; R455-E471 PolarHBondContact NH2-OE1 3.49Å; K456-E471 HydrophobicContact CG-CB 4.24Å; K456-E471 HydrophobicContact CG-CG 4.28Å
472	I	96.8	Very high	94.3	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-80.6	135.5	174.7	-60.8	-52.2	0	0	0	110.4	R455 I457 E474 F476 V479 V492 L500 F508	R455-I472 HydrophobicContact CB-CB 4.38Å; R455-I472 WeakPolarHBondContact O-CB 2.85Å; R455-I472 PolarHBondContact O-N 3.37Å; I457-I472 HydrophobicContact CD1-CD1 3.94Å; I457-I472 HydrophobicContact CD1-CG1 4.3Å; I457-I472 HydrophobicContact CG1-CG1 4.49Å; I472-E474 PolarHBondContact O-N 2.64Å; I472-F476 HydrophobicContact CG2-CB 4.13Å; I472-V479 HydrophobicContact CG1-CG2 3.74Å; I472-V492 HydrophobicContact CD1-CG1 4.42Å; I472-V492 HydrophobicContact CD1-CG2 4.48Å; I472-V492 HydrophobicContact CG1-CG1 4.43Å; I472-L500 HydrophobicContact CD1-CD1 4.11Å; I472-L500 HydrophobicContact CG2-CD1 3.44Å; I472-L500 VanDerWaalsContact CG2-CD1 3.44Å; I472-F508 HydrophobicContact CD1-CB 3.92Å; I472-F508 HydrophobicContact CD1-CD1 4.26Å; I472-F508 HydrophobicContact CD1-CD2 3.35Å; I472-F508 HydrophobicContact CD1-CE2 3.88Å; I472-F508 HydrophobicContact CD1-CG 3.57Å
473	P	94.7	Very high	94.5	Very high	53 Å²	53	53.1 Å²	53.1	34%	0.344	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-54.6	135.2	177.4	-26.6	33.5	0	0	0	113.4	K475 F476	P473-K475 HydrophobicContact CB-CG 4.36Å; P473-K475 PolarHBondContact O-N 3.33Å; P473-F476 HydrophobicContact CB-CD2 3.88Å; P473-F476 HydrophobicContact CB-CE2 4.16Å; P473-F476 HydrophobicContact CG-CD2 4.16Å; P473-F476 HydrophobicContact CG-CE2 4.23Å; P473-F476 PolarHBondContact O-N 2.99Å
474	E	93.5	Very high	94.8	Very high	128 Å²	128	48.9 Å²	48.9	60%	0.598	26%	0.255	S	S	*	.	G	3₁₀ helix	trans	-49	-39.9	-174.8	179	150.5	174.7	0	0	114.7	R455 I472 F476 G477	R455-E474 IonicContact CZ-OE2 2.72Å; R455-E474 IonicContact NH1-OE1 3.44Å; R455-E474 IonicContact NH1-OE2 3.77Å; R455-E474 PolarHBondContact NH1-OE2 3.39Å; R455-E474 IonicContact NH2-OE2 3.3Å; I472-E474 PolarHBondContact O-N 2.64Å; E474-F476 PolarHBondContact O-N 3.42Å; E474-G477 PolarHBondContact O-N 3.17Å
475	K	92.2	Very high	94.8	Very high	140 Å²	140	49.2 Å²	49.2	61%	0.609	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-56.1	-27.7	-177.9	65.4	-176.2	-177.8	178.8	0	113.2	P473 R496	P473-K475 HydrophobicContact CB-CG 4.36Å; P473-K475 PolarHBondContact O-N 3.33Å; K475-R496 WeakPolarHBondContact O-CD 3.48Å; K475-R496 PolarHBondContact O-NH1 2.93Å
476	F	93.9	Very high	94.5	Very high	12 Å²	12	51.1 Å²	51.1	5%	0.053	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-92.3	-4.1	179.4	-55.2	-60.1	0	0	0	113.9	I472 P473 E474 T494 R496 A498 L500 A510	I472-F476 HydrophobicContact CG2-CB 4.13Å; P473-F476 HydrophobicContact CB-CD2 3.88Å; P473-F476 HydrophobicContact CB-CE2 4.16Å; P473-F476 HydrophobicContact CG-CD2 4.16Å; P473-F476 HydrophobicContact CG-CE2 4.23Å; P473-F476 PolarHBondContact O-N 2.99Å; E474-F476 PolarHBondContact O-N 3.42Å; F476-T494 HydrophobicContact CB-CG2 4.08Å; F476-T494 WeakPolarHBondContact O-CB 3.47Å; F476-T494 PolarHBondContact O-OG1 2.88Å; F476-R496 WeakPolarHBondContact O-CB 3.23Å; F476-A498 HydrophobicContact CD1-CB 3.96Å; F476-L500 HydrophobicContact CB-CD1 4.19Å; F476-L500 HydrophobicContact CB-CD2 4.41Å; F476-L500 HydrophobicContact CD1-CD2 3.94Å; F476-L500 HydrophobicContact CD2-CD1 3.87Å; F476-L500 HydrophobicContact CD2-CD2 3.8Å; F476-L500 HydrophobicContact CE1-CD2 4.04Å; F476-L500 HydrophobicContact CE2-CD1 4.49Å; F476-L500 HydrophobicContact CE2-CD2 3.9Å; F476-L500 HydrophobicContact CG-CD1 4.17Å; F476-L500 HydrophobicContact CG-CD2 3.81Å; F476-L500 HydrophobicContact CZ-CD2 4Å; F476-A510 HydrophobicContact CE1-CB 3.64Å; F476-A510 HydrophobicContact CZ-CB 3.62Å
477	G	94.2	Very high	93.9	Very high	9 Å²	9	53.8 Å²	53.8	9%	0.093	27%	0.271	C	S	.	.			trans	73.3	-149.4	178.5	0	0	0	0	0	113.5	E474	E474-G477 PolarHBondContact O-N 3.17Å
478	A	95.7	Very high	93.4	Very high	11 Å²	11	52.9 Å²	52.9	9%	0.091	27%	0.266	C	S	.	.	S	Bend	trans	-87.4	158	-171.1	0	0	0	0	0	112.6	G452 R480 T494 T495	G452-A478 WeakPolarHBondContact O-CB 3.33Å; A478-R480 PolarHBondContact O-N 3.16Å; A478-T494 CarbonylContact O-C 3.57Å; A478-T494 VanDerWaalsContact O-CA 3.23Å; A478-T494 WeakPolarHBondContact O-CA 3.48Å; A478-T494 WeakPolarHBondContact O-CB 3.27Å; A478-T495 HydrophobicContact CB-CG2 3.75Å; A478-T495 PolarHBondContact N-OG1 3.24Å; A478-T495 PolarHBondContact O-N 3.1Å
479	V	96.9	Very high	93.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	122.9	172.7	-179.5	0	0	0	0	109.1	F437 T438 G451 I457 I472 V482 V492	F437-V479 WeakPolarHBondContact CD2-O 3.39Å; T438-V479 HydrophobicContact CG2-CG1 3.91Å; G451-V479 PolarHBondContact O-N 3.49Å; I457-V479 HydrophobicContact CD1-CG2 4.32Å; I457-V479 HydrophobicContact CG1-CG1 4.41Å; I457-V479 HydrophobicContact CG1-CG2 3.77Å; I472-V479 HydrophobicContact CG1-CG2 3.74Å; V479-V482 HydrophobicContact CG1-CG2 3.75Å; V479-V492 HydrophobicContact CB-CG1 4.49Å; V479-V492 HydrophobicContact CG1-CG1 3.95Å; V479-V492 HydrophobicContact CG2-CG1 4.2Å
480	R	95.8	Very high	93.5	Very high	33 Å²	33	44.9 Å²	44.9	13%	0.125	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	-42.2	176.9	174.3	60.5	74	-146.2	2.8	112.3	G190 R191 C193 A478 G493 T495	G190-R480 WeakPolarHBondContact O-CG 3.1Å; G190-R480 PolarHBondContact O-NE 3.14Å; R191-R480 PolarHBondContact O-NH2 3.37Å; C193-R480 WeakPolarHBondContact O-CD 3.41Å; C193-R480 VanDerWaalsContact O-CG 3.28Å; C193-R480 WeakPolarHBondContact O-CG 3.4Å; C193-R480 PolarHBondContact O-NE 2.93Å; A478-R480 PolarHBondContact O-N 3.16Å; R480-G493 WeakPolarHBondContact CA-O 3.18Å; R480-G493 WeakPolarHBondContact CB-O 3.15Å; R480-G493 PolarHBondContact N-O 3.21Å; R480-T495 HydrophobicContact CB-CG2 4.2Å
481	T	95.9	Very high	93.6	Very high	6 Å²	6	44 Å²	44	4%	0.037	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	149.9	-178	-175.8	0	0	0	0	109.6	Y188 L197 V492 G493	Y188-T481 WeakPolarHBondContact OH-CG2 3.33Å; L197-T481 HydrophobicContact CB-CG2 3.59Å; L197-T481 HydrophobicContact CD2-CG2 4.13Å; T481-V492 WeakPolarHBondContact O-CA 3.43Å; T481-G493 PolarHBondContact N-O 3.15Å; T481-G493 PolarHBondContact O-N 2.92Å
482	V	96.5	Very high	93.7	Very high	10 Å²	10	39.4 Å²	39.4	6%	0.061	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	133.9	177.2	175	0	0	0	0	108.3	T438 L448 I457 V479 L490 L491	T438-V482 HydrophobicContact CG2-CB 4.25Å; T438-V482 HydrophobicContact CG2-CG2 3.81Å; L448-V482 HydrophobicContact CD1-CG1 3.99Å; I457-V482 HydrophobicContact CD1-CG2 4.26Å; V479-V482 HydrophobicContact CG1-CG2 3.75Å; V482-L490 HydrophobicContact CG1-CD2 4.38Å; V482-L491 CarbonylContact C-O 3.55Å; V482-L491 WeakPolarHBondContact CA-O 3.34Å
483	A	95.5	Very high	93.7	Very high	8 Å²	8	39.4 Å²	39.4	7%	0.066	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	140.8	172.7	0	0	0	0	0	110.1	L197 L491	L197-A483 HydrophobicContact CG-CB 4.36Å; A483-L491 HydrophobicContact CB-CB 4.32Å; A483-L491 PolarHBondContact N-O 2.78Å; A483-L491 PolarHBondContact O-N 3.07Å
484	V	94	Very high	93.9	Very high	51 Å²	51	36.9 Å²	36.9	31%	0.309	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	131.2	-178.1	-176.8	0	0	0	0	109.2	L442 L448 D486 L490	L442-V484 HydrophobicContact CD2-CB 4.49Å; L442-V484 HydrophobicContact CD2-CG1 4.25Å; L442-V484 HydrophobicContact CD2-CG2 3.43Å; L442-V484 VanDerWaalsContact CD2-CG2 3.43Å; L448-V484 HydrophobicContact CD1-CG2 4.18Å; V484-D486 VanDerWaalsContact CG1-O 3.26Å; V484-D486 WeakPolarHBondContact CG1-O 3.49Å; V484-L490 HydrophobicContact CG2-CD2 4.17Å
485	V	92.4	Very high	93.9	Very high	30 Å²	30	32.3 Å²	32.3	18%	0.182	17%	0.173	C	C	.	.			trans	-95.5	-54.8	177.1	179.4	0	0	0	0	110.1	F199 G489 L491	F199-V485 HydrophobicContact CD1-CB 4.32Å; F199-V485 HydrophobicContact CD1-CG1 4.2Å; F199-V485 HydrophobicContact CD1-CG2 4.48Å; F199-V485 HydrophobicContact CD2-CG2 4.39Å; F199-V485 HydrophobicContact CE1-CB 4.27Å; F199-V485 HydrophobicContact CE1-CG1 3.66Å; F199-V485 HydrophobicContact CE2-CG1 4.24Å; F199-V485 HydrophobicContact CG-CG2 4.33Å; F199-V485 HydrophobicContact CZ-CG1 3.67Å; V485-G489 WeakPolarHBondContact CB-O 3.21Å; V485-G489 PolarHBondContact N-O 2.81Å; V485-L491 HydrophobicContact CG2-CD1 4.14Å; V485-L491 HydrophobicContact CG2-CD2 4.03Å; V485-L491 HydrophobicContact CG2-CG 3.56Å
486	D	88.2	Confident	94	Very high	88 Å²	88	30.5 Å²	30.5	47%	0.471	16%	0.162	S	C	.	.	S	Bend	trans	-148.8	-165.5	177.2	56.8	48.6	0	0	0	108.8	V484 E488 G489	V484-D486 VanDerWaalsContact CG1-O 3.26Å; V484-D486 WeakPolarHBondContact CG1-O 3.49Å; D486-E488 PolarHBondContact O-N 3.23Å; D486-E488 PolarHBondContact OD1-N 3.06Å; D486-G489 PolarHBondContact N-O 3.28Å; D486-G489 WeakPolarHBondContact OD1-CA 3.19Å; D486-G489 PolarHBondContact OD1-N 3.03Å
487	D	82.1	Confident	94.1	Very high	151 Å²	151	30.1 Å²	30.1	81%	0.807	16%	0.161	S	C	*	.	S	Bend	trans	-63	-25.1	-172.2	-68	-31.3	0	0	0	114
488	E	84.7	Confident	94.1	Very high	78 Å²	78	29.7 Å²	29.7	36%	0.364	16%	0.157	S	C	.	.	S	Bend	trans	-123.4	-23.8	-179.3	-68.2	-65.2	134.9	0	0	113.1	R459 R468 D486 S503	R459-E488 IonicContact NH1-OE1 3.69Å; R468-E488 IonicContact CZ-OE1 3.16Å; R468-E488 IonicContact CZ-OE2 2.81Å; R468-E488 IonicContact NH1-OE1 3.69Å; R468-E488 IonicContact NH1-OE2 2.94Å; R468-E488 PolarHBondContact NH1-OE2 3.33Å; R468-E488 IonicContact NH2-OE1 3.63Å; R468-E488 PolarHBondContact NH2-OE1 3.29Å; R468-E488 IonicContact NH2-OE2 3.77Å; R468-E488 PolarHBondContact NH2-OE2 3.08Å; R468-E488 VanDerWaalsContact NH2-OE2 3.17Å; D486-E488 PolarHBondContact O-N 3.23Å; D486-E488 PolarHBondContact OD1-N 3.06Å; E488-S503 WeakPolarHBondContact O-CA 3.4Å; E488-S503 VanDerWaalsContact O-CB 3.27Å; E488-S503 WeakPolarHBondContact O-CB 3.36Å
489	G	93.6	Very high	94.2	Very high	13 Å²	13	29.2 Å²	29.2	13%	0.134	15%	0.153	C	C	.	.			trans	-83.4	130.2	-178	0	0	0	0	0	113.4	V485 D486	V485-G489 WeakPolarHBondContact CB-O 3.21Å; V485-G489 PolarHBondContact N-O 2.81Å; D486-G489 PolarHBondContact N-O 3.28Å; D486-G489 WeakPolarHBondContact OD1-CA 3.19Å; D486-G489 PolarHBondContact OD1-N 3.03Å
490	L	96.3	Very high	94.1	Very high	7 Å²	7	29.2 Å²	29.2	4%	0.037	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	148.8	179.9	-60.7	179.2	0	0	0	111.5	L448 V482 V484 R501 G502 F504 F508	L448-L490 HydrophobicContact CD1-CD1 4.13Å; L448-L490 HydrophobicContact CD1-CD2 3.6Å; V482-L490 HydrophobicContact CG1-CD2 4.38Å; V484-L490 HydrophobicContact CG2-CD2 4.17Å; L490-R501 WeakPolarHBondContact O-CA 3.43Å; L490-G502 PolarHBondContact N-O 2.64Å; L490-G502 PolarHBondContact O-N 2.79Å; L490-F504 HydrophobicContact CD1-CD2 4.32Å; L490-F504 HydrophobicContact CD1-CE2 3.67Å; L490-F504 HydrophobicContact CD1-CZ 4.18Å; L490-F508 HydrophobicContact CB-CE1 3.93Å; L490-F508 HydrophobicContact CB-CZ 4.17Å; L490-F508 HydrophobicContact CD1-CZ 4.19Å
491	L	97.4	Very high	94.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	138.8	162.2	-57.7	177	0	0	0	110	L197 F199 A205 I218 V482 A483 V485 L500 R501 I511	L197-L491 HydrophobicContact CD2-CB 3.94Å; F199-L491 HydrophobicContact CB-CD1 4.37Å; F199-L491 HydrophobicContact CD2-CD1 3.96Å; A205-L491 HydrophobicContact CB-CD1 3.74Å; I218-L491 HydrophobicContact CD1-CD1 3.97Å; I218-L491 HydrophobicContact CD1-CD2 3.79Å; I218-L491 HydrophobicContact CD1-CG 4.43Å; V482-L491 CarbonylContact C-O 3.55Å; V482-L491 WeakPolarHBondContact CA-O 3.34Å; A483-L491 HydrophobicContact CB-CB 4.32Å; A483-L491 PolarHBondContact N-O 2.78Å; A483-L491 PolarHBondContact O-N 3.07Å; V485-L491 HydrophobicContact CG2-CD1 4.14Å; V485-L491 HydrophobicContact CG2-CD2 4.03Å; V485-L491 HydrophobicContact CG2-CG 3.56Å; L491-L500 CarbonylContact C-O 3.56Å; L491-L500 VanDerWaalsContact CA-O 3.26Å; L491-L500 WeakPolarHBondContact CA-O 3.15Å; L491-R501 HydrophobicContact CD2-CB 3.85Å; L491-R501 HydrophobicContact CD2-CG 3.97Å; L491-I511 HydrophobicContact CD2-CD1 4.04Å
492	V	97.6	Very high	94.1	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	112.1	-177.3	-173.6	0	0	0	0	108.7	I457 I472 V479 T481 T494 I499 L500 F508	I457-V492 HydrophobicContact CD1-CB 4.36Å; I457-V492 HydrophobicContact CD1-CG1 4.06Å; I457-V492 HydrophobicContact CD1-CG2 3.34Å; I472-V492 HydrophobicContact CD1-CG1 4.42Å; I472-V492 HydrophobicContact CD1-CG2 4.48Å; I472-V492 HydrophobicContact CG1-CG1 4.43Å; V479-V492 HydrophobicContact CB-CG1 4.49Å; V479-V492 HydrophobicContact CG1-CG1 3.95Å; V479-V492 HydrophobicContact CG2-CG1 4.2Å; T481-V492 WeakPolarHBondContact O-CA 3.43Å; V492-T494 HydrophobicContact CG1-CG2 4.36Å; V492-I499 CarbonylContact O-C 3.55Å; V492-I499 WeakPolarHBondContact O-CA 3.45Å; V492-L500 HydrophobicContact CB-CB 4.24Å; V492-L500 PolarHBondContact N-O 3.44Å; V492-L500 PolarHBondContact O-N 2.8Å; V492-F508 HydrophobicContact CG2-CD1 3.7Å; V492-F508 HydrophobicContact CG2-CE1 3.32Å; V492-F508 HydrophobicContact CG2-CZ 3.91Å
493	G	97.4	Very high	94	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	130.4	167.1	0	0	0	0	0	109.2	R480 T481 A498	R480-G493 WeakPolarHBondContact CA-O 3.18Å; R480-G493 WeakPolarHBondContact CB-O 3.15Å; R480-G493 PolarHBondContact N-O 3.21Å; T481-G493 PolarHBondContact N-O 3.15Å; T481-G493 PolarHBondContact O-N 2.92Å; G493-A498 WeakPolarHBondContact CA-O 3.48Å
494	T	97.1	Very high	93.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	165.9	-174.7	80.3	0	0	0	0	112.9	G190 F476 A478 V492 R496 A498 L500	G190-T494 CarbonylContact C-O 3.55Å; G190-T494 VanDerWaalsContact CA-O 3.29Å; G190-T494 WeakPolarHBondContact CA-O 3.36Å; F476-T494 HydrophobicContact CB-CG2 4.08Å; F476-T494 WeakPolarHBondContact O-CB 3.47Å; F476-T494 PolarHBondContact O-OG1 2.88Å; A478-T494 CarbonylContact O-C 3.57Å; A478-T494 VanDerWaalsContact O-CA 3.23Å; A478-T494 WeakPolarHBondContact O-CA 3.48Å; A478-T494 WeakPolarHBondContact O-CB 3.27Å; V492-T494 HydrophobicContact CG1-CG2 4.36Å; T494-R496 PolarHBondContact O-N 3.23Å; T494-R496 PolarHBondContact OG1-N 3.47Å; T494-A498 PolarHBondContact N-O 3.38Å; T494-A498 PolarHBondContact OG1-N 2.82Å; T494-L500 HydrophobicContact CG2-CD1 3.82Å; T494-L500 HydrophobicContact CG2-CG 3.89Å
495	T	95.1	Very high	93.8	Very high	32 Å²	32	35.7 Å²	35.7	20%	0.196	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-10	174.9	59.9	0	0	0	0	113.9	R191 A478 R480	R191-T495 WeakPolarHBondContact CA-O 3.19Å; A478-T495 HydrophobicContact CB-CG2 3.75Å; A478-T495 PolarHBondContact N-OG1 3.24Å; A478-T495 PolarHBondContact O-N 3.1Å; R480-T495 HydrophobicContact CB-CG2 4.2Å
496	R	94.4	Very high	93.7	Very high	102 Å²	102	41 Å²	41	39%	0.385	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	42.9	174.3	-63.3	-173.9	173.3	-173.6	0	112.5	K475 F476 T494 A498 L516	K475-R496 WeakPolarHBondContact O-CD 3.48Å; K475-R496 PolarHBondContact O-NH1 2.93Å; F476-R496 WeakPolarHBondContact O-CB 3.23Å; T494-R496 PolarHBondContact O-N 3.23Å; T494-R496 PolarHBondContact OG1-N 3.47Å; R496-A498 PolarHBondContact O-N 2.8Å; R496-L516 HydrophobicContact CB-CD1 4.03Å; R496-L516 HydrophobicContact CB-CD2 3.76Å; R496-L516 HydrophobicContact CG-CD1 3.82Å; R496-L516 HydrophobicContact CG-CD2 4.36Å; R496-L516 WeakPolarHBondContact O-CD2 3.42Å
497	N	94.8	Very high	94	Very high	3 Å²	3	38 Å²	38	2%	0.016	21%	0.205	C	C	.	.	S	Bend	trans	51.4	33.8	169.5	-67.9	-4.6	0	0	0	114.7	Y188 G190 R191 G514 H515 L516	Y188-N497 PolarHBondContact N-O 3.5Å; Y188-N497 WeakPolarHBondContact O-CA 3.44Å; Y188-N497 WeakPolarHBondContact O-CB 3.25Å; Y188-N497 PolarHBondContact O-OD1 3.26Å; G190-N497 PolarHBondContact N-OD1 2.88Å; R191-N497 WeakPolarHBondContact CB-OD1 3.35Å; R191-N497 PolarHBondContact N-OD1 2.85Å; N497-G514 PolarHBondContact O-N 2.89Å; N497-H515 PolarHBondContact ND2-O 3.07Å; N497-L516 HydrophobicContact CB-CD2 3.84Å
498	A	95.1	Very high	94.6	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.008	17%	0.17	C	C	.	.			trans	-116	148.7	176.1	0	0	0	0	0	111.1	Y188 F476 G493 T494 R496 L500 V512 Q513	Y188-A498 WeakPolarHBondContact CD1-O 3.49Å; F476-A498 HydrophobicContact CD1-CB 3.96Å; G493-A498 WeakPolarHBondContact CA-O 3.48Å; T494-A498 PolarHBondContact N-O 3.38Å; T494-A498 PolarHBondContact OG1-N 2.82Å; R496-A498 PolarHBondContact O-N 2.8Å; A498-L500 HydrophobicContact CB-CD2 4.18Å; A498-V512 CarbonylContact C-O 3.09Å; A498-V512 WeakPolarHBondContact CA-O 3.47Å; A498-Q513 HydrophobicContact CB-CG 4.27Å
499	I	96.5	Very high	95	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.3	165.5	-57.7	170.6	0	0	0	107.1	Y188 L197 Y207 V492 I511 V512	Y188-I499 HydrophobicContact CD1-CG1 3.98Å; Y188-I499 HydrophobicContact CD2-CD1 3.84Å; Y188-I499 HydrophobicContact CD2-CG1 3.9Å; Y188-I499 HydrophobicContact CG-CD1 3.94Å; Y188-I499 HydrophobicContact CG-CG1 3.59Å; L197-I499 HydrophobicContact CD1-CD1 3.9Å; L197-I499 HydrophobicContact CD1-CG1 4.46Å; L197-I499 HydrophobicContact CD1-CG2 4.37Å; L197-I499 HydrophobicContact CD2-CG2 3.98Å; Y207-I499 HydrophobicContact CD1-CD1 3.47Å; Y207-I499 VanDerWaalsContact CD1-CD1 3.47Å; Y207-I499 HydrophobicContact CD2-CD1 3.99Å; Y207-I499 HydrophobicContact CE1-CD1 3.6Å; Y207-I499 HydrophobicContact CE2-CD1 4.09Å; Y207-I499 HydrophobicContact CG-CD1 3.68Å; V492-I499 CarbonylContact O-C 3.55Å; V492-I499 WeakPolarHBondContact O-CA 3.45Å; I499-I511 HydrophobicContact CB-CG1 4.25Å; I499-I511 HydrophobicContact CG2-CD1 3.99Å; I499-I511 HydrophobicContact CG2-CG1 4Å; I499-I511 VanDerWaalsContact O-CG1 3.27Å; I499-I511 WeakPolarHBondContact O-CG1 3.44Å; I499-I511 PolarHBondContact O-N 3.02Å; I499-V512 HydrophobicContact CB-CB 3.99Å; I499-V512 HydrophobicContact CB-CG2 4.33Å; I499-V512 HydrophobicContact CD1-CB 4.16Å; I499-V512 HydrophobicContact CD1-CG2 4.15Å; I499-V512 HydrophobicContact CG1-CB 4.21Å; I499-V512 PolarHBondContact N-O 2.91Å; I499-V512 PolarHBondContact O-N 3.3Å
500	L	96.6	Very high	95	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	146.8	176.9	-42.6	179.3	0	0	0	109.9	I472 F476 L491 V492 T494 A498 F508 V509 A510	I472-L500 HydrophobicContact CD1-CD1 4.11Å; I472-L500 HydrophobicContact CG2-CD1 3.44Å; I472-L500 VanDerWaalsContact CG2-CD1 3.44Å; F476-L500 HydrophobicContact CB-CD1 4.19Å; F476-L500 HydrophobicContact CB-CD2 4.41Å; F476-L500 HydrophobicContact CD1-CD2 3.94Å; F476-L500 HydrophobicContact CD2-CD1 3.87Å; F476-L500 HydrophobicContact CD2-CD2 3.8Å; F476-L500 HydrophobicContact CE1-CD2 4.04Å; F476-L500 HydrophobicContact CE2-CD1 4.49Å; F476-L500 HydrophobicContact CE2-CD2 3.9Å; F476-L500 HydrophobicContact CG-CD1 4.17Å; F476-L500 HydrophobicContact CG-CD2 3.81Å; F476-L500 HydrophobicContact CZ-CD2 4Å; L491-L500 CarbonylContact C-O 3.56Å; L491-L500 VanDerWaalsContact CA-O 3.26Å; L491-L500 WeakPolarHBondContact CA-O 3.15Å; V492-L500 HydrophobicContact CB-CB 4.24Å; V492-L500 PolarHBondContact N-O 3.44Å; V492-L500 PolarHBondContact O-N 2.8Å; T494-L500 HydrophobicContact CG2-CD1 3.82Å; T494-L500 HydrophobicContact CG2-CG 3.89Å; A498-L500 HydrophobicContact CB-CD2 4.18Å; L500-F508 HydrophobicContact CB-CB 4.03Å; L500-F508 HydrophobicContact CB-CD1 4.21Å; L500-F508 HydrophobicContact CD1-CB 4.09Å; L500-V509 CarbonylContact C-O 3.56Å; L500-V509 WeakPolarHBondContact CA-O 3.47Å; L500-A510 HydrophobicContact CD2-CB 3.61Å
501	R	95.8	Very high	94.9	Very high	98 Å²	98	35.1 Å²	35.1	37%	0.37	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	138.5	170.4	-178.9	-179.3	178.9	-149.2	-4.8	108.7	L490 L491 V509 I511	L490-R501 WeakPolarHBondContact O-CA 3.43Å; L491-R501 HydrophobicContact CD2-CB 3.85Å; L491-R501 HydrophobicContact CD2-CG 3.97Å; R501-V509 PolarHBondContact N-O 2.95Å; R501-V509 WeakPolarHBondContact O-CG2 3.03Å; R501-V509 PolarHBondContact O-N 2.82Å; R501-I511 HydrophobicContact CB-CD1 4.19Å; R501-I511 HydrophobicContact CB-CG1 4.43Å; R501-I511 HydrophobicContact CB-CG2 3.86Å
502	G	95.3	Very high	94.7	Very high	14 Å²	14	35.6 Å²	35.6	14%	0.144	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	180	-173.5	-177.6	0	0	0	0	0	114	L490 G507	L490-G502 PolarHBondContact N-O 2.64Å; L490-G502 PolarHBondContact O-N 2.79Å; G502-G507 WeakPolarHBondContact CA-O 3.43Å
503	S	94.9	Very high	94.4	Very high	7 Å²	7	38.6 Å²	38.6	5%	0.049	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	171.1	172.7	75	0	0	0	0	109.1	E488 S505 D506 G507	E488-S503 WeakPolarHBondContact O-CA 3.4Å; E488-S503 VanDerWaalsContact O-CB 3.27Å; E488-S503 WeakPolarHBondContact O-CB 3.36Å; S503-S505 PolarHBondContact O-N 3.35Å; S503-S505 PolarHBondContact OG-N 2.78Å; S503-D506 WeakPolarHBondContact OG-CB 3.46Å; S503-D506 PolarHBondContact OG-N 2.81Å; S503-D506 PolarHBondContact OG-OD2 3.46Å; S503-G507 PolarHBondContact N-O 2.91Å; S503-G507 PolarHBondContact O-N 3.43Å; S503-G507 VanDerWaalsContact O-N 3.16Å
504	F	93	Very high	94.1	Very high	29 Å²	29	39 Å²	39	13%	0.127	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-21.9	172.7	-72.4	-87.6	0	0	0	112.9	L448 I457 R459 R468 C470 L490	L448-F504 HydrophobicContact CD2-CE2 3.99Å; L448-F504 HydrophobicContact CD2-CZ 3.81Å; I457-F504 HydrophobicContact CG2-CE1 4.21Å; I457-F504 HydrophobicContact CG2-CZ 3.89Å; R459-F504 HydrophobicContact CB-CE1 4.3Å; R459-F504 HydrophobicContact CB-CE2 4.16Å; R459-F504 HydrophobicContact CB-CZ 3.73Å; R468-F504 HydrophobicContact CB-CD1 3.93Å; R468-F504 HydrophobicContact CB-CE1 4.27Å; R468-F504 HydrophobicContact CB-CG 4.29Å; C470-F504 HydrophobicContact CB-CD1 3.75Å; C470-F504 HydrophobicContact CB-CE1 4.25Å; L490-F504 HydrophobicContact CD1-CD2 4.32Å; L490-F504 HydrophobicContact CD1-CE2 3.67Å; L490-F504 HydrophobicContact CD1-CZ 4.18Å
505	S	91.6	Very high	93.9	Very high	95 Å²	95	39 Å²	39	66%	0.664	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92	-41.1	-176.9	-62.6	0	0	0	0	112.6	S503	S503-S505 PolarHBondContact O-N 3.35Å; S503-S505 PolarHBondContact OG-N 2.78Å
506	D	90.8	Very high	93.8	Very high	142 Å²	142	38.7 Å²	38.7	76%	0.759	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-9.7	-172.5	-51.7	-53.4	0	0	0	112.9	S503	S503-D506 WeakPolarHBondContact OG-CB 3.46Å; S503-D506 PolarHBondContact OG-N 2.81Å; S503-D506 PolarHBondContact OG-OD2 3.46Å
507	G	93	Very high	93.8	Very high	24 Å²	24	36.8 Å²	36.8	25%	0.247	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	72.3	-168.5	-171.5	0	0	0	0	0	112.4	G502 S503	G502-G507 WeakPolarHBondContact CA-O 3.43Å; S503-G507 PolarHBondContact N-O 2.91Å; S503-G507 PolarHBondContact O-N 3.43Å; S503-G507 VanDerWaalsContact O-N 3.16Å
508	F	95.8	Very high	93.9	Very high	16 Å²	16	38 Å²	38	7%	0.07	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.7	-170	-72	-86.3	0	0	0	112.8	I457 C470 I472 L490 V492 L500	I457-F508 HydrophobicContact CD1-CE1 4.41Å; I457-F508 HydrophobicContact CD1-CE2 4.04Å; I457-F508 HydrophobicContact CD1-CZ 3.8Å; C470-F508 HydrophobicContact CB-CE2 4.27Å; I472-F508 HydrophobicContact CD1-CB 3.92Å; I472-F508 HydrophobicContact CD1-CD1 4.26Å; I472-F508 HydrophobicContact CD1-CD2 3.35Å; I472-F508 HydrophobicContact CD1-CE2 3.88Å; I472-F508 HydrophobicContact CD1-CG 3.57Å; L490-F508 HydrophobicContact CB-CE1 3.93Å; L490-F508 HydrophobicContact CB-CZ 4.17Å; L490-F508 HydrophobicContact CD1-CZ 4.19Å; V492-F508 HydrophobicContact CG2-CD1 3.7Å; V492-F508 HydrophobicContact CG2-CE1 3.32Å; V492-F508 HydrophobicContact CG2-CZ 3.91Å; L500-F508 HydrophobicContact CB-CB 4.03Å; L500-F508 HydrophobicContact CB-CD1 4.21Å; L500-F508 HydrophobicContact CD1-CB 4.09Å
509	V	93.9	Very high	93.8	Very high	97 Å²	97	38 Å²	38	59%	0.588	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	143.4	176.6	-63.4	0	0	0	0	110.8	L500 R501	L500-V509 CarbonylContact C-O 3.56Å; L500-V509 WeakPolarHBondContact CA-O 3.47Å; R501-V509 PolarHBondContact N-O 2.95Å; R501-V509 WeakPolarHBondContact O-CG2 3.03Å; R501-V509 PolarHBondContact O-N 2.82Å
510	A	93.4	Very high	93.8	Very high	32 Å²	32	41.7 Å²	41.7	26%	0.264	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	132.4	178.9	0	0	0	0	0	111.3	F476 L500 Q513	F476-A510 HydrophobicContact CE1-CB 3.64Å; F476-A510 HydrophobicContact CZ-CB 3.62Å; L500-A510 HydrophobicContact CD2-CB 3.61Å; A510-Q513 HydrophobicContact CB-CG 3.73Å
511	I	93	Very high	93.8	Very high	45 Å²	45	41.7 Å²	41.7	23%	0.231	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	-20.1	173.3	57.8	164.9	0	0	0	112.2	Y216 I218 L491 I499 R501	Y216-I511 HydrophobicContact CD1-CD1 4.33Å; Y216-I511 HydrophobicContact CE1-CB 4.34Å; Y216-I511 HydrophobicContact CE1-CD1 4.04Å; I218-I511 HydrophobicContact CD1-CD1 4.31Å; I218-I511 HydrophobicContact CG1-CD1 4.45Å; L491-I511 HydrophobicContact CD2-CD1 4.04Å; I499-I511 HydrophobicContact CB-CG1 4.25Å; I499-I511 HydrophobicContact CG2-CD1 3.99Å; I499-I511 HydrophobicContact CG2-CG1 4Å; I499-I511 VanDerWaalsContact O-CG1 3.27Å; I499-I511 WeakPolarHBondContact O-CG1 3.44Å; I499-I511 PolarHBondContact O-N 3.02Å; R501-I511 HydrophobicContact CB-CD1 4.19Å; R501-I511 HydrophobicContact CB-CG1 4.43Å; R501-I511 HydrophobicContact CB-CG2 3.86Å
512	V	92.8	Very high	93.9	Very high	10 Å²	10	37.3 Å²	37.3	6%	0.061	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	137	173.1	-178.1	0	0	0	0	107.9	G187 Y216 A498 I499	G187-V512 WeakPolarHBondContact O-CG1 3.22Å; Y216-V512 HydrophobicContact CD1-CG2 4.19Å; Y216-V512 HydrophobicContact CE1-CG2 4.3Å; A498-V512 CarbonylContact C-O 3.09Å; A498-V512 WeakPolarHBondContact CA-O 3.47Å; I499-V512 HydrophobicContact CB-CB 3.99Å; I499-V512 HydrophobicContact CB-CG2 4.33Å; I499-V512 HydrophobicContact CD1-CB 4.16Å; I499-V512 HydrophobicContact CD1-CG2 4.15Å; I499-V512 HydrophobicContact CG1-CB 4.21Å; I499-V512 PolarHBondContact N-O 2.91Å; I499-V512 PolarHBondContact O-N 3.3Å
513	Q	92	Very high	94	Very high	63 Å²	63	36.7 Å²	36.7	29%	0.294	21%	0.208	S	C	.	.			trans	-142	154.1	176.2	-65	-175	-110.9	0	0	110	Y186 G187 A498 A510 L550	Y186-Q513 CarbonylContact C-O 3.52Å; G187-Q513 WeakPolarHBondContact CA-O 3.14Å; G187-Q513 PolarHBondContact N-O 2.75Å; A498-Q513 HydrophobicContact CB-CG 4.27Å; A510-Q513 HydrophobicContact CB-CG 3.73Å; Q513-L550 HydrophobicContact CB-CD2 4.49Å
514	G	90.8	Very high	94.1	Very high	7 Å²	7	37.4 Å²	37.4	7%	0.072	21%	0.212	C	C	.	.			trans	-159.8	174.6	172.7	0	0	0	0	0	111.9	N497	N497-G514 PolarHBondContact O-N 2.89Å
515	H	94.1	Very high	94.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.207	C	C	.	.			trans	-69.8	161.5	177.8	-75.5	-76.1	0	0	0	112.4	N497 M519 T533 S535 D537 C541 T781	N497-H515 PolarHBondContact ND2-O 3.07Å; H515-M519 HydrophobicContact CB-CG 3.9Å; H515-M519 HydrophobicContact CB-SD 3.66Å; H515-M519 PolarHBondContact CD2-SD 2.8Å; H515-T533 PolarHBondContact NE2-OG1 2.99Å; H515-S535 VanDerWaalsContact ND1-CB 3.27Å; H515-S535 WeakPolarHBondContact ND1-CB 3.48Å; H515-D537 WeakPolarHBondContact CA-OD2 3.27Å; H515-D537 WeakPolarHBondContact CB-OD2 3.38Å; H515-D537 IonicContact CG-OD2 3.68Å; H515-D537 IonicContact ND1-OD1 2.68Å; H515-D537 PolarHBondContact ND1-OD1 3.24Å; H515-D537 IonicContact ND1-OD2 2.73Å; H515-D537 PolarHBondContact ND1-OD2 3.11Å; H515-D537 VanDerWaalsContact ND1-OD2 3.13Å; H515-C541 PolarHBondContact CE1-SG 3.38Å; H515-T781 WeakPolarHBondContact O-CB 3.37Å
516	L	93.1	Very high	94.5	Very high	27 Å²	27	34.4 Å²	34.4	14%	0.141	19%	0.193	C	C	.	.	S	Bend	trans	-104.1	-15.1	-175.7	-54.2	-173.9	0	0	0	114.1	R191 R496 N497 D537	R191-L516 WeakPolarHBondContact CD-O 3.46Å; R191-L516 PolarHBondContact NH1-O 2.96Å; R496-L516 HydrophobicContact CB-CD1 4.03Å; R496-L516 HydrophobicContact CB-CD2 3.76Å; R496-L516 HydrophobicContact CG-CD1 3.82Å; R496-L516 HydrophobicContact CG-CD2 4.36Å; R496-L516 WeakPolarHBondContact O-CD2 3.42Å; N497-L516 HydrophobicContact CB-CD2 3.84Å; L516-D537 HydrophobicContact CB-CB 3.9Å; L516-D537 HydrophobicContact CG-CB 4.48Å; L516-D537 PolarHBondContact N-OD2 2.85Å
517	D	94.6	Very high	94.7	Very high	62 Å²	62	31.2 Å²	31.2	33%	0.332	18%	0.182	S	C	.	.	S	Bend	trans	-148	178	-171.7	-140.9	-41.5	0	0	0	110.6	R191 M519 S535 H536 D537	R191-D517 IonicContact NH1-OD2 3.02Å; D517-M519 PolarHBondContact O-N 3.45Å; D517-S535 PolarHBondContact O-OG 2.95Å; D517-H536 HydrophobicContact CB-CB 3.91Å; D517-D537 HydrophobicContact CB-CB 3.99Å
518	E	95.2	Very high	94.8	Very high	28 Å²	28	35 Å²	35	13%	0.131	19%	0.193	C	C	.	.			trans	-55.2	131	-172.6	-172.5	170	-176.3	0	0	113	W520 S535 H536 H760 G778 K779	E518-W520 PolarHBondContact OE1-NE1 2.75Å; E518-W520 VanDerWaalsContact OE1-NE1 3.16Å; E518-S535 WeakPolarHBondContact O-CA 3.41Å; E518-S535 PolarHBondContact O-OG 3.46Å; E518-S535 VanDerWaalsContact O-OG 3.14Å; E518-H536 WeakPolarHBondContact O-CB 3.16Å; E518-H536 PolarHBondContact O-N 2.87Å; E518-H760 IonicContact OE1-CE1 2.93Å; E518-H760 PolarHBondContact OE1-CE1 3.48Å; E518-H760 IonicContact OE1-NE2 3.53Å; E518-H760 PolarHBondContact OE1-NE2 3.38Å; E518-G778 WeakPolarHBondContact CA-O 3.41Å; E518-K779 HydrophobicContact CB-CG 4.16Å; E518-K779 HydrophobicContact CG-CG 4Å; E518-K779 WeakPolarHBondContact OE2-CE 3.45Å
519	M	94.4	Very high	94.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	137	-176.2	-53.1	-178.4	-65.7	0	0	111	H515 D517 T762 I776 G778 C782 I783	H515-M519 HydrophobicContact CB-CG 3.9Å; H515-M519 HydrophobicContact CB-SD 3.66Å; H515-M519 PolarHBondContact CD2-SD 2.8Å; D517-M519 PolarHBondContact O-N 3.45Å; M519-T762 VanDerWaalsContact O-CB 3.3Å; M519-T762 WeakPolarHBondContact O-CB 3.24Å; M519-T762 WeakPolarHBondContact O-CG2 3.3Å; M519-T762 PolarHBondContact O-OG1 2.86Å; M519-I776 HydrophobicContact CB-CD1 4.07Å; M519-I776 HydrophobicContact CE-CB 4.06Å; M519-I776 HydrophobicContact CE-CG2 4.43Å; M519-G778 PolarHBondContact N-O 3.3Å; M519-C782 VanDerWaalsContact CE-O 3.24Å; M519-C782 WeakPolarHBondContact CE-O 3.36Å; M519-I783 HydrophobicContact CE-CG1 4.11Å; M519-I783 HydrophobicContact SD-CG1 4.14Å
520	W	96.1	Very high	94.8	Very high	79 Å²	79	31.4 Å²	31.4	30%	0.299	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	-35.1	177.3	-76.4	91.7	0	0	0	113	E518 C534 H536 L561 T762 N763	E518-W520 PolarHBondContact OE1-NE1 2.75Å; E518-W520 VanDerWaalsContact OE1-NE1 3.16Å; W520-C534 PolarHBondContact N-O 3.24Å; W520-H536 AromaticContact CD1-CE1 3.99Å; W520-H536 AromaticContact CD1-NE2 3.5Å; W520-H536 AromaticContact NE1-NE2 3.96Å; W520-L561 CarbonylContact C-O 3.56Å; W520-L561 HydrophobicContact CB-CD2 4.28Å; W520-L561 VanDerWaalsContact CB-O 3.26Å; W520-L561 WeakPolarHBondContact CB-O 3.43Å; W520-L561 HydrophobicContact CG-CD2 4.32Å; W520-T762 HydrophobicContact CD2-CG2 3.75Å; W520-T762 HydrophobicContact CE3-CG2 3.89Å; W520-T762 HydrophobicContact CG-CG2 4.4Å; W520-T762 HydrophobicContact CH2-CG2 3.88Å; W520-T762 HydrophobicContact CZ2-CG2 3.73Å; W520-T762 HydrophobicContact CZ3-CG2 3.95Å; W520-N763 PolarHBondContact O-ND2 2.56Å; W520-N763 VanDerWaalsContact O-ND2 3.08Å
521	G	96.1	Very high	94.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	126.4	-178.9	0	0	0	0	0	111.7	T533 C534 L561	G521-T533 VanDerWaalsContact O-CA 3.24Å; G521-T533 WeakPolarHBondContact O-CA 3.5Å; G521-C534 WeakPolarHBondContact CA-SG 3.22Å; G521-C534 PolarHBondContact N-O 3.36Å; G521-C534 PolarHBondContact O-N 3.31Å; G521-L561 VanDerWaalsContact CA-O 3.3Å; G521-L561 WeakPolarHBondContact CA-O 3.49Å; G521-L561 PolarHBondContact N-O 3.05Å
522	L	97.8	Very high	95.2	Very high	6 Å²	6	27.8 Å²	27.8	3%	0.031	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	129.1	174.1	175.8	64.7	0	0	0	107.9	F531 L532 T533 N763 C765 L774 I776	L522-F531 HydrophobicContact CD1-CD2 3.91Å; L522-L532 WeakPolarHBondContact CA-O 3.41Å; L522-T533 HydrophobicContact CD1-CG2 3.96Å; L522-N763 HydrophobicContact CB-CB 4.03Å; L522-N763 HydrophobicContact CD2-CB 4.32Å; L522-C765 HydrophobicContact CD2-CB 3.72Å; L522-C765 HydrophobicContact CG-CB 3.98Å; L522-L774 HydrophobicContact CD1-CB 4.3Å; L522-L774 HydrophobicContact CD1-CD1 4.27Å; L522-L774 HydrophobicContact CD2-CB 4.12Å; L522-I776 HydrophobicContact CB-CD1 4Å; L522-I776 HydrophobicContact CB-CG1 4.34Å; L522-I776 HydrophobicContact CD1-CG2 4.27Å; L522-I776 HydrophobicContact CD2-CG1 4.41Å; L522-I776 HydrophobicContact CD2-CG2 4.34Å
523	A	97.6	Very high	95.4	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.008	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	141.7	174.9	0	0	0	0	0	109.9	F531 L532 A563 F565	A523-F531 CarbonylContact O-C 3.57Å; A523-F531 VanDerWaalsContact O-CA 3.3Å; A523-F531 WeakPolarHBondContact O-CA 3.34Å; A523-F531 WeakPolarHBondContact O-CB 3.41Å; A523-L532 PolarHBondContact N-O 2.92Å; A523-L532 PolarHBondContact O-N 2.96Å; A523-A563 HydrophobicContact CB-CB 4.14Å; A523-F565 HydrophobicContact CB-CD2 3.7Å; A523-F565 HydrophobicContact CB-CE2 3.81Å; A523-F565 WeakPolarHBondContact O-CE2 3.29Å
524	T	97.2	Very high	95.6	Very high	22 Å²	22	24.3 Å²	24.3	14%	0.135	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	142.7	174.6	51.8	0	0	0	0	110.2	F531 F565 C765 F766 L774	T524-F531 HydrophobicContact CG2-CB 4.13Å; T524-F565 VanDerWaalsContact O-CD2 3.25Å; T524-F565 WeakPolarHBondContact O-CD2 3.34Å; T524-C765 HydrophobicContact CG2-CB 4.13Å; T524-C765 PolarHBondContact OG1-SG 3.06Å; T524-F766 WeakPolarHBondContact CB-O 3.43Å; T524-F766 WeakPolarHBondContact CG2-O 3.3Å; T524-F766 PolarHBondContact OG1-O 2.91Å; T524-L774 HydrophobicContact CG2-CD1 3.67Å
525	H	97.4	Very high	95.9	Very high	2 Å²	2	24 Å²	24	1%	0.009	13%	0.129	C	C	.	.			trans	-68.8	142.4	179.5	-173.6	-86.6	0	0	0	110.5	S527 Q528 I530 F565 G569 H768	H525-S527 PolarHBondContact CE1-OG 2.78Å; H525-S527 PolarHBondContact ND1-N 3.29Å; H525-S527 VanDerWaalsContact ND1-N 3.18Å; H525-S527 PolarHBondContact ND1-OG 2.96Å; H525-S527 PolarHBondContact O-N 2.99Å; H525-Q528 HydrophobicContact CB-CB 4.38Å; H525-Q528 VanDerWaalsContact ND1-CB 3.32Å; H525-Q528 WeakPolarHBondContact ND1-CB 3.48Å; H525-Q528 PolarHBondContact ND1-N 3.41Å; H525-I530 HydrophobicContact CB-CD1 4.12Å; H525-I530 HydrophobicContact CB-CG1 3.41Å; H525-I530 VanDerWaalsContact CB-CG1 3.41Å; H525-I530 WeakPolarHBondContact CB-O 3.23Å; H525-I530 PolarHBondContact N-O 3.15Å; H525-F565 HydrophobicContact CB-CD1 4.43Å; H525-F565 HydrophobicContact CB-CE1 4.29Å; H525-F565 HydrophobicContact CB-CZ 4.35Å; H525-F565 AromaticContact CD2-CD1 3.64Å; H525-F565 AromaticContact CD2-CE1 3.72Å; H525-G569 WeakPolarHBondContact NE2-CA 3.33Å; H525-G569 PolarHBondContact NE2-O 3.14Å; H525-H768 WeakPolarHBondContact O-CB 3.41Å
526	P	95.6	Very high	96	Very high	59 Å²	59	26.3 Å²	26.3	38%	0.383	14%	0.14	S	C	.	.	S	Bend	trans	-67.4	-17.4	-173.1	25.8	-37.3	0	0	0	115.1	H768	P526-H768 WeakPolarHBondContact O-CB 3.06Å
527	S	95.1	Very high	96	Very high	76 Å²	76	26.1 Å²	26.1	53%	0.531	14%	0.139	S	C	.	.	S	Bend	trans	-145.5	-3.3	-173.7	61.1	0	0	0	0	116.2	H525	H525-S527 PolarHBondContact CE1-OG 2.78Å; H525-S527 PolarHBondContact ND1-N 3.29Å; H525-S527 VanDerWaalsContact ND1-N 3.18Å; H525-S527 PolarHBondContact ND1-OG 2.96Å; H525-S527 PolarHBondContact O-N 2.99Å
528	Q	95.3	Very high	96.1	Very high	102 Å²	102	29.1 Å²	29.1	48%	0.477	15%	0.146	S	C	.	.	S	Bend	trans	-125.3	155.5	-174.4	-64.3	178.3	27.2	0	0	108.9	H525 I530 H768	H525-Q528 HydrophobicContact CB-CB 4.38Å; H525-Q528 VanDerWaalsContact ND1-CB 3.32Å; H525-Q528 WeakPolarHBondContact ND1-CB 3.48Å; H525-Q528 PolarHBondContact ND1-N 3.41Å; Q528-I530 HydrophobicContact CB-CD1 4.36Å; Q528-I530 HydrophobicContact CB-CG1 4.16Å; Q528-I530 PolarHBondContact O-N 2.79Å; Q528-H768 VanDerWaalsContact C-CE1 3.41Å; Q528-H768 PolarHBondContact O-CE1 3.09Å; Q528-H768 PolarHBondContact O-ND1 3.32Å
529	S	93.5	Very high	96.1	Very high	22 Å²	22	29.7 Å²	29.7	15%	0.154	15%	0.149	C	C	.	.	S	Bend	trans	-78.7	52.1	177.7	-61.6	0	0	0	0	111.5	T545 E546	S529-T545 VanDerWaalsContact C-OG1 3.23Å; S529-T545 WeakPolarHBondContact CA-OG1 3.47Å; S529-T545 VanDerWaalsContact CB-OG1 3.25Å; S529-T545 WeakPolarHBondContact CB-OG1 3.38Å; S529-T545 PolarHBondContact O-N 2.93Å; S529-T545 PolarHBondContact O-OG1 2.9Å; S529-E546 WeakPolarHBondContact CB-OE1 3.1Å; S529-E546 PolarHBondContact OG-OE1 2.88Å
530	I	95.4	Very high	96.2	Very high	17 Å²	17	29.7 Å²	29.7	9%	0.087	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	154.7	177.8	70.2	-175.6	0	0	0	110.5	H525 Q528 L542 W543	H525-I530 HydrophobicContact CB-CD1 4.12Å; H525-I530 HydrophobicContact CB-CG1 3.41Å; H525-I530 VanDerWaalsContact CB-CG1 3.41Å; H525-I530 WeakPolarHBondContact CB-O 3.23Å; H525-I530 PolarHBondContact N-O 3.15Å; Q528-I530 HydrophobicContact CB-CD1 4.36Å; Q528-I530 HydrophobicContact CB-CG1 4.16Å; Q528-I530 PolarHBondContact O-N 2.79Å; I530-L542 HydrophobicContact CD1-CD1 4.18Å; I530-L542 HydrophobicContact CD1-CD2 4.23Å; I530-L542 HydrophobicContact CG1-CD1 4.38Å; I530-W543 CarbonylContact C-O 3.45Å; I530-W543 WeakPolarHBondContact CA-O 3.49Å; I530-W543 WeakPolarHBondContact CB-O 3.23Å
531	F	96.9	Very high	96.2	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	160.1	176.6	70.2	-82.8	0	0	0	111	Y186 L522 A523 T524 T533 W543 T545 L774 I783	Y186-F531 HydrophobicContact CD2-CZ 4.38Å; Y186-F531 HydrophobicContact CE2-CE1 4.36Å; Y186-F531 HydrophobicContact CE2-CZ 4.02Å; L522-F531 HydrophobicContact CD1-CD2 3.91Å; A523-F531 CarbonylContact O-C 3.57Å; A523-F531 VanDerWaalsContact O-CA 3.3Å; A523-F531 WeakPolarHBondContact O-CA 3.34Å; A523-F531 WeakPolarHBondContact O-CB 3.41Å; T524-F531 HydrophobicContact CG2-CB 4.13Å; F531-T533 HydrophobicContact CD2-CG2 3.96Å; F531-T533 HydrophobicContact CE2-CG2 3.85Å; F531-W543 HydrophobicContact CD1-CB 3.7Å; F531-W543 HydrophobicContact CD2-CB 4.23Å; F531-W543 AromaticContact CD2-CD1 3.7Å; F531-W543 HydrophobicContact CD2-CG 4.24Å; F531-W543 HydrophobicContact CE1-CB 3.3Å; F531-W543 HydrophobicContact CE1-CG 4.01Å; F531-W543 HydrophobicContact CE2-CB 3.84Å; F531-W543 AromaticContact CE2-CD1 3.3Å; F531-W543 AromaticContact CE2-CG 3.64Å; F531-W543 HydrophobicContact CE2-CG 3.64Å; F531-W543 AromaticContact CE2-NE1 3.99Å; F531-W543 HydrophobicContact CG-CB 4.19Å; F531-W543 HydrophobicContact CZ-CB 3.37Å; F531-W543 AromaticContact CZ-CD1 3.72Å; F531-W543 HydrophobicContact CZ-CD2 4.33Å; F531-W543 AromaticContact CZ-CG 3.53Å; F531-W543 HydrophobicContact CZ-CG 3.53Å; F531-W543 PolarHBondContact N-O 3.35Å; F531-W543 PolarHBondContact O-N 2.93Å; F531-T545 HydrophobicContact CD1-CG2 3.35Å; F531-T545 HydrophobicContact CE1-CG2 3.72Å; F531-T545 HydrophobicContact CG-CG2 4.47Å; F531-L774 HydrophobicContact CB-CD1 3.45Å; F531-L774 VanDerWaalsContact CB-CD1 3.45Å; F531-L774 HydrophobicContact CD1-CD1 3.6Å; F531-L774 HydrophobicContact CD1-CD2 4.47Å; F531-L774 HydrophobicContact CD2-CD1 3.68Å; F531-L774 HydrophobicContact CE1-CD1 4.16Å; F531-L774 HydrophobicContact CE1-CD2 4.31Å; F531-L774 HydrophobicContact CE2-CD1 4.26Å; F531-L774 HydrophobicContact CG-CD1 3.3Å; F531-L774 HydrophobicContact CZ-CD1 4.47Å; F531-I783 HydrophobicContact CE2-CD1 4.31Å; F531-I783 HydrophobicContact CE2-CG2 3.92Å; F531-I783 HydrophobicContact CZ-CG2 4.07Å
532	L	97.7	Very high	96.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	140.3	-179	-177.3	138.2	0	0	0	110.7	L522 A523 V540 C541 L542 W552 A563 F565 V572 V574	L522-L532 WeakPolarHBondContact CA-O 3.41Å; A523-L532 PolarHBondContact N-O 2.92Å; A523-L532 PolarHBondContact O-N 2.96Å; L532-V540 HydrophobicContact CD1-CG1 3.57Å; L532-V540 HydrophobicContact CD2-CG1 3.82Å; L532-V540 HydrophobicContact CG-CG1 3.79Å; L532-C541 VanDerWaalsContact CA-O 3.31Å; L532-C541 WeakPolarHBondContact CA-O 3.31Å; L532-L542 HydrophobicContact CB-CD1 4.18Å; L532-L542 HydrophobicContact CD1-CD1 4.36Å; L532-W552 HydrophobicContact CD1-CH2 4.03Å; L532-A563 HydrophobicContact CD2-CB 3.53Å; L532-F565 HydrophobicContact CB-CE2 3.81Å; L532-F565 HydrophobicContact CB-CZ 3.74Å; L532-V572 HydrophobicContact CD1-CB 4.39Å; L532-V572 HydrophobicContact CD1-CG1 3.75Å; L532-V572 HydrophobicContact CD1-CG2 3.99Å; L532-V572 HydrophobicContact CD2-CG2 4.18Å; L532-V574 HydrophobicContact CD2-CG2 4.42Å
533	T	97.6	Very high	96.1	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	147.9	171.9	57.6	0	0	0	0	111.5	H515 G521 L522 F531 V540 C541 W543 I776 I783	H515-T533 PolarHBondContact NE2-OG1 2.99Å; G521-T533 VanDerWaalsContact O-CA 3.24Å; G521-T533 WeakPolarHBondContact O-CA 3.5Å; L522-T533 HydrophobicContact CD1-CG2 3.96Å; F531-T533 HydrophobicContact CD2-CG2 3.96Å; F531-T533 HydrophobicContact CE2-CG2 3.85Å; T533-V540 WeakPolarHBondContact O-CA 3.35Å; T533-C541 PolarHBondContact N-O 3.01Å; T533-C541 PolarHBondContact O-N 2.99Å; T533-W543 PolarHBondContact OG1-NE1 3.42Å; T533-I776 HydrophobicContact CG2-CG2 4.27Å; T533-I783 HydrophobicContact CG2-CD1 3.87Å
534	C	96.7	Very high	95.8	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	147.5	169.5	67.3	0	0	0	0	111.8	W520 G521 Q539 V540 V574	W520-C534 PolarHBondContact N-O 3.24Å; G521-C534 WeakPolarHBondContact CA-SG 3.22Å; G521-C534 PolarHBondContact N-O 3.36Å; G521-C534 PolarHBondContact O-N 3.31Å; C534-Q539 WeakPolarHBondContact CA-O 3.38Å; C534-V540 HydrophobicContact CB-CG2 3.92Å; C534-V574 HydrophobicContact CB-CG1 4.28Å
535	S	95.7	Very high	95.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	162.5	-168.6	169.1	0	0	0	0	112.3	H515 D517 E518 D537 R538 Q539 Y559	H515-S535 VanDerWaalsContact ND1-CB 3.27Å; H515-S535 WeakPolarHBondContact ND1-CB 3.48Å; D517-S535 PolarHBondContact O-OG 2.95Å; E518-S535 WeakPolarHBondContact O-CA 3.41Å; E518-S535 PolarHBondContact O-OG 3.46Å; E518-S535 VanDerWaalsContact O-OG 3.14Å; S535-D537 WeakPolarHBondContact CB-OD1 3.37Å; S535-D537 PolarHBondContact O-N 3.38Å; S535-D537 VanDerWaalsContact O-N 3.14Å; S535-D537 VanDerWaalsContact OG-CG 3.31Å; S535-D537 PolarHBondContact OG-N 3.19Å; S535-D537 PolarHBondContact OG-OD1 3.19Å; S535-R538 PolarHBondContact O-N 3.05Å; S535-Q539 PolarHBondContact N-O 3.4Å; S535-Y559 WeakPolarHBondContact O-CB 3.24Å
536	H	96.1	Very high	95	Very high	49 Å²	49	33.1 Å²	33.1	23%	0.227	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-17.1	169.5	-70.4	-172	0	0	0	113.7	D517 E518 W520 R538 Y559 L561	D517-H536 HydrophobicContact CB-CB 3.91Å; E518-H536 WeakPolarHBondContact O-CB 3.16Å; E518-H536 PolarHBondContact O-N 2.87Å; W520-H536 AromaticContact CD1-CE1 3.99Å; W520-H536 AromaticContact CD1-NE2 3.5Å; W520-H536 AromaticContact NE1-NE2 3.96Å; H536-R538 PolarHBondContact O-N 2.83Å; H536-Y559 VanDerWaalsContact CA-CB 3.48Å; H536-Y559 AromaticContact CD2-CD2 3.39Å; H536-Y559 WeakPolarHBondContact CD2-CD2 3.46Å; H536-Y559 AromaticContact CD2-CE2 3.78Å; H536-Y559 AromaticContact NE2-CD2 3.92Å; H536-Y559 AromaticContact NE2-CE2 3.84Å; H536-L561 VanDerWaalsContact NE2-CD2 3.32Å; H536-L561 WeakPolarHBondContact NE2-CD2 3.27Å
537	D	94.5	Very high	94.6	Very high	23 Å²	23	35.2 Å²	35.2	12%	0.123	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	1.6	171.8	66.9	11.4	0	0	0	114.3	H515 L516 D517 S535 Q539	H515-D537 WeakPolarHBondContact CA-OD2 3.27Å; H515-D537 WeakPolarHBondContact CB-OD2 3.38Å; H515-D537 IonicContact CG-OD2 3.68Å; H515-D537 IonicContact ND1-OD1 2.68Å; H515-D537 PolarHBondContact ND1-OD1 3.24Å; H515-D537 IonicContact ND1-OD2 2.73Å; H515-D537 PolarHBondContact ND1-OD2 3.11Å; H515-D537 VanDerWaalsContact ND1-OD2 3.13Å; L516-D537 HydrophobicContact CB-CB 3.9Å; L516-D537 HydrophobicContact CG-CB 4.48Å; L516-D537 PolarHBondContact N-OD2 2.85Å; D517-D537 HydrophobicContact CB-CB 3.99Å; S535-D537 WeakPolarHBondContact CB-OD1 3.37Å; S535-D537 PolarHBondContact O-N 3.38Å; S535-D537 VanDerWaalsContact O-N 3.14Å; S535-D537 VanDerWaalsContact OG-CG 3.31Å; S535-D537 PolarHBondContact OG-N 3.19Å; S535-D537 PolarHBondContact OG-OD1 3.19Å; D537-Q539 PolarHBondContact O-N 2.87Å; D537-Q539 WeakPolarHBondContact OD1-CA 3.16Å; D537-Q539 WeakPolarHBondContact OD1-CB 3.45Å; D537-Q539 PolarHBondContact OD1-N 3.26Å
538	R	95.8	Very high	94.2	Very high	125 Å²	125	33.5 Å²	33.5	47%	0.472	16%	0.156	S	C	.	.	S	Bend	trans	66.8	8.9	-175.3	-49.7	-176.3	-72	-96.3	-3.7	114.3	S535 H536 T555 L556 E557	S535-R538 PolarHBondContact O-N 3.05Å; H536-R538 PolarHBondContact O-N 2.83Å; R538-T555 HydrophobicContact CB-CG2 4.24Å; R538-T555 WeakPolarHBondContact O-CA 3.18Å; R538-L556 WeakPolarHBondContact CB-O 3.45Å; R538-L556 PolarHBondContact O-N 2.95Å; R538-E557 VanDerWaalsContact CD-O 3.3Å; R538-E557 WeakPolarHBondContact CD-O 3.49Å
539	Q	95.3	Very high	93.9	Very high	40 Å²	40	30.9 Å²	30.9	19%	0.187	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	137.1	175.9	-59.4	-160.1	-34.3	0	0	110.8	C534 S535 D537 C553 I554	C534-Q539 WeakPolarHBondContact CA-O 3.38Å; S535-Q539 PolarHBondContact N-O 3.4Å; D537-Q539 PolarHBondContact O-N 2.87Å; D537-Q539 WeakPolarHBondContact OD1-CA 3.16Å; D537-Q539 WeakPolarHBondContact OD1-CB 3.45Å; D537-Q539 PolarHBondContact OD1-N 3.26Å; Q539-C553 VanDerWaalsContact CD-SG 3.55Å; Q539-I554 WeakPolarHBondContact CA-O 3.47Å
540	V	96.7	Very high	93.8	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	119.2	166.5	-180	0	0	0	0	107.3	L532 T533 C534 W552 C553 I554 L556 V574 L584	L532-V540 HydrophobicContact CD1-CG1 3.57Å; L532-V540 HydrophobicContact CD2-CG1 3.82Å; L532-V540 HydrophobicContact CG-CG1 3.79Å; T533-V540 WeakPolarHBondContact O-CA 3.35Å; C534-V540 HydrophobicContact CB-CG2 3.92Å; V540-W552 HydrophobicContact CG1-CZ3 4.36Å; V540-C553 VanDerWaalsContact O-CA 3.31Å; V540-C553 WeakPolarHBondContact O-CA 3.29Å; V540-I554 HydrophobicContact CB-CG1 3.93Å; V540-I554 PolarHBondContact N-O 2.88Å; V540-I554 PolarHBondContact O-N 3.33Å; V540-L556 HydrophobicContact CG2-CD1 3.48Å; V540-L556 VanDerWaalsContact CG2-CD1 3.48Å; V540-L556 HydrophobicContact CG2-CG 3.81Å; V540-V574 HydrophobicContact CG1-CG2 4.42Å; V540-V574 HydrophobicContact CG2-CG1 4.37Å; V540-L584 HydrophobicContact CG1-CD1 4.12Å
541	C	96.2	Very high	93.6	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.014	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	128.8	-171.8	-67	0	0	0	0	109.7	H515 L532 T533 W543 L550	H515-C541 PolarHBondContact CE1-SG 3.38Å; L532-C541 VanDerWaalsContact CA-O 3.31Å; L532-C541 WeakPolarHBondContact CA-O 3.31Å; T533-C541 PolarHBondContact N-O 3.01Å; T533-C541 PolarHBondContact O-N 2.99Å; C541-W543 HydrophobicContact CB-CD2 4.44Å; C541-W543 VanDerWaalsContact CB-CE2 3.47Å; C541-W543 HydrophobicContact CB-CZ2 3.54Å; C541-W543 VanDerWaalsContact CB-NE1 3.31Å; C541-W543 PolarHBondContact O-NE1 2.85Å; C541-L550 HydrophobicContact CB-CD1 3.6Å
542	L	96.4	Very high	93.5	Very high	6 Å²	6	35.1 Å²	35.1	3%	0.031	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128.4	169.6	-171.2	77	0	0	0	109.1	I530 L532 D551 W552 F565 L586	I530-L542 HydrophobicContact CD1-CD1 4.18Å; I530-L542 HydrophobicContact CD1-CD2 4.23Å; I530-L542 HydrophobicContact CG1-CD1 4.38Å; L532-L542 HydrophobicContact CB-CD1 4.18Å; L532-L542 HydrophobicContact CD1-CD1 4.36Å; L542-D551 HydrophobicContact CD2-CB 4.35Å; L542-D551 PolarHBondContact O-N 3.17Å; L542-W552 HydrophobicContact CB-CD2 3.77Å; L542-W552 VanDerWaalsContact CB-CE2 3.45Å; L542-W552 HydrophobicContact CB-CE3 4.16Å; L542-W552 HydrophobicContact CB-CG 4.3Å; L542-W552 HydrophobicContact CB-CH2 3.98Å; L542-W552 HydrophobicContact CB-CZ2 3.58Å; L542-W552 HydrophobicContact CB-CZ3 4.25Å; L542-W552 HydrophobicContact CD1-CZ2 4.4Å; L542-W552 HydrophobicContact CD2-CD2 4.49Å; L542-W552 HydrophobicContact CD2-CZ2 3.74Å; L542-W552 HydrophobicContact CG-CZ2 4.11Å; L542-W552 PolarHBondContact N-O 3.39Å; L542-F565 HydrophobicContact CD1-CE1 4.39Å; L542-F565 HydrophobicContact CD1-CZ 3.93Å; L542-L586 HydrophobicContact CD1-CD2 4.26Å
543	W	95.1	Very high	93.3	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.015	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	144	-172.6	-51.6	91.1	0	0	0	110.7	Y186 I530 F531 T533 C541 L550 I783	Y186-W543 HydrophobicContact CD1-CD2 4.24Å; Y186-W543 AromaticContact CD1-CE3 3.44Å; Y186-W543 HydrophobicContact CD1-CE3 3.44Å; Y186-W543 VanDerWaalsContact CD1-CE3 3.44Å; Y186-W543 AromaticContact CD1-CZ3 3.64Å; Y186-W543 HydrophobicContact CD1-CZ3 3.64Å; Y186-W543 AromaticContact CE1-CE3 3.85Å; Y186-W543 HydrophobicContact CE1-CE3 3.85Å; Y186-W543 HydrophobicContact CE1-CZ3 4.44Å; Y186-W543 HydrophobicContact CG-CE3 4.26Å; Y186-W543 HydrophobicContact CG-CZ3 4.32Å; I530-W543 CarbonylContact C-O 3.45Å; I530-W543 WeakPolarHBondContact CA-O 3.49Å; I530-W543 WeakPolarHBondContact CB-O 3.23Å; F531-W543 HydrophobicContact CD1-CB 3.7Å; F531-W543 HydrophobicContact CD2-CB 4.23Å; F531-W543 AromaticContact CD2-CD1 3.7Å; F531-W543 HydrophobicContact CD2-CG 4.24Å; F531-W543 HydrophobicContact CE1-CB 3.3Å; F531-W543 HydrophobicContact CE1-CG 4.01Å; F531-W543 HydrophobicContact CE2-CB 3.84Å; F531-W543 AromaticContact CE2-CD1 3.3Å; F531-W543 AromaticContact CE2-CG 3.64Å; F531-W543 HydrophobicContact CE2-CG 3.64Å; F531-W543 AromaticContact CE2-NE1 3.99Å; F531-W543 HydrophobicContact CG-CB 4.19Å; F531-W543 HydrophobicContact CZ-CB 3.37Å; F531-W543 AromaticContact CZ-CD1 3.72Å; F531-W543 HydrophobicContact CZ-CD2 4.33Å; F531-W543 AromaticContact CZ-CG 3.53Å; F531-W543 HydrophobicContact CZ-CG 3.53Å; F531-W543 PolarHBondContact N-O 3.35Å; F531-W543 PolarHBondContact O-N 2.93Å; T533-W543 PolarHBondContact OG1-NE1 3.42Å; C541-W543 HydrophobicContact CB-CD2 4.44Å; C541-W543 VanDerWaalsContact CB-CE2 3.47Å; C541-W543 HydrophobicContact CB-CZ2 3.54Å; C541-W543 VanDerWaalsContact CB-NE1 3.31Å; C541-W543 PolarHBondContact O-NE1 2.85Å; W543-L550 HydrophobicContact CD2-CD1 3.86Å; W543-L550 HydrophobicContact CE3-CB 3.87Å; W543-L550 HydrophobicContact CE3-CD1 3.76Å; W543-L550 HydrophobicContact CE3-CG 4.44Å; W543-L550 HydrophobicContact CH2-CD1 3.87Å; W543-L550 HydrophobicContact CZ2-CD1 3.96Å; W543-L550 HydrophobicContact CZ3-CB 3.74Å; W543-L550 HydrophobicContact CZ3-CD1 3.77Å; W543-L550 HydrophobicContact CZ3-CG 4.29Å; W543-I783 HydrophobicContact CZ2-CD1 3.88Å
544	N	92.3	Very high	93.2	Very high	28 Å²	28	38.9 Å²	38.9	15%	0.15	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	126.5	170.8	-169.8	-52	0	0	0	110.1	Y186 E546 E547 H548 N549	Y186-N544 PolarHBondContact OH-O 3.47Å; N544-E546 WeakPolarHBondContact OD1-CA 2.95Å; N544-E546 PolarHBondContact OD1-N 2.8Å; N544-E547 HydrophobicContact CB-CB 4.34Å; N544-E547 PolarHBondContact OD1-N 3.48Å; N544-H548 WeakPolarHBondContact O-CA 3.28Å; N544-H548 PolarHBondContact O-N 2.8Å; N544-H548 VanDerWaalsContact O-N 3.16Å; N544-N549 VanDerWaalsContact CB-OD1 3.31Å; N544-N549 WeakPolarHBondContact CB-OD1 3.4Å; N544-N549 PolarHBondContact N-O 2.71Å
545	T	89.2	Confident	93.1	Very high	6 Å²	6	43.2 Å²	43.2	4%	0.037	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-17.8	-179.8	58.4	0	0	0	0	113.7	S529 F531 H548 T767 L774 Q785	S529-T545 VanDerWaalsContact C-OG1 3.23Å; S529-T545 WeakPolarHBondContact CA-OG1 3.47Å; S529-T545 VanDerWaalsContact CB-OG1 3.25Å; S529-T545 WeakPolarHBondContact CB-OG1 3.38Å; S529-T545 PolarHBondContact O-N 2.93Å; S529-T545 PolarHBondContact O-OG1 2.9Å; F531-T545 HydrophobicContact CD1-CG2 3.35Å; F531-T545 HydrophobicContact CE1-CG2 3.72Å; F531-T545 HydrophobicContact CG-CG2 4.47Å; T545-H548 PolarHBondContact O-CE1 2.95Å; T545-H548 PolarHBondContact O-ND1 3.44Å; T545-T767 HydrophobicContact CG2-CG2 4.3Å; T545-L774 HydrophobicContact CG2-CD2 4.46Å; T545-Q785 PolarHBondContact O-NE2 3.41Å; T545-Q785 PolarHBondContact O-OE1 3.48Å
546	E	87.8	Confident	93.1	Very high	136 Å²	136	44.1 Å²	44.1	64%	0.636	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-44.5	-179.5	-71.4	175.6	-164.6	0	0	111.7	S529 N544 H548	S529-E546 WeakPolarHBondContact CB-OE1 3.1Å; S529-E546 PolarHBondContact OG-OE1 2.88Å; N544-E546 WeakPolarHBondContact OD1-CA 2.95Å; N544-E546 PolarHBondContact OD1-N 2.8Å; E546-H548 PolarHBondContact O-CD2 2.9Å; E546-H548 PolarHBondContact O-NE2 3.33Å
547	E	86.7	Confident	92.9	Very high	102 Å²	102	48.9 Å²	48.9	48%	0.477	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-15.3	178.8	-64.1	-167.4	175.7	0	0	113	R221 N544 N549	R221-E547 PolarHBondContact NH2-O 2.84Å; N544-E547 HydrophobicContact CB-CB 4.34Å; N544-E547 PolarHBondContact OD1-N 3.48Å; E547-N549 VanDerWaalsContact C-N 3.3Å; E547-N549 WeakPolarHBondContact CB-OD1 3.1Å; E547-N549 PolarHBondContact O-N 3.43Å; E547-N549 PolarHBondContact OE2-ND2 2.79Å
548	H	88	Confident	92.9	Very high	40 Å²	40	50 Å²	50	19%	0.185	25%	0.246	C	C	.	.			trans	56.2	41	-178.5	-45.7	-66.8	0	0	0	114.4	W183 Y186 N544 T545 E546	W183-H548 WeakPolarHBondContact CB-CE1 3.4Å; W183-H548 AromaticContact CD1-CD2 3.99Å; W183-H548 AromaticContact CD1-CE1 3.86Å; W183-H548 AromaticContact CD1-CG 3.38Å; W183-H548 AromaticContact CD1-ND1 3.3Å; W183-H548 VanDerWaalsContact CD1-ND1 3.3Å; W183-H548 HydrophobicContact CD2-CB 4.06Å; W183-H548 AromaticContact CD2-CD2 3.22Å; W183-H548 AromaticContact CD2-CE1 3.78Å; W183-H548 AromaticContact CD2-CG 3.45Å; W183-H548 VanDerWaalsContact CD2-CG 3.45Å; W183-H548 AromaticContact CD2-ND1 3.8Å; W183-H548 AromaticContact CD2-NE2 3.44Å; W183-H548 VanDerWaalsContact CE2-CB 3.45Å; W183-H548 AromaticContact CE2-CD2 3.46Å; W183-H548 VanDerWaalsContact CE2-CD2 3.46Å; W183-H548 AromaticContact CE2-CG 3.4Å; W183-H548 AromaticContact CE3-CD2 3.43Å; W183-H548 VanDerWaalsContact CE3-CD2 3.43Å; W183-H548 AromaticContact CE3-NE2 3.47Å; W183-H548 HydrophobicContact CG-CB 4.15Å; W183-H548 AromaticContact CG-CD2 3.59Å; W183-H548 AromaticContact CG-CE1 3.33Å; W183-H548 AromaticContact CG-CG 3.43Å; W183-H548 VanDerWaalsContact CG-CG 3.43Å; W183-H548 AromaticContact CG-ND1 3.27Å; W183-H548 VanDerWaalsContact CG-ND1 3.27Å; W183-H548 AromaticContact CG-NE2 3.51Å; W183-H548 AromaticContact CH2-CD2 3.9Å; W183-H548 HydrophobicContact CZ2-CB 3.81Å; W183-H548 AromaticContact CZ2-CD2 3.82Å; W183-H548 AromaticContact CZ2-CG 3.99Å; W183-H548 AromaticContact CZ3-CD2 3.73Å; W183-H548 AromaticContact NE1-CD2 3.95Å; W183-H548 AromaticContact NE1-CG 3.4Å; W183-H548 AromaticContact NE1-ND1 3.84Å; Y186-H548 HydrophobicContact CE1-CB 4.42Å; Y186-H548 WeakPolarHBondContact OH-CA 3.48Å; Y186-H548 PolarHBondContact OH-ND1 3Å; N544-H548 WeakPolarHBondContact O-CA 3.28Å; N544-H548 PolarHBondContact O-N 2.8Å; N544-H548 VanDerWaalsContact O-N 3.16Å; T545-H548 PolarHBondContact O-CE1 2.95Å; T545-H548 PolarHBondContact O-ND1 3.44Å; E546-H548 PolarHBondContact O-CD2 2.9Å; E546-H548 PolarHBondContact O-NE2 3.33Å
549	N	87.5	Confident	92.8	Very high	48 Å²	48	48 Å²	48	26%	0.257	24%	0.239	S	C	.	.	S	Bend	trans	-123.7	165.8	176.3	56	3.8	0	0	0	111	N544 E547	N544-N549 VanDerWaalsContact CB-OD1 3.31Å; N544-N549 WeakPolarHBondContact CB-OD1 3.4Å; N544-N549 PolarHBondContact N-O 2.71Å; E547-N549 VanDerWaalsContact C-N 3.3Å; E547-N549 WeakPolarHBondContact CB-OD1 3.1Å; E547-N549 PolarHBondContact O-N 3.43Å; E547-N549 PolarHBondContact OE2-ND2 2.79Å
550	L	91.7	Very high	92.8	Very high	36 Å²	36	46.1 Å²	46.1	19%	0.188	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	118.2	171.1	178.3	72.6	0	0	0	108.1	Q513 C541 W543 W552 C553	Q513-L550 HydrophobicContact CB-CD2 4.49Å; C541-L550 HydrophobicContact CB-CD1 3.6Å; W543-L550 HydrophobicContact CD2-CD1 3.86Å; W543-L550 HydrophobicContact CE3-CB 3.87Å; W543-L550 HydrophobicContact CE3-CD1 3.76Å; W543-L550 HydrophobicContact CE3-CG 4.44Å; W543-L550 HydrophobicContact CH2-CD1 3.87Å; W543-L550 HydrophobicContact CZ2-CD1 3.96Å; W543-L550 HydrophobicContact CZ3-CB 3.74Å; W543-L550 HydrophobicContact CZ3-CD1 3.77Å; W543-L550 HydrophobicContact CZ3-CG 4.29Å; L550-W552 WeakPolarHBondContact CD1-O 3.21Å; L550-C553 HydrophobicContact CD1-CB 4.37Å; L550-C553 HydrophobicContact CD2-CB 3.95Å
551	D	92.6	Very high	92.8	Very high	70 Å²	70	46.7 Å²	46.7	37%	0.374	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	-49.9	178	-74.8	-9.8	0	0	0	110.4	L542	L542-D551 HydrophobicContact CD2-CB 4.35Å; L542-D551 PolarHBondContact O-N 3.17Å
552	W	94	Very high	92.8	Very high	22 Å²	22	47.1 Å²	47.1	8%	0.083	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	158.5	172.8	53.5	-100	0	0	0	111.8	L532 V540 L542 L550 I554 L586 K589	L532-W552 HydrophobicContact CD1-CH2 4.03Å; V540-W552 HydrophobicContact CG1-CZ3 4.36Å; L542-W552 HydrophobicContact CB-CD2 3.77Å; L542-W552 VanDerWaalsContact CB-CE2 3.45Å; L542-W552 HydrophobicContact CB-CE3 4.16Å; L542-W552 HydrophobicContact CB-CG 4.3Å; L542-W552 HydrophobicContact CB-CH2 3.98Å; L542-W552 HydrophobicContact CB-CZ2 3.58Å; L542-W552 HydrophobicContact CB-CZ3 4.25Å; L542-W552 HydrophobicContact CD1-CZ2 4.4Å; L542-W552 HydrophobicContact CD2-CD2 4.49Å; L542-W552 HydrophobicContact CD2-CZ2 3.74Å; L542-W552 HydrophobicContact CG-CZ2 4.11Å; L542-W552 PolarHBondContact N-O 3.39Å; L550-W552 WeakPolarHBondContact CD1-O 3.21Å; W552-I554 HydrophobicContact CE3-CG2 4.01Å; W552-I554 HydrophobicContact CZ3-CG1 4.16Å; W552-I554 HydrophobicContact CZ3-CG2 4.24Å; W552-L586 HydrophobicContact CZ2-CD2 3.89Å; W552-L586 PolarHBondContact NE1-O 2.92Å; W552-K589 HydrophobicContact CB-CD 4.14Å; W552-K589 HydrophobicContact CD2-CD 4.39Å; W552-K589 HydrophobicContact CD2-CG 4.21Å; W552-K589 HydrophobicContact CG-CD 3.99Å; W552-K589 HydrophobicContact CG-CG 4.24Å
553	C	93.9	Very high	92.9	Very high	47 Å²	47	47 Å²	47	32%	0.318	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	131.2	173.4	169.3	0	0	0	0	108.3	Q539 V540 L550	Q539-C553 VanDerWaalsContact CD-SG 3.55Å; V540-C553 VanDerWaalsContact O-CA 3.31Å; V540-C553 WeakPolarHBondContact O-CA 3.29Å; L550-C553 HydrophobicContact CD1-CB 4.37Å; L550-C553 HydrophobicContact CD2-CB 3.95Å
554	I	94.9	Very high	93	Very high	31 Å²	31	47.9 Å²	47.9	16%	0.159	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	157.3	170.9	67.6	170.4	0	0	0	109.6	Q539 V540 W552 L556 L584 K589	Q539-I554 WeakPolarHBondContact CA-O 3.47Å; V540-I554 HydrophobicContact CB-CG1 3.93Å; V540-I554 PolarHBondContact N-O 2.88Å; V540-I554 PolarHBondContact O-N 3.33Å; W552-I554 HydrophobicContact CE3-CG2 4.01Å; W552-I554 HydrophobicContact CZ3-CG1 4.16Å; W552-I554 HydrophobicContact CZ3-CG2 4.24Å; I554-L556 HydrophobicContact CD1-CD2 3.91Å; I554-L556 HydrophobicContact CG1-CD2 4.47Å; I554-L584 HydrophobicContact CD1-CD1 3.52Å; I554-L584 HydrophobicContact CD1-CD2 3.6Å; I554-L584 HydrophobicContact CD1-CG 4.17Å; I554-K589 HydrophobicContact CG2-CB 4.26Å
555	T	95.3	Very high	93.3	Very high	91 Å²	91	47 Å²	47	56%	0.558	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	121.9	173.8	-57.9	0	0	0	0	108.6	R538	R538-T555 HydrophobicContact CB-CG2 4.24Å; R538-T555 WeakPolarHBondContact O-CA 3.18Å
556	L	94.4	Very high	93.6	Very high	19 Å²	19	46.9 Å²	46.9	10%	0.099	24%	0.236	C	C	.	.			trans	-85.3	166.5	175.3	-62.2	-175.7	0	0	0	111.1	R538 V540 I554 E558 V574 L576 V582	R538-L556 WeakPolarHBondContact CB-O 3.45Å; R538-L556 PolarHBondContact O-N 2.95Å; V540-L556 HydrophobicContact CG2-CD1 3.48Å; V540-L556 VanDerWaalsContact CG2-CD1 3.48Å; V540-L556 HydrophobicContact CG2-CG 3.81Å; I554-L556 HydrophobicContact CD1-CD2 3.91Å; I554-L556 HydrophobicContact CG1-CD2 4.47Å; L556-E558 VanDerWaalsContact C-N 3.31Å; L556-E558 VanDerWaalsContact CB-O 3.29Å; L556-E558 WeakPolarHBondContact CB-O 3.25Å; L556-V574 HydrophobicContact CD1-CG1 4.21Å; L556-L576 HydrophobicContact CD1-CD2 3.72Å; L556-V582 HydrophobicContact CD1-CG2 4.15Å; L556-V582 HydrophobicContact CD2-CG2 4.38Å
557	E	92.7	Very high	94	Very high	149 Å²	149	43 Å²	43	70%	0.696	22%	0.222	S	C	*	.	S	Bend	trans	-68.8	-33.5	174.8	-64.9	-177.7	163.7	0	0	112	R538 R580	R538-E557 VanDerWaalsContact CD-O 3.3Å; R538-E557 WeakPolarHBondContact CD-O 3.49Å; E557-R580 IonicContact OE2-CZ 2.67Å; E557-R580 IonicContact OE2-NH1 3.51Å; E557-R580 PolarHBondContact OE2-NH1 2.96Å; E557-R580 IonicContact OE2-NH2 3.58Å; E557-R580 PolarHBondContact OE2-NH2 2.85Å
558	E	94	Very high	94.3	Very high	47 Å²	47	40.7 Å²	40.7	22%	0.22	22%	0.217	C	C	.	.	S	Bend	trans	-128.2	166	179.6	-62.6	178	-145.5	0	0	110.6	L556 L576 T578	L556-E558 VanDerWaalsContact C-N 3.31Å; L556-E558 VanDerWaalsContact CB-O 3.29Å; L556-E558 WeakPolarHBondContact CB-O 3.25Å; E558-L576 HydrophobicContact CB-CB 4.4Å; E558-L576 HydrophobicContact CB-CD1 4.29Å; E558-T578 VanDerWaalsContact CD-OG1 3.27Å; E558-T578 PolarHBondContact OE1-OG1 2.85Å; E558-T578 VanDerWaalsContact OE2-CB 3.3Å; E558-T578 WeakPolarHBondContact OE2-CB 3.41Å; E558-T578 WeakPolarHBondContact OE2-CG2 3.21Å; E558-T578 PolarHBondContact OE2-OG1 3.36Å
559	Y	94.9	Very high	94.6	Very high	82 Å²	82	39.2 Å²	39.2	32%	0.322	21%	0.213	S	C	.	.			trans	-81.3	143.3	-179.6	58.9	-91.3	0	0	0	112.6	S535 H536 L561 L576 S577	S535-Y559 WeakPolarHBondContact O-CB 3.24Å; H536-Y559 VanDerWaalsContact CA-CB 3.48Å; H536-Y559 AromaticContact CD2-CD2 3.39Å; H536-Y559 WeakPolarHBondContact CD2-CD2 3.46Å; H536-Y559 AromaticContact CD2-CE2 3.78Å; H536-Y559 AromaticContact NE2-CD2 3.92Å; H536-Y559 AromaticContact NE2-CE2 3.84Å; Y559-L561 HydrophobicContact CD2-CD2 4.1Å; Y559-L561 HydrophobicContact CD2-CG 4.15Å; Y559-L561 HydrophobicContact CE2-CD1 4.26Å; Y559-L561 HydrophobicContact CE2-CD2 3.99Å; Y559-L561 HydrophobicContact CE2-CG 4.14Å; Y559-L576 WeakPolarHBondContact O-CA 3.44Å; Y559-S577 WeakPolarHBondContact CE1-OG 3.13Å; Y559-S577 PolarHBondContact O-N 3.27Å; Y559-S577 WeakPolarHBondContact OH-CB 3.25Å
560	G	95	Very high	94.9	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.01	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	145.5	176.6	0	0	0	0	0	112	G575	G560-G575 WeakPolarHBondContact CA-O 3.4Å
561	L	96.4	Very high	95.1	Very high	14 Å²	14	37.6 Å²	37.6	7%	0.073	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	-32.4	-177.6	-71.9	171.5	0	0	0	113.3	W520 G521 H536 Y559 G575 Q601 L602	W520-L561 CarbonylContact C-O 3.56Å; W520-L561 HydrophobicContact CB-CD2 4.28Å; W520-L561 VanDerWaalsContact CB-O 3.26Å; W520-L561 WeakPolarHBondContact CB-O 3.43Å; W520-L561 HydrophobicContact CG-CD2 4.32Å; G521-L561 VanDerWaalsContact CA-O 3.3Å; G521-L561 WeakPolarHBondContact CA-O 3.49Å; G521-L561 PolarHBondContact N-O 3.05Å; H536-L561 VanDerWaalsContact NE2-CD2 3.32Å; H536-L561 WeakPolarHBondContact NE2-CD2 3.27Å; Y559-L561 HydrophobicContact CD2-CD2 4.1Å; Y559-L561 HydrophobicContact CD2-CG 4.15Å; Y559-L561 HydrophobicContact CE2-CD1 4.26Å; Y559-L561 HydrophobicContact CE2-CD2 3.99Å; Y559-L561 HydrophobicContact CE2-CG 4.14Å; L561-G575 PolarHBondContact N-O 2.82Å; L561-Q601 HydrophobicContact CD1-CB 3.59Å; L561-Q601 HydrophobicContact CD1-CG 4.37Å; L561-L602 WeakPolarHBondContact CB-O 3.21Å
562	C	96.9	Very high	95.3	Very high	10 Å²	10	34.3 Å²	34.3	7%	0.068	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	156.8	177.7	57.4	0	0	0	0	110.1	V574 G575 L602 S603	C562-V574 WeakPolarHBondContact O-CA 3.43Å; C562-G575 PolarHBondContact O-N 3.32Å; C562-L602 PolarHBondContact SG-O 3.27Å; C562-L602 VanDerWaalsContact SG-O 3.35Å; C562-S603 WeakPolarHBondContact CB-O 3.27Å
563	A	97.6	Very high	95.5	Very high	5 Å²	5	33.2 Å²	33.2	4%	0.041	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	158	175.2	0	0	0	0	0	110.6	A523 L532 V572 S573 V574	A523-A563 HydrophobicContact CB-CB 4.14Å; L532-A563 HydrophobicContact CD2-CB 3.53Å; A563-V572 HydrophobicContact CB-CG2 4.42Å; A563-S573 CarbonylContact C-O 3.58Å; A563-S573 WeakPolarHBondContact CA-O 3.46Å; A563-S573 WeakPolarHBondContact CB-O 3.25Å; A563-V574 HydrophobicContact CB-CG2 4.27Å
564	D	97.9	Very high	95.7	Very high	22 Å²	22	31 Å²	31	12%	0.118	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	143	173	-155.6	51.9	0	0	0	110.2	V572 S573 M605 K606 Y607	D564-V572 WeakPolarHBondContact O-CG2 2.86Å; D564-S573 PolarHBondContact N-O 3.09Å; D564-S573 PolarHBondContact O-N 2.9Å; D564-S573 PolarHBondContact O-OG 2.77Å; D564-M605 VanDerWaalsContact CB-O 3.31Å; D564-M605 WeakPolarHBondContact CB-O 3.36Å; D564-K606 HydrophobicContact CB-CD 4.45Å; D564-K606 WeakPolarHBondContact OD1-CD 3.41Å; D564-K606 IonicContact OD1-NZ 2.72Å; D564-K606 PolarHBondContact OD1-NZ 2.99Å; D564-K606 VanDerWaalsContact OD2-CA 3.28Å; D564-K606 WeakPolarHBondContact OD2-CA 3.43Å; D564-Y607 HydrophobicContact CB-CD2 4.14Å; D564-Y607 HydrophobicContact CB-CE2 4.49Å; D564-Y607 WeakPolarHBondContact O-CE2 3.39Å; D564-Y607 PolarHBondContact OD2-N 3.23Å
565	F	97.5	Very high	95.8	Very high	10 Å²	10	29.5 Å²	29.5	4%	0.044	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	139.3	176.2	-76.4	-93.6	0	0	0	110.1	A523 T524 H525 L532 L542 V572 L586 Y607	A523-F565 HydrophobicContact CB-CD2 3.7Å; A523-F565 HydrophobicContact CB-CE2 3.81Å; A523-F565 WeakPolarHBondContact O-CE2 3.29Å; T524-F565 VanDerWaalsContact O-CD2 3.25Å; T524-F565 WeakPolarHBondContact O-CD2 3.34Å; H525-F565 HydrophobicContact CB-CD1 4.43Å; H525-F565 HydrophobicContact CB-CE1 4.29Å; H525-F565 HydrophobicContact CB-CZ 4.35Å; H525-F565 AromaticContact CD2-CD1 3.64Å; H525-F565 AromaticContact CD2-CE1 3.72Å; L532-F565 HydrophobicContact CB-CE2 3.81Å; L532-F565 HydrophobicContact CB-CZ 3.74Å; L542-F565 HydrophobicContact CD1-CE1 4.39Å; L542-F565 HydrophobicContact CD1-CZ 3.93Å; F565-V572 HydrophobicContact CD1-CB 4.06Å; F565-V572 HydrophobicContact CD1-CG2 4.33Å; F565-V572 HydrophobicContact CD2-CG2 4.36Å; F565-V572 HydrophobicContact CE1-CB 4.14Å; F565-V572 HydrophobicContact CE1-CG2 4.37Å; F565-V572 HydrophobicContact CE2-CG2 4.38Å; F565-V572 HydrophobicContact CG-CB 4.49Å; F565-V572 HydrophobicContact CG-CG2 4.33Å; F565-V572 HydrophobicContact CZ-CG2 4.4Å; F565-L586 HydrophobicContact CD1-CD1 3.91Å; F565-L586 HydrophobicContact CE1-CD1 3.64Å; F565-L586 HydrophobicContact CE1-CD2 3.75Å; F565-L586 HydrophobicContact CE1-CG 4.32Å; F565-Y607 VanDerWaalsContact O-CD2 3.31Å; F565-Y607 WeakPolarHBondContact O-CD2 3.4Å
566	C	96.5	Very high	95.9	Very high	3 Å²	3	25.3 Å²	25.3	2%	0.02	14%	0.138	C	C	.	.			trans	-62.2	141.2	166	-177.4	0	0	0	0	108.7	S568 G569 V571 Y607	C566-S568 PolarHBondContact O-N 2.77Å; C566-S568 PolarHBondContact SG-OG 2.83Å; C566-G569 PolarHBondContact O-N 3.31Å; C566-V571 HydrophobicContact CB-CG2 3.43Å; C566-V571 VanDerWaalsContact CB-CG2 3.43Å; C566-V571 PolarHBondContact N-O 2.8Å; C566-Y607 HydrophobicContact CB-CD1 4.39Å; C566-Y607 HydrophobicContact CB-CD2 4.47Å; C566-Y607 HydrophobicContact CB-CE1 4.12Å; C566-Y607 HydrophobicContact CB-CE2 4.22Å
567	P	95.1	Very high	95.9	Very high	54 Å²	54	25.3 Å²	25.3	35%	0.351	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-21.4	177.2	-28.3	35.5	0	0	0	114.3	G569 S608	P567-G569 PolarHBondContact O-N 3.05Å; P567-S608 WeakPolarHBondContact CG-O 3.31Å
568	S	93.7	Very high	96	Very high	53 Å²	53	20.9 Å²	20.9	37%	0.371	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-22.8	172.1	66.2	0	0	0	0	113.4	C566 S570 S631	C566-S568 PolarHBondContact O-N 2.77Å; C566-S568 PolarHBondContact SG-OG 2.83Å; S568-S570 PolarHBondContact O-N 3Å; S568-S570 PolarHBondContact OG-N 3.13Å; S568-S631 PolarHBondContact OG-O 2.86Å
569	G	93.7	Very high	95.9	Very high	10 Å²	10	18.6 Å²	18.6	10%	0.103	11%	0.112	C	C	.	.	S	Bend	trans	73	7.9	-174.9	0	0	0	0	0	114.3	H525 C566 P567 L586	H525-G569 WeakPolarHBondContact NE2-CA 3.33Å; H525-G569 PolarHBondContact NE2-O 3.14Å; C566-G569 PolarHBondContact O-N 3.31Å; P567-G569 PolarHBondContact O-N 3.05Å; G569-L586 WeakPolarHBondContact O-CD1 3.46Å
570	S	93.6	Very high	96	Very high	50 Å²	50	16.6 Å²	16.6	35%	0.35	10%	0.104	S	C	.	.	S	Bend	trans	-91.3	-25.7	-177.2	-56.1	0	0	0	0	113.5	S568 L586	S568-S570 PolarHBondContact O-N 3Å; S568-S570 PolarHBondContact OG-N 3.13Å; S570-L586 PolarHBondContact O-N 2.78Å
571	V	96.6	Very high	96.1	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	157.8	-170.7	-54	0	0	0	0	110.8	C566 V583 L584 I592	C566-V571 HydrophobicContact CB-CG2 3.43Å; C566-V571 VanDerWaalsContact CB-CG2 3.43Å; C566-V571 PolarHBondContact N-O 2.8Å; V571-V583 HydrophobicContact CB-CG1 3.88Å; V571-V583 HydrophobicContact CG2-CG1 3.98Å; V571-L584 VanDerWaalsContact CA-O 3.26Å; V571-L584 WeakPolarHBondContact CA-O 3.46Å; V571-L584 WeakPolarHBondContact CB-O 3.36Å; V571-I592 HydrophobicContact CB-CD1 4.16Å; V571-I592 HydrophobicContact CG1-CD1 3.61Å
572	V	97.3	Very high	96.2	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	131.5	178	61	0	0	0	0	110	L532 A563 D564 F565 V583 L584 L586	L532-V572 HydrophobicContact CD1-CB 4.39Å; L532-V572 HydrophobicContact CD1-CG1 3.75Å; L532-V572 HydrophobicContact CD1-CG2 3.99Å; L532-V572 HydrophobicContact CD2-CG2 4.18Å; A563-V572 HydrophobicContact CB-CG2 4.42Å; D564-V572 WeakPolarHBondContact O-CG2 2.86Å; F565-V572 HydrophobicContact CD1-CB 4.06Å; F565-V572 HydrophobicContact CD1-CG2 4.33Å; F565-V572 HydrophobicContact CD2-CG2 4.36Å; F565-V572 HydrophobicContact CE1-CB 4.14Å; F565-V572 HydrophobicContact CE1-CG2 4.37Å; F565-V572 HydrophobicContact CE2-CG2 4.38Å; F565-V572 HydrophobicContact CG-CB 4.49Å; F565-V572 HydrophobicContact CG-CG2 4.33Å; F565-V572 HydrophobicContact CZ-CG2 4.4Å; V572-V583 CarbonylContact O-C 3.57Å; V572-V583 WeakPolarHBondContact O-CA 3.49Å; V572-L584 HydrophobicContact CG1-CB 3.87Å; V572-L584 HydrophobicContact CG1-CD1 4.4Å; V572-L584 PolarHBondContact N-O 3.05Å; V572-L584 PolarHBondContact O-N 3.16Å; V572-L586 HydrophobicContact CB-CD2 4.21Å; V572-L586 HydrophobicContact CG1-CD2 3.74Å
573	S	97.5	Very high	96.2	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	141.6	171.3	62.7	0	0	0	0	110.6	A563 D564 V582 Y607	A563-S573 CarbonylContact C-O 3.58Å; A563-S573 WeakPolarHBondContact CA-O 3.46Å; A563-S573 WeakPolarHBondContact CB-O 3.25Å; D564-S573 PolarHBondContact N-O 3.09Å; D564-S573 PolarHBondContact O-N 2.9Å; D564-S573 PolarHBondContact O-OG 2.77Å; S573-V582 CarbonylContact C-O 3.56Å; S573-V582 WeakPolarHBondContact CA-O 3.38Å; S573-Y607 WeakPolarHBondContact CB-OH 3.37Å; S573-Y607 VanDerWaalsContact OG-CE2 3.32Å; S573-Y607 WeakPolarHBondContact OG-CE2 3.45Å
574	V	98.1	Very high	96.2	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	123.6	176	-175.5	0	0	0	0	109.2	L532 C534 V540 L556 C562 A563 L576 W581 V582 L584 M605	L532-V574 HydrophobicContact CD2-CG2 4.42Å; C534-V574 HydrophobicContact CB-CG1 4.28Å; V540-V574 HydrophobicContact CG1-CG2 4.42Å; V540-V574 HydrophobicContact CG2-CG1 4.37Å; L556-V574 HydrophobicContact CD1-CG1 4.21Å; C562-V574 WeakPolarHBondContact O-CA 3.43Å; A563-V574 HydrophobicContact CB-CG2 4.27Å; V574-L576 HydrophobicContact CG1-CD2 4.04Å; V574-W581 VanDerWaalsContact O-CA 3.3Å; V574-W581 WeakPolarHBondContact O-CA 3.35Å; V574-W581 WeakPolarHBondContact O-CB 3.16Å; V574-V582 HydrophobicContact CB-CG2 4.04Å; V574-V582 PolarHBondContact N-O 3.07Å; V574-V582 PolarHBondContact O-N 2.63Å; V574-L584 HydrophobicContact CG2-CD1 4.05Å; V574-M605 VanDerWaalsContact C-SD 3.59Å
575	G	97.4	Very high	96	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	134.9	176.7	0	0	0	0	0	111.2	G560 L561 C562 M605	G560-G575 WeakPolarHBondContact CA-O 3.4Å; L561-G575 PolarHBondContact N-O 2.82Å; C562-G575 PolarHBondContact O-N 3.32Å; G575-M605 WeakPolarHBondContact CA-SD 3.41Å; G575-M605 PolarHBondContact N-SD 3.35Å
576	L	96.9	Very high	95.8	Very high	2 Å²	2	15 Å²	15	1%	0.01	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	176.1	-173.7	-45	177	0	0	0	111.7	L556 E558 Y559 V574 T578 R580 V582 L602	L556-L576 HydrophobicContact CD1-CD2 3.72Å; E558-L576 HydrophobicContact CB-CB 4.4Å; E558-L576 HydrophobicContact CB-CD1 4.29Å; Y559-L576 WeakPolarHBondContact O-CA 3.44Å; V574-L576 HydrophobicContact CG1-CD2 4.04Å; L576-T578 PolarHBondContact O-N 2.92Å; L576-R580 WeakPolarHBondContact CA-O 3.46Å; L576-R580 WeakPolarHBondContact CB-O 3.46Å; L576-R580 HydrophobicContact CD1-CB 4.1Å; L576-R580 HydrophobicContact CD1-CG 3.94Å; L576-R580 WeakPolarHBondContact CG-O 3.33Å; L576-R580 PolarHBondContact N-O 3.48Å; L576-V582 HydrophobicContact CD1-CG1 4.21Å; L576-L602 PolarHBondContact O-N 3.3Å; L576-L602 VanDerWaalsContact O-N 3.09Å
577	S	95	Very high	95.6	Very high	19 Å²	19	20.7 Å²	20.7	13%	0.133	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-14.7	-173.5	59	0	0	0	0	116.9	Y559 Q601	Y559-S577 WeakPolarHBondContact CE1-OG 3.13Å; Y559-S577 PolarHBondContact O-N 3.27Å; Y559-S577 WeakPolarHBondContact OH-CB 3.25Å; S577-Q601 VanDerWaalsContact O-CA 3.24Å; S577-Q601 WeakPolarHBondContact O-CA 2.86Å; S577-Q601 PolarHBondContact O-N 2.99Å
578	T	93.8	Very high	95.5	Very high	56 Å²	56	21.7 Å²	21.7	34%	0.344	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	15.3	-171.3	59.8	0	0	0	0	113.6	E558 L576 R580 N599 E600	E558-T578 VanDerWaalsContact CD-OG1 3.27Å; E558-T578 PolarHBondContact OE1-OG1 2.85Å; E558-T578 VanDerWaalsContact OE2-CB 3.3Å; E558-T578 WeakPolarHBondContact OE2-CB 3.41Å; E558-T578 WeakPolarHBondContact OE2-CG2 3.21Å; E558-T578 PolarHBondContact OE2-OG1 3.36Å; L576-T578 PolarHBondContact O-N 2.92Å; T578-R580 PolarHBondContact O-N 2.86Å; T578-N599 CarbonylContact O-C 3.55Å; T578-N599 WeakPolarHBondContact O-CA 3.31Å; T578-E600 CarbonylContact C-O 3.53Å
579	G	93.3	Very high	95.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	84.5	-7.4	-173.7	0	0	0	0	0	113.1	D597 E600	G579-D597 VanDerWaalsContact CA-O 3.3Å; G579-D597 WeakPolarHBondContact CA-O 3.26Å; G579-D597 PolarHBondContact O-N 2.96Å; G579-E600 WeakPolarHBondContact CA-O 3.14Å; G579-E600 PolarHBondContact N-O 3.04Å
580	R	96.6	Very high	95.5	Very high	39 Å²	39	29.5 Å²	29.5	15%	0.147	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	143.3	169.8	-172.6	179.3	169	-162.8	4.1	110.6	E557 L576 T578 E594 S595 L602	E557-R580 IonicContact OE2-CZ 2.67Å; E557-R580 IonicContact OE2-NH1 3.51Å; E557-R580 PolarHBondContact OE2-NH1 2.96Å; E557-R580 IonicContact OE2-NH2 3.58Å; E557-R580 PolarHBondContact OE2-NH2 2.85Å; L576-R580 WeakPolarHBondContact CA-O 3.46Å; L576-R580 WeakPolarHBondContact CB-O 3.46Å; L576-R580 HydrophobicContact CD1-CB 4.1Å; L576-R580 HydrophobicContact CD1-CG 3.94Å; L576-R580 WeakPolarHBondContact CG-O 3.33Å; L576-R580 PolarHBondContact N-O 3.48Å; T578-R580 PolarHBondContact O-N 2.86Å; R580-E594 IonicContact CZ-OE2 3.94Å; R580-E594 IonicContact NE-OE2 3.64Å; R580-E594 PolarHBondContact NE-OE2 2.93Å; R580-E594 IonicContact NH2-OE2 3.85Å; R580-E594 PolarHBondContact NH2-OE2 2.91Å; R580-S595 WeakPolarHBondContact CA-O 3.43Å; R580-L602 WeakPolarHBondContact O-CD1 3.21Å
581	W	97.3	Very high	95.6	Very high	1 Å²	1	30.6 Å²	30.6	0%	0.004	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	152.1	167.8	54.1	-89	0	0	0	109.9	V574 V583 E594 S595 D597 L602 M605 L614 Y626 Y635	V574-W581 VanDerWaalsContact O-CA 3.3Å; V574-W581 WeakPolarHBondContact O-CA 3.35Å; V574-W581 WeakPolarHBondContact O-CB 3.16Å; W581-V583 HydrophobicContact CE3-CG2 3.87Å; W581-V583 HydrophobicContact CZ3-CG2 3.59Å; W581-E594 WeakPolarHBondContact O-CA 3.34Å; W581-S595 VanDerWaalsContact CE2-CB 3.42Å; W581-S595 PolarHBondContact N-O 2.8Å; W581-S595 PolarHBondContact O-N 2.89Å; W581-S595 VanDerWaalsContact O-N 3.09Å; W581-D597 PolarHBondContact NE1-OD2 2.93Å; W581-L602 HydrophobicContact CB-CD1 3.72Å; W581-L602 HydrophobicContact CG-CD1 4.23Å; W581-M605 HydrophobicContact CB-CE 3.59Å; W581-M605 HydrophobicContact CB-SD 3.81Å; W581-M605 HydrophobicContact CD2-CE 3.89Å; W581-M605 HydrophobicContact CE3-CE 4.07Å; W581-M605 HydrophobicContact CG-CE 3.71Å; W581-M605 HydrophobicContact CG-SD 4.49Å; W581-L614 HydrophobicContact CZ3-CD2 4.41Å; W581-Y626 HydrophobicContact CH2-CD1 4.4Å; W581-Y626 HydrophobicContact CH2-CE1 4.47Å; W581-Y626 HydrophobicContact CZ2-CD1 4.02Å; W581-Y626 AromaticContact CZ2-CD2 3.95Å; W581-Y626 HydrophobicContact CZ2-CD2 3.95Å; W581-Y626 AromaticContact CZ2-CE1 3.77Å; W581-Y626 HydrophobicContact CZ2-CE1 3.77Å; W581-Y626 AromaticContact CZ2-CE2 3.67Å; W581-Y626 HydrophobicContact CZ2-CE2 3.67Å; W581-Y626 HydrophobicContact CZ2-CG 4.12Å; W581-Y626 AromaticContact CZ2-CZ 3.59Å; W581-Y626 AromaticContact NE1-CE2 3.96Å; W581-Y635 AromaticContact CH2-CD1 3.98Å; W581-Y635 HydrophobicContact CH2-CD1 3.98Å; W581-Y635 HydrophobicContact CH2-CD2 4.49Å; W581-Y635 AromaticContact CH2-CG 3.85Å; W581-Y635 HydrophobicContact CH2-CG 3.85Å; W581-Y635 HydrophobicContact CZ3-CD1 4.22Å; W581-Y635 HydrophobicContact CZ3-CD2 4.46Å; W581-Y635 HydrophobicContact CZ3-CG 4.18Å
582	V	97.3	Very high	95.6	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.018	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	153.2	-179.7	-63.3	0	0	0	0	109.7	L556 S573 V574 L576 V591 S593 E594	L556-V582 HydrophobicContact CD1-CG2 4.15Å; L556-V582 HydrophobicContact CD2-CG2 4.38Å; S573-V582 CarbonylContact C-O 3.56Å; S573-V582 WeakPolarHBondContact CA-O 3.38Å; V574-V582 HydrophobicContact CB-CG2 4.04Å; V574-V582 PolarHBondContact N-O 3.07Å; V574-V582 PolarHBondContact O-N 2.63Å; L576-V582 HydrophobicContact CD1-CG1 4.21Å; V582-V591 HydrophobicContact CB-CG1 4.18Å; V582-V591 HydrophobicContact CG1-CG1 4.33Å; V582-S593 CarbonylContact C-O 3.58Å; V582-S593 WeakPolarHBondContact CA-O 3.11Å; V582-E594 HydrophobicContact CG1-CB 4.1Å
583	V	97.6	Very high	95.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.1	172.7	-174.7	0	0	0	0	108.1	V571 V572 W581 V591 I592 S593 Y635	V571-V583 HydrophobicContact CB-CG1 3.88Å; V571-V583 HydrophobicContact CG2-CG1 3.98Å; V572-V583 CarbonylContact O-C 3.57Å; V572-V583 WeakPolarHBondContact O-CA 3.49Å; W581-V583 HydrophobicContact CE3-CG2 3.87Å; W581-V583 HydrophobicContact CZ3-CG2 3.59Å; V583-V591 CarbonylContact O-C 3.55Å; V583-V591 WeakPolarHBondContact O-CA 3.27Å; V583-I592 HydrophobicContact CB-CD1 4.14Å; V583-I592 HydrophobicContact CB-CG1 3.9Å; V583-I592 HydrophobicContact CG1-CD1 3.53Å; V583-I592 HydrophobicContact CG1-CG1 3.75Å; V583-I592 WeakPolarHBondContact O-CG1 3.44Å; V583-I592 PolarHBondContact O-N 2.86Å; V583-S593 PolarHBondContact N-O 3.17Å; V583-Y635 HydrophobicContact CB-CE2 4.17Å; V583-Y635 HydrophobicContact CG1-CE2 4.14Å; V583-Y635 WeakPolarHBondContact CG1-OH 3.35Å; V583-Y635 HydrophobicContact CG2-CD2 4.45Å; V583-Y635 HydrophobicContact CG2-CE1 4.31Å; V583-Y635 HydrophobicContact CG2-CE2 3.75Å
584	L	96.9	Very high	95.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	137.4	-175.8	-57.8	167.7	0	0	0	109.5	V540 I554 V571 V572 V574 E590 V591	V540-L584 HydrophobicContact CG1-CD1 4.12Å; I554-L584 HydrophobicContact CD1-CD1 3.52Å; I554-L584 HydrophobicContact CD1-CD2 3.6Å; I554-L584 HydrophobicContact CD1-CG 4.17Å; V571-L584 VanDerWaalsContact CA-O 3.26Å; V571-L584 WeakPolarHBondContact CA-O 3.46Å; V571-L584 WeakPolarHBondContact CB-O 3.36Å; V572-L584 HydrophobicContact CG1-CB 3.87Å; V572-L584 HydrophobicContact CG1-CD1 4.4Å; V572-L584 PolarHBondContact N-O 3.05Å; V572-L584 PolarHBondContact O-N 3.16Å; V574-L584 HydrophobicContact CG2-CD1 4.05Å; L584-E590 WeakPolarHBondContact CA-O 3.17Å; L584-V591 HydrophobicContact CD2-CB 4.45Å; L584-V591 HydrophobicContact CD2-CG2 3.67Å
585	D	95.4	Very high	95.2	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.016	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	130.7	166.5	-171.7	-79.4	0	0	0	109.9	V587 T588 K589 E590 I592 R633	D585-V587 VanDerWaalsContact C-N 3.29Å; D585-V587 PolarHBondContact O-N 2.83Å; D585-V587 WeakPolarHBondContact OD1-CA 3.44Å; D585-V587 WeakPolarHBondContact OD1-CB 3.32Å; D585-V587 PolarHBondContact OD1-N 2.94Å; D585-T588 WeakPolarHBondContact CB-OG1 3.07Å; D585-T588 PolarHBondContact OD1-N 3.39Å; D585-K589 WeakPolarHBondContact O-CA 3.48Å; D585-K589 PolarHBondContact O-N 3.16Å; D585-E590 PolarHBondContact N-O 3.4Å; D585-I592 HydrophobicContact CB-CG2 3.87Å; D585-R633 IonicContact OD2-CZ 3.4Å; D585-R633 IonicContact OD2-NH1 2.8Å; D585-R633 PolarHBondContact OD2-NH1 3.27Å; D585-R633 IonicContact OD2-NH2 3.83Å; D585-R633 PolarHBondContact OD2-NH2 3.17Å
586	L	93.5	Very high	95.2	Very high	21 Å²	21	45.9 Å²	45.9	11%	0.11	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-22.7	-175.9	-65.3	171.4	0	0	0	113.5	L542 W552 F565 G569 S570 V572	L542-L586 HydrophobicContact CD1-CD2 4.26Å; W552-L586 HydrophobicContact CZ2-CD2 3.89Å; W552-L586 PolarHBondContact NE1-O 2.92Å; F565-L586 HydrophobicContact CD1-CD1 3.91Å; F565-L586 HydrophobicContact CE1-CD1 3.64Å; F565-L586 HydrophobicContact CE1-CD2 3.75Å; F565-L586 HydrophobicContact CE1-CG 4.32Å; G569-L586 WeakPolarHBondContact O-CD1 3.46Å; S570-L586 PolarHBondContact O-N 2.78Å; V572-L586 HydrophobicContact CB-CD2 4.21Å; V572-L586 HydrophobicContact CG1-CD2 3.74Å
587	V	91.8	Very high	94.9	Very high	124 Å²	124	46.3 Å²	46.3	75%	0.752	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-53.8	-177.9	-178.1	0	0	0	0	110.3	D585	D585-V587 VanDerWaalsContact C-N 3.29Å; D585-V587 PolarHBondContact O-N 2.83Å; D585-V587 WeakPolarHBondContact OD1-CA 3.44Å; D585-V587 WeakPolarHBondContact OD1-CB 3.32Å; D585-V587 PolarHBondContact OD1-N 2.94Å
588	T	93	Very high	94.7	Very high	74 Å²	74	47.2 Å²	47.2	45%	0.454	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-22.5	-177.8	72.8	0	0	0	0	112.6	D585 E590	D585-T588 WeakPolarHBondContact CB-OG1 3.07Å; D585-T588 PolarHBondContact OD1-N 3.39Å; T588-E590 PolarHBondContact O-N 2.81Å; T588-E590 PolarHBondContact OG1-N 3.2Å
589	K	93.9	Very high	94.6	Very high	97 Å²	97	50.5 Å²	50.5	42%	0.422	28%	0.281	S	S	.	.			trans	66.7	13	-177.6	-48	162.9	-170.4	178.4	0	113.2	W552 I554 D585	W552-K589 HydrophobicContact CB-CD 4.14Å; W552-K589 HydrophobicContact CD2-CD 4.39Å; W552-K589 HydrophobicContact CD2-CG 4.21Å; W552-K589 HydrophobicContact CG-CD 3.99Å; W552-K589 HydrophobicContact CG-CG 4.24Å; I554-K589 HydrophobicContact CG2-CB 4.26Å; D585-K589 WeakPolarHBondContact O-CA 3.48Å; D585-K589 PolarHBondContact O-N 3.16Å
590	E	93.9	Very high	94.7	Very high	131 Å²	131	54.7 Å²	54.7	61%	0.612	30%	0.301	S	S	*	.			trans	-91.1	153.2	-179.7	-63.4	-179.5	158.1	0	0	111	L584 D585 T588 I592	L584-E590 WeakPolarHBondContact CA-O 3.17Å; D585-E590 PolarHBondContact N-O 3.4Å; T588-E590 PolarHBondContact O-N 2.81Å; T588-E590 PolarHBondContact OG1-N 3.2Å; E590-I592 PolarHBondContact O-N 3.36Å
591	V	95.4	Very high	94.7	Very high	73 Å²	73	56.1 Å²	56.1	44%	0.442	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	114.1	170.7	-179.6	0	0	0	0	108.2	V582 V583 L584 E594	V582-V591 HydrophobicContact CB-CG1 4.18Å; V582-V591 HydrophobicContact CG1-CG1 4.33Å; V583-V591 CarbonylContact O-C 3.55Å; V583-V591 WeakPolarHBondContact O-CA 3.27Å; L584-V591 HydrophobicContact CD2-CB 4.45Å; L584-V591 HydrophobicContact CD2-CG2 3.67Å; V591-E594 HydrophobicContact CG1-CB 4.41Å
592	I	95.1	Very high	94.6	Very high	54 Å²	54	56.1 Å²	56.1	28%	0.277	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-26.5	179.6	51.5	151.6	0	0	0	112.8	V571 V583 D585 E590 G632 R633	V571-I592 HydrophobicContact CB-CD1 4.16Å; V571-I592 HydrophobicContact CG1-CD1 3.61Å; V583-I592 HydrophobicContact CB-CD1 4.14Å; V583-I592 HydrophobicContact CB-CG1 3.9Å; V583-I592 HydrophobicContact CG1-CD1 3.53Å; V583-I592 HydrophobicContact CG1-CG1 3.75Å; V583-I592 WeakPolarHBondContact O-CG1 3.44Å; V583-I592 PolarHBondContact O-N 2.86Å; D585-I592 HydrophobicContact CB-CG2 3.87Å; E590-I592 PolarHBondContact O-N 3.36Å; I592-G632 WeakPolarHBondContact CD1-O 3.42Å; I592-R633 HydrophobicContact CD1-CB 4.47Å; I592-R633 HydrophobicContact CD1-CG 4.25Å
593	S	94.6	Very high	94.6	Very high	27 Å²	27	57.4 Å²	57.4	19%	0.189	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	145.1	178.6	-165.4	0	0	0	0	109.7	V582 V583 Y635	V582-S593 CarbonylContact C-O 3.58Å; V582-S593 WeakPolarHBondContact CA-O 3.11Å; V583-S593 PolarHBondContact N-O 3.17Å; S593-Y635 WeakPolarHBondContact OG-CD2 3.37Å
594	E	95.3	Very high	94.5	Very high	111 Å²	111	58 Å²	58	52%	0.519	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	147.9	171.8	61.5	175.8	-166.8	0	0	109.5	R580 W581 V582 V591	R580-E594 IonicContact CZ-OE2 3.94Å; R580-E594 IonicContact NE-OE2 3.64Å; R580-E594 PolarHBondContact NE-OE2 2.93Å; R580-E594 IonicContact NH2-OE2 3.85Å; R580-E594 PolarHBondContact NH2-OE2 2.91Å; W581-E594 WeakPolarHBondContact O-CA 3.34Å; V582-E594 HydrophobicContact CG1-CB 4.1Å; V591-E594 HydrophobicContact CG1-CB 4.41Å
595	S	96	Very high	94.5	Very high	41 Å²	41	58 Å²	58	29%	0.287	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	165	170.5	-147.7	0	0	0	0	110.2	R580 W581	R580-S595 WeakPolarHBondContact CA-O 3.43Å; W581-S595 VanDerWaalsContact CE2-CB 3.42Å; W581-S595 PolarHBondContact N-O 2.8Å; W581-S595 PolarHBondContact O-N 2.89Å; W581-S595 VanDerWaalsContact O-N 3.09Å
596	T	96.1	Very high	94.6	Very high	87 Å²	87	59.7 Å²	59.7	53%	0.534	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	123.9	179.2	-54.8	0	0	0	0	109.4
597	D	91.6	Very high	94.8	Very high	11 Å²	11	59.3 Å²	59.3	6%	0.059	33%	0.326	C	S	.	.			trans	-125.3	110.9	-178.8	-74.6	-63.7	0	0	0	109.7	G579 W581 Y624 Y626 R637	G579-D597 VanDerWaalsContact CA-O 3.3Å; G579-D597 WeakPolarHBondContact CA-O 3.26Å; G579-D597 PolarHBondContact O-N 2.96Å; W581-D597 PolarHBondContact NE1-OD2 2.93Å; D597-Y624 HydrophobicContact CB-CD1 3.4Å; D597-Y624 VanDerWaalsContact CB-CD1 3.4Å; D597-Y624 HydrophobicContact CB-CD2 4.09Å; D597-Y624 HydrophobicContact CB-CE1 3.68Å; D597-Y624 HydrophobicContact CB-CE2 4.19Å; D597-Y624 HydrophobicContact CB-CG 3.74Å; D597-Y624 WeakPolarHBondContact OD1-CD1 3.39Å; D597-Y626 PolarHBondContact OD1-OH 2.68Å; D597-Y626 WeakPolarHBondContact OD2-CE2 3.23Å; D597-Y626 VanDerWaalsContact OD2-CZ 3.22Å; D597-Y626 PolarHBondContact OD2-OH 3.15Å; D597-R637 IonicContact OD1-CZ 3.43Å; D597-R637 IonicContact OD1-NH1 2.92Å
598	G	89.6	Confident	95.1	Very high	38 Å²	38	53.4 Å²	53.4	39%	0.392	29%	0.29	S	S	.	.	S	Bend	trans	70.3	-156.7	-174.3	0	0	0	0	0	112.4
599	N	92.8	Very high	95.1	Very high	125 Å²	125	52.6 Å²	52.6	67%	0.668	29%	0.287	S	S	*	.	S	Bend	trans	-139.8	15.1	-179.5	68.6	-28	0	0	0	112.7	T578	T578-N599 CarbonylContact O-C 3.55Å; T578-N599 WeakPolarHBondContact O-CA 3.31Å
600	E	95.4	Very high	95.1	Very high	89 Å²	89	51.2 Å²	51.2	42%	0.416	28%	0.284	S	S	.	.	S	Bend	trans	-115.7	161	-175.6	-71.6	-70.8	176.3	0	0	109.9	T578 G579 H619 D620	T578-E600 CarbonylContact C-O 3.53Å; G579-E600 WeakPolarHBondContact CA-O 3.14Å; G579-E600 PolarHBondContact N-O 3.04Å; E600-H619 HydrophobicContact CB-CB 3.83Å; E600-D620 HydrophobicContact CB-CB 4.23Å; E600-D620 HydrophobicContact CG-CB 4.17Å
601	Q	95.5	Very high	95.1	Very high	69 Å²	69	45.6 Å²	45.6	32%	0.322	26%	0.261	S	S	.	.			trans	-62.2	143.6	-176.6	64.6	175.5	69	0	0	113.5	L561 S577 H619	L561-Q601 HydrophobicContact CD1-CB 3.59Å; L561-Q601 HydrophobicContact CD1-CG 4.37Å; S577-Q601 VanDerWaalsContact O-CA 3.24Å; S577-Q601 WeakPolarHBondContact O-CA 2.86Å; S577-Q601 PolarHBondContact O-N 2.99Å; Q601-H619 VanDerWaalsContact CD-CE1 3.41Å; Q601-H619 HydrophobicContact CG-CB 3.8Å; Q601-H619 VanDerWaalsContact CG-ND1 3.33Å; Q601-H619 WeakPolarHBondContact CG-ND1 3.47Å; Q601-H619 PolarHBondContact NE2-CE1 2.77Å; Q601-H619 PolarHBondContact NE2-NE2 3.37Å; Q601-H619 WeakPolarHBondContact O-CB 3.36Å; Q601-H619 PolarHBondContact O-N 3.45Å
602	L	97.1	Very high	95.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	114.5	175.2	-57.5	-176.1	0	0	0	110.1	L561 C562 L576 R580 W581 V616	L561-L602 WeakPolarHBondContact CB-O 3.21Å; C562-L602 PolarHBondContact SG-O 3.27Å; C562-L602 VanDerWaalsContact SG-O 3.35Å; L576-L602 PolarHBondContact O-N 3.3Å; L576-L602 VanDerWaalsContact O-N 3.09Å; R580-L602 WeakPolarHBondContact O-CD1 3.21Å; W581-L602 HydrophobicContact CB-CD1 3.72Å; W581-L602 HydrophobicContact CG-CD1 4.23Å; L602-V616 HydrophobicContact CD1-CG1 3.76Å; L602-V616 HydrophobicContact CD2-CG1 3.78Å; L602-V616 HydrophobicContact CG-CG1 4.28Å
603	S	95.3	Very high	95.2	Very high	30 Å²	30	46.8 Å²	46.8	21%	0.21	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-32.4	-176	51.9	0	0	0	0	113.2	C562 G617 I648	C562-S603 WeakPolarHBondContact CB-O 3.27Å; S603-G617 PolarHBondContact N-O 2.84Å; S603-G617 PolarHBondContact OG-O 3.33Å; S603-I648 VanDerWaalsContact CB-O 3.25Å; S603-I648 WeakPolarHBondContact CB-O 3.34Å; S603-I648 PolarHBondContact OG-O 2.93Å
604	V	96.6	Very high	95.3	Very high	13 Å²	13	45.5 Å²	45.5	8%	0.079	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	139.3	-176.7	57.4	0	0	0	0	111.2	K606 G617 I648 L651	V604-K606 HydrophobicContact CG2-CG 4.06Å; V604-G617 PolarHBondContact O-N 3.11Å; V604-I648 HydrophobicContact CG1-CG2 4.06Å; V604-L651 HydrophobicContact CB-CD2 4.33Å; V604-L651 HydrophobicContact CB-CG 4.41Å; V604-L651 HydrophobicContact CG1-CB 4.48Å; V604-L651 HydrophobicContact CG1-CD2 3.38Å; V604-L651 HydrophobicContact CG1-CG 3.73Å; V604-L651 HydrophobicContact CG2-CD1 4.43Å; V604-L651 HydrophobicContact CG2-CD2 4.12Å; V604-L651 HydrophobicContact CG2-CG 3.78Å
605	M	97.1	Very high	95.4	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.9	167.4	-67.1	-177.6	81.8	0	0	107.7	D564 V574 G575 W581 L614 A615 V616	D564-M605 VanDerWaalsContact CB-O 3.31Å; D564-M605 WeakPolarHBondContact CB-O 3.36Å; V574-M605 VanDerWaalsContact C-SD 3.59Å; G575-M605 WeakPolarHBondContact CA-SD 3.41Å; G575-M605 PolarHBondContact N-SD 3.35Å; W581-M605 HydrophobicContact CB-CE 3.59Å; W581-M605 HydrophobicContact CB-SD 3.81Å; W581-M605 HydrophobicContact CD2-CE 3.89Å; W581-M605 HydrophobicContact CE3-CE 4.07Å; W581-M605 HydrophobicContact CG-CE 3.71Å; W581-M605 HydrophobicContact CG-SD 4.49Å; M605-L614 HydrophobicContact CB-CD1 4.4Å; M605-L614 HydrophobicContact CE-CD1 4.3Å; M605-L614 HydrophobicContact CE-CD2 3.78Å; M605-L614 HydrophobicContact CE-CG 4.32Å; M605-A615 CarbonylContact C-O 3.57Å; M605-A615 VanDerWaalsContact CA-O 3.28Å; M605-A615 WeakPolarHBondContact CA-O 3.44Å; M605-V616 HydrophobicContact CE-CG1 4.47Å; M605-V616 HydrophobicContact CE-CG2 3.58Å; M605-V616 HydrophobicContact CG-CB 4.5Å; M605-V616 HydrophobicContact CG-CG1 4.19Å; M605-V616 HydrophobicContact CG-CG2 4.23Å
606	K	97.6	Very high	95.5	Very high	38 Å²	38	38.3 Å²	38.3	17%	0.165	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	132.2	171.7	-62.4	-71.7	172.4	-174.3	0	112.5	D564 V604 A615 L651 W653	D564-K606 HydrophobicContact CB-CD 4.45Å; D564-K606 WeakPolarHBondContact OD1-CD 3.41Å; D564-K606 IonicContact OD1-NZ 2.72Å; D564-K606 PolarHBondContact OD1-NZ 2.99Å; D564-K606 VanDerWaalsContact OD2-CA 3.28Å; D564-K606 WeakPolarHBondContact OD2-CA 3.43Å; V604-K606 HydrophobicContact CG2-CG 4.06Å; K606-A615 PolarHBondContact N-O 3.18Å; K606-A615 PolarHBondContact O-N 3.2Å; K606-L651 HydrophobicContact CB-CD1 3.46Å; K606-L651 VanDerWaalsContact CB-CD1 3.46Å; K606-L651 HydrophobicContact CG-CD1 3.47Å; K606-L651 VanDerWaalsContact CG-CD1 3.47Å; K606-L651 HydrophobicContact CG-CG 4.32Å; K606-W653 PolarHBondContact O-NE1 3.43Å
607	Y	97.7	Very high	95.6	Very high	12 Å²	12	34.1 Å²	34.1	5%	0.047	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	148.2	166.1	-69.6	-89	0	0	0	110.8	D564 F565 C566 S573 F613 L614 V628 Y635 W653	D564-Y607 HydrophobicContact CB-CD2 4.14Å; D564-Y607 HydrophobicContact CB-CE2 4.49Å; D564-Y607 WeakPolarHBondContact O-CE2 3.39Å; D564-Y607 PolarHBondContact OD2-N 3.23Å; F565-Y607 VanDerWaalsContact O-CD2 3.31Å; F565-Y607 WeakPolarHBondContact O-CD2 3.4Å; C566-Y607 HydrophobicContact CB-CD1 4.39Å; C566-Y607 HydrophobicContact CB-CD2 4.47Å; C566-Y607 HydrophobicContact CB-CE1 4.12Å; C566-Y607 HydrophobicContact CB-CE2 4.22Å; S573-Y607 WeakPolarHBondContact CB-OH 3.37Å; S573-Y607 VanDerWaalsContact OG-CE2 3.32Å; S573-Y607 WeakPolarHBondContact OG-CE2 3.45Å; Y607-F613 CarbonylContact C-O 3.51Å; Y607-F613 WeakPolarHBondContact CA-O 3.37Å; Y607-L614 HydrophobicContact CD1-CB 4.1Å; Y607-L614 HydrophobicContact CD1-CD1 4.11Å; Y607-L614 HydrophobicContact CD2-CD1 4Å; Y607-L614 HydrophobicContact CE1-CB 4.07Å; Y607-L614 HydrophobicContact CE1-CD1 4.07Å; Y607-L614 HydrophobicContact CE1-CD2 4.3Å; Y607-L614 HydrophobicContact CE1-CG 4.38Å; Y607-L614 HydrophobicContact CE2-CD1 3.95Å; Y607-L614 HydrophobicContact CG-CD1 4.08Å; Y607-V628 HydrophobicContact CD1-CG2 4.31Å; Y607-V628 HydrophobicContact CE1-CG1 4.29Å; Y607-V628 HydrophobicContact CE1-CG2 4.15Å; Y607-Y635 HydrophobicContact CE1-CE1 4.02Å; Y607-Y635 PolarHBondContact OH-OH 3.23Å; Y607-W653 PolarHBondContact O-NE1 2.73Å
608	S	96.8	Very high	95.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.18	C	C	.	.			trans	-66.2	153.4	167.2	59.6	0	0	0	0	110.1	P567 D610 G611 R612 F613	P567-S608 WeakPolarHBondContact CG-O 3.31Å; S608-D610 VanDerWaalsContact CB-OD1 3.28Å; S608-D610 WeakPolarHBondContact CB-OD1 3.47Å; S608-D610 PolarHBondContact O-N 2.7Å; S608-D610 VanDerWaalsContact O-N 3.11Å; S608-D610 PolarHBondContact OG-OD1 2.91Å; S608-G611 WeakPolarHBondContact O-CA 2.95Å; S608-G611 PolarHBondContact O-N 2.8Å; S608-R612 PolarHBondContact OG-N 2.78Å; S608-F613 PolarHBondContact N-O 3.31Å; S608-F613 PolarHBondContact OG-N 2.65Å; S608-F613 PolarHBondContact OG-O 2.79Å
609	P	94.8	Very high	96.2	Very high	58 Å²	58	34 Å²	34	38%	0.377	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-27.9	-177.1	-25.5	35.1	0	0	0	114	G611 W653 A693	P609-G611 VanDerWaalsContact C-N 3.34Å; P609-W653 HydrophobicContact CG-CB 4.28Å; P609-A693 HydrophobicContact CB-CB 4.37Å; P609-A693 HydrophobicContact CG-CB 3.41Å; P609-A693 VanDerWaalsContact CG-CB 3.41Å
610	D	92.9	Very high	96.3	Very high	67 Å²	67	29.4 Å²	29.4	36%	0.358	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-3.3	176.1	62.4	8.1	0	0	0	113.8	S608 R612	S608-D610 VanDerWaalsContact CB-OD1 3.28Å; S608-D610 WeakPolarHBondContact CB-OD1 3.47Å; S608-D610 PolarHBondContact O-N 2.7Å; S608-D610 VanDerWaalsContact O-N 3.11Å; S608-D610 PolarHBondContact OG-OD1 2.91Å; D610-R612 HydrophobicContact CB-CG 4.46Å; D610-R612 PolarHBondContact O-N 2.81Å; D610-R612 WeakPolarHBondContact OD1-CB 3.41Å; D610-R612 PolarHBondContact OD1-N 3.01Å; D610-R612 IonicContact OD1-NE 3.2Å; D610-R612 IonicContact OD2-CZ 3.48Å; D610-R612 IonicContact OD2-NE 3.15Å; D610-R612 PolarHBondContact OD2-NE 3.41Å; D610-R612 IonicContact OD2-NH2 3.49Å; D610-R612 PolarHBondContact OD2-NH2 3.37Å
611	G	93.9	Very high	96.4	Very high	14 Å²	14	27.6 Å²	27.6	14%	0.144	14%	0.14	C	C	.	.	S	Bend	trans	68.6	9.9	-179.1	0	0	0	0	0	115	S608 P609 V628	S608-G611 WeakPolarHBondContact O-CA 2.95Å; S608-G611 PolarHBondContact O-N 2.8Å; P609-G611 VanDerWaalsContact C-N 3.34Å; G611-V628 WeakPolarHBondContact O-CB 3.22Å
612	R	94.7	Very high	96.4	Very high	131 Å²	131	26.5 Å²	26.5	49%	0.494	13%	0.134	S	C	.	.	S	Bend	trans	-81.1	-22.7	-179.2	-69	-169	-63.9	158.3	0.7	113.8	S608 D610 V628	S608-R612 PolarHBondContact OG-N 2.78Å; D610-R612 HydrophobicContact CB-CG 4.46Å; D610-R612 PolarHBondContact O-N 2.81Å; D610-R612 WeakPolarHBondContact OD1-CB 3.41Å; D610-R612 PolarHBondContact OD1-N 3.01Å; D610-R612 IonicContact OD1-NE 3.2Å; D610-R612 IonicContact OD2-CZ 3.48Å; D610-R612 IonicContact OD2-NE 3.15Å; D610-R612 PolarHBondContact OD2-NE 3.41Å; D610-R612 IonicContact OD2-NH2 3.49Å; D610-R612 PolarHBondContact OD2-NH2 3.37Å; R612-V628 PolarHBondContact O-N 2.88Å
613	F	96.9	Very high	96.5	Very high	21 Å²	21	26.5 Å²	26.5	9%	0.092	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	151.7	-178.8	-62.5	-73	0	0	0	111.8	Y607 S608 I625 Y626 F638 W653	Y607-F613 CarbonylContact C-O 3.51Å; Y607-F613 WeakPolarHBondContact CA-O 3.37Å; S608-F613 PolarHBondContact N-O 3.31Å; S608-F613 PolarHBondContact OG-N 2.65Å; S608-F613 PolarHBondContact OG-O 2.79Å; F613-I625 HydrophobicContact CB-CG2 4.36Å; F613-I625 HydrophobicContact CD1-CG2 3.94Å; F613-I625 HydrophobicContact CG-CG2 4.42Å; F613-Y626 CarbonylContact C-O 3.47Å; F613-Y626 WeakPolarHBondContact CA-O 3.42Å; F613-F638 HydrophobicContact CD1-CG 4.46Å; F613-F638 HydrophobicContact CE1-CB 4.41Å; F613-F638 HydrophobicContact CE1-CD1 4.14Å; F613-F638 AromaticContact CE1-CD2 3.89Å; F613-F638 HydrophobicContact CE1-CD2 3.89Å; F613-F638 HydrophobicContact CE1-CE1 4.4Å; F613-F638 HydrophobicContact CE1-CE2 4.16Å; F613-F638 AromaticContact CE1-CG 3.88Å; F613-F638 HydrophobicContact CE1-CG 3.88Å; F613-F638 HydrophobicContact CE1-CZ 4.4Å; F613-F638 HydrophobicContact CZ-CE2 4.47Å; F613-W653 HydrophobicContact CB-CH2 3.48Å; F613-W653 VanDerWaalsContact CB-CH2 3.48Å; F613-W653 HydrophobicContact CB-CZ2 3.79Å; F613-W653 HydrophobicContact CB-CZ3 4.4Å; F613-W653 HydrophobicContact CD2-CH2 4.34Å; F613-W653 HydrophobicContact CG-CH2 4.13Å
614	L	97.6	Very high	96.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	122.3	167.8	172.8	62.8	0	0	0	107.9	W581 M605 Y607 V616 I625 Y626 V628 Y635	W581-L614 HydrophobicContact CZ3-CD2 4.41Å; M605-L614 HydrophobicContact CB-CD1 4.4Å; M605-L614 HydrophobicContact CE-CD1 4.3Å; M605-L614 HydrophobicContact CE-CD2 3.78Å; M605-L614 HydrophobicContact CE-CG 4.32Å; Y607-L614 HydrophobicContact CD1-CB 4.1Å; Y607-L614 HydrophobicContact CD1-CD1 4.11Å; Y607-L614 HydrophobicContact CD2-CD1 4Å; Y607-L614 HydrophobicContact CE1-CB 4.07Å; Y607-L614 HydrophobicContact CE1-CD1 4.07Å; Y607-L614 HydrophobicContact CE1-CD2 4.3Å; Y607-L614 HydrophobicContact CE1-CG 4.38Å; Y607-L614 HydrophobicContact CE2-CD1 3.95Å; Y607-L614 HydrophobicContact CG-CD1 4.08Å; L614-V616 HydrophobicContact CD2-CG2 4.32Å; L614-V616 HydrophobicContact CG-CG2 4.01Å; L614-I625 WeakPolarHBondContact O-CA 3.2Å; L614-Y626 PolarHBondContact N-O 2.74Å; L614-Y626 PolarHBondContact O-N 3.38Å; L614-V628 HydrophobicContact CB-CG2 3.7Å; L614-Y635 HydrophobicContact CB-CE1 4.35Å; L614-Y635 HydrophobicContact CD2-CD1 4Å; L614-Y635 HydrophobicContact CD2-CE1 3.64Å
615	A	98	Very high	96.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	132.3	172.5	0	0	0	0	0	110.1	M605 K606 I623 Y624 I625 L651 W653 I660	M605-A615 CarbonylContact C-O 3.57Å; M605-A615 VanDerWaalsContact CA-O 3.28Å; M605-A615 WeakPolarHBondContact CA-O 3.44Å; K606-A615 PolarHBondContact N-O 3.18Å; K606-A615 PolarHBondContact O-N 3.2Å; A615-I623 HydrophobicContact CB-CG2 4.23Å; A615-Y624 CarbonylContact C-O 3.6Å; A615-Y624 WeakPolarHBondContact CA-O 3.21Å; A615-I625 HydrophobicContact CB-CD1 3.69Å; A615-L651 HydrophobicContact CB-CD1 4.02Å; A615-L651 HydrophobicContact CB-CD2 4.19Å; A615-W653 HydrophobicContact CB-CZ2 3.64Å; A615-I660 HydrophobicContact CB-CD1 3.7Å
616	V	98.1	Very high	96.7	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	107.8	-177.8	-179.4	0	0	0	0	108	L602 M605 L614 I623 Y624 Y626	L602-V616 HydrophobicContact CD1-CG1 3.76Å; L602-V616 HydrophobicContact CD2-CG1 3.78Å; L602-V616 HydrophobicContact CG-CG1 4.28Å; M605-V616 HydrophobicContact CE-CG1 4.47Å; M605-V616 HydrophobicContact CE-CG2 3.58Å; M605-V616 HydrophobicContact CG-CB 4.5Å; M605-V616 HydrophobicContact CG-CG1 4.19Å; M605-V616 HydrophobicContact CG-CG2 4.23Å; L614-V616 HydrophobicContact CD2-CG2 4.32Å; L614-V616 HydrophobicContact CG-CG2 4.01Å; V616-I623 CarbonylContact O-C 3.58Å; V616-I623 WeakPolarHBondContact O-CA 3.37Å; V616-Y624 PolarHBondContact N-O 2.79Å; V616-Y624 WeakPolarHBondContact O-CB 3.37Å; V616-Y624 PolarHBondContact O-N 2.95Å; V616-Y626 HydrophobicContact CG2-CD2 4.46Å
617	G	97.4	Very high	96.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.7	177	0	0	0	0	0	110.8	S603 V604	S603-G617 PolarHBondContact N-O 2.84Å; S603-G617 PolarHBondContact OG-O 3.33Å; V604-G617 PolarHBondContact O-N 3.11Å
618	S	97.1	Very high	96.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	157.8	-176.5	176.6	0	0	0	0	111.9	D620 N621 F622 I648	S618-D620 WeakPolarHBondContact CB-OD1 3.38Å; S618-D620 PolarHBondContact O-N 3.07Å; S618-D620 PolarHBondContact OG-N 3.16Å; S618-D620 PolarHBondContact OG-OD1 3.46Å; S618-N621 PolarHBondContact O-N 3.29Å; S618-F622 PolarHBondContact N-O 2.84Å; S618-F622 VanDerWaalsContact N-O 3.15Å; S618-I648 WeakPolarHBondContact O-CG1 3.3Å; S618-I648 PolarHBondContact O-N 2.84Å
619	H	96.9	Very high	96.4	Very high	46 Å²	46	28.7 Å²	28.7	21%	0.213	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-4.9	171.1	-87.1	-141.2	0	0	0	114.2	E600 Q601 N621 F647	E600-H619 HydrophobicContact CB-CB 3.83Å; Q601-H619 VanDerWaalsContact CD-CE1 3.41Å; Q601-H619 HydrophobicContact CG-CB 3.8Å; Q601-H619 VanDerWaalsContact CG-ND1 3.33Å; Q601-H619 WeakPolarHBondContact CG-ND1 3.47Å; Q601-H619 PolarHBondContact NE2-CE1 2.77Å; Q601-H619 PolarHBondContact NE2-NE2 3.37Å; Q601-H619 WeakPolarHBondContact O-CB 3.36Å; Q601-H619 PolarHBondContact O-N 3.45Å; H619-N621 PolarHBondContact O-N 3.26Å; H619-N621 PolarHBondContact O-OD1 2.64Å; H619-F647 HydrophobicContact CB-CB 3.95Å; H619-F647 AromaticContact CE1-CD2 3.89Å; H619-F647 AromaticContact NE2-CD2 3.86Å
620	D	95.7	Very high	96.1	Very high	28 Å²	28	31.5 Å²	31.5	15%	0.15	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	9.3	170.7	70.8	6	0	0	0	114.3	E600 S618 F622 Y624	E600-D620 HydrophobicContact CB-CB 4.23Å; E600-D620 HydrophobicContact CG-CB 4.17Å; S618-D620 WeakPolarHBondContact CB-OD1 3.38Å; S618-D620 PolarHBondContact O-N 3.07Å; S618-D620 PolarHBondContact OG-N 3.16Å; S618-D620 PolarHBondContact OG-OD1 3.46Å; D620-F622 VanDerWaalsContact C-N 3.29Å; D620-F622 HydrophobicContact CB-CD2 4.29Å; D620-F622 VanDerWaalsContact O-CD2 3.3Å; D620-F622 WeakPolarHBondContact O-CD2 3.39Å; D620-F622 PolarHBondContact O-N 3.26Å; D620-F622 WeakPolarHBondContact OD1-CB 3.3Å; D620-F622 WeakPolarHBondContact OD1-CD2 3.39Å; D620-F622 PolarHBondContact OD1-N 3.4Å; D620-Y624 WeakPolarHBondContact OD1-CE2 3.38Å; D620-Y624 WeakPolarHBondContact OD2-CE2 3.4Å; D620-Y624 VanDerWaalsContact OD2-CZ 3.26Å; D620-Y624 PolarHBondContact OD2-OH 2.97Å
621	N	96.3	Very high	95.8	Very high	52 Å²	52	32.2 Å²	32.2	28%	0.278	17%	0.167	S	C	.	.	S	Bend	trans	75	3	-179.2	-44.7	-17.9	0	0	0	115.3	S618 H619 S645 S646 F647	S618-N621 PolarHBondContact O-N 3.29Å; H619-N621 PolarHBondContact O-N 3.26Å; H619-N621 PolarHBondContact O-OD1 2.64Å; N621-S645 PolarHBondContact ND2-O 3.04Å; N621-S646 WeakPolarHBondContact CB-O 3.25Å; N621-S646 VanDerWaalsContact CG-C 3.42Å; N621-S646 VanDerWaalsContact OD1-CA 3.31Å; N621-S646 WeakPolarHBondContact OD1-CA 3.32Å; N621-S646 PolarHBondContact OD1-O 2.96Å; N621-F647 PolarHBondContact OD1-N 2.84Å
622	F	96.7	Very high	95.5	Very high	45 Å²	45	31.6 Å²	31.6	20%	0.197	16%	0.16	C	C	.	.			trans	-100.3	154.8	178.1	-61.1	-76.4	0	0	0	112.5	S618 D620 Y624 N642	S618-F622 PolarHBondContact N-O 2.84Å; S618-F622 VanDerWaalsContact N-O 3.15Å; D620-F622 VanDerWaalsContact C-N 3.29Å; D620-F622 HydrophobicContact CB-CD2 4.29Å; D620-F622 VanDerWaalsContact O-CD2 3.3Å; D620-F622 WeakPolarHBondContact O-CD2 3.39Å; D620-F622 PolarHBondContact O-N 3.26Å; D620-F622 WeakPolarHBondContact OD1-CB 3.3Å; D620-F622 WeakPolarHBondContact OD1-CD2 3.39Å; D620-F622 PolarHBondContact OD1-N 3.4Å; F622-Y624 HydrophobicContact CB-CD2 4.07Å; F622-Y624 HydrophobicContact CB-CE2 3.56Å; F622-N642 HydrophobicContact CD1-CB 4Å; F622-N642 HydrophobicContact CE1-CB 3.81Å; F622-N642 VanDerWaalsContact CE1-CG 3.5Å; F622-N642 WeakPolarHBondContact CE1-OD1 3.38Å
623	I	97.8	Very high	95.3	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	119.4	165.1	-49.8	166.8	0	0	0	108.2	A615 V616 I625 R640 C641 I648 L651 S662	A615-I623 HydrophobicContact CB-CG2 4.23Å; V616-I623 CarbonylContact O-C 3.58Å; V616-I623 WeakPolarHBondContact O-CA 3.37Å; I623-I625 HydrophobicContact CG2-CD1 3.95Å; I623-R640 CarbonylContact O-C 3.6Å; I623-R640 WeakPolarHBondContact O-CA 3.17Å; I623-C641 HydrophobicContact CB-CB 3.89Å; I623-C641 HydrophobicContact CD1-CB 4.49Å; I623-C641 HydrophobicContact CG1-CB 4.48Å; I623-C641 PolarHBondContact N-O 2.82Å; I623-C641 PolarHBondContact O-N 3.23Å; I623-I648 HydrophobicContact CD1-CD1 4.21Å; I623-I648 HydrophobicContact CG1-CD1 3.87Å; I623-I648 HydrophobicContact CG1-CG1 3.86Å; I623-I648 HydrophobicContact CG1-CG2 4.4Å; I623-L651 HydrophobicContact CG2-CD2 4.3Å; I623-S662 VanDerWaalsContact CD1-OG 3.3Å; I623-S662 WeakPolarHBondContact CD1-OG 3.17Å
624	Y	97.6	Very high	95.2	Very high	22 Å²	22	36.8 Å²	36.8	9%	0.086	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	121	-174.5	-75.2	-93.5	0	0	0	108.7	D597 A615 V616 D620 F622 R637	D597-Y624 HydrophobicContact CB-CD1 3.4Å; D597-Y624 VanDerWaalsContact CB-CD1 3.4Å; D597-Y624 HydrophobicContact CB-CD2 4.09Å; D597-Y624 HydrophobicContact CB-CE1 3.68Å; D597-Y624 HydrophobicContact CB-CE2 4.19Å; D597-Y624 HydrophobicContact CB-CG 3.74Å; D597-Y624 WeakPolarHBondContact OD1-CD1 3.39Å; A615-Y624 CarbonylContact C-O 3.6Å; A615-Y624 WeakPolarHBondContact CA-O 3.21Å; V616-Y624 PolarHBondContact N-O 2.79Å; V616-Y624 WeakPolarHBondContact O-CB 3.37Å; V616-Y624 PolarHBondContact O-N 2.95Å; D620-Y624 WeakPolarHBondContact OD1-CE2 3.38Å; D620-Y624 WeakPolarHBondContact OD2-CE2 3.4Å; D620-Y624 VanDerWaalsContact OD2-CZ 3.26Å; D620-Y624 PolarHBondContact OD2-OH 2.97Å; F622-Y624 HydrophobicContact CB-CD2 4.07Å; F622-Y624 HydrophobicContact CB-CE2 3.56Å; Y624-R637 VanDerWaalsContact C-NH1 3.28Å; Y624-R637 VanDerWaalsContact CD1-NH1 3.31Å
625	I	98	Very high	95.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	129.1	-178.7	-50.8	-60.2	0	0	0	110.6	F613 L614 A615 I623 R637 F638 G639 I660 I674	F613-I625 HydrophobicContact CB-CG2 4.36Å; F613-I625 HydrophobicContact CD1-CG2 3.94Å; F613-I625 HydrophobicContact CG-CG2 4.42Å; L614-I625 WeakPolarHBondContact O-CA 3.2Å; A615-I625 HydrophobicContact CB-CD1 3.69Å; I623-I625 HydrophobicContact CG2-CD1 3.95Å; I625-R637 VanDerWaalsContact N-NH1 3.16Å; I625-F638 HydrophobicContact CB-CD1 4.39Å; I625-F638 HydrophobicContact CG2-CB 4.17Å; I625-F638 HydrophobicContact CG2-CD1 3.93Å; I625-F638 HydrophobicContact CG2-CG 4.44Å; I625-F638 PolarHBondContact O-N 3.18Å; I625-G639 PolarHBondContact N-O 2.98Å; I625-G639 PolarHBondContact O-N 3.33Å; I625-I660 HydrophobicContact CD1-CD1 3.7Å; I625-I674 HydrophobicContact CD1-CD1 4.17Å; I625-I674 HydrophobicContact CG1-CD1 4.17Å; I625-I674 HydrophobicContact CG2-CG2 3.93Å
626	Y	97.4	Very high	95	Very high	11 Å²	11	41.1 Å²	41.1	4%	0.043	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	135.8	175.4	-75.4	-93.6	0	0	0	110.5	W581 D597 F613 L614 V616 S636 R637	W581-Y626 HydrophobicContact CH2-CD1 4.4Å; W581-Y626 HydrophobicContact CH2-CE1 4.47Å; W581-Y626 HydrophobicContact CZ2-CD1 4.02Å; W581-Y626 AromaticContact CZ2-CD2 3.95Å; W581-Y626 HydrophobicContact CZ2-CD2 3.95Å; W581-Y626 AromaticContact CZ2-CE1 3.77Å; W581-Y626 HydrophobicContact CZ2-CE1 3.77Å; W581-Y626 AromaticContact CZ2-CE2 3.67Å; W581-Y626 HydrophobicContact CZ2-CE2 3.67Å; W581-Y626 HydrophobicContact CZ2-CG 4.12Å; W581-Y626 AromaticContact CZ2-CZ 3.59Å; W581-Y626 AromaticContact NE1-CE2 3.96Å; D597-Y626 PolarHBondContact OD1-OH 2.68Å; D597-Y626 WeakPolarHBondContact OD2-CE2 3.23Å; D597-Y626 VanDerWaalsContact OD2-CZ 3.22Å; D597-Y626 PolarHBondContact OD2-OH 3.15Å; F613-Y626 CarbonylContact C-O 3.47Å; F613-Y626 WeakPolarHBondContact CA-O 3.42Å; L614-Y626 PolarHBondContact N-O 2.74Å; L614-Y626 PolarHBondContact O-N 3.38Å; V616-Y626 HydrophobicContact CG2-CD2 4.46Å; Y626-S636 CarbonylContact C-O 3.55Å; Y626-S636 WeakPolarHBondContact CA-O 3.47Å; Y626-R637 HydrophobicContact CD1-CB 4.47Å; Y626-R637 HydrophobicContact CE1-CB 4.03Å
627	S	96.4	Very high	94.9	Very high	34 Å²	34	45.6 Å²	45.6	24%	0.238	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	133.5	162.4	-172.4	0	0	0	0	108.4	Y635 S636	S627-Y635 WeakPolarHBondContact O-CA 3.32Å; S627-S636 PolarHBondContact N-O 2.86Å; S627-S636 PolarHBondContact O-N 2.94Å
628	V	96	Very high	94.7	Very high	9 Å²	9	49.8 Å²	49.8	6%	0.055	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	125.9	-177.5	-175.7	0	0	0	0	108.2	Y607 G611 R612 L614 R634 Y635	Y607-V628 HydrophobicContact CD1-CG2 4.31Å; Y607-V628 HydrophobicContact CE1-CG1 4.29Å; Y607-V628 HydrophobicContact CE1-CG2 4.15Å; G611-V628 WeakPolarHBondContact O-CB 3.22Å; R612-V628 PolarHBondContact O-N 2.88Å; L614-V628 HydrophobicContact CB-CG2 3.7Å; V628-R634 WeakPolarHBondContact CA-O 3.27Å; V628-Y635 HydrophobicContact CB-CE1 4.38Å; V628-Y635 HydrophobicContact CG1-CE1 3.98Å; V628-Y635 HydrophobicContact CG2-CD1 3.83Å; V628-Y635 HydrophobicContact CG2-CE1 3.63Å
629	T	93.8	Very high	94.6	Very high	64 Å²	64	50.7 Å²	50.7	39%	0.393	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	174.6	176.7	62.3	0	0	0	0	110.6	S631 G632 R633 R634	T629-S631 VanDerWaalsContact C-N 3.28Å; T629-S631 PolarHBondContact O-N 2.85Å; T629-G632 PolarHBondContact O-N 3.23Å; T629-R633 PolarHBondContact O-N 3.16Å; T629-R634 PolarHBondContact N-O 3.28Å; T629-R634 PolarHBondContact O-N 2.98Å; T629-R634 WeakPolarHBondContact OG1-CB 3.46Å
630	E	90	Very high	94.6	Very high	117 Å²	117	55.2 Å²	55.2	55%	0.547	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	54.6	44.2	178.1	-60.8	172.6	-155.6	0	0	112.1	G632 R633 R634	E630-G632 VanDerWaalsContact C-N 3.25Å; E630-G632 PolarHBondContact O-N 2.86Å; E630-R633 HydrophobicContact CB-CB 4.13Å; E630-R633 WeakPolarHBondContact O-CB 3.45Å; E630-R633 WeakPolarHBondContact O-CG 3.16Å; E630-R633 PolarHBondContact O-N 3.29Å; E630-R633 VanDerWaalsContact O-N 3.12Å; E630-R634 HydrophobicContact CB-CB 4.42Å; E630-R634 HydrophobicContact CG-CB 4.48Å; E630-R634 WeakPolarHBondContact OE1-CD 3.47Å; E630-R634 IonicContact OE1-NH1 3.17Å
631	S	86.6	Confident	94.6	Very high	81 Å²	81	53.9 Å²	53.9	57%	0.566	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	57.1	31.8	178.6	-55.6	0	0	0	0	115	S568 T629	S568-S631 PolarHBondContact OG-O 2.86Å; T629-S631 VanDerWaalsContact C-N 3.28Å; T629-S631 PolarHBondContact O-N 2.85Å
632	G	86.9	Confident	94.5	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.01	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	97.4	9.5	-178.9	0	0	0	0	0	114.2	I592 T629 E630 Y635	I592-G632 WeakPolarHBondContact CD1-O 3.42Å; T629-G632 PolarHBondContact O-N 3.23Å; E630-G632 VanDerWaalsContact C-N 3.25Å; E630-G632 PolarHBondContact O-N 2.86Å; G632-Y635 WeakPolarHBondContact O-CE2 3.38Å; G632-Y635 VanDerWaalsContact O-CZ 3.24Å; G632-Y635 PolarHBondContact O-OH 2.81Å
633	R	90.9	Very high	94.4	Very high	112 Å²	112	55.7 Å²	55.7	42%	0.423	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-18	180	-64.8	-174.2	-179.5	-77.2	-4.9	114.3	D585 I592 T629 E630	D585-R633 IonicContact OD2-CZ 3.4Å; D585-R633 IonicContact OD2-NH1 2.8Å; D585-R633 PolarHBondContact OD2-NH1 3.27Å; D585-R633 IonicContact OD2-NH2 3.83Å; D585-R633 PolarHBondContact OD2-NH2 3.17Å; I592-R633 HydrophobicContact CD1-CB 4.47Å; I592-R633 HydrophobicContact CD1-CG 4.25Å; T629-R633 PolarHBondContact O-N 3.16Å; E630-R633 HydrophobicContact CB-CB 4.13Å; E630-R633 WeakPolarHBondContact O-CB 3.45Å; E630-R633 WeakPolarHBondContact O-CG 3.16Å; E630-R633 PolarHBondContact O-N 3.29Å; E630-R633 VanDerWaalsContact O-N 3.12Å
634	R	94	Very high	94.3	Very high	149 Å²	149	56.2 Å²	56.2	56%	0.562	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.3	133.7	-178	-175.2	173.4	-173.1	153.6	4	111.7	V628 T629 E630	V628-R634 WeakPolarHBondContact CA-O 3.27Å; T629-R634 PolarHBondContact N-O 3.28Å; T629-R634 PolarHBondContact O-N 2.98Å; T629-R634 WeakPolarHBondContact OG1-CB 3.46Å; E630-R634 HydrophobicContact CB-CB 4.42Å; E630-R634 HydrophobicContact CG-CB 4.48Å; E630-R634 WeakPolarHBondContact OE1-CD 3.47Å; E630-R634 IonicContact OE1-NH1 3.17Å
635	Y	96.3	Very high	94.2	Very high	30 Å²	30	58.1 Å²	58.1	12%	0.118	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	133.9	-176.1	-62.5	-95.7	0	0	0	110	W581 V583 S593 Y607 L614 S627 V628 G632	W581-Y635 AromaticContact CH2-CD1 3.98Å; W581-Y635 HydrophobicContact CH2-CD1 3.98Å; W581-Y635 HydrophobicContact CH2-CD2 4.49Å; W581-Y635 AromaticContact CH2-CG 3.85Å; W581-Y635 HydrophobicContact CH2-CG 3.85Å; W581-Y635 HydrophobicContact CZ3-CD1 4.22Å; W581-Y635 HydrophobicContact CZ3-CD2 4.46Å; W581-Y635 HydrophobicContact CZ3-CG 4.18Å; V583-Y635 HydrophobicContact CB-CE2 4.17Å; V583-Y635 HydrophobicContact CG1-CE2 4.14Å; V583-Y635 WeakPolarHBondContact CG1-OH 3.35Å; V583-Y635 HydrophobicContact CG2-CD2 4.45Å; V583-Y635 HydrophobicContact CG2-CE1 4.31Å; V583-Y635 HydrophobicContact CG2-CE2 3.75Å; S593-Y635 WeakPolarHBondContact OG-CD2 3.37Å; Y607-Y635 HydrophobicContact CE1-CE1 4.02Å; Y607-Y635 PolarHBondContact OH-OH 3.23Å; L614-Y635 HydrophobicContact CB-CE1 4.35Å; L614-Y635 HydrophobicContact CD2-CD1 4Å; L614-Y635 HydrophobicContact CD2-CE1 3.64Å; S627-Y635 WeakPolarHBondContact O-CA 3.32Å; V628-Y635 HydrophobicContact CB-CE1 4.38Å; V628-Y635 HydrophobicContact CG1-CE1 3.98Å; V628-Y635 HydrophobicContact CG2-CD1 3.83Å; V628-Y635 HydrophobicContact CG2-CE1 3.63Å; G632-Y635 WeakPolarHBondContact O-CE2 3.38Å; G632-Y635 VanDerWaalsContact O-CZ 3.24Å; G632-Y635 PolarHBondContact O-OH 2.81Å
636	S	95.4	Very high	94.1	Very high	62 Å²	62	59 Å²	59	43%	0.434	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	137.2	172.2	64	0	0	0	0	110.4	Y626 S627 F638	Y626-S636 CarbonylContact C-O 3.55Å; Y626-S636 WeakPolarHBondContact CA-O 3.47Å; S627-S636 PolarHBondContact N-O 2.86Å; S627-S636 PolarHBondContact O-N 2.94Å; S636-F638 PolarHBondContact O-N 2.92Å; S636-F638 VanDerWaalsContact O-N 3.15Å
637	R	95.1	Very high	94	Very high	93 Å²	93	62.3 Å²	62.3	35%	0.351	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	116.2	-178.1	-173.5	70.9	-176.8	157.2	0.4	110.9	D597 Y624 I625 Y626 G639	D597-R637 IonicContact OD1-CZ 3.43Å; D597-R637 IonicContact OD1-NH1 2.92Å; Y624-R637 VanDerWaalsContact C-NH1 3.28Å; Y624-R637 VanDerWaalsContact CD1-NH1 3.31Å; I625-R637 VanDerWaalsContact N-NH1 3.16Å; Y626-R637 HydrophobicContact CD1-CB 4.47Å; Y626-R637 HydrophobicContact CE1-CB 4.03Å; R637-G639 PolarHBondContact NH1-O 2.9Å; R637-G639 PolarHBondContact NH2-O 2.94Å
638	F	94.8	Very high	94.1	Very high	88 Å²	88	60.7 Å²	60.7	39%	0.386	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-45.2	177.8	178.7	-99.3	0	0	0	111.5	F613 I625 S636 I674	F613-F638 HydrophobicContact CD1-CG 4.46Å; F613-F638 HydrophobicContact CE1-CB 4.41Å; F613-F638 HydrophobicContact CE1-CD1 4.14Å; F613-F638 AromaticContact CE1-CD2 3.89Å; F613-F638 HydrophobicContact CE1-CD2 3.89Å; F613-F638 HydrophobicContact CE1-CE1 4.4Å; F613-F638 HydrophobicContact CE1-CE2 4.16Å; F613-F638 AromaticContact CE1-CG 3.88Å; F613-F638 HydrophobicContact CE1-CG 3.88Å; F613-F638 HydrophobicContact CE1-CZ 4.4Å; F613-F638 HydrophobicContact CZ-CE2 4.47Å; I625-F638 HydrophobicContact CB-CD1 4.39Å; I625-F638 HydrophobicContact CG2-CB 4.17Å; I625-F638 HydrophobicContact CG2-CD1 3.93Å; I625-F638 HydrophobicContact CG2-CG 4.44Å; I625-F638 PolarHBondContact O-N 3.18Å; S636-F638 PolarHBondContact O-N 2.92Å; S636-F638 VanDerWaalsContact O-N 3.15Å; F638-I674 HydrophobicContact CD1-CG2 4.43Å; F638-I674 HydrophobicContact CE1-CG2 4.16Å; F638-I674 VanDerWaalsContact CE1-O 3.28Å; F638-I674 WeakPolarHBondContact CE1-O 3.31Å
639	G	94.8	Very high	94.1	Very high	19 Å²	19	62 Å²	62	20%	0.196	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.4	-175.3	-178.6	0	0	0	0	0	113.5	I625 R637	I625-G639 PolarHBondContact N-O 2.98Å; I625-G639 PolarHBondContact O-N 3.33Å; R637-G639 PolarHBondContact NH1-O 2.9Å; R637-G639 PolarHBondContact NH2-O 2.94Å
640	R	95.3	Very high	94.2	Very high	141 Å²	141	60.3 Å²	60.3	53%	0.532	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	140.2	174.8	71.1	-178.8	177.2	173.2	-1.4	111.2	I623	I623-R640 CarbonylContact O-C 3.6Å; I623-R640 WeakPolarHBondContact O-CA 3.17Å
641	C	96.2	Very high	94.6	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	123.5	169.4	-56.6	0	0	0	0	108.6	I623 W672	I623-C641 HydrophobicContact CB-CB 3.89Å; I623-C641 HydrophobicContact CD1-CB 4.49Å; I623-C641 HydrophobicContact CG1-CB 4.48Å; I623-C641 PolarHBondContact N-O 2.82Å; I623-C641 PolarHBondContact O-N 3.23Å; C641-W672 HydrophobicContact CB-CD2 3.61Å; C641-W672 HydrophobicContact CB-CE3 3.44Å; C641-W672 VanDerWaalsContact CB-CE3 3.44Å; C641-W672 HydrophobicContact CB-CG 4.26Å; C641-W672 HydrophobicContact CB-CH2 3.99Å; C641-W672 HydrophobicContact CB-CZ2 4.16Å; C641-W672 HydrophobicContact CB-CZ3 3.63Å
642	N	95.4	Very high	95.1	Very high	99 Å²	99	50.9 Å²	50.9	53%	0.529	25%	0.25	S	S	.	.			trans	-123.2	125.7	179.2	179.7	12.8	0	0	0	109.8	F622 W672	F622-N642 HydrophobicContact CD1-CB 4Å; F622-N642 HydrophobicContact CE1-CB 3.81Å; F622-N642 VanDerWaalsContact CE1-CG 3.5Å; F622-N642 WeakPolarHBondContact CE1-OD1 3.38Å; N642-W672 VanDerWaalsContact C-CH2 3.47Å; N642-W672 WeakPolarHBondContact O-CH2 3.41Å; N642-W672 WeakPolarHBondContact O-CZ3 3.46Å
643	G	93.7	Very high	95.6	Very high	37 Å²	37	51 Å²	51	38%	0.381	25%	0.25	S	S	.	.			trans	164.3	-21	175.9	0	0	0	0	0	116.1
644	H	96.1	Very high	95.9	Very high	11 Å²	11	45.8 Å²	45.8	5%	0.051	23%	0.231	C	C	.	.			trans	-67.3	144	174	-86	-66.6	0	0	0	111.4	I648 S662 S664 E668 L670 W672	H644-I648 HydrophobicContact CB-CD1 3.97Å; H644-I648 WeakPolarHBondContact CD2-CD1 3.44Å; H644-S662 PolarHBondContact NE2-OG 3.32Å; H644-S664 VanDerWaalsContact ND1-CB 3.28Å; H644-S664 WeakPolarHBondContact ND1-CB 3.35Å; H644-S664 PolarHBondContact ND1-OG 2.62Å; H644-E668 IonicContact ND1-OE2 2.68Å; H644-L670 HydrophobicContact CB-CD1 4.37Å; H644-W672 AromaticContact CD2-CZ2 3.83Å
645	S	94.7	Very high	96	Very high	63 Å²	63	43 Å²	43	44%	0.441	22%	0.223	S	C	.	.	S	Bend	trans	-86.7	-10.7	176.1	60.9	0	0	0	0	114.4	N621 D666 E668	N621-S645 PolarHBondContact ND2-O 3.04Å; S645-D666 WeakPolarHBondContact CB-OD2 3.25Å; S645-D666 WeakPolarHBondContact OG-CB 3.44Å; S645-D666 PolarHBondContact OG-OD2 3.01Å; S645-E668 PolarHBondContact N-OE2 3.44Å; S645-E668 PolarHBondContact OG-OE2 2.78Å
646	S	95.6	Very high	95.8	Very high	19 Å²	19	45.8 Å²	45.8	13%	0.133	24%	0.24	C	C	.	.	S	Bend	trans	-147.5	175.7	-175.2	-170.2	0	0	0	0	111.5	N621 D666	N621-S646 WeakPolarHBondContact CB-O 3.25Å; N621-S646 VanDerWaalsContact CG-C 3.42Å; N621-S646 VanDerWaalsContact OD1-CA 3.31Å; N621-S646 WeakPolarHBondContact OD1-CA 3.32Å; N621-S646 PolarHBondContact OD1-O 2.96Å; S646-D666 WeakPolarHBondContact CB-OD2 3.49Å
647	F	96	Very high	95.8	Very high	79 Å²	79	42.9 Å²	42.9	35%	0.346	22%	0.22	S	C	.	.			trans	-58.5	143.5	-174.9	54.3	-91.4	0	0	0	111.5	H619 N621 T649 S664 G665	H619-F647 HydrophobicContact CB-CB 3.95Å; H619-F647 AromaticContact CE1-CD2 3.89Å; H619-F647 AromaticContact NE2-CD2 3.86Å; N621-F647 PolarHBondContact OD1-N 2.84Å; F647-T649 HydrophobicContact CD2-CG2 3.77Å; F647-T649 HydrophobicContact CE2-CG2 3.6Å; F647-S664 CarbonylContact O-C 3.58Å; F647-S664 WeakPolarHBondContact O-CA 3.42Å; F647-S664 WeakPolarHBondContact O-CB 3.18Å; F647-G665 PolarHBondContact O-N 3.16Å
648	I	97.8	Very high	95.8	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	136.5	177	-52.2	-56.1	0	0	0	108.9	S603 V604 S618 I623 H644	S603-I648 VanDerWaalsContact CB-O 3.25Å; S603-I648 WeakPolarHBondContact CB-O 3.34Å; S603-I648 PolarHBondContact OG-O 2.93Å; V604-I648 HydrophobicContact CG1-CG2 4.06Å; S618-I648 WeakPolarHBondContact O-CG1 3.3Å; S618-I648 PolarHBondContact O-N 2.84Å; I623-I648 HydrophobicContact CD1-CD1 4.21Å; I623-I648 HydrophobicContact CG1-CD1 3.87Å; I623-I648 HydrophobicContact CG1-CG1 3.86Å; I623-I648 HydrophobicContact CG1-CG2 4.4Å; H644-I648 HydrophobicContact CB-CD1 3.97Å; H644-I648 WeakPolarHBondContact CD2-CD1 3.44Å
649	T	96.2	Very high	95.8	Very high	38 Å²	38	38.4 Å²	38.4	23%	0.233	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	-45	177.2	52.8	0	0	0	0	112.1	F647 N663	F647-T649 HydrophobicContact CD2-CG2 3.77Å; F647-T649 HydrophobicContact CE2-CG2 3.6Å; T649-N663 PolarHBondContact N-O 2.81Å; T649-N663 PolarHBondContact OG1-O 3.14Å
650	H	97.3	Very high	95.9	Very high	27 Å²	27	37.5 Å²	37.5	13%	0.125	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	154.9	-178.7	-53.2	-79.9	0	0	0	111.1	S662 N663 T696 C697 N717	H650-S662 VanDerWaalsContact O-CA 3.31Å; H650-S662 WeakPolarHBondContact O-CA 3.39Å; H650-S662 WeakPolarHBondContact O-CB 3.39Å; H650-N663 HydrophobicContact CB-CB 4.28Å; H650-N663 PolarHBondContact O-N 2.75Å; H650-T696 PolarHBondContact ND1-O 2.95Å; H650-C697 HydrophobicContact CB-CB 4.34Å; H650-N717 PolarHBondContact CE1-O 3.06Å; H650-N717 VanDerWaalsContact CE1-O 3.26Å
651	L	97.4	Very high	96	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	147	171.6	64.4	89.8	0	0	0	110.9	V604 K606 A615 I623 I660 V661 T696	V604-L651 HydrophobicContact CB-CD2 4.33Å; V604-L651 HydrophobicContact CB-CG 4.41Å; V604-L651 HydrophobicContact CG1-CB 4.48Å; V604-L651 HydrophobicContact CG1-CD2 3.38Å; V604-L651 HydrophobicContact CG1-CG 3.73Å; V604-L651 HydrophobicContact CG2-CD1 4.43Å; V604-L651 HydrophobicContact CG2-CD2 4.12Å; V604-L651 HydrophobicContact CG2-CG 3.78Å; K606-L651 HydrophobicContact CB-CD1 3.46Å; K606-L651 VanDerWaalsContact CB-CD1 3.46Å; K606-L651 HydrophobicContact CG-CD1 3.47Å; K606-L651 VanDerWaalsContact CG-CD1 3.47Å; K606-L651 HydrophobicContact CG-CG 4.32Å; A615-L651 HydrophobicContact CB-CD1 4.02Å; A615-L651 HydrophobicContact CB-CD2 4.19Å; I623-L651 HydrophobicContact CG2-CD2 4.3Å; L651-I660 HydrophobicContact CB-CG2 4.11Å; L651-V661 CarbonylContact C-O 3.53Å; L651-V661 VanDerWaalsContact CA-O 3.24Å; L651-V661 WeakPolarHBondContact CA-O 3.43Å; L651-T696 PolarHBondContact O-OG1 2.96Å
652	D	97.9	Very high	96.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	142.5	173.1	-67.4	-67.1	0	0	0	110.8	I660 V661 S694 T696 C697	D652-I660 WeakPolarHBondContact O-CA 3.24Å; D652-V661 HydrophobicContact CB-CG1 3.79Å; D652-V661 PolarHBondContact N-O 2.95Å; D652-V661 PolarHBondContact O-N 2.82Å; D652-S694 WeakPolarHBondContact CB-O 3.31Å; D652-S694 WeakPolarHBondContact OD1-CB 3.43Å; D652-S694 PolarHBondContact OD1-OG 3.04Å; D652-T696 PolarHBondContact OD1-N 3.28Å; D652-T696 PolarHBondContact OD1-OG1 2.85Å; D652-T696 PolarHBondContact OD2-N 2.9Å; D652-T696 PolarHBondContact OD2-OG1 2.88Å; D652-C697 WeakPolarHBondContact OD2-CB 3.41Å; D652-C697 PolarHBondContact OD2-N 2.99Å; D652-C697 PolarHBondContact OD2-SG 2.94Å
653	W	97.8	Very high	96.1	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.015	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	148.5	174.2	-73	96.1	0	0	0	111.5	K606 Y607 P609 F613 A615 G657 Y659 I660 I674 A693	K606-W653 PolarHBondContact O-NE1 3.43Å; Y607-W653 PolarHBondContact O-NE1 2.73Å; P609-W653 HydrophobicContact CG-CB 4.28Å; F613-W653 HydrophobicContact CB-CH2 3.48Å; F613-W653 VanDerWaalsContact CB-CH2 3.48Å; F613-W653 HydrophobicContact CB-CZ2 3.79Å; F613-W653 HydrophobicContact CB-CZ3 4.4Å; F613-W653 HydrophobicContact CD2-CH2 4.34Å; F613-W653 HydrophobicContact CG-CH2 4.13Å; A615-W653 HydrophobicContact CB-CZ2 3.64Å; W653-G657 WeakPolarHBondContact CZ3-O 3.44Å; W653-Y659 WeakPolarHBondContact CA-O 3.49Å; W653-I660 HydrophobicContact CD2-CD1 4.07Å; W653-I660 HydrophobicContact CD2-CG1 3.69Å; W653-I660 HydrophobicContact CE3-CD1 4.11Å; W653-I660 HydrophobicContact CE3-CG1 3.56Å; W653-I660 HydrophobicContact CG-CG1 4.39Å; W653-I660 HydrophobicContact CH2-CD1 3.69Å; W653-I660 HydrophobicContact CH2-CG1 4.06Å; W653-I660 HydrophobicContact CZ2-CD1 3.63Å; W653-I660 HydrophobicContact CZ2-CG1 4.17Å; W653-I660 HydrophobicContact CZ3-CD1 3.93Å; W653-I660 HydrophobicContact CZ3-CG1 3.76Å; W653-I674 HydrophobicContact CH2-CB 4.42Å; W653-I674 HydrophobicContact CH2-CG1 4.07Å; W653-I674 HydrophobicContact CH2-CG2 4.08Å; W653-I674 HydrophobicContact CZ3-CB 4.11Å; W653-I674 HydrophobicContact CZ3-CG1 3.78Å; W653-I674 HydrophobicContact CZ3-CG2 4.21Å; W653-A693 WeakPolarHBondContact O-CB 3.28Å; W653-A693 PolarHBondContact O-N 2.83Å
654	S	96.8	Very high	96.2	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.021	13%	0.13	C	C	.	.	B	Isolated β-bridge	trans	-69.7	155.1	166.4	54.9	0	0	0	0	111.6	D656 G657 C658 Y659 E691	S654-D656 WeakPolarHBondContact CB-OD1 3.35Å; S654-D656 PolarHBondContact O-N 2.92Å; S654-D656 PolarHBondContact OG-OD1 3.06Å; S654-G657 PolarHBondContact O-N 2.79Å; S654-C658 PolarHBondContact OG-N 3Å; S654-Y659 PolarHBondContact N-O 3.32Å; S654-Y659 WeakPolarHBondContact OG-CA 3.31Å; S654-Y659 WeakPolarHBondContact OG-CB 3.4Å; S654-Y659 PolarHBondContact OG-N 2.95Å; S654-Y659 PolarHBondContact OG-O 2.72Å; S654-E691 WeakPolarHBondContact CA-O 3.31Å
655	K	94.6	Very high	96.1	Very high	90 Å²	90	25 Å²	25	39%	0.391	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-29.6	178.8	-74	-173.1	-175.8	169.4	0	113.5	G657 E691 A693 E725	K655-G657 VanDerWaalsContact C-N 3.32Å; K655-E691 HydrophobicContact CD-CB 3.93Å; K655-E691 WeakPolarHBondContact CD-OE2 3.14Å; K655-E691 HydrophobicContact CG-CB 4.24Å; K655-E691 PolarHBondContact N-O 3.44Å; K655-E691 IonicContact NZ-OE2 3.82Å; K655-E691 PolarHBondContact NZ-OE2 3.47Å; K655-A693 HydrophobicContact CG-CB 4.28Å; K655-E725 VanDerWaalsContact CE-OE1 3.26Å; K655-E725 WeakPolarHBondContact CE-OE1 3.44Å; K655-E725 IonicContact NZ-OE1 2.79Å; K655-E725 PolarHBondContact NZ-OE1 2.81Å; K655-E725 IonicContact NZ-OE2 3.4Å
656	D	93.9	Very high	95.8	Very high	89 Å²	89	24.1 Å²	24.1	48%	0.476	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-4.6	176.6	66.7	-0.4	0	0	0	114	S654 C658	S654-D656 WeakPolarHBondContact CB-OD1 3.35Å; S654-D656 PolarHBondContact O-N 2.92Å; S654-D656 PolarHBondContact OG-OD1 3.06Å; D656-C658 PolarHBondContact O-N 3.05Å; D656-C658 PolarHBondContact OD1-N 3.04Å
657	G	94.1	Very high	95.6	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.01	13%	0.125	C	C	.	.	S	Bend	trans	69.7	8.8	-178.3	0	0	0	0	0	115.1	W653 S654 K655	W653-G657 WeakPolarHBondContact CZ3-O 3.44Å; S654-G657 PolarHBondContact O-N 2.79Å; K655-G657 VanDerWaalsContact C-N 3.32Å
658	C	94.5	Very high	95.4	Very high	32 Å²	32	24.2 Å²	24.2	22%	0.216	12%	0.124	C	C	.	.	S	Bend	trans	-92.9	-24.5	-175	-66.3	0	0	0	0	113.8	S654 D656 I674 A675	S654-C658 PolarHBondContact OG-N 3Å; D656-C658 PolarHBondContact O-N 3.05Å; D656-C658 PolarHBondContact OD1-N 3.04Å; C658-I674 PolarHBondContact O-N 3.41Å; C658-A675 HydrophobicContact CB-CB 4.33Å
659	Y	96.3	Very high	95.3	Very high	54 Å²	54	24.8 Å²	24.8	21%	0.212	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	151.8	-171.6	-57.2	-81.3	0	0	0	112.4	W653 S654 W672 D673 L681 R690	W653-Y659 WeakPolarHBondContact CA-O 3.49Å; S654-Y659 PolarHBondContact N-O 3.32Å; S654-Y659 WeakPolarHBondContact OG-CA 3.31Å; S654-Y659 WeakPolarHBondContact OG-CB 3.4Å; S654-Y659 PolarHBondContact OG-N 2.95Å; S654-Y659 PolarHBondContact OG-O 2.72Å; Y659-W672 CarbonylContact C-O 3.51Å; Y659-W672 WeakPolarHBondContact CA-O 3.36Å; Y659-W672 WeakPolarHBondContact CD1-O 3.3Å; Y659-D673 HydrophobicContact CD1-CB 4.11Å; Y659-D673 HydrophobicContact CE1-CB 3.84Å; Y659-L681 HydrophobicContact CD1-CD1 3.84Å; Y659-L681 HydrophobicContact CE1-CD1 4.01Å; Y659-R690 VanDerWaalsContact CE1-NH2 3.35Å
660	I	97.4	Very high	95.3	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	137.1	170.9	-65.7	177.8	0	0	0	108.9	A615 I625 L651 D652 W653 Y671 W672 I674	A615-I660 HydrophobicContact CB-CD1 3.7Å; I625-I660 HydrophobicContact CD1-CD1 3.7Å; L651-I660 HydrophobicContact CB-CG2 4.11Å; D652-I660 WeakPolarHBondContact O-CA 3.24Å; W653-I660 HydrophobicContact CD2-CD1 4.07Å; W653-I660 HydrophobicContact CD2-CG1 3.69Å; W653-I660 HydrophobicContact CE3-CD1 4.11Å; W653-I660 HydrophobicContact CE3-CG1 3.56Å; W653-I660 HydrophobicContact CG-CG1 4.39Å; W653-I660 HydrophobicContact CH2-CD1 3.69Å; W653-I660 HydrophobicContact CH2-CG1 4.06Å; W653-I660 HydrophobicContact CZ2-CD1 3.63Å; W653-I660 HydrophobicContact CZ2-CG1 4.17Å; W653-I660 HydrophobicContact CZ3-CD1 3.93Å; W653-I660 HydrophobicContact CZ3-CG1 3.76Å; I660-Y671 CarbonylContact O-C 3.56Å; I660-Y671 VanDerWaalsContact O-CA 3.3Å; I660-Y671 WeakPolarHBondContact O-CA 3.18Å; I660-W672 HydrophobicContact CB-CB 4.3Å; I660-W672 PolarHBondContact N-O 3.3Å; I660-W672 PolarHBondContact O-N 2.69Å; I660-I674 HydrophobicContact CB-CG1 4.48Å; I660-I674 HydrophobicContact CD1-CD1 3.79Å; I660-I674 HydrophobicContact CD1-CG1 3.78Å; I660-I674 HydrophobicContact CG1-CD1 4.15Å; I660-I674 HydrophobicContact CG1-CG1 3.78Å
661	V	97.1	Very high	95.3	Very high	8 Å²	8	24.2 Å²	24.2	5%	0.048	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	141.3	158.7	60.6	0	0	0	0	108.3	L651 D652 I669 L670 Y671 W692	L651-V661 CarbonylContact C-O 3.53Å; L651-V661 VanDerWaalsContact CA-O 3.24Å; L651-V661 WeakPolarHBondContact CA-O 3.43Å; D652-V661 HydrophobicContact CB-CG1 3.79Å; D652-V661 PolarHBondContact N-O 2.95Å; D652-V661 PolarHBondContact O-N 2.82Å; V661-I669 HydrophobicContact CG2-CG2 3.71Å; V661-L670 WeakPolarHBondContact CA-O 3.27Å; V661-Y671 HydrophobicContact CB-CD1 3.8Å; V661-Y671 HydrophobicContact CB-CE1 3.81Å; V661-Y671 HydrophobicContact CG2-CD1 3.83Å; V661-Y671 HydrophobicContact CG2-CE1 3.49Å; V661-Y671 VanDerWaalsContact CG2-CE1 3.49Å; V661-W692 HydrophobicContact CB-CD2 4.38Å; V661-W692 HydrophobicContact CB-CE3 4.08Å; V661-W692 HydrophobicContact CB-CH2 3.56Å; V661-W692 HydrophobicContact CB-CZ2 3.86Å; V661-W692 HydrophobicContact CB-CZ3 3.67Å; V661-W692 HydrophobicContact CG1-CD2 3.77Å; V661-W692 HydrophobicContact CG1-CE3 3.53Å; V661-W692 HydrophobicContact CG1-CH2 3.99Å; V661-W692 HydrophobicContact CG1-CZ2 4.17Å; V661-W692 HydrophobicContact CG1-CZ3 3.65Å
662	S	97.4	Very high	95.2	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	149.6	175.3	55.5	0	0	0	0	113.4	I623 H644 H650 L670 W672	I623-S662 VanDerWaalsContact CD1-OG 3.3Å; I623-S662 WeakPolarHBondContact CD1-OG 3.17Å; H644-S662 PolarHBondContact NE2-OG 3.32Å; H650-S662 VanDerWaalsContact O-CA 3.31Å; H650-S662 WeakPolarHBondContact O-CA 3.39Å; H650-S662 WeakPolarHBondContact O-CB 3.39Å; S662-L670 PolarHBondContact N-O 3.39Å; S662-L670 PolarHBondContact O-N 3.33Å; S662-L670 VanDerWaalsContact O-N 3.13Å; S662-W672 PolarHBondContact OG-NE1 3.36Å
663	N	96.2	Very high	95.1	Very high	0 Å²	0	26 Å²	26	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	148.3	173.9	-63.7	170.5	0	0	0	109.9	T649 H650 E668 C697 V698 L699	T649-N663 PolarHBondContact N-O 2.81Å; T649-N663 PolarHBondContact OG1-O 3.14Å; H650-N663 HydrophobicContact CB-CB 4.28Å; H650-N663 PolarHBondContact O-N 2.75Å; N663-E668 WeakPolarHBondContact CA-O 3.39Å; N663-C697 WeakPolarHBondContact OD1-CA 3.43Å; N663-C697 VanDerWaalsContact OD1-CB 3.25Å; N663-C697 WeakPolarHBondContact OD1-CB 3.41Å; N663-V698 PolarHBondContact OD1-N 2.88Å; N663-V698 VanDerWaalsContact OD1-N 3.16Å; N663-L699 PolarHBondContact ND2-O 2.9Å; N663-L699 WeakPolarHBondContact OD1-CB 3.31Å; N663-L699 PolarHBondContact OD1-N 2.95Å
664	S	95.3	Very high	95	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.007	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	166.3	176.4	64	0	0	0	0	112.6	H644 F647 D666 Y667 E668	H644-S664 VanDerWaalsContact ND1-CB 3.28Å; H644-S664 WeakPolarHBondContact ND1-CB 3.35Å; H644-S664 PolarHBondContact ND1-OG 2.62Å; F647-S664 CarbonylContact O-C 3.58Å; F647-S664 WeakPolarHBondContact O-CA 3.42Å; F647-S664 WeakPolarHBondContact O-CB 3.18Å; S664-D666 PolarHBondContact O-N 2.78Å; S664-D666 VanDerWaalsContact O-N 3.14Å; S664-Y667 WeakPolarHBondContact O-CA 3.31Å; S664-Y667 PolarHBondContact O-N 3.36Å; S664-E668 PolarHBondContact N-O 3.13Å; S664-E668 PolarHBondContact OG-N 3.45Å
665	G	92.8	Very high	94.5	Very high	16 Å²	16	28.8 Å²	28.8	17%	0.165	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-14.3	174.9	0	0	0	0	0	114.7	F647 Y667	F647-G665 PolarHBondContact O-N 3.16Å; G665-Y667 VanDerWaalsContact C-N 3.3Å
666	D	90.4	Very high	94.1	Very high	46 Å²	46	25.7 Å²	25.7	25%	0.246	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	2.7	172.1	-96.1	-35.7	0	0	0	113.6	R154 S645 S646 S664 E668	R154-D666 IonicContact CZ-OD1 3.15Å; R154-D666 PolarHBondContact NH1-O 3.08Å; R154-D666 IonicContact NH1-OD1 3.99Å; R154-D666 PolarHBondContact NH1-OD1 3.06Å; R154-D666 IonicContact NH2-OD1 2.75Å; S645-D666 WeakPolarHBondContact CB-OD2 3.25Å; S645-D666 WeakPolarHBondContact OG-CB 3.44Å; S645-D666 PolarHBondContact OG-OD2 3.01Å; S646-D666 WeakPolarHBondContact CB-OD2 3.49Å; S664-D666 PolarHBondContact O-N 2.78Å; S664-D666 VanDerWaalsContact O-N 3.14Å; D666-E668 HydrophobicContact CB-CG 4.26Å
667	Y	91.3	Very high	93.9	Very high	28 Å²	28	23.7 Å²	23.7	11%	0.11	15%	0.149	C	C	.	.			trans	67	32.5	-178.5	-40.3	-66.1	0	0	0	114.1	I151 R152 S664 G665 L699 D712 G713	I151-Y667 HydrophobicContact CG2-CD1 4.26Å; I151-Y667 HydrophobicContact CG2-CD2 3.96Å; I151-Y667 HydrophobicContact CG2-CE1 4.2Å; I151-Y667 HydrophobicContact CG2-CE2 3.89Å; I151-Y667 HydrophobicContact CG2-CG 4.15Å; R152-Y667 PolarHBondContact NH1-OH 3.32Å; S664-Y667 WeakPolarHBondContact O-CA 3.31Å; S664-Y667 PolarHBondContact O-N 3.36Å; G665-Y667 VanDerWaalsContact C-N 3.3Å; Y667-L699 HydrophobicContact CD1-CD1 4.42Å; Y667-D712 PolarHBondContact OH-O 2.91Å; Y667-D712 VanDerWaalsContact OH-O 3.05Å; Y667-G713 WeakPolarHBondContact CE1-O 3.26Å
668	E	91.8	Very high	93.8	Very high	72 Å²	72	24 Å²	24	34%	0.336	15%	0.151	S	C	.	.			trans	-88.3	145	175	-56	-171.4	124.1	0	0	111.4	H644 S645 N663 S664 D666	H644-E668 IonicContact ND1-OE2 2.68Å; S645-E668 PolarHBondContact N-OE2 3.44Å; S645-E668 PolarHBondContact OG-OE2 2.78Å; N663-E668 WeakPolarHBondContact CA-O 3.39Å; S664-E668 PolarHBondContact N-O 3.13Å; S664-E668 PolarHBondContact OG-N 3.45Å; D666-E668 HydrophobicContact CB-CG 4.26Å
669	I	94.8	Very high	93.8	Very high	11 Å²	11	28.9 Å²	28.9	6%	0.056	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	110.1	170.4	-52.3	172.5	0	0	0	107.5	I156 M158 V661 Y671 R684 L699	I156-I669 HydrophobicContact CG2-CD1 3.88Å; I156-I669 HydrophobicContact CG2-CG1 4.33Å; M158-I669 HydrophobicContact CG-CD1 3.89Å; M158-I669 HydrophobicContact SD-CD1 4.19Å; V661-I669 HydrophobicContact CG2-CG2 3.71Å; I669-Y671 HydrophobicContact CG2-CE1 4.44Å; I669-Y671 HydrophobicContact CG2-CE2 4.06Å; I669-R684 VanDerWaalsContact O-CD 3.31Å; I669-R684 WeakPolarHBondContact O-CD 3.16Å; I669-L699 HydrophobicContact CD1-CB 3.9Å; I669-L699 HydrophobicContact CG1-CB 3.84Å
670	L	96.1	Very high	93.7	Very high	23 Å²	23	29.1 Å²	29.1	12%	0.12	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	151.1	176.8	-60.9	-172	0	0	0	110.9	H644 V661 S662 W672 L680	H644-L670 HydrophobicContact CB-CD1 4.37Å; V661-L670 WeakPolarHBondContact CA-O 3.27Å; S662-L670 PolarHBondContact N-O 3.39Å; S662-L670 PolarHBondContact O-N 3.33Å; S662-L670 VanDerWaalsContact O-N 3.13Å; L670-W672 HydrophobicContact CB-CZ2 3.92Å; L670-W672 HydrophobicContact CD1-CH2 4.17Å; L670-W672 HydrophobicContact CD1-CZ2 3.72Å; L670-W672 HydrophobicContact CG-CZ2 4.49Å; L670-L680 HydrophobicContact CB-CD1 3.95Å; L670-L680 HydrophobicContact CD1-CD1 4.08Å; L670-L680 HydrophobicContact CD2-CD1 4.17Å; L670-L680 HydrophobicContact CG-CD1 4.29Å
671	Y	96.8	Very high	93.5	Very high	30 Å²	30	30.4 Å²	30.4	12%	0.118	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	138.8	179.1	-57.8	-84	0	0	0	110.1	I660 V661 I669 L681 R684 W692	I660-Y671 CarbonylContact O-C 3.56Å; I660-Y671 VanDerWaalsContact O-CA 3.3Å; I660-Y671 WeakPolarHBondContact O-CA 3.18Å; V661-Y671 HydrophobicContact CB-CD1 3.8Å; V661-Y671 HydrophobicContact CB-CE1 3.81Å; V661-Y671 HydrophobicContact CG2-CD1 3.83Å; V661-Y671 HydrophobicContact CG2-CE1 3.49Å; V661-Y671 VanDerWaalsContact CG2-CE1 3.49Å; I669-Y671 HydrophobicContact CG2-CE1 4.44Å; I669-Y671 HydrophobicContact CG2-CE2 4.06Å; Y671-L681 WeakPolarHBondContact O-CB 3.46Å; Y671-L681 PolarHBondContact O-N 3.29Å; Y671-R684 HydrophobicContact CD2-CB 4.36Å; Y671-R684 HydrophobicContact CD2-CG 4.03Å; Y671-R684 HydrophobicContact CE2-CB 4.09Å; Y671-R684 HydrophobicContact CE2-CG 4Å; Y671-W692 AromaticContact CD1-CH2 3.62Å; Y671-W692 HydrophobicContact CD1-CH2 3.62Å; Y671-W692 AromaticContact CD1-CZ2 3.59Å; Y671-W692 HydrophobicContact CD1-CZ2 3.59Å; Y671-W692 AromaticContact CE1-CH2 3.96Å; Y671-W692 HydrophobicContact CE1-CH2 3.96Å; Y671-W692 AromaticContact CE1-CZ2 3.44Å; Y671-W692 HydrophobicContact CE1-CZ2 3.44Å; Y671-W692 VanDerWaalsContact CE1-CZ2 3.44Å
672	W	96.8	Very high	93.1	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.008	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.4	-172.6	-50.2	90	0	0	0	110.3	C641 N642 H644 Y659 I660 S662 L670 I674 K679 L680	C641-W672 HydrophobicContact CB-CD2 3.61Å; C641-W672 HydrophobicContact CB-CE3 3.44Å; C641-W672 VanDerWaalsContact CB-CE3 3.44Å; C641-W672 HydrophobicContact CB-CG 4.26Å; C641-W672 HydrophobicContact CB-CH2 3.99Å; C641-W672 HydrophobicContact CB-CZ2 4.16Å; C641-W672 HydrophobicContact CB-CZ3 3.63Å; N642-W672 VanDerWaalsContact C-CH2 3.47Å; N642-W672 WeakPolarHBondContact O-CH2 3.41Å; N642-W672 WeakPolarHBondContact O-CZ3 3.46Å; H644-W672 AromaticContact CD2-CZ2 3.83Å; Y659-W672 CarbonylContact C-O 3.51Å; Y659-W672 WeakPolarHBondContact CA-O 3.36Å; Y659-W672 WeakPolarHBondContact CD1-O 3.3Å; I660-W672 HydrophobicContact CB-CB 4.3Å; I660-W672 PolarHBondContact N-O 3.3Å; I660-W672 PolarHBondContact O-N 2.69Å; S662-W672 PolarHBondContact OG-NE1 3.36Å; L670-W672 HydrophobicContact CB-CZ2 3.92Å; L670-W672 HydrophobicContact CD1-CH2 4.17Å; L670-W672 HydrophobicContact CD1-CZ2 3.72Å; L670-W672 HydrophobicContact CG-CZ2 4.49Å; W672-I674 HydrophobicContact CB-CD1 3.82Å; W672-K679 CarbonylContact C-O 3.56Å; W672-K679 WeakPolarHBondContact CA-O 3.46Å; W672-L680 HydrophobicContact CD2-CD1 4.34Å; W672-L680 HydrophobicContact CE3-CB 3.96Å; W672-L680 HydrophobicContact CE3-CD1 4.1Å; W672-L680 HydrophobicContact CH2-CB 4.34Å; W672-L680 HydrophobicContact CH2-CD1 3.89Å; W672-L680 HydrophobicContact CZ2-CD1 4.11Å; W672-L680 HydrophobicContact CZ3-CB 3.63Å; W672-L680 HydrophobicContact CZ3-CD1 3.89Å; W672-L680 HydrophobicContact CZ3-CG 4.27Å
673	D	95.4	Very high	92.6	Very high	35 Å²	35	44.5 Å²	44.5	19%	0.187	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	103.6	167.9	179.2	2.7	0	0	0	108.8	Y659 A675 G676 C678 K679 L681	Y659-D673 HydrophobicContact CD1-CB 4.11Å; Y659-D673 HydrophobicContact CE1-CB 3.84Å; D673-A675 PolarHBondContact OD1-N 2.87Å; D673-G676 PolarHBondContact OD1-N 3.25Å; D673-C678 CarbonylContact O-C 3.58Å; D673-C678 VanDerWaalsContact O-CA 3.22Å; D673-C678 WeakPolarHBondContact O-CA 3.36Å; D673-C678 PolarHBondContact O-N 3.24Å; D673-K679 PolarHBondContact N-O 3.2Å; D673-K679 PolarHBondContact O-N 3.14Å; D673-L681 HydrophobicContact CB-CD2 4.11Å; D673-L681 HydrophobicContact CB-CG 4.4Å
674	I	94.6	Very high	92.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.252	C	S	.	.	S	Bend	trans	-79.8	-44.7	-176.8	-55	-50.1	0	0	0	110.1	I625 F638 W653 C658 I660 W672 G676 G677 C678	I625-I674 HydrophobicContact CD1-CD1 4.17Å; I625-I674 HydrophobicContact CG1-CD1 4.17Å; I625-I674 HydrophobicContact CG2-CG2 3.93Å; F638-I674 HydrophobicContact CD1-CG2 4.43Å; F638-I674 HydrophobicContact CE1-CG2 4.16Å; F638-I674 VanDerWaalsContact CE1-O 3.28Å; F638-I674 WeakPolarHBondContact CE1-O 3.31Å; W653-I674 HydrophobicContact CH2-CB 4.42Å; W653-I674 HydrophobicContact CH2-CG1 4.07Å; W653-I674 HydrophobicContact CH2-CG2 4.08Å; W653-I674 HydrophobicContact CZ3-CB 4.11Å; W653-I674 HydrophobicContact CZ3-CG1 3.78Å; W653-I674 HydrophobicContact CZ3-CG2 4.21Å; C658-I674 PolarHBondContact O-N 3.41Å; I660-I674 HydrophobicContact CB-CG1 4.48Å; I660-I674 HydrophobicContact CD1-CD1 3.79Å; I660-I674 HydrophobicContact CD1-CG1 3.78Å; I660-I674 HydrophobicContact CG1-CD1 4.15Å; I660-I674 HydrophobicContact CG1-CG1 3.78Å; W672-I674 HydrophobicContact CB-CD1 3.82Å; I674-G676 PolarHBondContact O-N 3.01Å; I674-G677 PolarHBondContact O-N 3.48Å; I674-C678 PolarHBondContact O-N 2.92Å
675	A	87.3	Confident	91.7	Very high	66 Å²	66	51 Å²	51	55%	0.545	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-34.9	176.9	0	0	0	0	0	112.1	C658 D673 G677	C658-A675 HydrophobicContact CB-CB 4.33Å; D673-A675 PolarHBondContact OD1-N 2.87Å; A675-G677 PolarHBondContact O-N 3.14Å
676	G	85.8	Confident	91.5	Very high	26 Å²	26	55.5 Å²	55.5	27%	0.268	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	8	175.8	0	0	0	0	0	115.9	D673 I674 K679	D673-G676 PolarHBondContact OD1-N 3.25Å; I674-G676 PolarHBondContact O-N 3.01Å; G676-K679 VanDerWaalsContact O-CD 3.32Å; G676-K679 WeakPolarHBondContact O-CD 3.42Å; G676-K679 WeakPolarHBondContact O-CE 3.32Å; G676-K679 PolarHBondContact O-NZ 3.16Å
677	G	89.8	Confident	91.4	Very high	46 Å²	46	53.4 Å²	53.4	47%	0.474	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.4	43.7	177.9	0	0	0	0	0	114.4	I674 A675 K679	I674-G677 PolarHBondContact O-N 3.48Å; A675-G677 PolarHBondContact O-N 3.14Å; G677-K679 PolarHBondContact O-N 3.25Å
678	C	92.5	Very high	91.2	Very high	9 Å²	9	53.5 Å²	53.5	6%	0.061	27%	0.27	C	S	.	.	S	Bend	trans	57.5	41.5	178.5	-55.2	0	0	0	0	114.3	D673 I674	D673-C678 CarbonylContact O-C 3.58Å; D673-C678 VanDerWaalsContact O-CA 3.22Å; D673-C678 WeakPolarHBondContact O-CA 3.36Å; D673-C678 PolarHBondContact O-N 3.24Å; I674-C678 PolarHBondContact O-N 2.92Å
679	K	93.3	Very high	91.2	Very high	134 Å²	134	53.9 Å²	53.9	58%	0.583	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	138.9	-175.5	-70	177.3	-177.2	157.9	0	112.1	W672 D673 G676 G677 L681	W672-K679 CarbonylContact C-O 3.56Å; W672-K679 WeakPolarHBondContact CA-O 3.46Å; D673-K679 PolarHBondContact N-O 3.2Å; D673-K679 PolarHBondContact O-N 3.14Å; G676-K679 VanDerWaalsContact O-CD 3.32Å; G676-K679 WeakPolarHBondContact O-CD 3.42Å; G676-K679 WeakPolarHBondContact O-CE 3.32Å; G676-K679 PolarHBondContact O-NZ 3.16Å; G677-K679 PolarHBondContact O-N 3.25Å; K679-L681 PolarHBondContact O-N 3.44Å
680	L	94.9	Very high	91.1	Very high	59 Å²	59	55.6 Å²	55.6	31%	0.309	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	124	172.8	179.3	61.6	0	0	0	111.1	L670 W672 R682	L670-L680 HydrophobicContact CB-CD1 3.95Å; L670-L680 HydrophobicContact CD1-CD1 4.08Å; L670-L680 HydrophobicContact CD2-CD1 4.17Å; L670-L680 HydrophobicContact CG-CD1 4.29Å; W672-L680 HydrophobicContact CD2-CD1 4.34Å; W672-L680 HydrophobicContact CE3-CB 3.96Å; W672-L680 HydrophobicContact CE3-CD1 4.1Å; W672-L680 HydrophobicContact CH2-CB 4.34Å; W672-L680 HydrophobicContact CH2-CD1 3.89Å; W672-L680 HydrophobicContact CZ2-CD1 4.11Å; W672-L680 HydrophobicContact CZ3-CB 3.63Å; W672-L680 HydrophobicContact CZ3-CD1 3.89Å; W672-L680 HydrophobicContact CZ3-CG 4.27Å; L680-R682 PolarHBondContact O-N 3.13Å
681	L	92.9	Very high	91	Very high	27 Å²	27	60.5 Å²	60.5	14%	0.141	30%	0.303	C	S	.	.			trans	-79.9	99.8	170.3	-62.2	177.7	0	0	0	109.5	Y659 Y671 D673 K679 N683	Y659-L681 HydrophobicContact CD1-CD1 3.84Å; Y659-L681 HydrophobicContact CE1-CD1 4.01Å; Y671-L681 WeakPolarHBondContact O-CB 3.46Å; Y671-L681 PolarHBondContact O-N 3.29Å; D673-L681 HydrophobicContact CB-CD2 4.11Å; D673-L681 HydrophobicContact CB-CG 4.4Å; K679-L681 PolarHBondContact O-N 3.44Å; L681-N683 VanDerWaalsContact C-N 3.32Å; L681-N683 PolarHBondContact O-N 3.2Å
682	R	88.7	Confident	90.9	Very high	232 Å²	232	59.8 Å²	59.8	88%	0.875	30%	0.3	S	S	*	.	S	Bend	trans	-66.9	-33.3	-179.1	-67.2	-175.1	176.9	170.1	-0.7	112.7	L680 R684	L680-R682 PolarHBondContact O-N 3.13Å; R682-R684 PolarHBondContact O-N 2.95Å
683	N	87.4	Confident	90.8	Very high	71 Å²	71	61.3 Å²	61.3	38%	0.38	31%	0.313	S	S	.	.			trans	-89.2	91.9	178.5	-171.6	7.9	0	0	0	111	L681 F685 E686	L681-N683 VanDerWaalsContact C-N 3.32Å; L681-N683 PolarHBondContact O-N 3.2Å; N683-F685 PolarHBondContact O-N 3.45Å; N683-F685 VanDerWaalsContact O-N 3.16Å; N683-F685 WeakPolarHBondContact OD1-CB 3.5Å; N683-F685 PolarHBondContact OD1-N 2.93Å; N683-E686 HydrophobicContact CB-CG 4.31Å; N683-E686 PolarHBondContact ND2-OE1 2.93Å; N683-E686 PolarHBondContact O-N 3.25Å
684	R	87.2	Confident	90.7	Very high	82 Å²	82	61.3 Å²	61.3	31%	0.309	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-61	-22.5	178.9	-67.3	-159.7	-55.4	-85	0.1	113.7	Y159 I669 Y671 R682 E686 S687	Y159-R684 HydrophobicContact CD2-CB 4.18Å; Y159-R684 HydrophobicContact CE2-CB 3.64Å; I669-R684 VanDerWaalsContact O-CD 3.31Å; I669-R684 WeakPolarHBondContact O-CD 3.16Å; Y671-R684 HydrophobicContact CD2-CB 4.36Å; Y671-R684 HydrophobicContact CD2-CG 4.03Å; Y671-R684 HydrophobicContact CE2-CB 4.09Å; Y671-R684 HydrophobicContact CE2-CG 4Å; R682-R684 PolarHBondContact O-N 2.95Å; R684-E686 VanDerWaalsContact C-N 3.28Å; R684-E686 PolarHBondContact O-N 2.79Å; R684-S687 PolarHBondContact O-N 3.36Å; R684-S687 VanDerWaalsContact O-N 3.15Å
685	F	86.1	Confident	90.8	Very high	57 Å²	57	62 Å²	62	25%	0.25	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-63.9	-34.4	178.9	-178.2	-93.6	0	0	0	111.9	E144 Y159 N683 S687 K688	E144-F685 HydrophobicContact CB-CD2 4.35Å; E144-F685 HydrophobicContact CB-CE2 4.05Å; E144-F685 HydrophobicContact CG-CD2 4.16Å; E144-F685 HydrophobicContact CG-CE2 3.82Å; E144-F685 HydrophobicContact CG-CZ 4.34Å; Y159-F685 AromaticContact CD1-CD2 3.67Å; Y159-F685 HydrophobicContact CD1-CD2 3.67Å; Y159-F685 HydrophobicContact CD1-CE2 4.48Å; Y159-F685 HydrophobicContact CE1-CB 4.37Å; Y159-F685 HydrophobicContact CE1-CD2 4.02Å; Y159-F685 HydrophobicContact CG-CD2 4.19Å; N683-F685 PolarHBondContact O-N 3.45Å; N683-F685 VanDerWaalsContact O-N 3.16Å; N683-F685 WeakPolarHBondContact OD1-CB 3.5Å; N683-F685 PolarHBondContact OD1-N 2.93Å; F685-S687 PolarHBondContact O-N 3.14Å; F685-K688 HydrophobicContact CD1-CD 4.35Å; F685-K688 HydrophobicContact CD2-CD 3.81Å; F685-K688 HydrophobicContact CE1-CD 4.17Å; F685-K688 HydrophobicContact CE2-CD 3.59Å; F685-K688 HydrophobicContact CG-CD 4.19Å; F685-K688 HydrophobicContact CZ-CD 3.8Å; F685-K688 WeakPolarHBondContact O-CB 3.16Å; F685-K688 WeakPolarHBondContact O-CD 3.44Å; F685-K688 WeakPolarHBondContact O-CG 3.44Å; F685-K688 PolarHBondContact O-N 2.86Å
686	E	87.3	Confident	91.2	Very high	109 Å²	109	59.9 Å²	59.9	51%	0.509	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-60.8	-30	176.9	-71.7	165.5	-156.7	0	0	111.2	N683 R684 K688 R690	N683-E686 HydrophobicContact CB-CG 4.31Å; N683-E686 PolarHBondContact ND2-OE1 2.93Å; N683-E686 PolarHBondContact O-N 3.25Å; R684-E686 VanDerWaalsContact C-N 3.28Å; R684-E686 PolarHBondContact O-N 2.79Å; E686-K688 VanDerWaalsContact C-N 3.35Å; E686-K688 PolarHBondContact O-N 3.19Å; E686-R690 PolarHBondContact O-NH1 3.19Å
687	S	89.1	Confident	91.7	Very high	2 Å²	2	58.8 Å²	58.8	1%	0.014	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-83.7	-1.2	-177.1	-59.9	0	0	0	0	115.5	R684 F685 D689 R690	R684-S687 PolarHBondContact O-N 3.36Å; R684-S687 VanDerWaalsContact O-N 3.15Å; F685-S687 PolarHBondContact O-N 3.14Å; S687-D689 VanDerWaalsContact C-N 3.3Å; S687-D689 PolarHBondContact O-N 3.47Å; S687-R690 VanDerWaalsContact N-NH1 3.2Å; S687-R690 PolarHBondContact O-N 2.95Å; S687-R690 PolarHBondContact OG-NH1 2.94Å
688	K	87.7	Confident	91.9	Very high	30 Å²	30	57 Å²	57	13%	0.13	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-67.7	-27	-173.8	77.1	-171.2	-174.3	61.9	0	114.4	P161 S162 F685 E686	P161-K688 WeakPolarHBondContact CG-O 3.45Å; S162-K688 PolarHBondContact OG-NZ 2.82Å; F685-K688 HydrophobicContact CD1-CD 4.35Å; F685-K688 HydrophobicContact CD2-CD 3.81Å; F685-K688 HydrophobicContact CE1-CD 4.17Å; F685-K688 HydrophobicContact CE2-CD 3.59Å; F685-K688 HydrophobicContact CG-CD 4.19Å; F685-K688 HydrophobicContact CZ-CD 3.8Å; F685-K688 WeakPolarHBondContact O-CB 3.16Å; F685-K688 WeakPolarHBondContact O-CD 3.44Å; F685-K688 WeakPolarHBondContact O-CG 3.44Å; F685-K688 PolarHBondContact O-N 2.86Å; E686-K688 VanDerWaalsContact C-N 3.35Å; E686-K688 PolarHBondContact O-N 3.19Å
689	D	90.8	Very high	92	Very high	81 Å²	81	56.8 Å²	56.8	43%	0.433	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-105.4	8.6	-176.5	-63	-31.9	0	0	0	112.6	P161 S162 S687	P161-D689 WeakPolarHBondContact CA-OD1 3.48Å; S162-D689 WeakPolarHBondContact CB-OD1 3.37Å; S162-D689 PolarHBondContact N-OD1 2.79Å; S162-D689 PolarHBondContact OG-OD1 3.46Å; S162-D689 PolarHBondContact OG-OD2 2.98Å; S687-D689 VanDerWaalsContact C-N 3.3Å; S687-D689 PolarHBondContact O-N 3.47Å
690	R	92.9	Very high	92	Very high	47 Å²	47	50.9 Å²	50.9	18%	0.177	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-75	136.1	-179.6	-74	179.1	165.1	78.2	-11.2	110.6	Y659 E686 S687 W692	Y659-R690 VanDerWaalsContact CE1-NH2 3.35Å; E686-R690 PolarHBondContact O-NH1 3.19Å; S687-R690 VanDerWaalsContact N-NH1 3.2Å; S687-R690 PolarHBondContact O-N 2.95Å; S687-R690 PolarHBondContact OG-NH1 2.94Å; R690-W692 HydrophobicContact CB-CZ2 3.98Å; R690-W692 PolarHBondContact O-NE1 2.91Å
691	E	93.1	Very high	91.8	Very high	126 Å²	126	48.8 Å²	48.8	59%	0.589	23%	0.231	S	C	*	.	P	Polyproline II helix	trans	-89.6	125.6	173.3	-63.8	-166.6	-171.4	0	0	111.2	S654 K655	S654-E691 WeakPolarHBondContact CA-O 3.31Å; K655-E691 HydrophobicContact CD-CB 3.93Å; K655-E691 WeakPolarHBondContact CD-OE2 3.14Å; K655-E691 HydrophobicContact CG-CB 4.24Å; K655-E691 PolarHBondContact N-O 3.44Å; K655-E691 IonicContact NZ-OE2 3.82Å; K655-E691 PolarHBondContact NZ-OE2 3.47Å
692	W	95.3	Very high	91.8	Very high	14 Å²	14	49 Å²	49	5%	0.053	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-95.2	139.2	179.2	-52.5	90.8	0	0	0	110.5	V661 Y671 R690 S694 F695	V661-W692 HydrophobicContact CB-CD2 4.38Å; V661-W692 HydrophobicContact CB-CE3 4.08Å; V661-W692 HydrophobicContact CB-CH2 3.56Å; V661-W692 HydrophobicContact CB-CZ2 3.86Å; V661-W692 HydrophobicContact CB-CZ3 3.67Å; V661-W692 HydrophobicContact CG1-CD2 3.77Å; V661-W692 HydrophobicContact CG1-CE3 3.53Å; V661-W692 HydrophobicContact CG1-CH2 3.99Å; V661-W692 HydrophobicContact CG1-CZ2 4.17Å; V661-W692 HydrophobicContact CG1-CZ3 3.65Å; Y671-W692 AromaticContact CD1-CH2 3.62Å; Y671-W692 HydrophobicContact CD1-CH2 3.62Å; Y671-W692 AromaticContact CD1-CZ2 3.59Å; Y671-W692 HydrophobicContact CD1-CZ2 3.59Å; Y671-W692 AromaticContact CE1-CH2 3.96Å; Y671-W692 HydrophobicContact CE1-CH2 3.96Å; Y671-W692 AromaticContact CE1-CZ2 3.44Å; Y671-W692 HydrophobicContact CE1-CZ2 3.44Å; Y671-W692 VanDerWaalsContact CE1-CZ2 3.44Å; R690-W692 HydrophobicContact CB-CZ2 3.98Å; R690-W692 PolarHBondContact O-NE1 2.91Å; W692-S694 WeakPolarHBondContact CB-O 3.13Å; W692-F695 HydrophobicContact CB-CD2 4.02Å; W692-F695 HydrophobicContact CB-CE2 3.57Å; W692-F695 HydrophobicContact CB-CZ 3.91Å; W692-F695 AromaticContact CD1-CE1 3.95Å; W692-F695 AromaticContact CD1-CE2 3.88Å; W692-F695 AromaticContact CD1-CZ 3.33Å; W692-F695 HydrophobicContact CG-CE1 4.4Å; W692-F695 HydrophobicContact CG-CE2 4.07Å; W692-F695 AromaticContact CG-CZ 3.88Å; W692-F695 HydrophobicContact CG-CZ 3.88Å
693	A	94.7	Very high	92	Very high	34 Å²	34	37.9 Å²	37.9	28%	0.281	19%	0.19	S	C	.	.	S	Bend	trans	-70.1	-44.7	179.7	0	0	0	0	0	111	P609 W653 K655 R721	P609-A693 HydrophobicContact CB-CB 4.37Å; P609-A693 HydrophobicContact CG-CB 3.41Å; P609-A693 VanDerWaalsContact CG-CB 3.41Å; W653-A693 WeakPolarHBondContact O-CB 3.28Å; W653-A693 PolarHBondContact O-N 2.83Å; K655-A693 HydrophobicContact CG-CB 4.28Å; A693-R721 PolarHBondContact O-NH2 3.32Å; A693-R721 VanDerWaalsContact O-NH2 3.15Å
694	S	93.9	Very high	92.1	Very high	36 Å²	36	34.8 Å²	34.8	25%	0.252	17%	0.173	S	C	.	.			trans	-120.7	162.7	172.7	57.3	0	0	0	0	110	D652 W692	D652-S694 WeakPolarHBondContact CB-O 3.31Å; D652-S694 WeakPolarHBondContact OD1-CB 3.43Å; D652-S694 PolarHBondContact OD1-OG 3.04Å; W692-S694 WeakPolarHBondContact CB-O 3.13Å
695	F	95.3	Very high	92.2	Very high	15 Å²	15	31 Å²	31	7%	0.066	16%	0.159	C	C	.	.			trans	-130	103.1	164.7	-87.2	-93.3	0	0	0	107	W692 H702 L719 C720 R721 Y742	W692-F695 HydrophobicContact CB-CD2 4.02Å; W692-F695 HydrophobicContact CB-CE2 3.57Å; W692-F695 HydrophobicContact CB-CZ 3.91Å; W692-F695 AromaticContact CD1-CE1 3.95Å; W692-F695 AromaticContact CD1-CE2 3.88Å; W692-F695 AromaticContact CD1-CZ 3.33Å; W692-F695 HydrophobicContact CG-CE1 4.4Å; W692-F695 HydrophobicContact CG-CE2 4.07Å; W692-F695 AromaticContact CG-CZ 3.88Å; W692-F695 HydrophobicContact CG-CZ 3.88Å; F695-H702 HydrophobicContact CE1-CB 4.06Å; F695-H702 AromaticContact CE1-CD2 3.84Å; F695-H702 HydrophobicContact CZ-CB 4.26Å; F695-H702 AromaticContact CZ-CD2 3.56Å; F695-L719 HydrophobicContact CB-CD2 4.37Å; F695-L719 WeakPolarHBondContact O-CD2 3.3Å; F695-C720 WeakPolarHBondContact O-CA 3.38Å; F695-R721 HydrophobicContact CB-CB 3.71Å; F695-R721 PolarHBondContact O-N 2.93Å; F695-Y742 HydrophobicContact CD2-CE2 4.21Å; F695-Y742 WeakPolarHBondContact CD2-OH 3.36Å; F695-Y742 HydrophobicContact CE2-CE2 4.44Å; F695-Y742 AromaticContact CE2-CZ 3.93Å; F695-Y742 WeakPolarHBondContact CE2-OH 3.44Å; F695-Y742 HydrophobicContact CG-CE2 4.22Å; F695-Y742 WeakPolarHBondContact CZ-OH 3.26Å
696	T	96.8	Very high	92.5	Very high	20 Å²	20	28.6 Å²	28.6	12%	0.123	15%	0.149	C	C	.	.			trans	-119.7	-17.9	171.9	64.8	0	0	0	0	112.1	H650 L651 D652 V698 L719	H650-T696 PolarHBondContact ND1-O 2.95Å; L651-T696 PolarHBondContact O-OG1 2.96Å; D652-T696 PolarHBondContact OD1-N 3.28Å; D652-T696 PolarHBondContact OD1-OG1 2.85Å; D652-T696 PolarHBondContact OD2-N 2.9Å; D652-T696 PolarHBondContact OD2-OG1 2.88Å; T696-V698 PolarHBondContact O-N 2.93Å; T696-L719 WeakPolarHBondContact CA-O 3.39Å
697	C	96.5	Very high	92.7	Very high	4 Å²	4	24 Å²	24	3%	0.027	13%	0.127	C	C	.	.			trans	-62.1	119.7	170.4	-71.3	0	0	0	0	110.9	H650 D652 N663 L699	H650-C697 HydrophobicContact CB-CB 4.34Å; D652-C697 WeakPolarHBondContact OD2-CB 3.41Å; D652-C697 PolarHBondContact OD2-N 2.99Å; D652-C697 PolarHBondContact OD2-SG 2.94Å; N663-C697 WeakPolarHBondContact OD1-CA 3.43Å; N663-C697 VanDerWaalsContact OD1-CB 3.25Å; N663-C697 WeakPolarHBondContact OD1-CB 3.41Å; C697-L699 VanDerWaalsContact C-N 3.27Å; C697-L699 PolarHBondContact O-N 3.18Å
698	V	94.5	Very high	92.4	Very high	8 Å²	8	28.8 Å²	28.8	5%	0.048	15%	0.152	C	C	.	.	S	Bend	trans	-73.7	-19.4	177.8	-59.7	0	0	0	0	112.4	N663 T696 W707 I716 L719	N663-V698 PolarHBondContact OD1-N 2.88Å; N663-V698 VanDerWaalsContact OD1-N 3.16Å; T696-V698 PolarHBondContact O-N 2.93Å; V698-W707 HydrophobicContact CB-CZ2 3.87Å; V698-W707 HydrophobicContact CG2-CZ2 3.77Å; V698-W707 PolarHBondContact O-NE1 2.82Å; V698-I716 HydrophobicContact CB-CG2 4.33Å; V698-I716 HydrophobicContact CG1-CG2 3.75Å; V698-L719 HydrophobicContact CG1-CB 3.86Å
699	L	93.3	Very high	91.9	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.021	18%	0.181	C	C	.	.	S	Bend	trans	-108.9	110.1	175.7	-52.4	175.9	0	0	0	110.4	M149 I151 I156 N663 Y667 I669 C697 W707	M149-L699 HydrophobicContact CE-CD2 3.72Å; I151-L699 HydrophobicContact CD1-CD2 3.63Å; I156-L699 HydrophobicContact CD1-CD1 4.28Å; I156-L699 HydrophobicContact CD1-CD2 4.17Å; N663-L699 PolarHBondContact ND2-O 2.9Å; N663-L699 WeakPolarHBondContact OD1-CB 3.31Å; N663-L699 PolarHBondContact OD1-N 2.95Å; Y667-L699 HydrophobicContact CD1-CD1 4.42Å; I669-L699 HydrophobicContact CD1-CB 3.9Å; I669-L699 HydrophobicContact CG1-CB 3.84Å; C697-L699 VanDerWaalsContact C-N 3.27Å; C697-L699 PolarHBondContact O-N 3.18Å; L699-W707 HydrophobicContact CD2-CZ2 3.77Å
700	G	92.8	Very high	91.3	Very high	11 Å²	11	34.8 Å²	34.8	11%	0.113	20%	0.2	C	C	.	.	S	Bend	trans	-175.9	157	175.7	0	0	0	0	0	112.2	H702 V703 I704	G700-H702 VanDerWaalsContact C-N 3.27Å; G700-H702 PolarHBondContact O-N 3.31Å; G700-V703 WeakPolarHBondContact O-CG2 3.47Å; G700-V703 PolarHBondContact O-N 2.85Å; G700-V703 VanDerWaalsContact O-N 3.11Å; G700-I704 WeakPolarHBondContact O-CG1 3.38Å; G700-I704 PolarHBondContact O-N 3.23Å
701	F	92	Very high	90.8	Very high	14 Å²	14	33.1 Å²	33.1	6%	0.061	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-55	-42.8	-176.4	170.1	-89.4	0	0	0	112.4	I147 M158 V160 P161 I164 Y167 V703 I704 P745	I147-F701 HydrophobicContact CD1-CD2 4.1Å; I147-F701 HydrophobicContact CD1-CE2 3.58Å; M158-F701 HydrophobicContact CB-CB 4.29Å; V160-F701 HydrophobicContact CB-CE2 4.22Å; V160-F701 HydrophobicContact CG1-CE2 4.2Å; V160-F701 HydrophobicContact CG1-CZ 4.09Å; V160-F701 HydrophobicContact CG2-CE2 3.91Å; P161-F701 HydrophobicContact CG-CD1 3.68Å; P161-F701 HydrophobicContact CG-CE1 3.82Å; P161-F701 HydrophobicContact CG-CG 4.39Å; I164-F701 HydrophobicContact CD1-CE1 3.4Å; I164-F701 HydrophobicContact CD1-CZ 3.69Å; Y167-F701 HydrophobicContact CD2-CE2 4.27Å; Y167-F701 HydrophobicContact CD2-CZ 4.13Å; Y167-F701 HydrophobicContact CE2-CE2 4.08Å; Y167-F701 HydrophobicContact CE2-CZ 4.16Å; F701-V703 PolarHBondContact O-N 2.86Å; F701-I704 HydrophobicContact CD2-CD1 4.3Å; F701-I704 WeakPolarHBondContact O-CG1 3.47Å; F701-P745 HydrophobicContact CD1-CB 4.11Å; F701-P745 HydrophobicContact CE1-CB 3.56Å; F701-P745 HydrophobicContact CE1-CG 4.22Å; F701-P745 HydrophobicContact CE2-CB 4.1Å; F701-P745 HydrophobicContact CZ-CB 3.58Å; F701-P745 HydrophobicContact CZ-CG 4.21Å; F701-P745 VanDerWaalsContact O-CA 3.25Å; F701-P745 WeakPolarHBondContact O-CA 3.39Å; F701-P745 WeakPolarHBondContact O-CB 3.5Å
702	H	92.3	Very high	90.2	Very high	31 Å²	31	29.5 Å²	29.5	14%	0.144	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-69.3	-13.2	-175.9	-63.8	-79.1	0	0	0	114.3	F695 G700 Y742 P743 C744	F695-H702 HydrophobicContact CE1-CB 4.06Å; F695-H702 AromaticContact CE1-CD2 3.84Å; F695-H702 HydrophobicContact CZ-CB 4.26Å; F695-H702 AromaticContact CZ-CD2 3.56Å; G700-H702 VanDerWaalsContact C-N 3.27Å; G700-H702 PolarHBondContact O-N 3.31Å; H702-Y742 HydrophobicContact CB-CE2 3.78Å; H702-P743 HydrophobicContact CB-CB 4.09Å; H702-C744 CarbonylContact O-C 3.45Å; H702-C744 PolarHBondContact O-N 2.9Å
703	V	93	Very high	89.7	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-127.5	11.2	-172.2	-61.7	0	0	0	0	113.3	G700 F701 G705 V706 L719 Y742	G700-V703 WeakPolarHBondContact O-CG2 3.47Å; G700-V703 PolarHBondContact O-N 2.85Å; G700-V703 VanDerWaalsContact O-N 3.11Å; F701-V703 PolarHBondContact O-N 2.86Å; V703-G705 PolarHBondContact O-N 3.33Å; V703-V706 HydrophobicContact CB-CG1 4.45Å; V703-V706 WeakPolarHBondContact O-CG2 3.47Å; V703-V706 PolarHBondContact O-N 3.15Å; V703-L719 HydrophobicContact CB-CD1 3.85Å; V703-L719 HydrophobicContact CG1-CD1 3.9Å; V703-L719 HydrophobicContact CG1-CD2 4.26Å; V703-L719 HydrophobicContact CG2-CD1 4.17Å; V703-Y742 HydrophobicContact CG1-CD2 4.48Å; V703-Y742 HydrophobicContact CG1-CE2 4.3Å
704	I	90.7	Very high	89.4	Confident	5 Å²	5	30.8 Å²	30.8	3%	0.026	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-50.7	-38.1	-179.3	-64	175.4	0	0	0	112.3	I147 M149 M158 G700 F701 V706 W707 C744 P747	I147-I704 HydrophobicContact CG2-CD1 4.13Å; M149-I704 HydrophobicContact SD-CG2 4.04Å; M158-I704 HydrophobicContact CE-CD1 3.46Å; M158-I704 VanDerWaalsContact CE-CD1 3.46Å; M158-I704 HydrophobicContact CE-CG1 3.59Å; M158-I704 HydrophobicContact SD-CD1 3.69Å; M158-I704 HydrophobicContact SD-CG1 3.62Å; G700-I704 WeakPolarHBondContact O-CG1 3.38Å; G700-I704 PolarHBondContact O-N 3.23Å; F701-I704 HydrophobicContact CD2-CD1 4.3Å; F701-I704 WeakPolarHBondContact O-CG1 3.47Å; I704-V706 PolarHBondContact O-N 2.94Å; I704-W707 PolarHBondContact O-N 3.42Å; I704-C744 PolarHBondContact N-O 3.03Å; I704-P747 HydrophobicContact CG2-CG 4.33Å
705	G	88.9	Confident	89.1	Confident	2 Å²	2	30.5 Å²	30.5	2%	0.021	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-67.7	-14.6	-172.8	0	0	0	0	0	115.8	V703 W707 C744 K746 A749	V703-G705 PolarHBondContact O-N 3.33Å; G705-W707 VanDerWaalsContact C-N 3.25Å; G705-W707 PolarHBondContact O-N 2.68Å; G705-C744 VanDerWaalsContact CA-O 3.32Å; G705-C744 WeakPolarHBondContact CA-O 3.22Å; G705-C744 PolarHBondContact N-O 2.86Å; G705-K746 WeakPolarHBondContact CA-O 3.36Å; G705-A749 PolarHBondContact O-N 3.02Å
706	V	92.4	Very high	89	Confident	7 Å²	7	30.6 Å²	30.6	4%	0.042	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-70.8	-24.8	176.9	-52.2	0	0	0	0	112.2	V703 I704 I716 L719 V728 V730 F740	V703-V706 HydrophobicContact CB-CG1 4.45Å; V703-V706 WeakPolarHBondContact O-CG2 3.47Å; V703-V706 PolarHBondContact O-N 3.15Å; I704-V706 PolarHBondContact O-N 2.94Å; V706-I716 HydrophobicContact CB-CD1 4.32Å; V706-I716 HydrophobicContact CG2-CD1 3.7Å; V706-L719 HydrophobicContact CG1-CD1 4.24Å; V706-L719 HydrophobicContact CG2-CD1 4.22Å; V706-V728 HydrophobicContact CG1-CG1 4.4Å; V706-V730 HydrophobicContact CB-CG2 4Å; V706-V730 HydrophobicContact CG1-CG2 3.8Å; V706-F740 HydrophobicContact CB-CE2 4.1Å; V706-F740 HydrophobicContact CB-CZ 4.17Å; V706-F740 HydrophobicContact CG1-CD2 3.97Å; V706-F740 HydrophobicContact CG1-CE2 4.05Å; V706-F740 HydrophobicContact CG1-CG 4.21Å; V706-F740 HydrophobicContact CG1-CZ 4.38Å
707	W	90.4	Very high	89	Confident	14 Å²	14	31 Å²	31	5%	0.053	19%	0.186	C	C	.	.	S	Bend	trans	-80.1	131.8	-179.3	-67.8	93.9	0	0	0	111.7	M149 I151 V698 L699 I704 G705 S711 I716	M149-W707 HydrophobicContact CE-CG 4.44Å; M149-W707 HydrophobicContact SD-CB 4.12Å; M149-W707 HydrophobicContact SD-CG 4.03Å; I151-W707 HydrophobicContact CD1-CD2 4.33Å; I151-W707 HydrophobicContact CD1-CE3 4.43Å; I151-W707 HydrophobicContact CD1-CH2 4.47Å; I151-W707 HydrophobicContact CD1-CZ2 4.37Å; V698-W707 HydrophobicContact CB-CZ2 3.87Å; V698-W707 HydrophobicContact CG2-CZ2 3.77Å; V698-W707 PolarHBondContact O-NE1 2.82Å; L699-W707 HydrophobicContact CD2-CZ2 3.77Å; I704-W707 PolarHBondContact O-N 3.42Å; G705-W707 VanDerWaalsContact C-N 3.25Å; G705-W707 PolarHBondContact O-N 2.68Å; W707-S711 VanDerWaalsContact CZ3-OG 3.29Å; W707-S711 WeakPolarHBondContact CZ3-OG 3.33Å; W707-I716 HydrophobicContact CD2-CD1 3.75Å; W707-I716 HydrophobicContact CE3-CD1 3.8Å; W707-I716 HydrophobicContact CE3-CG1 4.19Å; W707-I716 HydrophobicContact CG-CD1 4.25Å; W707-I716 HydrophobicContact CH2-CB 3.89Å; W707-I716 HydrophobicContact CH2-CD1 4.27Å; W707-I716 HydrophobicContact CH2-CG1 4.22Å; W707-I716 HydrophobicContact CZ2-CB 4.25Å; W707-I716 HydrophobicContact CZ2-CD1 4.21Å; W707-I716 HydrophobicContact CZ3-CB 4.14Å; W707-I716 HydrophobicContact CZ3-CD1 4.06Å; W707-I716 HydrophobicContact CZ3-CG1 3.99Å
708	L	82.9	Confident	89	Confident	102 Å²	102	31 Å²	31	53%	0.534	19%	0.186	S	C	.	.	P	Polyproline II helix	trans	-80	153.7	173.2	-64.6	175.7	0	0	0	111.3	G710 S711	L708-G710 PolarHBondContact O-N 2.79Å; L708-S711 WeakPolarHBondContact O-CB 3.41Å; L708-S711 PolarHBondContact O-N 3.35Å; L708-S711 VanDerWaalsContact O-N 3.14Å
709	E	77.9	Confident	89.1	Confident	156 Å²	156	30.7 Å²	30.7	73%	0.729	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	128.9	175.9	-169.7	170.7	-166	0	0	110.3	S711 K748	E709-S711 VanDerWaalsContact C-N 3.31Å; E709-K748 WeakPolarHBondContact OE2-CE 3.42Å; E709-K748 IonicContact OE2-NZ 2.66Å; E709-K748 PolarHBondContact OE2-NZ 2.83Å
710	G	76.9	Confident	89.3	Confident	81 Å²	81	31.1 Å²	31.1	84%	0.835	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.5	6.6	-174.9	0	0	0	0	0	114.5	L708	L708-G710 PolarHBondContact O-N 2.79Å
711	S	83.1	Confident	89.6	Confident	12 Å²	12	31.4 Å²	31.4	8%	0.084	19%	0.185	C	C	.	.			trans	-57.3	142.7	174.5	-179.6	0	0	0	0	111.9	W707 L708 E709 D715	W707-S711 VanDerWaalsContact CZ3-OG 3.29Å; W707-S711 WeakPolarHBondContact CZ3-OG 3.33Å; L708-S711 WeakPolarHBondContact O-CB 3.41Å; L708-S711 PolarHBondContact O-N 3.35Å; L708-S711 VanDerWaalsContact O-N 3.14Å; E709-S711 VanDerWaalsContact C-N 3.31Å; S711-D715 WeakPolarHBondContact CA-OD2 3.28Å; S711-D715 WeakPolarHBondContact CB-OD2 3.44Å; S711-D715 PolarHBondContact OG-OD2 2.88Å
712	D	81.6	Confident	89.8	Confident	49 Å²	49	30.8 Å²	30.8	26%	0.262	18%	0.183	S	C	.	.			trans	-92.1	-2	-174.6	88.2	-19.1	0	0	0	113.3	R152 Y667 T714 D715	R152-D712 VanDerWaalsContact CD-O 3.25Å; R152-D712 WeakPolarHBondContact CD-O 3.41Å; R152-D712 HydrophobicContact CG-CB 4.44Å; R152-D712 WeakPolarHBondContact CG-O 3.21Å; R152-D712 IonicContact CZ-OD2 2.75Å; R152-D712 PolarHBondContact NE-O 3.37Å; R152-D712 IonicContact NH2-OD2 3.75Å; R152-D712 PolarHBondContact NH2-OD2 3.33Å; Y667-D712 PolarHBondContact OH-O 2.91Å; Y667-D712 VanDerWaalsContact OH-O 3.05Å; D712-T714 VanDerWaalsContact C-N 3.31Å; D712-T714 WeakPolarHBondContact OD1-CA 3.24Å; D712-T714 PolarHBondContact OD1-N 3.46Å; D712-T714 PolarHBondContact OD1-OG1 2.86Å; D712-T714 PolarHBondContact OD2-OG1 2.81Å; D712-D715 PolarHBondContact N-OD2 3.35Å; D712-D715 VanDerWaalsContact N-OD2 3.08Å; D712-D715 PolarHBondContact OD1-N 2.58Å
713	G	84.1	Confident	89.9	Confident	10 Å²	10	34.2 Å²	34.2	10%	0.103	20%	0.198	C	C	.	.	S	Bend	trans	86.4	-9.2	179.1	0	0	0	0	0	115	Y667	Y667-G713 WeakPolarHBondContact CE1-O 3.26Å
714	T	87.3	Confident	90	Very high	65 Å²	65	37.6 Å²	37.6	40%	0.399	22%	0.217	S	C	.	.			trans	-103.7	-13.1	171.2	40.2	0	0	0	0	112.8	D712 I716	D712-T714 VanDerWaalsContact C-N 3.31Å; D712-T714 WeakPolarHBondContact OD1-CA 3.24Å; D712-T714 PolarHBondContact OD1-N 3.46Å; D712-T714 PolarHBondContact OD1-OG1 2.86Å; D712-T714 PolarHBondContact OD2-OG1 2.81Å; T714-I716 PolarHBondContact O-N 3.23Å
715	D	88.4	Confident	90.2	Very high	31 Å²	31	40.9 Å²	40.9	17%	0.166	23%	0.232	C	C	.	.	S	Bend	trans	-54.3	-23.8	179	-61.6	-37.5	0	0	0	115.3	S711 D712 D732 D733 F734	S711-D715 WeakPolarHBondContact CA-OD2 3.28Å; S711-D715 WeakPolarHBondContact CB-OD2 3.44Å; S711-D715 PolarHBondContact OG-OD2 2.88Å; D712-D715 PolarHBondContact N-OD2 3.35Å; D712-D715 VanDerWaalsContact N-OD2 3.08Å; D712-D715 PolarHBondContact OD1-N 2.58Å; D715-D732 CarbonylContact O-C 3.55Å; D715-D732 VanDerWaalsContact O-CA 3.27Å; D715-D732 WeakPolarHBondContact O-CA 3.28Å; D715-D732 WeakPolarHBondContact O-CB 3.39Å; D715-D733 PolarHBondContact O-N 3.24Å; D715-F734 HydrophobicContact CB-CE2 3.95Å; D715-F734 HydrophobicContact CB-CZ 4.38Å; D715-F734 WeakPolarHBondContact OD1-CZ 3.43Å
716	I	93.8	Very high	90.5	Very high	16 Å²	16	45.6 Å²	45.6	8%	0.082	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	118.1	-179.3	-60.4	179.9	0	0	0	109.3	V698 V706 W707 T714 V730	V698-I716 HydrophobicContact CB-CG2 4.33Å; V698-I716 HydrophobicContact CG1-CG2 3.75Å; V706-I716 HydrophobicContact CB-CD1 4.32Å; V706-I716 HydrophobicContact CG2-CD1 3.7Å; W707-I716 HydrophobicContact CD2-CD1 3.75Å; W707-I716 HydrophobicContact CE3-CD1 3.8Å; W707-I716 HydrophobicContact CE3-CG1 4.19Å; W707-I716 HydrophobicContact CG-CD1 4.25Å; W707-I716 HydrophobicContact CH2-CB 3.89Å; W707-I716 HydrophobicContact CH2-CD1 4.27Å; W707-I716 HydrophobicContact CH2-CG1 4.22Å; W707-I716 HydrophobicContact CZ2-CB 4.25Å; W707-I716 HydrophobicContact CZ2-CD1 4.21Å; W707-I716 HydrophobicContact CZ3-CB 4.14Å; W707-I716 HydrophobicContact CZ3-CD1 4.06Å; W707-I716 HydrophobicContact CZ3-CG1 3.99Å; T714-I716 PolarHBondContact O-N 3.23Å; I716-V730 HydrophobicContact CB-CG1 4.43Å; I716-V730 HydrophobicContact CD1-CG1 4.01Å; I716-V730 HydrophobicContact CG1-CG1 4.11Å; I716-V730 HydrophobicContact CG2-CG1 3.56Å
717	N	95.4	Very high	90.7	Very high	28 Å²	28	45.4 Å²	45.4	15%	0.15	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-37.8	-178.2	-68.4	-44.4	0	0	0	113.2	H650 A731 D733 V761	H650-N717 PolarHBondContact CE1-O 3.06Å; H650-N717 VanDerWaalsContact CE1-O 3.26Å; N717-A731 PolarHBondContact N-O 3.41Å; N717-D733 PolarHBondContact ND2-OD1 3Å; N717-D733 PolarHBondContact OD1-OD1 2.93Å; N717-V761 VanDerWaalsContact CB-O 3.27Å; N717-V761 WeakPolarHBondContact CB-O 3.48Å; N717-V761 PolarHBondContact ND2-O 3.14Å
718	A	96.8	Very high	91	Very high	4 Å²	4	44.7 Å²	44.7	3%	0.033	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	153.5	-177.6	0	0	0	0	0	111.8	V730 A731 N763 V764	A718-V730 WeakPolarHBondContact O-CA 3.34Å; A718-A731 HydrophobicContact CB-CB 4.03Å; A718-A731 PolarHBondContact O-N 2.83Å; A718-N763 HydrophobicContact CB-CB 4.45Å; A718-V764 HydrophobicContact CB-CG2 4.18Å
719	L	97.3	Very high	91.7	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.016	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	143.7	175.2	-179.5	150.3	0	0	0	107.8	F695 T696 V698 V703 V706 V728 A729 V730	F695-L719 HydrophobicContact CB-CD2 4.37Å; F695-L719 WeakPolarHBondContact O-CD2 3.3Å; T696-L719 WeakPolarHBondContact CA-O 3.39Å; V698-L719 HydrophobicContact CG1-CB 3.86Å; V703-L719 HydrophobicContact CB-CD1 3.85Å; V703-L719 HydrophobicContact CG1-CD1 3.9Å; V703-L719 HydrophobicContact CG1-CD2 4.26Å; V703-L719 HydrophobicContact CG2-CD1 4.17Å; V706-L719 HydrophobicContact CG1-CD1 4.24Å; V706-L719 HydrophobicContact CG2-CD1 4.22Å; L719-V728 HydrophobicContact CD1-CG2 3.83Å; L719-V728 HydrophobicContact CD2-CG2 3.44Å; L719-V728 VanDerWaalsContact CD2-CG2 3.44Å; L719-V728 HydrophobicContact CG-CG2 3.43Å; L719-V728 VanDerWaalsContact CG-CG2 3.43Å; L719-A729 CarbonylContact C-O 3.53Å; L719-A729 WeakPolarHBondContact CA-O 3.33Å; L719-V730 HydrophobicContact CD1-CG2 4.14Å; L719-V730 HydrophobicContact CG-CG2 4.33Å
720	C	97.8	Very high	92.7	Very high	13 Å²	13	32.5 Å²	32.5	9%	0.088	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	123	173	-175.1	0	0	0	0	109.4	F695 V728 A729 V764 F766	F695-C720 WeakPolarHBondContact O-CA 3.38Å; C720-V728 WeakPolarHBondContact O-CA 3.44Å; C720-A729 PolarHBondContact N-O 3.21Å; C720-A729 PolarHBondContact O-N 3.03Å; C720-V764 HydrophobicContact CB-CG2 4.28Å; C720-V764 VanDerWaalsContact CB-O 3.27Å; C720-V764 WeakPolarHBondContact CB-O 3.04Å; C720-F766 HydrophobicContact CB-CD2 4.44Å; C720-F766 WeakPolarHBondContact O-CE2 3.43Å
721	R	97.6	Very high	93.6	Very high	17 Å²	17	28.7 Å²	28.7	6%	0.064	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	141.8	170.8	-174.3	-167.2	69.7	147.6	3.6	110.4	A693 F695 E725 Y742	A693-R721 PolarHBondContact O-NH2 3.32Å; A693-R721 VanDerWaalsContact O-NH2 3.15Å; F695-R721 HydrophobicContact CB-CB 3.71Å; F695-R721 PolarHBondContact O-N 2.93Å; R721-E725 VanDerWaalsContact CZ-CG 3.49Å; R721-E725 IonicContact CZ-OE1 2.69Å; R721-E725 VanDerWaalsContact CZ-OE1 3.3Å; R721-E725 IonicContact NH1-OE1 3.44Å; R721-E725 PolarHBondContact NH1-OE1 2.99Å; R721-E725 IonicContact NH1-OE2 3.32Å; R721-E725 PolarHBondContact NH1-OE2 3.38Å; R721-E725 IonicContact NH2-OE1 3.13Å; R721-E725 PolarHBondContact NH2-OE1 3.25Å; R721-Y742 VanDerWaalsContact CD-CE2 3.5Å; R721-Y742 VanDerWaalsContact CD-CZ 3.44Å; R721-Y742 HydrophobicContact CG-CD1 4.28Å; R721-Y742 HydrophobicContact CG-CD2 3.8Å; R721-Y742 HydrophobicContact CG-CE2 4.06Å; R721-Y742 HydrophobicContact CG-CG 3.91Å
722	S	97.4	Very high	94.1	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.007	15%	0.147	C	C	.	.			trans	-61.2	152.1	171.3	61.3	0	0	0	0	112	N724 E725 K726 V727 D770	S722-N724 VanDerWaalsContact C-N 3.26Å; S722-N724 WeakPolarHBondContact CB-OD1 3.19Å; S722-N724 PolarHBondContact O-N 3.39Å; S722-N724 PolarHBondContact OG-OD1 2.64Å; S722-E725 PolarHBondContact O-N 3.39Å; S722-E725 VanDerWaalsContact O-N 3.08Å; S722-K726 PolarHBondContact OG-N 3.38Å; S722-V727 PolarHBondContact N-O 3.4Å; S722-V727 WeakPolarHBondContact OG-CG2 3.3Å; S722-V727 PolarHBondContact OG-N 3.44Å; S722-V727 VanDerWaalsContact OG-N 3.15Å; S722-V727 PolarHBondContact OG-O 3.25Å; S722-D770 WeakPolarHBondContact CA-OD1 3.37Å; S722-D770 WeakPolarHBondContact CB-OD1 3.39Å
723	H	94.9	Very high	94.5	Very high	102 Å²	102	29.2 Å²	29.2	47%	0.472	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-32.3	179.5	-61.5	-70.2	0	0	0	112.1	E725 T767 D770	H723-E725 PolarHBondContact O-N 3.35Å; H723-T767 PolarHBondContact CD2-O 3.02Å; H723-T767 PolarHBondContact NE2-O 3.43Å; H723-D770 IonicContact CD2-OD1 3.76Å; H723-D770 PolarHBondContact CD2-OD1 3.2Å; H723-D770 IonicContact CG-OD1 3.8Å; H723-D770 VanDerWaalsContact N-CG 3.33Å; H723-D770 PolarHBondContact N-OD1 2.75Å; H723-D770 PolarHBondContact N-OD2 3.02Å; H723-D770 VanDerWaalsContact N-OD2 3.07Å
724	N	94.4	Very high	94.8	Very high	72 Å²	72	31.8 Å²	31.8	39%	0.385	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	0.9	174.8	71.2	14.6	0	0	0	114.5	S722 K726 D770	S722-N724 VanDerWaalsContact C-N 3.26Å; S722-N724 WeakPolarHBondContact CB-OD1 3.19Å; S722-N724 PolarHBondContact O-N 3.39Å; S722-N724 PolarHBondContact OG-OD1 2.64Å; N724-K726 VanDerWaalsContact C-N 3.26Å; N724-K726 PolarHBondContact O-N 3Å; N724-K726 WeakPolarHBondContact OD1-CB 3.25Å; N724-K726 PolarHBondContact OD1-N 2.84Å; N724-D770 WeakPolarHBondContact CB-OD2 3.3Å; N724-D770 VanDerWaalsContact CG-OD2 3.23Å; N724-D770 PolarHBondContact N-OD2 3.21Å
725	E	94.8	Very high	94.9	Very high	73 Å²	73	30.1 Å²	30.1	34%	0.341	15%	0.15	S	C	.	.	S	Bend	trans	61.1	24.6	176.2	-35.9	-162.5	143.6	0	0	114.9	K655 R721 S722 H723 Y742	K655-E725 VanDerWaalsContact CE-OE1 3.26Å; K655-E725 WeakPolarHBondContact CE-OE1 3.44Å; K655-E725 IonicContact NZ-OE1 2.79Å; K655-E725 PolarHBondContact NZ-OE1 2.81Å; K655-E725 IonicContact NZ-OE2 3.4Å; R721-E725 VanDerWaalsContact CZ-CG 3.49Å; R721-E725 IonicContact CZ-OE1 2.69Å; R721-E725 VanDerWaalsContact CZ-OE1 3.3Å; R721-E725 IonicContact NH1-OE1 3.44Å; R721-E725 PolarHBondContact NH1-OE1 2.99Å; R721-E725 IonicContact NH1-OE2 3.32Å; R721-E725 PolarHBondContact NH1-OE2 3.38Å; R721-E725 IonicContact NH2-OE1 3.13Å; R721-E725 PolarHBondContact NH2-OE1 3.25Å; S722-E725 PolarHBondContact O-N 3.39Å; S722-E725 VanDerWaalsContact O-N 3.08Å; H723-E725 PolarHBondContact O-N 3.35Å; E725-Y742 WeakPolarHBondContact O-CD1 3.46Å
726	K	94.3	Very high	95.1	Very high	102 Å²	102	30.2 Å²	30.2	44%	0.443	15%	0.149	S	C	.	.	S	Bend	trans	-98.2	-31.4	-179.5	-66.1	-175.2	178.9	179.9	0	114.8	E177 S722 N724 Y742	E177-K726 WeakPolarHBondContact OE1-CD 3.45Å; S722-K726 PolarHBondContact OG-N 3.38Å; N724-K726 VanDerWaalsContact C-N 3.26Å; N724-K726 PolarHBondContact O-N 3Å; N724-K726 WeakPolarHBondContact OD1-CB 3.25Å; N724-K726 PolarHBondContact OD1-N 2.84Å; K726-Y742 PolarHBondContact O-N 2.85Å
727	V	96.9	Very high	95.2	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.012	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	160.9	-173.9	-64.1	0	0	0	0	111.8	P175 E177 S722 L739 F740 F766	P175-V727 HydrophobicContact CB-CG1 3.69Å; E177-V727 HydrophobicContact CB-CG1 4.11Å; E177-V727 HydrophobicContact CG-CG1 4.33Å; E177-V727 WeakPolarHBondContact OE2-CG1 3.31Å; S722-V727 PolarHBondContact N-O 3.4Å; S722-V727 WeakPolarHBondContact OG-CG2 3.3Å; S722-V727 PolarHBondContact OG-N 3.44Å; S722-V727 VanDerWaalsContact OG-N 3.15Å; S722-V727 PolarHBondContact OG-O 3.25Å; V727-L739 HydrophobicContact CB-CD1 4Å; V727-L739 HydrophobicContact CB-CG 4.41Å; V727-L739 HydrophobicContact CG2-CD1 4.05Å; V727-F740 VanDerWaalsContact CA-O 3.3Å; V727-F740 WeakPolarHBondContact CA-O 3.39Å; V727-F740 WeakPolarHBondContact CB-O 3.38Å; V727-F766 HydrophobicContact CG2-CE1 4.37Å; V727-F766 HydrophobicContact CG2-CZ 3.82Å
728	V	97.4	Very high	95.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	129.3	173.8	64.1	0	0	0	0	109.8	V706 L719 C720 F740 Y742	V706-V728 HydrophobicContact CG1-CG1 4.4Å; L719-V728 HydrophobicContact CD1-CG2 3.83Å; L719-V728 HydrophobicContact CD2-CG2 3.44Å; L719-V728 VanDerWaalsContact CD2-CG2 3.44Å; L719-V728 HydrophobicContact CG-CG2 3.43Å; L719-V728 VanDerWaalsContact CG-CG2 3.43Å; C720-V728 WeakPolarHBondContact O-CA 3.44Å; V728-F740 HydrophobicContact CG1-CB 3.72Å; V728-F740 PolarHBondContact N-O 2.91Å; V728-F740 PolarHBondContact O-N 2.85Å; V728-Y742 HydrophobicContact CB-CD2 4.35Å
729	A	98.1	Very high	95.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	143.4	174.9	0	0	0	0	0	110.2	L719 C720 H738 L739 V764 F766 L773	L719-A729 CarbonylContact C-O 3.53Å; L719-A729 WeakPolarHBondContact CA-O 3.33Å; C720-A729 PolarHBondContact N-O 3.21Å; C720-A729 PolarHBondContact O-N 3.03Å; A729-H738 CarbonylContact C-O 3.56Å; A729-H738 VanDerWaalsContact CA-O 3.29Å; A729-H738 WeakPolarHBondContact CA-O 3.19Å; A729-L739 HydrophobicContact CB-CD1 4.35Å; A729-V764 HydrophobicContact CB-CG2 4.39Å; A729-F766 HydrophobicContact CB-CE2 3.77Å; A729-F766 HydrophobicContact CB-CZ 3.92Å; A729-L773 HydrophobicContact CB-CD1 3.54Å; A729-L773 HydrophobicContact CB-CD2 3.6Å; A729-L773 HydrophobicContact CB-CG 4.24Å
730	V	97.5	Very high	95.3	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.012	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	132.4	-177.1	-179.5	0	0	0	0	109.7	V706 I716 A718 L719 V737 H738 F740	V706-V730 HydrophobicContact CB-CG2 4Å; V706-V730 HydrophobicContact CG1-CG2 3.8Å; I716-V730 HydrophobicContact CB-CG1 4.43Å; I716-V730 HydrophobicContact CD1-CG1 4.01Å; I716-V730 HydrophobicContact CG1-CG1 4.11Å; I716-V730 HydrophobicContact CG2-CG1 3.56Å; A718-V730 WeakPolarHBondContact O-CA 3.34Å; L719-V730 HydrophobicContact CD1-CG2 4.14Å; L719-V730 HydrophobicContact CG-CG2 4.33Å; V730-V737 CarbonylContact O-C 3.58Å; V730-V737 WeakPolarHBondContact O-CA 3.48Å; V730-H738 HydrophobicContact CB-CB 4.26Å; V730-H738 PolarHBondContact N-O 2.52Å; V730-H738 PolarHBondContact O-N 2.48Å; V730-F740 HydrophobicContact CB-CE2 4.19Å; V730-F740 HydrophobicContact CG2-CD2 3.9Å; V730-F740 HydrophobicContact CG2-CE2 3.81Å
731	A	96.4	Very high	95.2	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	124.2	173.4	0	0	0	0	0	109.5	N717 A718 V761 V764	N717-A731 PolarHBondContact N-O 3.41Å; A718-A731 HydrophobicContact CB-CB 4.03Å; A718-A731 PolarHBondContact O-N 2.83Å; A731-V761 HydrophobicContact CB-CB 3.8Å; A731-V761 HydrophobicContact CB-CG1 3.58Å; A731-V761 WeakPolarHBondContact CB-O 3.17Å; A731-V764 HydrophobicContact CB-CB 4.45Å; A731-V764 HydrophobicContact CB-CG1 3.84Å; A731-V764 HydrophobicContact CB-CG2 3.98Å
732	D	93.1	Very high	95	Very high	11 Å²	11	32.3 Å²	32.3	6%	0.059	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	164.5	179.8	79.7	11.9	0	0	0	113.8	D715 F734 C735 K736 H738 V761	D715-D732 CarbonylContact O-C 3.55Å; D715-D732 VanDerWaalsContact O-CA 3.27Å; D715-D732 WeakPolarHBondContact O-CA 3.28Å; D715-D732 WeakPolarHBondContact O-CB 3.39Å; D732-F734 HydrophobicContact CB-CD2 4.29Å; D732-F734 PolarHBondContact O-N 3.11Å; D732-F734 VanDerWaalsContact OD1-CA 3.29Å; D732-F734 WeakPolarHBondContact OD1-CA 3.5Å; D732-F734 PolarHBondContact OD1-N 3.24Å; D732-C735 PolarHBondContact OD1-N 2.99Å; D732-C735 VanDerWaalsContact OD1-N 3.15Å; D732-K736 PolarHBondContact N-O 3.37Å; D732-K736 VanDerWaalsContact N-O 3.16Å; D732-K736 WeakPolarHBondContact OD1-CA 3.36Å; D732-K736 PolarHBondContact OD1-N 3.01Å; D732-K736 WeakPolarHBondContact OD2-CB 3.5Å; D732-H738 IonicContact OD2-CD2 3.79Å; D732-H738 IonicContact OD2-CE1 2.82Å; D732-H738 IonicContact OD2-NE2 3.71Å; D732-H738 PolarHBondContact OD2-NE2 3.31Å; D732-V761 PolarHBondContact O-N 2.85Å
733	D	91.1	Very high	94.8	Very high	61 Å²	61	34.7 Å²	34.7	33%	0.326	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-8	174.5	-101.3	-4.2	0	0	0	113.4	D715 N717 H760	D715-D733 PolarHBondContact O-N 3.24Å; N717-D733 PolarHBondContact ND2-OD1 3Å; N717-D733 PolarHBondContact OD1-OD1 2.93Å; D733-H760 VanDerWaalsContact OD1-CB 3.31Å; D733-H760 WeakPolarHBondContact OD1-CB 3.31Å
734	F	89.6	Confident	94.7	Very high	65 Å²	65	29.9 Å²	29.9	29%	0.285	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	22.2	-176.4	-49.8	-66.5	0	0	0	113	K255 D715 D732 K736	K255-F734 HydrophobicContact CB-CB 4.45Å; K255-F734 HydrophobicContact CB-CD1 3.71Å; K255-F734 HydrophobicContact CB-CD2 4.13Å; K255-F734 HydrophobicContact CB-CE1 3.91Å; K255-F734 HydrophobicContact CB-CE2 4.31Å; K255-F734 HydrophobicContact CB-CG 3.83Å; K255-F734 HydrophobicContact CB-CZ 4.21Å; D715-F734 HydrophobicContact CB-CE2 3.95Å; D715-F734 HydrophobicContact CB-CZ 4.38Å; D715-F734 WeakPolarHBondContact OD1-CZ 3.43Å; D732-F734 HydrophobicContact CB-CD2 4.29Å; D732-F734 PolarHBondContact O-N 3.11Å; D732-F734 VanDerWaalsContact OD1-CA 3.29Å; D732-F734 WeakPolarHBondContact OD1-CA 3.5Å; D732-F734 PolarHBondContact OD1-N 3.24Å; F734-K736 VanDerWaalsContact C-N 3.3Å; F734-K736 PolarHBondContact O-N 3.26Å
735	C	91.1	Very high	94.5	Very high	30 Å²	30	26.5 Å²	26.5	20%	0.203	13%	0.13	C	C	.	.	S	Bend	trans	67.1	22.9	177.1	-42.9	0	0	0	0	114.3	D732 H757 S759	D732-C735 PolarHBondContact OD1-N 2.99Å; D732-C735 VanDerWaalsContact OD1-N 3.15Å; C735-H757 HydrophobicContact CB-CB 4.34Å; C735-H757 WeakPolarHBondContact CB-O 3.33Å; C735-S759 WeakPolarHBondContact CA-O 3.46Å; C735-S759 WeakPolarHBondContact CB-O 3.44Å; C735-S759 VanDerWaalsContact SG-CA 3.53Å; C735-S759 PolarHBondContact SG-O 3.27Å
736	K	92.4	Very high	94.3	Very high	33 Å²	33	24.6 Å²	24.6	14%	0.143	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	148.2	-178.2	-48.3	-62.6	168.1	-174.2	0	112.1	D732 F734 Y754 E755	D732-K736 PolarHBondContact N-O 3.37Å; D732-K736 VanDerWaalsContact N-O 3.16Å; D732-K736 WeakPolarHBondContact OD1-CA 3.36Å; D732-K736 PolarHBondContact OD1-N 3.01Å; D732-K736 WeakPolarHBondContact OD2-CB 3.5Å; F734-K736 VanDerWaalsContact C-N 3.3Å; F734-K736 PolarHBondContact O-N 3.26Å; K736-Y754 WeakPolarHBondContact CA-O 3.3Å; K736-E755 HydrophobicContact CD-CG 3.91Å; K736-E755 IonicContact NZ-OE1 2.94Å; K736-E755 PolarHBondContact NZ-OE1 3.24Å
737	V	95.8	Very high	93.9	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.006	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134.1	163.7	179	0	0	0	0	107.8	L179 V730 Y754 V761 V764 L773 W786	L179-V737 HydrophobicContact CD1-CG1 4.24Å; V730-V737 CarbonylContact O-C 3.58Å; V730-V737 WeakPolarHBondContact O-CA 3.48Å; V737-Y754 PolarHBondContact N-O 3.09Å; V737-Y754 VanDerWaalsContact N-O 3.13Å; V737-Y754 WeakPolarHBondContact O-CD2 3.46Å; V737-Y754 PolarHBondContact O-N 3.4Å; V737-V761 HydrophobicContact CG2-CG1 4.13Å; V737-V761 HydrophobicContact CG2-CG2 4.41Å; V737-V764 HydrophobicContact CG1-CG1 4.27Å; V737-V764 HydrophobicContact CG2-CG1 4.31Å; V737-L773 HydrophobicContact CG1-CD2 3.8Å; V737-W786 HydrophobicContact CB-CZ2 4.44Å; V737-W786 HydrophobicContact CG2-CZ2 4.07Å
738	H	96.4	Very high	93.4	Very high	19 Å²	19	30.4 Å²	30.4	9%	0.088	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	145.3	175.5	-55.5	-108.6	0	0	0	110.3	A729 V730 D732 F740 Y752	A729-H738 CarbonylContact C-O 3.56Å; A729-H738 VanDerWaalsContact CA-O 3.29Å; A729-H738 WeakPolarHBondContact CA-O 3.19Å; V730-H738 HydrophobicContact CB-CB 4.26Å; V730-H738 PolarHBondContact N-O 2.52Å; V730-H738 PolarHBondContact O-N 2.48Å; D732-H738 IonicContact OD2-CD2 3.79Å; D732-H738 IonicContact OD2-CE1 2.82Å; D732-H738 IonicContact OD2-NE2 3.71Å; D732-H738 PolarHBondContact OD2-NE2 3.31Å; H738-F740 HydrophobicContact CB-CD2 4.08Å; H738-F740 HydrophobicContact CB-CE2 3.43Å; H738-F740 VanDerWaalsContact CB-CE2 3.43Å; H738-F740 HydrophobicContact CB-CZ 4.18Å; H738-Y752 CarbonylContact C-O 3.57Å; H738-Y752 VanDerWaalsContact CA-O 3.24Å; H738-Y752 WeakPolarHBondContact CA-O 3.49Å
739	L	97.7	Very high	93.1	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	123.9	171.3	-168.7	74	0	0	0	109.5	P175 E177 L179 V727 A729 S751 Y752 Y754 F766	P175-L739 HydrophobicContact CG-CD2 4.12Å; P175-L739 HydrophobicContact CG-CG 4.11Å; E177-L739 HydrophobicContact CB-CD2 4.37Å; E177-L739 WeakPolarHBondContact O-CD2 3.48Å; L179-L739 HydrophobicContact CD2-CD2 4.3Å; L179-L739 HydrophobicContact CG-CD2 4.13Å; V727-L739 HydrophobicContact CB-CD1 4Å; V727-L739 HydrophobicContact CB-CG 4.41Å; V727-L739 HydrophobicContact CG2-CD1 4.05Å; A729-L739 HydrophobicContact CB-CD1 4.35Å; L739-S751 VanDerWaalsContact O-CA 3.3Å; L739-S751 WeakPolarHBondContact O-CA 3.48Å; L739-S751 VanDerWaalsContact O-CB 3.32Å; L739-S751 WeakPolarHBondContact O-CB 3.18Å; L739-Y752 PolarHBondContact N-O 2.8Å; L739-Y752 PolarHBondContact O-N 2.78Å; L739-Y754 HydrophobicContact CB-CE2 3.84Å; L739-F766 HydrophobicContact CD1-CZ 4.01Å
740	F	96.8	Very high	92.9	Very high	10 Å²	10	33.1 Å²	33.1	4%	0.044	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	157.4	178.1	-61.9	-102.4	0	0	0	110.4	V706 V727 V728 V730 H738 A749 S751	V706-F740 HydrophobicContact CB-CE2 4.1Å; V706-F740 HydrophobicContact CB-CZ 4.17Å; V706-F740 HydrophobicContact CG1-CD2 3.97Å; V706-F740 HydrophobicContact CG1-CE2 4.05Å; V706-F740 HydrophobicContact CG1-CG 4.21Å; V706-F740 HydrophobicContact CG1-CZ 4.38Å; V727-F740 VanDerWaalsContact CA-O 3.3Å; V727-F740 WeakPolarHBondContact CA-O 3.39Å; V727-F740 WeakPolarHBondContact CB-O 3.38Å; V728-F740 HydrophobicContact CG1-CB 3.72Å; V728-F740 PolarHBondContact N-O 2.91Å; V728-F740 PolarHBondContact O-N 2.85Å; V730-F740 HydrophobicContact CB-CE2 4.19Å; V730-F740 HydrophobicContact CG2-CD2 3.9Å; V730-F740 HydrophobicContact CG2-CE2 3.81Å; H738-F740 HydrophobicContact CB-CD2 4.08Å; H738-F740 HydrophobicContact CB-CE2 3.43Å; H738-F740 VanDerWaalsContact CB-CE2 3.43Å; H738-F740 HydrophobicContact CB-CZ 4.18Å; F740-A749 HydrophobicContact CD1-CB 3.88Å; F740-A749 HydrophobicContact CE1-CB 4.18Å; F740-A749 WeakPolarHBondContact CE1-O 3.36Å; F740-S751 VanDerWaalsContact CE1-CB 3.45Å
741	Q	95.6	Very high	92.8	Very high	71 Å²	71	34.3 Å²	34.3	33%	0.332	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	140.9	164.4	-173.9	178	17.5	0	0	109.9	E173 P175 P743 C744	E173-Q741 PolarHBondContact O-OE1 2.72Å; P175-Q741 HydrophobicContact CB-CB 4.46Å; Q741-P743 CarbonylContact O-C 3.47Å; Q741-C744 VanDerWaalsContact O-CB 3.29Å; Q741-C744 WeakPolarHBondContact O-CB 3.16Å
742	Y	93.9	Very high	92.8	Very high	23 Å²	23	36.3 Å²	36.3	9%	0.09	19%	0.189	C	C	.	.	S	Bend	trans	-108.3	137.8	170.8	-177.5	-84.7	0	0	0	110.4	F695 H702 V703 R721 E725 K726 V728	F695-Y742 HydrophobicContact CD2-CE2 4.21Å; F695-Y742 WeakPolarHBondContact CD2-OH 3.36Å; F695-Y742 HydrophobicContact CE2-CE2 4.44Å; F695-Y742 AromaticContact CE2-CZ 3.93Å; F695-Y742 WeakPolarHBondContact CE2-OH 3.44Å; F695-Y742 HydrophobicContact CG-CE2 4.22Å; F695-Y742 WeakPolarHBondContact CZ-OH 3.26Å; H702-Y742 HydrophobicContact CB-CE2 3.78Å; V703-Y742 HydrophobicContact CG1-CD2 4.48Å; V703-Y742 HydrophobicContact CG1-CE2 4.3Å; R721-Y742 VanDerWaalsContact CD-CE2 3.5Å; R721-Y742 VanDerWaalsContact CD-CZ 3.44Å; R721-Y742 HydrophobicContact CG-CD1 4.28Å; R721-Y742 HydrophobicContact CG-CD2 3.8Å; R721-Y742 HydrophobicContact CG-CE2 4.06Å; R721-Y742 HydrophobicContact CG-CG 3.91Å; E725-Y742 WeakPolarHBondContact O-CD1 3.46Å; K726-Y742 PolarHBondContact O-N 2.85Å; V728-Y742 HydrophobicContact CB-CD2 4.35Å
743	P	92.8	Very high	92.8	Very high	51 Å²	51	41.4 Å²	41.4	33%	0.331	21%	0.211	S	C	.	.			cis	-73.8	153.1	-10.5	33.2	-35.7	0	0	0	111.4	H702 Q741 P745	H702-P743 HydrophobicContact CB-CB 4.09Å; Q741-P743 CarbonylContact O-C 3.47Å; P743-P745 VanDerWaalsContact C-CD 3.41Å; P743-P745 WeakPolarHBondContact O-CD 3.28Å
744	C	92.3	Very high	92.9	Very high	2 Å²	2	39.9 Å²	39.9	1%	0.014	20%	0.201	C	C	.	.			trans	-119.2	67.8	172.9	50.2	0	0	0	0	111.9	M172 H702 I704 G705 Q741 K746 A749	M172-C744 HydrophobicContact SD-CB 4.19Å; H702-C744 CarbonylContact O-C 3.45Å; H702-C744 PolarHBondContact O-N 2.9Å; I704-C744 PolarHBondContact N-O 3.03Å; G705-C744 VanDerWaalsContact CA-O 3.32Å; G705-C744 WeakPolarHBondContact CA-O 3.22Å; G705-C744 PolarHBondContact N-O 2.86Å; Q741-C744 VanDerWaalsContact O-CB 3.29Å; Q741-C744 WeakPolarHBondContact O-CB 3.16Å; C744-K746 VanDerWaalsContact C-N 3.27Å; C744-K746 PolarHBondContact O-N 2.81Å; C744-A749 HydrophobicContact CB-CB 3.92Å
745	P	91.1	Very high	92.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.208	C	C	.	.			trans	-84.4	8.2	-170.9	37.4	-39.9	0	0	0	114.4	Y167 L170 F701 P743	Y167-P745 HydrophobicContact CE2-CB 4.19Å; Y167-P745 HydrophobicContact CE2-CG 4.32Å; Y167-P745 WeakPolarHBondContact CE2-O 3.31Å; Y167-P745 PolarHBondContact OH-O 3.24Å; L170-P745 HydrophobicContact CD2-CG 3.31Å; F701-P745 HydrophobicContact CD1-CB 4.11Å; F701-P745 HydrophobicContact CE1-CB 3.56Å; F701-P745 HydrophobicContact CE1-CG 4.22Å; F701-P745 HydrophobicContact CE2-CB 4.1Å; F701-P745 HydrophobicContact CZ-CB 3.58Å; F701-P745 HydrophobicContact CZ-CG 4.21Å; F701-P745 VanDerWaalsContact O-CA 3.25Å; F701-P745 WeakPolarHBondContact O-CA 3.39Å; F701-P745 WeakPolarHBondContact O-CB 3.5Å; P743-P745 VanDerWaalsContact C-CD 3.41Å; P743-P745 WeakPolarHBondContact O-CD 3.28Å
746	K	89.2	Confident	92.8	Very high	34 Å²	34	40 Å²	40	15%	0.148	20%	0.2	C	C	.	.	S	Bend	trans	-112	135	-179.5	-73	-83.5	180	-178.1	0	110.3	Y167 D168 L170 M172 G705 C744	Y167-K746 HydrophobicContact CE1-CD 3.97Å; Y167-K746 VanDerWaalsContact CE1-CE 3.48Å; Y167-K746 HydrophobicContact CE2-CD 3.99Å; Y167-K746 HydrophobicContact CE2-CG 4.21Å; Y167-K746 WeakPolarHBondContact O-CE 3.44Å; Y167-K746 PolarHBondContact O-NZ 2.95Å; Y167-K746 WeakPolarHBondContact OH-CD 3.32Å; D168-K746 IonicContact OD1-NZ 2.71Å; L170-K746 HydrophobicContact CD2-CG 4.42Å; M172-K746 HydrophobicContact CG-CB 3.57Å; M172-K746 HydrophobicContact CG-CG 4.19Å; M172-K746 HydrophobicContact SD-CB 3.95Å; M172-K746 HydrophobicContact SD-CG 4.31Å; G705-K746 WeakPolarHBondContact CA-O 3.36Å; C744-K746 VanDerWaalsContact C-N 3.27Å; C744-K746 PolarHBondContact O-N 2.81Å
747	P	86.8	Confident	92.8	Very high	80 Å²	80	38.6 Å²	38.6	52%	0.519	19%	0.194	S	C	.	.	S	Bend	trans	-53.3	151.5	172.5	-23.9	33.1	0	0	0	112.1	I704 A749	I704-P747 HydrophobicContact CG2-CG 4.33Å; P747-A749 VanDerWaalsContact C-N 3.34Å
748	K	85.6	Confident	92.3	Very high	145 Å²	145	39.1 Å²	39.1	63%	0.63	20%	0.2	S	C	*	.	S	Bend	trans	60.9	39.1	179.8	-53.2	179.5	179.5	-179.8	0	113	E709	E709-K748 WeakPolarHBondContact OE2-CE 3.42Å; E709-K748 IonicContact OE2-NZ 2.66Å; E709-K748 PolarHBondContact OE2-NZ 2.83Å
749	A	91.8	Very high	92	Very high	12 Å²	12	39.2 Å²	39.2	10%	0.099	20%	0.202	C	C	.	.			trans	-61.7	137.2	172.5	0	0	0	0	0	109.7	M172 G705 F740 C744 P747	M172-A749 HydrophobicContact CB-CB 4.25Å; M172-A749 HydrophobicContact CG-CB 4.2Å; G705-A749 PolarHBondContact O-N 3.02Å; F740-A749 HydrophobicContact CD1-CB 3.88Å; F740-A749 HydrophobicContact CE1-CB 4.18Å; F740-A749 WeakPolarHBondContact CE1-O 3.36Å; C744-A749 HydrophobicContact CB-CB 3.92Å; P747-A749 VanDerWaalsContact C-N 3.34Å
750	P	94	Very high	91.7	Very high	46 Å²	46	40.7 Å²	40.7	30%	0.299	21%	0.209	S	C	.	.			trans	-72.6	145.6	176.4	32.8	-35.1	0	0	0	110.2	M172 E173 L174	M172-P750 HydrophobicContact CB-CG 4.46Å; E173-P750 VanDerWaalsContact C-CG 3.5Å; L174-P750 HydrophobicContact CD2-CB 3.82Å; L174-P750 HydrophobicContact CD2-CG 4.45Å; L174-P750 HydrophobicContact CG-CB 4.01Å; L174-P750 HydrophobicContact CG-CG 4.33Å
751	S	95.4	Very high	91.7	Very high	27 Å²	27	40.2 Å²	40.2	19%	0.189	21%	0.207	C	C	.	.			trans	-138.8	156.5	177.4	61.2	0	0	0	0	112.6	L739 F740	L739-S751 VanDerWaalsContact O-CA 3.3Å; L739-S751 WeakPolarHBondContact O-CA 3.48Å; L739-S751 VanDerWaalsContact O-CB 3.32Å; L739-S751 WeakPolarHBondContact O-CB 3.18Å; F740-S751 VanDerWaalsContact CE1-CB 3.45Å
752	Y	96.1	Very high	91.7	Very high	42 Å²	42	36.9 Å²	36.9	17%	0.165	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	141.1	158.4	-63.5	-56	0	0	0	109.9	L174 P175 R178 H738 L739 Y754	L174-Y752 HydrophobicContact CB-CE1 4.49Å; L174-Y752 HydrophobicContact CB-CE2 4.21Å; L174-Y752 HydrophobicContact CD1-CE1 3.87Å; L174-Y752 HydrophobicContact CD2-CD1 4.18Å; L174-Y752 HydrophobicContact CD2-CE1 3.98Å; L174-Y752 HydrophobicContact CD2-CE2 4.46Å; L174-Y752 HydrophobicContact CD2-CG 4.46Å; L174-Y752 HydrophobicContact CG-CE1 4.35Å; P175-Y752 HydrophobicContact CG-CD2 3.75Å; P175-Y752 HydrophobicContact CG-CE2 3.9Å; P175-Y752 WeakPolarHBondContact O-CE2 3.39Å; R178-Y752 HydrophobicContact CG-CD2 4.14Å; R178-Y752 HydrophobicContact CG-CE2 3.82Å; R178-Y752 VanDerWaalsContact CZ-CZ 3.45Å; R178-Y752 PolarHBondContact NH2-OH 2.9Å; H738-Y752 CarbonylContact C-O 3.57Å; H738-Y752 VanDerWaalsContact CA-O 3.24Å; H738-Y752 WeakPolarHBondContact CA-O 3.49Å; L739-Y752 PolarHBondContact N-O 2.8Å; L739-Y752 PolarHBondContact O-N 2.78Å; Y752-Y754 VanDerWaalsContact CB-OH 3.24Å; Y752-Y754 WeakPolarHBondContact CB-OH 3.29Å
753	K	93.5	Very high	91.9	Very high	118 Å²	118	37.7 Å²	37.7	51%	0.513	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	134.8	-178.7	-52.8	-170.3	179.2	177.3	0	109.5
754	Y	93	Very high	92.1	Very high	29 Å²	29	35.4 Å²	35.4	11%	0.114	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	136.9	-176.5	-54.4	-82.4	0	0	0	110.1	L179 K736 V737 L739 Y752 W786	L179-Y754 HydrophobicContact CB-CD1 4.02Å; L179-Y754 HydrophobicContact CB-CD2 4.2Å; L179-Y754 HydrophobicContact CB-CE1 3.62Å; L179-Y754 HydrophobicContact CB-CE2 3.81Å; L179-Y754 HydrophobicContact CB-CG 4.29Å; L179-Y754 VanDerWaalsContact CB-CZ 3.49Å; L179-Y754 HydrophobicContact CD1-CD2 3.72Å; L179-Y754 HydrophobicContact CD1-CE2 3.63Å; L179-Y754 HydrophobicContact CD1-CG 4.35Å; L179-Y754 HydrophobicContact CG-CD2 4.25Å; L179-Y754 HydrophobicContact CG-CE1 4.44Å; L179-Y754 HydrophobicContact CG-CE2 3.73Å; L179-Y754 PolarHBondContact N-OH 3.18Å; L179-Y754 WeakPolarHBondContact O-CE1 3.38Å; K736-Y754 WeakPolarHBondContact CA-O 3.3Å; V737-Y754 PolarHBondContact N-O 3.09Å; V737-Y754 VanDerWaalsContact N-O 3.13Å; V737-Y754 WeakPolarHBondContact O-CD2 3.46Å; V737-Y754 PolarHBondContact O-N 3.4Å; L739-Y754 HydrophobicContact CB-CE2 3.84Å; Y752-Y754 VanDerWaalsContact CB-OH 3.24Å; Y752-Y754 WeakPolarHBondContact CB-OH 3.29Å; Y754-W786 HydrophobicContact CD1-CZ3 4.33Å; Y754-W786 HydrophobicContact CG-CZ3 4.21Å
755	E	89.7	Confident	92.4	Very high	93 Å²	93	36.1 Å²	36.1	44%	0.435	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	149.6	-177.1	-47.3	-168.1	135.7	0	0	110.1	K736	K736-E755 HydrophobicContact CD-CG 3.91Å; K736-E755 IonicContact NZ-OE1 2.94Å; K736-E755 PolarHBondContact NZ-OE1 3.24Å
756	G	88.6	Confident	92.7	Very high	4 Å²	4	36.2 Å²	36.2	4%	0.041	19%	0.188	C	C	.	.			trans	167.4	-40.4	175.2	0	0	0	0	0	112.3	A210 C211	A210-G756 WeakPolarHBondContact CB-O 3.47Å; C211-G756 WeakPolarHBondContact CB-O 3.36Å; C211-G756 PolarHBondContact N-O 3.17Å; C211-G756 VanDerWaalsContact N-O 3.09Å
757	H	92.5	Very high	93	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.019	18%	0.182	C	C	.	.			trans	-66.5	149.2	173.1	-71.2	-64.5	0	0	0	111.9	C211 C735 V761 S775 I776 G777 D780 C782 L784	C211-H757 PolarHBondContact SG-O 3.1Å; C735-H757 HydrophobicContact CB-CB 4.34Å; C735-H757 WeakPolarHBondContact CB-O 3.33Å; H757-V761 HydrophobicContact CB-CG2 3.94Å; H757-V761 VanDerWaalsContact CD2-CG2 3.44Å; H757-V761 WeakPolarHBondContact CD2-CG2 3.33Å; H757-S775 PolarHBondContact NE2-OG 3.39Å; H757-I776 VanDerWaalsContact CE1-C 3.45Å; H757-G777 WeakPolarHBondContact CE1-CA 3.42Å; H757-G777 PolarHBondContact CE1-N 2.9Å; H757-G777 WeakPolarHBondContact ND1-CA 3.12Å; H757-D780 WeakPolarHBondContact CA-OD2 3.47Å; H757-D780 VanDerWaalsContact CB-OD2 3.27Å; H757-D780 WeakPolarHBondContact CB-OD2 3.42Å; H757-D780 IonicContact CG-OD2 2.67Å; H757-D780 IonicContact ND1-OD1 2.81Å; H757-D780 IonicContact ND1-OD2 2.77Å; H757-D780 PolarHBondContact ND1-OD2 3.46Å; H757-C782 PolarHBondContact CE1-O 2.86Å; H757-L784 WeakPolarHBondContact CD2-CD1 3.43Å; H757-L784 WeakPolarHBondContact CE1-CG 3.47Å; H757-L784 VanDerWaalsContact NE2-CD1 3.26Å; H757-L784 WeakPolarHBondContact NE2-CD1 3.46Å; H757-L784 WeakPolarHBondContact NE2-CG 3.39Å
758	G	86.2	Confident	93.4	Very high	12 Å²	12	33.5 Å²	33.5	12%	0.124	17%	0.169	C	C	.	.	S	Bend	trans	-116.9	8.1	179.3	0	0	0	0	0	113.4	C211 S232 D780	C211-G758 WeakPolarHBondContact SG-CA 3.45Å; S232-G758 PolarHBondContact OG-O 2.86Å; G758-D780 PolarHBondContact N-OD2 2.91Å
759	S	89.3	Confident	93.8	Very high	21 Å²	21	30.4 Å²	30.4	15%	0.147	16%	0.159	C	C	.	.	S	Bend	trans	-144	174.3	170.4	-166.9	0	0	0	0	108.4	C735 V761	C735-S759 WeakPolarHBondContact CA-O 3.46Å; C735-S759 WeakPolarHBondContact CB-O 3.44Å; C735-S759 VanDerWaalsContact SG-CA 3.53Å; C735-S759 PolarHBondContact SG-O 3.27Å; S759-V761 PolarHBondContact O-N 3.15Å
760	H	91.2	Very high	94	Very high	30 Å²	30	30.7 Å²	30.7	14%	0.139	16%	0.159	C	C	.	.			trans	-45.4	131.9	171.6	55	-77.2	0	0	0	112	E518 D733 T762 G777	E518-H760 IonicContact OE1-CE1 2.93Å; E518-H760 PolarHBondContact OE1-CE1 3.48Å; E518-H760 IonicContact OE1-NE2 3.53Å; E518-H760 PolarHBondContact OE1-NE2 3.38Å; D733-H760 VanDerWaalsContact OD1-CB 3.31Å; D733-H760 WeakPolarHBondContact OD1-CB 3.31Å; H760-T762 WeakPolarHBondContact CD2-CG2 3.3Å; H760-T762 PolarHBondContact O-N 3.24Å; H760-G777 CarbonylContact O-C 3.59Å; H760-G777 VanDerWaalsContact O-C 3.3Å
761	V	96.3	Very high	94	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.158	C	C	.	.			trans	-80.9	113.4	174.9	-170.1	0	0	0	0	106.3	N717 A731 D732 V737 H757 S759 V764 I776	N717-V761 VanDerWaalsContact CB-O 3.27Å; N717-V761 WeakPolarHBondContact CB-O 3.48Å; N717-V761 PolarHBondContact ND2-O 3.14Å; A731-V761 HydrophobicContact CB-CB 3.8Å; A731-V761 HydrophobicContact CB-CG1 3.58Å; A731-V761 WeakPolarHBondContact CB-O 3.17Å; D732-V761 PolarHBondContact O-N 2.85Å; V737-V761 HydrophobicContact CG2-CG1 4.13Å; V737-V761 HydrophobicContact CG2-CG2 4.41Å; H757-V761 HydrophobicContact CB-CG2 3.94Å; H757-V761 VanDerWaalsContact CD2-CG2 3.44Å; H757-V761 WeakPolarHBondContact CD2-CG2 3.33Å; S759-V761 PolarHBondContact O-N 3.15Å; V761-V764 HydrophobicContact CG1-CG1 4.38Å; V761-I776 WeakPolarHBondContact CA-O 3.5Å; V761-I776 WeakPolarHBondContact CG1-O 3.13Å
762	T	96.8	Very high	94	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.012	16%	0.155	C	C	.	.			trans	-85.2	-31.3	-171.3	45.1	0	0	0	0	112.5	M519 W520 H760 I776 G778	M519-T762 VanDerWaalsContact O-CB 3.3Å; M519-T762 WeakPolarHBondContact O-CB 3.24Å; M519-T762 WeakPolarHBondContact O-CG2 3.3Å; M519-T762 PolarHBondContact O-OG1 2.86Å; W520-T762 HydrophobicContact CD2-CG2 3.75Å; W520-T762 HydrophobicContact CE3-CG2 3.89Å; W520-T762 HydrophobicContact CG-CG2 4.4Å; W520-T762 HydrophobicContact CH2-CG2 3.88Å; W520-T762 HydrophobicContact CZ2-CG2 3.73Å; W520-T762 HydrophobicContact CZ3-CG2 3.95Å; H760-T762 WeakPolarHBondContact CD2-CG2 3.3Å; H760-T762 PolarHBondContact O-N 3.24Å; T762-I776 PolarHBondContact N-O 2.99Å; T762-I776 WeakPolarHBondContact OG1-CD1 3.28Å; T762-I776 WeakPolarHBondContact OG1-CG1 3.44Å; T762-I776 PolarHBondContact OG1-O 2.89Å; T762-G778 PolarHBondContact OG1-N 2.72Å
763	N	97.6	Very high	94	Very high	40 Å²	40	28.3 Å²	28.3	21%	0.214	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	152.9	-178	-145.2	-25.8	0	0	0	112.9	W520 L522 A718 S775 I776	W520-N763 PolarHBondContact O-ND2 2.56Å; W520-N763 VanDerWaalsContact O-ND2 3.08Å; L522-N763 HydrophobicContact CB-CB 4.03Å; L522-N763 HydrophobicContact CD2-CB 4.32Å; A718-N763 HydrophobicContact CB-CB 4.45Å; N763-S775 WeakPolarHBondContact O-CA 3.45Å; N763-I776 HydrophobicContact CB-CD1 3.64Å; N763-I776 HydrophobicContact CB-CG1 3.55Å; N763-I776 PolarHBondContact O-N 3.31Å
764	V	97.8	Very high	94.2	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.012	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	139.7	175.4	-79	0	0	0	0	110.1	A718 C720 A729 A731 V737 V761 L773 L774	A718-V764 HydrophobicContact CB-CG2 4.18Å; C720-V764 HydrophobicContact CB-CG2 4.28Å; C720-V764 VanDerWaalsContact CB-O 3.27Å; C720-V764 WeakPolarHBondContact CB-O 3.04Å; A729-V764 HydrophobicContact CB-CG2 4.39Å; A731-V764 HydrophobicContact CB-CB 4.45Å; A731-V764 HydrophobicContact CB-CG1 3.84Å; A731-V764 HydrophobicContact CB-CG2 3.98Å; V737-V764 HydrophobicContact CG1-CG1 4.27Å; V737-V764 HydrophobicContact CG2-CG1 4.31Å; V761-V764 HydrophobicContact CG1-CG1 4.38Å; V764-L773 HydrophobicContact CB-CD1 4.37Å; V764-L774 CarbonylContact C-O 3.55Å; V764-L774 VanDerWaalsContact CA-O 3.23Å; V764-L774 WeakPolarHBondContact CA-O 3.19Å
765	C	97.7	Very high	94.4	Very high	18 Å²	18	21.3 Å²	21.3	12%	0.122	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	132.5	179.5	-164.2	0	0	0	0	111.8	L522 T524 L774	L522-C765 HydrophobicContact CD2-CB 3.72Å; L522-C765 HydrophobicContact CG-CB 3.98Å; T524-C765 HydrophobicContact CG2-CB 4.13Å; T524-C765 PolarHBondContact OG1-SG 3.06Å; C765-L774 PolarHBondContact N-O 3.24Å; C765-L774 PolarHBondContact O-N 2.83Å
766	F	97.8	Very high	94.7	Very high	1 Å²	1	16.9 Å²	16.9	0%	0.004	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	147.4	171.5	-73.4	-81	0	0	0	110.8	T524 C720 V727 A729 L739 H772 L773 V788	T524-F766 WeakPolarHBondContact CB-O 3.43Å; T524-F766 WeakPolarHBondContact CG2-O 3.3Å; T524-F766 PolarHBondContact OG1-O 2.91Å; C720-F766 HydrophobicContact CB-CD2 4.44Å; C720-F766 WeakPolarHBondContact O-CE2 3.43Å; V727-F766 HydrophobicContact CG2-CE1 4.37Å; V727-F766 HydrophobicContact CG2-CZ 3.82Å; A729-F766 HydrophobicContact CB-CE2 3.77Å; A729-F766 HydrophobicContact CB-CZ 3.92Å; L739-F766 HydrophobicContact CD1-CZ 4.01Å; F766-H772 WeakPolarHBondContact CA-O 3.33Å; F766-L773 HydrophobicContact CD1-CB 4.08Å; F766-L773 HydrophobicContact CD1-CD1 3.84Å; F766-L773 HydrophobicContact CD2-CD1 3.83Å; F766-L773 HydrophobicContact CE1-CB 3.99Å; F766-L773 HydrophobicContact CE1-CD1 3.83Å; F766-L773 HydrophobicContact CE1-CG 4.44Å; F766-L773 HydrophobicContact CE2-CD1 3.82Å; F766-L773 HydrophobicContact CG-CD1 3.84Å; F766-L773 HydrophobicContact CZ-CD1 3.82Å; F766-V788 HydrophobicContact CD1-CG2 4.29Å; F766-V788 HydrophobicContact CE1-CG2 3.96Å
767	T	96.3	Very high	94.9	Very high	5 Å²	5	16.7 Å²	16.7	3%	0.031	9%	0.094	C	C	.	.			trans	-70.1	157.4	168.4	58.2	0	0	0	0	110.2	T545 H723 N769 D770 S771 H772 L774	T545-T767 HydrophobicContact CG2-CG2 4.3Å; H723-T767 PolarHBondContact CD2-O 3.02Å; H723-T767 PolarHBondContact NE2-O 3.43Å; T767-N769 PolarHBondContact O-N 2.68Å; T767-N769 PolarHBondContact OG1-OD1 2.73Å; T767-D770 PolarHBondContact O-N 2.68Å; T767-S771 PolarHBondContact OG1-N 3.18Å; T767-S771 PolarHBondContact OG1-OG 2.72Å; T767-H772 HydrophobicContact CG2-CB 3.82Å; T767-H772 PolarHBondContact N-O 2.8Å; T767-H772 PolarHBondContact OG1-N 3.4Å; T767-H772 VanDerWaalsContact OG1-N 3.1Å; T767-H772 PolarHBondContact OG1-O 2.86Å; T767-L774 HydrophobicContact CG2-CG 4.44Å
768	H	94.3	Very high	95	Very high	52 Å²	52	16.5 Å²	16.5	24%	0.241	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-27.1	-174.3	66.4	-84.2	0	0	0	116.5	H525 P526 Q528	H525-H768 WeakPolarHBondContact O-CB 3.41Å; P526-H768 WeakPolarHBondContact O-CB 3.06Å; Q528-H768 VanDerWaalsContact C-CE1 3.41Å; Q528-H768 PolarHBondContact O-CE1 3.09Å; Q528-H768 PolarHBondContact O-ND1 3.32Å
769	N	94.4	Very high	95.3	Very high	80 Å²	80	22.2 Å²	22.2	43%	0.428	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	9.9	-177.5	61	4.1	0	0	0	113.8	T767 S771	T767-N769 PolarHBondContact O-N 2.68Å; T767-N769 PolarHBondContact OG1-OD1 2.73Å; N769-S771 PolarHBondContact ND2-OG 3.04Å; N769-S771 PolarHBondContact O-N 3.26Å; N769-S771 WeakPolarHBondContact OD1-CB 3.15Å; N769-S771 PolarHBondContact OD1-N 3.12Å; N769-S771 PolarHBondContact OD1-OG 3.33Å
770	D	95.6	Very high	95.4	Very high	18 Å²	18	21.5 Å²	21.5	10%	0.096	11%	0.11	C	C	.	.	S	Bend	trans	55.9	14.5	-172.9	-63.1	-35.9	0	0	0	114.8	S722 H723 N724 T767 H772 V788	S722-D770 WeakPolarHBondContact CA-OD1 3.37Å; S722-D770 WeakPolarHBondContact CB-OD1 3.39Å; H723-D770 IonicContact CD2-OD1 3.76Å; H723-D770 PolarHBondContact CD2-OD1 3.2Å; H723-D770 IonicContact CG-OD1 3.8Å; H723-D770 VanDerWaalsContact N-CG 3.33Å; H723-D770 PolarHBondContact N-OD1 2.75Å; H723-D770 PolarHBondContact N-OD2 3.02Å; H723-D770 VanDerWaalsContact N-OD2 3.07Å; N724-D770 WeakPolarHBondContact CB-OD2 3.3Å; N724-D770 VanDerWaalsContact CG-OD2 3.23Å; N724-D770 PolarHBondContact N-OD2 3.21Å; T767-D770 PolarHBondContact O-N 2.68Å; D770-H772 VanDerWaalsContact C-N 3.29Å; D770-H772 PolarHBondContact O-N 3.29Å; D770-V788 WeakPolarHBondContact O-CB 3.32Å; D770-V788 WeakPolarHBondContact O-CG2 3.08Å
771	S	94.1	Very high	95.5	Very high	40 Å²	40	20.7 Å²	20.7	28%	0.28	11%	0.107	S	C	.	.	S	Bend	trans	-68.6	-32.5	179	65.5	0	0	0	0	112.1	T767 N769 V788	T767-S771 PolarHBondContact OG1-N 3.18Å; T767-S771 PolarHBondContact OG1-OG 2.72Å; N769-S771 PolarHBondContact ND2-OG 3.04Å; N769-S771 PolarHBondContact O-N 3.26Å; N769-S771 WeakPolarHBondContact OD1-CB 3.15Å; N769-S771 PolarHBondContact OD1-N 3.12Å; N769-S771 PolarHBondContact OD1-OG 3.33Å; S771-V788 PolarHBondContact O-N 3.27Å
772	H	95.3	Very high	95.3	Very high	25 Å²	25	20.7 Å²	20.7	12%	0.116	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	154.5	-179.7	-62.6	79.8	0	0	0	111.8	D182 F766 T767 D770 Q785 W786	D182-H772 IonicContact OD2-NE2 3.31Å; D182-H772 PolarHBondContact OD2-NE2 3Å; F766-H772 WeakPolarHBondContact CA-O 3.33Å; T767-H772 HydrophobicContact CG2-CB 3.82Å; T767-H772 PolarHBondContact N-O 2.8Å; T767-H772 PolarHBondContact OG1-N 3.4Å; T767-H772 VanDerWaalsContact OG1-N 3.1Å; T767-H772 PolarHBondContact OG1-O 2.86Å; D770-H772 VanDerWaalsContact C-N 3.29Å; D770-H772 PolarHBondContact O-N 3.29Å; H772-Q785 HydrophobicContact CB-CG 4.14Å; H772-Q785 PolarHBondContact CD2-NE2 2.81Å; H772-W786 CarbonylContact C-O 3.54Å; H772-W786 WeakPolarHBondContact CA-O 3.43Å; H772-W786 WeakPolarHBondContact CB-O 3.46Å
773	L	96.9	Very high	95.2	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138	163.3	-179	75.7	0	0	0	108.1	L179 A729 V737 V764 F766 Q785 W786	L179-L773 HydrophobicContact CD1-CD2 3.49Å; L179-L773 VanDerWaalsContact CD1-CD2 3.49Å; L179-L773 HydrophobicContact CD2-CB 4.2Å; L179-L773 HydrophobicContact CD2-CD2 4.43Å; A729-L773 HydrophobicContact CB-CD1 3.54Å; A729-L773 HydrophobicContact CB-CD2 3.6Å; A729-L773 HydrophobicContact CB-CG 4.24Å; V737-L773 HydrophobicContact CG1-CD2 3.8Å; V764-L773 HydrophobicContact CB-CD1 4.37Å; F766-L773 HydrophobicContact CD1-CB 4.08Å; F766-L773 HydrophobicContact CD1-CD1 3.84Å; F766-L773 HydrophobicContact CD2-CD1 3.83Å; F766-L773 HydrophobicContact CE1-CB 3.99Å; F766-L773 HydrophobicContact CE1-CD1 3.83Å; F766-L773 HydrophobicContact CE1-CG 4.44Å; F766-L773 HydrophobicContact CE2-CD1 3.82Å; F766-L773 HydrophobicContact CG-CD1 3.84Å; F766-L773 HydrophobicContact CZ-CD1 3.82Å; L773-Q785 CarbonylContact O-C 3.55Å; L773-W786 HydrophobicContact CB-CB 4.23Å; L773-W786 PolarHBondContact N-O 2.54Å; L773-W786 VanDerWaalsContact O-CD1 3.26Å; L773-W786 PolarHBondContact O-N 2.8Å
774	L	97.3	Very high	95.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	139.6	170.7	-57.5	176.8	0	0	0	109.1	L522 T524 F531 T545 V764 C765 T767 L784 Q785	L522-L774 HydrophobicContact CD1-CB 4.3Å; L522-L774 HydrophobicContact CD1-CD1 4.27Å; L522-L774 HydrophobicContact CD2-CB 4.12Å; T524-L774 HydrophobicContact CG2-CD1 3.67Å; F531-L774 HydrophobicContact CB-CD1 3.45Å; F531-L774 VanDerWaalsContact CB-CD1 3.45Å; F531-L774 HydrophobicContact CD1-CD1 3.6Å; F531-L774 HydrophobicContact CD1-CD2 4.47Å; F531-L774 HydrophobicContact CD2-CD1 3.68Å; F531-L774 HydrophobicContact CE1-CD1 4.16Å; F531-L774 HydrophobicContact CE1-CD2 4.31Å; F531-L774 HydrophobicContact CE2-CD1 4.26Å; F531-L774 HydrophobicContact CG-CD1 3.3Å; F531-L774 HydrophobicContact CZ-CD1 4.47Å; T545-L774 HydrophobicContact CG2-CD2 4.46Å; V764-L774 CarbonylContact C-O 3.55Å; V764-L774 VanDerWaalsContact CA-O 3.23Å; V764-L774 WeakPolarHBondContact CA-O 3.19Å; C765-L774 PolarHBondContact N-O 3.24Å; C765-L774 PolarHBondContact O-N 2.83Å; T767-L774 HydrophobicContact CG2-CG 4.44Å; L774-L784 CarbonylContact C-O 3.58Å; L774-L784 WeakPolarHBondContact CA-O 3.48Å; L774-Q785 HydrophobicContact CD2-CB 3.67Å; L774-Q785 HydrophobicContact CD2-CG 3.8Å
775	S	97.1	Very high	94.9	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	145.9	169.8	71.3	0	0	0	0	111.7	H757 N763 I783 L784 W786	H757-S775 PolarHBondContact NE2-OG 3.39Å; N763-S775 WeakPolarHBondContact O-CA 3.45Å; S775-I783 WeakPolarHBondContact O-CA 3.35Å; S775-L784 PolarHBondContact N-O 3.38Å; S775-L784 PolarHBondContact O-N 2.9Å; S775-L784 WeakPolarHBondContact OG-CB 3.22Å; S775-W786 PolarHBondContact OG-NE1 3.25Å
776	I	96.6	Very high	94.8	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	137.8	-179.9	55.6	161	0	0	0	110.8	M519 L522 T533 H757 V761 T762 N763 I783	M519-I776 HydrophobicContact CB-CD1 4.07Å; M519-I776 HydrophobicContact CE-CB 4.06Å; M519-I776 HydrophobicContact CE-CG2 4.43Å; L522-I776 HydrophobicContact CB-CD1 4Å; L522-I776 HydrophobicContact CB-CG1 4.34Å; L522-I776 HydrophobicContact CD1-CG2 4.27Å; L522-I776 HydrophobicContact CD2-CG1 4.41Å; L522-I776 HydrophobicContact CD2-CG2 4.34Å; T533-I776 HydrophobicContact CG2-CG2 4.27Å; H757-I776 VanDerWaalsContact CE1-C 3.45Å; V761-I776 WeakPolarHBondContact CA-O 3.5Å; V761-I776 WeakPolarHBondContact CG1-O 3.13Å; T762-I776 PolarHBondContact N-O 2.99Å; T762-I776 WeakPolarHBondContact OG1-CD1 3.28Å; T762-I776 WeakPolarHBondContact OG1-CG1 3.44Å; T762-I776 PolarHBondContact OG1-O 2.89Å; N763-I776 HydrophobicContact CB-CD1 3.64Å; N763-I776 HydrophobicContact CB-CG1 3.55Å; N763-I776 PolarHBondContact O-N 3.31Å; I776-I783 HydrophobicContact CG2-CB 4.43Å; I776-I783 HydrophobicContact CG2-CG1 4.09Å; I776-I783 HydrophobicContact CG2-CG2 4.06Å
777	G	92.9	Very high	94.6	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.108	C	C	.	.			trans	-104.7	36.6	-167.2	0	0	0	0	0	116	H757 H760 K779 D780 C782	H757-G777 WeakPolarHBondContact CE1-CA 3.42Å; H757-G777 PolarHBondContact CE1-N 2.9Å; H757-G777 WeakPolarHBondContact ND1-CA 3.12Å; H760-G777 CarbonylContact O-C 3.59Å; H760-G777 VanDerWaalsContact O-C 3.3Å; G777-K779 PolarHBondContact O-N 2.9Å; G777-D780 VanDerWaalsContact C-OD1 3.31Å; G777-D780 WeakPolarHBondContact CA-OD1 3.45Å; G777-D780 PolarHBondContact O-N 3.41Å; G777-C782 PolarHBondContact N-O 3.09Å
778	G	93.8	Very high	94.5	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	47.4	-112.1	174.9	0	0	0	0	0	112.6	E518 M519 T762 D780 T781	E518-G778 WeakPolarHBondContact CA-O 3.41Å; M519-G778 PolarHBondContact N-O 3.3Å; T762-G778 PolarHBondContact OG1-N 2.72Å; G778-D780 VanDerWaalsContact C-N 3.35Å; G778-D780 PolarHBondContact O-N 2.98Å; G778-T781 PolarHBondContact O-N 3.03Å
779	K	92.8	Very high	94.4	Very high	132 Å²	132	22 Å²	22	57%	0.574	11%	0.112	S	C	*	.	G	3₁₀ helix	trans	-74.4	-15.8	-177.6	-65.2	176.7	179.3	169	0	115.3	E518 G777 T781	E518-K779 HydrophobicContact CB-CG 4.16Å; E518-K779 HydrophobicContact CG-CG 4Å; E518-K779 WeakPolarHBondContact OE2-CE 3.45Å; G777-K779 PolarHBondContact O-N 2.9Å; K779-T781 PolarHBondContact O-N 3.5Å
780	D	90.9	Very high	93.5	Very high	7 Å²	7	20.8 Å²	20.8	4%	0.037	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-75.7	-10.1	174.1	77.8	17.5	0	0	0	112.5	A210 H757 G758 G777 G778 C782	A210-D780 HydrophobicContact CB-CB 3.91Å; A210-D780 WeakPolarHBondContact CB-OD2 3.12Å; H757-D780 WeakPolarHBondContact CA-OD2 3.47Å; H757-D780 VanDerWaalsContact CB-OD2 3.27Å; H757-D780 WeakPolarHBondContact CB-OD2 3.42Å; H757-D780 IonicContact CG-OD2 2.67Å; H757-D780 IonicContact ND1-OD1 2.81Å; H757-D780 IonicContact ND1-OD2 2.77Å; H757-D780 PolarHBondContact ND1-OD2 3.46Å; G758-D780 PolarHBondContact N-OD2 2.91Å; G777-D780 VanDerWaalsContact C-OD1 3.31Å; G777-D780 WeakPolarHBondContact CA-OD1 3.45Å; G777-D780 PolarHBondContact O-N 3.41Å; G778-D780 VanDerWaalsContact C-N 3.35Å; G778-D780 PolarHBondContact O-N 2.98Å; D780-C782 PolarHBondContact O-N 3.19Å; D780-C782 VanDerWaalsContact O-N 3.15Å; D780-C782 WeakPolarHBondContact OD1-CA 3.22Å; D780-C782 WeakPolarHBondContact OD1-CB 3.08Å; D780-C782 PolarHBondContact OD1-N 2.81Å
781	T	92.6	Very high	91.7	Very high	13 Å²	13	22.1 Å²	22.1	8%	0.08	14%	0.136	C	C	.	.			trans	60.1	15.5	177.9	63.6	0	0	0	0	114.8	H515 G778 K779	H515-T781 WeakPolarHBondContact O-CB 3.37Å; G778-T781 PolarHBondContact O-N 3.03Å; K779-T781 PolarHBondContact O-N 3.5Å
782	C	92.9	Very high	89.1	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	16%	0.158	C	C	.	.			trans	-99.1	139.4	-174.4	-159.5	0	0	0	0	112.1	I209 A210 M519 H757 G777 D780 L784	I209-C782 HydrophobicContact CD1-CB 3.91Å; I209-C782 HydrophobicContact CG1-CB 3.98Å; I209-C782 HydrophobicContact CG2-CB 4.41Å; I209-C782 VanDerWaalsContact CG2-SG 3.52Å; A210-C782 HydrophobicContact CB-CB 4.1Å; M519-C782 VanDerWaalsContact CE-O 3.24Å; M519-C782 WeakPolarHBondContact CE-O 3.36Å; H757-C782 PolarHBondContact CE1-O 2.86Å; G777-C782 PolarHBondContact N-O 3.09Å; D780-C782 PolarHBondContact O-N 3.19Å; D780-C782 VanDerWaalsContact O-N 3.15Å; D780-C782 WeakPolarHBondContact OD1-CA 3.22Å; D780-C782 WeakPolarHBondContact OD1-CB 3.08Å; D780-C782 PolarHBondContact OD1-N 2.81Å; C782-L784 HydrophobicContact CB-CD2 4.2Å; C782-L784 WeakPolarHBondContact SG-CD2 3.39Å
783	I	95.3	Very high	86.4	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	129.8	170.9	-47.4	171.4	0	0	0	108.3	Y186 M519 F531 T533 W543 S775 I776	Y186-I783 HydrophobicContact CD2-CB 4.01Å; Y186-I783 HydrophobicContact CD2-CG2 4.13Å; Y186-I783 HydrophobicContact CG-CB 4.4Å; Y186-I783 PolarHBondContact N-O 2.9Å; Y186-I783 PolarHBondContact O-N 2.65Å; M519-I783 HydrophobicContact CE-CG1 4.11Å; M519-I783 HydrophobicContact SD-CG1 4.14Å; F531-I783 HydrophobicContact CE2-CD1 4.31Å; F531-I783 HydrophobicContact CE2-CG2 3.92Å; F531-I783 HydrophobicContact CZ-CG2 4.07Å; T533-I783 HydrophobicContact CG2-CD1 3.87Å; W543-I783 HydrophobicContact CZ2-CD1 3.88Å; S775-I783 WeakPolarHBondContact O-CA 3.35Å; I776-I783 HydrophobicContact CG2-CB 4.43Å; I776-I783 HydrophobicContact CG2-CG1 4.09Å; I776-I783 HydrophobicContact CG2-CG2 4.06Å
784	L	94.5	Very high	83.3	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	117	-178.4	-49	-171.1	0	0	0	110.8	L184 H757 L774 S775 C782 W786	L184-L784 VanDerWaalsContact CD1-CA 3.43Å; L184-L784 HydrophobicContact CD1-CB 3.64Å; L184-L784 HydrophobicContact CD2-CB 3.45Å; L184-L784 VanDerWaalsContact CD2-CB 3.45Å; L184-L784 HydrophobicContact CD2-CD1 3.92Å; L184-L784 HydrophobicContact CD2-CD2 3Å; L184-L784 HydrophobicContact CD2-CG 3.49Å; L184-L784 VanDerWaalsContact CD2-CG 3.49Å; L184-L784 VanDerWaalsContact CG-CA 3.49Å; L184-L784 HydrophobicContact CG-CB 3.74Å; L184-L784 HydrophobicContact CG-CD2 3.98Å; L184-L784 HydrophobicContact CG-CG 4.28Å; H757-L784 WeakPolarHBondContact CD2-CD1 3.43Å; H757-L784 WeakPolarHBondContact CE1-CG 3.47Å; H757-L784 VanDerWaalsContact NE2-CD1 3.26Å; H757-L784 WeakPolarHBondContact NE2-CD1 3.46Å; H757-L784 WeakPolarHBondContact NE2-CG 3.39Å; L774-L784 CarbonylContact C-O 3.58Å; L774-L784 WeakPolarHBondContact CA-O 3.48Å; S775-L784 PolarHBondContact N-O 3.38Å; S775-L784 PolarHBondContact O-N 2.9Å; S775-L784 WeakPolarHBondContact OG-CB 3.22Å; C782-L784 HydrophobicContact CB-CD2 4.2Å; C782-L784 WeakPolarHBondContact SG-CD2 3.39Å; L784-W786 HydrophobicContact CB-CZ2 4.02Å; L784-W786 HydrophobicContact CD1-CH2 4.07Å; L784-W786 HydrophobicContact CD1-CZ2 3.43Å; L784-W786 VanDerWaalsContact CD1-CZ2 3.43Å; L784-W786 HydrophobicContact CG-CZ2 4.36Å
785	Q	94.8	Very high	80.1	Confident	1 Å²	1	41 Å²	41	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	104.9	167.4	177.9	177.8	-16.2	0	0	114.7	L184 Y186 T545 H772 L773 L774	L184-Q785 HydrophobicContact CD1-CB 4.39Å; L184-Q785 WeakPolarHBondContact CD1-O 3.35Å; Y186-Q785 PolarHBondContact OH-OE1 2.68Å; T545-Q785 PolarHBondContact O-NE2 3.41Å; T545-Q785 PolarHBondContact O-OE1 3.48Å; H772-Q785 HydrophobicContact CB-CG 4.14Å; H772-Q785 PolarHBondContact CD2-NE2 2.81Å; L773-Q785 CarbonylContact O-C 3.55Å; L774-Q785 HydrophobicContact CD2-CB 3.67Å; L774-Q785 HydrophobicContact CD2-CG 3.8Å
786	W	94.4	Very high	76.8	Confident	2 Å²	2	46 Å²	46	1%	0.008	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	129	178.9	-42	81.7	0	0	0	110.8	L179 E180 L181 V737 Y754 H772 L773 S775 L784	L179-W786 HydrophobicContact CB-CB 4.02Å; L179-W786 HydrophobicContact CB-CE3 4.31Å; L179-W786 HydrophobicContact CD1-CB 4.23Å; L179-W786 HydrophobicContact CD1-CG 4.28Å; L179-W786 HydrophobicContact CD2-CB 4.25Å; L179-W786 HydrophobicContact CG-CB 4.4Å; E180-W786 CarbonylContact O-C 3.48Å; E180-W786 WeakPolarHBondContact O-CA 3.45Å; L181-W786 HydrophobicContact CD1-CD2 3.93Å; L181-W786 HydrophobicContact CD1-CE3 3.34Å; L181-W786 HydrophobicContact CD1-CH2 3.8Å; L181-W786 HydrophobicContact CD1-CZ2 4.36Å; L181-W786 HydrophobicContact CD1-CZ3 3.25Å; V737-W786 HydrophobicContact CB-CZ2 4.44Å; V737-W786 HydrophobicContact CG2-CZ2 4.07Å; Y754-W786 HydrophobicContact CD1-CZ3 4.33Å; Y754-W786 HydrophobicContact CG-CZ3 4.21Å; H772-W786 CarbonylContact C-O 3.54Å; H772-W786 WeakPolarHBondContact CA-O 3.43Å; H772-W786 WeakPolarHBondContact CB-O 3.46Å; L773-W786 HydrophobicContact CB-CB 4.23Å; L773-W786 PolarHBondContact N-O 2.54Å; L773-W786 VanDerWaalsContact O-CD1 3.26Å; L773-W786 PolarHBondContact O-N 2.8Å; S775-W786 PolarHBondContact OG-NE1 3.25Å; L784-W786 HydrophobicContact CB-CZ2 4.02Å; L784-W786 HydrophobicContact CD1-CH2 4.07Å; L784-W786 HydrophobicContact CD1-CZ2 3.43Å; L784-W786 VanDerWaalsContact CD1-CZ2 3.43Å; L784-W786 HydrophobicContact CG-CZ2 4.36Å
787	K	93.9	Very high	73.6	Confident	84 Å²	84	57.4 Å²	57.4	37%	0.365	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	137	170.6	177.3	175.5	-172.5	170	0	110.8	L179 E180 D182 T789	L179-K787 WeakPolarHBondContact CA-O 3.27Å; E180-K787 PolarHBondContact N-O 2.82Å; E180-K787 PolarHBondContact O-N 3.21Å; D182-K787 HydrophobicContact CB-CB 3.43Å; D182-K787 VanDerWaalsContact CB-CB 3.43Å; D182-K787 HydrophobicContact CB-CD 4.07Å; D182-K787 HydrophobicContact CB-CG 4.45Å; D182-K787 WeakPolarHBondContact OD1-CD 3.12Å; D182-K787 IonicContact OD1-NZ 2.73Å; K787-T789 HydrophobicContact CD-CG2 4.47Å; K787-T789 HydrophobicContact CG-CG2 4.16Å
788	V	94.9	Very high	70.6	Confident	31 Å²	31	65.4 Å²	65.4	19%	0.188	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	117.5	176.9	-173.2	0	0	0	0	108.6	E177 R178 L179 F766 D770 S771	E177-V788 HydrophobicContact CB-CG1 3.93Å; E177-V788 HydrophobicContact CG-CG1 4.1Å; R178-V788 CarbonylContact O-C 3.57Å; R178-V788 WeakPolarHBondContact O-CA 3.26Å; L179-V788 HydrophobicContact CD2-CG2 3.87Å; F766-V788 HydrophobicContact CD1-CG2 4.29Å; F766-V788 HydrophobicContact CE1-CG2 3.96Å; D770-V788 WeakPolarHBondContact O-CB 3.32Å; D770-V788 WeakPolarHBondContact O-CG2 3.08Å; S771-V788 PolarHBondContact O-N 3.27Å
789	T	92.1	Very high	67.5	Low	29 Å²	29	71.4 Å²	71.4	18%	0.178	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	155.6	178.2	64.2	0	0	0	0	110.7	E177 R178 E180 K787	E177-T789 CarbonylContact C-O 3.54Å; E177-T789 WeakPolarHBondContact CA-O 3.45Å; R178-T789 PolarHBondContact N-O 2.92Å; R178-T789 PolarHBondContact O-N 2.93Å; E180-T789 HydrophobicContact CB-CG2 4.25Å; E180-T789 HydrophobicContact CG-CG2 4.15Å; E180-T789 PolarHBondContact OE1-OG1 2.75Å; K787-T789 HydrophobicContact CD-CG2 4.47Å; K787-T789 HydrophobicContact CG-CG2 4.16Å
790	G	75.6	Confident	64.5	Low	53 Å²	53	72.9 Å²	72.9	55%	0.546	43%	0.433	S	S	.	.			trans	96.2	8.4	173.1	0	0	0	0	0	117.4	G792	G790-G792 PolarHBondContact O-N 2.98Å
791	G	57.6	Low	61.6	Low	47 Å²	47	76.2 Å²	76.2	49%	0.485	46%	0.461	S	S	.	.			trans	-86.2	87.5	171.3	0	0	0	0	0	111.9	V793	G791-V793 PolarHBondContact O-N 3.31Å
792	G	39.7	Very low	58.6	Low	72 Å²	72	80.6 Å²	80.6	74%	0.742	49%	0.492	S	S	*	.			trans	-62.7	103.9	173.2	0	0	0	0	0	111.6	G790	G790-G792 PolarHBondContact O-N 2.98Å
793	V	36.9	Very low	55.4	Low	134 Å²	134	87.1 Å²	87.1	81%	0.812	53%	0.532	S	S	*	.			trans	-66.8	130.4	142.3	177.6	0	0	0	0	105.1	G791 E795	G791-V793 PolarHBondContact O-N 3.31Å; V793-E795 PolarHBondContact O-N 2.89Å
794	G	32.2	Very low	52.3	Low	70 Å²	70	91.9 Å²	91.9	72%	0.722	57%	0.566	S	S	*	*			trans	-55.2	103.3	175	0	0	0	0	0	109.9	S796	G794-S796 VanDerWaalsContact C-N 3.34Å; G794-S796 PolarHBondContact O-N 3.15Å
795	E	29.9	Very low	49.1	Very low	186 Å²	186	96.8 Å²	96.8	87%	0.869	60%	0.6	S	S	*	*			trans	-58.8	109.8	151.5	-79.6	-172.3	156.9	0	0	105.3	V793 R797	V793-E795 PolarHBondContact O-N 2.89Å; E795-R797 PolarHBondContact O-N 2.8Å
796	S	28.9	Very low	45.9	Very low	104 Å²	104	102.8 Å²	102.8	73%	0.727	64%	0.637	S	S	*	*			trans	-48.8	94.1	160.8	44.6	0	0	0	0	107.5	G794 E798	G794-S796 VanDerWaalsContact C-N 3.34Å; G794-S796 PolarHBondContact O-N 3.15Å; S796-E798 PolarHBondContact O-N 3.49Å
797	R	29.6	Very low	42.9	Very low	240 Å²	240	107.9 Å²	107.9	91%	0.906	67%	0.673	S	S	*	*			trans	-68.7	77.5	164.6	-158.2	174.4	177.2	-179.2	-0.8	105.5	E795 T799	E795-R797 PolarHBondContact O-N 2.8Å; R797-T799 VanDerWaalsContact C-N 3.3Å; R797-T799 PolarHBondContact O-N 3.22Å
798	E	28.4	Very low	39.8	Very low	168 Å²	168	110.8 Å²	110.8	79%	0.785	70%	0.698	S	S	*	*			trans	-62.7	103.7	164.2	-84.8	-165.1	162.7	0	0	107.1	S796 L800	S796-E798 PolarHBondContact O-N 3.49Å; E798-L800 PolarHBondContact O-N 2.8Å
799	T	30.3	Very low	36.8	Very low	125 Å²	125	115 Å²	115	77%	0.767	73%	0.728	S	S	*	*			trans	-49.9	98	161.2	-34.6	0	0	0	0	109.1	R797	R797-T799 VanDerWaalsContact C-N 3.3Å; R797-T799 PolarHBondContact O-N 3.22Å
800	L	28.2	Very low	33.8	Very low	164 Å²	164	119 Å²	119	86%	0.859	76%	0.758	S	S	*	*			trans	-108.9	91.7	150.1	-82.5	166.9	0	0	0	107.7	E798	E798-L800 PolarHBondContact O-N 2.8Å
801	A	30.3	Very low	32.1	Very low	76 Å²	76	122.6 Å²	122.6	63%	0.628	77%	0.771	S	S	*	*			trans	-64.4	134.2	166.6	0	0	0	0	0	110.2
802	S	29.8	Very low	31	Very low	105 Å²	105	129.4 Å²	129.4	73%	0.734	79%	0.79	S	S	*	*			trans	53.7	112.7	142.8	64	0	0	0	0	119.4
803	T	26.9	Very low	31	Very low	138 Å²	138	131.5 Å²	131.5	85%	0.847	79%	0.791	S	S	*	*				-146.6	107.7	129.1	19.4	0	0	0	0	110.4
804	S	28.9	Very low	31.5	Very low	101 Å²	101	131.1 Å²	131.1	71%	0.706	79%	0.791	S	S	*	*			trans	22.5	132	143.1	57	0	0	0	0	122.4
805	S	28.4	Very low	31.7	Very low	103 Å²	103	132.2 Å²	132.2	72%	0.72	79%	0.793	S	S	*	*			trans	62.8	131.5	142.1	57.6	0	0	0	0	117.7
806	T	27.7	Very low	32.1	Very low	126 Å²	126	132.7 Å²	132.7	77%	0.773	82%	0.818	S	S	*	*				-166	145.2	58.5	-35.6	0	0	0	0	110.7
807	S	30	Very low	32.2	Very low	110 Å²	110	134.2 Å²	134.2	77%	0.769	82%	0.822	S	S	*	*			trans	-55.2	139.1	172.3	49	0	0	0	0	114.9
808	T	29.1	Very low	32.4	Very low	145 Å²	145	128.6 Å²	128.6	89%	0.89	82%	0.818	S	S	*	*			trans	-111.9	121.3	160.9	31	0	0	0	0	110.7
809	S	31.3	Very low	32.6	Very low	118 Å²	118	126.4 Å²	126.4	83%	0.825	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-75.6	144.3	-175.9	47.8	0	0	0	0	113.7
810	S	30.4	Very low	32.7	Very low	115 Å²	115	126.5 Å²	126.5	80%	0.804	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-77.9	149.1	164	-47.8	0	0	0	0	111.4
811	P	40	Very low	33	Very low	127 Å²	127	124.1 Å²	124.1	83%	0.825	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-97.3	140.3	178.7	35.2	-28.5	0	0	0	112.6
812	E	33.4	Very low	33.2	Very low	190 Å²	190	127.3 Å²	127.3	89%	0.888	83%	0.833	S	S	*	*			trans	-107	155.3	160.4	-92.2	-171.3	158	0	0	110.7
813	P	41.3	Very low	33.4	Very low	116 Å²	116	128.9 Å²	128.9	75%	0.753	84%	0.84	S	S	*	*			trans	-92.7	171.4	-168.8	21.2	-2.7	0	0	0	113.5
814	P	45.7	Very low	33.9	Very low	127 Å²	127	128.2 Å²	128.2	83%	0.825	84%	0.84	S	S	*	*			trans	-88.3	155.6	-157.4	35.3	-33.8	0	0	0	113.8
815	A	36.9	Very low	34.4	Very low	92 Å²	92	130.5 Å²	130.5	76%	0.76	85%	0.851	S	S	*	*			trans	-120	138.1	156.3	0	0	0	0	0	108.9
816	S	37.9	Very low	34.9	Very low	197 Å²	197	133 Å²	133	100%	1.378	86%	0.863	S	S	*	*			trans	73.8	0	-175.3	73.8	0	0	0	0	117.7

Retrieved 816 of 816 residues in 1578.6 ms (Link to these results)

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