A0A087XNU3_POEFO Loading...

Beta-secretase 1

Responsible for the proteolytic processing of the amyloid precursor protein (APP). Cleaves at the N-terminus of the A-beta peptide sequence, between residues 671 and 672 of APP, leads to the generation and extracellular release of beta-cleaved soluble APP, and a corresponding cell-associated C-terminal fragment which is later released by gamma-secretase. Cleaves CHL1.

AlphaFold DB , UniProt , Accession A0A087XNU3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 526 aa.

Structure Viewer

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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	39.9	Very low	34.5	Very low	232 Å²	232	163.7 Å²	163.7	100%	1.143	88%	0.877	S	S	*	*				0	148.7	0	-82.3	176.4	171.1	0	0	108.3
2	T	33.3	Very low	34.4	Very low	149 Å²	149	162.4 Å²	162.4	91%	0.914	88%	0.88	S	S	*	*			trans	65.8	129	174.6	56.8	0	0	0	0	117
3	G	35.3	Very low	34	Very low	76 Å²	76	157.2 Å²	157.2	78%	0.784	87%	0.872	S	S	*	*			trans	-99.9	-175.8	-166.1	0	0	0	0	0	115.6
4	S	31.6	Very low	33.8	Very low	119 Å²	119	157.1 Å²	157.1	83%	0.832	87%	0.868	S	S	*	*			trans	-170	120	155.2	37.3	0	0	0	0	112.9
5	R	32.9	Very low	33.6	Very low	240 Å²	240	159.5 Å²	159.5	91%	0.906	87%	0.867	S	S	*	*			trans	27.4	118.4	146.4	-66.6	178.2	-177.4	-167.3	-0.4	120.7
6	L	32.3	Very low	33.3	Very low	174 Å²	174	159.8 Å²	159.8	91%	0.911	87%	0.865	S	S	*	*			trans	-104.4	136.7	135.3	-97.5	95	0	0	0	109.5
7	Q	32	Very low	32.9	Very low	170 Å²	170	164.7 Å²	164.7	79%	0.794	87%	0.868	S	S	*	*			trans	-76.6	138.5	178.1	-75.5	178.7	-42.4	0	0	112.1
8	P	36.5	Very low	32.7	Very low	125 Å²	125	162.8 Å²	162.8	81%	0.812	87%	0.865	S	S	*	*			trans	-106.1	110.2	158.9	32.9	-20.5	0	0	0	109.8
9	R	35.8	Very low	32.5	Very low	227 Å²	227	161.6 Å²	161.6	86%	0.857	86%	0.864	S	S	*	*			trans	-123.4	78.4	165.3	-87.4	-171.3	157.7	-175.5	-4.9	109.3
10	C	33.2	Very low	32.3	Very low	120 Å²	120	162.2 Å²	162.2	81%	0.811	87%	0.866	S	S	*	*	S	Bend	trans	-173.7	54.9	158.5	-103.8	0	0	0	0	110.8
11	L	37.2	Very low	32.1	Very low	169 Å²	169	160.4 Å²	160.4	89%	0.885	87%	0.865	S	S	*	*			trans	-165.9	79.6	169.2	-105.9	132	0	0	0	109.2
12	T	32.7	Very low	31.5	Very low	148 Å²	148	157.2 Å²	157.2	91%	0.908	85%	0.852	S	S	*	*			trans	179.6	95.6	156.8	15.7	0	0	0	0	109.2
13	A	29.1	Very low	31.2	Very low	94 Å²	94	159 Å²	159	78%	0.777	85%	0.85	S	S	*	*			trans	-173.3	76.3	154.9	0	0	0	0	0	109.8
14	L	31.8	Very low	30.7	Very low	157 Å²	157	161.1 Å²	161.1	82%	0.822	85%	0.852	S	S	*	*			trans	-139.9	138.9	152.3	-130.9	91.3	0	0	0	106.4
15	F	29.7	Very low	30.6	Very low	193 Å²	193	161.2 Å²	161.2	85%	0.846	85%	0.853	S	S	*	*			trans	89.1	77.2	-175.6	-64.8	-81.6	0	0	0	117.7
16	I	29	Very low	30.3	Very low	163 Å²	163	153.2 Å²	153.2	84%	0.836	85%	0.845	S	S	*	*			trans	-142.2	115.8	136.9	-58.3	-177.9	0	0	0	106.1
17	W	26.5	Very low	30.2	Very low	244 Å²	244	154.1 Å²	154.1	92%	0.924	85%	0.845	S	S	*	*			trans	179.9	96.4	146.7	-109.9	64	0	0	0	107.1
18	T	29.3	Very low	30.1	Very low	131 Å²	131	151.4 Å²	151.4	80%	0.804	84%	0.842	S	S	*	*			trans	160.5	84.4	141.8	46.7	0	0	0	0	109.2
19	T	30.1	Very low	29.8	Very low	139 Å²	139	150 Å²	150	85%	0.853	84%	0.841	S	S	*	*			trans	-168.2	88.3	157.3	17.1	0	0	0	0	108.3
20	L	27	Very low	29.5	Very low	174 Å²	174	144.7 Å²	144.7	91%	0.911	84%	0.836	S	S	*	*			trans	-161.8	75.3	159.5	-136.4	94.7	0	0	0	110.9
21	C	28.4	Very low	29.5	Very low	125 Å²	125	146.8 Å²	146.8	85%	0.845	84%	0.839	S	S	*	*			trans	-158	85.8	155.7	-94.7	0	0	0	0	106.5
22	L	28.1	Very low	29.1	Very low	164 Å²	164	144 Å²	144	86%	0.859	83%	0.834	S	S	*	*			trans	174.5	96.7	158.5	-94.3	144.6	0	0	0	107.1
23	H	26.9	Very low	29.2	Very low	188 Å²	188	143 Å²	143	87%	0.87	83%	0.833	S	S	*	*			trans	163.7	106	137.9	-92.4	76.5	0	0	0	109.4
24	S	25.9	Very low	29.2	Very low	120 Å²	120	141.9 Å²	141.9	84%	0.839	83%	0.83	S	S	*	*				158.3	107.9	126.5	-176.2	0	0	0	0	110.3
25	S	29	Very low	29.2	Very low	120 Å²	120	142.4 Å²	142.4	84%	0.839	83%	0.833	S	S	*	*			trans	-176	92.2	132.2	55.9	0	0	0	0	108.4
26	G	25.9	Very low	29.4	Very low	73 Å²	73	139.1 Å²	139.1	75%	0.753	83%	0.831	S	S	*	*			trans	-95.5	132.7	162.4	0	0	0	0	0	109.3
27	Q	29.3	Very low	29.5	Very low	193 Å²	193	142.7 Å²	142.7	90%	0.902	83%	0.834	S	S	*	*			trans	-166.4	161.9	157.2	-102.2	-146.6	-6.1	0	0	109.4
28	P	30.1	Very low	29.8	Very low	113 Å²	113	134.8 Å²	134.8	73%	0.734	82%	0.821	S	S	*	*	P	Polyproline II helix		-96.7	165.6	-117.3	30.5	-22.7	0	0	0	115.7
29	A	30.5	Very low	30.1	Very low	95 Å²	95	136 Å²	136	79%	0.785	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-62.9	142.3	174.9	0	0	0	0	0	112.8
30	P	31	Very low	30.4	Very low	115 Å²	115	139.5 Å²	139.5	75%	0.747	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-90.8	125.6	159.2	31.7	-24.8	0	0	0	110.4
31	D	31.2	Very low	30.8	Very low	165 Å²	165	137.5 Å²	137.5	88%	0.882	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-53.9	131.3	157.3	-90.2	-35.4	0	0	0	110
32	S	30.5	Very low	31	Very low	111 Å²	111	137.2 Å²	137.2	78%	0.776	81%	0.809	S	S	*	*			trans	-147.6	92.1	156.3	52	0	0	0	0	110.4
33	S	34.8	Very low	31.3	Very low	126 Å²	126	137.4 Å²	137.4	88%	0.881	81%	0.81	S	S	*	*			trans	-67.6	118.1	152.2	44.6	0	0	0	0	108.5
34	G	27.9	Very low	31.4	Very low	70 Å²	70	140.6 Å²	140.6	72%	0.722	82%	0.815	S	S	*	*			trans	-169.9	107.9	175.7	0	0	0	0	0	111.4
35	L	31.4	Very low	31.6	Very low	168 Å²	168	144.4 Å²	144.4	88%	0.88	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-57.1	142.6	171.1	-76.7	105.7	0	0	0	110.9	R37	L35-R37 PolarHBondContact O-N 3.46Å
36	P	35.6	Very low	31.5	Very low	124 Å²	124	142.1 Å²	142.1	81%	0.805	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-68.9	124.2	173.9	26.7	-30.4	0	0	0	110.4	A38	P36-A38 PolarHBondContact O-N 3.25Å
37	R	31.2	Very low	31.7	Very low	239 Å²	239	144 Å²	144	90%	0.902	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-72	118.1	171.6	-87.8	177.7	162.4	174.1	-4.7	109.7	L35	L35-R37 PolarHBondContact O-N 3.46Å
38	A	31.9	Very low	31.6	Very low	78 Å²	78	146.5 Å²	146.5	65%	0.645	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-63.6	128.5	161.1	0	0	0	0	0	109.5	P36	P36-A38 PolarHBondContact O-N 3.25Å
39	I	36.7	Very low	31.6	Very low	156 Å²	156	145.5 Å²	145.5	80%	0.8	83%	0.825	S	S	*	*			trans	-95.4	115.2	176.3	-63.7	174.9	0	0	0	107.7
40	R	36.4	Very low	31.5	Very low	212 Å²	212	150 Å²	150	80%	0.8	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-83.9	132.2	172.3	-70	-178	-177.1	-180	0.2	110
41	V	35.3	Very low	31.4	Very low	132 Å²	132	153.5 Å²	153.5	80%	0.8	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-98.8	116.6	167.8	-177.6	0	0	0	0	108.5
42	P	31.7	Very low	31.5	Very low	119 Å²	119	151.3 Å²	151.3	77%	0.773	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-83.6	129.1	177.7	29.7	-29.7	0	0	0	111.8
43	L	34.4	Very low	31.9	Very low	169 Å²	169	151.9 Å²	151.9	89%	0.885	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-78.3	135.9	165.5	-81.9	160.9	0	0	0	110.6	Q45	L43-Q45 PolarHBondContact O-N 3.42Å
44	R	29.3	Very low	31.9	Very low	255 Å²	255	151.9 Å²	151.9	96%	0.962	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-70	120.2	178.2	-124.2	176.2	179.1	-175.4	-0.6	110.1
45	Q	30.3	Very low	32.2	Very low	199 Å²	199	156.6 Å²	156.6	93%	0.93	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-80.9	134.4	170.6	-79.8	-178.8	-16.1	0	0	111.5	L43	L43-Q45 PolarHBondContact O-N 3.42Å
46	G	26.8	Very low	32.5	Very low	72 Å²	72	153.8 Å²	153.8	74%	0.742	83%	0.832	S	S	*	*			trans	-127	112.5	166.6	0	0	0	0	0	110.8
47	A	29.5	Very low	32.5	Very low	114 Å²	114	154.1 Å²	154.1	94%	0.942	83%	0.834	S	S	*	*			trans	51.3	140.9	153.3	0	0	0	0	0	122.5
48	R	27.8	Very low	32.5	Very low	245 Å²	245	147.8 Å²	147.8	93%	0.925	83%	0.833	S	S	*	*			trans	-107.5	142.8	-166.7	-178.8	-172.6	-169.9	-177.9	2.8	110.7
49	A	29.1	Very low	32.4	Very low	91 Å²	91	148.9 Å²	148.9	75%	0.752	84%	0.842	S	S	*	*			trans	-168.2	150.1	152.4	0	0	0	0	0	106.5
50	E	28.8	Very low	32	Very low	190 Å²	190	150.2 Å²	150.2	89%	0.888	85%	0.845	S	S	*	*			cis	-160.3	152.2	-24.1	-119.7	178.6	174.8	0	0	104.2
51	Q	29.3	Very low	31.6	Very low	189 Å²	189	146 Å²	146	88%	0.883	85%	0.847	S	S	*	*			trans	-80.4	150.3	-173.6	-73.3	167.2	-20.2	0	0	113.1
52	S	32.3	Very low	31.3	Very low	119 Å²	119	148.7 Å²	148.7	83%	0.832	85%	0.848	S	S	*	*			trans	-142.3	148.4	159.8	-62.5	0	0	0	0	111.1
53	P	39.1	Very low	31.2	Very low	122 Å²	122	155.2 Å²	155.2	79%	0.792	86%	0.858	S	S	*	*			trans	-95.3	173.7	-157.2	36.6	-30.1	0	0	0	114.6
54	P	35.7	Very low	30.9	Very low	126 Å²	126	150.6 Å²	150.6	82%	0.818	85%	0.851	S	S	*	*			trans	-89.8	156.1	-161.1	35	-32.4	0	0	0	114.2
55	L	32.9	Very low	30.9	Very low	170 Å²	170	150.6 Å²	150.6	89%	0.89	85%	0.851	S	S	*	*			trans	-119.2	154	173	-85.5	161	0	0	0	111.5
56	P	38.7	Very low	30.7	Very low	109 Å²	109	144.7 Å²	144.7	71%	0.708	84%	0.844	S	S	*	*			trans	-93.7	175.2	-149.4	38.9	-38.6	0	0	0	114.9
57	P	34.8	Very low	30.8	Very low	130 Å²	130	147.9 Å²	147.9	84%	0.844	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-80.9	142.1	-169.4	31.9	-31.6	0	0	0	112.6
58	A	31.3	Very low	30.8	Very low	106 Å²	106	147 Å²	147	88%	0.876	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-91.9	140.9	172.8	0	0	0	0	0	111.5
59	A	30.3	Very low	30.9	Very low	101 Å²	101	140.9 Å²	140.9	84%	0.835	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-80.8	157.7	-161.9	0	0	0	0	0	115.7
60	E	28.6	Very low	30.9	Very low	185 Å²	185	145.6 Å²	145.6	86%	0.864	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-55.7	142.3	163.4	-65	176.6	137.8	0	0	112.6
61	S	27.6	Very low	30.8	Very low	122 Å²	122	141.5 Å²	141.5	85%	0.853	84%	0.835	S	S	*	*			trans	-121.8	116.6	161.5	177.8	0	0	0	0	109.7
62	K	29.5	Very low	30.9	Very low	189 Å²	189	138.5 Å²	138.5	82%	0.822	83%	0.832	S	S	*	*			trans	-81.5	129.3	169.5	-74.9	177.1	176.3	173.4	0	110.4
63	R	29.5	Very low	30.7	Very low	256 Å²	256	137.6 Å²	137.6	97%	0.966	83%	0.832	S	S	*	*			trans	179.4	136.3	148.1	-102	170.3	-171.6	-144.9	3.2	105.7
64	G	27.5	Very low	30.3	Very low	73 Å²	73	142.9 Å²	142.9	75%	0.753	84%	0.836	S	S	*	*			cis	-178	151.1	4.1	0	0	0	0	0	106.3
65	R	29.1	Very low	30	Very low	254 Å²	254	148.5 Å²	148.5	96%	0.958	84%	0.841	S	S	*	*			trans	-64	127.9	-175.3	-158.5	176.3	-166.7	179.8	2.7	111.1
66	G	26.9	Very low	29.8	Very low	75 Å²	75	151.8 Å²	151.8	77%	0.773	84%	0.842	S	S	*	*			trans	-147.8	104.5	170.1	0	0	0	0	0	109.9
67	T	28.6	Very low	29.8	Very low	139 Å²	139	158.2 Å²	158.2	85%	0.853	85%	0.852	S	S	*	*			trans	-74.9	122.8	175.7	44	0	0	0	0	110.4
68	A	29.7	Very low	29.6	Very low	97 Å²	97	155.7 Å²	155.7	80%	0.802	85%	0.849	S	S	*	*			trans	-144.9	116.7	160	0	0	0	0	0	109.1
69	S	28.9	Very low	29.7	Very low	115 Å²	115	155.3 Å²	155.3	80%	0.804	85%	0.846	S	S	*	*			trans	-73.1	119.9	173.1	155.7	0	0	0	0	109.3
70	E	29.5	Very low	30	Very low	191 Å²	191	154.9 Å²	154.9	89%	0.893	84%	0.843	S	S	*	*			trans	-134.9	121.6	161	-79.9	-167.9	152.5	0	0	111.5
71	S	27.5	Very low	30.5	Very low	103 Å²	103	156.4 Å²	156.4	72%	0.72	85%	0.846	S	S	*	*			trans	-61.7	146.5	179.6	-50.9	0	0	0	0	112.3	A73	S71-A73 PolarHBondContact O-N 3.24Å; S71-A73 VanDerWaalsContact O-N 3.15Å
72	P	30.9	Very low	31	Very low	127 Å²	127	154.5 Å²	154.5	83%	0.825	85%	0.845	S	S	*	*			trans	-74.3	112.7	177.1	28.5	-30.5	0	0	0	110.3	R74	P72-R74 PolarHBondContact O-N 3.32Å
73	A	28.6	Very low	31.8	Very low	99 Å²	99	148.9 Å²	148.9	82%	0.818	84%	0.841	S	S	*	*			trans	-61.6	101.7	167	0	0	0	0	0	109.5	S71 R75	S71-A73 PolarHBondContact O-N 3.24Å; S71-A73 VanDerWaalsContact O-N 3.15Å; A73-R75 PolarHBondContact O-N 3.34Å
74	R	29.8	Very low	33.4	Very low	234 Å²	234	141.9 Å²	141.9	88%	0.883	83%	0.827	S	S	*	*			trans	-63.7	92.9	173.7	-158.1	174.4	-179.1	-171.3	1	108.7	P72 R76	P72-R74 PolarHBondContact O-N 3.32Å; R74-R76 PolarHBondContact O-N 2.81Å
75	R	30.5	Very low	35.9	Very low	243 Å²	243	142.8 Å²	142.8	92%	0.917	82%	0.822	S	S	*	*			trans	-60.7	100	166.1	-100.4	-178.8	167.1	-175.5	-3.6	108	A73 R77	A73-R75 PolarHBondContact O-N 3.34Å; R75-R77 PolarHBondContact O-N 3.49Å
76	R	29.2	Very low	38.8	Very low	240 Å²	240	132.1 Å²	132.1	91%	0.906	78%	0.782	S	S	*	*			trans	-58.5	104.4	167.7	-80.5	178.2	161.3	178.4	-5.1	108.1	R74 G78	R74-R76 PolarHBondContact O-N 2.81Å; R76-G78 PolarHBondContact O-N 2.84Å
77	R	38.1	Very low	41.7	Very low	244 Å²	244	133.3 Å²	133.3	92%	0.921	77%	0.774	S	S	*	*			trans	-59	118.1	157.7	-81.6	-179.8	172.6	178.4	-2.9	106.7	R75 A79	R75-R77 PolarHBondContact O-N 3.49Å; R77-A79 PolarHBondContact O-N 3.36Å; R77-A79 VanDerWaalsContact O-N 3.12Å
78	G	29.9	Very low	44.6	Very low	77 Å²	77	132.3 Å²	132.3	79%	0.794	76%	0.764	S	S	*	*			trans	-59.5	113.8	165.8	0	0	0	0	0	107.7	R76 A80	R76-G78 PolarHBondContact O-N 2.84Å; G78-A80 PolarHBondContact O-N 3.41Å; G78-A80 VanDerWaalsContact O-N 3.11Å
79	A	34.2	Very low	47.7	Very low	97 Å²	97	128.2 Å²	128.2	80%	0.802	73%	0.728	S	S	*	*			trans	-64.9	107.8	171.1	0	0	0	0	0	107.9	R77 K81	R77-A79 PolarHBondContact O-N 3.36Å; R77-A79 VanDerWaalsContact O-N 3.12Å; A79-K81 PolarHBondContact O-N 2.84Å
80	A	37	Very low	50.8	Low	93 Å²	93	125 Å²	125	77%	0.769	70%	0.702	S	S	*	*			trans	-62.1	130.5	159.1	0	0	0	0	0	107.4	G78 G82	G78-A80 PolarHBondContact O-N 3.41Å; G78-A80 VanDerWaalsContact O-N 3.11Å; A80-G82 PolarHBondContact O-N 3.3Å
81	K	38.2	Very low	53.9	Low	217 Å²	217	118.1 Å²	118.1	94%	0.943	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.4	120.4	-178.5	-74.5	173.4	171.4	177.8	0	110.4	A79	A79-K81 PolarHBondContact O-N 2.84Å
82	G	37.2	Very low	57.2	Low	81 Å²	81	113.8 Å²	113.8	84%	0.835	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.5	38.3	156.8	0	0	0	0	0	117.8	A80 V84	A80-G82 PolarHBondContact O-N 3.3Å; G82-V84 PolarHBondContact O-N 3.42Å
83	G	48	Very low	60.3	Low	71 Å²	71	107.8 Å²	107.8	73%	0.732	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-68.8	127.7	171.4	0	0	0	0	0	111.9	S85	G83-S85 PolarHBondContact O-N 3.4Å
84	V	62.9	Low	63.5	Low	109 Å²	109	106.2 Å²	106.2	66%	0.661	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-61.1	125.3	166	-178.2	0	0	0	0	107.4	G82 F86	G82-V84 PolarHBondContact O-N 3.42Å; V84-F86 HydrophobicContact CB-CE1 3.87Å; V84-F86 HydrophobicContact CB-CZ 3.91Å; V84-F86 HydrophobicContact CG1-CD1 3.95Å; V84-F86 HydrophobicContact CG1-CE1 3.44Å; V84-F86 VanDerWaalsContact CG1-CE1 3.44Å; V84-F86 HydrophobicContact CG1-CZ 4.02Å
85	S	79.1	Confident	66.5	Low	93 Å²	93	96.1 Å²	96.1	65%	0.65	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-83	120.7	178.1	-173.5	0	0	0	0	109.3	G83 V87	G83-S85 PolarHBondContact O-N 3.4Å; S85-V87 VanDerWaalsContact OG-CG2 3.32Å; S85-V87 WeakPolarHBondContact OG-CG2 3.42Å
86	F	90.1	Very high	69.5	Low	29 Å²	29	86.9 Å²	86.9	13%	0.127	51%	0.509	C	S	.	.			trans	-99.2	14.3	178.6	-55.7	-53.4	0	0	0	113.1	V84 D88 M89 I90 I262 D267	V84-F86 HydrophobicContact CB-CE1 3.87Å; V84-F86 HydrophobicContact CB-CZ 3.91Å; V84-F86 HydrophobicContact CG1-CD1 3.95Å; V84-F86 HydrophobicContact CG1-CE1 3.44Å; V84-F86 VanDerWaalsContact CG1-CE1 3.44Å; V84-F86 HydrophobicContact CG1-CZ 4.02Å; F86-D88 VanDerWaalsContact C-N 3.27Å; F86-D88 PolarHBondContact O-N 3.42Å; F86-M89 HydrophobicContact CB-CE 4.13Å; F86-M89 HydrophobicContact CD1-CE 3.37Å; F86-M89 HydrophobicContact CE1-CE 4.19Å; F86-M89 HydrophobicContact CG-CE 4.16Å; F86-M89 WeakPolarHBondContact O-CA 3.23Å; F86-M89 WeakPolarHBondContact O-CB 3.05Å; F86-M89 PolarHBondContact O-N 2.85Å; F86-I90 PolarHBondContact O-N 3.08Å; F86-I262 HydrophobicContact CB-CD1 4.45Å; F86-I262 HydrophobicContact CB-CG2 3.97Å; F86-I262 HydrophobicContact CD1-CG2 3.76Å; F86-I262 HydrophobicContact CD2-CG2 4.03Å; F86-I262 HydrophobicContact CE1-CG2 4.19Å; F86-I262 HydrophobicContact CE2-CG2 4.47Å; F86-I262 HydrophobicContact CG-CG2 3.65Å; F86-D267 HydrophobicContact CD2-CB 4.31Å
87	V	87.7	Confident	72.4	Confident	100 Å²	100	75.7 Å²	75.7	61%	0.606	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-55.7	-40.1	-171.1	172.8	0	0	0	0	112.4	S85 M89 I90	S85-V87 VanDerWaalsContact OG-CG2 3.32Å; S85-V87 WeakPolarHBondContact OG-CG2 3.42Å; V87-M89 PolarHBondContact O-N 2.96Å; V87-I90 PolarHBondContact O-N 3.31Å
88	D	89	Confident	74.8	Confident	119 Å²	119	65.5 Å²	65.5	64%	0.636	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-72.1	-11.7	180	-62	-33.6	0	0	0	113.6	F86 H176	F86-D88 VanDerWaalsContact C-N 3.27Å; F86-D88 PolarHBondContact O-N 3.42Å; D88-H176 WeakPolarHBondContact O-CB 3.07Å
89	M	95	Very high	77.8	Confident	11 Å²	11	63.6 Å²	63.6	5%	0.054	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-101.8	-4.6	177.9	-68	-173.1	-76.4	0	0	113.2	F86 V87 N92 H176 I262 I263	F86-M89 HydrophobicContact CB-CE 4.13Å; F86-M89 HydrophobicContact CD1-CE 3.37Å; F86-M89 HydrophobicContact CE1-CE 4.19Å; F86-M89 HydrophobicContact CG-CE 4.16Å; F86-M89 WeakPolarHBondContact O-CA 3.23Å; F86-M89 WeakPolarHBondContact O-CB 3.05Å; F86-M89 PolarHBondContact O-N 2.85Å; V87-M89 PolarHBondContact O-N 2.96Å; M89-N92 PolarHBondContact O-ND2 3.42Å; M89-N92 PolarHBondContact O-OD1 2.85Å; M89-H176 WeakPolarHBondContact CG-O 3.41Å; M89-I262 HydrophobicContact CB-CD1 3.62Å; M89-I262 HydrophobicContact CE-CG2 4.05Å; M89-I262 WeakPolarHBondContact O-CD1 3.46Å; M89-I263 HydrophobicContact SD-CB 3.98Å; M89-I263 PolarHBondContact SD-N 3.48Å
90	I	94.8	Very high	80.6	Confident	47 Å²	47	59.3 Å²	59.3	24%	0.241	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	135	170	-56.6	-66.2	0	0	0	108.3	F86 V87 N92 I262 D267 L270	F86-I90 PolarHBondContact O-N 3.08Å; V87-I90 PolarHBondContact O-N 3.31Å; I90-N92 PolarHBondContact O-N 3.46Å; I90-I262 HydrophobicContact CD1-CD1 4.03Å; I90-D267 HydrophobicContact CD1-CB 4.19Å; I90-L270 HydrophobicContact CD1-CD1 3.96Å; I90-L270 HydrophobicContact CD1-CD2 3.72Å; I90-L270 HydrophobicContact CD1-CG 4Å
91	D	94.6	Very high	83.5	Confident	47 Å²	47	55 Å²	55	25%	0.251	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	29.1	178.5	-59.1	-20.1	0	0	0	113.3	R94 Q248 V257 G259 S260	D91-R94 PolarHBondContact O-NH1 2.84Å; D91-Q248 PolarHBondContact OD2-NE2 3.47Å; D91-V257 HydrophobicContact CB-CB 4.5Å; D91-V257 HydrophobicContact CB-CG1 3.54Å; D91-V257 HydrophobicContact CB-CG2 4.1Å; D91-V257 WeakPolarHBondContact OD1-CG1 3.19Å; D91-G259 CarbonylContact C-O 3.58Å; D91-G259 VanDerWaalsContact CA-O 3.25Å; D91-G259 WeakPolarHBondContact CA-O 3.4Å; D91-S260 PolarHBondContact N-OG 2.69Å
92	N	96.1	Very high	86.4	Confident	12 Å²	12	45.7 Å²	45.7	6%	0.064	30%	0.297	C	S	.	.			trans	-86.2	-4.8	-179.3	72.2	-5.1	0	0	0	114.2	M89 I90 H176 G259 S260 M261	M89-N92 PolarHBondContact O-ND2 3.42Å; M89-N92 PolarHBondContact O-OD1 2.85Å; I90-N92 PolarHBondContact O-N 3.46Å; N92-H176 HydrophobicContact CB-CB 3.72Å; N92-H176 PolarHBondContact ND2-O 2.96Å; N92-G259 PolarHBondContact N-O 2.82Å; N92-S260 WeakPolarHBondContact OD1-CA 3.42Å; N92-M261 PolarHBondContact ND2-O 3.48Å; N92-M261 PolarHBondContact OD1-N 2.8Å
93	L	97.3	Very high	89.3	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	152.2	175.1	-56.7	-178	0	0	0	112.2	Y102 V103 V118 L241 G258 G259 M261	L93-Y102 WeakPolarHBondContact CA-O 3.22Å; L93-V103 HydrophobicContact CD2-CB 3.78Å; L93-V103 HydrophobicContact CD2-CG2 4.34Å; L93-V118 HydrophobicContact CD2-CG2 3.93Å; L93-L241 HydrophobicContact CD1-CD2 3.8Å; L93-G258 PolarHBondContact O-N 3.12Å; L93-G259 WeakPolarHBondContact CB-O 3.44Å; L93-G259 PolarHBondContact N-O 2.99Å; L93-M261 HydrophobicContact CD1-CB 4.2Å; L93-M261 HydrophobicContact CD2-CB 3.86Å; L93-M261 HydrophobicContact CG-CB 4.19Å
94	R	95.1	Very high	91.7	Very high	66 Å²	66	40.5 Å²	40.5	25%	0.249	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	169.3	168.9	-62.7	-65.3	-178.9	-80.8	0.6	109	D91 Y101 Y102 S255 T256	D91-R94 PolarHBondContact O-NH1 2.84Å; R94-Y101 CarbonylContact O-C 3.55Å; R94-Y101 VanDerWaalsContact O-CA 3.3Å; R94-Y101 WeakPolarHBondContact O-CA 3.32Å; R94-Y102 HydrophobicContact CB-CD2 4.29Å; R94-Y102 HydrophobicContact CB-CE1 3.94Å; R94-Y102 HydrophobicContact CB-CE2 3.64Å; R94-Y102 VanDerWaalsContact CB-CZ 3.44Å; R94-Y102 WeakPolarHBondContact CB-OH 3.19Å; R94-Y102 HydrophobicContact CG-CE2 4.33Å; R94-Y102 PolarHBondContact N-O 3.31Å; R94-Y102 PolarHBondContact O-N 2.95Å; R94-S255 WeakPolarHBondContact CD-OG 3.29Å; R94-S255 PolarHBondContact NE-OG 3.12Å; R94-T256 WeakPolarHBondContact CD-O 3.25Å
95	G	93.1	Very high	93.4	Very high	22 Å²	22	35.3 Å²	35.3	23%	0.227	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	106.9	-166.4	179.4	0	0	0	0	0	113
96	K	92.7	Very high	94.3	Very high	50 Å²	50	31.1 Å²	31.1	22%	0.217	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	153	-175.2	55.4	-175	174.1	-178.9	0	110.1	G98 Q99 G100 E397	K96-G98 PolarHBondContact O-N 3.08Å; K96-Q99 HydrophobicContact CG-CB 4.44Å; K96-Q99 PolarHBondContact O-N 3.38Å; K96-G100 PolarHBondContact N-O 3.41Å; K96-G100 CarbonylContact O-C 3.56Å; K96-G100 PolarHBondContact O-N 3.42Å; K96-E397 IonicContact NZ-OE2 3.47Å; K96-E397 PolarHBondContact NZ-OE2 3.39Å
97	S	90.4	Very high	94.7	Very high	4 Å²	4	29.7 Å²	29.7	3%	0.028	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-38	-177	40	0	0	0	0	115.4	Q99 T319 E426	S97-Q99 VanDerWaalsContact C-N 3.27Å; S97-Q99 PolarHBondContact O-N 3.46Å; S97-T319 WeakPolarHBondContact O-CB 3.4Å; S97-T319 WeakPolarHBondContact O-CG2 3.39Å; S97-T319 PolarHBondContact O-OG1 3.11Å; S97-E426 WeakPolarHBondContact CB-OE1 3.01Å; S97-E426 PolarHBondContact OG-OE1 3.25Å
98	G	88.6	Confident	95.3	Very high	30 Å²	30	25.2 Å²	25.2	31%	0.309	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-16.5	-179.5	0	0	0	0	0	115.6	K96	K96-G98 PolarHBondContact O-N 3.08Å
99	Q	92.1	Very high	95.7	Very high	38 Å²	38	21 Å²	21	18%	0.178	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126	-10.8	179.8	-70.9	176.8	-39.8	0	0	113.1	K96 S97 I197 N198 W202	K96-Q99 HydrophobicContact CG-CB 4.44Å; K96-Q99 PolarHBondContact O-N 3.38Å; S97-Q99 VanDerWaalsContact C-N 3.27Å; S97-Q99 PolarHBondContact O-N 3.46Å; Q99-I197 HydrophobicContact CG-CG2 4.27Å; Q99-N198 PolarHBondContact NE2-O 3.14Å; Q99-W202 PolarHBondContact O-NE1 3.32Å
100	G	94.8	Very high	95.9	Very high	7 Å²	7	25 Å²	25	7%	0.072	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	96	154.7	-175.7	0	0	0	0	0	113.3	K96	K96-G100 PolarHBondContact N-O 3.41Å; K96-G100 CarbonylContact O-C 3.56Å; K96-G100 PolarHBondContact O-N 3.42Å
101	Y	97.7	Very high	96.1	Very high	1 Å²	1	27.2 Å²	27.2	0%	0.004	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	134.9	174.9	-70.4	-87.4	0	0	0	109.9	R94 L117 V118 L241 C242 G243 G258 A422 E426	R94-Y101 CarbonylContact O-C 3.55Å; R94-Y101 VanDerWaalsContact O-CA 3.3Å; R94-Y101 WeakPolarHBondContact O-CA 3.32Å; Y101-L117 WeakPolarHBondContact O-CD1 3.28Å; Y101-V118 PolarHBondContact O-N 3.35Å; Y101-L241 HydrophobicContact CD1-CD2 4.37Å; Y101-L241 HydrophobicContact CD2-CB 4.15Å; Y101-L241 HydrophobicContact CD2-CD1 3.8Å; Y101-L241 HydrophobicContact CD2-CD2 3.95Å; Y101-L241 HydrophobicContact CD2-CG 4.18Å; Y101-L241 HydrophobicContact CE1-CB 4.48Å; Y101-L241 HydrophobicContact CE2-CB 3.87Å; Y101-L241 HydrophobicContact CE2-CD1 4.07Å; Y101-L241 HydrophobicContact CE2-CG 4.37Å; Y101-L241 HydrophobicContact CG-CD2 3.85Å; Y101-C242 WeakPolarHBondContact CE1-O 3.37Å; Y101-C242 PolarHBondContact OH-O 2.9Å; Y101-G243 WeakPolarHBondContact OH-CA 3.28Å; Y101-G243 PolarHBondContact OH-N 3.41Å; Y101-G258 VanDerWaalsContact CD1-O 3.27Å; Y101-G258 WeakPolarHBondContact CD1-O 3.18Å; Y101-G258 WeakPolarHBondContact CE1-O 3.28Å; Y101-A422 HydrophobicContact CE2-CB 4.41Å; Y101-E426 HydrophobicContact CE2-CG 4.48Å; Y101-E426 PolarHBondContact OH-OE1 2.84Å
102	Y	98.3	Very high	96.3	Very high	22 Å²	22	26.3 Å²	26.3	9%	0.086	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	154.9	-174.8	65	-96.7	0	0	0	112.4	L93 R94 N115 I116 S200 N201 W202	L93-Y102 WeakPolarHBondContact CA-O 3.22Å; R94-Y102 HydrophobicContact CB-CD2 4.29Å; R94-Y102 HydrophobicContact CB-CE1 3.94Å; R94-Y102 HydrophobicContact CB-CE2 3.64Å; R94-Y102 VanDerWaalsContact CB-CZ 3.44Å; R94-Y102 WeakPolarHBondContact CB-OH 3.19Å; R94-Y102 HydrophobicContact CG-CE2 4.33Å; R94-Y102 PolarHBondContact N-O 3.31Å; R94-Y102 PolarHBondContact O-N 2.95Å; Y102-N115 HydrophobicContact CD2-CB 3.51Å; Y102-N115 HydrophobicContact CE2-CB 3.75Å; Y102-N115 VanDerWaalsContact CE2-CG 3.45Å; Y102-N115 HydrophobicContact CG-CB 4.24Å; Y102-I116 CarbonylContact C-O 3.58Å; Y102-I116 WeakPolarHBondContact CA-O 3.43Å; Y102-I116 VanDerWaalsContact CB-O 3.23Å; Y102-I116 WeakPolarHBondContact CB-O 3.32Å; Y102-S200 WeakPolarHBondContact CE1-O 3.28Å; Y102-N201 HydrophobicContact CE1-CB 4.1Å; Y102-W202 HydrophobicContact CD1-CB 4.15Å; Y102-W202 HydrophobicContact CG-CB 4.01Å
103	V	98.3	Very high	96.4	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	146.4	176.4	65.8	0	0	0	0	109.7	L93 M105 I116 V118 V174 M261	L93-V103 HydrophobicContact CD2-CB 3.78Å; L93-V103 HydrophobicContact CD2-CG2 4.34Å; V103-M105 HydrophobicContact CG1-CG 4.03Å; V103-M105 HydrophobicContact CG1-SD 4.35Å; V103-I116 PolarHBondContact N-O 3.38Å; V103-I116 PolarHBondContact O-N 3.42Å; V103-V118 HydrophobicContact CB-CG2 4.2Å; V103-V118 HydrophobicContact CG1-CG2 3.94Å; V103-V174 HydrophobicContact CG2-CG1 4.08Å; V103-M261 HydrophobicContact CB-CE 4.04Å; V103-M261 HydrophobicContact CG1-CE 3.78Å; V103-M261 HydrophobicContact CG2-CE 3.94Å
104	E	98.3	Very high	96.4	Very high	42 Å²	42	30.9 Å²	30.9	20%	0.196	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	132.1	170	-173.6	174.6	93.5	0	0	109.6	K113 P175	E104-K113 WeakPolarHBondContact OE1-CE 3.47Å; E104-K113 IonicContact OE1-NZ 2.85Å; E104-K113 PolarHBondContact OE1-NZ 3.39Å; E104-K113 IonicContact OE2-NZ 3.17Å; E104-P175 HydrophobicContact CG-CG 4.4Å; E104-P175 WeakPolarHBondContact O-CD 2.98Å
105	M	98.7	Very high	96.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	160.7	171.1	-60.2	-176.7	67.3	0	0	109.7	V103 K113 L114 I116 F125 V172 S173 V174 L206 F223	V103-M105 HydrophobicContact CG1-CG 4.03Å; V103-M105 HydrophobicContact CG1-SD 4.35Å; M105-K113 CarbonylContact O-C 3.38Å; M105-K113 WeakPolarHBondContact O-CA 3.43Å; M105-L114 PolarHBondContact N-O 2.96Å; M105-L114 PolarHBondContact O-N 2.94Å; M105-L114 VanDerWaalsContact O-O 3.08Å; M105-I116 HydrophobicContact CB-CG1 3.79Å; M105-I116 HydrophobicContact CG-CB 4.2Å; M105-I116 HydrophobicContact CG-CG1 3.81Å; M105-I116 HydrophobicContact SD-CB 3.85Å; M105-I116 HydrophobicContact SD-CG1 3.73Å; M105-I116 HydrophobicContact SD-CG2 4.02Å; M105-F125 HydrophobicContact CE-CE2 4.41Å; M105-F125 HydrophobicContact CE-CZ 4.24Å; M105-F125 HydrophobicContact SD-CE2 4.24Å; M105-F125 HydrophobicContact SD-CZ 4.5Å; M105-V172 HydrophobicContact CE-CG1 3.48Å; M105-V172 VanDerWaalsContact CE-CG1 3.48Å; M105-S173 WeakPolarHBondContact CA-O 3.46Å; M105-V174 HydrophobicContact CE-CG2 4.01Å; M105-V174 HydrophobicContact CG-CG2 4.29Å; M105-L206 HydrophobicContact CE-CD1 4.24Å; M105-L206 HydrophobicContact CE-CD2 4.48Å; M105-L206 HydrophobicContact SD-CD1 4.23Å; M105-L206 HydrophobicContact SD-CD2 3.95Å; M105-L206 HydrophobicContact SD-CG 4.49Å; M105-F223 HydrophobicContact CE-CD2 4.22Å; M105-F223 HydrophobicContact CE-CE1 4.31Å; M105-F223 HydrophobicContact CE-CE2 3.66Å; M105-F223 HydrophobicContact CE-CZ 3.71Å
106	A	98.6	Very high	96.9	Very high	5 Å²	5	27.7 Å²	27.7	4%	0.041	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	134.1	173.4	0	0	0	0	0	110.9	P111 Q112 K113 V172 S173	A106-P111 HydrophobicContact CB-CB 3.86Å; A106-Q112 WeakPolarHBondContact CA-O 3.47Å; A106-K113 HydrophobicContact CB-CG 4.48Å; A106-V172 VanDerWaalsContact O-CA 3.31Å; A106-V172 WeakPolarHBondContact O-CA 3.18Å; A106-S173 PolarHBondContact N-O 3.12Å; A106-S173 PolarHBondContact O-N 2.8Å
107	V	98.8	Very high	97.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	133.4	-179.3	-173.6	0	0	0	0	109.9	Q112 F125 Y139 D170 L171 V172 V186	V107-Q112 PolarHBondContact N-O 3.49Å; V107-Q112 VanDerWaalsContact O-CB 3.32Å; V107-Q112 WeakPolarHBondContact O-CB 3.42Å; V107-Q112 PolarHBondContact O-N 3.25Å; V107-F125 HydrophobicContact CG2-CE1 4.07Å; V107-F125 HydrophobicContact CG2-CZ 3.75Å; V107-Y139 HydrophobicContact CB-CD2 4.37Å; V107-Y139 HydrophobicContact CB-CE2 4.35Å; V107-Y139 HydrophobicContact CG1-CD2 4.12Å; V107-Y139 HydrophobicContact CG1-CE1 4.48Å; V107-Y139 HydrophobicContact CG1-CE2 3.73Å; V107-D170 HydrophobicContact CG1-CB 3.93Å; V107-L171 CarbonylContact C-O 3.59Å; V107-L171 WeakPolarHBondContact CA-O 3.5Å; V107-V172 HydrophobicContact CG1-CG2 4.44Å; V107-V172 HydrophobicContact CG2-CG2 4.43Å; V107-V186 HydrophobicContact CG1-CG2 4.39Å
108	G	98.6	Very high	97.6	Very high	5 Å²	5	25.8 Å²	25.8	5%	0.052	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.8	179.1	172.1	0	0	0	0	0	116.9	P110 P111 S144 D170 L171	G108-P110 CarbonylContact C-O 3.34Å; G108-P110 CarbonylContact O-C 3.56Å; G108-P111 VanDerWaalsContact O-CA 3.28Å; G108-P111 WeakPolarHBondContact O-CA 3.32Å; G108-S144 WeakPolarHBondContact CA-OG 3.34Å; G108-D170 VanDerWaalsContact CA-CG 3.43Å; G108-D170 WeakPolarHBondContact CA-OD1 3.37Å; G108-D170 WeakPolarHBondContact CA-OD2 3.25Å; G108-L171 PolarHBondContact N-O 3.17Å
109	S	98.5	Very high	98	Very high	32 Å²	32	24.8 Å²	24.8	22%	0.224	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.1	106.5	179.7	-58.8	0	0	0	0	111.1	S144 S145 S146	S109-S144 PolarHBondContact N-OG 3.41Å; S109-S144 WeakPolarHBondContact O-CA 3.43Å; S109-S145 WeakPolarHBondContact CB-OG 3.32Å; S109-S145 PolarHBondContact O-N 2.94Å; S109-S145 PolarHBondContact O-OG 2.85Å; S109-S146 VanDerWaalsContact CB-OG 3.28Å; S109-S146 WeakPolarHBondContact CB-OG 3.34Å; S109-S146 PolarHBondContact N-OG 3.48Å; S109-S146 PolarHBondContact OG-OG 2.74Å
110	P	98.4	Very high	98.3	Very high	93 Å²	93	23 Å²	23	60%	0.604	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	cis	-67.8	156.3	4.4	29	-36	0	0	0	113.5	G108 Q112	G108-P110 CarbonylContact C-O 3.34Å; G108-P110 CarbonylContact O-C 3.56Å; P110-Q112 PolarHBondContact O-N 2.96Å
111	P	98.4	Very high	98.5	Very high	94 Å²	94	23.2 Å²	23.2	61%	0.61	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.5	126.8	-176.1	-20.9	32.3	0	0	0	113.2	A106 G108	A106-P111 HydrophobicContact CB-CB 3.86Å; G108-P111 VanDerWaalsContact O-CA 3.28Å; G108-P111 WeakPolarHBondContact O-CA 3.32Å
112	Q	98.6	Very high	98.4	Very high	29 Å²	29	23.7 Å²	23.7	14%	0.136	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	111.2	175.1	-57.8	175.8	51.2	0	0	109.2	A106 V107 P110 H140	A106-Q112 WeakPolarHBondContact CA-O 3.47Å; V107-Q112 PolarHBondContact N-O 3.49Å; V107-Q112 VanDerWaalsContact O-CB 3.32Å; V107-Q112 WeakPolarHBondContact O-CB 3.42Å; V107-Q112 PolarHBondContact O-N 3.25Å; P110-Q112 PolarHBondContact O-N 2.96Å; Q112-H140 PolarHBondContact NE2-O 3.4Å
113	K	98.5	Very high	98.4	Very high	106 Å²	106	22.8 Å²	22.8	46%	0.461	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	128.8	-178.1	-69.4	-177.6	167	-142.5	0	111.6	E104 M105 A106 R137	E104-K113 WeakPolarHBondContact OE1-CE 3.47Å; E104-K113 IonicContact OE1-NZ 2.85Å; E104-K113 PolarHBondContact OE1-NZ 3.39Å; E104-K113 IonicContact OE2-NZ 3.17Å; M105-K113 CarbonylContact O-C 3.38Å; M105-K113 WeakPolarHBondContact O-CA 3.43Å; A106-K113 HydrophobicContact CB-CG 4.48Å; K113-R137 VanDerWaalsContact O-CD 3.3Å; K113-R137 WeakPolarHBondContact O-CD 3.22Å; K113-R137 PolarHBondContact O-NE 3.49Å; K113-R137 PolarHBondContact O-NH1 2.94Å
114	L	98.6	Very high	98.5	Very high	2 Å²	2	23 Å²	23	1%	0.01	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	148.5	177.2	-62.6	171	0	0	0	109.4	M105 I116 V127 R137 E203	M105-L114 PolarHBondContact N-O 2.96Å; M105-L114 PolarHBondContact O-N 2.94Å; M105-L114 VanDerWaalsContact O-O 3.08Å; L114-I116 HydrophobicContact CB-CD1 3.76Å; L114-I116 HydrophobicContact CB-CG1 4.48Å; L114-V127 HydrophobicContact CD1-CB 4.04Å; L114-V127 HydrophobicContact CD1-CG1 4.1Å; L114-V127 HydrophobicContact CD1-CG2 4.45Å; L114-R137 HydrophobicContact CD2-CB 4.43Å; L114-R137 HydrophobicContact CD2-CG 3.91Å; L114-E203 HydrophobicContact CD2-CB 4.13Å
115	N	98.6	Very high	98.5	Very high	20 Å²	20	21.3 Å²	21.3	11%	0.107	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	126	170.6	-71.5	-24.6	0	0	0	108.5	Y102 R137 N201 W202 E203 G204	Y102-N115 HydrophobicContact CD2-CB 3.51Å; Y102-N115 HydrophobicContact CE2-CB 3.75Å; Y102-N115 VanDerWaalsContact CE2-CG 3.45Å; Y102-N115 HydrophobicContact CG-CB 4.24Å; N115-R137 PolarHBondContact ND2-NH2 3.45Å; N115-R137 VanDerWaalsContact ND2-NH2 3.17Å; N115-R137 PolarHBondContact OD1-NH2 3.2Å; N115-N201 WeakPolarHBondContact CB-O 3.27Å; N115-N201 PolarHBondContact ND2-O 3.13Å; N115-W202 HydrophobicContact CB-CB 4.26Å; N115-W202 CarbonylContact O-C 3.6Å; N115-W202 WeakPolarHBondContact O-CA 3.33Å; N115-W202 WeakPolarHBondContact O-CB 3.41Å; N115-E203 WeakPolarHBondContact CB-OE2 3.48Å; N115-E203 PolarHBondContact N-OE2 3.46Å; N115-E203 PolarHBondContact O-N 3.49Å; N115-G204 PolarHBondContact O-N 3.27Å
116	I	98.8	Very high	98.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	121.7	-170.5	-52.5	-59.2	0	0	0	109.8	Y102 V103 M105 L114 V118 F125 V127 I205 L206	Y102-I116 CarbonylContact C-O 3.58Å; Y102-I116 WeakPolarHBondContact CA-O 3.43Å; Y102-I116 VanDerWaalsContact CB-O 3.23Å; Y102-I116 WeakPolarHBondContact CB-O 3.32Å; V103-I116 PolarHBondContact N-O 3.38Å; V103-I116 PolarHBondContact O-N 3.42Å; M105-I116 HydrophobicContact CB-CG1 3.79Å; M105-I116 HydrophobicContact CG-CB 4.2Å; M105-I116 HydrophobicContact CG-CG1 3.81Å; M105-I116 HydrophobicContact SD-CB 3.85Å; M105-I116 HydrophobicContact SD-CG1 3.73Å; M105-I116 HydrophobicContact SD-CG2 4.02Å; L114-I116 HydrophobicContact CB-CD1 3.76Å; L114-I116 HydrophobicContact CB-CG1 4.48Å; I116-V118 PolarHBondContact O-N 3.34Å; I116-F125 HydrophobicContact CD1-CE2 4.09Å; I116-F125 HydrophobicContact CG1-CE2 4.18Å; I116-F125 HydrophobicContact CG2-CD2 4.38Å; I116-F125 HydrophobicContact CG2-CE2 3.99Å; I116-V127 HydrophobicContact CD1-CG1 3.72Å; I116-I205 VanDerWaalsContact CG2-C 3.43Å; I116-L206 HydrophobicContact CG2-CB 3.54Å; I116-L206 VanDerWaalsContact CG2-N 3.31Å
117	L	98.6	Very high	98.5	Very high	13 Å²	13	21.1 Å²	21.1	7%	0.068	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	128.9	174	173.2	67	0	0	0	110.1	Y101 D119 W202 G204 I205 L206	Y101-L117 WeakPolarHBondContact O-CD1 3.28Å; L117-D119 PolarHBondContact O-N 2.85Å; L117-W202 HydrophobicContact CB-CD2 4.08Å; L117-W202 HydrophobicContact CB-CE3 4.4Å; L117-W202 HydrophobicContact CB-CG 4.18Å; L117-W202 HydrophobicContact CD2-CZ2 4.27Å; L117-G204 WeakPolarHBondContact CB-O 3.44Å; L117-G204 PolarHBondContact N-O 3.48Å; L117-I205 HydrophobicContact CB-CB 4.39Å; L117-I205 HydrophobicContact CB-CG1 4.26Å; L117-I205 HydrophobicContact CD2-CD1 3.87Å; L117-I205 HydrophobicContact CD2-CG1 3.99Å; L117-I205 HydrophobicContact CG-CG1 4.25Å; L117-L206 PolarHBondContact O-N 3.38Å
118	V	98.8	Very high	98.5	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.006	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	108.5	175.6	178.1	0	0	0	0	108.7	L93 Y101 V103 I116 L208 L239 M261 S316	L93-V118 HydrophobicContact CD2-CG2 3.93Å; Y101-V118 PolarHBondContact O-N 3.35Å; V103-V118 HydrophobicContact CB-CG2 4.2Å; V103-V118 HydrophobicContact CG1-CG2 3.94Å; I116-V118 PolarHBondContact O-N 3.34Å; V118-L208 HydrophobicContact CG1-CD1 3.7Å; V118-L239 HydrophobicContact CG1-CD1 4.05Å; V118-L239 HydrophobicContact CG1-CD2 3.95Å; V118-M261 HydrophobicContact CG1-SD 4.09Å; V118-M261 HydrophobicContact CG2-SD 4.15Å; V118-S316 PolarHBondContact O-OG 2.88Å
119	D	98.5	Very high	98.5	Very high	9 Å²	9	21.3 Å²	21.3	5%	0.048	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	109	-172.6	-179.2	17.4	0	0	0	111.8	L117 G121 S122 I205 L206 G207 L208 G317	L117-D119 PolarHBondContact O-N 2.85Å; D119-G121 VanDerWaalsContact C-N 3.34Å; D119-G121 WeakPolarHBondContact OD1-CA 3.27Å; D119-G121 PolarHBondContact OD1-N 2.93Å; D119-S122 WeakPolarHBondContact OD2-CB 3.34Å; D119-S122 PolarHBondContact OD2-N 2.6Å; D119-S122 PolarHBondContact OD2-OG 3.31Å; D119-I205 HydrophobicContact CB-CD1 3.71Å; D119-I205 HydrophobicContact CB-CG1 3.58Å; D119-I205 WeakPolarHBondContact OD2-CD1 3.21Å; D119-L206 PolarHBondContact N-O 2.88Å; D119-L206 VanDerWaalsContact O-O 3.11Å; D119-G207 CarbonylContact O-C 3.59Å; D119-G207 WeakPolarHBondContact O-CA 3.37Å; D119-L208 PolarHBondContact O-N 3.12Å; D119-G317 WeakPolarHBondContact OD1-CA 3.22Å
120	T	98.8	Very high	98.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-3.1	174.8	44.6	0	0	0	0	113	L208 F237 L239 Y286 D315 S316 F432	T120-L208 HydrophobicContact CG2-CB 4.06Å; T120-L208 HydrophobicContact CG2-CD1 4.2Å; T120-F237 HydrophobicContact CG2-CE2 3.9Å; T120-F237 HydrophobicContact CG2-CZ 3.87Å; T120-L239 HydrophobicContact CG2-CD1 4.06Å; T120-Y286 HydrophobicContact CG2-CD2 4.34Å; T120-Y286 HydrophobicContact CG2-CE2 4.13Å; T120-Y286 WeakPolarHBondContact O-CD2 3.2Å; T120-D315 WeakPolarHBondContact OG1-CA 3.17Å; T120-S316 PolarHBondContact N-OG 3.33Å; T120-S316 PolarHBondContact OG1-N 3.38Å; T120-S316 PolarHBondContact OG1-OG 3.46Å; T120-F432 HydrophobicContact CG2-CD1 4.47Å; T120-F432 HydrophobicContact CG2-CE1 3.91Å; T120-F432 HydrophobicContact CG2-CE2 4.24Å; T120-F432 HydrophobicContact CG2-CZ 3.78Å
121	G	97.1	Very high	98.4	Very high	13 Å²	13	20.9 Å²	20.9	13%	0.134	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	1.8	174.9	0	0	0	0	0	115.2	D119 Y285 D315	D119-G121 VanDerWaalsContact C-N 3.34Å; D119-G121 WeakPolarHBondContact OD1-CA 3.27Å; D119-G121 PolarHBondContact OD1-N 2.93Å; G121-Y285 VanDerWaalsContact O-CE1 3.27Å; G121-Y285 WeakPolarHBondContact O-CE1 3.47Å; G121-D315 WeakPolarHBondContact CA-OD1 3.35Å; G121-D315 PolarHBondContact N-OD1 3.5Å; G121-D315 VanDerWaalsContact N-OD1 3.16Å
122	S	97.3	Very high	98.4	Very high	11 Å²	11	18.9 Å²	18.9	8%	0.077	12%	0.115	C	C	.	.			trans	-143.6	174.9	173.1	77.2	0	0	0	0	112.5	D119 G207 L208 A209	D119-S122 WeakPolarHBondContact OD2-CB 3.34Å; D119-S122 PolarHBondContact OD2-N 2.6Å; D119-S122 PolarHBondContact OD2-OG 3.31Å; S122-G207 VanDerWaalsContact C-CA 3.45Å; S122-G207 CarbonylContact O-C 3.53Å; S122-G207 WeakPolarHBondContact O-CA 3.46Å; S122-L208 PolarHBondContact O-N 2.81Å; S122-A209 VanDerWaalsContact O-CB 3.26Å; S122-A209 WeakPolarHBondContact O-CB 3.48Å; S122-A209 PolarHBondContact O-N 3.08Å
123	S	98.4	Very high	98.3	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.014	15%	0.145	C	C	.	.			trans	-126.1	-1.3	-171.8	-55.2	0	0	0	0	115	A209 Y210 I213 P222	S123-A209 WeakPolarHBondContact OG-CB 3.39Å; S123-Y210 VanDerWaalsContact CB-O 3.24Å; S123-Y210 WeakPolarHBondContact CB-O 3.16Å; S123-Y210 PolarHBondContact OG-N 2.88Å; S123-Y210 PolarHBondContact OG-O 3.37Å; S123-I213 WeakPolarHBondContact OG-CG1 3.29Å; S123-P222 WeakPolarHBondContact O-CB 3.4Å
124	N	98.6	Very high	98.3	Very high	6 Å²	6	22.4 Å²	22.4	3%	0.032	14%	0.142	C	C	.	.			trans	-92.9	134.5	179.6	-74	90.7	0	0	0	110.9	W163 G207 R215 L220	N124-W163 HydrophobicContact CB-CH2 4.28Å; N124-W163 HydrophobicContact CB-CZ2 4.16Å; N124-G207 WeakPolarHBondContact O-CA 3.3Å; N124-G207 PolarHBondContact O-N 3.39Å; N124-R215 PolarHBondContact ND2-O 3.19Å; N124-R215 PolarHBondContact OD1-N 2.82Å; N124-L220 WeakPolarHBondContact ND2-CD2 3.5Å
125	F	98.8	Very high	98.2	Very high	7 Å²	7	23.4 Å²	23.4	3%	0.031	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	112	159.8	178.3	-140.6	0	0	0	108.9	M105 V107 I116 V127 V172 V186 A187 I205 L206 F223	M105-F125 HydrophobicContact CE-CE2 4.41Å; M105-F125 HydrophobicContact CE-CZ 4.24Å; M105-F125 HydrophobicContact SD-CE2 4.24Å; M105-F125 HydrophobicContact SD-CZ 4.5Å; V107-F125 HydrophobicContact CG2-CE1 4.07Å; V107-F125 HydrophobicContact CG2-CZ 3.75Å; I116-F125 HydrophobicContact CD1-CE2 4.09Å; I116-F125 HydrophobicContact CG1-CE2 4.18Å; I116-F125 HydrophobicContact CG2-CD2 4.38Å; I116-F125 HydrophobicContact CG2-CE2 3.99Å; F125-V127 HydrophobicContact CD2-CG1 4.42Å; F125-V127 HydrophobicContact CE2-CG1 3.62Å; F125-V127 HydrophobicContact CZ-CG1 3.77Å; F125-V172 HydrophobicContact CE1-CG1 4.01Å; F125-V172 HydrophobicContact CE1-CG2 3.81Å; F125-V172 HydrophobicContact CZ-CG1 4.37Å; F125-V186 HydrophobicContact CD1-CB 4.4Å; F125-V186 HydrophobicContact CD1-CG1 4.36Å; F125-V186 HydrophobicContact CD1-CG2 3.81Å; F125-V186 HydrophobicContact CE1-CG1 4.2Å; F125-V186 HydrophobicContact CE1-CG2 3.74Å; F125-A187 PolarHBondContact O-N 2.89Å; F125-I205 WeakPolarHBondContact CA-O 3.46Å; F125-I205 WeakPolarHBondContact CD2-O 3.15Å; F125-L206 HydrophobicContact CB-CD1 4.22Å; F125-L206 HydrophobicContact CD2-CD1 3.88Å; F125-L206 HydrophobicContact CG-CD1 4.14Å; F125-F223 HydrophobicContact CB-CB 4.23Å
126	A	98.8	Very high	98.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	136.6	-175.3	0	0	0	0	0	111.2	W163 A187 I189 G204 I205	A126-W163 HydrophobicContact CB-CH2 3.76Å; A126-W163 HydrophobicContact CB-CZ2 3.67Å; A126-W163 HydrophobicContact CB-CZ3 4.28Å; A126-A187 CarbonylContact C-O 3.56Å; A126-A187 VanDerWaalsContact CA-O 3.27Å; A126-A187 WeakPolarHBondContact CA-O 3.48Å; A126-A187 HydrophobicContact CB-CB 3.77Å; A126-I189 HydrophobicContact CB-CD1 3.87Å; A126-I189 HydrophobicContact CB-CG1 4.04Å; A126-G204 CarbonylContact O-C 3.53Å; A126-G204 WeakPolarHBondContact O-CA 3.25Å; A126-I205 HydrophobicContact CB-CG2 3.91Å; A126-I205 PolarHBondContact N-O 2.84Å; A126-I205 PolarHBondContact O-N 3.43Å
127	V	98.8	Very high	98	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	143.3	-176.5	-60.8	0	0	0	0	110.6	L114 I116 F125 A129 Y139 V186 A187 I189	L114-V127 HydrophobicContact CD1-CB 4.04Å; L114-V127 HydrophobicContact CD1-CG1 4.1Å; L114-V127 HydrophobicContact CD1-CG2 4.45Å; I116-V127 HydrophobicContact CD1-CG1 3.72Å; F125-V127 HydrophobicContact CD2-CG1 4.42Å; F125-V127 HydrophobicContact CE2-CG1 3.62Å; F125-V127 HydrophobicContact CZ-CG1 3.77Å; V127-A129 PolarHBondContact O-N 3.39Å; V127-Y139 HydrophobicContact CG2-CD1 3.71Å; V127-Y139 HydrophobicContact CG2-CG 3.94Å; V127-V186 HydrophobicContact CG2-CG1 3.69Å; V127-A187 PolarHBondContact N-O 3.06Å; V127-I189 WeakPolarHBondContact O-CB 3.39Å; V127-I189 PolarHBondContact O-N 2.83Å
128	G	98.8	Very high	98	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.1	128.5	168.6	0	0	0	0	0	109.8	Y138 Y139 E203	G128-Y138 CarbonylContact O-C 3.53Å; G128-Y138 WeakPolarHBondContact O-CA 3.36Å; G128-Y138 VanDerWaalsContact O-CB 3.3Å; G128-Y138 WeakPolarHBondContact O-CB 3.42Å; G128-Y139 WeakPolarHBondContact O-CB 3.06Å; G128-Y139 PolarHBondContact O-N 2.88Å; G128-E203 PolarHBondContact N-O 2.91Å
129	A	98.6	Very high	98	Very high	10 Å²	10	39.1 Å²	39.1	8%	0.083	20%	0.204	C	C	.	.			trans	-133.5	16.3	-178.1	0	0	0	0	0	112.8	V127 Y139 A188 I189	V127-A129 PolarHBondContact O-N 3.39Å; A129-Y139 WeakPolarHBondContact CA-O 3.3Å; A129-A188 HydrophobicContact CB-CB 3.53Å; A129-I189 PolarHBondContact N-O 2.89Å
130	A	97.9	Very high	98	Very high	35 Å²	35	42 Å²	42	29%	0.289	22%	0.217	S	C	.	.	S	Bend	trans	-143.6	159.2	173.4	0	0	0	0	0	109.3	H132	A130-H132 PolarHBondContact O-N 3.36Å
131	A	97.6	Very high	97.9	Very high	81 Å²	81	44.4 Å²	44.4	67%	0.669	23%	0.226	S	C	*	.			trans	-61.8	135.4	176.2	0	0	0	0	0	110.9	Y138	A131-Y138 HydrophobicContact CB-CE1 4.12Å
132	H	98.1	Very high	98	Very high	52 Å²	52	49 Å²	49	24%	0.241	26%	0.256	C	S	.	.			trans	-146	142.4	179.1	-176.6	-89.5	0	0	0	109.6	A130 F134 L135 F196	A130-H132 PolarHBondContact O-N 3.36Å; H132-F134 AromaticContact CE1-CD2 3.58Å; H132-F134 AromaticContact CE1-CG 3.88Å; H132-F134 PolarHBondContact ND1-N 2.87Å; H132-F134 PolarHBondContact O-N 2.92Å; H132-L135 HydrophobicContact CB-CB 4.17Å; H132-L135 HydrophobicContact CB-CD1 3.83Å; H132-L135 HydrophobicContact CB-CG 3.84Å; H132-L135 PolarHBondContact O-N 3.33Å; H132-F196 AromaticContact CE1-CD2 3.99Å; H132-F196 AromaticContact CG-CD2 3.89Å; H132-F196 AromaticContact ND1-CD2 3.82Å
133	P	97.4	Very high	98.1	Very high	118 Å²	118	53.6 Å²	53.6	77%	0.766	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-27.2	-174.6	-28.2	35.7	0	0	0	115.4
134	F	97.4	Very high	98.1	Very high	91 Å²	91	54 Å²	54	40%	0.399	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-1	-177.9	-53.7	-27.3	0	0	0	114	H132 F196 N198	H132-F134 AromaticContact CE1-CD2 3.58Å; H132-F134 AromaticContact CE1-CG 3.88Å; H132-F134 PolarHBondContact ND1-N 2.87Å; H132-F134 PolarHBondContact O-N 2.92Å; F134-F196 HydrophobicContact CB-CB 4.31Å; F134-F196 WeakPolarHBondContact CD2-O 3.46Å; F134-N198 HydrophobicContact CD1-CB 3.69Å; F134-N198 HydrophobicContact CD2-CB 4.13Å; F134-N198 HydrophobicContact CE1-CB 3.76Å; F134-N198 HydrophobicContact CE2-CB 4.19Å; F134-N198 HydrophobicContact CG-CB 3.91Å; F134-N198 HydrophobicContact CZ-CB 4.02Å
135	L	97.5	Very high	98.1	Very high	22 Å²	22	59 Å²	59	12%	0.115	32%	0.317	C	S	.	.			trans	-99.5	125.6	178.6	-68.2	-174.1	0	0	0	110.7	H132 F196 E203	H132-L135 HydrophobicContact CB-CB 4.17Å; H132-L135 HydrophobicContact CB-CD1 3.83Å; H132-L135 HydrophobicContact CB-CG 3.84Å; H132-L135 PolarHBondContact O-N 3.33Å; L135-F196 HydrophobicContact CD1-CD1 4.46Å; L135-F196 HydrophobicContact CD1-CD2 4.2Å; L135-F196 HydrophobicContact CD1-CE1 4.1Å; L135-F196 HydrophobicContact CD1-CE2 3.82Å; L135-F196 HydrophobicContact CD1-CZ 3.77Å; L135-F196 HydrophobicContact CD2-CD1 3.51Å; L135-F196 HydrophobicContact CD2-CD2 4.42Å; L135-F196 HydrophobicContact CD2-CE1 3.67Å; L135-F196 HydrophobicContact CD2-CG 3.92Å; L135-F196 HydrophobicContact CD2-CZ 4.21Å; L135-F196 HydrophobicContact CG-CD1 4.2Å; L135-F196 HydrophobicContact CG-CD2 4.25Å; L135-F196 HydrophobicContact CG-CE1 4.31Å; L135-F196 HydrophobicContact CG-CE2 4.35Å; L135-F196 HydrophobicContact CG-CG 4.18Å; L135-F196 HydrophobicContact CG-CZ 4.38Å; L135-E203 HydrophobicContact CD2-CB 3.86Å; L135-E203 HydrophobicContact CD2-CG 3.81Å
136	R	94.8	Very high	98.1	Very high	204 Å²	204	59.3 Å²	59.3	77%	0.77	32%	0.321	S	S	*	.	S	Bend	trans	-78.1	-29	172.8	-67.9	-176.2	177.5	163	4.1	112.4	N201	R136-N201 VanDerWaalsContact CZ-OD1 3.25Å; R136-N201 PolarHBondContact NH1-OD1 2.86Å; R136-N201 VanDerWaalsContact NH1-OD1 3.12Å; R136-N201 PolarHBondContact NH2-OD1 3.01Å
137	R	97	Very high	98.1	Very high	87 Å²	87	61.8 Å²	61.8	33%	0.328	33%	0.331	S	S	.	.			trans	-150.6	160.4	-179.1	51.6	-177	167	-176.5	-7.9	109	K113 L114 N115 E203	K113-R137 VanDerWaalsContact O-CD 3.3Å; K113-R137 WeakPolarHBondContact O-CD 3.22Å; K113-R137 PolarHBondContact O-NE 3.49Å; K113-R137 PolarHBondContact O-NH1 2.94Å; L114-R137 HydrophobicContact CD2-CB 4.43Å; L114-R137 HydrophobicContact CD2-CG 3.91Å; N115-R137 PolarHBondContact ND2-NH2 3.45Å; N115-R137 VanDerWaalsContact ND2-NH2 3.17Å; N115-R137 PolarHBondContact OD1-NH2 3.2Å; R137-E203 HydrophobicContact CG-CG 3.99Å; R137-E203 WeakPolarHBondContact CG-OE1 3.48Å; R137-E203 IonicContact CZ-OE2 3.18Å; R137-E203 IonicContact NE-OE1 2.74Å; R137-E203 PolarHBondContact NE-OE1 3.08Å; R137-E203 IonicContact NE-OE2 3.9Å; R137-E203 PolarHBondContact NE-OE2 2.82Å; R137-E203 IonicContact NH2-OE2 3.24Å; R137-E203 WeakPolarHBondContact O-CG 3.38Å
138	Y	98.4	Very high	98.1	Very high	72 Å²	72	69 Å²	69	28%	0.282	36%	0.358	S	S	.	.			trans	-151.9	164.5	177.6	56.7	-93.1	0	0	0	109.4	G128 A131 H140	G128-Y138 CarbonylContact O-C 3.53Å; G128-Y138 WeakPolarHBondContact O-CA 3.36Å; G128-Y138 VanDerWaalsContact O-CB 3.3Å; G128-Y138 WeakPolarHBondContact O-CB 3.42Å; A131-Y138 HydrophobicContact CB-CE1 4.12Å; Y138-H140 AromaticContact CD2-NE2 3.98Å; Y138-H140 AromaticContact CE2-CE1 3.24Å; Y138-H140 WeakPolarHBondContact CE2-CE1 3.37Å; Y138-H140 AromaticContact CE2-ND1 3.72Å; Y138-H140 AromaticContact CE2-NE2 3.59Å; Y138-H140 AromaticContact CZ-CE1 3.46Å; Y138-H140 VanDerWaalsContact CZ-CE1 3.46Å; Y138-H140 AromaticContact CZ-NE2 3.79Å; Y138-H140 PolarHBondContact O-CD2 3.24Å; Y138-H140 VanDerWaalsContact O-CD2 3.22Å; Y138-H140 PolarHBondContact O-N 2.94Å; Y138-H140 PolarHBondContact OH-CE1 2.9Å
139	Y	98.8	Very high	98	Very high	2 Å²	2	73.9 Å²	73.9	1%	0.008	38%	0.384	C	S	.	.			trans	-73.7	119.3	-178.3	175.4	-135	0	0	0	111.8	V107 V127 G128 A129 R141 Y147 D170	V107-Y139 HydrophobicContact CB-CD2 4.37Å; V107-Y139 HydrophobicContact CB-CE2 4.35Å; V107-Y139 HydrophobicContact CG1-CD2 4.12Å; V107-Y139 HydrophobicContact CG1-CE1 4.48Å; V107-Y139 HydrophobicContact CG1-CE2 3.73Å; V127-Y139 HydrophobicContact CG2-CD1 3.71Å; V127-Y139 HydrophobicContact CG2-CG 3.94Å; G128-Y139 WeakPolarHBondContact O-CB 3.06Å; G128-Y139 PolarHBondContact O-N 2.88Å; A129-Y139 WeakPolarHBondContact CA-O 3.3Å; Y139-R141 HydrophobicContact CD1-CG 3.71Å; Y139-R141 HydrophobicContact CE1-CB 4.31Å; Y139-R141 HydrophobicContact CE1-CG 3.2Å; Y139-Y147 HydrophobicContact CE1-CD2 4.4Å; Y139-Y147 WeakPolarHBondContact OH-CD2 3.18Å; Y139-D170 PolarHBondContact OH-OD2 3.06Å
140	H	98.6	Very high	98	Very high	68 Å²	68	77 Å²	77	32%	0.315	40%	0.398	S	S	.	.			trans	-96.5	91.8	174	-65.6	-91.6	0	0	0	110.7	Q112 Y138 S142 L143	Q112-H140 PolarHBondContact NE2-O 3.4Å; Y138-H140 AromaticContact CD2-NE2 3.98Å; Y138-H140 AromaticContact CE2-CE1 3.24Å; Y138-H140 WeakPolarHBondContact CE2-CE1 3.37Å; Y138-H140 AromaticContact CE2-ND1 3.72Å; Y138-H140 AromaticContact CE2-NE2 3.59Å; Y138-H140 AromaticContact CZ-CE1 3.46Å; Y138-H140 VanDerWaalsContact CZ-CE1 3.46Å; Y138-H140 AromaticContact CZ-NE2 3.79Å; Y138-H140 PolarHBondContact O-CD2 3.24Å; Y138-H140 VanDerWaalsContact O-CD2 3.22Å; Y138-H140 PolarHBondContact O-N 2.94Å; Y138-H140 PolarHBondContact OH-CE1 2.9Å; H140-S142 VanDerWaalsContact C-N 3.28Å; H140-S142 PolarHBondContact O-N 2.89Å; H140-L143 HydrophobicContact CB-CB 4.09Å; H140-L143 HydrophobicContact CB-CD1 3.64Å; H140-L143 HydrophobicContact CB-CG 3.77Å; H140-L143 PolarHBondContact O-N 3.4Å; H140-L143 VanDerWaalsContact O-N 3.08Å
141	R	98.3	Very high	97.9	Very high	51 Å²	51	78.5 Å²	78.5	19%	0.192	42%	0.417	C	S	.	.	G	3₁₀ helix	trans	-52.2	-43.5	177.7	-71.1	166.5	-77.3	170.7	2.6	113.5	Y139 L143 S144 Y147 E166 A188	Y139-R141 HydrophobicContact CD1-CG 3.71Å; Y139-R141 HydrophobicContact CE1-CB 4.31Å; Y139-R141 HydrophobicContact CE1-CG 3.2Å; R141-L143 PolarHBondContact O-N 2.93Å; R141-S144 PolarHBondContact O-N 3.45Å; R141-S144 VanDerWaalsContact O-N 3.07Å; R141-Y147 HydrophobicContact CB-CD1 4.1Å; R141-Y147 HydrophobicContact CB-CD2 4.37Å; R141-Y147 HydrophobicContact CB-CE1 4.09Å; R141-Y147 HydrophobicContact CB-CE2 4.32Å; R141-Y147 HydrophobicContact CB-CG 4.25Å; R141-Y147 HydrophobicContact CG-CD2 4.08Å; R141-Y147 HydrophobicContact CG-CE1 4.32Å; R141-Y147 HydrophobicContact CG-CE2 3.77Å; R141-Y147 HydrophobicContact CG-CG 4.46Å; R141-E166 IonicContact CZ-OE2 3.92Å; R141-E166 IonicContact NH1-OE2 3.97Å; R141-E166 PolarHBondContact NH1-OE2 3.25Å; R141-A188 HydrophobicContact CG-CB 4.48Å
142	S	98.1	Very high	97.9	Very high	110 Å²	110	79.8 Å²	79.8	77%	0.769	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-65.7	-18.2	-178.7	55.3	0	0	0	0	114.3	H140	H140-S142 VanDerWaalsContact C-N 3.28Å; H140-S142 PolarHBondContact O-N 2.89Å
143	L	98.5	Very high	97.8	Very high	108 Å²	108	81.8 Å²	81.8	57%	0.565	43%	0.425	S	S	*	.	G	3₁₀ helix	trans	-90.2	-9.9	176.6	-59.4	-176.9	0	0	0	112.6	H140 R141	H140-L143 HydrophobicContact CB-CB 4.09Å; H140-L143 HydrophobicContact CB-CD1 3.64Å; H140-L143 HydrophobicContact CB-CG 3.77Å; H140-L143 PolarHBondContact O-N 3.4Å; H140-L143 VanDerWaalsContact O-N 3.08Å; R141-L143 PolarHBondContact O-N 2.93Å
144	S	98.7	Very high	97.8	Very high	11 Å²	11	76.4 Å²	76.4	8%	0.077	39%	0.39	C	S	.	.			trans	-95.1	114.5	178.8	-178.5	0	0	0	0	111.1	G108 S109 R141 S146 Y147 D170	G108-S144 WeakPolarHBondContact CA-OG 3.34Å; S109-S144 PolarHBondContact N-OG 3.41Å; S109-S144 WeakPolarHBondContact O-CA 3.43Å; R141-S144 PolarHBondContact O-N 3.45Å; R141-S144 VanDerWaalsContact O-N 3.07Å; S144-S146 PolarHBondContact O-N 3.39Å; S144-S146 PolarHBondContact OG-N 3.27Å; S144-S146 PolarHBondContact OG-OG 3.03Å; S144-Y147 PolarHBondContact O-N 2.85Å; S144-Y147 PolarHBondContact OG-N 2.88Å; S144-D170 WeakPolarHBondContact CB-OD2 3.5Å; S144-D170 VanDerWaalsContact OG-CG 3.3Å; S144-D170 PolarHBondContact OG-OD1 3.41Å; S144-D170 PolarHBondContact OG-OD2 3.44Å
145	S	98.6	Very high	97.8	Very high	109 Å²	109	77.3 Å²	77.3	76%	0.762	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-15.4	172.4	57.3	0	0	0	0	113.7	S109	S109-S145 WeakPolarHBondContact CB-OG 3.32Å; S109-S145 PolarHBondContact O-N 2.94Å; S109-S145 PolarHBondContact O-OG 2.85Å
146	S	98.7	Very high	97.7	Very high	15 Å²	15	76.7 Å²	76.7	11%	0.105	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-3.4	-178.5	54	0	0	0	0	114.5	S109 S144 D170 R183	S109-S146 VanDerWaalsContact CB-OG 3.28Å; S109-S146 WeakPolarHBondContact CB-OG 3.34Å; S109-S146 PolarHBondContact N-OG 3.48Å; S109-S146 PolarHBondContact OG-OG 2.74Å; S144-S146 PolarHBondContact O-N 3.39Å; S144-S146 PolarHBondContact OG-N 3.27Å; S144-S146 PolarHBondContact OG-OG 3.03Å; S146-D170 VanDerWaalsContact CB-OD1 3.29Å; S146-D170 WeakPolarHBondContact CB-OD1 3.39Å; S146-D170 PolarHBondContact OG-OD1 3.31Å; S146-R183 PolarHBondContact O-NH1 2.03Å; S146-R183 PolarHBondContact O-NH2 2.8Å
147	Y	98.8	Very high	97.5	Very high	52 Å²	52	69.7 Å²	69.7	20%	0.204	37%	0.37	C	S	.	.			trans	-63.7	137.4	176	176.1	-110.5	0	0	0	111.1	Y139 R141 S144 D149 D170	Y139-Y147 HydrophobicContact CE1-CD2 4.4Å; Y139-Y147 WeakPolarHBondContact OH-CD2 3.18Å; R141-Y147 HydrophobicContact CB-CD1 4.1Å; R141-Y147 HydrophobicContact CB-CD2 4.37Å; R141-Y147 HydrophobicContact CB-CE1 4.09Å; R141-Y147 HydrophobicContact CB-CE2 4.32Å; R141-Y147 HydrophobicContact CB-CG 4.25Å; R141-Y147 HydrophobicContact CG-CD2 4.08Å; R141-Y147 HydrophobicContact CG-CE1 4.32Å; R141-Y147 HydrophobicContact CG-CE2 3.77Å; R141-Y147 HydrophobicContact CG-CG 4.46Å; S144-Y147 PolarHBondContact O-N 2.85Å; S144-Y147 PolarHBondContact OG-N 2.88Å; Y147-D149 HydrophobicContact CE1-CB 4Å; Y147-D170 PolarHBondContact N-OD1 2.84Å
148	R	98.7	Very high	96.8	Very high	152 Å²	152	69.3 Å²	69.3	57%	0.574	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.1	119.4	172.2	-60.7	179.4	-179.1	179.3	-1.8	108.7	G168 T169	R148-G168 CarbonylContact O-C 3.56Å; R148-G168 WeakPolarHBondContact O-CA 3.22Å; R148-T169 PolarHBondContact N-O 3.42Å; R148-T169 PolarHBondContact O-N 2.69Å
149	D	98.3	Very high	95.8	Very high	101 Å²	101	70.6 Å²	70.6	54%	0.54	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	137.2	173.4	-172.7	9.9	0	0	0	110.4	Y147 G151	Y147-D149 HydrophobicContact CE1-CB 4Å; D149-G151 PolarHBondContact OD1-N 2.67Å
150	L	97.8	Very high	94.8	Very high	75 Å²	75	77.7 Å²	77.7	39%	0.393	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-6.2	173	-63.3	177.8	0	0	0	112.4	R152 L167 T169	L150-R152 PolarHBondContact O-N 3.39Å; L150-L167 HydrophobicContact CB-CB 4.26Å; L150-L167 WeakPolarHBondContact CB-O 3.42Å; L150-L167 HydrophobicContact CD1-CB 4.17Å; L150-L167 PolarHBondContact N-O 2.74Å; L150-T169 HydrophobicContact CD1-CG2 4.1Å; L150-T169 HydrophobicContact CD2-CG2 4.25Å; L150-T169 HydrophobicContact CG-CG2 4.37Å
151	G	96.5	Very high	94.4	Very high	67 Å²	67	75.1 Å²	75.1	69%	0.691	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	65.4	22.3	177.5	0	0	0	0	0	113.9	D149	D149-G151 PolarHBondContact OD1-N 2.67Å
152	R	96.5	Very high	94.3	Very high	108 Å²	108	77 Å²	77	41%	0.408	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	136.3	-179.3	-68.7	179.4	71.8	-174	2	110.1	L150 L167 P216 D217	L150-R152 PolarHBondContact O-N 3.39Å; R152-L167 HydrophobicContact CB-CB 4.4Å; R152-L167 HydrophobicContact CB-CD1 3.98Å; R152-L167 WeakPolarHBondContact O-CB 3.18Å; R152-L167 PolarHBondContact O-N 3.48Å; R152-P216 VanDerWaalsContact NH2-CG 3.32Å; R152-D217 IonicContact CZ-OD2 3.9Å; R152-D217 IonicContact NH2-OD2 2.76Å; R152-D217 PolarHBondContact NH2-OD2 3.09Å
153	S	96.9	Very high	94.3	Very high	94 Å²	94	71.7 Å²	71.7	66%	0.657	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	159.6	169.4	-53.3	0	0	0	0	111	G165	S153-G165 CarbonylContact C-O 3.34Å; S153-G165 WeakPolarHBondContact CA-O 3.34Å
154	V	97.8	Very high	94.2	Very high	6 Å²	6	69.3 Å²	69.3	4%	0.036	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	140	177.5	55.1	0	0	0	0	110.1	V156 W163 E164 G165 L167 A187 R215	V154-V156 HydrophobicContact CG2-CG2 3.89Å; V154-W163 HydrophobicContact CG1-CH2 4.31Å; V154-W163 HydrophobicContact CG1-CZ3 3.69Å; V154-W163 HydrophobicContact CG2-CH2 4.3Å; V154-W163 HydrophobicContact CG2-CZ3 4.23Å; V154-E164 WeakPolarHBondContact O-CA 2.81Å; V154-G165 PolarHBondContact N-O 2.93Å; V154-G165 PolarHBondContact O-N 3.19Å; V154-L167 HydrophobicContact CB-CD1 4.35Å; V154-L167 HydrophobicContact CB-CD2 4.03Å; V154-L167 HydrophobicContact CB-CG 4.06Å; V154-L167 HydrophobicContact CG1-CD2 3.58Å; V154-L167 HydrophobicContact CG1-CG 3.86Å; V154-A187 HydrophobicContact CG1-CB 3.99Å; V154-R215 HydrophobicContact CG2-CB 3.85Å
155	Y	96.9	Very high	94.2	Very high	109 Å²	109	69 Å²	69	43%	0.427	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	129.2	176.2	171.2	-91.8	0	0	0	108.9	P157 E164	Y155-P157 HydrophobicContact CD1-CG 4.38Å; Y155-P157 HydrophobicContact CE1-CB 3.84Å; Y155-P157 HydrophobicContact CE1-CG 3.72Å; Y155-E164 HydrophobicContact CD2-CG 3.43Å; Y155-E164 VanDerWaalsContact CD2-CG 3.43Å; Y155-E164 WeakPolarHBondContact CD2-OE1 3.48Å; Y155-E164 HydrophobicContact CE2-CG 4.19Å; Y155-E164 HydrophobicContact CG-CG 4.33Å
156	V	94.8	Very high	94.2	Very high	9 Å²	9	67.5 Å²	67.5	6%	0.055	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	109.5	-178.6	-174	0	0	0	0	110.7	V154 Y158 R162 W163 R215	V154-V156 HydrophobicContact CG2-CG2 3.89Å; V156-Y158 HydrophobicContact CG1-CE1 4.24Å; V156-Y158 HydrophobicContact CG1-CE2 4.1Å; V156-R162 VanDerWaalsContact O-CA 3.29Å; V156-R162 WeakPolarHBondContact O-CA 3.33Å; V156-W163 HydrophobicContact CB-CD2 3.95Å; V156-W163 HydrophobicContact CB-CE3 4.34Å; V156-W163 HydrophobicContact CB-CH2 4.05Å; V156-W163 HydrophobicContact CB-CZ2 3.62Å; V156-W163 HydrophobicContact CB-CZ3 4.4Å; V156-W163 HydrophobicContact CG1-CZ2 4.07Å; V156-W163 HydrophobicContact CG2-CD2 4.18Å; V156-W163 HydrophobicContact CG2-CE3 4.14Å; V156-W163 HydrophobicContact CG2-CH2 3.25Å; V156-W163 HydrophobicContact CG2-CZ2 3.26Å; V156-W163 HydrophobicContact CG2-CZ3 3.72Å; V156-W163 PolarHBondContact N-O 3.21Å; V156-W163 PolarHBondContact O-N 3.27Å; V156-R215 HydrophobicContact CG1-CG 4.34Å; V156-R215 HydrophobicContact CG2-CB 3.6Å; V156-R215 HydrophobicContact CG2-CG 3.82Å
157	P	90.8	Very high	94.2	Very high	58 Å²	58	66.9 Å²	66.9	38%	0.377	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	138.8	171.1	34.3	-30.3	0	0	0	111.3	Y155	Y155-P157 HydrophobicContact CD1-CG 4.38Å; Y155-P157 HydrophobicContact CE1-CB 3.84Å; Y155-P157 HydrophobicContact CE1-CG 3.72Å
158	Y	82.9	Confident	94.2	Very high	79 Å²	79	64.4 Å²	64.4	31%	0.31	33%	0.33	S	S	.	.			trans	-113.9	177	167.1	-59.3	-79.3	0	0	0	110.8	V156 Q160 G161 W163 F195	V156-Y158 HydrophobicContact CG1-CE1 4.24Å; V156-Y158 HydrophobicContact CG1-CE2 4.1Å; Y158-Q160 VanDerWaalsContact C-N 3.27Å; Y158-Q160 PolarHBondContact O-N 3.39Å; Y158-G161 CarbonylContact C-O 3.53Å; Y158-G161 WeakPolarHBondContact CA-O 3.39Å; Y158-G161 WeakPolarHBondContact CB-O 3.01Å; Y158-G161 PolarHBondContact N-O 2.75Å; Y158-W163 AromaticContact CE2-CD1 3.44Å; Y158-W163 VanDerWaalsContact CE2-CD1 3.44Å; Y158-W163 AromaticContact CE2-NE1 3.27Å; Y158-W163 VanDerWaalsContact CE2-NE1 3.27Å; Y158-W163 AromaticContact CZ-NE1 3.53Å; Y158-W163 PolarHBondContact OH-NE1 3.04Å; Y158-F195 HydrophobicContact CD2-CD2 4.44Å; Y158-F195 AromaticContact CE2-CD2 3.94Å; Y158-F195 HydrophobicContact CE2-CD2 3.94Å; Y158-F195 AromaticContact CE2-CE2 3.98Å; Y158-F195 HydrophobicContact CE2-CE2 3.98Å
159	T	77.8	Confident	94.2	Very high	98 Å²	98	57.9 Å²	57.9	60%	0.601	31%	0.308	S	S	*	.	S	Bend	trans	-60	-36	178.2	-55.6	0	0	0	0	112.6
160	Q	77.9	Confident	94.2	Very high	152 Å²	152	53.1 Å²	53.1	71%	0.71	28%	0.282	S	S	*	.	S	Bend	trans	-124	8.5	-172.5	-62	-172.4	13.6	0	0	114.5	Y158 R194	Y158-Q160 VanDerWaalsContact C-N 3.27Å; Y158-Q160 PolarHBondContact O-N 3.39Å; Q160-R194 WeakPolarHBondContact O-CB 3.34Å
161	G	89.7	Confident	94.3	Very high	13 Å²	13	52.1 Å²	52.1	13%	0.134	28%	0.277	C	S	.	.			trans	-174.5	-177.2	-176.9	0	0	0	0	0	112.3	Y158 D193	Y158-G161 CarbonylContact C-O 3.53Å; Y158-G161 WeakPolarHBondContact CA-O 3.39Å; Y158-G161 WeakPolarHBondContact CB-O 3.01Å; Y158-G161 PolarHBondContact N-O 2.75Å; G161-D193 CarbonylContact C-O 3.54Å; G161-D193 WeakPolarHBondContact CA-O 3.36Å
162	R	95.1	Very high	94.4	Very high	90 Å²	90	49 Å²	49	34%	0.34	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	159.5	178.3	64.4	-173.9	-173.8	107.1	-1.3	111.2	V156 E164 S192 D193	V156-R162 VanDerWaalsContact O-CA 3.29Å; V156-R162 WeakPolarHBondContact O-CA 3.33Å; R162-E164 IonicContact CZ-OE1 3.03Å; R162-E164 IonicContact NH1-OE1 2.64Å; R162-E164 PolarHBondContact NH1-OE1 3.23Å; R162-S192 WeakPolarHBondContact O-CA 3.46Å; R162-D193 HydrophobicContact CG-CB 4.08Å; R162-D193 PolarHBondContact N-O 3.22Å; R162-D193 PolarHBondContact O-N 3.18Å
163	W	98	Very high	94.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	156.6	164.8	57.6	-103.8	0	0	0	112	N124 A126 V154 V156 Y158 A187 I189 Q191 F195	N124-W163 HydrophobicContact CB-CH2 4.28Å; N124-W163 HydrophobicContact CB-CZ2 4.16Å; A126-W163 HydrophobicContact CB-CH2 3.76Å; A126-W163 HydrophobicContact CB-CZ2 3.67Å; A126-W163 HydrophobicContact CB-CZ3 4.28Å; V154-W163 HydrophobicContact CG1-CH2 4.31Å; V154-W163 HydrophobicContact CG1-CZ3 3.69Å; V154-W163 HydrophobicContact CG2-CH2 4.3Å; V154-W163 HydrophobicContact CG2-CZ3 4.23Å; V156-W163 HydrophobicContact CB-CD2 3.95Å; V156-W163 HydrophobicContact CB-CE3 4.34Å; V156-W163 HydrophobicContact CB-CH2 4.05Å; V156-W163 HydrophobicContact CB-CZ2 3.62Å; V156-W163 HydrophobicContact CB-CZ3 4.4Å; V156-W163 HydrophobicContact CG1-CZ2 4.07Å; V156-W163 HydrophobicContact CG2-CD2 4.18Å; V156-W163 HydrophobicContact CG2-CE3 4.14Å; V156-W163 HydrophobicContact CG2-CH2 3.25Å; V156-W163 HydrophobicContact CG2-CZ2 3.26Å; V156-W163 HydrophobicContact CG2-CZ3 3.72Å; V156-W163 PolarHBondContact N-O 3.21Å; V156-W163 PolarHBondContact O-N 3.27Å; Y158-W163 AromaticContact CE2-CD1 3.44Å; Y158-W163 VanDerWaalsContact CE2-CD1 3.44Å; Y158-W163 AromaticContact CE2-NE1 3.27Å; Y158-W163 VanDerWaalsContact CE2-NE1 3.27Å; Y158-W163 AromaticContact CZ-NE1 3.53Å; Y158-W163 PolarHBondContact OH-NE1 3.04Å; W163-A187 HydrophobicContact CH2-CB 3.83Å; W163-A187 HydrophobicContact CZ3-CB 3.84Å; W163-I189 HydrophobicContact CB-CD1 4.34Å; W163-I189 HydrophobicContact CB-CG1 4.38Å; W163-I189 HydrophobicContact CB-CG2 3.89Å; W163-I189 HydrophobicContact CD2-CD1 4.17Å; W163-I189 HydrophobicContact CD2-CG1 4.06Å; W163-I189 HydrophobicContact CE3-CG1 3.94Å; W163-I189 HydrophobicContact CG-CD1 4.06Å; W163-I189 HydrophobicContact CG-CG1 4.25Å; W163-Q191 WeakPolarHBondContact CA-O 3.25Å; W163-F195 HydrophobicContact CB-CG 4.5Å; W163-F195 AromaticContact CD1-CD2 3.58Å; W163-F195 AromaticContact CD1-CE2 3.59Å; W163-F195 AromaticContact CD1-CG 3.89Å; W163-F195 AromaticContact CD1-CZ 3.92Å; W163-F195 AromaticContact NE1-CE2 3.9Å
164	E	98.2	Very high	94.5	Very high	58 Å²	58	41.3 Å²	41.3	27%	0.271	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	145	174.7	-75.4	172.4	-144	0	0	109.1	V154 Y155 R162 I189 T190 Q191	V154-E164 WeakPolarHBondContact O-CA 2.81Å; Y155-E164 HydrophobicContact CD2-CG 3.43Å; Y155-E164 VanDerWaalsContact CD2-CG 3.43Å; Y155-E164 WeakPolarHBondContact CD2-OE1 3.48Å; Y155-E164 HydrophobicContact CE2-CG 4.19Å; Y155-E164 HydrophobicContact CG-CG 4.33Å; R162-E164 IonicContact CZ-OE1 3.03Å; R162-E164 IonicContact NH1-OE1 2.64Å; R162-E164 PolarHBondContact NH1-OE1 3.23Å; E164-I189 WeakPolarHBondContact O-CA 3.18Å; E164-T190 PolarHBondContact O-N 2.81Å; E164-Q191 HydrophobicContact CB-CB 4.31Å; E164-Q191 PolarHBondContact N-O 3.18Å; E164-Q191 PolarHBondContact O-N 2.71Å
165	G	98	Very high	94.4	Very high	4 Å²	4	43.6 Å²	43.6	4%	0.041	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.9	-177.3	-178.7	0	0	0	0	0	114.3	S153 V154 A188	S153-G165 CarbonylContact C-O 3.34Å; S153-G165 WeakPolarHBondContact CA-O 3.34Å; V154-G165 PolarHBondContact N-O 2.93Å; V154-G165 PolarHBondContact O-N 3.19Å; G165-A188 CarbonylContact C-O 3.59Å; G165-A188 WeakPolarHBondContact CA-O 3.37Å
166	E	98.5	Very high	94.4	Very high	77 Å²	77	42.8 Å²	42.8	36%	0.36	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.4	179.7	-67.5	171	-175.1	0	0	109.4	R141 A188	R141-E166 IonicContact CZ-OE2 3.92Å; R141-E166 IonicContact NH1-OE2 3.97Å; R141-E166 PolarHBondContact NH1-OE2 3.25Å; E166-A188 PolarHBondContact N-O 3.2Å; E166-A188 WeakPolarHBondContact O-CB 3.26Å; E166-A188 PolarHBondContact O-N 3.12Å
167	L	98.6	Very high	94.4	Very high	2 Å²	2	43 Å²	43	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	133.3	-179.3	-65.1	176.8	0	0	0	110.7	L150 R152 V154 A187 P216 L220	L150-L167 HydrophobicContact CB-CB 4.26Å; L150-L167 WeakPolarHBondContact CB-O 3.42Å; L150-L167 HydrophobicContact CD1-CB 4.17Å; L150-L167 PolarHBondContact N-O 2.74Å; R152-L167 HydrophobicContact CB-CB 4.4Å; R152-L167 HydrophobicContact CB-CD1 3.98Å; R152-L167 WeakPolarHBondContact O-CB 3.18Å; R152-L167 PolarHBondContact O-N 3.48Å; V154-L167 HydrophobicContact CB-CD1 4.35Å; V154-L167 HydrophobicContact CB-CD2 4.03Å; V154-L167 HydrophobicContact CB-CG 4.06Å; V154-L167 HydrophobicContact CG1-CD2 3.58Å; V154-L167 HydrophobicContact CG1-CG 3.86Å; L167-A187 HydrophobicContact CD2-CB 3.94Å; L167-P216 HydrophobicContact CD1-CG 4.39Å; L167-L220 HydrophobicContact CD1-CD1 4.15Å; L167-L220 HydrophobicContact CD1-CD2 4.36Å; L167-L220 HydrophobicContact CD2-CD1 4.4Å; L167-L220 HydrophobicContact CD2-CD2 3.79Å
168	G	98.5	Very high	94.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	-178.5	170.3	0	0	0	0	0	111.2	R148 N185 V186	R148-G168 CarbonylContact O-C 3.56Å; R148-G168 WeakPolarHBondContact O-CA 3.22Å; G168-N185 WeakPolarHBondContact O-CA 3.46Å; G168-V186 PolarHBondContact N-O 3.43Å; G168-V186 PolarHBondContact O-N 2.77Å
169	T	98.8	Very high	95.1	Very high	16 Å²	16	46.2 Å²	46.2	10%	0.098	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	145.7	163.8	69.3	0	0	0	0	110.2	R148 L150 R183 A184 N185	R148-T169 PolarHBondContact N-O 3.42Å; R148-T169 PolarHBondContact O-N 2.69Å; L150-T169 HydrophobicContact CD1-CG2 4.1Å; L150-T169 HydrophobicContact CD2-CG2 4.25Å; L150-T169 HydrophobicContact CG-CG2 4.37Å; T169-R183 PolarHBondContact O-NH1 2.92Å; T169-R183 PolarHBondContact OG1-NH1 3.4Å; T169-A184 WeakPolarHBondContact CA-O 3.17Å; T169-A184 WeakPolarHBondContact CB-O 3.33Å; T169-N185 WeakPolarHBondContact CG2-OD1 3.26Å
170	D	98.9	Very high	95.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	171.1	172.4	-148.1	-18.3	0	0	0	111	V107 G108 Y139 S144 S146 Y147 R183 A184 V186	V107-D170 HydrophobicContact CG1-CB 3.93Å; G108-D170 VanDerWaalsContact CA-CG 3.43Å; G108-D170 WeakPolarHBondContact CA-OD1 3.37Å; G108-D170 WeakPolarHBondContact CA-OD2 3.25Å; Y139-D170 PolarHBondContact OH-OD2 3.06Å; S144-D170 WeakPolarHBondContact CB-OD2 3.5Å; S144-D170 VanDerWaalsContact OG-CG 3.3Å; S144-D170 PolarHBondContact OG-OD1 3.41Å; S144-D170 PolarHBondContact OG-OD2 3.44Å; S146-D170 VanDerWaalsContact CB-OD1 3.29Å; S146-D170 WeakPolarHBondContact CB-OD1 3.39Å; S146-D170 PolarHBondContact OG-OD1 3.31Å; Y147-D170 PolarHBondContact N-OD1 2.84Å; D170-R183 WeakPolarHBondContact O-CA 3.38Å; D170-A184 PolarHBondContact N-O 2.99Å; D170-A184 PolarHBondContact O-N 2.76Å; D170-V186 HydrophobicContact CB-CG2 4.49Å
171	L	98.9	Very high	96.8	Very high	54 Å²	54	39.9 Å²	39.9	28%	0.283	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	131.8	170	-64.8	-176	0	0	0	109.7	V107 G108 T181 L182 R183	V107-L171 CarbonylContact C-O 3.59Å; V107-L171 WeakPolarHBondContact CA-O 3.5Å; G108-L171 PolarHBondContact N-O 3.17Å; L171-T181 HydrophobicContact CB-CG2 3.91Å; L171-T181 HydrophobicContact CD1-CG2 4.48Å; L171-T181 HydrophobicContact CD2-CG2 4.39Å; L171-T181 HydrophobicContact CG-CG2 4.48Å; L171-L182 CarbonylContact C-O 3.55Å; L171-L182 WeakPolarHBondContact CA-O 3.46Å; L171-R183 HydrophobicContact CD2-CB 4.27Å
172	V	98.8	Very high	97.2	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	137.8	-176.8	-173.9	0	0	0	0	109.4	M105 A106 V107 F125 T181 L182 A184 V186 F223	M105-V172 HydrophobicContact CE-CG1 3.48Å; M105-V172 VanDerWaalsContact CE-CG1 3.48Å; A106-V172 VanDerWaalsContact O-CA 3.31Å; A106-V172 WeakPolarHBondContact O-CA 3.18Å; V107-V172 HydrophobicContact CG1-CG2 4.44Å; V107-V172 HydrophobicContact CG2-CG2 4.43Å; F125-V172 HydrophobicContact CE1-CG1 4.01Å; F125-V172 HydrophobicContact CE1-CG2 3.81Å; F125-V172 HydrophobicContact CZ-CG1 4.37Å; V172-T181 WeakPolarHBondContact O-CA 3.45Å; V172-L182 PolarHBondContact N-O 3.32Å; V172-L182 PolarHBondContact O-N 2.86Å; V172-A184 HydrophobicContact CB-CB 4.42Å; V172-A184 HydrophobicContact CG2-CB 3.88Å; V172-V186 HydrophobicContact CG2-CG2 4.25Å; V172-F223 HydrophobicContact CB-CE2 4.2Å; V172-F223 HydrophobicContact CG1-CD2 4.33Å; V172-F223 HydrophobicContact CG1-CE2 3.66Å
173	S	98.3	Very high	97.3	Very high	30 Å²	30	38 Å²	38	21%	0.21	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	157.9	171.6	62.6	0	0	0	0	111.4	M105 A106	M105-S173 WeakPolarHBondContact CA-O 3.46Å; A106-S173 PolarHBondContact N-O 3.12Å; A106-S173 PolarHBondContact O-N 2.8Å
174	V	98	Very high	97.4	Very high	12 Å²	12	38 Å²	38	7%	0.073	21%	0.21	C	C	.	.			trans	-111.6	101.6	174.7	-175.2	0	0	0	0	107	V103 M105 H176 G177 F223 I263	V103-V174 HydrophobicContact CG2-CG1 4.08Å; M105-V174 HydrophobicContact CE-CG2 4.01Å; M105-V174 HydrophobicContact CG-CG2 4.29Å; V174-H176 PolarHBondContact O-N 3.34Å; V174-G177 WeakPolarHBondContact O-CA 3.48Å; V174-G177 PolarHBondContact O-N 3.05Å; V174-F223 HydrophobicContact CG2-CZ 4.17Å; V174-I263 HydrophobicContact CG1-CD1 4.46Å; V174-I263 HydrophobicContact CG2-CD1 4.28Å
175	P	96.1	Very high	97.4	Very high	53 Å²	53	36.7 Å²	36.7	34%	0.344	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-38.5	-174.6	-30.3	36.6	0	0	0	114.5	E104	E104-P175 HydrophobicContact CG-CG 4.4Å; E104-P175 WeakPolarHBondContact O-CD 2.98Å
176	H	95.8	Very high	97.4	Very high	92 Å²	92	36.6 Å²	36.6	43%	0.426	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105	51.3	176.2	-62.4	-65.5	0	0	0	110.1	D88 M89 N92 V174	D88-H176 WeakPolarHBondContact O-CB 3.07Å; M89-H176 WeakPolarHBondContact CG-O 3.41Å; N92-H176 HydrophobicContact CB-CB 3.72Å; N92-H176 PolarHBondContact ND2-O 2.96Å; V174-H176 PolarHBondContact O-N 3.34Å
177	G	95.3	Very high	97.4	Very high	13 Å²	13	33 Å²	33	13%	0.134	19%	0.188	C	C	.	.	S	Bend	trans	-146.5	-162.2	-173	0	0	0	0	0	111.9	V174 N179	V174-G177 WeakPolarHBondContact O-CA 3.48Å; V174-G177 PolarHBondContact O-N 3.05Å; G177-N179 PolarHBondContact O-N 3.03Å
178	P	94.1	Very high	97.4	Very high	27 Å²	27	33 Å²	33	18%	0.175	19%	0.187	C	C	.	.			trans	-58.2	138.5	171.3	-20.6	32.3	0	0	0	110.2	A180 V233 I263	P178-A180 PolarHBondContact O-N 3.1Å; P178-V233 HydrophobicContact CB-CG2 3.73Å; P178-V233 HydrophobicContact CG-CG2 3.86Å; P178-I263 HydrophobicContact CG-CB 3.76Å; P178-I263 HydrophobicContact CG-CG2 3.48Å; P178-I263 VanDerWaalsContact CG-CG2 3.48Å
179	N	93.4	Very high	97.5	Very high	178 Å²	178	33.2 Å²	33.2	95%	0.952	19%	0.188	S	C	*	.	S	Bend	trans	-73	73.4	175.7	-173.7	15.1	0	0	0	110.7	G177	G177-N179 PolarHBondContact O-N 3.03Å
180	A	93.6	Very high	97.4	Very high	27 Å²	27	34.7 Å²	34.7	22%	0.223	20%	0.197	C	C	.	.			trans	-146	145.4	-179.1	0	0	0	0	0	110.5	P178 T231	P178-A180 PolarHBondContact O-N 3.1Å; A180-T231 HydrophobicContact CB-CG2 3.77Å
181	T	97.5	Very high	97.4	Very high	91 Å²	91	40.3 Å²	40.3	56%	0.558	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.5	126.5	169.1	-58.9	0	0	0	0	107.3	L171 V172	L171-T181 HydrophobicContact CB-CG2 3.91Å; L171-T181 HydrophobicContact CD1-CG2 4.48Å; L171-T181 HydrophobicContact CD2-CG2 4.39Å; L171-T181 HydrophobicContact CG-CG2 4.48Å; V172-T181 WeakPolarHBondContact O-CA 3.45Å
182	L	98.2	Very high	97.3	Very high	6 Å²	6	39.3 Å²	39.3	3%	0.031	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	160	-178.8	68.8	116	0	0	0	110.9	L171 V172 A184 F223 L227 Q230	L171-L182 CarbonylContact C-O 3.55Å; L171-L182 WeakPolarHBondContact CA-O 3.46Å; V172-L182 PolarHBondContact N-O 3.32Å; V172-L182 PolarHBondContact O-N 2.86Å; L182-A184 HydrophobicContact CD1-CB 3.73Å; L182-F223 HydrophobicContact CD1-CD2 4.33Å; L182-F223 HydrophobicContact CD1-CE2 4.19Å; L182-F223 HydrophobicContact CD2-CE2 3.81Å; L182-F223 HydrophobicContact CD2-CZ 3.97Å; L182-F223 HydrophobicContact CG-CE2 4.31Å; L182-L227 HydrophobicContact CD2-CB 3.88Å; L182-L227 HydrophobicContact CD2-CD1 3.49Å; L182-L227 VanDerWaalsContact CD2-CD1 3.49Å; L182-L227 HydrophobicContact CD2-CG 4.28Å; L182-Q230 HydrophobicContact CB-CB 4.37Å
183	R	98.7	Very high	97.2	Very high	56 Å²	56	42.5 Å²	42.5	21%	0.211	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	119.7	168	178.8	168.2	-69.1	-79.7	-6.6	108.8	S146 T169 D170 L171 Q230	S146-R183 PolarHBondContact O-NH1 2.03Å; S146-R183 PolarHBondContact O-NH2 2.8Å; T169-R183 PolarHBondContact O-NH1 2.92Å; T169-R183 PolarHBondContact OG1-NH1 3.4Å; D170-R183 WeakPolarHBondContact O-CA 3.38Å; L171-R183 HydrophobicContact CD2-CB 4.27Å; R183-Q230 PolarHBondContact O-NE2 2.87Å; R183-Q230 PolarHBondContact O-OE1 2.9Å
184	A	98.6	Very high	97.1	Very high	1 Å²	1	50.3 Å²	50.3	1%	0.008	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	157.9	-179.9	0	0	0	0	0	111.3	T169 D170 V172 L182 F223	T169-A184 WeakPolarHBondContact CA-O 3.17Å; T169-A184 WeakPolarHBondContact CB-O 3.33Å; D170-A184 PolarHBondContact N-O 2.99Å; D170-A184 PolarHBondContact O-N 2.76Å; V172-A184 HydrophobicContact CB-CB 4.42Å; V172-A184 HydrophobicContact CG2-CB 3.88Å; L182-A184 HydrophobicContact CD1-CB 3.73Å; A184-F223 HydrophobicContact CB-CD2 4Å
185	N	98.8	Very high	97	Very high	31 Å²	31	50.6 Å²	50.6	17%	0.166	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	135.5	162.2	-65.3	-51.9	0	0	0	109.5	G168 T169 L220 E221	G168-N185 WeakPolarHBondContact O-CA 3.46Å; T169-N185 WeakPolarHBondContact CG2-OD1 3.26Å; N185-L220 HydrophobicContact CB-CD1 3.91Å; N185-L220 HydrophobicContact CB-CG 4.22Å; N185-E221 PolarHBondContact ND2-N 3.48Å; N185-E221 PolarHBondContact ND2-O 3.21Å
186	V	98.7	Very high	97	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.012	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	123.1	177.8	-172.2	0	0	0	0	108.3	V107 F125 V127 G168 D170 V172	V107-V186 HydrophobicContact CG1-CG2 4.39Å; F125-V186 HydrophobicContact CD1-CB 4.4Å; F125-V186 HydrophobicContact CD1-CG1 4.36Å; F125-V186 HydrophobicContact CD1-CG2 3.81Å; F125-V186 HydrophobicContact CE1-CG1 4.2Å; F125-V186 HydrophobicContact CE1-CG2 3.74Å; V127-V186 HydrophobicContact CG2-CG1 3.69Å; G168-V186 PolarHBondContact N-O 3.43Å; G168-V186 PolarHBondContact O-N 2.77Å; D170-V186 HydrophobicContact CB-CG2 4.49Å; V172-V186 HydrophobicContact CG2-CG2 4.25Å
187	A	98.7	Very high	96.9	Very high	2 Å²	2	47.5 Å²	47.5	2%	0.017	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	113.5	168.4	0	0	0	0	0	109.7	F125 A126 V127 V154 W163 L167 I189	F125-A187 PolarHBondContact O-N 2.89Å; A126-A187 CarbonylContact C-O 3.56Å; A126-A187 VanDerWaalsContact CA-O 3.27Å; A126-A187 WeakPolarHBondContact CA-O 3.48Å; A126-A187 HydrophobicContact CB-CB 3.77Å; V127-A187 PolarHBondContact N-O 3.06Å; V154-A187 HydrophobicContact CG1-CB 3.99Å; W163-A187 HydrophobicContact CH2-CB 3.83Å; W163-A187 HydrophobicContact CZ3-CB 3.84Å; L167-A187 HydrophobicContact CD2-CB 3.94Å; A187-I189 PolarHBondContact O-N 2.79Å
188	A	98.8	Very high	96.9	Very high	1 Å²	1	52 Å²	52	1%	0.008	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	99.6	175.9	0	0	0	0	0	109.7	A129 R141 G165 E166 T190	A129-A188 HydrophobicContact CB-CB 3.53Å; R141-A188 HydrophobicContact CG-CB 4.48Å; G165-A188 CarbonylContact C-O 3.59Å; G165-A188 WeakPolarHBondContact CA-O 3.37Å; E166-A188 PolarHBondContact N-O 3.2Å; E166-A188 WeakPolarHBondContact O-CB 3.26Å; E166-A188 PolarHBondContact O-N 3.12Å; A188-T190 PolarHBondContact O-N 3.34Å
189	I	98.8	Very high	96.7	Very high	4 Å²	4	52.5 Å²	52.5	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	117.3	-177.8	-59.8	170.6	0	0	0	109.3	A126 V127 A129 W163 E164 A187 Q191 F195 F196	A126-I189 HydrophobicContact CB-CD1 3.87Å; A126-I189 HydrophobicContact CB-CG1 4.04Å; V127-I189 WeakPolarHBondContact O-CB 3.39Å; V127-I189 PolarHBondContact O-N 2.83Å; A129-I189 PolarHBondContact N-O 2.89Å; W163-I189 HydrophobicContact CB-CD1 4.34Å; W163-I189 HydrophobicContact CB-CG1 4.38Å; W163-I189 HydrophobicContact CB-CG2 3.89Å; W163-I189 HydrophobicContact CD2-CD1 4.17Å; W163-I189 HydrophobicContact CD2-CG1 4.06Å; W163-I189 HydrophobicContact CE3-CG1 3.94Å; W163-I189 HydrophobicContact CG-CD1 4.06Å; W163-I189 HydrophobicContact CG-CG1 4.25Å; E164-I189 WeakPolarHBondContact O-CA 3.18Å; A187-I189 PolarHBondContact O-N 2.79Å; I189-Q191 WeakPolarHBondContact CG2-O 3.26Å; I189-F195 HydrophobicContact CD1-CD1 4.15Å; I189-F195 HydrophobicContact CD1-CE1 3.52Å; I189-F195 HydrophobicContact CD1-CZ 4.12Å; I189-F196 HydrophobicContact CD1-CZ 4.11Å; I189-F196 HydrophobicContact CG2-CE2 4.25Å; I189-F196 HydrophobicContact CG2-CZ 4.38Å
190	T	98.3	Very high	96.6	Very high	47 Å²	47	44.2 Å²	44.2	29%	0.288	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	-25.1	178.9	54.3	0	0	0	0	112.1	E164 A188	E164-T190 PolarHBondContact O-N 2.81Å; A188-T190 PolarHBondContact O-N 3.34Å
191	Q	98.1	Very high	96.7	Very high	119 Å²	119	45.2 Å²	45.2	56%	0.556	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-141.2	147	176.2	-58	-179.6	41.9	0	0	110.8	W163 E164 I189	W163-Q191 WeakPolarHBondContact CA-O 3.25Å; E164-Q191 HydrophobicContact CB-CB 4.31Å; E164-Q191 PolarHBondContact N-O 3.18Å; E164-Q191 PolarHBondContact O-N 2.71Å; I189-Q191 WeakPolarHBondContact CG2-O 3.26Å
192	S	97.8	Very high	96.7	Very high	33 Å²	33	41.2 Å²	41.2	23%	0.231	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	150.2	176.7	62.3	0	0	0	0	112	R162 F196	R162-S192 WeakPolarHBondContact O-CA 3.46Å; S192-F196 WeakPolarHBondContact OG-CD2 3.29Å
193	D	96.8	Very high	96.7	Very high	68 Å²	68	41.1 Å²	41.1	36%	0.364	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	125.6	167.8	175.6	24.3	0	0	0	108.6	G161 R162 F195	G161-D193 CarbonylContact C-O 3.54Å; G161-D193 WeakPolarHBondContact CA-O 3.36Å; R162-D193 HydrophobicContact CG-CB 4.08Å; R162-D193 PolarHBondContact N-O 3.22Å; R162-D193 PolarHBondContact O-N 3.18Å; D193-F195 PolarHBondContact O-N 3.16Å
194	R	94.3	Very high	96.7	Very high	194 Å²	194	38.4 Å²	38.4	73%	0.732	20%	0.198	S	C	*	.	S	Bend	trans	48.2	34.8	-179.5	-72.6	177.8	-92.5	176.8	-6.6	114.5	Q160	Q160-R194 WeakPolarHBondContact O-CB 3.34Å
195	F	96.1	Very high	96.7	Very high	18 Å²	18	38.6 Å²	38.6	8%	0.079	20%	0.199	C	C	.	.			trans	-96.2	-66	173.1	177.8	-111.6	0	0	0	110.8	Y158 W163 I189 D193 I197 W202 I205	Y158-F195 HydrophobicContact CD2-CD2 4.44Å; Y158-F195 AromaticContact CE2-CD2 3.94Å; Y158-F195 HydrophobicContact CE2-CD2 3.94Å; Y158-F195 AromaticContact CE2-CE2 3.98Å; Y158-F195 HydrophobicContact CE2-CE2 3.98Å; W163-F195 HydrophobicContact CB-CG 4.5Å; W163-F195 AromaticContact CD1-CD2 3.58Å; W163-F195 AromaticContact CD1-CE2 3.59Å; W163-F195 AromaticContact CD1-CG 3.89Å; W163-F195 AromaticContact CD1-CZ 3.92Å; W163-F195 AromaticContact NE1-CE2 3.9Å; I189-F195 HydrophobicContact CD1-CD1 4.15Å; I189-F195 HydrophobicContact CD1-CE1 3.52Å; I189-F195 HydrophobicContact CD1-CZ 4.12Å; D193-F195 PolarHBondContact O-N 3.16Å; F195-I197 PolarHBondContact O-N 3.49Å; F195-W202 HydrophobicContact CD1-CZ3 4.41Å; F195-W202 HydrophobicContact CE1-CH2 4.49Å; F195-W202 AromaticContact CE1-CZ3 3.92Å; F195-W202 HydrophobicContact CE1-CZ3 3.92Å; F195-W202 HydrophobicContact CZ-CH2 4.45Å; F195-W202 HydrophobicContact CZ-CZ3 4.06Å; F195-W202 VanDerWaalsContact O-CH2 3.31Å; F195-W202 WeakPolarHBondContact O-CH2 3.39Å; F195-I205 HydrophobicContact CE2-CD1 4.31Å; F195-I205 HydrophobicContact CE2-CG2 4.29Å; F195-I205 HydrophobicContact CZ-CB 4Å; F195-I205 HydrophobicContact CZ-CG2 3.74Å
196	F	96.9	Very high	96.7	Very high	11 Å²	11	37.2 Å²	37.2	5%	0.048	19%	0.192	C	C	.	.	S	Bend	trans	-67.1	132.4	176.8	-62.1	-62.9	0	0	0	110.8	H132 F134 L135 I189 S192 W202	H132-F196 AromaticContact CE1-CD2 3.99Å; H132-F196 AromaticContact CG-CD2 3.89Å; H132-F196 AromaticContact ND1-CD2 3.82Å; F134-F196 HydrophobicContact CB-CB 4.31Å; F134-F196 WeakPolarHBondContact CD2-O 3.46Å; L135-F196 HydrophobicContact CD1-CD1 4.46Å; L135-F196 HydrophobicContact CD1-CD2 4.2Å; L135-F196 HydrophobicContact CD1-CE1 4.1Å; L135-F196 HydrophobicContact CD1-CE2 3.82Å; L135-F196 HydrophobicContact CD1-CZ 3.77Å; L135-F196 HydrophobicContact CD2-CD1 3.51Å; L135-F196 HydrophobicContact CD2-CD2 4.42Å; L135-F196 HydrophobicContact CD2-CE1 3.67Å; L135-F196 HydrophobicContact CD2-CG 3.92Å; L135-F196 HydrophobicContact CD2-CZ 4.21Å; L135-F196 HydrophobicContact CG-CD1 4.2Å; L135-F196 HydrophobicContact CG-CD2 4.25Å; L135-F196 HydrophobicContact CG-CE1 4.31Å; L135-F196 HydrophobicContact CG-CE2 4.35Å; L135-F196 HydrophobicContact CG-CG 4.18Å; L135-F196 HydrophobicContact CG-CZ 4.38Å; I189-F196 HydrophobicContact CD1-CZ 4.11Å; I189-F196 HydrophobicContact CG2-CE2 4.25Å; I189-F196 HydrophobicContact CG2-CZ 4.38Å; S192-F196 WeakPolarHBondContact OG-CD2 3.29Å; F196-W202 HydrophobicContact CD1-CE3 4.18Å; F196-W202 HydrophobicContact CD1-CH2 4.39Å; F196-W202 AromaticContact CD1-CZ3 3.6Å; F196-W202 HydrophobicContact CD1-CZ3 3.6Å; F196-W202 HydrophobicContact CE1-CZ3 4.05Å
197	I	94.8	Very high	96.7	Very high	69 Å²	69	37.1 Å²	37.1	35%	0.354	19%	0.191	S	C	.	.	P	Polyproline II helix	trans	-102.5	128.5	-179.3	-59.7	174.1	0	0	0	108.9	Q99 F195 G199 S200 W202	Q99-I197 HydrophobicContact CG-CG2 4.27Å; F195-I197 PolarHBondContact O-N 3.49Å; I197-G199 PolarHBondContact O-N 2.86Å; I197-S200 VanDerWaalsContact O-CB 3.3Å; I197-S200 WeakPolarHBondContact O-CB 3.49Å; I197-S200 PolarHBondContact O-N 3.17Å; I197-S200 PolarHBondContact O-OG 3.35Å; I197-W202 HydrophobicContact CB-CZ2 4.36Å; I197-W202 HydrophobicContact CD1-CZ2 4.05Å; I197-W202 HydrophobicContact CG1-CZ2 4.07Å
198	N	93.6	Very high	96.7	Very high	108 Å²	108	37.1 Å²	37.1	58%	0.578	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	131.2	176.1	-170.6	15.1	0	0	0	111.1	Q99 F134 S200	Q99-N198 PolarHBondContact NE2-O 3.14Å; F134-N198 HydrophobicContact CD1-CB 3.69Å; F134-N198 HydrophobicContact CD2-CB 4.13Å; F134-N198 HydrophobicContact CE1-CB 3.76Å; F134-N198 HydrophobicContact CE2-CB 4.19Å; F134-N198 HydrophobicContact CG-CB 3.91Å; F134-N198 HydrophobicContact CZ-CB 4.02Å; N198-S200 PolarHBondContact O-N 3.42Å
199	G	89.6	Confident	96.7	Very high	37 Å²	37	37 Å²	37	38%	0.381	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	1.4	179.2	0	0	0	0	0	115.8	I197 N201	I197-G199 PolarHBondContact O-N 2.86Å; G199-N201 VanDerWaalsContact C-N 3.3Å; G199-N201 PolarHBondContact O-N 2.68Å; G199-N201 PolarHBondContact O-ND2 3.02Å
200	S	92.9	Very high	96.7	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.021	19%	0.192	C	C	.	.			trans	-71.6	-21.5	-179.1	64.2	0	0	0	0	114.8	Y102 I197 N198 W202	Y102-S200 WeakPolarHBondContact CE1-O 3.28Å; I197-S200 VanDerWaalsContact O-CB 3.3Å; I197-S200 WeakPolarHBondContact O-CB 3.49Å; I197-S200 PolarHBondContact O-N 3.17Å; I197-S200 PolarHBondContact O-OG 3.35Å; N198-S200 PolarHBondContact O-N 3.42Å; S200-W202 VanDerWaalsContact CB-NE1 3.33Å; S200-W202 PolarHBondContact O-N 3.27Å
201	N	95.1	Very high	96.7	Very high	49 Å²	49	36.5 Å²	36.5	26%	0.262	19%	0.188	S	C	.	.			trans	64.9	4	-179.6	-52.2	-63.6	0	0	0	116.4	Y102 N115 R136 G199	Y102-N201 HydrophobicContact CE1-CB 4.1Å; N115-N201 WeakPolarHBondContact CB-O 3.27Å; N115-N201 PolarHBondContact ND2-O 3.13Å; R136-N201 VanDerWaalsContact CZ-OD1 3.25Å; R136-N201 PolarHBondContact NH1-OD1 2.86Å; R136-N201 VanDerWaalsContact NH1-OD1 3.12Å; R136-N201 PolarHBondContact NH2-OD1 3.01Å; G199-N201 VanDerWaalsContact C-N 3.3Å; G199-N201 PolarHBondContact O-N 2.68Å; G199-N201 PolarHBondContact O-ND2 3.02Å
202	W	97.8	Very high	96.7	Very high	6 Å²	6	34.1 Å²	34.1	2%	0.023	18%	0.18	C	C	.	.			trans	-100	149.8	170.2	56.2	-104.1	0	0	0	111.7	Q99 Y102 N115 L117 F195 F196 I197 S200	Q99-W202 PolarHBondContact O-NE1 3.32Å; Y102-W202 HydrophobicContact CD1-CB 4.15Å; Y102-W202 HydrophobicContact CG-CB 4.01Å; N115-W202 HydrophobicContact CB-CB 4.26Å; N115-W202 CarbonylContact O-C 3.6Å; N115-W202 WeakPolarHBondContact O-CA 3.33Å; N115-W202 WeakPolarHBondContact O-CB 3.41Å; L117-W202 HydrophobicContact CB-CD2 4.08Å; L117-W202 HydrophobicContact CB-CE3 4.4Å; L117-W202 HydrophobicContact CB-CG 4.18Å; L117-W202 HydrophobicContact CD2-CZ2 4.27Å; F195-W202 HydrophobicContact CD1-CZ3 4.41Å; F195-W202 HydrophobicContact CE1-CH2 4.49Å; F195-W202 AromaticContact CE1-CZ3 3.92Å; F195-W202 HydrophobicContact CE1-CZ3 3.92Å; F195-W202 HydrophobicContact CZ-CH2 4.45Å; F195-W202 HydrophobicContact CZ-CZ3 4.06Å; F195-W202 VanDerWaalsContact O-CH2 3.31Å; F195-W202 WeakPolarHBondContact O-CH2 3.39Å; F196-W202 HydrophobicContact CD1-CE3 4.18Å; F196-W202 HydrophobicContact CD1-CH2 4.39Å; F196-W202 AromaticContact CD1-CZ3 3.6Å; F196-W202 HydrophobicContact CD1-CZ3 3.6Å; F196-W202 HydrophobicContact CE1-CZ3 4.05Å; I197-W202 HydrophobicContact CB-CZ2 4.36Å; I197-W202 HydrophobicContact CD1-CZ2 4.05Å; I197-W202 HydrophobicContact CG1-CZ2 4.07Å; S200-W202 VanDerWaalsContact CB-NE1 3.33Å; S200-W202 PolarHBondContact O-N 3.27Å
203	E	98.7	Very high	96.6	Very high	4 Å²	4	34.1 Å²	34.1	2%	0.019	18%	0.176	C	C	.	.			trans	-123.5	4.6	-172.2	-56.1	106.3	-180	0	0	113	L114 N115 G128 L135 R137	L114-E203 HydrophobicContact CD2-CB 4.13Å; N115-E203 WeakPolarHBondContact CB-OE2 3.48Å; N115-E203 PolarHBondContact N-OE2 3.46Å; N115-E203 PolarHBondContact O-N 3.49Å; G128-E203 PolarHBondContact N-O 2.91Å; L135-E203 HydrophobicContact CD2-CB 3.86Å; L135-E203 HydrophobicContact CD2-CG 3.81Å; R137-E203 HydrophobicContact CG-CG 3.99Å; R137-E203 WeakPolarHBondContact CG-OE1 3.48Å; R137-E203 IonicContact CZ-OE2 3.18Å; R137-E203 IonicContact NE-OE1 2.74Å; R137-E203 PolarHBondContact NE-OE1 3.08Å; R137-E203 IonicContact NE-OE2 3.9Å; R137-E203 PolarHBondContact NE-OE2 2.82Å; R137-E203 IonicContact NH2-OE2 3.24Å; R137-E203 WeakPolarHBondContact O-CG 3.38Å
204	G	98.6	Very high	96.7	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.8	-176.5	174.5	0	0	0	0	0	111.8	N115 L117 A126	N115-G204 PolarHBondContact O-N 3.27Å; L117-G204 WeakPolarHBondContact CB-O 3.44Å; L117-G204 PolarHBondContact N-O 3.48Å; A126-G204 CarbonylContact O-C 3.53Å; A126-G204 WeakPolarHBondContact O-CA 3.25Å
205	I	98.7	Very high	96.9	Very high	5 Å²	5	27.3 Å²	27.3	3%	0.026	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	137.3	179.9	-170.3	168.9	0	0	0	110.3	I116 L117 D119 F125 A126 F195	I116-I205 VanDerWaalsContact CG2-C 3.43Å; L117-I205 HydrophobicContact CB-CB 4.39Å; L117-I205 HydrophobicContact CB-CG1 4.26Å; L117-I205 HydrophobicContact CD2-CD1 3.87Å; L117-I205 HydrophobicContact CD2-CG1 3.99Å; L117-I205 HydrophobicContact CG-CG1 4.25Å; D119-I205 HydrophobicContact CB-CD1 3.71Å; D119-I205 HydrophobicContact CB-CG1 3.58Å; D119-I205 WeakPolarHBondContact OD2-CD1 3.21Å; F125-I205 WeakPolarHBondContact CA-O 3.46Å; F125-I205 WeakPolarHBondContact CD2-O 3.15Å; A126-I205 HydrophobicContact CB-CG2 3.91Å; A126-I205 PolarHBondContact N-O 2.84Å; A126-I205 PolarHBondContact O-N 3.43Å; F195-I205 HydrophobicContact CE2-CD1 4.31Å; F195-I205 HydrophobicContact CE2-CG2 4.29Å; F195-I205 HydrophobicContact CZ-CB 4Å; F195-I205 HydrophobicContact CZ-CG2 3.74Å
206	L	98.9	Very high	96.9	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	94.7	175	-176.4	65.3	0	0	0	108.4	M105 I116 L117 D119 F125 L208 F223	M105-L206 HydrophobicContact CE-CD1 4.24Å; M105-L206 HydrophobicContact CE-CD2 4.48Å; M105-L206 HydrophobicContact SD-CD1 4.23Å; M105-L206 HydrophobicContact SD-CD2 3.95Å; M105-L206 HydrophobicContact SD-CG 4.49Å; I116-L206 HydrophobicContact CG2-CB 3.54Å; I116-L206 VanDerWaalsContact CG2-N 3.31Å; L117-L206 PolarHBondContact O-N 3.38Å; D119-L206 PolarHBondContact N-O 2.88Å; D119-L206 VanDerWaalsContact O-O 3.11Å; F125-L206 HydrophobicContact CB-CD1 4.22Å; F125-L206 HydrophobicContact CD2-CD1 3.88Å; F125-L206 HydrophobicContact CG-CD1 4.14Å; L206-L208 HydrophobicContact CD2-CD2 3.84Å; L206-L208 HydrophobicContact CD2-CG 4.26Å; L206-L208 HydrophobicContact CG-CD2 3.92Å; L206-L208 HydrophobicContact CG-CG 4.13Å; L206-L208 PolarHBondContact O-N 3.47Å; L206-F223 HydrophobicContact CD1-CB 3.62Å; L206-F223 HydrophobicContact CD1-CD1 3.63Å; L206-F223 HydrophobicContact CD1-CD2 4.27Å; L206-F223 HydrophobicContact CD1-CE1 4.34Å; L206-F223 HydrophobicContact CD1-CG 3.57Å; L206-F223 HydrophobicContact CD2-CD1 4.3Å; L206-F223 HydrophobicContact CD2-CE1 4.44Å; L206-F223 HydrophobicContact CG-CD1 4.43Å
207	G	98.6	Very high	96.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	117	169.3	0	0	0	0	0	111.2	D119 S122 N124	D119-G207 CarbonylContact O-C 3.59Å; D119-G207 WeakPolarHBondContact O-CA 3.37Å; S122-G207 VanDerWaalsContact C-CA 3.45Å; S122-G207 CarbonylContact O-C 3.53Å; S122-G207 WeakPolarHBondContact O-CA 3.46Å; N124-G207 WeakPolarHBondContact O-CA 3.3Å; N124-G207 PolarHBondContact O-N 3.39Å
208	L	98.8	Very high	96.8	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.01	18%	0.18	C	C	.	.			trans	-105.9	-0.9	-177.2	-71	175.7	0	0	0	113.8	V118 D119 T120 S122 L206 F224 F237 M261 Y286 R434	V118-L208 HydrophobicContact CG1-CD1 3.7Å; D119-L208 PolarHBondContact O-N 3.12Å; T120-L208 HydrophobicContact CG2-CB 4.06Å; T120-L208 HydrophobicContact CG2-CD1 4.2Å; S122-L208 PolarHBondContact O-N 2.81Å; L206-L208 HydrophobicContact CD2-CD2 3.84Å; L206-L208 HydrophobicContact CD2-CG 4.26Å; L206-L208 HydrophobicContact CG-CD2 3.92Å; L206-L208 HydrophobicContact CG-CG 4.13Å; L206-L208 PolarHBondContact O-N 3.47Å; L208-F224 HydrophobicContact CD2-CB 4.24Å; L208-F224 HydrophobicContact CD2-CD2 3.92Å; L208-F224 HydrophobicContact CD2-CG 4.44Å; L208-F237 HydrophobicContact CB-CE1 4.31Å; L208-F237 HydrophobicContact CB-CZ 3.9Å; L208-F237 HydrophobicContact CD1-CD2 4.38Å; L208-F237 HydrophobicContact CD1-CE2 3.82Å; L208-F237 HydrophobicContact CD1-CZ 3.95Å; L208-F237 HydrophobicContact CG-CZ 4.44Å; L208-M261 HydrophobicContact CD1-SD 4.27Å; L208-Y286 WeakPolarHBondContact O-CE2 3.21Å; L208-Y286 PolarHBondContact O-OH 2.94Å; L208-R434 PolarHBondContact O-NH1 2.9Å
209	A	98.6	Very high	97	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.182	C	C	.	.	S	Bend	trans	-74.1	-166.3	174.3	0	0	0	0	0	111.7	S122 S123 I213 W284 Y286 R434	S122-A209 VanDerWaalsContact O-CB 3.26Å; S122-A209 WeakPolarHBondContact O-CB 3.48Å; S122-A209 PolarHBondContact O-N 3.08Å; S123-A209 WeakPolarHBondContact OG-CB 3.39Å; A209-I213 HydrophobicContact CB-CD1 3.91Å; A209-W284 WeakPolarHBondContact CB-O 3.48Å; A209-Y286 HydrophobicContact CB-CE2 4.32Å; A209-R434 PolarHBondContact O-NH1 2.95Å
210	Y	98.7	Very high	97.4	Very high	14 Å²	14	32 Å²	32	6%	0.055	17%	0.167	C	C	.	.			trans	-96.2	164.3	-171.4	-58.7	-89.1	0	0	0	112.6	S123 D212 I213 I280 E283 W284 Y286 R434	S123-Y210 VanDerWaalsContact CB-O 3.24Å; S123-Y210 WeakPolarHBondContact CB-O 3.16Å; S123-Y210 PolarHBondContact OG-N 2.88Å; S123-Y210 PolarHBondContact OG-O 3.37Å; Y210-D212 PolarHBondContact O-N 3.47Å; Y210-I213 PolarHBondContact O-N 3.16Å; Y210-I280 WeakPolarHBondContact OH-CD1 3.48Å; Y210-E283 WeakPolarHBondContact CB-O 3.49Å; Y210-E283 HydrophobicContact CD1-CB 3.81Å; Y210-E283 HydrophobicContact CD1-CG 4.31Å; Y210-E283 VanDerWaalsContact CD2-C 3.42Å; Y210-E283 HydrophobicContact CD2-CB 4.11Å; Y210-E283 HydrophobicContact CE1-CB 3.93Å; Y210-E283 HydrophobicContact CE1-CG 3.91Å; Y210-E283 HydrophobicContact CE2-CB 4.22Å; Y210-E283 HydrophobicContact CE2-CG 4.4Å; Y210-E283 VanDerWaalsContact CG-C 3.5Å; Y210-E283 HydrophobicContact CG-CB 3.9Å; Y210-W284 WeakPolarHBondContact CB-O 3.4Å; Y210-W284 WeakPolarHBondContact CD2-O 3.26Å; Y210-W284 PolarHBondContact N-O 3.12Å; Y210-Y286 AromaticContact CE2-CD1 3.88Å; Y210-Y286 HydrophobicContact CE2-CD1 3.88Å; Y210-Y286 AromaticContact CE2-CE1 3.67Å; Y210-Y286 HydrophobicContact CE2-CE1 3.67Å; Y210-Y286 AromaticContact CZ-CE1 3.84Å; Y210-R434 HydrophobicContact CE1-CB 4.44Å; Y210-R434 HydrophobicContact CE1-CG 4.25Å
211	A	98.1	Very high	97.6	Very high	26 Å²	26	34.1 Å²	34.1	22%	0.215	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-58.4	-30.8	-175.3	0	0	0	0	0	114.3	I213 A214 E218 P222	A211-I213 PolarHBondContact O-N 3.02Å; A211-A214 WeakPolarHBondContact O-CB 3.22Å; A211-A214 PolarHBondContact O-N 3.42Å; A211-E218 VanDerWaalsContact O-CA 3.31Å; A211-E218 WeakPolarHBondContact O-CA 3.24Å; A211-P222 HydrophobicContact CB-CG 4.19Å
212	D	97.8	Very high	97.8	Very high	69 Å²	69	32 Å²	32	37%	0.369	17%	0.165	S	C	.	.	G	3₁₀ helix	trans	-49.2	-29.6	-178.8	-102	37.9	0	0	0	114.8	Y210 R282 W284	Y210-D212 PolarHBondContact O-N 3.47Å; D212-R282 IonicContact OD2-CZ 2.81Å; D212-R282 IonicContact OD2-NE 3.98Å; D212-R282 PolarHBondContact OD2-NE 3.11Å; D212-R282 IonicContact OD2-NH2 2.9Å; D212-R282 PolarHBondContact OD2-NH2 2.87Å; D212-W284 HydrophobicContact CB-CB 3.56Å
213	I	96.4	Very high	97.9	Very high	32 Å²	32	31.9 Å²	31.9	16%	0.164	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-112.2	7.8	-179.9	65.1	173.5	0	0	0	113.2	S123 A209 Y210 A211 W284 Y285	S123-I213 WeakPolarHBondContact OG-CG1 3.29Å; A209-I213 HydrophobicContact CB-CD1 3.91Å; Y210-I213 PolarHBondContact O-N 3.16Å; A211-I213 PolarHBondContact O-N 3.02Å; I213-W284 HydrophobicContact CG2-CB 4.12Å; I213-W284 HydrophobicContact CG2-CE3 4.23Å; I213-Y285 HydrophobicContact CD1-CD1 3.52Å; I213-Y285 HydrophobicContact CD1-CD2 4.29Å; I213-Y285 HydrophobicContact CD1-CE1 3.35Å; I213-Y285 HydrophobicContact CD1-CE2 4.14Å; I213-Y285 HydrophobicContact CD1-CG 3.98Å; I213-Y285 HydrophobicContact CG2-CD2 4.3Å; I213-Y285 HydrophobicContact CG2-CE2 3.86Å
214	A	97.7	Very high	97.9	Very high	4 Å²	4	31.8 Å²	31.8	3%	0.033	17%	0.165	C	C	.	.			trans	-64.4	147.8	173.3	0	0	0	0	0	110.5	A211 D217 L220	A211-A214 WeakPolarHBondContact O-CB 3.22Å; A211-A214 PolarHBondContact O-N 3.42Å; A214-D217 CarbonylContact O-C 3.49Å; A214-D217 WeakPolarHBondContact O-CA 3.1Å; A214-D217 PolarHBondContact O-N 2.86Å; A214-L220 WeakPolarHBondContact CB-O 3.38Å
215	R	97.6	Very high	97.9	Very high	115 Å²	115	33.9 Å²	33.9	43%	0.434	18%	0.176	S	C	.	.	S	Bend	trans	-109.4	142.4	176.4	-65.3	-62	-167.5	149.6	1.3	110.9	N124 V154 V156 L220	N124-R215 PolarHBondContact ND2-O 3.19Å; N124-R215 PolarHBondContact OD1-N 2.82Å; V154-R215 HydrophobicContact CG2-CB 3.85Å; V156-R215 HydrophobicContact CG1-CG 4.34Å; V156-R215 HydrophobicContact CG2-CB 3.6Å; V156-R215 HydrophobicContact CG2-CG 3.82Å; R215-L220 WeakPolarHBondContact O-CD2 3.28Å
216	P	96.9	Very high	97.9	Very high	46 Å²	46	33.8 Å²	33.8	30%	0.299	18%	0.176	S	C	.	.	S	Bend	cis	-73	-22.7	4.3	28.1	-35.4	0	0	0	114.5	R152 L167	R152-P216 VanDerWaalsContact NH2-CG 3.32Å; L167-P216 HydrophobicContact CD1-CG 4.39Å
217	D	96.1	Very high	97.8	Very high	54 Å²	54	34 Å²	34	29%	0.289	18%	0.177	S	C	.	.			trans	-157.5	171.3	-176.1	59.5	72.4	0	0	0	110.6	R152 A214 T219 L220	R152-D217 IonicContact CZ-OD2 3.9Å; R152-D217 IonicContact NH2-OD2 2.76Å; R152-D217 PolarHBondContact NH2-OD2 3.09Å; A214-D217 CarbonylContact O-C 3.49Å; A214-D217 WeakPolarHBondContact O-CA 3.1Å; A214-D217 PolarHBondContact O-N 2.86Å; D217-T219 PolarHBondContact O-N 3.03Å; D217-T219 VanDerWaalsContact O-N 3.09Å; D217-T219 WeakPolarHBondContact OD1-CB 3.33Å; D217-T219 VanDerWaalsContact OD1-CG2 3.31Å; D217-T219 WeakPolarHBondContact OD1-CG2 3.14Å; D217-T219 PolarHBondContact OD1-N 3.1Å; D217-T219 PolarHBondContact OD1-OG1 3.42Å; D217-L220 PolarHBondContact O-N 3.49Å; D217-L220 VanDerWaalsContact O-N 3.15Å
218	E	94.7	Very high	97.8	Very high	126 Å²	126	35.9 Å²	35.9	59%	0.589	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-13.7	-175.9	66.6	-175.4	-166.8	0	0	115.2	A211 L220	A211-E218 VanDerWaalsContact O-CA 3.31Å; A211-E218 WeakPolarHBondContact O-CA 3.24Å; E218-L220 PolarHBondContact O-N 3.36Å
219	T	96.4	Very high	97.8	Very high	102 Å²	102	43.2 Å²	43.2	63%	0.626	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-17.5	177.2	74	0	0	0	0	112.3	D217 E221	D217-T219 PolarHBondContact O-N 3.03Å; D217-T219 VanDerWaalsContact O-N 3.09Å; D217-T219 WeakPolarHBondContact OD1-CB 3.33Å; D217-T219 VanDerWaalsContact OD1-CG2 3.31Å; D217-T219 WeakPolarHBondContact OD1-CG2 3.14Å; D217-T219 PolarHBondContact OD1-N 3.1Å; D217-T219 PolarHBondContact OD1-OG1 3.42Å; T219-E221 PolarHBondContact O-N 3.22Å; T219-E221 VanDerWaalsContact O-N 3.13Å
220	L	97.8	Very high	97.8	Very high	14 Å²	14	47.1 Å²	47.1	7%	0.073	23%	0.234	C	C	.	.	S	Bend	trans	-79.9	95.5	174.9	-167.2	76.5	0	0	0	110	N124 L167 N185 A214 R215 D217 E218 P222	N124-L220 WeakPolarHBondContact ND2-CD2 3.5Å; L167-L220 HydrophobicContact CD1-CD1 4.15Å; L167-L220 HydrophobicContact CD1-CD2 4.36Å; L167-L220 HydrophobicContact CD2-CD1 4.4Å; L167-L220 HydrophobicContact CD2-CD2 3.79Å; N185-L220 HydrophobicContact CB-CD1 3.91Å; N185-L220 HydrophobicContact CB-CG 4.22Å; A214-L220 WeakPolarHBondContact CB-O 3.38Å; R215-L220 WeakPolarHBondContact O-CD2 3.28Å; D217-L220 PolarHBondContact O-N 3.49Å; D217-L220 VanDerWaalsContact O-N 3.15Å; E218-L220 PolarHBondContact O-N 3.36Å; L220-P222 WeakPolarHBondContact O-CD 3.35Å
221	E	98.4	Very high	97.7	Very high	48 Å²	48	48.1 Å²	48.1	22%	0.224	24%	0.242	C	C	.	.			trans	-57.7	126.2	-178.8	-174.4	177	79.2	0	0	112.9	N185 T219 D225 S226 R229	N185-E221 PolarHBondContact ND2-N 3.48Å; N185-E221 PolarHBondContact ND2-O 3.21Å; T219-E221 PolarHBondContact O-N 3.22Å; T219-E221 VanDerWaalsContact O-N 3.13Å; E221-D225 HydrophobicContact CG-CB 3.61Å; E221-S226 VanDerWaalsContact OE1-CA 3.32Å; E221-S226 WeakPolarHBondContact OE1-CA 3.46Å; E221-S226 WeakPolarHBondContact OE1-CB 3.41Å; E221-S226 PolarHBondContact OE1-OG 2.99Å; E221-R229 IonicContact OE1-CZ 2.69Å; E221-R229 IonicContact OE1-NH1 3.21Å; E221-R229 PolarHBondContact OE1-NH1 2.69Å; E221-R229 IonicContact OE1-NH2 2.98Å; E221-R229 PolarHBondContact OE1-NH2 2.84Å; E221-R229 IonicContact OE2-CZ 3Å; E221-R229 IonicContact OE2-NH1 3.72Å; E221-R229 PolarHBondContact OE2-NH1 3.43Å; E221-R229 IonicContact OE2-NH2 2.75Å
222	P	98.8	Very high	97.5	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.019	27%	0.273	C	S	.	.			trans	-65.2	161	174.5	-22.5	34.3	0	0	0	113.9	S123 A211 L220 F224 D225 S226	S123-P222 WeakPolarHBondContact O-CB 3.4Å; A211-P222 HydrophobicContact CB-CG 4.19Å; L220-P222 WeakPolarHBondContact O-CD 3.35Å; P222-F224 PolarHBondContact O-N 2.9Å; P222-D225 WeakPolarHBondContact CB-OD2 3.36Å; P222-D225 PolarHBondContact O-N 2.79Å; P222-S226 PolarHBondContact O-N 3.07Å; P222-S226 VanDerWaalsContact O-N 3.1Å
223	F	98.8	Very high	97.4	Very high	4 Å²	4	50.5 Å²	50.5	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-57.7	-44.4	-178.4	170.3	-92.7	0	0	0	113.2	M105 F125 V172 V174 L182 A184 L206 D225 S226 L227	M105-F223 HydrophobicContact CE-CD2 4.22Å; M105-F223 HydrophobicContact CE-CE1 4.31Å; M105-F223 HydrophobicContact CE-CE2 3.66Å; M105-F223 HydrophobicContact CE-CZ 3.71Å; F125-F223 HydrophobicContact CB-CB 4.23Å; V172-F223 HydrophobicContact CB-CE2 4.2Å; V172-F223 HydrophobicContact CG1-CD2 4.33Å; V172-F223 HydrophobicContact CG1-CE2 3.66Å; V174-F223 HydrophobicContact CG2-CZ 4.17Å; L182-F223 HydrophobicContact CD1-CD2 4.33Å; L182-F223 HydrophobicContact CD1-CE2 4.19Å; L182-F223 HydrophobicContact CD2-CE2 3.81Å; L182-F223 HydrophobicContact CD2-CZ 3.97Å; L182-F223 HydrophobicContact CG-CE2 4.31Å; A184-F223 HydrophobicContact CB-CD2 4Å; L206-F223 HydrophobicContact CD1-CB 3.62Å; L206-F223 HydrophobicContact CD1-CD1 3.63Å; L206-F223 HydrophobicContact CD1-CD2 4.27Å; L206-F223 HydrophobicContact CD1-CE1 4.34Å; L206-F223 HydrophobicContact CD1-CG 3.57Å; L206-F223 HydrophobicContact CD2-CD1 4.3Å; L206-F223 HydrophobicContact CD2-CE1 4.44Å; L206-F223 HydrophobicContact CG-CD1 4.43Å; F223-D225 VanDerWaalsContact C-N 3.35Å; F223-D225 PolarHBondContact O-N 2.81Å; F223-S226 WeakPolarHBondContact O-CB 3.44Å; F223-S226 PolarHBondContact O-N 2.8Å; F223-L227 HydrophobicContact CE1-CB 4.5Å; F223-L227 HydrophobicContact CE1-CD2 4.24Å; F223-L227 WeakPolarHBondContact O-CB 3.35Å; F223-L227 PolarHBondContact O-N 3.04Å
224	F	98.6	Very high	97.4	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.009	27%	0.271	C	S	.	.	H	α-helix	trans	-68.8	-36	-174.5	-155.5	-93.7	0	0	0	111.8	L208 P222 L227 V228 F237 I263	L208-F224 HydrophobicContact CD2-CB 4.24Å; L208-F224 HydrophobicContact CD2-CD2 3.92Å; L208-F224 HydrophobicContact CD2-CG 4.44Å; P222-F224 PolarHBondContact O-N 2.9Å; F224-L227 HydrophobicContact CD2-CD2 4.23Å; F224-L227 HydrophobicContact CE2-CD2 4.13Å; F224-L227 WeakPolarHBondContact O-CB 3.29Å; F224-L227 PolarHBondContact O-N 2.65Å; F224-V228 HydrophobicContact CD1-CG2 3.97Å; F224-V228 HydrophobicContact CE1-CG2 3.79Å; F224-V228 WeakPolarHBondContact O-CG2 3.04Å; F224-V228 PolarHBondContact O-N 3.37Å; F224-F237 HydrophobicContact CD1-CD1 4.43Å; F224-F237 HydrophobicContact CD2-CD1 4.04Å; F224-F237 AromaticContact CE1-CD1 3.99Å; F224-F237 HydrophobicContact CE1-CD1 3.99Å; F224-F237 HydrophobicContact CE2-CB 3.91Å; F224-F237 AromaticContact CE2-CD1 3.56Å; F224-F237 HydrophobicContact CE2-CD1 3.56Å; F224-F237 HydrophobicContact CE2-CE1 4.45Å; F224-F237 HydrophobicContact CE2-CG 4.04Å; F224-F237 HydrophobicContact CG-CD1 4.46Å; F224-F237 HydrophobicContact CZ-CB 3.94Å; F224-F237 AromaticContact CZ-CD1 3.55Å; F224-F237 HydrophobicContact CZ-CD1 3.55Å; F224-F237 HydrophobicContact CZ-CG 4.19Å; F224-I263 HydrophobicContact CE2-CG2 4.07Å
225	D	98.6	Very high	97.4	Very high	45 Å²	45	53.7 Å²	53.7	24%	0.241	28%	0.281	C	S	.	.	H	α-helix	trans	-62.7	-45.8	172.2	-60.6	-100.4	0	0	0	111.1	E221 P222 F223 L227 V228 R229 R434	E221-D225 HydrophobicContact CG-CB 3.61Å; P222-D225 WeakPolarHBondContact CB-OD2 3.36Å; P222-D225 PolarHBondContact O-N 2.79Å; F223-D225 VanDerWaalsContact C-N 3.35Å; F223-D225 PolarHBondContact O-N 2.81Å; D225-L227 VanDerWaalsContact C-N 3.31Å; D225-L227 PolarHBondContact O-N 2.75Å; D225-V228 PolarHBondContact O-N 3.38Å; D225-R229 WeakPolarHBondContact O-CB 3.05Å; D225-R229 PolarHBondContact O-N 2.71Å; D225-R434 IonicContact OD1-NH2 2.62Å; D225-R434 PolarHBondContact OD1-NH2 2.67Å; D225-R434 IonicContact OD2-CZ 2.82Å; D225-R434 IonicContact OD2-NH1 3.4Å; D225-R434 IonicContact OD2-NH2 2.99Å; D225-R434 PolarHBondContact OD2-NH2 2.78Å
226	S	98.6	Very high	97.4	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.014	27%	0.269	C	S	.	.	H	α-helix	trans	-58.4	-40.8	172.4	-88.5	0	0	0	0	112.7	E221 P222 F223 Q230	E221-S226 VanDerWaalsContact OE1-CA 3.32Å; E221-S226 WeakPolarHBondContact OE1-CA 3.46Å; E221-S226 WeakPolarHBondContact OE1-CB 3.41Å; E221-S226 PolarHBondContact OE1-OG 2.99Å; P222-S226 PolarHBondContact O-N 3.07Å; P222-S226 VanDerWaalsContact O-N 3.1Å; F223-S226 WeakPolarHBondContact O-CB 3.44Å; F223-S226 PolarHBondContact O-N 2.8Å; S226-Q230 VanDerWaalsContact O-CB 3.26Å; S226-Q230 WeakPolarHBondContact O-CB 3.48Å; S226-Q230 VanDerWaalsContact O-CG 3.27Å; S226-Q230 WeakPolarHBondContact O-CG 3.2Å; S226-Q230 PolarHBondContact O-N 2.99Å; S226-Q230 PolarHBondContact O-NE2 2.82Å
227	L	98.5	Very high	97.4	Very high	6 Å²	6	47.9 Å²	47.9	3%	0.031	25%	0.254	C	S	.	.	H	α-helix	trans	-64.6	-51.9	179.4	172.8	67.2	0	0	0	111.7	L182 F223 F224 D225 R229 Q230 T231 V233 I263	L182-L227 HydrophobicContact CD2-CB 3.88Å; L182-L227 HydrophobicContact CD2-CD1 3.49Å; L182-L227 VanDerWaalsContact CD2-CD1 3.49Å; L182-L227 HydrophobicContact CD2-CG 4.28Å; F223-L227 HydrophobicContact CE1-CB 4.5Å; F223-L227 HydrophobicContact CE1-CD2 4.24Å; F223-L227 WeakPolarHBondContact O-CB 3.35Å; F223-L227 PolarHBondContact O-N 3.04Å; F224-L227 HydrophobicContact CD2-CD2 4.23Å; F224-L227 HydrophobicContact CE2-CD2 4.13Å; F224-L227 WeakPolarHBondContact O-CB 3.29Å; F224-L227 PolarHBondContact O-N 2.65Å; D225-L227 VanDerWaalsContact C-N 3.31Å; D225-L227 PolarHBondContact O-N 2.75Å; L227-R229 VanDerWaalsContact C-N 3.32Å; L227-R229 PolarHBondContact O-N 2.89Å; L227-Q230 PolarHBondContact O-N 2.65Å; L227-T231 HydrophobicContact CD1-CG2 3.95Å; L227-T231 WeakPolarHBondContact O-CB 3.03Å; L227-T231 WeakPolarHBondContact O-CG2 3.39Å; L227-T231 PolarHBondContact O-N 2.9Å; L227-T231 VanDerWaalsContact O-N 3.11Å; L227-T231 PolarHBondContact O-OG1 2.82Å; L227-V233 HydrophobicContact CD1-CB 4.49Å; L227-V233 HydrophobicContact CD1-CG2 4.14Å; L227-V233 HydrophobicContact CD2-CG1 4.11Å; L227-V233 HydrophobicContact CG-CB 4.28Å; L227-V233 HydrophobicContact CG-CG1 4.31Å; L227-V233 HydrophobicContact CG-CG2 4.44Å; L227-I263 HydrophobicContact CD2-CG2 3.61Å
228	V	98.1	Very high	97.6	Very high	39 Å²	39	45.3 Å²	45.3	24%	0.236	24%	0.241	C	C	.	.	H	α-helix	trans	-62.6	-40.8	-180	171.4	0	0	0	0	110.9	F224 D225 T231 N235	F224-V228 HydrophobicContact CD1-CG2 3.97Å; F224-V228 HydrophobicContact CE1-CG2 3.79Å; F224-V228 WeakPolarHBondContact O-CG2 3.04Å; F224-V228 PolarHBondContact O-N 3.37Å; D225-V228 PolarHBondContact O-N 3.38Å; V228-T231 VanDerWaalsContact O-O 3.1Å; V228-N235 HydrophobicContact CG1-CB 3.86Å; V228-N235 HydrophobicContact CG2-CB 3.98Å
229	R	98	Very high	97.8	Very high	156 Å²	156	39.4 Å²	39.4	59%	0.589	21%	0.213	S	C	*	.	H	α-helix	trans	-68.7	-38.7	179.9	-173	-172.1	65.4	-146.3	-17.1	113.4	E221 D225 L227	E221-R229 IonicContact OE1-CZ 2.69Å; E221-R229 IonicContact OE1-NH1 3.21Å; E221-R229 PolarHBondContact OE1-NH1 2.69Å; E221-R229 IonicContact OE1-NH2 2.98Å; E221-R229 PolarHBondContact OE1-NH2 2.84Å; E221-R229 IonicContact OE2-CZ 3Å; E221-R229 IonicContact OE2-NH1 3.72Å; E221-R229 PolarHBondContact OE2-NH1 3.43Å; E221-R229 IonicContact OE2-NH2 2.75Å; D225-R229 WeakPolarHBondContact O-CB 3.05Å; D225-R229 PolarHBondContact O-N 2.71Å; L227-R229 VanDerWaalsContact C-N 3.32Å; L227-R229 PolarHBondContact O-N 2.89Å
230	Q	98.4	Very high	97.9	Very high	83 Å²	83	34.8 Å²	34.8	39%	0.388	18%	0.184	S	C	.	.	H	α-helix	trans	-91.9	-8.4	-172	-68.1	174.2	63.4	0	0	113.7	L182 R183 S226 L227	L182-Q230 HydrophobicContact CB-CB 4.37Å; R183-Q230 PolarHBondContact O-NE2 2.87Å; R183-Q230 PolarHBondContact O-OE1 2.9Å; S226-Q230 VanDerWaalsContact O-CB 3.26Å; S226-Q230 WeakPolarHBondContact O-CB 3.48Å; S226-Q230 VanDerWaalsContact O-CG 3.27Å; S226-Q230 WeakPolarHBondContact O-CG 3.2Å; S226-Q230 PolarHBondContact O-N 2.99Å; S226-Q230 PolarHBondContact O-NE2 2.82Å; L227-Q230 PolarHBondContact O-N 2.65Å
231	T	96.4	Very high	97.9	Very high	35 Å²	35	34.1 Å²	34.1	22%	0.215	18%	0.181	C	C	.	.	S	Bend	trans	-134.6	-179	-174.2	76.2	0	0	0	0	111	A180 L227 V228 V233	A180-T231 HydrophobicContact CB-CG2 3.77Å; L227-T231 HydrophobicContact CD1-CG2 3.95Å; L227-T231 WeakPolarHBondContact O-CB 3.03Å; L227-T231 WeakPolarHBondContact O-CG2 3.39Å; L227-T231 PolarHBondContact O-N 2.9Å; L227-T231 VanDerWaalsContact O-N 3.11Å; L227-T231 PolarHBondContact O-OG1 2.82Å; V228-T231 VanDerWaalsContact O-O 3.1Å; T231-V233 VanDerWaalsContact C-N 3.33Å; T231-V233 WeakPolarHBondContact OG1-CB 3.48Å; T231-V233 VanDerWaalsContact OG1-CG2 3.31Å; T231-V233 WeakPolarHBondContact OG1-CG2 3.46Å; T231-V233 PolarHBondContact OG1-N 3.37Å
232	S	94.3	Very high	97.7	Very high	126 Å²	126	32.1 Å²	32.1	88%	0.881	17%	0.172	S	C	*	.	S	Bend	trans	-96.5	17.2	172.5	-52.6	0	0	0	0	112.7	P234	S232-P234 WeakPolarHBondContact O-CD 3.28Å
233	V	96.1	Very high	97.1	Very high	19 Å²	19	32.3 Å²	32.3	12%	0.115	17%	0.174	C	C	.	.			trans	-68.4	125.3	177.4	171.8	0	0	0	0	109.2	P178 L227 T231 I263	P178-V233 HydrophobicContact CB-CG2 3.73Å; P178-V233 HydrophobicContact CG-CG2 3.86Å; L227-V233 HydrophobicContact CD1-CB 4.49Å; L227-V233 HydrophobicContact CD1-CG2 4.14Å; L227-V233 HydrophobicContact CD2-CG1 4.11Å; L227-V233 HydrophobicContact CG-CB 4.28Å; L227-V233 HydrophobicContact CG-CG1 4.31Å; L227-V233 HydrophobicContact CG-CG2 4.44Å; T231-V233 VanDerWaalsContact C-N 3.33Å; T231-V233 WeakPolarHBondContact OG1-CB 3.48Å; T231-V233 VanDerWaalsContact OG1-CG2 3.31Å; T231-V233 WeakPolarHBondContact OG1-CG2 3.46Å; T231-V233 PolarHBondContact OG1-N 3.37Å; V233-I263 HydrophobicContact CG1-CG2 3.66Å
234	P	97.2	Very high	95.8	Very high	56 Å²	56	33.7 Å²	33.7	36%	0.364	19%	0.187	S	C	.	.			trans	-55.9	147.5	174.3	-27.6	36.2	0	0	0	112.7	S232 F236	S232-P234 WeakPolarHBondContact O-CD 3.28Å; P234-F236 HydrophobicContact CB-CD1 3.66Å; P234-F236 HydrophobicContact CB-CE1 3.48Å; P234-F236 VanDerWaalsContact CB-CE1 3.48Å; P234-F236 HydrophobicContact CG-CE1 4.29Å; P234-F236 PolarHBondContact O-N 3.29Å
235	N	98	Very high	94.1	Very high	47 Å²	47	36.3 Å²	36.3	25%	0.251	21%	0.214	S	C	.	.	S	Bend	trans	-78.8	58.8	-178	-170.4	19.5	0	0	0	112.3	V228 R434 E435	V228-N235 HydrophobicContact CG1-CB 3.86Å; V228-N235 HydrophobicContact CG2-CB 3.98Å; N235-R434 CarbonylContact O-C 3.59Å; N235-R434 WeakPolarHBondContact O-CB 3.3Å; N235-R434 PolarHBondContact O-N 3.02Å; N235-R434 WeakPolarHBondContact OD1-CB 3.44Å; N235-R434 PolarHBondContact OD1-NE 3.31Å; N235-E435 HydrophobicContact CB-CB 4.22Å; N235-E435 PolarHBondContact O-N 3.41Å
236	F	95.8	Very high	92.3	Very high	39 Å²	39	37.4 Å²	37.4	17%	0.171	22%	0.217	C	C	.	.			trans	-160.6	157.3	169.2	71.3	-82.6	0	0	0	110.9	P234 G264 G265 V266 V431 F432 D433	P234-F236 HydrophobicContact CB-CD1 3.66Å; P234-F236 HydrophobicContact CB-CE1 3.48Å; P234-F236 VanDerWaalsContact CB-CE1 3.48Å; P234-F236 HydrophobicContact CG-CE1 4.29Å; P234-F236 PolarHBondContact O-N 3.29Å; F236-G264 WeakPolarHBondContact CZ-O 3.36Å; F236-G264 WeakPolarHBondContact O-CA 3.41Å; F236-G264 PolarHBondContact O-N 2.69Å; F236-G265 VanDerWaalsContact CE2-N 3.34Å; F236-G265 WeakPolarHBondContact CE2-O 3.16Å; F236-G265 VanDerWaalsContact CZ-CA 3.48Å; F236-V266 HydrophobicContact CD2-CG2 4.36Å; F236-V266 HydrophobicContact CE2-CG2 3.64Å; F236-V431 HydrophobicContact CD2-CG1 4.39Å; F236-F432 VanDerWaalsContact CA-O 3.25Å; F236-F432 WeakPolarHBondContact CA-O 3.27Å; F236-F432 WeakPolarHBondContact CB-O 3Å; F236-D433 HydrophobicContact CB-CB 4.46Å
237	F	98.8	Very high	90.3	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	168.4	172.9	62.8	-85.4	0	0	0	109.5	T120 L208 F224 L239 I262 Y286 F432	T120-F237 HydrophobicContact CG2-CE2 3.9Å; T120-F237 HydrophobicContact CG2-CZ 3.87Å; L208-F237 HydrophobicContact CB-CE1 4.31Å; L208-F237 HydrophobicContact CB-CZ 3.9Å; L208-F237 HydrophobicContact CD1-CD2 4.38Å; L208-F237 HydrophobicContact CD1-CE2 3.82Å; L208-F237 HydrophobicContact CD1-CZ 3.95Å; L208-F237 HydrophobicContact CG-CZ 4.44Å; F224-F237 HydrophobicContact CD1-CD1 4.43Å; F224-F237 HydrophobicContact CD2-CD1 4.04Å; F224-F237 AromaticContact CE1-CD1 3.99Å; F224-F237 HydrophobicContact CE1-CD1 3.99Å; F224-F237 HydrophobicContact CE2-CB 3.91Å; F224-F237 AromaticContact CE2-CD1 3.56Å; F224-F237 HydrophobicContact CE2-CD1 3.56Å; F224-F237 HydrophobicContact CE2-CE1 4.45Å; F224-F237 HydrophobicContact CE2-CG 4.04Å; F224-F237 HydrophobicContact CG-CD1 4.46Å; F224-F237 HydrophobicContact CZ-CB 3.94Å; F224-F237 AromaticContact CZ-CD1 3.55Å; F224-F237 HydrophobicContact CZ-CD1 3.55Å; F224-F237 HydrophobicContact CZ-CG 4.19Å; F237-L239 HydrophobicContact CD2-CD2 4.48Å; F237-L239 HydrophobicContact CD2-CG 4.24Å; F237-L239 HydrophobicContact CE2-CD1 4.23Å; F237-L239 HydrophobicContact CE2-CG 4.21Å; F237-I262 CarbonylContact C-O 3.5Å; F237-I262 WeakPolarHBondContact CA-O 3.42Å; F237-I262 WeakPolarHBondContact CB-O 3.27Å; F237-Y286 VanDerWaalsContact CE1-OH 3.3Å; F237-Y286 WeakPolarHBondContact CE1-OH 3.35Å; F237-Y286 HydrophobicContact CZ-CE2 4.17Å; F237-Y286 AromaticContact CZ-CZ 3.98Å; F237-F432 HydrophobicContact CD1-CB 4.08Å; F237-F432 HydrophobicContact CD2-CB 4.16Å; F237-F432 AromaticContact CD2-CD2 3.88Å; F237-F432 HydrophobicContact CD2-CD2 3.88Å; F237-F432 HydrophobicContact CD2-CG 4.27Å; F237-F432 HydrophobicContact CE1-CB 3.71Å; F237-F432 HydrophobicContact CE1-CG 4.24Å; F237-F432 HydrophobicContact CE2-CB 3.77Å; F237-F432 HydrophobicContact CE2-CD1 4.34Å; F237-F432 AromaticContact CE2-CD2 3.31Å; F237-F432 HydrophobicContact CE2-CD2 3.31Å; F237-F432 AromaticContact CE2-CE2 3.95Å; F237-F432 HydrophobicContact CE2-CE2 3.95Å; F237-F432 AromaticContact CE2-CG 3.55Å; F237-F432 HydrophobicContact CE2-CG 3.55Å; F237-F432 HydrophobicContact CG-CB 4.3Å; F237-F432 HydrophobicContact CZ-CB 3.52Å; F237-F432 HydrophobicContact CZ-CD1 4.05Å; F237-F432 AromaticContact CZ-CD2 3.83Å; F237-F432 HydrophobicContact CZ-CD2 3.83Å; F237-F432 AromaticContact CZ-CG 3.53Å; F237-F432 HydrophobicContact CZ-CG 3.53Å; F237-F432 PolarHBondContact N-O 2.82Å; F237-F432 WeakPolarHBondContact O-CA 3.12Å; F237-F432 PolarHBondContact O-N 3.05Å
238	S	98.8	Very high	88	Confident	0 Å²	0	47 Å²	47	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	149.8	176.9	54.6	0	0	0	0	111.7	M261 I262 G265 Y429 V430	S238-M261 WeakPolarHBondContact O-CA 3.32Å; S238-I262 PolarHBondContact N-O 2.87Å; S238-I262 PolarHBondContact O-N 2.89Å; S238-I262 WeakPolarHBondContact OG-CB 3.22Å; S238-G265 PolarHBondContact OG-O 2.79Å; S238-Y429 WeakPolarHBondContact CB-OH 3.27Å; S238-Y429 VanDerWaalsContact OG-CZ 3.32Å; S238-Y429 PolarHBondContact OG-OH 2.88Å; S238-V430 CarbonylContact C-O 3.54Å; S238-V430 WeakPolarHBondContact CA-O 3.46Å; S238-V430 WeakPolarHBondContact CB-O 3.41Å
239	L	98.9	Very high	85.4	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	130	-175.8	-64.2	-179.5	0	0	0	110	V118 T120 F237 L241 S260 M261 M425 Y429 V430 F432	V118-L239 HydrophobicContact CG1-CD1 4.05Å; V118-L239 HydrophobicContact CG1-CD2 3.95Å; T120-L239 HydrophobicContact CG2-CD1 4.06Å; F237-L239 HydrophobicContact CD2-CD2 4.48Å; F237-L239 HydrophobicContact CD2-CG 4.24Å; F237-L239 HydrophobicContact CE2-CD1 4.23Å; F237-L239 HydrophobicContact CE2-CG 4.21Å; L239-L241 HydrophobicContact CB-CD2 4.48Å; L239-S260 WeakPolarHBondContact CA-O 3.31Å; L239-M261 HydrophobicContact CD2-CB 3.61Å; L239-M261 HydrophobicContact CD2-CG 3.55Å; L239-M261 HydrophobicContact CD2-SD 4.17Å; L239-M425 HydrophobicContact CB-CE 4.32Å; L239-M425 HydrophobicContact CD1-CE 3.81Å; L239-Y429 WeakPolarHBondContact O-CD2 3.24Å; L239-V430 PolarHBondContact N-O 3.25Å; L239-V430 PolarHBondContact O-N 2.86Å; L239-F432 HydrophobicContact CB-CE2 4.36Å; L239-F432 HydrophobicContact CD1-CE2 3.77Å; L239-F432 HydrophobicContact CD1-CZ 4.38Å; L239-F432 HydrophobicContact CG-CD2 4.46Å; L239-F432 HydrophobicContact CG-CE2 4.05Å
240	Q	98.6	Very high	82.6	Confident	5 Å²	5	54.3 Å²	54.3	2%	0.023	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	112.2	161.5	-173.2	-167.8	38.1	0	0	106.8	G259 S260 L270 Y429 S444 T445	Q240-G259 CarbonylContact O-C 3.5Å; Q240-G259 VanDerWaalsContact O-CA 3.25Å; Q240-G259 WeakPolarHBondContact O-CA 3.34Å; Q240-S260 PolarHBondContact N-O 3.4Å; Q240-S260 PolarHBondContact O-N 2.85Å; Q240-L270 HydrophobicContact CB-CD1 4.29Å; Q240-L270 PolarHBondContact NE2-O 3.15Å; Q240-L270 VanDerWaalsContact NE2-O 3.08Å; Q240-Y429 HydrophobicContact CB-CD2 3.9Å; Q240-Y429 HydrophobicContact CB-CE2 4.4Å; Q240-S444 WeakPolarHBondContact CG-OG 3.31Å; Q240-S444 PolarHBondContact NE2-OG 3.14Å; Q240-T445 PolarHBondContact NE2-OG1 2.76Å
241	L	97.9	Very high	79.6	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	127.1	174.5	-52.9	-173.7	0	0	0	108	L93 Y101 L239 A422 M425 E426	L93-L241 HydrophobicContact CD1-CD2 3.8Å; Y101-L241 HydrophobicContact CD1-CD2 4.37Å; Y101-L241 HydrophobicContact CD2-CB 4.15Å; Y101-L241 HydrophobicContact CD2-CD1 3.8Å; Y101-L241 HydrophobicContact CD2-CD2 3.95Å; Y101-L241 HydrophobicContact CD2-CG 4.18Å; Y101-L241 HydrophobicContact CE1-CB 4.48Å; Y101-L241 HydrophobicContact CE2-CB 3.87Å; Y101-L241 HydrophobicContact CE2-CD1 4.07Å; Y101-L241 HydrophobicContact CE2-CG 4.37Å; Y101-L241 HydrophobicContact CG-CD2 3.85Å; L239-L241 HydrophobicContact CB-CD2 4.48Å; L241-A422 HydrophobicContact CD1-CB 4.32Å; L241-M425 HydrophobicContact CD1-CB 3.8Å; L241-M425 HydrophobicContact CD1-CE 4.29Å; L241-M425 HydrophobicContact CD1-SD 4.27Å; L241-M425 HydrophobicContact CG-CB 4.36Å; L241-E426 HydrophobicContact CB-CG 4.14Å; L241-E426 WeakPolarHBondContact O-CA 3.43Å
242	C	95.4	Very high	76.8	Confident	6 Å²	6	61 Å²	61	4%	0.041	36%	0.357	C	S	.	.			trans	-108.7	113.1	-178.8	-56.8	0	0	0	0	109.4	Y101 F246 G258 C446	Y101-C242 WeakPolarHBondContact CE1-O 3.37Å; Y101-C242 PolarHBondContact OH-O 2.9Å; C242-F246 HydrophobicContact CB-CB 4.41Å; C242-F246 HydrophobicContact CB-CD1 3.99Å; C242-F246 HydrophobicContact CB-CG 4.32Å; C242-G258 PolarHBondContact N-O 3.1Å; C242-C446 WeakPolarHBondContact CA-SG 3.14Å; C242-C446 HydrophobicContact CB-CB 3.83Å; C242-C446 WeakPolarHBondContact CB-SG 3.27Å; C242-C446 WeakPolarHBondContact SG-CB 3.36Å; C242-C446 CovalentContact SG-SG 2.04Å; C242-C446 PolarHBondContact SG-SG 3.26Å
243	G	85.1	Confident	74	Confident	6 Å²	6	59.1 Å²	59.1	6%	0.062	36%	0.357	C	S	.	.			trans	-69.7	161.8	-175.4	0	0	0	0	0	114.1	Y101 G245 F246 E426	Y101-G243 WeakPolarHBondContact OH-CA 3.28Å; Y101-G243 PolarHBondContact OH-N 3.41Å; G243-G245 PolarHBondContact O-N 3.24Å; G243-F246 WeakPolarHBondContact O-CB 3.35Å; G243-F246 PolarHBondContact O-N 3.38Å; G243-F246 VanDerWaalsContact O-N 3.09Å; G243-E426 WeakPolarHBondContact CA-OE2 3.43Å
244	A	70.8	Confident	71.3	Confident	34 Å²	34	62.9 Å²	62.9	28%	0.281	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	118.3	170.9	0	0	0	0	0	109.3	P395	A244-P395 HydrophobicContact CB-CG 3.7Å
245	G	64.1	Low	69.1	Low	57 Å²	57	63.7 Å²	63.7	59%	0.588	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	125.1	-18.6	-167.6	0	0	0	0	0	112.7	G243	G243-G245 PolarHBondContact O-N 3.24Å
246	F	59.7	Low	67.8	Low	67 Å²	67	67.2 Å²	67.2	29%	0.294	42%	0.415	S	S	.	.			trans	-77.2	121	166.4	-179.9	-108.9	0	0	0	110.6	C242 G243 Q248 C446	C242-F246 HydrophobicContact CB-CB 4.41Å; C242-F246 HydrophobicContact CB-CD1 3.99Å; C242-F246 HydrophobicContact CB-CG 4.32Å; G243-F246 WeakPolarHBondContact O-CB 3.35Å; G243-F246 PolarHBondContact O-N 3.38Å; G243-F246 VanDerWaalsContact O-N 3.09Å; F246-Q248 HydrophobicContact CE1-CB 3.83Å; F246-Q248 HydrophobicContact CE1-CG 4.1Å; F246-Q248 HydrophobicContact CZ-CB 4.3Å; F246-Q248 HydrophobicContact CZ-CG 4.26Å; F246-C446 HydrophobicContact CD1-CB 4.11Å; F246-C446 HydrophobicContact CD2-CB 3.51Å; F246-C446 WeakPolarHBondContact CD2-O 3.43Å; F246-C446 HydrophobicContact CE1-CB 4.01Å; F246-C446 HydrophobicContact CE2-CB 3.42Å; F246-C446 VanDerWaalsContact CE2-CB 3.42Å; F246-C446 HydrophobicContact CG-CB 3.86Å; F246-C446 HydrophobicContact CZ-CB 3.67Å
247	T	57.1	Low	67.2	Low	120 Å²	120	66.9 Å²	66.9	74%	0.736	42%	0.416	S	S	*	.			trans	-109.2	102.3	172.4	48.5	0	0	0	0	109.7
248	Q	51.4	Low	66.8	Low	89 Å²	89	66.9 Å²	66.9	42%	0.416	42%	0.416	S	S	.	.			trans	-71.4	136.1	164.1	-145.5	176.5	14	0	0	107.7	D91 F246 Q250 V257	D91-Q248 PolarHBondContact OD2-NE2 3.47Å; F246-Q248 HydrophobicContact CE1-CB 3.83Å; F246-Q248 HydrophobicContact CE1-CG 4.1Å; F246-Q248 HydrophobicContact CZ-CB 4.3Å; F246-Q248 HydrophobicContact CZ-CG 4.26Å; Q248-Q250 PolarHBondContact O-N 3.25Å; Q248-Q250 VanDerWaalsContact O-N 3.11Å; Q248-V257 VanDerWaalsContact OE1-CG2 3.3Å
249	N	42.2	Very low	66.7	Low	150 Å²	150	66.9 Å²	66.9	80%	0.802	42%	0.416	S	S	*	.			trans	-37.5	120.2	180	-80.4	-36.9	0	0	0	111.5	S251	N249-S251 PolarHBondContact O-N 3.32Å
250	Q	39	Very low	66.7	Low	199 Å²	199	66.9 Å²	66.9	93%	0.93	42%	0.416	S	S	*	.	S	Bend	trans	-64.2	71.2	-175.7	-71.6	177	-3.2	0	0	112.7	Q248	Q248-Q250 PolarHBondContact O-N 3.25Å; Q248-Q250 VanDerWaalsContact O-N 3.11Å
251	S	36.3	Very low	66.7	Low	100 Å²	100	66.7 Å²	66.7	70%	0.699	42%	0.416	S	S	*	.			trans	-120.8	-7.1	173.8	62.1	0	0	0	0	114.4	N249	N249-S251 PolarHBondContact O-N 3.32Å
252	L	36.9	Very low	66.7	Low	159 Å²	159	66.7 Å²	66.7	83%	0.832	42%	0.415	S	S	*	.			trans	-130.5	91.1	179.4	-77.2	150.1	0	0	0	110.2	S254	L252-S254 PolarHBondContact O-N 3.02Å
253	G	35.8	Very low	66.8	Low	86 Å²	86	66.7 Å²	66.7	89%	0.887	42%	0.415	S	S	*	.			trans	-65.3	100.4	170.9	0	0	0	0	0	110.9
254	S	39.6	Very low	67.4	Low	98 Å²	98	66.9 Å²	66.9	69%	0.685	42%	0.417	S	S	*	.	S	Bend	trans	173.5	111.2	150.9	-176.7	0	0	0	0	109.2	L252	L252-S254 PolarHBondContact O-N 3.02Å
255	S	51.2	Low	68.6	Low	74 Å²	74	65.3 Å²	65.3	52%	0.517	40%	0.404	S	S	.	.	S	Bend	trans	54.6	120.9	178.1	63.9	0	0	0	0	115.2	R94 V257	R94-S255 WeakPolarHBondContact CD-OG 3.29Å; R94-S255 PolarHBondContact NE-OG 3.12Å; S255-V257 PolarHBondContact O-N 3.27Å; S255-V257 VanDerWaalsContact O-N 3.15Å
256	T	70.7	Confident	70.1	Confident	121 Å²	121	64.7 Å²	64.7	74%	0.742	39%	0.388	S	S	*	.			trans	-53.4	124.1	177	46.3	0	0	0	0	110.3	R94 G258	R94-T256 WeakPolarHBondContact CD-O 3.25Å; T256-G258 PolarHBondContact O-N 2.89Å
257	V	82.3	Confident	71.9	Confident	31 Å²	31	62.9 Å²	62.9	19%	0.188	38%	0.382	C	S	.	.			trans	-54.5	125.3	172.5	168.2	0	0	0	0	108.2	D91 Q248 S255	D91-V257 HydrophobicContact CB-CB 4.5Å; D91-V257 HydrophobicContact CB-CG1 3.54Å; D91-V257 HydrophobicContact CB-CG2 4.1Å; D91-V257 WeakPolarHBondContact OD1-CG1 3.19Å; Q248-V257 VanDerWaalsContact OE1-CG2 3.3Å; S255-V257 PolarHBondContact O-N 3.27Å; S255-V257 VanDerWaalsContact O-N 3.15Å
258	G	91.4	Very high	73.7	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.01	38%	0.377	C	S	.	.			trans	-94.4	-5.8	-177.8	0	0	0	0	0	113.6	L93 Y101 C242 T256	L93-G258 PolarHBondContact O-N 3.12Å; Y101-G258 VanDerWaalsContact CD1-O 3.27Å; Y101-G258 WeakPolarHBondContact CD1-O 3.18Å; Y101-G258 WeakPolarHBondContact CE1-O 3.28Å; C242-G258 PolarHBondContact N-O 3.1Å; T256-G258 PolarHBondContact O-N 2.89Å
259	G	96.1	Very high	75.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	123.2	-155	-179.1	0	0	0	0	0	112.7	D91 N92 L93 Q240	D91-G259 CarbonylContact C-O 3.58Å; D91-G259 VanDerWaalsContact CA-O 3.25Å; D91-G259 WeakPolarHBondContact CA-O 3.4Å; N92-G259 PolarHBondContact N-O 2.82Å; L93-G259 WeakPolarHBondContact CB-O 3.44Å; L93-G259 PolarHBondContact N-O 2.99Å; Q240-G259 CarbonylContact O-C 3.5Å; Q240-G259 VanDerWaalsContact O-CA 3.25Å; Q240-G259 WeakPolarHBondContact O-CA 3.34Å
260	S	98.2	Very high	78.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	138.2	-169.2	-53.9	0	0	0	0	112	D91 N92 L239 Q240	D91-S260 PolarHBondContact N-OG 2.69Å; N92-S260 WeakPolarHBondContact OD1-CA 3.42Å; L239-S260 WeakPolarHBondContact CA-O 3.31Å; Q240-S260 PolarHBondContact N-O 3.4Å; Q240-S260 PolarHBondContact O-N 2.85Å
261	M	98.6	Very high	81.3	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.01	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	109.5	164.1	176.7	177.9	66.3	0	0	109	N92 L93 V103 V118 L208 S238 L239 I263	N92-M261 PolarHBondContact ND2-O 3.48Å; N92-M261 PolarHBondContact OD1-N 2.8Å; L93-M261 HydrophobicContact CD1-CB 4.2Å; L93-M261 HydrophobicContact CD2-CB 3.86Å; L93-M261 HydrophobicContact CG-CB 4.19Å; V103-M261 HydrophobicContact CB-CE 4.04Å; V103-M261 HydrophobicContact CG1-CE 3.78Å; V103-M261 HydrophobicContact CG2-CE 3.94Å; V118-M261 HydrophobicContact CG1-SD 4.09Å; V118-M261 HydrophobicContact CG2-SD 4.15Å; L208-M261 HydrophobicContact CD1-SD 4.27Å; S238-M261 WeakPolarHBondContact O-CA 3.32Å; L239-M261 HydrophobicContact CD2-CB 3.61Å; L239-M261 HydrophobicContact CD2-CG 3.55Å; L239-M261 HydrophobicContact CD2-SD 4.17Å; M261-I263 HydrophobicContact CE-CD1 3.82Å; M261-I263 HydrophobicContact CE-CG1 4.15Å; M261-I263 HydrophobicContact CG-CG1 4.2Å; M261-I263 HydrophobicContact SD-CG1 4.41Å
262	I	98.5	Very high	84.2	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	111.7	177.7	-45.1	-56.1	0	0	0	108.4	F86 M89 I90 F237 S238 D267 L270	F86-I262 HydrophobicContact CB-CD1 4.45Å; F86-I262 HydrophobicContact CB-CG2 3.97Å; F86-I262 HydrophobicContact CD1-CG2 3.76Å; F86-I262 HydrophobicContact CD2-CG2 4.03Å; F86-I262 HydrophobicContact CE1-CG2 4.19Å; F86-I262 HydrophobicContact CE2-CG2 4.47Å; F86-I262 HydrophobicContact CG-CG2 3.65Å; M89-I262 HydrophobicContact CB-CD1 3.62Å; M89-I262 HydrophobicContact CE-CG2 4.05Å; M89-I262 WeakPolarHBondContact O-CD1 3.46Å; I90-I262 HydrophobicContact CD1-CD1 4.03Å; F237-I262 CarbonylContact C-O 3.5Å; F237-I262 WeakPolarHBondContact CA-O 3.42Å; F237-I262 WeakPolarHBondContact CB-O 3.27Å; S238-I262 PolarHBondContact N-O 2.87Å; S238-I262 PolarHBondContact O-N 2.89Å; S238-I262 WeakPolarHBondContact OG-CB 3.22Å; I262-D267 HydrophobicContact CG1-CB 4.34Å; I262-L270 HydrophobicContact CD1-CD1 4.09Å; I262-L270 HydrophobicContact CG1-CD1 3.94Å
263	I	98.3	Very high	87	Confident	7 Å²	7	41.3 Å²	41.3	4%	0.036	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	125.4	178.3	-63.8	170.7	0	0	0	109.1	M89 V174 P178 F224 L227 V233 M261	M89-I263 HydrophobicContact SD-CB 3.98Å; M89-I263 PolarHBondContact SD-N 3.48Å; V174-I263 HydrophobicContact CG1-CD1 4.46Å; V174-I263 HydrophobicContact CG2-CD1 4.28Å; P178-I263 HydrophobicContact CG-CB 3.76Å; P178-I263 HydrophobicContact CG-CG2 3.48Å; P178-I263 VanDerWaalsContact CG-CG2 3.48Å; F224-I263 HydrophobicContact CE2-CG2 4.07Å; L227-I263 HydrophobicContact CD2-CG2 3.61Å; V233-I263 HydrophobicContact CG1-CG2 3.66Å; M261-I263 HydrophobicContact CE-CD1 3.82Å; M261-I263 HydrophobicContact CE-CG1 4.15Å; M261-I263 HydrophobicContact CG-CG1 4.2Å; M261-I263 HydrophobicContact SD-CG1 4.41Å
264	G	96.8	Very high	89.9	Confident	9 Å²	9	44.1 Å²	44.1	9%	0.093	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	16.5	179.3	0	0	0	0	0	114.6	F236	F236-G264 WeakPolarHBondContact CZ-O 3.36Å; F236-G264 WeakPolarHBondContact O-CA 3.41Å; F236-G264 PolarHBondContact O-N 2.69Å
265	G	95.6	Very high	92.6	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.01	26%	0.258	C	S	.	.			trans	-162.1	162.4	-165.4	0	0	0	0	0	116.9	F236 S238	F236-G265 VanDerWaalsContact CE2-N 3.34Å; F236-G265 WeakPolarHBondContact CE2-O 3.16Å; F236-G265 VanDerWaalsContact CZ-CA 3.48Å; S238-G265 PolarHBondContact OG-O 2.79Å
266	V	96.6	Very high	94.9	Very high	44 Å²	44	39.7 Å²	39.7	27%	0.267	24%	0.241	S	C	.	.			trans	-121.3	127.2	168	-177	0	0	0	0	106.5	F236 Y271 L275 Y429 V431	F236-V266 HydrophobicContact CD2-CG2 4.36Å; F236-V266 HydrophobicContact CE2-CG2 3.64Å; V266-Y271 HydrophobicContact CG1-CE1 3.89Å; V266-L275 HydrophobicContact CG1-CD1 3.93Å; V266-Y429 WeakPolarHBondContact CA-OH 3.45Å; V266-Y429 HydrophobicContact CG1-CE1 3.61Å; V266-V431 HydrophobicContact CG1-CG2 4.34Å; V266-V431 HydrophobicContact CG2-CG1 3.83Å; V266-V431 HydrophobicContact CG2-CG2 4.12Å
267	D	96.5	Very high	96.2	Very high	29 Å²	29	35.9 Å²	35.9	16%	0.155	21%	0.213	C	C	.	.			trans	-107.3	117.1	174	-166.4	-58.9	0	0	0	110.3	F86 I90 I262 S269 L270 Y429	F86-D267 HydrophobicContact CD2-CB 4.31Å; I90-D267 HydrophobicContact CD1-CB 4.19Å; I262-D267 HydrophobicContact CG1-CB 4.34Å; D267-S269 PolarHBondContact O-N 2.87Å; D267-S269 VanDerWaalsContact OD1-CB 3.24Å; D267-S269 WeakPolarHBondContact OD1-CB 3.27Å; D267-S269 PolarHBondContact OD1-N 2.97Å; D267-S269 PolarHBondContact OD1-OG 2.7Å; D267-L270 HydrophobicContact CB-CD1 4.16Å; D267-L270 HydrophobicContact CB-CG 4.13Å; D267-L270 PolarHBondContact O-N 2.82Å; D267-Y429 PolarHBondContact N-OH 2.97Å
268	S	95.9	Very high	96.9	Very high	90 Å²	90	34.4 Å²	34.4	63%	0.629	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-10	-176.8	61.2	0	0	0	0	114.8	L270 Y271	S268-L270 VanDerWaalsContact C-N 3.28Å; S268-Y271 VanDerWaalsContact CA-CE1 3.48Å
269	S	96.4	Very high	97.2	Very high	71 Å²	71	36.3 Å²	36.3	50%	0.497	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-12.5	175	69.7	0	0	0	0	113.4	D267 T445	D267-S269 PolarHBondContact O-N 2.87Å; D267-S269 VanDerWaalsContact OD1-CB 3.24Å; D267-S269 WeakPolarHBondContact OD1-CB 3.27Å; D267-S269 PolarHBondContact OD1-N 2.97Å; D267-S269 PolarHBondContact OD1-OG 2.7Å; S269-T445 WeakPolarHBondContact O-CG2 3.34Å; S269-T445 PolarHBondContact O-OG1 2.98Å
270	L	96.9	Very high	97.3	Very high	8 Å²	8	37 Å²	37	4%	0.042	22%	0.22	C	C	.	.	S	Bend	trans	-93.4	-5.1	-174.8	-56.9	-173.2	0	0	0	114	I90 Q240 I262 D267 S268 Y429 T445	I90-L270 HydrophobicContact CD1-CD1 3.96Å; I90-L270 HydrophobicContact CD1-CD2 3.72Å; I90-L270 HydrophobicContact CD1-CG 4Å; Q240-L270 HydrophobicContact CB-CD1 4.29Å; Q240-L270 PolarHBondContact NE2-O 3.15Å; Q240-L270 VanDerWaalsContact NE2-O 3.08Å; I262-L270 HydrophobicContact CD1-CD1 4.09Å; I262-L270 HydrophobicContact CG1-CD1 3.94Å; D267-L270 HydrophobicContact CB-CD1 4.16Å; D267-L270 HydrophobicContact CB-CG 4.13Å; D267-L270 PolarHBondContact O-N 2.82Å; S268-L270 VanDerWaalsContact C-N 3.28Å; L270-Y429 HydrophobicContact CB-CD2 4.08Å; L270-Y429 HydrophobicContact CB-CE2 4.06Å; L270-Y429 HydrophobicContact CB-CG 4.41Å; L270-Y429 HydrophobicContact CD1-CD2 4.48Å; L270-Y429 HydrophobicContact CD1-CE2 3.84Å; L270-T445 VanDerWaalsContact C-OG1 3.3Å; L270-T445 WeakPolarHBondContact CA-OG1 3.14Å; L270-T445 PolarHBondContact O-N 2.94Å; L270-T445 PolarHBondContact O-OG1 2.88Å
271	Y	98.3	Very high	97.2	Very high	49 Å²	49	41 Å²	41	19%	0.192	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	163.8	-179	70.5	-88.6	0	0	0	113	V266 S268 G273 L275 Y429 A442 V443	V266-Y271 HydrophobicContact CG1-CE1 3.89Å; S268-Y271 VanDerWaalsContact CA-CE1 3.48Å; Y271-G273 WeakPolarHBondContact CE2-O 3.26Å; Y271-L275 HydrophobicContact CE1-CD1 4.23Å; Y271-L275 HydrophobicContact CE2-CD1 4.41Å; Y271-L275 HydrophobicContact CE2-CG 4.14Å; Y271-Y429 AromaticContact CD1-CD1 3.2Å; Y271-Y429 HydrophobicContact CD1-CD1 3.2Å; Y271-Y429 AromaticContact CD1-CE1 3.43Å; Y271-Y429 HydrophobicContact CD1-CE1 3.43Å; Y271-Y429 VanDerWaalsContact CD1-CE1 3.43Å; Y271-Y429 HydrophobicContact CD1-CG 4.18Å; Y271-Y429 AromaticContact CE1-CD1 3.92Å; Y271-Y429 HydrophobicContact CE1-CD1 3.92Å; Y271-Y429 AromaticContact CE1-CE1 3.79Å; Y271-Y429 HydrophobicContact CE1-CE1 3.79Å; Y271-Y429 AromaticContact CG-CD1 3.77Å; Y271-Y429 HydrophobicContact CG-CD1 3.77Å; Y271-Y429 HydrophobicContact CG-CE1 4.43Å; Y271-A442 HydrophobicContact CD2-CB 3.45Å; Y271-A442 VanDerWaalsContact CD2-CB 3.45Å; Y271-A442 HydrophobicContact CE2-CB 4.23Å; Y271-A442 HydrophobicContact CG-CB 3.78Å; Y271-V443 CarbonylContact C-O 3.58Å; Y271-V443 WeakPolarHBondContact CA-O 3.4Å; Y271-V443 VanDerWaalsContact CB-O 3.32Å; Y271-V443 WeakPolarHBondContact CB-O 3.5Å
272	V	97.1	Very high	97	Very high	80 Å²	80	47 Å²	47	49%	0.485	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	152.6	171.8	-60.2	0	0	0	0	110.2	V443 T445	V272-V443 HydrophobicContact CG2-CB 3.75Å; V272-V443 HydrophobicContact CG2-CG1 3.86Å; V272-V443 PolarHBondContact N-O 3.13Å; V272-T445 HydrophobicContact CG1-CG2 3.86Å
273	G	96.1	Very high	96.9	Very high	66 Å²	66	50.5 Å²	50.5	68%	0.68	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	77.9	-156.7	-177.2	0	0	0	0	0	113.4	Y271	Y271-G273 WeakPolarHBondContact CE2-O 3.26Å
274	E	95.7	Very high	96.8	Very high	146 Å²	146	52.3 Å²	52.3	68%	0.682	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	150.6	-177.2	-62.2	-174.4	151	0	0	111.5
275	L	97.8	Very high	96.9	Very high	34 Å²	34	54.6 Å²	54.6	18%	0.178	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	123.7	171.2	-80.7	162.8	0	0	0	109.9	V266 Y271 Y277 V431 A442	V266-L275 HydrophobicContact CG1-CD1 3.93Å; Y271-L275 HydrophobicContact CE1-CD1 4.23Å; Y271-L275 HydrophobicContact CE2-CD1 4.41Å; Y271-L275 HydrophobicContact CE2-CG 4.14Å; L275-Y277 HydrophobicContact CB-CE2 3.9Å; L275-V431 HydrophobicContact CD1-CG2 4.24Å; L275-V431 HydrophobicContact CD2-CG2 3.75Å; L275-A442 HydrophobicContact CD2-CB 3.62Å; L275-A442 HydrophobicContact CG-CB 4.03Å
276	W	98.3	Very high	97	Very high	45 Å²	45	54.5 Å²	54.5	17%	0.17	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	132.7	171.9	-75.9	81.4	0	0	0	110.7	F383 G440 F441 V457 G459 P460	W276-F383 HydrophobicContact CB-CB 4.26Å; W276-F383 HydrophobicContact CB-CD1 4.03Å; W276-F383 HydrophobicContact CB-CD2 3.4Å; W276-F383 VanDerWaalsContact CB-CD2 3.4Å; W276-F383 HydrophobicContact CB-CE1 4.21Å; W276-F383 HydrophobicContact CB-CE2 3.59Å; W276-F383 HydrophobicContact CB-CG 3.63Å; W276-F383 HydrophobicContact CB-CZ 3.99Å; W276-F383 HydrophobicContact CD2-CB 3.82Å; W276-F383 HydrophobicContact CD2-CG 4.14Å; W276-F383 HydrophobicContact CE3-CB 3.52Å; W276-F383 HydrophobicContact CE3-CD1 4.13Å; W276-F383 AromaticContact CE3-CG 3.91Å; W276-F383 HydrophobicContact CE3-CG 3.91Å; W276-F383 HydrophobicContact CG-CB 4.15Å; W276-F383 HydrophobicContact CG-CD2 4.04Å; W276-F383 HydrophobicContact CG-CG 4.06Å; W276-F383 HydrophobicContact CZ3-CB 4.21Å; W276-G440 CarbonylContact O-C 3.55Å; W276-G440 VanDerWaalsContact O-CA 3.27Å; W276-G440 WeakPolarHBondContact O-CA 3.3Å; W276-F441 PolarHBondContact N-O 2.9Å; W276-F441 PolarHBondContact O-N 2.71Å; W276-V457 HydrophobicContact CB-CG1 3.79Å; W276-V457 HydrophobicContact CG-CG1 3.85Å; W276-G459 VanDerWaalsContact CZ2-O 3.22Å; W276-G459 WeakPolarHBondContact CZ2-O 3.49Å; W276-P460 HydrophobicContact CH2-CB 3.89Å; W276-P460 HydrophobicContact CH2-CG 4.2Å; W276-P460 HydrophobicContact CZ3-CB 4Å
277	Y	98.4	Very high	97.1	Very high	40 Å²	40	52.7 Å²	52.7	16%	0.157	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	135.6	-174.6	-68.8	-86.5	0	0	0	112.4	L275 E377 F383 R438 I439 G440	L275-Y277 HydrophobicContact CB-CE2 3.9Å; Y277-E377 PolarHBondContact O-N 3.46Å; Y277-F383 VanDerWaalsContact C-CE1 3.46Å; Y277-F383 VanDerWaalsContact O-CE1 3.32Å; Y277-F383 WeakPolarHBondContact O-CE1 3.19Å; Y277-R438 HydrophobicContact CD1-CB 4.3Å; Y277-R438 HydrophobicContact CD1-CG 3.71Å; Y277-R438 HydrophobicContact CE1-CG 4.32Å; Y277-R438 HydrophobicContact CG-CG 4.39Å; Y277-I439 CarbonylContact C-O 3.5Å; Y277-I439 WeakPolarHBondContact CA-O 3.39Å; Y277-G440 VanDerWaalsContact CD1-CA 3.43Å
278	T	98.1	Very high	97.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	138.1	167.6	-172.8	0	0	0	0	109.7	V288 L374 M375 F383 R438 I439 F441	T278-V288 HydrophobicContact CG2-CB 4.08Å; T278-V288 HydrophobicContact CG2-CG1 3.56Å; T278-L374 HydrophobicContact CG2-CD1 4.18Å; T278-M375 VanDerWaalsContact CA-O 3.24Å; T278-M375 WeakPolarHBondContact CA-O 3.45Å; T278-M375 WeakPolarHBondContact CB-O 3.04Å; T278-M375 PolarHBondContact OG1-O 3.31Å; T278-F383 HydrophobicContact CG2-CZ 4.42Å; T278-R438 CarbonylContact O-C 3.6Å; T278-R438 VanDerWaalsContact O-CA 3.26Å; T278-R438 WeakPolarHBondContact O-CA 3.31Å; T278-R438 WeakPolarHBondContact O-CB 3.45Å; T278-I439 HydrophobicContact CG2-CB 4.03Å; T278-I439 PolarHBondContact N-O 2.84Å; T278-I439 PolarHBondContact O-N 2.83Å; T278-F441 HydrophobicContact CG2-CE2 4Å
279	P	97.6	Very high	97.3	Very high	41 Å²	41	47.5 Å²	47.5	27%	0.266	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	146.7	179.1	27.9	-34	0	0	0	111.7	R281 M375	P279-R281 PolarHBondContact O-N 3.35Å; P279-M375 WeakPolarHBondContact CD-O 3.29Å; P279-M375 HydrophobicContact CG-CG 4.44Å; P279-M375 HydrophobicContact CG-SD 4.08Å
280	I	97.8	Very high	97.3	Very high	14 Å²	14	44.1 Å²	44.1	7%	0.072	22%	0.216	C	C	.	.			trans	-78.5	116.6	166.8	-66	173.1	0	0	0	107.4	Y210 R282 Y286 E287 K437 I439	Y210-I280 WeakPolarHBondContact OH-CD1 3.48Å; I280-R282 VanDerWaalsContact CG2-O 3.24Å; I280-R282 WeakPolarHBondContact CG2-O 3.38Å; I280-Y286 HydrophobicContact CD1-CD1 3.82Å; I280-Y286 HydrophobicContact CD1-CE1 4.19Å; I280-E287 CarbonylContact C-O 3.48Å; I280-E287 WeakPolarHBondContact CA-O 3.35Å; I280-K437 HydrophobicContact CB-CB 4.5Å; I280-K437 WeakPolarHBondContact CB-O 3.03Å; I280-K437 PolarHBondContact N-O 3.22Å; I280-I439 HydrophobicContact CD1-CG1 4.05Å; I280-I439 HydrophobicContact CG1-CD1 4.22Å; I280-I439 HydrophobicContact CG1-CG1 3.73Å
281	R	94.9	Very high	97.3	Very high	85 Å²	85	44.5 Å²	44.5	32%	0.321	22%	0.219	S	C	.	.	S	Bend	trans	-66.8	-42.1	-175.8	174.5	166.9	177.4	-140	7.2	112.8	P279 E287 I289 Y471 N472	P279-R281 PolarHBondContact O-N 3.35Å; R281-E287 HydrophobicContact CB-CB 4.4Å; R281-E287 HydrophobicContact CB-CG 4.09Å; R281-E287 WeakPolarHBondContact CD-OE1 3.17Å; R281-E287 IonicContact CZ-OE1 3.96Å; R281-E287 PolarHBondContact N-O 2.96Å; R281-E287 IonicContact NE-OE1 2.8Å; R281-E287 IonicContact NH1-OE1 3.17Å; R281-E287 PolarHBondContact NH1-OE1 2.83Å; R281-I289 VanDerWaalsContact CD-CD1 3.44Å; R281-Y471 PolarHBondContact NH1-O 2.62Å; R281-Y471 VanDerWaalsContact NH2-C 3.3Å; R281-Y471 PolarHBondContact NH2-O 3.3Å; R281-N472 PolarHBondContact NH2-OD1 2.77Å
282	R	95.3	Very high	97.2	Very high	128 Å²	128	45.9 Å²	45.9	48%	0.483	22%	0.224	S	C	.	.	S	Bend	trans	-147.6	144.4	177.6	177.4	-179	171.9	177.1	-0.4	109.3	D212 I280 W284 Y285	D212-R282 IonicContact OD2-CZ 2.81Å; D212-R282 IonicContact OD2-NE 3.98Å; D212-R282 PolarHBondContact OD2-NE 3.11Å; D212-R282 IonicContact OD2-NH2 2.9Å; D212-R282 PolarHBondContact OD2-NH2 2.87Å; I280-R282 VanDerWaalsContact CG2-O 3.24Å; I280-R282 WeakPolarHBondContact CG2-O 3.38Å; R282-W284 HydrophobicContact CB-CG 4.45Å; R282-W284 HydrophobicContact CG-CB 4.38Å; R282-W284 HydrophobicContact CG-CG 3.94Å; R282-W284 VanDerWaalsContact O-CD1 3.31Å; R282-W284 PolarHBondContact O-N 2.91Å; R282-W284 VanDerWaalsContact O-N 3.15Å; R282-Y285 VanDerWaalsContact O-O 3.06Å
283	E	97.1	Very high	97.3	Very high	74 Å²	74	42.2 Å²	42.2	35%	0.346	20%	0.201	S	C	.	.	B	Isolated β-bridge	trans	-87.6	69.9	-179.5	-68.2	163.6	114	0	0	111.2	Y210 K437	Y210-E283 WeakPolarHBondContact CB-O 3.49Å; Y210-E283 HydrophobicContact CD1-CB 3.81Å; Y210-E283 HydrophobicContact CD1-CG 4.31Å; Y210-E283 VanDerWaalsContact CD2-C 3.42Å; Y210-E283 HydrophobicContact CD2-CB 4.11Å; Y210-E283 HydrophobicContact CE1-CB 3.93Å; Y210-E283 HydrophobicContact CE1-CG 3.91Å; Y210-E283 HydrophobicContact CE2-CB 4.22Å; Y210-E283 HydrophobicContact CE2-CG 4.4Å; Y210-E283 VanDerWaalsContact CG-C 3.5Å; Y210-E283 HydrophobicContact CG-CB 3.9Å; E283-K437 WeakPolarHBondContact OE1-CE 3.41Å; E283-K437 IonicContact OE1-NZ 2.71Å; E283-K437 PolarHBondContact OE1-NZ 2.98Å; E283-K437 WeakPolarHBondContact OE2-CE 3.44Å; E283-K437 IonicContact OE2-NZ 2.65Å; E283-K437 PolarHBondContact OE2-NZ 3.27Å
284	W	96.3	Very high	97.4	Very high	45 Å²	45	39.6 Å²	39.6	17%	0.17	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.5	-75.6	176.7	63.1	-33.6	0	0	0	108.7	A209 Y210 D212 I213 R282 E287 K311	A209-W284 WeakPolarHBondContact CB-O 3.48Å; Y210-W284 WeakPolarHBondContact CB-O 3.4Å; Y210-W284 WeakPolarHBondContact CD2-O 3.26Å; Y210-W284 PolarHBondContact N-O 3.12Å; D212-W284 HydrophobicContact CB-CB 3.56Å; I213-W284 HydrophobicContact CG2-CB 4.12Å; I213-W284 HydrophobicContact CG2-CE3 4.23Å; R282-W284 HydrophobicContact CB-CG 4.45Å; R282-W284 HydrophobicContact CG-CB 4.38Å; R282-W284 HydrophobicContact CG-CG 3.94Å; R282-W284 VanDerWaalsContact O-CD1 3.31Å; R282-W284 PolarHBondContact O-N 2.91Å; R282-W284 VanDerWaalsContact O-N 3.15Å; W284-E287 PolarHBondContact NE1-OE2 2.83Å; W284-K311 HydrophobicContact CH2-CD 3.84Å; W284-K311 HydrophobicContact CZ2-CB 4.33Å; W284-K311 HydrophobicContact CZ2-CD 3.84Å
285	Y	97.9	Very high	97.6	Very high	56 Å²	56	32.9 Å²	32.9	22%	0.22	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	173.1	153.2	-64.7	-82	0	0	0	110.8	G121 I213 R282 E287 K311 I313	G121-Y285 VanDerWaalsContact O-CE1 3.27Å; G121-Y285 WeakPolarHBondContact O-CE1 3.47Å; I213-Y285 HydrophobicContact CD1-CD1 3.52Å; I213-Y285 HydrophobicContact CD1-CD2 4.29Å; I213-Y285 HydrophobicContact CD1-CE1 3.35Å; I213-Y285 HydrophobicContact CD1-CE2 4.14Å; I213-Y285 HydrophobicContact CD1-CG 3.98Å; I213-Y285 HydrophobicContact CG2-CD2 4.3Å; I213-Y285 HydrophobicContact CG2-CE2 3.86Å; R282-Y285 VanDerWaalsContact O-O 3.06Å; Y285-E287 PolarHBondContact O-N 2.76Å; Y285-K311 HydrophobicContact CD2-CD 4.17Å; Y285-K311 HydrophobicContact CE2-CD 4.32Å; Y285-I313 VanDerWaalsContact CB-CG2 3.48Å; Y285-I313 HydrophobicContact CD1-CD1 3.84Å; Y285-I313 HydrophobicContact CD1-CG2 4.34Å; Y285-I313 HydrophobicContact CD2-CG2 4.4Å; Y285-I313 HydrophobicContact CE1-CD1 4.23Å; Y285-I313 HydrophobicContact CG-CD1 4.39Å; Y285-I313 HydrophobicContact CG-CG2 3.84Å
286	Y	98.6	Very high	97.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	16%	0.158	C	C	.	.	B	Isolated β-bridge	trans	-75.8	67.4	160.1	-70.3	-68.5	0	0	0	110.4	T120 L208 A209 Y210 F237 I280 I313 V314 F432 R434 I439	T120-Y286 HydrophobicContact CG2-CD2 4.34Å; T120-Y286 HydrophobicContact CG2-CE2 4.13Å; T120-Y286 WeakPolarHBondContact O-CD2 3.2Å; L208-Y286 WeakPolarHBondContact O-CE2 3.21Å; L208-Y286 PolarHBondContact O-OH 2.94Å; A209-Y286 HydrophobicContact CB-CE2 4.32Å; Y210-Y286 AromaticContact CE2-CD1 3.88Å; Y210-Y286 HydrophobicContact CE2-CD1 3.88Å; Y210-Y286 AromaticContact CE2-CE1 3.67Å; Y210-Y286 HydrophobicContact CE2-CE1 3.67Å; Y210-Y286 AromaticContact CZ-CE1 3.84Å; F237-Y286 VanDerWaalsContact CE1-OH 3.3Å; F237-Y286 WeakPolarHBondContact CE1-OH 3.35Å; F237-Y286 HydrophobicContact CZ-CE2 4.17Å; F237-Y286 AromaticContact CZ-CZ 3.98Å; I280-Y286 HydrophobicContact CD1-CD1 3.82Å; I280-Y286 HydrophobicContact CD1-CE1 4.19Å; Y286-I313 WeakPolarHBondContact O-CA 3.32Å; Y286-V314 PolarHBondContact O-N 3.23Å; Y286-V314 VanDerWaalsContact O-N 3.13Å; Y286-F432 AromaticContact CD1-CD1 3.51Å; Y286-F432 HydrophobicContact CD1-CD1 3.51Å; Y286-F432 HydrophobicContact CD1-CE1 4.14Å; Y286-F432 AromaticContact CD2-CD1 3.75Å; Y286-F432 HydrophobicContact CD2-CD1 3.75Å; Y286-F432 AromaticContact CD2-CE1 3.74Å; Y286-F432 HydrophobicContact CD2-CE1 3.74Å; Y286-F432 HydrophobicContact CE1-CB 4.16Å; Y286-F432 AromaticContact CE1-CD1 3.64Å; Y286-F432 HydrophobicContact CE1-CD1 3.64Å; Y286-F432 HydrophobicContact CE1-CG 4.37Å; Y286-F432 AromaticContact CE2-CD1 3.88Å; Y286-F432 HydrophobicContact CE2-CD1 3.88Å; Y286-F432 HydrophobicContact CE2-CE1 4.2Å; Y286-F432 AromaticContact CG-CD1 3.56Å; Y286-F432 HydrophobicContact CG-CD1 3.56Å; Y286-F432 AromaticContact CG-CE1 3.7Å; Y286-F432 HydrophobicContact CG-CE1 3.7Å; Y286-F432 AromaticContact CZ-CD1 3.84Å; Y286-R434 HydrophobicContact CE1-CG 4.06Å; Y286-R434 WeakPolarHBondContact OH-CD 3.3Å; Y286-R434 PolarHBondContact OH-NH1 2.78Å; Y286-I439 HydrophobicContact CD1-CD1 4.24Å; Y286-I439 HydrophobicContact CG-CD1 4.34Å
287	E	98.4	Very high	97.4	Very high	5 Å²	5	36.1 Å²	36.1	2%	0.023	17%	0.172	C	C	.	.	B	Isolated β-bridge	trans	-78.4	128.8	-177	-172.8	-172.8	-179.7	0	0	111.4	I280 R281 W284 Y285 K311 S312	I280-E287 CarbonylContact C-O 3.48Å; I280-E287 WeakPolarHBondContact CA-O 3.35Å; R281-E287 HydrophobicContact CB-CB 4.4Å; R281-E287 HydrophobicContact CB-CG 4.09Å; R281-E287 WeakPolarHBondContact CD-OE1 3.17Å; R281-E287 IonicContact CZ-OE1 3.96Å; R281-E287 PolarHBondContact N-O 2.96Å; R281-E287 IonicContact NE-OE1 2.8Å; R281-E287 IonicContact NH1-OE1 3.17Å; R281-E287 PolarHBondContact NH1-OE1 2.83Å; W284-E287 PolarHBondContact NE1-OE2 2.83Å; Y285-E287 PolarHBondContact O-N 2.76Å; E287-K311 HydrophobicContact CG-CB 4.39Å; E287-S312 CarbonylContact C-O 3.51Å; E287-S312 VanDerWaalsContact CA-O 3.28Å; E287-S312 WeakPolarHBondContact CA-O 3.39Å
288	V	97.9	Very high	97.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.197	C	C	.	.			trans	-126.7	173.2	175.8	-57.7	0	0	0	0	110.3	T278 S312 V314 L374 M420 I439	T278-V288 HydrophobicContact CG2-CB 4.08Å; T278-V288 HydrophobicContact CG2-CG1 3.56Å; V288-S312 PolarHBondContact N-O 3.37Å; V288-S312 WeakPolarHBondContact O-CB 3.27Å; V288-V314 HydrophobicContact CG1-CG2 4.48Å; V288-L374 HydrophobicContact CG2-CD2 4.07Å; V288-M420 HydrophobicContact CG2-CE 3.26Å; V288-I439 HydrophobicContact CG1-CD1 3.59Å; V288-I439 HydrophobicContact CG1-CG1 4.3Å
289	I	97.4	Very high	97.3	Very high	10 Å²	10	44 Å²	44	5%	0.051	21%	0.212	C	C	.	.			trans	-115.4	120.7	176.6	-64.1	-55.5	0	0	0	110.8	R281 V291 N308 L374 M375 C469	R281-I289 VanDerWaalsContact CD-CD1 3.44Å; I289-V291 HydrophobicContact CG2-CG1 3.97Å; I289-N308 HydrophobicContact CD1-CB 4.5Å; I289-L374 WeakPolarHBondContact O-CA 3.19Å; I289-M375 HydrophobicContact CB-CB 4.26Å; I289-M375 HydrophobicContact CB-CE 4.29Å; I289-M375 HydrophobicContact CG2-CE 4.04Å; I289-M375 PolarHBondContact O-N 2.81Å; I289-C469 HydrophobicContact CG2-CB 3.71Å
290	I	97.9	Very high	97.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	123.2	169.9	-59.7	171.2	0	0	0	108.2	I293 Y307 N308 Y373 L374 T418	I290-I293 HydrophobicContact CG2-CD1 4.2Å; I290-I293 HydrophobicContact CG2-CG1 3.75Å; I290-Y307 HydrophobicContact CG2-CD2 4.25Å; I290-Y307 HydrophobicContact CG2-CG 4.27Å; I290-N308 PolarHBondContact N-OD1 3.39Å; I290-N308 PolarHBondContact O-ND2 3.01Å; I290-Y373 CarbonylContact C-O 3.49Å; I290-Y373 WeakPolarHBondContact CA-O 3.31Å; I290-L374 HydrophobicContact CG1-CD2 3.86Å; I290-T418 HydrophobicContact CD1-CG2 3.58Å
291	V	96.8	Very high	97.1	Very high	16 Å²	16	49.4 Å²	49.4	10%	0.097	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-22.6	-175.6	-58.9	0	0	0	0	112.8	I289 C304 Y373 M375 L466 C469	I289-V291 HydrophobicContact CG2-CG1 3.97Å; V291-C304 WeakPolarHBondContact O-CB 3.5Å; V291-Y373 WeakPolarHBondContact CG2-O 3.21Å; V291-Y373 PolarHBondContact N-O 3.23Å; V291-M375 HydrophobicContact CG1-CB 4.16Å; V291-L466 HydrophobicContact CB-CD2 3.87Å; V291-L466 HydrophobicContact CG1-CB 3.98Å; V291-L466 HydrophobicContact CG1-CD1 4.47Å; V291-L466 HydrophobicContact CG1-CD2 3.87Å; V291-L466 HydrophobicContact CG1-CG 4.32Å; V291-L466 HydrophobicContact CG2-CD2 4.12Å; V291-C469 HydrophobicContact CG1-CB 4.4Å
292	R	96.8	Very high	97.1	Very high	79 Å²	79	47.6 Å²	47.6	30%	0.298	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	147.2	-179	-171.8	177.8	-173.4	-138.9	-14.2	110.3	E294 D299 Y373	R292-E294 IonicContact CZ-OE1 3.12Å; R292-E294 IonicContact NE-OE1 2.77Å; R292-E294 IonicContact NH1-OE1 3.05Å; R292-E294 PolarHBondContact NH1-OE1 2.89Å; R292-E294 IonicContact NH2-OE1 3.9Å; R292-E294 PolarHBondContact NH2-OE1 3.22Å; R292-D299 IonicContact CZ-OD2 3.98Å; R292-D299 IonicContact NE-OD1 3.6Å; R292-D299 IonicContact NE-OD2 3.27Å; R292-D299 PolarHBondContact NE-OD2 3.41Å; R292-D299 IonicContact NH2-OD2 3.73Å; R292-D299 PolarHBondContact NH2-OD2 3.14Å; R292-Y373 HydrophobicContact CB-CD2 3.84Å; R292-Y373 HydrophobicContact CB-CG 3.88Å; R292-Y373 HydrophobicContact CG-CD2 4.1Å; R292-Y373 HydrophobicContact CG-CE2 4.47Å; R292-Y373 PolarHBondContact O-N 2.85Å
293	I	98.4	Very high	97.1	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	129.2	171.9	-59.2	-177.5	0	0	0	108.3	I290 L300 Y307 L323 V327 I370 S371 L372	I290-I293 HydrophobicContact CG2-CD1 4.2Å; I290-I293 HydrophobicContact CG2-CG1 3.75Å; I293-L300 HydrophobicContact CB-CD1 3.86Å; I293-L300 HydrophobicContact CB-CG 4.22Å; I293-L300 HydrophobicContact CG2-CD1 3.63Å; I293-L300 HydrophobicContact CG2-CG 4.07Å; I293-L300 PolarHBondContact O-N 2.97Å; I293-Y307 HydrophobicContact CB-CE1 4.25Å; I293-Y307 HydrophobicContact CD1-CD1 3.6Å; I293-Y307 HydrophobicContact CD1-CE1 4.03Å; I293-Y307 HydrophobicContact CD1-CG 4.03Å; I293-Y307 HydrophobicContact CG1-CD1 3.96Å; I293-Y307 HydrophobicContact CG1-CD2 4.44Å; I293-Y307 HydrophobicContact CG1-CE1 4.08Å; I293-Y307 HydrophobicContact CG1-CG 4.16Å; I293-L323 HydrophobicContact CD1-CD2 4.4Å; I293-V327 HydrophobicContact CD1-CG1 3.79Å; I293-I370 HydrophobicContact CG2-CG2 4.47Å; I293-S371 WeakPolarHBondContact CA-O 3.31Å; I293-L372 HydrophobicContact CB-CD2 4.42Å; I293-L372 HydrophobicContact CD1-CD2 3.9Å; I293-L372 HydrophobicContact CG1-CD2 3.77Å; I293-L372 HydrophobicContact CG2-CD2 4.03Å
294	E	98.4	Very high	96.9	Very high	11 Å²	11	43.4 Å²	43.4	5%	0.051	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	143.8	172.6	-66.5	176.6	155.3	0	0	110.9	R292 Q298 I370 S371 Y373 R384	R292-E294 IonicContact CZ-OE1 3.12Å; R292-E294 IonicContact NE-OE1 2.77Å; R292-E294 IonicContact NH1-OE1 3.05Å; R292-E294 PolarHBondContact NH1-OE1 2.89Å; R292-E294 IonicContact NH2-OE1 3.9Å; R292-E294 PolarHBondContact NH2-OE1 3.22Å; E294-Q298 CarbonylContact C-O 3.55Å; E294-Q298 WeakPolarHBondContact CA-O 3.48Å; E294-I370 WeakPolarHBondContact O-CA 3.21Å; E294-S371 PolarHBondContact N-O 3.06Å; E294-S371 PolarHBondContact O-N 3.33Å; E294-Y373 HydrophobicContact CB-CE2 4.44Å; E294-Y373 VanDerWaalsContact CD-CE2 3.49Å; E294-Y373 HydrophobicContact CG-CE2 3.78Å; E294-Y373 PolarHBondContact OE1-OH 3.31Å; E294-Y373 VanDerWaalsContact OE2-CE2 3.29Å; E294-Y373 WeakPolarHBondContact OE2-CE2 3.35Å; E294-Y373 PolarHBondContact OE2-OH 2.92Å; E294-R384 IonicContact OE2-NH1 3.81Å
295	V	98.4	Very high	96.8	Very high	6 Å²	6	44.5 Å²	44.5	4%	0.036	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117.2	167.3	177.9	0	0	0	0	107.6	G297 Q298 L300 A334 I335 P368	V295-G297 VanDerWaalsContact C-N 3.25Å; V295-G297 PolarHBondContact O-N 3.11Å; V295-Q298 PolarHBondContact N-O 2.89Å; V295-Q298 WeakPolarHBondContact O-CB 3.41Å; V295-Q298 PolarHBondContact O-N 3.32Å; V295-L300 HydrophobicContact CG2-CD2 3.92Å; V295-A334 HydrophobicContact CB-CB 3.88Å; V295-A334 HydrophobicContact CG1-CB 3.95Å; V295-A334 HydrophobicContact CG2-CB 4.05Å; V295-I335 HydrophobicContact CG1-CG1 3.86Å; V295-I335 HydrophobicContact CG2-CG1 4.44Å; V295-P368 HydrophobicContact CG1-CB 3.83Å; V295-P368 HydrophobicContact CG1-CG 3.67Å
296	N	96.4	Very high	96.8	Very high	101 Å²	101	44 Å²	44	54%	0.54	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	38.5	-174	-151.3	28.7	0	0	0	113.9	Q298 P368 V369	N296-Q298 PolarHBondContact O-N 3.38Å; N296-P368 HydrophobicContact CB-CB 3.69Å; N296-V369 PolarHBondContact N-O 2.8Å
297	G	96.1	Very high	96.7	Very high	45 Å²	45	44 Å²	44	46%	0.464	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.1	1.5	-176.2	0	0	0	0	0	115	V295	V295-G297 VanDerWaalsContact C-N 3.25Å; V295-G297 PolarHBondContact O-N 3.11Å
298	Q	97.4	Very high	96.7	Very high	145 Å²	145	43.8 Å²	43.8	68%	0.678	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.1	173.4	-60.9	-65.8	-28.2	0	0	109.9	E294 V295 N296	E294-Q298 CarbonylContact C-O 3.55Å; E294-Q298 WeakPolarHBondContact CA-O 3.48Å; V295-Q298 PolarHBondContact N-O 2.89Å; V295-Q298 WeakPolarHBondContact O-CB 3.41Å; V295-Q298 PolarHBondContact O-N 3.32Å; N296-Q298 PolarHBondContact O-N 3.38Å
299	D	97.1	Very high	96.6	Very high	62 Å²	62	49.2 Å²	49.2	33%	0.332	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	138	175.9	-159.2	-25.5	0	0	0	111.3	R292 N301	R292-D299 IonicContact CZ-OD2 3.98Å; R292-D299 IonicContact NE-OD1 3.6Å; R292-D299 IonicContact NE-OD2 3.27Å; R292-D299 PolarHBondContact NE-OD2 3.41Å; R292-D299 IonicContact NH2-OD2 3.73Å; R292-D299 PolarHBondContact NH2-OD2 3.14Å; D299-N301 PolarHBondContact O-N 2.92Å; D299-N301 PolarHBondContact OD1-N 3.17Å
300	L	97.1	Very high	96.4	Very high	25 Å²	25	51 Å²	51	13%	0.131	26%	0.261	C	S	.	.			trans	-65.8	-18.5	167.7	-66.3	-170.1	0	0	0	112.5	I293 V295 M302 V327 A330 A331 A334	I293-L300 HydrophobicContact CB-CD1 3.86Å; I293-L300 HydrophobicContact CB-CG 4.22Å; I293-L300 HydrophobicContact CG2-CD1 3.63Å; I293-L300 HydrophobicContact CG2-CG 4.07Å; I293-L300 PolarHBondContact O-N 2.97Å; V295-L300 HydrophobicContact CG2-CD2 3.92Å; L300-M302 HydrophobicContact CB-CG 4.22Å; L300-M302 HydrophobicContact CB-SD 4.39Å; L300-M302 PolarHBondContact O-N 3.25Å; L300-V327 HydrophobicContact CD1-CG1 4.35Å; L300-A330 HydrophobicContact CD1-CB 4.47Å; L300-A331 HydrophobicContact CD1-CB 4.15Å; L300-A334 HydrophobicContact CD2-CB 4.06Å
301	N	94.7	Very high	96.4	Very high	142 Å²	142	52 Å²	52	76%	0.759	27%	0.265	S	S	*	.			trans	53.5	51	174.6	-166.8	39.5	0	0	0	112.5	D299	D299-N301 PolarHBondContact O-N 2.92Å; D299-N301 PolarHBondContact OD1-N 3.17Å
302	M	94.7	Very high	96.5	Very high	48 Å²	48	51.2 Å²	51.2	24%	0.236	26%	0.261	C	S	.	.			trans	-112.4	160.1	177.7	-56.6	-179.4	67.2	0	0	109.9	L300 C304 E306 Y307 K326 V327 A330	L300-M302 HydrophobicContact CB-CG 4.22Å; L300-M302 HydrophobicContact CB-SD 4.39Å; L300-M302 PolarHBondContact O-N 3.25Å; M302-C304 PolarHBondContact O-N 3.41Å; M302-E306 HydrophobicContact CE-CB 4.09Å; M302-E306 HydrophobicContact CE-CG 4.39Å; M302-Y307 HydrophobicContact CB-CE1 3.9Å; M302-Y307 HydrophobicContact CG-CE1 4.31Å; M302-Y307 PolarHBondContact N-OH 2.92Å; M302-Y307 HydrophobicContact SD-CE1 4.08Å; M302-K326 HydrophobicContact CE-CB 3.84Å; M302-V327 HydrophobicContact CE-CG2 4.06Å; M302-V327 HydrophobicContact SD-CG2 4.26Å; M302-A330 HydrophobicContact SD-CB 3.67Å
303	D	94.4	Very high	96.6	Very high	89 Å²	89	48 Å²	48	48%	0.476	25%	0.249	S	C	.	.			trans	-57.3	125.2	164.5	-177.5	-22	0	0	0	108.8	K305 E306	D303-K305 PolarHBondContact O-N 2.85Å; D303-K305 VanDerWaalsContact O-N 3.12Å; D303-K305 WeakPolarHBondContact OD1-CB 3.19Å; D303-K305 PolarHBondContact OD1-N 3.38Å; D303-E306 HydrophobicContact CB-CG 4.27Å; D303-E306 VanDerWaalsContact O-CB 3.26Å; D303-E306 WeakPolarHBondContact O-CB 3.34Å; D303-E306 PolarHBondContact O-N 2.94Å
304	C	93.7	Very high	96.6	Very high	24 Å²	24	47.9 Å²	47.9	16%	0.162	25%	0.249	C	C	.	.	H	α-helix	trans	-64.1	-18.3	-175.5	62.5	0	0	0	0	113.5	V291 M302 E306 Y307 N308 C469	V291-C304 WeakPolarHBondContact O-CB 3.5Å; M302-C304 PolarHBondContact O-N 3.41Å; C304-E306 PolarHBondContact O-N 3.03Å; C304-Y307 VanDerWaalsContact CA-CD2 3.47Å; C304-Y307 HydrophobicContact CB-CD2 3.88Å; C304-Y307 HydrophobicContact CB-CE2 4.04Å; C304-Y307 WeakPolarHBondContact O-CB 3.24Å; C304-Y307 PolarHBondContact O-N 3.36Å; C304-N308 PolarHBondContact O-ND2 3.09Å; C304-C469 HydrophobicContact CB-CB 3.68Å; C304-C469 WeakPolarHBondContact CB-SG 3.14Å; C304-C469 WeakPolarHBondContact SG-CA 3.37Å; C304-C469 WeakPolarHBondContact SG-CB 3.41Å; C304-C469 CovalentContact SG-SG 2.03Å; C304-C469 PolarHBondContact SG-SG 2.89Å
305	K	95	Very high	96.6	Very high	69 Å²	69	48 Å²	48	30%	0.3	25%	0.25	S	C	.	.	H	α-helix	trans	-60.7	-31.2	169.3	-71.4	171.6	179.8	158.6	0	112.5	D303 Y307 N308 Y309 D468	D303-K305 PolarHBondContact O-N 2.85Å; D303-K305 VanDerWaalsContact O-N 3.12Å; D303-K305 WeakPolarHBondContact OD1-CB 3.19Å; D303-K305 PolarHBondContact OD1-N 3.38Å; K305-Y307 VanDerWaalsContact C-N 3.28Å; K305-Y307 PolarHBondContact O-N 2.99Å; K305-N308 CarbonylContact O-C 3.43Å; K305-N308 PolarHBondContact O-N 3.47Å; K305-N308 VanDerWaalsContact O-N 3.17Å; K305-Y309 PolarHBondContact O-N 2.86Å; K305-Y309 VanDerWaalsContact O-N 3.16Å; K305-D468 VanDerWaalsContact CE-CG 3.47Å; K305-D468 WeakPolarHBondContact CE-O 3Å; K305-D468 WeakPolarHBondContact CE-OD1 3.27Å; K305-D468 WeakPolarHBondContact CE-OD2 3.23Å; K305-D468 WeakPolarHBondContact CG-O 3.41Å; K305-D468 IonicContact NZ-OD1 3.99Å; K305-D468 PolarHBondContact NZ-OD1 3.28Å; K305-D468 IonicContact NZ-OD2 2.92Å; K305-D468 PolarHBondContact NZ-OD2 2.91Å
306	E	96.6	Very high	96.6	Very high	44 Å²	44	47.8 Å²	47.8	21%	0.206	25%	0.249	C	C	.	.	H	α-helix	trans	-66.5	-31.5	178.3	-63.4	-75.5	175.3	0	0	111.7	M302 D303 C304 N308 Y309 P324 K326 V327	M302-E306 HydrophobicContact CE-CB 4.09Å; M302-E306 HydrophobicContact CE-CG 4.39Å; D303-E306 HydrophobicContact CB-CG 4.27Å; D303-E306 VanDerWaalsContact O-CB 3.26Å; D303-E306 WeakPolarHBondContact O-CB 3.34Å; D303-E306 PolarHBondContact O-N 2.94Å; C304-E306 PolarHBondContact O-N 3.03Å; E306-N308 PolarHBondContact O-N 2.8Å; E306-Y309 PolarHBondContact O-N 2.95Å; E306-P324 WeakPolarHBondContact O-CG 3.38Å; E306-K326 IonicContact OE1-NZ 3.39Å; E306-K326 PolarHBondContact OE1-NZ 3.41Å; E306-K326 WeakPolarHBondContact OE2-CD 3.29Å; E306-K326 IonicContact OE2-NZ 2.94Å; E306-K326 PolarHBondContact OE2-NZ 3.35Å; E306-V327 HydrophobicContact CB-CG2 4.1Å; E306-V327 VanDerWaalsContact O-CG2 3.26Å; E306-V327 WeakPolarHBondContact O-CG2 3.5Å
307	Y	97.5	Very high	96.6	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-65.7	-27.1	175.6	-52.9	-39.8	0	0	0	112.4	I290 I293 M302 C304 K305 S312 V327 T418	I290-Y307 HydrophobicContact CG2-CD2 4.25Å; I290-Y307 HydrophobicContact CG2-CG 4.27Å; I293-Y307 HydrophobicContact CB-CE1 4.25Å; I293-Y307 HydrophobicContact CD1-CD1 3.6Å; I293-Y307 HydrophobicContact CD1-CE1 4.03Å; I293-Y307 HydrophobicContact CD1-CG 4.03Å; I293-Y307 HydrophobicContact CG1-CD1 3.96Å; I293-Y307 HydrophobicContact CG1-CD2 4.44Å; I293-Y307 HydrophobicContact CG1-CE1 4.08Å; I293-Y307 HydrophobicContact CG1-CG 4.16Å; M302-Y307 HydrophobicContact CB-CE1 3.9Å; M302-Y307 HydrophobicContact CG-CE1 4.31Å; M302-Y307 PolarHBondContact N-OH 2.92Å; M302-Y307 HydrophobicContact SD-CE1 4.08Å; C304-Y307 VanDerWaalsContact CA-CD2 3.47Å; C304-Y307 HydrophobicContact CB-CD2 3.88Å; C304-Y307 HydrophobicContact CB-CE2 4.04Å; C304-Y307 WeakPolarHBondContact O-CB 3.24Å; C304-Y307 PolarHBondContact O-N 3.36Å; K305-Y307 VanDerWaalsContact C-N 3.28Å; K305-Y307 PolarHBondContact O-N 2.99Å; Y307-S312 PolarHBondContact O-OG 2.96Å; Y307-S312 VanDerWaalsContact O-OG 3.13Å; Y307-V327 HydrophobicContact CD1-CG1 3.85Å; Y307-V327 HydrophobicContact CD1-CG2 3.81Å; Y307-V327 HydrophobicContact CE1-CG1 4.27Å; Y307-V327 HydrophobicContact CE1-CG2 4.42Å; Y307-T418 PolarHBondContact O-OG1 2.84Å
308	N	97.5	Very high	96.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.7	21	-176.2	-50.2	-70.6	0	0	0	112.4	I289 I290 C304 K305 E306 D310 K311 S312 C469 Y471	I289-N308 HydrophobicContact CD1-CB 4.5Å; I290-N308 PolarHBondContact N-OD1 3.39Å; I290-N308 PolarHBondContact O-ND2 3.01Å; C304-N308 PolarHBondContact O-ND2 3.09Å; K305-N308 CarbonylContact O-C 3.43Å; K305-N308 PolarHBondContact O-N 3.47Å; K305-N308 VanDerWaalsContact O-N 3.17Å; E306-N308 PolarHBondContact O-N 2.8Å; N308-D310 CarbonylContact O-C 3.48Å; N308-D310 WeakPolarHBondContact O-CA 3.34Å; N308-K311 WeakPolarHBondContact O-CA 3.11Å; N308-K311 PolarHBondContact O-N 2.82Å; N308-S312 WeakPolarHBondContact CA-OG 3.48Å; N308-S312 WeakPolarHBondContact OD1-CB 3.4Å; N308-S312 PolarHBondContact OD1-OG 3.18Å; N308-C469 PolarHBondContact ND2-O 2.85Å; N308-Y471 WeakPolarHBondContact O-CB 3.5Å
309	Y	95.7	Very high	96.5	Very high	114 Å²	114	38.5 Å²	38.5	45%	0.447	20%	0.203	S	C	.	.	S	Bend	trans	-86.2	110.5	179	177.6	-94.3	0	0	0	111.4	K305 E306 P324 G417 Y471	K305-Y309 PolarHBondContact O-N 2.86Å; K305-Y309 VanDerWaalsContact O-N 3.16Å; E306-Y309 PolarHBondContact O-N 2.95Å; Y309-P324 VanDerWaalsContact O-CG 3.26Å; Y309-P324 WeakPolarHBondContact O-CG 3.26Å; Y309-G417 VanDerWaalsContact O-CA 3.25Å; Y309-G417 WeakPolarHBondContact O-CA 3.37Å; Y309-G417 PolarHBondContact O-N 3.06Å; Y309-Y471 HydrophobicContact CD2-CD1 4.46Å; Y309-Y471 AromaticContact CD2-CD2 3.7Å; Y309-Y471 HydrophobicContact CD2-CD2 3.7Å; Y309-Y471 HydrophobicContact CD2-CE1 4.19Å; Y309-Y471 AromaticContact CD2-CE2 3.4Å; Y309-Y471 HydrophobicContact CD2-CE2 3.4Å; Y309-Y471 HydrophobicContact CD2-CG 4.22Å; Y309-Y471 AromaticContact CD2-CZ 3.66Å; Y309-Y471 HydrophobicContact CE2-CD2 4.41Å; Y309-Y471 HydrophobicContact CE2-CE1 4.22Å; Y309-Y471 AromaticContact CE2-CE2 3.67Å; Y309-Y471 HydrophobicContact CE2-CE2 3.67Å; Y309-Y471 AromaticContact CE2-CZ 3.54Å; Y309-Y471 WeakPolarHBondContact CE2-OH 3.46Å
310	D	94.7	Very high	96.5	Very high	48 Å²	48	37.1 Å²	37.1	26%	0.257	20%	0.196	S	C	.	.	S	Bend	cis	-93.8	-7.9	-0.7	65.7	-29.5	0	0	0	114.3	N308 G417 Y471	N308-D310 CarbonylContact O-C 3.48Å; N308-D310 WeakPolarHBondContact O-CA 3.34Å; D310-G417 PolarHBondContact OD1-N 2.58Å; D310-Y471 HydrophobicContact CB-CD1 3.86Å; D310-Y471 HydrophobicContact CB-CE1 3.98Å; D310-Y471 WeakPolarHBondContact O-CD1 3.46Å
311	K	97	Very high	96.6	Very high	20 Å²	20	36 Å²	36	9%	0.087	19%	0.19	C	C	.	.			trans	-157.6	171.2	174.9	60.9	-164.5	161.8	-66.8	0	110.7	W284 Y285 E287 N308 I313 T416 G417 T418	W284-K311 HydrophobicContact CH2-CD 3.84Å; W284-K311 HydrophobicContact CZ2-CB 4.33Å; W284-K311 HydrophobicContact CZ2-CD 3.84Å; Y285-K311 HydrophobicContact CD2-CD 4.17Å; Y285-K311 HydrophobicContact CE2-CD 4.32Å; E287-K311 HydrophobicContact CG-CB 4.39Å; N308-K311 WeakPolarHBondContact O-CA 3.11Å; N308-K311 PolarHBondContact O-N 2.82Å; K311-I313 HydrophobicContact CD-CG2 4.19Å; K311-I313 HydrophobicContact CG-CG2 4.16Å; K311-T416 WeakPolarHBondContact CE-O 3.38Å; K311-T416 PolarHBondContact NZ-O 2.82Å; K311-G417 CarbonylContact O-C 3.59Å; K311-G417 WeakPolarHBondContact O-CA 3.46Å; K311-T418 PolarHBondContact O-N 3.46Å
312	S	98.5	Very high	96.8	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	123.9	167.6	-65.1	0	0	0	0	109.5	E287 V288 Y307 N308 T418	E287-S312 CarbonylContact C-O 3.51Å; E287-S312 VanDerWaalsContact CA-O 3.28Å; E287-S312 WeakPolarHBondContact CA-O 3.39Å; V288-S312 PolarHBondContact N-O 3.37Å; V288-S312 WeakPolarHBondContact O-CB 3.27Å; Y307-S312 PolarHBondContact O-OG 2.96Å; Y307-S312 VanDerWaalsContact O-OG 3.13Å; N308-S312 WeakPolarHBondContact CA-OG 3.48Å; N308-S312 WeakPolarHBondContact OD1-CB 3.4Å; N308-S312 PolarHBondContact OD1-OG 3.18Å; S312-T418 WeakPolarHBondContact CA-O 3.42Å; S312-T418 WeakPolarHBondContact OG-CB 3.41Å
313	I	98.7	Very high	97	Very high	10 Å²	10	28.8 Å²	28.8	5%	0.051	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	153.8	-174.7	67.9	172	0	0	0	112.3	Y285 Y286 K311 D315 T418 V419 M420	Y285-I313 VanDerWaalsContact CB-CG2 3.48Å; Y285-I313 HydrophobicContact CD1-CD1 3.84Å; Y285-I313 HydrophobicContact CD1-CG2 4.34Å; Y285-I313 HydrophobicContact CD2-CG2 4.4Å; Y285-I313 HydrophobicContact CE1-CD1 4.23Å; Y285-I313 HydrophobicContact CG-CD1 4.39Å; Y285-I313 HydrophobicContact CG-CG2 3.84Å; Y286-I313 WeakPolarHBondContact O-CA 3.32Å; K311-I313 HydrophobicContact CD-CG2 4.19Å; K311-I313 HydrophobicContact CG-CG2 4.16Å; I313-D315 HydrophobicContact CD1-CB 4.08Å; I313-D315 HydrophobicContact CG1-CB 4.28Å; I313-T418 PolarHBondContact N-O 2.91Å; I313-V419 HydrophobicContact CD1-CG1 4.32Å; I313-V419 HydrophobicContact CD1-CG2 4.24Å; I313-V419 HydrophobicContact CG1-CB 4.34Å; I313-V419 HydrophobicContact CG1-CG1 4.08Å; I313-V419 HydrophobicContact CG1-CG2 4.07Å; I313-M420 PolarHBondContact O-N 3.23Å
314	V	98.8	Very high	97.2	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123	165.3	-174.8	0	0	0	0	108.6	Y286 V288 M420 M425 V430 F432 I439 F441	Y286-V314 PolarHBondContact O-N 3.23Å; Y286-V314 VanDerWaalsContact O-N 3.13Å; V288-V314 HydrophobicContact CG1-CG2 4.48Å; V314-M420 HydrophobicContact CB-CE 4.45Å; V314-M420 HydrophobicContact CG2-CE 3.37Å; V314-M425 HydrophobicContact CG1-CE 4.08Å; V314-M425 HydrophobicContact CG1-CG 4.22Å; V314-M425 HydrophobicContact CG1-SD 3.87Å; V314-V430 HydrophobicContact CG1-CG1 4.29Å; V314-F432 HydrophobicContact CB-CE1 4.17Å; V314-F432 HydrophobicContact CB-CZ 4.4Å; V314-F432 HydrophobicContact CG1-CE1 3.95Å; V314-F432 HydrophobicContact CG1-CZ 3.68Å; V314-I439 HydrophobicContact CB-CD1 4.27Å; V314-I439 HydrophobicContact CG2-CD1 3.76Å; V314-F441 HydrophobicContact CG2-CZ 3.96Å
315	D	98.4	Very high	97.3	Very high	13 Å²	13	31.1 Å²	31.1	7%	0.07	15%	0.149	C	C	.	.			trans	-145.4	103.7	-169.6	178.4	8.8	0	0	0	112.7	T120 G121 I313 G317 T318 V419 M420 G421	T120-D315 WeakPolarHBondContact OG1-CA 3.17Å; G121-D315 WeakPolarHBondContact CA-OD1 3.35Å; G121-D315 PolarHBondContact N-OD1 3.5Å; G121-D315 VanDerWaalsContact N-OD1 3.16Å; I313-D315 HydrophobicContact CD1-CB 4.08Å; I313-D315 HydrophobicContact CG1-CB 4.28Å; D315-G317 VanDerWaalsContact C-N 3.27Å; D315-G317 PolarHBondContact O-N 2.92Å; D315-G317 WeakPolarHBondContact OD1-CA 3.35Å; D315-G317 PolarHBondContact OD1-N 3.15Å; D315-T318 PolarHBondContact O-N 2.81Å; D315-T318 PolarHBondContact OD1-N 3.16Å; D315-T318 VanDerWaalsContact OD2-CB 3.25Å; D315-T318 WeakPolarHBondContact OD2-CB 3.3Å; D315-T318 PolarHBondContact OD2-OG1 3.06Å; D315-V419 HydrophobicContact CB-CG1 3.54Å; D315-M420 PolarHBondContact N-O 2.51Å; D315-G421 VanDerWaalsContact O-CA 3.3Å; D315-G421 WeakPolarHBondContact O-CA 3.25Å
316	S	98.4	Very high	97.5	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.014	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-17.6	175.5	59.3	0	0	0	0	114.2	V118 T120	V118-S316 PolarHBondContact O-OG 2.88Å; T120-S316 PolarHBondContact N-OG 3.33Å; T120-S316 PolarHBondContact OG1-N 3.38Å; T120-S316 PolarHBondContact OG1-OG 3.46Å
317	G	96.2	Very high	97.6	Very high	33 Å²	33	31.5 Å²	31.5	34%	0.34	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-14.9	176.2	0	0	0	0	0	113.6	D119 D315	D119-G317 WeakPolarHBondContact OD1-CA 3.22Å; D315-G317 VanDerWaalsContact C-N 3.27Å; D315-G317 PolarHBondContact O-N 2.92Å; D315-G317 WeakPolarHBondContact OD1-CA 3.35Å; D315-G317 PolarHBondContact OD1-N 3.15Å
318	T	96.2	Very high	97.6	Very high	28 Å²	28	32 Å²	32	17%	0.172	15%	0.152	C	C	.	.			trans	-99.2	131.2	174	-71	0	0	0	0	111	D315 R322 V419 G421 A422	D315-T318 PolarHBondContact O-N 2.81Å; D315-T318 PolarHBondContact OD1-N 3.16Å; D315-T318 VanDerWaalsContact OD2-CB 3.25Å; D315-T318 WeakPolarHBondContact OD2-CB 3.3Å; D315-T318 PolarHBondContact OD2-OG1 3.06Å; T318-R322 HydrophobicContact CG2-CG 3.93Å; T318-V419 HydrophobicContact CG2-CB 4.44Å; T318-V419 HydrophobicContact CG2-CG1 3.78Å; T318-G421 CarbonylContact O-C 3.54Å; T318-G421 WeakPolarHBondContact O-CA 3.48Å; T318-A422 PolarHBondContact O-N 2.87Å
319	T	95.8	Very high	97.7	Very high	35 Å²	35	36.9 Å²	36.9	22%	0.215	18%	0.175	C	C	.	.			trans	-65	-56.8	177.3	-57	0	0	0	0	113.1	S97 A422 V423	S97-T319 WeakPolarHBondContact O-CB 3.4Å; S97-T319 WeakPolarHBondContact O-CG2 3.39Å; S97-T319 PolarHBondContact O-OG1 3.11Å; T319-A422 PolarHBondContact O-N 3.08Å; T319-V423 HydrophobicContact CG2-CG1 4.49Å; T319-V423 WeakPolarHBondContact O-CG1 3.11Å; T319-V423 WeakPolarHBondContact O-CG2 3.44Å; T319-V423 PolarHBondContact O-N 3.1Å; T319-V423 VanDerWaalsContact O-N 3.08Å
320	N	97.8	Very high	97.8	Very high	32 Å²	32	32.8 Å²	32.8	17%	0.171	16%	0.164	C	C	.	.	S	Bend	trans	-86.6	159.4	-163.6	-73	16.1	0	0	0	113.2	R322 A410 S412 G421	N320-R322 HydrophobicContact CB-CG 4.26Å; N320-R322 PolarHBondContact O-N 3.24Å; N320-A410 CarbonylContact C-O 3.5Å; N320-A410 VanDerWaalsContact CA-O 3.29Å; N320-A410 WeakPolarHBondContact CA-O 3.32Å; N320-A410 WeakPolarHBondContact CB-O 3.46Å; N320-S412 WeakPolarHBondContact ND2-CB 3.38Å; N320-S412 PolarHBondContact ND2-OG 2.98Å; N320-G421 WeakPolarHBondContact O-CA 3.49Å; N320-G421 PolarHBondContact O-N 2.92Å
321	L	98.6	Very high	98	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	109.4	152.6	175	61.5	0	0	0	108	L323 L372 A410 V411 S412 T418 V419 I424	L321-L323 HydrophobicContact CD1-CD2 4.03Å; L321-L323 HydrophobicContact CD1-CG 4.46Å; L321-L323 HydrophobicContact CD2-CD1 4.23Å; L321-L323 HydrophobicContact CD2-CD2 4.34Å; L321-L323 HydrophobicContact CD2-CG 4.32Å; L321-L323 HydrophobicContact CG-CD1 4.49Å; L321-L323 HydrophobicContact CG-CD2 4.16Å; L321-L323 HydrophobicContact CG-CG 4.08Å; L321-L372 HydrophobicContact CD1-CD1 4.48Å; L321-A410 PolarHBondContact N-O 3.02Å; L321-V411 HydrophobicContact CB-CG1 4.42Å; L321-V411 HydrophobicContact CB-CG2 4.37Å; L321-V411 HydrophobicContact CD2-CG1 4.12Å; L321-V411 HydrophobicContact CD2-CG2 4.24Å; L321-V411 HydrophobicContact CG-CG1 4.25Å; L321-V411 CarbonylContact O-C 3.39Å; L321-V411 VanDerWaalsContact O-CA 3.26Å; L321-V411 WeakPolarHBondContact O-CA 3.45Å; L321-S412 PolarHBondContact O-N 2.58Å; L321-T418 HydrophobicContact CD1-CG2 4.45Å; L321-V419 WeakPolarHBondContact CA-O 3.37Å; L321-I424 HydrophobicContact CB-CD1 3.87Å; L321-I424 HydrophobicContact CB-CG1 3.98Å; L321-I424 HydrophobicContact CD1-CD1 4.13Å; L321-I424 HydrophobicContact CD1-CG1 4Å; L321-I424 HydrophobicContact CD2-CD1 4.11Å; L321-I424 HydrophobicContact CG-CD1 4.22Å; L321-I424 HydrophobicContact CG-CG1 4.45Å
322	R	98.6	Very high	98	Very high	36 Å²	36	30.3 Å²	30.3	14%	0.136	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	130.2	176.2	-48.3	-176.7	62.6	-168	-3.7	109.2	T318 N320 S412 T418 V419	T318-R322 HydrophobicContact CG2-CG 3.93Å; N320-R322 HydrophobicContact CB-CG 4.26Å; N320-R322 PolarHBondContact O-N 3.24Å; R322-S412 CarbonylContact C-O 3.58Å; R322-S412 VanDerWaalsContact CA-O 3.27Å; R322-S412 WeakPolarHBondContact CA-O 3.33Å; R322-T418 CarbonylContact O-C 3.48Å; R322-T418 WeakPolarHBondContact O-CA 3.35Å; R322-V419 HydrophobicContact CB-CB 3.9Å; R322-V419 HydrophobicContact CB-CG2 4.15Å; R322-V419 HydrophobicContact CG-CB 4.09Å; R322-V419 HydrophobicContact CG-CG2 4.49Å; R322-V419 PolarHBondContact N-O 3.25Å; R322-V419 PolarHBondContact O-N 3.4Å
323	L	98.6	Very high	98	Very high	4 Å²	4	37.8 Å²	37.8	2%	0.021	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	143.5	-177.9	-64.9	172.3	0	0	0	110.8	I293 L321 V327 F328 A331 V411 S412 Q413 S414 T418	I293-L323 HydrophobicContact CD1-CD2 4.4Å; L321-L323 HydrophobicContact CD1-CD2 4.03Å; L321-L323 HydrophobicContact CD1-CG 4.46Å; L321-L323 HydrophobicContact CD2-CD1 4.23Å; L321-L323 HydrophobicContact CD2-CD2 4.34Å; L321-L323 HydrophobicContact CD2-CG 4.32Å; L321-L323 HydrophobicContact CG-CD1 4.49Å; L321-L323 HydrophobicContact CG-CD2 4.16Å; L321-L323 HydrophobicContact CG-CG 4.08Å; L323-V327 HydrophobicContact CB-CB 4.35Å; L323-V327 HydrophobicContact CB-CG1 4.28Å; L323-V327 HydrophobicContact CD1-CG1 4.3Å; L323-V327 HydrophobicContact CD2-CG1 4.17Å; L323-V327 HydrophobicContact CG-CG1 4.49Å; L323-F328 HydrophobicContact CB-CB 3.98Å; L323-A331 HydrophobicContact CD1-CB 3.96Å; L323-V411 HydrophobicContact CD1-CG1 3.71Å; L323-V411 HydrophobicContact CG-CG1 4.26Å; L323-S412 PolarHBondContact N-O 3.28Å; L323-Q413 CarbonylContact O-C 3.54Å; L323-S414 WeakPolarHBondContact O-CB 3.4Å; L323-S414 PolarHBondContact O-N 3.48Å; L323-T418 HydrophobicContact CD2-CG2 4.04Å
324	P	98.3	Very high	98	Very high	4 Å²	4	38.8 Å²	38.8	3%	0.026	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.6	145.1	171.4	-28.7	35.7	0	0	0	111.2	E306 Y309 K326 V327 F328 T418	E306-P324 WeakPolarHBondContact O-CG 3.38Å; Y309-P324 VanDerWaalsContact O-CG 3.26Å; Y309-P324 WeakPolarHBondContact O-CG 3.26Å; P324-K326 VanDerWaalsContact C-N 3.31Å; P324-K326 PolarHBondContact O-N 2.86Å; P324-K326 VanDerWaalsContact O-N 3.08Å; P324-V327 HydrophobicContact CB-CG2 4.21Å; P324-V327 HydrophobicContact CG-CG2 4.48Å; P324-V327 CarbonylContact O-C 2.88Å; P324-V327 WeakPolarHBondContact O-CA 3.42Å; P324-V327 WeakPolarHBondContact O-CB 3.49Å; P324-V327 PolarHBondContact O-N 2.76Å; P324-F328 PolarHBondContact O-N 2.6Å; P324-T418 WeakPolarHBondContact CD-OG1 3.45Å
325	R	97.4	Very high	97.9	Very high	158 Å²	158	38.8 Å²	38.8	60%	0.596	20%	0.195	S	C	*	.	H	α-helix	trans	-45.5	-47.8	-171.1	178.8	175.7	175.9	-168.8	0.5	115	Q329 Q413 S414	R325-Q329 VanDerWaalsContact O-CG 3.28Å; R325-Q329 WeakPolarHBondContact O-CG 3.43Å; R325-Q329 PolarHBondContact O-N 3.33Å; R325-Q329 VanDerWaalsContact O-N 3.12Å; R325-Q413 HydrophobicContact CB-CG 4.09Å; R325-Q413 HydrophobicContact CG-CG 4.41Å; R325-S414 PolarHBondContact N-O 3.36Å
326	K	98	Very high	97.9	Very high	120 Å²	120	42.1 Å²	42.1	52%	0.522	21%	0.211	S	C	.	.	H	α-helix	trans	-66.1	-41.7	-179.8	-60.5	-168.9	-158.9	158.2	0	111.9	M302 E306 P324 Q329 A330	M302-K326 HydrophobicContact CE-CB 3.84Å; E306-K326 IonicContact OE1-NZ 3.39Å; E306-K326 PolarHBondContact OE1-NZ 3.41Å; E306-K326 WeakPolarHBondContact OE2-CD 3.29Å; E306-K326 IonicContact OE2-NZ 2.94Å; E306-K326 PolarHBondContact OE2-NZ 3.35Å; P324-K326 VanDerWaalsContact C-N 3.31Å; P324-K326 PolarHBondContact O-N 2.86Å; P324-K326 VanDerWaalsContact O-N 3.08Å; K326-Q329 PolarHBondContact O-N 3.39Å; K326-A330 PolarHBondContact O-N 2.8Å
327	V	98.6	Very high	97.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67.7	-43.9	179.5	-175.7	0	0	0	0	110.8	I293 L300 M302 E306 Y307 L323 P324 Q329 A330 A331	I293-V327 HydrophobicContact CD1-CG1 3.79Å; L300-V327 HydrophobicContact CD1-CG1 4.35Å; M302-V327 HydrophobicContact CE-CG2 4.06Å; M302-V327 HydrophobicContact SD-CG2 4.26Å; E306-V327 HydrophobicContact CB-CG2 4.1Å; E306-V327 VanDerWaalsContact O-CG2 3.26Å; E306-V327 WeakPolarHBondContact O-CG2 3.5Å; Y307-V327 HydrophobicContact CD1-CG1 3.85Å; Y307-V327 HydrophobicContact CD1-CG2 3.81Å; Y307-V327 HydrophobicContact CE1-CG1 4.27Å; Y307-V327 HydrophobicContact CE1-CG2 4.42Å; L323-V327 HydrophobicContact CB-CB 4.35Å; L323-V327 HydrophobicContact CB-CG1 4.28Å; L323-V327 HydrophobicContact CD1-CG1 4.3Å; L323-V327 HydrophobicContact CD2-CG1 4.17Å; L323-V327 HydrophobicContact CG-CG1 4.49Å; P324-V327 HydrophobicContact CB-CG2 4.21Å; P324-V327 HydrophobicContact CG-CG2 4.48Å; P324-V327 CarbonylContact O-C 2.88Å; P324-V327 WeakPolarHBondContact O-CA 3.42Å; P324-V327 WeakPolarHBondContact O-CB 3.49Å; P324-V327 PolarHBondContact O-N 2.76Å; V327-Q329 VanDerWaalsContact C-N 3.34Å; V327-Q329 PolarHBondContact O-N 2.93Å; V327-A330 PolarHBondContact O-N 3.19Å; V327-A331 VanDerWaalsContact O-CB 3.29Å; V327-A331 WeakPolarHBondContact O-CB 3.42Å; V327-A331 PolarHBondContact O-N 3.4Å
328	F	98.6	Very high	97.7	Very high	13 Å²	13	45.5 Å²	45.5	6%	0.057	24%	0.236	C	C	.	.	H	α-helix	trans	-55.6	-48.8	174.4	175.6	-105	0	0	0	111.4	L323 P324 A330 A331 V332 V411 S412 Q413	L323-F328 HydrophobicContact CB-CB 3.98Å; P324-F328 PolarHBondContact O-N 2.6Å; F328-A330 PolarHBondContact O-N 3.36Å; F328-A331 PolarHBondContact O-N 3.37Å; F328-V332 HydrophobicContact CD1-CG2 4.48Å; F328-V332 HydrophobicContact CD2-CG2 3.94Å; F328-V332 HydrophobicContact CE1-CG2 4.12Å; F328-V332 HydrophobicContact CE2-CG2 3.51Å; F328-V332 HydrophobicContact CG-CG2 4.41Å; F328-V332 HydrophobicContact CZ-CG2 3.62Å; F328-V332 WeakPolarHBondContact O-CB 3.38Å; F328-V332 WeakPolarHBondContact O-CG2 3.39Å; F328-V332 PolarHBondContact O-N 3.08Å; F328-V411 HydrophobicContact CD2-CG1 4.16Å; F328-V411 HydrophobicContact CE2-CG1 4.32Å; F328-S412 VanDerWaalsContact CD2-C 3.48Å; F328-Q413 HydrophobicContact CD1-CB 3.86Å; F328-Q413 HydrophobicContact CD1-CG 4.31Å; F328-Q413 HydrophobicContact CE1-CB 4.22Å; F328-Q413 HydrophobicContact CG-CB 4.06Å
329	Q	98.3	Very high	97.7	Very high	102 Å²	102	44.2 Å²	44.2	48%	0.477	23%	0.228	S	C	.	.	H	α-helix	trans	-62	-42.9	178.8	-71.8	174.9	-13.6	0	0	112.3	R325 K326 V327 K333	R325-Q329 VanDerWaalsContact O-CG 3.28Å; R325-Q329 WeakPolarHBondContact O-CG 3.43Å; R325-Q329 PolarHBondContact O-N 3.33Å; R325-Q329 VanDerWaalsContact O-N 3.12Å; K326-Q329 PolarHBondContact O-N 3.39Å; V327-Q329 VanDerWaalsContact C-N 3.34Å; V327-Q329 PolarHBondContact O-N 2.93Å; Q329-K333 VanDerWaalsContact O-CB 3.27Å; Q329-K333 WeakPolarHBondContact O-CB 3.41Å; Q329-K333 PolarHBondContact O-N 3.25Å; Q329-K333 VanDerWaalsContact O-N 3.08Å
330	A	98.4	Very high	97.5	Very high	28 Å²	28	46.9 Å²	46.9	23%	0.231	25%	0.248	C	C	.	.	H	α-helix	trans	-65.4	-45.2	177.2	0	0	0	0	0	112	L300 M302 K326 V327 F328 K333 A334	L300-A330 HydrophobicContact CD1-CB 4.47Å; M302-A330 HydrophobicContact SD-CB 3.67Å; K326-A330 PolarHBondContact O-N 2.8Å; V327-A330 PolarHBondContact O-N 3.19Å; F328-A330 PolarHBondContact O-N 3.36Å; A330-K333 PolarHBondContact O-N 3.2Å; A330-A334 WeakPolarHBondContact O-CB 3.21Å; A330-A334 PolarHBondContact O-N 2.75Å
331	A	98.5	Very high	97.3	Very high	3 Å²	3	50.5 Å²	50.5	3%	0.025	27%	0.271	C	S	.	.	H	α-helix	trans	-63.7	-49.5	178.9	0	0	0	0	0	111.8	L300 L323 V327 F328 K333 A334 I335	L300-A331 HydrophobicContact CD1-CB 4.15Å; L323-A331 HydrophobicContact CD1-CB 3.96Å; V327-A331 VanDerWaalsContact O-CB 3.29Å; V327-A331 WeakPolarHBondContact O-CB 3.42Å; V327-A331 PolarHBondContact O-N 3.4Å; F328-A331 PolarHBondContact O-N 3.37Å; A331-K333 VanDerWaalsContact C-N 3.34Å; A331-K333 PolarHBondContact O-N 3.27Å; A331-A334 PolarHBondContact O-N 2.89Å; A331-A334 VanDerWaalsContact O-N 3.16Å; A331-I335 WeakPolarHBondContact O-CD1 3.45Å; A331-I335 WeakPolarHBondContact O-CG1 3.16Å; A331-I335 PolarHBondContact O-N 3.46Å
332	V	98.1	Very high	96.9	Very high	13 Å²	13	54 Å²	54	8%	0.079	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-44	178	170.1	0	0	0	0	111	F328 A334 I335 E336 W349 F409	F328-V332 HydrophobicContact CD1-CG2 4.48Å; F328-V332 HydrophobicContact CD2-CG2 3.94Å; F328-V332 HydrophobicContact CE1-CG2 4.12Å; F328-V332 HydrophobicContact CE2-CG2 3.51Å; F328-V332 HydrophobicContact CG-CG2 4.41Å; F328-V332 HydrophobicContact CZ-CG2 3.62Å; F328-V332 WeakPolarHBondContact O-CB 3.38Å; F328-V332 WeakPolarHBondContact O-CG2 3.39Å; F328-V332 PolarHBondContact O-N 3.08Å; V332-A334 VanDerWaalsContact C-N 3.32Å; V332-A334 PolarHBondContact O-N 3.05Å; V332-I335 PolarHBondContact O-N 2.97Å; V332-E336 HydrophobicContact CG1-CG 4.2Å; V332-E336 VanDerWaalsContact CG1-OE1 3.3Å; V332-E336 WeakPolarHBondContact CG1-OE1 3.5Å; V332-E336 WeakPolarHBondContact O-CB 3.43Å; V332-E336 WeakPolarHBondContact O-CG 3.16Å; V332-E336 PolarHBondContact O-N 3.17Å; V332-W349 HydrophobicContact CG1-CB 3.92Å; V332-W349 HydrophobicContact CG1-CG 4.28Å; V332-F409 HydrophobicContact CG2-CE1 3.9Å; V332-F409 HydrophobicContact CG2-CZ 4.32Å
333	K	97.7	Very high	96.5	Very high	157 Å²	157	61.5 Å²	61.5	68%	0.683	32%	0.324	S	S	*	.	H	α-helix	trans	-58.6	-42.9	175.6	-177.6	-177.2	177.4	-174.2	0	112.3	Q329 A330 A331 A337	Q329-K333 VanDerWaalsContact O-CB 3.27Å; Q329-K333 WeakPolarHBondContact O-CB 3.41Å; Q329-K333 PolarHBondContact O-N 3.25Å; Q329-K333 VanDerWaalsContact O-N 3.08Å; A330-K333 PolarHBondContact O-N 3.2Å; A331-K333 VanDerWaalsContact C-N 3.34Å; A331-K333 PolarHBondContact O-N 3.27Å; K333-A337 WeakPolarHBondContact O-CB 3.35Å; K333-A337 PolarHBondContact O-N 2.79Å; K333-A337 VanDerWaalsContact O-N 3.09Å
334	A	98.1	Very high	96.3	Very high	32 Å²	32	62.9 Å²	62.9	26%	0.264	33%	0.33	S	S	.	.	H	α-helix	trans	-67.7	-38.8	177.6	0	0	0	0	0	112	V295 L300 A330 A331 V332 A337 A338	V295-A334 HydrophobicContact CB-CB 3.88Å; V295-A334 HydrophobicContact CG1-CB 3.95Å; V295-A334 HydrophobicContact CG2-CB 4.05Å; L300-A334 HydrophobicContact CD2-CB 4.06Å; A330-A334 WeakPolarHBondContact O-CB 3.21Å; A330-A334 PolarHBondContact O-N 2.75Å; A331-A334 PolarHBondContact O-N 2.89Å; A331-A334 VanDerWaalsContact O-N 3.16Å; V332-A334 VanDerWaalsContact C-N 3.32Å; V332-A334 PolarHBondContact O-N 3.05Å; A334-A337 PolarHBondContact O-N 2.97Å; A334-A338 WeakPolarHBondContact O-CB 3.29Å; A334-A338 PolarHBondContact O-N 2.93Å
335	I	98.1	Very high	96.1	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-66.2	-48.8	177.2	-66.2	162.5	0	0	0	110.7	V295 A331 V332 A337 A338 S339 W349 P368 I370 F409	V295-I335 HydrophobicContact CG1-CG1 3.86Å; V295-I335 HydrophobicContact CG2-CG1 4.44Å; A331-I335 WeakPolarHBondContact O-CD1 3.45Å; A331-I335 WeakPolarHBondContact O-CG1 3.16Å; A331-I335 PolarHBondContact O-N 3.46Å; V332-I335 PolarHBondContact O-N 2.97Å; I335-A337 VanDerWaalsContact C-N 3.29Å; I335-A337 PolarHBondContact O-N 2.87Å; I335-A338 PolarHBondContact O-N 2.86Å; I335-A338 VanDerWaalsContact O-N 3.1Å; I335-S339 PolarHBondContact O-N 2.78Å; I335-S339 PolarHBondContact O-OG 3.25Å; I335-S339 VanDerWaalsContact O-OG 3.1Å; I335-W349 HydrophobicContact CG2-CH2 3.94Å; I335-W349 HydrophobicContact CG2-CZ3 3.61Å; I335-P368 HydrophobicContact CB-CG 4.25Å; I335-P368 HydrophobicContact CG1-CG 3.98Å; I335-P368 HydrophobicContact CG2-CG 4.09Å; I335-I370 HydrophobicContact CD1-CD1 3.75Å; I335-I370 HydrophobicContact CD1-CG1 4.43Å; I335-F409 HydrophobicContact CD1-CE2 4.35Å; I335-F409 HydrophobicContact CD1-CZ 3.92Å
336	E	96.6	Very high	95.9	Very high	83 Å²	83	62.4 Å²	62.4	39%	0.388	35%	0.35	S	S	.	.	H	α-helix	trans	-56.1	-43.3	176	-79.7	-179.2	-161.6	0	0	112	V332 S339 S340 W349	V332-E336 HydrophobicContact CG1-CG 4.2Å; V332-E336 VanDerWaalsContact CG1-OE1 3.3Å; V332-E336 WeakPolarHBondContact CG1-OE1 3.5Å; V332-E336 WeakPolarHBondContact O-CB 3.43Å; V332-E336 WeakPolarHBondContact O-CG 3.16Å; V332-E336 PolarHBondContact O-N 3.17Å; E336-S339 CarbonylContact O-C 3.44Å; E336-S339 PolarHBondContact O-N 2.89Å; E336-S340 PolarHBondContact O-N 2.8Å; E336-W349 HydrophobicContact CB-CZ2 4.48Å; E336-W349 HydrophobicContact CG-CD2 3.84Å; E336-W349 VanDerWaalsContact CG-CE2 3.4Å; E336-W349 HydrophobicContact CG-CE3 4.45Å; E336-W349 HydrophobicContact CG-CG 4.18Å; E336-W349 HydrophobicContact CG-CH2 4.3Å; E336-W349 HydrophobicContact CG-CZ2 3.65Å; E336-W349 PolarHBondContact OE1-NE1 2.88Å
337	A	96.1	Very high	95.7	Very high	69 Å²	69	56.8 Å²	56.8	57%	0.57	33%	0.326	S	S	*	.	H	α-helix	trans	-65.7	-37.5	177.1	0	0	0	0	0	112.3	K333 A334 I335 S340	K333-A337 WeakPolarHBondContact O-CB 3.35Å; K333-A337 PolarHBondContact O-N 2.79Å; K333-A337 VanDerWaalsContact O-N 3.09Å; A334-A337 PolarHBondContact O-N 2.97Å; I335-A337 VanDerWaalsContact C-N 3.29Å; I335-A337 PolarHBondContact O-N 2.87Å; A337-S340 PolarHBondContact O-OG 2.66Å
338	A	95.9	Very high	95.6	Very high	38 Å²	38	56.8 Å²	56.8	31%	0.314	33%	0.326	S	S	.	.	H	α-helix	trans	-71.7	-34	177.1	0	0	0	0	0	112.5	A334 I335 P368	A334-A338 WeakPolarHBondContact O-CB 3.29Å; A334-A338 PolarHBondContact O-N 2.93Å; I335-A338 PolarHBondContact O-N 2.86Å; I335-A338 VanDerWaalsContact O-N 3.1Å; A338-P368 HydrophobicContact CB-CB 3.9Å; A338-P368 HydrophobicContact CB-CG 3.86Å
339	S	95.5	Very high	95.5	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.007	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	20.7	-179	69.5	0	0	0	0	113.9	I335 E336 T341 E342 W349 I366	I335-S339 PolarHBondContact O-N 2.78Å; I335-S339 PolarHBondContact O-OG 3.25Å; I335-S339 VanDerWaalsContact O-OG 3.1Å; E336-S339 CarbonylContact O-C 3.44Å; E336-S339 PolarHBondContact O-N 2.89Å; S339-T341 PolarHBondContact O-N 3Å; S339-E342 PolarHBondContact O-N 3.48Å; S339-W349 WeakPolarHBondContact OG-CH2 3.44Å; S339-I366 VanDerWaalsContact CA-O 3.28Å; S339-I366 WeakPolarHBondContact CA-O 3.33Å; S339-I366 WeakPolarHBondContact CB-O 3.41Å
340	S	92.8	Very high	95.4	Very high	91 Å²	91	56.5 Å²	56.5	64%	0.636	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-2.1	-169.5	72.7	0	0	0	0	115	E336 A337	E336-S340 PolarHBondContact O-N 2.8Å; A337-S340 PolarHBondContact O-OG 2.66Å
341	T	91.6	Very high	95.1	Very high	108 Å²	108	56 Å²	56	66%	0.663	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-23.9	174.2	49.7	0	0	0	0	112.3	S339 I366	S339-T341 PolarHBondContact O-N 3Å; T341-I366 WeakPolarHBondContact OG1-CG2 3.43Å
342	E	90.5	Very high	94.7	Very high	73 Å²	73	62.6 Å²	62.6	34%	0.341	36%	0.355	S	S	.	.	S	Bend	trans	-120	150.4	171.5	-71	-172.5	-164.2	0	0	110.8	S339 F344 W357 I366	S339-E342 PolarHBondContact O-N 3.48Å; E342-F344 HydrophobicContact CB-CE2 3.75Å; E342-F344 HydrophobicContact CB-CZ 3.74Å; E342-W357 PolarHBondContact OE2-NE1 3.44Å; E342-W357 VanDerWaalsContact OE2-NE1 3.14Å; E342-I366 HydrophobicContact CB-CD1 4.01Å; E342-I366 HydrophobicContact CG-CD1 3.89Å
343	Q	90.7	Very high	94.5	Very high	195 Å²	195	66.5 Å²	66.5	91%	0.911	37%	0.372	S	S	*	.			trans	-98.4	129	174.8	-70.8	-176.8	17.8	0	0	110
344	F	94.8	Very high	94.3	Very high	33 Å²	33	62 Å²	62	15%	0.145	36%	0.355	C	S	.	.			trans	-113.6	143.3	178.4	-61.1	-79.9	0	0	0	110.1	E342 F348 W349 V355 W357 I366 F367	E342-F344 HydrophobicContact CB-CE2 3.75Å; E342-F344 HydrophobicContact CB-CZ 3.74Å; F344-F348 HydrophobicContact CB-CD1 3.83Å; F344-F348 AromaticContact CD1-CD1 3.95Å; F344-F348 HydrophobicContact CD1-CD1 3.95Å; F344-F348 HydrophobicContact CD1-CE1 4.01Å; F344-F348 AromaticContact CG-CD1 4Å; F344-F348 HydrophobicContact CG-CD1 4Å; F344-F348 HydrophobicContact CG-CE1 4.22Å; F344-W349 HydrophobicContact CB-CZ2 3.85Å; F344-W349 HydrophobicContact CD2-CH2 4.12Å; F344-W349 AromaticContact CD2-CZ2 3.45Å; F344-W349 HydrophobicContact CD2-CZ2 3.45Å; F344-W349 VanDerWaalsContact CD2-CZ2 3.45Å; F344-W349 HydrophobicContact CE2-CZ2 4.26Å; F344-W349 AromaticContact CG-CZ2 3.8Å; F344-W349 HydrophobicContact CG-CZ2 3.8Å; F344-V355 HydrophobicContact CD1-CG1 4Å; F344-W357 HydrophobicContact CE1-CH2 4.06Å; F344-W357 AromaticContact CE1-CZ2 3.65Å; F344-W357 HydrophobicContact CE1-CZ2 3.65Å; F344-W357 HydrophobicContact CZ-CZ2 4.08Å; F344-I366 HydrophobicContact CE2-CD1 4.47Å; F344-I366 HydrophobicContact CZ-CD1 4.09Å; F344-F367 AromaticContact CE1-CZ 3.81Å; F344-F367 HydrophobicContact CE1-CZ 3.81Å; F344-F367 HydrophobicContact CE2-CE1 4.34Å; F344-F367 HydrophobicContact CE2-CZ 4.05Å; F344-F367 HydrophobicContact CZ-CE1 4.11Å; F344-F367 HydrophobicContact CZ-CE2 4.09Å; F344-F367 AromaticContact CZ-CZ 3.39Å; F344-F367 HydrophobicContact CZ-CZ 3.39Å
345	P	94.2	Very high	94.1	Very high	56 Å²	56	61.2 Å²	61.2	36%	0.364	35%	0.347	S	S	.	.			trans	-64.7	144.8	173.3	28.6	-33.4	0	0	0	109.8	G347 F348 Q353	P345-G347 PolarHBondContact O-N 3.34Å; P345-G347 VanDerWaalsContact O-N 3.12Å; P345-F348 HydrophobicContact CG-CB 4Å; P345-F348 VanDerWaalsContact O-CB 3.27Å; P345-F348 WeakPolarHBondContact O-CB 3.42Å; P345-F348 PolarHBondContact O-N 3.33Å; P345-Q353 VanDerWaalsContact CB-OE1 3.24Å
346	S	92.6	Very high	93.8	Very high	95 Å²	95	63.3 Å²	63.3	66%	0.664	36%	0.362	S	S	*	.	H	α-helix	trans	-56.4	-33.3	179.6	54.3	0	0	0	0	113	F348 W349 L350	S346-F348 PolarHBondContact O-N 2.9Å; S346-W349 PolarHBondContact O-N 2.57Å; S346-L350 PolarHBondContact O-N 3.02Å
347	G	94.9	Very high	93.7	Very high	3 Å²	3	60.9 Å²	60.9	3%	0.031	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-22.3	175.4	0	0	0	0	0	114.2	P345 G351 E352 Q353	P345-G347 PolarHBondContact O-N 3.34Å; P345-G347 VanDerWaalsContact O-N 3.12Å; G347-G351 PolarHBondContact O-N 3.1Å; G347-E352 PolarHBondContact O-N 3.21Å; G347-Q353 PolarHBondContact O-N 2.77Å
348	F	96.4	Very high	93.5	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-66.6	-47.8	173.7	168.1	-112.2	0	0	0	110.9	F344 P345 S346 L350 G351 V355 F367 L393 F409	F344-F348 HydrophobicContact CB-CD1 3.83Å; F344-F348 AromaticContact CD1-CD1 3.95Å; F344-F348 HydrophobicContact CD1-CD1 3.95Å; F344-F348 HydrophobicContact CD1-CE1 4.01Å; F344-F348 AromaticContact CG-CD1 4Å; F344-F348 HydrophobicContact CG-CD1 4Å; F344-F348 HydrophobicContact CG-CE1 4.22Å; P345-F348 HydrophobicContact CG-CB 4Å; P345-F348 VanDerWaalsContact O-CB 3.27Å; P345-F348 WeakPolarHBondContact O-CB 3.42Å; P345-F348 PolarHBondContact O-N 3.33Å; S346-F348 PolarHBondContact O-N 2.9Å; F348-L350 PolarHBondContact O-N 2.76Å; F348-G351 WeakPolarHBondContact O-CA 3.47Å; F348-G351 PolarHBondContact O-N 3.38Å; F348-V355 HydrophobicContact CB-CG1 3.95Å; F348-V355 HydrophobicContact CD1-CG1 4.25Å; F348-V355 HydrophobicContact CD2-CB 4.15Å; F348-V355 HydrophobicContact CD2-CG1 3.44Å; F348-V355 VanDerWaalsContact CD2-CG1 3.44Å; F348-V355 HydrophobicContact CD2-CG2 3.67Å; F348-V355 HydrophobicContact CE2-CB 4.2Å; F348-V355 HydrophobicContact CE2-CG1 3.93Å; F348-V355 HydrophobicContact CE2-CG2 3.24Å; F348-V355 HydrophobicContact CG-CG1 3.61Å; F348-V355 HydrophobicContact CG-CG2 4.46Å; F348-V355 HydrophobicContact CZ-CG1 4.48Å; F348-V355 HydrophobicContact CZ-CG2 3.71Å; F348-F367 HydrophobicContact CE1-CE1 4.33Å; F348-L393 HydrophobicContact CE2-CD2 4.33Å; F348-L393 HydrophobicContact CZ-CD2 3.67Å; F348-F409 HydrophobicContact CD2-CB 4.14Å; F348-F409 HydrophobicContact CE1-CB 4.4Å; F348-F409 HydrophobicContact CE2-CB 3.81Å; F348-F409 HydrophobicContact CZ-CB 3.99Å; F348-F409 HydrophobicContact CZ-CD2 4.38Å; F348-F409 WeakPolarHBondContact O-CB 3.4Å
349	W	96.8	Very high	93.2	Very high	13 Å²	13	64.7 Å²	64.7	5%	0.049	36%	0.357	C	S	.	.	H	α-helix	trans	-67	-20.3	179.3	-55.7	120.2	0	0	0	113.8	V332 I335 E336 S339 F344 S346 G351 F367 F409	V332-W349 HydrophobicContact CG1-CB 3.92Å; V332-W349 HydrophobicContact CG1-CG 4.28Å; I335-W349 HydrophobicContact CG2-CH2 3.94Å; I335-W349 HydrophobicContact CG2-CZ3 3.61Å; E336-W349 HydrophobicContact CB-CZ2 4.48Å; E336-W349 HydrophobicContact CG-CD2 3.84Å; E336-W349 VanDerWaalsContact CG-CE2 3.4Å; E336-W349 HydrophobicContact CG-CE3 4.45Å; E336-W349 HydrophobicContact CG-CG 4.18Å; E336-W349 HydrophobicContact CG-CH2 4.3Å; E336-W349 HydrophobicContact CG-CZ2 3.65Å; E336-W349 PolarHBondContact OE1-NE1 2.88Å; S339-W349 WeakPolarHBondContact OG-CH2 3.44Å; F344-W349 HydrophobicContact CB-CZ2 3.85Å; F344-W349 HydrophobicContact CD2-CH2 4.12Å; F344-W349 AromaticContact CD2-CZ2 3.45Å; F344-W349 HydrophobicContact CD2-CZ2 3.45Å; F344-W349 VanDerWaalsContact CD2-CZ2 3.45Å; F344-W349 HydrophobicContact CE2-CZ2 4.26Å; F344-W349 AromaticContact CG-CZ2 3.8Å; F344-W349 HydrophobicContact CG-CZ2 3.8Å; S346-W349 PolarHBondContact O-N 2.57Å; W349-G351 VanDerWaalsContact C-N 3.33Å; W349-F367 AromaticContact CH2-CE1 3.98Å; W349-F367 HydrophobicContact CH2-CE1 3.98Å; W349-F367 HydrophobicContact CZ3-CE1 4.4Å; W349-F409 HydrophobicContact CE3-CD1 4.26Å; W349-F409 HydrophobicContact CE3-CD2 4.14Å; W349-F409 HydrophobicContact CE3-CE1 4.14Å; W349-F409 HydrophobicContact CE3-CE2 4.06Å; W349-F409 HydrophobicContact CE3-CG 4.24Å; W349-F409 HydrophobicContact CE3-CZ 4.05Å; W349-F409 HydrophobicContact CZ3-CD2 4.18Å; W349-F409 AromaticContact CZ3-CE2 3.97Å; W349-F409 HydrophobicContact CZ3-CE2 3.97Å; W349-F409 HydrophobicContact CZ3-CZ 4.3Å; W349-F409 VanDerWaalsContact O-CD1 3.3Å; W349-F409 WeakPolarHBondContact O-CD1 3.22Å
350	L	94.2	Very high	92.8	Very high	95 Å²	95	68.3 Å²	68.3	50%	0.497	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-5.4	171.3	-61.6	176.2	0	0	0	113.1	S346 F348 E352	S346-L350 PolarHBondContact O-N 3.02Å; F348-L350 PolarHBondContact O-N 2.76Å; L350-E352 HydrophobicContact CB-CG 3.93Å; L350-E352 PolarHBondContact O-N 3.38Å
351	G	92.4	Very high	92.8	Very high	19 Å²	19	67.5 Å²	67.5	20%	0.196	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.5	8.8	-175.7	0	0	0	0	0	114.3	G347 F348 W349	G347-G351 PolarHBondContact O-N 3.1Å; F348-G351 WeakPolarHBondContact O-CA 3.47Å; F348-G351 PolarHBondContact O-N 3.38Å; W349-G351 VanDerWaalsContact C-N 3.33Å
352	E	91.2	Very high	93	Very high	140 Å²	140	62.9 Å²	62.9	65%	0.654	36%	0.357	S	S	*	.	S	Bend	trans	-84.1	-35	-177.2	-62.1	177.6	172	0	0	111.6	G347 L350	G347-E352 PolarHBondContact O-N 3.21Å; L350-E352 HydrophobicContact CB-CG 3.93Å; L350-E352 PolarHBondContact O-N 3.38Å
353	Q	92.6	Very high	93.2	Very high	95 Å²	95	59.9 Å²	59.9	44%	0.444	34%	0.344	S	S	.	.	S	Bend	trans	-111.8	152.5	-179.8	-62.4	-177.4	-0.5	0	0	111.8	P345 G347	P345-Q353 VanDerWaalsContact CB-OE1 3.24Å; G347-Q353 PolarHBondContact O-N 2.77Å
354	L	93.4	Very high	93.5	Very high	62 Å²	62	53.3 Å²	53.3	33%	0.325	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	149.7	175.7	41.3	86.3	0	0	0	110.3	V399 Y407 K408	L354-V399 HydrophobicContact CD1-CG1 4.43Å; L354-V399 HydrophobicContact CD2-CB 4.19Å; L354-V399 HydrophobicContact CD2-CG1 4.06Å; L354-V399 HydrophobicContact CD2-CG2 4.1Å; L354-Y407 VanDerWaalsContact CA-O 3.29Å; L354-Y407 WeakPolarHBondContact CA-O 3.19Å; L354-K408 HydrophobicContact CB-CG 4.22Å
355	V	94.1	Very high	93.5	Very high	16 Å²	16	58.8 Å²	58.8	10%	0.097	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	137.5	174.8	-65	0	0	0	0	107.8	F344 F348 W357 C406 Y407	F344-V355 HydrophobicContact CD1-CG1 4Å; F348-V355 HydrophobicContact CB-CG1 3.95Å; F348-V355 HydrophobicContact CD1-CG1 4.25Å; F348-V355 HydrophobicContact CD2-CB 4.15Å; F348-V355 HydrophobicContact CD2-CG1 3.44Å; F348-V355 VanDerWaalsContact CD2-CG1 3.44Å; F348-V355 HydrophobicContact CD2-CG2 3.67Å; F348-V355 HydrophobicContact CE2-CB 4.2Å; F348-V355 HydrophobicContact CE2-CG1 3.93Å; F348-V355 HydrophobicContact CE2-CG2 3.24Å; F348-V355 HydrophobicContact CG-CG1 3.61Å; F348-V355 HydrophobicContact CG-CG2 4.46Å; F348-V355 HydrophobicContact CZ-CG1 4.48Å; F348-V355 HydrophobicContact CZ-CG2 3.71Å; V355-W357 HydrophobicContact CB-CH2 4.22Å; V355-W357 HydrophobicContact CB-CZ3 4.34Å; V355-W357 HydrophobicContact CG2-CE3 4.46Å; V355-W357 HydrophobicContact CG2-CH2 3.49Å; V355-W357 VanDerWaalsContact CG2-CH2 3.49Å; V355-W357 HydrophobicContact CG2-CZ2 4.39Å; V355-W357 HydrophobicContact CG2-CZ3 3.54Å; V355-C406 CarbonylContact O-C 3.53Å; V355-C406 WeakPolarHBondContact O-CA 3.4Å; V355-Y407 PolarHBondContact N-O 2.89Å; V355-Y407 PolarHBondContact O-N 3.4Å
356	C	93.7	Very high	93.6	Very high	45 Å²	45	56.8 Å²	56.8	30%	0.304	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	138	-175.2	-55.3	0	0	0	0	109.8	E404 D405 C406	C356-E404 HydrophobicContact CB-CB 4.45Å; C356-D405 VanDerWaalsContact CA-O 3.28Å; C356-D405 WeakPolarHBondContact CA-O 3.37Å; C356-C406 HydrophobicContact CB-CB 4.12Å; C356-C406 WeakPolarHBondContact CB-SG 3.45Å; C356-C406 WeakPolarHBondContact SG-CB 3.46Å; C356-C406 CovalentContact SG-SG 2.05Å; C356-C406 PolarHBondContact SG-SG 3Å
357	W	93.4	Very high	93.8	Very high	31 Å²	31	52.3 Å²	52.3	12%	0.117	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	165.9	169.5	-65.5	-89.1	0	0	0	109.6	E342 F344 V355 T362 P363 F367 E404 D405 Y407	E342-W357 PolarHBondContact OE2-NE1 3.44Å; E342-W357 VanDerWaalsContact OE2-NE1 3.14Å; F344-W357 HydrophobicContact CE1-CH2 4.06Å; F344-W357 AromaticContact CE1-CZ2 3.65Å; F344-W357 HydrophobicContact CE1-CZ2 3.65Å; F344-W357 HydrophobicContact CZ-CZ2 4.08Å; V355-W357 HydrophobicContact CB-CH2 4.22Å; V355-W357 HydrophobicContact CB-CZ3 4.34Å; V355-W357 HydrophobicContact CG2-CE3 4.46Å; V355-W357 HydrophobicContact CG2-CH2 3.49Å; V355-W357 VanDerWaalsContact CG2-CH2 3.49Å; V355-W357 HydrophobicContact CG2-CZ2 4.39Å; V355-W357 HydrophobicContact CG2-CZ3 3.54Å; W357-T362 HydrophobicContact CD2-CG2 4.38Å; W357-T362 HydrophobicContact CE3-CG2 3.83Å; W357-T362 HydrophobicContact CZ3-CG2 4Å; W357-P363 HydrophobicContact CD2-CG 4.48Å; W357-P363 HydrophobicContact CZ2-CG 3.89Å; W357-F367 AromaticContact CH2-CE2 3.79Å; W357-F367 HydrophobicContact CH2-CE2 3.79Å; W357-F367 AromaticContact CH2-CZ 3.91Å; W357-F367 HydrophobicContact CH2-CZ 3.91Å; W357-F367 HydrophobicContact CZ2-CE2 4Å; W357-F367 HydrophobicContact CZ2-CZ 4.23Å; W357-E404 CarbonylContact O-C 3.56Å; W357-E404 VanDerWaalsContact O-CA 3.23Å; W357-E404 WeakPolarHBondContact O-CA 3.25Å; W357-D405 PolarHBondContact N-O 3.45Å; W357-D405 PolarHBondContact O-N 3.11Å; W357-Y407 AromaticContact CE3-CD2 3.73Å; W357-Y407 HydrophobicContact CE3-CD2 3.73Å; W357-Y407 AromaticContact CE3-CE2 3.94Å; W357-Y407 HydrophobicContact CE3-CE2 3.94Å; W357-Y407 AromaticContact CZ3-CD2 3.56Å; W357-Y407 HydrophobicContact CZ3-CD2 3.56Å; W357-Y407 HydrophobicContact CZ3-CE2 4.12Å; W357-Y407 HydrophobicContact CZ3-CG 4.42Å
358	Q	92.4	Very high	94	Very high	142 Å²	142	52.3 Å²	52.3	66%	0.664	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.6	143.3	169.8	-178.6	175.2	-13.5	0	0	109.3	G360 T361	Q358-G360 PolarHBondContact O-N 3.13Å; Q358-T361 HydrophobicContact CB-CG2 4.05Å; Q358-T361 HydrophobicContact CG-CG2 4.29Å; Q358-T361 PolarHBondContact N-OG1 3.33Å; Q358-T361 PolarHBondContact O-N 2.9Å; Q358-T361 PolarHBondContact O-OG1 3.42Å
359	A	88.2	Confident	94.1	Very high	46 Å²	46	53.7 Å²	53.7	38%	0.38	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	127.1	-177.7	0	0	0	0	0	112	T361 Q403 D405	A359-T361 VanDerWaalsContact C-N 3.28Å; A359-T361 PolarHBondContact O-N 3.47Å; A359-Q403 PolarHBondContact N-O 2.84Å; A359-D405 WeakPolarHBondContact CA-OD2 3.32Å
360	G	88	Confident	94.2	Very high	76 Å²	76	53.4 Å²	53.4	78%	0.784	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	2.6	-178.9	0	0	0	0	0	115.5	Q358 D405	Q358-G360 PolarHBondContact O-N 3.13Å; G360-D405 PolarHBondContact N-OD2 2.84Å
361	T	93.3	Very high	94.4	Very high	74 Å²	74	49.2 Å²	49.2	45%	0.454	28%	0.277	S	S	.	.			trans	-108.5	11.4	179.8	79.4	0	0	0	0	113.7	Q358 A359 P363	Q358-T361 HydrophobicContact CB-CG2 4.05Å; Q358-T361 HydrophobicContact CG-CG2 4.29Å; Q358-T361 PolarHBondContact N-OG1 3.33Å; Q358-T361 PolarHBondContact O-N 2.9Å; Q358-T361 PolarHBondContact O-OG1 3.42Å; A359-T361 VanDerWaalsContact C-N 3.28Å; A359-T361 PolarHBondContact O-N 3.47Å; T361-P363 WeakPolarHBondContact O-CD 3.48Å
362	T	94.3	Very high	94.7	Very high	11 Å²	11	48.4 Å²	48.4	7%	0.067	27%	0.268	C	S	.	.			trans	-55.9	122.6	178.2	-54.7	0	0	0	0	110.4	W357 W364 Y407	W357-T362 HydrophobicContact CD2-CG2 4.38Å; W357-T362 HydrophobicContact CE3-CG2 3.83Å; W357-T362 HydrophobicContact CZ3-CG2 4Å; T362-W364 HydrophobicContact CG2-CD2 3.77Å; T362-W364 HydrophobicContact CG2-CE3 3.92Å; T362-W364 HydrophobicContact CG2-CH2 3.74Å; T362-W364 HydrophobicContact CG2-CZ2 3.56Å; T362-W364 HydrophobicContact CG2-CZ3 3.9Å; T362-W364 PolarHBondContact O-N 2.97Å; T362-Y407 HydrophobicContact CG2-CD2 4.43Å; T362-Y407 HydrophobicContact CG2-CE2 3.73Å; T362-Y407 WeakPolarHBondContact OG1-CE2 3.21Å; T362-Y407 PolarHBondContact OG1-OH 3.26Å
363	P	95.7	Very high	95	Very high	11 Å²	11	42 Å²	42	7%	0.071	24%	0.238	C	C	.	.			trans	-82	62.5	-170.6	34.4	-37.9	0	0	0	111.7	W357 T361 H365 I366	W357-P363 HydrophobicContact CD2-CG 4.48Å; W357-P363 HydrophobicContact CZ2-CG 3.89Å; T361-P363 WeakPolarHBondContact O-CD 3.48Å; P363-H365 PolarHBondContact O-N 2.64Å; P363-I366 HydrophobicContact CB-CD1 4.05Å; P363-I366 HydrophobicContact CB-CG1 4.39Å; P363-I366 HydrophobicContact CB-CG2 4.27Å; P363-I366 HydrophobicContact CG-CD1 3.71Å; P363-I366 HydrophobicContact CG-CG1 4.35Å; P363-I366 WeakPolarHBondContact O-CG1 3.36Å; P363-I366 PolarHBondContact O-N 2.93Å; P363-I366 VanDerWaalsContact O-N 3.11Å
364	W	96.2	Very high	95.3	Very high	56 Å²	56	37.5 Å²	37.5	21%	0.212	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-50.2	-35.8	-173.9	-59.6	116.8	0	0	0	114.3	T362 I366 F367 P389 Q390 L393 Y407 R453	T362-W364 HydrophobicContact CG2-CD2 3.77Å; T362-W364 HydrophobicContact CG2-CE3 3.92Å; T362-W364 HydrophobicContact CG2-CH2 3.74Å; T362-W364 HydrophobicContact CG2-CZ2 3.56Å; T362-W364 HydrophobicContact CG2-CZ3 3.9Å; T362-W364 PolarHBondContact O-N 2.97Å; W364-I366 VanDerWaalsContact C-N 3.29Å; W364-I366 PolarHBondContact O-N 2.81Å; W364-F367 PolarHBondContact O-N 2.9Å; W364-P389 HydrophobicContact CE3-CB 3.95Å; W364-P389 HydrophobicContact CE3-CG 4.11Å; W364-P389 HydrophobicContact CZ3-CB 4.3Å; W364-Q390 HydrophobicContact CD2-CG 4.05Å; W364-Q390 HydrophobicContact CE3-CG 3.99Å; W364-Q390 HydrophobicContact CH2-CG 4.17Å; W364-Q390 HydrophobicContact CZ2-CG 4.23Å; W364-Q390 HydrophobicContact CZ3-CG 4.05Å; W364-L393 HydrophobicContact CZ3-CB 4.28Å; W364-L393 HydrophobicContact CZ3-CD1 4.08Å; W364-Y407 HydrophobicContact CH2-CD1 4.28Å; W364-Y407 AromaticContact CH2-CE1 3.54Å; W364-Y407 HydrophobicContact CH2-CE1 3.54Å; W364-Y407 HydrophobicContact CH2-CE2 4.43Å; W364-Y407 AromaticContact CH2-CZ 3.6Å; W364-Y407 HydrophobicContact CZ2-CE1 4.18Å; W364-Y407 AromaticContact CZ2-CZ 3.86Å; W364-Y407 WeakPolarHBondContact CZ2-OH 3.43Å; W364-R453 PolarHBondContact O-NH2 3.45Å
365	H	95.1	Very high	95.4	Very high	148 Å²	148	35.1 Å²	35.1	69%	0.685	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-65.5	-23.1	-175.7	64.7	-82.6	0	0	0	114.8	P363 F367	P363-H365 PolarHBondContact O-N 2.64Å; H365-F367 VanDerWaalsContact C-N 3.29Å
366	I	96.3	Very high	95.4	Very high	15 Å²	15	34.9 Å²	34.9	8%	0.077	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-78.4	-20.7	178.3	78.2	-175	0	0	0	111.7	S339 T341 E342 F344 P363 W364	S339-I366 VanDerWaalsContact CA-O 3.28Å; S339-I366 WeakPolarHBondContact CA-O 3.33Å; S339-I366 WeakPolarHBondContact CB-O 3.41Å; T341-I366 WeakPolarHBondContact OG1-CG2 3.43Å; E342-I366 HydrophobicContact CB-CD1 4.01Å; E342-I366 HydrophobicContact CG-CD1 3.89Å; F344-I366 HydrophobicContact CE2-CD1 4.47Å; F344-I366 HydrophobicContact CZ-CD1 4.09Å; P363-I366 HydrophobicContact CB-CD1 4.05Å; P363-I366 HydrophobicContact CB-CG1 4.39Å; P363-I366 HydrophobicContact CB-CG2 4.27Å; P363-I366 HydrophobicContact CG-CD1 3.71Å; P363-I366 HydrophobicContact CG-CG1 4.35Å; P363-I366 WeakPolarHBondContact O-CG1 3.36Å; P363-I366 PolarHBondContact O-N 2.93Å; P363-I366 VanDerWaalsContact O-N 3.11Å; W364-I366 VanDerWaalsContact C-N 3.29Å; W364-I366 PolarHBondContact O-N 2.81Å
367	F	98	Very high	95.2	Very high	1 Å²	1	37.6 Å²	37.6	0%	0.004	21%	0.212	C	C	.	.	S	Bend	trans	-91.2	133.2	-177.9	-74.2	-78.6	0	0	0	110.5	F344 F348 W349 W357 W364 H365 P389 Y392 L393 R453	F344-F367 AromaticContact CE1-CZ 3.81Å; F344-F367 HydrophobicContact CE1-CZ 3.81Å; F344-F367 HydrophobicContact CE2-CE1 4.34Å; F344-F367 HydrophobicContact CE2-CZ 4.05Å; F344-F367 HydrophobicContact CZ-CE1 4.11Å; F344-F367 HydrophobicContact CZ-CE2 4.09Å; F344-F367 AromaticContact CZ-CZ 3.39Å; F344-F367 HydrophobicContact CZ-CZ 3.39Å; F348-F367 HydrophobicContact CE1-CE1 4.33Å; W349-F367 AromaticContact CH2-CE1 3.98Å; W349-F367 HydrophobicContact CH2-CE1 3.98Å; W349-F367 HydrophobicContact CZ3-CE1 4.4Å; W357-F367 AromaticContact CH2-CE2 3.79Å; W357-F367 HydrophobicContact CH2-CE2 3.79Å; W357-F367 AromaticContact CH2-CZ 3.91Å; W357-F367 HydrophobicContact CH2-CZ 3.91Å; W357-F367 HydrophobicContact CZ2-CE2 4Å; W357-F367 HydrophobicContact CZ2-CZ 4.23Å; W364-F367 PolarHBondContact O-N 2.9Å; H365-F367 VanDerWaalsContact C-N 3.29Å; F367-P389 HydrophobicContact CB-CB 3.52Å; F367-P389 HydrophobicContact CB-CG 3.76Å; F367-P389 HydrophobicContact CG-CB 4.23Å; F367-Y392 WeakPolarHBondContact CB-OH 3.07Å; F367-L393 HydrophobicContact CD1-CD1 4.18Å; F367-L393 HydrophobicContact CD2-CD1 3.83Å; F367-L393 HydrophobicContact CE1-CD1 4.11Å; F367-L393 HydrophobicContact CE1-CD2 4.5Å; F367-L393 HydrophobicContact CE2-CD1 3.75Å; F367-L393 HydrophobicContact CG-CD1 4.04Å; F367-L393 HydrophobicContact CZ-CD1 3.88Å; F367-R453 PolarHBondContact O-NH1 2.65Å
368	P	98.1	Very high	95	Very high	3 Å²	3	40 Å²	40	2%	0.019	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-76.2	160.5	-173.2	32.3	-38.6	0	0	0	113.5	V295 N296 I335 A338 Y392	V295-P368 HydrophobicContact CG1-CB 3.83Å; V295-P368 HydrophobicContact CG1-CG 3.67Å; N296-P368 HydrophobicContact CB-CB 3.69Å; I335-P368 HydrophobicContact CB-CG 4.25Å; I335-P368 HydrophobicContact CG1-CG 3.98Å; I335-P368 HydrophobicContact CG2-CG 4.09Å; A338-P368 HydrophobicContact CB-CB 3.9Å; A338-P368 HydrophobicContact CB-CG 3.86Å; P368-Y392 WeakPolarHBondContact CD-OH 3.3Å; P368-Y392 WeakPolarHBondContact O-CE1 3.07Å; P368-Y392 PolarHBondContact O-OH 3.22Å
369	V	98.4	Very high	94.4	Very high	29 Å²	29	40.3 Å²	40.3	18%	0.176	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-76.1	142.5	164.2	174.2	0	0	0	0	109.1	N296 I387 L388	N296-V369 PolarHBondContact N-O 2.8Å; V369-I387 WeakPolarHBondContact CG1-O 3.46Å; V369-L388 HydrophobicContact CG2-CD2 3.91Å
370	I	98.8	Very high	94.3	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.036	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.4	171.1	-56.7	172.1	0	0	0	107.8	I293 E294 I335 L372 S386 I387 Y392 V411	I293-I370 HydrophobicContact CG2-CG2 4.47Å; E294-I370 WeakPolarHBondContact O-CA 3.21Å; I335-I370 HydrophobicContact CD1-CD1 3.75Å; I335-I370 HydrophobicContact CD1-CG1 4.43Å; I370-L372 HydrophobicContact CG2-CD2 4.39Å; I370-S386 WeakPolarHBondContact O-CA 3.37Å; I370-I387 HydrophobicContact CB-CD1 4.1Å; I370-I387 HydrophobicContact CB-CG1 3.8Å; I370-I387 HydrophobicContact CD1-CD1 4.38Å; I370-I387 PolarHBondContact N-O 2.72Å; I370-I387 VanDerWaalsContact N-O 3.11Å; I370-I387 WeakPolarHBondContact O-CG1 3.31Å; I370-I387 PolarHBondContact O-N 2.97Å; I370-Y392 HydrophobicContact CD1-CD1 3.78Å; I370-Y392 HydrophobicContact CD1-CE1 3.87Å; I370-Y392 HydrophobicContact CD1-CG 4.21Å; I370-Y392 HydrophobicContact CG1-CD1 4.33Å; I370-Y392 HydrophobicContact CG1-CE1 4.05Å; I370-V411 HydrophobicContact CD1-CG2 4.45Å
371	S	98.8	Very high	94.6	Very high	6 Å²	6	40.6 Å²	40.6	4%	0.042	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.6	178.6	-57.2	0	0	0	0	110.8	I293 E294 I385 S386	I293-S371 WeakPolarHBondContact CA-O 3.31Å; E294-S371 PolarHBondContact N-O 3.06Å; E294-S371 PolarHBondContact O-N 3.33Å; S371-I385 CarbonylContact C-O 3.6Å; S371-I385 VanDerWaalsContact CA-O 3.31Å; S371-I385 WeakPolarHBondContact CA-O 3.32Å; S371-S386 PolarHBondContact OG-OG 2.74Å
372	L	98.6	Very high	94.7	Very high	3 Å²	3	37.3 Å²	37.3	2%	0.016	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120.3	174.7	-52.9	178.6	0	0	0	108.3	I293 L321 I370 R384 I385 M420	I293-L372 HydrophobicContact CB-CD2 4.42Å; I293-L372 HydrophobicContact CD1-CD2 3.9Å; I293-L372 HydrophobicContact CG1-CD2 3.77Å; I293-L372 HydrophobicContact CG2-CD2 4.03Å; L321-L372 HydrophobicContact CD1-CD1 4.48Å; I370-L372 HydrophobicContact CG2-CD2 4.39Å; L372-R384 CarbonylContact O-C 3.53Å; L372-R384 VanDerWaalsContact O-CA 3.29Å; L372-R384 WeakPolarHBondContact O-CA 3.33Å; L372-I385 HydrophobicContact CB-CD1 4.47Å; L372-I385 HydrophobicContact CB-CG1 3.92Å; L372-I385 HydrophobicContact CD1-CD1 4.44Å; L372-I385 PolarHBondContact N-O 3.21Å; L372-I385 PolarHBondContact O-N 3.23Å; L372-M420 HydrophobicContact CD1-CG 4.21Å; L372-M420 HydrophobicContact CD1-SD 4.18Å
373	Y	98.1	Very high	94.9	Very high	6 Å²	6	36.8 Å²	36.8	2%	0.024	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	122.7	173.7	-67.6	-113	0	0	0	108.5	I290 V291 R292 E294 F383 R384 F461	I290-Y373 CarbonylContact C-O 3.49Å; I290-Y373 WeakPolarHBondContact CA-O 3.31Å; V291-Y373 WeakPolarHBondContact CG2-O 3.21Å; V291-Y373 PolarHBondContact N-O 3.23Å; R292-Y373 HydrophobicContact CB-CD2 3.84Å; R292-Y373 HydrophobicContact CB-CG 3.88Å; R292-Y373 HydrophobicContact CG-CD2 4.1Å; R292-Y373 HydrophobicContact CG-CE2 4.47Å; R292-Y373 PolarHBondContact O-N 2.85Å; E294-Y373 HydrophobicContact CB-CE2 4.44Å; E294-Y373 VanDerWaalsContact CD-CE2 3.49Å; E294-Y373 HydrophobicContact CG-CE2 3.78Å; E294-Y373 PolarHBondContact OE1-OH 3.31Å; E294-Y373 VanDerWaalsContact OE2-CE2 3.29Å; E294-Y373 WeakPolarHBondContact OE2-CE2 3.35Å; E294-Y373 PolarHBondContact OE2-OH 2.92Å; Y373-F383 CarbonylContact C-O 3.59Å; Y373-F383 WeakPolarHBondContact CA-O 3.46Å; Y373-R384 HydrophobicContact CD1-CB 3.84Å; Y373-R384 HydrophobicContact CD2-CB 3.96Å; Y373-R384 HydrophobicContact CE1-CB 3.83Å; Y373-R384 HydrophobicContact CE1-CG 4.44Å; Y373-R384 HydrophobicContact CE2-CB 3.94Å; Y373-R384 HydrophobicContact CG-CB 3.9Å; Y373-R384 WeakPolarHBondContact OH-CD 3.33Å; Y373-R384 PolarHBondContact OH-NH1 3.01Å; Y373-F461 AromaticContact CD1-CD2 3.99Å; Y373-F461 HydrophobicContact CD1-CD2 3.99Å; Y373-F461 HydrophobicContact CD1-CE2 4.48Å; Y373-F461 HydrophobicContact CD1-CG 4.32Å; Y373-F461 HydrophobicContact CE1-CB 4.43Å; Y373-F461 HydrophobicContact CE1-CD1 4.22Å; Y373-F461 AromaticContact CE1-CD2 3.65Å; Y373-F461 HydrophobicContact CE1-CD2 3.65Å; Y373-F461 HydrophobicContact CE1-CE1 4.41Å; Y373-F461 AromaticContact CE1-CE2 3.87Å; Y373-F461 HydrophobicContact CE1-CE2 3.87Å; Y373-F461 AromaticContact CE1-CG 3.84Å; Y373-F461 HydrophobicContact CE1-CG 3.84Å; Y373-F461 HydrophobicContact CE1-CZ 4.25Å
374	L	97.9	Very high	95	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	141.8	177.9	-60.9	174.4	0	0	0	109.2	T278 V288 I289 I290 S376 S382 F383 I385 M420 F441	T278-L374 HydrophobicContact CG2-CD1 4.18Å; V288-L374 HydrophobicContact CG2-CD2 4.07Å; I289-L374 WeakPolarHBondContact O-CA 3.19Å; I290-L374 HydrophobicContact CG1-CD2 3.86Å; L374-S376 PolarHBondContact O-N 3.06Å; L374-S382 CarbonylContact O-C 3.59Å; L374-S382 WeakPolarHBondContact O-CA 3.44Å; L374-S382 WeakPolarHBondContact O-CB 3.45Å; L374-F383 HydrophobicContact CB-CD1 4.45Å; L374-F383 HydrophobicContact CB-CE1 3.9Å; L374-F383 HydrophobicContact CB-CE2 4.34Å; L374-F383 HydrophobicContact CB-CZ 3.85Å; L374-F383 HydrophobicContact CD1-CE2 4.01Å; L374-F383 HydrophobicContact CD1-CZ 3.82Å; L374-F383 HydrophobicContact CG-CZ 4.44Å; L374-F383 PolarHBondContact N-O 2.85Å; L374-F383 PolarHBondContact O-N 2.76Å; L374-I385 HydrophobicContact CD1-CD1 4.08Å; L374-I385 HydrophobicContact CD1-CG1 4.42Å; L374-I385 HydrophobicContact CD1-CG2 4.44Å; L374-M420 HydrophobicContact CD2-SD 4.5Å; L374-F441 HydrophobicContact CD1-CD2 3.94Å; L374-F441 HydrophobicContact CD1-CE2 3.65Å; L374-F441 HydrophobicContact CD1-CZ 4.17Å
375	M	95.8	Very high	95.2	Very high	11 Å²	11	36.3 Å²	36.3	5%	0.054	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	135.1	169.4	-178.9	-173.3	-75	0	0	109.7	T278 P279 I289 V291 L466 E467	T278-M375 VanDerWaalsContact CA-O 3.24Å; T278-M375 WeakPolarHBondContact CA-O 3.45Å; T278-M375 WeakPolarHBondContact CB-O 3.04Å; T278-M375 PolarHBondContact OG1-O 3.31Å; P279-M375 WeakPolarHBondContact CD-O 3.29Å; P279-M375 HydrophobicContact CG-CG 4.44Å; P279-M375 HydrophobicContact CG-SD 4.08Å; I289-M375 HydrophobicContact CB-CB 4.26Å; I289-M375 HydrophobicContact CB-CE 4.29Å; I289-M375 HydrophobicContact CG2-CE 4.04Å; I289-M375 PolarHBondContact O-N 2.81Å; V291-M375 HydrophobicContact CG1-CB 4.16Å; M375-L466 HydrophobicContact CE-CB 3.8Å; M375-L466 WeakPolarHBondContact CE-O 3.17Å; M375-L466 HydrophobicContact CG-CB 4.49Å; M375-E467 HydrophobicContact CE-CB 4.35Å; M375-E467 HydrophobicContact CE-CG 3.91Å
376	S	94.3	Very high	95.3	Very high	12 Å²	12	29.5 Å²	29.5	8%	0.084	14%	0.141	C	C	.	.			trans	-87	170.4	174.1	-171	0	0	0	0	111.3	L374 N378 Q381	L374-S376 PolarHBondContact O-N 3.06Å; S376-N378 PolarHBondContact O-N 2.83Å; S376-Q381 VanDerWaalsContact CB-O 3.22Å; S376-Q381 WeakPolarHBondContact CB-O 3.13Å; S376-Q381 PolarHBondContact N-O 3.05Å
377	E	90.5	Very high	95.4	Very high	102 Å²	102	28.9 Å²	28.9	48%	0.477	14%	0.137	S	C	.	.	S	Bend	trans	-57.3	-28.5	170.2	-65.6	-175.4	109.5	0	0	112.4	Y277 R438	Y277-E377 PolarHBondContact O-N 3.46Å; E377-R438 VanDerWaalsContact CD-NH1 3.28Å; E377-R438 WeakPolarHBondContact OE1-CD 3.42Å; E377-R438 IonicContact OE1-CZ 3.32Å; E377-R438 IonicContact OE1-NE 2.66Å; E377-R438 IonicContact OE1-NH1 3.76Å; E377-R438 PolarHBondContact OE1-NH1 2.97Å; E377-R438 IonicContact OE2-NH1 2.57Å; E377-R438 PolarHBondContact OE2-NH1 2.74Å
378	N	88.4	Confident	95.4	Very high	80 Å²	80	28.9 Å²	28.9	43%	0.428	14%	0.137	S	C	.	.	S	Bend	trans	-86.3	117.3	167.9	-174.8	-6	0	0	0	109.8	S376 N380 Q381	S376-N378 PolarHBondContact O-N 2.83Å; N378-N380 PolarHBondContact O-N 3.12Å; N378-Q381 HydrophobicContact CB-CB 4.12Å; N378-Q381 HydrophobicContact CB-CG 4.21Å; N378-Q381 VanDerWaalsContact CB-OE1 3.31Å; N378-Q381 VanDerWaalsContact ND2-CD 3.3Å; N378-Q381 PolarHBondContact ND2-OE1 2.78Å; N378-Q381 WeakPolarHBondContact O-CA 2.97Å; N378-Q381 PolarHBondContact O-N 2.91Å; N378-Q381 VanDerWaalsContact O-O 3.09Å
379	R	78.8	Confident	95.4	Very high	149 Å²	149	28.8 Å²	28.8	56%	0.562	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59	-21.3	-172	-63.9	-179.3	178.4	-148.4	-12.6	115.3	L466 E467	R379-L466 WeakPolarHBondContact O-CB 3.49Å; R379-L466 WeakPolarHBondContact O-CD1 3.41Å; R379-E467 WeakPolarHBondContact CD-OE1 3.33Å; R379-E467 VanDerWaalsContact CZ-CD 3.46Å; R379-E467 IonicContact CZ-OE1 2.75Å; R379-E467 IonicContact CZ-OE2 2.67Å; R379-E467 IonicContact NE-OE1 2.84Å; R379-E467 PolarHBondContact NE-OE1 3.23Å; R379-E467 VanDerWaalsContact NH1-CD 3.26Å; R379-E467 IonicContact NH1-OE1 3.43Å; R379-E467 PolarHBondContact NH1-OE1 2.79Å; R379-E467 VanDerWaalsContact NH1-OE1 3.12Å; R379-E467 IonicContact NH1-OE2 3.42Å; R379-E467 PolarHBondContact NH1-OE2 3.49Å; R379-E467 IonicContact NH2-OE1 2.74Å; R379-E467 PolarHBondContact NH2-OE1 3.41Å; R379-E467 IonicContact NH2-OE2 3.47Å
380	N	87.2	Confident	95.3	Very high	92 Å²	92	28 Å²	28	49%	0.492	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	11.2	177.9	-62.7	-6.6	0	0	0	112.5	N378 G463	N378-N380 PolarHBondContact O-N 3.12Å; N380-G463 CarbonylContact C-O 3.54Å; N380-G463 WeakPolarHBondContact CA-O 3.33Å; N380-G463 PolarHBondContact O-N 3.24Å; N380-G463 VanDerWaalsContact O-N 3.1Å
381	Q	93.8	Very high	95.2	Very high	36 Å²	36	27.9 Å²	27.9	17%	0.168	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	149	-179.6	-66	-179	-38.8	0	0	110.7	S376 N378 P460 F461 H462 L466	S376-Q381 VanDerWaalsContact CB-O 3.22Å; S376-Q381 WeakPolarHBondContact CB-O 3.13Å; S376-Q381 PolarHBondContact N-O 3.05Å; N378-Q381 HydrophobicContact CB-CB 4.12Å; N378-Q381 HydrophobicContact CB-CG 4.21Å; N378-Q381 VanDerWaalsContact CB-OE1 3.31Å; N378-Q381 VanDerWaalsContact ND2-CD 3.3Å; N378-Q381 PolarHBondContact ND2-OE1 2.78Å; N378-Q381 WeakPolarHBondContact O-CA 2.97Å; N378-Q381 PolarHBondContact O-N 2.91Å; N378-Q381 VanDerWaalsContact O-O 3.09Å; Q381-P460 HydrophobicContact CB-CB 4.33Å; Q381-P460 HydrophobicContact CG-CB 4.27Å; Q381-F461 CarbonylContact C-O 3.42Å; Q381-F461 VanDerWaalsContact CA-O 3.29Å; Q381-F461 WeakPolarHBondContact CA-O 3.41Å; Q381-H462 PolarHBondContact NE2-CE1 2.92Å; Q381-H462 VanDerWaalsContact NE2-CE1 3.34Å; Q381-L466 VanDerWaalsContact C-CD1 3.49Å; Q381-L466 WeakPolarHBondContact O-CD1 3.25Å
382	S	96.5	Very high	95.1	Very high	6 Å²	6	27.6 Å²	27.6	4%	0.042	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	166.2	169.6	57.1	0	0	0	0	109.3	L374 P460 F461	L374-S382 CarbonylContact O-C 3.59Å; L374-S382 WeakPolarHBondContact O-CA 3.44Å; L374-S382 WeakPolarHBondContact O-CB 3.45Å; S382-P460 CarbonylContact O-C 3.51Å; S382-F461 PolarHBondContact N-O 2.55Å; S382-F461 PolarHBondContact O-N 2.92Å; S382-F461 PolarHBondContact OG-O 2.8Å
383	F	98.1	Very high	95	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	156.3	167	67.7	-82.9	0	0	0	107.3	W276 Y277 T278 Y373 L374 I385 F441 V457 E458	W276-F383 HydrophobicContact CB-CB 4.26Å; W276-F383 HydrophobicContact CB-CD1 4.03Å; W276-F383 HydrophobicContact CB-CD2 3.4Å; W276-F383 VanDerWaalsContact CB-CD2 3.4Å; W276-F383 HydrophobicContact CB-CE1 4.21Å; W276-F383 HydrophobicContact CB-CE2 3.59Å; W276-F383 HydrophobicContact CB-CG 3.63Å; W276-F383 HydrophobicContact CB-CZ 3.99Å; W276-F383 HydrophobicContact CD2-CB 3.82Å; W276-F383 HydrophobicContact CD2-CG 4.14Å; W276-F383 HydrophobicContact CE3-CB 3.52Å; W276-F383 HydrophobicContact CE3-CD1 4.13Å; W276-F383 AromaticContact CE3-CG 3.91Å; W276-F383 HydrophobicContact CE3-CG 3.91Å; W276-F383 HydrophobicContact CG-CB 4.15Å; W276-F383 HydrophobicContact CG-CD2 4.04Å; W276-F383 HydrophobicContact CG-CG 4.06Å; W276-F383 HydrophobicContact CZ3-CB 4.21Å; Y277-F383 VanDerWaalsContact C-CE1 3.46Å; Y277-F383 VanDerWaalsContact O-CE1 3.32Å; Y277-F383 WeakPolarHBondContact O-CE1 3.19Å; T278-F383 HydrophobicContact CG2-CZ 4.42Å; Y373-F383 CarbonylContact C-O 3.59Å; Y373-F383 WeakPolarHBondContact CA-O 3.46Å; L374-F383 HydrophobicContact CB-CD1 4.45Å; L374-F383 HydrophobicContact CB-CE1 3.9Å; L374-F383 HydrophobicContact CB-CE2 4.34Å; L374-F383 HydrophobicContact CB-CZ 3.85Å; L374-F383 HydrophobicContact CD1-CE2 4.01Å; L374-F383 HydrophobicContact CD1-CZ 3.82Å; L374-F383 HydrophobicContact CG-CZ 4.44Å; L374-F383 PolarHBondContact N-O 2.85Å; L374-F383 PolarHBondContact O-N 2.76Å; F383-I385 HydrophobicContact CD2-CG2 4.28Å; F383-I385 HydrophobicContact CE2-CG2 3.91Å; F383-F441 HydrophobicContact CE2-CB 4.29Å; F383-F441 HydrophobicContact CE2-CD2 4.22Å; F383-F441 HydrophobicContact CZ-CD2 4.13Å; F383-V457 HydrophobicContact CD2-CG1 3.92Å; F383-V457 HydrophobicContact CE2-CG1 4.26Å; F383-E458 CarbonylContact C-O 3.11Å; F383-E458 VanDerWaalsContact CA-O 3.28Å; F383-E458 WeakPolarHBondContact CA-O 2.94Å; F383-E458 VanDerWaalsContact CB-O 3.31Å; F383-E458 WeakPolarHBondContact CB-O 3.31Å
384	R	98.3	Very high	94.7	Very high	56 Å²	56	29.4 Å²	29.4	21%	0.211	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	143.2	178.7	77	-169.6	176.5	178.6	1.9	111.1	E294 L372 Y373 V457 E458 F461	E294-R384 IonicContact OE2-NH1 3.81Å; L372-R384 CarbonylContact O-C 3.53Å; L372-R384 VanDerWaalsContact O-CA 3.29Å; L372-R384 WeakPolarHBondContact O-CA 3.33Å; Y373-R384 HydrophobicContact CD1-CB 3.84Å; Y373-R384 HydrophobicContact CD2-CB 3.96Å; Y373-R384 HydrophobicContact CE1-CB 3.83Å; Y373-R384 HydrophobicContact CE1-CG 4.44Å; Y373-R384 HydrophobicContact CE2-CB 3.94Å; Y373-R384 HydrophobicContact CG-CB 3.9Å; Y373-R384 WeakPolarHBondContact OH-CD 3.33Å; Y373-R384 PolarHBondContact OH-NH1 3.01Å; R384-V457 WeakPolarHBondContact O-CA 3.39Å; R384-E458 HydrophobicContact CG-CB 4.15Å; R384-E458 IonicContact CZ-OE2 3.76Å; R384-E458 PolarHBondContact N-O 2.98Å; R384-E458 IonicContact NE-OE2 3.02Å; R384-E458 PolarHBondContact NE-OE2 3.39Å; R384-E458 IonicContact NH2-OE2 3.81Å; R384-E458 PolarHBondContact NH2-OE2 2.89Å; R384-E458 PolarHBondContact O-N 3.02Å; R384-F461 HydrophobicContact CB-CE2 4.16Å; R384-F461 HydrophobicContact CG-CE2 3.78Å; R384-F461 HydrophobicContact CG-CZ 4.27Å
385	I	98.8	Very high	94.4	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.5	164	62.2	173	0	0	0	108	S371 L372 L374 F383 M420 I424 F428 F441 S456 V457	S371-I385 CarbonylContact C-O 3.6Å; S371-I385 VanDerWaalsContact CA-O 3.31Å; S371-I385 WeakPolarHBondContact CA-O 3.32Å; L372-I385 HydrophobicContact CB-CD1 4.47Å; L372-I385 HydrophobicContact CB-CG1 3.92Å; L372-I385 HydrophobicContact CD1-CD1 4.44Å; L372-I385 PolarHBondContact N-O 3.21Å; L372-I385 PolarHBondContact O-N 3.23Å; L374-I385 HydrophobicContact CD1-CD1 4.08Å; L374-I385 HydrophobicContact CD1-CG1 4.42Å; L374-I385 HydrophobicContact CD1-CG2 4.44Å; F383-I385 HydrophobicContact CD2-CG2 4.28Å; F383-I385 HydrophobicContact CE2-CG2 3.91Å; I385-M420 HydrophobicContact CD1-SD 4.36Å; I385-I424 HydrophobicContact CD1-CG2 4.31Å; I385-F428 HydrophobicContact CB-CE1 3.96Å; I385-F428 HydrophobicContact CB-CE2 4.01Å; I385-F428 HydrophobicContact CB-CZ 3.6Å; I385-F428 HydrophobicContact CD1-CD2 4.49Å; I385-F428 HydrophobicContact CD1-CE2 4.08Å; I385-F428 HydrophobicContact CG1-CE2 4.39Å; I385-F428 HydrophobicContact CG1-CZ 4.39Å; I385-F428 HydrophobicContact CG2-CE1 4.35Å; I385-F428 HydrophobicContact CG2-CZ 4.42Å; I385-F441 HydrophobicContact CD1-CD1 4.24Å; I385-F441 HydrophobicContact CD1-CE1 4.15Å; I385-F441 HydrophobicContact CG2-CB 3.92Å; I385-F441 HydrophobicContact CG2-CD1 4.31Å; I385-F441 HydrophobicContact CG2-CG 4.08Å; I385-S456 CarbonylContact C-O 3.57Å; I385-S456 WeakPolarHBondContact CA-O 3.37Å; I385-V457 HydrophobicContact CG2-CG1 4.22Å; I385-V457 HydrophobicContact CG2-CG2 4.12Å
386	S	98.7	Very high	93.9	Very high	5 Å²	5	31.6 Å²	31.6	4%	0.035	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123.1	-176.6	-57.5	0	0	0	0	110.5	I370 S371 A455 S456	I370-S386 WeakPolarHBondContact O-CA 3.37Å; S371-S386 PolarHBondContact OG-OG 2.74Å; S386-A455 WeakPolarHBondContact O-CA 3.24Å; S386-S456 WeakPolarHBondContact CB-OG 3.37Å; S386-S456 PolarHBondContact N-O 2.98Å; S386-S456 PolarHBondContact O-N 2.83Å; S386-S456 PolarHBondContact OG-OG 3.38Å
387	I	98.2	Very high	92.7	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.01	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	149.9	178.5	66.6	175.1	0	0	0	111.2	V369 I370 Q391 Y392 I424 F428	V369-I387 WeakPolarHBondContact CG1-O 3.46Å; I370-I387 HydrophobicContact CB-CD1 4.1Å; I370-I387 HydrophobicContact CB-CG1 3.8Å; I370-I387 HydrophobicContact CD1-CD1 4.38Å; I370-I387 PolarHBondContact N-O 2.72Å; I370-I387 VanDerWaalsContact N-O 3.11Å; I370-I387 WeakPolarHBondContact O-CG1 3.31Å; I370-I387 PolarHBondContact O-N 2.97Å; I387-Q391 HydrophobicContact CB-CB 4.29Å; I387-Y392 HydrophobicContact CD1-CD1 4.08Å; I387-Y392 HydrophobicContact CG1-CD1 4.25Å; I387-I424 HydrophobicContact CD1-CD1 3.25Å; I387-I424 HydrophobicContact CG1-CD1 4.43Å; I387-I424 HydrophobicContact CG2-CD1 4.09Å; I387-I424 HydrophobicContact CG2-CG2 4.44Å; I387-F428 HydrophobicContact CG2-CE2 3.58Å; I387-F428 HydrophobicContact CG2-CZ 3.89Å
388	L	98.2	Very high	91.6	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	18%	0.184	C	C	.	.			trans	-97.7	165.4	178.8	-49.8	179.3	0	0	0	111.1	V369 Q390 Q391 Y392 H449 R453	V369-L388 HydrophobicContact CG2-CD2 3.91Å; L388-Q390 PolarHBondContact O-N 3.02Å; L388-Q391 WeakPolarHBondContact O-CB 3.44Å; L388-Q391 PolarHBondContact O-N 3.33Å; L388-Q391 PolarHBondContact O-OE1 3.45Å; L388-Y392 WeakPolarHBondContact O-CD1 3.37Å; L388-Y392 PolarHBondContact O-N 2.82Å; L388-H449 HydrophobicContact CD1-CB 3.69Å; L388-R453 HydrophobicContact CD1-CB 4.44Å; L388-R453 WeakPolarHBondContact CD1-O 3.41Å; L388-R453 HydrophobicContact CD2-CB 3.85Å
389	P	97.6	Very high	90.5	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-56.5	-27.3	168.8	19.7	-32.1	0	0	0	114.1	W364 F367 Q391 Y392 L393	W364-P389 HydrophobicContact CE3-CB 3.95Å; W364-P389 HydrophobicContact CE3-CG 4.11Å; W364-P389 HydrophobicContact CZ3-CB 4.3Å; F367-P389 HydrophobicContact CB-CB 3.52Å; F367-P389 HydrophobicContact CB-CG 3.76Å; F367-P389 HydrophobicContact CG-CB 4.23Å; P389-Q391 PolarHBondContact O-N 2.86Å; P389-Y392 VanDerWaalsContact CA-CZ 3.5Å; P389-Y392 HydrophobicContact CB-CE1 4.03Å; P389-Y392 HydrophobicContact CB-CE2 4.13Å; P389-Y392 PolarHBondContact O-N 2.87Å; P389-L393 HydrophobicContact CB-CD1 4.09Å; P389-L393 HydrophobicContact CB-CG 4.26Å; P389-L393 WeakPolarHBondContact O-CA 3.28Å; P389-L393 WeakPolarHBondContact O-CB 3.23Å; P389-L393 WeakPolarHBondContact O-CG 3.47Å; P389-L393 PolarHBondContact O-N 2.92Å
390	Q	95.8	Very high	89.6	Confident	14 Å²	14	32.8 Å²	32.8	7%	0.065	17%	0.173	C	C	.	.	H	α-helix	trans	-60.3	-22.7	173.5	-68.6	85.9	-23.5	0	0	113	W364 L388 V448 D450	W364-Q390 HydrophobicContact CD2-CG 4.05Å; W364-Q390 HydrophobicContact CE3-CG 3.99Å; W364-Q390 HydrophobicContact CH2-CG 4.17Å; W364-Q390 HydrophobicContact CZ2-CG 4.23Å; W364-Q390 HydrophobicContact CZ3-CG 4.05Å; L388-Q390 PolarHBondContact O-N 3.02Å; Q390-V448 HydrophobicContact CB-CB 4.18Å; Q390-V448 HydrophobicContact CB-CG1 4.04Å; Q390-V448 WeakPolarHBondContact CB-O 3.26Å; Q390-V448 HydrophobicContact CG-CG1 4.11Å; Q390-D450 PolarHBondContact NE2-OD2 3.06Å
391	Q	96.4	Very high	88.5	Confident	3 Å²	3	31.1 Å²	31.1	1%	0.014	17%	0.169	C	C	.	.	H	α-helix	trans	-87.3	-54.7	172.4	-77.1	73.2	56.2	0	0	111.3	I387 L388 P389 L393 V423 V448	I387-Q391 HydrophobicContact CB-CB 4.29Å; L388-Q391 WeakPolarHBondContact O-CB 3.44Å; L388-Q391 PolarHBondContact O-N 3.33Å; L388-Q391 PolarHBondContact O-OE1 3.45Å; P389-Q391 PolarHBondContact O-N 2.86Å; Q391-L393 PolarHBondContact O-N 3.05Å; Q391-V423 WeakPolarHBondContact CB-O 3.47Å; Q391-V423 WeakPolarHBondContact CG-O 3.25Å; Q391-V423 WeakPolarHBondContact O-CB 3.4Å; Q391-V448 PolarHBondContact NE2-O 2.93Å
392	Y	96.9	Very high	87.4	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-85.4	-4.6	-171.2	69.6	-106.3	0	0	0	114.6	F367 P368 I370 I387 L388 P389 F409 A410 V411	F367-Y392 WeakPolarHBondContact CB-OH 3.07Å; P368-Y392 WeakPolarHBondContact CD-OH 3.3Å; P368-Y392 WeakPolarHBondContact O-CE1 3.07Å; P368-Y392 PolarHBondContact O-OH 3.22Å; I370-Y392 HydrophobicContact CD1-CD1 3.78Å; I370-Y392 HydrophobicContact CD1-CE1 3.87Å; I370-Y392 HydrophobicContact CD1-CG 4.21Å; I370-Y392 HydrophobicContact CG1-CD1 4.33Å; I370-Y392 HydrophobicContact CG1-CE1 4.05Å; I387-Y392 HydrophobicContact CD1-CD1 4.08Å; I387-Y392 HydrophobicContact CG1-CD1 4.25Å; L388-Y392 WeakPolarHBondContact O-CD1 3.37Å; L388-Y392 PolarHBondContact O-N 2.82Å; P389-Y392 VanDerWaalsContact CA-CZ 3.5Å; P389-Y392 HydrophobicContact CB-CE1 4.03Å; P389-Y392 HydrophobicContact CB-CE2 4.13Å; P389-Y392 PolarHBondContact O-N 2.87Å; Y392-F409 HydrophobicContact CD2-CD2 4.15Å; Y392-F409 AromaticContact CD2-CE2 3.8Å; Y392-F409 HydrophobicContact CD2-CE2 3.8Å; Y392-F409 HydrophobicContact CE2-CE2 4.03Å; Y392-A410 WeakPolarHBondContact O-CB 3.45Å; Y392-A410 PolarHBondContact O-N 3.27Å; Y392-V411 HydrophobicContact CG-CG2 4.46Å
393	L	96.5	Very high	86.6	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	95.9	163.9	-58.5	-175.1	0	0	0	108.5	F348 W364 F367 P389 Q391 Y407 F409	F348-L393 HydrophobicContact CE2-CD2 4.33Å; F348-L393 HydrophobicContact CZ-CD2 3.67Å; W364-L393 HydrophobicContact CZ3-CB 4.28Å; W364-L393 HydrophobicContact CZ3-CD1 4.08Å; F367-L393 HydrophobicContact CD1-CD1 4.18Å; F367-L393 HydrophobicContact CD2-CD1 3.83Å; F367-L393 HydrophobicContact CE1-CD1 4.11Å; F367-L393 HydrophobicContact CE1-CD2 4.5Å; F367-L393 HydrophobicContact CE2-CD1 3.75Å; F367-L393 HydrophobicContact CG-CD1 4.04Å; F367-L393 HydrophobicContact CZ-CD1 3.88Å; P389-L393 HydrophobicContact CB-CD1 4.09Å; P389-L393 HydrophobicContact CB-CG 4.26Å; P389-L393 WeakPolarHBondContact O-CA 3.28Å; P389-L393 WeakPolarHBondContact O-CB 3.23Å; P389-L393 WeakPolarHBondContact O-CG 3.47Å; P389-L393 PolarHBondContact O-N 2.92Å; Q391-L393 PolarHBondContact O-N 3.05Å; L393-Y407 HydrophobicContact CB-CD1 4.16Å; L393-Y407 HydrophobicContact CB-CG 4.32Å; L393-Y407 WeakPolarHBondContact O-CD1 3.34Å; L393-F409 HydrophobicContact CD2-CD2 3.89Å
394	R	93.1	Very high	86.2	Confident	47 Å²	47	44.3 Å²	44.3	18%	0.177	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	125.8	-173.4	-175.6	-179.6	56.5	70.2	-4.4	110.5	Y407 K408 A410	R394-Y407 CarbonylContact O-C 3.43Å; R394-Y407 VanDerWaalsContact O-CA 3.31Å; R394-Y407 WeakPolarHBondContact O-CA 3.36Å; R394-K408 PolarHBondContact N-O 3.42Å; R394-K408 PolarHBondContact O-N 3.1Å; R394-A410 HydrophobicContact CB-CB 3.9Å
395	P	90.4	Very high	85.8	Confident	37 Å²	37	44.1 Å²	44.1	24%	0.24	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	148.4	177.4	27.6	-35.4	0	0	0	111.9	A244 C406 Y407	A244-P395 HydrophobicContact CB-CG 3.7Å; P395-C406 CarbonylContact C-O 3.59Å; P395-C406 WeakPolarHBondContact CA-O 3.37Å; P395-Y407 HydrophobicContact CB-CD1 4.2Å; P395-Y407 HydrophobicContact CB-CE1 4.12Å
396	V	84.9	Confident	85.5	Confident	20 Å²	20	44.3 Å²	44.3	12%	0.121	25%	0.253	C	S	.	.			trans	-127.1	99.4	177.3	-176	0	0	0	0	109.3	V399 C406 K408	V396-V399 HydrophobicContact CG1-CB 4.46Å; V396-V399 HydrophobicContact CG1-CG2 4.14Å; V396-C406 PolarHBondContact N-O 2.64Å; V396-K408 HydrophobicContact CG2-CB 4.23Å; V396-K408 HydrophobicContact CG2-CD 4.2Å; V396-K408 HydrophobicContact CG2-CG 3.89Å
397	E	70.4	Confident	85.2	Confident	114 Å²	114	45.1 Å²	45.1	53%	0.533	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-35.2	-176.1	-64.4	168.9	160.6	0	0	112.9	K96 V399 A400	K96-E397 IonicContact NZ-OE2 3.47Å; K96-E397 PolarHBondContact NZ-OE2 3.39Å; E397-V399 PolarHBondContact O-N 3.23Å; E397-V399 VanDerWaalsContact O-N 3.08Å; E397-A400 PolarHBondContact O-N 3.44Å
398	D	65.9	Low	85.1	Confident	140 Å²	140	47.9 Å²	47.9	75%	0.749	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-14.3	-170.3	-60.7	-28.1	0	0	0	114.2
399	V	65.6	Low	85	Confident	81 Å²	81	47.9 Å²	47.9	49%	0.491	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-19.1	-179.2	-172.6	0	0	0	0	111.6	L354 V396 E397 S401	L354-V399 HydrophobicContact CD1-CG1 4.43Å; L354-V399 HydrophobicContact CD2-CB 4.19Å; L354-V399 HydrophobicContact CD2-CG1 4.06Å; L354-V399 HydrophobicContact CD2-CG2 4.1Å; V396-V399 HydrophobicContact CG1-CB 4.46Å; V396-V399 HydrophobicContact CG1-CG2 4.14Å; E397-V399 PolarHBondContact O-N 3.23Å; E397-V399 VanDerWaalsContact O-N 3.08Å; V399-S401 PolarHBondContact O-N 2.91Å
400	A	61.3	Low	85	Confident	34 Å²	34	47.9 Å²	47.9	28%	0.281	27%	0.268	S	S	.	.			trans	-71.1	122.1	-178.6	0	0	0	0	0	110.2	E397 E404 C406	E397-A400 PolarHBondContact O-N 3.44Å; A400-E404 WeakPolarHBondContact CB-O 3.48Å; A400-C406 HydrophobicContact CB-CB 4.36Å
401	S	63.8	Low	85.2	Confident	56 Å²	56	47.3 Å²	47.3	39%	0.392	27%	0.265	S	S	.	.			trans	-66.5	157.3	160.4	74.8	0	0	0	0	108.6	V399 Q403 E404	V399-S401 PolarHBondContact O-N 2.91Å; S401-Q403 PolarHBondContact O-N 2.05Å; S401-Q403 PolarHBondContact OG-N 2.96Å; S401-E404 PolarHBondContact O-N 3Å
402	A	69.4	Low	85.2	Confident	112 Å²	112	48.3 Å²	48.3	93%	0.926	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-2.4	177.5	0	0	0	0	0	114.7
403	Q	81.4	Confident	85.3	Confident	150 Å²	150	52.7 Å²	52.7	70%	0.701	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-4.5	-178.2	-63	178.8	-8.9	0	0	113.4	A359 S401	A359-Q403 PolarHBondContact N-O 2.84Å; S401-Q403 PolarHBondContact O-N 2.05Å; S401-Q403 PolarHBondContact OG-N 2.96Å
404	E	88.2	Confident	85.2	Confident	57 Å²	57	52.8 Å²	52.8	27%	0.266	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	136.9	-175.4	-68.3	179.6	163	0	0	111.4	C356 W357 A400 S401	C356-E404 HydrophobicContact CB-CB 4.45Å; W357-E404 CarbonylContact O-C 3.56Å; W357-E404 VanDerWaalsContact O-CA 3.23Å; W357-E404 WeakPolarHBondContact O-CA 3.25Å; A400-E404 WeakPolarHBondContact CB-O 3.48Å; S401-E404 PolarHBondContact O-N 3Å
405	D	90.2	Very high	85.3	Confident	53 Å²	53	55.6 Å²	55.6	28%	0.283	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	111.8	169.7	-68.3	-31.9	0	0	0	108.6	C356 W357 A359 G360 Y407	C356-D405 VanDerWaalsContact CA-O 3.28Å; C356-D405 WeakPolarHBondContact CA-O 3.37Å; W357-D405 PolarHBondContact N-O 3.45Å; W357-D405 PolarHBondContact O-N 3.11Å; A359-D405 WeakPolarHBondContact CA-OD2 3.32Å; G360-D405 PolarHBondContact N-OD2 2.84Å; D405-Y407 HydrophobicContact CB-CE2 3.62Å; D405-Y407 WeakPolarHBondContact O-CE2 3.33Å
406	C	92.3	Very high	85.5	Confident	4 Å²	4	56.5 Å²	56.5	3%	0.027	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	136.6	-176.3	-66.1	0	0	0	0	112.2	V355 C356 P395 V396 A400	V355-C406 CarbonylContact O-C 3.53Å; V355-C406 WeakPolarHBondContact O-CA 3.4Å; C356-C406 HydrophobicContact CB-CB 4.12Å; C356-C406 WeakPolarHBondContact CB-SG 3.45Å; C356-C406 WeakPolarHBondContact SG-CB 3.46Å; C356-C406 CovalentContact SG-SG 2.05Å; C356-C406 PolarHBondContact SG-SG 3Å; P395-C406 CarbonylContact C-O 3.59Å; P395-C406 WeakPolarHBondContact CA-O 3.37Å; V396-C406 PolarHBondContact N-O 2.64Å; A400-C406 HydrophobicContact CB-CB 4.36Å
407	Y	93.9	Very high	86	Confident	22 Å²	22	55.5 Å²	55.5	9%	0.086	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	149.6	-174.9	-54.5	-90.9	0	0	0	112.4	L354 V355 W357 T362 W364 L393 R394 P395 D405	L354-Y407 VanDerWaalsContact CA-O 3.29Å; L354-Y407 WeakPolarHBondContact CA-O 3.19Å; V355-Y407 PolarHBondContact N-O 2.89Å; V355-Y407 PolarHBondContact O-N 3.4Å; W357-Y407 AromaticContact CE3-CD2 3.73Å; W357-Y407 HydrophobicContact CE3-CD2 3.73Å; W357-Y407 AromaticContact CE3-CE2 3.94Å; W357-Y407 HydrophobicContact CE3-CE2 3.94Å; W357-Y407 AromaticContact CZ3-CD2 3.56Å; W357-Y407 HydrophobicContact CZ3-CD2 3.56Å; W357-Y407 HydrophobicContact CZ3-CE2 4.12Å; W357-Y407 HydrophobicContact CZ3-CG 4.42Å; T362-Y407 HydrophobicContact CG2-CD2 4.43Å; T362-Y407 HydrophobicContact CG2-CE2 3.73Å; T362-Y407 WeakPolarHBondContact OG1-CE2 3.21Å; T362-Y407 PolarHBondContact OG1-OH 3.26Å; W364-Y407 HydrophobicContact CH2-CD1 4.28Å; W364-Y407 AromaticContact CH2-CE1 3.54Å; W364-Y407 HydrophobicContact CH2-CE1 3.54Å; W364-Y407 HydrophobicContact CH2-CE2 4.43Å; W364-Y407 AromaticContact CH2-CZ 3.6Å; W364-Y407 HydrophobicContact CZ2-CE1 4.18Å; W364-Y407 AromaticContact CZ2-CZ 3.86Å; W364-Y407 WeakPolarHBondContact CZ2-OH 3.43Å; L393-Y407 HydrophobicContact CB-CD1 4.16Å; L393-Y407 HydrophobicContact CB-CG 4.32Å; L393-Y407 WeakPolarHBondContact O-CD1 3.34Å; R394-Y407 CarbonylContact O-C 3.43Å; R394-Y407 VanDerWaalsContact O-CA 3.31Å; R394-Y407 WeakPolarHBondContact O-CA 3.36Å; P395-Y407 HydrophobicContact CB-CD1 4.2Å; P395-Y407 HydrophobicContact CB-CE1 4.12Å; D405-Y407 HydrophobicContact CB-CE2 3.62Å; D405-Y407 WeakPolarHBondContact O-CE2 3.33Å
408	K	94.5	Very high	87.4	Confident	60 Å²	60	50.1 Å²	50.1	26%	0.261	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	141.7	164	-82.6	-173.2	173.1	-159.6	0	109.9	L354 R394 V396 A410	L354-K408 HydrophobicContact CB-CG 4.22Å; R394-K408 PolarHBondContact N-O 3.42Å; R394-K408 PolarHBondContact O-N 3.1Å; V396-K408 HydrophobicContact CG2-CB 4.23Å; V396-K408 HydrophobicContact CG2-CD 4.2Å; V396-K408 HydrophobicContact CG2-CG 3.89Å; K408-A410 PolarHBondContact O-N 3.47Å
409	F	97.7	Very high	88.9	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.009	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	118.2	170.3	-169.5	-120.7	0	0	0	109.7	V332 I335 F348 W349 Y392 L393 V411	V332-F409 HydrophobicContact CG2-CE1 3.9Å; V332-F409 HydrophobicContact CG2-CZ 4.32Å; I335-F409 HydrophobicContact CD1-CE2 4.35Å; I335-F409 HydrophobicContact CD1-CZ 3.92Å; F348-F409 HydrophobicContact CD2-CB 4.14Å; F348-F409 HydrophobicContact CE1-CB 4.4Å; F348-F409 HydrophobicContact CE2-CB 3.81Å; F348-F409 HydrophobicContact CZ-CB 3.99Å; F348-F409 HydrophobicContact CZ-CD2 4.38Å; F348-F409 WeakPolarHBondContact O-CB 3.4Å; W349-F409 HydrophobicContact CE3-CD1 4.26Å; W349-F409 HydrophobicContact CE3-CD2 4.14Å; W349-F409 HydrophobicContact CE3-CE1 4.14Å; W349-F409 HydrophobicContact CE3-CE2 4.06Å; W349-F409 HydrophobicContact CE3-CG 4.24Å; W349-F409 HydrophobicContact CE3-CZ 4.05Å; W349-F409 HydrophobicContact CZ3-CD2 4.18Å; W349-F409 AromaticContact CZ3-CE2 3.97Å; W349-F409 HydrophobicContact CZ3-CE2 3.97Å; W349-F409 HydrophobicContact CZ3-CZ 4.3Å; W349-F409 VanDerWaalsContact O-CD1 3.3Å; W349-F409 WeakPolarHBondContact O-CD1 3.22Å; Y392-F409 HydrophobicContact CD2-CD2 4.15Å; Y392-F409 AromaticContact CD2-CE2 3.8Å; Y392-F409 HydrophobicContact CD2-CE2 3.8Å; Y392-F409 HydrophobicContact CE2-CE2 4.03Å; L393-F409 HydrophobicContact CD2-CD2 3.89Å; F409-V411 HydrophobicContact CD1-CB 4.23Å; F409-V411 WeakPolarHBondContact CD1-O 3.18Å; F409-V411 HydrophobicContact CE1-CB 3.58Å; F409-V411 HydrophobicContact CE1-CG2 4.19Å; F409-V411 HydrophobicContact CE2-CB 4.3Å; F409-V411 HydrophobicContact CE2-CG2 3.99Å; F409-V411 HydrophobicContact CZ-CB 3.61Å; F409-V411 HydrophobicContact CZ-CG2 3.71Å
410	A	97.4	Very high	90.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.237	C	C	.	.			trans	-103.1	25.8	-173.5	0	0	0	0	0	112.8	N320 L321 Y392 R394 K408 V423	N320-A410 CarbonylContact C-O 3.5Å; N320-A410 VanDerWaalsContact CA-O 3.29Å; N320-A410 WeakPolarHBondContact CA-O 3.32Å; N320-A410 WeakPolarHBondContact CB-O 3.46Å; L321-A410 PolarHBondContact N-O 3.02Å; Y392-A410 WeakPolarHBondContact O-CB 3.45Å; Y392-A410 PolarHBondContact O-N 3.27Å; R394-A410 HydrophobicContact CB-CB 3.9Å; K408-A410 PolarHBondContact O-N 3.47Å; A410-V423 HydrophobicContact CB-CG1 3.87Å; A410-V423 HydrophobicContact CB-CG2 4.22Å
411	V	98.3	Very high	92.3	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.1	162.4	-170.5	0	0	0	0	107.5	L321 L323 F328 I370 Y392 F409	L321-V411 HydrophobicContact CB-CG1 4.42Å; L321-V411 HydrophobicContact CB-CG2 4.37Å; L321-V411 HydrophobicContact CD2-CG1 4.12Å; L321-V411 HydrophobicContact CD2-CG2 4.24Å; L321-V411 HydrophobicContact CG-CG1 4.25Å; L321-V411 CarbonylContact O-C 3.39Å; L321-V411 VanDerWaalsContact O-CA 3.26Å; L321-V411 WeakPolarHBondContact O-CA 3.45Å; L323-V411 HydrophobicContact CD1-CG1 3.71Å; L323-V411 HydrophobicContact CG-CG1 4.26Å; F328-V411 HydrophobicContact CD2-CG1 4.16Å; F328-V411 HydrophobicContact CE2-CG1 4.32Å; I370-V411 HydrophobicContact CD1-CG2 4.45Å; Y392-V411 HydrophobicContact CG-CG2 4.46Å; F409-V411 HydrophobicContact CD1-CB 4.23Å; F409-V411 WeakPolarHBondContact CD1-O 3.18Å; F409-V411 HydrophobicContact CE1-CB 3.58Å; F409-V411 HydrophobicContact CE1-CG2 4.19Å; F409-V411 HydrophobicContact CE2-CB 4.3Å; F409-V411 HydrophobicContact CE2-CG2 3.99Å; F409-V411 HydrophobicContact CZ-CB 3.61Å; F409-V411 HydrophobicContact CZ-CG2 3.71Å
412	S	97.8	Very high	93.9	Very high	24 Å²	24	35.6 Å²	35.6	17%	0.168	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	160.8	-177.9	59.9	0	0	0	0	113.5	N320 L321 R322 L323 F328	N320-S412 WeakPolarHBondContact ND2-CB 3.38Å; N320-S412 PolarHBondContact ND2-OG 2.98Å; L321-S412 PolarHBondContact O-N 2.58Å; R322-S412 CarbonylContact C-O 3.58Å; R322-S412 VanDerWaalsContact CA-O 3.27Å; R322-S412 WeakPolarHBondContact CA-O 3.33Å; L323-S412 PolarHBondContact N-O 3.28Å; F328-S412 VanDerWaalsContact CD2-C 3.48Å
413	Q	97.7	Very high	95.2	Very high	92 Å²	92	30.3 Å²	30.3	43%	0.43	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	142.8	176.6	-169.5	179.8	-70.3	0	0	111.8	L323 R325 F328	L323-Q413 CarbonylContact O-C 3.54Å; R325-Q413 HydrophobicContact CB-CG 4.09Å; R325-Q413 HydrophobicContact CG-CG 4.41Å; F328-Q413 HydrophobicContact CD1-CB 3.86Å; F328-Q413 HydrophobicContact CD1-CG 4.31Å; F328-Q413 HydrophobicContact CE1-CB 4.22Å; F328-Q413 HydrophobicContact CG-CB 4.06Å
414	S	96.1	Very high	96	Very high	3 Å²	3	23.2 Å²	23.2	2%	0.021	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	145.4	172.8	-166.4	0	0	0	0	111.6	L323 R325 T416 G417	L323-S414 WeakPolarHBondContact O-CB 3.4Å; L323-S414 PolarHBondContact O-N 3.48Å; R325-S414 PolarHBondContact N-O 3.36Å; S414-T416 PolarHBondContact OG-N 2.83Å; S414-T416 VanDerWaalsContact OG-N 3.14Å; S414-T416 PolarHBondContact OG-OG1 2.88Å; S414-G417 WeakPolarHBondContact CB-O 3.49Å; S414-G417 PolarHBondContact OG-O 2.63Å
415	S	94.8	Very high	96.5	Very high	106 Å²	106	20.5 Å²	20.5	74%	0.741	12%	0.115	S	C	*	.	S	Bend	trans	-106.9	3.9	166.6	60.2	0	0	0	0	112.5
416	T	93.9	Very high	96.9	Very high	55 Å²	55	18.6 Å²	18.6	34%	0.337	11%	0.105	S	C	.	.	S	Bend	trans	-130.8	33.5	-170.8	59.1	0	0	0	0	112	K311 S414	K311-T416 WeakPolarHBondContact CE-O 3.38Å; K311-T416 PolarHBondContact NZ-O 2.82Å; S414-T416 PolarHBondContact OG-N 2.83Å; S414-T416 VanDerWaalsContact OG-N 3.14Å; S414-T416 PolarHBondContact OG-OG1 2.88Å
417	G	96.3	Very high	97.2	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.104	C	C	.	.			trans	92.3	175.5	-177.2	0	0	0	0	0	115	Y309 D310 K311 S414	Y309-G417 VanDerWaalsContact O-CA 3.25Å; Y309-G417 WeakPolarHBondContact O-CA 3.37Å; Y309-G417 PolarHBondContact O-N 3.06Å; D310-G417 PolarHBondContact OD1-N 2.58Å; K311-G417 CarbonylContact O-C 3.59Å; K311-G417 WeakPolarHBondContact O-CA 3.46Å; S414-G417 WeakPolarHBondContact CB-O 3.49Å; S414-G417 PolarHBondContact OG-O 2.63Å
418	T	98.6	Very high	97.4	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	138.6	170.2	-65.6	0	0	0	0	110.2	I290 Y307 K311 S312 I313 L321 R322 L323 P324	I290-T418 HydrophobicContact CD1-CG2 3.58Å; Y307-T418 PolarHBondContact O-OG1 2.84Å; K311-T418 PolarHBondContact O-N 3.46Å; S312-T418 WeakPolarHBondContact CA-O 3.42Å; S312-T418 WeakPolarHBondContact OG-CB 3.41Å; I313-T418 PolarHBondContact N-O 2.91Å; L321-T418 HydrophobicContact CD1-CG2 4.45Å; R322-T418 CarbonylContact O-C 3.48Å; R322-T418 WeakPolarHBondContact O-CA 3.35Å; L323-T418 HydrophobicContact CD2-CG2 4.04Å; P324-T418 WeakPolarHBondContact CD-OG1 3.45Å
419	V	98.6	Very high	97.6	Very high	5 Å²	5	14.5 Å²	14.5	3%	0.03	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	112.8	173.9	-173.3	0	0	0	0	108.4	I313 D315 T318 L321 R322 G421	I313-V419 HydrophobicContact CD1-CG1 4.32Å; I313-V419 HydrophobicContact CD1-CG2 4.24Å; I313-V419 HydrophobicContact CG1-CB 4.34Å; I313-V419 HydrophobicContact CG1-CG1 4.08Å; I313-V419 HydrophobicContact CG1-CG2 4.07Å; D315-V419 HydrophobicContact CB-CG1 3.54Å; T318-V419 HydrophobicContact CG2-CB 4.44Å; T318-V419 HydrophobicContact CG2-CG1 3.78Å; L321-V419 WeakPolarHBondContact CA-O 3.37Å; R322-V419 HydrophobicContact CB-CB 3.9Å; R322-V419 HydrophobicContact CB-CG2 4.15Å; R322-V419 HydrophobicContact CG-CB 4.09Å; R322-V419 HydrophobicContact CG-CG2 4.49Å; R322-V419 PolarHBondContact N-O 3.25Å; R322-V419 PolarHBondContact O-N 3.4Å; V419-G421 VanDerWaalsContact C-N 3.34Å; V419-G421 PolarHBondContact O-N 3.2Å; V419-G421 VanDerWaalsContact O-N 3.12Å
420	M	98.8	Very high	97.7	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.005	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	87	169.9	-66.4	177.8	-77.2	0	0	108.4	V288 I313 V314 D315 L372 L374 I385 I424	V288-M420 HydrophobicContact CG2-CE 3.26Å; I313-M420 PolarHBondContact O-N 3.23Å; V314-M420 HydrophobicContact CB-CE 4.45Å; V314-M420 HydrophobicContact CG2-CE 3.37Å; D315-M420 PolarHBondContact N-O 2.51Å; L372-M420 HydrophobicContact CD1-CG 4.21Å; L372-M420 HydrophobicContact CD1-SD 4.18Å; L374-M420 HydrophobicContact CD2-SD 4.5Å; I385-M420 HydrophobicContact CD1-SD 4.36Å; M420-I424 HydrophobicContact CB-CB 4.26Å; M420-I424 HydrophobicContact CB-CG1 4.34Å; M420-I424 HydrophobicContact CB-CG2 4.17Å; M420-I424 HydrophobicContact CG-CG2 4.44Å
421	G	98.3	Very high	97.7	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	9%	0.087	C	C	.	.			trans	-72.2	-176.6	-177.1	0	0	0	0	0	114.7	D315 T318 N320 V419 V423 I424 M425	D315-G421 VanDerWaalsContact O-CA 3.3Å; D315-G421 WeakPolarHBondContact O-CA 3.25Å; T318-G421 CarbonylContact O-C 3.54Å; T318-G421 WeakPolarHBondContact O-CA 3.48Å; N320-G421 WeakPolarHBondContact O-CA 3.49Å; N320-G421 PolarHBondContact O-N 2.92Å; V419-G421 VanDerWaalsContact C-N 3.34Å; V419-G421 PolarHBondContact O-N 3.2Å; V419-G421 VanDerWaalsContact O-N 3.12Å; G421-V423 VanDerWaalsContact C-N 3.26Å; G421-V423 PolarHBondContact O-N 3.34Å; G421-I424 WeakPolarHBondContact O-CB 3.07Å; G421-I424 PolarHBondContact O-N 2.9Å; G421-M425 PolarHBondContact O-N 3.3Å; G421-M425 VanDerWaalsContact O-N 3.11Å
422	A	97.9	Very high	97.8	Very high	1 Å²	1	14.4 Å²	14.4	1%	0.008	9%	0.086	C	C	.	.	H	α-helix	trans	-49.9	-42	177.7	0	0	0	0	0	113	Y101 L241 T318 T319 I424 M425 E426	Y101-A422 HydrophobicContact CE2-CB 4.41Å; L241-A422 HydrophobicContact CD1-CB 4.32Å; T318-A422 PolarHBondContact O-N 2.87Å; T319-A422 PolarHBondContact O-N 3.08Å; A422-I424 PolarHBondContact O-N 3.14Å; A422-M425 CarbonylContact O-C 3.42Å; A422-M425 PolarHBondContact O-N 3.13Å; A422-M425 VanDerWaalsContact O-N 3.1Å; A422-E426 VanDerWaalsContact O-CG 3.31Å; A422-E426 WeakPolarHBondContact O-CG 3.5Å; A422-E426 PolarHBondContact O-N 3.3Å
423	V	96.9	Very high	97.8	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.9	-30	178.5	-64.7	0	0	0	0	113.5	T319 Q391 A410 G421	T319-V423 HydrophobicContact CG2-CG1 4.49Å; T319-V423 WeakPolarHBondContact O-CG1 3.11Å; T319-V423 WeakPolarHBondContact O-CG2 3.44Å; T319-V423 PolarHBondContact O-N 3.1Å; T319-V423 VanDerWaalsContact O-N 3.08Å; Q391-V423 WeakPolarHBondContact CB-O 3.47Å; Q391-V423 WeakPolarHBondContact CG-O 3.25Å; Q391-V423 WeakPolarHBondContact O-CB 3.4Å; A410-V423 HydrophobicContact CB-CG1 3.87Å; A410-V423 HydrophobicContact CB-CG2 4.22Å; G421-V423 VanDerWaalsContact C-N 3.26Å; G421-V423 PolarHBondContact O-N 3.34Å
424	I	98.3	Very high	97.8	Very high	1 Å²	1	9.7 Å²	9.7	1%	0.005	6%	0.062	C	C	.	.	H	α-helix	trans	-73.8	-49.1	172.5	-57.8	-57.1	0	0	0	109.5	L321 I385 I387 M420 G421 A422 E426 G427 F428	L321-I424 HydrophobicContact CB-CD1 3.87Å; L321-I424 HydrophobicContact CB-CG1 3.98Å; L321-I424 HydrophobicContact CD1-CD1 4.13Å; L321-I424 HydrophobicContact CD1-CG1 4Å; L321-I424 HydrophobicContact CD2-CD1 4.11Å; L321-I424 HydrophobicContact CG-CD1 4.22Å; L321-I424 HydrophobicContact CG-CG1 4.45Å; I385-I424 HydrophobicContact CD1-CG2 4.31Å; I387-I424 HydrophobicContact CD1-CD1 3.25Å; I387-I424 HydrophobicContact CG1-CD1 4.43Å; I387-I424 HydrophobicContact CG2-CD1 4.09Å; I387-I424 HydrophobicContact CG2-CG2 4.44Å; M420-I424 HydrophobicContact CB-CB 4.26Å; M420-I424 HydrophobicContact CB-CG1 4.34Å; M420-I424 HydrophobicContact CB-CG2 4.17Å; M420-I424 HydrophobicContact CG-CG2 4.44Å; G421-I424 WeakPolarHBondContact O-CB 3.07Å; G421-I424 PolarHBondContact O-N 2.9Å; A422-I424 PolarHBondContact O-N 3.14Å; I424-E426 PolarHBondContact O-N 3Å; I424-G427 PolarHBondContact O-N 3Å; I424-F428 HydrophobicContact CG2-CD2 4.39Å; I424-F428 HydrophobicContact CG2-CE2 4.22Å; I424-F428 WeakPolarHBondContact O-CD2 3.48Å
425	M	98.6	Very high	97.9	Very high	1 Å²	1	15.5 Å²	15.5	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-62.8	-26.5	-178.3	-62.4	178.7	71.5	0	0	112.5	L239 L241 V314 G421 A422 G427 F428 V430 F432	L239-M425 HydrophobicContact CB-CE 4.32Å; L239-M425 HydrophobicContact CD1-CE 3.81Å; L241-M425 HydrophobicContact CD1-CB 3.8Å; L241-M425 HydrophobicContact CD1-CE 4.29Å; L241-M425 HydrophobicContact CD1-SD 4.27Å; L241-M425 HydrophobicContact CG-CB 4.36Å; V314-M425 HydrophobicContact CG1-CE 4.08Å; V314-M425 HydrophobicContact CG1-CG 4.22Å; V314-M425 HydrophobicContact CG1-SD 3.87Å; G421-M425 PolarHBondContact O-N 3.3Å; G421-M425 VanDerWaalsContact O-N 3.11Å; A422-M425 CarbonylContact O-C 3.42Å; A422-M425 PolarHBondContact O-N 3.13Å; A422-M425 VanDerWaalsContact O-N 3.1Å; M425-G427 PolarHBondContact O-N 2.88Å; M425-F428 PolarHBondContact O-N 2.04Å; M425-V430 HydrophobicContact CB-CG2 4.36Å; M425-V430 HydrophobicContact CE-CB 4.3Å; M425-V430 HydrophobicContact CE-CG1 4.5Å; M425-V430 HydrophobicContact CE-CG2 4.25Å; M425-V430 HydrophobicContact CG-CG2 4.31Å; M425-F432 HydrophobicContact CE-CE2 4Å; M425-F432 HydrophobicContact CE-CZ 3.81Å
426	E	98.1	Very high	98	Very high	13 Å²	13	16.4 Å²	16.4	6%	0.061	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-22.2	173.5	-77.8	173.3	-170.9	0	0	113.3	S97 Y101 L241 G243 A422 I424	S97-E426 WeakPolarHBondContact CB-OE1 3.01Å; S97-E426 PolarHBondContact OG-OE1 3.25Å; Y101-E426 HydrophobicContact CE2-CG 4.48Å; Y101-E426 PolarHBondContact OH-OE1 2.84Å; L241-E426 HydrophobicContact CB-CG 4.14Å; L241-E426 WeakPolarHBondContact O-CA 3.43Å; G243-E426 WeakPolarHBondContact CA-OE2 3.43Å; A422-E426 VanDerWaalsContact O-CG 3.31Å; A422-E426 WeakPolarHBondContact O-CG 3.5Å; A422-E426 PolarHBondContact O-N 3.3Å; I424-E426 PolarHBondContact O-N 3Å
427	G	97.9	Very high	98.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-18.4	173.9	0	0	0	0	0	114.2	I424 M425 S444	I424-G427 PolarHBondContact O-N 3Å; M425-G427 PolarHBondContact O-N 2.88Å; G427-S444 PolarHBondContact O-N 2.75Å
428	F	98.8	Very high	98.3	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	153.8	-163.3	-53.2	-71.1	0	0	0	113.1	I385 I387 I424 M425 V430 F441 A442 A455 V457	I385-F428 HydrophobicContact CB-CE1 3.96Å; I385-F428 HydrophobicContact CB-CE2 4.01Å; I385-F428 HydrophobicContact CB-CZ 3.6Å; I385-F428 HydrophobicContact CD1-CD2 4.49Å; I385-F428 HydrophobicContact CD1-CE2 4.08Å; I385-F428 HydrophobicContact CG1-CE2 4.39Å; I385-F428 HydrophobicContact CG1-CZ 4.39Å; I385-F428 HydrophobicContact CG2-CE1 4.35Å; I385-F428 HydrophobicContact CG2-CZ 4.42Å; I387-F428 HydrophobicContact CG2-CE2 3.58Å; I387-F428 HydrophobicContact CG2-CZ 3.89Å; I424-F428 HydrophobicContact CG2-CD2 4.39Å; I424-F428 HydrophobicContact CG2-CE2 4.22Å; I424-F428 WeakPolarHBondContact O-CD2 3.48Å; M425-F428 PolarHBondContact O-N 2.04Å; F428-V430 HydrophobicContact CB-CG2 4.11Å; F428-F441 HydrophobicContact CB-CD1 4.11Å; F428-F441 HydrophobicContact CD2-CD1 4.36Å; F428-F441 HydrophobicContact CG-CD1 4.21Å; F428-A442 CarbonylContact C-O 3.56Å; F428-A442 WeakPolarHBondContact CA-O 3.42Å; F428-A442 WeakPolarHBondContact CB-O 3.31Å; F428-A455 HydrophobicContact CE1-CB 4.41Å; F428-V457 HydrophobicContact CD1-CG2 3.59Å; F428-V457 HydrophobicContact CE1-CG2 3.63Å
429	Y	98.8	Very high	98.4	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	119.3	159.2	-179.3	-127.5	0	0	0	108.2	S238 L239 Q240 V266 D267 L270 Y271 V431 A442	S238-Y429 WeakPolarHBondContact CB-OH 3.27Å; S238-Y429 VanDerWaalsContact OG-CZ 3.32Å; S238-Y429 PolarHBondContact OG-OH 2.88Å; L239-Y429 WeakPolarHBondContact O-CD2 3.24Å; Q240-Y429 HydrophobicContact CB-CD2 3.9Å; Q240-Y429 HydrophobicContact CB-CE2 4.4Å; V266-Y429 WeakPolarHBondContact CA-OH 3.45Å; V266-Y429 HydrophobicContact CG1-CE1 3.61Å; D267-Y429 PolarHBondContact N-OH 2.97Å; L270-Y429 HydrophobicContact CB-CD2 4.08Å; L270-Y429 HydrophobicContact CB-CE2 4.06Å; L270-Y429 HydrophobicContact CB-CG 4.41Å; L270-Y429 HydrophobicContact CD1-CD2 4.48Å; L270-Y429 HydrophobicContact CD1-CE2 3.84Å; Y271-Y429 AromaticContact CD1-CD1 3.2Å; Y271-Y429 HydrophobicContact CD1-CD1 3.2Å; Y271-Y429 AromaticContact CD1-CE1 3.43Å; Y271-Y429 HydrophobicContact CD1-CE1 3.43Å; Y271-Y429 VanDerWaalsContact CD1-CE1 3.43Å; Y271-Y429 HydrophobicContact CD1-CG 4.18Å; Y271-Y429 AromaticContact CE1-CD1 3.92Å; Y271-Y429 HydrophobicContact CE1-CD1 3.92Å; Y271-Y429 AromaticContact CE1-CE1 3.79Å; Y271-Y429 HydrophobicContact CE1-CE1 3.79Å; Y271-Y429 AromaticContact CG-CD1 3.77Å; Y271-Y429 HydrophobicContact CG-CD1 3.77Å; Y271-Y429 HydrophobicContact CG-CE1 4.43Å; Y429-V431 HydrophobicContact CD1-CG2 4.24Å; Y429-V431 HydrophobicContact CE1-CG2 4.06Å; Y429-A442 PolarHBondContact N-O 3.36Å; Y429-A442 PolarHBondContact O-N 3.19Å; Y429-A442 VanDerWaalsContact O-N 3.11Å
430	V	98.9	Very high	98.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122	-170	-171.1	0	0	0	0	109.7	S238 L239 V314 M425 F428 F432 I439 G440 F441	S238-V430 CarbonylContact C-O 3.54Å; S238-V430 WeakPolarHBondContact CA-O 3.46Å; S238-V430 WeakPolarHBondContact CB-O 3.41Å; L239-V430 PolarHBondContact N-O 3.25Å; L239-V430 PolarHBondContact O-N 2.86Å; V314-V430 HydrophobicContact CG1-CG1 4.29Å; M425-V430 HydrophobicContact CB-CG2 4.36Å; M425-V430 HydrophobicContact CE-CB 4.3Å; M425-V430 HydrophobicContact CE-CG1 4.5Å; M425-V430 HydrophobicContact CE-CG2 4.25Å; M425-V430 HydrophobicContact CG-CG2 4.31Å; F428-V430 HydrophobicContact CB-CG2 4.11Å; V430-F432 HydrophobicContact CB-CE2 4.03Å; V430-F432 HydrophobicContact CG1-CD2 4.22Å; V430-F432 HydrophobicContact CG1-CE2 3.57Å; V430-F432 HydrophobicContact CG1-CZ 3.78Å; V430-I439 HydrophobicContact CG1-CG2 3.68Å; V430-G440 CarbonylContact C-O 3.5Å; V430-G440 WeakPolarHBondContact CA-O 3.33Å; V430-F441 HydrophobicContact CG1-CE1 4.07Å; V430-F441 HydrophobicContact CG1-CZ 4.27Å; V430-F441 HydrophobicContact CG2-CD1 4.1Å; V430-F441 HydrophobicContact CG2-CE1 3.99Å
431	V	98.9	Very high	98.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	116.4	-177.7	-177.4	0	0	0	0	109.5	F236 V266 L275 Y429 D433 I439 G440	F236-V431 HydrophobicContact CD2-CG1 4.39Å; V266-V431 HydrophobicContact CG1-CG2 4.34Å; V266-V431 HydrophobicContact CG2-CG1 3.83Å; V266-V431 HydrophobicContact CG2-CG2 4.12Å; L275-V431 HydrophobicContact CD1-CG2 4.24Å; L275-V431 HydrophobicContact CD2-CG2 3.75Å; Y429-V431 HydrophobicContact CD1-CG2 4.24Å; Y429-V431 HydrophobicContact CE1-CG2 4.06Å; V431-D433 HydrophobicContact CG1-CB 4.44Å; V431-D433 PolarHBondContact O-N 2.95Å; V431-I439 CarbonylContact O-C 3.5Å; V431-I439 WeakPolarHBondContact O-CA 3.36Å; V431-G440 PolarHBondContact N-O 2.92Å; V431-G440 PolarHBondContact O-N 3.19Å
432	F	98.8	Very high	98.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	82.7	176.6	-63.4	-95.8	0	0	0	109.5	T120 F236 F237 L239 Y286 V314 M425 V430 R434 I439	T120-F432 HydrophobicContact CG2-CD1 4.47Å; T120-F432 HydrophobicContact CG2-CE1 3.91Å; T120-F432 HydrophobicContact CG2-CE2 4.24Å; T120-F432 HydrophobicContact CG2-CZ 3.78Å; F236-F432 VanDerWaalsContact CA-O 3.25Å; F236-F432 WeakPolarHBondContact CA-O 3.27Å; F236-F432 WeakPolarHBondContact CB-O 3Å; F237-F432 HydrophobicContact CD1-CB 4.08Å; F237-F432 HydrophobicContact CD2-CB 4.16Å; F237-F432 AromaticContact CD2-CD2 3.88Å; F237-F432 HydrophobicContact CD2-CD2 3.88Å; F237-F432 HydrophobicContact CD2-CG 4.27Å; F237-F432 HydrophobicContact CE1-CB 3.71Å; F237-F432 HydrophobicContact CE1-CG 4.24Å; F237-F432 HydrophobicContact CE2-CB 3.77Å; F237-F432 HydrophobicContact CE2-CD1 4.34Å; F237-F432 AromaticContact CE2-CD2 3.31Å; F237-F432 HydrophobicContact CE2-CD2 3.31Å; F237-F432 AromaticContact CE2-CE2 3.95Å; F237-F432 HydrophobicContact CE2-CE2 3.95Å; F237-F432 AromaticContact CE2-CG 3.55Å; F237-F432 HydrophobicContact CE2-CG 3.55Å; F237-F432 HydrophobicContact CG-CB 4.3Å; F237-F432 HydrophobicContact CZ-CB 3.52Å; F237-F432 HydrophobicContact CZ-CD1 4.05Å; F237-F432 AromaticContact CZ-CD2 3.83Å; F237-F432 HydrophobicContact CZ-CD2 3.83Å; F237-F432 AromaticContact CZ-CG 3.53Å; F237-F432 HydrophobicContact CZ-CG 3.53Å; F237-F432 PolarHBondContact N-O 2.82Å; F237-F432 WeakPolarHBondContact O-CA 3.12Å; F237-F432 PolarHBondContact O-N 3.05Å; L239-F432 HydrophobicContact CB-CE2 4.36Å; L239-F432 HydrophobicContact CD1-CE2 3.77Å; L239-F432 HydrophobicContact CD1-CZ 4.38Å; L239-F432 HydrophobicContact CG-CD2 4.46Å; L239-F432 HydrophobicContact CG-CE2 4.05Å; Y286-F432 AromaticContact CD1-CD1 3.51Å; Y286-F432 HydrophobicContact CD1-CD1 3.51Å; Y286-F432 HydrophobicContact CD1-CE1 4.14Å; Y286-F432 AromaticContact CD2-CD1 3.75Å; Y286-F432 HydrophobicContact CD2-CD1 3.75Å; Y286-F432 AromaticContact CD2-CE1 3.74Å; Y286-F432 HydrophobicContact CD2-CE1 3.74Å; Y286-F432 HydrophobicContact CE1-CB 4.16Å; Y286-F432 AromaticContact CE1-CD1 3.64Å; Y286-F432 HydrophobicContact CE1-CD1 3.64Å; Y286-F432 HydrophobicContact CE1-CG 4.37Å; Y286-F432 AromaticContact CE2-CD1 3.88Å; Y286-F432 HydrophobicContact CE2-CD1 3.88Å; Y286-F432 HydrophobicContact CE2-CE1 4.2Å; Y286-F432 AromaticContact CG-CD1 3.56Å; Y286-F432 HydrophobicContact CG-CD1 3.56Å; Y286-F432 AromaticContact CG-CE1 3.7Å; Y286-F432 HydrophobicContact CG-CE1 3.7Å; Y286-F432 AromaticContact CZ-CD1 3.84Å; V314-F432 HydrophobicContact CB-CE1 4.17Å; V314-F432 HydrophobicContact CB-CZ 4.4Å; V314-F432 HydrophobicContact CG1-CE1 3.95Å; V314-F432 HydrophobicContact CG1-CZ 3.68Å; M425-F432 HydrophobicContact CE-CE2 4Å; M425-F432 HydrophobicContact CE-CZ 3.81Å; V430-F432 HydrophobicContact CB-CE2 4.03Å; V430-F432 HydrophobicContact CG1-CD2 4.22Å; V430-F432 HydrophobicContact CG1-CE2 3.57Å; V430-F432 HydrophobicContact CG1-CZ 3.78Å; F432-R434 PolarHBondContact O-N 2.89Å; F432-R434 VanDerWaalsContact O-N 3.1Å; F432-I439 HydrophobicContact CD1-CD1 4.46Å; F432-I439 HydrophobicContact CE1-CD1 4.47Å
433	D	98.6	Very high	98.4	Very high	11 Å²	11	20.5 Å²	20.5	6%	0.059	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	77.1	-178.8	-171.8	-10.3	0	0	0	110.2	F236 V431 E435 K436 K437 R438	F236-D433 HydrophobicContact CB-CB 4.46Å; V431-D433 HydrophobicContact CG1-CB 4.44Å; V431-D433 PolarHBondContact O-N 2.95Å; D433-E435 VanDerWaalsContact C-N 3.29Å; D433-E435 PolarHBondContact O-N 2.82Å; D433-K436 CarbonylContact O-C 3.58Å; D433-K436 PolarHBondContact O-N 2.84Å; D433-K436 WeakPolarHBondContact OD1-CB 3.48Å; D433-K436 PolarHBondContact OD1-N 2.85Å; D433-K436 WeakPolarHBondContact OD2-CD 3.42Å; D433-K437 WeakPolarHBondContact O-CA 3.47Å; D433-K437 PolarHBondContact O-N 2.75Å; D433-R438 CarbonylContact C-O 3.54Å; D433-R438 WeakPolarHBondContact CA-O 3.41Å; D433-R438 HydrophobicContact CB-CG 3.75Å; D433-R438 WeakPolarHBondContact CB-O 3.47Å; D433-R438 PolarHBondContact N-O 3.34Å; D433-R438 PolarHBondContact O-N 2.79Å; D433-R438 IonicContact OD2-CZ 2.75Å; D433-R438 IonicContact OD2-NE 3.37Å; D433-R438 PolarHBondContact OD2-NE 2.81Å; D433-R438 IonicContact OD2-NH2 3.48Å; D433-R438 PolarHBondContact OD2-NH2 2.94Å; D433-R438 VanDerWaalsContact OD2-NH2 3.17Å
434	R	98.4	Very high	98.5	Very high	6 Å²	6	20.5 Å²	20.5	2%	0.023	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-35.5	-179.7	-58.9	168	63.5	135.4	-7.3	111.2	L208 A209 Y210 D225 N235 Y286 F432 K436 K437	L208-R434 PolarHBondContact O-NH1 2.9Å; A209-R434 PolarHBondContact O-NH1 2.95Å; Y210-R434 HydrophobicContact CE1-CB 4.44Å; Y210-R434 HydrophobicContact CE1-CG 4.25Å; D225-R434 IonicContact OD1-NH2 2.62Å; D225-R434 PolarHBondContact OD1-NH2 2.67Å; D225-R434 IonicContact OD2-CZ 2.82Å; D225-R434 IonicContact OD2-NH1 3.4Å; D225-R434 IonicContact OD2-NH2 2.99Å; D225-R434 PolarHBondContact OD2-NH2 2.78Å; N235-R434 CarbonylContact O-C 3.59Å; N235-R434 WeakPolarHBondContact O-CB 3.3Å; N235-R434 PolarHBondContact O-N 3.02Å; N235-R434 WeakPolarHBondContact OD1-CB 3.44Å; N235-R434 PolarHBondContact OD1-NE 3.31Å; Y286-R434 HydrophobicContact CE1-CG 4.06Å; Y286-R434 WeakPolarHBondContact OH-CD 3.3Å; Y286-R434 PolarHBondContact OH-NH1 2.78Å; F432-R434 PolarHBondContact O-N 2.89Å; F432-R434 VanDerWaalsContact O-N 3.1Å; R434-K436 VanDerWaalsContact C-N 3.33Å; R434-K436 PolarHBondContact O-N 3.48Å; R434-K437 PolarHBondContact O-N 3.09Å
435	E	97.3	Very high	98.4	Very high	126 Å²	126	23.6 Å²	23.6	59%	0.589	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-43.5	176.6	-171.3	175.2	-176	0	0	112.3	N235 D433	N235-E435 HydrophobicContact CB-CB 4.22Å; N235-E435 PolarHBondContact O-N 3.41Å; D433-E435 VanDerWaalsContact C-N 3.29Å; D433-E435 PolarHBondContact O-N 2.82Å
436	K	98	Very high	98.3	Very high	124 Å²	124	23.7 Å²	23.7	54%	0.539	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	11.3	178.3	-61.9	179.5	-179.3	171.6	0	114	D433 R434 R438	D433-K436 CarbonylContact O-C 3.58Å; D433-K436 PolarHBondContact O-N 2.84Å; D433-K436 WeakPolarHBondContact OD1-CB 3.48Å; D433-K436 PolarHBondContact OD1-N 2.85Å; D433-K436 WeakPolarHBondContact OD2-CD 3.42Å; R434-K436 VanDerWaalsContact C-N 3.33Å; R434-K436 PolarHBondContact O-N 3.48Å; K436-R438 HydrophobicContact CB-CG 3.99Å; K436-R438 VanDerWaalsContact CD-CZ 3.48Å; K436-R438 PolarHBondContact O-N 2.79Å
437	K	98.3	Very high	98.1	Very high	102 Å²	102	23.8 Å²	23.8	44%	0.443	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	51.8	178	-53.3	-172.2	-176.9	-159.3	0	113	I280 E283 D433 R434	I280-K437 HydrophobicContact CB-CB 4.5Å; I280-K437 WeakPolarHBondContact CB-O 3.03Å; I280-K437 PolarHBondContact N-O 3.22Å; E283-K437 WeakPolarHBondContact OE1-CE 3.41Å; E283-K437 IonicContact OE1-NZ 2.71Å; E283-K437 PolarHBondContact OE1-NZ 2.98Å; E283-K437 WeakPolarHBondContact OE2-CE 3.44Å; E283-K437 IonicContact OE2-NZ 2.65Å; E283-K437 PolarHBondContact OE2-NZ 3.27Å; D433-K437 WeakPolarHBondContact O-CA 3.47Å; D433-K437 PolarHBondContact O-N 2.75Å; R434-K437 PolarHBondContact O-N 3.09Å
438	R	98.4	Very high	98	Very high	31 Å²	31	25.6 Å²	25.6	12%	0.117	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	158.5	-176.9	62.2	-169	-174.3	156.4	14.2	112.3	Y277 T278 E377 D433 K436	Y277-R438 HydrophobicContact CD1-CB 4.3Å; Y277-R438 HydrophobicContact CD1-CG 3.71Å; Y277-R438 HydrophobicContact CE1-CG 4.32Å; Y277-R438 HydrophobicContact CG-CG 4.39Å; T278-R438 CarbonylContact O-C 3.6Å; T278-R438 VanDerWaalsContact O-CA 3.26Å; T278-R438 WeakPolarHBondContact O-CA 3.31Å; T278-R438 WeakPolarHBondContact O-CB 3.45Å; E377-R438 VanDerWaalsContact CD-NH1 3.28Å; E377-R438 WeakPolarHBondContact OE1-CD 3.42Å; E377-R438 IonicContact OE1-CZ 3.32Å; E377-R438 IonicContact OE1-NE 2.66Å; E377-R438 IonicContact OE1-NH1 3.76Å; E377-R438 PolarHBondContact OE1-NH1 2.97Å; E377-R438 IonicContact OE2-NH1 2.57Å; E377-R438 PolarHBondContact OE2-NH1 2.74Å; D433-R438 CarbonylContact C-O 3.54Å; D433-R438 WeakPolarHBondContact CA-O 3.41Å; D433-R438 HydrophobicContact CB-CG 3.75Å; D433-R438 WeakPolarHBondContact CB-O 3.47Å; D433-R438 PolarHBondContact N-O 3.34Å; D433-R438 PolarHBondContact O-N 2.79Å; D433-R438 IonicContact OD2-CZ 2.75Å; D433-R438 IonicContact OD2-NE 3.37Å; D433-R438 PolarHBondContact OD2-NE 2.81Å; D433-R438 IonicContact OD2-NH2 3.48Å; D433-R438 PolarHBondContact OD2-NH2 2.94Å; D433-R438 VanDerWaalsContact OD2-NH2 3.17Å; K436-R438 HydrophobicContact CB-CG 3.99Å; K436-R438 VanDerWaalsContact CD-CZ 3.48Å; K436-R438 PolarHBondContact O-N 2.79Å
439	I	98.8	Very high	97.7	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	125.5	175.9	-51.5	-179.2	0	0	0	109	Y277 T278 I280 Y286 V288 V314 V430 V431 F432 F441	Y277-I439 CarbonylContact C-O 3.5Å; Y277-I439 WeakPolarHBondContact CA-O 3.39Å; T278-I439 HydrophobicContact CG2-CB 4.03Å; T278-I439 PolarHBondContact N-O 2.84Å; T278-I439 PolarHBondContact O-N 2.83Å; I280-I439 HydrophobicContact CD1-CG1 4.05Å; I280-I439 HydrophobicContact CG1-CD1 4.22Å; I280-I439 HydrophobicContact CG1-CG1 3.73Å; Y286-I439 HydrophobicContact CD1-CD1 4.24Å; Y286-I439 HydrophobicContact CG-CD1 4.34Å; V288-I439 HydrophobicContact CG1-CD1 3.59Å; V288-I439 HydrophobicContact CG1-CG1 4.3Å; V314-I439 HydrophobicContact CB-CD1 4.27Å; V314-I439 HydrophobicContact CG2-CD1 3.76Å; V430-I439 HydrophobicContact CG1-CG2 3.68Å; V431-I439 CarbonylContact O-C 3.5Å; V431-I439 WeakPolarHBondContact O-CA 3.36Å; F432-I439 HydrophobicContact CD1-CD1 4.46Å; F432-I439 HydrophobicContact CE1-CD1 4.47Å; I439-F441 HydrophobicContact CB-CE2 4.19Å; I439-F441 HydrophobicContact CG2-CD2 4.31Å; I439-F441 HydrophobicContact CG2-CE2 3.61Å; I439-F441 HydrophobicContact CG2-CZ 3.92Å
440	G	98.7	Very high	97.4	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	142.5	177.4	0	0	0	0	0	112.1	W276 Y277 V430 V431	W276-G440 CarbonylContact O-C 3.55Å; W276-G440 VanDerWaalsContact O-CA 3.27Å; W276-G440 WeakPolarHBondContact O-CA 3.3Å; Y277-G440 VanDerWaalsContact CD1-CA 3.43Å; V430-G440 CarbonylContact C-O 3.5Å; V430-G440 WeakPolarHBondContact CA-O 3.33Å; V431-G440 PolarHBondContact N-O 2.92Å; V431-G440 PolarHBondContact O-N 3.19Å
441	F	98.9	Very high	97.1	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	134.1	172.6	-66.4	-95.5	0	0	0	110	W276 T278 V314 L374 F383 I385 F428 V430 I439 V457	W276-F441 PolarHBondContact N-O 2.9Å; W276-F441 PolarHBondContact O-N 2.71Å; T278-F441 HydrophobicContact CG2-CE2 4Å; V314-F441 HydrophobicContact CG2-CZ 3.96Å; L374-F441 HydrophobicContact CD1-CD2 3.94Å; L374-F441 HydrophobicContact CD1-CE2 3.65Å; L374-F441 HydrophobicContact CD1-CZ 4.17Å; F383-F441 HydrophobicContact CE2-CB 4.29Å; F383-F441 HydrophobicContact CE2-CD2 4.22Å; F383-F441 HydrophobicContact CZ-CD2 4.13Å; I385-F441 HydrophobicContact CD1-CD1 4.24Å; I385-F441 HydrophobicContact CD1-CE1 4.15Å; I385-F441 HydrophobicContact CG2-CB 3.92Å; I385-F441 HydrophobicContact CG2-CD1 4.31Å; I385-F441 HydrophobicContact CG2-CG 4.08Å; F428-F441 HydrophobicContact CB-CD1 4.11Å; F428-F441 HydrophobicContact CD2-CD1 4.36Å; F428-F441 HydrophobicContact CG-CD1 4.21Å; V430-F441 HydrophobicContact CG1-CE1 4.07Å; V430-F441 HydrophobicContact CG1-CZ 4.27Å; V430-F441 HydrophobicContact CG2-CD1 4.1Å; V430-F441 HydrophobicContact CG2-CE1 3.99Å; I439-F441 HydrophobicContact CB-CE2 4.19Å; I439-F441 HydrophobicContact CG2-CD2 4.31Å; I439-F441 HydrophobicContact CG2-CE2 3.61Å; I439-F441 HydrophobicContact CG2-CZ 3.92Å; F441-V457 HydrophobicContact CB-CG1 4.5Å; F441-V457 HydrophobicContact CB-CG2 4.42Å
442	A	98.8	Very high	96.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	161.1	165.9	0	0	0	0	0	109.1	Y271 L275 F428 Y429 S444	Y271-A442 HydrophobicContact CD2-CB 3.45Å; Y271-A442 VanDerWaalsContact CD2-CB 3.45Å; Y271-A442 HydrophobicContact CE2-CB 4.23Å; Y271-A442 HydrophobicContact CG-CB 3.78Å; L275-A442 HydrophobicContact CD2-CB 3.62Å; L275-A442 HydrophobicContact CG-CB 4.03Å; F428-A442 CarbonylContact C-O 3.56Å; F428-A442 WeakPolarHBondContact CA-O 3.42Å; F428-A442 WeakPolarHBondContact CB-O 3.31Å; Y429-A442 PolarHBondContact N-O 3.36Å; Y429-A442 PolarHBondContact O-N 3.19Å; Y429-A442 VanDerWaalsContact O-N 3.11Å; A442-S444 PolarHBondContact O-N 3.4Å
443	V	98.7	Very high	96.7	Very high	14 Å²	14	52.2 Å²	52.2	9%	0.085	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	126.1	179.3	178.8	0	0	0	0	109.4	Y271 V272 H447 A455 V457	Y271-V443 CarbonylContact C-O 3.58Å; Y271-V443 WeakPolarHBondContact CA-O 3.4Å; Y271-V443 VanDerWaalsContact CB-O 3.32Å; Y271-V443 WeakPolarHBondContact CB-O 3.5Å; V272-V443 HydrophobicContact CG2-CB 3.75Å; V272-V443 HydrophobicContact CG2-CG1 3.86Å; V272-V443 PolarHBondContact N-O 3.13Å; V443-H447 VanDerWaalsContact CG1-CE1 3.45Å; V443-H447 WeakPolarHBondContact CG1-CE1 3.36Å; V443-A455 HydrophobicContact CG1-CB 4.47Å; V443-A455 WeakPolarHBondContact CG2-O 3.49Å; V443-V457 HydrophobicContact CG2-CG2 4.03Å
444	S	98.2	Very high	96.6	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	142.4	-179.6	175	0	0	0	0	111.4	Q240 G427 A442 C446 H447	Q240-S444 WeakPolarHBondContact CG-OG 3.31Å; Q240-S444 PolarHBondContact NE2-OG 3.14Å; G427-S444 PolarHBondContact O-N 2.75Å; A442-S444 PolarHBondContact O-N 3.4Å; S444-C446 PolarHBondContact O-N 3.21Å; S444-C446 PolarHBondContact OG-N 3.08Å; S444-C446 VanDerWaalsContact OG-N 3.13Å; S444-C446 PolarHBondContact OG-SG 2.82Å; S444-H447 PolarHBondContact O-ND1 3.03Å
445	T	96.7	Very high	96.6	Very high	67 Å²	67	55.2 Å²	55.2	41%	0.411	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-12.8	171.4	49.2	0	0	0	0	114.1	Q240 S269 L270 V272	Q240-T445 PolarHBondContact NE2-OG1 2.76Å; S269-T445 WeakPolarHBondContact O-CG2 3.34Å; S269-T445 PolarHBondContact O-OG1 2.98Å; L270-T445 VanDerWaalsContact C-OG1 3.3Å; L270-T445 WeakPolarHBondContact CA-OG1 3.14Å; L270-T445 PolarHBondContact O-N 2.94Å; L270-T445 PolarHBondContact O-OG1 2.88Å; V272-T445 HydrophobicContact CG1-CG2 3.86Å
446	C	95.8	Very high	96.7	Very high	3 Å²	3	50.1 Å²	50.1	2%	0.02	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	10.4	179.6	71.9	0	0	0	0	114.3	C242 F246 S444 V448	C242-C446 WeakPolarHBondContact CA-SG 3.14Å; C242-C446 HydrophobicContact CB-CB 3.83Å; C242-C446 WeakPolarHBondContact CB-SG 3.27Å; C242-C446 WeakPolarHBondContact SG-CB 3.36Å; C242-C446 CovalentContact SG-SG 2.04Å; C242-C446 PolarHBondContact SG-SG 3.26Å; F246-C446 HydrophobicContact CD1-CB 4.11Å; F246-C446 HydrophobicContact CD2-CB 3.51Å; F246-C446 WeakPolarHBondContact CD2-O 3.43Å; F246-C446 HydrophobicContact CE1-CB 4.01Å; F246-C446 HydrophobicContact CE2-CB 3.42Å; F246-C446 VanDerWaalsContact CE2-CB 3.42Å; F246-C446 HydrophobicContact CG-CB 3.86Å; F246-C446 HydrophobicContact CZ-CB 3.67Å; S444-C446 PolarHBondContact O-N 3.21Å; S444-C446 PolarHBondContact OG-N 3.08Å; S444-C446 VanDerWaalsContact OG-N 3.13Å; S444-C446 PolarHBondContact OG-SG 2.82Å; C446-V448 PolarHBondContact O-N 2.94Å
447	H	95.3	Very high	96.7	Very high	14 Å²	14	45.3 Å²	45.3	7%	0.065	22%	0.222	C	C	.	.			trans	-65.8	136.1	177	78.7	-76.1	0	0	0	111.1	V443 S444 H449 T454 A455	V443-H447 VanDerWaalsContact CG1-CE1 3.45Å; V443-H447 WeakPolarHBondContact CG1-CE1 3.36Å; S444-H447 PolarHBondContact O-ND1 3.03Å; H447-H449 AromaticContact CD2-ND1 3.79Å; H447-H449 AromaticContact CE1-ND1 3.71Å; H447-H449 AromaticContact NE2-CG 3.63Å; H447-H449 AromaticContact NE2-ND1 3.41Å; H447-H449 PolarHBondContact NE2-ND1 2.77Å; H447-H449 PolarHBondContact O-ND1 3.36Å; H447-T454 PolarHBondContact CE1-OG1 2.81Å; H447-T454 VanDerWaalsContact CE1-OG1 3.23Å; H447-T454 PolarHBondContact NE2-OG1 3.29Å; H447-A455 PolarHBondContact NE2-N 2.57Å
448	V	94.1	Very high	96.7	Very high	38 Å²	38	43.8 Å²	43.8	23%	0.23	22%	0.217	C	C	.	.			trans	-77	130.7	177.4	-174.3	0	0	0	0	109.5	Q390 Q391 C446	Q390-V448 HydrophobicContact CB-CB 4.18Å; Q390-V448 HydrophobicContact CB-CG1 4.04Å; Q390-V448 WeakPolarHBondContact CB-O 3.26Å; Q390-V448 HydrophobicContact CG-CG1 4.11Å; Q391-V448 PolarHBondContact NE2-O 2.93Å; C446-V448 PolarHBondContact O-N 2.94Å
449	H	93.5	Very high	96.5	Very high	104 Å²	104	43.8 Å²	43.8	48%	0.481	23%	0.227	S	C	.	.			trans	-150.4	171.2	-177.5	61.3	-82.1	0	0	0	111.4	L388 H447 R453	L388-H449 HydrophobicContact CD1-CB 3.69Å; H447-H449 AromaticContact CD2-ND1 3.79Å; H447-H449 AromaticContact CE1-ND1 3.71Å; H447-H449 AromaticContact NE2-CG 3.63Å; H447-H449 AromaticContact NE2-ND1 3.41Å; H447-H449 PolarHBondContact NE2-ND1 2.77Å; H447-H449 PolarHBondContact O-ND1 3.36Å; H449-R453 WeakPolarHBondContact CB-O 3.42Å
450	D	92.3	Very high	96.3	Very high	29 Å²	29	46.8 Å²	46.8	16%	0.155	25%	0.246	C	C	.	.			trans	-108.3	174.4	174.2	60.8	53.2	0	0	0	110.8	Q390 F452 R453	Q390-D450 PolarHBondContact NE2-OD2 3.06Å; D450-F452 PolarHBondContact O-N 3.11Å; D450-F452 VanDerWaalsContact O-N 3.12Å; D450-F452 WeakPolarHBondContact OD1-CA 3.49Å; D450-F452 WeakPolarHBondContact OD1-CB 3.41Å; D450-F452 PolarHBondContact OD1-N 3.41Å; D450-R453 PolarHBondContact OD1-N 3.18Å; D450-R453 IonicContact OD2-CZ 3.52Å; D450-R453 IonicContact OD2-NE 3.67Å; D450-R453 IonicContact OD2-NH2 3.72Å; D450-R453 PolarHBondContact OD2-NH2 3.26Å
451	E	92	Very high	96.1	Very high	189 Å²	189	49.8 Å²	49.8	88%	0.883	26%	0.259	S	S	*	.	S	Bend	trans	-64.5	-14.6	-178.8	-62.8	-176.1	167.5	0	0	113.7
452	F	94	Very high	95.7	Very high	182 Å²	182	56.9 Å²	56.9	80%	0.798	29%	0.292	S	S	*	.	S	Bend	trans	-104.5	-30.8	-171.3	-55	-75.8	0	0	0	113.3	D450	D450-F452 PolarHBondContact O-N 3.11Å; D450-F452 VanDerWaalsContact O-N 3.12Å; D450-F452 WeakPolarHBondContact OD1-CA 3.49Å; D450-F452 WeakPolarHBondContact OD1-CB 3.41Å; D450-F452 PolarHBondContact OD1-N 3.41Å
453	R	96.3	Very high	94.6	Very high	55 Å²	55	58 Å²	58	21%	0.208	30%	0.304	C	S	.	.			trans	-137	140.9	-174.4	-62.5	175.4	-63	176.8	5.7	110.5	W364 F367 L388 H449 D450	W364-R453 PolarHBondContact O-NH2 3.45Å; F367-R453 PolarHBondContact O-NH1 2.65Å; L388-R453 HydrophobicContact CD1-CB 4.44Å; L388-R453 WeakPolarHBondContact CD1-O 3.41Å; L388-R453 HydrophobicContact CD2-CB 3.85Å; H449-R453 WeakPolarHBondContact CB-O 3.42Å; D450-R453 PolarHBondContact OD1-N 3.18Å; D450-R453 IonicContact OD2-CZ 3.52Å; D450-R453 IonicContact OD2-NE 3.67Å; D450-R453 IonicContact OD2-NH2 3.72Å; D450-R453 PolarHBondContact OD2-NH2 3.26Å
454	T	97.2	Very high	93	Very high	78 Å²	78	63.4 Å²	63.4	48%	0.479	34%	0.336	S	S	.	.			trans	-123.3	154.2	174.2	-176.9	0	0	0	0	109.2	H447	H447-T454 PolarHBondContact CE1-OG1 2.81Å; H447-T454 VanDerWaalsContact CE1-OG1 3.23Å; H447-T454 PolarHBondContact NE2-OG1 3.29Å
455	A	97.8	Very high	91.4	Very high	2 Å²	2	69.1 Å²	69.1	2%	0.017	37%	0.367	C	S	.	.			trans	-61.7	147.6	168.2	0	0	0	0	0	109.2	S386 F428 V443 H447	S386-A455 WeakPolarHBondContact O-CA 3.24Å; F428-A455 HydrophobicContact CE1-CB 4.41Å; V443-A455 HydrophobicContact CG1-CB 4.47Å; V443-A455 WeakPolarHBondContact CG2-O 3.49Å; H447-A455 PolarHBondContact NE2-N 2.57Å
456	S	98.4	Very high	90.4	Very high	19 Å²	19	66.6 Å²	66.6	13%	0.133	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	149.8	-177.3	78.9	0	0	0	0	113.2	I385 S386 E458	I385-S456 CarbonylContact C-O 3.57Å; I385-S456 WeakPolarHBondContact CA-O 3.37Å; S386-S456 WeakPolarHBondContact CB-OG 3.37Å; S386-S456 PolarHBondContact N-O 2.98Å; S386-S456 PolarHBondContact O-N 2.83Å; S386-S456 PolarHBondContact OG-OG 3.38Å; S456-E458 WeakPolarHBondContact CB-OE1 3.36Å; S456-E458 PolarHBondContact OG-OE1 2.88Å
457	V	98.6	Very high	89.1	Confident	23 Å²	23	71.2 Å²	71.2	14%	0.139	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	114.9	168.4	-174.2	0	0	0	0	106.8	W276 F383 R384 I385 F428 F441 V443	W276-V457 HydrophobicContact CB-CG1 3.79Å; W276-V457 HydrophobicContact CG-CG1 3.85Å; F383-V457 HydrophobicContact CD2-CG1 3.92Å; F383-V457 HydrophobicContact CE2-CG1 4.26Å; R384-V457 WeakPolarHBondContact O-CA 3.39Å; I385-V457 HydrophobicContact CG2-CG1 4.22Å; I385-V457 HydrophobicContact CG2-CG2 4.12Å; F428-V457 HydrophobicContact CD1-CG2 3.59Å; F428-V457 HydrophobicContact CE1-CG2 3.63Å; F441-V457 HydrophobicContact CB-CG1 4.5Å; F441-V457 HydrophobicContact CB-CG2 4.42Å; V443-V457 HydrophobicContact CG2-CG2 4.03Å
458	E	97.8	Very high	88.4	Confident	71 Å²	71	75.1 Å²	75.1	33%	0.332	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	143.7	-169	-66.7	167.5	-151.9	0	0	111.2	F383 R384 S456 F461	F383-E458 CarbonylContact C-O 3.11Å; F383-E458 VanDerWaalsContact CA-O 3.28Å; F383-E458 WeakPolarHBondContact CA-O 2.94Å; F383-E458 VanDerWaalsContact CB-O 3.31Å; F383-E458 WeakPolarHBondContact CB-O 3.31Å; R384-E458 HydrophobicContact CG-CB 4.15Å; R384-E458 IonicContact CZ-OE2 3.76Å; R384-E458 PolarHBondContact N-O 2.98Å; R384-E458 IonicContact NE-OE2 3.02Å; R384-E458 PolarHBondContact NE-OE2 3.39Å; R384-E458 IonicContact NH2-OE2 3.81Å; R384-E458 PolarHBondContact NH2-OE2 2.89Å; R384-E458 PolarHBondContact O-N 3.02Å; S456-E458 WeakPolarHBondContact CB-OE1 3.36Å; S456-E458 PolarHBondContact OG-OE1 2.88Å; E458-F461 HydrophobicContact CB-CE2 4.32Å; E458-F461 HydrophobicContact CB-CZ 4.43Å; E458-F461 VanDerWaalsContact O-CE2 3.28Å; E458-F461 WeakPolarHBondContact O-CE2 3.13Å
459	G	94.6	Very high	88.2	Confident	31 Å²	31	73.5 Å²	73.5	32%	0.32	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	178.7	179.2	178.5	0	0	0	0	0	111.6	W276	W276-G459 VanDerWaalsContact CZ2-O 3.22Å; W276-G459 WeakPolarHBondContact CZ2-O 3.49Å
460	P	95.4	Very high	87.8	Confident	62 Å²	62	68.8 Å²	68.8	40%	0.403	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-85.7	148.4	-2.6	33.2	-29.3	0	0	0	111.4	W276 Q381 S382	W276-P460 HydrophobicContact CH2-CB 3.89Å; W276-P460 HydrophobicContact CH2-CG 4.2Å; W276-P460 HydrophobicContact CZ3-CB 4Å; Q381-P460 HydrophobicContact CB-CB 4.33Å; Q381-P460 HydrophobicContact CG-CB 4.27Å; S382-P460 CarbonylContact O-C 3.51Å
461	F	94.6	Very high	87.4	Confident	64 Å²	64	70.2 Å²	70.2	28%	0.281	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	131.7	167.2	-60.7	-84.2	0	0	0	109.4	Y373 Q381 S382 R384 E458	Y373-F461 AromaticContact CD1-CD2 3.99Å; Y373-F461 HydrophobicContact CD1-CD2 3.99Å; Y373-F461 HydrophobicContact CD1-CE2 4.48Å; Y373-F461 HydrophobicContact CD1-CG 4.32Å; Y373-F461 HydrophobicContact CE1-CB 4.43Å; Y373-F461 HydrophobicContact CE1-CD1 4.22Å; Y373-F461 AromaticContact CE1-CD2 3.65Å; Y373-F461 HydrophobicContact CE1-CD2 3.65Å; Y373-F461 HydrophobicContact CE1-CE1 4.41Å; Y373-F461 AromaticContact CE1-CE2 3.87Å; Y373-F461 HydrophobicContact CE1-CE2 3.87Å; Y373-F461 AromaticContact CE1-CG 3.84Å; Y373-F461 HydrophobicContact CE1-CG 3.84Å; Y373-F461 HydrophobicContact CE1-CZ 4.25Å; Q381-F461 CarbonylContact C-O 3.42Å; Q381-F461 VanDerWaalsContact CA-O 3.29Å; Q381-F461 WeakPolarHBondContact CA-O 3.41Å; S382-F461 PolarHBondContact N-O 2.55Å; S382-F461 PolarHBondContact O-N 2.92Å; S382-F461 PolarHBondContact OG-O 2.8Å; R384-F461 HydrophobicContact CB-CE2 4.16Å; R384-F461 HydrophobicContact CG-CE2 3.78Å; R384-F461 HydrophobicContact CG-CZ 4.27Å; E458-F461 HydrophobicContact CB-CE2 4.32Å; E458-F461 HydrophobicContact CB-CZ 4.43Å; E458-F461 VanDerWaalsContact O-CE2 3.28Å; E458-F461 WeakPolarHBondContact O-CE2 3.13Å
462	H	90.8	Very high	86.8	Confident	149 Å²	149	67 Å²	67	69%	0.69	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	133	-179.6	-70.9	-90	0	0	0	111.3	Q381	Q381-H462 PolarHBondContact NE2-CE1 2.92Å; Q381-H462 VanDerWaalsContact NE2-CE1 3.34Å
463	G	75.6	Confident	85.6	Confident	24 Å²	24	64.3 Å²	64.3	25%	0.247	35%	0.349	C	S	.	.			trans	-142.7	154	175.5	0	0	0	0	0	110.9	N380	N380-G463 CarbonylContact C-O 3.54Å; N380-G463 WeakPolarHBondContact CA-O 3.33Å; N380-G463 PolarHBondContact O-N 3.24Å; N380-G463 VanDerWaalsContact O-N 3.1Å
464	V	63.2	Low	83.8	Confident	127 Å²	127	65.6 Å²	65.6	77%	0.77	36%	0.364	S	S	*	.	S	Bend	trans	-96	134.8	177	-173.2	0	0	0	0	108.3	L466	V464-L466 PolarHBondContact O-N 2.8Å
465	D	66	Low	81.4	Confident	120 Å²	120	70.4 Å²	70.4	64%	0.642	38%	0.381	S	S	*	.			trans	55.4	48.1	171.6	-58.7	-28.9	0	0	0	116.9	E467 D468	D465-E467 PolarHBondContact O-N 3.05Å; D465-D468 PolarHBondContact O-N 3.41Å
466	L	75.3	Confident	79.1	Confident	15 Å²	15	75.2 Å²	75.2	8%	0.079	41%	0.41	C	S	.	.	G	3₁₀ helix	trans	-63	-22.3	179.2	-58.7	179.7	0	0	0	114.2	V291 M375 R379 Q381 V464 D468 C469	V291-L466 HydrophobicContact CB-CD2 3.87Å; V291-L466 HydrophobicContact CG1-CB 3.98Å; V291-L466 HydrophobicContact CG1-CD1 4.47Å; V291-L466 HydrophobicContact CG1-CD2 3.87Å; V291-L466 HydrophobicContact CG1-CG 4.32Å; V291-L466 HydrophobicContact CG2-CD2 4.12Å; M375-L466 HydrophobicContact CE-CB 3.8Å; M375-L466 WeakPolarHBondContact CE-O 3.17Å; M375-L466 HydrophobicContact CG-CB 4.49Å; R379-L466 WeakPolarHBondContact O-CB 3.49Å; R379-L466 WeakPolarHBondContact O-CD1 3.41Å; Q381-L466 VanDerWaalsContact C-CD1 3.49Å; Q381-L466 WeakPolarHBondContact O-CD1 3.25Å; V464-L466 PolarHBondContact O-N 2.8Å; L466-D468 PolarHBondContact O-N 2.86Å; L466-C469 WeakPolarHBondContact O-CB 3.36Å; L466-C469 PolarHBondContact O-N 2.82Å
467	E	68.7	Low	77	Confident	99 Å²	99	78.4 Å²	78.4	46%	0.463	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-67.2	-23.8	177.9	-69.5	-155.1	152.3	0	0	113.2	M375 R379 D465 C469 G470	M375-E467 HydrophobicContact CE-CB 4.35Å; M375-E467 HydrophobicContact CE-CG 3.91Å; R379-E467 WeakPolarHBondContact CD-OE1 3.33Å; R379-E467 VanDerWaalsContact CZ-CD 3.46Å; R379-E467 IonicContact CZ-OE1 2.75Å; R379-E467 IonicContact CZ-OE2 2.67Å; R379-E467 IonicContact NE-OE1 2.84Å; R379-E467 PolarHBondContact NE-OE1 3.23Å; R379-E467 VanDerWaalsContact NH1-CD 3.26Å; R379-E467 IonicContact NH1-OE1 3.43Å; R379-E467 PolarHBondContact NH1-OE1 2.79Å; R379-E467 VanDerWaalsContact NH1-OE1 3.12Å; R379-E467 IonicContact NH1-OE2 3.42Å; R379-E467 PolarHBondContact NH1-OE2 3.49Å; R379-E467 IonicContact NH2-OE1 2.74Å; R379-E467 PolarHBondContact NH2-OE1 3.41Å; R379-E467 IonicContact NH2-OE2 3.47Å; D465-E467 PolarHBondContact O-N 3.05Å; E467-C469 PolarHBondContact O-N 3.02Å; E467-G470 PolarHBondContact O-N 3.17Å
468	D	81.1	Confident	75.1	Confident	96 Å²	96	85.4 Å²	85.4	51%	0.513	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-66.8	-18.8	176.8	-167	43.5	0	0	0	111.9	K305 D465 L466 G470	K305-D468 VanDerWaalsContact CE-CG 3.47Å; K305-D468 WeakPolarHBondContact CE-O 3Å; K305-D468 WeakPolarHBondContact CE-OD1 3.27Å; K305-D468 WeakPolarHBondContact CE-OD2 3.23Å; K305-D468 WeakPolarHBondContact CG-O 3.41Å; K305-D468 IonicContact NZ-OD1 3.99Å; K305-D468 PolarHBondContact NZ-OD1 3.28Å; K305-D468 IonicContact NZ-OD2 2.92Å; K305-D468 PolarHBondContact NZ-OD2 2.91Å; D465-D468 PolarHBondContact O-N 3.41Å; L466-D468 PolarHBondContact O-N 2.86Å; D468-G470 PolarHBondContact O-N 2.94Å
469	C	90	Very high	73.4	Confident	5 Å²	5	85.2 Å²	85.2	3%	0.034	46%	0.464	C	S	.	.	G	3₁₀ helix	trans	-69.1	-14.7	179.3	-58.3	0	0	0	0	114	I289 V291 C304 N308 L466 E467 Y471	I289-C469 HydrophobicContact CG2-CB 3.71Å; V291-C469 HydrophobicContact CG1-CB 4.4Å; C304-C469 HydrophobicContact CB-CB 3.68Å; C304-C469 WeakPolarHBondContact CB-SG 3.14Å; C304-C469 WeakPolarHBondContact SG-CA 3.37Å; C304-C469 WeakPolarHBondContact SG-CB 3.41Å; C304-C469 CovalentContact SG-SG 2.03Å; C304-C469 PolarHBondContact SG-SG 2.89Å; N308-C469 PolarHBondContact ND2-O 2.85Å; L466-C469 WeakPolarHBondContact O-CB 3.36Å; L466-C469 PolarHBondContact O-N 2.82Å; E467-C469 PolarHBondContact O-N 3.02Å; C469-Y471 PolarHBondContact O-N 3.25Å
470	G	84.6	Confident	72.3	Confident	5 Å²	5	87.3 Å²	87.3	5%	0.052	47%	0.47	C	S	.	.	S	Bend	trans	-70.8	122.8	177	0	0	0	0	0	112.5	E467 D468 N472	E467-G470 PolarHBondContact O-N 3.17Å; D468-G470 PolarHBondContact O-N 2.94Å; G470-N472 PolarHBondContact O-N 2.87Å
471	Y	82.8	Confident	71.2	Confident	58 Å²	58	89.7 Å²	89.7	23%	0.227	48%	0.479	C	S	.	.			trans	-71.8	116	173.3	-175.9	-100.6	0	0	0	110.1	R281 N308 Y309 D310 C469 I473	R281-Y471 PolarHBondContact NH1-O 2.62Å; R281-Y471 VanDerWaalsContact NH2-C 3.3Å; R281-Y471 PolarHBondContact NH2-O 3.3Å; N308-Y471 WeakPolarHBondContact O-CB 3.5Å; Y309-Y471 HydrophobicContact CD2-CD1 4.46Å; Y309-Y471 AromaticContact CD2-CD2 3.7Å; Y309-Y471 HydrophobicContact CD2-CD2 3.7Å; Y309-Y471 HydrophobicContact CD2-CE1 4.19Å; Y309-Y471 AromaticContact CD2-CE2 3.4Å; Y309-Y471 HydrophobicContact CD2-CE2 3.4Å; Y309-Y471 HydrophobicContact CD2-CG 4.22Å; Y309-Y471 AromaticContact CD2-CZ 3.66Å; Y309-Y471 HydrophobicContact CE2-CD2 4.41Å; Y309-Y471 HydrophobicContact CE2-CE1 4.22Å; Y309-Y471 AromaticContact CE2-CE2 3.67Å; Y309-Y471 HydrophobicContact CE2-CE2 3.67Å; Y309-Y471 AromaticContact CE2-CZ 3.54Å; Y309-Y471 WeakPolarHBondContact CE2-OH 3.46Å; D310-Y471 HydrophobicContact CB-CD1 3.86Å; D310-Y471 HydrophobicContact CB-CE1 3.98Å; D310-Y471 WeakPolarHBondContact O-CD1 3.46Å; C469-Y471 PolarHBondContact O-N 3.25Å; Y471-I473 HydrophobicContact CE1-CG1 4.15Å
472	N	80.1	Confident	70.4	Confident	123 Å²	123	91.3 Å²	91.3	66%	0.658	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-96.7	126.5	168.4	-64.4	-50.4	0	0	0	107.3	R281 G470 P474	R281-N472 PolarHBondContact NH2-OD1 2.77Å; G470-N472 PolarHBondContact O-N 2.87Å; N472-P474 WeakPolarHBondContact O-CD 3.3Å; N472-P474 VanDerWaalsContact O-N 3.12Å
473	I	68.3	Low	69.9	Low	124 Å²	124	87.8 Å²	87.8	64%	0.636	48%	0.478	S	S	*	.	P	Polyproline II helix	trans	-56.6	122.2	168.7	-58.7	171.8	0	0	0	105.6	Y471 Q475	Y471-I473 HydrophobicContact CE1-CG1 4.15Å; I473-Q475 PolarHBondContact O-N 3.41Å
474	P	58.2	Low	70.5	Confident	82 Å²	82	91.1 Å²	91.1	53%	0.532	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-53	122.7	172.8	-20.1	29.6	0	0	0	106.6	N472 T476	N472-P474 WeakPolarHBondContact O-CD 3.3Å; N472-P474 VanDerWaalsContact O-N 3.12Å; P474-T476 PolarHBondContact O-N 2.74Å
475	Q	47.5	Very low	71.6	Confident	179 Å²	179	87.6 Å²	87.6	84%	0.836	47%	0.473	S	S	*	.			trans	-61.3	89.8	167.3	-76.4	-175.8	-25.7	0	0	105.9	I473 D477	I473-Q475 PolarHBondContact O-N 3.41Å; Q475-D477 PolarHBondContact O-N 2.8Å
476	T	49.8	Very low	72.8	Confident	103 Å²	103	89.7 Å²	89.7	63%	0.632	47%	0.473	S	S	*	.			trans	-65.6	91.9	155.8	46.2	0	0	0	0	103.3	P474 E478	P474-T476 PolarHBondContact O-N 2.74Å; T476-E478 PolarHBondContact O-N 3.19Å
477	D	53	Low	73.6	Confident	87 Å²	87	93.6 Å²	93.6	47%	0.465	49%	0.493	S	S	.	.			trans	-37.6	109.1	172	-103.4	-16.3	0	0	0	107.3	Q475 S479 T480 L481	Q475-D477 PolarHBondContact O-N 2.8Å; D477-S479 VanDerWaalsContact CB-OG 3.32Å; D477-S479 WeakPolarHBondContact CB-OG 3.4Å; D477-S479 PolarHBondContact O-N 3.46Å; D477-T480 WeakPolarHBondContact CB-OG1 3.48Å; D477-T480 WeakPolarHBondContact O-CA 3.48Å; D477-T480 WeakPolarHBondContact O-CB 3.39Å; D477-T480 PolarHBondContact O-N 3.19Å; D477-L481 PolarHBondContact O-N 3.03Å
478	E	59.2	Low	74.7	Confident	169 Å²	169	94 Å²	94	79%	0.79	50%	0.497	S	S	*	.	H	α-helix	trans	-51.1	-31.5	175.6	-101.4	-168.3	151.6	0	0	109.4	T476 T480 L481 M482	T476-E478 PolarHBondContact O-N 3.19Å; E478-T480 PolarHBondContact O-N 3.42Å; E478-L481 PolarHBondContact O-N 3.04Å; E478-M482 VanDerWaalsContact O-CB 3.22Å; E478-M482 WeakPolarHBondContact O-CB 3.34Å; E478-M482 WeakPolarHBondContact O-CG 3.46Å; E478-M482 PolarHBondContact O-N 2.83Å
479	S	63.3	Low	75.2	Confident	67 Å²	67	92.2 Å²	92.2	47%	0.469	50%	0.495	S	S	.	.	H	α-helix	trans	-58.3	-40.5	170.9	61	0	0	0	0	113.4	D477 T483	D477-S479 VanDerWaalsContact CB-OG 3.32Å; D477-S479 WeakPolarHBondContact CB-OG 3.4Å; D477-S479 PolarHBondContact O-N 3.46Å; S479-T483 WeakPolarHBondContact O-CB 3.46Å; S479-T483 PolarHBondContact O-N 3.49Å; S479-T483 PolarHBondContact O-OG1 3.46Å
480	T	70.5	Confident	75.3	Confident	75 Å²	75	94 Å²	94	46%	0.46	51%	0.513	S	S	.	.	H	α-helix	trans	-68.8	-43.1	178.1	-59.6	0	0	0	0	111	D477 E478 T483 I484	D477-T480 WeakPolarHBondContact CB-OG1 3.48Å; D477-T480 WeakPolarHBondContact O-CA 3.48Å; D477-T480 WeakPolarHBondContact O-CB 3.39Å; D477-T480 PolarHBondContact O-N 3.19Å; E478-T480 PolarHBondContact O-N 3.42Å; T480-T483 PolarHBondContact O-N 3.24Å; T480-I484 HydrophobicContact CG2-CD1 4.09Å; T480-I484 VanDerWaalsContact O-CG1 3.25Å; T480-I484 WeakPolarHBondContact O-CG1 3.17Å; T480-I484 PolarHBondContact O-N 3.31Å
481	L	73.3	Confident	75.8	Confident	113 Å²	113	97.5 Å²	97.5	59%	0.592	53%	0.53	S	S	*	.	H	α-helix	trans	-71.3	-39.4	-179.7	-132.8	141.5	0	0	0	111.6	D477 E478 I484 A485	D477-L481 PolarHBondContact O-N 3.03Å; E478-L481 PolarHBondContact O-N 3.04Å; L481-I484 PolarHBondContact O-N 3.11Å; L481-A485 WeakPolarHBondContact O-CB 3.45Å; L481-A485 PolarHBondContact O-N 3.36Å
482	M	76.8	Confident	76.1	Confident	97 Å²	97	98.2 Å²	98.2	48%	0.478	54%	0.543	S	S	.	.	H	α-helix	trans	-63.9	-40.1	169.9	-73.5	-66.5	-73.7	0	0	111.8	E478 A485 Y486	E478-M482 VanDerWaalsContact O-CB 3.22Å; E478-M482 WeakPolarHBondContact O-CB 3.34Å; E478-M482 WeakPolarHBondContact O-CG 3.46Å; E478-M482 PolarHBondContact O-N 2.83Å; M482-A485 PolarHBondContact O-N 2.76Å; M482-Y486 HydrophobicContact CB-CE2 4.39Å; M482-Y486 HydrophobicContact CE-CE2 3.74Å; M482-Y486 WeakPolarHBondContact O-CD2 3.38Å; M482-Y486 PolarHBondContact O-N 3.19Å
483	T	81.4	Confident	76.5	Confident	75 Å²	75	94.4 Å²	94.4	46%	0.46	53%	0.529	S	S	.	.	H	α-helix	trans	-62.3	-45.7	175.3	-63.2	0	0	0	0	110.8	S479 T480 A485 Y486 I487	S479-T483 WeakPolarHBondContact O-CB 3.46Å; S479-T483 PolarHBondContact O-N 3.49Å; S479-T483 PolarHBondContact O-OG1 3.46Å; T480-T483 PolarHBondContact O-N 3.24Å; T483-A485 VanDerWaalsContact C-N 3.33Å; T483-A485 PolarHBondContact O-N 3.46Å; T483-Y486 PolarHBondContact O-N 3.36Å; T483-I487 HydrophobicContact CG2-CD1 3.79Å; T483-I487 HydrophobicContact CG2-CG1 4.44Å; T483-I487 WeakPolarHBondContact O-CB 3.38Å; T483-I487 WeakPolarHBondContact O-CG1 3.29Å; T483-I487 PolarHBondContact O-N 2.8Å
484	I	86.4	Confident	77.7	Confident	95 Å²	95	94.4 Å²	94.4	49%	0.487	53%	0.529	S	S	.	.	H	α-helix	trans	-60.4	-43.5	174.5	-68.1	164.7	0	0	0	110.5	T480 L481 I487 M488	T480-I484 HydrophobicContact CG2-CD1 4.09Å; T480-I484 VanDerWaalsContact O-CG1 3.25Å; T480-I484 WeakPolarHBondContact O-CG1 3.17Å; T480-I484 PolarHBondContact O-N 3.31Å; L481-I484 PolarHBondContact O-N 3.11Å; I484-I487 PolarHBondContact O-N 2.98Å; I484-M488 HydrophobicContact CG2-CG 4.43Å; I484-M488 WeakPolarHBondContact O-CB 3.37Å; I484-M488 VanDerWaalsContact O-CG 3.3Å; I484-M488 WeakPolarHBondContact O-CG 3.43Å; I484-M488 PolarHBondContact O-N 3.49Å
485	A	86.7	Confident	79.1	Confident	52 Å²	52	97 Å²	97	43%	0.43	53%	0.532	S	S	.	.	H	α-helix	trans	-62.1	-44	177.7	0	0	0	0	0	112.5	L481 M482 T483 M488 A489	L481-A485 WeakPolarHBondContact O-CB 3.45Å; L481-A485 PolarHBondContact O-N 3.36Å; M482-A485 PolarHBondContact O-N 2.76Å; T483-A485 VanDerWaalsContact C-N 3.33Å; T483-A485 PolarHBondContact O-N 3.46Å; A485-M488 PolarHBondContact O-N 3.19Å; A485-A489 WeakPolarHBondContact O-CB 3.31Å; A485-A489 PolarHBondContact O-N 3.28Å
486	Y	90.8	Very high	81	Confident	165 Å²	165	93.8 Å²	93.8	65%	0.647	52%	0.519	S	S	*	.	H	α-helix	trans	-66.4	-39.2	176.3	-75.5	-58.2	0	0	0	112.7	M482 T483 A489 G490	M482-Y486 HydrophobicContact CB-CE2 4.39Å; M482-Y486 HydrophobicContact CE-CE2 3.74Å; M482-Y486 WeakPolarHBondContact O-CD2 3.38Å; M482-Y486 PolarHBondContact O-N 3.19Å; T483-Y486 PolarHBondContact O-N 3.36Å; Y486-A489 PolarHBondContact O-N 2.88Å; Y486-G490 PolarHBondContact O-N 3.03Å
487	I	93.6	Very high	82.8	Confident	96 Å²	96	93.8 Å²	93.8	49%	0.492	51%	0.514	S	S	.	.	H	α-helix	trans	-61.4	-47.3	174.7	-70.3	167.4	0	0	0	110.1	T483 I484 A489 G490 I491	T483-I487 HydrophobicContact CG2-CD1 3.79Å; T483-I487 HydrophobicContact CG2-CG1 4.44Å; T483-I487 WeakPolarHBondContact O-CB 3.38Å; T483-I487 WeakPolarHBondContact O-CG1 3.29Å; T483-I487 PolarHBondContact O-N 2.8Å; I484-I487 PolarHBondContact O-N 2.98Å; I487-A489 PolarHBondContact O-N 3.01Å; I487-G490 PolarHBondContact O-N 3.35Å; I487-I491 HydrophobicContact CG2-CD1 3.88Å; I487-I491 VanDerWaalsContact O-CG1 3.32Å; I487-I491 WeakPolarHBondContact O-CG1 3.41Å; I487-I491 PolarHBondContact O-N 3.45Å
488	M	90.8	Very high	84.4	Confident	109 Å²	109	93 Å²	93	54%	0.537	51%	0.514	S	S	.	.	H	α-helix	trans	-63.7	-41.2	177.9	-70.8	-61.1	-66.8	0	0	112.2	I484 A485 G490 I491 C492	I484-M488 HydrophobicContact CG2-CG 4.43Å; I484-M488 WeakPolarHBondContact O-CB 3.37Å; I484-M488 VanDerWaalsContact O-CG 3.3Å; I484-M488 WeakPolarHBondContact O-CG 3.43Å; I484-M488 PolarHBondContact O-N 3.49Å; A485-M488 PolarHBondContact O-N 3.19Å; M488-G490 VanDerWaalsContact C-N 3.35Å; M488-G490 PolarHBondContact O-N 2.54Å; M488-I491 PolarHBondContact O-N 2.82Å; M488-C492 WeakPolarHBondContact O-CB 3.41Å; M488-C492 PolarHBondContact O-N 3.04Å; M488-C492 PolarHBondContact O-SG 3.21Å; M488-C492 VanDerWaalsContact O-SG 3.41Å
489	A	91.1	Very high	85.7	Confident	58 Å²	58	89.8 Å²	89.8	48%	0.479	50%	0.502	S	S	.	.	H	α-helix	trans	-62.5	-41	174.7	0	0	0	0	0	112	A485 Y486 I487 C492 A493	A485-A489 WeakPolarHBondContact O-CB 3.31Å; A485-A489 PolarHBondContact O-N 3.28Å; Y486-A489 PolarHBondContact O-N 2.88Å; I487-A489 PolarHBondContact O-N 3.01Å; A489-C492 PolarHBondContact O-N 3.25Å; A489-A493 WeakPolarHBondContact O-CB 3.49Å; A489-A493 PolarHBondContact O-N 2.96Å
490	G	93.1	Very high	86.7	Confident	41 Å²	41	90 Å²	90	42%	0.423	50%	0.502	S	S	.	.	H	α-helix	trans	-63.4	-44.8	175.7	0	0	0	0	0	112.9	Y486 I487 M488 A493 L494	Y486-G490 PolarHBondContact O-N 3.03Å; I487-G490 PolarHBondContact O-N 3.35Å; M488-G490 VanDerWaalsContact C-N 3.35Å; M488-G490 PolarHBondContact O-N 2.54Å; G490-A493 PolarHBondContact O-N 3.2Å; G490-L494 WeakPolarHBondContact O-CB 3.38Å; G490-L494 PolarHBondContact O-N 3.37Å
491	I	93.9	Very high	87.5	Confident	79 Å²	79	91 Å²	91	41%	0.405	50%	0.504	S	S	.	.	H	α-helix	trans	-61.5	-47	175.8	-67.9	169.3	0	0	0	110.4	I487 M488 A493 L494 F495	I487-I491 HydrophobicContact CG2-CD1 3.88Å; I487-I491 VanDerWaalsContact O-CG1 3.32Å; I487-I491 WeakPolarHBondContact O-CG1 3.41Å; I487-I491 PolarHBondContact O-N 3.45Å; M488-I491 PolarHBondContact O-N 2.82Å; I491-A493 VanDerWaalsContact C-N 3.34Å; I491-A493 PolarHBondContact O-N 2.89Å; I491-L494 PolarHBondContact O-N 2.97Å; I491-F495 HydrophobicContact CG2-CD2 3.9Å; I491-F495 HydrophobicContact CG2-CE2 3.72Å; I491-F495 WeakPolarHBondContact O-CD2 3.36Å; I491-F495 PolarHBondContact O-N 2.7Å
492	C	90.6	Very high	88.1	Confident	73 Å²	73	91.8 Å²	91.8	49%	0.493	51%	0.507	S	S	.	.	H	α-helix	trans	-59	-43.8	176.2	-77.5	0	0	0	0	112.1	M488 A489 L494 F495 M496	M488-C492 WeakPolarHBondContact O-CB 3.41Å; M488-C492 PolarHBondContact O-N 3.04Å; M488-C492 PolarHBondContact O-SG 3.21Å; M488-C492 VanDerWaalsContact O-SG 3.41Å; A489-C492 PolarHBondContact O-N 3.25Å; C492-L494 VanDerWaalsContact C-N 3.33Å; C492-L494 PolarHBondContact O-N 2.84Å; C492-F495 PolarHBondContact O-N 2.85Å; C492-M496 VanDerWaalsContact O-CB 3.27Å; C492-M496 WeakPolarHBondContact O-CB 3.12Å; C492-M496 WeakPolarHBondContact O-CG 3.16Å; C492-M496 PolarHBondContact O-N 2.62Å
493	A	88.7	Confident	88.5	Confident	43 Å²	43	90.9 Å²	90.9	36%	0.355	51%	0.506	S	S	.	.	H	α-helix	trans	-62	-41.6	176.7	0	0	0	0	0	111.7	A489 G490 I491 F495 M496 L497	A489-A493 WeakPolarHBondContact O-CB 3.49Å; A489-A493 PolarHBondContact O-N 2.96Å; G490-A493 PolarHBondContact O-N 3.2Å; I491-A493 VanDerWaalsContact C-N 3.34Å; I491-A493 PolarHBondContact O-N 2.89Å; A493-F495 VanDerWaalsContact C-N 3.28Å; A493-F495 PolarHBondContact O-N 2.57Å; A493-M496 PolarHBondContact O-N 3.07Å; A493-L497 HydrophobicContact CB-CD1 4.36Å; A493-L497 VanDerWaalsContact O-CB 3.28Å; A493-L497 WeakPolarHBondContact O-CB 3.42Å; A493-L497 PolarHBondContact O-N 3.2Å
494	L	91.9	Very high	88.5	Confident	125 Å²	125	90.9 Å²	90.9	65%	0.654	51%	0.508	S	S	*	.	H	α-helix	trans	-63.3	-32.3	-177.8	-156.2	143.3	0	0	0	112.8	G490 I491 C492 P498	G490-L494 WeakPolarHBondContact O-CB 3.38Å; G490-L494 PolarHBondContact O-N 3.37Å; I491-L494 PolarHBondContact O-N 2.97Å; C492-L494 VanDerWaalsContact C-N 3.33Å; C492-L494 PolarHBondContact O-N 2.84Å; L494-P498 WeakPolarHBondContact O-CD 3.32Å; L494-P498 VanDerWaalsContact O-CG 3.22Å; L494-P498 WeakPolarHBondContact O-CG 3.12Å
495	F	88.2	Confident	88.4	Confident	136 Å²	136	92.7 Å²	92.7	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-88.9	-36.7	175.8	-70	-67.6	0	0	0	113.7	I491 C492 A493 L499	I491-F495 HydrophobicContact CG2-CD2 3.9Å; I491-F495 HydrophobicContact CG2-CE2 3.72Å; I491-F495 WeakPolarHBondContact O-CD2 3.36Å; I491-F495 PolarHBondContact O-N 2.7Å; C492-F495 PolarHBondContact O-N 2.85Å; A493-F495 VanDerWaalsContact C-N 3.28Å; A493-F495 PolarHBondContact O-N 2.57Å; F495-L499 WeakPolarHBondContact O-CD1 3.5Å
496	M	87.1	Confident	88	Confident	111 Å²	111	96.8 Å²	96.8	55%	0.547	52%	0.519	S	S	.	.	H	α-helix	trans	-80.2	-31.7	-175.3	-66.4	-62.2	-71.6	0	0	113.1	C492 A493 L499 C500	C492-M496 VanDerWaalsContact O-CB 3.27Å; C492-M496 WeakPolarHBondContact O-CB 3.12Å; C492-M496 WeakPolarHBondContact O-CG 3.16Å; C492-M496 PolarHBondContact O-N 2.62Å; A493-M496 PolarHBondContact O-N 3.07Å; M496-L499 PolarHBondContact O-N 3.06Å; M496-L499 HydrophobicContact SD-CD1 4.36Å; M496-C500 WeakPolarHBondContact O-CB 3.34Å; M496-C500 PolarHBondContact O-N 3.15Å; M496-C500 PolarHBondContact O-SG 3.08Å; M496-C500 VanDerWaalsContact O-SG 3.35Å
497	L	87.5	Confident	87.3	Confident	103 Å²	103	96.7 Å²	96.7	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-61.9	-49.4	177.4	-101.9	143.7	0	0	0	113	A493 L499 C500 L501	A493-L497 HydrophobicContact CB-CD1 4.36Å; A493-L497 VanDerWaalsContact O-CB 3.28Å; A493-L497 WeakPolarHBondContact O-CB 3.42Å; A493-L497 PolarHBondContact O-N 3.2Å; L497-L499 VanDerWaalsContact C-N 3.31Å; L497-L499 PolarHBondContact O-N 2.87Å; L497-C500 PolarHBondContact O-N 2.87Å; L497-L501 HydrophobicContact CD2-CD1 4.43Å; L497-L501 WeakPolarHBondContact O-CB 3.41Å; L497-L501 VanDerWaalsContact O-CG 3.23Å; L497-L501 WeakPolarHBondContact O-CG 3.44Å; L497-L501 PolarHBondContact O-N 3.36Å
498	P	88.6	Confident	86.5	Confident	70 Å²	70	99.1 Å²	99.1	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-60.6	-39.4	176.7	-23.9	33.4	0	0	0	112.8	L494 L501 M502	L494-P498 WeakPolarHBondContact O-CD 3.32Å; L494-P498 VanDerWaalsContact O-CG 3.22Å; L494-P498 WeakPolarHBondContact O-CG 3.12Å; P498-L501 PolarHBondContact O-N 2.74Å; P498-M502 WeakPolarHBondContact O-CB 3.21Å; P498-M502 PolarHBondContact O-N 3.18Å
499	L	85.3	Confident	85.5	Confident	102 Å²	102	96.8 Å²	96.8	53%	0.534	52%	0.523	S	S	.	.	H	α-helix	trans	-64.4	-46.8	176.1	-78.3	166.2	0	0	0	111.6	F495 M496 L497 L501 M502 V503	F495-L499 WeakPolarHBondContact O-CD1 3.5Å; M496-L499 PolarHBondContact O-N 3.06Å; M496-L499 HydrophobicContact SD-CD1 4.36Å; L497-L499 VanDerWaalsContact C-N 3.31Å; L497-L499 PolarHBondContact O-N 2.87Å; L499-L501 VanDerWaalsContact C-N 3.34Å; L499-L501 PolarHBondContact O-N 3.44Å; L499-M502 PolarHBondContact O-N 3.24Å; L499-V503 VanDerWaalsContact O-CG2 3.32Å; L499-V503 WeakPolarHBondContact O-CG2 3.37Å; L499-V503 PolarHBondContact O-N 3.17Å
500	C	85	Confident	84.3	Confident	71 Å²	71	101.4 Å²	101.4	48%	0.48	53%	0.528	S	S	.	.	H	α-helix	trans	-61.9	-42	175.4	-76.7	0	0	0	0	111.7	M496 L497 V503 C504	M496-C500 WeakPolarHBondContact O-CB 3.34Å; M496-C500 PolarHBondContact O-N 3.15Å; M496-C500 PolarHBondContact O-SG 3.08Å; M496-C500 VanDerWaalsContact O-SG 3.35Å; L497-C500 PolarHBondContact O-N 2.87Å; C500-V503 PolarHBondContact O-N 3.11Å; C500-C504 WeakPolarHBondContact O-CB 3.41Å; C500-C504 PolarHBondContact O-N 3.28Å; C500-C504 PolarHBondContact O-SG 3.12Å; C500-C504 VanDerWaalsContact O-SG 3.38Å
501	L	86.3	Confident	82.8	Confident	97 Å²	97	104.3 Å²	104.3	51%	0.508	54%	0.541	S	S	.	.	H	α-helix	trans	-65.4	-42.2	176.8	-71.5	172.6	0	0	0	111.8	L497 P498 L499 V503 C504 Q505	L497-L501 HydrophobicContact CD2-CD1 4.43Å; L497-L501 WeakPolarHBondContact O-CB 3.41Å; L497-L501 VanDerWaalsContact O-CG 3.23Å; L497-L501 WeakPolarHBondContact O-CG 3.44Å; L497-L501 PolarHBondContact O-N 3.36Å; P498-L501 PolarHBondContact O-N 2.74Å; L499-L501 VanDerWaalsContact C-N 3.34Å; L499-L501 PolarHBondContact O-N 3.44Å; L501-V503 PolarHBondContact O-N 3.22Å; L501-C504 PolarHBondContact O-N 3.04Å; L501-Q505 WeakPolarHBondContact O-CB 3.3Å; L501-Q505 VanDerWaalsContact O-CG 3.25Å; L501-Q505 WeakPolarHBondContact O-CG 3.47Å; L501-Q505 PolarHBondContact O-N 3.5Å
502	M	85.6	Confident	81.1	Confident	130 Å²	130	106.6 Å²	106.6	64%	0.64	55%	0.553	S	S	*	*	H	α-helix	trans	-60	-44.4	173.1	-91	-171.5	69.5	0	0	111.8	P498 L499 Q505 W506	P498-M502 WeakPolarHBondContact O-CB 3.21Å; P498-M502 PolarHBondContact O-N 3.18Å; L499-M502 PolarHBondContact O-N 3.24Å; M502-Q505 PolarHBondContact O-N 3.12Å; M502-W506 VanDerWaalsContact O-CB 3.25Å; M502-W506 WeakPolarHBondContact O-CB 3.24Å; M502-W506 PolarHBondContact O-N 3.02Å
503	V	85.9	Confident	79.6	Confident	77 Å²	77	110.3 Å²	110.3	47%	0.467	56%	0.563	S	S	.	*	H	α-helix	trans	-65.9	-41.5	178.1	172	0	0	0	0	111.1	L499 C500 L501 W506 R507	L499-V503 VanDerWaalsContact O-CG2 3.32Å; L499-V503 WeakPolarHBondContact O-CG2 3.37Å; L499-V503 PolarHBondContact O-N 3.17Å; C500-V503 PolarHBondContact O-N 3.11Å; L501-V503 PolarHBondContact O-N 3.22Å; V503-W506 PolarHBondContact O-N 2.92Å; V503-R507 WeakPolarHBondContact O-CB 3.32Å; V503-R507 WeakPolarHBondContact O-CG 3.28Å; V503-R507 PolarHBondContact O-N 3.45Å
504	C	82.4	Confident	78	Confident	75 Å²	75	113.2 Å²	113.2	51%	0.507	58%	0.579	S	S	.	*	H	α-helix	trans	-63.3	-45.4	175.2	-78.8	0	0	0	0	111.7	C500 L501 R507 F508	C500-C504 WeakPolarHBondContact O-CB 3.41Å; C500-C504 PolarHBondContact O-N 3.28Å; C500-C504 PolarHBondContact O-SG 3.12Å; C500-C504 VanDerWaalsContact O-SG 3.38Å; L501-C504 PolarHBondContact O-N 3.04Å; C504-R507 PolarHBondContact O-N 3.32Å; C504-F508 WeakPolarHBondContact O-CB 3.43Å; C504-F508 PolarHBondContact O-N 2.85Å
505	Q	83.9	Confident	76.2	Confident	134 Å²	134	115.4 Å²	115.4	63%	0.626	59%	0.585	S	S	*	*	H	α-helix	trans	-62.9	-43.3	176.2	-75.7	176.5	-13.6	0	0	111.7	L501 M502 R507 F508 A509	L501-Q505 WeakPolarHBondContact O-CB 3.3Å; L501-Q505 VanDerWaalsContact O-CG 3.25Å; L501-Q505 WeakPolarHBondContact O-CG 3.47Å; L501-Q505 PolarHBondContact O-N 3.5Å; M502-Q505 PolarHBondContact O-N 3.12Å; Q505-R507 PolarHBondContact O-N 3.25Å; Q505-F508 PolarHBondContact O-N 3.22Å; Q505-A509 WeakPolarHBondContact O-CB 3.28Å; Q505-A509 PolarHBondContact O-N 2.83Å
506	W	78.2	Confident	74.3	Confident	138 Å²	138	112 Å²	112	52%	0.523	59%	0.588	S	S	.	*	H	α-helix	trans	-61.7	-41.9	175.6	179.9	82.9	0	0	0	112.3	M502 V503 R510	M502-W506 VanDerWaalsContact O-CB 3.25Å; M502-W506 WeakPolarHBondContact O-CB 3.24Å; M502-W506 PolarHBondContact O-N 3.02Å; V503-W506 PolarHBondContact O-N 2.92Å; W506-R510 VanDerWaalsContact CH2-CZ 3.47Å; W506-R510 VanDerWaalsContact CH2-NH1 3.27Å; W506-R510 VanDerWaalsContact CZ2-NE 3.27Å; W506-R510 PolarHBondContact O-N 3.04Å; W506-R510 VanDerWaalsContact O-N 3.14Å
507	R	76.6	Confident	72.4	Confident	162 Å²	162	113.6 Å²	113.6	61%	0.611	60%	0.599	S	S	*	*	H	α-helix	trans	-68.7	-39.9	175.4	-73.9	-163.6	176.4	-164.5	0.5	112.5	V503 C504 Q505 R510 C511	V503-R507 WeakPolarHBondContact O-CB 3.32Å; V503-R507 WeakPolarHBondContact O-CG 3.28Å; V503-R507 PolarHBondContact O-N 3.45Å; C504-R507 PolarHBondContact O-N 3.32Å; Q505-R507 PolarHBondContact O-N 3.25Å; R507-R510 PolarHBondContact O-N 2.83Å; R507-C511 PolarHBondContact O-N 2.88Å; R507-C511 VanDerWaalsContact O-N 3.08Å; R507-C511 PolarHBondContact O-SG 2.74Å
508	F	75	Confident	70.6	Confident	147 Å²	147	119 Å²	119	65%	0.645	62%	0.619	S	S	*	*	H	α-helix	trans	-65.1	-42.2	175.7	-109.3	-89.2	0	0	0	112.1	C504 Q505 R510 C511 L512	C504-F508 WeakPolarHBondContact O-CB 3.43Å; C504-F508 PolarHBondContact O-N 2.85Å; Q505-F508 PolarHBondContact O-N 3.22Å; F508-R510 VanDerWaalsContact C-N 3.31Å; F508-R510 PolarHBondContact O-N 3.21Å; F508-C511 PolarHBondContact O-N 3.39Å; F508-C511 VanDerWaalsContact O-N 3.08Å; F508-L512 HydrophobicContact CD1-CD1 4.13Å; F508-L512 PolarHBondContact O-N 3.28Å
509	A	70.8	Confident	68.7	Low	61 Å²	61	118.8 Å²	118.8	50%	0.504	62%	0.623	S	S	.	*	H	α-helix	trans	-60.5	-40.6	175.7	0	0	0	0	0	111.8	Q505 C511 L512 H513	Q505-A509 WeakPolarHBondContact O-CB 3.28Å; Q505-A509 PolarHBondContact O-N 2.83Å; A509-C511 VanDerWaalsContact C-N 3.32Å; A509-C511 PolarHBondContact O-N 3.38Å; A509-L512 PolarHBondContact O-N 3.03Å; A509-H513 PolarHBondContact O-N 2.74Å; A509-H513 VanDerWaalsContact O-N 3.12Å
510	R	65.5	Low	66.9	Low	155 Å²	155	120.9 Å²	120.9	59%	0.585	63%	0.634	S	S	*	*	H	α-helix	trans	-67	-27.6	173.2	-81.5	-173	167.8	-161.3	-1.8	114.2	W506 R507 F508	W506-R510 VanDerWaalsContact CH2-CZ 3.47Å; W506-R510 VanDerWaalsContact CH2-NH1 3.27Å; W506-R510 VanDerWaalsContact CZ2-NE 3.27Å; W506-R510 PolarHBondContact O-N 3.04Å; W506-R510 VanDerWaalsContact O-N 3.14Å; R507-R510 PolarHBondContact O-N 2.83Å; F508-R510 VanDerWaalsContact C-N 3.31Å; F508-R510 PolarHBondContact O-N 3.21Å
511	C	61.4	Low	65.1	Low	101 Å²	101	124.8 Å²	124.8	68%	0.682	65%	0.65	S	S	*	*	H	α-helix	trans	-80.3	-30.7	175.1	-75.4	0	0	0	0	113	R507 F508 A509	R507-C511 PolarHBondContact O-N 2.88Å; R507-C511 VanDerWaalsContact O-N 3.08Å; R507-C511 PolarHBondContact O-SG 2.74Å; F508-C511 PolarHBondContact O-N 3.39Å; F508-C511 VanDerWaalsContact O-N 3.08Å; A509-C511 VanDerWaalsContact C-N 3.32Å; A509-C511 PolarHBondContact O-N 3.38Å
512	L	58.8	Low	63.4	Low	128 Å²	128	128.6 Å²	128.6	67%	0.67	67%	0.669	S	S	*	*	H	α-helix	trans	-82.5	-24.8	-179.9	-85.2	150.9	0	0	0	113.6	F508 A509	F508-L512 HydrophobicContact CD1-CD1 4.13Å; F508-L512 PolarHBondContact O-N 3.28Å; A509-L512 PolarHBondContact O-N 3.03Å
513	H	58.5	Low	61.7	Low	150 Å²	150	126.8 Å²	126.8	69%	0.694	67%	0.67	S	S	*	*			trans	-120.8	87	169.3	-90.7	-72.6	0	0	0	110.9	A509 H515	A509-H513 PolarHBondContact O-N 2.74Å; A509-H513 VanDerWaalsContact O-N 3.12Å; H513-H515 VanDerWaalsContact C-N 3.25Å; H513-H515 PolarHBondContact O-N 2.97Å
514	P	55.3	Low	59.9	Low	105 Å²	105	130.1 Å²	130.1	68%	0.682	68%	0.684	S	S	*	*	S	Bend	trans	-75.6	-12.9	178.7	-11.3	27.6	0	0	0	113.6
515	H	54.6	Low	58.1	Low	170 Å²	170	135.2 Å²	135.2	79%	0.787	71%	0.705	S	S	*	*			trans	-134.3	97.3	179	-81.9	-69	0	0	0	109.8	H513	H513-H515 VanDerWaalsContact C-N 3.25Å; H513-H515 PolarHBondContact O-N 2.97Å
516	G	48	Very low	56	Low	64 Å²	64	142 Å²	142	66%	0.66	73%	0.733	S	S	*	*	S	Bend	trans	-138.2	118	158.7	0	0	0	0	0	105.8	F518	G516-F518 PolarHBondContact O-N 3.15Å
517	D	47.7	Very low	54.9	Low	145 Å²	145	142.2 Å²	142.2	78%	0.775	74%	0.743	S	S	*	*			trans	-53	124.3	-156.5	-66.7	-57.2	0	0	0	115.6	A519	D517-A519 PolarHBondContact O-N 2.94Å
518	F	49.2	Very low	53.8	Low	218 Å²	218	141.2 Å²	141.2	96%	0.956	75%	0.75	S	S	*	*	S	Bend	trans	-87.4	45.4	163.9	-136.2	-85.1	0	0	0	109.4	G516	G516-F518 PolarHBondContact O-N 3.15Å
519	A	48.8	Very low	52.6	Low	65 Å²	65	140.8 Å²	140.8	54%	0.537	76%	0.756	S	S	.	*			trans	-147.9	88.2	177.3	0	0	0	0	0	106.9	D517	D517-A519 PolarHBondContact O-N 2.94Å
520	D	47.7	Very low	51.5	Low	146 Å²	146	145.5 Å²	145.5	78%	0.781	77%	0.771	S	S	*	*	S	Bend	trans	172.8	3.7	142.2	-87	-12.8	0	0	0	115.8
521	D	46.8	Very low	50.7	Low	152 Å²	152	144.9 Å²	144.9	81%	0.813	78%	0.782	S	S	*	*			trans	-107.9	35.2	175.4	-77.4	-32.5	0	0	0	114.8
522	I	50.9	Low	49.9	Very low	177 Å²	177	147.9 Å²	147.9	91%	0.908	79%	0.789	S	S	*	*	S	Bend	trans	-105.9	57.3	154.9	-51.9	178.2	0	0	0	107.8
523	S	48.5	Very low	49.3	Very low	93 Å²	93	149.3 Å²	149.3	65%	0.65	80%	0.798	S	S	*	*	S	Bend	trans	-149.6	11.1	169.1	69.3	0	0	0	0	114.8
524	L	48.6	Very low	48.6	Very low	147 Å²	147	149.2 Å²	149.2	77%	0.77	81%	0.805	S	S	*	*	S	Bend	trans	-143.7	80.2	173.5	-85.7	163.6	0	0	0	110.4
525	L	44.5	Very low	48	Very low	181 Å²	181	152.9 Å²	152.9	95%	0.948	82%	0.816	S	S	*	*			trans	-170.5	80.4	142	-97.2	164	0	0	0	107.5
526	K	41	Very low	47.4	Very low	277 Å²	277	151.4 Å²	151.4	100%	1.204	82%	0.818	S	S	*	*			trans	-99.2	0	153.9	-150.8	-176.6	-165.7	178.5	0	107.1

Retrieved 526 of 526 residues in 362.3 ms (Link to these results)

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