A0A087YCV8_POEFO Loading...

F-box/LRR-repeat protein 16

Substrate-recognition component of the SCF (SKP1-CUL1-F-box protein)-type E3 ubiquitin ligase complex.

AlphaFold DB , UniProt , Accession A0A087YCV8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 505 aa.

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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	32.3	Very low	35	Very low	238 Å²	238	151.1 Å²	151.1	100%	1.172	81%	0.814	S	S	*	*				0	147.8	0	-78.8	177.2	168.6	0	0	108.5
2	L	32.1	Very low	34.6	Very low	171 Å²	171	147.4 Å²	147.4	90%	0.895	81%	0.808	S	S	*	*			trans	72.2	90.6	165.7	-61.9	169.8	0	0	0	120.2
3	N	37.3	Very low	34.9	Very low	144 Å²	144	144.5 Å²	144.5	77%	0.77	80%	0.801	S	S	*	*			trans	2.9	145	132.4	-82.8	2.5	0	0	0	121.7
4	M	33.3	Very low	34.1	Very low	162 Å²	162	142.3 Å²	142.3	80%	0.798	80%	0.798	S	S	*	*				171.6	119.6	110.7	-86.1	-69.4	176.5	0	0	108.3
5	S	36.4	Very low	33.5	Very low	92 Å²	92	143.5 Å²	143.5	64%	0.643	80%	0.798	S	S	*	*				74.1	134.6	87.1	-58.6	0	0	0	0	114.7
6	T	40.1	Very low	33.2	Very low	129 Å²	129	141.9 Å²	141.9	79%	0.791	79%	0.793	S	S	*	*			cis	-161.6	-151.1	-9.2	31.8	0	0	0	0	108
7	P	51.4	Low	32.8	Very low	117 Å²	117	148.2 Å²	148.2	76%	0.76	80%	0.802	S	S	*	*				-103.2	-159.2	-106.6	44	-26.5	0	0	0	112.6
8	S	29.9	Very low	32.4	Very low	112 Å²	112	149.5 Å²	149.5	78%	0.783	81%	0.808	S	S	*	*			cis	-157.4	165.1	10.6	51.6	0	0	0	0	112.8
9	E	32.7	Very low	32.1	Very low	169 Å²	169	145.9 Å²	145.9	79%	0.79	81%	0.81	S	S	*	*			trans	-92	164.5	171.9	-55.8	173.8	123	0	0	113.4
10	L	30.4	Very low	31.5	Very low	138 Å²	138	148 Å²	148	72%	0.723	82%	0.816	S	S	*	*				155.8	119.5	118.2	-85.5	152.7	0	0	0	116.5
11	K	29.3	Very low	31.2	Very low	190 Å²	190	147.4 Å²	147.4	83%	0.826	82%	0.816	S	S	*	*			trans	37.9	139.9	135.4	-62.9	175.8	-172.5	171.7	0	124
12	S	29.7	Very low	30.8	Very low	107 Å²	107	145.6 Å²	145.6	75%	0.748	80%	0.802	S	S	*	*			trans	-50.3	168.8	158.7	55.7	0	0	0	0	115.6
13	P	39.2	Very low	30.7	Very low	109 Å²	109	145.1 Å²	145.1	71%	0.708	80%	0.799	S	S	*	*			cis	-157.6	-167.4	38.6	44.8	-21.3	0	0	0	119.8
14	C	23.8	Very low	30.8	Very low	114 Å²	114	143.9 Å²	143.9	77%	0.77	80%	0.799	S	S	*	*			trans	76.9	118	149.4	-72.9	0	0	0	0	125.5
15	M	24.5	Very low	31.2	Very low	161 Å²	161	141.7 Å²	141.7	79%	0.793	80%	0.797	S	S	*	*			trans	64.8	127.3	130.4	-63.3	-130.5	100.3	0	0	125.7
16	T	29.5	Very low	30.8	Very low	118 Å²	118	142.3 Å²	142.3	72%	0.724	80%	0.801	S	S	*	*			trans	58.5	124.8	140.5	58.2	0	0	0	0	123.3
17	R	26	Very low	30.4	Very low	249 Å²	249	144.9 Å²	144.9	94%	0.94	80%	0.804	S	S	*	*			trans	-163	146.9	133.3	-137.6	169.2	177.9	160.1	-1.6	114.6
18	N	25.5	Very low	30.1	Very low	171 Å²	171	143.8 Å²	143.8	91%	0.914	80%	0.797	S	S	*	*			trans	-86.7	161.6	177.2	-66.8	-23.2	0	0	0	113.4
19	G	25.9	Very low	30.2	Very low	82 Å²	82	146.1 Å²	146.1	85%	0.845	80%	0.801	S	S	*	*			trans	-170.9	118.8	163.4	0	0	0	0	0	114.8
20	M	20.9	Very low	30.1	Very low	186 Å²	186	141.1 Å²	141.1	92%	0.916	80%	0.795	S	S	*	*			trans	-101	147.2	176.4	-59.3	161.6	62.3	0	0	111.9
21	V	26	Very low	30.2	Very low	137 Å²	137	143.6 Å²	143.6	83%	0.83	81%	0.808	S	S	*	*			trans	-149.6	118.8	155.2	176.2	0	0	0	0	113.9
22	K	23.9	Very low	30.2	Very low	199 Å²	199	137.3 Å²	137.3	87%	0.865	80%	0.797	S	S	*	*			trans	45.7	123.5	145.3	-69.3	-178.7	174.6	179	0	125.8
23	L	28	Very low	30.2	Very low	162 Å²	162	138 Å²	138	85%	0.848	80%	0.802	S	S	*	*			trans	-76.6	-174.2	141.3	-63.8	160.9	0	0	0	110.4
24	P	41.1	Very low	29.8	Very low	117 Å²	117	137.1 Å²	137.1	76%	0.76	80%	0.804	S	S	*	*			cis	-137.9	-144.7	10.2	42	-17.7	0	0	0	111.3
25	P	40.3	Very low	30	Very low	116 Å²	116	136.5 Å²	136.5	75%	0.753	80%	0.801	S	S	*	*			cis	-128.4	-169.2	-10.1	46.1	-28.1	0	0	0	113.4
26	S	27.8	Very low	30.2	Very low	106 Å²	106	136 Å²	136	74%	0.741	80%	0.799	S	S	*	*			cis	-154.9	133.6	3.1	36.1	0	0	0	0	111.8
27	Q	32	Very low	30.3	Very low	183 Å²	183	137.2 Å²	137.2	86%	0.855	81%	0.807	S	S	*	*				9.4	171.8	128.2	-92.9	-173.6	6.7	0	0	123.1
28	P	46.6	Very low	30.4	Very low	93 Å²	93	135.3 Å²	135.3	60%	0.604	81%	0.806	S	S	*	*			cis	-139.9	172.8	-6.6	30.2	-7.7	0	0	0	117.4
29	N	30.5	Very low	30.4	Very low	161 Å²	161	131.1 Å²	131.1	86%	0.861	80%	0.803	S	S	*	*			trans	143.3	127.7	134.8	-74	-15.5	0	0	0	111.5
30	G	31.1	Very low	30.5	Very low	65 Å²	65	133.7 Å²	133.7	67%	0.67	80%	0.802	S	S	*	*			cis	171.1	144.8	-11.5	0	0	0	0	0	113.1
31	L	32.7	Very low	31.5	Very low	189 Å²	189	130.2 Å²	130.2	99%	0.99	79%	0.794	S	S	*	*			trans	65.3	136.5	157.9	-58.7	159.3	0	0	0	118.4
32	G	29	Very low	31.5	Very low	58 Å²	58	128.4 Å²	128.4	60%	0.598	79%	0.793	S	S	*	*			cis	-155.2	149.7	-3.4	0	0	0	0	0	110.8
33	S	29.9	Very low	31.7	Very low	123 Å²	123	123.1 Å²	123.1	86%	0.86	79%	0.786	S	S	*	*				65.8	140.6	97.4	67.9	0	0	0	0	115.4
34	A	30.7	Very low	31.7	Very low	90 Å²	90	124.9 Å²	124.9	74%	0.744	79%	0.787	S	S	*	*			cis	-178.4	158.3	-7.9	0	0	0	0	0	107.6
35	S	28.6	Very low	31	Very low	100 Å²	100	126.9 Å²	126.9	70%	0.699	79%	0.792	S	S	*	*			cis	-167.5	143.8	-13.9	-98.3	0	0	0	0	111.6
36	I	29.2	Very low	30.4	Very low	150 Å²	150	132.9 Å²	132.9	77%	0.769	80%	0.799	S	S	*	*			trans	36.3	123.9	136.3	-58	168.8	0	0	0	119.2
37	T	30.1	Very low	30.3	Very low	145 Å²	145	135.1 Å²	135.1	89%	0.89	80%	0.802	S	S	*	*				-161.2	144.3	121.3	10.6	0	0	0	0	112.6
38	K	29.4	Very low	29.9	Very low	209 Å²	209	132 Å²	132	91%	0.909	80%	0.799	S	S	*	*			trans	-104.2	151.6	175	-80.2	-178.4	172.1	-179.6	0	110.3
39	G	25.7	Very low	28.9	Very low	82 Å²	82	137.1 Å²	137.1	85%	0.845	82%	0.815	S	S	*	*			trans	-166.3	98	168.9	0	0	0	0	0	114.3
40	T	26.1	Very low	28.6	Very low	136 Å²	136	134.8 Å²	134.8	83%	0.834	81%	0.811	S	S	*	*			trans	-94	175.9	168.3	24.4	0	0	0	0	110.9
41	P	43.3	Very low	28.4	Very low	114 Å²	114	136.8 Å²	136.8	74%	0.74	82%	0.815	S	S	*	*			cis	-138.8	178.2	-24.5	35.2	-15.7	0	0	0	115.7
42	A	26.5	Very low	28.2	Very low	98 Å²	98	133 Å²	133	81%	0.81	80%	0.804	S	S	*	*			trans	64.7	129.7	145	0	0	0	0	0	123.2
43	A	26.6	Very low	28.2	Very low	89 Å²	89	136.3 Å²	136.3	74%	0.736	81%	0.813	S	S	*	*				177.1	131.3	115.9	0	0	0	0	0	116.4
44	K	28.1	Very low	28.2	Very low	199 Å²	199	136 Å²	136	87%	0.865	81%	0.808	S	S	*	*			trans	59.7	113	140	-64.9	177.7	178.9	176.2	0	123.1
45	N	28	Very low	28	Very low	159 Å²	159	137 Å²	137	85%	0.85	81%	0.809	S	S	*	*			trans	21.2	123	130.4	-64.9	1.5	0	0	0	120.5
46	R	26.2	Very low	28	Very low	242 Å²	242	139.9 Å²	139.9	91%	0.913	82%	0.815	S	S	*	*				-156.1	139.4	123	-115.4	176.2	-151.5	-113.1	2.8	115
47	L	25.5	Very low	28	Very low	153 Å²	153	140.6 Å²	140.6	80%	0.801	82%	0.82	S	S	*	*			trans	-33.4	138	171.3	-69.3	137.5	0	0	0	118.6
48	C	24.2	Very low	28.1	Very low	117 Å²	117	139 Å²	139	79%	0.791	81%	0.811	S	S	*	*			trans	24.9	124.3	135.9	-52.1	0	0	0	0	120.4
49	Q	24.7	Very low	28.3	Very low	200 Å²	200	134.5 Å²	134.5	94%	0.935	80%	0.804	S	S	*	*				-151.1	166.6	127.6	-116.4	173	22	0	0	112.3
50	S	25.3	Very low	28.6	Very low	113 Å²	113	136.1 Å²	136.1	79%	0.79	80%	0.8	S	S	*	*			trans	-92.1	144.9	-157.3	51.7	0	0	0	0	115.6
51	S	26.9	Very low	28.8	Very low	107 Å²	107	136 Å²	136	75%	0.748	80%	0.801	S	S	*	*			trans	-139.2	95.1	156.2	48.6	0	0	0	0	112.3
52	S	28	Very low	28.2	Very low	109 Å²	109	135.2 Å²	135.2	76%	0.762	80%	0.798	S	S	*	*				38.7	93.9	124.5	60.3	0	0	0	0	118.6
53	V	29.7	Very low	28.2	Very low	128 Å²	128	136.2 Å²	136.2	78%	0.776	80%	0.799	S	S	*	*			trans	-85.1	126.5	159.8	178	0	0	0	0	109.1	S55	V53-S55 PolarHBondContact O-N 3.07Å
54	P	28.7	Very low	28.3	Very low	116 Å²	116	139.5 Å²	139.5	75%	0.753	80%	0.804	S	S	*	*			trans	-82.6	104.4	165.7	29.5	-26.5	0	0	0	109.8	I56	P54-I56 PolarHBondContact O-N 2.94Å
55	S	26.9	Very low	28.2	Very low	111 Å²	111	134.5 Å²	134.5	78%	0.776	79%	0.792	S	S	*	*			trans	-79.4	111.8	174.7	28.2	0	0	0	0	111.3	V53	V53-S55 PolarHBondContact O-N 3.07Å
56	I	29.7	Very low	28.1	Very low	160 Å²	160	138 Å²	138	82%	0.821	80%	0.795	S	S	*	*			trans	-133.4	96.5	165	-55.3	-179.7	0	0	0	108.6	P54	P54-I56 PolarHBondContact O-N 2.94Å
57	L	28.7	Very low	28.1	Very low	166 Å²	166	134.6 Å²	134.6	87%	0.869	79%	0.789	S	S	*	*			trans	-124.9	125	163.7	-95.2	162.5	0	0	0	106.8
58	P	32.5	Very low	28	Very low	110 Å²	110	135.5 Å²	135.5	71%	0.714	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-72	144.1	175	29.9	-33	0	0	0	110.4
59	P	34	Very low	28.1	Very low	116 Å²	116	138.6 Å²	138.6	75%	0.753	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-74.3	153.8	179.8	31.4	-35.2	0	0	0	111.8
60	P	31.6	Very low	28	Very low	116 Å²	116	135.9 Å²	135.9	75%	0.753	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-67.5	146.6	170.7	30.2	-34.6	0	0	0	110.5	S62	P60-S62 PolarHBondContact O-N 3.13Å
61	P	30.4	Very low	28.1	Very low	133 Å²	133	139.3 Å²	139.3	86%	0.864	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-65.8	122.6	176.1	26.8	-33	0	0	0	110.4
62	S	29.1	Very low	28	Very low	98 Å²	98	142 Å²	142	69%	0.685	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-69.3	137.9	-179	54.2	0	0	0	0	112.4	P60	P60-S62 PolarHBondContact O-N 3.13Å
63	S	28.6	Very low	27.9	Very low	119 Å²	119	144.4 Å²	144.4	83%	0.832	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-52.9	137	158.5	44.8	0	0	0	0	111.4
64	L	27.2	Very low	27.7	Very low	157 Å²	157	145.2 Å²	145.2	82%	0.822	79%	0.789	S	S	*	*			trans	-120.2	151.4	165.7	-85.4	172.7	0	0	0	110.3
65	P	27.3	Very low	27.7	Very low	95 Å²	95	146.8 Å²	146.8	62%	0.617	79%	0.791	S	S	*	*			trans	-95.8	155.7	-158.1	37.3	-36	0	0	0	113
66	Y	24.2	Very low	27.9	Very low	233 Å²	233	147.1 Å²	147.1	91%	0.914	79%	0.79	S	S	*	*			trans	-103.2	106.6	158.8	-86.7	-83.5	0	0	0	110.1
67	H	26.4	Very low	27.8	Very low	170 Å²	170	142.9 Å²	142.9	79%	0.787	79%	0.787	S	S	*	*			trans	-71.6	136.8	168.1	-105.9	-88.4	0	0	0	110.3	H69	H67-H69 PolarHBondContact O-N 3.18Å
68	H	24.8	Very low	27.8	Very low	172 Å²	172	143.9 Å²	143.9	80%	0.796	79%	0.789	S	S	*	*			trans	-56.9	132.9	156.6	-84.8	-83.8	0	0	0	110.2
69	H	25.3	Very low	27.8	Very low	182 Å²	182	144.5 Å²	144.5	84%	0.843	79%	0.793	S	S	*	*			trans	-152.8	144.1	131.8	-105.3	-71	0	0	0	110.7	H67	H67-H69 PolarHBondContact O-N 3.18Å
70	L	23.4	Very low	27.6	Very low	142 Å²	142	147.7 Å²	147.7	74%	0.743	80%	0.798	S	S	*	*			trans	-74.6	152.9	-175.8	-61.4	75.7	0	0	0	111.3
71	H	25.9	Very low	27.4	Very low	186 Å²	186	148.6 Å²	148.6	86%	0.861	80%	0.801	S	S	*	*				-153.9	150.5	122.8	-108.7	-78.1	0	0	0	111.3
72	H	24.5	Very low	27.3	Very low	162 Å²	162	148.8 Å²	148.8	75%	0.75	80%	0.8	S	S	*	*			trans	-52.8	153.4	-177.3	-80.4	-105.9	0	0	0	115.4
73	L	26.5	Very low	27.2	Very low	161 Å²	161	148.4 Å²	148.4	84%	0.843	80%	0.803	S	S	*	*				-165.3	168.5	117.7	-99.7	159.4	0	0	0	111.7
74	D	26.6	Very low	27.3	Very low	144 Å²	144	148.9 Å²	148.9	77%	0.77	80%	0.803	S	S	*	*			trans	-79.3	166.5	-150.7	-68.5	-74.6	0	0	0	119.2
75	N	27.4	Very low	27.3	Very low	150 Å²	150	149.7 Å²	149.7	80%	0.802	81%	0.807	S	S	*	*			trans	-104.9	134.9	-177.2	177.6	28	0	0	0	111.5
76	P	32.7	Very low	27.4	Very low	117 Å²	117	153 Å²	153	76%	0.76	82%	0.819	S	S	*	*			trans	-118.6	130.9	162.8	31.9	-18.7	0	0	0	113.9
77	G	26	Very low	27.8	Very low	72 Å²	72	147.8 Å²	147.8	74%	0.742	81%	0.814	S	S	*	*			trans	-59.5	151.8	-171.8	0	0	0	0	0	119.2
78	M	29.3	Very low	27.9	Very low	187 Å²	187	145 Å²	145	92%	0.921	81%	0.813	S	S	*	*			trans	-65.7	144.7	155.1	-74.7	-95	-168.4	0	0	111.7
79	P	33.2	Very low	28	Very low	123 Å²	123	144.2 Å²	144.2	80%	0.799	82%	0.815	S	S	*	*			trans	-108.5	142.6	161.5	35.1	-27.3	0	0	0	113.2
80	H	28.9	Very low	28.2	Very low	183 Å²	183	143.6 Å²	143.6	85%	0.847	82%	0.817	S	S	*	*			trans	-90.1	143.5	170.4	-67.3	-92.7	0	0	0	111.9
81	T	27.5	Very low	28.3	Very low	135 Å²	135	145.5 Å²	145.5	83%	0.828	82%	0.822	S	S	*	*			trans	-148	124.5	154.5	44.9	0	0	0	0	106.6
82	T	28.5	Very low	29.1	Very low	136 Å²	136	142.3 Å²	142.3	83%	0.834	82%	0.818	S	S	*	*			cis	68.9	133.9	39.3	66.3	0	0	0	0	115.8
83	A	26.3	Very low	29.3	Very low	90 Å²	90	138 Å²	138	74%	0.744	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-84.4	158.1	-161.4	0	0	0	0	0	114.2
84	P	31.9	Very low	29.4	Very low	130 Å²	130	140.2 Å²	140.2	84%	0.844	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-81	138.4	176.1	32.5	-33.5	0	0	0	112.6
85	L	27.2	Very low	29.8	Very low	173 Å²	173	138.3 Å²	138.3	91%	0.906	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-91.3	155.8	170.5	-77.2	158.3	0	0	0	111.1
86	L	29.1	Very low	29.9	Very low	164 Å²	164	138.7 Å²	138.7	86%	0.859	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-71.2	152.9	169.5	-76.5	154.4	0	0	0	111.4
87	P	32.6	Very low	29.7	Very low	124 Å²	124	140 Å²	140	81%	0.805	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-82.2	156.2	172.3	34.9	-34.3	0	0	0	112
88	S	28	Very low	29.8	Very low	111 Å²	111	139.5 Å²	139.5	78%	0.776	82%	0.817	S	S	*	*			trans	-134.2	130	174.9	57.9	0	0	0	0	109.5
89	D	27.8	Very low	29.6	Very low	156 Å²	156	139.2 Å²	139.2	83%	0.834	82%	0.818	S	S	*	*			trans	-149.7	139	166.7	-104.6	-38.2	0	0	0	111.7
90	L	28.3	Very low	29.5	Very low	169 Å²	169	142.7 Å²	142.7	89%	0.885	82%	0.821	S	S	*	*			trans	78.4	141.1	160.3	-61.4	161.3	0	0	0	121
91	E	25.9	Very low	30.3	Very low	183 Å²	183	139.2 Å²	139.2	86%	0.855	81%	0.814	S	S	*	*			trans	-100.8	-155.1	-168.8	-62.6	-163.3	142.5	0	0	114.1
92	P	43	Very low	30.4	Very low	118 Å²	118	137.6 Å²	137.6	77%	0.766	81%	0.809	S	S	*	*				-127.4	166.8	-78.6	35.8	-19.7	0	0	0	114.3
93	G	28.8	Very low	30.9	Very low	72 Å²	72	138.4 Å²	138.4	74%	0.742	81%	0.807	S	S	*	*			trans	170.6	93.1	162.4	0	0	0	0	0	122.3
94	K	27.6	Very low	31.1	Very low	208 Å²	208	146 Å²	146	90%	0.904	82%	0.817	S	S	*	*			trans	62.2	166.8	137	-96.1	-179.3	-178.6	176.6	0	119.6
95	P	35	Very low	31.5	Very low	103 Å²	103	148.6 Å²	148.6	67%	0.669	82%	0.817	S	S	*	*				-133.8	168.8	-117.6	45.4	-30.3	0	0	0	119.1
96	L	30.4	Very low	31.9	Very low	159 Å²	159	148 Å²	148	83%	0.832	81%	0.814	S	S	*	*			trans	70	154.2	147	-75.8	164.9	0	0	0	122.2
97	V	27.5	Very low	32.4	Very low	145 Å²	145	145.2 Å²	145.2	88%	0.879	81%	0.806	S	S	*	*			trans	85.3	126.4	160.2	-165.1	0	0	0	0	118.8
98	G	28.1	Very low	32.9	Very low	61 Å²	61	145 Å²	145	63%	0.629	80%	0.804	S	S	*	*			trans	145	106.4	139.4	0	0	0	0	0	119.8
99	L	25.6	Very low	33.5	Very low	180 Å²	180	147.9 Å²	147.9	94%	0.942	81%	0.81	S	S	*	*			trans	72.6	109.3	137.2	-61.5	160.5	0	0	0	121.7
100	K	31.3	Very low	34.6	Very low	196 Å²	196	146.5 Å²	146.5	85%	0.852	81%	0.808	S	S	*	*			trans	-61.8	174.8	142.3	-83.4	-179.7	178.5	178.9	0	111.4
101	P	46.5	Very low	35.5	Very low	110 Å²	110	145.8 Å²	145.8	71%	0.714	80%	0.804	S	S	*	*			cis	-137.7	-167.8	-16.6	30.6	-7.4	0	0	0	114.6
102	S	28.8	Very low	36.4	Very low	101 Å²	101	142.6 Å²	142.6	71%	0.706	80%	0.799	S	S	*	*			trans	104.9	103.5	135.9	72.6	0	0	0	0	121.7
103	L	38.4	Very low	36.8	Very low	154 Å²	154	144.6 Å²	144.6	81%	0.806	80%	0.796	S	S	*	*				47.7	109.2	128.1	-72.3	159.2	0	0	0	120.6
104	R	31.9	Very low	37.9	Very low	250 Å²	250	145.1 Å²	145.1	94%	0.943	79%	0.786	S	S	*	*				-145.6	124.1	118.9	-100.8	174.9	-167.4	-167.4	2.4	109.7
105	Q	38.9	Very low	38.9	Very low	183 Å²	183	140.7 Å²	140.7	86%	0.855	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-76.5	125.1	171.5	-73.2	173.4	-28.1	0	0	109.3
106	L	36.2	Very low	39.6	Very low	161 Å²	161	140.6 Å²	140.6	84%	0.843	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-89	144	155.4	-83.6	144.5	0	0	0	107.9
107	P	40.3	Very low	40.8	Very low	106 Å²	106	138.1 Å²	138.1	69%	0.688	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-63.3	144.8	173.8	28.6	-33.9	0	0	0	109.5	L109	P107-L109 PolarHBondContact O-N 3.48Å; P107-L109 VanDerWaalsContact O-N 3.07Å
108	P	41.7	Very low	42.2	Very low	118 Å²	118	137.1 Å²	137.1	77%	0.766	74%	0.737	S	S	*	*			trans	-64.4	115.5	176.5	26.8	-32.9	0	0	0	109.3	T110	P108-T110 PolarHBondContact O-N 3.33Å
109	L	41.6	Very low	43.7	Very low	172 Å²	172	143.1 Å²	143.1	90%	0.901	74%	0.741	S	S	*	*			trans	-62.2	100.4	166.7	-79	162.8	0	0	0	108.2	P107 L111	P107-L109 PolarHBondContact O-N 3.48Å; P107-L109 VanDerWaalsContact O-N 3.07Å; L109-L111 PolarHBondContact O-N 2.87Å; L109-L111 VanDerWaalsContact O-N 3.13Å
110	T	51.7	Low	45.6	Very low	128 Å²	128	141 Å²	141	79%	0.785	73%	0.726	S	S	*	*			trans	-65.2	111.1	171.8	49.5	0	0	0	0	108.7	P108	P108-T110 PolarHBondContact O-N 3.33Å
111	L	45.4	Very low	47.5	Very low	154 Å²	154	135.9 Å²	135.9	81%	0.806	71%	0.707	S	S	*	*			trans	-54.3	135.5	169.2	-94.5	79	0	0	0	109.6	L109	L109-L111 PolarHBondContact O-N 2.87Å; L109-L111 VanDerWaalsContact O-N 3.13Å
112	P	45	Very low	48.9	Very low	115 Å²	115	134.2 Å²	134.2	75%	0.747	70%	0.695	S	S	*	*			trans	-58.5	139.3	167.4	-17.5	30.3	0	0	0	109.1	P114	P112-P114 WeakPolarHBondContact O-CD 3.06Å
113	K	51.9	Low	51.5	Low	160 Å²	160	133.5 Å²	133.5	70%	0.696	68%	0.683	S	S	*	*			trans	-84.1	100.7	-173.2	-63.8	164.7	171.3	176.5	0	112.1	L116	K113-L116 HydrophobicContact CB-CB 4.33Å; K113-L116 HydrophobicContact CB-CD1 4.32Å; K113-L116 HydrophobicContact CD-CD1 3.76Å; K113-L116 HydrophobicContact CG-CD1 4.12Å
114	P	51.6	Low	53.9	Low	83 Å²	83	129.6 Å²	129.6	54%	0.539	66%	0.663	S	S	.	*	S	Bend	trans	-88.3	-48.1	-179.7	-3.5	26.6	0	0	0	110	P112 L116 L117 E118	P112-P114 WeakPolarHBondContact O-CD 3.06Å; P114-L116 VanDerWaalsContact C-N 3.27Å; P114-L116 PolarHBondContact O-N 2.74Å; P114-L117 WeakPolarHBondContact O-CB 3.19Å; P114-L117 PolarHBondContact O-N 3.06Å; P114-E118 PolarHBondContact O-N 3.45Å
115	I	49.3	Very low	56.7	Low	116 Å²	116	121 Å²	121	60%	0.595	63%	0.633	S	S	*	*	H	α-helix	trans	-60.4	-30.1	-174.9	-56.3	164.3	0	0	0	113	R119	I115-R119 PolarHBondContact O-N 3.08Å
116	L	49.4	Very low	59.1	Low	100 Å²	100	120.2 Å²	120.2	52%	0.524	63%	0.627	S	S	.	*	H	α-helix	trans	-75	-32.4	176.1	-85.1	165.1	0	0	0	112.5	K113 P114 Q120	K113-L116 HydrophobicContact CB-CB 4.33Å; K113-L116 HydrophobicContact CB-CD1 4.32Å; K113-L116 HydrophobicContact CD-CD1 3.76Å; K113-L116 HydrophobicContact CG-CD1 4.12Å; P114-L116 VanDerWaalsContact C-N 3.27Å; P114-L116 PolarHBondContact O-N 2.74Å; L116-Q120 WeakPolarHBondContact O-CG 3.37Å; L116-Q120 PolarHBondContact O-N 3.1Å
117	L	54.8	Low	61.8	Low	107 Å²	107	116.3 Å²	116.3	56%	0.56	61%	0.607	S	S	*	*	H	α-helix	trans	-72.5	-44.6	179.3	-138.4	79.6	0	0	0	110.5	P114 R119 Q120 L121	P114-L117 WeakPolarHBondContact O-CB 3.19Å; P114-L117 PolarHBondContact O-N 3.06Å; L117-R119 PolarHBondContact O-N 2.94Å; L117-Q120 PolarHBondContact O-N 3.23Å; L117-Q120 VanDerWaalsContact O-N 3.1Å; L117-L121 WeakPolarHBondContact O-CG 3.41Å; L117-L121 PolarHBondContact O-N 2.97Å
118	E	57.4	Low	64.3	Low	124 Å²	124	111.3 Å²	111.3	58%	0.579	57%	0.574	S	S	*	*	H	α-helix	trans	-58.5	-45.7	175.9	-67.8	175.7	158.5	0	0	111.9	P114 Q120 L121 V122	P114-E118 PolarHBondContact O-N 3.45Å; E118-Q120 VanDerWaalsContact C-N 3.28Å; E118-Q120 PolarHBondContact O-N 3.06Å; E118-L121 PolarHBondContact O-N 3.32Å; E118-V122 WeakPolarHBondContact O-CG2 3.42Å; E118-V122 PolarHBondContact O-N 3.36Å
119	R	60.5	Low	66.7	Low	188 Å²	188	107.3 Å²	107.3	71%	0.709	55%	0.546	S	S	*	.	H	α-helix	trans	-64.4	-29	175.5	-78.2	-171.4	174.2	-159	-0.3	113.6	I115 L117 L123	I115-R119 PolarHBondContact O-N 3.08Å; L117-R119 PolarHBondContact O-N 2.94Å; R119-L123 WeakPolarHBondContact O-CD1 3.48Å; R119-L123 WeakPolarHBondContact O-CG 3.48Å
120	Q	65.2	Low	69.1	Low	136 Å²	136	108.4 Å²	108.4	64%	0.636	54%	0.539	S	S	*	.	H	α-helix	trans	-74.7	-44.4	173.9	-80.2	-175.8	-43	0	0	111.8	L116 L117 E118 V122 L123 D124	L116-Q120 WeakPolarHBondContact O-CG 3.37Å; L116-Q120 PolarHBondContact O-N 3.1Å; L117-Q120 PolarHBondContact O-N 3.23Å; L117-Q120 VanDerWaalsContact O-N 3.1Å; E118-Q120 VanDerWaalsContact C-N 3.28Å; E118-Q120 PolarHBondContact O-N 3.06Å; Q120-V122 VanDerWaalsContact C-N 3.35Å; Q120-V122 PolarHBondContact O-N 2.97Å; Q120-L123 CarbonylContact O-C 3.49Å; Q120-L123 PolarHBondContact O-N 3.21Å; Q120-D124 PolarHBondContact O-N 3.43Å
121	L	70.3	Confident	71.1	Confident	87 Å²	87	106.1 Å²	106.1	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-59.9	-43.8	178.8	-70.9	165.4	0	0	0	111.8	L117 E118 L123 D124 L127	L117-L121 WeakPolarHBondContact O-CG 3.41Å; L117-L121 PolarHBondContact O-N 2.97Å; E118-L121 PolarHBondContact O-N 3.32Å; L121-L123 PolarHBondContact O-N 3.23Å; L121-L123 VanDerWaalsContact O-N 3.11Å; L121-D124 PolarHBondContact O-N 2.86Å; L121-D124 VanDerWaalsContact O-N 3.13Å; L121-L127 HydrophobicContact CB-CD2 4.17Å; L121-L127 HydrophobicContact CD2-CD2 4.37Å; L121-L127 WeakPolarHBondContact O-CD2 3.39Å
122	V	76.9	Confident	73.4	Confident	76 Å²	76	98.8 Å²	98.8	46%	0.461	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-13.3	176.6	168.7	0	0	0	0	113.1	E118 Q120 W150	E118-V122 WeakPolarHBondContact O-CG2 3.42Å; E118-V122 PolarHBondContact O-N 3.36Å; Q120-V122 VanDerWaalsContact C-N 3.35Å; Q120-V122 PolarHBondContact O-N 2.97Å; V122-W150 HydrophobicContact CG1-CZ2 3.98Å; V122-W150 PolarHBondContact O-NE1 3.43Å
123	L	83.4	Confident	75.7	Confident	86 Å²	86	100 Å²	100	45%	0.45	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	0.9	177.1	-62.5	175.3	0	0	0	113.4	R119 Q120 L121 E125 T149	R119-L123 WeakPolarHBondContact O-CD1 3.48Å; R119-L123 WeakPolarHBondContact O-CG 3.48Å; Q120-L123 CarbonylContact O-C 3.49Å; Q120-L123 PolarHBondContact O-N 3.21Å; L121-L123 PolarHBondContact O-N 3.23Å; L121-L123 VanDerWaalsContact O-N 3.11Å; L123-E125 PolarHBondContact O-N 3.13Å; L123-T149 HydrophobicContact CD2-CG2 4.48Å
124	D	88.7	Confident	77.7	Confident	71 Å²	71	101.8 Å²	101.8	38%	0.38	48%	0.476	S	S	.	.			trans	-73.1	110.3	176.3	-173.3	-31.8	0	0	0	109.9	Q120 L121 K126 L127 L128	Q120-D124 PolarHBondContact O-N 3.43Å; L121-D124 PolarHBondContact O-N 2.86Å; L121-D124 VanDerWaalsContact O-N 3.13Å; D124-K126 PolarHBondContact O-N 3.23Å; D124-K126 WeakPolarHBondContact OD1-CA 3.39Å; D124-K126 VanDerWaalsContact OD1-CB 3.29Å; D124-K126 WeakPolarHBondContact OD1-CB 3.4Å; D124-K126 PolarHBondContact OD1-N 3.11Å; D124-L127 HydrophobicContact CB-CB 4.07Å; D124-L127 PolarHBondContact O-N 3.32Å; D124-L127 VanDerWaalsContact O-N 3.13Å; D124-L127 PolarHBondContact OD1-N 3.05Å; D124-L128 WeakPolarHBondContact O-CB 3.48Å; D124-L128 WeakPolarHBondContact O-CG 3.31Å; D124-L128 PolarHBondContact O-N 3.2Å
125	E	90.3	Very high	79.8	Confident	69 Å²	69	100.8 Å²	100.8	32%	0.322	46%	0.463	S	S	.	.	H	α-helix	trans	-57	-32.7	179.4	-64.8	-170.7	-174.3	0	0	112.4	L123 N129 T149 K152 V153	L123-E125 PolarHBondContact O-N 3.13Å; E125-N129 WeakPolarHBondContact O-CB 3.49Å; E125-N129 VanDerWaalsContact O-CG 3.28Å; E125-N129 PolarHBondContact O-N 3.03Å; E125-N129 PolarHBondContact O-ND2 2.79Å; E125-T149 HydrophobicContact CG-CG2 4.1Å; E125-K152 VanDerWaalsContact CD-NZ 3.32Å; E125-K152 WeakPolarHBondContact OE1-CD 3.13Å; E125-K152 IonicContact OE1-NZ 2.65Å; E125-K152 PolarHBondContact OE1-NZ 3.21Å; E125-K152 IonicContact OE2-NZ 3.16Å; E125-K152 PolarHBondContact OE2-NZ 2.99Å; E125-K152 VanDerWaalsContact OE2-NZ 3.16Å; E125-V153 HydrophobicContact CB-CG2 4.06Å; E125-V153 HydrophobicContact CG-CG2 3.87Å
126	K	90.3	Very high	81.9	Confident	168 Å²	168	99 Å²	99	73%	0.73	46%	0.458	S	S	*	.	H	α-helix	trans	-70.1	-39.3	178.3	-63.7	179.4	179.2	176.2	0	112	D124	D124-K126 PolarHBondContact O-N 3.23Å; D124-K126 WeakPolarHBondContact OD1-CA 3.39Å; D124-K126 VanDerWaalsContact OD1-CB 3.29Å; D124-K126 WeakPolarHBondContact OD1-CB 3.4Å; D124-K126 PolarHBondContact OD1-N 3.11Å
127	L	92	Very high	84	Confident	78 Å²	78	97.1 Å²	97.1	41%	0.408	45%	0.451	S	S	.	.	H	α-helix	trans	-68.4	-49.6	175.9	-174.8	67.1	0	0	0	110.3	L121 D124 N129 R130 L131	L121-L127 HydrophobicContact CB-CD2 4.17Å; L121-L127 HydrophobicContact CD2-CD2 4.37Å; L121-L127 WeakPolarHBondContact O-CD2 3.39Å; D124-L127 HydrophobicContact CB-CB 4.07Å; D124-L127 PolarHBondContact O-N 3.32Å; D124-L127 VanDerWaalsContact O-N 3.13Å; D124-L127 PolarHBondContact OD1-N 3.05Å; L127-N129 VanDerWaalsContact C-N 3.26Å; L127-N129 PolarHBondContact O-N 2.98Å; L127-R130 PolarHBondContact O-N 3.35Å; L127-L131 WeakPolarHBondContact O-CB 3.5Å; L127-L131 PolarHBondContact O-N 3.24Å
128	L	93.1	Very high	85.8	Confident	2 Å²	2	95.4 Å²	95.4	1%	0.01	45%	0.452	C	S	.	.	H	α-helix	trans	-56.6	-40.3	177	-68.8	175.2	0	0	0	111.8	D124 R130 L131 L132 T149 W150 V153	D124-L128 WeakPolarHBondContact O-CB 3.48Å; D124-L128 WeakPolarHBondContact O-CG 3.31Å; D124-L128 PolarHBondContact O-N 3.2Å; L128-R130 PolarHBondContact O-N 3.48Å; L128-L131 PolarHBondContact O-N 3.17Å; L128-L132 HydrophobicContact CB-CD1 3.86Å; L128-L132 HydrophobicContact CB-CG 4.47Å; L128-L132 HydrophobicContact CD2-CD1 4.19Å; L128-L132 WeakPolarHBondContact O-CB 3.29Å; L128-L132 WeakPolarHBondContact O-CD1 3.34Å; L128-L132 WeakPolarHBondContact O-CG 3.46Å; L128-L132 PolarHBondContact O-N 2.93Å; L128-T149 HydrophobicContact CD1-CG2 4.13Å; L128-W150 HydrophobicContact CD1-CG 4.41Å; L128-W150 HydrophobicContact CD2-CD2 4.24Å; L128-W150 HydrophobicContact CD2-CG 4.47Å; L128-W150 HydrophobicContact CD2-CZ2 3.81Å; L128-V153 HydrophobicContact CB-CG1 4.13Å; L128-V153 HydrophobicContact CB-CG2 4.22Å; L128-V153 HydrophobicContact CD1-CG2 4.25Å
129	N	92	Very high	87.6	Confident	34 Å²	34	93.6 Å²	93.6	18%	0.182	44%	0.444	C	S	.	.	H	α-helix	trans	-61.6	-23.5	177.7	-90.7	-66.6	0	0	0	114.4	E125 L127 Q156 K158	E125-N129 WeakPolarHBondContact O-CB 3.49Å; E125-N129 VanDerWaalsContact O-CG 3.28Å; E125-N129 PolarHBondContact O-N 3.03Å; E125-N129 PolarHBondContact O-ND2 2.79Å; L127-N129 VanDerWaalsContact C-N 3.26Å; L127-N129 PolarHBondContact O-N 2.98Å; N129-Q156 PolarHBondContact OD1-OE1 3.47Å; N129-K158 WeakPolarHBondContact OD1-CE 3.46Å; N129-K158 PolarHBondContact OD1-NZ 2.88Å
130	R	92.8	Very high	89.2	Confident	195 Å²	195	85.5 Å²	85.5	74%	0.736	41%	0.414	S	S	*	.	H	α-helix	trans	-93.1	-48.5	174.1	-63.4	-178.5	-179.2	-160.8	-1.5	111.2	L127 L128 L132 W133 Y134	L127-R130 PolarHBondContact O-N 3.35Å; L128-R130 PolarHBondContact O-N 3.48Å; R130-L132 PolarHBondContact O-N 2.82Å; R130-W133 VanDerWaalsContact O-CB 3.31Å; R130-W133 WeakPolarHBondContact O-CB 3.45Å; R130-W133 PolarHBondContact O-N 2.95Å; R130-Y134 WeakPolarHBondContact O-CD2 3.49Å; R130-Y134 WeakPolarHBondContact O-CE2 3.38Å
131	L	93.4	Very high	90.6	Very high	80 Å²	80	81.6 Å²	81.6	42%	0.419	40%	0.401	S	S	.	.	H	α-helix	trans	-59.7	-45.2	-177.4	178.5	61.8	0	0	0	112.1	L127 L128 W133 Y134 F135	L127-L131 WeakPolarHBondContact O-CB 3.5Å; L127-L131 PolarHBondContact O-N 3.24Å; L128-L131 PolarHBondContact O-N 3.17Å; L131-W133 PolarHBondContact O-N 2.94Å; L131-Y134 PolarHBondContact O-N 3.06Å; L131-F135 HydrophobicContact CD1-CE2 4.3Å; L131-F135 HydrophobicContact CG-CE2 4.23Å; L131-F135 WeakPolarHBondContact O-CD2 3.39Å; L131-F135 WeakPolarHBondContact O-CE2 3.26Å
132	L	94	Very high	91.8	Very high	0 Å²	0	81.9 Å²	81.9	0%	0	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-73.7	-7.1	-175.4	-62	170	0	0	0	113.4	L128 R130 F135 K140 L143 W150 V153 L154 F159	L128-L132 HydrophobicContact CB-CD1 3.86Å; L128-L132 HydrophobicContact CB-CG 4.47Å; L128-L132 HydrophobicContact CD2-CD1 4.19Å; L128-L132 WeakPolarHBondContact O-CB 3.29Å; L128-L132 WeakPolarHBondContact O-CD1 3.34Å; L128-L132 WeakPolarHBondContact O-CG 3.46Å; L128-L132 PolarHBondContact O-N 2.93Å; R130-L132 PolarHBondContact O-N 2.82Å; L132-F135 HydrophobicContact CD2-CD2 4.44Å; L132-K140 WeakPolarHBondContact O-CE 3.44Å; L132-L143 HydrophobicContact CD2-CB 4.48Å; L132-L143 HydrophobicContact CD2-CD1 3.53Å; L132-W150 HydrophobicContact CD2-CE3 4.28Å; L132-W150 HydrophobicContact CD2-CZ3 4.18Å; L132-V153 HydrophobicContact CD1-CB 4.37Å; L132-V153 HydrophobicContact CD1-CG1 3.92Å; L132-L154 HydrophobicContact CB-CD2 3.98Å; L132-L154 HydrophobicContact CD1-CD1 4.32Å; L132-L154 HydrophobicContact CD1-CD2 4.01Å; L132-L154 HydrophobicContact CD1-CG 3.89Å; L132-L154 HydrophobicContact CD2-CD2 4.47Å; L132-L154 HydrophobicContact CG-CD2 4.38Å; L132-F159 HydrophobicContact CB-CE1 4.18Å; L132-F159 HydrophobicContact CB-CZ 4.35Å
133	W	92.8	Very high	92.6	Very high	139 Å²	139	79.7 Å²	79.7	53%	0.527	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-67.3	-40.5	176	-166.3	-97.6	0	0	0	111.9	R130 L131 F135 K140 K158 F159	R130-W133 VanDerWaalsContact O-CB 3.31Å; R130-W133 WeakPolarHBondContact O-CB 3.45Å; R130-W133 PolarHBondContact O-N 2.95Å; L131-W133 PolarHBondContact O-N 2.94Å; W133-F135 PolarHBondContact O-N 2.98Å; W133-K140 PolarHBondContact O-NZ 3.46Å; W133-K158 VanDerWaalsContact CH2-O 3.3Å; W133-K158 WeakPolarHBondContact CH2-O 3.48Å; W133-K158 HydrophobicContact CZ3-CB 4.26Å; W133-K158 HydrophobicContact CZ3-CG 4.14Å; W133-K158 WeakPolarHBondContact CZ3-O 3.2Å; W133-F159 HydrophobicContact CB-CE1 4.4Å; W133-F159 AromaticContact CE3-CD1 3.78Å; W133-F159 HydrophobicContact CE3-CD1 3.78Å; W133-F159 AromaticContact CE3-CE1 3.67Å; W133-F159 HydrophobicContact CE3-CE1 3.67Å; W133-F159 HydrophobicContact CZ3-CD1 4.18Å; W133-F159 HydrophobicContact CZ3-CE1 4.38Å
134	Y	94.4	Very high	93.2	Very high	198 Å²	198	76 Å²	76	78%	0.776	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-71.7	-10.1	-174.2	-63.3	-80.7	0	0	0	115.2	R130 L131	R130-Y134 WeakPolarHBondContact O-CD2 3.49Å; R130-Y134 WeakPolarHBondContact O-CE2 3.38Å; L131-Y134 PolarHBondContact O-N 3.06Å
135	F	95	Very high	93.4	Very high	62 Å²	62	79.4 Å²	79.4	27%	0.272	39%	0.387	S	S	.	.	S	Bend	trans	-86.2	147.8	-179.9	-69.9	-91.4	0	0	0	111.6	L131 L132 W133 E139 K140 L143	L131-F135 HydrophobicContact CD1-CE2 4.3Å; L131-F135 HydrophobicContact CG-CE2 4.23Å; L131-F135 WeakPolarHBondContact O-CD2 3.39Å; L131-F135 WeakPolarHBondContact O-CE2 3.26Å; L132-F135 HydrophobicContact CD2-CD2 4.44Å; W133-F135 PolarHBondContact O-N 2.98Å; F135-E139 HydrophobicContact CB-CB 4.01Å; F135-E139 HydrophobicContact CD1-CB 3.94Å; F135-E139 HydrophobicContact CD1-CG 4.4Å; F135-E139 HydrophobicContact CG-CB 4.44Å; F135-K140 HydrophobicContact CB-CG 4.13Å; F135-K140 WeakPolarHBondContact O-CE 3.35Å; F135-K140 PolarHBondContact O-NZ 2.9Å; F135-L143 HydrophobicContact CB-CD1 4.45Å; F135-L143 HydrophobicContact CD1-CD1 3.79Å; F135-L143 HydrophobicContact CD2-CD1 4Å; F135-L143 HydrophobicContact CE1-CD1 3.95Å; F135-L143 HydrophobicContact CE2-CD1 4.16Å; F135-L143 HydrophobicContact CG-CD1 3.8Å; F135-L143 HydrophobicContact CZ-CD1 4.13Å
136	T	94.1	Very high	93.6	Very high	80 Å²	80	80.3 Å²	80.3	49%	0.491	40%	0.397	S	S	.	.			trans	-64.2	163	172	64	0	0	0	0	111.8	A138 E139 K140	T136-A138 PolarHBondContact O-N 3.38Å; T136-E139 VanDerWaalsContact CB-OE2 3.32Å; T136-E139 WeakPolarHBondContact CB-OE2 3.46Å; T136-E139 WeakPolarHBondContact CG2-OE2 3.28Å; T136-E139 PolarHBondContact N-OE2 2.76Å; T136-E139 PolarHBondContact O-N 3.46Å; T136-E139 VanDerWaalsContact OG1-CD 3.3Å; T136-E139 VanDerWaalsContact OG1-CG 3.28Å; T136-E139 WeakPolarHBondContact OG1-CG 3.2Å; T136-E139 PolarHBondContact OG1-N 2.82Å; T136-E139 PolarHBondContact OG1-OE2 2.93Å; T136-K140 WeakPolarHBondContact O-CB 3.33Å; T136-K140 VanDerWaalsContact O-CG 3.28Å; T136-K140 WeakPolarHBondContact O-CG 3.45Å; T136-K140 PolarHBondContact O-N 3.13Å
137	T	92.4	Very high	93.8	Very high	59 Å²	59	74.1 Å²	74.1	36%	0.362	38%	0.375	S	S	.	.	H	α-helix	trans	-56.3	-38.9	174.8	-51.4	0	0	0	0	112.4	C141 W160 V163	T137-C141 PolarHBondContact O-N 2.7Å; T137-C141 PolarHBondContact O-SG 2.65Å; T137-W160 HydrophobicContact CG2-CE3 4.01Å; T137-W160 HydrophobicContact CG2-CZ3 3.69Å; T137-V163 HydrophobicContact CG2-CG1 3.69Å; T137-V163 HydrophobicContact CG2-CG2 4Å
138	A	92.3	Very high	93.8	Very high	72 Å²	72	79.3 Å²	79.3	60%	0.595	39%	0.394	S	S	*	.	H	α-helix	trans	-67.3	-46.5	178.2	0	0	0	0	0	111.9	T136 K140 C141 V142	T136-A138 PolarHBondContact O-N 3.38Å; A138-K140 PolarHBondContact O-N 3.19Å; A138-C141 WeakPolarHBondContact O-CB 3.34Å; A138-C141 PolarHBondContact O-N 3.16Å; A138-V142 PolarHBondContact O-N 3.24Å
139	E	95.6	Very high	93.8	Very high	85 Å²	85	81 Å²	81	40%	0.397	41%	0.405	S	S	.	.	H	α-helix	trans	-62.2	-43.8	175.7	-69.5	163.9	126.4	0	0	111.2	F135 T136 C141 V142 L143	F135-E139 HydrophobicContact CB-CB 4.01Å; F135-E139 HydrophobicContact CD1-CB 3.94Å; F135-E139 HydrophobicContact CD1-CG 4.4Å; F135-E139 HydrophobicContact CG-CB 4.44Å; T136-E139 VanDerWaalsContact CB-OE2 3.32Å; T136-E139 WeakPolarHBondContact CB-OE2 3.46Å; T136-E139 WeakPolarHBondContact CG2-OE2 3.28Å; T136-E139 PolarHBondContact N-OE2 2.76Å; T136-E139 PolarHBondContact O-N 3.46Å; T136-E139 VanDerWaalsContact OG1-CD 3.3Å; T136-E139 VanDerWaalsContact OG1-CG 3.28Å; T136-E139 WeakPolarHBondContact OG1-CG 3.2Å; T136-E139 PolarHBondContact OG1-N 2.82Å; T136-E139 PolarHBondContact OG1-OE2 2.93Å; E139-C141 PolarHBondContact O-N 2.83Å; E139-V142 CarbonylContact O-C 3.58Å; E139-V142 WeakPolarHBondContact O-CA 3.21Å; E139-V142 WeakPolarHBondContact O-CB 3.16Å; E139-V142 PolarHBondContact O-N 3.43Å; E139-L143 WeakPolarHBondContact O-CG 3.37Å; E139-L143 PolarHBondContact O-N 3.49Å
140	K	95.3	Very high	94	Very high	19 Å²	19	81 Å²	81	8%	0.083	40%	0.402	C	S	.	.	H	α-helix	trans	-53.9	-37.7	174.8	-74.9	163.7	173.5	150.2	0	112.3	L132 W133 F135 T136 A138 L143 A144 L154 W160	L132-K140 WeakPolarHBondContact O-CE 3.44Å; W133-K140 PolarHBondContact O-NZ 3.46Å; F135-K140 HydrophobicContact CB-CG 4.13Å; F135-K140 WeakPolarHBondContact O-CE 3.35Å; F135-K140 PolarHBondContact O-NZ 2.9Å; T136-K140 WeakPolarHBondContact O-CB 3.33Å; T136-K140 VanDerWaalsContact O-CG 3.28Å; T136-K140 WeakPolarHBondContact O-CG 3.45Å; T136-K140 PolarHBondContact O-N 3.13Å; A138-K140 PolarHBondContact O-N 3.19Å; K140-L143 PolarHBondContact O-N 2.92Å; K140-A144 WeakPolarHBondContact O-CB 3.45Å; K140-A144 PolarHBondContact O-N 3.21Å; K140-L154 HydrophobicContact CB-CD2 4.11Å; K140-L154 HydrophobicContact CG-CD2 3.89Å; K140-W160 HydrophobicContact CB-CH2 3.88Å; K140-W160 HydrophobicContact CB-CZ2 4.19Å
141	C	92.9	Very high	94.1	Very high	54 Å²	54	76.9 Å²	76.9	37%	0.365	39%	0.386	S	S	.	.	H	α-helix	trans	-63.9	-36.6	173.8	-72.7	0	0	0	0	113.4	T137 A138 E139 Q145 W160	T137-C141 PolarHBondContact O-N 2.7Å; T137-C141 PolarHBondContact O-SG 2.65Å; A138-C141 WeakPolarHBondContact O-CB 3.34Å; A138-C141 PolarHBondContact O-N 3.16Å; E139-C141 PolarHBondContact O-N 2.83Å; C141-Q145 PolarHBondContact O-NE2 3.35Å; C141-W160 VanDerWaalsContact SG-CH2 3.6Å
142	V	95.6	Very high	94.2	Very high	93 Å²	93	78.9 Å²	78.9	56%	0.564	39%	0.392	S	S	*	.	H	α-helix	trans	-73.9	-45.4	175	-178.5	0	0	0	0	110.6	A138 E139 A144 Q145	A138-V142 PolarHBondContact O-N 3.24Å; E139-V142 CarbonylContact O-C 3.58Å; E139-V142 WeakPolarHBondContact O-CA 3.21Å; E139-V142 WeakPolarHBondContact O-CB 3.16Å; E139-V142 PolarHBondContact O-N 3.43Å; V142-A144 PolarHBondContact O-N 3.29Å; V142-Q145 VanDerWaalsContact O-CB 3.31Å; V142-Q145 WeakPolarHBondContact O-CB 3.33Å; V142-Q145 PolarHBondContact O-N 2.92Å
143	L	95.1	Very high	94.2	Very high	29 Å²	29	78.9 Å²	78.9	15%	0.152	39%	0.392	C	S	.	.	H	α-helix	trans	-62.8	-28.8	-178.8	-63.4	-166.7	0	0	0	112.8	L132 F135 E139 K140 Q145 V146 W150 L154	L132-L143 HydrophobicContact CD2-CB 4.48Å; L132-L143 HydrophobicContact CD2-CD1 3.53Å; F135-L143 HydrophobicContact CB-CD1 4.45Å; F135-L143 HydrophobicContact CD1-CD1 3.79Å; F135-L143 HydrophobicContact CD2-CD1 4Å; F135-L143 HydrophobicContact CE1-CD1 3.95Å; F135-L143 HydrophobicContact CE2-CD1 4.16Å; F135-L143 HydrophobicContact CG-CD1 3.8Å; F135-L143 HydrophobicContact CZ-CD1 4.13Å; E139-L143 WeakPolarHBondContact O-CG 3.37Å; E139-L143 PolarHBondContact O-N 3.49Å; K140-L143 PolarHBondContact O-N 2.92Å; L143-Q145 PolarHBondContact O-N 3.32Å; L143-Q145 VanDerWaalsContact O-N 3.17Å; L143-V146 HydrophobicContact CD2-CG2 4.42Å; L143-V146 WeakPolarHBondContact O-CB 3.32Å; L143-V146 PolarHBondContact O-N 2.86Å; L143-W150 HydrophobicContact CB-CE3 3.99Å; L143-W150 HydrophobicContact CB-CZ3 4.16Å; L143-W150 HydrophobicContact CD1-CZ3 4.06Å; L143-W150 HydrophobicContact CD2-CE3 4.49Å; L143-W150 HydrophobicContact CD2-CZ3 3.91Å; L143-W150 HydrophobicContact CG-CZ3 4.23Å; L143-L154 HydrophobicContact CB-CD1 3.74Å
144	A	94.5	Very high	94.4	Very high	9 Å²	9	72.2 Å²	72.2	7%	0.074	37%	0.367	C	S	.	.	H	α-helix	trans	-66.7	-10.1	173.2	0	0	0	0	0	114.2	K140 V142 R151 L154 Y155	K140-A144 WeakPolarHBondContact O-CB 3.45Å; K140-A144 PolarHBondContact O-N 3.21Å; V142-A144 PolarHBondContact O-N 3.29Å; A144-R151 WeakPolarHBondContact O-CB 3.38Å; A144-R151 PolarHBondContact O-NE 2.85Å; A144-L154 HydrophobicContact CB-CB 4.33Å; A144-L154 HydrophobicContact CB-CD1 3.91Å; A144-L154 VanDerWaalsContact N-CD1 3.3Å; A144-Y155 HydrophobicContact CB-CE1 4.4Å
145	Q	94.7	Very high	94.4	Very high	142 Å²	142	65.8 Å²	65.8	66%	0.664	34%	0.341	S	S	*	.	H	α-helix	trans	-93.3	-19.3	177.3	-52.3	-176.5	30.5	0	0	112.6	C141 V142 L143	C141-Q145 PolarHBondContact O-NE2 3.35Å; V142-Q145 VanDerWaalsContact O-CB 3.31Å; V142-Q145 WeakPolarHBondContact O-CB 3.33Å; V142-Q145 PolarHBondContact O-N 2.92Å; L143-Q145 PolarHBondContact O-N 3.32Å; L143-Q145 VanDerWaalsContact O-N 3.17Å
146	V	93.9	Very high	94.4	Very high	89 Å²	89	65.6 Å²	65.6	54%	0.539	34%	0.341	S	S	.	.	H	α-helix	trans	-59.7	-52.8	-174.1	175.1	0	0	0	0	112.7	L143 W150	L143-V146 HydrophobicContact CD2-CG2 4.42Å; L143-V146 WeakPolarHBondContact O-CB 3.32Å; L143-V146 PolarHBondContact O-N 2.86Å; V146-W150 HydrophobicContact CB-CD2 4.25Å; V146-W150 HydrophobicContact CB-CE3 3.98Å; V146-W150 HydrophobicContact CG1-CD2 4.18Å; V146-W150 HydrophobicContact CG1-CE3 4.18Å; V146-W150 HydrophobicContact CG2-CE3 4.07Å; V146-W150 HydrophobicContact CG2-CZ3 4.36Å
147	C	92.9	Very high	94.5	Very high	38 Å²	38	65.1 Å²	65.1	26%	0.257	34%	0.34	S	S	.	.			trans	-157.9	168.6	175.6	82.7	0	0	0	0	112.6	T149 W150 R151	C147-T149 VanDerWaalsContact C-N 3.32Å; C147-T149 PolarHBondContact O-N 3.31Å; C147-W150 PolarHBondContact O-N 3.19Å; C147-W150 PolarHBondContact SG-N 3.45Å; C147-W150 VanDerWaalsContact SG-N 3.43Å; C147-R151 WeakPolarHBondContact O-CB 3.38Å; C147-R151 PolarHBondContact O-N 2.88Å
148	K	93.1	Very high	94.5	Very high	186 Å²	186	66.1 Å²	66.1	81%	0.809	34%	0.339	S	S	*	.	H	α-helix	trans	-59.9	-37.6	-179.2	-65.9	-175.4	179.9	-178.7	0	113.1	K152	K148-K152 WeakPolarHBondContact O-CB 3.37Å; K148-K152 PolarHBondContact O-N 2.92Å
149	T	93.7	Very high	94.7	Very high	39 Å²	39	63.1 Å²	63.1	24%	0.239	31%	0.312	C	S	.	.	H	α-helix	trans	-68.2	-45.3	178.7	-50.1	0	0	0	0	111.4	L123 E125 L128 C147 R151 K152 V153	L123-T149 HydrophobicContact CD2-CG2 4.48Å; E125-T149 HydrophobicContact CG-CG2 4.1Å; L128-T149 HydrophobicContact CD1-CG2 4.13Å; C147-T149 VanDerWaalsContact C-N 3.32Å; C147-T149 PolarHBondContact O-N 3.31Å; T149-R151 VanDerWaalsContact C-N 3.34Å; T149-R151 PolarHBondContact O-N 3.37Å; T149-K152 PolarHBondContact O-N 3.43Å; T149-V153 WeakPolarHBondContact O-CG2 3.48Å; T149-V153 PolarHBondContact O-N 3.2Å
150	W	95.4	Very high	94.6	Very high	33 Å²	33	59.6 Å²	59.6	13%	0.125	30%	0.296	C	S	.	.	H	α-helix	trans	-61.4	-44.7	176.5	-75.3	37.4	0	0	0	110.7	V122 L128 L132 L143 V146 C147 K152 V153 L154	V122-W150 HydrophobicContact CG1-CZ2 3.98Å; V122-W150 PolarHBondContact O-NE1 3.43Å; L128-W150 HydrophobicContact CD1-CG 4.41Å; L128-W150 HydrophobicContact CD2-CD2 4.24Å; L128-W150 HydrophobicContact CD2-CG 4.47Å; L128-W150 HydrophobicContact CD2-CZ2 3.81Å; L132-W150 HydrophobicContact CD2-CE3 4.28Å; L132-W150 HydrophobicContact CD2-CZ3 4.18Å; L143-W150 HydrophobicContact CB-CE3 3.99Å; L143-W150 HydrophobicContact CB-CZ3 4.16Å; L143-W150 HydrophobicContact CD1-CZ3 4.06Å; L143-W150 HydrophobicContact CD2-CE3 4.49Å; L143-W150 HydrophobicContact CD2-CZ3 3.91Å; L143-W150 HydrophobicContact CG-CZ3 4.23Å; V146-W150 HydrophobicContact CB-CD2 4.25Å; V146-W150 HydrophobicContact CB-CE3 3.98Å; V146-W150 HydrophobicContact CG1-CD2 4.18Å; V146-W150 HydrophobicContact CG1-CE3 4.18Å; V146-W150 HydrophobicContact CG2-CE3 4.07Å; V146-W150 HydrophobicContact CG2-CZ3 4.36Å; C147-W150 PolarHBondContact O-N 3.19Å; C147-W150 PolarHBondContact SG-N 3.45Å; C147-W150 VanDerWaalsContact SG-N 3.43Å; W150-K152 PolarHBondContact O-N 3.38Å; W150-V153 PolarHBondContact O-N 3.23Å; W150-L154 WeakPolarHBondContact O-CB 3.4Å; W150-L154 WeakPolarHBondContact O-CG 3.4Å; W150-L154 PolarHBondContact O-N 3.25Å
151	R	95.2	Very high	94.4	Very high	108 Å²	108	66.5 Å²	66.5	41%	0.408	33%	0.328	S	S	.	.	H	α-helix	trans	-57	-47.3	172.7	-166	177.7	-62.2	179	0.4	112.5	A144 C147 T149 V153 L154 Y155	A144-R151 WeakPolarHBondContact O-CB 3.38Å; A144-R151 PolarHBondContact O-NE 2.85Å; C147-R151 WeakPolarHBondContact O-CB 3.38Å; C147-R151 PolarHBondContact O-N 2.88Å; T149-R151 VanDerWaalsContact C-N 3.34Å; T149-R151 PolarHBondContact O-N 3.37Å; R151-V153 PolarHBondContact O-N 3.08Å; R151-L154 PolarHBondContact O-N 2.81Å; R151-Y155 HydrophobicContact CG-CD1 3.74Å; R151-Y155 HydrophobicContact CG-CE1 3.42Å; R151-Y155 VanDerWaalsContact CG-CE1 3.42Å; R151-Y155 HydrophobicContact CG-CE2 4.42Å; R151-Y155 HydrophobicContact CG-CG 4.38Å; R151-Y155 WeakPolarHBondContact O-CB 3.23Å; R151-Y155 WeakPolarHBondContact O-CD1 3.17Å; R151-Y155 PolarHBondContact O-N 3.47Å
152	K	94.6	Very high	94.3	Very high	122 Å²	122	67.6 Å²	67.6	53%	0.53	35%	0.348	S	S	.	.	H	α-helix	trans	-60.3	-41.8	178.9	-176.7	-165.1	169	-153.2	0	112.1	E125 K148 T149 W150	E125-K152 VanDerWaalsContact CD-NZ 3.32Å; E125-K152 WeakPolarHBondContact OE1-CD 3.13Å; E125-K152 IonicContact OE1-NZ 2.65Å; E125-K152 PolarHBondContact OE1-NZ 3.21Å; E125-K152 IonicContact OE2-NZ 3.16Å; E125-K152 PolarHBondContact OE2-NZ 2.99Å; E125-K152 VanDerWaalsContact OE2-NZ 3.16Å; K148-K152 WeakPolarHBondContact O-CB 3.37Å; K148-K152 PolarHBondContact O-N 2.92Å; T149-K152 PolarHBondContact O-N 3.43Å; W150-K152 PolarHBondContact O-N 3.38Å
153	V	95.4	Very high	94.3	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-68.5	-48.4	176.3	174.5	0	0	0	0	110.6	E125 L128 L132 T149 W150 R151 Y155 Q156 F159	E125-V153 HydrophobicContact CB-CG2 4.06Å; E125-V153 HydrophobicContact CG-CG2 3.87Å; L128-V153 HydrophobicContact CB-CG1 4.13Å; L128-V153 HydrophobicContact CB-CG2 4.22Å; L128-V153 HydrophobicContact CD1-CG2 4.25Å; L132-V153 HydrophobicContact CD1-CB 4.37Å; L132-V153 HydrophobicContact CD1-CG1 3.92Å; T149-V153 WeakPolarHBondContact O-CG2 3.48Å; T149-V153 PolarHBondContact O-N 3.2Å; W150-V153 PolarHBondContact O-N 3.23Å; R151-V153 PolarHBondContact O-N 3.08Å; V153-Y155 VanDerWaalsContact C-N 3.26Å; V153-Y155 PolarHBondContact O-N 3Å; V153-Q156 WeakPolarHBondContact O-CB 3.44Å; V153-Q156 VanDerWaalsContact O-CG 3.26Å; V153-Q156 WeakPolarHBondContact O-CG 3.37Å; V153-Q156 PolarHBondContact O-N 3.46Å; V153-F159 HydrophobicContact CG1-CE2 3.95Å; V153-F159 HydrophobicContact CG1-CZ 4.25Å; V153-F159 WeakPolarHBondContact O-CD2 3.4Å; V153-F159 VanDerWaalsContact O-CE2 3.3Å; V153-F159 WeakPolarHBondContact O-CE2 3.31Å
154	L	95.8	Very high	94.3	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-65.9	-26.7	-179	-73.9	164.9	0	0	0	113	L132 K140 L143 A144 W150 R151 Q156 W160	L132-L154 HydrophobicContact CB-CD2 3.98Å; L132-L154 HydrophobicContact CD1-CD1 4.32Å; L132-L154 HydrophobicContact CD1-CD2 4.01Å; L132-L154 HydrophobicContact CD1-CG 3.89Å; L132-L154 HydrophobicContact CD2-CD2 4.47Å; L132-L154 HydrophobicContact CG-CD2 4.38Å; K140-L154 HydrophobicContact CB-CD2 4.11Å; K140-L154 HydrophobicContact CG-CD2 3.89Å; L143-L154 HydrophobicContact CB-CD1 3.74Å; A144-L154 HydrophobicContact CB-CB 4.33Å; A144-L154 HydrophobicContact CB-CD1 3.91Å; A144-L154 VanDerWaalsContact N-CD1 3.3Å; W150-L154 WeakPolarHBondContact O-CB 3.4Å; W150-L154 WeakPolarHBondContact O-CG 3.4Å; W150-L154 PolarHBondContact O-N 3.25Å; R151-L154 PolarHBondContact O-N 2.81Å; L154-Q156 PolarHBondContact O-N 3.46Å; L154-Q156 VanDerWaalsContact O-N 3.16Å; L154-W160 PolarHBondContact O-NE1 2.81Å
155	Y	95.3	Very high	94.4	Very high	62 Å²	62	66.9 Å²	66.9	24%	0.243	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-0	177.4	-84.3	35.5	0	0	0	113.3	A144 R151 V153 A188 L191 R192	A144-Y155 HydrophobicContact CB-CE1 4.4Å; R151-Y155 HydrophobicContact CG-CD1 3.74Å; R151-Y155 HydrophobicContact CG-CE1 3.42Å; R151-Y155 VanDerWaalsContact CG-CE1 3.42Å; R151-Y155 HydrophobicContact CG-CE2 4.42Å; R151-Y155 HydrophobicContact CG-CG 4.38Å; R151-Y155 WeakPolarHBondContact O-CB 3.23Å; R151-Y155 WeakPolarHBondContact O-CD1 3.17Å; R151-Y155 PolarHBondContact O-N 3.47Å; V153-Y155 VanDerWaalsContact C-N 3.26Å; V153-Y155 PolarHBondContact O-N 3Å; Y155-A188 HydrophobicContact CE2-CB 4.03Å; Y155-L191 HydrophobicContact CD2-CB 3.84Å; Y155-L191 HydrophobicContact CD2-CD1 3.89Å; Y155-L191 HydrophobicContact CE2-CD1 4.16Å; Y155-L191 CarbonylContact O-C 3.59Å; Y155-R192 HydrophobicContact CD1-CG 4.28Å; Y155-R192 HydrophobicContact CG-CG 4.22Å
156	Q	95	Very high	94.5	Very high	58 Å²	58	65.2 Å²	65.2	27%	0.271	34%	0.339	S	S	.	.	S	Bend	trans	-71.4	131.1	173.7	-64.3	179.2	23.3	0	0	111.2	N129 V153 L154 K158 F159	N129-Q156 PolarHBondContact OD1-OE1 3.47Å; V153-Q156 WeakPolarHBondContact O-CB 3.44Å; V153-Q156 VanDerWaalsContact O-CG 3.26Å; V153-Q156 WeakPolarHBondContact O-CG 3.37Å; V153-Q156 PolarHBondContact O-N 3.46Å; L154-Q156 PolarHBondContact O-N 3.46Å; L154-Q156 VanDerWaalsContact O-N 3.16Å; Q156-K158 VanDerWaalsContact C-N 3.26Å; Q156-K158 HydrophobicContact CB-CG 4.32Å; Q156-K158 PolarHBondContact O-N 3.45Å; Q156-K158 VanDerWaalsContact O-N 3.07Å; Q156-F159 HydrophobicContact CB-CD2 4.15Å; Q156-F159 HydrophobicContact CB-CE2 4.37Å; Q156-F159 PolarHBondContact O-N 2.98Å; Q156-F159 VanDerWaalsContact O-N 3.15Å
157	P	94.8	Very high	94.7	Very high	70 Å²	70	61.7 Å²	61.7	46%	0.455	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-55.8	-31.7	-172.4	-30.8	35.8	0	0	0	116.4	F159 W160 E161 R192	P157-F159 PolarHBondContact O-N 2.82Å; P157-W160 CarbonylContact O-C 3.56Å; P157-W160 PolarHBondContact O-N 2.6Å; P157-E161 PolarHBondContact O-N 3.2Å; P157-R192 VanDerWaalsContact CA-O 3.31Å; P157-R192 WeakPolarHBondContact CA-O 3.16Å
158	K	94.3	Very high	94.9	Very high	81 Å²	81	64.2 Å²	64.2	35%	0.352	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-54.4	-22.8	177.9	70.7	-173.1	-170.8	-154.4	0	115.1	N129 W133 Q156 W160	N129-K158 WeakPolarHBondContact OD1-CE 3.46Å; N129-K158 PolarHBondContact OD1-NZ 2.88Å; W133-K158 VanDerWaalsContact CH2-O 3.3Å; W133-K158 WeakPolarHBondContact CH2-O 3.48Å; W133-K158 HydrophobicContact CZ3-CB 4.26Å; W133-K158 HydrophobicContact CZ3-CG 4.14Å; W133-K158 WeakPolarHBondContact CZ3-O 3.2Å; Q156-K158 VanDerWaalsContact C-N 3.26Å; Q156-K158 HydrophobicContact CB-CG 4.32Å; Q156-K158 PolarHBondContact O-N 3.45Å; Q156-K158 VanDerWaalsContact O-N 3.07Å; K158-W160 VanDerWaalsContact C-N 3.32Å
159	F	95.1	Very high	94.9	Very high	8 Å²	8	56.2 Å²	56.2	4%	0.035	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-83.1	-8.9	177.3	-69.4	-68.4	0	0	0	113.7	L132 W133 V153 Q156 P157	L132-F159 HydrophobicContact CB-CE1 4.18Å; L132-F159 HydrophobicContact CB-CZ 4.35Å; W133-F159 HydrophobicContact CB-CE1 4.4Å; W133-F159 AromaticContact CE3-CD1 3.78Å; W133-F159 HydrophobicContact CE3-CD1 3.78Å; W133-F159 AromaticContact CE3-CE1 3.67Å; W133-F159 HydrophobicContact CE3-CE1 3.67Å; W133-F159 HydrophobicContact CZ3-CD1 4.18Å; W133-F159 HydrophobicContact CZ3-CE1 4.38Å; V153-F159 HydrophobicContact CG1-CE2 3.95Å; V153-F159 HydrophobicContact CG1-CZ 4.25Å; V153-F159 WeakPolarHBondContact O-CD2 3.4Å; V153-F159 VanDerWaalsContact O-CE2 3.3Å; V153-F159 WeakPolarHBondContact O-CE2 3.31Å; Q156-F159 HydrophobicContact CB-CD2 4.15Å; Q156-F159 HydrophobicContact CB-CE2 4.37Å; Q156-F159 PolarHBondContact O-N 2.98Å; Q156-F159 VanDerWaalsContact O-N 3.15Å; P157-F159 PolarHBondContact O-N 2.82Å
160	W	94.7	Very high	94.9	Very high	11 Å²	11	63.6 Å²	63.6	4%	0.042	32%	0.322	C	S	.	.	S	Bend	trans	-128.4	8.5	-173.4	-50.1	93.7	0	0	0	112.8	T137 K140 C141 L154 P157 K158 G162 V163 R192 F194	T137-W160 HydrophobicContact CG2-CE3 4.01Å; T137-W160 HydrophobicContact CG2-CZ3 3.69Å; K140-W160 HydrophobicContact CB-CH2 3.88Å; K140-W160 HydrophobicContact CB-CZ2 4.19Å; C141-W160 VanDerWaalsContact SG-CH2 3.6Å; L154-W160 PolarHBondContact O-NE1 2.81Å; P157-W160 CarbonylContact O-C 3.56Å; P157-W160 PolarHBondContact O-N 2.6Å; K158-W160 VanDerWaalsContact C-N 3.32Å; W160-G162 PolarHBondContact O-N 3.47Å; W160-V163 HydrophobicContact CE3-CG1 4.42Å; W160-V163 WeakPolarHBondContact O-CB 3.44Å; W160-V163 PolarHBondContact O-N 2.89Å; W160-R192 HydrophobicContact CD2-CG 4.48Å; W160-R192 VanDerWaalsContact CE2-CD 3.44Å; W160-R192 HydrophobicContact CG-CB 4.15Å; W160-R192 HydrophobicContact CG-CG 4.34Å; W160-F194 HydrophobicContact CB-CD1 4.32Å; W160-F194 HydrophobicContact CB-CE1 3.71Å; W160-F194 HydrophobicContact CB-CZ 4.13Å; W160-F194 HydrophobicContact CD2-CE1 4.39Å; W160-F194 HydrophobicContact CD2-CZ 4.02Å; W160-F194 HydrophobicContact CE3-CE1 4.14Å; W160-F194 AromaticContact CE3-CZ 3.78Å; W160-F194 HydrophobicContact CE3-CZ 3.78Å; W160-F194 HydrophobicContact CG-CE1 4.23Å; W160-F194 HydrophobicContact CG-CZ 4.16Å
161	E	90.9	Very high	94.7	Very high	165 Å²	165	67.3 Å²	67.3	77%	0.771	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	132.8	173.3	-171.3	167.7	-172.3	0	0	109.9	P157 V163	P157-E161 PolarHBondContact O-N 3.2Å; E161-V163 PolarHBondContact O-N 3.4Å
162	G	90.3	Very high	94.6	Very high	76 Å²	76	62.3 Å²	62.3	78%	0.784	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	-2.6	-173.4	0	0	0	0	0	116	W160	W160-G162 PolarHBondContact O-N 3.47Å
163	V	94.8	Very high	94.7	Very high	33 Å²	33	58.1 Å²	58.1	20%	0.2	30%	0.304	C	S	.	.			trans	-88	121.6	178.3	178.4	0	0	0	0	110.6	T137 W160 E161 F194 S196	T137-V163 HydrophobicContact CG2-CG1 3.69Å; T137-V163 HydrophobicContact CG2-CG2 4Å; W160-V163 HydrophobicContact CE3-CG1 4.42Å; W160-V163 WeakPolarHBondContact O-CB 3.44Å; W160-V163 PolarHBondContact O-N 2.89Å; E161-V163 PolarHBondContact O-N 3.4Å; V163-F194 HydrophobicContact CB-CE1 4.03Å; V163-F194 HydrophobicContact CG1-CE1 3.9Å; V163-F194 VanDerWaalsContact O-CD1 3.26Å; V163-F194 WeakPolarHBondContact O-CD1 3.49Å; V163-S196 PolarHBondContact O-OG 3.26Å
164	T	96.7	Very high	94.5	Very high	66 Å²	66	62 Å²	62	41%	0.405	33%	0.325	S	S	.	.			trans	-100.8	112.7	174	-58.1	0	0	0	0	110.3	S196 C198	T164-S196 WeakPolarHBondContact CA-OG 2.95Å; T164-S196 VanDerWaalsContact OG1-CB 3.25Å; T164-S196 WeakPolarHBondContact OG1-CB 3.3Å; T164-S196 PolarHBondContact OG1-OG 3.43Å; T164-C198 HydrophobicContact CG2-CB 4.22Å
165	P	96.3	Very high	94.3	Very high	17 Å²	17	68.5 Å²	68.5	11%	0.11	36%	0.358	C	S	.	.			trans	-68.9	136.8	171.1	-17.1	33	0	0	0	111.2	F189 F194 S196 F197 C198	P165-F189 HydrophobicContact CB-CD1 4.23Å; P165-F189 HydrophobicContact CB-CE1 3.73Å; P165-F189 HydrophobicContact CG-CD1 3.98Å; P165-F189 HydrophobicContact CG-CE1 3.95Å; P165-F194 HydrophobicContact CG-CB 4.44Å; P165-F194 HydrophobicContact CG-CD1 3.63Å; P165-F194 HydrophobicContact CG-CD2 3.85Å; P165-F194 HydrophobicContact CG-CE1 3.66Å; P165-F194 HydrophobicContact CG-CE2 3.86Å; P165-F194 HydrophobicContact CG-CG 3.73Å; P165-F194 HydrophobicContact CG-CZ 3.78Å; P165-S196 WeakPolarHBondContact CD-O 3.35Å; P165-F197 HydrophobicContact CB-CD1 4.42Å; P165-F197 HydrophobicContact CB-CE1 4.49Å; P165-F197 HydrophobicContact CG-CD1 4.44Å; P165-F197 HydrophobicContact CG-CE1 4.26Å; P165-C198 PolarHBondContact O-N 3.01Å
166	I	97.3	Very high	94.2	Very high	107 Å²	107	68.2 Å²	68.2	55%	0.549	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.8	170.3	-52.7	175.8	0	0	0	106.9	C198 V200	I166-C198 CarbonylContact C-O 3.58Å; I166-C198 WeakPolarHBondContact CA-O 3.36Å; I166-C198 HydrophobicContact CB-CB 4.43Å; I166-C198 HydrophobicContact CG1-CB 4.08Å; I166-C198 HydrophobicContact CG2-CB 4.41Å; I166-V200 HydrophobicContact CG2-CG2 3.75Å
167	L	96.8	Very high	94	Very high	16 Å²	16	72.3 Å²	72.3	8%	0.084	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	119.8	-179.6	-58.1	175.6	0	0	0	109	L172 L186 F189 F197 C198 L199 V200	L167-L172 HydrophobicContact CB-CD2 4.07Å; L167-L172 HydrophobicContact CD1-CD2 4.01Å; L167-L186 HydrophobicContact CD1-CD2 4.47Å; L167-F189 HydrophobicContact CD2-CE1 4.11Å; L167-F189 HydrophobicContact CD2-CZ 3.98Å; L167-F197 HydrophobicContact CD1-CD1 3.92Å; L167-F197 HydrophobicContact CD1-CE1 4.11Å; L167-C198 PolarHBondContact N-O 3.18Å; L167-L199 HydrophobicContact CB-CD2 3.98Å; L167-L199 HydrophobicContact CD1-CD2 4.07Å; L167-L199 HydrophobicContact CG-CD2 4.47Å; L167-L199 WeakPolarHBondContact O-CA 3.32Å; L167-V200 PolarHBondContact O-N 3.3Å
168	H	97.2	Very high	93.8	Very high	90 Å²	90	73.9 Å²	73.9	42%	0.417	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	146.7	170.9	-67.6	-90.3	0	0	0	110.2	K170 E171 L172 V200	H168-K170 PolarHBondContact O-N 3.26Å; H168-E171 HydrophobicContact CB-CG 4.15Å; H168-E171 IonicContact CD2-OE2 2.7Å; H168-E171 IonicContact CG-OE2 3.48Å; H168-E171 PolarHBondContact N-OE2 2.73Å; H168-E171 WeakPolarHBondContact O-CA 3.45Å; H168-E171 WeakPolarHBondContact O-CB 3.47Å; H168-E171 PolarHBondContact O-N 3.26Å; H168-L172 PolarHBondContact O-N 2.91Å; H168-V200 WeakPolarHBondContact CA-O 3.01Å
169	A	94.3	Very high	93.6	Very high	18 Å²	18	72.7 Å²	72.7	15%	0.149	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-28.2	-179.9	0	0	0	0	0	114.1	E171 L172 Y173 V200 G201 V202	A169-E171 VanDerWaalsContact C-N 3.31Å; A169-E171 PolarHBondContact O-N 2.68Å; A169-L172 PolarHBondContact O-N 3.32Å; A169-Y173 WeakPolarHBondContact O-CD2 3.31Å; A169-V200 PolarHBondContact N-O 2.69Å; A169-G201 WeakPolarHBondContact CB-O 3.28Å; A169-V202 HydrophobicContact CB-CG1 3.88Å
170	K	91.9	Very high	93.4	Very high	194 Å²	194	78.1 Å²	78.1	84%	0.843	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-24.6	174.1	-66.5	-177.6	-180	178.4	0	114.1	H168	H168-K170 PolarHBondContact O-N 3.26Å
171	E	92.3	Very high	93.2	Very high	112 Å²	112	84.7 Å²	84.7	52%	0.523	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-13.4	-179.2	-58	170.9	147.4	0	0	112	H168 A169 Y173	H168-E171 HydrophobicContact CB-CG 4.15Å; H168-E171 IonicContact CD2-OE2 2.7Å; H168-E171 IonicContact CG-OE2 3.48Å; H168-E171 PolarHBondContact N-OE2 2.73Å; H168-E171 WeakPolarHBondContact O-CA 3.45Å; H168-E171 WeakPolarHBondContact O-CB 3.47Å; H168-E171 PolarHBondContact O-N 3.26Å; A169-E171 VanDerWaalsContact C-N 3.31Å; A169-E171 PolarHBondContact O-N 2.68Å; E171-Y173 PolarHBondContact O-N 2.77Å
172	L	93.6	Very high	93.2	Very high	2 Å²	2	81.8 Å²	81.8	1%	0.01	45%	0.448	C	S	.	.	S	Bend	trans	-75.2	-11.1	175.8	-62.4	-178.8	0	0	0	113.2	L167 H168 A169 F183 V184 V202 D206	L167-L172 HydrophobicContact CB-CD2 4.07Å; L167-L172 HydrophobicContact CD1-CD2 4.01Å; H168-L172 PolarHBondContact O-N 2.91Å; A169-L172 PolarHBondContact O-N 3.32Å; L172-F183 HydrophobicContact CB-CD2 4.29Å; L172-F183 HydrophobicContact CB-CE2 3.76Å; L172-F183 HydrophobicContact CB-CZ 4.15Å; L172-F183 HydrophobicContact CD1-CE2 4.14Å; L172-F183 HydrophobicContact CD1-CZ 4.4Å; L172-F183 HydrophobicContact CD2-CE2 4.45Å; L172-F183 HydrophobicContact CD2-CZ 4.05Å; L172-F183 HydrophobicContact CG-CE2 4.33Å; L172-F183 HydrophobicContact CG-CZ 4.43Å; L172-F183 CarbonylContact O-C 3Å; L172-F183 WeakPolarHBondContact O-CA 3.38Å; L172-V184 PolarHBondContact O-N 3.43Å; L172-V202 HydrophobicContact CD1-CG1 3.87Å; L172-D206 HydrophobicContact CD1-CB 4.38Å
173	Y	95.3	Very high	93.4	Very high	34 Å²	34	79.2 Å²	79.2	13%	0.133	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.7	-177	-57.4	-86.8	0	0	0	113.2	A169 E171 K181 E182 F183 D206	A169-Y173 WeakPolarHBondContact O-CD2 3.31Å; E171-Y173 PolarHBondContact O-N 2.77Å; Y173-K181 HydrophobicContact CD1-CB 3.83Å; Y173-K181 HydrophobicContact CD1-CD 4.36Å; Y173-K181 HydrophobicContact CD2-CD 4.44Å; Y173-K181 HydrophobicContact CG-CB 4.15Å; Y173-K181 HydrophobicContact CG-CD 4.12Å; Y173-E182 CarbonylContact C-O 3.57Å; Y173-E182 VanDerWaalsContact CA-O 3.26Å; Y173-E182 WeakPolarHBondContact CA-O 3.26Å; Y173-F183 HydrophobicContact CD1-CB 4.31Å; Y173-F183 HydrophobicContact CD1-CD2 4.22Å; Y173-F183 HydrophobicContact CE1-CB 4.25Å; Y173-F183 AromaticContact CE1-CD2 3.7Å; Y173-F183 HydrophobicContact CE1-CD2 3.7Å; Y173-F183 HydrophobicContact CE1-CG 4.45Å; Y173-F183 AromaticContact CZ-CD2 3.91Å; Y173-D206 WeakPolarHBondContact CE2-OD1 3.49Å; Y173-D206 VanDerWaalsContact CZ-OD1 3.27Å; Y173-D206 PolarHBondContact OH-OD1 3.25Å
174	N	92.4	Very high	93.3	Very high	83 Å²	83	79.5 Å²	79.5	44%	0.444	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	140.5	158.4	-66	-42.9	0	0	0	109.2	K181 E182	N174-K181 WeakPolarHBondContact O-CA 3.45Å; N174-E182 PolarHBondContact N-O 3.07Å; N174-E182 PolarHBondContact O-N 3.15Å
175	I	91.9	Very high	93	Very high	136 Å²	136	80.5 Å²	80.5	70%	0.697	43%	0.427	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	115.8	168	-58.1	175.8	0	0	0	107.5
176	L	92.1	Very high	92.9	Very high	56 Å²	56	79.9 Å²	79.9	29%	0.293	42%	0.423	S	S	.	.			trans	-75.5	160.1	178.2	-65	-179	0	0	0	111.1	N178 G179 E180 E182	L176-N178 WeakPolarHBondContact CB-OD1 3.49Å; L176-N178 PolarHBondContact O-N 3.18Å; L176-G179 PolarHBondContact O-N 2.71Å; L176-E180 HydrophobicContact CD1-CB 4.38Å; L176-E180 PolarHBondContact N-O 3.16Å; L176-E182 HydrophobicContact CD1-CB 4.16Å; L176-E182 HydrophobicContact CD2-CB 4.32Å; L176-E182 HydrophobicContact CG-CB 4.17Å
177	P	91.5	Very high	92.7	Very high	144 Å²	144	79 Å²	79	94%	0.935	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-18.3	-177.9	-25.5	35.5	0	0	0	115.5
178	N	91.4	Very high	92.5	Very high	103 Å²	103	79.7 Å²	79.7	55%	0.551	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-2.8	173.9	63.2	-7.8	0	0	0	113.6	L176 E180	L176-N178 WeakPolarHBondContact CB-OD1 3.49Å; L176-N178 PolarHBondContact O-N 3.18Å; N178-E180 PolarHBondContact ND2-OE2 3.48Å; N178-E180 WeakPolarHBondContact OD1-CB 3.36Å; N178-E180 PolarHBondContact OD1-N 3.14Å; N178-E180 VanDerWaalsContact OD1-N 3.08Å
179	G	88.8	Confident	92.5	Very high	56 Å²	56	77.2 Å²	77.2	58%	0.577	41%	0.412	S	S	*	.	S	Bend	trans	88.4	-2.3	-177	0	0	0	0	0	115.1	L176	L176-G179 PolarHBondContact O-N 2.71Å
180	E	90.8	Very high	92.5	Very high	121 Å²	121	77 Å²	77	57%	0.565	41%	0.41	S	S	*	.			trans	-71.9	156.1	174.3	-67.5	176.3	161.8	0	0	111.4	L176 N178	L176-E180 HydrophobicContact CD1-CB 4.38Å; L176-E180 PolarHBondContact N-O 3.16Å; N178-E180 PolarHBondContact ND2-OE2 3.48Å; N178-E180 WeakPolarHBondContact OD1-CB 3.36Å; N178-E180 PolarHBondContact OD1-N 3.14Å; N178-E180 VanDerWaalsContact OD1-N 3.08Å
181	K	90.1	Very high	92.6	Very high	149 Å²	149	72.3 Å²	72.3	65%	0.648	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	130.5	175.5	-67.8	-176.5	-178.1	179.2	0	109.9	Y173 N174	Y173-K181 HydrophobicContact CD1-CB 3.83Å; Y173-K181 HydrophobicContact CD1-CD 4.36Å; Y173-K181 HydrophobicContact CD2-CD 4.44Å; Y173-K181 HydrophobicContact CG-CB 4.15Å; Y173-K181 HydrophobicContact CG-CD 4.12Å; N174-K181 WeakPolarHBondContact O-CA 3.45Å
182	E	92.3	Very high	92.8	Very high	105 Å²	105	68.4 Å²	68.4	49%	0.491	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	128.5	172.3	-179.1	-174.2	-138	0	0	109.1	Y173 N174 L176	Y173-E182 CarbonylContact C-O 3.57Å; Y173-E182 VanDerWaalsContact CA-O 3.26Å; Y173-E182 WeakPolarHBondContact CA-O 3.26Å; N174-E182 PolarHBondContact N-O 3.07Å; N174-E182 PolarHBondContact O-N 3.15Å; L176-E182 HydrophobicContact CD1-CB 4.16Å; L176-E182 HydrophobicContact CD2-CB 4.32Å; L176-E182 HydrophobicContact CG-CB 4.17Å
183	F	93.5	Very high	92.9	Very high	21 Å²	21	69.3 Å²	69.3	9%	0.092	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	136.9	-179.8	-164.6	-84.1	0	0	0	111.5	L172 Y173 S185 L186 E209 F210 N213	L172-F183 HydrophobicContact CB-CD2 4.29Å; L172-F183 HydrophobicContact CB-CE2 3.76Å; L172-F183 HydrophobicContact CB-CZ 4.15Å; L172-F183 HydrophobicContact CD1-CE2 4.14Å; L172-F183 HydrophobicContact CD1-CZ 4.4Å; L172-F183 HydrophobicContact CD2-CE2 4.45Å; L172-F183 HydrophobicContact CD2-CZ 4.05Å; L172-F183 HydrophobicContact CG-CE2 4.33Å; L172-F183 HydrophobicContact CG-CZ 4.43Å; L172-F183 CarbonylContact O-C 3Å; L172-F183 WeakPolarHBondContact O-CA 3.38Å; Y173-F183 HydrophobicContact CD1-CB 4.31Å; Y173-F183 HydrophobicContact CD1-CD2 4.22Å; Y173-F183 HydrophobicContact CE1-CB 4.25Å; Y173-F183 AromaticContact CE1-CD2 3.7Å; Y173-F183 HydrophobicContact CE1-CD2 3.7Å; Y173-F183 HydrophobicContact CE1-CG 4.45Å; Y173-F183 AromaticContact CZ-CD2 3.91Å; F183-S185 PolarHBondContact O-N 3.4Å; F183-L186 HydrophobicContact CE1-CD1 3.94Å; F183-L186 HydrophobicContact CE1-CG 4.15Å; F183-L186 HydrophobicContact CZ-CD1 4.28Å; F183-E209 HydrophobicContact CD2-CB 3.5Å; F183-E209 VanDerWaalsContact CD2-CB 3.5Å; F183-E209 HydrophobicContact CD2-CG 4.3Å; F183-E209 HydrophobicContact CE2-CB 3.58Å; F183-E209 HydrophobicContact CG-CB 4.28Å; F183-E209 HydrophobicContact CZ-CB 4.45Å; F183-F210 HydrophobicContact CZ-CB 4.2Å; F183-N213 HydrophobicContact CD1-CB 3.4Å; F183-N213 HydrophobicContact CE1-CB 3.56Å; F183-N213 HydrophobicContact CG-CB 4.28Å
184	V	92.9	Very high	92.9	Very high	40 Å²	40	68 Å²	68	24%	0.242	38%	0.379	C	S	.	.			trans	-74.2	125.3	-176	175	0	0	0	0	110.7	L172 L186	L172-V184 PolarHBondContact O-N 3.43Å; V184-L186 PolarHBondContact O-N 3.01Å; V184-L186 VanDerWaalsContact O-N 3.08Å
185	S	90.6	Very high	93.1	Very high	87 Å²	87	69.4 Å²	69.4	61%	0.608	38%	0.383	S	S	*	.			trans	-61.8	113.2	178.8	-175.5	0	0	0	0	112.8	F183 Q187	F183-S185 PolarHBondContact O-N 3.4Å; S185-Q187 PolarHBondContact O-N 3.07Å
186	L	94.7	Very high	93.4	Very high	4 Å²	4	63.7 Å²	63.7	2%	0.021	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	15.8	179	-61.6	177.2	0	0	0	113.4	L167 F183 V184 A188 F189 A190 F210 Y214	L167-L186 HydrophobicContact CD1-CD2 4.47Å; F183-L186 HydrophobicContact CE1-CD1 3.94Å; F183-L186 HydrophobicContact CE1-CG 4.15Å; F183-L186 HydrophobicContact CZ-CD1 4.28Å; V184-L186 PolarHBondContact O-N 3.01Å; V184-L186 VanDerWaalsContact O-N 3.08Å; L186-A188 PolarHBondContact O-N 2.93Å; L186-F189 HydrophobicContact CB-CB 4.47Å; L186-F189 HydrophobicContact CB-CD2 4.44Å; L186-F189 HydrophobicContact CD2-CD2 3.74Å; L186-F189 HydrophobicContact CD2-CE2 3.85Å; L186-F189 HydrophobicContact CD2-CG 4.29Å; L186-F189 HydrophobicContact CD2-CZ 4.47Å; L186-F189 WeakPolarHBondContact O-CA 3.45Å; L186-F189 VanDerWaalsContact O-CB 3.32Å; L186-F189 WeakPolarHBondContact O-CB 3.44Å; L186-F189 PolarHBondContact O-N 2.88Å; L186-A190 PolarHBondContact O-N 2.95Å; L186-A190 VanDerWaalsContact O-N 3.07Å; L186-F210 HydrophobicContact CD1-CD2 3.56Å; L186-F210 HydrophobicContact CD1-CE2 3.68Å; L186-Y214 HydrophobicContact CB-CD2 3.67Å; L186-Y214 HydrophobicContact CB-CG 4.41Å; L186-Y214 HydrophobicContact CD1-CD2 4.42Å; L186-Y214 HydrophobicContact CD1-CG 4.46Å
187	Q	93.5	Very high	93.7	Very high	89 Å²	89	61 Å²	61	42%	0.416	34%	0.341	S	S	.	.	H	α-helix	trans	-57.1	-36	177.6	-173.7	62.1	39.7	0	0	112.8	S185 F189 A190 L191	S185-Q187 PolarHBondContact O-N 3.07Å; Q187-F189 VanDerWaalsContact C-N 3.25Å; Q187-F189 PolarHBondContact O-N 2.84Å; Q187-A190 PolarHBondContact O-N 3.07Å; Q187-L191 WeakPolarHBondContact O-CG 3.25Å; Q187-L191 PolarHBondContact O-N 3.45Å
188	A	92.5	Very high	94	Very high	29 Å²	29	54.6 Å²	54.6	24%	0.24	30%	0.299	C	S	.	.	H	α-helix	trans	-69.7	-20.4	176.2	0	0	0	0	0	113.5	Y155 L186 R192	Y155-A188 HydrophobicContact CE2-CB 4.03Å; L186-A188 PolarHBondContact O-N 2.93Å; A188-R192 PolarHBondContact O-NE 2.9Å
189	F	95.5	Very high	94.4	Very high	39 Å²	39	49.7 Å²	49.7	17%	0.171	27%	0.273	C	S	.	.	H	α-helix	trans	-80.1	-40.5	170.3	-70.8	-110.3	0	0	0	110.2	P165 L167 L186 Q187 L191 R192 G193 F194 F197 Y214	P165-F189 HydrophobicContact CB-CD1 4.23Å; P165-F189 HydrophobicContact CB-CE1 3.73Å; P165-F189 HydrophobicContact CG-CD1 3.98Å; P165-F189 HydrophobicContact CG-CE1 3.95Å; L167-F189 HydrophobicContact CD2-CE1 4.11Å; L167-F189 HydrophobicContact CD2-CZ 3.98Å; L186-F189 HydrophobicContact CB-CB 4.47Å; L186-F189 HydrophobicContact CB-CD2 4.44Å; L186-F189 HydrophobicContact CD2-CD2 3.74Å; L186-F189 HydrophobicContact CD2-CE2 3.85Å; L186-F189 HydrophobicContact CD2-CG 4.29Å; L186-F189 HydrophobicContact CD2-CZ 4.47Å; L186-F189 WeakPolarHBondContact O-CA 3.45Å; L186-F189 VanDerWaalsContact O-CB 3.32Å; L186-F189 WeakPolarHBondContact O-CB 3.44Å; L186-F189 PolarHBondContact O-N 2.88Å; Q187-F189 VanDerWaalsContact C-N 3.25Å; Q187-F189 PolarHBondContact O-N 2.84Å; F189-L191 PolarHBondContact O-N 3.01Å; F189-R192 CarbonylContact O-C 3.59Å; F189-R192 PolarHBondContact O-N 2.61Å; F189-R192 VanDerWaalsContact O-N 3.14Å; F189-G193 PolarHBondContact O-N 3.32Å; F189-G193 VanDerWaalsContact O-N 3.07Å; F189-F194 HydrophobicContact CB-CD2 3.83Å; F189-F194 HydrophobicContact CB-CE2 4.36Å; F189-F194 AromaticContact CD1-CD2 3.63Å; F189-F194 HydrophobicContact CD1-CD2 3.63Å; F189-F194 AromaticContact CD1-CE2 3.71Å; F189-F194 HydrophobicContact CD1-CE2 3.71Å; F189-F194 HydrophobicContact CE1-CE2 4.38Å; F189-F194 HydrophobicContact CG-CD2 4.1Å; F189-F194 HydrophobicContact CG-CE2 4.26Å; F189-F194 WeakPolarHBondContact O-CD2 3.42Å; F189-F197 HydrophobicContact CB-CZ 4.31Å; F189-F197 AromaticContact CD1-CE1 3.79Å; F189-F197 HydrophobicContact CD1-CE1 3.79Å; F189-F197 HydrophobicContact CD1-CZ 4.25Å; F189-F197 HydrophobicContact CE1-CE1 4.42Å; F189-F197 HydrophobicContact CG-CE1 4.49Å; F189-Y214 HydrophobicContact CB-CD2 4.48Å; F189-Y214 HydrophobicContact CB-CE2 3.82Å
190	A	95.1	Very high	94.8	Very high	14 Å²	14	48.2 Å²	48.2	12%	0.116	25%	0.253	C	S	.	.	H	α-helix	trans	-65.1	-39	179.4	0	0	0	0	0	112	L186 Q187 R192 G193 Y214 P215 L216	L186-A190 PolarHBondContact O-N 2.95Å; L186-A190 VanDerWaalsContact O-N 3.07Å; Q187-A190 PolarHBondContact O-N 3.07Å; A190-R192 VanDerWaalsContact C-N 3.31Å; A190-R192 PolarHBondContact O-N 3.23Å; A190-G193 WeakPolarHBondContact O-CA 3.4Å; A190-G193 PolarHBondContact O-N 2.91Å; A190-Y214 HydrophobicContact CB-CD2 4.42Å; A190-Y214 HydrophobicContact CB-CE2 3.82Å; A190-P215 HydrophobicContact CB-CB 4.27Å; A190-P215 HydrophobicContact CB-CG 4.09Å; A190-L216 HydrophobicContact CB-CD1 4.15Å; A190-L216 HydrophobicContact CB-CG 4.09Å
191	L	94.7	Very high	95.2	Very high	94 Å²	94	44.2 Å²	44.2	49%	0.492	24%	0.244	S	C	.	.	H	α-helix	trans	-61.2	-38.6	173.5	-70.7	172.2	0	0	0	112.5	Y155 Q187 F189 G193	Y155-L191 HydrophobicContact CD2-CB 3.84Å; Y155-L191 HydrophobicContact CD2-CD1 3.89Å; Y155-L191 HydrophobicContact CE2-CD1 4.16Å; Y155-L191 CarbonylContact O-C 3.59Å; Q187-L191 WeakPolarHBondContact O-CG 3.25Å; Q187-L191 PolarHBondContact O-N 3.45Å; F189-L191 PolarHBondContact O-N 3.01Å; L191-G193 PolarHBondContact O-N 2.89Å
192	R	95.6	Very high	95.5	Very high	31 Å²	31	37.1 Å²	37.1	12%	0.117	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-6.5	173.8	-72.6	-179	-74.2	161.4	4.3	113.4	Y155 P157 W160 A188 F189 A190 F194	Y155-R192 HydrophobicContact CD1-CG 4.28Å; Y155-R192 HydrophobicContact CG-CG 4.22Å; P157-R192 VanDerWaalsContact CA-O 3.31Å; P157-R192 WeakPolarHBondContact CA-O 3.16Å; W160-R192 HydrophobicContact CD2-CG 4.48Å; W160-R192 VanDerWaalsContact CE2-CD 3.44Å; W160-R192 HydrophobicContact CG-CB 4.15Å; W160-R192 HydrophobicContact CG-CG 4.34Å; A188-R192 PolarHBondContact O-NE 2.9Å; F189-R192 CarbonylContact O-C 3.59Å; F189-R192 PolarHBondContact O-N 2.61Å; F189-R192 VanDerWaalsContact O-N 3.14Å; A190-R192 VanDerWaalsContact C-N 3.31Å; A190-R192 PolarHBondContact O-N 3.23Å; R192-F194 HydrophobicContact CB-CD2 4.05Å; R192-F194 HydrophobicContact CB-CE2 3.76Å; R192-F194 HydrophobicContact CB-CZ 4.28Å; R192-F194 VanDerWaalsContact CZ-CE2 3.45Å; R192-F194 PolarHBondContact O-N 3.4Å
193	G	95.1	Very high	95.8	Very high	20 Å²	20	33.8 Å²	33.8	21%	0.206	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	29	171.8	0	0	0	0	0	115.3	F189 A190 L191 Q195	F189-G193 PolarHBondContact O-N 3.32Å; F189-G193 VanDerWaalsContact O-N 3.07Å; A190-G193 WeakPolarHBondContact O-CA 3.4Å; A190-G193 PolarHBondContact O-N 2.91Å; L191-G193 PolarHBondContact O-N 2.89Å; G193-Q195 WeakPolarHBondContact O-CG 3.35Å; G193-Q195 PolarHBondContact O-N 2.89Å
194	F	96.8	Very high	96	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.026	21%	0.208	C	C	.	.			trans	-60.8	131	179.5	-68.7	-67.8	0	0	0	112.4	W160 V163 P165 F189 R192 F197 Y214	W160-F194 HydrophobicContact CB-CD1 4.32Å; W160-F194 HydrophobicContact CB-CE1 3.71Å; W160-F194 HydrophobicContact CB-CZ 4.13Å; W160-F194 HydrophobicContact CD2-CE1 4.39Å; W160-F194 HydrophobicContact CD2-CZ 4.02Å; W160-F194 HydrophobicContact CE3-CE1 4.14Å; W160-F194 AromaticContact CE3-CZ 3.78Å; W160-F194 HydrophobicContact CE3-CZ 3.78Å; W160-F194 HydrophobicContact CG-CE1 4.23Å; W160-F194 HydrophobicContact CG-CZ 4.16Å; V163-F194 HydrophobicContact CB-CE1 4.03Å; V163-F194 HydrophobicContact CG1-CE1 3.9Å; V163-F194 VanDerWaalsContact O-CD1 3.26Å; V163-F194 WeakPolarHBondContact O-CD1 3.49Å; P165-F194 HydrophobicContact CG-CB 4.44Å; P165-F194 HydrophobicContact CG-CD1 3.63Å; P165-F194 HydrophobicContact CG-CD2 3.85Å; P165-F194 HydrophobicContact CG-CE1 3.66Å; P165-F194 HydrophobicContact CG-CE2 3.86Å; P165-F194 HydrophobicContact CG-CG 3.73Å; P165-F194 HydrophobicContact CG-CZ 3.78Å; F189-F194 HydrophobicContact CB-CD2 3.83Å; F189-F194 HydrophobicContact CB-CE2 4.36Å; F189-F194 AromaticContact CD1-CD2 3.63Å; F189-F194 HydrophobicContact CD1-CD2 3.63Å; F189-F194 AromaticContact CD1-CE2 3.71Å; F189-F194 HydrophobicContact CD1-CE2 3.71Å; F189-F194 HydrophobicContact CE1-CE2 4.38Å; F189-F194 HydrophobicContact CG-CD2 4.1Å; F189-F194 HydrophobicContact CG-CE2 4.26Å; F189-F194 WeakPolarHBondContact O-CD2 3.42Å; R192-F194 HydrophobicContact CB-CD2 4.05Å; R192-F194 HydrophobicContact CB-CE2 3.76Å; R192-F194 HydrophobicContact CB-CZ 4.28Å; R192-F194 VanDerWaalsContact CZ-CE2 3.45Å; R192-F194 PolarHBondContact O-N 3.4Å; F194-F197 HydrophobicContact CB-CE2 3.83Å; F194-F197 HydrophobicContact CB-CZ 3.76Å; F194-Y214 PolarHBondContact O-OH 3.41Å
195	Q	96.1	Very high	96.2	Very high	113 Å²	113	38 Å²	38	53%	0.528	22%	0.223	S	C	.	.			trans	-113.4	-6.6	179	-55.2	-172.1	12.6	0	0	112.6	G193 G220 V221 R222 S223	G193-Q195 WeakPolarHBondContact O-CG 3.35Å; G193-Q195 PolarHBondContact O-N 2.89Å; Q195-G220 WeakPolarHBondContact CB-O 3.32Å; Q195-G220 WeakPolarHBondContact CG-O 3.3Å; Q195-V221 CarbonylContact O-C 3.57Å; Q195-V221 WeakPolarHBondContact O-CA 3.26Å; Q195-R222 HydrophobicContact CB-CB 4.4Å; Q195-R222 HydrophobicContact CB-CG 4.18Å; Q195-R222 PolarHBondContact O-N 2.95Å; Q195-S223 PolarHBondContact O-N 3.36Å
196	S	98	Very high	96.5	Very high	17 Å²	17	34.8 Å²	34.8	12%	0.119	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	142.8	176.6	53.1	0	0	0	0	110.2	V163 T164 P165 S223	V163-S196 PolarHBondContact O-OG 3.26Å; T164-S196 WeakPolarHBondContact CA-OG 2.95Å; T164-S196 VanDerWaalsContact OG1-CB 3.25Å; T164-S196 WeakPolarHBondContact OG1-CB 3.3Å; T164-S196 PolarHBondContact OG1-OG 3.43Å; P165-S196 WeakPolarHBondContact CD-O 3.35Å; S196-S223 VanDerWaalsContact CA-O 3.28Å; S196-S223 WeakPolarHBondContact CA-O 3.49Å
197	F	98.2	Very high	96.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	147.3	174.8	-74.3	-94.2	0	0	0	110.9	P165 L167 F189 F194 L199 F210 Y214 V221 S223 L224 S225	P165-F197 HydrophobicContact CB-CD1 4.42Å; P165-F197 HydrophobicContact CB-CE1 4.49Å; P165-F197 HydrophobicContact CG-CD1 4.44Å; P165-F197 HydrophobicContact CG-CE1 4.26Å; L167-F197 HydrophobicContact CD1-CD1 3.92Å; L167-F197 HydrophobicContact CD1-CE1 4.11Å; F189-F197 HydrophobicContact CB-CZ 4.31Å; F189-F197 AromaticContact CD1-CE1 3.79Å; F189-F197 HydrophobicContact CD1-CE1 3.79Å; F189-F197 HydrophobicContact CD1-CZ 4.25Å; F189-F197 HydrophobicContact CE1-CE1 4.42Å; F189-F197 HydrophobicContact CG-CE1 4.49Å; F194-F197 HydrophobicContact CB-CE2 3.83Å; F194-F197 HydrophobicContact CB-CZ 3.76Å; F197-L199 HydrophobicContact CB-CD2 4.45Å; F197-F210 HydrophobicContact CB-CZ 4.4Å; F197-F210 AromaticContact CD1-CE2 3.94Å; F197-F210 HydrophobicContact CD1-CE2 3.94Å; F197-F210 HydrophobicContact CD1-CZ 4.05Å; F197-F210 AromaticContact CD2-CZ 3.88Å; F197-F210 HydrophobicContact CD2-CZ 3.88Å; F197-F210 HydrophobicContact CE1-CE2 4.07Å; F197-F210 HydrophobicContact CE1-CZ 4.28Å; F197-F210 HydrophobicContact CE2-CZ 4.15Å; F197-F210 HydrophobicContact CG-CE2 4.2Å; F197-F210 AromaticContact CG-CZ 3.84Å; F197-F210 HydrophobicContact CG-CZ 3.84Å; F197-F210 HydrophobicContact CZ-CE2 4.45Å; F197-F210 HydrophobicContact CZ-CZ 4.33Å; F197-Y214 HydrophobicContact CD2-CE1 4.41Å; F197-Y214 HydrophobicContact CE2-CD1 4.09Å; F197-Y214 AromaticContact CE2-CE1 3.38Å; F197-Y214 HydrophobicContact CE2-CE1 3.38Å; F197-Y214 HydrophobicContact CE2-CE2 4.43Å; F197-Y214 AromaticContact CE2-CZ 3.59Å; F197-Y214 HydrophobicContact CZ-CD1 4.25Å; F197-Y214 HydrophobicContact CZ-CD2 4.46Å; F197-Y214 AromaticContact CZ-CE1 3.69Å; F197-Y214 HydrophobicContact CZ-CE1 3.69Å; F197-Y214 AromaticContact CZ-CE2 3.91Å; F197-Y214 HydrophobicContact CZ-CE2 3.91Å; F197-Y214 AromaticContact CZ-CZ 3.5Å; F197-Y214 VanDerWaalsContact CZ-CZ 3.5Å; F197-V221 HydrophobicContact CD2-CG2 4.11Å; F197-V221 HydrophobicContact CE2-CG2 4.16Å; F197-S223 PolarHBondContact N-O 2.88Å; F197-S223 VanDerWaalsContact N-O 3.16Å; F197-L224 HydrophobicContact CB-CD1 3.88Å; F197-L224 WeakPolarHBondContact O-CA 3.24Å; F197-S225 PolarHBondContact O-N 3.31Å
198	C	98.5	Very high	96.7	Very high	9 Å²	9	32.6 Å²	32.6	6%	0.061	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	113.9	165.8	179.5	0	0	0	0	108.8	T164 P165 I166 L167 S225	T164-C198 HydrophobicContact CG2-CB 4.22Å; P165-C198 PolarHBondContact O-N 3.01Å; I166-C198 CarbonylContact C-O 3.58Å; I166-C198 WeakPolarHBondContact CA-O 3.36Å; I166-C198 HydrophobicContact CB-CB 4.43Å; I166-C198 HydrophobicContact CG1-CB 4.08Å; I166-C198 HydrophobicContact CG2-CB 4.41Å; L167-C198 PolarHBondContact N-O 3.18Å; C198-S225 CarbonylContact C-O 3.53Å; C198-S225 VanDerWaalsContact CA-O 3.31Å; C198-S225 WeakPolarHBondContact CA-O 3.3Å
199	L	98.4	Very high	96.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	125.9	178.8	-53.1	-177.6	0	0	0	109.5	L167 F197 V202 F210 L224 S225 L226 K227	L167-L199 HydrophobicContact CB-CD2 3.98Å; L167-L199 HydrophobicContact CD1-CD2 4.07Å; L167-L199 HydrophobicContact CG-CD2 4.47Å; L167-L199 WeakPolarHBondContact O-CA 3.32Å; F197-L199 HydrophobicContact CB-CD2 4.45Å; L199-V202 HydrophobicContact CB-CG1 3.97Å; L199-V202 HydrophobicContact CB-CG2 3.74Å; L199-F210 HydrophobicContact CD1-CD1 4.28Å; L199-F210 HydrophobicContact CD1-CD2 4.34Å; L199-F210 HydrophobicContact CD1-CG 4.12Å; L199-F210 HydrophobicContact CD2-CD2 4.28Å; L199-F210 HydrophobicContact CD2-CE2 4.29Å; L199-L224 HydrophobicContact CD1-CD1 4.01Å; L199-L224 HydrophobicContact CG-CD1 3.99Å; L199-S225 PolarHBondContact N-O 3.39Å; L199-L226 HydrophobicContact CB-CD2 3.87Å; L199-L226 HydrophobicContact CD1-CD2 4.16Å; L199-L226 HydrophobicContact CG-CD2 4.32Å; L199-L226 WeakPolarHBondContact O-CA 3.46Å; L199-K227 PolarHBondContact O-N 3.17Å
200	V	98.5	Very high	97	Very high	24 Å²	24	32.8 Å²	32.8	15%	0.145	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	121.8	-170.5	-171.8	0	0	0	0	111.2	I166 L167 H168 A169 K227	I166-V200 HydrophobicContact CG2-CG2 3.75Å; L167-V200 PolarHBondContact O-N 3.3Å; H168-V200 WeakPolarHBondContact CA-O 3.01Å; A169-V200 PolarHBondContact N-O 2.69Å; V200-K227 CarbonylContact C-O 3.5Å; V200-K227 VanDerWaalsContact CA-O 3.32Å; V200-K227 WeakPolarHBondContact CA-O 3.46Å; V200-K227 HydrophobicContact CG1-CB 4.46Å; V200-K227 WeakPolarHBondContact CG1-O 3.49Å; V200-K227 HydrophobicContact CG2-CB 4.36Å
201	G	97.9	Very high	97.1	Very high	38 Å²	38	32.4 Å²	32.4	39%	0.392	19%	0.186	S	C	.	.	S	Bend	trans	70.5	30.3	178.7	0	0	0	0	0	114.1	A169 K227 R228 S229	A169-G201 WeakPolarHBondContact CB-O 3.28Å; G201-K227 PolarHBondContact N-O 3.33Å; G201-R228 WeakPolarHBondContact CA-O 3.4Å; G201-S229 PolarHBondContact N-OG 3.13Å
202	V	97.8	Very high	97.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.192	C	C	.	.			trans	-87.3	150.6	179.8	-72	0	0	0	0	112.1	A169 L172 L199 D206 I207 L226 S229 T230	A169-V202 HydrophobicContact CB-CG1 3.88Å; L172-V202 HydrophobicContact CD1-CG1 3.87Å; L199-V202 HydrophobicContact CB-CG1 3.97Å; L199-V202 HydrophobicContact CB-CG2 3.74Å; V202-D206 HydrophobicContact CB-CB 3.85Å; V202-D206 HydrophobicContact CG1-CB 3.9Å; V202-I207 HydrophobicContact CB-CG1 4.45Å; V202-I207 HydrophobicContact CG2-CD1 4.28Å; V202-I207 HydrophobicContact CG2-CG1 4.07Å; V202-L226 HydrophobicContact CG2-CD2 4.08Å; V202-S229 VanDerWaalsContact CG2-OG 3.24Å; V202-S229 WeakPolarHBondContact CG2-OG 3.47Å; V202-S229 PolarHBondContact N-OG 3.42Å; V202-S229 CarbonylContact O-C 3.59Å; V202-S229 VanDerWaalsContact O-CA 3.32Å; V202-S229 WeakPolarHBondContact O-CA 3.44Å; V202-S229 WeakPolarHBondContact O-CB 3.4Å; V202-T230 PolarHBondContact O-N 2.76Å
203	S	97.6	Very high	97	Very high	34 Å²	34	34.8 Å²	34.8	24%	0.238	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-101.4	171.7	170.2	66.8	0	0	0	0	111.5	L205 D206 I207	S203-L205 PolarHBondContact O-N 2.94Å; S203-D206 WeakPolarHBondContact CB-OD2 3.21Å; S203-D206 PolarHBondContact N-OD2 2.65Å; S203-D206 PolarHBondContact O-N 3.49Å; S203-D206 VanDerWaalsContact O-N 3.08Å; S203-D206 PolarHBondContact OG-OD2 2.79Å; S203-I207 WeakPolarHBondContact O-CG1 3.4Å; S203-I207 PolarHBondContact O-N 3.08Å; S203-I207 VanDerWaalsContact O-N 3.13Å
204	D	97.9	Very high	97.1	Very high	42 Å²	42	33.9 Å²	33.9	23%	0.225	19%	0.192	C	C	.	.	H	α-helix	trans	-50.6	-41.3	173.7	-60.3	-13.3	0	0	0	112.7	I207 C208 I231 T232 G235	D204-I207 PolarHBondContact O-N 3.22Å; D204-C208 PolarHBondContact O-N 3.44Å; D204-C208 PolarHBondContact O-SG 3.08Å; D204-I231 VanDerWaalsContact OD1-CA 3.3Å; D204-I231 WeakPolarHBondContact OD1-CA 3.22Å; D204-T232 PolarHBondContact OD1-N 3.42Å; D204-T232 WeakPolarHBondContact OD2-CB 3.42Å; D204-T232 WeakPolarHBondContact OD2-CG2 3.36Å; D204-T232 PolarHBondContact OD2-OG1 2.6Å; D204-G235 WeakPolarHBondContact OD1-CA 3.39Å
205	L	96.3	Very high	97	Very high	109 Å²	109	37.1 Å²	37.1	57%	0.571	21%	0.213	S	C	*	.	H	α-helix	trans	-65.6	-43.3	178.9	179.5	61.8	0	0	0	111.8	S203 I207 C208 E209	S203-L205 PolarHBondContact O-N 2.94Å; L205-I207 PolarHBondContact O-N 3.22Å; L205-C208 PolarHBondContact O-N 3.21Å; L205-E209 HydrophobicContact CD1-CG 4.4Å; L205-E209 WeakPolarHBondContact O-CG 3.13Å; L205-E209 PolarHBondContact O-N 3Å
206	D	97	Very high	97	Very high	18 Å²	18	34.8 Å²	34.8	10%	0.096	20%	0.204	C	C	.	.	H	α-helix	trans	-64.5	-29.8	178.9	-56.2	-56.2	0	0	0	111.9	L172 Y173 V202 S203 F210	L172-D206 HydrophobicContact CD1-CB 4.38Å; Y173-D206 WeakPolarHBondContact CE2-OD1 3.49Å; Y173-D206 VanDerWaalsContact CZ-OD1 3.27Å; Y173-D206 PolarHBondContact OH-OD1 3.25Å; V202-D206 HydrophobicContact CB-CB 3.85Å; V202-D206 HydrophobicContact CG1-CB 3.9Å; S203-D206 WeakPolarHBondContact CB-OD2 3.21Å; S203-D206 PolarHBondContact N-OD2 2.65Å; S203-D206 PolarHBondContact O-N 3.49Å; S203-D206 VanDerWaalsContact O-N 3.08Å; S203-D206 PolarHBondContact OG-OD2 2.79Å; D206-F210 VanDerWaalsContact O-CB 3.3Å; D206-F210 WeakPolarHBondContact O-CB 3.46Å; D206-F210 PolarHBondContact O-N 3.04Å
207	I	97.1	Very high	96.9	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.015	20%	0.2	C	C	.	.	H	α-helix	trans	-72.8	-43.8	175.2	-66.3	168.4	0	0	0	110.6	V202 S203 D204 L205 F210 I211 L226 I231 M239	V202-I207 HydrophobicContact CB-CG1 4.45Å; V202-I207 HydrophobicContact CG2-CD1 4.28Å; V202-I207 HydrophobicContact CG2-CG1 4.07Å; S203-I207 WeakPolarHBondContact O-CG1 3.4Å; S203-I207 PolarHBondContact O-N 3.08Å; S203-I207 VanDerWaalsContact O-N 3.13Å; D204-I207 PolarHBondContact O-N 3.22Å; L205-I207 PolarHBondContact O-N 3.22Å; I207-F210 PolarHBondContact O-N 3.26Å; I207-I211 HydrophobicContact CG2-CD1 3.85Å; I207-I211 WeakPolarHBondContact O-CB 3.3Å; I207-I211 VanDerWaalsContact O-CG1 3.24Å; I207-I211 WeakPolarHBondContact O-CG1 3.36Å; I207-I211 PolarHBondContact O-N 3.07Å; I207-L226 HydrophobicContact CD1-CD1 4.02Å; I207-I231 HydrophobicContact CD1-CB 4.2Å; I207-I231 HydrophobicContact CD1-CD1 3.49Å; I207-I231 VanDerWaalsContact CD1-CD1 3.49Å; I207-I231 HydrophobicContact CD1-CG1 3.85Å; I207-M239 HydrophobicContact CD1-SD 4.35Å; I207-M239 HydrophobicContact CG2-CB 3.86Å; I207-M239 HydrophobicContact CG2-CG 3.69Å; I207-M239 HydrophobicContact CG2-SD 3.94Å
208	C	96.9	Very high	96.7	Very high	45 Å²	45	37.6 Å²	37.6	30%	0.304	22%	0.215	S	C	.	.	H	α-helix	trans	-59.3	-48.5	172.3	-69.5	0	0	0	0	111.5	D204 L205 F210 I211 D212	D204-C208 PolarHBondContact O-N 3.44Å; D204-C208 PolarHBondContact O-SG 3.08Å; L205-C208 PolarHBondContact O-N 3.21Å; C208-F210 VanDerWaalsContact C-N 3.34Å; C208-F210 PolarHBondContact O-N 3.21Å; C208-I211 WeakPolarHBondContact O-CB 3.26Å; C208-I211 PolarHBondContact O-N 3.43Å; C208-I211 VanDerWaalsContact O-N 3.08Å; C208-D212 PolarHBondContact O-N 3.39Å
209	E	96.4	Very high	96.6	Very high	70 Å²	70	44.5 Å²	44.5	33%	0.327	24%	0.244	S	C	.	.	H	α-helix	trans	-59.9	-41.4	175.7	-71.9	-69.8	166.7	0	0	111.9	F183 L205 I211 D212 N213	F183-E209 HydrophobicContact CD2-CB 3.5Å; F183-E209 VanDerWaalsContact CD2-CB 3.5Å; F183-E209 HydrophobicContact CD2-CG 4.3Å; F183-E209 HydrophobicContact CE2-CB 3.58Å; F183-E209 HydrophobicContact CG-CB 4.28Å; F183-E209 HydrophobicContact CZ-CB 4.45Å; L205-E209 HydrophobicContact CD1-CG 4.4Å; L205-E209 WeakPolarHBondContact O-CG 3.13Å; L205-E209 PolarHBondContact O-N 3Å; E209-I211 PolarHBondContact O-N 2.88Å; E209-D212 PolarHBondContact O-N 2.73Å; E209-N213 VanDerWaalsContact O-CB 3.23Å; E209-N213 WeakPolarHBondContact O-CB 3.31Å; E209-N213 PolarHBondContact O-N 2.9Å; E209-N213 PolarHBondContact O-ND2 3.16Å; E209-N213 PolarHBondContact OE2-ND2 2.95Å
210	F	97.3	Very high	96.5	Very high	1 Å²	1	45.3 Å²	45.3	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-61.5	-42.2	172.6	174.2	-92.6	0	0	0	112.3	F183 L186 F197 L199 D206 I207 C208 Y214 M243	F183-F210 HydrophobicContact CZ-CB 4.2Å; L186-F210 HydrophobicContact CD1-CD2 3.56Å; L186-F210 HydrophobicContact CD1-CE2 3.68Å; F197-F210 HydrophobicContact CB-CZ 4.4Å; F197-F210 AromaticContact CD1-CE2 3.94Å; F197-F210 HydrophobicContact CD1-CE2 3.94Å; F197-F210 HydrophobicContact CD1-CZ 4.05Å; F197-F210 AromaticContact CD2-CZ 3.88Å; F197-F210 HydrophobicContact CD2-CZ 3.88Å; F197-F210 HydrophobicContact CE1-CE2 4.07Å; F197-F210 HydrophobicContact CE1-CZ 4.28Å; F197-F210 HydrophobicContact CE2-CZ 4.15Å; F197-F210 HydrophobicContact CG-CE2 4.2Å; F197-F210 AromaticContact CG-CZ 3.84Å; F197-F210 HydrophobicContact CG-CZ 3.84Å; F197-F210 HydrophobicContact CZ-CE2 4.45Å; F197-F210 HydrophobicContact CZ-CZ 4.33Å; L199-F210 HydrophobicContact CD1-CD1 4.28Å; L199-F210 HydrophobicContact CD1-CD2 4.34Å; L199-F210 HydrophobicContact CD1-CG 4.12Å; L199-F210 HydrophobicContact CD2-CD2 4.28Å; L199-F210 HydrophobicContact CD2-CE2 4.29Å; D206-F210 VanDerWaalsContact O-CB 3.3Å; D206-F210 WeakPolarHBondContact O-CB 3.46Å; D206-F210 PolarHBondContact O-N 3.04Å; I207-F210 PolarHBondContact O-N 3.26Å; C208-F210 VanDerWaalsContact C-N 3.34Å; C208-F210 PolarHBondContact O-N 3.21Å; F210-Y214 HydrophobicContact CE1-CD1 4.3Å; F210-Y214 HydrophobicContact CE2-CD1 4.41Å; F210-Y214 HydrophobicContact CE2-CG 4.36Å; F210-Y214 AromaticContact CZ-CD1 3.81Å; F210-Y214 HydrophobicContact CZ-CD1 3.81Å; F210-Y214 HydrophobicContact CZ-CG 4.19Å; F210-Y214 WeakPolarHBondContact O-CB 3.44Å; F210-Y214 PolarHBondContact O-N 3.15Å; F210-M243 HydrophobicContact CE1-CE 4.36Å
211	I	96.5	Very high	96.4	Very high	6 Å²	6	44.2 Å²	44.2	3%	0.031	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-41	179.6	-73.7	164.9	0	0	0	111.1	I207 C208 E209 S217 K218 M239 Q242 M243	I207-I211 HydrophobicContact CG2-CD1 3.85Å; I207-I211 WeakPolarHBondContact O-CB 3.3Å; I207-I211 VanDerWaalsContact O-CG1 3.24Å; I207-I211 WeakPolarHBondContact O-CG1 3.36Å; I207-I211 PolarHBondContact O-N 3.07Å; C208-I211 WeakPolarHBondContact O-CB 3.26Å; C208-I211 PolarHBondContact O-N 3.43Å; C208-I211 VanDerWaalsContact O-N 3.08Å; E209-I211 PolarHBondContact O-N 2.88Å; I211-S217 WeakPolarHBondContact O-CB 3.25Å; I211-S217 PolarHBondContact O-OG 3.4Å; I211-K218 HydrophobicContact CG2-CD 4.41Å; I211-K218 HydrophobicContact CG2-CG 4.24Å; I211-M239 HydrophobicContact CD1-CB 4.5Å; I211-M239 HydrophobicContact CD1-CG 4.36Å; I211-Q242 HydrophobicContact CD1-CB 4.27Å; I211-Q242 HydrophobicContact CG2-CB 4.09Å; I211-M243 HydrophobicContact CD1-CG 4.1Å; I211-M243 HydrophobicContact CD1-SD 4.23Å; I211-M243 HydrophobicContact CG1-CG 4.09Å; I211-M243 HydrophobicContact CG1-SD 4.1Å
212	D	95	Very high	96.4	Very high	116 Å²	116	46.7 Å²	46.7	62%	0.62	24%	0.243	S	C	*	.	H	α-helix	trans	-83.5	-31.1	-177	-70.5	-24.7	0	0	0	113	C208 E209 K218	C208-D212 PolarHBondContact O-N 3.39Å; E209-D212 PolarHBondContact O-N 2.73Å; D212-K218 IonicContact OD1-NZ 3.3Å
213	N	94.8	Very high	96.4	Very high	59 Å²	59	48.5 Å²	48.5	32%	0.316	26%	0.256	S	S	.	.	H	α-helix	trans	-93.6	-10.5	-179.8	-66.8	-81	0	0	0	114.9	F183 E209 P215	F183-N213 HydrophobicContact CD1-CB 3.4Å; F183-N213 HydrophobicContact CE1-CB 3.56Å; F183-N213 HydrophobicContact CG-CB 4.28Å; E209-N213 VanDerWaalsContact O-CB 3.23Å; E209-N213 WeakPolarHBondContact O-CB 3.31Å; E209-N213 PolarHBondContact O-N 2.9Å; E209-N213 PolarHBondContact O-ND2 3.16Å; E209-N213 PolarHBondContact OE2-ND2 2.95Å; N213-P215 WeakPolarHBondContact O-CD 3.31Å
214	Y	96.7	Very high	96.4	Very high	1 Å²	1	46.9 Å²	46.9	0%	0.004	24%	0.244	C	C	.	.	S	Bend	trans	-99.1	108.6	170.7	-174.1	-128.4	0	0	0	111.7	L186 F189 A190 F194 F197 F210 L216 S217 V221	L186-Y214 HydrophobicContact CB-CD2 3.67Å; L186-Y214 HydrophobicContact CB-CG 4.41Å; L186-Y214 HydrophobicContact CD1-CD2 4.42Å; L186-Y214 HydrophobicContact CD1-CG 4.46Å; F189-Y214 HydrophobicContact CB-CD2 4.48Å; F189-Y214 HydrophobicContact CB-CE2 3.82Å; A190-Y214 HydrophobicContact CB-CD2 4.42Å; A190-Y214 HydrophobicContact CB-CE2 3.82Å; F194-Y214 PolarHBondContact O-OH 3.41Å; F197-Y214 HydrophobicContact CD2-CE1 4.41Å; F197-Y214 HydrophobicContact CE2-CD1 4.09Å; F197-Y214 AromaticContact CE2-CE1 3.38Å; F197-Y214 HydrophobicContact CE2-CE1 3.38Å; F197-Y214 HydrophobicContact CE2-CE2 4.43Å; F197-Y214 AromaticContact CE2-CZ 3.59Å; F197-Y214 HydrophobicContact CZ-CD1 4.25Å; F197-Y214 HydrophobicContact CZ-CD2 4.46Å; F197-Y214 AromaticContact CZ-CE1 3.69Å; F197-Y214 HydrophobicContact CZ-CE1 3.69Å; F197-Y214 AromaticContact CZ-CE2 3.91Å; F197-Y214 HydrophobicContact CZ-CE2 3.91Å; F197-Y214 AromaticContact CZ-CZ 3.5Å; F197-Y214 VanDerWaalsContact CZ-CZ 3.5Å; F210-Y214 HydrophobicContact CE1-CD1 4.3Å; F210-Y214 HydrophobicContact CE2-CD1 4.41Å; F210-Y214 HydrophobicContact CE2-CG 4.36Å; F210-Y214 AromaticContact CZ-CD1 3.81Å; F210-Y214 HydrophobicContact CZ-CD1 3.81Å; F210-Y214 HydrophobicContact CZ-CG 4.19Å; F210-Y214 WeakPolarHBondContact O-CB 3.44Å; F210-Y214 PolarHBondContact O-N 3.15Å; Y214-L216 HydrophobicContact CD1-CB 4.33Å; Y214-L216 HydrophobicContact CE1-CB 3.67Å; Y214-L216 PolarHBondContact O-N 3.36Å; Y214-S217 VanDerWaalsContact O-CB 3.25Å; Y214-S217 WeakPolarHBondContact O-CB 3.4Å; Y214-S217 PolarHBondContact O-N 3.31Å; Y214-S217 PolarHBondContact O-OG 2.78Å; Y214-V221 HydrophobicContact CD1-CG2 3.95Å; Y214-V221 HydrophobicContact CE1-CG2 3.64Å
215	P	95	Very high	96.4	Very high	75 Å²	75	45.2 Å²	45.2	49%	0.487	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-20.2	-172.8	-26.4	32.5	0	0	0	116.3	A190 N213	A190-P215 HydrophobicContact CB-CB 4.27Å; A190-P215 HydrophobicContact CB-CG 4.09Å; N213-P215 WeakPolarHBondContact O-CD 3.31Å
216	L	95.4	Very high	96.6	Very high	63 Å²	63	40 Å²	40	33%	0.33	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	3.5	-179.5	-57.6	-179.5	0	0	0	113.1	A190 Y214 K218 G220 V221	A190-L216 HydrophobicContact CB-CD1 4.15Å; A190-L216 HydrophobicContact CB-CG 4.09Å; Y214-L216 HydrophobicContact CD1-CB 4.33Å; Y214-L216 HydrophobicContact CE1-CB 3.67Å; Y214-L216 PolarHBondContact O-N 3.36Å; L216-K218 PolarHBondContact O-N 2.79Å; L216-G220 CarbonylContact O-C 3.56Å; L216-G220 VanDerWaalsContact O-CA 3.25Å; L216-G220 WeakPolarHBondContact O-CA 3.24Å; L216-G220 PolarHBondContact O-N 2.87Å; L216-V221 PolarHBondContact O-N 2.78Å; L216-V221 VanDerWaalsContact O-N 3.15Å
217	S	95.4	Very high	96.6	Very high	4 Å²	4	42.4 Å²	42.4	3%	0.028	22%	0.218	C	C	.	.	H	α-helix	trans	-49	-55.5	-177.1	57.8	0	0	0	0	113.2	I211 Y214 K219	I211-S217 WeakPolarHBondContact O-CB 3.25Å; I211-S217 PolarHBondContact O-OG 3.4Å; Y214-S217 VanDerWaalsContact O-CB 3.25Å; Y214-S217 WeakPolarHBondContact O-CB 3.4Å; Y214-S217 PolarHBondContact O-N 3.31Å; Y214-S217 PolarHBondContact O-OG 2.78Å; S217-K219 PolarHBondContact O-N 3.25Å
218	K	95.1	Very high	96.6	Very high	73 Å²	73	52 Å²	52	32%	0.317	25%	0.254	S	S	.	.	H	α-helix	trans	-71.3	-29.1	-167.5	-52.1	-159	-175	-157.7	0	113.5	I211 D212 L216 Q242 M243 Q244 G245	I211-K218 HydrophobicContact CG2-CD 4.41Å; I211-K218 HydrophobicContact CG2-CG 4.24Å; D212-K218 IonicContact OD1-NZ 3.3Å; L216-K218 PolarHBondContact O-N 2.79Å; K218-Q242 WeakPolarHBondContact CA-O 3.29Å; K218-Q242 VanDerWaalsContact CB-O 3.31Å; K218-Q242 WeakPolarHBondContact CB-O 3.42Å; K218-M243 CarbonylContact O-C 3.58Å; K218-Q244 CarbonylContact O-C 3.52Å; K218-Q244 WeakPolarHBondContact O-CA 3.21Å; K218-Q244 WeakPolarHBondContact O-CB 3.48Å; K218-Q244 PolarHBondContact O-N 3.27Å; K218-G245 PolarHBondContact O-N 3.31Å
219	K	95.4	Very high	96.7	Very high	153 Å²	153	49.9 Å²	49.9	67%	0.665	24%	0.24	S	C	*	.	H	α-helix	trans	-132.8	-23	-172.9	-67	-172.3	178.9	-178.2	0	116.2	S217	S217-K219 PolarHBondContact O-N 3.25Å
220	G	95.6	Very high	96.7	Very high	18 Å²	18	50.1 Å²	50.1	19%	0.186	25%	0.247	C	C	.	.	H	α-helix	trans	-94.4	-27.4	-177.5	0	0	0	0	0	113.9	Q195 L216 R222	Q195-G220 WeakPolarHBondContact CB-O 3.32Å; Q195-G220 WeakPolarHBondContact CG-O 3.3Å; L216-G220 CarbonylContact O-C 3.56Å; L216-G220 VanDerWaalsContact O-CA 3.25Å; L216-G220 WeakPolarHBondContact O-CA 3.24Å; L216-G220 PolarHBondContact O-N 2.87Å; G220-R222 PolarHBondContact O-N 3.43Å
221	V	97.1	Very high	96.7	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.246	C	C	.	.			trans	-71.9	124.4	172.8	-176.4	0	0	0	0	109.6	Q195 F197 Y214 L216 S223 M243 G245 L246	Q195-V221 CarbonylContact O-C 3.57Å; Q195-V221 WeakPolarHBondContact O-CA 3.26Å; F197-V221 HydrophobicContact CD2-CG2 4.11Å; F197-V221 HydrophobicContact CE2-CG2 4.16Å; Y214-V221 HydrophobicContact CD1-CG2 3.95Å; Y214-V221 HydrophobicContact CE1-CG2 3.64Å; L216-V221 PolarHBondContact O-N 2.78Å; L216-V221 VanDerWaalsContact O-N 3.15Å; V221-S223 VanDerWaalsContact CG1-O 3.27Å; V221-S223 WeakPolarHBondContact CG1-O 3.13Å; V221-M243 HydrophobicContact CB-CE 3.6Å; V221-M243 HydrophobicContact CG1-CE 3.52Å; V221-M243 HydrophobicContact CG2-CE 4Å; V221-G245 CarbonylContact O-C 3.5Å; V221-G245 WeakPolarHBondContact O-CA 3.45Å; V221-L246 HydrophobicContact CG1-CD1 4.11Å; V221-L246 PolarHBondContact O-N 2.96Å
222	R	97.4	Very high	96.7	Very high	91 Å²	91	52.2 Å²	52.2	34%	0.343	26%	0.26	S	S	.	.			trans	-108.6	-29.6	177.7	-60.1	-51.8	-171.6	175.2	-0.1	112.6	Q195 G220 G245 M247 H248	Q195-R222 HydrophobicContact CB-CB 4.4Å; Q195-R222 HydrophobicContact CB-CG 4.18Å; Q195-R222 PolarHBondContact O-N 2.95Å; G220-R222 PolarHBondContact O-N 3.43Å; R222-G245 WeakPolarHBondContact CD-O 3.31Å; R222-G245 PolarHBondContact NH1-O 3.47Å; R222-M247 PolarHBondContact O-N 3.08Å; R222-H248 PolarHBondContact O-N 3.41Å
223	S	98.3	Very high	96.9	Very high	37 Å²	37	48.7 Å²	48.7	26%	0.259	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	136	178.7	174.6	0	0	0	0	111	Q195 S196 F197 V221 H248	Q195-S223 PolarHBondContact O-N 3.36Å; S196-S223 VanDerWaalsContact CA-O 3.28Å; S196-S223 WeakPolarHBondContact CA-O 3.49Å; F197-S223 PolarHBondContact N-O 2.88Å; F197-S223 VanDerWaalsContact N-O 3.16Å; V221-S223 VanDerWaalsContact CG1-O 3.27Å; V221-S223 WeakPolarHBondContact CG1-O 3.13Å; S223-H248 WeakPolarHBondContact CA-O 3.4Å
224	L	98.3	Very high	97	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	130.9	174.9	-174.2	65.8	0	0	0	109.3	F197 L199 L226 M239 M243 L246 H248 L249 E250	F197-L224 HydrophobicContact CB-CD1 3.88Å; F197-L224 WeakPolarHBondContact O-CA 3.24Å; L199-L224 HydrophobicContact CD1-CD1 4.01Å; L199-L224 HydrophobicContact CG-CD1 3.99Å; L224-L226 HydrophobicContact CD1-CD2 4.41Å; L224-L226 HydrophobicContact CD2-CD2 4.14Å; L224-L226 HydrophobicContact CG-CD2 4.09Å; L224-M239 HydrophobicContact CD2-CE 4.03Å; L224-M239 HydrophobicContact CD2-CG 4.26Å; L224-M239 HydrophobicContact CD2-SD 3.39Å; L224-M239 WeakPolarHBondContact CD2-SD 3.17Å; L224-M243 HydrophobicContact CD2-CE 4.04Å; L224-M243 HydrophobicContact CD2-SD 3.85Å; L224-L246 HydrophobicContact CB-CD1 3.59Å; L224-L246 HydrophobicContact CB-CD2 4.38Å; L224-H248 PolarHBondContact N-O 2.61Å; L224-L249 WeakPolarHBondContact O-CA 3.49Å; L224-E250 PolarHBondContact O-N 2.86Å
225	S	98.6	Very high	97	Very high	7 Å²	7	49 Å²	49	5%	0.049	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.7	175.6	177.9	0	0	0	0	109	F197 C198 L199 K227 E250	F197-S225 PolarHBondContact O-N 3.31Å; C198-S225 CarbonylContact C-O 3.53Å; C198-S225 VanDerWaalsContact CA-O 3.31Å; C198-S225 WeakPolarHBondContact CA-O 3.3Å; L199-S225 PolarHBondContact N-O 3.39Å; S225-K227 WeakPolarHBondContact OG-CE 3.42Å; S225-E250 CarbonylContact C-O 3.36Å; S225-E250 WeakPolarHBondContact CA-O 3.32Å; S225-E250 VanDerWaalsContact CB-OE2 3.31Å; S225-E250 WeakPolarHBondContact CB-OE2 3.41Å; S225-E250 VanDerWaalsContact OG-CD 3.24Å; S225-E250 PolarHBondContact OG-OE2 2.94Å
226	L	98.5	Very high	97.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	119.8	175.7	-57.5	-175.1	0	0	0	108.3	L199 V202 I207 L224 I231 M239 E250 L251 S252	L199-L226 HydrophobicContact CB-CD2 3.87Å; L199-L226 HydrophobicContact CD1-CD2 4.16Å; L199-L226 HydrophobicContact CG-CD2 4.32Å; L199-L226 WeakPolarHBondContact O-CA 3.46Å; V202-L226 HydrophobicContact CG2-CD2 4.08Å; I207-L226 HydrophobicContact CD1-CD1 4.02Å; L224-L226 HydrophobicContact CD1-CD2 4.41Å; L224-L226 HydrophobicContact CD2-CD2 4.14Å; L224-L226 HydrophobicContact CG-CD2 4.09Å; L226-I231 HydrophobicContact CD1-CB 4.47Å; L226-I231 HydrophobicContact CD1-CD1 3.53Å; L226-I231 HydrophobicContact CD1-CG2 4.17Å; L226-M239 HydrophobicContact CD1-CE 4.23Å; L226-M239 HydrophobicContact CD1-SD 3.9Å; L226-E250 PolarHBondContact N-O 3.46Å; L226-L251 HydrophobicContact CB-CD2 4.08Å; L226-L251 HydrophobicContact CD1-CD2 3.86Å; L226-L251 HydrophobicContact CG-CD2 4.22Å; L226-S252 PolarHBondContact O-N 3.37Å
227	K	98.3	Very high	97.3	Very high	67 Å²	67	47 Å²	47	29%	0.291	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	125.7	-177.1	-51.9	-153.2	-175.7	-143.6	0	112.3	L199 V200 G201 S225 S229 E250 S252	L199-K227 PolarHBondContact O-N 3.17Å; V200-K227 CarbonylContact C-O 3.5Å; V200-K227 VanDerWaalsContact CA-O 3.32Å; V200-K227 WeakPolarHBondContact CA-O 3.46Å; V200-K227 HydrophobicContact CG1-CB 4.46Å; V200-K227 WeakPolarHBondContact CG1-O 3.49Å; V200-K227 HydrophobicContact CG2-CB 4.36Å; G201-K227 PolarHBondContact N-O 3.33Å; S225-K227 WeakPolarHBondContact OG-CE 3.42Å; K227-S229 PolarHBondContact O-N 3.35Å; K227-S229 PolarHBondContact O-OG 3.06Å; K227-E250 WeakPolarHBondContact CE-OE1 3.08Å; K227-E250 WeakPolarHBondContact CE-OE2 3.09Å; K227-E250 IonicContact NZ-OE1 2.71Å; K227-E250 PolarHBondContact NZ-OE1 2.92Å; K227-E250 IonicContact NZ-OE2 3.55Å; K227-E250 PolarHBondContact NZ-OE2 3.43Å; K227-S252 CarbonylContact C-O 3.37Å; K227-S252 VanDerWaalsContact CA-O 3.29Å; K227-S252 WeakPolarHBondContact CA-O 3.37Å
228	R	97.4	Very high	97.4	Very high	204 Å²	204	49.7 Å²	49.7	77%	0.77	25%	0.251	S	S	*	.	S	Bend	trans	54.6	34	-179.5	-54.3	176.9	-178.2	164.3	0.6	112.3	G201 S252 G253	G201-R228 WeakPolarHBondContact CA-O 3.4Å; R228-S252 PolarHBondContact N-O 3.42Å; R228-G253 WeakPolarHBondContact CA-O 3.35Å
229	S	97.6	Very high	97.5	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.007	24%	0.236	C	C	.	.			trans	-97.3	138.9	-172.8	-63.9	0	0	0	0	110.6	G201 V202 K227 I231 C254	G201-S229 PolarHBondContact N-OG 3.13Å; V202-S229 VanDerWaalsContact CG2-OG 3.24Å; V202-S229 WeakPolarHBondContact CG2-OG 3.47Å; V202-S229 PolarHBondContact N-OG 3.42Å; V202-S229 CarbonylContact O-C 3.59Å; V202-S229 VanDerWaalsContact O-CA 3.32Å; V202-S229 WeakPolarHBondContact O-CA 3.44Å; V202-S229 WeakPolarHBondContact O-CB 3.4Å; K227-S229 PolarHBondContact O-N 3.35Å; K227-S229 PolarHBondContact O-OG 3.06Å; S229-I231 PolarHBondContact O-N 2.89Å; S229-I231 VanDerWaalsContact O-N 3.08Å; S229-C254 WeakPolarHBondContact O-CA 3.29Å; S229-C254 PolarHBondContact O-SG 2.77Å
230	T	97.1	Very high	97.5	Very high	76 Å²	76	39 Å²	39	47%	0.466	20%	0.204	S	C	.	.	B	Isolated β-bridge	trans	-87.5	52.3	179.3	61.7	0	0	0	0	110.2	V202 D256	V202-T230 PolarHBondContact O-N 2.76Å; T230-D256 WeakPolarHBondContact CA-OD2 3.33Å; T230-D256 WeakPolarHBondContact CB-OD2 3.39Å; T230-D256 WeakPolarHBondContact CG2-OD2 3.47Å
231	I	97.1	Very high	97.6	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.223	C	C	.	.			trans	-81.8	127.4	178.8	-171.9	178	0	0	0	109.3	D204 I207 L226 S229 L236 M239 C254 D256 F257	D204-I231 VanDerWaalsContact OD1-CA 3.3Å; D204-I231 WeakPolarHBondContact OD1-CA 3.22Å; I207-I231 HydrophobicContact CD1-CB 4.2Å; I207-I231 HydrophobicContact CD1-CD1 3.49Å; I207-I231 VanDerWaalsContact CD1-CD1 3.49Å; I207-I231 HydrophobicContact CD1-CG1 3.85Å; L226-I231 HydrophobicContact CD1-CB 4.47Å; L226-I231 HydrophobicContact CD1-CD1 3.53Å; L226-I231 HydrophobicContact CD1-CG2 4.17Å; S229-I231 PolarHBondContact O-N 2.89Å; S229-I231 VanDerWaalsContact O-N 3.08Å; I231-L236 HydrophobicContact CD1-CB 3.88Å; I231-L236 HydrophobicContact CD1-CD1 3.96Å; I231-L236 HydrophobicContact CG1-CB 4.29Å; I231-M239 HydrophobicContact CD1-SD 4.28Å; I231-C254 HydrophobicContact CG2-CB 4.02Å; I231-D256 CarbonylContact O-C 3.44Å; I231-F257 PolarHBondContact O-N 2.83Å
232	T	97.8	Very high	97.6	Very high	51 Å²	51	46.8 Å²	46.8	31%	0.313	24%	0.236	S	C	.	.			trans	-92.6	171	176.8	76.9	0	0	0	0	111.5	D204 A234 G235 L236 D256	D204-T232 PolarHBondContact OD1-N 3.42Å; D204-T232 WeakPolarHBondContact OD2-CB 3.42Å; D204-T232 WeakPolarHBondContact OD2-CG2 3.36Å; D204-T232 PolarHBondContact OD2-OG1 2.6Å; T232-A234 PolarHBondContact O-N 3.27Å; T232-A234 PolarHBondContact OG1-N 3.2Å; T232-G235 PolarHBondContact O-N 3.38Å; T232-G235 VanDerWaalsContact O-N 3.14Å; T232-G235 PolarHBondContact OG1-N 2.57Å; T232-L236 WeakPolarHBondContact O-CB 3.28Å; T232-L236 PolarHBondContact O-N 3.16Å; T232-D256 HydrophobicContact CG2-CB 4.5Å
233	D	97.8	Very high	97.6	Very high	42 Å²	42	42.4 Å²	42.4	23%	0.225	22%	0.22	C	C	.	.	H	α-helix	trans	-50.6	-42.6	172.7	-66.1	-16.4	0	0	0	112.3	L236 E237 F257 T258 G261	D233-L236 PolarHBondContact O-N 2.95Å; D233-E237 WeakPolarHBondContact O-CB 3.25Å; D233-E237 PolarHBondContact O-N 2.91Å; D233-F257 VanDerWaalsContact OD1-CA 3.23Å; D233-F257 WeakPolarHBondContact OD1-CA 3.44Å; D233-T258 PolarHBondContact OD1-N 3.26Å; D233-T258 PolarHBondContact OD1-OG1 2.94Å; D233-T258 PolarHBondContact OD2-OG1 3.04Å; D233-G261 VanDerWaalsContact OD1-CA 3.26Å; D233-G261 WeakPolarHBondContact OD1-CA 3.38Å; D233-G261 PolarHBondContact OD1-N 3Å
234	A	97.5	Very high	97.4	Very high	61 Å²	61	45.8 Å²	45.8	50%	0.504	23%	0.231	S	C	.	.	H	α-helix	trans	-70.2	-39.5	179.7	0	0	0	0	0	112.6	T232 E237 V238	T232-A234 PolarHBondContact O-N 3.27Å; T232-A234 PolarHBondContact OG1-N 3.2Å; A234-E237 PolarHBondContact O-N 3.07Å; A234-V238 WeakPolarHBondContact O-CG2 3.47Å; A234-V238 PolarHBondContact O-N 3.21Å
235	G	97.4	Very high	97.3	Very high	5 Å²	5	45.9 Å²	45.9	5%	0.052	23%	0.233	C	C	.	.	H	α-helix	trans	-64.4	-41.4	174.5	0	0	0	0	0	112.3	D204 T232 M239	D204-G235 WeakPolarHBondContact OD1-CA 3.39Å; T232-G235 PolarHBondContact O-N 3.38Å; T232-G235 VanDerWaalsContact O-N 3.14Å; T232-G235 PolarHBondContact OG1-N 2.57Å; G235-M239 WeakPolarHBondContact O-CB 3.41Å; G235-M239 PolarHBondContact O-N 2.99Å
236	L	97.4	Very high	97.3	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-65.2	-41.5	177.2	-173.1	66.7	0	0	0	111.7	I231 T232 D233 M239 L240 L249 L251 F257 L262 S265	I231-L236 HydrophobicContact CD1-CB 3.88Å; I231-L236 HydrophobicContact CD1-CD1 3.96Å; I231-L236 HydrophobicContact CG1-CB 4.29Å; T232-L236 WeakPolarHBondContact O-CB 3.28Å; T232-L236 PolarHBondContact O-N 3.16Å; D233-L236 PolarHBondContact O-N 2.95Å; L236-M239 HydrophobicContact CD1-CE 3.79Å; L236-M239 PolarHBondContact O-N 3.01Å; L236-L240 HydrophobicContact CD1-CD1 4.31Å; L236-L240 HydrophobicContact CD1-CG 4.45Å; L236-L240 HydrophobicContact CG-CD1 4.38Å; L236-L240 WeakPolarHBondContact O-CB 3.36Å; L236-L240 WeakPolarHBondContact O-CG 3.05Å; L236-L240 PolarHBondContact O-N 2.98Å; L236-L249 HydrophobicContact CD1-CD2 4.31Å; L236-L251 HydrophobicContact CD1-CD1 4.32Å; L236-L251 HydrophobicContact CD1-CD2 4.33Å; L236-L251 HydrophobicContact CD2-CD1 4.41Å; L236-F257 HydrophobicContact CD2-CD2 4.44Å; L236-L262 HydrophobicContact CD2-CD2 4.13Å; L236-S265 WeakPolarHBondContact CD2-OG 3.33Å; L236-S265 WeakPolarHBondContact CG-OG 3.27Å
237	E	97.4	Very high	97.2	Very high	95 Å²	95	49.1 Å²	49.1	44%	0.444	25%	0.248	S	C	.	.	H	α-helix	trans	-61.5	-53.2	175.2	-171	174	148.1	0	0	112.1	D233 A234 M239 L240 E241 S264	D233-E237 WeakPolarHBondContact O-CB 3.25Å; D233-E237 PolarHBondContact O-N 2.91Å; A234-E237 PolarHBondContact O-N 3.07Å; E237-M239 VanDerWaalsContact C-N 3.31Å; E237-M239 PolarHBondContact O-N 2.83Å; E237-L240 PolarHBondContact O-N 3.39Å; E237-E241 WeakPolarHBondContact O-CB 3.41Å; E237-E241 PolarHBondContact O-N 2.88Å; E237-S264 WeakPolarHBondContact OE2-CB 3.36Å; E237-S264 PolarHBondContact OE2-OG 3.12Å
238	V	97.4	Very high	97.2	Very high	62 Å²	62	49.4 Å²	49.4	38%	0.376	25%	0.25	S	C	.	.	H	α-helix	trans	-59.6	-42.4	177.4	171.5	0	0	0	0	111.3	A234 E241 Q242	A234-V238 WeakPolarHBondContact O-CG2 3.47Å; A234-V238 PolarHBondContact O-N 3.21Å; V238-E241 PolarHBondContact O-N 2.83Å; V238-Q242 HydrophobicContact CG1-CG 4.28Å; V238-Q242 WeakPolarHBondContact O-CB 3.43Å; V238-Q242 VanDerWaalsContact O-CG 3.26Å; V238-Q242 WeakPolarHBondContact O-CG 3.39Å; V238-Q242 PolarHBondContact O-N 2.89Å
239	M	97.5	Very high	97.3	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.7	-49.3	177.8	-173.1	-173	80.1	0	0	111.7	I207 I211 L224 L226 I231 G235 L236 E237 Q242 M243 L249	I207-M239 HydrophobicContact CD1-SD 4.35Å; I207-M239 HydrophobicContact CG2-CB 3.86Å; I207-M239 HydrophobicContact CG2-CG 3.69Å; I207-M239 HydrophobicContact CG2-SD 3.94Å; I211-M239 HydrophobicContact CD1-CB 4.5Å; I211-M239 HydrophobicContact CD1-CG 4.36Å; L224-M239 HydrophobicContact CD2-CE 4.03Å; L224-M239 HydrophobicContact CD2-CG 4.26Å; L224-M239 HydrophobicContact CD2-SD 3.39Å; L224-M239 WeakPolarHBondContact CD2-SD 3.17Å; L226-M239 HydrophobicContact CD1-CE 4.23Å; L226-M239 HydrophobicContact CD1-SD 3.9Å; I231-M239 HydrophobicContact CD1-SD 4.28Å; G235-M239 WeakPolarHBondContact O-CB 3.41Å; G235-M239 PolarHBondContact O-N 2.99Å; L236-M239 HydrophobicContact CD1-CE 3.79Å; L236-M239 PolarHBondContact O-N 3.01Å; E237-M239 VanDerWaalsContact C-N 3.31Å; E237-M239 PolarHBondContact O-N 2.83Å; M239-Q242 PolarHBondContact O-N 3.47Å; M239-M243 HydrophobicContact CG-CG 4.39Å; M239-M243 HydrophobicContact CG-SD 3.66Å; M239-M243 WeakPolarHBondContact O-CB 3.44Å; M239-M243 VanDerWaalsContact O-CG 3.3Å; M239-M243 WeakPolarHBondContact O-CG 3.33Å; M239-M243 PolarHBondContact O-N 2.99Å; M239-L249 HydrophobicContact CE-CD1 3.81Å
240	L	97	Very high	97.3	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-74.3	-22.9	-179	-68.4	-173.3	0	0	0	113.3	L236 E237 L246 L249 S265 L266 R269 L270	L236-L240 HydrophobicContact CD1-CD1 4.31Å; L236-L240 HydrophobicContact CD1-CG 4.45Å; L236-L240 HydrophobicContact CG-CD1 4.38Å; L236-L240 WeakPolarHBondContact O-CB 3.36Å; L236-L240 WeakPolarHBondContact O-CG 3.05Å; L236-L240 PolarHBondContact O-N 2.98Å; E237-L240 PolarHBondContact O-N 3.39Å; L240-L246 HydrophobicContact CD2-CD2 3.52Å; L240-L249 HydrophobicContact CD1-CD2 4.28Å; L240-L249 HydrophobicContact CD2-CD2 4.37Å; L240-S265 WeakPolarHBondContact CB-O 3.37Å; L240-S265 VanDerWaalsContact CD1-O 3.3Å; L240-S265 WeakPolarHBondContact CD1-O 3.31Å; L240-L266 HydrophobicContact CD1-CD2 4.24Å; L240-R269 PolarHBondContact O-NH2 3.4Å; L240-L270 HydrophobicContact CD1-CD1 4.44Å
241	E	96.4	Very high	97.3	Very high	122 Å²	122	38.7 Å²	38.7	57%	0.57	20%	0.203	S	C	*	.	H	α-helix	trans	-70.1	-50.8	169.2	-167.7	-160.6	-157.9	0	0	111.2	E237 V238	E237-E241 WeakPolarHBondContact O-CB 3.41Å; E237-E241 PolarHBondContact O-N 2.88Å; V238-E241 PolarHBondContact O-N 2.83Å
242	Q	97.2	Very high	97.4	Very high	59 Å²	59	39.8 Å²	39.8	28%	0.276	21%	0.211	S	C	.	.	H	α-helix	trans	-75.7	-35.3	-173.9	-63.8	-63.3	-52	0	0	113	I211 K218 V238 M239 Q244	I211-Q242 HydrophobicContact CD1-CB 4.27Å; I211-Q242 HydrophobicContact CG2-CB 4.09Å; K218-Q242 WeakPolarHBondContact CA-O 3.29Å; K218-Q242 VanDerWaalsContact CB-O 3.31Å; K218-Q242 WeakPolarHBondContact CB-O 3.42Å; V238-Q242 HydrophobicContact CG1-CG 4.28Å; V238-Q242 WeakPolarHBondContact O-CB 3.43Å; V238-Q242 VanDerWaalsContact O-CG 3.26Å; V238-Q242 WeakPolarHBondContact O-CG 3.39Å; V238-Q242 PolarHBondContact O-N 2.89Å; M239-Q242 PolarHBondContact O-N 3.47Å; Q242-Q244 VanDerWaalsContact C-N 3.27Å; Q242-Q244 PolarHBondContact O-N 2.96Å
243	M	96.9	Very high	97.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.205	C	C	.	.			trans	-85.3	66.4	-179.5	-59.8	-174.3	70.3	0	0	111.6	F210 I211 K218 V221 L224 M239 G245 L246 R269	F210-M243 HydrophobicContact CE1-CE 4.36Å; I211-M243 HydrophobicContact CD1-CG 4.1Å; I211-M243 HydrophobicContact CD1-SD 4.23Å; I211-M243 HydrophobicContact CG1-CG 4.09Å; I211-M243 HydrophobicContact CG1-SD 4.1Å; K218-M243 CarbonylContact O-C 3.58Å; V221-M243 HydrophobicContact CB-CE 3.6Å; V221-M243 HydrophobicContact CG1-CE 3.52Å; V221-M243 HydrophobicContact CG2-CE 4Å; L224-M243 HydrophobicContact CD2-CE 4.04Å; L224-M243 HydrophobicContact CD2-SD 3.85Å; M239-M243 HydrophobicContact CG-CG 4.39Å; M239-M243 HydrophobicContact CG-SD 3.66Å; M239-M243 WeakPolarHBondContact O-CB 3.44Å; M239-M243 VanDerWaalsContact O-CG 3.3Å; M239-M243 WeakPolarHBondContact O-CG 3.33Å; M239-M243 PolarHBondContact O-N 2.99Å; M243-G245 PolarHBondContact O-N 3.39Å; M243-G245 VanDerWaalsContact O-N 3.16Å; M243-L246 HydrophobicContact CB-CB 4.2Å; M243-L246 WeakPolarHBondContact O-CB 3.3Å; M243-L246 PolarHBondContact O-N 3.42Å; M243-R269 PolarHBondContact O-NH2 2.86Å
244	Q	95.3	Very high	97.2	Very high	108 Å²	108	36.2 Å²	36.2	51%	0.505	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-23	178.3	-61.4	176.4	-1.5	0	0	113.9	K218 Q242 R269	K218-Q244 CarbonylContact O-C 3.52Å; K218-Q244 WeakPolarHBondContact O-CA 3.21Å; K218-Q244 WeakPolarHBondContact O-CB 3.48Å; K218-Q244 PolarHBondContact O-N 3.27Å; Q242-Q244 VanDerWaalsContact C-N 3.27Å; Q242-Q244 PolarHBondContact O-N 2.96Å; Q244-R269 WeakPolarHBondContact O-CD 3.38Å; Q244-R269 PolarHBondContact O-NE 2.95Å
245	G	95.9	Very high	97.1	Very high	3 Å²	3	35.9 Å²	35.9	3%	0.031	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-21.4	175.2	0	0	0	0	0	115.1	K218 V221 R222 M243	K218-G245 PolarHBondContact O-N 3.31Å; V221-G245 CarbonylContact O-C 3.5Å; V221-G245 WeakPolarHBondContact O-CA 3.45Å; R222-G245 WeakPolarHBondContact CD-O 3.31Å; R222-G245 PolarHBondContact NH1-O 3.47Å; M243-G245 PolarHBondContact O-N 3.39Å; M243-G245 VanDerWaalsContact O-N 3.16Å
246	L	97.5	Very high	97	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	20%	0.203	C	C	.	.			trans	-69.6	132.7	-165.9	-164.4	72.5	0	0	0	112.5	V221 L224 L240 M243 L249 L270	V221-L246 HydrophobicContact CG1-CD1 4.11Å; V221-L246 PolarHBondContact O-N 2.96Å; L224-L246 HydrophobicContact CB-CD1 3.59Å; L224-L246 HydrophobicContact CB-CD2 4.38Å; L240-L246 HydrophobicContact CD2-CD2 3.52Å; M243-L246 HydrophobicContact CB-CB 4.2Å; M243-L246 WeakPolarHBondContact O-CB 3.3Å; M243-L246 PolarHBondContact O-N 3.42Å; L246-L249 HydrophobicContact CD2-CB 4.47Å; L246-L249 HydrophobicContact CD2-CD1 4.34Å; L246-L270 HydrophobicContact CD2-CD2 4.23Å; L246-L270 HydrophobicContact CG-CD2 4.12Å
247	M	97.4	Very high	96.9	Very high	74 Å²	74	39.7 Å²	39.7	37%	0.365	20%	0.203	S	C	.	.			trans	-127.5	-25.8	-179.6	-69.7	171.2	170.4	0	0	112.4	R222 L270 T271 S272	R222-M247 PolarHBondContact O-N 3.08Å; M247-L270 CarbonylContact O-C 3.58Å; M247-L270 WeakPolarHBondContact O-CA 3.2Å; M247-T271 PolarHBondContact O-N 3.33Å; M247-T271 PolarHBondContact O-OG1 3.4Å; M247-S272 PolarHBondContact O-N 2.95Å
248	H	98.3	Very high	96.8	Very high	72 Å²	72	37.4 Å²	37.4	33%	0.333	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	121.4	-179.5	-47.3	-58.6	0	0	0	109.7	R222 S223 L224 T271 S272	R222-H248 PolarHBondContact O-N 3.41Å; S223-H248 WeakPolarHBondContact CA-O 3.4Å; L224-H248 PolarHBondContact N-O 2.61Å; H248-T271 PolarHBondContact CE1-OG1 2.98Å; H248-S272 WeakPolarHBondContact CA-O 3.27Å; H248-S272 WeakPolarHBondContact ND1-CB 3.2Å
249	L	98.4	Very high	96.6	Very high	5 Å²	5	36.7 Å²	36.7	3%	0.026	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	130.2	178.1	178.5	64.4	0	0	0	109.9	L224 L236 M239 L240 L246 L251 L270 S272 L273 S274	L224-L249 WeakPolarHBondContact O-CA 3.49Å; L236-L249 HydrophobicContact CD1-CD2 4.31Å; M239-L249 HydrophobicContact CE-CD1 3.81Å; L240-L249 HydrophobicContact CD1-CD2 4.28Å; L240-L249 HydrophobicContact CD2-CD2 4.37Å; L246-L249 HydrophobicContact CD2-CB 4.47Å; L246-L249 HydrophobicContact CD2-CD1 4.34Å; L249-L251 HydrophobicContact CD1-CD2 4Å; L249-L251 HydrophobicContact CD1-CG 4.42Å; L249-L251 HydrophobicContact CD2-CD1 4.3Å; L249-L251 HydrophobicContact CD2-CD2 4.41Å; L249-L251 HydrophobicContact CD2-CG 4.23Å; L249-L251 HydrophobicContact CG-CD2 4.28Å; L249-L251 HydrophobicContact CG-CG 4.16Å; L249-L270 HydrophobicContact CB-CD1 4.3Å; L249-L270 HydrophobicContact CB-CD2 4.26Å; L249-L270 HydrophobicContact CD2-CD1 4.34Å; L249-S272 PolarHBondContact N-O 3.49Å; L249-S272 VanDerWaalsContact N-O 3.09Å; L249-L273 HydrophobicContact CB-CD1 4.01Å; L249-L273 HydrophobicContact CD2-CD1 3.96Å; L249-L273 HydrophobicContact CG-CD1 4.08Å; L249-L273 WeakPolarHBondContact O-CA 3.46Å; L249-S274 PolarHBondContact O-N 2.87Å
250	E	98.3	Very high	96.6	Very high	52 Å²	52	39.6 Å²	39.6	24%	0.243	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.9	167	179.2	-171.2	-174.3	0	0	109.4	L224 S225 L226 K227 S274	L224-E250 PolarHBondContact O-N 2.86Å; S225-E250 CarbonylContact C-O 3.36Å; S225-E250 WeakPolarHBondContact CA-O 3.32Å; S225-E250 VanDerWaalsContact CB-OE2 3.31Å; S225-E250 WeakPolarHBondContact CB-OE2 3.41Å; S225-E250 VanDerWaalsContact OG-CD 3.24Å; S225-E250 PolarHBondContact OG-OE2 2.94Å; L226-E250 PolarHBondContact N-O 3.46Å; K227-E250 WeakPolarHBondContact CE-OE1 3.08Å; K227-E250 WeakPolarHBondContact CE-OE2 3.09Å; K227-E250 IonicContact NZ-OE1 2.71Å; K227-E250 PolarHBondContact NZ-OE1 2.92Å; K227-E250 IonicContact NZ-OE2 3.55Å; K227-E250 PolarHBondContact NZ-OE2 3.43Å; E250-S274 CarbonylContact C-O 3.52Å; E250-S274 WeakPolarHBondContact CA-O 3.24Å
251	L	97.9	Very high	96.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	117.6	170.5	-59.2	178.1	0	0	0	107.8	L226 L236 L249 F257 S274 V275 S276	L226-L251 HydrophobicContact CB-CD2 4.08Å; L226-L251 HydrophobicContact CD1-CD2 3.86Å; L226-L251 HydrophobicContact CG-CD2 4.22Å; L236-L251 HydrophobicContact CD1-CD1 4.32Å; L236-L251 HydrophobicContact CD1-CD2 4.33Å; L236-L251 HydrophobicContact CD2-CD1 4.41Å; L249-L251 HydrophobicContact CD1-CD2 4Å; L249-L251 HydrophobicContact CD1-CG 4.42Å; L249-L251 HydrophobicContact CD2-CD1 4.3Å; L249-L251 HydrophobicContact CD2-CD2 4.41Å; L249-L251 HydrophobicContact CD2-CG 4.23Å; L249-L251 HydrophobicContact CG-CD2 4.28Å; L249-L251 HydrophobicContact CG-CG 4.16Å; L251-F257 HydrophobicContact CB-CE1 4.25Å; L251-F257 HydrophobicContact CD1-CD1 4.31Å; L251-F257 HydrophobicContact CD1-CE1 3.79Å; L251-F257 HydrophobicContact CD1-CE2 4.32Å; L251-F257 HydrophobicContact CD1-CZ 3.82Å; L251-S274 PolarHBondContact N-O 2.85Å; L251-V275 HydrophobicContact CB-CG1 4.41Å; L251-V275 CarbonylContact O-C 3.48Å; L251-V275 VanDerWaalsContact O-CA 3.3Å; L251-V275 WeakPolarHBondContact O-CA 3.16Å; L251-S276 PolarHBondContact O-N 3.24Å
252	S	97.7	Very high	96.5	Very high	23 Å²	23	33.8 Å²	33.8	16%	0.161	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	113.4	-175	-170.8	0	0	0	0	111.2	L226 K227 R228 C254 S276	L226-S252 PolarHBondContact O-N 3.37Å; K227-S252 CarbonylContact C-O 3.37Å; K227-S252 VanDerWaalsContact CA-O 3.29Å; K227-S252 WeakPolarHBondContact CA-O 3.37Å; R228-S252 PolarHBondContact N-O 3.42Å; S252-C254 PolarHBondContact O-N 3.03Å; S252-S276 CarbonylContact C-O 3.55Å; S252-S276 VanDerWaalsContact CA-O 3.27Å; S252-S276 WeakPolarHBondContact CA-O 3.48Å; S252-S276 VanDerWaalsContact CB-OG 3.31Å; S252-S276 WeakPolarHBondContact CB-OG 3.42Å; S252-S276 PolarHBondContact OG-OG 2.96Å
253	G	96.5	Very high	96.5	Very high	17 Å²	17	35.3 Å²	35.3	18%	0.175	19%	0.188	C	C	.	.	S	Bend	trans	65	27.7	-175.4	0	0	0	0	0	113.7	R228 S276 D277	R228-G253 WeakPolarHBondContact CA-O 3.35Å; G253-S276 PolarHBondContact N-O 3.17Å; G253-D277 WeakPolarHBondContact CA-O 3.47Å
254	C	96.3	Very high	96.4	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.007	21%	0.208	C	C	.	.			trans	-92.6	101.6	175.5	-70.5	0	0	0	0	108.5	S229 I231 S252 F257 C278	S229-C254 WeakPolarHBondContact O-CA 3.29Å; S229-C254 PolarHBondContact O-SG 2.77Å; I231-C254 HydrophobicContact CG2-CB 4.02Å; S252-C254 PolarHBondContact O-N 3.03Å; C254-F257 HydrophobicContact CB-CD1 3.86Å; C254-F257 HydrophobicContact CB-CE1 3.83Å; C254-F257 VanDerWaalsContact O-CD1 3.24Å; C254-F257 WeakPolarHBondContact O-CD1 3.31Å; C254-F257 WeakPolarHBondContact O-CE1 3.46Å; C254-C278 PolarHBondContact O-SG 2.89Å; C254-C278 VanDerWaalsContact O-SG 3.39Å
255	N	94.3	Very high	96.4	Very high	54 Å²	54	33.3 Å²	33.3	29%	0.289	19%	0.186	S	C	.	.			trans	-104.6	-0.6	-167.4	-69	-50.4	0	0	0	114.7	D277 C278 I279 N280	N255-D277 PolarHBondContact OD1-O 2.86Å; N255-C278 WeakPolarHBondContact OD1-CA 3.37Å; N255-I279 HydrophobicContact CB-CD1 4.12Å; N255-I279 HydrophobicContact CB-CG1 4.09Å; N255-I279 WeakPolarHBondContact OD1-CG1 3.23Å; N255-I279 PolarHBondContact OD1-N 3.25Å; N255-N280 PolarHBondContact O-ND2 3.14Å
256	D	96	Very high	96.4	Very high	84 Å²	84	33.6 Å²	33.6	45%	0.449	19%	0.187	S	C	.	.	S	Bend	trans	-101	-6.8	-176	-58.7	-38.8	0	0	0	113.5	T230 I231 T232	T230-D256 WeakPolarHBondContact CA-OD2 3.33Å; T230-D256 WeakPolarHBondContact CB-OD2 3.39Å; T230-D256 WeakPolarHBondContact CG2-OD2 3.47Å; I231-D256 CarbonylContact O-C 3.44Å; T232-D256 HydrophobicContact CG2-CB 4.5Å
257	F	95.6	Very high	96.1	Very high	1 Å²	1	35.1 Å²	35.1	0%	0.004	20%	0.195	C	C	.	.			trans	-89.6	162	166.5	85.2	-90.6	0	0	0	110.7	I231 D233 L236 L251 C254 L262 V275 C278 N280 V281	I231-F257 PolarHBondContact O-N 2.83Å; D233-F257 VanDerWaalsContact OD1-CA 3.23Å; D233-F257 WeakPolarHBondContact OD1-CA 3.44Å; L236-F257 HydrophobicContact CD2-CD2 4.44Å; L251-F257 HydrophobicContact CB-CE1 4.25Å; L251-F257 HydrophobicContact CD1-CD1 4.31Å; L251-F257 HydrophobicContact CD1-CE1 3.79Å; L251-F257 HydrophobicContact CD1-CE2 4.32Å; L251-F257 HydrophobicContact CD1-CZ 3.82Å; C254-F257 HydrophobicContact CB-CD1 3.86Å; C254-F257 HydrophobicContact CB-CE1 3.83Å; C254-F257 VanDerWaalsContact O-CD1 3.24Å; C254-F257 WeakPolarHBondContact O-CD1 3.31Å; C254-F257 WeakPolarHBondContact O-CE1 3.46Å; F257-L262 HydrophobicContact CD2-CD2 4.24Å; F257-L262 HydrophobicContact CD2-CG 4.15Å; F257-L262 HydrophobicContact CE2-CD1 4Å; F257-L262 HydrophobicContact CE2-CD2 3.86Å; F257-L262 HydrophobicContact CE2-CG 3.83Å; F257-V275 HydrophobicContact CZ-CG1 3.95Å; F257-C278 HydrophobicContact CE1-CB 4.05Å; F257-C278 HydrophobicContact CZ-CB 4.04Å; F257-N280 WeakPolarHBondContact O-CB 3.09Å; F257-N280 PolarHBondContact O-ND2 3.04Å; F257-V281 HydrophobicContact CE2-CG2 4.13Å; F257-V281 HydrophobicContact CZ-CG2 3.95Å
258	T	94.8	Very high	95.9	Very high	47 Å²	47	33.8 Å²	33.8	29%	0.288	20%	0.196	S	C	.	.			trans	-132.3	172.8	-177.2	77.9	0	0	0	0	111.5	D233 A260 G261 L262	D233-T258 PolarHBondContact OD1-N 3.26Å; D233-T258 PolarHBondContact OD1-OG1 2.94Å; D233-T258 PolarHBondContact OD2-OG1 3.04Å; T258-A260 PolarHBondContact O-N 3.19Å; T258-A260 WeakPolarHBondContact OG1-CB 3.49Å; T258-A260 PolarHBondContact OG1-N 2.98Å; T258-G261 PolarHBondContact O-N 3.06Å; T258-G261 VanDerWaalsContact O-N 3.08Å; T258-L262 PolarHBondContact O-N 2.88Å
259	E	94.4	Very high	95.7	Very high	46 Å²	46	34.6 Å²	34.6	22%	0.215	20%	0.196	C	C	.	.	H	α-helix	trans	-58	-31.2	173.1	-49.8	-172.5	104.8	0	0	111.8	L262 W263 N280 A282 D284 A285	E259-L262 PolarHBondContact O-N 3.36Å; E259-W263 PolarHBondContact O-N 2.97Å; E259-N280 VanDerWaalsContact CG-O 3.29Å; E259-N280 WeakPolarHBondContact CG-O 3.24Å; E259-A282 VanDerWaalsContact OE1-CA 3.3Å; E259-A282 WeakPolarHBondContact OE1-CA 3.5Å; E259-A282 WeakPolarHBondContact OE1-CB 3.45Å; E259-A282 PolarHBondContact OE1-N 2.88Å; E259-D284 HydrophobicContact CB-CB 4.31Å; E259-D284 PolarHBondContact OE1-N 3.42Å; E259-A285 HydrophobicContact CG-CB 4.22Å; E259-A285 PolarHBondContact OE1-N 2.98Å
260	A	95.6	Very high	95.7	Very high	62 Å²	62	34.4 Å²	34.4	51%	0.512	20%	0.195	S	C	.	.	H	α-helix	trans	-67.7	-37.3	175.3	0	0	0	0	0	112.6	T258 L262 W263 S264	T258-A260 PolarHBondContact O-N 3.19Å; T258-A260 WeakPolarHBondContact OG1-CB 3.49Å; T258-A260 PolarHBondContact OG1-N 2.98Å; A260-L262 VanDerWaalsContact C-N 3.35Å; A260-W263 WeakPolarHBondContact O-CB 3.42Å; A260-W263 PolarHBondContact O-N 2.78Å; A260-S264 PolarHBondContact O-N 2.98Å
261	G	95.8	Very high	95.6	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65.5	-35.9	172.1	0	0	0	0	0	112.8	D233 T258 W263 S264 S265	D233-G261 VanDerWaalsContact OD1-CA 3.26Å; D233-G261 WeakPolarHBondContact OD1-CA 3.38Å; D233-G261 PolarHBondContact OD1-N 3Å; T258-G261 PolarHBondContact O-N 3.06Å; T258-G261 VanDerWaalsContact O-N 3.08Å; G261-W263 VanDerWaalsContact C-N 3.31Å; G261-W263 PolarHBondContact O-N 3.44Å; G261-S264 PolarHBondContact O-N 2.96Å; G261-S264 PolarHBondContact O-OG 2.81Å; G261-S265 WeakPolarHBondContact O-CB 3.28Å; G261-S265 PolarHBondContact O-N 3.33Å; G261-S265 PolarHBondContact O-OG 3.14Å
262	L	96.3	Very high	95.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.8	-38.5	170.8	-65.1	179.6	0	0	0	111.4	L236 F257 T258 E259 A260 L266 A285 A288	L236-L262 HydrophobicContact CD2-CD2 4.13Å; F257-L262 HydrophobicContact CD2-CD2 4.24Å; F257-L262 HydrophobicContact CD2-CG 4.15Å; F257-L262 HydrophobicContact CE2-CD1 4Å; F257-L262 HydrophobicContact CE2-CD2 3.86Å; F257-L262 HydrophobicContact CE2-CG 3.83Å; T258-L262 PolarHBondContact O-N 2.88Å; E259-L262 PolarHBondContact O-N 3.36Å; A260-L262 VanDerWaalsContact C-N 3.35Å; L262-L266 HydrophobicContact CB-CD1 3.99Å; L262-L266 HydrophobicContact CB-CG 4.34Å; L262-L266 HydrophobicContact CD2-CD1 4.21Å; L262-L266 HydrophobicContact CD2-CD2 4.42Å; L262-L266 HydrophobicContact CD2-CG 4.27Å; L262-L266 VanDerWaalsContact O-CB 3.25Å; L262-L266 WeakPolarHBondContact O-CB 3.33Å; L262-L266 WeakPolarHBondContact O-CG 3.35Å; L262-L266 PolarHBondContact O-N 2.75Å; L262-A285 HydrophobicContact CD1-CB 3.62Å; L262-A288 HydrophobicContact CB-CB 4.17Å
263	W	96.6	Very high	95.7	Very high	91 Å²	91	33.3 Å²	33.3	35%	0.345	19%	0.192	S	C	.	.	H	α-helix	trans	-65.3	-35.3	175.5	-83.3	111.2	0	0	0	114.4	E259 A260 G261 D284 A287 A288 Q291 L292	E259-W263 PolarHBondContact O-N 2.97Å; A260-W263 WeakPolarHBondContact O-CB 3.42Å; A260-W263 PolarHBondContact O-N 2.78Å; G261-W263 VanDerWaalsContact C-N 3.31Å; G261-W263 PolarHBondContact O-N 3.44Å; W263-D284 PolarHBondContact NE1-O 2.85Å; W263-A287 HydrophobicContact CH2-CB 4.37Å; W263-A287 HydrophobicContact CZ2-CB 3.75Å; W263-A288 HydrophobicContact CD2-CB 3.59Å; W263-A288 HydrophobicContact CE3-CB 4.09Å; W263-A288 HydrophobicContact CG-CB 3.85Å; W263-A288 HydrophobicContact CZ2-CB 4.08Å; W263-A288 VanDerWaalsContact CZ2-N 3.33Å; W263-Q291 HydrophobicContact CH2-CB 4.11Å; W263-Q291 HydrophobicContact CH2-CG 4.21Å; W263-Q291 HydrophobicContact CZ3-CB 4.07Å; W263-L292 HydrophobicContact CE3-CD1 3.92Å; W263-L292 HydrophobicContact CE3-CG 4.32Å; W263-L292 HydrophobicContact CZ3-CD1 4.46Å; W263-L292 HydrophobicContact CZ3-CG 4.39Å; W263-L292 VanDerWaalsContact O-CD1 3.3Å; W263-L292 WeakPolarHBondContact O-CD1 3.26Å
264	S	95.8	Very high	95.7	Very high	60 Å²	60	33.7 Å²	33.7	42%	0.42	19%	0.191	S	C	.	.	H	α-helix	trans	-85.5	-33.6	179.4	73.5	0	0	0	0	113.8	E237 A260 G261	E237-S264 WeakPolarHBondContact OE2-CB 3.36Å; E237-S264 PolarHBondContact OE2-OG 3.12Å; A260-S264 PolarHBondContact O-N 2.98Å; G261-S264 PolarHBondContact O-N 2.96Å; G261-S264 PolarHBondContact O-OG 2.81Å
265	S	95.9	Very high	95.8	Very high	6 Å²	6	33.8 Å²	33.8	4%	0.042	19%	0.192	C	C	.	.	H	α-helix	trans	-95.9	-32.2	-168.9	69.7	0	0	0	0	115.4	L236 L240 G261 N267	L236-S265 WeakPolarHBondContact CD2-OG 3.33Å; L236-S265 WeakPolarHBondContact CG-OG 3.27Å; L240-S265 WeakPolarHBondContact CB-O 3.37Å; L240-S265 VanDerWaalsContact CD1-O 3.3Å; L240-S265 WeakPolarHBondContact CD1-O 3.31Å; G261-S265 WeakPolarHBondContact O-CB 3.28Å; G261-S265 PolarHBondContact O-N 3.33Å; G261-S265 PolarHBondContact O-OG 3.14Å; S265-N267 PolarHBondContact O-ND2 2.84Å
266	L	96.1	Very high	95.9	Very high	9 Å²	9	31.9 Å²	31.9	5%	0.047	18%	0.183	C	C	.	.			trans	-67.3	141.8	-176	-69.4	179.7	0	0	0	111.4	L240 L262 L270 L273 I289 L292 L293	L240-L266 HydrophobicContact CD1-CD2 4.24Å; L262-L266 HydrophobicContact CB-CD1 3.99Å; L262-L266 HydrophobicContact CB-CG 4.34Å; L262-L266 HydrophobicContact CD2-CD1 4.21Å; L262-L266 HydrophobicContact CD2-CD2 4.42Å; L262-L266 HydrophobicContact CD2-CG 4.27Å; L262-L266 VanDerWaalsContact O-CB 3.25Å; L262-L266 WeakPolarHBondContact O-CB 3.33Å; L262-L266 WeakPolarHBondContact O-CG 3.35Å; L262-L266 PolarHBondContact O-N 2.75Å; L266-L270 HydrophobicContact CD2-CD1 3.79Å; L266-L273 HydrophobicContact CD1-CD2 4.49Å; L266-L273 HydrophobicContact CD2-CD2 4.37Å; L266-I289 HydrophobicContact CD1-CG1 3.81Å; L266-L292 HydrophobicContact CB-CB 3.97Å; L266-L292 HydrophobicContact CB-CD1 3.9Å; L266-L293 HydrophobicContact CB-CD2 4.04Å; L266-L293 HydrophobicContact CD1-CD1 4.37Å; L266-L293 HydrophobicContact CD1-CG 4.45Å; L266-L293 HydrophobicContact CD2-CD1 4.35Å; L266-L293 HydrophobicContact CD2-CD2 4.44Å
267	N	90.5	Very high	95.8	Very high	34 Å²	34	31.4 Å²	31.4	18%	0.182	18%	0.181	C	C	.	.			trans	-149.3	157.7	-177.4	65.8	83.3	0	0	0	112.3	S265 R269 L270 L292 L293	S265-N267 PolarHBondContact O-ND2 2.84Å; N267-R269 PolarHBondContact O-N 3.16Å; N267-R269 WeakPolarHBondContact OD1-CB 3.42Å; N267-R269 WeakPolarHBondContact OD1-CG 3.36Å; N267-R269 PolarHBondContact OD1-N 2.99Å; N267-R269 PolarHBondContact OD1-NE 3.03Å; N267-R269 PolarHBondContact OD1-NH1 3.29Å; N267-R269 VanDerWaalsContact OD1-NH1 3.11Å; N267-L270 PolarHBondContact O-N 2.95Å; N267-L292 CarbonylContact C-O 3.39Å; N267-L293 WeakPolarHBondContact O-CD2 3.16Å
268	A	92.7	Very high	95.7	Very high	46 Å²	46	31.5 Å²	31.5	38%	0.38	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	5.3	-168.6	0	0	0	0	0	117.3	L292 P294 N295	A268-L292 PolarHBondContact N-O 2.91Å; A268-P294 HydrophobicContact CB-CG 3.6Å; A268-N295 PolarHBondContact O-ND2 3.21Å; A268-N295 VanDerWaalsContact O-ND2 3.13Å
269	R	95.1	Very high	95.5	Very high	89 Å²	89	34 Å²	34	34%	0.336	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-25.2	174.5	-55.1	-171.7	-52.4	-94.7	3.8	113	L240 M243 Q244 N267	L240-R269 PolarHBondContact O-NH2 3.4Å; M243-R269 PolarHBondContact O-NH2 2.86Å; Q244-R269 WeakPolarHBondContact O-CD 3.38Å; Q244-R269 PolarHBondContact O-NE 2.95Å; N267-R269 PolarHBondContact O-N 3.16Å; N267-R269 WeakPolarHBondContact OD1-CB 3.42Å; N267-R269 WeakPolarHBondContact OD1-CG 3.36Å; N267-R269 PolarHBondContact OD1-N 2.99Å; N267-R269 PolarHBondContact OD1-NE 3.03Å; N267-R269 PolarHBondContact OD1-NH1 3.29Å; N267-R269 VanDerWaalsContact OD1-NH1 3.11Å
270	L	96.9	Very high	95.3	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	20%	0.198	C	C	.	.			trans	-72.3	131.7	179.4	-61.9	177.2	0	0	0	111	L240 L246 M247 L249 L266 N267 L293	L240-L270 HydrophobicContact CD1-CD1 4.44Å; L246-L270 HydrophobicContact CD2-CD2 4.23Å; L246-L270 HydrophobicContact CG-CD2 4.12Å; M247-L270 CarbonylContact O-C 3.58Å; M247-L270 WeakPolarHBondContact O-CA 3.2Å; L249-L270 HydrophobicContact CB-CD1 4.3Å; L249-L270 HydrophobicContact CB-CD2 4.26Å; L249-L270 HydrophobicContact CD2-CD1 4.34Å; L266-L270 HydrophobicContact CD2-CD1 3.79Å; N267-L270 PolarHBondContact O-N 2.95Å; L270-L293 HydrophobicContact CB-CD1 4.3Å; L270-L293 HydrophobicContact CB-CD2 4Å; L270-L293 HydrophobicContact CD1-CD2 4.35Å
271	T	97.4	Very high	95	Very high	38 Å²	38	32.1 Å²	32.1	23%	0.233	18%	0.175	C	C	.	.	S	Bend	trans	-117.7	-19.9	178.8	59.2	0	0	0	0	112.5	M247 H248 S297 E298	M247-T271 PolarHBondContact O-N 3.33Å; M247-T271 PolarHBondContact O-OG1 3.4Å; H248-T271 PolarHBondContact CE1-OG1 2.98Å; T271-S297 PolarHBondContact O-N 2.83Å; T271-S297 PolarHBondContact O-OG 3.36Å; T271-E298 PolarHBondContact O-N 2.62Å; T271-E298 VanDerWaalsContact O-N 3.11Å
272	S	98.3	Very high	95	Very high	14 Å²	14	33.3 Å²	33.3	10%	0.098	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	132.2	166.2	-174.3	0	0	0	0	110.1	M247 H248 L249 E298	M247-S272 PolarHBondContact O-N 2.95Å; H248-S272 WeakPolarHBondContact CA-O 3.27Å; H248-S272 WeakPolarHBondContact ND1-CB 3.2Å; L249-S272 PolarHBondContact N-O 3.49Å; L249-S272 VanDerWaalsContact N-O 3.09Å; S272-E298 WeakPolarHBondContact CA-O 3.2Å; S272-E298 WeakPolarHBondContact OG-CG 3.46Å; S272-E298 PolarHBondContact OG-OE2 2.76Å
273	L	98.3	Very high	94.9	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	126.9	173.5	177.9	62.8	0	0	0	109.4	L249 L266 V275 I289 L293 L296 E298 L299 S300	L249-L273 HydrophobicContact CB-CD1 4.01Å; L249-L273 HydrophobicContact CD2-CD1 3.96Å; L249-L273 HydrophobicContact CG-CD1 4.08Å; L249-L273 WeakPolarHBondContact O-CA 3.46Å; L266-L273 HydrophobicContact CD1-CD2 4.49Å; L266-L273 HydrophobicContact CD2-CD2 4.37Å; L273-V275 HydrophobicContact CD1-CG2 4.06Å; L273-V275 HydrophobicContact CD2-CG2 4.38Å; L273-V275 HydrophobicContact CG-CG2 4.07Å; L273-I289 HydrophobicContact CD2-CD1 3.63Å; L273-I289 HydrophobicContact CD2-CG1 3.66Å; L273-L293 HydrophobicContact CB-CD1 4.33Å; L273-L293 HydrophobicContact CD2-CD1 3.92Å; L273-L296 HydrophobicContact CB-CD1 4.12Å; L273-E298 PolarHBondContact N-O 3.42Å; L273-E298 VanDerWaalsContact N-O 3.11Å; L273-L299 HydrophobicContact CB-CD1 4.3Å; L273-L299 HydrophobicContact CD2-CD1 4.42Å; L273-L299 HydrophobicContact CG-CD1 4.45Å; L273-L299 WeakPolarHBondContact O-CA 3.22Å; L273-S300 PolarHBondContact O-N 3.34Å
274	S	98	Very high	94.9	Very high	24 Å²	24	34.2 Å²	34.2	17%	0.168	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.3	170.8	-175.9	0	0	0	0	110.2	L249 E250 L251 S300	L249-S274 PolarHBondContact O-N 2.87Å; E250-S274 CarbonylContact C-O 3.52Å; E250-S274 WeakPolarHBondContact CA-O 3.24Å; L251-S274 PolarHBondContact N-O 2.85Å; S274-S300 CarbonylContact C-O 3.53Å; S274-S300 VanDerWaalsContact CA-O 3.24Å; S274-S300 WeakPolarHBondContact CA-O 3.28Å
275	V	97.1	Very high	94.8	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.018	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	121.2	173.3	-169.3	0	0	0	0	108.9	L251 F257 L273 C278 V281 S300 L301 Q302	L251-V275 HydrophobicContact CB-CG1 4.41Å; L251-V275 CarbonylContact O-C 3.48Å; L251-V275 VanDerWaalsContact O-CA 3.3Å; L251-V275 WeakPolarHBondContact O-CA 3.16Å; F257-V275 HydrophobicContact CZ-CG1 3.95Å; L273-V275 HydrophobicContact CD1-CG2 4.06Å; L273-V275 HydrophobicContact CD2-CG2 4.38Å; L273-V275 HydrophobicContact CG-CG2 4.07Å; V275-C278 HydrophobicContact CG1-CB 3.85Å; V275-V281 HydrophobicContact CG1-CG2 3.99Å; V275-S300 PolarHBondContact N-O 2.85Å; V275-L301 HydrophobicContact CB-CD2 3.67Å; V275-L301 HydrophobicContact CG2-CD2 3.92Å; V275-L301 CarbonylContact O-C 3.58Å; V275-L301 WeakPolarHBondContact O-CA 3.48Å; V275-Q302 PolarHBondContact O-N 3.09Å
276	S	96.4	Very high	94.8	Very high	14 Å²	14	31 Å²	31	10%	0.098	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	143.2	-174	53.4	0	0	0	0	112.6	L251 S252 G253 C278	L251-S276 PolarHBondContact O-N 3.24Å; S252-S276 CarbonylContact C-O 3.55Å; S252-S276 VanDerWaalsContact CA-O 3.27Å; S252-S276 WeakPolarHBondContact CA-O 3.48Å; S252-S276 VanDerWaalsContact CB-OG 3.31Å; S252-S276 WeakPolarHBondContact CB-OG 3.42Å; S252-S276 PolarHBondContact OG-OG 2.96Å; G253-S276 PolarHBondContact N-O 3.17Å; S276-C278 PolarHBondContact O-N 3.34Å; S276-C278 PolarHBondContact O-SG 2.89Å
277	D	94.3	Very high	94.8	Very high	75 Å²	75	30.8 Å²	30.8	40%	0.401	17%	0.173	S	C	.	.	S	Bend	trans	51.1	28.4	-179.2	-72.2	-33.3	0	0	0	114.7	G253 N255 Q302 Y304	G253-D277 WeakPolarHBondContact CA-O 3.47Å; N255-D277 PolarHBondContact OD1-O 2.86Å; D277-Q302 PolarHBondContact OD1-NE2 3.09Å; D277-Y304 PolarHBondContact OD1-OH 3.01Å
278	C	93.1	Very high	95.1	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.02	17%	0.165	C	C	.	.			trans	-99.5	118.9	176.7	-60.1	0	0	0	0	109.7	C254 N255 F257 V275 S276 V281	C254-C278 PolarHBondContact O-SG 2.89Å; C254-C278 VanDerWaalsContact O-SG 3.39Å; N255-C278 WeakPolarHBondContact OD1-CA 3.37Å; F257-C278 HydrophobicContact CE1-CB 4.05Å; F257-C278 HydrophobicContact CZ-CB 4.04Å; V275-C278 HydrophobicContact CG1-CB 3.85Å; S276-C278 PolarHBondContact O-N 3.34Å; S276-C278 PolarHBondContact O-SG 2.89Å; C278-V281 HydrophobicContact CB-CG2 3.75Å
279	I	90.3	Very high	95.3	Very high	98 Å²	98	27 Å²	27	50%	0.503	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-25.5	-170.1	64.9	-177.6	0	0	0	114.7	N255 V281	N255-I279 HydrophobicContact CB-CD1 4.12Å; N255-I279 HydrophobicContact CB-CG1 4.09Å; N255-I279 WeakPolarHBondContact OD1-CG1 3.23Å; N255-I279 PolarHBondContact OD1-N 3.25Å; I279-V281 VanDerWaalsContact C-N 3.32Å; I279-V281 PolarHBondContact O-N 3.22Å
280	N	90.5	Very high	95.3	Very high	65 Å²	65	22.9 Å²	22.9	35%	0.348	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	36.1	-175.5	-58.1	-33.3	0	0	0	113	N255 F257 E259	N255-N280 PolarHBondContact O-ND2 3.14Å; F257-N280 WeakPolarHBondContact O-CB 3.09Å; F257-N280 PolarHBondContact O-ND2 3.04Å; E259-N280 VanDerWaalsContact CG-O 3.29Å; E259-N280 WeakPolarHBondContact CG-O 3.24Å
281	V	90.9	Very high	95.1	Very high	4 Å²	4	29.1 Å²	29.1	2%	0.024	16%	0.16	C	C	.	.			trans	-123.8	112.2	-174.9	-179.2	0	0	0	0	109.5	F257 V275 C278 I279 A285 A303	F257-V281 HydrophobicContact CE2-CG2 4.13Å; F257-V281 HydrophobicContact CZ-CG2 3.95Å; V275-V281 HydrophobicContact CG1-CG2 3.99Å; C278-V281 HydrophobicContact CB-CG2 3.75Å; I279-V281 VanDerWaalsContact C-N 3.32Å; I279-V281 PolarHBondContact O-N 3.22Å; V281-A285 HydrophobicContact CG1-CB 3.75Å; V281-A303 HydrophobicContact CB-CB 4.42Å; V281-A303 HydrophobicContact CG1-CB 3.99Å
282	A	93.9	Very high	95.1	Very high	25 Å²	25	29.6 Å²	29.6	21%	0.207	16%	0.161	C	C	.	.	S	Bend	trans	-133.9	-150.5	179.6	0	0	0	0	0	110.2	E259 D284 A285 H305	E259-A282 VanDerWaalsContact OE1-CA 3.3Å; E259-A282 WeakPolarHBondContact OE1-CA 3.5Å; E259-A282 WeakPolarHBondContact OE1-CB 3.45Å; E259-A282 PolarHBondContact OE1-N 2.88Å; A282-D284 PolarHBondContact O-N 2.88Å; A282-A285 WeakPolarHBondContact O-CB 3.49Å; A282-A285 PolarHBondContact O-N 2.69Å; A282-H305 HydrophobicContact CB-CB 3.8Å
283	D	95.8	Very high	95	Very high	26 Å²	26	28.9 Å²	28.9	14%	0.139	16%	0.157	C	C	.	.	H	α-helix	trans	-66	-34.3	-172.8	-70.2	2.2	0	0	0	113.2	A285 I286 A287 V306 T307 T309 A310 Y313	D283-A285 VanDerWaalsContact C-N 3.31Å; D283-A285 PolarHBondContact O-N 3.11Å; D283-I286 WeakPolarHBondContact O-CB 3.33Å; D283-I286 PolarHBondContact O-N 3.35Å; D283-I286 VanDerWaalsContact O-N 3.09Å; D283-A287 PolarHBondContact O-N 2.61Å; D283-A287 VanDerWaalsContact O-N 3.17Å; D283-V306 WeakPolarHBondContact OD1-CA 3.33Å; D283-T307 PolarHBondContact OD1-N 2.89Å; D283-T307 PolarHBondContact OD2-OG1 3.3Å; D283-T309 WeakPolarHBondContact OD2-CB 3.23Å; D283-A310 HydrophobicContact CB-CB 3.98Å; D283-A310 WeakPolarHBondContact OD1-CB 3.36Å; D283-Y313 HydrophobicContact CB-CE2 4.17Å; D283-Y313 WeakPolarHBondContact O-CD2 3.35Å; D283-Y313 WeakPolarHBondContact O-CE2 3.44Å
284	D	95.2	Very high	94.7	Very high	84 Å²	84	30 Å²	30	45%	0.449	16%	0.163	S	C	.	.	H	α-helix	trans	-70.6	-27.5	-179	-83.5	-4.6	0	0	0	111.9	E259 W263 A282 I286 A287 A288	E259-D284 HydrophobicContact CB-CB 4.31Å; E259-D284 PolarHBondContact OE1-N 3.42Å; W263-D284 PolarHBondContact NE1-O 2.85Å; A282-D284 PolarHBondContact O-N 2.88Å; D284-I286 VanDerWaalsContact C-N 3.33Å; D284-A287 WeakPolarHBondContact O-CB 3.38Å; D284-A287 PolarHBondContact O-N 2.98Å; D284-A288 PolarHBondContact O-N 3.34Å
285	A	95.3	Very high	94.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-39.7	168.2	0	0	0	0	0	112.2	E259 L262 V281 A282 D283 A287 A288 I289	E259-A285 HydrophobicContact CG-CB 4.22Å; E259-A285 PolarHBondContact OE1-N 2.98Å; L262-A285 HydrophobicContact CD1-CB 3.62Å; V281-A285 HydrophobicContact CG1-CB 3.75Å; A282-A285 WeakPolarHBondContact O-CB 3.49Å; A282-A285 PolarHBondContact O-N 2.69Å; D283-A285 VanDerWaalsContact C-N 3.31Å; D283-A285 PolarHBondContact O-N 3.11Å; A285-A287 VanDerWaalsContact C-N 3.32Å; A285-A288 PolarHBondContact O-N 2.97Å; A285-I289 WeakPolarHBondContact O-CB 3.43Å; A285-I289 WeakPolarHBondContact O-CD1 3.19Å; A285-I289 WeakPolarHBondContact O-CG1 3.34Å; A285-I289 PolarHBondContact O-N 3.3Å
286	I	95.7	Very high	94.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-67.9	-35.7	175.9	-48.8	-55.5	0	0	0	110.8	D283 D284 S290 L301 V306 A310 Y313 F314	D283-I286 WeakPolarHBondContact O-CB 3.33Å; D283-I286 PolarHBondContact O-N 3.35Å; D283-I286 VanDerWaalsContact O-N 3.09Å; D284-I286 VanDerWaalsContact C-N 3.33Å; I286-S290 VanDerWaalsContact O-CB 3.23Å; I286-S290 WeakPolarHBondContact O-CB 3.3Å; I286-S290 PolarHBondContact O-N 3.24Å; I286-S290 PolarHBondContact O-OG 2.91Å; I286-L301 HydrophobicContact CD1-CD1 3.16Å; I286-V306 HydrophobicContact CD1-CG1 4.43Å; I286-V306 HydrophobicContact CD1-CG2 4.2Å; I286-V306 HydrophobicContact CG1-CG1 4.13Å; I286-V306 HydrophobicContact CG1-CG2 4.21Å; I286-A310 HydrophobicContact CB-CB 3.89Å; I286-A310 HydrophobicContact CG1-CB 3.57Å; I286-A310 HydrophobicContact CG2-CB 4.25Å; I286-A310 WeakPolarHBondContact CG2-O 3.3Å; I286-Y313 HydrophobicContact CB-CD2 4.39Å; I286-F314 HydrophobicContact CG2-CE1 4.28Å; I286-F314 HydrophobicContact CG2-CE2 4.26Å; I286-F314 HydrophobicContact CG2-CZ 3.97Å
287	A	96.1	Very high	94.6	Very high	4 Å²	4	34 Å²	34	3%	0.033	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-45	173.2	0	0	0	0	0	111.8	W263 D283 D284 A285 S290 Q291 Y313	W263-A287 HydrophobicContact CH2-CB 4.37Å; W263-A287 HydrophobicContact CZ2-CB 3.75Å; D283-A287 PolarHBondContact O-N 2.61Å; D283-A287 VanDerWaalsContact O-N 3.17Å; D284-A287 WeakPolarHBondContact O-CB 3.38Å; D284-A287 PolarHBondContact O-N 2.98Å; A285-A287 VanDerWaalsContact C-N 3.32Å; A287-S290 PolarHBondContact O-N 2.71Å; A287-Q291 WeakPolarHBondContact O-CB 3.42Å; A287-Q291 WeakPolarHBondContact O-CG 3.38Å; A287-Q291 PolarHBondContact O-N 3.47Å; A287-Y313 HydrophobicContact CB-CD1 4.31Å; A287-Y313 HydrophobicContact CB-CD2 3.72Å; A287-Y313 HydrophobicContact CB-CE2 3.98Å; A287-Y313 HydrophobicContact CB-CG 3.92Å
288	A	96.7	Very high	94.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.7	-51.6	175.1	0	0	0	0	0	111.4	L262 W263 D284 A285 S290 Q291 L292	L262-A288 HydrophobicContact CB-CB 4.17Å; W263-A288 HydrophobicContact CD2-CB 3.59Å; W263-A288 HydrophobicContact CE3-CB 4.09Å; W263-A288 HydrophobicContact CG-CB 3.85Å; W263-A288 HydrophobicContact CZ2-CB 4.08Å; W263-A288 VanDerWaalsContact CZ2-N 3.33Å; D284-A288 PolarHBondContact O-N 3.34Å; A285-A288 PolarHBondContact O-N 2.97Å; A288-S290 VanDerWaalsContact C-N 3.34Å; A288-S290 PolarHBondContact O-N 3.44Å; A288-Q291 PolarHBondContact O-N 3.19Å; A288-L292 HydrophobicContact CB-CD1 4.49Å; A288-L292 VanDerWaalsContact O-CB 3.26Å; A288-L292 WeakPolarHBondContact O-CB 3.29Å; A288-L292 WeakPolarHBondContact O-CG 3.38Å; A288-L292 PolarHBondContact O-N 3.46Å
289	I	96.1	Very high	95.1	Very high	1 Å²	1	33 Å²	33	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-57.3	-47	178.5	-70.5	166.4	0	0	0	110.9	L266 L273 A285 Q291 L293 L296 L299 L301	L266-I289 HydrophobicContact CD1-CG1 3.81Å; L273-I289 HydrophobicContact CD2-CD1 3.63Å; L273-I289 HydrophobicContact CD2-CG1 3.66Å; A285-I289 WeakPolarHBondContact O-CB 3.43Å; A285-I289 WeakPolarHBondContact O-CD1 3.19Å; A285-I289 WeakPolarHBondContact O-CG1 3.34Å; A285-I289 PolarHBondContact O-N 3.3Å; I289-Q291 VanDerWaalsContact C-N 3.34Å; I289-Q291 PolarHBondContact O-N 3.08Å; I289-L293 HydrophobicContact CG2-CD1 4.28Å; I289-L293 VanDerWaalsContact O-CB 3.29Å; I289-L293 WeakPolarHBondContact O-CB 3.45Å; I289-L293 PolarHBondContact O-N 3.43Å; I289-L296 HydrophobicContact CG2-CD2 3.56Å; I289-L299 HydrophobicContact CD1-CD1 4.18Å; I289-L299 HydrophobicContact CG2-CD1 4.22Å; I289-L299 HydrophobicContact CG2-CD2 4.07Å; I289-L301 HydrophobicContact CD1-CD2 4.47Å
290	S	94.6	Very high	95.4	Very high	2 Å²	2	29 Å²	29	1%	0.014	16%	0.16	C	C	.	.	H	α-helix	trans	-69.6	-27.7	-177.4	-59.1	0	0	0	0	113.5	I286 A287 A288 Y313 F314 Q318	I286-S290 VanDerWaalsContact O-CB 3.23Å; I286-S290 WeakPolarHBondContact O-CB 3.3Å; I286-S290 PolarHBondContact O-N 3.24Å; I286-S290 PolarHBondContact O-OG 2.91Å; A287-S290 PolarHBondContact O-N 2.71Å; A288-S290 VanDerWaalsContact C-N 3.34Å; A288-S290 PolarHBondContact O-N 3.44Å; S290-Y313 WeakPolarHBondContact CB-O 3.37Å; S290-F314 WeakPolarHBondContact OG-CD1 3.49Å; S290-Q318 PolarHBondContact O-NE2 3.21Å; S290-Q318 PolarHBondContact O-OE1 2.83Å
291	Q	94.2	Very high	95.7	Very high	131 Å²	131	26 Å²	26	61%	0.612	14%	0.143	S	C	*	.	H	α-helix	trans	-90.7	-35.6	178.5	-67.2	-174.6	41.5	0	0	113	W263 A287 A288 I289	W263-Q291 HydrophobicContact CH2-CB 4.11Å; W263-Q291 HydrophobicContact CH2-CG 4.21Å; W263-Q291 HydrophobicContact CZ3-CB 4.07Å; A287-Q291 WeakPolarHBondContact O-CB 3.42Å; A287-Q291 WeakPolarHBondContact O-CG 3.38Å; A287-Q291 PolarHBondContact O-N 3.47Å; A288-Q291 PolarHBondContact O-N 3.19Å; I289-Q291 VanDerWaalsContact C-N 3.34Å; I289-Q291 PolarHBondContact O-N 3.08Å
292	L	96.3	Very high	95.9	Very high	48 Å²	48	27.6 Å²	27.6	25%	0.251	15%	0.15	S	C	.	.	H	α-helix	trans	-95.6	-21.5	-172.3	-59	174.7	0	0	0	114.1	W263 L266 N267 A268 A288 P294	W263-L292 HydrophobicContact CE3-CD1 3.92Å; W263-L292 HydrophobicContact CE3-CG 4.32Å; W263-L292 HydrophobicContact CZ3-CD1 4.46Å; W263-L292 HydrophobicContact CZ3-CG 4.39Å; W263-L292 VanDerWaalsContact O-CD1 3.3Å; W263-L292 WeakPolarHBondContact O-CD1 3.26Å; L266-L292 HydrophobicContact CB-CB 3.97Å; L266-L292 HydrophobicContact CB-CD1 3.9Å; N267-L292 CarbonylContact C-O 3.39Å; A268-L292 PolarHBondContact N-O 2.91Å; A288-L292 HydrophobicContact CB-CD1 4.49Å; A288-L292 VanDerWaalsContact O-CB 3.26Å; A288-L292 WeakPolarHBondContact O-CB 3.29Å; A288-L292 WeakPolarHBondContact O-CG 3.38Å; A288-L292 PolarHBondContact O-N 3.46Å; L292-P294 WeakPolarHBondContact O-CD 3.41Å
293	L	96	Very high	95.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.141	C	C	.	.			trans	-111.1	73.6	-179.4	-50.1	-171	0	0	0	111.9	L266 N267 L270 L273 I289 N295 L296 Q318	L266-L293 HydrophobicContact CB-CD2 4.04Å; L266-L293 HydrophobicContact CD1-CD1 4.37Å; L266-L293 HydrophobicContact CD1-CG 4.45Å; L266-L293 HydrophobicContact CD2-CD1 4.35Å; L266-L293 HydrophobicContact CD2-CD2 4.44Å; N267-L293 WeakPolarHBondContact O-CD2 3.16Å; L270-L293 HydrophobicContact CB-CD1 4.3Å; L270-L293 HydrophobicContact CB-CD2 4Å; L270-L293 HydrophobicContact CD1-CD2 4.35Å; L273-L293 HydrophobicContact CB-CD1 4.33Å; L273-L293 HydrophobicContact CD2-CD1 3.92Å; I289-L293 HydrophobicContact CG2-CD1 4.28Å; I289-L293 VanDerWaalsContact O-CB 3.29Å; I289-L293 WeakPolarHBondContact O-CB 3.45Å; I289-L293 PolarHBondContact O-N 3.43Å; L293-N295 VanDerWaalsContact C-N 3.26Å; L293-N295 PolarHBondContact O-N 3.41Å; L293-L296 HydrophobicContact CB-CB 4.01Å; L293-L296 HydrophobicContact CB-CD1 4.41Å; L293-L296 HydrophobicContact CB-CD2 4.4Å; L293-L296 HydrophobicContact CD1-CD1 3.91Å; L293-L296 HydrophobicContact CD1-CD2 4.42Å; L293-L296 WeakPolarHBondContact O-CB 3.48Å; L293-L296 PolarHBondContact O-N 3.5Å; L293-Q318 PolarHBondContact O-NE2 2.67Å; L293-Q318 VanDerWaalsContact O-NE2 3.12Å
294	P	93.3	Very high	95	Very high	22 Å²	22	28.2 Å²	28.2	14%	0.143	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-21	-178.6	25.8	-35.8	0	0	0	114.9	A268 L292 K317 T321	A268-P294 HydrophobicContact CB-CG 3.6Å; L292-P294 WeakPolarHBondContact O-CD 3.41Å; P294-K317 HydrophobicContact CB-CD 3.71Å; P294-T321 WeakPolarHBondContact O-CG2 3.26Å; P294-T321 PolarHBondContact O-OG1 2.77Å
295	N	94.8	Very high	94.8	Very high	78 Å²	78	29.6 Å²	29.6	42%	0.417	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.2	17.4	-175.6	-53.8	-43.2	0	0	0	112	A268 L293 S297	A268-N295 PolarHBondContact O-ND2 3.21Å; A268-N295 VanDerWaalsContact O-ND2 3.13Å; L293-N295 VanDerWaalsContact C-N 3.26Å; L293-N295 PolarHBondContact O-N 3.41Å; N295-S297 PolarHBondContact O-N 2.71Å
296	L	96.8	Very high	94.7	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	15%	0.15	C	C	.	.			trans	-62	118.7	179.2	-167.4	65	0	0	0	109.5	L273 I289 L293 E298 L299 T321 T322	L273-L296 HydrophobicContact CB-CD1 4.12Å; I289-L296 HydrophobicContact CG2-CD2 3.56Å; L293-L296 HydrophobicContact CB-CB 4.01Å; L293-L296 HydrophobicContact CB-CD1 4.41Å; L293-L296 HydrophobicContact CB-CD2 4.4Å; L293-L296 HydrophobicContact CD1-CD1 3.91Å; L293-L296 HydrophobicContact CD1-CD2 4.42Å; L293-L296 WeakPolarHBondContact O-CB 3.48Å; L293-L296 PolarHBondContact O-N 3.5Å; L296-E298 VanDerWaalsContact CD1-O 3.26Å; L296-E298 WeakPolarHBondContact CD1-O 3.47Å; L296-L299 HydrophobicContact CD2-CB 3.97Å; L296-L299 HydrophobicContact CD2-CD1 4.31Å; L296-L299 HydrophobicContact CD2-CD2 4.25Å; L296-L299 HydrophobicContact CD2-CG 4.41Å; L296-T321 CarbonylContact O-C 3.07Å; L296-T322 VanDerWaalsContact O-CA 3.27Å; L296-T322 WeakPolarHBondContact O-CA 3.25Å; L296-T322 PolarHBondContact O-N 3.04Å; L296-T322 VanDerWaalsContact O-N 3.12Å; L296-T322 PolarHBondContact O-OG1 3.18Å
297	S	97.4	Very high	94.7	Very high	47 Å²	47	31.5 Å²	31.5	33%	0.329	16%	0.162	S	C	.	.			trans	-96	-29.3	174.8	53	0	0	0	0	113.2	T271 N295 T321 H323 T324	T271-S297 PolarHBondContact O-N 2.83Å; T271-S297 PolarHBondContact O-OG 3.36Å; N295-S297 PolarHBondContact O-N 2.71Å; S297-T321 VanDerWaalsContact CA-O 3.31Å; S297-T321 WeakPolarHBondContact CA-O 3.29Å; S297-H323 PolarHBondContact O-N 2.98Å; S297-T324 PolarHBondContact O-N 3.34Å
298	E	98.3	Very high	94.7	Very high	56 Å²	56	32.8 Å²	32.8	26%	0.262	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	130.2	-176.4	176.5	173.8	-133.3	0	0	110.3	T271 S272 L273 L296 T324 R326	T271-E298 PolarHBondContact O-N 2.62Å; T271-E298 VanDerWaalsContact O-N 3.11Å; S272-E298 WeakPolarHBondContact CA-O 3.2Å; S272-E298 WeakPolarHBondContact OG-CG 3.46Å; S272-E298 PolarHBondContact OG-OE2 2.76Å; L273-E298 PolarHBondContact N-O 3.42Å; L273-E298 VanDerWaalsContact N-O 3.11Å; L296-E298 VanDerWaalsContact CD1-O 3.26Å; L296-E298 WeakPolarHBondContact CD1-O 3.47Å; E298-T324 WeakPolarHBondContact CA-O 3.29Å; E298-T324 HydrophobicContact CG-CG2 3.89Å; E298-R326 IonicContact OE1-CZ 3.4Å; E298-R326 IonicContact OE1-NH1 2.83Å; E298-R326 PolarHBondContact OE1-NH1 3.11Å; E298-R326 IonicContact OE1-NH2 3.34Å; E298-R326 PolarHBondContact OE1-NH2 3.17Å
299	L	98	Very high	94.7	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	124.3	172.4	-178.8	56.8	0	0	0	109	L273 I289 L296 L301 F314 T324 L325 R326	L273-L299 HydrophobicContact CB-CD1 4.3Å; L273-L299 HydrophobicContact CD2-CD1 4.42Å; L273-L299 HydrophobicContact CG-CD1 4.45Å; L273-L299 WeakPolarHBondContact O-CA 3.22Å; I289-L299 HydrophobicContact CD1-CD1 4.18Å; I289-L299 HydrophobicContact CG2-CD1 4.22Å; I289-L299 HydrophobicContact CG2-CD2 4.07Å; L296-L299 HydrophobicContact CD2-CB 3.97Å; L296-L299 HydrophobicContact CD2-CD1 4.31Å; L296-L299 HydrophobicContact CD2-CD2 4.25Å; L296-L299 HydrophobicContact CD2-CG 4.41Å; L299-L301 HydrophobicContact CD1-CD1 3.97Å; L299-L301 HydrophobicContact CD1-CD2 3.91Å; L299-L301 HydrophobicContact CD1-CG 3.74Å; L299-L301 HydrophobicContact CD2-CD1 3.95Å; L299-L301 HydrophobicContact CD2-CG 4.48Å; L299-L301 HydrophobicContact CG-CD1 3.97Å; L299-L301 HydrophobicContact CG-CG 3.94Å; L299-F314 HydrophobicContact CD2-CE1 3.75Å; L299-F314 HydrophobicContact CD2-CZ 3.67Å; L299-T324 PolarHBondContact N-O 3.41Å; L299-L325 HydrophobicContact CB-CD1 4.04Å; L299-L325 HydrophobicContact CD2-CD1 4.03Å; L299-L325 HydrophobicContact CG-CD1 4.12Å; L299-L325 CarbonylContact O-C 3.57Å; L299-L325 WeakPolarHBondContact O-CA 3.33Å; L299-R326 PolarHBondContact O-N 3.4Å
300	S	97.9	Very high	94.7	Very high	16 Å²	16	36.3 Å²	36.3	11%	0.112	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	119.8	174.8	-166.2	0	0	0	0	109.1	L273 S274 V275 R326	L273-S300 PolarHBondContact O-N 3.34Å; S274-S300 CarbonylContact C-O 3.53Å; S274-S300 VanDerWaalsContact CA-O 3.24Å; S274-S300 WeakPolarHBondContact CA-O 3.28Å; V275-S300 PolarHBondContact N-O 2.85Å; S300-R326 CarbonylContact C-O 3.48Å; S300-R326 WeakPolarHBondContact CA-O 3.23Å
301	L	96.2	Very high	94.7	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	130.3	-176.4	-64.6	175.8	0	0	0	110.5	V275 I286 I289 L299 R326 L327 Q328	V275-L301 HydrophobicContact CB-CD2 3.67Å; V275-L301 HydrophobicContact CG2-CD2 3.92Å; V275-L301 CarbonylContact O-C 3.58Å; V275-L301 WeakPolarHBondContact O-CA 3.48Å; I286-L301 HydrophobicContact CD1-CD1 3.16Å; I289-L301 HydrophobicContact CD1-CD2 4.47Å; L299-L301 HydrophobicContact CD1-CD1 3.97Å; L299-L301 HydrophobicContact CD1-CD2 3.91Å; L299-L301 HydrophobicContact CD1-CG 3.74Å; L299-L301 HydrophobicContact CD2-CD1 3.95Å; L299-L301 HydrophobicContact CD2-CG 4.48Å; L299-L301 HydrophobicContact CG-CD1 3.97Å; L299-L301 HydrophobicContact CG-CG 3.94Å; L301-R326 PolarHBondContact N-O 2.94Å; L301-L327 HydrophobicContact CB-CD2 4.43Å; L301-Q328 PolarHBondContact O-N 3.13Å
302	Q	94.4	Very high	94.6	Very high	37 Å²	37	32.7 Å²	32.7	17%	0.173	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	91.9	163.7	-176	-167.3	-17.6	0	0	108.1	V275 D277 Y304 Q328	V275-Q302 PolarHBondContact O-N 3.09Å; D277-Q302 PolarHBondContact OD1-NE2 3.09Å; Q302-Y304 PolarHBondContact NE2-OH 2.97Å; Q302-Q328 VanDerWaalsContact CA-O 3.23Å; Q302-Q328 WeakPolarHBondContact CA-O 3.5Å; Q302-Q328 HydrophobicContact CB-CB 4.08Å; Q302-Q328 HydrophobicContact CG-CB 4.27Å; Q302-Q328 WeakPolarHBondContact CG-O 3.46Å
303	A	84.4	Confident	94.6	Very high	2 Å²	2	34.6 Å²	34.6	2%	0.017	19%	0.186	C	C	.	.			trans	-135.9	112.1	-169.6	0	0	0	0	0	111.2	V281 H305 V306	V281-A303 HydrophobicContact CB-CB 4.42Å; V281-A303 HydrophobicContact CG1-CB 3.99Å; A303-H305 PolarHBondContact O-N 3.29Å; A303-V306 HydrophobicContact CB-CB 4.28Å; A303-V306 HydrophobicContact CB-CG2 3.53Å
304	Y	87.9	Confident	94.6	Very high	62 Å²	62	34.9 Å²	34.9	24%	0.243	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-15.7	-173.5	-50.7	-71.7	0	0	0	114	D277 Q302 W331	D277-Y304 PolarHBondContact OD1-OH 3.01Å; Q302-Y304 PolarHBondContact NE2-OH 2.97Å; Y304-W331 HydrophobicContact CD1-CD2 4.2Å; Y304-W331 HydrophobicContact CD1-CE3 4.08Å; Y304-W331 AromaticContact CD1-CH2 3.89Å; Y304-W331 HydrophobicContact CD1-CH2 3.89Å; Y304-W331 HydrophobicContact CD1-CZ2 4Å; Y304-W331 AromaticContact CD1-CZ3 3.93Å; Y304-W331 HydrophobicContact CD1-CZ3 3.93Å; Y304-W331 AromaticContact CE1-CH2 3.96Å; Y304-W331 HydrophobicContact CE1-CH2 3.96Å; Y304-W331 AromaticContact CE1-CZ2 3.9Å; Y304-W331 HydrophobicContact CE1-CZ2 3.9Å; Y304-W331 HydrophobicContact CE1-CZ3 4.46Å
305	H	90	Very high	94.5	Very high	113 Å²	113	36.6 Å²	36.6	52%	0.523	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109	4.9	-174.9	-60.2	-49.5	0	0	0	114	A282 A303	A282-H305 HydrophobicContact CB-CB 3.8Å; A303-H305 PolarHBondContact O-N 3.29Å
306	V	93.9	Very high	94.3	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	21%	0.209	C	C	.	.			trans	-82.4	125.5	176.9	172.2	0	0	0	0	110.6	D283 I286 A303 A310 M311 I333	D283-V306 WeakPolarHBondContact OD1-CA 3.33Å; I286-V306 HydrophobicContact CD1-CG1 4.43Å; I286-V306 HydrophobicContact CD1-CG2 4.2Å; I286-V306 HydrophobicContact CG1-CG1 4.13Å; I286-V306 HydrophobicContact CG1-CG2 4.21Å; A303-V306 HydrophobicContact CB-CB 4.28Å; A303-V306 HydrophobicContact CB-CG2 3.53Å; V306-A310 HydrophobicContact CG1-CB 3.74Å; V306-M311 HydrophobicContact CG1-CE 3.99Å; V306-I333 HydrophobicContact CG1-CD1 4.16Å
307	T	95.8	Very high	94	Very high	40 Å²	40	41.8 Å²	41.8	25%	0.245	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-110.1	175.2	-175	86.6	0	0	0	0	113.1	D283 T309 A310 E332	D283-T307 PolarHBondContact OD1-N 2.89Å; D283-T307 PolarHBondContact OD2-OG1 3.3Å; T307-T309 PolarHBondContact O-N 2.85Å; T307-T309 VanDerWaalsContact O-N 3.12Å; T307-T309 WeakPolarHBondContact OG1-CB 3.5Å; T307-T309 PolarHBondContact OG1-N 3.03Å; T307-T309 VanDerWaalsContact OG1-N 3.16Å; T307-T309 PolarHBondContact OG1-OG1 2.94Å; T307-T309 VanDerWaalsContact OG1-OG1 3.12Å; T307-A310 WeakPolarHBondContact O-CB 3.42Å; T307-A310 PolarHBondContact O-N 3.39Å; T307-A310 VanDerWaalsContact O-N 3.08Å; T307-E332 HydrophobicContact CG2-CB 4.19Å
308	D	96.3	Very high	93.7	Very high	30 Å²	30	39.6 Å²	39.6	16%	0.16	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-28.3	172.2	-66.5	-27.8	0	0	0	114.2	A310 I333 T334 H336 G337 N340	D308-A310 VanDerWaalsContact C-N 3.33Å; D308-I333 WeakPolarHBondContact OD1-CA 3.41Å; D308-T334 PolarHBondContact OD1-N 3.34Å; D308-T334 WeakPolarHBondContact OD2-CB 3.33Å; D308-T334 WeakPolarHBondContact OD2-CG2 3.38Å; D308-T334 PolarHBondContact OD2-OG1 3.41Å; D308-H336 HydrophobicContact CB-CB 4.36Å; D308-G337 WeakPolarHBondContact OD1-CA 3.31Å; D308-G337 PolarHBondContact OD1-N 3.18Å; D308-N340 PolarHBondContact O-ND2 3.13Å
309	T	95.6	Very high	93.4	Very high	76 Å²	76	37.1 Å²	37.1	47%	0.466	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-40.1	178.3	-43.7	0	0	0	0	111.1	D283 T307 M311 A312	D283-T309 WeakPolarHBondContact OD2-CB 3.23Å; T307-T309 PolarHBondContact O-N 2.85Å; T307-T309 VanDerWaalsContact O-N 3.12Å; T307-T309 WeakPolarHBondContact OG1-CB 3.5Å; T307-T309 PolarHBondContact OG1-N 3.03Å; T307-T309 VanDerWaalsContact OG1-N 3.16Å; T307-T309 PolarHBondContact OG1-OG1 2.94Å; T307-T309 VanDerWaalsContact OG1-OG1 3.12Å; T309-M311 VanDerWaalsContact C-N 3.26Å; T309-M311 PolarHBondContact O-N 2.91Å; T309-A312 WeakPolarHBondContact O-CB 3.41Å; T309-A312 PolarHBondContact O-N 3.43Å
310	A	95.6	Very high	93.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-63.3	-34.2	-174.7	0	0	0	0	0	112.6	D283 I286 V306 T307 D308 A312 Y313	D283-A310 HydrophobicContact CB-CB 3.98Å; D283-A310 WeakPolarHBondContact OD1-CB 3.36Å; I286-A310 HydrophobicContact CB-CB 3.89Å; I286-A310 HydrophobicContact CG1-CB 3.57Å; I286-A310 HydrophobicContact CG2-CB 4.25Å; I286-A310 WeakPolarHBondContact CG2-O 3.3Å; V306-A310 HydrophobicContact CG1-CB 3.74Å; T307-A310 WeakPolarHBondContact O-CB 3.42Å; T307-A310 PolarHBondContact O-N 3.39Å; T307-A310 VanDerWaalsContact O-N 3.08Å; D308-A310 VanDerWaalsContact C-N 3.33Å; A310-A312 PolarHBondContact O-N 2.81Å; A310-Y313 HydrophobicContact CB-CD2 4.45Å; A310-Y313 WeakPolarHBondContact O-CB 3.39Å; A310-Y313 PolarHBondContact O-N 3.08Å
311	M	95.1	Very high	93	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.005	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-64.3	-20.8	178.4	-60.8	-59.7	98.3	0	0	112.6	V306 T309 Y313 F314 L327 I333 G337 N340 M341	V306-M311 HydrophobicContact CG1-CE 3.99Å; T309-M311 VanDerWaalsContact C-N 3.26Å; T309-M311 PolarHBondContact O-N 2.91Å; M311-Y313 VanDerWaalsContact C-N 3.33Å; M311-F314 HydrophobicContact CE-CE2 3.92Å; M311-F314 HydrophobicContact SD-CE2 3.87Å; M311-L327 HydrophobicContact CE-CD1 4.39Å; M311-L327 HydrophobicContact CE-CD2 4.3Å; M311-L327 HydrophobicContact SD-CD1 3.75Å; M311-I333 HydrophobicContact CE-CD1 4.31Å; M311-I333 HydrophobicContact SD-CD1 4.41Å; M311-G337 WeakPolarHBondContact CB-O 3.23Å; M311-N340 HydrophobicContact CB-CB 3.79Å; M311-M341 HydrophobicContact CB-CB 4.43Å; M311-M341 HydrophobicContact SD-CB 4.46Å
312	A	93.6	Very high	93	Very high	56 Å²	56	46.4 Å²	46.4	46%	0.463	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-79.5	-10.7	174.3	0	0	0	0	0	113.7	T309 A310 N340	T309-A312 WeakPolarHBondContact O-CB 3.41Å; T309-A312 PolarHBondContact O-N 3.43Å; A310-A312 PolarHBondContact O-N 2.81Å; A312-N340 HydrophobicContact CB-CB 4.45Å
313	Y	95.6	Very high	93.2	Very high	87 Å²	87	48.3 Å²	48.3	34%	0.341	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-79.3	-19.8	177.3	-63.8	-46.3	0	0	0	114	D283 I286 A287 S290 A310 M311 T315	D283-Y313 HydrophobicContact CB-CE2 4.17Å; D283-Y313 WeakPolarHBondContact O-CD2 3.35Å; D283-Y313 WeakPolarHBondContact O-CE2 3.44Å; I286-Y313 HydrophobicContact CB-CD2 4.39Å; A287-Y313 HydrophobicContact CB-CD1 4.31Å; A287-Y313 HydrophobicContact CB-CD2 3.72Å; A287-Y313 HydrophobicContact CB-CE2 3.98Å; A287-Y313 HydrophobicContact CB-CG 3.92Å; S290-Y313 WeakPolarHBondContact CB-O 3.37Å; A310-Y313 HydrophobicContact CB-CD2 4.45Å; A310-Y313 WeakPolarHBondContact O-CB 3.39Å; A310-Y313 PolarHBondContact O-N 3.08Å; M311-Y313 VanDerWaalsContact C-N 3.33Å; Y313-T315 PolarHBondContact O-N 2.99Å
314	F	95.1	Very high	93.9	Very high	6 Å²	6	49.3 Å²	49.3	3%	0.026	26%	0.258	C	S	.	.			trans	-60.1	122.2	173.8	-69.7	-59.8	0	0	0	110.2	I286 S290 L299 M311 Q318 L325 S344 L345	I286-F314 HydrophobicContact CG2-CE1 4.28Å; I286-F314 HydrophobicContact CG2-CE2 4.26Å; I286-F314 HydrophobicContact CG2-CZ 3.97Å; S290-F314 WeakPolarHBondContact OG-CD1 3.49Å; L299-F314 HydrophobicContact CD2-CE1 3.75Å; L299-F314 HydrophobicContact CD2-CZ 3.67Å; M311-F314 HydrophobicContact CE-CE2 3.92Å; M311-F314 HydrophobicContact SD-CE2 3.87Å; F314-Q318 HydrophobicContact CD1-CB 4.33Å; F314-Q318 HydrophobicContact CD1-CG 4.33Å; F314-L325 HydrophobicContact CE2-CD2 4.49Å; F314-L325 HydrophobicContact CZ-CD1 4.39Å; F314-S344 PolarHBondContact O-OG 3.23Å; F314-L345 HydrophobicContact CB-CD2 4.06Å; F314-L345 HydrophobicContact CB-CG 4.32Å; F314-L345 HydrophobicContact CD1-CD1 4.44Å; F314-L345 HydrophobicContact CD1-CD2 4.35Å; F314-L345 HydrophobicContact CD2-CD1 3.83Å; F314-L345 HydrophobicContact CD2-CG 4.29Å; F314-L345 HydrophobicContact CE2-CD1 4Å; F314-L345 HydrophobicContact CG-CD1 4.07Å; F314-L345 HydrophobicContact CG-CD2 4.12Å; F314-L345 HydrophobicContact CG-CG 4.24Å; F314-L345 HydrophobicContact CZ-CD1 4.39Å
315	T	91.8	Very high	94.4	Very high	59 Å²	59	46.3 Å²	46.3	36%	0.362	25%	0.246	S	C	.	.			trans	-86.6	164.2	-177.8	86	0	0	0	0	111	Y313 K317 Q318 G319	Y313-T315 PolarHBondContact O-N 2.99Å; T315-K317 PolarHBondContact O-N 2.94Å; T315-K317 WeakPolarHBondContact OG1-CB 3.2Å; T315-K317 PolarHBondContact OG1-N 3.45Å; T315-K317 VanDerWaalsContact OG1-N 3.12Å; T315-Q318 PolarHBondContact O-N 3.07Å; T315-Q318 PolarHBondContact OG1-OE1 2.86Å; T315-G319 PolarHBondContact O-N 2.83Å
316	A	89.8	Confident	94.8	Very high	77 Å²	77	44.7 Å²	44.7	64%	0.636	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	-21.4	171.8	0	0	0	0	0	113.7	G319 Y320	A316-G319 PolarHBondContact O-N 3.15Å; A316-Y320 WeakPolarHBondContact O-CD2 3.01Å; A316-Y320 WeakPolarHBondContact O-CE2 3.23Å
317	K	90.8	Very high	94.9	Very high	110 Å²	110	44.7 Å²	44.7	48%	0.478	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-46.6	174.3	-168	171.9	-176	176.8	0	112.1	P294 T315 G319 Y320 T321	P294-K317 HydrophobicContact CB-CD 3.71Å; T315-K317 PolarHBondContact O-N 2.94Å; T315-K317 WeakPolarHBondContact OG1-CB 3.2Å; T315-K317 PolarHBondContact OG1-N 3.45Å; T315-K317 VanDerWaalsContact OG1-N 3.12Å; K317-G319 PolarHBondContact O-N 2.93Å; K317-Y320 PolarHBondContact O-N 2.7Å; K317-T321 PolarHBondContact O-N 2.91Å; K317-T321 PolarHBondContact O-OG1 3.29Å
318	Q	91	Very high	94.9	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.009	24%	0.237	C	C	.	.	H	α-helix	trans	-59.8	-31.2	172.1	-77.7	76.3	21.5	0	0	111.5	S290 L293 F314 T315 Y320 T321 T322 L345	S290-Q318 PolarHBondContact O-NE2 3.21Å; S290-Q318 PolarHBondContact O-OE1 2.83Å; L293-Q318 PolarHBondContact O-NE2 2.67Å; L293-Q318 VanDerWaalsContact O-NE2 3.12Å; F314-Q318 HydrophobicContact CD1-CB 4.33Å; F314-Q318 HydrophobicContact CD1-CG 4.33Å; T315-Q318 PolarHBondContact O-N 3.07Å; T315-Q318 PolarHBondContact OG1-OE1 2.86Å; Q318-Y320 PolarHBondContact O-N 3.31Å; Q318-T321 WeakPolarHBondContact CA-OG1 3.25Å; Q318-T321 PolarHBondContact O-N 3.29Å; Q318-T321 VanDerWaalsContact O-N 3.12Å; Q318-T322 WeakPolarHBondContact O-CB 3.15Å; Q318-T322 PolarHBondContact O-N 3.3Å; Q318-T322 PolarHBondContact O-OG1 2.71Å; Q318-L345 HydrophobicContact CB-CD2 3.86Å
319	G	91.6	Very high	94.8	Very high	4 Å²	4	45.8 Å²	45.8	4%	0.041	24%	0.24	C	C	.	.	H	α-helix	trans	-56	-20.2	172.1	0	0	0	0	0	115.5	T315 A316 K317 S344 N347	T315-G319 PolarHBondContact O-N 2.83Å; A316-G319 PolarHBondContact O-N 3.15Å; K317-G319 PolarHBondContact O-N 2.93Å; G319-S344 WeakPolarHBondContact CA-O 3.2Å; G319-S344 PolarHBondContact N-O 2.88Å; G319-N347 WeakPolarHBondContact O-CB 3.3Å; G319-N347 PolarHBondContact O-ND2 2.58Å
320	Y	93.1	Very high	94.8	Very high	176 Å²	176	42.1 Å²	42.1	69%	0.69	22%	0.218	S	C	*	.	H	α-helix	trans	-106.3	-21.9	173.6	-58.9	-76.3	0	0	0	114.2	A316 K317 Q318 H323	A316-Y320 WeakPolarHBondContact O-CD2 3.01Å; A316-Y320 WeakPolarHBondContact O-CE2 3.23Å; K317-Y320 PolarHBondContact O-N 2.7Å; Q318-Y320 PolarHBondContact O-N 3.31Å; Y320-H323 PolarHBondContact O-CE1 2.8Å
321	T	95.4	Very high	94.6	Very high	35 Å²	35	48 Å²	48	22%	0.215	24%	0.24	C	C	.	.	H	α-helix	trans	-100.9	-37	-174.3	49.8	0	0	0	0	113.2	P294 L296 S297 K317 Q318 H323	P294-T321 WeakPolarHBondContact O-CG2 3.26Å; P294-T321 PolarHBondContact O-OG1 2.77Å; L296-T321 CarbonylContact O-C 3.07Å; S297-T321 VanDerWaalsContact CA-O 3.31Å; S297-T321 WeakPolarHBondContact CA-O 3.29Å; K317-T321 PolarHBondContact O-N 2.91Å; K317-T321 PolarHBondContact O-OG1 3.29Å; Q318-T321 WeakPolarHBondContact CA-OG1 3.25Å; Q318-T321 PolarHBondContact O-N 3.29Å; Q318-T321 VanDerWaalsContact O-N 3.12Å; T321-H323 PolarHBondContact O-CE1 2.78Å; T321-H323 PolarHBondContact O-N 2.69Å; T321-H323 PolarHBondContact O-ND1 3.11Å
322	T	97.1	Very high	94.7	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.259	C	S	.	.			trans	-78.5	117.6	179.5	-51.3	0	0	0	0	110.7	L296 Q318 L348	L296-T322 VanDerWaalsContact O-CA 3.27Å; L296-T322 WeakPolarHBondContact O-CA 3.25Å; L296-T322 PolarHBondContact O-N 3.04Å; L296-T322 VanDerWaalsContact O-N 3.12Å; L296-T322 PolarHBondContact O-OG1 3.18Å; Q318-T322 WeakPolarHBondContact O-CB 3.15Å; Q318-T322 PolarHBondContact O-N 3.3Å; Q318-T322 PolarHBondContact O-OG1 2.71Å; T322-L348 HydrophobicContact CG2-CD2 4.17Å
323	H	97.7	Very high	94.8	Very high	78 Å²	78	49.5 Å²	49.5	36%	0.361	24%	0.238	S	C	.	.			trans	-111.4	-23.7	179.2	-67.3	77.5	0	0	0	112.4	S297 Y320 T321 T349 A350	S297-H323 PolarHBondContact O-N 2.98Å; Y320-H323 PolarHBondContact O-CE1 2.8Å; T321-H323 PolarHBondContact O-CE1 2.78Å; T321-H323 PolarHBondContact O-N 2.69Å; T321-H323 PolarHBondContact O-ND1 3.11Å; H323-T349 PolarHBondContact O-N 2.93Å; H323-T349 PolarHBondContact O-OG1 3.18Å; H323-T349 VanDerWaalsContact O-OG1 3.09Å; H323-A350 PolarHBondContact O-N 3.46Å; H323-A350 VanDerWaalsContact O-N 3.09Å
324	T	98.6	Very high	94.9	Very high	22 Å²	22	46.9 Å²	46.9	14%	0.135	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	123.4	179	-60.9	0	0	0	0	109.9	S297 E298 L299 R326 A350	S297-T324 PolarHBondContact O-N 3.34Å; E298-T324 WeakPolarHBondContact CA-O 3.29Å; E298-T324 HydrophobicContact CG-CG2 3.89Å; L299-T324 PolarHBondContact N-O 3.41Å; T324-R326 HydrophobicContact CG2-CG 4.32Å; T324-A350 WeakPolarHBondContact CA-O 3.4Å; T324-A350 HydrophobicContact CG2-CB 4.02Å
325	L	98.4	Very high	95	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.7	172.5	178.3	60.8	0	0	0	109.4	L299 F314 L327 M341 L345 L348 A350 L351 S352	L299-L325 HydrophobicContact CB-CD1 4.04Å; L299-L325 HydrophobicContact CD2-CD1 4.03Å; L299-L325 HydrophobicContact CG-CD1 4.12Å; L299-L325 CarbonylContact O-C 3.57Å; L299-L325 WeakPolarHBondContact O-CA 3.33Å; F314-L325 HydrophobicContact CE2-CD2 4.49Å; F314-L325 HydrophobicContact CZ-CD1 4.39Å; L325-L327 HydrophobicContact CD1-CD2 4.02Å; L325-L327 HydrophobicContact CD1-CG 4.09Å; L325-L327 HydrophobicContact CD2-CD1 4.03Å; L325-L327 HydrophobicContact CD2-CG 4.34Å; L325-L327 HydrophobicContact CG-CD1 4.26Å; L325-L327 HydrophobicContact CG-CD2 4.5Å; L325-L327 HydrophobicContact CG-CG 4.03Å; L325-M341 HydrophobicContact CD2-CG 3.89Å; L325-M341 HydrophobicContact CD2-SD 3.72Å; L325-L345 HydrophobicContact CD2-CD1 3.65Å; L325-L348 HydrophobicContact CB-CD1 4.23Å; L325-L348 HydrophobicContact CB-CD2 3.77Å; L325-L348 HydrophobicContact CD2-CD1 4.41Å; L325-A350 PolarHBondContact N-O 3.03Å; L325-L351 HydrophobicContact CB-CD1 4.43Å; L325-L351 HydrophobicContact CG-CD1 4.49Å; L325-L351 CarbonylContact O-C 3.59Å; L325-L351 VanDerWaalsContact O-CA 3.28Å; L325-L351 WeakPolarHBondContact O-CA 3.48Å; L325-S352 PolarHBondContact O-N 3.26Å
326	R	98.4	Very high	95.3	Very high	78 Å²	78	51.6 Å²	51.6	29%	0.294	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.5	172.6	-55.9	-168.2	-167.9	82.7	-0	109.2	E298 L299 S300 L301 T324	E298-R326 IonicContact OE1-CZ 3.4Å; E298-R326 IonicContact OE1-NH1 2.83Å; E298-R326 PolarHBondContact OE1-NH1 3.11Å; E298-R326 IonicContact OE1-NH2 3.34Å; E298-R326 PolarHBondContact OE1-NH2 3.17Å; L299-R326 PolarHBondContact O-N 3.4Å; S300-R326 CarbonylContact C-O 3.48Å; S300-R326 WeakPolarHBondContact CA-O 3.23Å; L301-R326 PolarHBondContact N-O 2.94Å; T324-R326 HydrophobicContact CG2-CG 4.32Å
327	L	96.8	Very high	95.7	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	94.7	177.9	-63.1	171.9	0	0	0	106.6	L301 M311 L325 C330 I333 M341 S352 L353 C356	L301-L327 HydrophobicContact CB-CD2 4.43Å; M311-L327 HydrophobicContact CE-CD1 4.39Å; M311-L327 HydrophobicContact CE-CD2 4.3Å; M311-L327 HydrophobicContact SD-CD1 3.75Å; L325-L327 HydrophobicContact CD1-CD2 4.02Å; L325-L327 HydrophobicContact CD1-CG 4.09Å; L325-L327 HydrophobicContact CD2-CD1 4.03Å; L325-L327 HydrophobicContact CD2-CG 4.34Å; L325-L327 HydrophobicContact CG-CD1 4.26Å; L325-L327 HydrophobicContact CG-CD2 4.5Å; L325-L327 HydrophobicContact CG-CG 4.03Å; L327-C330 HydrophobicContact CB-CB 4.45Å; L327-I333 HydrophobicContact CB-CD1 4.49Å; L327-I333 HydrophobicContact CD1-CD1 3.84Å; L327-I333 HydrophobicContact CD2-CD1 4.42Å; L327-I333 HydrophobicContact CG-CD1 4.48Å; L327-M341 HydrophobicContact CD1-SD 4.35Å; L327-S352 PolarHBondContact N-O 2.88Å; L327-L353 HydrophobicContact CB-CD2 4.29Å; L327-L353 HydrophobicContact CD1-CD2 4.03Å; L327-L353 CarbonylContact O-C 3.59Å; L327-L353 WeakPolarHBondContact O-CA 3.37Å; L327-C356 PolarHBondContact O-SG 3.2Å
328	Q	95.1	Very high	96	Very high	60 Å²	60	42.7 Å²	42.7	28%	0.28	20%	0.196	S	C	.	.			trans	-99.8	126	-172.9	-67.8	179.4	-19.5	0	0	109.9	L301 Q302 C330 S354	L301-Q328 PolarHBondContact O-N 3.13Å; Q302-Q328 VanDerWaalsContact CA-O 3.23Å; Q302-Q328 WeakPolarHBondContact CA-O 3.5Å; Q302-Q328 HydrophobicContact CB-CB 4.08Å; Q302-Q328 HydrophobicContact CG-CB 4.27Å; Q302-Q328 WeakPolarHBondContact CG-O 3.46Å; Q328-C330 PolarHBondContact O-N 2.83Å; Q328-C330 VanDerWaalsContact O-N 3.07Å; Q328-S354 CarbonylContact C-O 3.41Å; Q328-S354 VanDerWaalsContact CA-O 3.31Å; Q328-S354 WeakPolarHBondContact CA-O 3.33Å
329	S	94.9	Very high	96.3	Very high	33 Å²	33	45 Å²	45	23%	0.231	21%	0.21	C	C	.	.	S	Bend	trans	52.4	29.2	-179	-61.7	0	0	0	0	114.5	W331 S354	S329-W331 PolarHBondContact O-N 3.43Å; S329-W331 PolarHBondContact O-NE1 2.76Å; S329-S354 PolarHBondContact N-O 3.23Å
330	C	94.4	Very high	96.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.223	C	C	.	.			trans	-76.8	74.7	173.9	-60	0	0	0	0	109.5	L327 Q328 E332 I333	L327-C330 HydrophobicContact CB-CB 4.45Å; Q328-C330 PolarHBondContact O-N 2.83Å; Q328-C330 VanDerWaalsContact O-N 3.07Å; C330-E332 PolarHBondContact O-N 3.07Å; C330-E332 VanDerWaalsContact O-N 3.12Å; C330-I333 HydrophobicContact CB-CB 4.48Å; C330-I333 HydrophobicContact CB-CD1 3.49Å; C330-I333 VanDerWaalsContact CB-CD1 3.49Å; C330-I333 HydrophobicContact CB-CG1 3.81Å; C330-I333 PolarHBondContact O-N 2.8Å; C330-I333 VanDerWaalsContact O-N 3.1Å
331	W	93.3	Very high	96.7	Very high	124 Å²	124	39.2 Å²	39.2	47%	0.47	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-19.5	-168.5	-58.4	-24	0	0	0	114.8	Y304 S329 G355 K358	Y304-W331 HydrophobicContact CD1-CD2 4.2Å; Y304-W331 HydrophobicContact CD1-CE3 4.08Å; Y304-W331 AromaticContact CD1-CH2 3.89Å; Y304-W331 HydrophobicContact CD1-CH2 3.89Å; Y304-W331 HydrophobicContact CD1-CZ2 4Å; Y304-W331 AromaticContact CD1-CZ3 3.93Å; Y304-W331 HydrophobicContact CD1-CZ3 3.93Å; Y304-W331 AromaticContact CE1-CH2 3.96Å; Y304-W331 HydrophobicContact CE1-CH2 3.96Å; Y304-W331 AromaticContact CE1-CZ2 3.9Å; Y304-W331 HydrophobicContact CE1-CZ2 3.9Å; Y304-W331 HydrophobicContact CE1-CZ3 4.46Å; S329-W331 PolarHBondContact O-N 3.43Å; S329-W331 PolarHBondContact O-NE1 2.76Å; W331-G355 VanDerWaalsContact CD1-O 3.23Å; W331-K358 WeakPolarHBondContact O-CD 3.38Å; W331-K358 WeakPolarHBondContact O-CE 3.26Å; W331-K358 WeakPolarHBondContact O-CG 3.47Å; W331-K358 PolarHBondContact O-NZ 3.13Å
332	E	95.4	Very high	96.7	Very high	86 Å²	86	37.8 Å²	37.8	40%	0.402	18%	0.181	S	C	.	.	B	Isolated β-bridge	trans	-89.9	-3.2	178.3	-66.4	-55.6	122.9	0	0	114.3	T307 C330 K358	T307-E332 HydrophobicContact CG2-CB 4.19Å; C330-E332 PolarHBondContact O-N 3.07Å; C330-E332 VanDerWaalsContact O-N 3.12Å; E332-K358 IonicContact OE1-NZ 3.96Å; E332-K358 PolarHBondContact OE1-NZ 2.82Å; E332-K358 IonicContact OE2-NZ 3.19Å; E332-K358 PolarHBondContact OE2-NZ 3.37Å
333	I	96.4	Very high	96.6	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	21%	0.211	C	C	.	.			trans	-82.4	128.8	174.1	-56.8	-176.3	0	0	0	110.5	V306 D308 M311 L327 C330 I359	V306-I333 HydrophobicContact CG1-CD1 4.16Å; D308-I333 WeakPolarHBondContact OD1-CA 3.41Å; M311-I333 HydrophobicContact CE-CD1 4.31Å; M311-I333 HydrophobicContact SD-CD1 4.41Å; L327-I333 HydrophobicContact CB-CD1 4.49Å; L327-I333 HydrophobicContact CD1-CD1 3.84Å; L327-I333 HydrophobicContact CD2-CD1 4.42Å; L327-I333 HydrophobicContact CG-CD1 4.48Å; C330-I333 HydrophobicContact CB-CB 4.48Å; C330-I333 HydrophobicContact CB-CD1 3.49Å; C330-I333 VanDerWaalsContact CB-CD1 3.49Å; C330-I333 HydrophobicContact CB-CG1 3.81Å; C330-I333 PolarHBondContact O-N 2.8Å; C330-I333 VanDerWaalsContact O-N 3.1Å; I333-I359 HydrophobicContact CG2-CD1 4.28Å
334	T	97.8	Very high	96.4	Very high	31 Å²	31	41.7 Å²	41.7	19%	0.19	20%	0.202	C	C	.	.			trans	-116.7	-178.6	176.5	85.4	0	0	0	0	110.9	D308 H336 G337 V338 K358 I359	D308-T334 PolarHBondContact OD1-N 3.34Å; D308-T334 WeakPolarHBondContact OD2-CB 3.33Å; D308-T334 WeakPolarHBondContact OD2-CG2 3.38Å; D308-T334 PolarHBondContact OD2-OG1 3.41Å; T334-H336 PolarHBondContact O-N 2.9Å; T334-H336 VanDerWaalsContact O-N 3.1Å; T334-H336 PolarHBondContact OG1-N 3.26Å; T334-H336 PolarHBondContact OG1-ND1 2.88Å; T334-H336 VanDerWaalsContact OG1-ND1 3.16Å; T334-G337 PolarHBondContact O-N 3.04Å; T334-V338 PolarHBondContact O-N 3.41Å; T334-K358 HydrophobicContact CG2-CB 4.11Å; T334-K358 HydrophobicContact CG2-CD 3.97Å; T334-I359 VanDerWaalsContact C-CD1 3.46Å
335	N	98.1	Very high	96.3	Very high	28 Å²	28	40.6 Å²	40.6	15%	0.15	20%	0.196	C	C	.	.	H	α-helix	trans	-56.6	-24.9	174.3	-57.1	-4.7	0	0	0	112.4	V338 V339 T360 D362 G363	N335-V338 WeakPolarHBondContact O-CB 3.31Å; N335-V338 PolarHBondContact O-N 2.78Å; N335-V339 WeakPolarHBondContact O-CG2 3.38Å; N335-V339 PolarHBondContact O-N 3.28Å; N335-T360 PolarHBondContact ND2-OG1 2.62Å; N335-T360 PolarHBondContact OD1-N 3.01Å; N335-T360 VanDerWaalsContact OD1-N 3.15Å; N335-D362 PolarHBondContact ND2-OD2 3.21Å; N335-G363 PolarHBondContact ND2-N 2.92Å
336	H	97.7	Very high	96.2	Very high	136 Å²	136	43.3 Å²	43.3	63%	0.63	21%	0.214	S	C	*	.	H	α-helix	trans	-68.1	-38.7	175.2	-59.5	88.4	0	0	0	112.4	D308 T334 V338 V339 N340	D308-H336 HydrophobicContact CB-CB 4.36Å; T334-H336 PolarHBondContact O-N 2.9Å; T334-H336 VanDerWaalsContact O-N 3.1Å; T334-H336 PolarHBondContact OG1-N 3.26Å; T334-H336 PolarHBondContact OG1-ND1 2.88Å; T334-H336 VanDerWaalsContact OG1-ND1 3.16Å; H336-V338 VanDerWaalsContact C-N 3.3Å; H336-V339 WeakPolarHBondContact O-CB 3.11Å; H336-V339 PolarHBondContact O-N 3.38Å; H336-N340 PolarHBondContact O-N 2.69Å; H336-N340 VanDerWaalsContact O-N 3.14Å
337	G	97.3	Very high	96.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.8	-35.8	172.3	0	0	0	0	0	111.5	D308 M311 T334 N340 M341	D308-G337 WeakPolarHBondContact OD1-CA 3.31Å; D308-G337 PolarHBondContact OD1-N 3.18Å; M311-G337 WeakPolarHBondContact CB-O 3.23Å; T334-G337 PolarHBondContact O-N 3.04Å; G337-N340 PolarHBondContact O-N 3.33Å; G337-M341 WeakPolarHBondContact O-CB 3.44Å; G337-M341 PolarHBondContact O-N 3.07Å
338	V	97.9	Very high	96.1	Very high	1 Å²	1	41 Å²	41	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-62.4	-43.6	171.4	175.5	0	0	0	0	111.6	T334 N335 H336 N340 M341 V342 L353 I359 G363 L366 V367	T334-V338 PolarHBondContact O-N 3.41Å; N335-V338 WeakPolarHBondContact O-CB 3.31Å; N335-V338 PolarHBondContact O-N 2.78Å; H336-V338 VanDerWaalsContact C-N 3.3Å; V338-N340 VanDerWaalsContact C-N 3.33Å; V338-N340 PolarHBondContact O-N 2.9Å; V338-M341 HydrophobicContact CG1-CE 4.09Å; V338-M341 PolarHBondContact O-N 3.14Å; V338-V342 HydrophobicContact CG1-CG1 4.14Å; V338-V342 WeakPolarHBondContact O-CG1 3.4Å; V338-V342 WeakPolarHBondContact O-CG2 3.2Å; V338-V342 PolarHBondContact O-N 3.03Å; V338-L353 HydrophobicContact CG2-CD1 4.28Å; V338-I359 HydrophobicContact CG2-CD1 3.6Å; V338-G363 WeakPolarHBondContact CG1-O 3.38Å; V338-L366 HydrophobicContact CG1-CB 4.14Å; V338-V367 HydrophobicContact CG1-CG2 3.73Å
339	V	97.7	Very high	96.3	Very high	50 Å²	50	40.2 Å²	40.2	30%	0.303	21%	0.206	S	C	.	.	H	α-helix	trans	-54	-49.7	172.7	173.5	0	0	0	0	110.6	N335 H336 M341 V342 H343 L366	N335-V339 WeakPolarHBondContact O-CG2 3.38Å; N335-V339 PolarHBondContact O-N 3.28Å; H336-V339 WeakPolarHBondContact O-CB 3.11Å; H336-V339 PolarHBondContact O-N 3.38Å; V339-M341 PolarHBondContact O-N 3.01Å; V339-V342 WeakPolarHBondContact O-CG2 3.3Å; V339-H343 PolarHBondContact O-N 2.68Å; V339-H343 PolarHBondContact O-ND1 3.05Å; V339-L366 HydrophobicContact CG2-CD1 3.49Å; V339-L366 VanDerWaalsContact CG2-CD1 3.49Å; V339-L366 HydrophobicContact CG2-CD2 4.27Å
340	N	96	Very high	96.5	Very high	57 Å²	57	39.3 Å²	39.3	31%	0.305	20%	0.201	S	C	.	.	H	α-helix	trans	-61.1	-45.8	178.4	-68.1	-24.3	0	0	0	111.6	D308 M311 A312 H336 G337 V338 H343 S344	D308-N340 PolarHBondContact O-ND2 3.13Å; M311-N340 HydrophobicContact CB-CB 3.79Å; A312-N340 HydrophobicContact CB-CB 4.45Å; H336-N340 PolarHBondContact O-N 2.69Å; H336-N340 VanDerWaalsContact O-N 3.14Å; G337-N340 PolarHBondContact O-N 3.33Å; V338-N340 VanDerWaalsContact C-N 3.33Å; V338-N340 PolarHBondContact O-N 2.9Å; N340-H343 PolarHBondContact O-N 2.94Å; N340-S344 PolarHBondContact O-N 2.96Å; N340-S344 PolarHBondContact O-OG 3.13Å
341	M	96.3	Very high	96.7	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-60	-48	-179.5	179.2	-168.1	72.6	0	0	112.7	M311 L325 L327 G337 V338 V339 H343 S344 L345 L351 L353 V367 L371	M311-M341 HydrophobicContact CB-CB 4.43Å; M311-M341 HydrophobicContact SD-CB 4.46Å; L325-M341 HydrophobicContact CD2-CG 3.89Å; L325-M341 HydrophobicContact CD2-SD 3.72Å; L327-M341 HydrophobicContact CD1-SD 4.35Å; G337-M341 WeakPolarHBondContact O-CB 3.44Å; G337-M341 PolarHBondContact O-N 3.07Å; V338-M341 HydrophobicContact CG1-CE 4.09Å; V338-M341 PolarHBondContact O-N 3.14Å; V339-M341 PolarHBondContact O-N 3.01Å; M341-H343 VanDerWaalsContact C-N 3.31Å; M341-H343 PolarHBondContact O-N 2.96Å; M341-S344 PolarHBondContact O-N 3.02Å; M341-L345 HydrophobicContact CG-CD1 4.36Å; M341-L345 WeakPolarHBondContact O-CB 3.25Å; M341-L345 PolarHBondContact O-N 2.93Å; M341-L351 HydrophobicContact CE-CD1 4.08Å; M341-L351 HydrophobicContact CE-CD2 3.7Å; M341-L351 HydrophobicContact SD-CD1 3.77Å; M341-L351 HydrophobicContact SD-CD2 4.49Å; M341-L353 HydrophobicContact SD-CD2 4.46Å; M341-V367 HydrophobicContact CE-CG2 4.08Å; M341-L371 HydrophobicContact CE-CD1 4.45Å
342	V	96.6	Very high	97	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.024	18%	0.18	C	C	.	.	H	α-helix	trans	-68.5	-30.2	-176.6	-59.9	0	0	0	0	112.8	V338 V339 V367 N370 L371	V338-V342 HydrophobicContact CG1-CG1 4.14Å; V338-V342 WeakPolarHBondContact O-CG1 3.4Å; V338-V342 WeakPolarHBondContact O-CG2 3.2Å; V338-V342 PolarHBondContact O-N 3.03Å; V339-V342 WeakPolarHBondContact O-CG2 3.3Å; V342-V367 HydrophobicContact CG1-CG2 4.31Å; V342-N370 HydrophobicContact CB-CB 3.86Å; V342-N370 HydrophobicContact CG1-CB 4.42Å; V342-N370 HydrophobicContact CG2-CB 4.12Å; V342-L371 HydrophobicContact CB-CD2 4.33Å; V342-L371 HydrophobicContact CB-CG 4.46Å; V342-L371 HydrophobicContact CG1-CD1 4.05Å; V342-L371 HydrophobicContact CG1-CD2 4.34Å; V342-L371 HydrophobicContact CG1-CG 3.98Å
343	H	93.8	Very high	97.1	Very high	133 Å²	133	29.6 Å²	29.6	62%	0.616	16%	0.161	S	C	*	.	H	α-helix	trans	-73.1	-41.7	173.6	-73.4	94.3	0	0	0	112.3	V339 N340 M341	V339-H343 PolarHBondContact O-N 2.68Å; V339-H343 PolarHBondContact O-ND1 3.05Å; N340-H343 PolarHBondContact O-N 2.94Å; M341-H343 VanDerWaalsContact C-N 3.31Å; M341-H343 PolarHBondContact O-N 2.96Å
344	S	94.6	Very high	97.2	Very high	27 Å²	27	30.4 Å²	30.4	19%	0.189	17%	0.167	C	C	.	.	H	α-helix	trans	-79.1	-29.6	-178	-66.9	0	0	0	0	113.6	F314 G319 N340 M341 P346	F314-S344 PolarHBondContact O-OG 3.23Å; G319-S344 WeakPolarHBondContact CA-O 3.2Å; G319-S344 PolarHBondContact N-O 2.88Å; N340-S344 PolarHBondContact O-N 2.96Å; N340-S344 PolarHBondContact O-OG 3.13Å; M341-S344 PolarHBondContact O-N 3.02Å; S344-P346 WeakPolarHBondContact O-CD 3.46Å
345	L	96.4	Very high	97.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.161	C	C	.	.			trans	-124.6	56.7	-173.3	-54.9	178.4	0	0	0	113.3	F314 Q318 L325 M341 N347 L348 L371	F314-L345 HydrophobicContact CB-CD2 4.06Å; F314-L345 HydrophobicContact CB-CG 4.32Å; F314-L345 HydrophobicContact CD1-CD1 4.44Å; F314-L345 HydrophobicContact CD1-CD2 4.35Å; F314-L345 HydrophobicContact CD2-CD1 3.83Å; F314-L345 HydrophobicContact CD2-CG 4.29Å; F314-L345 HydrophobicContact CE2-CD1 4Å; F314-L345 HydrophobicContact CG-CD1 4.07Å; F314-L345 HydrophobicContact CG-CD2 4.12Å; F314-L345 HydrophobicContact CG-CG 4.24Å; F314-L345 HydrophobicContact CZ-CD1 4.39Å; Q318-L345 HydrophobicContact CB-CD2 3.86Å; L325-L345 HydrophobicContact CD2-CD1 3.65Å; M341-L345 HydrophobicContact CG-CD1 4.36Å; M341-L345 WeakPolarHBondContact O-CB 3.25Å; M341-L345 PolarHBondContact O-N 2.93Å; L345-N347 PolarHBondContact O-N 2.74Å; L345-L348 HydrophobicContact CB-CD1 3.88Å; L345-L348 HydrophobicContact CB-CD2 4.48Å; L345-L348 HydrophobicContact CB-CG 3.91Å; L345-L348 HydrophobicContact CD1-CD1 4.34Å; L345-L348 WeakPolarHBondContact O-CG 3.48Å; L345-L348 PolarHBondContact O-N 2.97Å; L345-L371 WeakPolarHBondContact O-CD2 3.18Å
346	P	95.8	Very high	97.1	Very high	57 Å²	57	27.9 Å²	27.9	37%	0.37	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-4.1	-173.1	31.7	-38.8	0	0	0	114.9	S344	S344-P346 WeakPolarHBondContact O-CD 3.46Å
347	N	95.6	Very high	96.9	Very high	31 Å²	31	23.4 Å²	23.4	17%	0.166	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	10.4	-177.4	-68.7	-59.7	0	0	0	114.1	G319 L345 T349 K373	G319-N347 WeakPolarHBondContact O-CB 3.3Å; G319-N347 PolarHBondContact O-ND2 2.58Å; L345-N347 PolarHBondContact O-N 2.74Å; N347-T349 PolarHBondContact O-N 2.88Å; N347-K373 PolarHBondContact OD1-NZ 2.85Å
348	L	98.2	Very high	96.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.15	C	C	.	.			trans	-55.8	132.3	177.1	-72.1	172.6	0	0	0	112	T322 L325 L345 L351 L371 L374	T322-L348 HydrophobicContact CG2-CD2 4.17Å; L325-L348 HydrophobicContact CB-CD1 4.23Å; L325-L348 HydrophobicContact CB-CD2 3.77Å; L325-L348 HydrophobicContact CD2-CD1 4.41Å; L345-L348 HydrophobicContact CB-CD1 3.88Å; L345-L348 HydrophobicContact CB-CD2 4.48Å; L345-L348 HydrophobicContact CB-CG 3.91Å; L345-L348 HydrophobicContact CD1-CD1 4.34Å; L345-L348 WeakPolarHBondContact O-CG 3.48Å; L345-L348 PolarHBondContact O-N 2.97Å; L348-L351 HydrophobicContact CD1-CD1 4.48Å; L348-L371 HydrophobicContact CB-CD1 4.3Å; L348-L371 HydrophobicContact CD1-CD1 3.99Å; L348-L374 HydrophobicContact CB-CD1 4.31Å
349	T	98.5	Very high	96.9	Very high	43 Å²	43	26.2 Å²	26.2	26%	0.264	15%	0.15	S	C	.	.	S	Bend	trans	-108.3	-21.3	172.8	53.3	0	0	0	0	112.2	H323 N347 R375 S376	H323-T349 PolarHBondContact O-N 2.93Å; H323-T349 PolarHBondContact O-OG1 3.18Å; H323-T349 VanDerWaalsContact O-OG1 3.09Å; N347-T349 PolarHBondContact O-N 2.88Å; T349-R375 WeakPolarHBondContact O-CA 3.2Å; T349-R375 WeakPolarHBondContact O-CB 3.16Å; T349-R375 PolarHBondContact O-N 3.31Å; T349-S376 PolarHBondContact O-N 3.12Å; T349-S376 VanDerWaalsContact O-N 3.15Å
350	A	98.8	Very high	97	Very high	14 Å²	14	25.2 Å²	25.2	12%	0.116	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	129.7	173	0	0	0	0	0	110.5	H323 T324 L325 S376	H323-A350 PolarHBondContact O-N 3.46Å; H323-A350 VanDerWaalsContact O-N 3.09Å; T324-A350 WeakPolarHBondContact CA-O 3.4Å; T324-A350 HydrophobicContact CG2-CB 4.02Å; L325-A350 PolarHBondContact N-O 3.03Å; A350-S376 WeakPolarHBondContact CA-O 3.4Å
351	L	98.8	Very high	97.1	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.01	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	124.2	179.3	177	61.5	0	0	0	109.6	L325 M341 L348 L353 V367 L371 L374 S376 L377 D378	L325-L351 HydrophobicContact CB-CD1 4.43Å; L325-L351 HydrophobicContact CG-CD1 4.49Å; L325-L351 CarbonylContact O-C 3.59Å; L325-L351 VanDerWaalsContact O-CA 3.28Å; L325-L351 WeakPolarHBondContact O-CA 3.48Å; M341-L351 HydrophobicContact CE-CD1 4.08Å; M341-L351 HydrophobicContact CE-CD2 3.7Å; M341-L351 HydrophobicContact SD-CD1 3.77Å; M341-L351 HydrophobicContact SD-CD2 4.49Å; L348-L351 HydrophobicContact CD1-CD1 4.48Å; L351-L353 HydrophobicContact CD1-CD2 4Å; L351-L353 HydrophobicContact CD1-CG 4.15Å; L351-L353 HydrophobicContact CD2-CD1 4.26Å; L351-L353 HydrophobicContact CD2-CG 4.28Å; L351-L353 HydrophobicContact CG-CG 4.13Å; L351-V367 HydrophobicContact CD2-CG1 3.98Å; L351-V367 HydrophobicContact CD2-CG2 3.85Å; L351-L371 HydrophobicContact CD2-CD1 4.05Å; L351-L374 HydrophobicContact CB-CD1 3.73Å; L351-L374 HydrophobicContact CB-CD2 4.24Å; L351-S376 PolarHBondContact N-O 3.45Å; L351-L377 HydrophobicContact CB-CD1 4.33Å; L351-L377 HydrophobicContact CD2-CD1 4.25Å; L351-L377 HydrophobicContact CG-CD1 4.31Å; L351-L377 CarbonylContact O-C 3.6Å; L351-L377 WeakPolarHBondContact O-CA 3.43Å; L351-D378 PolarHBondContact O-N 3.29Å
352	S	98.6	Very high	97.2	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.014	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	128.4	163.1	173.8	0	0	0	0	109.1	L325 L327 S354 D378	L325-S352 PolarHBondContact O-N 3.26Å; L327-S352 PolarHBondContact N-O 2.88Å; S352-S354 WeakPolarHBondContact OG-CB 3.05Å; S352-S354 PolarHBondContact OG-N 2.98Å; S352-D378 WeakPolarHBondContact CA-O 3.39Å; S352-D378 WeakPolarHBondContact CB-OD2 3.31Å; S352-D378 PolarHBondContact OG-OD2 3.29Å
353	L	98.2	Very high	97.3	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.005	16%	0.156	C	C	.	.			trans	-114.8	24.9	167.3	-61.4	176.2	0	0	0	109.9	L327 V338 M341 L351 G355 C356 D378 L379 C382	L327-L353 HydrophobicContact CB-CD2 4.29Å; L327-L353 HydrophobicContact CD1-CD2 4.03Å; L327-L353 CarbonylContact O-C 3.59Å; L327-L353 WeakPolarHBondContact O-CA 3.37Å; V338-L353 HydrophobicContact CG2-CD1 4.28Å; M341-L353 HydrophobicContact SD-CD2 4.46Å; L351-L353 HydrophobicContact CD1-CD2 4Å; L351-L353 HydrophobicContact CD1-CG 4.15Å; L351-L353 HydrophobicContact CD2-CD1 4.26Å; L351-L353 HydrophobicContact CD2-CG 4.28Å; L351-L353 HydrophobicContact CG-CG 4.13Å; L353-G355 PolarHBondContact O-N 3.02Å; L353-C356 HydrophobicContact CB-CB 4.34Å; L353-C356 WeakPolarHBondContact O-CB 3.21Å; L353-C356 PolarHBondContact O-N 2.89Å; L353-C356 PolarHBondContact O-SG 2.61Å; L353-C356 VanDerWaalsContact O-SG 3.38Å; L353-D378 PolarHBondContact N-O 2.82Å; L353-L379 HydrophobicContact CB-CD2 4.24Å; L353-L379 HydrophobicContact CD1-CD2 4.29Å; L353-C382 PolarHBondContact O-SG 3.1Å
354	S	97.9	Very high	97.6	Very high	19 Å²	19	21.2 Å²	21.2	13%	0.133	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	124.8	-171.6	172	0	0	0	0	112.1	Q328 S329 S352 C356 D378 S380	Q328-S354 CarbonylContact C-O 3.41Å; Q328-S354 VanDerWaalsContact CA-O 3.31Å; Q328-S354 WeakPolarHBondContact CA-O 3.33Å; S329-S354 PolarHBondContact N-O 3.23Å; S352-S354 WeakPolarHBondContact OG-CB 3.05Å; S352-S354 PolarHBondContact OG-N 2.98Å; S354-C356 VanDerWaalsContact C-N 3.3Å; S354-C356 PolarHBondContact O-N 3.12Å; S354-D378 VanDerWaalsContact CB-OD2 3.25Å; S354-D378 WeakPolarHBondContact CB-OD2 3.16Å; S354-S380 CarbonylContact C-O 3.5Å; S354-S380 WeakPolarHBondContact CA-O 3.19Å; S354-S380 PolarHBondContact OG-O 3.2Å
355	G	96.8	Very high	97.7	Very high	6 Å²	6	22.9 Å²	22.9	6%	0.062	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	4.4	-178.3	0	0	0	0	0	115.1	W331 L353 S357 S380	W331-G355 VanDerWaalsContact CD1-O 3.23Å; L353-G355 PolarHBondContact O-N 3.02Å; G355-S357 PolarHBondContact O-N 2.76Å; G355-S380 PolarHBondContact N-O 3.42Å
356	C	96.8	Very high	97.8	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.142	C	C	.	.			trans	-72.3	75.6	173.6	-66.3	0	0	0	0	110.7	L327 L353 S354 K358 I359	L327-C356 PolarHBondContact O-SG 3.2Å; L353-C356 HydrophobicContact CB-CB 4.34Å; L353-C356 WeakPolarHBondContact O-CB 3.21Å; L353-C356 PolarHBondContact O-N 2.89Å; L353-C356 PolarHBondContact O-SG 2.61Å; L353-C356 VanDerWaalsContact O-SG 3.38Å; S354-C356 VanDerWaalsContact C-N 3.3Å; S354-C356 PolarHBondContact O-N 3.12Å; C356-K358 PolarHBondContact O-N 2.99Å; C356-I359 HydrophobicContact CB-CG1 3.7Å; C356-I359 WeakPolarHBondContact O-CB 3.42Å; C356-I359 WeakPolarHBondContact O-CG1 3.49Å; C356-I359 PolarHBondContact O-N 3.38Å
357	S	95.3	Very high	98	Very high	42 Å²	42	22.2 Å²	22.2	29%	0.294	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-8.1	-163.9	68.8	0	0	0	0	117.3	G355 R384	G355-S357 PolarHBondContact O-N 2.76Å; S357-R384 WeakPolarHBondContact O-CD 3.41Å; S357-R384 PolarHBondContact O-NE 3.39Å
358	K	97.3	Very high	98.1	Very high	60 Å²	60	20.8 Å²	20.8	26%	0.261	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-11.6	177	-61.2	-180	-170.4	173.3	0	113.8	W331 E332 T334 C356	W331-K358 WeakPolarHBondContact O-CD 3.38Å; W331-K358 WeakPolarHBondContact O-CE 3.26Å; W331-K358 WeakPolarHBondContact O-CG 3.47Å; W331-K358 PolarHBondContact O-NZ 3.13Å; E332-K358 IonicContact OE1-NZ 3.96Å; E332-K358 PolarHBondContact OE1-NZ 2.82Å; E332-K358 IonicContact OE2-NZ 3.19Å; E332-K358 PolarHBondContact OE2-NZ 3.37Å; T334-K358 HydrophobicContact CG2-CB 4.11Å; T334-K358 HydrophobicContact CG2-CD 3.97Å; C356-K358 PolarHBondContact O-N 2.99Å
359	I	98	Very high	98.1	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.138	C	C	.	.			trans	-66.1	137.9	174.1	-57.5	-55	0	0	0	110.2	I333 T334 V338 C356 R384 I385	I333-I359 HydrophobicContact CG2-CD1 4.28Å; T334-I359 VanDerWaalsContact C-CD1 3.46Å; V338-I359 HydrophobicContact CG2-CD1 3.6Å; C356-I359 HydrophobicContact CB-CG1 3.7Å; C356-I359 WeakPolarHBondContact O-CB 3.42Å; C356-I359 WeakPolarHBondContact O-CG1 3.49Å; C356-I359 PolarHBondContact O-N 3.38Å; I359-R384 WeakPolarHBondContact O-CB 3.45Å; I359-I385 HydrophobicContact CG2-CD1 4.26Å
360	T	98.6	Very high	98.1	Very high	30 Å²	30	26.7 Å²	26.7	18%	0.184	14%	0.144	C	C	.	.			trans	-122.3	-178.7	175.4	64.9	0	0	0	0	111.3	N335 D362 G363 V364 R384	N335-T360 PolarHBondContact ND2-OG1 2.62Å; N335-T360 PolarHBondContact OD1-N 3.01Å; N335-T360 VanDerWaalsContact OD1-N 3.15Å; T360-D362 VanDerWaalsContact C-N 3.3Å; T360-D362 PolarHBondContact O-N 2.91Å; T360-D362 PolarHBondContact OG1-OD2 3Å; T360-G363 WeakPolarHBondContact O-CA 3.41Å; T360-G363 PolarHBondContact O-N 2.88Å; T360-V364 PolarHBondContact O-N 2.89Å; T360-R384 HydrophobicContact CG2-CB 4.06Å
361	D	98.8	Very high	98	Very high	21 Å²	21	26 Å²	26	11%	0.112	14%	0.139	C	C	.	.	H	α-helix	trans	-56.6	-40	179.6	-55.3	-37	0	0	0	112.4	G363 V364 E365 I385 T386 M388 A389 Y392	D361-G363 PolarHBondContact O-N 2.61Å; D361-V364 CarbonylContact O-C 3.51Å; D361-V364 WeakPolarHBondContact O-CA 3.43Å; D361-V364 WeakPolarHBondContact O-CB 3.44Å; D361-V364 PolarHBondContact O-N 3.22Å; D361-E365 PolarHBondContact O-N 3.04Å; D361-I385 WeakPolarHBondContact OD1-CA 3.27Å; D361-T386 PolarHBondContact OD1-N 3.4Å; D361-T386 WeakPolarHBondContact OD2-CB 3.46Å; D361-T386 PolarHBondContact OD2-OG1 3.35Å; D361-M388 HydrophobicContact CB-CB 4.01Å; D361-A389 HydrophobicContact CB-CB 4.35Å; D361-A389 WeakPolarHBondContact OD1-CB 3.29Å; D361-Y392 HydrophobicContact CB-CE2 4.41Å
362	D	98.6	Very high	97.9	Very high	88 Å²	88	32.6 Å²	32.6	47%	0.471	16%	0.163	S	C	.	.	H	α-helix	trans	-62.1	-25.7	173	5.7	-47.5	0	0	0	113.4	N335 T360 L366	N335-D362 PolarHBondContact ND2-OD2 3.21Å; T360-D362 VanDerWaalsContact C-N 3.3Å; T360-D362 PolarHBondContact O-N 2.91Å; T360-D362 PolarHBondContact OG1-OD2 3Å; D362-L366 WeakPolarHBondContact O-CD1 3.39Å; D362-L366 WeakPolarHBondContact O-CG 3.5Å; D362-L366 PolarHBondContact O-N 3.33Å
363	G	98.4	Very high	97.8	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-70.8	-34.5	169.2	0	0	0	0	0	112.2	N335 V338 T360 D361 V367	N335-G363 PolarHBondContact ND2-N 2.92Å; V338-G363 WeakPolarHBondContact CG1-O 3.38Å; T360-G363 WeakPolarHBondContact O-CA 3.41Å; T360-G363 PolarHBondContact O-N 2.88Å; D361-G363 PolarHBondContact O-N 2.61Å; G363-V367 PolarHBondContact O-N 3.06Å
364	V	98.7	Very high	97.8	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-76.4	-34.9	175.9	-177.4	0	0	0	0	111.5	T360 D361 L366 V367 A368 L379 I385 A389 I393	T360-V364 PolarHBondContact O-N 2.89Å; D361-V364 CarbonylContact O-C 3.51Å; D361-V364 WeakPolarHBondContact O-CA 3.43Å; D361-V364 WeakPolarHBondContact O-CB 3.44Å; D361-V364 PolarHBondContact O-N 3.22Å; V364-L366 PolarHBondContact O-N 2.89Å; V364-V367 WeakPolarHBondContact O-CB 3.38Å; V364-V367 PolarHBondContact O-N 3.18Å; V364-A368 WeakPolarHBondContact O-CB 3.26Å; V364-A368 PolarHBondContact O-N 3.02Å; V364-L379 HydrophobicContact CG1-CD1 4.22Å; V364-L379 HydrophobicContact CG2-CD1 3.77Å; V364-L379 HydrophobicContact CG2-CD2 4.17Å; V364-I385 HydrophobicContact CG2-CD1 3.6Å; V364-A389 HydrophobicContact CB-CB 3.94Å; V364-A389 HydrophobicContact CG1-CB 3.97Å; V364-A389 HydrophobicContact CG2-CB 4.02Å; V364-I393 HydrophobicContact CG1-CD1 3.71Å; V364-I393 HydrophobicContact CG1-CG1 3.66Å
365	E	98.7	Very high	97.9	Very high	62 Å²	62	41.5 Å²	41.5	29%	0.29	20%	0.196	S	C	.	.	H	α-helix	trans	-53.3	-52.8	170.1	-172.7	176.8	-131.2	0	0	110.5	D361 V367 A368 E369 Y392	D361-E365 PolarHBondContact O-N 3.04Å; E365-V367 VanDerWaalsContact C-N 3.32Å; E365-V367 PolarHBondContact O-N 3.19Å; E365-A368 PolarHBondContact O-N 3.28Å; E365-A368 VanDerWaalsContact O-N 3.08Å; E365-E369 WeakPolarHBondContact O-CG 3.34Å; E365-E369 PolarHBondContact O-N 2.83Å; E365-Y392 HydrophobicContact CB-CD1 4.12Å; E365-Y392 HydrophobicContact CB-CD2 3.77Å; E365-Y392 HydrophobicContact CB-CE1 4.12Å; E365-Y392 HydrophobicContact CB-CE2 3.81Å; E365-Y392 HydrophobicContact CB-CG 3.93Å; E365-Y392 VanDerWaalsContact CD-CZ 3.45Å; E365-Y392 VanDerWaalsContact CD-OH 3.29Å; E365-Y392 HydrophobicContact CG-CD1 3.8Å; E365-Y392 HydrophobicContact CG-CD2 4.33Å; E365-Y392 HydrophobicContact CG-CE1 3.61Å; E365-Y392 HydrophobicContact CG-CE2 4.19Å; E365-Y392 HydrophobicContact CG-CG 4.15Å; E365-Y392 WeakPolarHBondContact OE1-CE1 3.35Å; E365-Y392 PolarHBondContact OE1-OH 3.04Å
366	L	98.5	Very high	98	Very high	41 Å²	41	42.4 Å²	42.4	22%	0.215	20%	0.202	C	C	.	.	H	α-helix	trans	-57.7	-40.1	175.9	-71	165.6	0	0	0	113.2	V338 V339 D362 V364 N370	V338-L366 HydrophobicContact CG1-CB 4.14Å; V339-L366 HydrophobicContact CG2-CD1 3.49Å; V339-L366 VanDerWaalsContact CG2-CD1 3.49Å; V339-L366 HydrophobicContact CG2-CD2 4.27Å; D362-L366 WeakPolarHBondContact O-CD1 3.39Å; D362-L366 WeakPolarHBondContact O-CG 3.5Å; D362-L366 PolarHBondContact O-N 3.33Å; V364-L366 PolarHBondContact O-N 2.89Å; L366-N370 WeakPolarHBondContact O-CB 3.48Å; L366-N370 PolarHBondContact O-N 3.3Å; L366-N370 PolarHBondContact O-ND2 3.44Å
367	V	98.6	Very high	98.1	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.012	20%	0.202	C	C	.	.	H	α-helix	trans	-64.5	-45.7	174.2	162.7	0	0	0	0	110.9	V338 M341 V342 L351 G363 V364 E365 L371 L374	V338-V367 HydrophobicContact CG1-CG2 3.73Å; M341-V367 HydrophobicContact CE-CG2 4.08Å; V342-V367 HydrophobicContact CG1-CG2 4.31Å; L351-V367 HydrophobicContact CD2-CG1 3.98Å; L351-V367 HydrophobicContact CD2-CG2 3.85Å; G363-V367 PolarHBondContact O-N 3.06Å; V364-V367 WeakPolarHBondContact O-CB 3.38Å; V364-V367 PolarHBondContact O-N 3.18Å; E365-V367 VanDerWaalsContact C-N 3.32Å; E365-V367 PolarHBondContact O-N 3.19Å; V367-L371 HydrophobicContact CG1-CD1 4.29Å; V367-L371 WeakPolarHBondContact O-CA 3.33Å; V367-L371 VanDerWaalsContact O-CB 3.27Å; V367-L371 WeakPolarHBondContact O-CB 3.23Å; V367-L371 PolarHBondContact O-N 2.77Å; V367-L374 HydrophobicContact CG1-CD2 4.25Å
368	A	98.2	Very high	98.3	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.008	19%	0.194	C	C	.	.	H	α-helix	trans	-64.9	-50.6	-176	0	0	0	0	0	111.8	V364 E365 N370 D396 L397	V364-A368 WeakPolarHBondContact O-CB 3.26Å; V364-A368 PolarHBondContact O-N 3.02Å; E365-A368 PolarHBondContact O-N 3.28Å; E365-A368 VanDerWaalsContact O-N 3.08Å; A368-N370 VanDerWaalsContact C-N 3.31Å; A368-N370 PolarHBondContact O-N 3.38Å; A368-D396 HydrophobicContact CB-CB 4.04Å; A368-D396 WeakPolarHBondContact O-CB 3.23Å; A368-L397 HydrophobicContact CB-CD1 4.44Å; A368-L397 HydrophobicContact CB-CG 4.13Å
369	E	97.7	Very high	98.3	Very high	95 Å²	95	38.7 Å²	38.7	44%	0.444	18%	0.182	S	C	.	.	H	α-helix	trans	-60	-38.4	-179.3	-70.8	-168.9	142.8	0	0	113.2	E365 R372	E365-E369 WeakPolarHBondContact O-CG 3.34Å; E365-E369 PolarHBondContact O-N 2.83Å; E369-R372 PolarHBondContact O-NH1 2.97Å
370	N	98	Very high	98.3	Very high	72 Å²	72	38.9 Å²	38.9	39%	0.385	18%	0.183	S	C	.	.	H	α-helix	trans	-99	-37.4	-168.9	-67.2	-83.3	0	0	0	113.4	V342 L366 A368 R372	V342-N370 HydrophobicContact CB-CB 3.86Å; V342-N370 HydrophobicContact CG1-CB 4.42Å; V342-N370 HydrophobicContact CG2-CB 4.12Å; L366-N370 WeakPolarHBondContact O-CB 3.48Å; L366-N370 PolarHBondContact O-N 3.3Å; L366-N370 PolarHBondContact O-ND2 3.44Å; A368-N370 VanDerWaalsContact C-N 3.31Å; A368-N370 PolarHBondContact O-N 3.38Å; N370-R372 PolarHBondContact O-N 2.82Å
371	L	97.8	Very high	98.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	20%	0.201	C	C	.	.			trans	-96.7	45	-173.8	-55.3	-174.4	0	0	0	112.9	M341 V342 L345 L348 L351 V367 K373 L374 L397	M341-L371 HydrophobicContact CE-CD1 4.45Å; V342-L371 HydrophobicContact CB-CD2 4.33Å; V342-L371 HydrophobicContact CB-CG 4.46Å; V342-L371 HydrophobicContact CG1-CD1 4.05Å; V342-L371 HydrophobicContact CG1-CD2 4.34Å; V342-L371 HydrophobicContact CG1-CG 3.98Å; L345-L371 WeakPolarHBondContact O-CD2 3.18Å; L348-L371 HydrophobicContact CB-CD1 4.3Å; L348-L371 HydrophobicContact CD1-CD1 3.99Å; L351-L371 HydrophobicContact CD2-CD1 4.05Å; V367-L371 HydrophobicContact CG1-CD1 4.29Å; V367-L371 WeakPolarHBondContact O-CA 3.33Å; V367-L371 VanDerWaalsContact O-CB 3.27Å; V367-L371 WeakPolarHBondContact O-CB 3.23Å; V367-L371 PolarHBondContact O-N 2.77Å; L371-K373 PolarHBondContact O-N 2.82Å; L371-L374 VanDerWaalsContact O-CB 3.24Å; L371-L374 WeakPolarHBondContact O-CB 3.43Å; L371-L374 PolarHBondContact O-N 2.98Å; L371-L397 WeakPolarHBondContact O-CD2 3.26Å
372	R	96.6	Very high	98.3	Very high	140 Å²	140	43.5 Å²	43.5	53%	0.528	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	9.2	180	-62.2	-175.1	174.7	121.9	-6.5	116.4	E369 N370 D396	E369-R372 PolarHBondContact O-NH1 2.97Å; N370-R372 PolarHBondContact O-N 2.82Å; R372-D396 IonicContact CZ-OD1 3.14Å; R372-D396 IonicContact NE-OD1 2.79Å; R372-D396 PolarHBondContact NE-OD1 3.29Å; R372-D396 IonicContact NH2-OD1 2.67Å; R372-D396 PolarHBondContact NH2-OD1 3.04Å
373	K	97.2	Very high	98.2	Very high	102 Å²	102	42.2 Å²	42.2	44%	0.443	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-4.6	170.3	-67.1	-179	-177.9	178.7	0	113	N347 L371	N347-K373 PolarHBondContact OD1-NZ 2.85Å; L371-K373 PolarHBondContact O-N 2.82Å
374	L	98.5	Very high	98.2	Very high	0 Å²	0	48 Å²	48	0%	0	21%	0.214	C	C	.	.			trans	-62	137.5	-177	-153.1	70.7	0	0	0	111.4	L348 L351 V367 L371 S376 L377 L397 K399 L400	L348-L374 HydrophobicContact CB-CD1 4.31Å; L351-L374 HydrophobicContact CB-CD1 3.73Å; L351-L374 HydrophobicContact CB-CD2 4.24Å; V367-L374 HydrophobicContact CG1-CD2 4.25Å; L371-L374 VanDerWaalsContact O-CB 3.24Å; L371-L374 WeakPolarHBondContact O-CB 3.43Å; L371-L374 PolarHBondContact O-N 2.98Å; L374-S376 WeakPolarHBondContact CG-O 3.25Å; L374-L377 HydrophobicContact CD2-CB 3.75Å; L374-L377 HydrophobicContact CD2-CD1 4Å; L374-L377 HydrophobicContact CD2-CD2 4.26Å; L374-L377 HydrophobicContact CD2-CG 4.2Å; L374-L397 HydrophobicContact CB-CD2 4.3Å; L374-L397 HydrophobicContact CD2-CD1 4.18Å; L374-K399 CarbonylContact O-C 3.29Å; L374-K399 VanDerWaalsContact O-C 3.29Å; L374-L400 HydrophobicContact CB-CD1 4.41Å; L374-L400 HydrophobicContact CD2-CD1 4.21Å; L374-L400 HydrophobicContact CG-CD1 4.2Å; L374-L400 PolarHBondContact O-N 3.44Å
375	R	98.8	Very high	98.1	Very high	107 Å²	107	47.9 Å²	47.9	40%	0.404	21%	0.213	S	C	.	.	S	Bend	trans	-120.6	-33.3	179.6	-64.7	-174.3	167.1	-77.8	6.8	112.1	T349 E401 E402	T349-R375 WeakPolarHBondContact O-CA 3.2Å; T349-R375 WeakPolarHBondContact O-CB 3.16Å; T349-R375 PolarHBondContact O-N 3.31Å; R375-E401 IonicContact CZ-OE1 2.78Å; R375-E401 IonicContact CZ-OE2 2.76Å; R375-E401 IonicContact NH1-OE1 3.73Å; R375-E401 PolarHBondContact NH1-OE1 3.06Å; R375-E401 IonicContact NH1-OE2 2.66Å; R375-E401 PolarHBondContact NH1-OE2 3.37Å; R375-E401 CarbonylContact O-C 3.58Å; R375-E401 WeakPolarHBondContact O-CA 3.44Å; R375-E401 PolarHBondContact O-N 3.35Å; R375-E402 PolarHBondContact O-N 3.18Å
376	S	98.9	Very high	98.1	Very high	25 Å²	25	46 Å²	46	18%	0.175	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	128	172.7	169.5	0	0	0	0	109.8	T349 A350 L351 L374 E402	T349-S376 PolarHBondContact O-N 3.12Å; T349-S376 VanDerWaalsContact O-N 3.15Å; A350-S376 WeakPolarHBondContact CA-O 3.4Å; L351-S376 PolarHBondContact N-O 3.45Å; L374-S376 WeakPolarHBondContact CG-O 3.25Å; S376-E402 WeakPolarHBondContact CA-O 3.41Å; S376-E402 WeakPolarHBondContact CB-OE1 3.49Å; S376-E402 PolarHBondContact OG-OE1 3.32Å
377	L	98.9	Very high	98.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	122.1	174.8	179.1	55.2	0	0	0	109.4	L351 L374 L379 I393 L397 L400 E402 L403 V404	L351-L377 HydrophobicContact CB-CD1 4.33Å; L351-L377 HydrophobicContact CD2-CD1 4.25Å; L351-L377 HydrophobicContact CG-CD1 4.31Å; L351-L377 CarbonylContact O-C 3.6Å; L351-L377 WeakPolarHBondContact O-CA 3.43Å; L374-L377 HydrophobicContact CD2-CB 3.75Å; L374-L377 HydrophobicContact CD2-CD1 4Å; L374-L377 HydrophobicContact CD2-CD2 4.26Å; L374-L377 HydrophobicContact CD2-CG 4.2Å; L377-L379 HydrophobicContact CD1-CD2 4.03Å; L377-L379 HydrophobicContact CD1-CG 4.06Å; L377-L379 HydrophobicContact CD2-CD1 4.13Å; L377-L379 HydrophobicContact CD2-CG 4.36Å; L377-L379 HydrophobicContact CG-CD1 4.32Å; L377-L379 HydrophobicContact CG-CG 4.02Å; L377-I393 HydrophobicContact CD2-CD1 3.68Å; L377-I393 HydrophobicContact CD2-CG1 3.93Å; L377-L397 HydrophobicContact CD2-CD1 4.05Å; L377-L400 HydrophobicContact CB-CD1 3.68Å; L377-L400 HydrophobicContact CB-CD2 4.22Å; L377-E402 PolarHBondContact N-O 2.78Å; L377-L403 HydrophobicContact CB-CD1 4.19Å; L377-L403 HydrophobicContact CD2-CD1 4.26Å; L377-L403 HydrophobicContact CG-CD1 4.19Å; L377-L403 WeakPolarHBondContact O-CA 3.32Å; L377-V404 PolarHBondContact O-N 2.85Å
378	D	98.9	Very high	98.2	Very high	24 Å²	24	48.9 Å²	48.9	13%	0.128	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	113.6	176	167.2	28	0	0	0	110	L351 S352 L353 S354 S380 V404	L351-D378 PolarHBondContact O-N 3.29Å; S352-D378 WeakPolarHBondContact CA-O 3.39Å; S352-D378 WeakPolarHBondContact CB-OD2 3.31Å; S352-D378 PolarHBondContact OG-OD2 3.29Å; L353-D378 PolarHBondContact N-O 2.82Å; S354-D378 VanDerWaalsContact CB-OD2 3.25Å; S354-D378 WeakPolarHBondContact CB-OD2 3.16Å; D378-S380 WeakPolarHBondContact OD1-CB 3.42Å; D378-S380 PolarHBondContact OD1-N 3.43Å; D378-S380 PolarHBondContact OD1-OG 3Å; D378-V404 HydrophobicContact CB-CB 3.92Å; D378-V404 HydrophobicContact CB-CG2 3.98Å
379	L	98.7	Very high	98.2	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.005	22%	0.219	C	C	.	.			trans	-114.3	16.9	178.1	-64.4	175.2	0	0	0	111.5	L353 V364 L377 C382 I393 V404 L405 C408	L353-L379 HydrophobicContact CB-CD2 4.24Å; L353-L379 HydrophobicContact CD1-CD2 4.29Å; V364-L379 HydrophobicContact CG1-CD1 4.22Å; V364-L379 HydrophobicContact CG2-CD1 3.77Å; V364-L379 HydrophobicContact CG2-CD2 4.17Å; L377-L379 HydrophobicContact CD1-CD2 4.03Å; L377-L379 HydrophobicContact CD1-CG 4.06Å; L377-L379 HydrophobicContact CD2-CD1 4.13Å; L377-L379 HydrophobicContact CD2-CG 4.36Å; L377-L379 HydrophobicContact CG-CD1 4.32Å; L377-L379 HydrophobicContact CG-CG 4.02Å; L379-C382 VanDerWaalsContact O-CB 3.25Å; L379-C382 WeakPolarHBondContact O-CB 3.25Å; L379-C382 PolarHBondContact O-N 3.12Å; L379-C382 PolarHBondContact O-SG 3.09Å; L379-I393 HydrophobicContact CD1-CD1 3.95Å; L379-V404 PolarHBondContact N-O 2.79Å; L379-L405 HydrophobicContact CB-CD2 4.2Å; L379-L405 HydrophobicContact CD1-CD2 4.38Å; L379-C408 PolarHBondContact O-SG 3.15Å
380	S	98.5	Very high	98.2	Very high	4 Å²	4	44.3 Å²	44.3	3%	0.028	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	150.2	-176.3	-55	0	0	0	0	112.1	S354 G355 D378 C382 V404 D406	S354-S380 CarbonylContact C-O 3.5Å; S354-S380 WeakPolarHBondContact CA-O 3.19Å; S354-S380 PolarHBondContact OG-O 3.2Å; G355-S380 PolarHBondContact N-O 3.42Å; D378-S380 WeakPolarHBondContact OD1-CB 3.42Å; D378-S380 PolarHBondContact OD1-N 3.43Å; D378-S380 PolarHBondContact OD1-OG 3Å; S380-C382 PolarHBondContact O-N 3.49Å; S380-V404 WeakPolarHBondContact OG-CG1 3.17Å; S380-D406 CarbonylContact C-O 3.49Å; S380-D406 WeakPolarHBondContact CA-O 3.37Å; S380-D406 WeakPolarHBondContact CB-O 3.31Å; S380-D406 PolarHBondContact OG-N 2.76Å
381	W	97.8	Very high	98.3	Very high	147 Å²	147	43.8 Å²	43.8	56%	0.557	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.8	18.9	179.3	-59	92.6	0	0	0	115.5	P383 D406 R407	W381-P383 WeakPolarHBondContact O-CD 3.43Å; W381-D406 PolarHBondContact N-O 2.77Å; W381-R407 HydrophobicContact CD2-CB 3.89Å; W381-R407 HydrophobicContact CD2-CG 3.77Å; W381-R407 HydrophobicContact CE3-CB 3.96Å; W381-R407 HydrophobicContact CE3-CG 3.96Å; W381-R407 HydrophobicContact CG-CB 4.27Å; W381-R407 HydrophobicContact CG-CG 4.44Å; W381-R407 VanDerWaalsContact CH2-CD 3.48Å; W381-R407 HydrophobicContact CH2-CG 4.03Å; W381-R407 HydrophobicContact CZ2-CG 3.81Å; W381-R407 VanDerWaalsContact CZ2-NE 3.3Å; W381-R407 HydrophobicContact CZ3-CB 4.45Å; W381-R407 HydrophobicContact CZ3-CG 4.08Å
382	C	97.7	Very high	98.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	20%	0.204	C	C	.	.			trans	-93.7	96.6	172.9	-67.2	0	0	0	0	110.3	L353 L379 S380 R384 I385	L353-C382 PolarHBondContact O-SG 3.1Å; L379-C382 VanDerWaalsContact O-CB 3.25Å; L379-C382 WeakPolarHBondContact O-CB 3.25Å; L379-C382 PolarHBondContact O-N 3.12Å; L379-C382 PolarHBondContact O-SG 3.09Å; S380-C382 PolarHBondContact O-N 3.49Å; C382-R384 PolarHBondContact O-N 3.12Å; C382-R384 VanDerWaalsContact O-N 3.13Å; C382-I385 HydrophobicContact CB-CB 4.5Å; C382-I385 HydrophobicContact CB-CG1 3.57Å; C382-I385 PolarHBondContact O-N 2.89Å
383	P	96.7	Very high	98.4	Very high	61 Å²	61	39.8 Å²	39.8	40%	0.396	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-7.1	-166.7	33.1	-38.7	0	0	0	114.2	W381 R410	W381-P383 WeakPolarHBondContact O-CD 3.43Å; P383-R410 WeakPolarHBondContact O-CD 3.22Å
384	R	98	Very high	98.4	Very high	122 Å²	122	35.4 Å²	35.4	46%	0.46	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-15.9	-179.6	-55.4	-178.5	-177.1	-147.2	-6.7	113.2	S357 I359 T360 C382 T386 R410	S357-R384 WeakPolarHBondContact O-CD 3.41Å; S357-R384 PolarHBondContact O-NE 3.39Å; I359-R384 WeakPolarHBondContact O-CB 3.45Å; T360-R384 HydrophobicContact CG2-CB 4.06Å; C382-R384 PolarHBondContact O-N 3.12Å; C382-R384 VanDerWaalsContact O-N 3.13Å; R384-T386 WeakPolarHBondContact O-CG2 3.19Å; R384-R410 PolarHBondContact O-NH1 3.09Å; R384-R410 VanDerWaalsContact O-NH1 3.16Å
385	I	98.4	Very high	98.4	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.185	C	C	.	.			trans	-65.8	133.3	178	-61.7	-54.6	0	0	0	110.1	I359 D361 V364 C382 A389 R410 I411	I359-I385 HydrophobicContact CG2-CD1 4.26Å; D361-I385 WeakPolarHBondContact OD1-CA 3.27Å; V364-I385 HydrophobicContact CG2-CD1 3.6Å; C382-I385 HydrophobicContact CB-CB 4.5Å; C382-I385 HydrophobicContact CB-CG1 3.57Å; C382-I385 PolarHBondContact O-N 2.89Å; I385-A389 HydrophobicContact CG2-CB 3.67Å; I385-R410 WeakPolarHBondContact O-CB 3.23Å; I385-I411 HydrophobicContact CG2-CD1 4.2Å
386	T	98.8	Very high	98.4	Very high	22 Å²	22	35.5 Å²	35.5	14%	0.135	18%	0.175	C	C	.	.			trans	-128.8	-178.1	-179.9	79.7	0	0	0	0	111.5	D361 R384 M388 A389 R410 I411	D361-T386 PolarHBondContact OD1-N 3.4Å; D361-T386 WeakPolarHBondContact OD2-CB 3.46Å; D361-T386 PolarHBondContact OD2-OG1 3.35Å; R384-T386 WeakPolarHBondContact O-CG2 3.19Å; T386-M388 PolarHBondContact O-N 2.98Å; T386-M388 VanDerWaalsContact O-N 3.1Å; T386-M388 PolarHBondContact OG1-N 3.02Å; T386-A389 WeakPolarHBondContact O-CB 3.45Å; T386-A389 PolarHBondContact O-N 3.26Å; T386-R410 HydrophobicContact CG2-CB 4.18Å; T386-R410 VanDerWaalsContact CG2-NH1 3.31Å; T386-I411 VanDerWaalsContact C-CD1 3.43Å; T386-I411 WeakPolarHBondContact O-CD1 3.23Å
387	D	98.8	Very high	98.3	Very high	23 Å²	23	34.4 Å²	34.4	12%	0.123	17%	0.167	C	C	.	.	H	α-helix	trans	-55.1	-26.3	177.4	-60	-38.2	0	0	0	113.6	A389 L390 E391 I411 T412 G415 Y418	D387-A389 VanDerWaalsContact C-N 3.33Å; D387-A389 PolarHBondContact O-N 3.17Å; D387-L390 WeakPolarHBondContact O-CB 3.02Å; D387-L390 PolarHBondContact O-N 3.28Å; D387-E391 PolarHBondContact O-N 2.93Å; D387-E391 VanDerWaalsContact O-N 3.08Å; D387-I411 WeakPolarHBondContact OD1-CA 3.26Å; D387-T412 PolarHBondContact OD1-N 2.8Å; D387-T412 WeakPolarHBondContact OD2-CB 3.41Å; D387-T412 WeakPolarHBondContact OD2-CG2 3.48Å; D387-T412 PolarHBondContact OD2-OG1 2.81Å; D387-G415 VanDerWaalsContact CG-N 3.3Å; D387-G415 VanDerWaalsContact OD1-CA 3.24Å; D387-G415 WeakPolarHBondContact OD1-CA 3.29Å; D387-G415 PolarHBondContact OD1-N 3.44Å; D387-G415 VanDerWaalsContact OD1-N 3.12Å; D387-Y418 HydrophobicContact CB-CE2 4.44Å
388	M	98.7	Very high	98.2	Very high	80 Å²	80	41 Å²	41	39%	0.394	20%	0.198	S	C	.	.	H	α-helix	trans	-59.5	-39.7	174.6	-67.7	-59	-49.7	0	0	112.6	D361 T386 L390 E391 Y392	D361-M388 HydrophobicContact CB-CB 4.01Å; T386-M388 PolarHBondContact O-N 2.98Å; T386-M388 VanDerWaalsContact O-N 3.1Å; T386-M388 PolarHBondContact OG1-N 3.02Å; M388-L390 PolarHBondContact O-N 2.72Å; M388-E391 WeakPolarHBondContact O-CB 3.45Å; M388-E391 PolarHBondContact O-N 3.44Å; M388-Y392 HydrophobicContact CB-CE2 4.43Å; M388-Y392 WeakPolarHBondContact O-CD2 3.32Å; M388-Y392 PolarHBondContact O-N 3.11Å; M388-Y392 VanDerWaalsContact O-N 3.13Å
389	A	98.8	Very high	98.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-60.9	-33.9	174.5	0	0	0	0	0	112.2	D361 V364 I385 T386 D387 Y392 I393	D361-A389 HydrophobicContact CB-CB 4.35Å; D361-A389 WeakPolarHBondContact OD1-CB 3.29Å; V364-A389 HydrophobicContact CB-CB 3.94Å; V364-A389 HydrophobicContact CG1-CB 3.97Å; V364-A389 HydrophobicContact CG2-CB 4.02Å; I385-A389 HydrophobicContact CG2-CB 3.67Å; T386-A389 WeakPolarHBondContact O-CB 3.45Å; T386-A389 PolarHBondContact O-N 3.26Å; D387-A389 VanDerWaalsContact C-N 3.33Å; D387-A389 PolarHBondContact O-N 3.17Å; A389-Y392 PolarHBondContact O-N 2.76Å; A389-I393 WeakPolarHBondContact O-CB 3.44Å; A389-I393 WeakPolarHBondContact O-CD1 3.48Å; A389-I393 VanDerWaalsContact O-CG1 3.24Å; A389-I393 WeakPolarHBondContact O-CG1 3.39Å; A389-I393 PolarHBondContact O-N 2.87Å
390	L	98.8	Very high	98.2	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-76	-29.6	179.2	-54	-167.2	0	0	0	111.9	D387 M388 I393 A394 L403 L405 I411 L419	D387-L390 WeakPolarHBondContact O-CB 3.02Å; D387-L390 PolarHBondContact O-N 3.28Å; M388-L390 PolarHBondContact O-N 2.72Å; L390-I393 HydrophobicContact CD2-CD1 4Å; L390-A394 VanDerWaalsContact O-CB 3.28Å; L390-A394 WeakPolarHBondContact O-CB 3.16Å; L390-A394 PolarHBondContact O-N 2.75Å; L390-L403 HydrophobicContact CD2-CD2 4.38Å; L390-L405 HydrophobicContact CD1-CD1 3.98Å; L390-L405 HydrophobicContact CD2-CD1 3.71Å; L390-L405 HydrophobicContact CD2-CD2 3.86Å; L390-L405 HydrophobicContact CD2-CG 4.44Å; L390-I411 HydrophobicContact CD1-CD1 3.72Å; L390-I411 HydrophobicContact CD1-CG1 4.28Å; L390-I411 HydrophobicContact CD1-CG2 3.71Å; L390-I411 HydrophobicContact CD2-CD1 4.34Å; L390-I411 HydrophobicContact CG-CD1 3.85Å; L390-L419 HydrophobicContact CB-CD2 4.14Å; L390-L419 HydrophobicContact CB-CG 4.27Å; L390-L419 HydrophobicContact CD1-CD1 3.98Å; L390-L419 HydrophobicContact CD1-CG 4.19Å; L390-L419 HydrophobicContact CD2-CD2 4.44Å
391	E	98.6	Very high	98.2	Very high	62 Å²	62	47.7 Å²	47.7	29%	0.29	23%	0.226	S	C	.	.	H	α-helix	trans	-60.5	-51.3	167.6	-167.9	171	170.4	0	0	110.8	D387 M388 I393 A394 C395 Y418	D387-E391 PolarHBondContact O-N 2.93Å; D387-E391 VanDerWaalsContact O-N 3.08Å; M388-E391 WeakPolarHBondContact O-CB 3.45Å; M388-E391 PolarHBondContact O-N 3.44Å; E391-I393 PolarHBondContact O-N 3.4Å; E391-A394 PolarHBondContact O-N 3.46Å; E391-C395 VanDerWaalsContact O-CB 3.32Å; E391-C395 WeakPolarHBondContact O-CB 3Å; E391-C395 PolarHBondContact O-N 3.46Å; E391-C395 PolarHBondContact O-SG 2.96Å; E391-Y418 HydrophobicContact CB-CD1 4.08Å; E391-Y418 HydrophobicContact CB-CD2 3.78Å; E391-Y418 HydrophobicContact CB-CE1 4.04Å; E391-Y418 HydrophobicContact CB-CE2 3.75Å; E391-Y418 HydrophobicContact CB-CG 3.95Å; E391-Y418 HydrophobicContact CG-CD1 3.91Å; E391-Y418 HydrophobicContact CG-CD2 4.47Å; E391-Y418 HydrophobicContact CG-CE1 3.68Å; E391-Y418 HydrophobicContact CG-CE2 4.29Å; E391-Y418 HydrophobicContact CG-CG 4.3Å; E391-Y418 PolarHBondContact OE2-OH 3.18Å
392	Y	98.6	Very high	98.2	Very high	56 Å²	56	43.5 Å²	43.5	22%	0.22	21%	0.213	C	C	.	.	H	α-helix	trans	-60.3	-44.6	177.5	-62.3	-53.6	0	0	0	113	D361 E365 M388 A389 A394 C395 D396	D361-Y392 HydrophobicContact CB-CE2 4.41Å; E365-Y392 HydrophobicContact CB-CD1 4.12Å; E365-Y392 HydrophobicContact CB-CD2 3.77Å; E365-Y392 HydrophobicContact CB-CE1 4.12Å; E365-Y392 HydrophobicContact CB-CE2 3.81Å; E365-Y392 HydrophobicContact CB-CG 3.93Å; E365-Y392 VanDerWaalsContact CD-CZ 3.45Å; E365-Y392 VanDerWaalsContact CD-OH 3.29Å; E365-Y392 HydrophobicContact CG-CD1 3.8Å; E365-Y392 HydrophobicContact CG-CD2 4.33Å; E365-Y392 HydrophobicContact CG-CE1 3.61Å; E365-Y392 HydrophobicContact CG-CE2 4.19Å; E365-Y392 HydrophobicContact CG-CG 4.15Å; E365-Y392 WeakPolarHBondContact OE1-CE1 3.35Å; E365-Y392 PolarHBondContact OE1-OH 3.04Å; M388-Y392 HydrophobicContact CB-CE2 4.43Å; M388-Y392 WeakPolarHBondContact O-CD2 3.32Å; M388-Y392 PolarHBondContact O-N 3.11Å; M388-Y392 VanDerWaalsContact O-N 3.13Å; A389-Y392 PolarHBondContact O-N 2.76Å; Y392-A394 PolarHBondContact O-N 3.38Å; Y392-C395 PolarHBondContact O-N 2.89Å; Y392-D396 PolarHBondContact O-N 3Å
393	I	98.7	Very high	98.3	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.5	-46.2	176.5	-73.6	163.3	0	0	0	111	V364 L377 L379 A389 L390 E391 L397 L400 L403 L419 M422	V364-I393 HydrophobicContact CG1-CD1 3.71Å; V364-I393 HydrophobicContact CG1-CG1 3.66Å; L377-I393 HydrophobicContact CD2-CD1 3.68Å; L377-I393 HydrophobicContact CD2-CG1 3.93Å; L379-I393 HydrophobicContact CD1-CD1 3.95Å; A389-I393 WeakPolarHBondContact O-CB 3.44Å; A389-I393 WeakPolarHBondContact O-CD1 3.48Å; A389-I393 VanDerWaalsContact O-CG1 3.24Å; A389-I393 WeakPolarHBondContact O-CG1 3.39Å; A389-I393 PolarHBondContact O-N 2.87Å; L390-I393 HydrophobicContact CD2-CD1 4Å; E391-I393 PolarHBondContact O-N 3.4Å; I393-L397 HydrophobicContact CG1-CD1 4.18Å; I393-L397 HydrophobicContact CG2-CD1 4.36Å; I393-L397 WeakPolarHBondContact O-CB 3.33Å; I393-L397 PolarHBondContact O-N 3.33Å; I393-L400 HydrophobicContact CG2-CD2 3.71Å; I393-L403 HydrophobicContact CD1-CD1 4.15Å; I393-L403 HydrophobicContact CG2-CD2 4.26Å; I393-L419 HydrophobicContact CG2-CD2 4.36Å; I393-M422 HydrophobicContact CG2-CE 3.78Å; I393-M422 HydrophobicContact CG2-SD 3.86Å
394	A	98.1	Very high	98.4	Very high	9 Å²	9	41.3 Å²	41.3	7%	0.074	20%	0.198	C	C	.	.	H	α-helix	trans	-65.5	-38.9	178.8	0	0	0	0	0	112.5	L390 E391 Y392 Y418 M422	L390-A394 VanDerWaalsContact O-CB 3.28Å; L390-A394 WeakPolarHBondContact O-CB 3.16Å; L390-A394 PolarHBondContact O-N 2.75Å; E391-A394 PolarHBondContact O-N 3.46Å; Y392-A394 PolarHBondContact O-N 3.38Å; A394-Y418 WeakPolarHBondContact CB-O 3.37Å; A394-M422 HydrophobicContact CB-CG 4.03Å; A394-M422 HydrophobicContact CB-SD 4.3Å
395	C	97.6	Very high	98.4	Very high	73 Å²	73	35.5 Å²	35.5	49%	0.493	18%	0.176	S	C	.	.	H	α-helix	trans	-68.9	-33.3	-177.5	-77.8	0	0	0	0	114.7	E391 Y392 H398	E391-C395 VanDerWaalsContact O-CB 3.32Å; E391-C395 WeakPolarHBondContact O-CB 3Å; E391-C395 PolarHBondContact O-N 3.46Å; E391-C395 PolarHBondContact O-SG 2.96Å; Y392-C395 PolarHBondContact O-N 2.89Å; C395-H398 PolarHBondContact O-CE1 2.72Å
396	D	97.9	Very high	98.4	Very high	37 Å²	37	36.3 Å²	36.3	20%	0.198	18%	0.18	C	C	.	.	H	α-helix	trans	-123	-28.2	-173.4	-91.5	-73.7	0	0	0	115.7	A368 R372 Y392 H398	A368-D396 HydrophobicContact CB-CB 4.04Å; A368-D396 WeakPolarHBondContact O-CB 3.23Å; R372-D396 IonicContact CZ-OD1 3.14Å; R372-D396 IonicContact NE-OD1 2.79Å; R372-D396 PolarHBondContact NE-OD1 3.29Å; R372-D396 IonicContact NH2-OD1 2.67Å; R372-D396 PolarHBondContact NH2-OD1 3.04Å; Y392-D396 PolarHBondContact O-N 3Å; D396-H398 VanDerWaalsContact C-N 3.3Å; D396-H398 PolarHBondContact O-N 3.38Å
397	L	98.1	Very high	98.4	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	19%	0.189	C	C	.	.			trans	-90.4	54.3	-173.2	-61.1	-177.7	0	0	0	113.1	A368 L371 L374 L377 I393 K399 L400 M422	A368-L397 HydrophobicContact CB-CD1 4.44Å; A368-L397 HydrophobicContact CB-CG 4.13Å; L371-L397 WeakPolarHBondContact O-CD2 3.26Å; L374-L397 HydrophobicContact CB-CD2 4.3Å; L374-L397 HydrophobicContact CD2-CD1 4.18Å; L377-L397 HydrophobicContact CD2-CD1 4.05Å; I393-L397 HydrophobicContact CG1-CD1 4.18Å; I393-L397 HydrophobicContact CG2-CD1 4.36Å; I393-L397 WeakPolarHBondContact O-CB 3.33Å; I393-L397 PolarHBondContact O-N 3.33Å; L397-K399 PolarHBondContact O-N 3.43Å; L397-L400 HydrophobicContact CB-CB 4.13Å; L397-L400 VanDerWaalsContact O-CB 3.3Å; L397-L400 WeakPolarHBondContact O-CB 3.38Å; L397-L400 PolarHBondContact O-N 2.78Å; L397-M422 WeakPolarHBondContact O-CE 3.48Å
398	H	97	Very high	98.4	Very high	139 Å²	139	38.1 Å²	38.1	64%	0.644	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	3.4	-178.7	-49.9	-30.2	0	0	0	116.3	C395 D396 S424	C395-H398 PolarHBondContact O-CE1 2.72Å; D396-H398 VanDerWaalsContact C-N 3.3Å; D396-H398 PolarHBondContact O-N 3.38Å; H398-S424 WeakPolarHBondContact O-CB 3.47Å; H398-S424 PolarHBondContact O-OG 3.01Å
399	K	97.9	Very high	98.3	Very high	110 Å²	110	37 Å²	37	48%	0.478	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.5	2.3	175.9	-66.8	-179.1	-175	164.5	0	112.8	L374 L397 E401	L374-K399 CarbonylContact O-C 3.29Å; L374-K399 VanDerWaalsContact O-C 3.29Å; L397-K399 PolarHBondContact O-N 3.43Å; K399-E401 PolarHBondContact O-N 3.42Å
400	L	98.7	Very high	98.2	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.203	C	C	.	.			trans	-68	121.2	179.5	-161.1	72.8	0	0	0	109.4	L374 L377 I393 L397 E402 L403 M422 S424 L425	L374-L400 HydrophobicContact CB-CD1 4.41Å; L374-L400 HydrophobicContact CD2-CD1 4.21Å; L374-L400 HydrophobicContact CG-CD1 4.2Å; L374-L400 PolarHBondContact O-N 3.44Å; L377-L400 HydrophobicContact CB-CD1 3.68Å; L377-L400 HydrophobicContact CB-CD2 4.22Å; I393-L400 HydrophobicContact CG2-CD2 3.71Å; L397-L400 HydrophobicContact CB-CB 4.13Å; L397-L400 VanDerWaalsContact O-CB 3.3Å; L397-L400 WeakPolarHBondContact O-CB 3.38Å; L397-L400 PolarHBondContact O-N 2.78Å; L400-E402 WeakPolarHBondContact CG-O 3.26Å; L400-L403 HydrophobicContact CD2-CB 3.98Å; L400-L403 HydrophobicContact CD2-CD1 4.21Å; L400-L403 HydrophobicContact CD2-CD2 4.42Å; L400-L403 HydrophobicContact CD2-CG 4.43Å; L400-M422 HydrophobicContact CB-CE 3.82Å; L400-M422 HydrophobicContact CD2-CE 4.11Å; L400-S424 PolarHBondContact N-OG 3.2Å; L400-S424 CarbonylContact O-C 3.21Å; L400-S424 VanDerWaalsContact O-CB 3.29Å; L400-S424 WeakPolarHBondContact O-CB 3.5Å; L400-S424 PolarHBondContact O-OG 3.13Å; L400-L425 HydrophobicContact CD2-CD1 4.33Å; L400-L425 HydrophobicContact CG-CD1 4.34Å; L400-L425 WeakPolarHBondContact O-CA 3.43Å; L400-L425 PolarHBondContact O-N 2.66Å
401	E	98.7	Very high	98.2	Very high	59 Å²	59	43 Å²	43	28%	0.276	20%	0.203	S	C	.	.			trans	-104.9	-26.4	179.8	-76.2	166.1	161.9	0	0	110.8	R375 K399 R426 S427	R375-E401 IonicContact CZ-OE1 2.78Å; R375-E401 IonicContact CZ-OE2 2.76Å; R375-E401 IonicContact NH1-OE1 3.73Å; R375-E401 PolarHBondContact NH1-OE1 3.06Å; R375-E401 IonicContact NH1-OE2 2.66Å; R375-E401 PolarHBondContact NH1-OE2 3.37Å; R375-E401 CarbonylContact O-C 3.58Å; R375-E401 WeakPolarHBondContact O-CA 3.44Å; R375-E401 PolarHBondContact O-N 3.35Å; K399-E401 PolarHBondContact O-N 3.42Å; E401-R426 CarbonylContact O-C 3.43Å; E401-R426 WeakPolarHBondContact O-CA 3.49Å; E401-R426 WeakPolarHBondContact O-CB 3.39Å; E401-R426 PolarHBondContact O-N 3.12Å; E401-R426 IonicContact OE1-NE 3.15Å; E401-S427 PolarHBondContact O-N 3.16Å
402	E	98.9	Very high	98.2	Very high	60 Å²	60	41.5 Å²	41.5	28%	0.28	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	130.4	179.3	176.6	176.2	82.7	0	0	111.2	R375 S376 L377 L400 V404 S427 Y429	R375-E402 PolarHBondContact O-N 3.18Å; S376-E402 WeakPolarHBondContact CA-O 3.41Å; S376-E402 WeakPolarHBondContact CB-OE1 3.49Å; S376-E402 PolarHBondContact OG-OE1 3.32Å; L377-E402 PolarHBondContact N-O 2.78Å; L400-E402 WeakPolarHBondContact CG-O 3.26Å; E402-V404 HydrophobicContact CG-CG2 4.12Å; E402-S427 WeakPolarHBondContact CA-O 3.47Å; E402-Y429 HydrophobicContact CG-CE2 4.23Å
403	L	98.9	Very high	98.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	120.6	174.5	-179.4	55.8	0	0	0	109.9	L377 L390 I393 L400 L405 L419 L425 S427 L428 Y429	L377-L403 HydrophobicContact CB-CD1 4.19Å; L377-L403 HydrophobicContact CD2-CD1 4.26Å; L377-L403 HydrophobicContact CG-CD1 4.19Å; L377-L403 WeakPolarHBondContact O-CA 3.32Å; L390-L403 HydrophobicContact CD2-CD2 4.38Å; I393-L403 HydrophobicContact CD1-CD1 4.15Å; I393-L403 HydrophobicContact CG2-CD2 4.26Å; L400-L403 HydrophobicContact CD2-CB 3.98Å; L400-L403 HydrophobicContact CD2-CD1 4.21Å; L400-L403 HydrophobicContact CD2-CD2 4.42Å; L400-L403 HydrophobicContact CD2-CG 4.43Å; L403-L405 HydrophobicContact CD1-CD1 4.5Å; L403-L405 HydrophobicContact CD1-CD2 4.22Å; L403-L405 HydrophobicContact CD1-CG 4.13Å; L403-L405 HydrophobicContact CD2-CD1 3.9Å; L403-L405 HydrophobicContact CD2-CG 4.41Å; L403-L405 HydrophobicContact CG-CD1 3.94Å; L403-L405 HydrophobicContact CG-CG 3.95Å; L403-L419 HydrophobicContact CD2-CD1 3.82Å; L403-L419 HydrophobicContact CD2-CD2 3.63Å; L403-L419 HydrophobicContact CD2-CG 4.41Å; L403-L425 HydrophobicContact CB-CD1 3.79Å; L403-S427 PolarHBondContact N-O 2.63Å; L403-L428 HydrophobicContact CB-CD1 4.25Å; L403-L428 HydrophobicContact CD2-CD1 4.33Å; L403-L428 HydrophobicContact CG-CD1 4.3Å; L403-L428 WeakPolarHBondContact O-CA 3.34Å; L403-Y429 PolarHBondContact O-N 2.95Å
404	V	98.9	Very high	98.2	Very high	15 Å²	15	43.6 Å²	43.6	9%	0.091	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	119	179.2	-158.3	0	0	0	0	108.9	L377 D378 L379 S380 E402 Y429	L377-V404 PolarHBondContact O-N 2.85Å; D378-V404 HydrophobicContact CB-CB 3.92Å; D378-V404 HydrophobicContact CB-CG2 3.98Å; L379-V404 PolarHBondContact N-O 2.79Å; S380-V404 WeakPolarHBondContact OG-CG1 3.17Å; E402-V404 HydrophobicContact CG-CG2 4.12Å; V404-Y429 HydrophobicContact CB-CD2 4.34Å; V404-Y429 HydrophobicContact CG1-CD2 4.15Å; V404-Y429 HydrophobicContact CG1-CG 4.13Å; V404-Y429 HydrophobicContact CG2-CD2 3.86Å; V404-Y429 HydrophobicContact CG2-CE2 4.26Å
405	L	98.6	Very high	98.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.213	C	C	.	.			trans	-126.3	23.9	-175.2	-67.3	165.5	0	0	0	111.5	L379 L390 L403 R407 C408 L419 L428 Y429 L430 C433	L379-L405 HydrophobicContact CB-CD2 4.2Å; L379-L405 HydrophobicContact CD1-CD2 4.38Å; L390-L405 HydrophobicContact CD1-CD1 3.98Å; L390-L405 HydrophobicContact CD2-CD1 3.71Å; L390-L405 HydrophobicContact CD2-CD2 3.86Å; L390-L405 HydrophobicContact CD2-CG 4.44Å; L403-L405 HydrophobicContact CD1-CD1 4.5Å; L403-L405 HydrophobicContact CD1-CD2 4.22Å; L403-L405 HydrophobicContact CD1-CG 4.13Å; L403-L405 HydrophobicContact CD2-CD1 3.9Å; L403-L405 HydrophobicContact CD2-CG 4.41Å; L403-L405 HydrophobicContact CG-CD1 3.94Å; L403-L405 HydrophobicContact CG-CG 3.95Å; L405-R407 PolarHBondContact O-N 3.1Å; L405-C408 HydrophobicContact CB-CB 4.37Å; L405-C408 VanDerWaalsContact O-CB 3.23Å; L405-C408 WeakPolarHBondContact O-CB 3.32Å; L405-C408 PolarHBondContact O-N 3.29Å; L405-C408 PolarHBondContact O-SG 2.68Å; L405-C408 VanDerWaalsContact O-SG 3.38Å; L405-L419 HydrophobicContact CD1-CD1 4.33Å; L405-L428 HydrophobicContact CD1-CD1 4.31Å; L405-Y429 PolarHBondContact N-O 3.32Å; L405-L430 HydrophobicContact CB-CD2 4.17Å; L405-L430 HydrophobicContact CD1-CD2 3.88Å; L405-C433 PolarHBondContact O-SG 3.06Å
406	D	98.6	Very high	98.2	Very high	16 Å²	16	39.7 Å²	39.7	9%	0.086	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	132.2	-173.1	-63.3	-29.9	0	0	0	110.6	S380 W381 C408 Y429 R431	S380-D406 CarbonylContact C-O 3.49Å; S380-D406 WeakPolarHBondContact CA-O 3.37Å; S380-D406 WeakPolarHBondContact CB-O 3.31Å; S380-D406 PolarHBondContact OG-N 2.76Å; W381-D406 PolarHBondContact N-O 2.77Å; D406-C408 PolarHBondContact O-N 3.45Å; D406-Y429 WeakPolarHBondContact OD1-CB 3.46Å; D406-R431 CarbonylContact C-O 3.59Å; D406-R431 WeakPolarHBondContact CA-O 3.48Å; D406-R431 HydrophobicContact CB-CB 4.21Å; D406-R431 VanDerWaalsContact CG-NE 3.26Å; D406-R431 WeakPolarHBondContact OD1-CB 3.28Å; D406-R431 VanDerWaalsContact OD1-CG 3.26Å; D406-R431 WeakPolarHBondContact OD1-CG 3.11Å; D406-R431 PolarHBondContact OD1-N 2.66Å; D406-R431 IonicContact OD1-NE 3.6Å; D406-R431 PolarHBondContact OD1-NE 3.26Å; D406-R431 VanDerWaalsContact OD1-NE 3.15Å; D406-R431 IonicContact OD2-CZ 2.6Å; D406-R431 IonicContact OD2-NE 3.95Å; D406-R431 PolarHBondContact OD2-NE 3.46Å; D406-R431 IonicContact OD2-NH2 3.2Å; D406-R431 PolarHBondContact OD2-NH2 3.06Å
407	R	98.2	Very high	98.3	Very high	83 Å²	83	38.8 Å²	38.8	31%	0.313	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	16.5	-179	-49.1	-109.9	-172.4	-142.3	-3.8	114.2	W381 L405 V409 R431 W432	W381-R407 HydrophobicContact CD2-CB 3.89Å; W381-R407 HydrophobicContact CD2-CG 3.77Å; W381-R407 HydrophobicContact CE3-CB 3.96Å; W381-R407 HydrophobicContact CE3-CG 3.96Å; W381-R407 HydrophobicContact CG-CB 4.27Å; W381-R407 HydrophobicContact CG-CG 4.44Å; W381-R407 VanDerWaalsContact CH2-CD 3.48Å; W381-R407 HydrophobicContact CH2-CG 4.03Å; W381-R407 HydrophobicContact CZ2-CG 3.81Å; W381-R407 VanDerWaalsContact CZ2-NE 3.3Å; W381-R407 HydrophobicContact CZ3-CB 4.45Å; W381-R407 HydrophobicContact CZ3-CG 4.08Å; L405-R407 PolarHBondContact O-N 3.1Å; R407-V409 PolarHBondContact O-N 2.78Å; R407-R431 PolarHBondContact N-O 3.49Å; R407-W432 HydrophobicContact CG-CB 4.18Å; R407-W432 VanDerWaalsContact CZ-CD1 3.46Å; R407-W432 VanDerWaalsContact CZ-CG 3.42Å
408	C	98.1	Very high	98.3	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.202	C	C	.	.			trans	-73.6	78.6	165.2	-65.1	0	0	0	0	109.5	L379 L405 D406 R410 I411	L379-C408 PolarHBondContact O-SG 3.15Å; L405-C408 HydrophobicContact CB-CB 4.37Å; L405-C408 VanDerWaalsContact O-CB 3.23Å; L405-C408 WeakPolarHBondContact O-CB 3.32Å; L405-C408 PolarHBondContact O-N 3.29Å; L405-C408 PolarHBondContact O-SG 2.68Å; L405-C408 VanDerWaalsContact O-SG 3.38Å; D406-C408 PolarHBondContact O-N 3.45Å; C408-R410 PolarHBondContact O-N 3.18Å; C408-I411 HydrophobicContact CB-CG1 3.7Å; C408-I411 PolarHBondContact O-N 2.97Å; C408-I411 VanDerWaalsContact O-N 3.12Å
409	V	96.3	Very high	98.3	Very high	58 Å²	58	35.5 Å²	35.5	35%	0.352	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-2.9	-170.7	-63.4	0	0	0	0	115.9	R407 Q435	R407-V409 PolarHBondContact O-N 2.78Å; V409-Q435 VanDerWaalsContact O-CD 3.22Å; V409-Q435 WeakPolarHBondContact O-CG 3.48Å; V409-Q435 PolarHBondContact O-NE2 3.01Å
410	R	98	Very high	98.2	Very high	124 Å²	124	32.4 Å²	32.4	47%	0.468	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	9.1	177.9	-52.1	176.1	69.2	-156.5	0.9	113.1	P383 R384 I385 T386 C408	P383-R410 WeakPolarHBondContact O-CD 3.22Å; R384-R410 PolarHBondContact O-NH1 3.09Å; R384-R410 VanDerWaalsContact O-NH1 3.16Å; I385-R410 WeakPolarHBondContact O-CB 3.23Å; T386-R410 HydrophobicContact CG2-CB 4.18Å; T386-R410 VanDerWaalsContact CG2-NH1 3.31Å; C408-R410 PolarHBondContact O-N 3.18Å
411	I	98.4	Very high	98	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.192	C	C	.	.			trans	-81	129.8	167.1	-61.8	-52.8	0	0	0	108.9	I385 T386 D387 L390 C408 V436	I385-I411 HydrophobicContact CG2-CD1 4.2Å; T386-I411 VanDerWaalsContact C-CD1 3.43Å; T386-I411 WeakPolarHBondContact O-CD1 3.23Å; D387-I411 WeakPolarHBondContact OD1-CA 3.26Å; L390-I411 HydrophobicContact CD1-CD1 3.72Å; L390-I411 HydrophobicContact CD1-CG1 4.28Å; L390-I411 HydrophobicContact CD1-CG2 3.71Å; L390-I411 HydrophobicContact CD2-CD1 4.34Å; L390-I411 HydrophobicContact CG-CD1 3.85Å; C408-I411 HydrophobicContact CB-CG1 3.7Å; C408-I411 PolarHBondContact O-N 2.97Å; C408-I411 VanDerWaalsContact O-N 3.12Å; I411-V436 HydrophobicContact CG2-CG2 4.45Å
412	T	98.6	Very high	97.9	Very high	32 Å²	32	34.6 Å²	34.6	20%	0.196	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-119.8	-178.8	179.9	83.1	0	0	0	0	111.1	D387 T414 G415 L416 Q435	D387-T412 PolarHBondContact OD1-N 2.8Å; D387-T412 WeakPolarHBondContact OD2-CB 3.41Å; D387-T412 WeakPolarHBondContact OD2-CG2 3.48Å; D387-T412 PolarHBondContact OD2-OG1 2.81Å; T412-T414 PolarHBondContact O-N 2.97Å; T412-T414 PolarHBondContact OG1-N 3.46Å; T412-T414 PolarHBondContact OG1-OG1 2.75Å; T412-G415 PolarHBondContact O-N 3.01Å; T412-G415 VanDerWaalsContact O-N 3.1Å; T412-L416 PolarHBondContact O-N 3.09Å; T412-Q435 HydrophobicContact CG2-CB 4.17Å
413	D	98.4	Very high	97.7	Very high	18 Å²	18	37 Å²	37	10%	0.096	20%	0.204	C	C	.	.	H	α-helix	trans	-54.2	-30.7	172.6	-60.5	-17.3	0	0	0	113.3	G415 L416 G417 Q437 F439 G440	D413-G415 VanDerWaalsContact C-N 3.34Å; D413-G415 PolarHBondContact O-N 3.38Å; D413-L416 PolarHBondContact O-N 3.38Å; D413-G417 PolarHBondContact O-N 3.34Å; D413-Q437 PolarHBondContact OD1-N 3.17Å; D413-Q437 WeakPolarHBondContact OD2-CB 3.34Å; D413-F439 HydrophobicContact CB-CD1 3.89Å; D413-G440 VanDerWaalsContact CB-CA 3.47Å; D413-G440 VanDerWaalsContact CG-CA 3.42Å; D413-G440 VanDerWaalsContact OD1-CA 3.26Å; D413-G440 WeakPolarHBondContact OD1-CA 3.41Å; D413-G440 PolarHBondContact OD1-N 3.19Å; D413-G440 PolarHBondContact OD2-N 3.47Å
414	T	98.4	Very high	97.6	Very high	82 Å²	82	38.1 Å²	38.1	50%	0.503	21%	0.211	S	C	.	.	H	α-helix	trans	-61.2	-43.7	177.1	-43.1	0	0	0	0	111.2	T412 L416 G417 Y418	T412-T414 PolarHBondContact O-N 2.97Å; T412-T414 PolarHBondContact OG1-N 3.46Å; T412-T414 PolarHBondContact OG1-OG1 2.75Å; T414-L416 VanDerWaalsContact C-N 3.34Å; T414-L416 PolarHBondContact O-N 3.12Å; T414-G417 WeakPolarHBondContact O-CA 3.49Å; T414-G417 PolarHBondContact O-N 3.13Å; T414-Y418 HydrophobicContact CG2-CE2 4.2Å; T414-Y418 PolarHBondContact O-N 2.86Å
415	G	98.3	Very high	97.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.5	-39.7	177.5	0	0	0	0	0	112.9	D387 T412 D413 G417 Y418 L419	D387-G415 VanDerWaalsContact CG-N 3.3Å; D387-G415 VanDerWaalsContact OD1-CA 3.24Å; D387-G415 WeakPolarHBondContact OD1-CA 3.29Å; D387-G415 PolarHBondContact OD1-N 3.44Å; D387-G415 VanDerWaalsContact OD1-N 3.12Å; T412-G415 PolarHBondContact O-N 3.01Å; T412-G415 VanDerWaalsContact O-N 3.1Å; D413-G415 VanDerWaalsContact C-N 3.34Å; D413-G415 PolarHBondContact O-N 3.38Å; G415-G417 VanDerWaalsContact C-N 3.27Å; G415-G417 PolarHBondContact O-N 3.41Å; G415-Y418 PolarHBondContact O-N 3.05Å; G415-L419 PolarHBondContact O-N 2.98Å
416	L	98.3	Very high	97.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.9	-30.9	172.9	-57.4	-171	0	0	0	112.3	T412 D413 T414 Y418 L419 S420 L430 V436 L444	T412-L416 PolarHBondContact O-N 3.09Å; D413-L416 PolarHBondContact O-N 3.38Å; T414-L416 VanDerWaalsContact C-N 3.34Å; T414-L416 PolarHBondContact O-N 3.12Å; L416-Y418 PolarHBondContact O-N 3.04Å; L416-L419 HydrophobicContact CD2-CD1 4.17Å; L416-L419 PolarHBondContact O-N 3.27Å; L416-S420 PolarHBondContact O-N 3.21Å; L416-L430 HydrophobicContact CD1-CD1 4.23Å; L416-L430 HydrophobicContact CD2-CD1 3.7Å; L416-L430 HydrophobicContact CD2-CD2 3.93Å; L416-L430 HydrophobicContact CD2-CG 4.48Å; L416-V436 HydrophobicContact CD1-CG1 3.58Å; L416-V436 HydrophobicContact CD1-CG2 4.18Å; L416-L444 HydrophobicContact CB-CD2 4.16Å; L416-L444 HydrophobicContact CD1-CD1 4.19Å; L416-L444 HydrophobicContact CD1-CG 4.45Å; L416-L444 HydrophobicContact CD2-CD2 4.47Å
417	G	98.3	Very high	97.6	Very high	17 Å²	17	43.5 Å²	43.5	18%	0.175	23%	0.232	C	C	.	.	H	α-helix	trans	-53.4	-47.9	168.3	0	0	0	0	0	112.6	D413 T414 G415 S420	D413-G417 PolarHBondContact O-N 3.34Å; T414-G417 WeakPolarHBondContact O-CA 3.49Å; T414-G417 PolarHBondContact O-N 3.13Å; G415-G417 VanDerWaalsContact C-N 3.27Å; G415-G417 PolarHBondContact O-N 3.41Å; G417-S420 PolarHBondContact O-OG 3.41Å
418	Y	98.3	Very high	97.6	Very high	72 Å²	72	39.5 Å²	39.5	28%	0.282	22%	0.218	S	C	.	.	H	α-helix	trans	-65.2	-47.1	175.9	-60.7	-57.6	0	0	0	112.5	D387 E391 A394 T414 G415 L416 S420 T421	D387-Y418 HydrophobicContact CB-CE2 4.44Å; E391-Y418 HydrophobicContact CB-CD1 4.08Å; E391-Y418 HydrophobicContact CB-CD2 3.78Å; E391-Y418 HydrophobicContact CB-CE1 4.04Å; E391-Y418 HydrophobicContact CB-CE2 3.75Å; E391-Y418 HydrophobicContact CB-CG 3.95Å; E391-Y418 HydrophobicContact CG-CD1 3.91Å; E391-Y418 HydrophobicContact CG-CD2 4.47Å; E391-Y418 HydrophobicContact CG-CE1 3.68Å; E391-Y418 HydrophobicContact CG-CE2 4.29Å; E391-Y418 HydrophobicContact CG-CG 4.3Å; E391-Y418 PolarHBondContact OE2-OH 3.18Å; A394-Y418 WeakPolarHBondContact CB-O 3.37Å; T414-Y418 HydrophobicContact CG2-CE2 4.2Å; T414-Y418 PolarHBondContact O-N 2.86Å; G415-Y418 PolarHBondContact O-N 3.05Å; L416-Y418 PolarHBondContact O-N 3.04Å; Y418-S420 PolarHBondContact O-N 2.91Å; Y418-S420 VanDerWaalsContact O-N 3.17Å; Y418-T421 PolarHBondContact O-N 2.64Å; Y418-T421 PolarHBondContact O-OG1 2.98Å
419	L	97.6	Very high	97.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-26.5	-179.3	-64	-175.4	0	0	0	113.5	L390 I393 L403 L405 G415 L416 T421 M422 L428 M447	L390-L419 HydrophobicContact CB-CD2 4.14Å; L390-L419 HydrophobicContact CB-CG 4.27Å; L390-L419 HydrophobicContact CD1-CD1 3.98Å; L390-L419 HydrophobicContact CD1-CG 4.19Å; L390-L419 HydrophobicContact CD2-CD2 4.44Å; I393-L419 HydrophobicContact CG2-CD2 4.36Å; L403-L419 HydrophobicContact CD2-CD1 3.82Å; L403-L419 HydrophobicContact CD2-CD2 3.63Å; L403-L419 HydrophobicContact CD2-CG 4.41Å; L405-L419 HydrophobicContact CD1-CD1 4.33Å; G415-L419 PolarHBondContact O-N 2.98Å; L416-L419 HydrophobicContact CD2-CD1 4.17Å; L416-L419 PolarHBondContact O-N 3.27Å; L419-T421 PolarHBondContact O-N 2.75Å; L419-M422 HydrophobicContact CD2-SD 3.61Å; L419-M422 WeakPolarHBondContact O-CB 3.47Å; L419-M422 WeakPolarHBondContact O-CG 3.43Å; L419-M422 PolarHBondContact O-N 3.02Å; L419-L428 HydrophobicContact CD1-CD1 4Å; L419-L428 HydrophobicContact CD1-CD2 4.26Å; L419-M447 VanDerWaalsContact O-CE 3.23Å; L419-M447 WeakPolarHBondContact O-CE 3.43Å
420	S	95.4	Very high	97.7	Very high	44 Å²	44	38.8 Å²	38.8	31%	0.308	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-20.2	177.5	74.1	0	0	0	0	114.8	L416 G417 Y418 H443	L416-S420 PolarHBondContact O-N 3.21Å; G417-S420 PolarHBondContact O-OG 3.41Å; Y418-S420 PolarHBondContact O-N 2.91Å; Y418-S420 VanDerWaalsContact O-N 3.17Å; S420-H443 WeakPolarHBondContact CB-O 3.4Å
421	T	94.8	Very high	97.8	Very high	98 Å²	98	36.2 Å²	36.2	60%	0.601	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-14.7	176.8	66	0	0	0	0	113.8	Y418 L419 S423	Y418-T421 PolarHBondContact O-N 2.64Å; Y418-T421 PolarHBondContact O-OG1 2.98Å; L419-T421 PolarHBondContact O-N 2.75Å; T421-S423 PolarHBondContact O-N 3.12Å; T421-S423 VanDerWaalsContact O-N 3.15Å
422	M	96.3	Very high	97.7	Very high	8 Å²	8	41.1 Å²	41.1	4%	0.039	22%	0.218	C	C	.	.			trans	-82.3	94.4	-171.9	-60.3	-171.3	79.9	0	0	112.7	I393 A394 L397 L400 L419 S424 L425	I393-M422 HydrophobicContact CG2-CE 3.78Å; I393-M422 HydrophobicContact CG2-SD 3.86Å; A394-M422 HydrophobicContact CB-CG 4.03Å; A394-M422 HydrophobicContact CB-SD 4.3Å; L397-M422 WeakPolarHBondContact O-CE 3.48Å; L400-M422 HydrophobicContact CB-CE 3.82Å; L400-M422 HydrophobicContact CD2-CE 4.11Å; L419-M422 HydrophobicContact CD2-SD 3.61Å; L419-M422 WeakPolarHBondContact O-CB 3.47Å; L419-M422 WeakPolarHBondContact O-CG 3.43Å; L419-M422 PolarHBondContact O-N 3.02Å; M422-S424 PolarHBondContact O-N 2.73Å; M422-L425 HydrophobicContact CB-CB 4.1Å; M422-L425 PolarHBondContact O-N 3.08Å
423	S	94.8	Very high	97.7	Very high	110 Å²	110	39.6 Å²	39.6	77%	0.769	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-8.4	178.4	59.8	0	0	0	0	115.7	T421 S449	T421-S423 PolarHBondContact O-N 3.12Å; T421-S423 VanDerWaalsContact O-N 3.15Å; S423-S449 VanDerWaalsContact O-CB 3.22Å; S423-S449 WeakPolarHBondContact O-CB 3.42Å; S423-S449 PolarHBondContact O-OG 3.04Å
424	S	97	Very high	97.6	Very high	23 Å²	23	41 Å²	41	16%	0.161	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-19.4	176.3	58.2	0	0	0	0	113.8	H398 L400 M422 R426	H398-S424 WeakPolarHBondContact O-CB 3.47Å; H398-S424 PolarHBondContact O-OG 3.01Å; L400-S424 PolarHBondContact N-OG 3.2Å; L400-S424 CarbonylContact O-C 3.21Å; L400-S424 VanDerWaalsContact O-CB 3.29Å; L400-S424 WeakPolarHBondContact O-CB 3.5Å; L400-S424 PolarHBondContact O-OG 3.13Å; M422-S424 PolarHBondContact O-N 2.73Å; S424-R426 PolarHBondContact O-N 3.28Å
425	L	98.4	Very high	97.5	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.215	C	C	.	.			trans	-73.5	126.5	-168.3	-164	71.8	0	0	0	111	L400 L403 M422 L428 M447 S449 L450	L400-L425 HydrophobicContact CD2-CD1 4.33Å; L400-L425 HydrophobicContact CG-CD1 4.34Å; L400-L425 WeakPolarHBondContact O-CA 3.43Å; L400-L425 PolarHBondContact O-N 2.66Å; L403-L425 HydrophobicContact CB-CD1 3.79Å; M422-L425 HydrophobicContact CB-CB 4.1Å; M422-L425 PolarHBondContact O-N 3.08Å; L425-L428 HydrophobicContact CD2-CB 4.21Å; L425-L428 HydrophobicContact CD2-CD1 4.37Å; L425-L428 HydrophobicContact CD2-CD2 4.4Å; L425-M447 HydrophobicContact CB-CE 4.06Å; L425-M447 HydrophobicContact CD2-CE 3.93Å; L425-S449 CarbonylContact O-C 3.23Å; L425-S449 VanDerWaalsContact O-C 3.23Å; L425-S449 VanDerWaalsContact O-CB 3.23Å; L425-S449 WeakPolarHBondContact O-CB 3.18Å; L425-S449 PolarHBondContact O-OG 3.31Å; L425-L450 PolarHBondContact O-N 3.41Å
426	R	98.4	Very high	97.5	Very high	121 Å²	121	41.3 Å²	41.3	46%	0.457	22%	0.215	S	C	.	.			trans	-114	-38.7	-176.9	-64.2	171.8	-179.5	-94.2	-1.5	112.2	E401 S424 S449 R451 L452	E401-R426 CarbonylContact O-C 3.43Å; E401-R426 WeakPolarHBondContact O-CA 3.49Å; E401-R426 WeakPolarHBondContact O-CB 3.39Å; E401-R426 PolarHBondContact O-N 3.12Å; E401-R426 IonicContact OE1-NE 3.15Å; S424-R426 PolarHBondContact O-N 3.28Å; R426-S449 WeakPolarHBondContact CA-O 3.43Å; R426-R451 HydrophobicContact CB-CG 4.47Å; R426-R451 WeakPolarHBondContact O-CA 3.45Å; R426-R451 PolarHBondContact O-N 3.05Å; R426-L452 PolarHBondContact O-N 2.99Å
427	S	98.8	Very high	97.5	Very high	23 Å²	23	46 Å²	46	16%	0.161	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	121.6	-177.7	-56.2	0	0	0	0	109.9	E401 E402 L403 L452	E401-S427 PolarHBondContact O-N 3.16Å; E402-S427 WeakPolarHBondContact CA-O 3.47Å; L403-S427 PolarHBondContact N-O 2.63Å; S427-L452 WeakPolarHBondContact CA-O 3.14Å
428	L	98.8	Very high	97.5	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	118.5	177.1	179.2	56.9	0	0	0	109.8	L403 L405 L419 L425 L430 L444 L450 L452 L453 S454	L403-L428 HydrophobicContact CB-CD1 4.25Å; L403-L428 HydrophobicContact CD2-CD1 4.33Å; L403-L428 HydrophobicContact CG-CD1 4.3Å; L403-L428 WeakPolarHBondContact O-CA 3.34Å; L405-L428 HydrophobicContact CD1-CD1 4.31Å; L419-L428 HydrophobicContact CD1-CD1 4Å; L419-L428 HydrophobicContact CD1-CD2 4.26Å; L425-L428 HydrophobicContact CD2-CB 4.21Å; L425-L428 HydrophobicContact CD2-CD1 4.37Å; L425-L428 HydrophobicContact CD2-CD2 4.4Å; L428-L430 HydrophobicContact CD1-CD1 4.48Å; L428-L430 HydrophobicContact CD1-CD2 4.29Å; L428-L430 HydrophobicContact CD1-CG 4.13Å; L428-L430 HydrophobicContact CD2-CD1 3.95Å; L428-L430 HydrophobicContact CD2-CG 4.47Å; L428-L430 HydrophobicContact CG-CD1 3.99Å; L428-L430 HydrophobicContact CG-CG 4.02Å; L428-L444 HydrophobicContact CD2-CD1 4.24Å; L428-L444 HydrophobicContact CD2-CD2 4.13Å; L428-L450 HydrophobicContact CB-CD1 3.92Å; L428-L452 PolarHBondContact N-O 3.47Å; L428-L453 HydrophobicContact CB-CD1 4.22Å; L428-L453 HydrophobicContact CD2-CD1 4.29Å; L428-L453 HydrophobicContact CG-CD1 4.25Å; L428-L453 WeakPolarHBondContact O-CA 3.49Å; L428-S454 PolarHBondContact O-N 3.42Å
429	Y	98.8	Very high	97.4	Very high	42 Å²	42	49 Å²	49	17%	0.165	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	122.4	176.2	-53.3	-102.7	0	0	0	109.7	E402 L403 V404 L405 D406 L452	E402-Y429 HydrophobicContact CG-CE2 4.23Å; L403-Y429 PolarHBondContact O-N 2.95Å; V404-Y429 HydrophobicContact CB-CD2 4.34Å; V404-Y429 HydrophobicContact CG1-CD2 4.15Å; V404-Y429 HydrophobicContact CG1-CG 4.13Å; V404-Y429 HydrophobicContact CG2-CD2 3.86Å; V404-Y429 HydrophobicContact CG2-CE2 4.26Å; L405-Y429 PolarHBondContact N-O 3.32Å; D406-Y429 WeakPolarHBondContact OD1-CB 3.46Å; Y429-L452 HydrophobicContact CD1-CD2 3.86Å; Y429-L452 HydrophobicContact CD2-CD2 4.37Å; Y429-L452 HydrophobicContact CE1-CD1 4.24Å; Y429-L452 HydrophobicContact CE1-CD2 3.4Å; Y429-L452 HydrophobicContact CE1-CG 4.49Å; Y429-L452 HydrophobicContact CE2-CD2 3.99Å; Y429-L452 HydrophobicContact CG-CD2 4.33Å; Y429-L452 VanDerWaalsContact CZ-CD2 3.49Å
430	L	98.4	Very high	97.4	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.			trans	-125.5	30.1	-177	-67.9	163.5	0	0	0	110.4	L405 L416 L428 W432 C433 L453 S454 L455 C458	L405-L430 HydrophobicContact CB-CD2 4.17Å; L405-L430 HydrophobicContact CD1-CD2 3.88Å; L416-L430 HydrophobicContact CD1-CD1 4.23Å; L416-L430 HydrophobicContact CD2-CD1 3.7Å; L416-L430 HydrophobicContact CD2-CD2 3.93Å; L416-L430 HydrophobicContact CD2-CG 4.48Å; L428-L430 HydrophobicContact CD1-CD1 4.48Å; L428-L430 HydrophobicContact CD1-CD2 4.29Å; L428-L430 HydrophobicContact CD1-CG 4.13Å; L428-L430 HydrophobicContact CD2-CD1 3.95Å; L428-L430 HydrophobicContact CD2-CG 4.47Å; L428-L430 HydrophobicContact CG-CD1 3.99Å; L428-L430 HydrophobicContact CG-CG 4.02Å; L430-W432 PolarHBondContact O-N 3.15Å; L430-C433 HydrophobicContact CB-CB 4.25Å; L430-C433 VanDerWaalsContact O-CB 3.26Å; L430-C433 WeakPolarHBondContact O-CB 3.38Å; L430-C433 PolarHBondContact O-N 3.4Å; L430-C433 PolarHBondContact O-SG 3.27Å; L430-L453 HydrophobicContact CD1-CD1 4.46Å; L430-S454 PolarHBondContact N-O 3.06Å; L430-L455 HydrophobicContact CB-CD2 4.25Å; L430-L455 HydrophobicContact CD1-CD2 3.86Å; L430-C458 PolarHBondContact O-SG 3.29Å
431	R	98.5	Very high	97.5	Very high	71 Å²	71	46.9 Å²	46.9	27%	0.268	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	128.8	-168.9	-59.4	-179.9	-83.2	-143.7	-2.3	110	D406 R407 C433 S454 A456 E479	D406-R431 CarbonylContact C-O 3.59Å; D406-R431 WeakPolarHBondContact CA-O 3.48Å; D406-R431 HydrophobicContact CB-CB 4.21Å; D406-R431 VanDerWaalsContact CG-NE 3.26Å; D406-R431 WeakPolarHBondContact OD1-CB 3.28Å; D406-R431 VanDerWaalsContact OD1-CG 3.26Å; D406-R431 WeakPolarHBondContact OD1-CG 3.11Å; D406-R431 PolarHBondContact OD1-N 2.66Å; D406-R431 IonicContact OD1-NE 3.6Å; D406-R431 PolarHBondContact OD1-NE 3.26Å; D406-R431 VanDerWaalsContact OD1-NE 3.15Å; D406-R431 IonicContact OD2-CZ 2.6Å; D406-R431 IonicContact OD2-NE 3.95Å; D406-R431 PolarHBondContact OD2-NE 3.46Å; D406-R431 IonicContact OD2-NH2 3.2Å; D406-R431 PolarHBondContact OD2-NH2 3.06Å; R407-R431 PolarHBondContact N-O 3.49Å; R431-C433 PolarHBondContact O-N 3.23Å; R431-S454 VanDerWaalsContact CD-OG 3.25Å; R431-S454 WeakPolarHBondContact CD-OG 3.5Å; R431-S454 WeakPolarHBondContact CG-OG 3.33Å; R431-A456 CarbonylContact C-O 3.57Å; R431-A456 WeakPolarHBondContact CA-O 3.42Å; R431-A456 HydrophobicContact CB-CB 4.46Å; R431-A456 HydrophobicContact CG-CB 3.96Å; R431-E479 WeakPolarHBondContact CD-OE2 3.48Å; R431-E479 IonicContact NH1-OE2 3.54Å; R431-E479 PolarHBondContact NH1-OE2 2.88Å
432	W	98	Very high	97.6	Very high	102 Å²	102	47.5 Å²	47.5	39%	0.386	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	60	23.6	-176.2	-48.9	87.3	0	0	0	114.6	R407 L430 C434 A456	R407-W432 HydrophobicContact CG-CB 4.18Å; R407-W432 VanDerWaalsContact CZ-CD1 3.46Å; R407-W432 VanDerWaalsContact CZ-CG 3.42Å; L430-W432 PolarHBondContact O-N 3.15Å; W432-C434 PolarHBondContact O-N 3Å; W432-A456 PolarHBondContact N-O 2.74Å
433	C	97.8	Very high	97.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.241	C	C	.	.			trans	-71	81.8	165.4	-73.6	0	0	0	0	109.8	L405 L430 R431 Q435 V436	L405-C433 PolarHBondContact O-SG 3.06Å; L430-C433 HydrophobicContact CB-CB 4.25Å; L430-C433 VanDerWaalsContact O-CB 3.26Å; L430-C433 WeakPolarHBondContact O-CB 3.38Å; L430-C433 PolarHBondContact O-N 3.4Å; L430-C433 PolarHBondContact O-SG 3.27Å; R431-C433 PolarHBondContact O-N 3.23Å; C433-Q435 PolarHBondContact O-N 3.35Å; C433-V436 HydrophobicContact CB-CG2 3.84Å; C433-V436 PolarHBondContact O-N 3.21Å
434	C	95.9	Very high	97.7	Very high	48 Å²	48	44.9 Å²	44.9	32%	0.324	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-2.9	-164.5	62.6	0	0	0	0	116.7	W432 P459 L460	W432-C434 PolarHBondContact O-N 3Å; C434-P459 HydrophobicContact CB-CG 4.22Å; C434-L460 WeakPolarHBondContact O-CD1 3.28Å
435	Q	97.6	Very high	97.6	Very high	89 Å²	89	45.4 Å²	45.4	42%	0.416	20%	0.204	S	C	.	.	B	Isolated β-bridge	trans	-108.8	-0.5	178.5	-59.4	-174.3	3.6	0	0	113.5	V409 T412 C433	V409-Q435 VanDerWaalsContact O-CD 3.22Å; V409-Q435 WeakPolarHBondContact O-CG 3.48Å; V409-Q435 PolarHBondContact O-NE2 3.01Å; T412-Q435 HydrophobicContact CG2-CB 4.17Å; C433-Q435 PolarHBondContact O-N 3.35Å
436	V	97.9	Very high	97.2	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.233	C	C	.	.			trans	-77.9	131.5	173.1	174.3	0	0	0	0	110	I411 L416 C433 L461	I411-V436 HydrophobicContact CG2-CG2 4.45Å; L416-V436 HydrophobicContact CD1-CG1 3.58Å; L416-V436 HydrophobicContact CD1-CG2 4.18Å; C433-V436 HydrophobicContact CB-CG2 3.84Å; C433-V436 PolarHBondContact O-N 3.21Å; V436-L461 HydrophobicContact CG1-CD2 4.27Å
437	Q	97.9	Very high	97	Very high	99 Å²	99	42.8 Å²	42.8	46%	0.463	21%	0.213	S	C	.	.	B	Isolated β-bridge	trans	-127.4	178.6	-175.9	-46	-177.9	43.1	0	0	111	D413 F439 G440 L441 L460 L461	D413-Q437 PolarHBondContact OD1-N 3.17Å; D413-Q437 WeakPolarHBondContact OD2-CB 3.34Å; Q437-F439 PolarHBondContact O-N 2.94Å; Q437-F439 VanDerWaalsContact O-N 3.13Å; Q437-G440 PolarHBondContact O-N 3.4Å; Q437-L441 PolarHBondContact O-N 2.96Å; Q437-L460 HydrophobicContact CG-CB 3.95Å; Q437-L460 HydrophobicContact CG-CD1 3.82Å; Q437-L461 VanDerWaalsContact C-CD2 3.47Å
438	D	97.8	Very high	96.7	Very high	33 Å²	33	52 Å²	52	18%	0.176	25%	0.245	C	C	.	.	H	α-helix	trans	-55.1	-29.6	179	-70.5	0.7	0	0	0	113.8	Q442 L461 T462 G465	D438-Q442 WeakPolarHBondContact O-CG 3.45Å; D438-L461 WeakPolarHBondContact OD1-CA 3.46Å; D438-T462 PolarHBondContact OD1-N 2.85Å; D438-T462 WeakPolarHBondContact OD2-CB 3.47Å; D438-T462 WeakPolarHBondContact OD2-CG2 3.36Å; D438-T462 PolarHBondContact OD2-OG1 3.46Å; D438-G465 PolarHBondContact OD2-N 3.47Å; D438-G465 VanDerWaalsContact OD2-N 3.13Å
439	F	97.3	Very high	96.6	Very high	117 Å²	117	53.3 Å²	53.3	51%	0.513	25%	0.253	S	S	.	.	H	α-helix	trans	-70.9	-39.2	177.6	-179.8	-102.7	0	0	0	111.7	D413 Q437 L441 Q442 H443	D413-F439 HydrophobicContact CB-CD1 3.89Å; Q437-F439 PolarHBondContact O-N 2.94Å; Q437-F439 VanDerWaalsContact O-N 3.13Å; F439-L441 VanDerWaalsContact C-N 3.29Å; F439-L441 PolarHBondContact O-N 3.41Å; F439-Q442 VanDerWaalsContact O-CB 3.32Å; F439-Q442 WeakPolarHBondContact O-CB 3.42Å; F439-Q442 PolarHBondContact O-N 3.16Å; F439-H443 AromaticContact CE1-NE2 3.49Å; F439-H443 WeakPolarHBondContact CE1-NE2 3.43Å; F439-H443 AromaticContact CZ-NE2 3.81Å
440	G	96.9	Very high	96.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.9	-37.5	174.6	0	0	0	0	0	113.1	D413 Q437 Q442 H443	D413-G440 VanDerWaalsContact CB-CA 3.47Å; D413-G440 VanDerWaalsContact CG-CA 3.42Å; D413-G440 VanDerWaalsContact OD1-CA 3.26Å; D413-G440 WeakPolarHBondContact OD1-CA 3.41Å; D413-G440 PolarHBondContact OD1-N 3.19Å; D413-G440 PolarHBondContact OD2-N 3.47Å; Q437-G440 PolarHBondContact O-N 3.4Å; G440-Q442 VanDerWaalsContact C-N 3.25Å; G440-Q442 PolarHBondContact O-N 3.17Å; G440-H443 PolarHBondContact O-N 3.29Å
441	L	97.3	Very high	96.5	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.3	-29.6	175.1	-60.4	-173.1	0	0	0	112.9	Q437 F439 H443 L444 F445 L455 L461 L466	Q437-L441 PolarHBondContact O-N 2.96Å; F439-L441 VanDerWaalsContact C-N 3.29Å; F439-L441 PolarHBondContact O-N 3.41Å; L441-H443 PolarHBondContact O-N 2.85Å; L441-L444 HydrophobicContact CD2-CD1 4.21Å; L441-L444 PolarHBondContact O-N 3.48Å; L441-F445 HydrophobicContact CB-CE1 4.03Å; L441-F445 HydrophobicContact CB-CZ 4.22Å; L441-F445 WeakPolarHBondContact O-CD1 3.4Å; L441-F445 VanDerWaalsContact O-CE1 3.26Å; L441-F445 WeakPolarHBondContact O-CE1 3.46Å; L441-F445 PolarHBondContact O-N 3.12Å; L441-L455 HydrophobicContact CD1-CD1 4.5Å; L441-L455 HydrophobicContact CD2-CD1 3.85Å; L441-L455 HydrophobicContact CD2-CD2 3.95Å; L441-L461 HydrophobicContact CD1-CD1 4.35Å; L441-L461 HydrophobicContact CD1-CD2 3.75Å; L441-L461 HydrophobicContact CD2-CD2 4.33Å; L441-L461 HydrophobicContact CG-CD2 3.89Å; L441-L466 HydrophobicContact CD1-CD2 4Å
442	Q	96.5	Very high	96.5	Very high	112 Å²	112	51.2 Å²	51.2	52%	0.523	25%	0.246	S	C	.	.	H	α-helix	trans	-62.5	-32.6	180	-59.3	-178.9	13.7	0	0	112.4	D438 F439 G440 L444 F445	D438-Q442 WeakPolarHBondContact O-CG 3.45Å; F439-Q442 VanDerWaalsContact O-CB 3.32Å; F439-Q442 WeakPolarHBondContact O-CB 3.42Å; F439-Q442 PolarHBondContact O-N 3.16Å; G440-Q442 VanDerWaalsContact C-N 3.25Å; G440-Q442 PolarHBondContact O-N 3.17Å; Q442-L444 VanDerWaalsContact C-N 3.32Å; Q442-F445 HydrophobicContact CB-CD2 4.35Å; Q442-F445 HydrophobicContact CB-CE2 4.17Å; Q442-F445 HydrophobicContact CG-CE2 3.92Å; Q442-F445 HydrophobicContact CG-CZ 4.47Å
443	H	96.6	Very high	96.5	Very high	62 Å²	62	46.3 Å²	46.3	29%	0.287	23%	0.228	S	C	.	.	H	α-helix	trans	-66.3	-34.6	174	-65.5	-64.3	0	0	0	112.2	S420 F439 G440 L441	S420-H443 WeakPolarHBondContact CB-O 3.4Å; F439-H443 AromaticContact CE1-NE2 3.49Å; F439-H443 WeakPolarHBondContact CE1-NE2 3.43Å; F439-H443 AromaticContact CZ-NE2 3.81Å; G440-H443 PolarHBondContact O-N 3.29Å; L441-H443 PolarHBondContact O-N 2.85Å
444	L	96.3	Very high	96.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-74.6	-25.8	-177.4	-54.9	-175.5	0	0	0	113.2	L416 L428 L441 Q442 G446 M447 L453 L472	L416-L444 HydrophobicContact CB-CD2 4.16Å; L416-L444 HydrophobicContact CD1-CD1 4.19Å; L416-L444 HydrophobicContact CD1-CG 4.45Å; L416-L444 HydrophobicContact CD2-CD2 4.47Å; L428-L444 HydrophobicContact CD2-CD1 4.24Å; L428-L444 HydrophobicContact CD2-CD2 4.13Å; L441-L444 HydrophobicContact CD2-CD1 4.21Å; L441-L444 PolarHBondContact O-N 3.48Å; Q442-L444 VanDerWaalsContact C-N 3.32Å; L444-G446 PolarHBondContact O-N 2.98Å; L444-M447 HydrophobicContact CB-SD 4.4Å; L444-M447 HydrophobicContact CD2-SD 3.58Å; L444-M447 VanDerWaalsContact CD2-SD 3.58Å; L444-M447 VanDerWaalsContact O-CB 3.31Å; L444-M447 WeakPolarHBondContact O-CB 3.49Å; L444-M447 WeakPolarHBondContact O-CG 3.37Å; L444-M447 PolarHBondContact O-N 3.47Å; L444-L453 HydrophobicContact CD1-CD1 4.31Å; L444-L453 HydrophobicContact CD1-CD2 4.44Å; L444-L472 WeakPolarHBondContact O-CD2 3.48Å
445	F	94.6	Very high	96.6	Very high	35 Å²	35	44.1 Å²	44.1	15%	0.154	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.6	-174.6	-60.2	-22.5	0	0	0	114.9	L441 Q442 G468 L469 Q471	L441-F445 HydrophobicContact CB-CE1 4.03Å; L441-F445 HydrophobicContact CB-CZ 4.22Å; L441-F445 WeakPolarHBondContact O-CD1 3.4Å; L441-F445 VanDerWaalsContact O-CE1 3.26Å; L441-F445 WeakPolarHBondContact O-CE1 3.46Å; L441-F445 PolarHBondContact O-N 3.12Å; Q442-F445 HydrophobicContact CB-CD2 4.35Å; Q442-F445 HydrophobicContact CB-CE2 4.17Å; Q442-F445 HydrophobicContact CG-CE2 3.92Å; Q442-F445 HydrophobicContact CG-CZ 4.47Å; F445-G468 WeakPolarHBondContact CE1-O 3.24Å; F445-L469 HydrophobicContact CD1-CD2 4.41Å; F445-L469 HydrophobicContact CE1-CD2 4.03Å; F445-L469 HydrophobicContact CE1-CG 4.4Å; F445-Q471 HydrophobicContact CB-CB 4.02Å; F445-Q471 HydrophobicContact CG-CB 4.38Å
446	G	90.9	Very high	96.7	Very high	59 Å²	59	40 Å²	40	61%	0.608	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-11.6	175.3	0	0	0	0	0	115.6	L444 R448	L444-G446 PolarHBondContact O-N 2.98Å; G446-R448 PolarHBondContact O-N 2.76Å
447	M	95.1	Very high	96.6	Very high	7 Å²	7	40.2 Å²	40.2	3%	0.034	20%	0.197	C	C	.	.			trans	-81	76.6	-167.8	-61.5	-175.3	75.7	0	0	113.1	L419 L425 L444 S449 L450	L419-M447 VanDerWaalsContact O-CE 3.23Å; L419-M447 WeakPolarHBondContact O-CE 3.43Å; L425-M447 HydrophobicContact CB-CE 4.06Å; L425-M447 HydrophobicContact CD2-CE 3.93Å; L444-M447 HydrophobicContact CB-SD 4.4Å; L444-M447 HydrophobicContact CD2-SD 3.58Å; L444-M447 VanDerWaalsContact CD2-SD 3.58Å; L444-M447 VanDerWaalsContact O-CB 3.31Å; L444-M447 WeakPolarHBondContact O-CB 3.49Å; L444-M447 WeakPolarHBondContact O-CG 3.37Å; L444-M447 PolarHBondContact O-N 3.47Å; M447-S449 PolarHBondContact O-N 2.59Å; M447-S449 VanDerWaalsContact O-N 3.11Å; M447-L450 HydrophobicContact CB-CB 4.28Å; M447-L450 VanDerWaalsContact O-CB 3.32Å; M447-L450 WeakPolarHBondContact O-CB 3.41Å; M447-L450 PolarHBondContact O-N 2.88Å
448	R	92.3	Very high	96.6	Very high	217 Å²	217	35.5 Å²	35.5	82%	0.819	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63	-14.9	-179.3	-60.8	179.1	-174.8	-110.8	-1.9	115.3	G446 R451	G446-R448 PolarHBondContact O-N 2.76Å; R448-R451 PolarHBondContact O-NH1 3.08Å
449	S	95.4	Very high	96.5	Very high	26 Å²	26	37 Å²	37	18%	0.182	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-20.1	174.7	53.9	0	0	0	0	113.1	S423 L425 R426 M447 R451	S423-S449 VanDerWaalsContact O-CB 3.22Å; S423-S449 WeakPolarHBondContact O-CB 3.42Å; S423-S449 PolarHBondContact O-OG 3.04Å; L425-S449 CarbonylContact O-C 3.23Å; L425-S449 VanDerWaalsContact O-C 3.23Å; L425-S449 VanDerWaalsContact O-CB 3.23Å; L425-S449 WeakPolarHBondContact O-CB 3.18Å; L425-S449 PolarHBondContact O-OG 3.31Å; R426-S449 WeakPolarHBondContact CA-O 3.43Å; M447-S449 PolarHBondContact O-N 2.59Å; M447-S449 VanDerWaalsContact O-N 3.11Å; S449-R451 PolarHBondContact O-NH1 3.1Å
450	L	97.3	Very high	96.6	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.182	C	C	.	.			trans	-66.1	140.4	-176.7	-152.4	70.3	0	0	0	110.4	L425 L428 M447 L453 L472 L475	L425-L450 PolarHBondContact O-N 3.41Å; L428-L450 HydrophobicContact CB-CD1 3.92Å; M447-L450 HydrophobicContact CB-CB 4.28Å; M447-L450 VanDerWaalsContact O-CB 3.32Å; M447-L450 WeakPolarHBondContact O-CB 3.41Å; M447-L450 PolarHBondContact O-N 2.88Å; L450-L453 HydrophobicContact CD2-CB 3.98Å; L450-L453 HydrophobicContact CD2-CD1 4.34Å; L450-L453 HydrophobicContact CD2-CD2 4.28Å; L450-L453 HydrophobicContact CD2-CG 4.43Å; L450-L472 HydrophobicContact CD2-CD1 4.15Å; L450-L475 HydrophobicContact CD2-CD1 4.34Å; L450-L475 HydrophobicContact CG-CD1 4.3Å
451	R	97.9	Very high	96.6	Very high	50 Å²	50	35.4 Å²	35.4	19%	0.189	18%	0.182	C	C	.	.			trans	-131.6	-39	-177.2	-65.3	-53.6	-172.6	-101.4	17.3	111.5	R426 R448 S449 E474 L475 E476 E477	R426-R451 HydrophobicContact CB-CG 4.47Å; R426-R451 WeakPolarHBondContact O-CA 3.45Å; R426-R451 PolarHBondContact O-N 3.05Å; R448-R451 PolarHBondContact O-NH1 3.08Å; S449-R451 PolarHBondContact O-NH1 3.1Å; R451-E474 WeakPolarHBondContact CD-O 3.49Å; R451-E474 IonicContact CZ-OE2 2.68Å; R451-E474 VanDerWaalsContact NH1-CB 3.31Å; R451-E474 IonicContact NH1-OE2 2.72Å; R451-E474 IonicContact NH2-OE2 3.91Å; R451-E474 PolarHBondContact NH2-OE2 3.14Å; R451-L475 WeakPolarHBondContact O-CD1 3.48Å; R451-E476 VanDerWaalsContact CD-OE1 3.23Å; R451-E476 WeakPolarHBondContact CD-OE1 3.41Å; R451-E476 IonicContact NE-OE1 3.99Å; R451-E476 PolarHBondContact NE-OE1 3.04Å; R451-E476 WeakPolarHBondContact O-CA 3.5Å; R451-E476 PolarHBondContact O-N 3.34Å; R451-E477 PolarHBondContact O-N 3.44Å
452	L	98.6	Very high	96.6	Very high	18 Å²	18	38.3 Å²	38.3	9%	0.094	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.1	173.9	-173.6	156	0	0	0	109.6	R426 S427 L428 Y429 E477	R426-L452 PolarHBondContact O-N 2.99Å; S427-L452 WeakPolarHBondContact CA-O 3.14Å; L428-L452 PolarHBondContact N-O 3.47Å; Y429-L452 HydrophobicContact CD1-CD2 3.86Å; Y429-L452 HydrophobicContact CD2-CD2 4.37Å; Y429-L452 HydrophobicContact CE1-CD1 4.24Å; Y429-L452 HydrophobicContact CE1-CD2 3.4Å; Y429-L452 HydrophobicContact CE1-CG 4.49Å; Y429-L452 HydrophobicContact CE2-CD2 3.99Å; Y429-L452 HydrophobicContact CG-CD2 4.33Å; Y429-L452 VanDerWaalsContact CZ-CD2 3.49Å; L452-E477 WeakPolarHBondContact CA-O 3.38Å; L452-E477 HydrophobicContact CB-CB 4.38Å; L452-E477 HydrophobicContact CD1-CB 4.18Å; L452-E477 HydrophobicContact CD1-CG 4.23Å; L452-E477 HydrophobicContact CG-CB 4.03Å; L452-E477 HydrophobicContact CG-CG 4.3Å
453	L	98.5	Very high	96.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	118.3	170.8	178.8	57.8	0	0	0	109.6	L428 L430 L444 L450 L455 L469 L472 L475 E477 L478 E479	L428-L453 HydrophobicContact CB-CD1 4.22Å; L428-L453 HydrophobicContact CD2-CD1 4.29Å; L428-L453 HydrophobicContact CG-CD1 4.25Å; L428-L453 WeakPolarHBondContact O-CA 3.49Å; L430-L453 HydrophobicContact CD1-CD1 4.46Å; L444-L453 HydrophobicContact CD1-CD1 4.31Å; L444-L453 HydrophobicContact CD1-CD2 4.44Å; L450-L453 HydrophobicContact CD2-CB 3.98Å; L450-L453 HydrophobicContact CD2-CD1 4.34Å; L450-L453 HydrophobicContact CD2-CD2 4.28Å; L450-L453 HydrophobicContact CD2-CG 4.43Å; L453-L455 HydrophobicContact CD1-CD2 4.11Å; L453-L455 HydrophobicContact CD1-CG 4.17Å; L453-L455 HydrophobicContact CD2-CD1 4.02Å; L453-L455 HydrophobicContact CD2-CG 4.36Å; L453-L455 HydrophobicContact CG-CD1 4.19Å; L453-L455 HydrophobicContact CG-CD2 4.47Å; L453-L455 HydrophobicContact CG-CG 4.02Å; L453-L469 HydrophobicContact CD2-CD2 3.75Å; L453-L472 HydrophobicContact CD2-CD1 4.04Å; L453-L475 HydrophobicContact CB-CD1 3.97Å; L453-L475 HydrophobicContact CB-CD2 4.4Å; L453-E477 PolarHBondContact N-O 2.94Å; L453-L478 HydrophobicContact CB-CD1 4.26Å; L453-L478 HydrophobicContact CD2-CD1 4.41Å; L453-L478 HydrophobicContact CG-CD1 4.32Å; L453-L478 WeakPolarHBondContact O-CA 3.47Å; L453-L478 WeakPolarHBondContact O-CD1 3.45Å; L453-E479 PolarHBondContact O-N 3.21Å
454	S	98.4	Very high	96.6	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.007	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	121.1	172.3	179.3	0	0	0	0	110.7	L428 L430 R431 E479	L428-S454 PolarHBondContact O-N 3.42Å; L430-S454 PolarHBondContact N-O 3.06Å; R431-S454 VanDerWaalsContact CD-OG 3.25Å; R431-S454 WeakPolarHBondContact CD-OG 3.5Å; R431-S454 WeakPolarHBondContact CG-OG 3.33Å; S454-E479 PolarHBondContact OG-OE2 3.18Å
455	L	98.3	Very high	96.5	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.212	C	C	.	.			trans	-116.5	9.6	178.9	-63.3	166.2	0	0	0	111.4	L430 L441 L453 G457 C458 L461 L466 L469 E479 L480 C483	L430-L455 HydrophobicContact CB-CD2 4.25Å; L430-L455 HydrophobicContact CD1-CD2 3.86Å; L441-L455 HydrophobicContact CD1-CD1 4.5Å; L441-L455 HydrophobicContact CD2-CD1 3.85Å; L441-L455 HydrophobicContact CD2-CD2 3.95Å; L453-L455 HydrophobicContact CD1-CD2 4.11Å; L453-L455 HydrophobicContact CD1-CG 4.17Å; L453-L455 HydrophobicContact CD2-CD1 4.02Å; L453-L455 HydrophobicContact CD2-CG 4.36Å; L453-L455 HydrophobicContact CG-CD1 4.19Å; L453-L455 HydrophobicContact CG-CD2 4.47Å; L453-L455 HydrophobicContact CG-CG 4.02Å; L455-G457 PolarHBondContact O-N 2.65Å; L455-C458 VanDerWaalsContact O-CB 3.23Å; L455-C458 WeakPolarHBondContact O-CB 3.48Å; L455-C458 PolarHBondContact O-N 2.79Å; L455-C458 VanDerWaalsContact O-N 3.07Å; L455-C458 PolarHBondContact O-SG 3.26Å; L455-L461 HydrophobicContact CB-CD1 3.91Å; L455-L461 HydrophobicContact CD1-CD1 3.98Å; L455-L461 HydrophobicContact CD2-CD1 4.17Å; L455-L461 HydrophobicContact CG-CD1 4.24Å; L455-L466 HydrophobicContact CD1-CD2 4.03Å; L455-L469 HydrophobicContact CD1-CD1 3.86Å; L455-E479 PolarHBondContact N-O 3.12Å; L455-L480 HydrophobicContact CB-CD2 4.04Å; L455-L480 HydrophobicContact CD1-CD2 4.03Å; L455-C483 PolarHBondContact O-SG 2.99Å
456	A	97.9	Very high	96.7	Very high	3 Å²	3	36.3 Å²	36.3	3%	0.025	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	130	-169.5	0	0	0	0	0	113.2	R431 W432 C458 E479 T481	R431-A456 CarbonylContact C-O 3.57Å; R431-A456 WeakPolarHBondContact CA-O 3.42Å; R431-A456 HydrophobicContact CB-CB 4.46Å; R431-A456 HydrophobicContact CG-CB 3.96Å; W432-A456 PolarHBondContact N-O 2.74Å; A456-C458 VanDerWaalsContact C-N 3.31Å; A456-C458 PolarHBondContact O-N 2.89Å; A456-E479 HydrophobicContact CB-CG 4.04Å; A456-E479 WeakPolarHBondContact CB-OE1 3.35Å; A456-E479 PolarHBondContact N-O 3.05Å; A456-T481 CarbonylContact C-O 3.56Å; A456-T481 WeakPolarHBondContact CA-O 3.41Å; A456-T481 VanDerWaalsContact CB-O 3.28Å; A456-T481 WeakPolarHBondContact CB-O 3.43Å
457	G	96.8	Very high	96.9	Very high	5 Å²	5	35.3 Å²	35.3	5%	0.052	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	15.3	-179.7	0	0	0	0	0	115.3	L455 P459 T481	L455-G457 PolarHBondContact O-N 2.65Å; G457-P459 WeakPolarHBondContact O-CD 3.24Å; G457-T481 PolarHBondContact N-O 2.99Å
458	C	97.7	Very high	97	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.193	C	C	.	.			trans	-76.9	109.5	167.8	-74.6	0	0	0	0	110.3	L430 L455 A456 L461	L430-C458 PolarHBondContact O-SG 3.29Å; L455-C458 VanDerWaalsContact O-CB 3.23Å; L455-C458 WeakPolarHBondContact O-CB 3.48Å; L455-C458 PolarHBondContact O-N 2.79Å; L455-C458 VanDerWaalsContact O-N 3.07Å; L455-C458 PolarHBondContact O-SG 3.26Å; A456-C458 VanDerWaalsContact C-N 3.31Å; A456-C458 PolarHBondContact O-N 2.89Å; C458-L461 HydrophobicContact CB-CD1 3.59Å; C458-L461 HydrophobicContact CB-CG 3.87Å
459	P	96.8	Very high	97.2	Very high	63 Å²	63	25.3 Å²	25.3	41%	0.409	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-14.5	-165.2	34.6	-34.1	0	0	0	114.2	C434 G457	C434-P459 HydrophobicContact CB-CG 4.22Å; G457-P459 WeakPolarHBondContact O-CD 3.24Å
460	L	97.7	Very high	97.2	Very high	81 Å²	81	25.6 Å²	25.6	42%	0.424	15%	0.154	S	C	.	.	B	Isolated β-bridge	trans	-96.2	-1.1	-177.3	-55.8	-179.9	0	0	0	113.3	C434 Q437	C434-L460 WeakPolarHBondContact O-CD1 3.28Å; Q437-L460 HydrophobicContact CG-CB 3.95Å; Q437-L460 HydrophobicContact CG-CD1 3.82Å
461	L	97.7	Very high	97.1	Very high	3 Å²	3	30.9 Å²	30.9	2%	0.016	18%	0.178	C	C	.	.			trans	-79.7	122.7	176.9	-63.1	-177	0	0	0	110.5	V436 Q437 D438 L441 L455 C458 L466 G485	V436-L461 HydrophobicContact CG1-CD2 4.27Å; Q437-L461 VanDerWaalsContact C-CD2 3.47Å; D438-L461 WeakPolarHBondContact OD1-CA 3.46Å; L441-L461 HydrophobicContact CD1-CD1 4.35Å; L441-L461 HydrophobicContact CD1-CD2 3.75Å; L441-L461 HydrophobicContact CD2-CD2 4.33Å; L441-L461 HydrophobicContact CG-CD2 3.89Å; L455-L461 HydrophobicContact CB-CD1 3.91Å; L455-L461 HydrophobicContact CD1-CD1 3.98Å; L455-L461 HydrophobicContact CD2-CD1 4.17Å; L455-L461 HydrophobicContact CG-CD1 4.24Å; C458-L461 HydrophobicContact CB-CD1 3.59Å; C458-L461 HydrophobicContact CB-CG 3.87Å; L461-L466 HydrophobicContact CB-CD1 4.32Å; L461-L466 HydrophobicContact CB-CD2 4.23Å; L461-L466 HydrophobicContact CB-CG 4.15Å; L461-L466 HydrophobicContact CD1-CD2 3.97Å; L461-G485 WeakPolarHBondContact O-CA 3.21Å; L461-G485 PolarHBondContact O-N 3.07Å
462	T	97.4	Very high	96.9	Very high	61 Å²	61	28.8 Å²	28.8	37%	0.374	17%	0.171	S	C	.	.			trans	-95.3	162.2	177.1	90.8	0	0	0	0	111.1	D438 T464 G465 L466	D438-T462 PolarHBondContact OD1-N 2.85Å; D438-T462 WeakPolarHBondContact OD2-CB 3.47Å; D438-T462 WeakPolarHBondContact OD2-CG2 3.36Å; D438-T462 PolarHBondContact OD2-OG1 3.46Å; T462-T464 PolarHBondContact O-N 3.18Å; T462-T464 VanDerWaalsContact O-N 3.13Å; T462-T464 WeakPolarHBondContact OG1-CB 3.24Å; T462-T464 PolarHBondContact OG1-N 3.3Å; T462-T464 VanDerWaalsContact OG1-N 3.09Å; T462-G465 PolarHBondContact O-N 3.4Å; T462-L466 WeakPolarHBondContact O-CB 3.3Å; T462-L466 WeakPolarHBondContact O-CG 3.5Å; T462-L466 PolarHBondContact O-N 3.32Å
463	T	97.3	Very high	96.6	Very high	51 Å²	51	33.9 Å²	33.9	31%	0.313	19%	0.194	S	C	.	.	H	α-helix	trans	-55.1	-29.7	172.6	-43.5	0	0	0	0	112.2	S467 G485 T487 L490	T463-S467 VanDerWaalsContact O-CB 3.29Å; T463-S467 WeakPolarHBondContact O-CB 3.4Å; T463-S467 PolarHBondContact O-N 3.04Å; T463-G485 VanDerWaalsContact CA-O 3.28Å; T463-G485 WeakPolarHBondContact CA-O 3.4Å; T463-G485 WeakPolarHBondContact CB-O 3.43Å; T463-G485 PolarHBondContact OG1-O 3.26Å; T463-T487 HydrophobicContact CG2-CG2 4.43Å; T463-L490 HydrophobicContact CG2-CB 4.04Å; T463-L490 HydrophobicContact CG2-CD1 4.2Å; T463-L490 HydrophobicContact CG2-CG 4.47Å
464	T	94.9	Very high	96.4	Very high	109 Å²	109	39 Å²	39	67%	0.669	22%	0.218	S	C	*	.	H	α-helix	trans	-69.7	-53.6	178.9	-47	0	0	0	0	111.2	T462 S467	T462-T464 PolarHBondContact O-N 3.18Å; T462-T464 VanDerWaalsContact O-N 3.13Å; T462-T464 WeakPolarHBondContact OG1-CB 3.24Å; T462-T464 PolarHBondContact OG1-N 3.3Å; T462-T464 VanDerWaalsContact OG1-N 3.09Å; T464-S467 PolarHBondContact O-N 3.16Å; T464-S467 PolarHBondContact O-OG 2.81Å
465	G	95.5	Very high	96.3	Very high	8 Å²	8	39.2 Å²	39.2	8%	0.082	22%	0.219	C	C	.	.	H	α-helix	trans	-62.2	-45	177.5	0	0	0	0	0	112.5	D438 T462 S467 G468	D438-G465 PolarHBondContact OD2-N 3.47Å; D438-G465 VanDerWaalsContact OD2-N 3.13Å; T462-G465 PolarHBondContact O-N 3.4Å; G465-S467 VanDerWaalsContact C-N 3.32Å; G465-S467 PolarHBondContact O-N 3.19Å; G465-G468 PolarHBondContact O-N 2.92Å; G465-G468 VanDerWaalsContact O-N 3.14Å
466	L	97.4	Very high	96.3	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59	-41.7	176.2	-69	171.8	0	0	0	111.8	L441 L455 L461 T462 G468 L469 L480 A486 L490 Y494	L441-L466 HydrophobicContact CD1-CD2 4Å; L455-L466 HydrophobicContact CD1-CD2 4.03Å; L461-L466 HydrophobicContact CB-CD1 4.32Å; L461-L466 HydrophobicContact CB-CD2 4.23Å; L461-L466 HydrophobicContact CB-CG 4.15Å; L461-L466 HydrophobicContact CD1-CD2 3.97Å; T462-L466 WeakPolarHBondContact O-CB 3.3Å; T462-L466 WeakPolarHBondContact O-CG 3.5Å; T462-L466 PolarHBondContact O-N 3.32Å; L466-G468 PolarHBondContact O-N 3.15Å; L466-L469 HydrophobicContact CD2-CD1 3.83Å; L466-L469 VanDerWaalsContact O-CB 3.23Å; L466-L469 WeakPolarHBondContact O-CB 3.42Å; L466-L469 VanDerWaalsContact O-CG 3.31Å; L466-L469 WeakPolarHBondContact O-CG 3.35Å; L466-L469 PolarHBondContact O-N 3.22Å; L466-L480 HydrophobicContact CD2-CD2 3.76Å; L466-A486 HydrophobicContact CD1-CB 4.4Å; L466-L490 HydrophobicContact CB-CD2 3.7Å; L466-L490 HydrophobicContact CD1-CD2 3.97Å; L466-L490 HydrophobicContact CG-CD2 4.48Å; L466-Y494 VanDerWaalsContact C-OH 3.31Å; L466-Y494 PolarHBondContact O-OH 3.34Å
467	S	96.6	Very high	96.3	Very high	37 Å²	37	48 Å²	48	26%	0.259	26%	0.26	S	S	.	.	H	α-helix	trans	-56.1	-26.5	178.4	75.5	0	0	0	0	113.8	T463 T464 G465 L469 I470	T463-S467 VanDerWaalsContact O-CB 3.29Å; T463-S467 WeakPolarHBondContact O-CB 3.4Å; T463-S467 PolarHBondContact O-N 3.04Å; T464-S467 PolarHBondContact O-N 3.16Å; T464-S467 PolarHBondContact O-OG 2.81Å; G465-S467 VanDerWaalsContact C-N 3.32Å; G465-S467 PolarHBondContact O-N 3.19Å; S467-L469 PolarHBondContact O-N 2.93Å; S467-I470 WeakPolarHBondContact O-CG1 3.27Å
468	G	96	Very high	96.3	Very high	14 Å²	14	47.8 Å²	47.8	14%	0.144	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-68.1	-18.1	175.7	0	0	0	0	0	114.7	F445 G465 L466 I470 Q471	F445-G468 WeakPolarHBondContact CE1-O 3.24Å; G465-G468 PolarHBondContact O-N 2.92Å; G465-G468 VanDerWaalsContact O-N 3.14Å; L466-G468 PolarHBondContact O-N 3.15Å; G468-I470 PolarHBondContact O-N 3.41Å; G468-I470 VanDerWaalsContact O-N 3.07Å; G468-Q471 PolarHBondContact O-N 3.24Å; G468-Q471 VanDerWaalsContact O-N 3.13Å; G468-Q471 PolarHBondContact O-NE2 3.29Å
469	L	96.4	Very high	96.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-61.7	-15.1	179.1	-67.1	172.7	0	0	0	113.4	F445 L453 L455 L466 S467 Q471 L472 L478 Y494	F445-L469 HydrophobicContact CD1-CD2 4.41Å; F445-L469 HydrophobicContact CE1-CD2 4.03Å; F445-L469 HydrophobicContact CE1-CG 4.4Å; L453-L469 HydrophobicContact CD2-CD2 3.75Å; L455-L469 HydrophobicContact CD1-CD1 3.86Å; L466-L469 HydrophobicContact CD2-CD1 3.83Å; L466-L469 VanDerWaalsContact O-CB 3.23Å; L466-L469 WeakPolarHBondContact O-CB 3.42Å; L466-L469 VanDerWaalsContact O-CG 3.31Å; L466-L469 WeakPolarHBondContact O-CG 3.35Å; L466-L469 PolarHBondContact O-N 3.22Å; S467-L469 PolarHBondContact O-N 2.93Å; L469-Q471 PolarHBondContact O-N 3.19Å; L469-L472 HydrophobicContact CD2-CD1 3.92Å; L469-L472 WeakPolarHBondContact O-CB 3.44Å; L469-L472 PolarHBondContact O-N 2.88Å; L469-L478 HydrophobicContact CD1-CD1 4.14Å; L469-L478 HydrophobicContact CD1-CD2 4.32Å; L469-Y494 HydrophobicContact CB-CE1 4.3Å
470	I	95.9	Very high	96.4	Very high	33 Å²	33	46.4 Å²	46.4	17%	0.169	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-57.3	-17.4	171	65.6	158.7	0	0	0	113.7	S467 G468 L472 Q473 Y493 Y494 H497 L498	S467-I470 WeakPolarHBondContact O-CG1 3.27Å; G468-I470 PolarHBondContact O-N 3.41Å; G468-I470 VanDerWaalsContact O-N 3.07Å; I470-L472 PolarHBondContact O-N 2.91Å; I470-Q473 PolarHBondContact O-NE2 3.39Å; I470-Y493 HydrophobicContact CD1-CE1 4.15Å; I470-Y493 VanDerWaalsContact CD1-OH 3.29Å; I470-Y493 WeakPolarHBondContact CD1-OH 3.37Å; I470-Y493 HydrophobicContact CG1-CE1 4.45Å; I470-Y493 HydrophobicContact CG2-CD1 4.05Å; I470-Y493 HydrophobicContact CG2-CE1 3.58Å; I470-Y494 HydrophobicContact CG2-CD1 3.88Å; I470-Y494 HydrophobicContact CG2-CE1 4.12Å; I470-H497 HydrophobicContact CB-CB 4.03Å; I470-H497 HydrophobicContact CD1-CB 4.44Å; I470-H497 HydrophobicContact CG2-CB 3.62Å; I470-L498 HydrophobicContact CG2-CG 4.43Å
471	Q	95.4	Very high	96.3	Very high	111 Å²	111	44.2 Å²	44.2	52%	0.519	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-67.5	-22.2	174.7	-71.9	167.7	90.8	0	0	112.6	F445 G468 L469 Q473	F445-Q471 HydrophobicContact CB-CB 4.02Å; F445-Q471 HydrophobicContact CG-CB 4.38Å; G468-Q471 PolarHBondContact O-N 3.24Å; G468-Q471 VanDerWaalsContact O-N 3.13Å; G468-Q471 PolarHBondContact O-NE2 3.29Å; L469-Q471 PolarHBondContact O-N 3.19Å; Q471-Q473 PolarHBondContact O-N 3.48Å
472	L	94.6	Very high	96.2	Very high	7 Å²	7	49.5 Å²	49.5	4%	0.037	26%	0.264	C	S	.	.			trans	-79.8	64.5	173.8	-60.1	173.9	0	0	0	110.7	L444 L450 L453 L469 I470 E474 L475 L498	L444-L472 WeakPolarHBondContact O-CD2 3.48Å; L450-L472 HydrophobicContact CD2-CD1 4.15Å; L453-L472 HydrophobicContact CD2-CD1 4.04Å; L469-L472 HydrophobicContact CD2-CD1 3.92Å; L469-L472 WeakPolarHBondContact O-CB 3.44Å; L469-L472 PolarHBondContact O-N 2.88Å; I470-L472 PolarHBondContact O-N 2.91Å; L472-E474 PolarHBondContact O-N 3.29Å; L472-L475 HydrophobicContact CB-CB 4.1Å; L472-L475 HydrophobicContact CB-CD2 4.48Å; L472-L475 HydrophobicContact CD1-CD2 4.45Å; L472-L475 WeakPolarHBondContact O-CB 3.47Å; L472-L475 PolarHBondContact O-N 3.28Å; L472-L498 WeakPolarHBondContact O-CD2 3.5Å
473	Q	91.6	Very high	96.1	Very high	125 Å²	125	47 Å²	47	58%	0.584	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.2	-176.1	-73.1	-71.7	-64.6	0	0	114.8	I470 Q471 H497	I470-Q473 PolarHBondContact O-NE2 3.39Å; Q471-Q473 PolarHBondContact O-N 3.48Å; Q473-H497 PolarHBondContact NE2-O 2.86Å
474	E	94.3	Very high	95.9	Very high	108 Å²	108	49 Å²	49	51%	0.505	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	4.5	178.8	-59	-80.3	135.3	0	0	113	R451 L472 E476	R451-E474 WeakPolarHBondContact CD-O 3.49Å; R451-E474 IonicContact CZ-OE2 2.68Å; R451-E474 VanDerWaalsContact NH1-CB 3.31Å; R451-E474 IonicContact NH1-OE2 2.72Å; R451-E474 IonicContact NH2-OE2 3.91Å; R451-E474 PolarHBondContact NH2-OE2 3.14Å; L472-E474 PolarHBondContact O-N 3.29Å; E474-E476 PolarHBondContact O-N 3.25Å
475	L	96.5	Very high	95.8	Very high	5 Å²	5	44.1 Å²	44.1	3%	0.026	23%	0.234	C	C	.	.			trans	-71.1	124.8	-176.8	-159.9	71.7	0	0	0	110.7	L450 R451 L453 L472 L478 C501	L450-L475 HydrophobicContact CD2-CD1 4.34Å; L450-L475 HydrophobicContact CG-CD1 4.3Å; R451-L475 WeakPolarHBondContact O-CD1 3.48Å; L453-L475 HydrophobicContact CB-CD1 3.97Å; L453-L475 HydrophobicContact CB-CD2 4.4Å; L472-L475 HydrophobicContact CB-CB 4.1Å; L472-L475 HydrophobicContact CB-CD2 4.48Å; L472-L475 HydrophobicContact CD1-CD2 4.45Å; L472-L475 WeakPolarHBondContact O-CB 3.47Å; L472-L475 PolarHBondContact O-N 3.28Å; L475-L478 HydrophobicContact CD2-CB 3.79Å; L475-L478 HydrophobicContact CD2-CD1 4.16Å; L475-L478 HydrophobicContact CD2-CD2 4.26Å; L475-L478 HydrophobicContact CD2-CG 4.27Å; L475-C501 WeakPolarHBondContact O-CA 3.49Å; L475-C501 WeakPolarHBondContact O-CB 3.34Å
476	E	97.3	Very high	95.8	Very high	120 Å²	120	44.6 Å²	44.6	56%	0.561	24%	0.237	S	C	*	.	S	Bend	trans	-94.8	-32.4	-179.4	-69	171	-156.8	0	0	111.2	R451 E474 M502	R451-E476 VanDerWaalsContact CD-OE1 3.23Å; R451-E476 WeakPolarHBondContact CD-OE1 3.41Å; R451-E476 IonicContact NE-OE1 3.99Å; R451-E476 PolarHBondContact NE-OE1 3.04Å; R451-E476 WeakPolarHBondContact O-CA 3.5Å; R451-E476 PolarHBondContact O-N 3.34Å; E474-E476 PolarHBondContact O-N 3.25Å; E476-M502 PolarHBondContact O-N 2.67Å
477	E	98.3	Very high	95.7	Very high	67 Å²	67	46.7 Å²	46.7	31%	0.313	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	133.6	-179.6	-171	176.1	143.7	0	0	112	R451 L452 L453 M502 I504	R451-E477 PolarHBondContact O-N 3.44Å; L452-E477 WeakPolarHBondContact CA-O 3.38Å; L452-E477 HydrophobicContact CB-CB 4.38Å; L452-E477 HydrophobicContact CD1-CB 4.18Å; L452-E477 HydrophobicContact CD1-CG 4.23Å; L452-E477 HydrophobicContact CG-CB 4.03Å; L452-E477 HydrophobicContact CG-CG 4.3Å; L453-E477 PolarHBondContact N-O 2.94Å; E477-M502 WeakPolarHBondContact CA-O 3.44Å; E477-I504 HydrophobicContact CG-CD1 4.23Å
478	L	98	Very high	95.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	111.8	179.3	177.3	56.1	0	0	0	110.5	L453 L469 L475 L480 Y494 M502 V503 I504	L453-L478 HydrophobicContact CB-CD1 4.26Å; L453-L478 HydrophobicContact CD2-CD1 4.41Å; L453-L478 HydrophobicContact CG-CD1 4.32Å; L453-L478 WeakPolarHBondContact O-CA 3.47Å; L453-L478 WeakPolarHBondContact O-CD1 3.45Å; L469-L478 HydrophobicContact CD1-CD1 4.14Å; L469-L478 HydrophobicContact CD1-CD2 4.32Å; L475-L478 HydrophobicContact CD2-CB 3.79Å; L475-L478 HydrophobicContact CD2-CD1 4.16Å; L475-L478 HydrophobicContact CD2-CD2 4.26Å; L475-L478 HydrophobicContact CD2-CG 4.27Å; L478-L480 HydrophobicContact CD1-CD2 3.94Å; L478-L480 HydrophobicContact CD1-CG 4.21Å; L478-L480 HydrophobicContact CD2-CD1 4.23Å; L478-L480 HydrophobicContact CD2-CG 4.47Å; L478-L480 HydrophobicContact CG-CD1 4.34Å; L478-L480 HydrophobicContact CG-CD2 4.32Å; L478-L480 HydrophobicContact CG-CG 4.04Å; L478-Y494 HydrophobicContact CD2-CD2 4.44Å; L478-Y494 HydrophobicContact CD2-CE1 4.41Å; L478-Y494 HydrophobicContact CD2-CE2 4Å; L478-M502 PolarHBondContact N-O 2.79Å; L478-V503 HydrophobicContact CB-CG1 4.48Å; L478-V503 HydrophobicContact CB-CG2 4.39Å; L478-V503 HydrophobicContact CD2-CG1 4.42Å; L478-V503 HydrophobicContact CD2-CG2 4.46Å; L478-V503 HydrophobicContact CG-CG1 4.39Å; L478-V503 CarbonylContact O-C 3.6Å; L478-V503 WeakPolarHBondContact O-CA 2.98Å; L478-I504 PolarHBondContact O-N 3.32Å
479	E	98.1	Very high	95.6	Very high	34 Å²	34	52.6 Å²	52.6	16%	0.159	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	117.1	178.4	-168.6	-164.2	173.4	0	0	111.3	R431 L453 S454 L455 A456 T481 I504	R431-E479 WeakPolarHBondContact CD-OE2 3.48Å; R431-E479 IonicContact NH1-OE2 3.54Å; R431-E479 PolarHBondContact NH1-OE2 2.88Å; L453-E479 PolarHBondContact O-N 3.21Å; S454-E479 PolarHBondContact OG-OE2 3.18Å; L455-E479 PolarHBondContact N-O 3.12Å; A456-E479 HydrophobicContact CB-CG 4.04Å; A456-E479 WeakPolarHBondContact CB-OE1 3.35Å; A456-E479 PolarHBondContact N-O 3.05Å; E479-T481 VanDerWaalsContact CG-OG1 3.22Å; E479-T481 WeakPolarHBondContact CG-OG1 3.05Å; E479-T481 PolarHBondContact OE1-OG1 3.05Å; E479-I504 HydrophobicContact CB-CB 4.39Å; E479-I504 HydrophobicContact CG-CB 4.14Å; E479-I504 HydrophobicContact CG-CG2 4.21Å
480	L	97.5	Very high	95.6	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.28	C	S	.	.			trans	-118.1	12.7	179.4	-61.5	-178.1	0	0	0	113.5	L455 L466 L478 N482 C483 A486 L490 F491 Y494 I504	L455-L480 HydrophobicContact CB-CD2 4.04Å; L455-L480 HydrophobicContact CD1-CD2 4.03Å; L466-L480 HydrophobicContact CD2-CD2 3.76Å; L478-L480 HydrophobicContact CD1-CD2 3.94Å; L478-L480 HydrophobicContact CD1-CG 4.21Å; L478-L480 HydrophobicContact CD2-CD1 4.23Å; L478-L480 HydrophobicContact CD2-CG 4.47Å; L478-L480 HydrophobicContact CG-CD1 4.34Å; L478-L480 HydrophobicContact CG-CD2 4.32Å; L478-L480 HydrophobicContact CG-CG 4.04Å; L480-N482 PolarHBondContact O-N 3.1Å; L480-C483 WeakPolarHBondContact O-CB 3.01Å; L480-C483 PolarHBondContact O-N 2.62Å; L480-C483 PolarHBondContact O-SG 3.16Å; L480-C483 VanDerWaalsContact O-SG 3.4Å; L480-A486 HydrophobicContact CB-CB 3.92Å; L480-A486 HydrophobicContact CD1-CB 4.26Å; L480-L490 HydrophobicContact CD1-CD2 4.34Å; L480-F491 HydrophobicContact CB-CE1 4.34Å; L480-F491 HydrophobicContact CB-CZ 4.49Å; L480-F491 HydrophobicContact CD1-CE1 4.1Å; L480-Y494 HydrophobicContact CD1-CE2 3.61Å; L480-I504 PolarHBondContact N-O 2.76Å
481	T	96.1	Very high	95.6	Very high	36 Å²	36	52.3 Å²	52.3	22%	0.221	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.1	125.5	-178.8	-33.4	0	0	0	0	112.2	A456 G457 E479 C483 E505	A456-T481 CarbonylContact C-O 3.56Å; A456-T481 WeakPolarHBondContact CA-O 3.41Å; A456-T481 VanDerWaalsContact CB-O 3.28Å; A456-T481 WeakPolarHBondContact CB-O 3.43Å; G457-T481 PolarHBondContact N-O 2.99Å; E479-T481 VanDerWaalsContact CG-OG1 3.22Å; E479-T481 WeakPolarHBondContact CG-OG1 3.05Å; E479-T481 PolarHBondContact OE1-OG1 3.05Å; T481-C483 VanDerWaalsContact C-N 3.29Å; T481-C483 PolarHBondContact O-N 2.77Å; T481-E505 WeakPolarHBondContact CA-OXT 3.49Å
482	N	95.2	Very high	95.6	Very high	114 Å²	114	53.1 Å²	53.1	61%	0.61	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	20.3	-178	-54.6	-67	0	0	0	116.4	L480	L480-N482 PolarHBondContact O-N 3.1Å
483	C	95.8	Very high	95.6	Very high	9 Å²	9	56.7 Å²	56.7	6%	0.061	29%	0.292	C	S	.	.			trans	-82.5	121.6	169.6	-71.6	0	0	0	0	111.3	L455 L480 T481 G485 A486	L455-C483 PolarHBondContact O-SG 2.99Å; L480-C483 WeakPolarHBondContact O-CB 3.01Å; L480-C483 PolarHBondContact O-N 2.62Å; L480-C483 PolarHBondContact O-SG 3.16Å; L480-C483 VanDerWaalsContact O-SG 3.4Å; T481-C483 VanDerWaalsContact C-N 3.29Å; T481-C483 PolarHBondContact O-N 2.77Å; C483-G485 PolarHBondContact O-N 2.64Å; C483-G485 VanDerWaalsContact O-N 3.16Å; C483-A486 HydrophobicContact CB-CB 3.96Å; C483-A486 WeakPolarHBondContact O-CB 3.44Å; C483-A486 PolarHBondContact O-N 3.45Å
484	P	93.1	Very high	95.9	Very high	93 Å²	93	50.8 Å²	50.8	60%	0.604	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-28.8	-179	-26	36	0	0	0	114.7	A486	P484-A486 VanDerWaalsContact C-N 3.32Å
485	G	92.6	Very high	95.8	Very high	5 Å²	5	49.2 Å²	49.2	5%	0.052	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-9.3	175.5	0	0	0	0	0	115.4	L461 T463 C483 T487	L461-G485 WeakPolarHBondContact O-CA 3.21Å; L461-G485 PolarHBondContact O-N 3.07Å; T463-G485 VanDerWaalsContact CA-O 3.28Å; T463-G485 WeakPolarHBondContact CA-O 3.4Å; T463-G485 WeakPolarHBondContact CB-O 3.43Å; T463-G485 PolarHBondContact OG1-O 3.26Å; C483-G485 PolarHBondContact O-N 2.64Å; C483-G485 VanDerWaalsContact O-N 3.16Å; G485-T487 PolarHBondContact O-N 2.92Å; G485-T487 VanDerWaalsContact O-N 3.14Å
486	A	95.3	Very high	95.7	Very high	19 Å²	19	55.9 Å²	55.9	16%	0.157	30%	0.301	C	S	.	.			trans	-85.5	83.8	-175.3	0	0	0	0	0	111.3	L466 L480 C483 P484 F491	L466-A486 HydrophobicContact CD1-CB 4.4Å; L480-A486 HydrophobicContact CB-CB 3.92Å; L480-A486 HydrophobicContact CD1-CB 4.26Å; C483-A486 HydrophobicContact CB-CB 3.96Å; C483-A486 WeakPolarHBondContact O-CB 3.44Å; C483-A486 PolarHBondContact O-N 3.45Å; P484-A486 VanDerWaalsContact C-N 3.32Å; A486-F491 HydrophobicContact CB-CE1 4.4Å; A486-F491 HydrophobicContact CB-CE2 4.24Å; A486-F491 HydrophobicContact CB-CZ 3.7Å
487	T	95.8	Very high	95.6	Very high	43 Å²	43	53.4 Å²	53.4	26%	0.264	29%	0.289	S	S	.	.			trans	-91.6	162	-178	80.7	0	0	0	0	113.1	T463 G485 E489 L490 F491	T463-T487 HydrophobicContact CG2-CG2 4.43Å; G485-T487 PolarHBondContact O-N 2.92Å; G485-T487 VanDerWaalsContact O-N 3.14Å; T487-E489 WeakPolarHBondContact CB-OE2 3.33Å; T487-E489 PolarHBondContact O-N 3.27Å; T487-E489 VanDerWaalsContact O-N 3.17Å; T487-E489 PolarHBondContact OG1-N 3.18Å; T487-E489 PolarHBondContact OG1-OE2 3.31Å; T487-L490 WeakPolarHBondContact O-CA 3.43Å; T487-L490 WeakPolarHBondContact O-CB 3.45Å; T487-L490 PolarHBondContact O-N 3.47Å; T487-L490 PolarHBondContact OG1-N 3.01Å; T487-F491 WeakPolarHBondContact O-CD2 3.35Å; T487-F491 PolarHBondContact O-N 2.66Å; T487-F491 VanDerWaalsContact O-N 3.12Å
488	A	94.8	Very high	95.4	Very high	55 Å²	55	50.6 Å²	50.6	46%	0.455	28%	0.276	S	S	.	.	H	α-helix	trans	-59.2	-25.8	175.2	0	0	0	0	0	113.6	K492	A488-K492 WeakPolarHBondContact O-CD 3.32Å; A488-K492 VanDerWaalsContact O-CG 3.29Å; A488-K492 WeakPolarHBondContact O-CG 3.48Å; A488-K492 PolarHBondContact O-N 3.4Å
489	E	95.4	Very high	95	Very high	121 Å²	121	54.9 Å²	54.9	57%	0.565	30%	0.304	S	S	*	.	H	α-helix	trans	-71.7	-38.6	172.7	-63.2	64.8	-137.1	0	0	111.4	T487 K492 Y493	T487-E489 WeakPolarHBondContact CB-OE2 3.33Å; T487-E489 PolarHBondContact O-N 3.27Å; T487-E489 VanDerWaalsContact O-N 3.17Å; T487-E489 PolarHBondContact OG1-N 3.18Å; T487-E489 PolarHBondContact OG1-OE2 3.31Å; E489-K492 PolarHBondContact O-N 3.13Å; E489-Y493 WeakPolarHBondContact O-CB 3.09Å; E489-Y493 PolarHBondContact O-N 2.95Å
490	L	96.3	Very high	94.6	Very high	5 Å²	5	61.4 Å²	61.4	3%	0.026	33%	0.334	C	S	.	.	H	α-helix	trans	-66.5	-42.7	177.2	-175.3	71.5	0	0	0	111.6	T463 L466 L480 T487 K492 Y493 Y494	T463-L490 HydrophobicContact CG2-CB 4.04Å; T463-L490 HydrophobicContact CG2-CD1 4.2Å; T463-L490 HydrophobicContact CG2-CG 4.47Å; L466-L490 HydrophobicContact CB-CD2 3.7Å; L466-L490 HydrophobicContact CD1-CD2 3.97Å; L466-L490 HydrophobicContact CG-CD2 4.48Å; L480-L490 HydrophobicContact CD1-CD2 4.34Å; T487-L490 WeakPolarHBondContact O-CA 3.43Å; T487-L490 WeakPolarHBondContact O-CB 3.45Å; T487-L490 PolarHBondContact O-N 3.47Å; T487-L490 PolarHBondContact OG1-N 3.01Å; L490-K492 VanDerWaalsContact C-N 3.33Å; L490-K492 PolarHBondContact O-N 3.2Å; L490-Y493 HydrophobicContact CD1-CD1 4.48Å; L490-Y493 CarbonylContact O-C 3.49Å; L490-Y493 WeakPolarHBondContact O-CA 3.44Å; L490-Y493 VanDerWaalsContact O-CB 3.31Å; L490-Y493 WeakPolarHBondContact O-CB 3.39Å; L490-Y493 PolarHBondContact O-N 3.32Å; L490-Y494 HydrophobicContact CD1-CE1 4.32Å; L490-Y494 HydrophobicContact CD1-CE2 4.12Å; L490-Y494 HydrophobicContact CD2-CE2 3.7Å; L490-Y494 HydrophobicContact CG-CD2 4.11Å; L490-Y494 HydrophobicContact CG-CE2 3.53Å; L490-Y494 WeakPolarHBondContact O-CD2 3.49Å; L490-Y494 PolarHBondContact O-N 3.42Å
491	F	95.5	Very high	94.6	Very high	22 Å²	22	62.3 Å²	62.3	10%	0.096	34%	0.341	C	S	.	.	H	α-helix	trans	-63	-39.1	176.1	-62.2	-57.2	0	0	0	112.1	L480 A486 T487 Y493 Y494 A495 V503 E505	L480-F491 HydrophobicContact CB-CE1 4.34Å; L480-F491 HydrophobicContact CB-CZ 4.49Å; L480-F491 HydrophobicContact CD1-CE1 4.1Å; A486-F491 HydrophobicContact CB-CE1 4.4Å; A486-F491 HydrophobicContact CB-CE2 4.24Å; A486-F491 HydrophobicContact CB-CZ 3.7Å; T487-F491 WeakPolarHBondContact O-CD2 3.35Å; T487-F491 PolarHBondContact O-N 2.66Å; T487-F491 VanDerWaalsContact O-N 3.12Å; F491-Y493 VanDerWaalsContact C-N 3.3Å; F491-Y493 PolarHBondContact O-N 3.08Å; F491-Y494 HydrophobicContact CD1-CD2 4.3Å; F491-Y494 PolarHBondContact O-N 2.84Å; F491-A495 PolarHBondContact O-N 3.25Å; F491-V503 HydrophobicContact CD1-CG1 3.7Å; F491-V503 HydrophobicContact CE1-CG1 3.71Å; F491-E505 WeakPolarHBondContact CB-OE1 3.45Å; F491-E505 HydrophobicContact CD1-CG 3.9Å; F491-E505 HydrophobicContact CD2-CB 4.48Å; F491-E505 HydrophobicContact CD2-CG 3.94Å; F491-E505 HydrophobicContact CE1-CB 4.19Å; F491-E505 HydrophobicContact CE1-CG 3.77Å; F491-E505 HydrophobicContact CE2-CB 3.89Å; F491-E505 HydrophobicContact CE2-CG 3.82Å; F491-E505 HydrophobicContact CG-CG 3.99Å; F491-E505 WeakPolarHBondContact CG-OE1 3.13Å; F491-E505 HydrophobicContact CZ-CB 3.71Å; F491-E505 HydrophobicContact CZ-CG 3.72Å
492	K	94.8	Very high	94.6	Very high	127 Å²	127	66.6 Å²	66.6	55%	0.552	36%	0.359	S	S	*	.	H	α-helix	trans	-62.7	-34.7	170.2	-69.8	165.8	-169.6	161	0	112.8	A488 E489 L490 Q496	A488-K492 WeakPolarHBondContact O-CD 3.32Å; A488-K492 VanDerWaalsContact O-CG 3.29Å; A488-K492 WeakPolarHBondContact O-CG 3.48Å; A488-K492 PolarHBondContact O-N 3.4Å; E489-K492 PolarHBondContact O-N 3.13Å; L490-K492 VanDerWaalsContact C-N 3.33Å; L490-K492 PolarHBondContact O-N 3.2Å; K492-Q496 WeakPolarHBondContact O-CG 3.4Å
493	Y	96.1	Very high	94.6	Very high	82 Å²	82	63 Å²	63	32%	0.322	34%	0.342	S	S	.	.	H	α-helix	trans	-68.7	-44.5	176.2	-177.9	-108.4	0	0	0	111.5	I470 E489 L490 F491 Q496 H497	I470-Y493 HydrophobicContact CD1-CE1 4.15Å; I470-Y493 VanDerWaalsContact CD1-OH 3.29Å; I470-Y493 WeakPolarHBondContact CD1-OH 3.37Å; I470-Y493 HydrophobicContact CG1-CE1 4.45Å; I470-Y493 HydrophobicContact CG2-CD1 4.05Å; I470-Y493 HydrophobicContact CG2-CE1 3.58Å; E489-Y493 WeakPolarHBondContact O-CB 3.09Å; E489-Y493 PolarHBondContact O-N 2.95Å; L490-Y493 HydrophobicContact CD1-CD1 4.48Å; L490-Y493 CarbonylContact O-C 3.49Å; L490-Y493 WeakPolarHBondContact O-CA 3.44Å; L490-Y493 VanDerWaalsContact O-CB 3.31Å; L490-Y493 WeakPolarHBondContact O-CB 3.39Å; L490-Y493 PolarHBondContact O-N 3.32Å; F491-Y493 VanDerWaalsContact C-N 3.3Å; F491-Y493 PolarHBondContact O-N 3.08Å; Y493-Q496 PolarHBondContact O-N 2.82Å; Y493-H497 AromaticContact CD2-CE1 3.53Å; Y493-H497 AromaticContact CD2-ND1 3.6Å; Y493-H497 AromaticContact CE2-CE1 3.25Å; Y493-H497 WeakPolarHBondContact CE2-CE1 3.45Å; Y493-H497 AromaticContact CE2-ND1 3.56Å; Y493-H497 AromaticContact CE2-NE2 3.86Å; Y493-H497 AromaticContact CZ-CE1 3.93Å; Y493-H497 AromaticContact CZ-ND1 3.96Å; Y493-H497 PolarHBondContact O-N 2.88Å; Y493-H497 PolarHBondContact O-ND1 3.32Å
494	Y	96.5	Very high	94.5	Very high	1 Å²	1	65.5 Å²	65.5	0%	0.004	35%	0.354	C	S	.	.	H	α-helix	trans	-62.7	-41.3	173.7	-65.6	-44.4	0	0	0	112.7	L466 L469 I470 L478 L480 L490 F491 Q496 H497 L498 V503	L466-Y494 VanDerWaalsContact C-OH 3.31Å; L466-Y494 PolarHBondContact O-OH 3.34Å; L469-Y494 HydrophobicContact CB-CE1 4.3Å; I470-Y494 HydrophobicContact CG2-CD1 3.88Å; I470-Y494 HydrophobicContact CG2-CE1 4.12Å; L478-Y494 HydrophobicContact CD2-CD2 4.44Å; L478-Y494 HydrophobicContact CD2-CE1 4.41Å; L478-Y494 HydrophobicContact CD2-CE2 4Å; L480-Y494 HydrophobicContact CD1-CE2 3.61Å; L490-Y494 HydrophobicContact CD1-CE1 4.32Å; L490-Y494 HydrophobicContact CD1-CE2 4.12Å; L490-Y494 HydrophobicContact CD2-CE2 3.7Å; L490-Y494 HydrophobicContact CG-CD2 4.11Å; L490-Y494 HydrophobicContact CG-CE2 3.53Å; L490-Y494 WeakPolarHBondContact O-CD2 3.49Å; L490-Y494 PolarHBondContact O-N 3.42Å; F491-Y494 HydrophobicContact CD1-CD2 4.3Å; F491-Y494 PolarHBondContact O-N 2.84Å; Y494-Q496 PolarHBondContact O-N 3.32Å; Y494-H497 PolarHBondContact O-N 3.18Å; Y494-L498 HydrophobicContact CD1-CD1 3.8Å; Y494-L498 HydrophobicContact CE1-CD1 4.3Å; Y494-L498 HydrophobicContact CG-CD1 4.44Å; Y494-L498 PolarHBondContact O-N 3.5Å; Y494-V503 HydrophobicContact CD2-CG1 4.23Å; Y494-V503 HydrophobicContact CD2-CG2 4.31Å; Y494-V503 HydrophobicContact CG-CG2 4.48Å
495	A	93.6	Very high	94.3	Very high	75 Å²	75	68.3 Å²	68.3	62%	0.62	36%	0.359	S	S	*	.	H	α-helix	trans	-57.8	-19.4	176.9	0	0	0	0	0	113.8	F491	F491-A495 PolarHBondContact O-N 3.25Å
496	Q	94.6	Very high	94.3	Very high	145 Å²	145	71.5 Å²	71.5	68%	0.678	37%	0.374	S	S	*	.	H	α-helix	trans	-94.2	-27.2	175.2	-65	172	17.7	0	0	113.8	K492 Y493 Y494	K492-Q496 WeakPolarHBondContact O-CG 3.4Å; Y493-Q496 PolarHBondContact O-N 2.82Å; Y494-Q496 PolarHBondContact O-N 3.32Å
497	H	95.2	Very high	94.3	Very high	68 Å²	68	74.2 Å²	74.2	32%	0.315	39%	0.385	S	S	.	.	H	α-helix	trans	-116.1	-15.9	-168.9	-62.9	85.3	0	0	0	114.7	I470 Q473 Y493 Y494 P499	I470-H497 HydrophobicContact CB-CB 4.03Å; I470-H497 HydrophobicContact CD1-CB 4.44Å; I470-H497 HydrophobicContact CG2-CB 3.62Å; Q473-H497 PolarHBondContact NE2-O 2.86Å; Y493-H497 AromaticContact CD2-CE1 3.53Å; Y493-H497 AromaticContact CD2-ND1 3.6Å; Y493-H497 AromaticContact CE2-CE1 3.25Å; Y493-H497 WeakPolarHBondContact CE2-CE1 3.45Å; Y493-H497 AromaticContact CE2-ND1 3.56Å; Y493-H497 AromaticContact CE2-NE2 3.86Å; Y493-H497 AromaticContact CZ-CE1 3.93Å; Y493-H497 AromaticContact CZ-ND1 3.96Å; Y493-H497 PolarHBondContact O-N 2.88Å; Y493-H497 PolarHBondContact O-ND1 3.32Å; Y494-H497 PolarHBondContact O-N 3.18Å; H497-P499 VanDerWaalsContact C-CD 3.48Å
498	L	94	Very high	94.2	Very high	8 Å²	8	75.9 Å²	75.9	4%	0.042	39%	0.392	C	S	.	.			trans	-130	59.3	175.9	-65.3	176.9	0	0	0	110	I470 L472 Y494 H500 C501	I470-L498 HydrophobicContact CG2-CG 4.43Å; L472-L498 WeakPolarHBondContact O-CD2 3.5Å; Y494-L498 HydrophobicContact CD1-CD1 3.8Å; Y494-L498 HydrophobicContact CE1-CD1 4.3Å; Y494-L498 HydrophobicContact CG-CD1 4.44Å; Y494-L498 PolarHBondContact O-N 3.5Å; L498-H500 PolarHBondContact O-N 2.75Å; L498-C501 HydrophobicContact CB-CB 3.79Å; L498-C501 PolarHBondContact O-N 3.28Å
499	P	88.9	Confident	94.2	Very high	90 Å²	90	77.2 Å²	77.2	58%	0.584	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-6.3	-170.3	30.6	-38.7	0	0	0	115	H497	H497-P499 VanDerWaalsContact C-CD 3.48Å
500	H	90.6	Very high	94.1	Very high	172 Å²	172	74.4 Å²	74.4	80%	0.796	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	-1.4	177.6	-59.6	-44.4	0	0	0	113.2	L498	L498-H500 PolarHBondContact O-N 2.75Å
501	C	95.8	Very high	94	Very high	19 Å²	19	79.1 Å²	79.1	13%	0.128	40%	0.401	C	S	.	.			trans	-90	129.1	177.8	-171	0	0	0	0	110.5	L475 L498 V503	L475-C501 WeakPolarHBondContact O-CA 3.49Å; L475-C501 WeakPolarHBondContact O-CB 3.34Å; L498-C501 HydrophobicContact CB-CB 3.79Å; L498-C501 PolarHBondContact O-N 3.28Å; C501-V503 PolarHBondContact O-N 3.39Å
502	M	96.4	Very high	93.8	Very high	125 Å²	125	83.1 Å²	83.1	62%	0.616	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	104.5	165.9	-171.8	-178.3	-52.1	0	0	108.8	E476 E477 L478	E476-M502 PolarHBondContact O-N 2.67Å; E477-M502 WeakPolarHBondContact CA-O 3.44Å; L478-M502 PolarHBondContact N-O 2.79Å
503	V	95.3	Very high	93.8	Very high	40 Å²	40	79.8 Å²	79.8	24%	0.242	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	126.7	174	-168.7	0	0	0	0	109.5	L478 F491 Y494 C501	L478-V503 HydrophobicContact CB-CG1 4.48Å; L478-V503 HydrophobicContact CB-CG2 4.39Å; L478-V503 HydrophobicContact CD2-CG1 4.42Å; L478-V503 HydrophobicContact CD2-CG2 4.46Å; L478-V503 HydrophobicContact CG-CG1 4.39Å; L478-V503 CarbonylContact O-C 3.6Å; L478-V503 WeakPolarHBondContact O-CA 2.98Å; F491-V503 HydrophobicContact CD1-CG1 3.7Å; F491-V503 HydrophobicContact CE1-CG1 3.71Å; Y494-V503 HydrophobicContact CD2-CG1 4.23Å; Y494-V503 HydrophobicContact CD2-CG2 4.31Å; Y494-V503 HydrophobicContact CG-CG2 4.48Å; C501-V503 PolarHBondContact O-N 3.39Å
504	I	94.3	Very high	93.6	Very high	60 Å²	60	79.6 Å²	79.6	31%	0.308	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	120.8	177.4	-54.4	173.1	0	0	0	107.7	E477 L478 E479 L480	E477-I504 HydrophobicContact CG-CD1 4.23Å; L478-I504 PolarHBondContact O-N 3.32Å; E479-I504 HydrophobicContact CB-CB 4.39Å; E479-I504 HydrophobicContact CG-CB 4.14Å; E479-I504 HydrophobicContact CG-CG2 4.21Å; L480-I504 PolarHBondContact N-O 2.76Å
505	E	87.9	Confident	93.3	Very high	152 Å²	152	86.7 Å²	86.7	71%	0.71	46%	0.458	S	S	*	.			trans	-88.3	0	-172	-51.8	-168.6	167.9	0	0	114.3	T481 F491	T481-E505 WeakPolarHBondContact CA-OXT 3.49Å; F491-E505 WeakPolarHBondContact CB-OE1 3.45Å; F491-E505 HydrophobicContact CD1-CG 3.9Å; F491-E505 HydrophobicContact CD2-CB 4.48Å; F491-E505 HydrophobicContact CD2-CG 3.94Å; F491-E505 HydrophobicContact CE1-CB 4.19Å; F491-E505 HydrophobicContact CE1-CG 3.77Å; F491-E505 HydrophobicContact CE2-CB 3.89Å; F491-E505 HydrophobicContact CE2-CG 3.82Å; F491-E505 HydrophobicContact CG-CG 3.99Å; F491-E505 WeakPolarHBondContact CG-OE1 3.13Å; F491-E505 HydrophobicContact CZ-CB 3.71Å; F491-E505 HydrophobicContact CZ-CG 3.72Å

Retrieved 505 of 505 residues in 350.1 ms (Link to these results)

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