A0A087YIP4_POEFO Loading...

Growth factor receptor bound protein 10

AlphaFold DB , UniProt , Accession A0A087YIP4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 617 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	32.2	Very low	32.9	Very low	238 Å²	238	140.8 Å²	140.8	100%	1.172	82%	0.823	S	S	*	*				0	97.5	0	-67.8	176.4	-175.7	0	0	105.6
2	A	30	Very low	32.6	Very low	95 Å²	95	143.2 Å²	143.2	79%	0.785	82%	0.819	S	S	*	*				63.6	125.9	83.6	0	0	0	0	0	109.4
3	V	30.6	Very low	32.5	Very low	137 Å²	137	145.9 Å²	145.9	83%	0.83	82%	0.82	S	S	*	*			cis	-159.9	158	25.8	176.5	0	0	0	0	110.6
4	A	32.1	Very low	33.7	Very low	98 Å²	98	143.4 Å²	143.4	81%	0.81	81%	0.813	S	S	*	*			trans	-42.3	164.9	163.8	0	0	0	0	0	119
5	G	27.8	Very low	33.5	Very low	83 Å²	83	143.7 Å²	143.7	86%	0.856	81%	0.811	S	S	*	*			trans	-162.7	100.4	156.2	0	0	0	0	0	112.5
6	C	28.8	Very low	33.3	Very low	115 Å²	115	147.8 Å²	147.8	78%	0.777	81%	0.812	S	S	*	*			trans	-95.9	169.9	163	-132.1	0	0	0	0	108.4
7	P	52.4	Low	33.3	Very low	124 Å²	124	147.8 Å²	147.8	81%	0.805	81%	0.805	S	S	*	*				-155.4	178.1	69.5	38.5	-15.2	0	0	0	118.3
8	D	34.8	Very low	33.2	Very low	127 Å²	127	147 Å²	147	68%	0.679	80%	0.795	S	S	*	*			trans	-61.9	163.7	-177.7	-60.3	-67.9	0	0	0	119
9	Y	31.9	Very low	33.2	Very low	232 Å²	232	145.3 Å²	145.3	91%	0.91	79%	0.785	S	S	*	*			trans	-147.3	96.5	141.8	-101.1	-81.2	0	0	0	112.3
10	F	31.3	Very low	33.1	Very low	171 Å²	171	144.4 Å²	144.4	75%	0.75	78%	0.78	S	S	*	*				28.1	128.9	123	-91.2	-61.6	0	0	0	124.2
11	L	30.1	Very low	33.2	Very low	129 Å²	129	144.1 Å²	144.1	68%	0.675	78%	0.777	S	S	*	*				113.9	128.5	123.8	-71.2	163.7	0	0	0	122.7
12	H	29.5	Very low	33.3	Very low	169 Å²	169	138.3 Å²	138.3	78%	0.782	75%	0.75	S	S	*	*			trans	81.3	117.1	136.1	-78.5	-57.5	0	0	0	123.6
13	H	30.6	Very low	33.5	Very low	179 Å²	179	143.5 Å²	143.5	83%	0.829	75%	0.75	S	S	*	*			trans	-53.2	171.5	146.8	-74.4	-71.5	0	0	0	112.6
14	P	49.3	Very low	33.4	Very low	110 Å²	110	142 Å²	142	71%	0.714	75%	0.745	S	S	*	*			cis	-149.6	177.1	23.8	36.6	-11.8	0	0	0	119.1
15	N	30.6	Very low	33.3	Very low	149 Å²	149	142 Å²	142	80%	0.797	74%	0.74	S	S	*	*			trans	25.7	139.7	146.2	-64.3	-16.4	0	0	0	123.9
16	Y	30.3	Very low	33.4	Very low	208 Å²	208	145 Å²	145	82%	0.816	74%	0.736	S	S	*	*				-170.8	110.7	127.4	-108.5	-90.6	0	0	0	108.4
17	Q	33.1	Very low	33.5	Very low	149 Å²	149	147.6 Å²	147.6	70%	0.696	74%	0.736	S	S	*	*				71.6	140.6	104.5	-82.6	-162	-36.1	0	0	115.8
18	Q	31.7	Very low	32.3	Very low	133 Å²	133	152.2 Å²	152.2	62%	0.621	74%	0.737	S	S	*	*			cis	-168.6	143.6	11.5	-172	80.7	15.2	0	0	109.4
19	D	33.7	Very low	32	Very low	114 Å²	114	154.4 Å²	154.4	61%	0.61	74%	0.744	S	S	*	*			trans	29.8	132.4	150.8	-55	-20.5	0	0	0	125.6
20	N	30.3	Very low	32	Very low	128 Å²	128	147.1 Å²	147.1	68%	0.684	73%	0.732	S	S	*	*				163.8	119.5	100.1	-93.4	-39.9	0	0	0	111.6
21	I	37	Very low	31.9	Very low	139 Å²	139	145.5 Å²	145.5	71%	0.713	73%	0.731	S	S	*	*				73	129.5	103.9	-69.6	-179.8	0	0	0	112.9
22	D	34.3	Very low	32.1	Very low	115 Å²	115	146.6 Å²	146.6	62%	0.615	74%	0.736	S	S	*	*			cis	-166.3	156.6	10.6	-128.2	-18	0	0	0	111.4
23	R	32.8	Very low	32.1	Very low	204 Å²	204	146.5 Å²	146.5	77%	0.77	74%	0.74	S	S	*	*			trans	55.9	115.5	138.1	-77.4	168	-172.4	-158.4	-3.7	122.5
24	S	29.6	Very low	32.1	Very low	106 Å²	106	148.9 Å²	148.9	74%	0.741	74%	0.742	S	S	*	*				92.2	148.4	87	78.8	0	0	0	0	112.7
25	S	30	Very low	31.9	Very low	99 Å²	99	148.3 Å²	148.3	69%	0.692	74%	0.738	S	S	*	*			cis	-179.4	144.4	-10.8	46.6	0	0	0	0	107.5
26	N	28.6	Very low	31.8	Very low	145 Å²	145	145.7 Å²	145.7	78%	0.775	73%	0.731	S	S	*	*			trans	37.9	123.5	143.4	-65.1	-21.7	0	0	0	123.1
27	H	30.7	Very low	31.7	Very low	169 Å²	169	145.9 Å²	145.9	78%	0.782	74%	0.737	S	S	*	*				161.7	125.6	114.6	-100.4	-13.5	0	0	0	110.9
28	R	28.9	Very low	31.5	Very low	221 Å²	221	147.3 Å²	147.3	83%	0.834	74%	0.743	S	S	*	*				45.7	128.5	91.9	-81.5	-170	176.1	-176.4	-0.5	112.2
29	Q	27.5	Very low	31.6	Very low	173 Å²	173	146.2 Å²	146.2	81%	0.808	75%	0.748	S	S	*	*			cis	-166.2	147.1	41.1	-115.2	167.7	-51.4	0	0	106.9
30	A	31.5	Very low	31.2	Very low	80 Å²	80	145.7 Å²	145.7	66%	0.661	75%	0.753	S	S	*	*				63.2	137.4	88.4	0	0	0	0	0	117.5
31	D	30.1	Very low	31	Very low	137 Å²	137	145.3 Å²	145.3	73%	0.733	76%	0.756	S	S	*	*			trans	110.9	104.8	159.7	-63.1	-16.5	0	0	0	115.7
32	L	33.6	Very low	30.5	Very low	151 Å²	151	145.1 Å²	145.1	79%	0.791	76%	0.756	S	S	*	*				92.2	139	77.9	-85.9	167.7	0	0	0	112.4
33	I	29.8	Very low	30.2	Very low	167 Å²	167	147.6 Å²	147.6	86%	0.856	76%	0.764	S	S	*	*			trans	125.3	116.2	151.5	-61.2	161.6	0	0	0	116
34	R	30.5	Very low	29.9	Very low	229 Å²	229	143.4 Å²	143.4	86%	0.864	77%	0.766	S	S	*	*			trans	-70.3	-178.7	163.8	-133.2	-175.4	173	175.4	-1.6	110
35	P	45.1	Very low	29.8	Very low	99 Å²	99	144 Å²	144	64%	0.643	77%	0.77	S	S	*	*			cis	-143	176	-0.3	37.1	-13.9	0	0	0	117.5
36	S	29.2	Very low	30.1	Very low	93 Å²	93	145.4 Å²	145.4	65%	0.65	78%	0.777	S	S	*	*			trans	54.8	124.4	145.6	56.6	0	0	0	0	122.1
37	F	27.6	Very low	30.1	Very low	212 Å²	212	146.2 Å²	146.2	93%	0.93	78%	0.781	S	S	*	*				-171.4	131	124	-98.1	-74	0	0	0	110.8
38	Q	28.8	Very low	30.3	Very low	179 Å²	179	147 Å²	147	84%	0.836	79%	0.785	S	S	*	*			trans	-78.6	164.8	162.4	-101.7	-177	-23.6	0	0	109.5
39	P	34.9	Very low	30.4	Very low	110 Å²	110	145.1 Å²	145.1	71%	0.714	79%	0.786	S	S	*	*			cis	-153.4	175.3	47.7	39.5	-16.7	0	0	0	119.6
40	S	24.8	Very low	30.6	Very low	104 Å²	104	144.2 Å²	144.2	73%	0.727	79%	0.786	S	S	*	*			trans	70.3	148.3	149	69.8	0	0	0	0	120.1
41	T	26.6	Very low	30.8	Very low	120 Å²	120	147.9 Å²	147.9	74%	0.736	80%	0.795	S	S	*	*			cis	-174.3	154.2	-17.5	26.3	0	0	0	0	106
42	N	26.7	Very low	31.1	Very low	135 Å²	135	149 Å²	149	72%	0.722	80%	0.801	S	S	*	*			trans	74.5	138.6	165.9	-65.7	-14	0	0	0	117
43	Q	27.2	Very low	31.9	Very low	167 Å²	167	147.4 Å²	147.4	78%	0.78	80%	0.797	S	S	*	*			cis	-168	169.1	10.6	-120.1	169.1	23.6	0	0	110.3
44	S	27.1	Very low	32.7	Very low	116 Å²	116	144.5 Å²	144.5	81%	0.811	78%	0.783	S	S	*	*			trans	85.4	94.5	158.5	77.3	0	0	0	0	120.5
45	S	27.2	Very low	33.3	Very low	118 Å²	118	139.8 Å²	139.8	83%	0.825	77%	0.774	S	S	*	*			trans	-109.1	148.8	146.7	-53.9	0	0	0	0	108.5
46	P	34.8	Very low	32.9	Very low	129 Å²	129	142 Å²	142	84%	0.838	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-99.3	144.9	159.9	27.8	-14.4	0	0	0	111.9
47	N	28.7	Very low	33.8	Very low	161 Å²	161	140.3 Å²	140.3	86%	0.861	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-64.9	150.6	-171.7	-79.4	-26.5	0	0	0	115.6
48	H	35.1	Very low	34.4	Very low	187 Å²	187	136.2 Å²	136.2	87%	0.866	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-54.9	132	151.7	-90.9	-72.2	0	0	0	111.1
49	Q	31.6	Very low	35.2	Very low	181 Å²	181	131.3 Å²	131.3	85%	0.846	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-102.1	134.5	157.2	-88.1	177.3	-27.6	0	0	108.3
50	D	31.1	Very low	35.4	Very low	153 Å²	153	130.9 Å²	130.9	82%	0.818	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-63.9	129.4	171.4	-63.2	-59.9	0	0	0	110.3	D52	D50-D52 PolarHBondContact O-N 3.16Å
51	D	35.8	Very low	36.3	Very low	158 Å²	158	131.9 Å²	131.9	85%	0.845	73%	0.726	S	S	*	*			trans	-91.2	93	167	-78.1	-37.4	0	0	0	108.2	V53	D51-V53 PolarHBondContact O-N 2.73Å
52	D	36.9	Very low	37	Very low	161 Å²	161	132.4 Å²	132.4	86%	0.861	72%	0.722	S	S	*	*			trans	-64.2	120.2	162.8	-91.8	-33.7	0	0	0	109	D50 D54	D50-D52 PolarHBondContact O-N 3.16Å; D52-D54 PolarHBondContact O-N 3.35Å
53	V	51	Low	37.6	Very low	116 Å²	116	130 Å²	130	70%	0.703	71%	0.709	S	S	*	*			trans	-81.5	113.8	176.2	-178.4	0	0	0	0	108.3	D51 L55	D51-V53 PolarHBondContact O-N 2.73Å; V53-L55 PolarHBondContact O-N 2.97Å
54	D	45.3	Very low	38.2	Very low	106 Å²	106	125.5 Å²	125.5	57%	0.567	70%	0.695	S	S	*	*			trans	-67	100.8	175.8	-171.7	-8.4	0	0	0	110.9	D52 E56 A57	D52-D54 PolarHBondContact O-N 3.35Å; D54-E56 PolarHBondContact O-N 3.27Å; D54-E56 WeakPolarHBondContact OD1-CB 3.44Å; D54-E56 PolarHBondContact OD1-N 3.07Å; D54-A57 HydrophobicContact CB-CB 4.47Å
55	L	43.8	Very low	38.7	Very low	130 Å²	130	123.9 Å²	123.9	68%	0.681	68%	0.684	S	S	*	*	H	α-helix	trans	-67.4	-18.9	178.4	-97.6	91.2	0	0	0	113	V53 V59	V53-L55 PolarHBondContact O-N 2.97Å; L55-V59 WeakPolarHBondContact O-CG2 2.8Å; L55-V59 PolarHBondContact O-N 2.88Å
56	E	37.7	Very low	39	Very low	147 Å²	147	123 Å²	123	69%	0.687	67%	0.67	S	S	*	*	H	α-helix	trans	-79.9	-32.6	-176.5	-136.6	174.8	-160.4	0	0	111.3	D54 L58 N60	D54-E56 PolarHBondContact O-N 3.27Å; D54-E56 WeakPolarHBondContact OD1-CB 3.44Å; D54-E56 PolarHBondContact OD1-N 3.07Å; E56-L58 VanDerWaalsContact C-N 3.35Å; E56-N60 PolarHBondContact O-N 2.69Å; E56-N60 PolarHBondContact O-ND2 3.13Å; E56-N60 VanDerWaalsContact O-ND2 3.1Å
57	A	47	Very low	39	Very low	56 Å²	56	124.1 Å²	124.1	46%	0.463	66%	0.664	S	S	.	*	H	α-helix	trans	-65.6	-35.7	171.6	0	0	0	0	0	112.6	D54 D61	D54-A57 HydrophobicContact CB-CB 4.47Å; A57-D61 PolarHBondContact O-N 3.41Å
58	L	39.8	Very low	39.4	Very low	127 Å²	127	120.4 Å²	120.4	67%	0.665	65%	0.651	S	S	*	*	H	α-helix	trans	-73.8	-31.9	-179.2	-163.1	74.7	0	0	0	112.8	E56	E56-L58 VanDerWaalsContact C-N 3.35Å
59	V	45.2	Very low	39.4	Very low	76 Å²	76	117.9 Å²	117.9	46%	0.461	64%	0.643	S	S	.	*	H	α-helix	trans	-76.5	-33.3	176.8	174.3	0	0	0	0	111.1	L55 M62 N63	L55-V59 WeakPolarHBondContact O-CG2 2.8Å; L55-V59 PolarHBondContact O-N 2.88Å; V59-M62 PolarHBondContact O-N 2.84Å; V59-N63 PolarHBondContact O-N 2.6Å
60	N	40.4	Very low	39.4	Very low	101 Å²	101	118.4 Å²	118.4	54%	0.54	64%	0.638	S	S	.	*	H	α-helix	trans	-72.1	-33.6	176.9	-73.5	-32	0	0	0	113.1	E56 M62 N63 S64	E56-N60 PolarHBondContact O-N 2.69Å; E56-N60 PolarHBondContact O-ND2 3.13Å; E56-N60 VanDerWaalsContact O-ND2 3.1Å; N60-M62 VanDerWaalsContact C-N 3.26Å; N60-M62 PolarHBondContact O-N 2.93Å; N60-N63 PolarHBondContact O-N 2.96Å; N60-S64 PolarHBondContact O-N 3.14Å
61	D	43.5	Very low	39.4	Very low	125 Å²	125	115.9 Å²	115.9	67%	0.668	63%	0.632	S	S	*	*	H	α-helix	trans	-69.5	-22	172.6	-101.8	6.5	0	0	0	113.4	A57 S64	A57-D61 PolarHBondContact O-N 3.41Å; D61-S64 PolarHBondContact O-OG 2.65Å; D61-S64 VanDerWaalsContact O-OG 3.08Å
62	M	41.4	Very low	39.3	Very low	131 Å²	131	114.2 Å²	114.2	65%	0.645	63%	0.628	S	S	*	*	H	α-helix	trans	-83.5	-29.1	177.2	-155.5	173.4	62.8	0	0	112.4	V59 N60	V59-M62 PolarHBondContact O-N 2.84Å; N60-M62 VanDerWaalsContact C-N 3.26Å; N60-M62 PolarHBondContact O-N 2.93Å
63	N	38.3	Very low	39.2	Very low	84 Å²	84	112.5 Å²	112.5	45%	0.449	63%	0.627	S	S	.	*	H	α-helix	trans	-77.7	-32.4	177.2	-75.8	-28.8	0	0	0	113	V59 N60 S65 L66 E67	V59-N63 PolarHBondContact O-N 2.6Å; N60-N63 PolarHBondContact O-N 2.96Å; N63-S65 PolarHBondContact O-N 3.05Å; N63-L66 PolarHBondContact O-N 3.25Å; N63-E67 PolarHBondContact O-N 3.21Å
64	S	40.5	Very low	38.1	Very low	72 Å²	72	112.3 Å²	112.3	50%	0.503	63%	0.631	S	S	.	*	H	α-helix	trans	-66.6	-27.2	174.7	62.2	0	0	0	0	112.8	N60 D61	N60-S64 PolarHBondContact O-N 3.14Å; D61-S64 PolarHBondContact O-OG 2.65Å; D61-S64 VanDerWaalsContact O-OG 3.08Å
65	S	37	Very low	37.2	Very low	82 Å²	82	110.8 Å²	110.8	57%	0.573	64%	0.64	S	S	*	*	H	α-helix	trans	-76.8	-23.4	175.1	-147.1	0	0	0	0	113.2	N63	N63-S65 PolarHBondContact O-N 3.05Å
66	L	34.7	Very low	36.4	Very low	101 Å²	101	114 Å²	114	53%	0.529	65%	0.652	S	S	.	*	H	α-helix	trans	-84.5	-35.8	-179.6	-162.8	77.5	0	0	0	112.6	N63 S68 L69	N63-L66 PolarHBondContact O-N 3.25Å; L66-S68 VanDerWaalsContact C-N 3.28Å; L66-S68 PolarHBondContact O-N 3.14Å; L66-L69 PolarHBondContact O-N 3.36Å
67	E	34.3	Very low	35.9	Very low	151 Å²	151	115.7 Å²	115.7	71%	0.706	66%	0.66	S	S	*	*	H	α-helix	trans	-69.9	-23.4	177.3	-77.8	-170.5	152.7	0	0	113.4	N63 L69 S71	N63-E67 PolarHBondContact O-N 3.21Å; E67-L69 PolarHBondContact O-N 2.96Å; E67-S71 PolarHBondContact O-OG 2.54Å
68	S	36.8	Very low	34.9	Very low	84 Å²	84	120.2 Å²	120.2	59%	0.587	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	-19.2	173.6	178.9	0	0	0	0	113.4	L66	L66-S68 VanDerWaalsContact C-N 3.28Å; L66-S68 PolarHBondContact O-N 3.14Å
69	L	34.4	Very low	34.3	Very low	134 Å²	134	122 Å²	122	70%	0.702	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-13	-176.1	-70.8	168.8	0	0	0	113.5	L66 E67	L66-L69 PolarHBondContact O-N 3.36Å; E67-L69 PolarHBondContact O-N 2.96Å
70	Y	31.4	Very low	33.4	Very low	192 Å²	192	126.2 Å²	126.2	75%	0.753	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	-9.4	176.3	-79.3	-78.2	0	0	0	114.4	T72	Y70-T72 PolarHBondContact O-N 2.79Å
71	S	31.9	Very low	32.8	Very low	99 Å²	99	127.3 Å²	127.3	69%	0.692	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	7.8	-176.2	-69	0	0	0	0	115.8	E67	E67-S71 PolarHBondContact O-OG 2.54Å
72	T	33.1	Very low	32.7	Very low	123 Å²	123	126.2 Å²	126.2	76%	0.755	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	10.3	-179.1	-3.8	0	0	0	0	115.1	Y70	Y70-T72 PolarHBondContact O-N 2.79Å
73	C	34.9	Very low	31.9	Very low	125 Å²	125	127 Å²	127	85%	0.845	72%	0.722	S	S	*	*	S	Bend	trans	-130.2	56.8	175.8	-69.1	0	0	0	0	112.3
74	S	28	Very low	31.3	Very low	112 Å²	112	129.9 Å²	129.9	78%	0.783	74%	0.736	S	S	*	*			trans	-170.5	113.2	160.1	48	0	0	0	0	110.4
75	G	26.3	Very low	30.7	Very low	74 Å²	74	134.1 Å²	134.1	76%	0.763	75%	0.748	S	S	*	*			trans	158.4	70.5	165.4	0	0	0	0	0	115.6
76	Q	28.1	Very low	30.1	Very low	199 Å²	199	137.8 Å²	137.8	93%	0.93	76%	0.761	S	S	*	*			trans	-139.6	118.4	131.6	-94.4	-170.9	-11.5	0	0	108.8
77	Q	26.9	Very low	29.7	Very low	182 Å²	182	136.5 Å²	136.5	85%	0.85	77%	0.772	S	S	*	*			trans	-80.9	146.7	179.5	-72.8	163.5	-37.7	0	0	110.7
78	T	26.9	Very low	29.4	Very low	150 Å²	150	138.1 Å²	138.1	92%	0.92	78%	0.78	S	S	*	*			trans	-132.1	125.7	142.9	-5.4	0	0	0	0	108.2
79	E	26.5	Very low	28.8	Very low	166 Å²	166	141.2 Å²	141.2	78%	0.776	79%	0.79	S	S	*	*			trans	-74.3	150.8	-174.8	-61.5	176.5	132.9	0	0	112.7
80	I	26.4	Very low	28.4	Very low	164 Å²	164	140.7 Å²	140.7	84%	0.841	79%	0.792	S	S	*	*				-176.6	137	106.3	-81.5	155.1	0	0	0	110
81	T	28	Very low	28	Very low	123 Å²	123	137 Å²	137	76%	0.755	79%	0.793	S	S	*	*			trans	-77.9	-171.5	-171.1	5.2	0	0	0	0	114.3
82	P	41.5	Very low	27.7	Very low	102 Å²	102	137 Å²	137	66%	0.662	79%	0.793	S	S	*	*				-130.6	-175.4	-73.8	31.7	-8.8	0	0	0	112.7
83	L	24.9	Very low	27.4	Very low	149 Å²	149	139.5 Å²	139.5	78%	0.78	80%	0.796	S	S	*	*				160.8	114.6	128.8	-83.2	164.8	0	0	0	113.8
84	L	25.4	Very low	27.1	Very low	144 Å²	144	141.2 Å²	141.2	75%	0.754	79%	0.791	S	S	*	*			trans	41.3	139	131.5	-67.3	172.7	0	0	0	124.2
85	H	26.8	Very low	27.2	Very low	161 Å²	161	142 Å²	142	75%	0.745	78%	0.782	S	S	*	*			trans	104.7	105.1	137	-101.3	72	0	0	0	120.6
86	N	25.8	Very low	27.3	Very low	158 Å²	158	146.4 Å²	146.4	85%	0.845	78%	0.783	S	S	*	*				40.5	133.9	118.3	-109.8	17.8	0	0	0	120.8
87	G	25.8	Very low	27.3	Very low	74 Å²	74	143.4 Å²	143.4	76%	0.763	77%	0.769	S	S	*	*			trans	142.1	101.5	143.7	0	0	0	0	0	116.4
88	Q	27.2	Very low	27.4	Very low	186 Å²	186	141.7 Å²	141.7	87%	0.869	76%	0.76	S	S	*	*			trans	-65.8	143.3	153.5	-73.5	171.5	-43.4	0	0	110
89	N	25.3	Very low	27.5	Very low	149 Å²	149	141.7 Å²	141.7	80%	0.797	75%	0.749	S	S	*	*			trans	-177.5	124.4	139.3	-93.2	-16.2	0	0	0	113.3
90	T	24.7	Very low	27.7	Very low	123 Å²	123	141.1 Å²	141.1	76%	0.755	75%	0.747	S	S	*	*			trans	15.5	136.3	131.8	59.6	0	0	0	0	120.7
91	C	24.5	Very low	27.9	Very low	115 Å²	115	140.7 Å²	140.7	78%	0.777	74%	0.741	S	S	*	*				164.3	120.9	103.9	-161.7	0	0	0	0	113.9
92	S	25	Very low	28	Very low	98 Å²	98	142.5 Å²	142.5	69%	0.685	74%	0.74	S	S	*	*			trans	29.6	129.8	136	-43.3	0	0	0	0	125.7
93	Q	26.3	Very low	27.4	Very low	175 Å²	175	144.6 Å²	144.6	82%	0.818	74%	0.741	S	S	*	*				44.9	136.7	126.4	-70.2	-174	-13.9	0	0	123.8
94	H	28.9	Very low	27.6	Very low	161 Å²	161	142.2 Å²	142.2	75%	0.745	73%	0.733	S	S	*	*				168.4	147.4	127.2	-93	-71.8	0	0	0	107.7
95	H	29.8	Very low	27.8	Very low	128 Å²	128	143.2 Å²	143.2	59%	0.593	73%	0.733	S	S	*	*			cis	-171.2	148.1	0.3	-133.6	28.6	0	0	0	108.6
96	H	28.9	Very low	27.8	Very low	167 Å²	167	143.6 Å²	143.6	77%	0.773	74%	0.735	S	S	*	*				178.4	115.8	120.7	-94.4	-48.9	0	0	0	114.1
97	Q	28.6	Very low	28	Very low	136 Å²	136	141.2 Å²	141.2	64%	0.636	73%	0.731	S	S	*	*			trans	-6	160.4	138.9	-69.1	175.5	-33.2	0	0	119.3
98	H	28.1	Very low	28.2	Very low	147 Å²	147	145.6 Å²	145.6	68%	0.681	73%	0.731	S	S	*	*			cis	-169.9	167.5	1.3	-118.8	-58.9	0	0	0	109.6
99	H	29.4	Very low	28.7	Very low	149 Å²	149	142.2 Å²	142.2	69%	0.69	73%	0.726	S	S	*	*			trans	112.8	104	154.6	-72.5	-50.2	0	0	0	117.7
100	H	30.1	Very low	28.9	Very low	155 Å²	155	145.5 Å²	145.5	72%	0.718	73%	0.727	S	S	*	*				78.6	137.8	105.5	-77.3	-30.9	0	0	0	114.2
101	H	30.8	Very low	29.1	Very low	155 Å²	155	148.7 Å²	148.7	72%	0.718	73%	0.733	S	S	*	*			cis	-159.4	159.9	22.6	-129.1	54.6	0	0	0	111.3
102	H	29.7	Very low	29.4	Very low	160 Å²	160	151.4 Å²	151.4	74%	0.741	73%	0.734	S	S	*	*			trans	-25.8	166.2	159.4	-83.1	-66.3	0	0	0	119
103	H	29.3	Very low	29.6	Very low	147 Å²	147	156 Å²	156	68%	0.681	74%	0.744	S	S	*	*			cis	-177.7	134.8	-14.8	-154.3	-20.9	0	0	0	104.9
104	T	28.7	Very low	29.8	Very low	99 Å²	99	151.6 Å²	151.6	61%	0.607	74%	0.738	S	S	*	*			trans	41.8	148.9	144.6	46.7	0	0	0	0	122.1
105	Q	29.2	Very low	29.8	Very low	164 Å²	164	149.4 Å²	149.4	77%	0.766	74%	0.74	S	S	*	*			cis	-177.3	147.5	20.6	-120.7	167.4	37.5	0	0	106.7
106	H	28.8	Very low	30	Very low	170 Å²	170	149.5 Å²	149.5	79%	0.787	75%	0.752	S	S	*	*				-178.6	120.9	127.4	-111.3	-61.9	0	0	0	114.7
107	S	29.1	Very low	29.9	Very low	107 Å²	107	150.2 Å²	150.2	75%	0.748	76%	0.756	S	S	*	*			trans	55.2	128.3	138.8	41.7	0	0	0	0	125.1
108	Q	29.8	Very low	30.6	Very low	166 Å²	166	149 Å²	149	78%	0.776	76%	0.76	S	S	*	*			trans	-52.6	-180	164.1	-78.7	-166.3	2.4	0	0	116.9
109	P	38.8	Very low	31	Very low	116 Å²	116	148.2 Å²	148.2	75%	0.753	77%	0.768	S	S	*	*			cis	-146.9	170.1	23.4	33.5	-7.7	0	0	0	121.9
110	R	28.4	Very low	31	Very low	217 Å²	217	146.2 Å²	146.2	82%	0.819	77%	0.771	S	S	*	*			trans	-8.4	149.5	161	-67.2	177.7	169.1	-178.7	-4	122.4
111	H	28.5	Very low	31.1	Very low	191 Å²	191	144.1 Å²	144.1	88%	0.884	77%	0.773	S	S	*	*				-169.1	138.5	114.5	-97.1	-68.1	0	0	0	114.4
112	H	31	Very low	31	Very low	172 Å²	172	142.5 Å²	142.5	80%	0.796	78%	0.78	S	S	*	*			trans	-101.7	148.9	162.6	-81.1	-56.9	0	0	0	109.7
113	H	29.9	Very low	31.2	Very low	193 Å²	193	140.3 Å²	140.3	89%	0.894	78%	0.782	S	S	*	*				157.4	164.5	121.8	-97.6	-64.1	0	0	0	114.8
114	A	29.1	Very low	31.2	Very low	83 Å²	83	138.9 Å²	138.9	69%	0.686	79%	0.789	S	S	*	*			trans	-99.4	166.8	-158.1	0	0	0	0	0	116.2
115	S	29.8	Very low	31.7	Very low	115 Å²	115	142.2 Å²	142.2	80%	0.804	80%	0.803	S	S	*	*			trans	48.8	140.9	158.2	-57.2	0	0	0	0	120.7
116	P	33.3	Very low	31.9	Very low	130 Å²	130	140.9 Å²	140.9	84%	0.844	81%	0.806	S	S	*	*				-154	163.4	99.2	37.1	-17.1	0	0	0	117.7
117	E	27.6	Very low	32.1	Very low	182 Å²	182	140.2 Å²	140.2	85%	0.85	81%	0.808	S	S	*	*			trans	-92.5	178.7	152.9	-87.1	-172.5	151.4	0	0	109.9
118	P	43.1	Very low	32.3	Very low	110 Å²	110	140.1 Å²	140.1	71%	0.714	81%	0.805	S	S	*	*			cis	-123.1	-171.1	-41.4	35.5	-17.7	0	0	0	111
119	P	35.8	Very low	32.6	Very low	132 Å²	132	138.2 Å²	138.2	86%	0.857	81%	0.807	S	S	*	*				-147.7	169.8	123.5	35.1	-17	0	0	0	116.3
120	S	31	Very low	32.4	Very low	106 Å²	106	140.8 Å²	140.8	74%	0.741	81%	0.809	S	S	*	*			trans	-90.9	147.2	-171.2	48.8	0	0	0	0	116.8
121	S	31.6	Very low	33	Very low	111 Å²	111	136.9 Å²	136.9	78%	0.776	81%	0.809	S	S	*	*			trans	56.7	116.5	146.7	67.4	0	0	0	0	122.6
122	S	29.3	Very low	33.8	Very low	121 Å²	121	136.5 Å²	136.5	85%	0.846	81%	0.805	S	S	*	*				-168.9	142.1	122.4	59	0	0	0	0	112.1
123	S	33.2	Very low	34.6	Very low	114 Å²	114	133.1 Å²	133.1	80%	0.797	79%	0.792	S	S	*	*			trans	-59.4	140.4	-176.8	51.1	0	0	0	0	117.1
124	S	30.1	Very low	35.8	Very low	118 Å²	118	134.5 Å²	134.5	83%	0.825	79%	0.79	S	S	*	*			trans	-164.7	128.6	134.8	46.3	0	0	0	0	111.2
125	N	38.9	Very low	37.2	Very low	169 Å²	169	139 Å²	139	90%	0.904	79%	0.789	S	S	*	*			trans	-67.5	121.8	177	-76.1	-29.8	0	0	0	111.3
126	V	32.6	Very low	38.8	Very low	135 Å²	135	134.4 Å²	134.4	82%	0.818	76%	0.757	S	S	*	*			trans	-149.7	107.6	151.7	-171.5	0	0	0	0	108.8
127	D	33.2	Very low	40.3	Very low	157 Å²	157	135.8 Å²	135.8	84%	0.84	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-69.2	138.8	170.6	-81.3	-40.9	0	0	0	111.2
128	P	33.7	Very low	41.6	Very low	105 Å²	105	131.3 Å²	131.3	68%	0.682	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-83.7	157.4	164.9	33.5	-29	0	0	0	110.8	Q130	P128-Q130 PolarHBondContact O-N 3.33Å
129	P	35.8	Very low	41.8	Very low	126 Å²	126	132.6 Å²	132.6	82%	0.818	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-72.2	119.3	-165.8	29.6	-33	0	0	0	111.4	T131	P129-T131 PolarHBondContact O-N 3.44Å; P129-T131 VanDerWaalsContact O-N 3.1Å
130	Q	35.6	Very low	42.1	Very low	169 Å²	169	134.7 Å²	134.7	79%	0.79	74%	0.735	S	S	*	*			trans	-65	106.1	165	-73.7	-172.7	-11.1	0	0	109.5	P128 K132	P128-Q130 PolarHBondContact O-N 3.33Å; Q130-K132 VanDerWaalsContact C-N 3.31Å; Q130-K132 PolarHBondContact O-N 2.71Å
131	T	39.9	Very low	42.8	Very low	135 Å²	135	136.9 Å²	136.9	83%	0.828	74%	0.737	S	S	*	*			trans	-63.8	95	158.9	35.7	0	0	0	0	108.2	P129 L133	P129-T131 PolarHBondContact O-N 3.44Å; P129-T131 VanDerWaalsContact O-N 3.1Å; T131-L133 PolarHBondContact O-N 2.85Å
132	K	44.9	Very low	42.9	Very low	184 Å²	184	138.7 Å²	138.7	80%	0.8	74%	0.737	S	S	*	*			trans	-61.8	103	172.5	-72.1	-177.5	179.2	178.6	0	108.8	Q130 R134	Q130-K132 VanDerWaalsContact C-N 3.31Å; Q130-K132 PolarHBondContact O-N 2.71Å; K132-R134 PolarHBondContact O-N 3.13Å; K132-R134 VanDerWaalsContact O-N 3.12Å
133	L	49.4	Very low	43	Very low	100 Å²	100	136.9 Å²	136.9	52%	0.524	73%	0.73	S	S	.	*			trans	-54.5	115.2	167.1	-107.8	131.1	0	0	0	108.4	T131 R135 V473	T131-L133 PolarHBondContact O-N 2.85Å; L133-R135 PolarHBondContact O-N 2.84Å; L133-V473 HydrophobicContact CD2-CB 4.28Å; L133-V473 HydrophobicContact CD2-CG1 3.97Å
134	R	53.9	Low	43.1	Very low	222 Å²	222	137.8 Å²	137.8	84%	0.838	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-69.7	116.9	175.9	-91.8	-159.3	175.2	-157.9	1.9	109.1	K132	K132-R134 PolarHBondContact O-N 3.13Å; K132-R134 VanDerWaalsContact O-N 3.12Å
135	R	57.7	Low	43.4	Very low	177 Å²	177	143.6 Å²	143.6	67%	0.668	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-65.2	133.6	169.9	-79.8	-174.6	153.8	-163.3	-10.1	110.7	L133	L133-R135 PolarHBondContact O-N 2.84Å
136	S	64.4	Low	43	Very low	20 Å²	20	144.9 Å²	144.9	14%	0.14	73%	0.731	C	S	.	*	P	Polyproline II helix	trans	-58.1	139.8	169.5	38.6	0	0	0	0	111.7	R467 E474	S136-R467 PolarHBondContact O-NH1 2.75Å; S136-R467 PolarHBondContact OG-NH1 3.15Å; S136-E474 PolarHBondContact N-OE2 3.47Å; S136-E474 PolarHBondContact OG-OE2 3.25Å
137	Q	65.6	Low	43.1	Very low	159 Å²	159	146.9 Å²	146.9	74%	0.743	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-82.6	149.3	-177.4	-67.3	-156.8	-3.5	0	0	111.9	M139	Q137-M139 PolarHBondContact O-N 3.49Å
138	P	54.5	Low	42.9	Very low	87 Å²	87	147.3 Å²	147.3	57%	0.565	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-61.1	124.7	175	-19.2	31.2	0	0	0	111.6	R467	P138-R467 HydrophobicContact CB-CB 4.42Å
139	M	46	Very low	43.1	Very low	138 Å²	138	150.6 Å²	150.6	68%	0.68	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-78.8	126.5	172.8	-78.9	-68.2	-73.8	0	0	110.5	Q137 I141	Q137-M139 PolarHBondContact O-N 3.49Å; M139-I141 PolarHBondContact O-N 2.9Å
140	H	42.2	Very low	42.7	Very low	176 Å²	176	153.9 Å²	153.9	82%	0.815	74%	0.744	S	S	*	*			trans	-83.4	101.1	176.3	-145.2	-80.5	0	0	0	109.2	L142	H140-L142 PolarHBondContact O-N 3.27Å
141	I	45.9	Very low	42.8	Very low	151 Å²	151	154.8 Å²	154.8	77%	0.774	75%	0.748	S	S	*	*			trans	-77	111.9	175.4	-58.6	174.4	0	0	0	107.8	M139 A143	M139-I141 PolarHBondContact O-N 2.9Å; I141-A143 PolarHBondContact O-N 3.33Å; I141-A143 VanDerWaalsContact O-N 3.07Å
142	L	33.2	Very low	42.4	Very low	149 Å²	149	156.6 Å²	156.6	78%	0.78	75%	0.747	S	S	*	*			trans	-67.5	105.3	169.7	-73.1	169.3	0	0	0	108.4	H140 V144	H140-L142 PolarHBondContact O-N 3.27Å; L142-V144 PolarHBondContact O-N 2.65Å
143	A	32.8	Very low	41.8	Very low	84 Å²	84	155.4 Å²	155.4	69%	0.694	75%	0.745	S	S	*	*			trans	-69.6	96.1	173.5	0	0	0	0	0	109.5	I141 R145	I141-A143 PolarHBondContact O-N 3.33Å; I141-A143 VanDerWaalsContact O-N 3.07Å; A143-R145 PolarHBondContact O-N 2.79Å
144	V	33.9	Very low	40.8	Very low	133 Å²	133	159.9 Å²	159.9	81%	0.806	76%	0.76	S	S	*	*			trans	-74.8	84.6	165.9	-176.4	0	0	0	0	107.7	L142 K146	L142-V144 PolarHBondContact O-N 2.65Å; V144-K146 HydrophobicContact CG1-CB 4.45Å; V144-K146 PolarHBondContact O-N 2.96Å
145	R	38	Very low	39.7	Very low	240 Å²	240	161.1 Å²	161.1	91%	0.906	77%	0.765	S	S	*	*			trans	-82.9	93.3	158.8	-76.8	-174.8	178.1	174.9	-0.1	107.5	A143	A143-R145 PolarHBondContact O-N 2.79Å
146	K	29	Very low	38.3	Very low	195 Å²	195	159.5 Å²	159.5	85%	0.848	78%	0.775	S	S	*	*			trans	-127.2	100.8	159	-129.4	-175.7	-178.8	-170.6	0	108	V144	V144-K146 HydrophobicContact CG1-CB 4.45Å; V144-K146 PolarHBondContact O-N 2.96Å
147	L	34.8	Very low	36.7	Very low	177 Å²	177	163.9 Å²	163.9	93%	0.927	81%	0.806	S	S	*	*			trans	-104.2	92.9	172.3	-141	157.5	0	0	0	104.5
148	Q	29.6	Very low	35.3	Very low	167 Å²	167	161.7 Å²	161.7	78%	0.78	81%	0.808	S	S	*	*			trans	-160.1	124.9	157.7	-144.7	159.3	4.6	0	0	109.8
149	E	37.2	Very low	34.4	Very low	174 Å²	174	165.5 Å²	165.5	81%	0.813	82%	0.822	S	S	*	*			trans	6.8	112.9	160.8	-67.5	162	148.8	0	0	117.6
150	E	28.1	Very low	34	Very low	194 Å²	194	164.5 Å²	164.5	91%	0.907	83%	0.826	S	S	*	*			trans	-165.6	105.7	138.2	-112.2	170.4	-175.4	0	0	109.3
151	E	36.8	Very low	33.9	Very low	188 Å²	188	160.7 Å²	160.7	88%	0.879	83%	0.825	S	S	*	*			trans	-81.5	134.9	165.9	-139.7	176.8	178.8	0	0	107.4
152	Q	32.6	Very low	33.6	Very low	173 Å²	173	161 Å²	161	81%	0.808	83%	0.827	S	S	*	*	S	Bend	trans	94.4	128.3	177.2	-55	-178	6.2	0	0	117.4
153	Q	32.2	Very low	34	Very low	160 Å²	160	159.3 Å²	159.3	75%	0.748	83%	0.825	S	S	*	*			trans	77	102.5	169.6	-60.4	172.3	-2.1	0	0	116.2
154	F	29.3	Very low	34.9	Very low	194 Å²	194	159.8 Å²	159.8	85%	0.851	82%	0.816	S	S	*	*				168.4	121.4	112.7	-88.8	-70.8	0	0	0	109.6
155	R	30	Very low	35.4	Very low	248 Å²	248	158.3 Å²	158.3	94%	0.936	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-69.6	133.6	168.5	-74.6	-154.2	178.8	-166.3	2.8	109.6
156	T	27.7	Very low	35.9	Very low	143 Å²	143	153.4 Å²	153.4	88%	0.877	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-82.1	120.5	169	47.8	0	0	0	0	111.1
157	S	32.3	Very low	36.8	Very low	112 Å²	112	148.8 Å²	148.8	78%	0.783	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-69.3	129.2	168.3	50.7	0	0	0	0	112.7
158	S	34.3	Very low	37.5	Very low	113 Å²	113	149 Å²	149	79%	0.79	78%	0.781	S	S	*	*			trans	178.6	103.1	137.5	53.1	0	0	0	0	110.8
159	L	36.2	Very low	38.3	Very low	166 Å²	166	148.4 Å²	148.4	87%	0.869	78%	0.782	S	S	*	*	S	Bend	trans	171.3	142.1	142.1	-88.2	175.7	0	0	0	107.8	A161	L159-A161 PolarHBondContact O-N 2.85Å
160	P	37	Very low	38.6	Very low	117 Å²	117	144.8 Å²	144.8	76%	0.76	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-67.5	129.4	-177.9	26.7	-30.7	0	0	0	110.5	I162	P160-I162 PolarHBondContact O-N 3.21Å
161	A	40.5	Very low	39.3	Very low	96 Å²	96	139.3 Å²	139.3	79%	0.793	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-69	122.6	-175.7	0	0	0	0	0	111.3	L159	L159-A161 PolarHBondContact O-N 2.85Å
162	I	40.2	Very low	39.6	Very low	158 Å²	158	137.2 Å²	137.2	81%	0.81	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-60.2	129	159.5	-61	170.1	0	0	0	106.8	P160 N164	P160-I162 PolarHBondContact O-N 3.21Å; I162-N164 PolarHBondContact O-N 3.11Å
163	P	41.5	Very low	40	Very low	114 Å²	114	133.5 Å²	133.5	74%	0.74	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-58.9	128.6	177.5	-20.9	31.3	0	0	0	110.5	P165	P163-P165 WeakPolarHBondContact O-CD 3.13Å
164	N	51.4	Low	40.4	Very low	94 Å²	94	130.7 Å²	130.7	50%	0.503	76%	0.758	S	S	.	*	P	Polyproline II helix	trans	-60	120.1	176	175.4	8	0	0	0	109.6	I162 F166	I162-N164 PolarHBondContact O-N 3.11Å; N164-F166 PolarHBondContact ND2-O 3.35Å; N164-F166 PolarHBondContact O-N 3.26Å; N164-F166 VanDerWaalsContact O-N 3.15Å; N164-F166 PolarHBondContact OD1-N 3.31Å
165	P	44.8	Very low	40.7	Very low	101 Å²	101	126.5 Å²	126.5	66%	0.656	75%	0.752	S	S	*	*	S	Bend	trans	-71.4	-3.8	-177.4	27.3	-32.1	0	0	0	114.1	P163	P163-P165 WeakPolarHBondContact O-CD 3.13Å
166	F	48	Very low	41	Very low	138 Å²	138	121.1 Å²	121.1	61%	0.605	75%	0.749	S	S	*	*			trans	-134.4	85.8	178	-59.6	-75.7	0	0	0	112.2	N164 E168 L169	N164-F166 PolarHBondContact ND2-O 3.35Å; N164-F166 PolarHBondContact O-N 3.26Å; N164-F166 VanDerWaalsContact O-N 3.15Å; N164-F166 PolarHBondContact OD1-N 3.31Å; F166-E168 VanDerWaalsContact C-N 3.32Å; F166-E168 PolarHBondContact O-N 3.49Å; F166-L169 HydrophobicContact CB-CD1 4.46Å
167	P	47.5	Very low	41.3	Very low	98 Å²	98	120.2 Å²	120.2	64%	0.636	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-71.5	-21.8	180	-16.5	30.7	0	0	0	114.2	L169	P167-L169 VanDerWaalsContact C-N 3.35Å; P167-L169 PolarHBondContact O-N 3.22Å
168	E	49.6	Very low	41.4	Very low	182 Å²	182	122.8 Å²	122.8	85%	0.85	75%	0.748	S	S	*	*	G	3₁₀ helix	trans	-81	-10.5	-169.2	-63.2	179.2	-176.4	0	0	114.3	F166	F166-E168 VanDerWaalsContact C-N 3.32Å; F166-E168 PolarHBondContact O-N 3.49Å
169	L	46.2	Very low	41.3	Very low	153 Å²	153	122.3 Å²	122.3	80%	0.801	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-92	1.7	179.5	-65.7	173.8	0	0	0	113.9	F166 P167	F166-L169 HydrophobicContact CB-CD1 4.46Å; P167-L169 VanDerWaalsContact C-N 3.35Å; P167-L169 PolarHBondContact O-N 3.22Å
170	C	45.1	Very low	41.4	Very low	99 Å²	99	121 Å²	121	67%	0.669	75%	0.746	S	S	*	*			trans	-115	40.4	-178.1	-72.1	0	0	0	0	113.1
171	S	42.5	Very low	41.6	Very low	78 Å²	78	118.9 Å²	118.9	55%	0.545	75%	0.745	S	S	.	*			trans	-100.7	122.6	164.7	-64.6	0	0	0	0	109.3	A173	S171-A173 PolarHBondContact O-N 3.42Å
172	P	43.2	Very low	41.6	Very low	145 Å²	145	119.7 Å²	119.7	94%	0.942	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	24.1	-175.8	30.2	-33.4	0	0	0	114.1
173	A	39.8	Very low	41.5	Very low	95 Å²	95	120.1 Å²	120.1	79%	0.785	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.5	2.8	-172.4	0	0	0	0	0	114.9	S171	S171-A173 PolarHBondContact O-N 3.42Å
174	S	42.4	Very low	41.5	Very low	101 Å²	101	119.8 Å²	119.8	71%	0.706	75%	0.745	S	S	*	*	S	Bend	trans	-149.9	73.7	179.4	55.9	0	0	0	0	112.5
175	S	34	Very low	41.1	Very low	106 Å²	106	122.1 Å²	122.1	74%	0.741	77%	0.766	S	S	*	*	S	Bend	trans	-150.7	140	154	-77.9	0	0	0	0	108	V177	S175-V177 VanDerWaalsContact C-N 3.31Å; S175-V177 PolarHBondContact O-N 3.06Å
176	P	36.3	Very low	40.7	Very low	134 Å²	134	120.4 Å²	120.4	87%	0.87	77%	0.766	S	S	*	*			trans	-79.5	80.9	-164.7	33.3	-33.6	0	0	0	109.9
177	V	35	Very low	40.5	Very low	124 Å²	124	123.2 Å²	123.2	75%	0.752	78%	0.781	S	S	*	*			trans	-90.8	111.3	164.4	179.1	0	0	0	0	106.2	S175 S179	S175-V177 VanDerWaalsContact C-N 3.31Å; S175-V177 PolarHBondContact O-N 3.06Å; V177-S179 PolarHBondContact O-N 3.01Å
178	L	34.3	Very low	40.3	Very low	167 Å²	167	123.9 Å²	123.9	87%	0.874	79%	0.788	S	S	*	*			trans	-57.6	119.2	170.2	-69	169.3	0	0	0	108.5
179	S	31.1	Very low	40.2	Very low	103 Å²	103	120 Å²	120	72%	0.72	78%	0.782	S	S	*	*			trans	-55.5	136.2	176.9	-50.1	0	0	0	0	111.3	V177 G181	V177-S179 PolarHBondContact O-N 3.01Å; S179-G181 PolarHBondContact O-N 3.07Å; S179-G181 VanDerWaalsContact O-N 3.11Å
180	P	38.4	Very low	41	Very low	139 Å²	139	117.6 Å²	117.6	90%	0.903	78%	0.778	S	S	*	*	S	Bend	trans	-78.4	95.1	171.7	30.5	-28.9	0	0	0	108.5
181	G	41.6	Very low	42.7	Very low	72 Å²	72	119.4 Å²	119.4	74%	0.742	78%	0.776	S	S	*	*			trans	166.4	46.5	178	0	0	0	0	0	116.4	S179	S179-G181 PolarHBondContact O-N 3.07Å; S179-G181 VanDerWaalsContact O-N 3.11Å
182	S	41.5	Very low	45	Very low	112 Å²	112	119.5 Å²	119.5	78%	0.783	77%	0.771	S	S	*	*			trans	-174.8	73.3	160.4	52.4	0	0	0	0	111.7
183	L	36.8	Very low	47.4	Very low	167 Å²	167	114.8 Å²	114.8	87%	0.874	74%	0.736	S	S	*	*	S	Bend	trans	-142.3	147.6	158.5	-81.8	177.7	0	0	0	108.1
184	P	42.3	Very low	50.1	Low	107 Å²	107	115.6 Å²	115.6	70%	0.695	73%	0.726	S	S	*	*			trans	-64.7	161.2	-171.2	29.8	-34.5	0	0	0	110.7	G186	P184-G186 PolarHBondContact O-N 2.82Å
185	P	41.9	Very low	52.6	Low	143 Å²	143	110.8 Å²	110.8	93%	0.929	69%	0.692	S	S	*	*			trans	-64.2	103.9	-177.4	26.5	-31.3	0	0	0	109.6
186	G	37.4	Very low	55.6	Low	65 Å²	65	111.8 Å²	111.8	67%	0.67	68%	0.683	S	S	*	*			trans	-125	101.1	165.9	0	0	0	0	0	107	P184 S188	P184-G186 PolarHBondContact O-N 2.82Å; G186-S188 PolarHBondContact O-N 2.93Å
187	E	44.4	Very low	58.5	Low	197 Å²	197	105.4 Å²	105.4	92%	0.921	64%	0.642	S	S	*	*			trans	-55	124.7	171.3	-65.3	174.8	152.5	0	0	109.7
188	S	42.4	Very low	61.3	Low	112 Å²	112	101 Å²	101	78%	0.783	61%	0.613	S	S	*	*			trans	-130.7	77.7	152.7	70.1	0	0	0	0	107.5	G186 S190	G186-S188 PolarHBondContact O-N 2.93Å; S188-S190 PolarHBondContact O-N 2.79Å; S188-S190 VanDerWaalsContact O-N 3.13Å
189	S	48.5	Very low	63.9	Low	102 Å²	102	93.2 Å²	93.2	71%	0.713	57%	0.572	S	S	*	*			trans	-51.4	118	156.3	50.7	0	0	0	0	107.1	E191	S189-E191 PolarHBondContact O-N 2.91Å
190	S	61.7	Low	66.4	Low	102 Å²	102	90.4 Å²	90.4	71%	0.713	55%	0.547	S	S	*	.			trans	-65	87	168.5	47.4	0	0	0	0	107.5	S188 N192	S188-S190 PolarHBondContact O-N 2.79Å; S188-S190 VanDerWaalsContact O-N 3.13Å; S190-N192 PolarHBondContact O-N 3.2Å
191	E	81.1	Confident	68.4	Low	136 Å²	136	87.9 Å²	87.9	64%	0.636	53%	0.527	S	S	*	.			trans	-68.3	106	-178.4	-169.7	175.9	-167.1	0	0	108.1	S189 H193	S189-E191 PolarHBondContact O-N 2.91Å; E191-H193 PolarHBondContact O-CE1 3.43Å; E191-H193 VanDerWaalsContact O-CE1 3.3Å; E191-H193 PolarHBondContact O-ND1 2.94Å
192	N	90.3	Very high	70.4	Confident	81 Å²	81	86.8 Å²	86.8	43%	0.433	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	136.4	175	-73.6	-17.5	0	0	0	109.6	S190 E208	S190-N192 PolarHBondContact O-N 3.2Å; N192-E208 HydrophobicContact CB-CG 3.56Å; N192-E208 WeakPolarHBondContact CB-OE1 3.49Å; N192-E208 VanDerWaalsContact CG-OE1 3.28Å; N192-E208 PolarHBondContact ND2-OE1 3.29Å
193	H	95.2	Very high	72.7	Confident	45 Å²	45	87 Å²	87	21%	0.208	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	136.9	-176.1	-68.3	68.6	0	0	0	110.1	E191 E208 I209 V256	E191-H193 PolarHBondContact O-CE1 3.43Å; E191-H193 VanDerWaalsContact O-CE1 3.3Å; E191-H193 PolarHBondContact O-ND1 2.94Å; H193-E208 WeakPolarHBondContact O-CA 3.39Å; H193-I209 HydrophobicContact CB-CG1 4.36Å; H193-I209 PolarHBondContact N-O 2.71Å; H193-I209 PolarHBondContact O-N 2.9Å; H193-V256 HydrophobicContact CB-CG2 3.79Å; H193-V256 VanDerWaalsContact CD2-CG1 3.44Å; H193-V256 WeakPolarHBondContact CD2-CG1 3.28Å
194	I	95.4	Very high	75.3	Confident	113 Å²	113	81.9 Å²	81.9	58%	0.579	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	126.3	176.8	-61	176.3	0	0	0	109.4	V206 Q259	I194-V206 HydrophobicContact CG2-CG1 3.34Å; I194-Q259 PolarHBondContact O-NE2 2.87Å
195	V	96	Very high	77.7	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	136.3	178.2	-177.9	0	0	0	0	110.2	I197 V206 V207 I209 V255 F268	V195-I197 HydrophobicContact CG1-CD1 4.47Å; V195-I197 HydrophobicContact CG1-CG1 3.99Å; V195-V206 WeakPolarHBondContact O-CA 3.21Å; V195-V207 PolarHBondContact N-O 2.89Å; V195-V207 PolarHBondContact O-N 3.5Å; V195-I209 HydrophobicContact CB-CD1 4.38Å; V195-I209 HydrophobicContact CG2-CD1 3.41Å; V195-I209 VanDerWaalsContact CG2-CD1 3.41Å; V195-I209 HydrophobicContact CG2-CG1 3.8Å; V195-V255 HydrophobicContact CG1-CG1 4.2Å; V195-V255 HydrophobicContact CG2-CG1 4.24Å; V195-F268 HydrophobicContact CG1-CD2 3.5Å; V195-F268 VanDerWaalsContact CG1-CD2 3.5Å; V195-F268 HydrophobicContact CG1-CE2 3.73Å
196	K	95.9	Very high	80.2	Confident	126 Å²	126	76.4 Å²	76.4	55%	0.548	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	125.7	174.4	-63.2	-176.3	-179.2	176	0	109.9	F198 V206	K196-F198 HydrophobicContact CB-CE2 3.95Å; K196-F198 HydrophobicContact CB-CZ 4.49Å; K196-V206 HydrophobicContact CG-CG2 4.33Å
197	I	96.6	Very high	83	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126	-174.6	-51.3	177.7	0	0	0	107.8	V195 C204 K205 V207 L218 L222 L236 F270 L617	V195-I197 HydrophobicContact CG1-CD1 4.47Å; V195-I197 HydrophobicContact CG1-CG1 3.99Å; I197-C204 WeakPolarHBondContact O-CA 3.46Å; I197-K205 PolarHBondContact N-O 2.97Å; I197-K205 PolarHBondContact O-N 3.29Å; I197-V207 HydrophobicContact CD1-CB 4.32Å; I197-V207 HydrophobicContact CD1-CG2 3.94Å; I197-L218 HydrophobicContact CD1-CD1 3.86Å; I197-L218 HydrophobicContact CD1-CD2 3.77Å; I197-L218 HydrophobicContact CD1-CG 4.06Å; I197-L222 HydrophobicContact CD1-CD1 3.84Å; I197-L222 HydrophobicContact CD1-CD2 4.05Å; I197-L222 HydrophobicContact CD1-CG 4.37Å; I197-L222 HydrophobicContact CG2-CD1 3.97Å; I197-L236 HydrophobicContact CG2-CD1 4.02Å; I197-F270 HydrophobicContact CG2-CB 3.74Å; I197-L617 HydrophobicContact CB-CD1 4.37Å; I197-L617 HydrophobicContact CG2-CD1 3.86Å
198	F	94.9	Very high	85.5	Confident	33 Å²	33	70 Å²	70	15%	0.145	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	141.5	-176.1	-62.8	-100.9	0	0	0	110.4	K196 M203 C204 R267 F268 L269 F270	K196-F198 HydrophobicContact CB-CE2 3.95Å; K196-F198 HydrophobicContact CB-CZ 4.49Å; F198-M203 CarbonylContact C-O 3.59Å; F198-M203 WeakPolarHBondContact CA-O 3.21Å; F198-C204 HydrophobicContact CD1-CB 3.75Å; F198-C204 HydrophobicContact CE1-CB 3.62Å; F198-C204 HydrophobicContact CG-CB 4.46Å; F198-C204 HydrophobicContact CZ-CB 4.23Å; F198-R267 HydrophobicContact CD2-CB 3.73Å; F198-R267 HydrophobicContact CD2-CG 4.17Å; F198-R267 HydrophobicContact CE2-CB 3.86Å; F198-R267 HydrophobicContact CE2-CG 3.87Å; F198-R267 HydrophobicContact CZ-CG 4.35Å; F198-F268 PolarHBondContact N-O 2.83Å; F198-L269 HydrophobicContact CB-CD2 3.83Å; F198-L269 CarbonylContact O-C 3.52Å; F198-L269 VanDerWaalsContact O-CA 3.23Å; F198-L269 WeakPolarHBondContact O-CA 3.37Å; F198-F270 PolarHBondContact O-N 2.81Å
199	S	88.9	Confident	88.1	Confident	2 Å²	2	64.8 Å²	64.8	1%	0.014	36%	0.357	C	S	.	.			trans	-85.8	171.2	165.9	36.6	0	0	0	0	110.7	D201 G202 M203 V615	S199-D201 VanDerWaalsContact CB-OD1 3.22Å; S199-D201 WeakPolarHBondContact CB-OD1 3.33Å; S199-D201 PolarHBondContact O-N 3.28Å; S199-D201 PolarHBondContact OG-OD1 3.26Å; S199-G202 PolarHBondContact O-N 2.88Å; S199-M203 PolarHBondContact N-O 2.9Å; S199-M203 WeakPolarHBondContact OG-CB 3.04Å; S199-M203 PolarHBondContact OG-O 2.87Å; S199-V615 WeakPolarHBondContact CB-O 3.08Å
200	E	82.9	Confident	90.4	Very high	44 Å²	44	62.2 Å²	62.2	21%	0.206	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-21.7	-178.3	-62	-178.7	105.3	0	0	113.4	G202 R271 V614	E200-G202 VanDerWaalsContact C-N 3.27Å; E200-R271 HydrophobicContact CG-CB 3.75Å; E200-R271 WeakPolarHBondContact OE1-CD 3.22Å; E200-V614 HydrophobicContact CB-CG1 4.41Å
201	D	80.8	Confident	92	Very high	87 Å²	87	59.8 Å²	59.8	47%	0.465	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-2.7	173.7	65.7	-5.7	0	0	0	113.5	S199 M203	S199-D201 VanDerWaalsContact CB-OD1 3.22Å; S199-D201 WeakPolarHBondContact CB-OD1 3.33Å; S199-D201 PolarHBondContact O-N 3.28Å; S199-D201 PolarHBondContact OG-OD1 3.26Å; D201-M203 WeakPolarHBondContact OD1-CB 2.8Å; D201-M203 WeakPolarHBondContact OD1-CG 3.39Å; D201-M203 PolarHBondContact OD1-N 3.02Å; D201-M203 WeakPolarHBondContact OD2-CG 3.38Å
202	G	83.9	Confident	92.6	Very high	49 Å²	49	58.1 Å²	58.1	51%	0.505	32%	0.32	S	S	.	.	S	Bend	trans	87.8	-0.7	179.9	0	0	0	0	0	114.9	S199 E200	S199-G202 PolarHBondContact O-N 2.88Å; E200-G202 VanDerWaalsContact C-N 3.27Å
203	M	88.6	Confident	93	Very high	115 Å²	115	55.5 Å²	55.5	57%	0.567	31%	0.305	S	S	*	.			trans	-64	144.7	172.6	-62.7	-68.8	-73.2	0	0	110.1	F198 S199 D201	F198-M203 CarbonylContact C-O 3.59Å; F198-M203 WeakPolarHBondContact CA-O 3.21Å; S199-M203 PolarHBondContact N-O 2.9Å; S199-M203 WeakPolarHBondContact OG-CB 3.04Å; S199-M203 PolarHBondContact OG-O 2.87Å; D201-M203 WeakPolarHBondContact OD1-CB 2.8Å; D201-M203 WeakPolarHBondContact OD1-CG 3.39Å; D201-M203 PolarHBondContact OD1-N 3.02Å; D201-M203 WeakPolarHBondContact OD2-CG 3.38Å
204	C	92.1	Very high	93.1	Very high	61 Å²	61	54.5 Å²	54.5	41%	0.412	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.8	-174.4	177.5	0	0	0	0	110.4	I197 F198	I197-C204 WeakPolarHBondContact O-CA 3.46Å; F198-C204 HydrophobicContact CD1-CB 3.75Å; F198-C204 HydrophobicContact CE1-CB 3.62Å; F198-C204 HydrophobicContact CG-CB 4.46Å; F198-C204 HydrophobicContact CZ-CB 4.23Å
205	K	92.6	Very high	93.3	Very high	43 Å²	43	49.1 Å²	49.1	19%	0.187	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	132.3	170.6	-166.3	175.9	-159.2	149.3	0	109.6	I197 V207 L222 L617	I197-K205 PolarHBondContact N-O 2.97Å; I197-K205 PolarHBondContact O-N 3.29Å; K205-V207 HydrophobicContact CD-CG2 4.37Å; K205-V207 HydrophobicContact CG-CG2 4.14Å; K205-L222 HydrophobicContact CD-CD2 4.18Å; K205-L617 HydrophobicContact CB-CB 4.2Å; K205-L617 HydrophobicContact CB-CD1 4.34Å; K205-L617 HydrophobicContact CD-CB 4.41Å; K205-L617 HydrophobicContact CD-CD2 4.43Å; K205-L617 WeakPolarHBondContact CD-OXT 3.12Å; K205-L617 WeakPolarHBondContact CE-OXT 3.34Å; K205-L617 PolarHBondContact NZ-OXT 3.32Å
206	V	95.4	Very high	93.3	Very high	92 Å²	92	50.2 Å²	50.2	56%	0.558	28%	0.279	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	128.9	173.8	-175	0	0	0	0	108	I194 V195 K196	I194-V206 HydrophobicContact CG2-CG1 3.34Å; V195-V206 WeakPolarHBondContact O-CA 3.21Å; K196-V206 HydrophobicContact CG-CG2 4.33Å
207	V	95.6	Very high	93.3	Very high	4 Å²	4	49 Å²	49	2%	0.024	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	133	-178.7	-172.4	0	0	0	0	109.1	V195 I197 K205 I209 L218 L221 L222	V195-V207 PolarHBondContact N-O 2.89Å; V195-V207 PolarHBondContact O-N 3.5Å; I197-V207 HydrophobicContact CD1-CB 4.32Å; I197-V207 HydrophobicContact CD1-CG2 3.94Å; K205-V207 HydrophobicContact CD-CG2 4.37Å; K205-V207 HydrophobicContact CG-CG2 4.14Å; V207-I209 HydrophobicContact CB-CG2 4.5Å; V207-I209 HydrophobicContact CG1-CG2 3.84Å; V207-L218 HydrophobicContact CG1-CD1 4.28Å; V207-L221 HydrophobicContact CG1-CD2 3.96Å; V207-L222 HydrophobicContact CG2-CD2 4.18Å
208	E	96.5	Very high	93.3	Very high	124 Å²	124	49 Å²	49	58%	0.579	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89	127.3	171.1	-173	176.2	177.7	0	0	109.2	N192 H193	N192-E208 HydrophobicContact CB-CG 3.56Å; N192-E208 WeakPolarHBondContact CB-OE1 3.49Å; N192-E208 VanDerWaalsContact CG-OE1 3.28Å; N192-E208 PolarHBondContact ND2-OE1 3.29Å; H193-E208 WeakPolarHBondContact O-CA 3.39Å
209	I	96.5	Very high	93.4	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	147.5	-176.2	68.2	175.8	0	0	0	111.2	H193 V195 V207 M213 L218 V255 V256	H193-I209 HydrophobicContact CB-CG1 4.36Å; H193-I209 PolarHBondContact N-O 2.71Å; H193-I209 PolarHBondContact O-N 2.9Å; V195-I209 HydrophobicContact CB-CD1 4.38Å; V195-I209 HydrophobicContact CG2-CD1 3.41Å; V195-I209 VanDerWaalsContact CG2-CD1 3.41Å; V195-I209 HydrophobicContact CG2-CG1 3.8Å; V207-I209 HydrophobicContact CB-CG2 4.5Å; V207-I209 HydrophobicContact CG1-CG2 3.84Å; I209-M213 HydrophobicContact CB-CB 3.98Å; I209-M213 HydrophobicContact CB-CE 4.06Å; I209-M213 HydrophobicContact CB-CG 3.99Å; I209-M213 HydrophobicContact CD1-CB 4.05Å; I209-M213 HydrophobicContact CD1-CG 4.09Å; I209-M213 HydrophobicContact CG1-CB 4.32Å; I209-M213 HydrophobicContact CG2-CE 4.03Å; I209-M213 HydrophobicContact CG2-CG 4.21Å; I209-L218 HydrophobicContact CG2-CD1 4.05Å; I209-V255 HydrophobicContact CD1-CB 3.71Å; I209-V255 HydrophobicContact CD1-CG1 3.69Å; I209-V255 HydrophobicContact CD1-CG2 4.45Å; I209-V256 HydrophobicContact CD1-CG2 3.99Å; I209-V256 HydrophobicContact CG1-CG2 4.2Å
210	P	96.7	Very high	93.6	Very high	48 Å²	48	50.7 Å²	50.7	31%	0.312	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	157.8	169.9	31	-35.9	0	0	0	111.3	D212 M213	P210-D212 WeakPolarHBondContact CB-OD1 3.45Å; P210-D212 WeakPolarHBondContact CG-OD1 3.33Å; P210-D212 PolarHBondContact O-N 3.13Å; P210-D212 VanDerWaalsContact O-N 3.14Å; P210-M213 HydrophobicContact CG-CB 4.15Å; P210-M213 HydrophobicContact CG-CE 4.2Å; P210-M213 VanDerWaalsContact O-CB 3.24Å; P210-M213 WeakPolarHBondContact O-CB 3.39Å; P210-M213 PolarHBondContact O-N 3.24Å; P210-M213 VanDerWaalsContact O-N 3.12Å
211	A	95.5	Very high	94.1	Very high	52 Å²	52	50.8 Å²	50.8	43%	0.43	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-28.6	-178.7	0	0	0	0	0	114.1
212	D	95.2	Very high	94.7	Very high	100 Å²	100	46.7 Å²	46.7	54%	0.535	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	-3	-176.4	75.4	-32.2	0	0	0	113.9	P210 T214 R254	P210-D212 WeakPolarHBondContact CB-OD1 3.45Å; P210-D212 WeakPolarHBondContact CG-OD1 3.33Å; P210-D212 PolarHBondContact O-N 3.13Å; P210-D212 VanDerWaalsContact O-N 3.14Å; D212-T214 PolarHBondContact O-N 3.02Å; D212-R254 VanDerWaalsContact CB-NH1 3.29Å; D212-R254 PolarHBondContact O-NH1 2.8Å
213	M	97.5	Very high	95.1	Very high	26 Å²	26	44.7 Å²	44.7	13%	0.128	24%	0.241	C	C	.	.			trans	-53.3	120.6	180	-179.5	72.4	74.7	0	0	111.5	I209 P210 H217 L218 V255	I209-M213 HydrophobicContact CB-CB 3.98Å; I209-M213 HydrophobicContact CB-CE 4.06Å; I209-M213 HydrophobicContact CB-CG 3.99Å; I209-M213 HydrophobicContact CD1-CB 4.05Å; I209-M213 HydrophobicContact CD1-CG 4.09Å; I209-M213 HydrophobicContact CG1-CB 4.32Å; I209-M213 HydrophobicContact CG2-CE 4.03Å; I209-M213 HydrophobicContact CG2-CG 4.21Å; P210-M213 HydrophobicContact CG-CB 4.15Å; P210-M213 HydrophobicContact CG-CE 4.2Å; P210-M213 VanDerWaalsContact O-CB 3.24Å; P210-M213 WeakPolarHBondContact O-CB 3.39Å; P210-M213 PolarHBondContact O-N 3.24Å; P210-M213 VanDerWaalsContact O-N 3.12Å; M213-H217 HydrophobicContact SD-CB 3.45Å; M213-H217 WeakPolarHBondContact SD-CB 3.33Å; M213-L218 HydrophobicContact CG-CB 4.08Å; M213-L218 HydrophobicContact SD-CB 4.29Å; M213-V255 HydrophobicContact CG-CG2 4.47Å; M213-V255 PolarHBondContact O-N 2.92Å
214	T	98.3	Very high	95.2	Very high	24 Å²	24	47.8 Å²	47.8	15%	0.147	25%	0.248	C	C	.	.	B	Isolated β-bridge	trans	-83.1	157.2	174.3	69	0	0	0	0	110.9	D212 R216 H217 L218 D251 E253	D212-T214 PolarHBondContact O-N 3.02Å; T214-R216 PolarHBondContact O-N 2.91Å; T214-H217 PolarHBondContact O-N 2.71Å; T214-H217 PolarHBondContact OG1-N 3.43Å; T214-H217 PolarHBondContact OG1-ND1 2.66Å; T214-L218 PolarHBondContact O-N 2.71Å; T214-D251 WeakPolarHBondContact CB-O 3.44Å; T214-E253 CarbonylContact C-O 3.35Å; T214-E253 WeakPolarHBondContact CA-O 3.43Å
215	V	98.3	Very high	95	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-55.5	-38.9	173.8	167.9	0	0	0	0	111.2	L218 C219 L236 L249 E250 D251 E253 V255	V215-L218 PolarHBondContact O-N 3.3Å; V215-C219 PolarHBondContact O-N 2.9Å; V215-C219 PolarHBondContact O-SG 3.22Å; V215-C219 VanDerWaalsContact O-SG 3.39Å; V215-L236 HydrophobicContact CG1-CB 3.89Å; V215-L249 HydrophobicContact CG1-CB 4.1Å; V215-L249 HydrophobicContact CG2-CB 3.76Å; V215-L249 HydrophobicContact CG2-CD1 3.88Å; V215-L249 HydrophobicContact CG2-CG 4.5Å; V215-E250 WeakPolarHBondContact CB-O 3.18Å; V215-D251 PolarHBondContact N-O 3.06Å; V215-E253 HydrophobicContact CG2-CB 4.08Å; V215-E253 WeakPolarHBondContact CG2-O 3.23Å; V215-E253 PolarHBondContact N-O 3.41Å; V215-V255 HydrophobicContact CG2-CG2 4Å
216	R	96.6	Very high	94.7	Very high	24 Å²	24	48.8 Å²	48.8	9%	0.091	25%	0.248	C	C	.	.	H	α-helix	trans	-59.3	-53.2	176.3	-179	176.6	-61.8	119.3	0.5	112.4	T214 L218 C219 Q220 D251 N433 Q436	T214-R216 PolarHBondContact O-N 2.91Å; R216-L218 VanDerWaalsContact C-N 3.27Å; R216-L218 PolarHBondContact O-N 3.37Å; R216-C219 PolarHBondContact O-N 2.8Å; R216-Q220 WeakPolarHBondContact O-CG 3.29Å; R216-Q220 PolarHBondContact O-N 2.84Å; R216-D251 HydrophobicContact CB-CB 4Å; R216-D251 IonicContact CZ-OD2 3.83Å; R216-D251 PolarHBondContact N-O 3.14Å; R216-D251 IonicContact NE-OD2 2.71Å; R216-D251 IonicContact NH2-OD2 2.65Å; R216-D251 PolarHBondContact NH2-OD2 2.75Å; R216-N433 PolarHBondContact NH2-O 3.27Å; R216-N433 PolarHBondContact NH2-OD1 2.94Å; R216-Q436 VanDerWaalsContact NH2-OE1 3.14Å
217	H	96.2	Very high	94.3	Very high	100 Å²	100	52.9 Å²	52.9	46%	0.463	26%	0.261	S	S	.	.	H	α-helix	trans	-62.8	-38.6	-176.5	-66	149.4	0	0	0	110.7	M213 T214 Q220 L221	M213-H217 HydrophobicContact SD-CB 3.45Å; M213-H217 WeakPolarHBondContact SD-CB 3.33Å; T214-H217 PolarHBondContact O-N 2.71Å; T214-H217 PolarHBondContact OG1-N 3.43Å; T214-H217 PolarHBondContact OG1-ND1 2.66Å; H217-Q220 PolarHBondContact O-N 3.5Å; H217-L221 WeakPolarHBondContact O-CB 3.37Å; H217-L221 PolarHBondContact O-N 2.94Å
218	L	96.9	Very high	93.8	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.7	-44.7	174.3	-177.2	54.6	0	0	0	112.1	I197 V207 I209 M213 T214 V215 R216 Q220 L221 L222 L236 V255	I197-L218 HydrophobicContact CD1-CD1 3.86Å; I197-L218 HydrophobicContact CD1-CD2 3.77Å; I197-L218 HydrophobicContact CD1-CG 4.06Å; V207-L218 HydrophobicContact CG1-CD1 4.28Å; I209-L218 HydrophobicContact CG2-CD1 4.05Å; M213-L218 HydrophobicContact CG-CB 4.08Å; M213-L218 HydrophobicContact SD-CB 4.29Å; T214-L218 PolarHBondContact O-N 2.71Å; V215-L218 PolarHBondContact O-N 3.3Å; R216-L218 VanDerWaalsContact C-N 3.27Å; R216-L218 PolarHBondContact O-N 3.37Å; L218-Q220 VanDerWaalsContact C-N 3.34Å; L218-Q220 PolarHBondContact O-N 2.77Å; L218-L221 HydrophobicContact CD1-CD2 4.33Å; L218-L221 WeakPolarHBondContact O-CB 3.3Å; L218-L221 PolarHBondContact O-N 2.81Å; L218-L222 HydrophobicContact CD1-CD1 4.44Å; L218-L222 HydrophobicContact CD1-CG 4.26Å; L218-L222 HydrophobicContact CG-CD1 4.28Å; L218-L222 VanDerWaalsContact O-CG 3.3Å; L218-L222 WeakPolarHBondContact O-CG 3.5Å; L218-L222 PolarHBondContact O-N 3.38Å; L218-L236 HydrophobicContact CD2-CD2 3.89Å; L218-V255 HydrophobicContact CB-CG2 4.18Å; L218-V255 HydrophobicContact CD2-CB 4.31Å; L218-V255 HydrophobicContact CD2-CG1 3.82Å; L218-V255 HydrophobicContact CD2-CG2 3.69Å
219	C	95.8	Very high	93.3	Very high	5 Å²	5	53.8 Å²	53.8	3%	0.034	28%	0.276	C	S	.	.	H	α-helix	trans	-57.3	-46.4	174.1	-75.5	0	0	0	0	111.6	V215 R216 L221 L222 V223 F270	V215-C219 PolarHBondContact O-N 2.9Å; V215-C219 PolarHBondContact O-SG 3.22Å; V215-C219 VanDerWaalsContact O-SG 3.39Å; R216-C219 PolarHBondContact O-N 2.8Å; C219-L221 VanDerWaalsContact C-N 3.34Å; C219-L221 PolarHBondContact O-N 2.94Å; C219-L222 PolarHBondContact O-N 2.84Å; C219-V223 VanDerWaalsContact O-CG2 3.32Å; C219-V223 WeakPolarHBondContact O-CG2 3.33Å; C219-V223 PolarHBondContact O-N 2.82Å; C219-F270 HydrophobicContact CB-CE2 4.16Å
220	Q	93.9	Very high	92.8	Very high	65 Å²	65	56.9 Å²	56.9	30%	0.304	29%	0.292	S	S	.	.	H	α-helix	trans	-61.2	-42.5	178.2	-72.7	173.6	-34.5	0	0	112.1	R216 H217 L218 L222 V223 Y224	R216-Q220 WeakPolarHBondContact O-CG 3.29Å; R216-Q220 PolarHBondContact O-N 2.84Å; H217-Q220 PolarHBondContact O-N 3.5Å; L218-Q220 VanDerWaalsContact C-N 3.34Å; L218-Q220 PolarHBondContact O-N 2.77Å; Q220-L222 VanDerWaalsContact C-N 3.32Å; Q220-L222 PolarHBondContact O-N 2.76Å; Q220-V223 PolarHBondContact O-N 2.89Å; Q220-Y224 WeakPolarHBondContact O-CB 3.34Å; Q220-Y224 PolarHBondContact O-N 2.69Å
221	L	93.8	Very high	92.2	Very high	47 Å²	47	56.8 Å²	56.8	25%	0.246	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-42.8	174.9	179	63.8	0	0	0	111.8	V207 H217 L218 C219 Y224 K225	V207-L221 HydrophobicContact CG1-CD2 3.96Å; H217-L221 WeakPolarHBondContact O-CB 3.37Å; H217-L221 PolarHBondContact O-N 2.94Å; L218-L221 HydrophobicContact CD1-CD2 4.33Å; L218-L221 WeakPolarHBondContact O-CB 3.3Å; L218-L221 PolarHBondContact O-N 2.81Å; C219-L221 VanDerWaalsContact C-N 3.34Å; C219-L221 PolarHBondContact O-N 2.94Å; L221-Y224 PolarHBondContact O-N 3.09Å; L221-K225 HydrophobicContact CD1-CD 4.11Å; L221-K225 HydrophobicContact CD1-CG 4.22Å; L221-K225 HydrophobicContact CG-CD 4.25Å; L221-K225 WeakPolarHBondContact O-CB 3.44Å; L221-K225 WeakPolarHBondContact O-CG 3.19Å; L221-K225 PolarHBondContact O-N 2.89Å
222	L	93.4	Very high	91.8	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-68.4	-42.1	178.7	-68.6	172.4	0	0	0	112.3	I197 K205 V207 L218 C219 Q220 Y224 K225 S226 F270 L617	I197-L222 HydrophobicContact CD1-CD1 3.84Å; I197-L222 HydrophobicContact CD1-CD2 4.05Å; I197-L222 HydrophobicContact CD1-CG 4.37Å; I197-L222 HydrophobicContact CG2-CD1 3.97Å; K205-L222 HydrophobicContact CD-CD2 4.18Å; V207-L222 HydrophobicContact CG2-CD2 4.18Å; L218-L222 HydrophobicContact CD1-CD1 4.44Å; L218-L222 HydrophobicContact CD1-CG 4.26Å; L218-L222 HydrophobicContact CG-CD1 4.28Å; L218-L222 VanDerWaalsContact O-CG 3.3Å; L218-L222 WeakPolarHBondContact O-CG 3.5Å; L218-L222 PolarHBondContact O-N 3.38Å; C219-L222 PolarHBondContact O-N 2.84Å; Q220-L222 VanDerWaalsContact C-N 3.32Å; Q220-L222 PolarHBondContact O-N 2.76Å; L222-Y224 VanDerWaalsContact C-N 3.33Å; L222-Y224 PolarHBondContact O-N 3.39Å; L222-K225 PolarHBondContact O-N 3.45Å; L222-S226 VanDerWaalsContact O-CB 3.23Å; L222-S226 WeakPolarHBondContact O-CB 3.44Å; L222-S226 PolarHBondContact O-N 2.87Å; L222-S226 PolarHBondContact O-OG 2.84Å; L222-F270 HydrophobicContact CB-CD1 4.3Å; L222-F270 HydrophobicContact CB-CD2 4.45Å; L222-F270 HydrophobicContact CB-CE1 3.84Å; L222-F270 HydrophobicContact CB-CE2 4.02Å; L222-F270 HydrophobicContact CB-CZ 3.69Å; L222-F270 HydrophobicContact CD1-CB 4.18Å; L222-F270 HydrophobicContact CD1-CD1 4.17Å; L222-F270 HydrophobicContact CD1-CD2 3.57Å; L222-F270 HydrophobicContact CD1-CE1 4.44Å; L222-F270 HydrophobicContact CD1-CE2 3.9Å; L222-F270 HydrophobicContact CD1-CG 3.72Å; L222-F270 HydrophobicContact CD1-CZ 4.31Å; L222-L617 HydrophobicContact CD2-CD2 4.04Å
223	V	91.5	Very high	91.7	Very high	8 Å²	8	50.6 Å²	50.6	5%	0.048	25%	0.249	C	C	.	.	H	α-helix	trans	-58.4	-48	174.5	172.7	0	0	0	0	110.2	C219 Q220 S226 H227 C228 D230 W234 F270	C219-V223 VanDerWaalsContact O-CG2 3.32Å; C219-V223 WeakPolarHBondContact O-CG2 3.33Å; C219-V223 PolarHBondContact O-N 2.82Å; Q220-V223 PolarHBondContact O-N 2.89Å; V223-S226 PolarHBondContact O-N 2.87Å; V223-H227 PolarHBondContact O-N 2.79Å; V223-H227 VanDerWaalsContact O-N 3.17Å; V223-C228 HydrophobicContact CG1-CB 4.02Å; V223-C228 VanDerWaalsContact CG1-O 3.27Å; V223-C228 WeakPolarHBondContact CG1-O 3.26Å; V223-C228 PolarHBondContact O-N 2.98Å; V223-D230 HydrophobicContact CG1-CB 3.96Å; V223-W234 HydrophobicContact CG2-CB 4.07Å; V223-W234 HydrophobicContact CG2-CD2 3.83Å; V223-W234 HydrophobicContact CG2-CG 3.49Å; V223-W234 VanDerWaalsContact CG2-CG 3.49Å; V223-F270 HydrophobicContact CG2-CZ 3.93Å
224	Y	90.3	Very high	91.5	Very high	180 Å²	180	49.9 Å²	49.9	71%	0.706	25%	0.245	S	C	*	.	H	α-helix	trans	-60.6	-51.2	177.4	175.1	-100.7	0	0	0	112.2	Q220 L221 L222 S226 H227	Q220-Y224 WeakPolarHBondContact O-CB 3.34Å; Q220-Y224 PolarHBondContact O-N 2.69Å; L221-Y224 PolarHBondContact O-N 3.09Å; L222-Y224 VanDerWaalsContact C-N 3.33Å; L222-Y224 PolarHBondContact O-N 3.39Å; Y224-S226 PolarHBondContact O-N 3.42Å; Y224-H227 PolarHBondContact O-N 3.04Å
225	K	89.4	Confident	91.4	Very high	103 Å²	103	48.7 Å²	48.7	45%	0.448	24%	0.238	S	C	.	.	H	α-helix	trans	-67.7	-21.7	-178.4	-78.2	-172.5	170.5	179.9	0	114	L221 L222	L221-K225 HydrophobicContact CD1-CD 4.11Å; L221-K225 HydrophobicContact CD1-CG 4.22Å; L221-K225 HydrophobicContact CG-CD 4.25Å; L221-K225 WeakPolarHBondContact O-CB 3.44Å; L221-K225 WeakPolarHBondContact O-CG 3.19Å; L221-K225 PolarHBondContact O-N 2.89Å; L222-K225 PolarHBondContact O-N 3.45Å
226	S	86.5	Confident	91.4	Very high	21 Å²	21	48.7 Å²	48.7	15%	0.147	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.3	11	-177.6	-37.1	0	0	0	0	111.8	L222 V223 Y224 C228	L222-S226 VanDerWaalsContact O-CB 3.23Å; L222-S226 WeakPolarHBondContact O-CB 3.44Å; L222-S226 PolarHBondContact O-N 2.87Å; L222-S226 PolarHBondContact O-OG 2.84Å; V223-S226 PolarHBondContact O-N 2.87Å; Y224-S226 PolarHBondContact O-N 3.42Å; S226-C228 PolarHBondContact O-N 2.85Å; S226-C228 VanDerWaalsContact O-N 3.07Å; S226-C228 PolarHBondContact O-SG 2.82Å; S226-C228 VanDerWaalsContact O-SG 3.41Å
227	H	85.9	Confident	91.4	Very high	178 Å²	178	47.6 Å²	47.6	82%	0.824	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.7	35.7	179.7	-57.8	-64.3	0	0	0	113.9	V223 Y224	V223-H227 PolarHBondContact O-N 2.79Å; V223-H227 VanDerWaalsContact O-N 3.17Å; Y224-H227 PolarHBondContact O-N 3.04Å
228	C	85.5	Confident	91.4	Very high	38 Å²	38	42.9 Å²	42.9	26%	0.257	21%	0.212	S	C	.	.			trans	-86.2	154.2	180	-71.1	0	0	0	0	111	V223 S226 D230 W234	V223-C228 HydrophobicContact CG1-CB 4.02Å; V223-C228 VanDerWaalsContact CG1-O 3.27Å; V223-C228 WeakPolarHBondContact CG1-O 3.26Å; V223-C228 PolarHBondContact O-N 2.98Å; S226-C228 PolarHBondContact O-N 2.85Å; S226-C228 VanDerWaalsContact O-N 3.07Å; S226-C228 PolarHBondContact O-SG 2.82Å; S226-C228 VanDerWaalsContact O-SG 3.41Å; C228-D230 PolarHBondContact O-N 2.87Å; C228-W234 HydrophobicContact CB-CH2 4.01Å; C228-W234 HydrophobicContact CB-CZ2 3.59Å
229	V	85.6	Confident	91.4	Very high	110 Å²	110	44.7 Å²	44.7	67%	0.667	22%	0.22	S	C	*	.			trans	-72.2	126.1	170.4	178.6	0	0	0	0	109	D231 W234	V229-D231 PolarHBondContact O-N 2.84Å; V229-D231 VanDerWaalsContact O-N 3.13Å; V229-W234 PolarHBondContact O-NE1 2.75Å
230	D	85.3	Confident	91.3	Very high	65 Å²	65	44.4 Å²	44.4	35%	0.348	22%	0.218	S	C	.	.			trans	-78.5	93.2	171.5	-166.3	-4.1	0	0	0	110.4	V223 C228 N232	V223-D230 HydrophobicContact CG1-CB 3.96Å; C228-D230 PolarHBondContact O-N 2.87Å; D230-N232 PolarHBondContact OD1-N 3.44Å; D230-N232 VanDerWaalsContact OD1-N 3.15Å
231	D	85.5	Confident	91.2	Very high	46 Å²	46	43.4 Å²	43.4	25%	0.246	22%	0.217	C	C	.	.			trans	-101.3	15.6	176.3	68.3	0.1	0	0	0	112.5	V229 S233 K272 Y274	V229-D231 PolarHBondContact O-N 2.84Å; V229-D231 VanDerWaalsContact O-N 3.13Å; D231-S233 PolarHBondContact O-N 2.97Å; D231-S233 VanDerWaalsContact OD1-CB 3.27Å; D231-S233 WeakPolarHBondContact OD1-CB 3.47Å; D231-S233 PolarHBondContact OD1-N 3.43Å; D231-S233 VanDerWaalsContact OD1-N 3.08Å; D231-S233 PolarHBondContact OD1-OG 3.26Å; D231-S233 PolarHBondContact OD2-OG 3.13Å; D231-K272 IonicContact OD2-NZ 3.3Å; D231-K272 PolarHBondContact OD2-NZ 2.86Å; D231-Y274 PolarHBondContact OD2-OH 3.32Å
232	N	86.8	Confident	90.9	Very high	19 Å²	19	47.3 Å²	47.3	10%	0.102	24%	0.238	C	C	.	.	S	Bend	trans	58.8	13.2	-177.9	-75.8	-71.7	0	0	0	115.7	D230 R437 L441	D230-N232 PolarHBondContact OD1-N 3.44Å; D230-N232 VanDerWaalsContact OD1-N 3.15Å; N232-R437 HydrophobicContact CB-CB 4.2Å; N232-R437 PolarHBondContact ND2-O 2.91Å; N232-R437 VanDerWaalsContact O-CD 3.29Å; N232-R437 WeakPolarHBondContact O-CD 3.28Å; N232-R437 WeakPolarHBondContact OD1-CA 3.49Å; N232-R437 WeakPolarHBondContact OD1-CB 3.45Å; N232-R437 WeakPolarHBondContact OD1-CD 3.42Å; N232-R437 WeakPolarHBondContact OD1-CG 3.32Å; N232-R437 PolarHBondContact OD1-O 2.82Å; N232-L441 WeakPolarHBondContact ND2-CD1 3.34Å; N232-L441 VanDerWaalsContact ND2-CG 3.28Å; N232-L441 WeakPolarHBondContact ND2-CG 3.41Å
233	S	92.3	Very high	90.7	Very high	3 Å²	3	50.7 Å²	50.7	2%	0.021	26%	0.256	C	S	.	.			trans	-96.1	-7.7	177.7	75.3	0	0	0	0	113.4	D231 K272 N273	D231-S233 PolarHBondContact O-N 2.97Å; D231-S233 VanDerWaalsContact OD1-CB 3.27Å; D231-S233 WeakPolarHBondContact OD1-CB 3.47Å; D231-S233 PolarHBondContact OD1-N 3.43Å; D231-S233 VanDerWaalsContact OD1-N 3.08Å; D231-S233 PolarHBondContact OD1-OG 3.26Å; D231-S233 PolarHBondContact OD2-OG 3.13Å; S233-K272 CarbonylContact O-C 3.52Å; S233-K272 WeakPolarHBondContact O-CA 3.44Å; S233-K272 VanDerWaalsContact OG-CD 3.32Å; S233-K272 WeakPolarHBondContact OG-CD 3.32Å; S233-K272 WeakPolarHBondContact OG-CG 3.23Å; S233-N273 PolarHBondContact O-N 3.2Å
234	W	94	Very high	90.8	Very high	11 Å²	11	50.5 Å²	50.5	4%	0.042	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	130.3	-176.2	-62.7	102.7	0	0	0	113.2	V223 C228 V229 F270 K272 R437 V615	V223-W234 HydrophobicContact CG2-CB 4.07Å; V223-W234 HydrophobicContact CG2-CD2 3.83Å; V223-W234 HydrophobicContact CG2-CG 3.49Å; V223-W234 VanDerWaalsContact CG2-CG 3.49Å; C228-W234 HydrophobicContact CB-CH2 4.01Å; C228-W234 HydrophobicContact CB-CZ2 3.59Å; V229-W234 PolarHBondContact O-NE1 2.75Å; W234-F270 HydrophobicContact CB-CE2 3.98Å; W234-F270 HydrophobicContact CB-CZ 4.08Å; W234-F270 HydrophobicContact CD2-CE1 4.31Å; W234-F270 HydrophobicContact CD2-CE2 4.45Å; W234-F270 AromaticContact CD2-CZ 3.78Å; W234-F270 HydrophobicContact CD2-CZ 3.78Å; W234-F270 HydrophobicContact CE3-CD1 4.2Å; W234-F270 AromaticContact CE3-CE1 3.41Å; W234-F270 HydrophobicContact CE3-CE1 3.41Å; W234-F270 VanDerWaalsContact CE3-CE1 3.41Å; W234-F270 AromaticContact CE3-CE2 3.87Å; W234-F270 HydrophobicContact CE3-CE2 3.87Å; W234-F270 AromaticContact CE3-CZ 3.21Å; W234-F270 HydrophobicContact CE3-CZ 3.21Å; W234-F270 HydrophobicContact CG-CZ 4.14Å; W234-F270 HydrophobicContact CH2-CE1 4.48Å; W234-F270 HydrophobicContact CZ3-CD1 4.13Å; W234-F270 AromaticContact CZ3-CE1 3.45Å; W234-F270 HydrophobicContact CZ3-CE1 3.45Å; W234-F270 VanDerWaalsContact CZ3-CE1 3.45Å; W234-F270 AromaticContact CZ3-CZ 3.79Å; W234-F270 HydrophobicContact CZ3-CZ 3.79Å; W234-K272 HydrophobicContact CD2-CG 4.32Å; W234-K272 HydrophobicContact CE3-CG 4.16Å; W234-K272 HydrophobicContact CH2-CG 4.32Å; W234-K272 VanDerWaalsContact CZ2-CE 3.48Å; W234-K272 HydrophobicContact CZ2-CG 4.39Å; W234-K272 HydrophobicContact CZ3-CG 4.23Å; W234-R437 PolarHBondContact O-NH2 3.32Å; W234-V615 HydrophobicContact CE3-CG2 4.33Å; W234-V615 HydrophobicContact CH2-CB 4.31Å; W234-V615 HydrophobicContact CH2-CG1 3.85Å; W234-V615 HydrophobicContact CH2-CG2 3.63Å; W234-V615 HydrophobicContact CZ3-CB 4.01Å; W234-V615 HydrophobicContact CZ3-CG1 3.59Å; W234-V615 HydrophobicContact CZ3-CG2 3.21Å
235	A	95.9	Very high	90.9	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	148.2	-177.6	0	0	0	0	0	112	R271 N273	A235-R271 PolarHBondContact N-O 2.79Å; A235-R271 PolarHBondContact O-N 3.13Å; A235-R271 VanDerWaalsContact O-N 3.13Å; A235-R271 VanDerWaalsContact O-O 3.11Å; A235-N273 HydrophobicContact CB-CB 4.02Å
236	L	97.7	Very high	91.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	134.9	166	-158.4	69	0	0	0	108.5	I197 V215 L218 L249 V255 F268 L269 F270	I197-L236 HydrophobicContact CG2-CD1 4.02Å; V215-L236 HydrophobicContact CG1-CB 3.89Å; L218-L236 HydrophobicContact CD2-CD2 3.89Å; L236-L249 HydrophobicContact CB-CD1 4.3Å; L236-L249 HydrophobicContact CD2-CD1 4.01Å; L236-L249 HydrophobicContact CG-CD1 4.26Å; L236-L249 PolarHBondContact O-N 3.06Å; L236-V255 HydrophobicContact CD2-CG1 4.35Å; L236-V255 HydrophobicContact CD2-CG2 4.31Å; L236-F268 HydrophobicContact CD1-CB 4.03Å; L236-F268 HydrophobicContact CD2-CB 4.48Å; L236-F268 HydrophobicContact CD2-CD1 3.92Å; L236-F268 HydrophobicContact CD2-CE1 4.39Å; L236-F268 HydrophobicContact CD2-CG 4.21Å; L236-F268 HydrophobicContact CG-CB 4.2Å; L236-F268 HydrophobicContact CG-CD1 4.05Å; L236-F268 HydrophobicContact CG-CG 4.35Å; L236-L269 CarbonylContact C-O 3.55Å; L236-L269 WeakPolarHBondContact CA-O 3.49Å; L236-F270 HydrophobicContact CD1-CB 4.46Å
237	V	97.3	Very high	91.7	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.7	-175.4	-179	0	0	0	0	108.9	E246 R247 F268 L269 R271	V237-E246 HydrophobicContact CG1-CB 3.86Å; V237-R247 CarbonylContact C-O 3.48Å; V237-R247 VanDerWaalsContact CA-O 3.28Å; V237-R247 WeakPolarHBondContact CA-O 3.39Å; V237-R247 WeakPolarHBondContact CG1-O 3.47Å; V237-F268 CarbonylContact O-C 3.59Å; V237-F268 VanDerWaalsContact O-CA 3.27Å; V237-F268 WeakPolarHBondContact O-CA 3.07Å; V237-L269 HydrophobicContact CB-CB 4.06Å; V237-L269 PolarHBondContact N-O 2.87Å; V237-L269 PolarHBondContact O-N 3.45Å; V237-R271 HydrophobicContact CG2-CG 4.07Å
238	E	97.1	Very high	92.3	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.009	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	117.7	165.1	173	-178	-176.5	0	0	108	H240 E246 R247 L249 V258 M262 F372 K392	E238-H240 IonicContact OE1-CE1 3.44Å; E238-H240 PolarHBondContact OE1-CE1 2.87Å; E238-H240 IonicContact OE1-NE2 3.81Å; E238-H240 PolarHBondContact OE1-NE2 3.14Å; E238-E246 CarbonylContact O-C 3.45Å; E238-E246 VanDerWaalsContact O-CA 3.24Å; E238-E246 WeakPolarHBondContact O-CA 3.44Å; E238-R247 HydrophobicContact CB-CG 4.11Å; E238-R247 PolarHBondContact N-O 2.86Å; E238-R247 PolarHBondContact O-N 3.3Å; E238-R247 IonicContact OE2-CZ 3.32Å; E238-R247 IonicContact OE2-NE 2.68Å; E238-R247 PolarHBondContact OE2-NE 2.76Å; E238-R247 IonicContact OE2-NH2 2.77Å; E238-R247 PolarHBondContact OE2-NH2 2.89Å; E238-L249 HydrophobicContact CB-CD2 3.88Å; E238-L249 HydrophobicContact CB-CG 4.48Å; E238-V258 HydrophobicContact CB-CG1 4.5Å; E238-M262 HydrophobicContact CG-CE 4.02Å; E238-M262 HydrophobicContact CG-CG 4.02Å; E238-M262 HydrophobicContact CG-SD 4.02Å; E238-M262 WeakPolarHBondContact OE1-CG 3.31Å; E238-F372 HydrophobicContact CG-CE1 4.06Å; E238-K392 IonicContact OE1-NZ 3.37Å; E238-K392 PolarHBondContact OE1-NZ 2.81Å
239	H	95.6	Very high	92.9	Very high	37 Å²	37	28.9 Å²	28.9	17%	0.171	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	130.1	-177.7	179.1	-135.4	0	0	0	110.6	P241 L245 S266 R267 L269	H239-P241 WeakPolarHBondContact O-CD 3.46Å; H239-L245 PolarHBondContact CD2-O 3.06Å; H239-S266 CarbonylContact O-C 3.58Å; H239-S266 VanDerWaalsContact O-CA 3.28Å; H239-S266 WeakPolarHBondContact O-CA 3.45Å; H239-R267 PolarHBondContact N-O 2.88Å; H239-R267 PolarHBondContact O-N 2.52Å; H239-L269 HydrophobicContact CB-CD1 3.85Å; H239-L269 HydrophobicContact CB-CG 3.88Å
240	H	93.7	Very high	93.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	89.9	175.3	-56.6	-56.9	0	0	0	109.4	E238 L242 L243 G244 L245 S266 F372 K392	E238-H240 IonicContact OE1-CE1 3.44Å; E238-H240 PolarHBondContact OE1-CE1 2.87Å; E238-H240 IonicContact OE1-NE2 3.81Å; E238-H240 PolarHBondContact OE1-NE2 3.14Å; H240-L242 VanDerWaalsContact C-N 3.34Å; H240-L242 PolarHBondContact O-N 3.18Å; H240-L243 HydrophobicContact CB-CB 4.01Å; H240-L243 HydrophobicContact CB-CD1 4.25Å; H240-L243 HydrophobicContact CB-CG 4.39Å; H240-L243 PolarHBondContact O-N 2.93Å; H240-G244 PolarHBondContact O-N 2.86Å; H240-L245 HydrophobicContact CB-CB 4.15Å; H240-L245 PolarHBondContact N-O 2.76Å; H240-L245 PolarHBondContact O-N 3.39Å; H240-L245 VanDerWaalsContact O-N 3.14Å; H240-S266 PolarHBondContact CE1-OG 3.06Å; H240-S266 WeakPolarHBondContact ND1-CB 3.17Å; H240-S266 PolarHBondContact ND1-OG 3.21Å; H240-F372 AromaticContact CD2-CE1 3.61Å; H240-F372 AromaticContact NE2-CE1 3.46Å; H240-F372 WeakPolarHBondContact NE2-CE1 3.47Å; H240-F372 AromaticContact NE2-CZ 3.74Å; H240-K392 PolarHBondContact CE1-NZ 2.94Å; H240-K392 PolarHBondContact NE2-NZ 3.13Å
241	P	91.3	Very high	94.1	Very high	43 Å²	43	20.7 Å²	20.7	28%	0.279	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-41.6	-173.6	-22.2	31.3	0	0	0	113.2	H239 L243 G244 D265	H239-P241 WeakPolarHBondContact O-CD 3.46Å; P241-L243 VanDerWaalsContact C-N 3.35Å; P241-L243 PolarHBondContact O-N 3.12Å; P241-G244 PolarHBondContact O-N 2.8Å; P241-D265 WeakPolarHBondContact CD-O 3.29Å
242	L	89.1	Confident	94.7	Very high	130 Å²	130	21 Å²	21	68%	0.681	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-31.9	-177.1	-61.9	-176.9	0	0	0	112.7	H240 D265	H240-L242 VanDerWaalsContact C-N 3.34Å; H240-L242 PolarHBondContact O-N 3.18Å; L242-D265 WeakPolarHBondContact CB-OD2 3.31Å; L242-D265 HydrophobicContact CD1-CB 3.85Å; L242-D265 VanDerWaalsContact CD1-OD2 3.28Å; L242-D265 WeakPolarHBondContact CD1-OD2 3.44Å; L242-D265 HydrophobicContact CG-CB 4.21Å; L242-D265 WeakPolarHBondContact CG-OD2 3.29Å
243	L	88.7	Confident	95.2	Very high	71 Å²	71	21.3 Å²	21.3	37%	0.372	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-9.9	175.7	-58.8	177.2	0	0	0	112.7	H240 P241 L245	H240-L243 HydrophobicContact CB-CB 4.01Å; H240-L243 HydrophobicContact CB-CD1 4.25Å; H240-L243 HydrophobicContact CB-CG 4.39Å; H240-L243 PolarHBondContact O-N 2.93Å; P241-L243 VanDerWaalsContact C-N 3.35Å; P241-L243 PolarHBondContact O-N 3.12Å; L243-L245 VanDerWaalsContact C-N 3.29Å; L243-L245 HydrophobicContact CB-CD1 3.93Å; L243-L245 HydrophobicContact CB-CG 3.75Å; L243-L245 HydrophobicContact CD1-CD1 4.16Å; L243-L245 PolarHBondContact O-N 3.02Å
244	G	92.6	Very high	95.4	Very high	3 Å²	3	26.7 Å²	26.7	3%	0.031	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	36.4	-174	0	0	0	0	0	113.2	H240 P241 V374 I375	H240-G244 PolarHBondContact O-N 2.86Å; P241-G244 PolarHBondContact O-N 2.8Å; G244-V374 CarbonylContact O-C 3.48Å; G244-V374 WeakPolarHBondContact O-CA 3.44Å; G244-I375 PolarHBondContact O-N 3.29Å
245	L	94.3	Very high	95.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	143.4	-177.7	-54	-179.3	0	0	0	111.3	H239 H240 L243 F372 T373 V374 C390 L403	H239-L245 PolarHBondContact CD2-O 3.06Å; H240-L245 HydrophobicContact CB-CB 4.15Å; H240-L245 PolarHBondContact N-O 2.76Å; H240-L245 PolarHBondContact O-N 3.39Å; H240-L245 VanDerWaalsContact O-N 3.14Å; L243-L245 VanDerWaalsContact C-N 3.29Å; L243-L245 HydrophobicContact CB-CD1 3.93Å; L243-L245 HydrophobicContact CB-CG 3.75Å; L243-L245 HydrophobicContact CD1-CD1 4.16Å; L243-L245 PolarHBondContact O-N 3.02Å; L245-F372 HydrophobicContact CB-CB 4.18Å; L245-F372 HydrophobicContact CB-CD1 3.99Å; L245-F372 HydrophobicContact CB-CG 4.33Å; L245-T373 WeakPolarHBondContact CA-O 3.48Å; L245-V374 HydrophobicContact CD2-CB 4.21Å; L245-V374 HydrophobicContact CD2-CG1 4.2Å; L245-V374 HydrophobicContact CD2-CG2 3.67Å; L245-C390 WeakPolarHBondContact CD2-SG 3.32Å; L245-L403 HydrophobicContact CD1-CD1 3.9Å; L245-L403 HydrophobicContact CD1-CD2 4.05Å
246	E	95.9	Very high	95.6	Very high	19 Å²	19	27.2 Å²	27.2	9%	0.089	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	151.9	165.6	63.3	178.4	-155.4	0	0	112.3	V237 E238 R271 F372 T373 I375	V237-E246 HydrophobicContact CG1-CB 3.86Å; E238-E246 CarbonylContact O-C 3.45Å; E238-E246 VanDerWaalsContact O-CA 3.24Å; E238-E246 WeakPolarHBondContact O-CA 3.44Å; E246-R271 IonicContact OE1-CZ 3.32Å; E246-R271 IonicContact OE1-NH1 2.88Å; E246-R271 IonicContact OE1-NH2 2.65Å; E246-R271 PolarHBondContact OE1-NH2 2.83Å; E246-R271 IonicContact OE2-CZ 3.4Å; E246-R271 IonicContact OE2-NH1 2.71Å; E246-R271 PolarHBondContact OE2-NH1 3.43Å; E246-R271 IonicContact OE2-NH2 3.26Å; E246-R271 PolarHBondContact OE2-NH2 3.24Å; E246-F372 CarbonylContact O-C 3.56Å; E246-F372 WeakPolarHBondContact O-CA 3.38Å; E246-T373 HydrophobicContact CG-CG2 4.24Å; E246-T373 PolarHBondContact N-O 3.31Å; E246-T373 PolarHBondContact O-N 2.85Å; E246-I375 HydrophobicContact CB-CD1 4.01Å; E246-I375 HydrophobicContact CG-CD1 3.65Å; E246-I375 HydrophobicContact CG-CG1 3.83Å
247	R	96.5	Very high	95.5	Very high	18 Å²	18	33.9 Å²	33.9	7%	0.068	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	143.5	166.4	72.1	176.8	179.2	104	2.4	111	V237 E238 L249 E253 I371 F372	V237-R247 CarbonylContact C-O 3.48Å; V237-R247 VanDerWaalsContact CA-O 3.28Å; V237-R247 WeakPolarHBondContact CA-O 3.39Å; V237-R247 WeakPolarHBondContact CG1-O 3.47Å; E238-R247 HydrophobicContact CB-CG 4.11Å; E238-R247 PolarHBondContact N-O 2.86Å; E238-R247 PolarHBondContact O-N 3.3Å; E238-R247 IonicContact OE2-CZ 3.32Å; E238-R247 IonicContact OE2-NE 2.68Å; E238-R247 PolarHBondContact OE2-NE 2.76Å; E238-R247 IonicContact OE2-NH2 2.77Å; E238-R247 PolarHBondContact OE2-NH2 2.89Å; R247-L249 HydrophobicContact CG-CD2 4.33Å; R247-L249 VanDerWaalsContact NH1-CD2 3.35Å; R247-E253 IonicContact CZ-OE2 2.75Å; R247-E253 IonicContact NH1-OE1 2.92Å; R247-E253 PolarHBondContact NH1-OE1 2.94Å; R247-E253 IonicContact NH1-OE2 3.02Å; R247-E253 PolarHBondContact NH1-OE2 2.88Å; R247-E253 IonicContact NH2-OE2 3.9Å; R247-E253 PolarHBondContact NH2-OE2 3.42Å; R247-I371 VanDerWaalsContact CB-O 3.25Å; R247-I371 WeakPolarHBondContact CB-O 3.48Å; R247-F372 HydrophobicContact CB-CD1 3.73Å; R247-F372 HydrophobicContact CB-CE1 4.03Å; R247-F372 HydrophobicContact CB-CG 4.12Å; R247-F372 VanDerWaalsContact CD-CZ 3.41Å; R247-F372 HydrophobicContact CG-CD1 3.76Å; R247-F372 HydrophobicContact CG-CE1 3.49Å; R247-F372 VanDerWaalsContact CG-CE1 3.49Å; R247-F372 HydrophobicContact CG-CE2 4.47Å; R247-F372 HydrophobicContact CG-CG 4.37Å; R247-F372 HydrophobicContact CG-CZ 3.88Å
248	C	97.3	Very high	95.4	Very high	29 Å²	29	34.2 Å²	34.2	20%	0.196	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	130	167.7	-67.1	0	0	0	0	109.2	N273	C248-N273 PolarHBondContact SG-ND2 3.24Å
249	L	98.1	Very high	95.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-77.9	143.4	176.1	-54.7	-179.9	0	0	0	110.5	V215 L236 E238 R247 V258 F268 K276	V215-L249 HydrophobicContact CG1-CB 4.1Å; V215-L249 HydrophobicContact CG2-CB 3.76Å; V215-L249 HydrophobicContact CG2-CD1 3.88Å; V215-L249 HydrophobicContact CG2-CG 4.5Å; L236-L249 HydrophobicContact CB-CD1 4.3Å; L236-L249 HydrophobicContact CD2-CD1 4.01Å; L236-L249 HydrophobicContact CG-CD1 4.26Å; L236-L249 PolarHBondContact O-N 3.06Å; E238-L249 HydrophobicContact CB-CD2 3.88Å; E238-L249 HydrophobicContact CB-CG 4.48Å; R247-L249 HydrophobicContact CG-CD2 4.33Å; R247-L249 VanDerWaalsContact NH1-CD2 3.35Å; L249-V258 HydrophobicContact CD1-CB 4.5Å; L249-V258 HydrophobicContact CD1-CG1 4.08Å; L249-V258 HydrophobicContact CD1-CG2 4.4Å; L249-V258 HydrophobicContact CD2-CG1 3.96Å; L249-V258 HydrophobicContact CD2-CG2 4.31Å; L249-F268 HydrophobicContact CD1-CD1 4.06Å; L249-F268 HydrophobicContact CD1-CE1 3.72Å; L249-K276 PolarHBondContact O-NZ 2.87Å
250	E	97.9	Very high	95.1	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.019	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-77.1	149.8	172.8	-52.9	-52.1	165.5	0	0	111.6	V215 H252 E253 K276 R422 Y426 L430	V215-E250 WeakPolarHBondContact CB-O 3.18Å; E250-H252 VanDerWaalsContact CB-CE1 3.46Å; E250-H252 WeakPolarHBondContact CB-CE1 3.25Å; E250-H252 WeakPolarHBondContact CB-ND1 3.5Å; E250-H252 PolarHBondContact O-N 2.83Å; E250-H252 VanDerWaalsContact O-N 3.12Å; E250-E253 HydrophobicContact CB-CG 4.19Å; E250-E253 PolarHBondContact N-OE1 2.69Å; E250-E253 WeakPolarHBondContact O-CB 3.45Å; E250-E253 PolarHBondContact O-N 3.23Å; E250-K276 WeakPolarHBondContact OE2-CE 3.49Å; E250-R422 VanDerWaalsContact CD-NH2 3.32Å; E250-R422 IonicContact OE1-CZ 3.67Å; E250-R422 IonicContact OE1-NE 3.99Å; E250-R422 PolarHBondContact OE1-NE 3.47Å; E250-R422 IonicContact OE1-NH2 2.76Å; E250-R422 PolarHBondContact OE1-NH2 2.9Å; E250-R422 IonicContact OE2-CZ 3.21Å; E250-R422 IonicContact OE2-NH2 3.52Å; E250-R422 PolarHBondContact OE2-NH2 2.84Å; E250-Y426 HydrophobicContact CG-CD2 3.79Å; E250-Y426 HydrophobicContact CG-CE2 3.51Å; E250-Y426 HydrophobicContact CG-CG 4.42Å; E250-L430 HydrophobicContact CG-CD1 4.14Å; E250-L430 VanDerWaalsContact OE2-CD1 3.24Å; E250-L430 WeakPolarHBondContact OE2-CD1 3.37Å
251	D	98.1	Very high	94.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-31.3	-169.2	-70	4.7	0	0	0	115.2	T214 V215 R216 K276 Y277 N433 R437	T214-D251 WeakPolarHBondContact CB-O 3.44Å; V215-D251 PolarHBondContact N-O 3.06Å; R216-D251 HydrophobicContact CB-CB 4Å; R216-D251 IonicContact CZ-OD2 3.83Å; R216-D251 PolarHBondContact N-O 3.14Å; R216-D251 IonicContact NE-OD2 2.71Å; R216-D251 IonicContact NH2-OD2 2.65Å; R216-D251 PolarHBondContact NH2-OD2 2.75Å; D251-K276 WeakPolarHBondContact OD1-CE 3.48Å; D251-K276 IonicContact OD1-NZ 2.75Å; D251-K276 PolarHBondContact OD1-NZ 3.09Å; D251-Y277 PolarHBondContact OD1-OH 2.9Å; D251-Y277 VanDerWaalsContact OD1-OH 3.13Å; D251-Y277 PolarHBondContact OD2-OH 2.65Å; D251-N433 HydrophobicContact CB-CB 3.98Å; D251-R437 IonicContact OD1-CZ 3.23Å; D251-R437 IonicContact OD1-NH1 3.61Å; D251-R437 PolarHBondContact OD1-NH1 3.26Å; D251-R437 IonicContact OD1-NH2 3.47Å; D251-R437 PolarHBondContact OD1-NH2 3.26Å; D251-R437 IonicContact OD2-CZ 3.83Å; D251-R437 IonicContact OD2-NE 2.97Å; D251-R437 IonicContact OD2-NH1 2.9Å; D251-R437 PolarHBondContact OD2-NH1 2.98Å; D251-R437 IonicContact OD2-NH2 3.63Å; D251-R437 PolarHBondContact OD2-NH2 3.35Å
252	H	97.9	Very high	94.8	Very high	53 Å²	53	40.9 Å²	40.9	25%	0.245	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-13.9	-178.2	70.7	-73.4	0	0	0	112.8	E250 Y426 I429 N433	E250-H252 VanDerWaalsContact CB-CE1 3.46Å; E250-H252 WeakPolarHBondContact CB-CE1 3.25Å; E250-H252 WeakPolarHBondContact CB-ND1 3.5Å; E250-H252 PolarHBondContact O-N 2.83Å; E250-H252 VanDerWaalsContact O-N 3.12Å; H252-Y426 AromaticContact CE1-CD1 3.3Å; H252-Y426 WeakPolarHBondContact CE1-CD1 3.25Å; H252-Y426 AromaticContact CE1-CE1 3.58Å; H252-Y426 AromaticContact CE1-CG 3.86Å; H252-Y426 AromaticContact NE2-CD1 3.33Å; H252-Y426 VanDerWaalsContact NE2-CD1 3.33Å; H252-Y426 WeakPolarHBondContact NE2-CD1 3.17Å; H252-Y426 AromaticContact NE2-CE1 3.55Å; H252-I429 HydrophobicContact CB-CG2 3.93Å; H252-I429 VanDerWaalsContact CG-CG2 3.46Å; H252-N433 PolarHBondContact ND1-ND2 2.85Å
253	E	97.7	Very high	94.6	Very high	24 Å²	24	37.1 Å²	37.1	11%	0.112	20%	0.2	C	C	.	.	S	Bend	trans	-64.2	144	179.1	-70	-178.8	-103.3	0	0	109.8	T214 V215 R247 E250 V258	T214-E253 CarbonylContact C-O 3.35Å; T214-E253 WeakPolarHBondContact CA-O 3.43Å; V215-E253 HydrophobicContact CG2-CB 4.08Å; V215-E253 WeakPolarHBondContact CG2-O 3.23Å; V215-E253 PolarHBondContact N-O 3.41Å; R247-E253 IonicContact CZ-OE2 2.75Å; R247-E253 IonicContact NH1-OE1 2.92Å; R247-E253 PolarHBondContact NH1-OE1 2.94Å; R247-E253 IonicContact NH1-OE2 3.02Å; R247-E253 PolarHBondContact NH1-OE2 2.88Å; R247-E253 IonicContact NH2-OE2 3.9Å; R247-E253 PolarHBondContact NH2-OE2 3.42Å; E250-E253 HydrophobicContact CB-CG 4.19Å; E250-E253 PolarHBondContact N-OE1 2.69Å; E250-E253 WeakPolarHBondContact O-CB 3.45Å; E250-E253 PolarHBondContact O-N 3.23Å; E253-V258 HydrophobicContact CB-CG2 4.33Å
254	R	97.6	Very high	94.6	Very high	116 Å²	116	40 Å²	40	44%	0.438	23%	0.226	S	C	.	.	B	Isolated β-bridge	trans	-86.3	126.1	175.9	-63.7	-175.1	-175.4	-81.3	10.9	109.4	D212 V256 Q257 V258	D212-R254 VanDerWaalsContact CB-NH1 3.29Å; D212-R254 PolarHBondContact O-NH1 2.8Å; R254-V256 VanDerWaalsContact C-N 3.34Å; R254-V256 PolarHBondContact O-N 2.94Å; R254-Q257 HydrophobicContact CB-CB 4.01Å; R254-Q257 PolarHBondContact O-N 3.3Å; R254-V258 PolarHBondContact O-N 2.61Å; R254-V258 VanDerWaalsContact O-N 3.13Å
255	V	97.8	Very high	94.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.2	-43.9	-173.7	-179.8	0	0	0	0	111	V195 I209 M213 V215 L218 L236 Q257 V258 Q259 F268	V195-V255 HydrophobicContact CG1-CG1 4.2Å; V195-V255 HydrophobicContact CG2-CG1 4.24Å; I209-V255 HydrophobicContact CD1-CB 3.71Å; I209-V255 HydrophobicContact CD1-CG1 3.69Å; I209-V255 HydrophobicContact CD1-CG2 4.45Å; M213-V255 HydrophobicContact CG-CG2 4.47Å; M213-V255 PolarHBondContact O-N 2.92Å; V215-V255 HydrophobicContact CG2-CG2 4Å; L218-V255 HydrophobicContact CB-CG2 4.18Å; L218-V255 HydrophobicContact CD2-CB 4.31Å; L218-V255 HydrophobicContact CD2-CG1 3.82Å; L218-V255 HydrophobicContact CD2-CG2 3.69Å; L236-V255 HydrophobicContact CD2-CG1 4.35Å; L236-V255 HydrophobicContact CD2-CG2 4.31Å; V255-Q257 VanDerWaalsContact C-N 3.34Å; V255-Q257 PolarHBondContact O-N 3.09Å; V255-V258 PolarHBondContact O-N 3.13Å; V255-Q259 PolarHBondContact O-N 2.79Å; V255-F268 HydrophobicContact CG1-CE2 4.1Å; V255-F268 HydrophobicContact CG1-CZ 4.11Å
256	V	96.3	Very high	94.4	Very high	23 Å²	23	42.7 Å²	42.7	14%	0.139	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-39.5	179.8	177.4	0	0	0	0	111.9	H193 I209 R254 V258 Q259 A260	H193-V256 HydrophobicContact CB-CG2 3.79Å; H193-V256 VanDerWaalsContact CD2-CG1 3.44Å; H193-V256 WeakPolarHBondContact CD2-CG1 3.28Å; I209-V256 HydrophobicContact CD1-CG2 3.99Å; I209-V256 HydrophobicContact CG1-CG2 4.2Å; R254-V256 VanDerWaalsContact C-N 3.34Å; R254-V256 PolarHBondContact O-N 2.94Å; V256-V258 PolarHBondContact O-N 3.06Å; V256-Q259 PolarHBondContact O-N 3.17Å; V256-A260 PolarHBondContact O-N 2.71Å
257	Q	94.5	Very high	94.4	Very high	139 Å²	139	47.4 Å²	47.4	65%	0.65	26%	0.258	S	S	*	.	H	α-helix	trans	-65.4	-40.3	177	-173.7	178.8	3.4	0	0	111.8	R254 V255	R254-Q257 HydrophobicContact CB-CB 4.01Å; R254-Q257 PolarHBondContact O-N 3.3Å; V255-Q257 VanDerWaalsContact C-N 3.34Å; V255-Q257 PolarHBondContact O-N 3.09Å
258	V	94.8	Very high	94.5	Very high	7 Å²	7	46.7 Å²	46.7	4%	0.042	26%	0.256	C	S	.	.	H	α-helix	trans	-65.4	-46.5	174.8	177.3	0	0	0	0	110.1	E238 L249 E253 R254 V255 V256 A260 S261 M262 F268	E238-V258 HydrophobicContact CB-CG1 4.5Å; L249-V258 HydrophobicContact CD1-CB 4.5Å; L249-V258 HydrophobicContact CD1-CG1 4.08Å; L249-V258 HydrophobicContact CD1-CG2 4.4Å; L249-V258 HydrophobicContact CD2-CG1 3.96Å; L249-V258 HydrophobicContact CD2-CG2 4.31Å; E253-V258 HydrophobicContact CB-CG2 4.33Å; R254-V258 PolarHBondContact O-N 2.61Å; R254-V258 VanDerWaalsContact O-N 3.13Å; V255-V258 PolarHBondContact O-N 3.13Å; V256-V258 PolarHBondContact O-N 3.06Å; V258-A260 VanDerWaalsContact C-N 3.28Å; V258-A260 PolarHBondContact O-N 3.14Å; V258-S261 PolarHBondContact O-N 3.22Å; V258-S261 PolarHBondContact O-OG 2.96Å; V258-M262 HydrophobicContact CG1-CG 4.47Å; V258-M262 HydrophobicContact CG1-SD 4.05Å; V258-M262 WeakPolarHBondContact O-CG 3.27Å; V258-M262 PolarHBondContact O-N 2.69Å; V258-F268 HydrophobicContact CB-CE1 4.36Å; V258-F268 HydrophobicContact CB-CZ 4.31Å; V258-F268 HydrophobicContact CG1-CE1 3.79Å; V258-F268 HydrophobicContact CG1-CZ 4.08Å
259	Q	94.8	Very high	94.4	Very high	67 Å²	67	46.4 Å²	46.4	31%	0.313	25%	0.252	S	S	.	.	H	α-helix	trans	-56.4	-41.4	178.6	-175.2	167.8	-69.4	0	0	112.2	I194 V255 V256 S261 M262 F268	I194-Q259 PolarHBondContact O-NE2 2.87Å; V255-Q259 PolarHBondContact O-N 2.79Å; V256-Q259 PolarHBondContact O-N 3.17Å; Q259-S261 PolarHBondContact O-N 2.8Å; Q259-M262 WeakPolarHBondContact O-CB 3.46Å; Q259-M262 PolarHBondContact O-N 2.63Å; Q259-M262 VanDerWaalsContact O-N 3.14Å; Q259-F268 HydrophobicContact CB-CE2 3.9Å; Q259-F268 HydrophobicContact CB-CZ 3.97Å; Q259-F268 HydrophobicContact CG-CE2 4.26Å
260	A	91.8	Very high	94.3	Very high	82 Å²	82	46.4 Å²	46.4	68%	0.678	25%	0.252	S	S	*	.	H	α-helix	trans	-63.7	-21.6	177.9	0	0	0	0	0	113.7	V256 V258	V256-A260 PolarHBondContact O-N 2.71Å; V258-A260 VanDerWaalsContact C-N 3.28Å; V258-A260 PolarHBondContact O-N 3.14Å
261	S	88.4	Confident	94.1	Very high	44 Å²	44	46.5 Å²	46.5	31%	0.308	25%	0.252	S	S	.	.	H	α-helix	trans	-93.4	-6.9	177.8	76.1	0	0	0	0	114.2	V258 Q259	V258-S261 PolarHBondContact O-N 3.22Å; V258-S261 PolarHBondContact O-OG 2.96Å; Q259-S261 PolarHBondContact O-N 2.8Å
262	M	90.1	Very high	93.9	Very high	29 Å²	29	47.1 Å²	47.1	14%	0.143	26%	0.255	C	S	.	.	S	Bend	trans	-86	151.3	-177.4	-71.8	169.7	73.4	0	0	111.6	E238 V258 Q259 F268	E238-M262 HydrophobicContact CG-CE 4.02Å; E238-M262 HydrophobicContact CG-CG 4.02Å; E238-M262 HydrophobicContact CG-SD 4.02Å; E238-M262 WeakPolarHBondContact OE1-CG 3.31Å; V258-M262 HydrophobicContact CG1-CG 4.47Å; V258-M262 HydrophobicContact CG1-SD 4.05Å; V258-M262 WeakPolarHBondContact O-CG 3.27Å; V258-M262 PolarHBondContact O-N 2.69Å; Q259-M262 WeakPolarHBondContact O-CB 3.46Å; Q259-M262 PolarHBondContact O-N 2.63Å; Q259-M262 VanDerWaalsContact O-N 3.14Å; M262-F268 HydrophobicContact CE-CD1 4.32Å; M262-F268 HydrophobicContact CE-CE1 4.2Å; M262-F268 HydrophobicContact CE-CZ 4.34Å; M262-F268 HydrophobicContact SD-CD1 4.23Å; M262-F268 HydrophobicContact SD-CE1 3.52Å; M262-F268 VanDerWaalsContact SD-CE1 3.52Å; M262-F268 HydrophobicContact SD-CE2 4Å; M262-F268 HydrophobicContact SD-CZ 3.41Å; M262-F268 WeakPolarHBondContact SD-CZ 3.28Å
263	S	86.6	Confident	93.8	Very high	51 Å²	51	45.6 Å²	45.6	36%	0.357	25%	0.248	S	C	.	.			trans	-80.2	161.6	169.7	55.8	0	0	0	0	111	D265 S266	S263-D265 WeakPolarHBondContact CB-OD1 3.48Å; S263-D265 PolarHBondContact O-N 3.05Å; S263-D265 VanDerWaalsContact O-N 3.14Å; S263-D265 PolarHBondContact OG-OD1 3.21Å; S263-S266 PolarHBondContact N-OG 3.45Å; S263-S266 WeakPolarHBondContact O-CB 3.37Å; S263-S266 PolarHBondContact O-N 3.27Å; S263-S266 PolarHBondContact O-OG 3.11Å; S263-S266 VanDerWaalsContact O-OG 3.05Å; S263-S266 PolarHBondContact OG-OG 2.9Å
264	S	87	Confident	93.7	Very high	131 Å²	131	44.7 Å²	44.7	92%	0.916	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.5	-174.9	55.7	0	0	0	0	115.2
265	D	89.9	Confident	93.6	Very high	43 Å²	43	40.3 Å²	40.3	23%	0.23	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-11.4	176.6	66.9	-55.8	0	0	0	113.6	P241 L242 S263	P241-D265 WeakPolarHBondContact CD-O 3.29Å; L242-D265 WeakPolarHBondContact CB-OD2 3.31Å; L242-D265 HydrophobicContact CD1-CB 3.85Å; L242-D265 VanDerWaalsContact CD1-OD2 3.28Å; L242-D265 WeakPolarHBondContact CD1-OD2 3.44Å; L242-D265 HydrophobicContact CG-CB 4.21Å; L242-D265 WeakPolarHBondContact CG-OD2 3.29Å; S263-D265 WeakPolarHBondContact CB-OD1 3.48Å; S263-D265 PolarHBondContact O-N 3.05Å; S263-D265 VanDerWaalsContact O-N 3.14Å; S263-D265 PolarHBondContact OG-OD1 3.21Å
266	S	93.9	Very high	93.5	Very high	17 Å²	17	40.7 Å²	40.7	12%	0.119	23%	0.234	C	C	.	.			trans	-74.4	154.3	-178	-53.4	0	0	0	0	111.8	H239 H240 S263	H239-S266 CarbonylContact O-C 3.58Å; H239-S266 VanDerWaalsContact O-CA 3.28Å; H239-S266 WeakPolarHBondContact O-CA 3.45Å; H240-S266 PolarHBondContact CE1-OG 3.06Å; H240-S266 WeakPolarHBondContact ND1-CB 3.17Å; H240-S266 PolarHBondContact ND1-OG 3.21Å; S263-S266 PolarHBondContact N-OG 3.45Å; S263-S266 WeakPolarHBondContact O-CB 3.37Å; S263-S266 PolarHBondContact O-N 3.27Å; S263-S266 PolarHBondContact O-OG 3.11Å; S263-S266 VanDerWaalsContact O-OG 3.05Å; S263-S266 PolarHBondContact OG-OG 2.9Å
267	R	95.7	Very high	93.5	Very high	118 Å²	118	40.2 Å²	40.2	45%	0.445	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	148.1	-174.3	-53	-177.4	-160.5	-173.7	3.6	111	F198 H239	F198-R267 HydrophobicContact CD2-CB 3.73Å; F198-R267 HydrophobicContact CD2-CG 4.17Å; F198-R267 HydrophobicContact CE2-CB 3.86Å; F198-R267 HydrophobicContact CE2-CG 3.87Å; F198-R267 HydrophobicContact CZ-CG 4.35Å; H239-R267 PolarHBondContact N-O 2.88Å; H239-R267 PolarHBondContact O-N 2.52Å
268	F	97.8	Very high	93.5	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.018	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.4	163.2	-67.7	-63.2	0	0	0	109.7	V195 F198 L236 V237 L249 V255 V258 Q259 M262	V195-F268 HydrophobicContact CG1-CD2 3.5Å; V195-F268 VanDerWaalsContact CG1-CD2 3.5Å; V195-F268 HydrophobicContact CG1-CE2 3.73Å; F198-F268 PolarHBondContact N-O 2.83Å; L236-F268 HydrophobicContact CD1-CB 4.03Å; L236-F268 HydrophobicContact CD2-CB 4.48Å; L236-F268 HydrophobicContact CD2-CD1 3.92Å; L236-F268 HydrophobicContact CD2-CE1 4.39Å; L236-F268 HydrophobicContact CD2-CG 4.21Å; L236-F268 HydrophobicContact CG-CB 4.2Å; L236-F268 HydrophobicContact CG-CD1 4.05Å; L236-F268 HydrophobicContact CG-CG 4.35Å; V237-F268 CarbonylContact O-C 3.59Å; V237-F268 VanDerWaalsContact O-CA 3.27Å; V237-F268 WeakPolarHBondContact O-CA 3.07Å; L249-F268 HydrophobicContact CD1-CD1 4.06Å; L249-F268 HydrophobicContact CD1-CE1 3.72Å; V255-F268 HydrophobicContact CG1-CE2 4.1Å; V255-F268 HydrophobicContact CG1-CZ 4.11Å; V258-F268 HydrophobicContact CB-CE1 4.36Å; V258-F268 HydrophobicContact CB-CZ 4.31Å; V258-F268 HydrophobicContact CG1-CE1 3.79Å; V258-F268 HydrophobicContact CG1-CZ 4.08Å; Q259-F268 HydrophobicContact CB-CE2 3.9Å; Q259-F268 HydrophobicContact CB-CZ 3.97Å; Q259-F268 HydrophobicContact CG-CE2 4.26Å; M262-F268 HydrophobicContact CE-CD1 4.32Å; M262-F268 HydrophobicContact CE-CE1 4.2Å; M262-F268 HydrophobicContact CE-CZ 4.34Å; M262-F268 HydrophobicContact SD-CD1 4.23Å; M262-F268 HydrophobicContact SD-CE1 3.52Å; M262-F268 VanDerWaalsContact SD-CE1 3.52Å; M262-F268 HydrophobicContact SD-CE2 4Å; M262-F268 HydrophobicContact SD-CZ 3.41Å; M262-F268 WeakPolarHBondContact SD-CZ 3.28Å
269	L	95.9	Very high	93.5	Very high	22 Å²	22	35.3 Å²	35.3	12%	0.115	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	140.5	168.7	-45.3	176	0	0	0	110	F198 L236 V237 H239	F198-L269 HydrophobicContact CB-CD2 3.83Å; F198-L269 CarbonylContact O-C 3.52Å; F198-L269 VanDerWaalsContact O-CA 3.23Å; F198-L269 WeakPolarHBondContact O-CA 3.37Å; L236-L269 CarbonylContact C-O 3.55Å; L236-L269 WeakPolarHBondContact CA-O 3.49Å; V237-L269 HydrophobicContact CB-CB 4.06Å; V237-L269 PolarHBondContact N-O 2.87Å; V237-L269 PolarHBondContact O-N 3.45Å; H239-L269 HydrophobicContact CB-CD1 3.85Å; H239-L269 HydrophobicContact CB-CG 3.88Å
270	F	95.8	Very high	93.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	114.2	172.2	-178.3	-115.7	0	0	0	109.7	I197 F198 C219 L222 V223 W234 L236 V615 L617	I197-F270 HydrophobicContact CG2-CB 3.74Å; F198-F270 PolarHBondContact O-N 2.81Å; C219-F270 HydrophobicContact CB-CE2 4.16Å; L222-F270 HydrophobicContact CB-CD1 4.3Å; L222-F270 HydrophobicContact CB-CD2 4.45Å; L222-F270 HydrophobicContact CB-CE1 3.84Å; L222-F270 HydrophobicContact CB-CE2 4.02Å; L222-F270 HydrophobicContact CB-CZ 3.69Å; L222-F270 HydrophobicContact CD1-CB 4.18Å; L222-F270 HydrophobicContact CD1-CD1 4.17Å; L222-F270 HydrophobicContact CD1-CD2 3.57Å; L222-F270 HydrophobicContact CD1-CE1 4.44Å; L222-F270 HydrophobicContact CD1-CE2 3.9Å; L222-F270 HydrophobicContact CD1-CG 3.72Å; L222-F270 HydrophobicContact CD1-CZ 4.31Å; V223-F270 HydrophobicContact CG2-CZ 3.93Å; W234-F270 HydrophobicContact CB-CE2 3.98Å; W234-F270 HydrophobicContact CB-CZ 4.08Å; W234-F270 HydrophobicContact CD2-CE1 4.31Å; W234-F270 HydrophobicContact CD2-CE2 4.45Å; W234-F270 AromaticContact CD2-CZ 3.78Å; W234-F270 HydrophobicContact CD2-CZ 3.78Å; W234-F270 HydrophobicContact CE3-CD1 4.2Å; W234-F270 AromaticContact CE3-CE1 3.41Å; W234-F270 HydrophobicContact CE3-CE1 3.41Å; W234-F270 VanDerWaalsContact CE3-CE1 3.41Å; W234-F270 AromaticContact CE3-CE2 3.87Å; W234-F270 HydrophobicContact CE3-CE2 3.87Å; W234-F270 AromaticContact CE3-CZ 3.21Å; W234-F270 HydrophobicContact CE3-CZ 3.21Å; W234-F270 HydrophobicContact CG-CZ 4.14Å; W234-F270 HydrophobicContact CH2-CE1 4.48Å; W234-F270 HydrophobicContact CZ3-CD1 4.13Å; W234-F270 AromaticContact CZ3-CE1 3.45Å; W234-F270 HydrophobicContact CZ3-CE1 3.45Å; W234-F270 VanDerWaalsContact CZ3-CE1 3.45Å; W234-F270 AromaticContact CZ3-CZ 3.79Å; W234-F270 HydrophobicContact CZ3-CZ 3.79Å; L236-F270 HydrophobicContact CD1-CB 4.46Å; F270-V615 HydrophobicContact CD1-CG1 3.92Å; F270-V615 HydrophobicContact CE1-CG1 3.98Å; F270-L617 HydrophobicContact CB-CD1 4.19Å; F270-L617 HydrophobicContact CB-CD2 4.46Å; F270-L617 HydrophobicContact CD1-CD2 3.53Å; F270-L617 HydrophobicContact CD1-CG 4.23Å; F270-L617 HydrophobicContact CE1-CD2 4.13Å; F270-L617 HydrophobicContact CG-CD2 4.31Å
271	R	93.9	Very high	93.4	Very high	7 Å²	7	33.5 Å²	33.5	3%	0.026	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	170.7	-178.2	70.3	179.6	-165.8	-142.8	1.2	111.9	E200 A235 V237 E246 Q532	E200-R271 HydrophobicContact CG-CB 3.75Å; E200-R271 WeakPolarHBondContact OE1-CD 3.22Å; A235-R271 PolarHBondContact N-O 2.79Å; A235-R271 PolarHBondContact O-N 3.13Å; A235-R271 VanDerWaalsContact O-N 3.13Å; A235-R271 VanDerWaalsContact O-O 3.11Å; V237-R271 HydrophobicContact CG2-CG 4.07Å; E246-R271 IonicContact OE1-CZ 3.32Å; E246-R271 IonicContact OE1-NH1 2.88Å; E246-R271 IonicContact OE1-NH2 2.65Å; E246-R271 PolarHBondContact OE1-NH2 2.83Å; E246-R271 IonicContact OE2-CZ 3.4Å; E246-R271 IonicContact OE2-NH1 2.71Å; E246-R271 PolarHBondContact OE2-NH1 3.43Å; E246-R271 IonicContact OE2-NH2 3.26Å; E246-R271 PolarHBondContact OE2-NH2 3.24Å; R271-Q532 PolarHBondContact NE-O 3.37Å; R271-Q532 VanDerWaalsContact NE-O 3.09Å; R271-Q532 PolarHBondContact NH2-O 3.21Å
272	K	94.3	Very high	93.5	Very high	12 Å²	12	35.1 Å²	35.1	5%	0.052	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	147	171.7	-65.5	-164.7	173.5	-171	0	111.5	D231 S233 W234 Y274 Q533 T613	D231-K272 IonicContact OD2-NZ 3.3Å; D231-K272 PolarHBondContact OD2-NZ 2.86Å; S233-K272 CarbonylContact O-C 3.52Å; S233-K272 WeakPolarHBondContact O-CA 3.44Å; S233-K272 VanDerWaalsContact OG-CD 3.32Å; S233-K272 WeakPolarHBondContact OG-CD 3.32Å; S233-K272 WeakPolarHBondContact OG-CG 3.23Å; W234-K272 HydrophobicContact CD2-CG 4.32Å; W234-K272 HydrophobicContact CE3-CG 4.16Å; W234-K272 HydrophobicContact CH2-CG 4.32Å; W234-K272 VanDerWaalsContact CZ2-CE 3.48Å; W234-K272 HydrophobicContact CZ2-CG 4.39Å; W234-K272 HydrophobicContact CZ3-CG 4.23Å; K272-Y274 HydrophobicContact CB-CE2 4.11Å; K272-Y274 HydrophobicContact CD-CE2 3.91Å; K272-Y274 WeakPolarHBondContact CD-OH 3.47Å; K272-Y274 PolarHBondContact NZ-OH 2.72Å; K272-Q533 HydrophobicContact CB-CG 4.43Å; K272-Q533 WeakPolarHBondContact O-CA 3.43Å; K272-T613 VanDerWaalsContact CD-OG1 3.27Å; K272-T613 WeakPolarHBondContact CD-OG1 3.32Å; K272-T613 WeakPolarHBondContact CE-OG1 3.32Å
273	N	95.6	Very high	93.5	Very high	21 Å²	21	35 Å²	35	11%	0.112	19%	0.186	C	C	.	.			trans	-144.9	96.7	168.6	-178.7	-7.5	0	0	0	109.7	S233 A235 C248 A275 K276 Q533	S233-N273 PolarHBondContact O-N 3.2Å; A235-N273 HydrophobicContact CB-CB 4.02Å; C248-N273 PolarHBondContact SG-ND2 3.24Å; N273-A275 VanDerWaalsContact C-N 3.3Å; N273-A275 PolarHBondContact O-N 3.12Å; N273-A275 PolarHBondContact OD1-N 3.02Å; N273-K276 HydrophobicContact CB-CB 4.46Å; N273-K276 PolarHBondContact OD1-N 2.72Å; N273-K276 VanDerWaalsContact OD1-N 3.09Å; N273-Q533 CarbonylContact C-O 3.52Å; N273-Q533 WeakPolarHBondContact CA-O 3.44Å
274	Y	95.6	Very high	93.5	Very high	6 Å²	6	37.3 Å²	37.3	2%	0.024	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-23.2	179.6	-68	-74.8	0	0	0	113.5	D231 K272 R281 Q533 V536 L539 H610 P611	D231-Y274 PolarHBondContact OD2-OH 3.32Å; K272-Y274 HydrophobicContact CB-CE2 4.11Å; K272-Y274 HydrophobicContact CD-CE2 3.91Å; K272-Y274 WeakPolarHBondContact CD-OH 3.47Å; K272-Y274 PolarHBondContact NZ-OH 2.72Å; Y274-R281 PolarHBondContact O-NH1 2.97Å; Y274-Q533 HydrophobicContact CD2-CB 4.31Å; Y274-Q533 WeakPolarHBondContact CD2-O 3.3Å; Y274-Q533 PolarHBondContact N-O 3.1Å; Y274-V536 HydrophobicContact CG-CG2 4.37Å; Y274-L539 HydrophobicContact CD2-CD1 3.54Å; Y274-L539 HydrophobicContact CE2-CD1 3.68Å; Y274-L539 HydrophobicContact CG-CD1 4.49Å; Y274-H610 HydrophobicContact CD1-CB 3.92Å; Y274-H610 AromaticContact CD1-CG 3.68Å; Y274-H610 AromaticContact CD1-ND1 3.64Å; Y274-H610 HydrophobicContact CD2-CB 4.1Å; Y274-H610 HydrophobicContact CE1-CB 3.79Å; Y274-H610 AromaticContact CE1-CG 3.84Å; Y274-H610 AromaticContact CE1-ND1 3.62Å; Y274-H610 HydrophobicContact CE2-CB 3.96Å; Y274-H610 HydrophobicContact CG-CB 4.07Å; Y274-P611 PolarHBondContact OH-O 3.29Å
275	A	95.5	Very high	93.5	Very high	24 Å²	24	36.6 Å²	36.6	20%	0.198	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-8.6	-177.5	0	0	0	0	0	113.9	N273 Y277 E278 V536	N273-A275 VanDerWaalsContact C-N 3.3Å; N273-A275 PolarHBondContact O-N 3.12Å; N273-A275 PolarHBondContact OD1-N 3.02Å; A275-Y277 PolarHBondContact O-N 2.63Å; A275-E278 WeakPolarHBondContact O-CB 3.47Å; A275-E278 PolarHBondContact O-N 3.37Å; A275-E278 VanDerWaalsContact O-N 3.07Å; A275-V536 HydrophobicContact CB-CG1 3.9Å
276	K	96.2	Very high	93.6	Very high	8 Å²	8	35.1 Å²	35.1	4%	0.035	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-37	-171.5	-177.1	171	177.9	171.5	0	114.1	L249 E250 D251 N273 R422	L249-K276 PolarHBondContact O-NZ 2.87Å; E250-K276 WeakPolarHBondContact OE2-CE 3.49Å; D251-K276 WeakPolarHBondContact OD1-CE 3.48Å; D251-K276 IonicContact OD1-NZ 2.75Å; D251-K276 PolarHBondContact OD1-NZ 3.09Å; N273-K276 HydrophobicContact CB-CB 4.46Å; N273-K276 PolarHBondContact OD1-N 2.72Å; N273-K276 VanDerWaalsContact OD1-N 3.09Å; K276-R422 PolarHBondContact O-NH1 3.46Å; K276-R422 PolarHBondContact O-NH2 2.96Å; K276-R422 VanDerWaalsContact O-NH2 3.07Å
277	Y	95.8	Very high	93.5	Very high	12 Å²	12	34.9 Å²	34.9	5%	0.047	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.6	24.3	-178.1	-62.4	-42.5	0	0	0	113.6	D251 A275 F279 F280 R281 L430 N433 Y434 R437	D251-Y277 PolarHBondContact OD1-OH 2.9Å; D251-Y277 VanDerWaalsContact OD1-OH 3.13Å; D251-Y277 PolarHBondContact OD2-OH 2.65Å; A275-Y277 PolarHBondContact O-N 2.63Å; Y277-F279 VanDerWaalsContact C-N 3.27Å; Y277-F279 PolarHBondContact O-N 3.06Å; Y277-F280 HydrophobicContact CD1-CD2 4.03Å; Y277-F280 HydrophobicContact CD1-CE2 4.11Å; Y277-F280 HydrophobicContact CG-CD2 4.39Å; Y277-F280 PolarHBondContact O-N 3.24Å; Y277-R281 PolarHBondContact O-N 3.12Å; Y277-L430 HydrophobicContact CE1-CD1 4.04Å; Y277-N433 HydrophobicContact CE1-CB 4.49Å; Y277-N433 VanDerWaalsContact OH-CB 3.27Å; Y277-N433 WeakPolarHBondContact OH-CB 3.31Å; Y277-Y434 AromaticContact CD2-CD2 3.99Å; Y277-Y434 HydrophobicContact CD2-CD2 3.99Å; Y277-Y434 AromaticContact CG-CD2 3.99Å; Y277-Y434 HydrophobicContact CG-CD2 3.99Å; Y277-Y434 HydrophobicContact CG-CG 4.49Å; Y277-R437 HydrophobicContact CE2-CG 4.19Å; Y277-R437 VanDerWaalsContact CZ-NH1 3.3Å; Y277-R437 PolarHBondContact OH-NH1 3.24Å
278	E	94.4	Very high	93.3	Very high	40 Å²	40	31 Å²	31	19%	0.187	16%	0.163	C	C	.	.	H	α-helix	trans	-59	-38	-174.5	-169.6	55.5	-152.8	0	0	112.8	A275 F280 R281 N282 F286 V536	A275-E278 WeakPolarHBondContact O-CB 3.47Å; A275-E278 PolarHBondContact O-N 3.37Å; A275-E278 VanDerWaalsContact O-N 3.07Å; E278-F280 VanDerWaalsContact C-N 3.28Å; E278-F280 PolarHBondContact O-N 3.5Å; E278-R281 WeakPolarHBondContact O-CB 3.48Å; E278-R281 PolarHBondContact O-N 3.1Å; E278-R281 IonicContact OE2-NH1 2.72Å; E278-N282 PolarHBondContact O-N 3.07Å; E278-N282 PolarHBondContact OE1-ND2 3.33Å; E278-F286 HydrophobicContact CB-CE2 4.2Å; E278-F286 HydrophobicContact CG-CE2 4.4Å; E278-V536 HydrophobicContact CG-CG1 4.28Å
279	F	94.3	Very high	92.8	Very high	3 Å²	3	38 Å²	38	1%	0.013	20%	0.2	C	C	.	.	H	α-helix	trans	-54.1	-40.1	172.7	169.1	-105.4	0	0	0	113.4	Y277 R281 N282 P283 F286 F287 L308 F311 T419 I423	Y277-F279 VanDerWaalsContact C-N 3.27Å; Y277-F279 PolarHBondContact O-N 3.06Å; F279-R281 VanDerWaalsContact C-N 3.32Å; F279-R281 PolarHBondContact O-N 3.45Å; F279-N282 CarbonylContact O-C 3.54Å; F279-P283 HydrophobicContact CD2-CB 4.43Å; F279-P283 HydrophobicContact CE2-CB 4.04Å; F279-P283 HydrophobicContact CZ-CB 4.32Å; F279-P283 WeakPolarHBondContact O-CA 3.3Å; F279-P283 VanDerWaalsContact O-CB 3.28Å; F279-P283 WeakPolarHBondContact O-CB 3.19Å; F279-P283 WeakPolarHBondContact O-CD 2.97Å; F279-F286 HydrophobicContact CB-CD1 4.05Å; F279-F286 HydrophobicContact CB-CD2 3.92Å; F279-F286 HydrophobicContact CB-CE1 4.12Å; F279-F286 HydrophobicContact CB-CE2 4Å; F279-F286 HydrophobicContact CB-CG 3.94Å; F279-F286 HydrophobicContact CB-CZ 4.11Å; F279-F286 HydrophobicContact CD2-CB 3.88Å; F279-F286 AromaticContact CD2-CD1 3.7Å; F279-F286 HydrophobicContact CD2-CD1 3.7Å; F279-F286 HydrophobicContact CD2-CE1 4.42Å; F279-F286 AromaticContact CD2-CG 3.79Å; F279-F286 HydrophobicContact CD2-CG 3.79Å; F279-F286 HydrophobicContact CG-CD1 4.31Å; F279-F286 HydrophobicContact CG-CG 4.38Å; F279-F287 HydrophobicContact CD2-CD2 4.28Å; F279-F287 AromaticContact CD2-CE2 3.72Å; F279-F287 HydrophobicContact CD2-CE2 3.72Å; F279-F287 HydrophobicContact CE2-CD2 4.05Å; F279-F287 AromaticContact CE2-CE2 3.55Å; F279-F287 HydrophobicContact CE2-CE2 3.55Å; F279-F287 HydrophobicContact CZ-CE2 4.42Å; F279-L308 HydrophobicContact CE1-CD1 3.59Å; F279-L308 HydrophobicContact CZ-CD1 3.95Å; F279-F311 HydrophobicContact CE2-CD2 4.26Å; F279-F311 HydrophobicContact CE2-CE2 4.4Å; F279-F311 AromaticContact CZ-CD2 3.76Å; F279-F311 HydrophobicContact CZ-CD2 3.76Å; F279-F311 HydrophobicContact CZ-CE2 4.34Å; F279-F311 HydrophobicContact CZ-CG 4.43Å; F279-T419 HydrophobicContact CB-CG2 3.75Å; F279-T419 HydrophobicContact CG-CG2 4.36Å; F279-I423 HydrophobicContact CD1-CD1 3.43Å; F279-I423 VanDerWaalsContact CD1-CD1 3.43Å; F279-I423 HydrophobicContact CD1-CG1 4.21Å; F279-I423 HydrophobicContact CD2-CD1 4.25Å; F279-I423 HydrophobicContact CE1-CD1 3.5Å; F279-I423 HydrophobicContact CE1-CG1 4.3Å; F279-I423 HydrophobicContact CE2-CD1 4.33Å; F279-I423 HydrophobicContact CG-CD1 3.83Å; F279-I423 HydrophobicContact CZ-CD1 3.97Å
280	F	93.7	Very high	92.4	Very high	14 Å²	14	43.7 Å²	43.7	6%	0.061	23%	0.226	C	C	.	.	H	α-helix	trans	-80.3	-14.9	-179.5	-57.8	-63.4	0	0	0	113.6	Y277 E278 L308 L430 Y431 Y434	Y277-F280 HydrophobicContact CD1-CD2 4.03Å; Y277-F280 HydrophobicContact CD1-CE2 4.11Å; Y277-F280 HydrophobicContact CG-CD2 4.39Å; Y277-F280 PolarHBondContact O-N 3.24Å; E278-F280 VanDerWaalsContact C-N 3.28Å; E278-F280 PolarHBondContact O-N 3.5Å; F280-L308 HydrophobicContact CD1-CD1 3.72Å; F280-L308 HydrophobicContact CE1-CD1 3.87Å; F280-L430 HydrophobicContact CE2-CD2 4.07Å; F280-L430 HydrophobicContact CE2-CG 3.8Å; F280-L430 HydrophobicContact CZ-CB 4.25Å; F280-L430 HydrophobicContact CZ-CD2 4.02Å; F280-L430 HydrophobicContact CZ-CG 3.93Å; F280-Y431 AromaticContact CD1-CD2 3.68Å; F280-Y431 HydrophobicContact CD1-CD2 3.68Å; F280-Y431 HydrophobicContact CD1-CE2 4.33Å; F280-Y431 AromaticContact CE1-CD2 3.83Å; F280-Y431 HydrophobicContact CE1-CD2 3.83Å; F280-Y431 HydrophobicContact CE1-CG 4.4Å; F280-Y431 HydrophobicContact CG-CD2 4.28Å; F280-Y434 HydrophobicContact CB-CD1 3.47Å; F280-Y434 VanDerWaalsContact CB-CD1 3.47Å; F280-Y434 HydrophobicContact CB-CD2 4Å; F280-Y434 HydrophobicContact CB-CE1 3.52Å; F280-Y434 HydrophobicContact CB-CE2 4.07Å; F280-Y434 HydrophobicContact CB-CG 3.68Å; F280-Y434 HydrophobicContact CD2-CD1 4.3Å; F280-Y434 HydrophobicContact CD2-CD2 4.45Å; F280-Y434 AromaticContact CD2-CG 3.91Å; F280-Y434 HydrophobicContact CD2-CG 3.91Å; F280-Y434 AromaticContact CG-CD1 3.95Å; F280-Y434 HydrophobicContact CG-CD1 3.95Å; F280-Y434 HydrophobicContact CG-CE1 4.46Å; F280-Y434 HydrophobicContact CG-CG 4.01Å; F280-Y434 PolarHBondContact O-OH 2.79Å
281	R	91.4	Very high	92.3	Very high	97 Å²	97	43.9 Å²	43.9	37%	0.366	23%	0.227	S	C	.	.	H	α-helix	trans	-81.2	-43.9	172.1	-66.8	-179.7	178.3	164.1	-1.5	110.6	Y274 Y277 E278 F279 Y434	Y274-R281 PolarHBondContact O-NH1 2.97Å; Y277-R281 PolarHBondContact O-N 3.12Å; E278-R281 WeakPolarHBondContact O-CB 3.48Å; E278-R281 PolarHBondContact O-N 3.1Å; E278-R281 IonicContact OE2-NH1 2.72Å; F279-R281 VanDerWaalsContact C-N 3.32Å; F279-R281 PolarHBondContact O-N 3.45Å; R281-Y434 HydrophobicContact CG-CE2 4.2Å
282	N	90.2	Very high	92.1	Very high	79 Å²	79	44.8 Å²	44.8	42%	0.422	23%	0.233	S	C	.	.	S	Bend	trans	-130.6	60.9	-174.2	-63.2	-52.3	0	0	0	112	E278 F279 L284 F286	E278-N282 PolarHBondContact O-N 3.07Å; E278-N282 PolarHBondContact OE1-ND2 3.33Å; F279-N282 CarbonylContact O-C 3.54Å; N282-L284 VanDerWaalsContact C-N 3.29Å; N282-L284 PolarHBondContact O-N 3.5Å; N282-F286 WeakPolarHBondContact O-CB 3.24Å; N282-F286 PolarHBondContact O-N 2.93Å
283	P	90.2	Very high	91.6	Very high	25 Å²	25	45.1 Å²	45.1	16%	0.162	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-30	-170.4	24.1	-33.6	0	0	0	113.9	F279 L307 L308	F279-P283 HydrophobicContact CD2-CB 4.43Å; F279-P283 HydrophobicContact CE2-CB 4.04Å; F279-P283 HydrophobicContact CZ-CB 4.32Å; F279-P283 WeakPolarHBondContact O-CA 3.3Å; F279-P283 VanDerWaalsContact O-CB 3.28Å; F279-P283 WeakPolarHBondContact O-CB 3.19Å; F279-P283 WeakPolarHBondContact O-CD 2.97Å; P283-L307 WeakPolarHBondContact O-CD2 3.25Å; P283-L308 HydrophobicContact CB-CB 4.39Å
284	L	85.7	Confident	90.7	Very high	101 Å²	101	47.3 Å²	47.3	53%	0.529	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-32.2	-172.6	-52.7	-177.1	0	0	0	113.2	N282 P304	N282-L284 VanDerWaalsContact C-N 3.29Å; N282-L284 PolarHBondContact O-N 3.5Å; L284-P304 HydrophobicContact CB-CB 4.32Å; L284-P304 HydrophobicContact CD2-CB 3.72Å; L284-P304 WeakPolarHBondContact CD2-O 3.42Å; L284-P304 HydrophobicContact CG-CB 4.48Å
285	T	87.5	Confident	89.2	Confident	116 Å²	116	50.1 Å²	50.1	71%	0.712	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.9	3.9	-174.9	54.9	0	0	0	0	112.4
286	F	92	Very high	87.8	Confident	12 Å²	12	56 Å²	56	5%	0.053	29%	0.288	C	S	.	.	S	Bend	trans	-73.8	-41.4	-173.1	-173.1	-93	0	0	0	113.2	E278 F279 N282 Q412 T415 C416 T419	E278-F286 HydrophobicContact CB-CE2 4.2Å; E278-F286 HydrophobicContact CG-CE2 4.4Å; F279-F286 HydrophobicContact CB-CD1 4.05Å; F279-F286 HydrophobicContact CB-CD2 3.92Å; F279-F286 HydrophobicContact CB-CE1 4.12Å; F279-F286 HydrophobicContact CB-CE2 4Å; F279-F286 HydrophobicContact CB-CG 3.94Å; F279-F286 HydrophobicContact CB-CZ 4.11Å; F279-F286 HydrophobicContact CD2-CB 3.88Å; F279-F286 AromaticContact CD2-CD1 3.7Å; F279-F286 HydrophobicContact CD2-CD1 3.7Å; F279-F286 HydrophobicContact CD2-CE1 4.42Å; F279-F286 AromaticContact CD2-CG 3.79Å; F279-F286 HydrophobicContact CD2-CG 3.79Å; F279-F286 HydrophobicContact CG-CD1 4.31Å; F279-F286 HydrophobicContact CG-CG 4.38Å; N282-F286 WeakPolarHBondContact O-CB 3.24Å; N282-F286 PolarHBondContact O-N 2.93Å; F286-Q412 PolarHBondContact O-NE2 3.42Å; F286-T415 HydrophobicContact CE2-CG2 4.33Å; F286-T415 HydrophobicContact CZ-CG2 3.94Å; F286-C416 PolarHBondContact O-SG 3.1Å; F286-T419 HydrophobicContact CE1-CG2 3.62Å; F286-T419 HydrophobicContact CZ-CG2 3.61Å; F286-T419 WeakPolarHBondContact CZ-OG1 3.34Å
287	F	92.8	Very high	85.8	Confident	12 Å²	12	64.7 Å²	64.7	5%	0.053	33%	0.329	C	S	.	.	S	Bend	trans	-102	135.5	179.8	-68.3	-73.1	0	0	0	110.4	F279 M291 V292 L307 F311 I320 C416 A420 I423	F279-F287 HydrophobicContact CD2-CD2 4.28Å; F279-F287 AromaticContact CD2-CE2 3.72Å; F279-F287 HydrophobicContact CD2-CE2 3.72Å; F279-F287 HydrophobicContact CE2-CD2 4.05Å; F279-F287 AromaticContact CE2-CE2 3.55Å; F279-F287 HydrophobicContact CE2-CE2 3.55Å; F279-F287 HydrophobicContact CZ-CE2 4.42Å; F287-M291 HydrophobicContact CD1-SD 4.21Å; F287-V292 HydrophobicContact CB-CG2 3.39Å; F287-V292 HydrophobicContact CD1-CG2 4.4Å; F287-V292 HydrophobicContact CD2-CG2 4.15Å; F287-V292 HydrophobicContact CG-CG2 3.76Å; F287-L307 HydrophobicContact CD2-CD2 4.41Å; F287-F311 HydrophobicContact CD2-CE2 4.01Å; F287-F311 HydrophobicContact CD2-CZ 4.27Å; F287-F311 AromaticContact CE2-CE2 3.66Å; F287-F311 HydrophobicContact CE2-CE2 3.66Å; F287-F311 AromaticContact CE2-CZ 3.82Å; F287-F311 HydrophobicContact CE2-CZ 3.82Å; F287-F311 HydrophobicContact CZ-CZ 4.33Å; F287-I320 HydrophobicContact CD1-CD1 4.26Å; F287-I320 HydrophobicContact CE1-CD1 4.19Å; F287-C416 HydrophobicContact CD1-CB 3.77Å; F287-C416 HydrophobicContact CE1-CB 3.89Å; F287-C416 WeakPolarHBondContact CE1-O 3.29Å; F287-A420 HydrophobicContact CE1-CB 4.01Å; F287-A420 HydrophobicContact CZ-CB 4.07Å; F287-I423 HydrophobicContact CE2-CD1 4.48Å; F287-I423 HydrophobicContact CZ-CD1 4.31Å
288	P	91.6	Very high	83.8	Confident	37 Å²	37	68.8 Å²	68.8	24%	0.24	35%	0.352	C	S	.	.			trans	-59.5	143.6	168.3	-22.5	32.9	0	0	0	111.7	H290 M291 Q412	P288-H290 VanDerWaalsContact CB-CE1 3.44Å; P288-H290 WeakPolarHBondContact CB-CE1 3.45Å; P288-H290 PolarHBondContact O-N 3.28Å; P288-H290 VanDerWaalsContact O-N 3.1Å; P288-M291 HydrophobicContact CB-CB 4.34Å; P288-M291 WeakPolarHBondContact O-CB 3.2Å; P288-M291 PolarHBondContact O-N 3.34Å; P288-Q412 HydrophobicContact CG-CG 4.49Å
289	D	85.6	Confident	81.9	Confident	149 Å²	149	75 Å²	75	80%	0.797	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-37.8	-176	-71.4	-8	0	0	0	114	M291	D289-M291 VanDerWaalsContact C-N 3.28Å; D289-M291 PolarHBondContact O-N 3.03Å
290	H	88.4	Confident	80.4	Confident	142 Å²	142	81.6 Å²	81.6	66%	0.657	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-16.8	-178.2	62.8	-92.6	0	0	0	113.5	P288 Q321	P288-H290 VanDerWaalsContact CB-CE1 3.44Å; P288-H290 WeakPolarHBondContact CB-CE1 3.45Å; P288-H290 PolarHBondContact O-N 3.28Å; P288-H290 VanDerWaalsContact O-N 3.1Å; H290-Q321 PolarHBondContact O-NE2 3.18Å
291	M	93.8	Very high	79.2	Confident	5 Å²	5	89.7 Å²	89.7	3%	0.025	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-26.3	-173	-174.2	169.2	-173.9	0	0	112.6	F287 P288 D289 I320 Q321 C416 W417	F287-M291 HydrophobicContact CD1-SD 4.21Å; P288-M291 HydrophobicContact CB-CB 4.34Å; P288-M291 WeakPolarHBondContact O-CB 3.2Å; P288-M291 PolarHBondContact O-N 3.34Å; D289-M291 VanDerWaalsContact C-N 3.28Å; D289-M291 PolarHBondContact O-N 3.03Å; M291-I320 HydrophobicContact CE-CG2 3.45Å; M291-I320 VanDerWaalsContact CE-CG2 3.45Å; M291-I320 HydrophobicContact CG-CG2 3.87Å; M291-I320 CarbonylContact O-C 3.49Å; M291-I320 WeakPolarHBondContact O-CA 3.35Å; M291-I320 HydrophobicContact SD-CG2 4.48Å; M291-Q321 WeakPolarHBondContact CA-O 3.39Å; M291-Q321 PolarHBondContact O-N 3.26Å; M291-C416 HydrophobicContact CE-CB 3.51Å; M291-C416 HydrophobicContact SD-CB 3.39Å; M291-C416 WeakPolarHBondContact SD-CB 3.48Å; M291-W417 HydrophobicContact CE-CB 4.28Å; M291-W417 VanDerWaalsContact CE-CD1 3.44Å; M291-W417 HydrophobicContact CE-CD2 3.64Å; M291-W417 HydrophobicContact CE-CE3 4.43Å; M291-W417 HydrophobicContact CE-CG 3.54Å; M291-W417 HydrophobicContact CE-CZ2 4.36Å
292	V	90.4	Very high	78.2	Confident	26 Å²	26	86.3 Å²	86.3	16%	0.158	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126	-179.1	-165.4	0	0	0	0	109.9	F287 I302 L307 F311 P318 I320	F287-V292 HydrophobicContact CB-CG2 3.39Å; F287-V292 HydrophobicContact CD1-CG2 4.4Å; F287-V292 HydrophobicContact CD2-CG2 4.15Å; F287-V292 HydrophobicContact CG-CG2 3.76Å; V292-I302 HydrophobicContact CG1-CD1 3.63Å; V292-L307 HydrophobicContact CG1-CD1 4.03Å; V292-F311 HydrophobicContact CG1-CZ 4.23Å; V292-P318 HydrophobicContact CG1-CB 3.64Å; V292-P318 HydrophobicContact CG1-CG 4.4Å; V292-I320 HydrophobicContact CB-CD1 4.28Å; V292-I320 HydrophobicContact CG1-CD1 4.21Å; V292-I320 HydrophobicContact CG2-CD1 3.76Å
293	A	83.8	Confident	77.4	Confident	18 Å²	18	85.1 Å²	85.1	15%	0.149	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	168.3	174.8	0	0	0	0	0	111	P318 E319 Q321	A293-P318 CarbonylContact O-C 3.59Å; A293-P318 WeakPolarHBondContact O-CA 3.3Å; A293-E319 PolarHBondContact N-O 3.44Å; A293-E319 PolarHBondContact O-N 3.4Å; A293-Q321 HydrophobicContact CB-CG 4.43Å
294	W	75.8	Confident	76.6	Confident	67 Å²	67	87.7 Å²	87.7	25%	0.254	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	145.3	164.6	-73.9	113.5	0	0	0	110.5	Q296 H300 I302 N310	W294-Q296 WeakPolarHBondContact CB-O 3.23Å; W294-Q296 PolarHBondContact O-N 3.01Å; W294-H300 PolarHBondContact NE1-O 3.2Å; W294-I302 HydrophobicContact CD2-CD1 4.16Å; W294-I302 HydrophobicContact CD2-CG1 3.9Å; W294-I302 HydrophobicContact CG-CD1 4.49Å; W294-I302 HydrophobicContact CG-CG1 4.21Å; W294-I302 HydrophobicContact CH2-CG1 4.46Å; W294-I302 HydrophobicContact CZ2-CB 4.49Å; W294-I302 HydrophobicContact CZ2-CD1 4.36Å; W294-I302 HydrophobicContact CZ2-CG1 3.61Å; W294-I302 HydrophobicContact CZ2-CG2 4.46Å; W294-N310 HydrophobicContact CH2-CB 4.13Å; W294-N310 VanDerWaalsContact CH2-ND2 3.31Å; W294-N310 WeakPolarHBondContact CH2-ND2 3.39Å
295	C	64.1	Low	76.1	Confident	65 Å²	65	87.7 Å²	87.7	44%	0.439	46%	0.462	S	S	.	.	S	Bend	trans	-64.9	-23.7	171.6	-80.8	0	0	0	0	112.6
296	Q	65.9	Low	75.8	Confident	147 Å²	147	86.4 Å²	86.4	69%	0.687	45%	0.448	S	S	*	.	S	Bend	trans	-105.2	136	176.8	-66.1	176.3	2.1	0	0	108.5	W294 N298	W294-Q296 WeakPolarHBondContact CB-O 3.23Å; W294-Q296 PolarHBondContact O-N 3.01Å; Q296-N298 PolarHBondContact O-N 2.92Å
297	E	54.3	Low	75.4	Confident	191 Å²	191	86.5 Å²	86.5	89%	0.893	45%	0.449	S	S	*	.			trans	-69.2	72.9	177.8	-71.5	179.4	169.1	0	0	110.8
298	N	54.8	Low	75.1	Confident	99 Å²	99	87.7 Å²	87.7	53%	0.529	46%	0.456	S	S	.	.			trans	-106.2	123.3	156.7	-67.9	-25.1	0	0	0	105.6	Q296 H300	Q296-N298 PolarHBondContact O-N 2.92Å; N298-H300 PolarHBondContact O-N 3.2Å
299	D	53.2	Low	74.9	Confident	171 Å²	171	92.4 Å²	92.4	91%	0.914	48%	0.475	S	S	*	.			trans	-65	9	-178.4	-137	7.4	0	0	0	113.3	K301	D299-K301 PolarHBondContact O-N 3Å
300	H	62.8	Low	74.9	Confident	141 Å²	141	86 Å²	86	65%	0.653	44%	0.44	S	S	*	.			trans	-81.2	111.6	178.4	-58.4	-45.4	0	0	0	110	W294 N298	W294-H300 PolarHBondContact NE1-O 3.2Å; N298-H300 PolarHBondContact O-N 3.2Å
301	K	68.3	Low	74.9	Confident	184 Å²	184	79.2 Å²	79.2	80%	0.8	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-54.8	139.7	166.1	-67.1	-175.8	177.3	-175.6	0	109.8	D299 P303	D299-K301 PolarHBondContact O-N 3Å; K301-P303 VanDerWaalsContact O-CD 3.31Å; K301-P303 WeakPolarHBondContact O-CD 3.38Å
302	I	70.5	Confident	74.5	Confident	26 Å²	26	80.3 Å²	80.3	13%	0.133	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-63.8	121.4	174.5	-64.3	162.5	0	0	0	107.9	V292 W294 P304 L307 P318	V292-I302 HydrophobicContact CG1-CD1 3.63Å; W294-I302 HydrophobicContact CD2-CD1 4.16Å; W294-I302 HydrophobicContact CD2-CG1 3.9Å; W294-I302 HydrophobicContact CG-CD1 4.49Å; W294-I302 HydrophobicContact CG-CG1 4.21Å; W294-I302 HydrophobicContact CH2-CG1 4.46Å; W294-I302 HydrophobicContact CZ2-CB 4.49Å; W294-I302 HydrophobicContact CZ2-CD1 4.36Å; W294-I302 HydrophobicContact CZ2-CG1 3.61Å; W294-I302 HydrophobicContact CZ2-CG2 4.46Å; I302-P304 WeakPolarHBondContact O-CD 3.27Å; I302-L307 HydrophobicContact CD1-CD1 4.35Å; I302-L307 HydrophobicContact CG2-CB 4.36Å; I302-L307 HydrophobicContact CG2-CD1 3.97Å; I302-P318 HydrophobicContact CD1-CB 3.86Å; I302-P318 HydrophobicContact CD1-CG 3.94Å
303	P	74.3	Confident	74.2	Confident	53 Å²	53	79.9 Å²	79.9	34%	0.344	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-57.7	128.3	172.2	-23.2	33.8	0	0	0	108.9	K301 S305 Q306 L307	K301-P303 VanDerWaalsContact O-CD 3.31Å; K301-P303 WeakPolarHBondContact O-CD 3.38Å; P303-S305 PolarHBondContact O-N 3.36Å; P303-S305 VanDerWaalsContact O-N 3.09Å; P303-Q306 HydrophobicContact CB-CG 4.3Å; P303-Q306 PolarHBondContact O-N 3.19Å; P303-L307 PolarHBondContact O-N 3.41Å
304	P	72.5	Confident	74	Confident	79 Å²	79	83.4 Å²	83.4	51%	0.513	43%	0.434	S	S	.	.	H	α-helix	trans	-52	-39.7	-177.1	-29.9	35.5	0	0	0	112.4	L284 I302 Q306 L307	L284-P304 HydrophobicContact CB-CB 4.32Å; L284-P304 HydrophobicContact CD2-CB 3.72Å; L284-P304 WeakPolarHBondContact CD2-O 3.42Å; L284-P304 HydrophobicContact CG-CB 4.48Å; I302-P304 WeakPolarHBondContact O-CD 3.27Å; P304-Q306 PolarHBondContact O-N 3.02Å; P304-Q306 VanDerWaalsContact O-N 3.13Å; P304-L307 VanDerWaalsContact O-CB 3.24Å; P304-L307 WeakPolarHBondContact O-CB 3.28Å; P304-L307 PolarHBondContact O-N 3.34Å; P304-L307 VanDerWaalsContact O-N 3.07Å
305	S	75	Confident	74	Confident	101 Å²	101	86 Å²	86	71%	0.706	46%	0.458	S	S	*	.	H	α-helix	trans	-58.4	-25.5	178.7	56.5	0	0	0	0	114.6	P303	P303-S305 PolarHBondContact O-N 3.36Å; P303-S305 VanDerWaalsContact O-N 3.09Å
306	Q	82.1	Confident	74.5	Confident	89 Å²	89	85.4 Å²	85.4	42%	0.416	45%	0.452	S	S	.	.	H	α-helix	trans	-98.1	-7.5	-179.1	-63.2	179.7	1.2	0	0	112.9	P303 P304 L308 Q309 N310	P303-Q306 HydrophobicContact CB-CG 4.3Å; P303-Q306 PolarHBondContact O-N 3.19Å; P304-Q306 PolarHBondContact O-N 3.02Å; P304-Q306 VanDerWaalsContact O-N 3.13Å; Q306-L308 PolarHBondContact O-N 3.11Å; Q306-Q309 PolarHBondContact O-N 2.91Å; Q306-Q309 VanDerWaalsContact O-N 3.15Å; Q306-N310 WeakPolarHBondContact O-CB 3.24Å; Q306-N310 PolarHBondContact O-N 3.42Å; Q306-N310 PolarHBondContact O-ND2 3.47Å
307	L	84.1	Confident	75	Confident	14 Å²	14	79.3 Å²	79.3	7%	0.073	43%	0.426	C	S	.	.	H	α-helix	trans	-57.7	-48.6	-172.1	-174.6	63.5	0	0	0	112.5	P283 F287 V292 I302 P303 P304 Q309 N310 F311	P283-L307 WeakPolarHBondContact O-CD2 3.25Å; F287-L307 HydrophobicContact CD2-CD2 4.41Å; V292-L307 HydrophobicContact CG1-CD1 4.03Å; I302-L307 HydrophobicContact CD1-CD1 4.35Å; I302-L307 HydrophobicContact CG2-CB 4.36Å; I302-L307 HydrophobicContact CG2-CD1 3.97Å; P303-L307 PolarHBondContact O-N 3.41Å; P304-L307 VanDerWaalsContact O-CB 3.24Å; P304-L307 WeakPolarHBondContact O-CB 3.28Å; P304-L307 PolarHBondContact O-N 3.34Å; P304-L307 VanDerWaalsContact O-N 3.07Å; L307-Q309 PolarHBondContact O-N 2.92Å; L307-N310 PolarHBondContact O-N 3.4Å; L307-F311 HydrophobicContact CD1-CD2 3.97Å; L307-F311 HydrophobicContact CD1-CE2 3.44Å; L307-F311 VanDerWaalsContact CD1-CE2 3.44Å; L307-F311 HydrophobicContact CD1-CZ 4.29Å; L307-F311 HydrophobicContact CD2-CE2 4.3Å; L307-F311 HydrophobicContact CG-CD2 3.94Å; L307-F311 HydrophobicContact CG-CE2 3.69Å; L307-F311 VanDerWaalsContact O-CD2 3.26Å; L307-F311 WeakPolarHBondContact O-CD2 3.43Å; L307-F311 PolarHBondContact O-N 3.27Å
308	L	86.6	Confident	76.5	Confident	37 Å²	37	70.2 Å²	70.2	19%	0.194	38%	0.383	C	S	.	.	H	α-helix	trans	-61.3	-44.4	178.2	178.3	61.4	0	0	0	111.5	F279 F280 P283 Q306 N310 F311 L312 Y431	F279-L308 HydrophobicContact CE1-CD1 3.59Å; F279-L308 HydrophobicContact CZ-CD1 3.95Å; F280-L308 HydrophobicContact CD1-CD1 3.72Å; F280-L308 HydrophobicContact CE1-CD1 3.87Å; P283-L308 HydrophobicContact CB-CB 4.39Å; Q306-L308 PolarHBondContact O-N 3.11Å; L308-N310 VanDerWaalsContact C-N 3.3Å; L308-N310 PolarHBondContact O-N 3.1Å; L308-F311 PolarHBondContact O-N 3.26Å; L308-L312 HydrophobicContact CD1-CD1 3.78Å; L308-L312 HydrophobicContact CD1-CG 4.09Å; L308-L312 HydrophobicContact CG-CD1 3.98Å; L308-L312 VanDerWaalsContact O-CG 3.26Å; L308-L312 WeakPolarHBondContact O-CG 3.31Å; L308-L312 PolarHBondContact O-N 2.9Å; L308-L312 VanDerWaalsContact O-N 3.1Å; L308-Y431 HydrophobicContact CD2-CE2 4.19Å
309	Q	86.6	Confident	78.3	Confident	137 Å²	137	65.5 Å²	65.5	64%	0.64	36%	0.358	S	S	*	.	H	α-helix	trans	-61.8	-41.2	178.6	-175	-179.7	2.1	0	0	111.2	Q306 L307 L312 S313	Q306-Q309 PolarHBondContact O-N 2.91Å; Q306-Q309 VanDerWaalsContact O-N 3.15Å; L307-Q309 PolarHBondContact O-N 2.92Å; Q309-L312 PolarHBondContact O-N 3.32Å; Q309-S313 WeakPolarHBondContact O-CB 3.3Å; Q309-S313 PolarHBondContact O-N 2.78Å
310	N	86.8	Confident	80.3	Confident	13 Å²	13	57.4 Å²	57.4	7%	0.07	31%	0.314	C	S	.	.	H	α-helix	trans	-66.6	-38.3	179.3	-68.2	-27.2	0	0	0	112.4	W294 Q306 L307 L308 L312 P318	W294-N310 HydrophobicContact CH2-CB 4.13Å; W294-N310 VanDerWaalsContact CH2-ND2 3.31Å; W294-N310 WeakPolarHBondContact CH2-ND2 3.39Å; Q306-N310 WeakPolarHBondContact O-CB 3.24Å; Q306-N310 PolarHBondContact O-N 3.42Å; Q306-N310 PolarHBondContact O-ND2 3.47Å; L307-N310 PolarHBondContact O-N 3.4Å; L308-N310 VanDerWaalsContact C-N 3.3Å; L308-N310 PolarHBondContact O-N 3.1Å; N310-L312 VanDerWaalsContact C-N 3.33Å; N310-P318 HydrophobicContact CB-CG 3.99Å
311	F	87.2	Confident	81.9	Confident	1 Å²	1	52 Å²	52	0%	0.004	29%	0.29	C	S	.	.	H	α-helix	trans	-67.8	-33.2	174	-84.3	-61	0	0	0	113.5	F279 F287 V292 L307 L308 P318 I320 I423 F424	F279-F311 HydrophobicContact CE2-CD2 4.26Å; F279-F311 HydrophobicContact CE2-CE2 4.4Å; F279-F311 AromaticContact CZ-CD2 3.76Å; F279-F311 HydrophobicContact CZ-CD2 3.76Å; F279-F311 HydrophobicContact CZ-CE2 4.34Å; F279-F311 HydrophobicContact CZ-CG 4.43Å; F287-F311 HydrophobicContact CD2-CE2 4.01Å; F287-F311 HydrophobicContact CD2-CZ 4.27Å; F287-F311 AromaticContact CE2-CE2 3.66Å; F287-F311 HydrophobicContact CE2-CE2 3.66Å; F287-F311 AromaticContact CE2-CZ 3.82Å; F287-F311 HydrophobicContact CE2-CZ 3.82Å; F287-F311 HydrophobicContact CZ-CZ 4.33Å; V292-F311 HydrophobicContact CG1-CZ 4.23Å; L307-F311 HydrophobicContact CD1-CD2 3.97Å; L307-F311 HydrophobicContact CD1-CE2 3.44Å; L307-F311 VanDerWaalsContact CD1-CE2 3.44Å; L307-F311 HydrophobicContact CD1-CZ 4.29Å; L307-F311 HydrophobicContact CD2-CE2 4.3Å; L307-F311 HydrophobicContact CG-CD2 3.94Å; L307-F311 HydrophobicContact CG-CE2 3.69Å; L307-F311 VanDerWaalsContact O-CD2 3.26Å; L307-F311 WeakPolarHBondContact O-CD2 3.43Å; L307-F311 PolarHBondContact O-N 3.27Å; L308-F311 PolarHBondContact O-N 3.26Å; F311-P318 HydrophobicContact CD1-CG 4.13Å; F311-P318 HydrophobicContact CD2-CG 4.43Å; F311-P318 HydrophobicContact CE1-CB 3.97Å; F311-P318 HydrophobicContact CE1-CG 3.92Å; F311-P318 HydrophobicContact CE2-CG 4.28Å; F311-P318 HydrophobicContact CG-CG 4.36Å; F311-P318 HydrophobicContact CZ-CB 4.04Å; F311-P318 HydrophobicContact CZ-CG 4Å; F311-I320 HydrophobicContact CE1-CD1 4.28Å; F311-I320 HydrophobicContact CE1-CG1 4.43Å; F311-I320 HydrophobicContact CZ-CD1 3.88Å; F311-I423 HydrophobicContact CB-CG2 3.79Å; F311-I423 HydrophobicContact CD1-CG2 3.86Å; F311-I423 HydrophobicContact CG-CG2 4.02Å; F311-F424 HydrophobicContact CD1-CE2 4.08Å; F311-F424 AromaticContact CE1-CE2 3.74Å; F311-F424 HydrophobicContact CE1-CE2 3.74Å; F311-F424 HydrophobicContact CE1-CZ 4.43Å
312	L	86.7	Confident	83.3	Confident	27 Å²	27	43.7 Å²	43.7	14%	0.141	26%	0.256	C	S	.	.	H	α-helix	trans	-87	-12.2	-179.3	-61.6	179.9	0	0	0	113.2	L308 Q309 N310 I428 Y431	L308-L312 HydrophobicContact CD1-CD1 3.78Å; L308-L312 HydrophobicContact CD1-CG 4.09Å; L308-L312 HydrophobicContact CG-CD1 3.98Å; L308-L312 VanDerWaalsContact O-CG 3.26Å; L308-L312 WeakPolarHBondContact O-CG 3.31Å; L308-L312 PolarHBondContact O-N 2.9Å; L308-L312 VanDerWaalsContact O-N 3.1Å; Q309-L312 PolarHBondContact O-N 3.32Å; N310-L312 VanDerWaalsContact C-N 3.33Å; L312-I428 HydrophobicContact CB-CD1 4.48Å; L312-I428 HydrophobicContact CD1-CD1 4.39Å; L312-Y431 HydrophobicContact CD1-CD1 3.69Å; L312-Y431 HydrophobicContact CD1-CD2 4.11Å; L312-Y431 HydrophobicContact CD1-CE1 4.12Å; L312-Y431 HydrophobicContact CD1-CG 3.65Å; L312-Y431 HydrophobicContact CD2-CG 4.48Å
313	S	84.1	Confident	84.6	Confident	17 Å²	17	47.6 Å²	47.6	12%	0.119	27%	0.27	C	S	.	.			trans	-65.5	139	-176.5	176.2	0	0	0	0	112.1	Q309 T315 T316 R427	Q309-S313 WeakPolarHBondContact O-CB 3.3Å; Q309-S313 PolarHBondContact O-N 2.78Å; S313-T315 VanDerWaalsContact C-N 3.29Å; S313-T315 PolarHBondContact OG-N 2.9Å; S313-T315 PolarHBondContact OG-OG1 3.21Å; S313-T316 WeakPolarHBondContact CB-O 3.32Å; S313-T316 WeakPolarHBondContact CB-OG1 3.46Å; S313-T316 PolarHBondContact OG-N 3.23Å; S313-T316 VanDerWaalsContact OG-N 3.08Å; S313-T316 PolarHBondContact OG-OG1 3.34Å; S313-R427 PolarHBondContact O-NH1 3.05Å
314	P	77.9	Confident	85.7	Confident	92 Å²	92	45.2 Å²	45.2	60%	0.597	26%	0.255	S	S	*	.	S	Bend	trans	-78.8	-11.7	174.4	32.1	-33.8	0	0	0	112.7	R343	P314-R343 PolarHBondContact O-NH1 2.89Å; P314-R343 PolarHBondContact O-NH2 3.5Å
315	T	75.9	Confident	86.9	Confident	121 Å²	121	44 Å²	44	74%	0.742	24%	0.24	S	C	*	.	S	Bend	trans	-116.9	-39.3	-174.7	53.3	0	0	0	0	112.4	S313	S313-T315 VanDerWaalsContact C-N 3.29Å; S313-T315 PolarHBondContact OG-N 2.9Å; S313-T315 PolarHBondContact OG-OG1 3.21Å
316	T	74.8	Confident	88	Confident	54 Å²	54	40.2 Å²	40.2	33%	0.331	21%	0.211	S	C	.	.			trans	-101	144.3	175.3	55.8	0	0	0	0	109.4	S313	S313-T316 WeakPolarHBondContact CB-O 3.32Å; S313-T316 WeakPolarHBondContact CB-OG1 3.46Å; S313-T316 PolarHBondContact OG-N 3.23Å; S313-T316 VanDerWaalsContact OG-N 3.08Å; S313-T316 PolarHBondContact OG-OG1 3.34Å
317	C	77.3	Confident	88.6	Confident	18 Å²	18	37.7 Å²	37.7	12%	0.122	20%	0.199	C	C	.	.			trans	-154.2	125.3	172.2	-161.2	0	0	0	0	107.5	F424	C317-F424 WeakPolarHBondContact SG-CE1 3.33Å
318	P	86.4	Confident	88.9	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	161.9	171	-22.8	34	0	0	0	111.1	V292 A293 I302 N310 F311 F424	V292-P318 HydrophobicContact CG1-CB 3.64Å; V292-P318 HydrophobicContact CG1-CG 4.4Å; A293-P318 CarbonylContact O-C 3.59Å; A293-P318 WeakPolarHBondContact O-CA 3.3Å; I302-P318 HydrophobicContact CD1-CB 3.86Å; I302-P318 HydrophobicContact CD1-CG 3.94Å; N310-P318 HydrophobicContact CB-CG 3.99Å; F311-P318 HydrophobicContact CD1-CG 4.13Å; F311-P318 HydrophobicContact CD2-CG 4.43Å; F311-P318 HydrophobicContact CE1-CB 3.97Å; F311-P318 HydrophobicContact CE1-CG 3.92Å; F311-P318 HydrophobicContact CE2-CG 4.28Å; F311-P318 HydrophobicContact CG-CG 4.36Å; F311-P318 HydrophobicContact CZ-CB 4.04Å; F311-P318 HydrophobicContact CZ-CG 4Å; P318-F424 WeakPolarHBondContact O-CZ 3.41Å
319	E	91.8	Very high	88.9	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	138.6	164.8	-175.5	177.3	78.8	0	0	108.4	A293 F340 R342 K355	A293-E319 PolarHBondContact N-O 3.44Å; A293-E319 PolarHBondContact O-N 3.4Å; E319-F340 HydrophobicContact CG-CD1 4.33Å; E319-F340 WeakPolarHBondContact OE1-CD1 3.45Å; E319-R342 HydrophobicContact CG-CG 4.26Å; E319-R342 IonicContact OE2-CZ 3.04Å; E319-R342 IonicContact OE2-NE 2.98Å; E319-R342 PolarHBondContact OE2-NE 2.77Å; E319-R342 IonicContact OE2-NH2 3.64Å; E319-R342 PolarHBondContact OE2-NH2 2.68Å; E319-K355 IonicContact OE1-NZ 3.88Å; E319-K355 PolarHBondContact OE1-NZ 2.77Å
320	I	95.4	Very high	88.7	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	130.4	167.9	-63.3	-61.3	0	0	0	108.5	F287 M291 V292 F311 F340 L341 W417 A420 F424	F287-I320 HydrophobicContact CD1-CD1 4.26Å; F287-I320 HydrophobicContact CE1-CD1 4.19Å; M291-I320 HydrophobicContact CE-CG2 3.45Å; M291-I320 VanDerWaalsContact CE-CG2 3.45Å; M291-I320 HydrophobicContact CG-CG2 3.87Å; M291-I320 CarbonylContact O-C 3.49Å; M291-I320 WeakPolarHBondContact O-CA 3.35Å; M291-I320 HydrophobicContact SD-CG2 4.48Å; V292-I320 HydrophobicContact CB-CD1 4.28Å; V292-I320 HydrophobicContact CG1-CD1 4.21Å; V292-I320 HydrophobicContact CG2-CD1 3.76Å; F311-I320 HydrophobicContact CE1-CD1 4.28Å; F311-I320 HydrophobicContact CE1-CG1 4.43Å; F311-I320 HydrophobicContact CZ-CD1 3.88Å; I320-F340 CarbonylContact O-C 3.54Å; I320-F340 WeakPolarHBondContact O-CA 3.49Å; I320-L341 HydrophobicContact CB-CB 4.14Å; I320-L341 HydrophobicContact CB-CD2 4.5Å; I320-L341 PolarHBondContact N-O 2.82Å; I320-L341 VanDerWaalsContact N-O 3.14Å; I320-L341 PolarHBondContact O-N 3.4Å; I320-W417 HydrophobicContact CB-CZ3 4.47Å; I320-W417 HydrophobicContact CG2-CD2 4.26Å; I320-W417 HydrophobicContact CG2-CE3 3.9Å; I320-W417 HydrophobicContact CG2-CH2 3.93Å; I320-W417 HydrophobicContact CG2-CZ2 4.29Å; I320-W417 HydrophobicContact CG2-CZ3 3.74Å; I320-A420 HydrophobicContact CB-CB 4.42Å; I320-A420 HydrophobicContact CG1-CB 3.76Å; I320-A420 HydrophobicContact CG2-CB 4.33Å; I320-F424 HydrophobicContact CG1-CE2 4.14Å
321	Q	96	Very high	88.8	Confident	28 Å²	28	46.8 Å²	46.8	13%	0.131	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	155.1	-174.5	61.9	175.6	3.3	0	0	112.3	H290 M291 A293 Y338 M339 F340 K355	H290-Q321 PolarHBondContact O-NE2 3.18Å; M291-Q321 WeakPolarHBondContact CA-O 3.39Å; M291-Q321 PolarHBondContact O-N 3.26Å; A293-Q321 HydrophobicContact CB-CG 4.43Å; Q321-Y338 HydrophobicContact CB-CE1 3.98Å; Q321-Y338 PolarHBondContact OE1-OH 3.01Å; Q321-M339 VanDerWaalsContact CA-O 3.27Å; Q321-M339 WeakPolarHBondContact CA-O 3.38Å; Q321-F340 HydrophobicContact CB-CD1 3.85Å; Q321-F340 HydrophobicContact CB-CE1 4.05Å; Q321-K355 VanDerWaalsContact OE1-CE 3.28Å
322	G	96.9	Very high	89	Confident	10 Å²	10	53.4 Å²	53.4	10%	0.103	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.8	175	175.8	0	0	0	0	0	113.1	M339	G322-M339 PolarHBondContact N-O 3.37Å; G322-M339 PolarHBondContact O-N 2.81Å
323	Y	97.8	Very high	89.3	Confident	108 Å²	108	54.4 Å²	54.4	42%	0.424	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	139.3	176.5	-72.6	-77.9	0	0	0	112	K336 V337 Y338 T353	Y323-K336 VanDerWaalsContact CB-CE 3.44Å; Y323-K336 HydrophobicContact CD1-CD 4.4Å; Y323-K336 HydrophobicContact CD1-CG 3.91Å; Y323-K336 HydrophobicContact CG-CG 4.35Å; Y323-V337 WeakPolarHBondContact CA-O 3.46Å; Y323-Y338 AromaticContact CD1-CD2 3.87Å; Y323-Y338 HydrophobicContact CD1-CD2 3.87Å; Y323-Y338 AromaticContact CD2-CD2 3.76Å; Y323-Y338 HydrophobicContact CD2-CD2 3.76Å; Y323-Y338 HydrophobicContact CD2-CE2 4.05Å; Y323-Y338 AromaticContact CE1-CD2 3.75Å; Y323-Y338 HydrophobicContact CE1-CD2 3.75Å; Y323-Y338 HydrophobicContact CE1-CG 4.39Å; Y323-Y338 AromaticContact CE2-CD2 3.62Å; Y323-Y338 HydrophobicContact CE2-CD2 3.62Å; Y323-Y338 AromaticContact CE2-CE2 3.92Å; Y323-Y338 HydrophobicContact CE2-CE2 3.92Å; Y323-Y338 AromaticContact CG-CD2 3.88Å; Y323-Y338 HydrophobicContact CG-CD2 3.88Å; Y323-Y338 AromaticContact CZ-CD2 3.62Å; Y323-T353 WeakPolarHBondContact OH-CG2 3.27Å
324	L	98.3	Very high	89.9	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.016	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	154.7	166.6	-70.8	175.3	0	0	0	109.6	V337 M339 F389 L406 A408 W417	L324-V337 PolarHBondContact N-O 3.41Å; L324-V337 PolarHBondContact O-N 2.92Å; L324-V337 VanDerWaalsContact O-O 3.13Å; L324-M339 HydrophobicContact CB-CE 4.3Å; L324-M339 HydrophobicContact CB-CG 4.02Å; L324-M339 HydrophobicContact CD1-CG 4.09Å; L324-M339 HydrophobicContact CG-CG 4.3Å; L324-F389 HydrophobicContact CD1-CE1 4.36Å; L324-F389 HydrophobicContact CD1-CZ 3.65Å; L324-F389 HydrophobicContact CD2-CE1 4.19Å; L324-F389 HydrophobicContact CD2-CZ 4.27Å; L324-L406 HydrophobicContact CD1-CB 4.36Å; L324-L406 HydrophobicContact CD1-CD1 3.85Å; L324-A408 HydrophobicContact CD2-CB 3.91Å; L324-W417 HydrophobicContact CD1-CD2 3.83Å; L324-W417 HydrophobicContact CD1-CE3 4.37Å; L324-W417 HydrophobicContact CD1-CG 4.04Å; L324-W417 HydrophobicContact CD1-CZ2 4.19Å; L324-W417 HydrophobicContact CD2-CG 4.41Å; L324-W417 HydrophobicContact CG-CZ2 4.39Å
325	Y	98	Very high	90.8	Very high	54 Å²	54	55.6 Å²	55.6	21%	0.212	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	126.6	166	-59.2	-87.5	0	0	0	109	K335 K336 P384 L406 C407 E409	Y325-K335 CarbonylContact C-O 3.52Å; Y325-K335 WeakPolarHBondContact CA-O 3.49Å; Y325-K336 HydrophobicContact CD1-CB 3.96Å; Y325-K336 HydrophobicContact CD1-CG 4.47Å; Y325-K336 HydrophobicContact CE1-CB 3.87Å; Y325-K336 HydrophobicContact CE1-CD 4.13Å; Y325-K336 HydrophobicContact CE1-CG 4.2Å; Y325-P384 HydrophobicContact CD1-CG 3.94Å; Y325-P384 HydrophobicContact CD2-CB 4.33Å; Y325-P384 HydrophobicContact CD2-CG 4.23Å; Y325-P384 HydrophobicContact CE1-CG 4.46Å; Y325-P384 HydrophobicContact CE2-CB 4.46Å; Y325-P384 HydrophobicContact CG-CB 4.39Å; Y325-P384 HydrophobicContact CG-CG 3.82Å; Y325-L406 CarbonylContact O-C 3.57Å; Y325-L406 VanDerWaalsContact O-CA 3.23Å; Y325-L406 WeakPolarHBondContact O-CA 3.37Å; Y325-C407 WeakPolarHBondContact CD2-O 3.49Å; Y325-C407 PolarHBondContact N-O 2.6Å; Y325-C407 PolarHBondContact O-N 3.48Å; Y325-E409 HydrophobicContact CE2-CG 3.82Å
326	M	96.6	Very high	91.8	Very high	20 Å²	20	54.7 Å²	54.7	10%	0.099	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	132.3	173.3	-178.2	-168.7	-63.2	0	0	109.5	W334 K335 V337 M339 C348 L363 L406	M326-W334 WeakPolarHBondContact O-CA 3.4Å; M326-K335 HydrophobicContact CB-CG 4.26Å; M326-K335 PolarHBondContact N-O 3.32Å; M326-K335 PolarHBondContact O-N 3.4Å; M326-K335 VanDerWaalsContact SD-CE 3.57Å; M326-V337 HydrophobicContact CB-CG2 3.68Å; M326-V337 HydrophobicContact CE-CG2 4.2Å; M326-M339 HydrophobicContact CB-CE 4.06Å; M326-M339 HydrophobicContact CE-CE 3.34Å; M326-M339 HydrophobicContact CE-SD 4.27Å; M326-C348 HydrophobicContact CE-CB 3.79Å; M326-L363 HydrophobicContact CE-CD1 3.33Å; M326-L363 HydrophobicContact CE-CD2 3.7Å; M326-L363 HydrophobicContact CE-CG 4.12Å; M326-L363 HydrophobicContact SD-CD2 4.36Å; M326-L406 HydrophobicContact CB-CD2 3.9Å; M326-L406 HydrophobicContact CG-CD2 3.98Å
327	K	95.1	Very high	92.9	Very high	37 Å²	37	53 Å²	53	16%	0.161	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	136.4	175.4	-168.4	-177.5	165.7	-67.6	0	110.8	R331 W334 H381 M405	K327-R331 WeakPolarHBondContact CE-O 3.33Å; K327-R331 PolarHBondContact NZ-O 2.94Å; K327-W334 HydrophobicContact CB-CD2 3.94Å; K327-W334 HydrophobicContact CB-CE3 3.79Å; K327-W334 HydrophobicContact CB-CH2 3.77Å; K327-W334 HydrophobicContact CB-CZ2 3.9Å; K327-W334 HydrophobicContact CB-CZ3 3.7Å; K327-W334 HydrophobicContact CD-CH2 4.25Å; K327-W334 HydrophobicContact CD-CZ2 3.85Å; K327-W334 HydrophobicContact CG-CD2 4.21Å; K327-W334 HydrophobicContact CG-CH2 4.26Å; K327-W334 HydrophobicContact CG-CZ2 3.88Å; K327-H381 HydrophobicContact CD-CB 4.25Å; K327-M405 HydrophobicContact CB-CB 3.9Å; K327-M405 HydrophobicContact CD-CB 4.07Å; K327-M405 HydrophobicContact CD-CG 4.36Å; K327-M405 HydrophobicContact CD-SD 3.57Å; K327-M405 VanDerWaalsContact CD-SD 3.57Å; K327-M405 PolarHBondContact N-O 3.23Å; K327-M405 VanDerWaalsContact N-O 3.07Å
328	D	91.7	Very high	93.9	Very high	46 Å²	46	53.7 Å²	53.7	25%	0.246	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-71.4	142.2	169.4	-69.4	-34.8	0	0	0	111.3	G330 R331 S333	D328-G330 PolarHBondContact O-N 3.48Å; D328-R331 HydrophobicContact CB-CB 4.05Å; D328-R331 PolarHBondContact O-N 3.22Å; D328-S333 WeakPolarHBondContact CB-OG 3.35Å; D328-S333 PolarHBondContact N-O 3.3Å; D328-S333 WeakPolarHBondContact OD2-CB 3.41Å; D328-S333 PolarHBondContact OD2-OG 2.9Å
329	V	85.4	Confident	94.4	Very high	90 Å²	90	53.7 Å²	53.7	55%	0.545	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	127.5	177.8	178.3	0	0	0	0	110.3	R331 E402	V329-R331 PolarHBondContact O-N 2.87Å; V329-E402 WeakPolarHBondContact CB-OE1 3.44Å; V329-E402 HydrophobicContact CG1-CG 4.32Å; V329-E402 WeakPolarHBondContact CG1-OE1 3.27Å; V329-E402 WeakPolarHBondContact CG2-OE1 3.47Å
330	G	82.9	Confident	94.7	Very high	82 Å²	82	53.6 Å²	53.6	85%	0.845	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.8	-3	177.6	0	0	0	0	0	116.1	D328	D328-G330 PolarHBondContact O-N 3.48Å
331	R	88.6	Confident	94.7	Very high	173 Å²	173	53.7 Å²	53.7	65%	0.653	27%	0.268	S	S	*	.	S	Bend	trans	-116.8	165.1	-176.8	-61.4	178.8	-178	-171	-0.5	111.5	K327 D328 V329 S333	K327-R331 WeakPolarHBondContact CE-O 3.33Å; K327-R331 PolarHBondContact NZ-O 2.94Å; D328-R331 HydrophobicContact CB-CB 4.05Å; D328-R331 PolarHBondContact O-N 3.22Å; V329-R331 PolarHBondContact O-N 2.87Å; R331-S333 VanDerWaalsContact C-N 3.34Å; R331-S333 WeakPolarHBondContact CB-OG 3.4Å
332	K	90.8	Very high	94.5	Very high	141 Å²	141	54.9 Å²	54.9	61%	0.613	27%	0.271	S	S	*	.	S	Bend	trans	-95.5	12	170.8	-65.2	-171.5	177.6	-173.5	0	112.8	W334 Q380	K332-W334 VanDerWaalsContact O-CD1 3.25Å; K332-Q380 WeakPolarHBondContact CE-O 3.4Å
333	S	94.1	Very high	94.1	Very high	47 Å²	47	60.3 Å²	60.3	33%	0.329	29%	0.289	S	S	.	.			trans	-83.2	149.2	175.1	48.9	0	0	0	0	111.1	D328 R331	D328-S333 WeakPolarHBondContact CB-OG 3.35Å; D328-S333 PolarHBondContact N-O 3.3Å; D328-S333 WeakPolarHBondContact OD2-CB 3.41Å; D328-S333 PolarHBondContact OD2-OG 2.9Å; R331-S333 VanDerWaalsContact C-N 3.34Å; R331-S333 WeakPolarHBondContact CB-OG 3.4Å
334	W	97.3	Very high	93.8	Very high	41 Å²	41	58.1 Å²	58.1	16%	0.155	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.9	-178.6	-64.8	79.3	0	0	0	109.4	M326 K327 K332 H381 G382 A383 P384 T388 M405 C407	M326-W334 WeakPolarHBondContact O-CA 3.4Å; K327-W334 HydrophobicContact CB-CD2 3.94Å; K327-W334 HydrophobicContact CB-CE3 3.79Å; K327-W334 HydrophobicContact CB-CH2 3.77Å; K327-W334 HydrophobicContact CB-CZ2 3.9Å; K327-W334 HydrophobicContact CB-CZ3 3.7Å; K327-W334 HydrophobicContact CD-CH2 4.25Å; K327-W334 HydrophobicContact CD-CZ2 3.85Å; K327-W334 HydrophobicContact CG-CD2 4.21Å; K327-W334 HydrophobicContact CG-CH2 4.26Å; K327-W334 HydrophobicContact CG-CZ2 3.88Å; K332-W334 VanDerWaalsContact O-CD1 3.25Å; W334-H381 HydrophobicContact CZ2-CB 4.12Å; W334-H381 PolarHBondContact NE1-O 2.75Å; W334-G382 VanDerWaalsContact CD1-O 3.29Å; W334-G382 PolarHBondContact NE1-O 3.32Å; W334-A383 HydrophobicContact CH2-CB 4.09Å; W334-A383 HydrophobicContact CZ2-CB 3.68Å; W334-P384 HydrophobicContact CB-CG 3.99Å; W334-P384 HydrophobicContact CD2-CG 4.36Å; W334-P384 HydrophobicContact CG-CG 4.04Å; W334-T388 HydrophobicContact CH2-CG2 3.91Å; W334-M405 HydrophobicContact CH2-CB 4.01Å; W334-M405 HydrophobicContact CZ3-CB 4.44Å; W334-C407 HydrophobicContact CE3-CB 4.09Å; W334-C407 HydrophobicContact CH2-CB 4.18Å; W334-C407 HydrophobicContact CZ3-CB 3.61Å
335	K	96.1	Very high	93.6	Very high	94 Å²	94	58 Å²	58	41%	0.409	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	135.3	176.8	56.5	176.5	-176.3	-172	0	110.4	Y325 M326 V337	Y325-K335 CarbonylContact C-O 3.52Å; Y325-K335 WeakPolarHBondContact CA-O 3.49Å; M326-K335 HydrophobicContact CB-CG 4.26Å; M326-K335 PolarHBondContact N-O 3.32Å; M326-K335 PolarHBondContact O-N 3.4Å; M326-K335 VanDerWaalsContact SD-CE 3.57Å; K335-V337 HydrophobicContact CD-CG2 4.23Å; K335-V337 HydrophobicContact CG-CG2 3.82Å; K335-V337 VanDerWaalsContact O-CG2 3.29Å; K335-V337 WeakPolarHBondContact O-CG2 3.43Å
336	K	97.6	Very high	93.5	Very high	101 Å²	101	55.5 Å²	55.5	44%	0.439	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	122.9	173.4	-169	169	177.8	170.5	0	108.6	Y323 Y325 E409	Y323-K336 VanDerWaalsContact CB-CE 3.44Å; Y323-K336 HydrophobicContact CD1-CD 4.4Å; Y323-K336 HydrophobicContact CD1-CG 3.91Å; Y323-K336 HydrophobicContact CG-CG 4.35Å; Y325-K336 HydrophobicContact CD1-CB 3.96Å; Y325-K336 HydrophobicContact CD1-CG 4.47Å; Y325-K336 HydrophobicContact CE1-CB 3.87Å; Y325-K336 HydrophobicContact CE1-CD 4.13Å; Y325-K336 HydrophobicContact CE1-CG 4.2Å; K336-E409 WeakPolarHBondContact CE-OE1 3.41Å; K336-E409 IonicContact NZ-OE1 3.02Å; K336-E409 PolarHBondContact NZ-OE1 2.83Å
337	V	97.4	Very high	93.5	Very high	19 Å²	19	56.4 Å²	56.4	12%	0.115	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	145.1	-174.9	-136.7	0	0	0	0	109.2	Y323 L324 M326 K335 M339 C348 S349	Y323-V337 WeakPolarHBondContact CA-O 3.46Å; L324-V337 PolarHBondContact N-O 3.41Å; L324-V337 PolarHBondContact O-N 2.92Å; L324-V337 VanDerWaalsContact O-O 3.13Å; M326-V337 HydrophobicContact CB-CG2 3.68Å; M326-V337 HydrophobicContact CE-CG2 4.2Å; K335-V337 HydrophobicContact CD-CG2 4.23Å; K335-V337 HydrophobicContact CG-CG2 3.82Å; K335-V337 VanDerWaalsContact O-CG2 3.29Å; K335-V337 WeakPolarHBondContact O-CG2 3.43Å; V337-M339 HydrophobicContact CB-CE 4.12Å; V337-M339 HydrophobicContact CG2-CE 4.2Å; V337-C348 HydrophobicContact CG1-CB 4.15Å; V337-S349 VanDerWaalsContact CG1-O 3.3Å; V337-S349 WeakPolarHBondContact CG1-O 3.41Å
338	Y	97.8	Very high	93.5	Very high	32 Å²	32	54.8 Å²	54.8	13%	0.125	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	133.3	174.1	-156.6	-96.6	0	0	0	110	Q321 Y323 F340 C348 S349 G352 T353	Q321-Y338 HydrophobicContact CB-CE1 3.98Å; Q321-Y338 PolarHBondContact OE1-OH 3.01Å; Y323-Y338 AromaticContact CD1-CD2 3.87Å; Y323-Y338 HydrophobicContact CD1-CD2 3.87Å; Y323-Y338 AromaticContact CD2-CD2 3.76Å; Y323-Y338 HydrophobicContact CD2-CD2 3.76Å; Y323-Y338 HydrophobicContact CD2-CE2 4.05Å; Y323-Y338 AromaticContact CE1-CD2 3.75Å; Y323-Y338 HydrophobicContact CE1-CD2 3.75Å; Y323-Y338 HydrophobicContact CE1-CG 4.39Å; Y323-Y338 AromaticContact CE2-CD2 3.62Å; Y323-Y338 HydrophobicContact CE2-CD2 3.62Å; Y323-Y338 AromaticContact CE2-CE2 3.92Å; Y323-Y338 HydrophobicContact CE2-CE2 3.92Å; Y323-Y338 AromaticContact CG-CD2 3.88Å; Y323-Y338 HydrophobicContact CG-CD2 3.88Å; Y323-Y338 AromaticContact CZ-CD2 3.62Å; Y338-F340 AromaticContact CD1-CE1 3.75Å; Y338-F340 HydrophobicContact CD1-CE1 3.75Å; Y338-F340 AromaticContact CD1-CE2 3.74Å; Y338-F340 HydrophobicContact CD1-CE2 3.74Å; Y338-F340 AromaticContact CD1-CZ 3.28Å; Y338-F340 HydrophobicContact CD1-CZ 3.28Å; Y338-F340 HydrophobicContact CE1-CD1 4.3Å; Y338-F340 AromaticContact CE1-CE1 3.41Å; Y338-F340 HydrophobicContact CE1-CE1 3.41Å; Y338-F340 VanDerWaalsContact CE1-CE1 3.41Å; Y338-F340 HydrophobicContact CE1-CE2 4.29Å; Y338-F340 AromaticContact CE1-CZ 3.42Å; Y338-F340 HydrophobicContact CE1-CZ 3.42Å; Y338-F340 VanDerWaalsContact CE1-CZ 3.42Å; Y338-C348 WeakPolarHBondContact O-CA 3.4Å; Y338-S349 PolarHBondContact O-N 2.93Å; Y338-G352 VanDerWaalsContact CB-O 3.3Å; Y338-G352 WeakPolarHBondContact CB-O 3.34Å; Y338-T353 HydrophobicContact CD1-CG2 4.24Å; Y338-T353 HydrophobicContact CD2-CG2 3.6Å; Y338-T353 HydrophobicContact CE1-CG2 4.42Å; Y338-T353 HydrophobicContact CE2-CG2 3.81Å; Y338-T353 HydrophobicContact CG-CG2 3.8Å
339	M	97.6	Very high	93.8	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	152.2	-169.3	-62.1	-74.4	-170.8	0	0	111.2	Q321 G322 L324 M326 V337 Y347 C348 L363 L406 W417	Q321-M339 VanDerWaalsContact CA-O 3.27Å; Q321-M339 WeakPolarHBondContact CA-O 3.38Å; G322-M339 PolarHBondContact N-O 3.37Å; G322-M339 PolarHBondContact O-N 2.81Å; L324-M339 HydrophobicContact CB-CE 4.3Å; L324-M339 HydrophobicContact CB-CG 4.02Å; L324-M339 HydrophobicContact CD1-CG 4.09Å; L324-M339 HydrophobicContact CG-CG 4.3Å; M326-M339 HydrophobicContact CB-CE 4.06Å; M326-M339 HydrophobicContact CE-CE 3.34Å; M326-M339 HydrophobicContact CE-SD 4.27Å; V337-M339 HydrophobicContact CB-CE 4.12Å; V337-M339 HydrophobicContact CG2-CE 4.2Å; M339-Y347 CarbonylContact C-O 3.44Å; M339-Y347 VanDerWaalsContact CA-O 3.32Å; M339-Y347 WeakPolarHBondContact CA-O 3.42Å; M339-C348 HydrophobicContact CE-CB 4.19Å; M339-C348 HydrophobicContact SD-CB 3.53Å; M339-C348 VanDerWaalsContact SD-CB 3.53Å; M339-L363 HydrophobicContact CE-CD1 4.01Å; M339-L363 HydrophobicContact SD-CD1 3.72Å; M339-L406 HydrophobicContact CE-CD1 4.5Å; M339-L406 HydrophobicContact CE-CD2 3.58Å; M339-W417 HydrophobicContact CB-CH2 3.6Å; M339-W417 HydrophobicContact CB-CZ2 3.96Å; M339-W417 HydrophobicContact CB-CZ3 4.35Å
340	F	96.8	Very high	94.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	121.8	176.1	-55.9	-81.6	0	0	0	109.9	E319 I320 Q321 Y338 Y347 K355 L360	E319-F340 HydrophobicContact CG-CD1 4.33Å; E319-F340 WeakPolarHBondContact OE1-CD1 3.45Å; I320-F340 CarbonylContact O-C 3.54Å; I320-F340 WeakPolarHBondContact O-CA 3.49Å; Q321-F340 HydrophobicContact CB-CD1 3.85Å; Q321-F340 HydrophobicContact CB-CE1 4.05Å; Y338-F340 AromaticContact CD1-CE1 3.75Å; Y338-F340 HydrophobicContact CD1-CE1 3.75Å; Y338-F340 AromaticContact CD1-CE2 3.74Å; Y338-F340 HydrophobicContact CD1-CE2 3.74Å; Y338-F340 AromaticContact CD1-CZ 3.28Å; Y338-F340 HydrophobicContact CD1-CZ 3.28Å; Y338-F340 HydrophobicContact CE1-CD1 4.3Å; Y338-F340 AromaticContact CE1-CE1 3.41Å; Y338-F340 HydrophobicContact CE1-CE1 3.41Å; Y338-F340 VanDerWaalsContact CE1-CE1 3.41Å; Y338-F340 HydrophobicContact CE1-CE2 4.29Å; Y338-F340 AromaticContact CE1-CZ 3.42Å; Y338-F340 HydrophobicContact CE1-CZ 3.42Å; Y338-F340 VanDerWaalsContact CE1-CZ 3.42Å; F340-Y347 PolarHBondContact N-O 3.43Å; F340-Y347 PolarHBondContact O-N 3.45Å; F340-K355 HydrophobicContact CD1-CG 4.5Å; F340-K355 HydrophobicContact CE1-CD 3.87Å; F340-K355 HydrophobicContact CE1-CG 3.61Å; F340-K355 HydrophobicContact CE2-CG 4.45Å; F340-K355 HydrophobicContact CZ-CB 4.49Å; F340-K355 HydrophobicContact CZ-CD 4.35Å; F340-K355 HydrophobicContact CZ-CG 3.57Å; F340-L360 HydrophobicContact CD2-CD2 3.51Å; F340-L360 HydrophobicContact CE2-CD2 3.67Å
341	L	95.9	Very high	94.9	Very high	1 Å²	1	56 Å²	56	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	119.6	168.9	171.4	68.8	0	0	0	109	I320 L346 L366 W417 A420 F421 F424	I320-L341 HydrophobicContact CB-CB 4.14Å; I320-L341 HydrophobicContact CB-CD2 4.5Å; I320-L341 PolarHBondContact N-O 2.82Å; I320-L341 VanDerWaalsContact N-O 3.14Å; I320-L341 PolarHBondContact O-N 3.4Å; L341-L346 HydrophobicContact CB-CD1 3.96Å; L341-L346 HydrophobicContact CD1-CB 4.41Å; L341-L366 HydrophobicContact CD1-CD2 4.03Å; L341-W417 HydrophobicContact CB-CZ3 3.81Å; L341-A420 HydrophobicContact CD2-CB 3.74Å; L341-F421 HydrophobicContact CD1-CD2 4.18Å; L341-F421 HydrophobicContact CD2-CB 4.42Å; L341-F424 HydrophobicContact CD2-CD2 3.93Å; L341-F424 HydrophobicContact CD2-CE2 4.08Å; L341-F424 HydrophobicContact CD2-CG 4.19Å; L341-F424 HydrophobicContact CG-CD1 4.23Å; L341-F424 HydrophobicContact CG-CD2 4.29Å; L341-F424 HydrophobicContact CG-CE1 4.29Å; L341-F424 HydrophobicContact CG-CE2 4.27Å; L341-F424 HydrophobicContact CG-CG 4.21Å; L341-F424 HydrophobicContact CG-CZ 4.25Å
342	R	93	Very high	95.3	Very high	53 Å²	53	50.5 Å²	50.5	20%	0.2	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	172.8	177.7	-63.7	-179.7	177.7	175.7	-0.4	109.5	E319 S344 G345 Y347 L366 F424	E319-R342 HydrophobicContact CG-CG 4.26Å; E319-R342 IonicContact OE2-CZ 3.04Å; E319-R342 IonicContact OE2-NE 2.98Å; E319-R342 PolarHBondContact OE2-NE 2.77Å; E319-R342 IonicContact OE2-NH2 3.64Å; E319-R342 PolarHBondContact OE2-NH2 2.68Å; R342-S344 PolarHBondContact O-N 2.76Å; R342-G345 PolarHBondContact N-O 3.18Å; R342-G345 PolarHBondContact O-N 3.13Å; R342-G345 VanDerWaalsContact O-O 3.13Å; R342-Y347 HydrophobicContact CB-CE2 4.19Å; R342-L366 WeakPolarHBondContact O-CD1 3.48Å; R342-F424 VanDerWaalsContact C-CE1 3.4Å; R342-F424 WeakPolarHBondContact O-CD1 3.43Å
343	R	88.6	Confident	95.5	Very high	125 Å²	125	47.3 Å²	47.3	47%	0.472	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.3	177.4	-172	177.3	-170.9	157.2	1.8	113.9	P314 L366 R427	P314-R343 PolarHBondContact O-NH1 2.89Å; P314-R343 PolarHBondContact O-NH2 3.5Å; R343-L366 VanDerWaalsContact O-CD1 3.32Å; R343-L366 WeakPolarHBondContact O-CD1 3.35Å; R343-R427 VanDerWaalsContact CD-NH2 3.31Å; R343-R427 VanDerWaalsContact CZ-CZ 3.44Å
344	S	89.9	Confident	95.5	Very high	61 Å²	61	46.3 Å²	46.3	43%	0.427	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-4.7	179.8	52.1	0	0	0	0	113.7	R342 Y347	R342-S344 PolarHBondContact O-N 2.76Å; S344-Y347 VanDerWaalsContact CB-OH 3.31Å; S344-Y347 WeakPolarHBondContact CB-OH 3.35Å; S344-Y347 WeakPolarHBondContact OG-CE2 3.45Å; S344-Y347 PolarHBondContact OG-OH 3.49Å
345	G	93.7	Very high	95.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	140	-176.1	-179.4	0	0	0	0	0	114.5	R342 Y347 A364	R342-G345 PolarHBondContact N-O 3.18Å; R342-G345 PolarHBondContact O-N 3.13Å; R342-G345 VanDerWaalsContact O-O 3.13Å; G345-Y347 WeakPolarHBondContact O-CD2 3.22Å; G345-Y347 VanDerWaalsContact O-CE2 3.3Å; G345-Y347 WeakPolarHBondContact O-CE2 3.12Å; G345-A364 VanDerWaalsContact CA-O 3.29Å; G345-A364 WeakPolarHBondContact CA-O 3.3Å
346	L	95.9	Very high	95.1	Very high	2 Å²	2	47.5 Å²	47.5	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	129	174.1	-177.9	70.5	0	0	0	110.4	L341 L363 A364 F391 L406 W417	L341-L346 HydrophobicContact CB-CD1 3.96Å; L341-L346 HydrophobicContact CD1-CB 4.41Å; L346-L363 HydrophobicContact CD2-CD1 4.43Å; L346-L363 PolarHBondContact O-N 3.2Å; L346-A364 HydrophobicContact CB-CB 4.47Å; L346-A364 PolarHBondContact N-O 3.44Å; L346-A364 PolarHBondContact O-N 2.96Å; L346-F391 HydrophobicContact CD2-CD2 4.32Å; L346-F391 HydrophobicContact CD2-CE2 3.35Å; L346-F391 HydrophobicContact CD2-CZ 3.63Å; L346-L406 HydrophobicContact CD2-CD1 3.71Å; L346-W417 HydrophobicContact CD1-CE3 4.43Å; L346-W417 HydrophobicContact CD1-CZ3 3.79Å
347	Y	96.5	Very high	94.9	Very high	39 Å²	39	48 Å²	48	15%	0.153	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	147.7	-179.2	-58.1	-95.3	0	0	0	110.9	M339 F340 R342 S344 G345 L360 Q361 L362	M339-Y347 CarbonylContact C-O 3.44Å; M339-Y347 VanDerWaalsContact CA-O 3.32Å; M339-Y347 WeakPolarHBondContact CA-O 3.42Å; F340-Y347 PolarHBondContact N-O 3.43Å; F340-Y347 PolarHBondContact O-N 3.45Å; R342-Y347 HydrophobicContact CB-CE2 4.19Å; S344-Y347 VanDerWaalsContact CB-OH 3.31Å; S344-Y347 WeakPolarHBondContact CB-OH 3.35Å; S344-Y347 WeakPolarHBondContact OG-CE2 3.45Å; S344-Y347 PolarHBondContact OG-OH 3.49Å; G345-Y347 WeakPolarHBondContact O-CD2 3.22Å; G345-Y347 VanDerWaalsContact O-CE2 3.3Å; G345-Y347 WeakPolarHBondContact O-CE2 3.12Å; Y347-L360 HydrophobicContact CD1-CB 4.22Å; Y347-Q361 CarbonylContact C-O 3.55Å; Y347-Q361 VanDerWaalsContact CA-O 3.23Å; Y347-Q361 WeakPolarHBondContact CA-O 3.35Å; Y347-L362 HydrophobicContact CD1-CB 4.04Å; Y347-L362 HydrophobicContact CD1-CD1 4.17Å; Y347-L362 HydrophobicContact CE1-CB 3.83Å; Y347-L362 HydrophobicContact CE1-CD1 3.7Å; Y347-L362 HydrophobicContact CE1-CG 4.34Å; Y347-L362 HydrophobicContact CE2-CD1 4.18Å
348	C	96.5	Very high	94.9	Very high	4 Å²	4	56.5 Å²	56.5	3%	0.027	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	147.7	161.9	60.2	0	0	0	0	111.4	M326 V337 Y338 M339 Q361 L363	M326-C348 HydrophobicContact CE-CB 3.79Å; V337-C348 HydrophobicContact CG1-CB 4.15Å; Y338-C348 WeakPolarHBondContact O-CA 3.4Å; M339-C348 HydrophobicContact CE-CB 4.19Å; M339-C348 HydrophobicContact SD-CB 3.53Å; M339-C348 VanDerWaalsContact SD-CB 3.53Å; C348-Q361 PolarHBondContact N-O 3.48Å; C348-Q361 PolarHBondContact O-N 2.94Å; C348-L363 HydrophobicContact CB-CD1 3.92Å; C348-L363 HydrophobicContact CB-CG 4.39Å
349	S	97.3	Very high	94.8	Very high	4 Å²	4	57.3 Å²	57.3	3%	0.028	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	134.2	167.7	-162.9	0	0	0	0	111	V337 Y338 R351 G352 S354 Y359	V337-S349 VanDerWaalsContact CG1-O 3.3Å; V337-S349 WeakPolarHBondContact CG1-O 3.41Å; Y338-S349 PolarHBondContact O-N 2.93Å; S349-R351 VanDerWaalsContact C-N 3.34Å; S349-R351 PolarHBondContact OG-N 3.19Å; S349-R351 PolarHBondContact OG-O 2.76Å; S349-G352 VanDerWaalsContact CB-O 3.31Å; S349-G352 WeakPolarHBondContact CB-O 3.34Å; S349-G352 PolarHBondContact OG-O 2.86Å; S349-S354 PolarHBondContact OG-O 3.36Å; S349-Y359 CarbonylContact C-O 3.59Å; S349-Y359 WeakPolarHBondContact CA-O 3.46Å
350	T	96.4	Very high	94.8	Very high	89 Å²	89	58.7 Å²	58.7	55%	0.546	30%	0.295	S	S	.	.	S	Bend	trans	-87.4	-7.2	168.5	55.4	0	0	0	0	112.2	Y359 Q361	T350-Y359 PolarHBondContact N-O 3.5Å; T350-Y359 VanDerWaalsContact OG1-CA 3.26Å; T350-Y359 WeakPolarHBondContact OG1-CA 3.33Å; T350-Y359 PolarHBondContact OG1-O 2.66Å; T350-Q361 HydrophobicContact CG2-CB 4.42Å
351	R	96.1	Very high	94.8	Very high	151 Å²	151	63.7 Å²	63.7	57%	0.57	32%	0.318	S	S	*	.	S	Bend	trans	-138.6	91.6	-179	-171.7	178.5	178.5	-176.7	-4	111.4	S349 T353 S354 Y359	S349-R351 VanDerWaalsContact C-N 3.34Å; S349-R351 PolarHBondContact OG-N 3.19Å; S349-R351 PolarHBondContact OG-O 2.76Å; R351-T353 PolarHBondContact O-N 2.71Å; R351-S354 WeakPolarHBondContact O-CB 3.4Å; R351-S354 PolarHBondContact O-N 2.88Å; R351-Y359 HydrophobicContact CB-CD1 3.87Å; R351-Y359 HydrophobicContact CB-CD2 4.12Å; R351-Y359 HydrophobicContact CB-CE1 4.34Å; R351-Y359 HydrophobicContact CB-CG 3.77Å; R351-Y359 PolarHBondContact NH1-OH 2.73Å
352	G	95.2	Very high	94.7	Very high	56 Å²	56	67.9 Å²	67.9	58%	0.577	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	-124.2	175.7	0	0	0	0	0	112	Y338 S349	Y338-G352 VanDerWaalsContact CB-O 3.3Å; Y338-G352 WeakPolarHBondContact CB-O 3.34Å; S349-G352 VanDerWaalsContact CB-O 3.31Å; S349-G352 WeakPolarHBondContact CB-O 3.34Å; S349-G352 PolarHBondContact OG-O 2.86Å
353	T	95.5	Very high	94.6	Very high	75 Å²	75	66.8 Å²	66.8	46%	0.46	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	14.5	176.3	59	0	0	0	0	112.7	Y323 Y338 R351 K355	Y323-T353 WeakPolarHBondContact OH-CG2 3.27Å; Y338-T353 HydrophobicContact CD1-CG2 4.24Å; Y338-T353 HydrophobicContact CD2-CG2 3.6Å; Y338-T353 HydrophobicContact CE1-CG2 4.42Å; Y338-T353 HydrophobicContact CE2-CG2 3.81Å; Y338-T353 HydrophobicContact CG-CG2 3.8Å; R351-T353 PolarHBondContact O-N 2.71Å; T353-K355 PolarHBondContact O-N 2.79Å
354	S	94.8	Very high	94.8	Very high	25 Å²	25	61 Å²	61	18%	0.175	32%	0.317	C	S	.	.			trans	-64.1	134.2	-175.4	-176.1	0	0	0	0	111.6	S349 R351 E356 Y359	S349-S354 PolarHBondContact OG-O 3.36Å; R351-S354 WeakPolarHBondContact O-CB 3.4Å; R351-S354 PolarHBondContact O-N 2.88Å; S354-E356 PolarHBondContact OG-N 3.47Å; S354-Y359 WeakPolarHBondContact OG-CD2 3.3Å
355	K	92.8	Very high	94.9	Very high	72 Å²	72	60.6 Å²	60.6	31%	0.313	31%	0.31	S	S	.	.			trans	-97.1	0.6	176.2	-54.7	-165.5	-172.7	-156.7	0	113.2	E319 Q321 F340 T353 L360	E319-K355 IonicContact OE1-NZ 3.88Å; E319-K355 PolarHBondContact OE1-NZ 2.77Å; Q321-K355 VanDerWaalsContact OE1-CE 3.28Å; F340-K355 HydrophobicContact CD1-CG 4.5Å; F340-K355 HydrophobicContact CE1-CD 3.87Å; F340-K355 HydrophobicContact CE1-CG 3.61Å; F340-K355 HydrophobicContact CE2-CG 4.45Å; F340-K355 HydrophobicContact CZ-CB 4.49Å; F340-K355 HydrophobicContact CZ-CD 4.35Å; F340-K355 HydrophobicContact CZ-CG 3.57Å; T353-K355 PolarHBondContact O-N 2.79Å; K355-L360 WeakPolarHBondContact O-CD1 3.33Å
356	E	92.9	Very high	94.6	Very high	88 Å²	88	61 Å²	61	41%	0.411	31%	0.312	S	S	.	.			trans	-62.9	133.6	-178.6	-65.5	174	-142.3	0	0	110	S354 R358 Y359 L360	S354-E356 PolarHBondContact OG-N 3.47Å; E356-R358 HydrophobicContact CB-CG 4.08Å; E356-R358 PolarHBondContact O-N 2.69Å; E356-R358 WeakPolarHBondContact OE2-CD 3.38Å; E356-R358 IonicContact OE2-NE 3.64Å; E356-Y359 HydrophobicContact CB-CD2 3.8Å; E356-Y359 HydrophobicContact CB-CE2 4.2Å; E356-Y359 HydrophobicContact CG-CD2 4.36Å; E356-Y359 HydrophobicContact CG-CE2 4.41Å; E356-Y359 PolarHBondContact O-N 2.9Å; E356-Y359 WeakPolarHBondContact OE2-CE2 3.43Å; E356-L360 PolarHBondContact O-N 3.38Å
357	P	93.3	Very high	94.2	Very high	112 Å²	112	68.5 Å²	68.5	73%	0.727	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-52.3	-34.4	-176	-30.1	35.4	0	0	0	114.5	Y359 L360	P357-Y359 PolarHBondContact O-N 3.18Å; P357-L360 PolarHBondContact O-N 2.91Å
358	R	95.9	Very high	93.6	Very high	197 Å²	197	69.1 Å²	69.1	74%	0.743	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-64.1	-23.4	177.9	64.2	-179.5	59.3	-177	-1.6	114.4	E356	E356-R358 HydrophobicContact CB-CG 4.08Å; E356-R358 PolarHBondContact O-N 2.69Å; E356-R358 WeakPolarHBondContact OE2-CD 3.38Å; E356-R358 IonicContact OE2-NE 3.64Å
359	Y	96.9	Very high	93.4	Very high	50 Å²	50	70 Å²	70	20%	0.196	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-101.4	-3	178.4	-56.5	-53.9	0	0	0	112.8	S349 T350 R351 S354 E356 P357	S349-Y359 CarbonylContact C-O 3.59Å; S349-Y359 WeakPolarHBondContact CA-O 3.46Å; T350-Y359 PolarHBondContact N-O 3.5Å; T350-Y359 VanDerWaalsContact OG1-CA 3.26Å; T350-Y359 WeakPolarHBondContact OG1-CA 3.33Å; T350-Y359 PolarHBondContact OG1-O 2.66Å; R351-Y359 HydrophobicContact CB-CD1 3.87Å; R351-Y359 HydrophobicContact CB-CD2 4.12Å; R351-Y359 HydrophobicContact CB-CE1 4.34Å; R351-Y359 HydrophobicContact CB-CG 3.77Å; R351-Y359 PolarHBondContact NH1-OH 2.73Å; S354-Y359 WeakPolarHBondContact OG-CD2 3.3Å; E356-Y359 HydrophobicContact CB-CD2 3.8Å; E356-Y359 HydrophobicContact CB-CE2 4.2Å; E356-Y359 HydrophobicContact CG-CD2 4.36Å; E356-Y359 HydrophobicContact CG-CE2 4.41Å; E356-Y359 PolarHBondContact O-N 2.9Å; E356-Y359 WeakPolarHBondContact OE2-CE2 3.43Å; P357-Y359 PolarHBondContact O-N 3.18Å
360	L	96.9	Very high	93.1	Very high	28 Å²	28	69.9 Å²	69.9	15%	0.147	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	122.5	179.5	-65.6	-177.7	0	0	0	111	F340 Y347 K355 E356 P357	F340-L360 HydrophobicContact CD2-CD2 3.51Å; F340-L360 HydrophobicContact CE2-CD2 3.67Å; Y347-L360 HydrophobicContact CD1-CB 4.22Å; K355-L360 WeakPolarHBondContact O-CD1 3.33Å; E356-L360 PolarHBondContact O-N 3.38Å; P357-L360 PolarHBondContact O-N 2.91Å
361	Q	95.8	Very high	93.1	Very high	106 Å²	106	66.3 Å²	66.3	50%	0.495	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.1	173.8	-178.9	178.4	7	0	0	109.7	Y347 C348 T350	Y347-Q361 CarbonylContact C-O 3.55Å; Y347-Q361 VanDerWaalsContact CA-O 3.23Å; Y347-Q361 WeakPolarHBondContact CA-O 3.35Å; C348-Q361 PolarHBondContact N-O 3.48Å; C348-Q361 PolarHBondContact O-N 2.94Å; T350-Q361 HydrophobicContact CG2-CB 4.42Å
362	L	94.6	Very high	93.1	Very high	89 Å²	89	59.2 Å²	59.2	47%	0.466	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	131.2	174.9	-178.8	68.8	0	0	0	110.2	Y347	Y347-L362 HydrophobicContact CD1-CB 4.04Å; Y347-L362 HydrophobicContact CD1-CD1 4.17Å; Y347-L362 HydrophobicContact CE1-CB 3.83Å; Y347-L362 HydrophobicContact CE1-CD1 3.7Å; Y347-L362 HydrophobicContact CE1-CG 4.34Å; Y347-L362 HydrophobicContact CE2-CD1 4.18Å
363	L	92.1	Very high	93.2	Very high	29 Å²	29	58 Å²	58	15%	0.152	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-40.3	179.4	-64	176.4	0	0	0	113.2	M326 M339 L346 C348	M326-L363 HydrophobicContact CE-CD1 3.33Å; M326-L363 HydrophobicContact CE-CD2 3.7Å; M326-L363 HydrophobicContact CE-CG 4.12Å; M326-L363 HydrophobicContact SD-CD2 4.36Å; M339-L363 HydrophobicContact CE-CD1 4.01Å; M339-L363 HydrophobicContact SD-CD1 3.72Å; L346-L363 HydrophobicContact CD2-CD1 4.43Å; L346-L363 PolarHBondContact O-N 3.2Å; C348-L363 HydrophobicContact CB-CD1 3.92Å; C348-L363 HydrophobicContact CB-CG 4.39Å
364	A	91.4	Very high	93.2	Very high	4 Å²	4	54.6 Å²	54.6	3%	0.033	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	129.6	-177.4	0	0	0	0	0	110.5	G345 L346 F391	G345-A364 VanDerWaalsContact CA-O 3.29Å; G345-A364 WeakPolarHBondContact CA-O 3.3Å; L346-A364 HydrophobicContact CB-CB 4.47Å; L346-A364 PolarHBondContact N-O 3.44Å; L346-A364 PolarHBondContact O-N 2.96Å; A364-F391 HydrophobicContact CB-CB 4.19Å; A364-F391 HydrophobicContact CB-CD1 4.34Å; A364-F391 HydrophobicContact CB-CD2 4.06Å; A364-F391 HydrophobicContact CB-CG 3.91Å
365	D	91.4	Very high	93	Very high	53 Å²	53	57.4 Å²	57.4	28%	0.283	28%	0.28	S	S	.	.			trans	-78.8	148.3	166.8	175.3	-95.2	0	0	0	110.8	E367 D368 N369	D365-E367 WeakPolarHBondContact OD1-CA 3.42Å; D365-E367 WeakPolarHBondContact OD1-CB 3.42Å; D365-E367 PolarHBondContact OD1-N 3.45Å; D365-D368 PolarHBondContact OD1-N 2.93Å; D365-N369 PolarHBondContact N-ND2 2.94Å; D365-N369 VanDerWaalsContact O-CB 3.31Å; D365-N369 WeakPolarHBondContact O-CB 3.28Å; D365-N369 PolarHBondContact O-ND2 3.36Å
366	L	88.7	Confident	92.8	Very high	8 Å²	8	55.4 Å²	55.4	4%	0.042	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-29.7	-175.9	-72	164.6	0	0	0	114	L341 R342 R343 F421 F424 K425	L341-L366 HydrophobicContact CD1-CD2 4.03Å; R342-L366 WeakPolarHBondContact O-CD1 3.48Å; R343-L366 VanDerWaalsContact O-CD1 3.32Å; R343-L366 WeakPolarHBondContact O-CD1 3.35Å; L366-F421 HydrophobicContact CD2-CD1 4.34Å; L366-F421 HydrophobicContact CD2-CD2 3.53Å; L366-F421 HydrophobicContact CD2-CE1 4.15Å; L366-F421 HydrophobicContact CD2-CE2 3.31Å; L366-F421 HydrophobicContact CD2-CG 4.07Å; L366-F421 HydrophobicContact CD2-CZ 3.65Å; L366-F421 HydrophobicContact CG-CE2 4.38Å; L366-F424 HydrophobicContact CD1-CB 3.76Å; L366-F424 HydrophobicContact CD1-CD1 4.2Å; L366-F424 HydrophobicContact CD1-CG 4.48Å; L366-F424 HydrophobicContact CD2-CB 3.99Å; L366-K425 WeakPolarHBondContact O-CG 3.45Å; L366-K425 PolarHBondContact O-NZ 3.01Å
367	E	86.9	Confident	92.3	Very high	159 Å²	159	51.4 Å²	51.4	74%	0.743	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-48.2	-174.6	-60.8	-171.5	170.3	0	0	110.4	D365 K425	D365-E367 WeakPolarHBondContact OD1-CA 3.42Å; D365-E367 WeakPolarHBondContact OD1-CB 3.42Å; D365-E367 PolarHBondContact OD1-N 3.45Å; E367-K425 PolarHBondContact O-NZ 3.27Å
368	D	85.2	Confident	92.1	Very high	53 Å²	53	50.5 Å²	50.5	28%	0.283	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-14	-172.2	-73.1	-38.1	0	0	0	114.3	D365 L393 N394 K395	D365-D368 PolarHBondContact OD1-N 2.93Å; D368-L393 HydrophobicContact CB-CD1 3.62Å; D368-N394 VanDerWaalsContact O-CB 3.29Å; D368-N394 WeakPolarHBondContact O-CB 3.27Å; D368-N394 VanDerWaalsContact O-CG 3.28Å; D368-N394 PolarHBondContact O-N 3.45Å; D368-N394 PolarHBondContact O-ND2 3.43Å; D368-K395 WeakPolarHBondContact OD1-CE 3.42Å; D368-K395 IonicContact OD1-NZ 2.84Å; D368-K395 PolarHBondContact OD1-NZ 2.8Å
369	N	90.4	Very high	91.7	Very high	21 Å²	21	50.3 Å²	50.3	11%	0.112	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	144.1	-178.2	-65.5	-84.8	0	0	0	113.1	D365 F391 K392 F421 K425	D365-N369 PolarHBondContact N-ND2 2.94Å; D365-N369 VanDerWaalsContact O-CB 3.31Å; D365-N369 WeakPolarHBondContact O-CB 3.28Å; D365-N369 PolarHBondContact O-ND2 3.36Å; N369-F391 HydrophobicContact CB-CB 4.24Å; N369-K392 WeakPolarHBondContact CA-O 3.48Å; N369-F421 HydrophobicContact CB-CZ 4.35Å; N369-K425 WeakPolarHBondContact O-CE 3.49Å; N369-K425 PolarHBondContact O-NZ 3.42Å
370	S	92.4	Very high	91.2	Very high	3 Å²	3	51.9 Å²	51.9	2%	0.021	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	143.9	166.5	-66.9	0	0	0	0	109.7	F372 F391 K392 N394	S370-F372 WeakPolarHBondContact O-CD2 3.21Å; S370-F391 WeakPolarHBondContact O-CA 3.43Å; S370-K392 PolarHBondContact N-O 3.25Å; S370-K392 PolarHBondContact O-N 3.26Å; S370-N394 WeakPolarHBondContact CB-OD1 3.44Å; S370-N394 PolarHBondContact OG-ND2 3.44Å; S370-N394 PolarHBondContact OG-OD1 3.25Å
371	I	96.1	Very high	90.9	Very high	14 Å²	14	52.4 Å²	52.4	7%	0.072	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	134.6	-179.4	-167.7	168.7	0	0	0	110.4	R247 F389 C390 F391 M418 F421 R422	R247-I371 VanDerWaalsContact CB-O 3.25Å; R247-I371 WeakPolarHBondContact CB-O 3.48Å; I371-F389 HydrophobicContact CD1-CD2 3.95Å; I371-F389 HydrophobicContact CD1-CE2 4.33Å; I371-F389 HydrophobicContact CG1-CD2 4.26Å; I371-C390 WeakPolarHBondContact CA-O 3.42Å; I371-F391 HydrophobicContact CB-CD1 4.18Å; I371-F391 HydrophobicContact CB-CE1 4.01Å; I371-F391 HydrophobicContact CD1-CE1 3.68Å; I371-F391 HydrophobicContact CD1-CZ 4.05Å; I371-F391 HydrophobicContact CG1-CD1 4.23Å; I371-F391 HydrophobicContact CG1-CE1 3.79Å; I371-F391 HydrophobicContact CG1-CZ 4.44Å; I371-M418 HydrophobicContact CD1-CB 4.05Å; I371-M418 HydrophobicContact CD1-CE 4.4Å; I371-M418 HydrophobicContact CD1-CG 3.79Å; I371-M418 HydrophobicContact CG1-CE 4.01Å; I371-M418 HydrophobicContact CG1-CG 4.38Å; I371-F421 HydrophobicContact CB-CD1 3.74Å; I371-F421 HydrophobicContact CB-CE1 4.06Å; I371-F421 HydrophobicContact CB-CG 4.37Å; I371-F421 HydrophobicContact CD1-CB 3.77Å; I371-F421 HydrophobicContact CD1-CD1 4.21Å; I371-F421 HydrophobicContact CD1-CG 3.99Å; I371-F421 HydrophobicContact CG2-CD1 3.76Å; I371-F421 HydrophobicContact CG2-CE1 4.36Å; I371-R422 HydrophobicContact CG2-CG 4.26Å
372	F	96.6	Very high	90.8	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.009	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	145.1	-177.9	-69.2	-102.4	0	0	0	110.2	E238 H240 L245 E246 R247 S370 F389 C390 K392	E238-F372 HydrophobicContact CG-CE1 4.06Å; H240-F372 AromaticContact CD2-CE1 3.61Å; H240-F372 AromaticContact NE2-CE1 3.46Å; H240-F372 WeakPolarHBondContact NE2-CE1 3.47Å; H240-F372 AromaticContact NE2-CZ 3.74Å; L245-F372 HydrophobicContact CB-CB 4.18Å; L245-F372 HydrophobicContact CB-CD1 3.99Å; L245-F372 HydrophobicContact CB-CG 4.33Å; E246-F372 CarbonylContact O-C 3.56Å; E246-F372 WeakPolarHBondContact O-CA 3.38Å; R247-F372 HydrophobicContact CB-CD1 3.73Å; R247-F372 HydrophobicContact CB-CE1 4.03Å; R247-F372 HydrophobicContact CB-CG 4.12Å; R247-F372 VanDerWaalsContact CD-CZ 3.41Å; R247-F372 HydrophobicContact CG-CD1 3.76Å; R247-F372 HydrophobicContact CG-CE1 3.49Å; R247-F372 VanDerWaalsContact CG-CE1 3.49Å; R247-F372 HydrophobicContact CG-CE2 4.47Å; R247-F372 HydrophobicContact CG-CG 4.37Å; R247-F372 HydrophobicContact CG-CZ 3.88Å; S370-F372 WeakPolarHBondContact O-CD2 3.21Å; F372-F389 CarbonylContact O-C 3.57Å; F372-F389 WeakPolarHBondContact O-CA 3.13Å; F372-F389 VanDerWaalsContact O-CB 3.25Å; F372-F389 WeakPolarHBondContact O-CB 3.45Å; F372-C390 PolarHBondContact N-O 2.93Å; F372-C390 PolarHBondContact O-N 3.41Å; F372-K392 HydrophobicContact CD2-CB 3.87Å; F372-K392 HydrophobicContact CE2-CB 3.64Å; F372-K392 HydrophobicContact CE2-CD 3.82Å; F372-K392 HydrophobicContact CE2-CG 4.31Å; F372-K392 HydrophobicContact CZ-CD 3.91Å
373	T	96.8	Very high	90.9	Very high	29 Å²	29	45.3 Å²	45.3	18%	0.178	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	144.2	163.4	-3.3	0	0	0	0	109.2	L245 E246	L245-T373 WeakPolarHBondContact CA-O 3.48Å; E246-T373 HydrophobicContact CG-CG2 4.24Å; E246-T373 PolarHBondContact N-O 3.31Å; E246-T373 PolarHBondContact O-N 2.85Å
374	V	95.6	Very high	91.1	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.024	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	107.7	178.8	-174.1	0	0	0	0	108.6	G244 L245 T376 T388 C390	G244-V374 CarbonylContact O-C 3.48Å; G244-V374 WeakPolarHBondContact O-CA 3.44Å; L245-V374 HydrophobicContact CD2-CB 4.21Å; L245-V374 HydrophobicContact CD2-CG1 4.2Å; L245-V374 HydrophobicContact CD2-CG2 3.67Å; V374-T376 VanDerWaalsContact C-N 3.32Å; V374-T376 PolarHBondContact O-N 3.17Å; V374-T388 HydrophobicContact CB-CG2 3.68Å; V374-T388 HydrophobicContact CG1-CG2 4.21Å; V374-T388 HydrophobicContact CG2-CG2 3.73Å; V374-T388 PolarHBondContact N-O 3.47Å; V374-C390 HydrophobicContact CG2-CB 4.02Å
375	I	90.9	Very high	91.3	Very high	84 Å²	84	47.6 Å²	47.6	43%	0.431	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-26.8	-175.5	-45.5	171.9	0	0	0	111.2	G244 E246	G244-I375 PolarHBondContact O-N 3.29Å; E246-I375 HydrophobicContact CB-CD1 4.01Å; E246-I375 HydrophobicContact CG-CD1 3.65Å; E246-I375 HydrophobicContact CG-CG1 3.83Å
376	T	86.9	Confident	91.4	Very high	31 Å²	31	49.5 Å²	49.5	19%	0.19	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	19.1	-174.8	53.1	0	0	0	0	113.5	V374 K378 K379 Q380	V374-T376 VanDerWaalsContact C-N 3.32Å; V374-T376 PolarHBondContact O-N 3.17Å; T376-K378 PolarHBondContact O-N 3.39Å; T376-K379 PolarHBondContact O-N 3.28Å; T376-Q380 VanDerWaalsContact CB-CD 3.45Å; T376-Q380 VanDerWaalsContact CB-OE1 3.28Å; T376-Q380 HydrophobicContact CG2-CG 4.49Å; T376-Q380 WeakPolarHBondContact O-CB 3.32Å; T376-Q380 PolarHBondContact O-N 2.78Å; T376-Q380 VanDerWaalsContact OG1-CD 3.3Å; T376-Q380 PolarHBondContact OG1-OE1 2.88Å
377	G	84.3	Confident	91.7	Very high	4 Å²	4	52.3 Å²	52.3	4%	0.041	27%	0.269	C	S	.	.	H	α-helix	trans	-49.2	-57.3	-170.5	0	0	0	0	0	114.6	H381 G382 A383	G377-H381 CarbonylContact O-C 3.46Å; G377-H381 WeakPolarHBondContact O-CA 3.46Å; G377-H381 WeakPolarHBondContact O-CB 3.25Å; G377-H381 PolarHBondContact O-N 3.32Å; G377-G382 PolarHBondContact O-N 3.2Å; G377-A383 PolarHBondContact O-N 2.92Å
378	K	87.5	Confident	92.2	Very high	92 Å²	92	44.7 Å²	44.7	40%	0.4	23%	0.234	S	C	.	.	H	α-helix	trans	-63.2	-51.1	177.6	-72.2	-164.1	-178.9	156.6	0	112.5	T376 G382 A383 D386	T376-K378 PolarHBondContact O-N 3.39Å; K378-G382 WeakPolarHBondContact O-CA 3.17Å; K378-G382 PolarHBondContact O-N 3Å; K378-G382 VanDerWaalsContact O-N 3.11Å; K378-A383 HydrophobicContact CG-CB 4.46Å; K378-D386 WeakPolarHBondContact CD-OD1 3.15Å; K378-D386 VanDerWaalsContact CE-CG 3.48Å; K378-D386 WeakPolarHBondContact CE-OD1 3.46Å; K378-D386 WeakPolarHBondContact CE-OD2 3.36Å; K378-D386 WeakPolarHBondContact CG-OD1 3.18Å; K378-D386 VanDerWaalsContact NZ-CG 3.26Å; K378-D386 IonicContact NZ-OD1 2.69Å; K378-D386 PolarHBondContact NZ-OD1 2.76Å; K378-D386 IonicContact NZ-OD2 2.76Å; K378-D386 PolarHBondContact NZ-OD2 2.69Å
379	K	87.8	Confident	92.8	Very high	193 Å²	193	42.3 Å²	42.3	84%	0.839	22%	0.221	S	C	*	.	H	α-helix	trans	-64.8	-44.3	-172	-66.3	-177.8	-179.6	178.2	0	112.6	T376	T376-K379 PolarHBondContact O-N 3.28Å
380	Q	87.5	Confident	93.1	Very high	83 Å²	83	41.3 Å²	41.3	39%	0.388	22%	0.215	S	C	.	.	H	α-helix	trans	-94.8	-34.3	-175.1	-71.8	179.2	-12.6	0	0	113	K332 T376	K332-Q380 WeakPolarHBondContact CE-O 3.4Å; T376-Q380 VanDerWaalsContact CB-CD 3.45Å; T376-Q380 VanDerWaalsContact CB-OE1 3.28Å; T376-Q380 HydrophobicContact CG2-CG 4.49Å; T376-Q380 WeakPolarHBondContact O-CB 3.32Å; T376-Q380 PolarHBondContact O-N 2.78Å; T376-Q380 VanDerWaalsContact OG1-CD 3.3Å; T376-Q380 PolarHBondContact OG1-OE1 2.88Å
381	H	89.8	Confident	93.1	Very high	39 Å²	39	41.5 Å²	41.5	18%	0.181	22%	0.216	C	C	.	.	H	α-helix	trans	-117.2	0.6	-168.7	-55.1	-62.3	0	0	0	115	K327 W334 G377 A383 M405	K327-H381 HydrophobicContact CD-CB 4.25Å; W334-H381 HydrophobicContact CZ2-CB 4.12Å; W334-H381 PolarHBondContact NE1-O 2.75Å; G377-H381 CarbonylContact O-C 3.46Å; G377-H381 WeakPolarHBondContact O-CA 3.46Å; G377-H381 WeakPolarHBondContact O-CB 3.25Å; G377-H381 PolarHBondContact O-N 3.32Å; H381-A383 VanDerWaalsContact C-N 3.27Å; H381-A383 PolarHBondContact O-N 2.65Å; H381-M405 HydrophobicContact CB-SD 4.23Å; H381-M405 WeakPolarHBondContact NE2-CE 3.39Å
382	G	94.1	Very high	92.7	Very high	38 Å²	38	42 Å²	42	39%	0.392	22%	0.218	S	C	.	.			trans	64.9	31.4	179.5	0	0	0	0	0	113	W334 G377 K378	W334-G382 VanDerWaalsContact CD1-O 3.29Å; W334-G382 PolarHBondContact NE1-O 3.32Å; G377-G382 PolarHBondContact O-N 3.2Å; K378-G382 WeakPolarHBondContact O-CA 3.17Å; K378-G382 PolarHBondContact O-N 3Å; K378-G382 VanDerWaalsContact O-N 3.11Å
383	A	96.2	Very high	92.1	Very high	9 Å²	9	45.2 Å²	45.2	7%	0.074	23%	0.234	C	C	.	.			trans	-58.9	144.5	-178.4	0	0	0	0	0	112.5	W334 G377 K378 H381 T385 T388	W334-A383 HydrophobicContact CH2-CB 4.09Å; W334-A383 HydrophobicContact CZ2-CB 3.68Å; G377-A383 PolarHBondContact O-N 2.92Å; K378-A383 HydrophobicContact CG-CB 4.46Å; H381-A383 VanDerWaalsContact C-N 3.27Å; H381-A383 PolarHBondContact O-N 2.65Å; A383-T385 VanDerWaalsContact C-N 3.32Å; A383-T385 WeakPolarHBondContact CB-O 3.34Å; A383-T385 PolarHBondContact O-N 3.05Å; A383-T388 VanDerWaalsContact CB-OG1 3.27Å; A383-T388 WeakPolarHBondContact CB-OG1 3.3Å
384	P	96.7	Very high	91	Very high	58 Å²	58	46.5 Å²	46.5	38%	0.377	24%	0.24	S	C	.	.	S	Bend	trans	-63.3	-34.7	178	-24.8	35.3	0	0	0	113.6	Y325 W334	Y325-P384 HydrophobicContact CD1-CG 3.94Å; Y325-P384 HydrophobicContact CD2-CB 4.33Å; Y325-P384 HydrophobicContact CD2-CG 4.23Å; Y325-P384 HydrophobicContact CE1-CG 4.46Å; Y325-P384 HydrophobicContact CE2-CB 4.46Å; Y325-P384 HydrophobicContact CG-CB 4.39Å; Y325-P384 HydrophobicContact CG-CG 3.82Å; W334-P384 HydrophobicContact CB-CG 3.99Å; W334-P384 HydrophobicContact CD2-CG 4.36Å; W334-P384 HydrophobicContact CG-CG 4.04Å
385	T	95.8	Very high	89.5	Confident	23 Å²	23	53 Å²	53	14%	0.141	27%	0.268	C	S	.	.	S	Bend	trans	-134.3	174.8	180	79.4	0	0	0	0	110.6	A383 Y387 C407 A408	A383-T385 VanDerWaalsContact C-N 3.32Å; A383-T385 WeakPolarHBondContact CB-O 3.34Å; A383-T385 PolarHBondContact O-N 3.05Å; T385-Y387 HydrophobicContact CG2-CD2 4.4Å; T385-Y387 PolarHBondContact O-N 2.88Å; T385-Y387 VanDerWaalsContact OG1-CD2 3.27Å; T385-Y387 WeakPolarHBondContact OG1-CD2 3.32Å; T385-Y387 PolarHBondContact OG1-N 3.13Å; T385-Y387 VanDerWaalsContact OG1-N 3.13Å; T385-C407 PolarHBondContact OG1-SG 3.11Å; T385-A408 WeakPolarHBondContact CG2-O 3.4Å; T385-A408 PolarHBondContact OG1-O 3.33Å
386	D	93.1	Very high	87.6	Confident	92 Å²	92	51.9 Å²	51.9	49%	0.492	27%	0.271	S	S	.	.	S	Bend	trans	-79.9	-4	175.7	-62.5	-54.7	0	0	0	112.3	K378 T388	K378-D386 WeakPolarHBondContact CD-OD1 3.15Å; K378-D386 VanDerWaalsContact CE-CG 3.48Å; K378-D386 WeakPolarHBondContact CE-OD1 3.46Å; K378-D386 WeakPolarHBondContact CE-OD2 3.36Å; K378-D386 WeakPolarHBondContact CG-OD1 3.18Å; K378-D386 VanDerWaalsContact NZ-CG 3.26Å; K378-D386 IonicContact NZ-OD1 2.69Å; K378-D386 PolarHBondContact NZ-OD1 2.76Å; K378-D386 IonicContact NZ-OD2 2.76Å; K378-D386 PolarHBondContact NZ-OD2 2.69Å; D386-T388 VanDerWaalsContact C-N 3.26Å; D386-T388 PolarHBondContact O-N 2.69Å; D386-T388 VanDerWaalsContact O-N 3.09Å
387	Y	95.9	Very high	85.9	Confident	67 Å²	67	58.7 Å²	58.7	26%	0.263	31%	0.305	S	S	.	.			trans	-93.3	50.5	-170.8	-45.1	-63	0	0	0	111.6	T385 A408 E409 D410 E411	T385-Y387 HydrophobicContact CG2-CD2 4.4Å; T385-Y387 PolarHBondContact O-N 2.88Å; T385-Y387 VanDerWaalsContact OG1-CD2 3.27Å; T385-Y387 WeakPolarHBondContact OG1-CD2 3.32Å; T385-Y387 PolarHBondContact OG1-N 3.13Å; T385-Y387 VanDerWaalsContact OG1-N 3.13Å; Y387-A408 PolarHBondContact O-N 3.19Å; Y387-E409 WeakPolarHBondContact CD2-O 3.45Å; Y387-E409 WeakPolarHBondContact CE2-O 3.4Å; Y387-D410 VanDerWaalsContact CD2-C 3.48Å; Y387-D410 VanDerWaalsContact CE2-CA 3.42Å; Y387-D410 HydrophobicContact CE2-CB 4.48Å; Y387-E411 HydrophobicContact CD1-CB 4.05Å; Y387-E411 WeakPolarHBondContact CD1-OE2 3.24Å; Y387-E411 HydrophobicContact CE1-CB 3.77Å; Y387-E411 WeakPolarHBondContact CE1-OE2 3.39Å
388	T	97.5	Very high	84.2	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	139.8	-176	-51.7	0	0	0	0	112	W334 V374 A383 D386 L406 C407	W334-T388 HydrophobicContact CH2-CG2 3.91Å; V374-T388 HydrophobicContact CB-CG2 3.68Å; V374-T388 HydrophobicContact CG1-CG2 4.21Å; V374-T388 HydrophobicContact CG2-CG2 3.73Å; V374-T388 PolarHBondContact N-O 3.47Å; A383-T388 VanDerWaalsContact CB-OG1 3.27Å; A383-T388 WeakPolarHBondContact CB-OG1 3.3Å; D386-T388 VanDerWaalsContact C-N 3.26Å; D386-T388 PolarHBondContact O-N 2.69Å; D386-T388 VanDerWaalsContact O-N 3.09Å; T388-L406 CarbonylContact C-O 3.54Å; T388-L406 WeakPolarHBondContact CA-O 3.34Å; T388-L406 VanDerWaalsContact CG2-O 3.28Å; T388-L406 WeakPolarHBondContact CG2-O 3.23Å; T388-C407 PolarHBondContact OG1-SG 2.98Å; T388-C407 VanDerWaalsContact OG1-SG 3.39Å
389	F	97.6	Very high	82.1	Confident	2 Å²	2	65.5 Å²	65.5	1%	0.009	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	162.8	174.3	62.8	-83.7	0	0	0	110.6	L324 I371 F372 F391 L406 R414 W417 M418	L324-F389 HydrophobicContact CD1-CE1 4.36Å; L324-F389 HydrophobicContact CD1-CZ 3.65Å; L324-F389 HydrophobicContact CD2-CE1 4.19Å; L324-F389 HydrophobicContact CD2-CZ 4.27Å; I371-F389 HydrophobicContact CD1-CD2 3.95Å; I371-F389 HydrophobicContact CD1-CE2 4.33Å; I371-F389 HydrophobicContact CG1-CD2 4.26Å; F372-F389 CarbonylContact O-C 3.57Å; F372-F389 WeakPolarHBondContact O-CA 3.13Å; F372-F389 VanDerWaalsContact O-CB 3.25Å; F372-F389 WeakPolarHBondContact O-CB 3.45Å; F389-F391 HydrophobicContact CD2-CZ 4.47Å; F389-F391 HydrophobicContact CE2-CE2 4.37Å; F389-F391 HydrophobicContact CE2-CZ 4.17Å; F389-L406 HydrophobicContact CD2-CB 4.33Å; F389-L406 HydrophobicContact CE1-CB 4.13Å; F389-L406 HydrophobicContact CE2-CB 3.93Å; F389-L406 HydrophobicContact CE2-CD1 3.84Å; F389-L406 HydrophobicContact CE2-CG 4.42Å; F389-L406 HydrophobicContact CZ-CB 3.83Å; F389-L406 HydrophobicContact CZ-CD1 4.09Å; F389-L406 PolarHBondContact N-O 3.21Å; F389-L406 PolarHBondContact O-N 2.85Å; F389-R414 HydrophobicContact CD1-CG 3.96Å; F389-W417 HydrophobicContact CE1-CB 4.33Å; F389-W417 HydrophobicContact CE2-CB 4.39Å; F389-W417 HydrophobicContact CZ-CB 3.78Å; F389-W417 HydrophobicContact CZ-CG 4.2Å; F389-M418 HydrophobicContact CB-CE 4.26Å; F389-M418 HydrophobicContact CB-CG 4.2Å; F389-M418 HydrophobicContact CB-SD 3.97Å; F389-M418 HydrophobicContact CD2-CG 4.34Å; F389-M418 HydrophobicContact CG-CG 4.15Å
390	C	95.6	Very high	80.3	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	166.3	-179.5	72.2	0	0	0	0	113.4	L245 I371 F372 V374 R404 M405	L245-C390 WeakPolarHBondContact CD2-SG 3.32Å; I371-C390 WeakPolarHBondContact CA-O 3.42Å; F372-C390 PolarHBondContact N-O 2.93Å; F372-C390 PolarHBondContact O-N 3.41Å; V374-C390 HydrophobicContact CG2-CB 4.02Å; C390-R404 WeakPolarHBondContact CA-O 3.39Å; C390-R404 VanDerWaalsContact CB-O 3.25Å; C390-R404 WeakPolarHBondContact CB-O 3.48Å; C390-M405 HydrophobicContact CB-CB 4.44Å; C390-M405 HydrophobicContact CB-CG 3.89Å
391	F	92.6	Very high	79	Confident	7 Å²	7	62.7 Å²	62.7	3%	0.031	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.9	171.9	-56.2	-76.2	0	0	0	110.6	L346 A364 N369 S370 I371 F389 R404 L406 F421	L346-F391 HydrophobicContact CD2-CD2 4.32Å; L346-F391 HydrophobicContact CD2-CE2 3.35Å; L346-F391 HydrophobicContact CD2-CZ 3.63Å; A364-F391 HydrophobicContact CB-CB 4.19Å; A364-F391 HydrophobicContact CB-CD1 4.34Å; A364-F391 HydrophobicContact CB-CD2 4.06Å; A364-F391 HydrophobicContact CB-CG 3.91Å; N369-F391 HydrophobicContact CB-CB 4.24Å; S370-F391 WeakPolarHBondContact O-CA 3.43Å; I371-F391 HydrophobicContact CB-CD1 4.18Å; I371-F391 HydrophobicContact CB-CE1 4.01Å; I371-F391 HydrophobicContact CD1-CE1 3.68Å; I371-F391 HydrophobicContact CD1-CZ 4.05Å; I371-F391 HydrophobicContact CG1-CD1 4.23Å; I371-F391 HydrophobicContact CG1-CE1 3.79Å; I371-F391 HydrophobicContact CG1-CZ 4.44Å; F389-F391 HydrophobicContact CD2-CZ 4.47Å; F389-F391 HydrophobicContact CE2-CE2 4.37Å; F389-F391 HydrophobicContact CE2-CZ 4.17Å; F391-R404 HydrophobicContact CD2-CB 4.4Å; F391-R404 PolarHBondContact N-O 3.2Å; F391-R404 VanDerWaalsContact N-O 3.09Å; F391-L406 HydrophobicContact CE2-CD1 3.7Å; F391-L406 HydrophobicContact CE2-CG 4.45Å; F391-F421 HydrophobicContact CD1-CD2 4.26Å; F391-F421 HydrophobicContact CD1-CE1 4.19Å; F391-F421 AromaticContact CD1-CE2 3.69Å; F391-F421 HydrophobicContact CD1-CE2 3.69Å; F391-F421 AromaticContact CD1-CZ 3.66Å; F391-F421 HydrophobicContact CD1-CZ 3.66Å; F391-F421 HydrophobicContact CE1-CD1 4.13Å; F391-F421 AromaticContact CE1-CD2 3.33Å; F391-F421 HydrophobicContact CE1-CD2 3.33Å; F391-F421 HydrophobicContact CE1-CE1 4.03Å; F391-F421 AromaticContact CE1-CE2 3.19Å; F391-F421 HydrophobicContact CE1-CE2 3.19Å; F391-F421 AromaticContact CE1-CG 3.79Å; F391-F421 HydrophobicContact CE1-CG 3.79Å; F391-F421 AromaticContact CE1-CZ 3.57Å; F391-F421 HydrophobicContact CE1-CZ 3.57Å; F391-F421 AromaticContact CZ-CD2 3.92Å; F391-F421 HydrophobicContact CZ-CD2 3.92Å; F391-F421 HydrophobicContact CZ-CE2 4Å
392	K	88.7	Confident	78	Confident	26 Å²	26	65.2 Å²	65.2	11%	0.113	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	130	175	177.9	-169.8	170.8	-161.6	0	108.8	E238 H240 N369 S370 F372 L403	E238-K392 IonicContact OE1-NZ 3.37Å; E238-K392 PolarHBondContact OE1-NZ 2.81Å; H240-K392 PolarHBondContact CE1-NZ 2.94Å; H240-K392 PolarHBondContact NE2-NZ 3.13Å; N369-K392 WeakPolarHBondContact CA-O 3.48Å; S370-K392 PolarHBondContact N-O 3.25Å; S370-K392 PolarHBondContact O-N 3.26Å; F372-K392 HydrophobicContact CD2-CB 3.87Å; F372-K392 HydrophobicContact CE2-CB 3.64Å; F372-K392 HydrophobicContact CE2-CD 3.82Å; F372-K392 HydrophobicContact CE2-CG 4.31Å; F372-K392 HydrophobicContact CZ-CD 3.91Å; K392-L403 HydrophobicContact CB-CD2 4.05Å; K392-L403 HydrophobicContact CG-CD2 4.32Å
393	L	82.5	Confident	77.5	Confident	68 Å²	68	65.3 Å²	65.3	36%	0.356	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	128.8	177.7	-166.3	71.6	0	0	0	111	D368 K395 K401	D368-L393 HydrophobicContact CB-CD1 3.62Å; L393-K395 WeakPolarHBondContact CD2-O 3.49Å; L393-K401 HydrophobicContact CB-CD 4.46Å; L393-K401 PolarHBondContact O-NZ 2.93Å
394	N	73.8	Confident	77.2	Confident	57 Å²	57	69.2 Å²	69.2	31%	0.305	37%	0.37	S	S	.	.	S	Bend	trans	-70.1	-35.9	-178.2	-67.4	-23.2	0	0	0	112	D368 S370	D368-N394 VanDerWaalsContact O-CB 3.29Å; D368-N394 WeakPolarHBondContact O-CB 3.27Å; D368-N394 VanDerWaalsContact O-CG 3.28Å; D368-N394 PolarHBondContact O-N 3.45Å; D368-N394 PolarHBondContact O-ND2 3.43Å; S370-N394 WeakPolarHBondContact CB-OD1 3.44Å; S370-N394 PolarHBondContact OG-ND2 3.44Å; S370-N394 PolarHBondContact OG-OD1 3.25Å
395	K	64.8	Low	77.1	Confident	141 Å²	141	66.9 Å²	66.9	61%	0.613	35%	0.354	S	S	*	.	S	Bend	trans	-95.2	109.6	179.7	-63.6	172.1	-175.7	150	0	110	D368 L393	D368-K395 WeakPolarHBondContact OD1-CE 3.42Å; D368-K395 IonicContact OD1-NZ 2.84Å; D368-K395 PolarHBondContact OD1-NZ 2.8Å; L393-K395 WeakPolarHBondContact CD2-O 3.49Å
396	A	51.6	Low	77.2	Confident	60 Å²	60	66 Å²	66	50%	0.496	35%	0.348	S	S	.	.			trans	161.4	118.4	143.6	0	0	0	0	0	109.9	K401	A396-K401 VanDerWaalsContact CB-CE 3.49Å; A396-K401 VanDerWaalsContact N-NZ 3.12Å; A396-K401 WeakPolarHBondContact O-CE 3.39Å; A396-K401 PolarHBondContact O-NZ 3Å
397	I	50.8	Low	77.4	Confident	173 Å²	173	61.6 Å²	61.6	89%	0.887	33%	0.325	S	S	*	.	S	Bend	trans	-81.7	122.4	158.6	-66.6	165.9	0	0	0	104.8
398	G	48.2	Very low	77.6	Confident	66 Å²	66	58.4 Å²	58.4	68%	0.68	31%	0.312	S	S	*	.	S	Bend	trans	82.8	79	170.3	0	0	0	0	0	115.4
399	E	43.9	Very low	77.5	Confident	173 Å²	173	62.8 Å²	62.8	81%	0.808	33%	0.333	S	S	*	.	S	Bend	trans	178.1	145	142.9	-101	172.6	-165.1	0	0	106	K401	E399-K401 VanDerWaalsContact C-N 3.31Å; E399-K401 PolarHBondContact O-N 3.09Å
400	T	50.4	Low	77.4	Confident	150 Å²	150	66.2 Å²	66.2	92%	0.92	35%	0.351	S	S	*	.			trans	-59.7	91.7	179.5	33.5	0	0	0	0	110.2	E402	T400-E402 PolarHBondContact O-N 3.46Å; T400-E402 VanDerWaalsContact O-N 3.16Å
401	K	58.4	Low	77.3	Confident	68 Å²	68	67 Å²	67	30%	0.296	36%	0.355	S	S	.	.			trans	-62.9	114.6	-176.6	-73.1	178.9	176.7	174.5	0	109.7	L393 A396 E399 L403	L393-K401 HydrophobicContact CB-CD 4.46Å; L393-K401 PolarHBondContact O-NZ 2.93Å; A396-K401 VanDerWaalsContact CB-CE 3.49Å; A396-K401 VanDerWaalsContact N-NZ 3.12Å; A396-K401 WeakPolarHBondContact O-CE 3.39Å; A396-K401 PolarHBondContact O-NZ 3Å; E399-K401 VanDerWaalsContact C-N 3.31Å; E399-K401 PolarHBondContact O-N 3.09Å; K401-L403 PolarHBondContact O-N 3.43Å; K401-L403 VanDerWaalsContact O-N 3.07Å
402	E	68.9	Low	77.4	Confident	92 Å²	92	69.4 Å²	69.4	43%	0.43	37%	0.366	S	S	.	.			trans	-65	106.4	174.6	-161.8	-166.6	167.2	0	0	110.1	V329 T400 R404	V329-E402 WeakPolarHBondContact CB-OE1 3.44Å; V329-E402 HydrophobicContact CG1-CG 4.32Å; V329-E402 WeakPolarHBondContact CG1-OE1 3.27Å; V329-E402 WeakPolarHBondContact CG2-OE1 3.47Å; T400-E402 PolarHBondContact O-N 3.46Å; T400-E402 VanDerWaalsContact O-N 3.16Å; E402-R404 PolarHBondContact O-N 3.07Å; E402-R404 IonicContact OE1-CZ 2.65Å; E402-R404 IonicContact OE1-NH1 2.65Å; E402-R404 PolarHBondContact OE1-NH1 3.08Å; E402-R404 IonicContact OE1-NH2 3.09Å; E402-R404 IonicContact OE2-CZ 2.9Å; E402-R404 IonicContact OE2-NH1 3.13Å; E402-R404 PolarHBondContact OE2-NH1 3.32Å; E402-R404 VanDerWaalsContact OE2-NH1 3.13Å; E402-R404 IonicContact OE2-NH2 3.18Å; E402-R404 PolarHBondContact OE2-NH2 3.14Å
403	L	85.2	Confident	77.7	Confident	39 Å²	39	69.2 Å²	69.2	20%	0.204	37%	0.368	C	S	.	.			trans	-71.7	123	177.2	-65.5	171	0	0	0	110.1	L245 K392 K401 M405	L245-L403 HydrophobicContact CD1-CD1 3.9Å; L245-L403 HydrophobicContact CD1-CD2 4.05Å; K392-L403 HydrophobicContact CB-CD2 4.05Å; K392-L403 HydrophobicContact CG-CD2 4.32Å; K401-L403 PolarHBondContact O-N 3.43Å; K401-L403 VanDerWaalsContact O-N 3.07Å; L403-M405 HydrophobicContact CB-CE 4.03Å; L403-M405 HydrophobicContact CB-CG 4.33Å; L403-M405 HydrophobicContact CD1-CE 3.74Å; L403-M405 PolarHBondContact O-N 3.46Å
404	R	89.9	Confident	78.4	Confident	92 Å²	92	67.5 Å²	67.5	35%	0.347	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	98	171.5	-65.2	-76.1	175.9	-116.7	-13	108.7	C390 F391 E402	C390-R404 WeakPolarHBondContact CA-O 3.39Å; C390-R404 VanDerWaalsContact CB-O 3.25Å; C390-R404 WeakPolarHBondContact CB-O 3.48Å; F391-R404 HydrophobicContact CD2-CB 4.4Å; F391-R404 PolarHBondContact N-O 3.2Å; F391-R404 VanDerWaalsContact N-O 3.09Å; E402-R404 PolarHBondContact O-N 3.07Å; E402-R404 IonicContact OE1-CZ 2.65Å; E402-R404 IonicContact OE1-NH1 2.65Å; E402-R404 PolarHBondContact OE1-NH1 3.08Å; E402-R404 IonicContact OE1-NH2 3.09Å; E402-R404 IonicContact OE2-CZ 2.9Å; E402-R404 IonicContact OE2-NH1 3.13Å; E402-R404 PolarHBondContact OE2-NH1 3.32Å; E402-R404 VanDerWaalsContact OE2-NH1 3.13Å; E402-R404 IonicContact OE2-NH2 3.18Å; E402-R404 PolarHBondContact OE2-NH2 3.14Å
405	M	94.4	Very high	79.4	Confident	9 Å²	9	66.3 Å²	66.3	4%	0.044	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.9	-177.8	-66.8	176.3	175	0	0	112.2	K327 W334 H381 C390 L403	K327-M405 HydrophobicContact CB-CB 3.9Å; K327-M405 HydrophobicContact CD-CB 4.07Å; K327-M405 HydrophobicContact CD-CG 4.36Å; K327-M405 HydrophobicContact CD-SD 3.57Å; K327-M405 VanDerWaalsContact CD-SD 3.57Å; K327-M405 PolarHBondContact N-O 3.23Å; K327-M405 VanDerWaalsContact N-O 3.07Å; W334-M405 HydrophobicContact CH2-CB 4.01Å; W334-M405 HydrophobicContact CZ3-CB 4.44Å; H381-M405 HydrophobicContact CB-SD 4.23Å; H381-M405 WeakPolarHBondContact NE2-CE 3.39Å; C390-M405 HydrophobicContact CB-CB 4.44Å; C390-M405 HydrophobicContact CB-CG 3.89Å; L403-M405 HydrophobicContact CB-CE 4.03Å; L403-M405 HydrophobicContact CB-CG 4.33Å; L403-M405 HydrophobicContact CD1-CE 3.74Å; L403-M405 PolarHBondContact O-N 3.46Å
406	L	97.4	Very high	81	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.021	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	153.4	176	-58.5	-178.7	0	0	0	110.1	L324 Y325 M326 M339 L346 T388 F389 F391	L324-L406 HydrophobicContact CD1-CB 4.36Å; L324-L406 HydrophobicContact CD1-CD1 3.85Å; Y325-L406 CarbonylContact O-C 3.57Å; Y325-L406 VanDerWaalsContact O-CA 3.23Å; Y325-L406 WeakPolarHBondContact O-CA 3.37Å; M326-L406 HydrophobicContact CB-CD2 3.9Å; M326-L406 HydrophobicContact CG-CD2 3.98Å; M339-L406 HydrophobicContact CE-CD1 4.5Å; M339-L406 HydrophobicContact CE-CD2 3.58Å; L346-L406 HydrophobicContact CD2-CD1 3.71Å; T388-L406 CarbonylContact C-O 3.54Å; T388-L406 WeakPolarHBondContact CA-O 3.34Å; T388-L406 VanDerWaalsContact CG2-O 3.28Å; T388-L406 WeakPolarHBondContact CG2-O 3.23Å; F389-L406 HydrophobicContact CD2-CB 4.33Å; F389-L406 HydrophobicContact CE1-CB 4.13Å; F389-L406 HydrophobicContact CE2-CB 3.93Å; F389-L406 HydrophobicContact CE2-CD1 3.84Å; F389-L406 HydrophobicContact CE2-CG 4.42Å; F389-L406 HydrophobicContact CZ-CB 3.83Å; F389-L406 HydrophobicContact CZ-CD1 4.09Å; F389-L406 PolarHBondContact N-O 3.21Å; F389-L406 PolarHBondContact O-N 2.85Å; F391-L406 HydrophobicContact CE2-CD1 3.7Å; F391-L406 HydrophobicContact CE2-CG 4.45Å
407	C	98.1	Very high	83.2	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	130.5	178.6	-169.7	0	0	0	0	109.9	Y325 W334 T385 T388	Y325-C407 WeakPolarHBondContact CD2-O 3.49Å; Y325-C407 PolarHBondContact N-O 2.6Å; Y325-C407 PolarHBondContact O-N 3.48Å; W334-C407 HydrophobicContact CE3-CB 4.09Å; W334-C407 HydrophobicContact CH2-CB 4.18Å; W334-C407 HydrophobicContact CZ3-CB 3.61Å; T385-C407 PolarHBondContact OG1-SG 3.11Å; T388-C407 PolarHBondContact OG1-SG 2.98Å; T388-C407 VanDerWaalsContact OG1-SG 3.39Å
408	A	98.1	Very high	85.4	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.264	C	S	.	.			trans	-89.8	167.9	176.9	0	0	0	0	0	111.6	L324 T385 Y387 R414	L324-A408 HydrophobicContact CD2-CB 3.91Å; T385-A408 WeakPolarHBondContact CG2-O 3.4Å; T385-A408 PolarHBondContact OG1-O 3.33Å; Y387-A408 PolarHBondContact O-N 3.19Å; A408-R414 HydrophobicContact CB-CB 3.9Å
409	E	96.3	Very high	87.7	Confident	92 Å²	92	47.5 Å²	47.5	43%	0.43	24%	0.235	S	C	.	.	S	Bend	trans	-78.4	-34.9	176.7	-72.5	-178.1	165.8	0	0	112.5	Y325 K336 Y387	Y325-E409 HydrophobicContact CE2-CG 3.82Å; K336-E409 WeakPolarHBondContact CE-OE1 3.41Å; K336-E409 IonicContact NZ-OE1 3.02Å; K336-E409 PolarHBondContact NZ-OE1 2.83Å; Y387-E409 WeakPolarHBondContact CD2-O 3.45Å; Y387-E409 WeakPolarHBondContact CE2-O 3.4Å
410	D	94.8	Very high	90.2	Very high	73 Å²	73	39.3 Å²	39.3	39%	0.39	20%	0.197	S	C	.	.	S	Bend	trans	-142.9	172.3	-178.6	58.6	54.4	0	0	0	112.1	Y387 Q412 S413 R414	Y387-D410 VanDerWaalsContact CD2-C 3.48Å; Y387-D410 VanDerWaalsContact CE2-CA 3.42Å; Y387-D410 HydrophobicContact CE2-CB 4.48Å; D410-Q412 VanDerWaalsContact C-N 3.33Å; D410-Q412 PolarHBondContact O-N 2.88Å; D410-Q412 WeakPolarHBondContact OD1-CB 3.24Å; D410-Q412 PolarHBondContact OD1-N 2.66Å; D410-Q412 VanDerWaalsContact OD1-N 3.13Å; D410-S413 WeakPolarHBondContact OD1-CB 3.27Å; D410-S413 PolarHBondContact OD1-N 2.88Å; D410-R414 PolarHBondContact O-N 3.07Å
411	E	93.4	Very high	92.4	Very high	17 Å²	17	32.2 Å²	32.2	8%	0.079	15%	0.153	C	C	.	.	H	α-helix	trans	-63.3	-37.1	179.7	-176	58.3	-140.6	0	0	112.8	Y387 R414 T415 Q535 Q560	Y387-E411 HydrophobicContact CD1-CB 4.05Å; Y387-E411 WeakPolarHBondContact CD1-OE2 3.24Å; Y387-E411 HydrophobicContact CE1-CB 3.77Å; Y387-E411 WeakPolarHBondContact CE1-OE2 3.39Å; E411-R414 PolarHBondContact O-N 3.43Å; E411-R414 IonicContact OE1-CZ 3.42Å; E411-R414 IonicContact OE1-NE 3.23Å; E411-R414 PolarHBondContact OE1-NE 3.35Å; E411-R414 IonicContact OE1-NH2 2.87Å; E411-R414 PolarHBondContact OE1-NH2 2.9Å; E411-R414 IonicContact OE2-CZ 3.62Å; E411-R414 IonicContact OE2-NE 2.83Å; E411-R414 PolarHBondContact OE2-NE 3.03Å; E411-R414 IonicContact OE2-NH1 2.71Å; E411-R414 IonicContact OE2-NH2 3.24Å; E411-R414 PolarHBondContact OE2-NH2 2.86Å; E411-T415 VanDerWaalsContact O-CB 3.29Å; E411-T415 WeakPolarHBondContact O-CB 3.42Å; E411-T415 PolarHBondContact O-N 3.08Å; E411-T415 PolarHBondContact O-OG1 2.94Å; E411-T415 PolarHBondContact OE1-OG1 2.99Å; E411-Q535 VanDerWaalsContact CG-OE1 3.27Å; E411-Q560 HydrophobicContact CG-CB 4.31Å; E411-Q560 HydrophobicContact CG-CG 4.47Å
412	Q	94.7	Very high	94.2	Very high	57 Å²	57	30.5 Å²	30.5	27%	0.266	15%	0.145	S	C	.	.	H	α-helix	trans	-63.6	-50.8	-179	178	72.1	42.7	0	0	109.5	F286 P288 D410 R414 T415 C416 Q560	F286-Q412 PolarHBondContact O-NE2 3.42Å; P288-Q412 HydrophobicContact CG-CG 4.49Å; D410-Q412 VanDerWaalsContact C-N 3.33Å; D410-Q412 PolarHBondContact O-N 2.88Å; D410-Q412 WeakPolarHBondContact OD1-CB 3.24Å; D410-Q412 PolarHBondContact OD1-N 2.66Å; D410-Q412 VanDerWaalsContact OD1-N 3.13Å; Q412-R414 PolarHBondContact O-N 3.24Å; Q412-T415 PolarHBondContact O-N 3.26Å; Q412-C416 PolarHBondContact NE2-SG 3.01Å; Q412-C416 WeakPolarHBondContact O-CB 3.45Å; Q412-C416 PolarHBondContact O-N 3.28Å; Q412-C416 PolarHBondContact O-SG 3.3Å; Q412-Q560 VanDerWaalsContact N-OE1 3.1Å; Q412-Q560 VanDerWaalsContact OE1-CD 3.32Å
413	S	96.2	Very high	95.4	Very high	23 Å²	23	26.2 Å²	26.2	16%	0.161	13%	0.125	C	C	.	.	H	α-helix	trans	-59.4	-45.8	178.4	-179.2	0	0	0	0	111.2	D410 T415 C416 W417	D410-S413 WeakPolarHBondContact OD1-CB 3.27Å; D410-S413 PolarHBondContact OD1-N 2.88Å; S413-T415 PolarHBondContact O-N 3.26Å; S413-C416 PolarHBondContact O-N 2.92Å; S413-W417 PolarHBondContact O-N 3.39Å
414	R	96.7	Very high	95.7	Very high	32 Å²	32	24.7 Å²	24.7	12%	0.121	12%	0.117	C	C	.	.	H	α-helix	trans	-57.8	-51	173.8	179.4	-178.6	76.3	174.3	9.1	111.6	F389 A408 D410 E411 Q412 C416 W417 M418	F389-R414 HydrophobicContact CD1-CG 3.96Å; A408-R414 HydrophobicContact CB-CB 3.9Å; D410-R414 PolarHBondContact O-N 3.07Å; E411-R414 PolarHBondContact O-N 3.43Å; E411-R414 IonicContact OE1-CZ 3.42Å; E411-R414 IonicContact OE1-NE 3.23Å; E411-R414 PolarHBondContact OE1-NE 3.35Å; E411-R414 IonicContact OE1-NH2 2.87Å; E411-R414 PolarHBondContact OE1-NH2 2.9Å; E411-R414 IonicContact OE2-CZ 3.62Å; E411-R414 IonicContact OE2-NE 2.83Å; E411-R414 PolarHBondContact OE2-NE 3.03Å; E411-R414 IonicContact OE2-NH1 2.71Å; E411-R414 IonicContact OE2-NH2 3.24Å; E411-R414 PolarHBondContact OE2-NH2 2.86Å; Q412-R414 PolarHBondContact O-N 3.24Å; R414-C416 VanDerWaalsContact C-N 3.3Å; R414-C416 PolarHBondContact O-N 2.86Å; R414-W417 PolarHBondContact O-N 3.1Å; R414-M418 HydrophobicContact CG-CG 4.24Å; R414-M418 HydrophobicContact CG-SD 3.91Å; R414-M418 WeakPolarHBondContact O-CB 3.48Å; R414-M418 VanDerWaalsContact O-CG 3.3Å; R414-M418 WeakPolarHBondContact O-CG 3.26Å; R414-M418 PolarHBondContact O-N 3.27Å
415	T	96.1	Very high	95.9	Very high	31 Å²	31	22.3 Å²	22.3	19%	0.19	11%	0.109	C	C	.	.	H	α-helix	trans	-60.5	-41.3	-178.4	-65.8	0	0	0	0	111.4	F286 E411 Q412 S413 T419	F286-T415 HydrophobicContact CE2-CG2 4.33Å; F286-T415 HydrophobicContact CZ-CG2 3.94Å; E411-T415 VanDerWaalsContact O-CB 3.29Å; E411-T415 WeakPolarHBondContact O-CB 3.42Å; E411-T415 PolarHBondContact O-N 3.08Å; E411-T415 PolarHBondContact O-OG1 2.94Å; E411-T415 PolarHBondContact OE1-OG1 2.99Å; Q412-T415 PolarHBondContact O-N 3.26Å; S413-T415 PolarHBondContact O-N 3.26Å; T415-T419 WeakPolarHBondContact O-CB 3.45Å; T415-T419 PolarHBondContact O-N 3.41Å; T415-T419 PolarHBondContact O-OG1 2.97Å
416	C	96.9	Very high	95.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62.8	-52	174.8	-69.6	0	0	0	0	111.8	F286 F287 M291 Q412 S413 R414 M418 T419 A420	F286-C416 PolarHBondContact O-SG 3.1Å; F287-C416 HydrophobicContact CD1-CB 3.77Å; F287-C416 HydrophobicContact CE1-CB 3.89Å; F287-C416 WeakPolarHBondContact CE1-O 3.29Å; M291-C416 HydrophobicContact CE-CB 3.51Å; M291-C416 HydrophobicContact SD-CB 3.39Å; M291-C416 WeakPolarHBondContact SD-CB 3.48Å; Q412-C416 PolarHBondContact NE2-SG 3.01Å; Q412-C416 WeakPolarHBondContact O-CB 3.45Å; Q412-C416 PolarHBondContact O-N 3.28Å; Q412-C416 PolarHBondContact O-SG 3.3Å; S413-C416 PolarHBondContact O-N 2.92Å; R414-C416 VanDerWaalsContact C-N 3.3Å; R414-C416 PolarHBondContact O-N 2.86Å; C416-M418 VanDerWaalsContact C-N 3.34Å; C416-M418 PolarHBondContact O-N 3.43Å; C416-T419 PolarHBondContact O-N 3.3Å; C416-A420 VanDerWaalsContact O-CB 3.25Å; C416-A420 WeakPolarHBondContact O-CB 3.44Å; C416-A420 PolarHBondContact O-N 3.19Å
417	W	97.7	Very high	95.5	Very high	8 Å²	8	25 Å²	25	3%	0.03	12%	0.118	C	C	.	.	H	α-helix	trans	-59.6	-44.5	179.2	-83.7	107.8	0	0	0	112	M291 I320 L324 M339 L341 L346 F389 S413 R414 F421	M291-W417 HydrophobicContact CE-CB 4.28Å; M291-W417 VanDerWaalsContact CE-CD1 3.44Å; M291-W417 HydrophobicContact CE-CD2 3.64Å; M291-W417 HydrophobicContact CE-CE3 4.43Å; M291-W417 HydrophobicContact CE-CG 3.54Å; M291-W417 HydrophobicContact CE-CZ2 4.36Å; I320-W417 HydrophobicContact CB-CZ3 4.47Å; I320-W417 HydrophobicContact CG2-CD2 4.26Å; I320-W417 HydrophobicContact CG2-CE3 3.9Å; I320-W417 HydrophobicContact CG2-CH2 3.93Å; I320-W417 HydrophobicContact CG2-CZ2 4.29Å; I320-W417 HydrophobicContact CG2-CZ3 3.74Å; L324-W417 HydrophobicContact CD1-CD2 3.83Å; L324-W417 HydrophobicContact CD1-CE3 4.37Å; L324-W417 HydrophobicContact CD1-CG 4.04Å; L324-W417 HydrophobicContact CD1-CZ2 4.19Å; L324-W417 HydrophobicContact CD2-CG 4.41Å; L324-W417 HydrophobicContact CG-CZ2 4.39Å; M339-W417 HydrophobicContact CB-CH2 3.6Å; M339-W417 HydrophobicContact CB-CZ2 3.96Å; M339-W417 HydrophobicContact CB-CZ3 4.35Å; L341-W417 HydrophobicContact CB-CZ3 3.81Å; L346-W417 HydrophobicContact CD1-CE3 4.43Å; L346-W417 HydrophobicContact CD1-CZ3 3.79Å; F389-W417 HydrophobicContact CE1-CB 4.33Å; F389-W417 HydrophobicContact CE2-CB 4.39Å; F389-W417 HydrophobicContact CZ-CB 3.78Å; F389-W417 HydrophobicContact CZ-CG 4.2Å; S413-W417 PolarHBondContact O-N 3.39Å; R414-W417 PolarHBondContact O-N 3.1Å; W417-F421 PolarHBondContact O-N 2.92Å
418	M	97.4	Very high	95.2	Very high	25 Å²	25	28.8 Å²	28.8	12%	0.123	14%	0.138	C	C	.	.	H	α-helix	trans	-66.1	-42.7	179.5	-67.4	-171.3	81	0	0	112.1	I371 F389 R414 C416 F421 R422	I371-M418 HydrophobicContact CD1-CB 4.05Å; I371-M418 HydrophobicContact CD1-CE 4.4Å; I371-M418 HydrophobicContact CD1-CG 3.79Å; I371-M418 HydrophobicContact CG1-CE 4.01Å; I371-M418 HydrophobicContact CG1-CG 4.38Å; F389-M418 HydrophobicContact CB-CE 4.26Å; F389-M418 HydrophobicContact CB-CG 4.2Å; F389-M418 HydrophobicContact CB-SD 3.97Å; F389-M418 HydrophobicContact CD2-CG 4.34Å; F389-M418 HydrophobicContact CG-CG 4.15Å; R414-M418 HydrophobicContact CG-CG 4.24Å; R414-M418 HydrophobicContact CG-SD 3.91Å; R414-M418 WeakPolarHBondContact O-CB 3.48Å; R414-M418 VanDerWaalsContact O-CG 3.3Å; R414-M418 WeakPolarHBondContact O-CG 3.26Å; R414-M418 PolarHBondContact O-N 3.27Å; C416-M418 VanDerWaalsContact C-N 3.34Å; C416-M418 PolarHBondContact O-N 3.43Å; M418-F421 PolarHBondContact O-N 2.8Å; M418-R422 VanDerWaalsContact O-CG 3.28Å; M418-R422 WeakPolarHBondContact O-CG 3.43Å; M418-R422 PolarHBondContact O-N 3.38Å; M418-R422 VanDerWaalsContact O-N 3.11Å
419	T	96.9	Very high	95.1	Very high	13 Å²	13	32.2 Å²	32.2	8%	0.08	16%	0.155	C	C	.	.	H	α-helix	trans	-69	-40.2	179.2	-59.9	0	0	0	0	111.7	F279 F286 T415 C416 F421 R422 I423	F279-T419 HydrophobicContact CB-CG2 3.75Å; F279-T419 HydrophobicContact CG-CG2 4.36Å; F286-T419 HydrophobicContact CE1-CG2 3.62Å; F286-T419 HydrophobicContact CZ-CG2 3.61Å; F286-T419 WeakPolarHBondContact CZ-OG1 3.34Å; T415-T419 WeakPolarHBondContact O-CB 3.45Å; T415-T419 PolarHBondContact O-N 3.41Å; T415-T419 PolarHBondContact O-OG1 2.97Å; C416-T419 PolarHBondContact O-N 3.3Å; T419-F421 PolarHBondContact O-N 3.32Å; T419-R422 WeakPolarHBondContact O-CB 3.09Å; T419-R422 PolarHBondContact O-N 3.17Å; T419-I423 HydrophobicContact CG2-CD1 3.88Å; T419-I423 HydrophobicContact CG2-CG1 4.41Å; T419-I423 VanDerWaalsContact O-CG1 3.27Å; T419-I423 WeakPolarHBondContact O-CG1 3.44Å; T419-I423 PolarHBondContact O-N 3.12Å
420	A	96.1	Very high	95.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-57.6	-49.7	172.3	0	0	0	0	0	111.1	F287 I320 L341 C416 R422 I423 F424	F287-A420 HydrophobicContact CE1-CB 4.01Å; F287-A420 HydrophobicContact CZ-CB 4.07Å; I320-A420 HydrophobicContact CB-CB 4.42Å; I320-A420 HydrophobicContact CG1-CB 3.76Å; I320-A420 HydrophobicContact CG2-CB 4.33Å; L341-A420 HydrophobicContact CD2-CB 3.74Å; C416-A420 VanDerWaalsContact O-CB 3.25Å; C416-A420 WeakPolarHBondContact O-CB 3.44Å; C416-A420 PolarHBondContact O-N 3.19Å; A420-R422 VanDerWaalsContact C-N 3.28Å; A420-R422 PolarHBondContact O-N 3.41Å; A420-I423 PolarHBondContact O-N 3.35Å; A420-I423 VanDerWaalsContact O-N 3.1Å; A420-F424 WeakPolarHBondContact O-CD2 3.35Å; A420-F424 PolarHBondContact O-N 3.21Å
421	F	95.9	Very high	95.1	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.009	13%	0.126	C	C	.	.	H	α-helix	trans	-56.6	-43.2	177.9	-169.4	-88	0	0	0	112.1	L341 L366 N369 I371 F391 W417 M418 T419 F424 K425	L341-F421 HydrophobicContact CD1-CD2 4.18Å; L341-F421 HydrophobicContact CD2-CB 4.42Å; L366-F421 HydrophobicContact CD2-CD1 4.34Å; L366-F421 HydrophobicContact CD2-CD2 3.53Å; L366-F421 HydrophobicContact CD2-CE1 4.15Å; L366-F421 HydrophobicContact CD2-CE2 3.31Å; L366-F421 HydrophobicContact CD2-CG 4.07Å; L366-F421 HydrophobicContact CD2-CZ 3.65Å; L366-F421 HydrophobicContact CG-CE2 4.38Å; N369-F421 HydrophobicContact CB-CZ 4.35Å; I371-F421 HydrophobicContact CB-CD1 3.74Å; I371-F421 HydrophobicContact CB-CE1 4.06Å; I371-F421 HydrophobicContact CB-CG 4.37Å; I371-F421 HydrophobicContact CD1-CB 3.77Å; I371-F421 HydrophobicContact CD1-CD1 4.21Å; I371-F421 HydrophobicContact CD1-CG 3.99Å; I371-F421 HydrophobicContact CG2-CD1 3.76Å; I371-F421 HydrophobicContact CG2-CE1 4.36Å; F391-F421 HydrophobicContact CD1-CD2 4.26Å; F391-F421 HydrophobicContact CD1-CE1 4.19Å; F391-F421 AromaticContact CD1-CE2 3.69Å; F391-F421 HydrophobicContact CD1-CE2 3.69Å; F391-F421 AromaticContact CD1-CZ 3.66Å; F391-F421 HydrophobicContact CD1-CZ 3.66Å; F391-F421 HydrophobicContact CE1-CD1 4.13Å; F391-F421 AromaticContact CE1-CD2 3.33Å; F391-F421 HydrophobicContact CE1-CD2 3.33Å; F391-F421 HydrophobicContact CE1-CE1 4.03Å; F391-F421 AromaticContact CE1-CE2 3.19Å; F391-F421 HydrophobicContact CE1-CE2 3.19Å; F391-F421 AromaticContact CE1-CG 3.79Å; F391-F421 HydrophobicContact CE1-CG 3.79Å; F391-F421 AromaticContact CE1-CZ 3.57Å; F391-F421 HydrophobicContact CE1-CZ 3.57Å; F391-F421 AromaticContact CZ-CD2 3.92Å; F391-F421 HydrophobicContact CZ-CD2 3.92Å; F391-F421 HydrophobicContact CZ-CE2 4Å; W417-F421 PolarHBondContact O-N 2.92Å; M418-F421 PolarHBondContact O-N 2.8Å; T419-F421 PolarHBondContact O-N 3.32Å; F421-F424 PolarHBondContact O-N 3.07Å; F421-K425 HydrophobicContact CE1-CD 4.2Å; F421-K425 VanDerWaalsContact O-CB 3.31Å; F421-K425 WeakPolarHBondContact O-CB 3.27Å; F421-K425 PolarHBondContact O-N 3.05Å
422	R	96.3	Very high	95.1	Very high	32 Å²	32	30.7 Å²	30.7	12%	0.121	14%	0.144	C	C	.	.	H	α-helix	trans	-61.3	-44.6	175.7	-67.2	165.2	66.2	-143	-2.9	112.2	E250 K276 I371 M418 T419 A420 K425 Y426 L430	E250-R422 VanDerWaalsContact CD-NH2 3.32Å; E250-R422 IonicContact OE1-CZ 3.67Å; E250-R422 IonicContact OE1-NE 3.99Å; E250-R422 PolarHBondContact OE1-NE 3.47Å; E250-R422 IonicContact OE1-NH2 2.76Å; E250-R422 PolarHBondContact OE1-NH2 2.9Å; E250-R422 IonicContact OE2-CZ 3.21Å; E250-R422 IonicContact OE2-NH2 3.52Å; E250-R422 PolarHBondContact OE2-NH2 2.84Å; K276-R422 PolarHBondContact O-NH1 3.46Å; K276-R422 PolarHBondContact O-NH2 2.96Å; K276-R422 VanDerWaalsContact O-NH2 3.07Å; I371-R422 HydrophobicContact CG2-CG 4.26Å; M418-R422 VanDerWaalsContact O-CG 3.28Å; M418-R422 WeakPolarHBondContact O-CG 3.43Å; M418-R422 PolarHBondContact O-N 3.38Å; M418-R422 VanDerWaalsContact O-N 3.11Å; T419-R422 WeakPolarHBondContact O-CB 3.09Å; T419-R422 PolarHBondContact O-N 3.17Å; A420-R422 VanDerWaalsContact C-N 3.28Å; A420-R422 PolarHBondContact O-N 3.41Å; R422-K425 PolarHBondContact O-N 3.4Å; R422-Y426 HydrophobicContact CB-CD2 4.47Å; R422-Y426 WeakPolarHBondContact O-CB 3.26Å; R422-Y426 WeakPolarHBondContact O-CD2 3.07Å; R422-Y426 PolarHBondContact O-N 2.97Å; R422-L430 HydrophobicContact CB-CD2 4.07Å
423	I	94.4	Very high	95.2	Very high	2 Å²	2	28.1 Å²	28.1	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-61.4	-44.8	176.7	-69.1	162.8	0	0	0	110.5	F279 F287 F311 T419 A420 R427 L430	F279-I423 HydrophobicContact CD1-CD1 3.43Å; F279-I423 VanDerWaalsContact CD1-CD1 3.43Å; F279-I423 HydrophobicContact CD1-CG1 4.21Å; F279-I423 HydrophobicContact CD2-CD1 4.25Å; F279-I423 HydrophobicContact CE1-CD1 3.5Å; F279-I423 HydrophobicContact CE1-CG1 4.3Å; F279-I423 HydrophobicContact CE2-CD1 4.33Å; F279-I423 HydrophobicContact CG-CD1 3.83Å; F279-I423 HydrophobicContact CZ-CD1 3.97Å; F287-I423 HydrophobicContact CE2-CD1 4.48Å; F287-I423 HydrophobicContact CZ-CD1 4.31Å; F311-I423 HydrophobicContact CB-CG2 3.79Å; F311-I423 HydrophobicContact CD1-CG2 3.86Å; F311-I423 HydrophobicContact CG-CG2 4.02Å; T419-I423 HydrophobicContact CG2-CD1 3.88Å; T419-I423 HydrophobicContact CG2-CG1 4.41Å; T419-I423 VanDerWaalsContact O-CG1 3.27Å; T419-I423 WeakPolarHBondContact O-CG1 3.44Å; T419-I423 PolarHBondContact O-N 3.12Å; A420-I423 PolarHBondContact O-N 3.35Å; A420-I423 VanDerWaalsContact O-N 3.1Å; I423-R427 WeakPolarHBondContact O-CA 3.47Å; I423-R427 PolarHBondContact O-N 3.25Å; I423-L430 HydrophobicContact CG1-CD2 4.14Å
424	F	93	Very high	95.2	Very high	7 Å²	7	28.6 Å²	28.6	3%	0.031	13%	0.131	C	C	.	.	H	α-helix	trans	-67.2	-39.3	179.8	-85.6	-112.9	0	0	0	112.6	F311 C317 P318 I320 L341 R342 L366 A420 F421 R427	F311-F424 HydrophobicContact CD1-CE2 4.08Å; F311-F424 AromaticContact CE1-CE2 3.74Å; F311-F424 HydrophobicContact CE1-CE2 3.74Å; F311-F424 HydrophobicContact CE1-CZ 4.43Å; C317-F424 WeakPolarHBondContact SG-CE1 3.33Å; P318-F424 WeakPolarHBondContact O-CZ 3.41Å; I320-F424 HydrophobicContact CG1-CE2 4.14Å; L341-F424 HydrophobicContact CD2-CD2 3.93Å; L341-F424 HydrophobicContact CD2-CE2 4.08Å; L341-F424 HydrophobicContact CD2-CG 4.19Å; L341-F424 HydrophobicContact CG-CD1 4.23Å; L341-F424 HydrophobicContact CG-CD2 4.29Å; L341-F424 HydrophobicContact CG-CE1 4.29Å; L341-F424 HydrophobicContact CG-CE2 4.27Å; L341-F424 HydrophobicContact CG-CG 4.21Å; L341-F424 HydrophobicContact CG-CZ 4.25Å; R342-F424 VanDerWaalsContact C-CE1 3.4Å; R342-F424 WeakPolarHBondContact O-CD1 3.43Å; L366-F424 HydrophobicContact CD1-CB 3.76Å; L366-F424 HydrophobicContact CD1-CD1 4.2Å; L366-F424 HydrophobicContact CD1-CG 4.48Å; L366-F424 HydrophobicContact CD2-CB 3.99Å; A420-F424 WeakPolarHBondContact O-CD2 3.35Å; A420-F424 PolarHBondContact O-N 3.21Å; F421-F424 PolarHBondContact O-N 3.07Å; F424-R427 WeakPolarHBondContact O-CG 3.27Å
425	K	93.8	Very high	95	Very high	41 Å²	41	32.3 Å²	32.3	18%	0.178	15%	0.148	C	C	.	.	H	α-helix	trans	-69.2	-48	178.9	-177.6	175.3	-177.9	81.6	0	112.4	L366 E367 N369 F421 R422	L366-K425 WeakPolarHBondContact O-CG 3.45Å; L366-K425 PolarHBondContact O-NZ 3.01Å; E367-K425 PolarHBondContact O-NZ 3.27Å; N369-K425 WeakPolarHBondContact O-CE 3.49Å; N369-K425 PolarHBondContact O-NZ 3.42Å; F421-K425 HydrophobicContact CE1-CD 4.2Å; F421-K425 VanDerWaalsContact O-CB 3.31Å; F421-K425 WeakPolarHBondContact O-CB 3.27Å; F421-K425 PolarHBondContact O-N 3.05Å; R422-K425 PolarHBondContact O-N 3.4Å
426	Y	93.6	Very high	94.7	Very high	30 Å²	30	35.5 Å²	35.5	12%	0.118	16%	0.16	C	C	.	.	H	α-helix	trans	-106.7	-18.1	-168.8	-60.6	-66.4	0	0	0	114.4	E250 H252 R422 I428 I429	E250-Y426 HydrophobicContact CG-CD2 3.79Å; E250-Y426 HydrophobicContact CG-CE2 3.51Å; E250-Y426 HydrophobicContact CG-CG 4.42Å; H252-Y426 AromaticContact CE1-CD1 3.3Å; H252-Y426 WeakPolarHBondContact CE1-CD1 3.25Å; H252-Y426 AromaticContact CE1-CE1 3.58Å; H252-Y426 AromaticContact CE1-CG 3.86Å; H252-Y426 AromaticContact NE2-CD1 3.33Å; H252-Y426 VanDerWaalsContact NE2-CD1 3.33Å; H252-Y426 WeakPolarHBondContact NE2-CD1 3.17Å; H252-Y426 AromaticContact NE2-CE1 3.55Å; R422-Y426 HydrophobicContact CB-CD2 4.47Å; R422-Y426 WeakPolarHBondContact O-CB 3.26Å; R422-Y426 WeakPolarHBondContact O-CD2 3.07Å; R422-Y426 PolarHBondContact O-N 2.97Å; Y426-I428 PolarHBondContact O-N 2.76Å; Y426-I429 VanDerWaalsContact O-CB 3.3Å; Y426-I429 WeakPolarHBondContact O-CB 3.32Å; Y426-I429 PolarHBondContact O-N 2.54Å
427	R	90.1	Very high	94.1	Very high	40 Å²	40	36.3 Å²	36.3	15%	0.151	16%	0.164	C	C	.	.	H	α-helix	trans	49.9	-127.7	171.7	-60.3	176.3	149.1	-99.8	-16.9	112.8	S313 R343 I423 F424 I429 L430 Y431	S313-R427 PolarHBondContact O-NH1 3.05Å; R343-R427 VanDerWaalsContact CD-NH2 3.31Å; R343-R427 VanDerWaalsContact CZ-CZ 3.44Å; I423-R427 WeakPolarHBondContact O-CA 3.47Å; I423-R427 PolarHBondContact O-N 3.25Å; F424-R427 WeakPolarHBondContact O-CG 3.27Å; R427-I429 PolarHBondContact O-N 3.41Å; R427-L430 WeakPolarHBondContact O-CB 3.43Å; R427-L430 PolarHBondContact O-N 2.92Å; R427-L430 VanDerWaalsContact O-N 3.08Å; R427-Y431 PolarHBondContact O-N 3.08Å
428	I	91.7	Very high	93.2	Very high	79 Å²	79	42.3 Å²	42.3	41%	0.405	19%	0.19	S	C	.	.	H	α-helix	trans	-60.2	-28.8	-177.6	-165.2	64.1	0	0	0	112.7	L312 Y426 L430 Y431 Q432	L312-I428 HydrophobicContact CB-CD1 4.48Å; L312-I428 HydrophobicContact CD1-CD1 4.39Å; Y426-I428 PolarHBondContact O-N 2.76Å; I428-L430 VanDerWaalsContact C-N 3.29Å; I428-L430 PolarHBondContact O-N 3.25Å; I428-Y431 HydrophobicContact CD1-CD1 3.99Å; I428-Y431 PolarHBondContact O-N 3.42Å; I428-Q432 WeakPolarHBondContact O-CG 3.32Å; I428-Q432 PolarHBondContact O-N 3.26Å
429	I	95.1	Very high	92	Very high	72 Å²	72	43.8 Å²	43.8	37%	0.369	21%	0.206	S	C	.	.	H	α-helix	trans	-64.2	-39.2	177.8	-56.7	172.9	0	0	0	109.8	H252 Y426 R427 Y431 Q432 N433	H252-I429 HydrophobicContact CB-CG2 3.93Å; H252-I429 VanDerWaalsContact CG-CG2 3.46Å; Y426-I429 VanDerWaalsContact O-CB 3.3Å; Y426-I429 WeakPolarHBondContact O-CB 3.32Å; Y426-I429 PolarHBondContact O-N 2.54Å; R427-I429 PolarHBondContact O-N 3.41Å; I429-Y431 VanDerWaalsContact C-N 3.33Å; I429-Y431 PolarHBondContact O-N 3.29Å; I429-Q432 WeakPolarHBondContact O-CB 3.2Å; I429-Q432 PolarHBondContact O-N 2.93Å; I429-N433 PolarHBondContact O-N 3.41Å; I429-N433 PolarHBondContact O-ND2 3.04Å
430	L	95.6	Very high	90.2	Very high	2 Å²	2	46.2 Å²	46.2	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-64.9	-39.3	176.8	-166.9	63.9	0	0	0	111.9	E250 Y277 F280 R422 I423 R427 I428 N433 Y434	E250-L430 HydrophobicContact CG-CD1 4.14Å; E250-L430 VanDerWaalsContact OE2-CD1 3.24Å; E250-L430 WeakPolarHBondContact OE2-CD1 3.37Å; Y277-L430 HydrophobicContact CE1-CD1 4.04Å; F280-L430 HydrophobicContact CE2-CD2 4.07Å; F280-L430 HydrophobicContact CE2-CG 3.8Å; F280-L430 HydrophobicContact CZ-CB 4.25Å; F280-L430 HydrophobicContact CZ-CD2 4.02Å; F280-L430 HydrophobicContact CZ-CG 3.93Å; R422-L430 HydrophobicContact CB-CD2 4.07Å; I423-L430 HydrophobicContact CG1-CD2 4.14Å; R427-L430 WeakPolarHBondContact O-CB 3.43Å; R427-L430 PolarHBondContact O-N 2.92Å; R427-L430 VanDerWaalsContact O-N 3.08Å; I428-L430 VanDerWaalsContact C-N 3.29Å; I428-L430 PolarHBondContact O-N 3.25Å; L430-N433 WeakPolarHBondContact O-CB 3.45Å; L430-N433 PolarHBondContact O-N 3.27Å; L430-Y434 PolarHBondContact O-N 3.45Å; L430-Y434 VanDerWaalsContact O-N 3.14Å
431	Y	94.9	Very high	88.3	Confident	51 Å²	51	51.3 Å²	51.3	20%	0.2	25%	0.245	C	C	.	.	H	α-helix	trans	-69.4	-38.3	175.4	-178.4	-120.4	0	0	0	112.8	F280 L308 L312 R427 I428 I429 N433 Y434 K435	F280-Y431 AromaticContact CD1-CD2 3.68Å; F280-Y431 HydrophobicContact CD1-CD2 3.68Å; F280-Y431 HydrophobicContact CD1-CE2 4.33Å; F280-Y431 AromaticContact CE1-CD2 3.83Å; F280-Y431 HydrophobicContact CE1-CD2 3.83Å; F280-Y431 HydrophobicContact CE1-CG 4.4Å; F280-Y431 HydrophobicContact CG-CD2 4.28Å; L308-Y431 HydrophobicContact CD2-CE2 4.19Å; L312-Y431 HydrophobicContact CD1-CD1 3.69Å; L312-Y431 HydrophobicContact CD1-CD2 4.11Å; L312-Y431 HydrophobicContact CD1-CE1 4.12Å; L312-Y431 HydrophobicContact CD1-CG 3.65Å; L312-Y431 HydrophobicContact CD2-CG 4.48Å; R427-Y431 PolarHBondContact O-N 3.08Å; I428-Y431 HydrophobicContact CD1-CD1 3.99Å; I428-Y431 PolarHBondContact O-N 3.42Å; I429-Y431 VanDerWaalsContact C-N 3.33Å; I429-Y431 PolarHBondContact O-N 3.29Å; Y431-N433 PolarHBondContact O-N 2.93Å; Y431-Y434 HydrophobicContact CD2-CD1 4.08Å; Y431-Y434 HydrophobicContact CE2-CD1 4.05Å; Y431-Y434 HydrophobicContact CE2-CE1 4.43Å; Y431-Y434 PolarHBondContact O-N 2.99Å; Y431-K435 HydrophobicContact CD1-CD 4.19Å; Y431-K435 HydrophobicContact CE1-CD 3.74Å; Y431-K435 HydrophobicContact CE1-CG 4.28Å; Y431-K435 HydrophobicContact CE2-CG 4.42Å; Y431-K435 PolarHBondContact O-N 3Å; Y431-K435 WeakPolarHBondContact OH-CE 3.27Å
432	Q	95.2	Very high	85.9	Confident	97 Å²	97	55.1 Å²	55.1	45%	0.453	27%	0.272	S	S	.	.	H	α-helix	trans	-59.1	-40.2	171.1	-74.6	172.4	-14.9	0	0	110.8	I428 I429 Y434 K435 Q436	I428-Q432 WeakPolarHBondContact O-CG 3.32Å; I428-Q432 PolarHBondContact O-N 3.26Å; I429-Q432 WeakPolarHBondContact O-CB 3.2Å; I429-Q432 PolarHBondContact O-N 2.93Å; Q432-Y434 PolarHBondContact O-N 2.87Å; Q432-K435 PolarHBondContact O-N 2.82Å; Q432-Q436 WeakPolarHBondContact O-CG 3.29Å; Q432-Q436 PolarHBondContact O-N 2.82Å
433	N	96.1	Very high	83	Confident	3 Å²	3	61.3 Å²	61.3	2%	0.016	30%	0.302	C	S	.	.	H	α-helix	trans	-62.1	-43.7	177.4	-66.8	-31.8	0	0	0	112.8	R216 D251 H252 Y277 I429 L430 Y431 R437	R216-N433 PolarHBondContact NH2-O 3.27Å; R216-N433 PolarHBondContact NH2-OD1 2.94Å; D251-N433 HydrophobicContact CB-CB 3.98Å; H252-N433 PolarHBondContact ND1-ND2 2.85Å; Y277-N433 HydrophobicContact CE1-CB 4.49Å; Y277-N433 VanDerWaalsContact OH-CB 3.27Å; Y277-N433 WeakPolarHBondContact OH-CB 3.31Å; I429-N433 PolarHBondContact O-N 3.41Å; I429-N433 PolarHBondContact O-ND2 3.04Å; L430-N433 WeakPolarHBondContact O-CB 3.45Å; L430-N433 PolarHBondContact O-N 3.27Å; Y431-N433 PolarHBondContact O-N 2.93Å; N433-R437 PolarHBondContact O-N 3.13Å
434	Y	94.9	Very high	80.4	Confident	33 Å²	33	68.1 Å²	68.1	13%	0.129	33%	0.332	C	S	.	.	H	α-helix	trans	-61	-47	173.5	167	-112	0	0	0	112.2	Y277 F280 R281 L430 Y431 Q432 Q436 R437 K438	Y277-Y434 AromaticContact CD2-CD2 3.99Å; Y277-Y434 HydrophobicContact CD2-CD2 3.99Å; Y277-Y434 AromaticContact CG-CD2 3.99Å; Y277-Y434 HydrophobicContact CG-CD2 3.99Å; Y277-Y434 HydrophobicContact CG-CG 4.49Å; F280-Y434 HydrophobicContact CB-CD1 3.47Å; F280-Y434 VanDerWaalsContact CB-CD1 3.47Å; F280-Y434 HydrophobicContact CB-CD2 4Å; F280-Y434 HydrophobicContact CB-CE1 3.52Å; F280-Y434 HydrophobicContact CB-CE2 4.07Å; F280-Y434 HydrophobicContact CB-CG 3.68Å; F280-Y434 HydrophobicContact CD2-CD1 4.3Å; F280-Y434 HydrophobicContact CD2-CD2 4.45Å; F280-Y434 AromaticContact CD2-CG 3.91Å; F280-Y434 HydrophobicContact CD2-CG 3.91Å; F280-Y434 AromaticContact CG-CD1 3.95Å; F280-Y434 HydrophobicContact CG-CD1 3.95Å; F280-Y434 HydrophobicContact CG-CE1 4.46Å; F280-Y434 HydrophobicContact CG-CG 4.01Å; F280-Y434 PolarHBondContact O-OH 2.79Å; R281-Y434 HydrophobicContact CG-CE2 4.2Å; L430-Y434 PolarHBondContact O-N 3.45Å; L430-Y434 VanDerWaalsContact O-N 3.14Å; Y431-Y434 HydrophobicContact CD2-CD1 4.08Å; Y431-Y434 HydrophobicContact CE2-CD1 4.05Å; Y431-Y434 HydrophobicContact CE2-CE1 4.43Å; Y431-Y434 PolarHBondContact O-N 2.99Å; Q432-Y434 PolarHBondContact O-N 2.87Å; Y434-Q436 PolarHBondContact O-N 2.84Å; Y434-R437 PolarHBondContact O-N 3.02Å; Y434-K438 PolarHBondContact O-N 3.15Å
435	K	92.7	Very high	77.6	Confident	111 Å²	111	72.3 Å²	72.3	48%	0.483	36%	0.362	S	S	.	.	H	α-helix	trans	-59.6	-43.8	178.6	-82.4	-173.3	160.4	173.6	0	112.5	Y431 Q432 R437 K438 A439	Y431-K435 HydrophobicContact CD1-CD 4.19Å; Y431-K435 HydrophobicContact CE1-CD 3.74Å; Y431-K435 HydrophobicContact CE1-CG 4.28Å; Y431-K435 HydrophobicContact CE2-CG 4.42Å; Y431-K435 PolarHBondContact O-N 3Å; Y431-K435 WeakPolarHBondContact OH-CE 3.27Å; Q432-K435 PolarHBondContact O-N 2.82Å; K435-R437 VanDerWaalsContact C-N 3.34Å; K435-R437 PolarHBondContact O-N 2.98Å; K435-K438 PolarHBondContact O-N 2.85Å; K435-A439 PolarHBondContact O-N 2.88Å
436	Q	89.8	Confident	74.5	Confident	97 Å²	97	73.5 Å²	73.5	45%	0.453	38%	0.379	S	S	.	.	H	α-helix	trans	-61.7	-41.6	179.1	-77.8	172.5	-35.4	0	0	111.9	R216 Q432 Y434 A439	R216-Q436 VanDerWaalsContact NH2-OE1 3.14Å; Q432-Q436 WeakPolarHBondContact O-CG 3.29Å; Q432-Q436 PolarHBondContact O-N 2.82Å; Y434-Q436 PolarHBondContact O-N 2.84Å; Q436-A439 PolarHBondContact O-N 2.82Å
437	R	84.8	Confident	71.8	Confident	17 Å²	17	76.9 Å²	76.9	6%	0.064	41%	0.405	C	S	.	.	H	α-helix	trans	-63.3	-41.3	173.3	-77.1	-146.9	171.5	97.3	9.2	112.7	N232 W234 D251 Y277 N433 Y434 K435	N232-R437 HydrophobicContact CB-CB 4.2Å; N232-R437 PolarHBondContact ND2-O 2.91Å; N232-R437 VanDerWaalsContact O-CD 3.29Å; N232-R437 WeakPolarHBondContact O-CD 3.28Å; N232-R437 WeakPolarHBondContact OD1-CA 3.49Å; N232-R437 WeakPolarHBondContact OD1-CB 3.45Å; N232-R437 WeakPolarHBondContact OD1-CD 3.42Å; N232-R437 WeakPolarHBondContact OD1-CG 3.32Å; N232-R437 PolarHBondContact OD1-O 2.82Å; W234-R437 PolarHBondContact O-NH2 3.32Å; D251-R437 IonicContact OD1-CZ 3.23Å; D251-R437 IonicContact OD1-NH1 3.61Å; D251-R437 PolarHBondContact OD1-NH1 3.26Å; D251-R437 IonicContact OD1-NH2 3.47Å; D251-R437 PolarHBondContact OD1-NH2 3.26Å; D251-R437 IonicContact OD2-CZ 3.83Å; D251-R437 IonicContact OD2-NE 2.97Å; D251-R437 IonicContact OD2-NH1 2.9Å; D251-R437 PolarHBondContact OD2-NH1 2.98Å; D251-R437 IonicContact OD2-NH2 3.63Å; D251-R437 PolarHBondContact OD2-NH2 3.35Å; Y277-R437 HydrophobicContact CE2-CG 4.19Å; Y277-R437 VanDerWaalsContact CZ-NH1 3.3Å; Y277-R437 PolarHBondContact OH-NH1 3.24Å; N433-R437 PolarHBondContact O-N 3.13Å; Y434-R437 PolarHBondContact O-N 3.02Å; K435-R437 VanDerWaalsContact C-N 3.34Å; K435-R437 PolarHBondContact O-N 2.98Å
438	K	79.7	Confident	69.3	Low	134 Å²	134	80.2 Å²	80.2	58%	0.583	43%	0.429	S	S	*	.	H	α-helix	trans	-67.4	-37.9	179.6	-169.4	176.3	179.1	178.1	0	112.6	Y434 K435 L440 L441	Y434-K438 PolarHBondContact O-N 3.15Å; K435-K438 PolarHBondContact O-N 2.85Å; K438-L440 VanDerWaalsContact C-N 3.32Å; K438-L440 PolarHBondContact O-N 2.74Å; K438-L441 PolarHBondContact O-N 3.26Å
439	A	71.6	Confident	66.8	Low	56 Å²	56	86.1 Å²	86.1	46%	0.463	45%	0.446	S	S	.	.	H	α-helix	trans	-65.2	-32.4	-178.6	0	0	0	0	0	113.3	K435 Q436 L441 S442	K435-A439 PolarHBondContact O-N 2.88Å; Q436-A439 PolarHBondContact O-N 2.82Å; A439-L441 VanDerWaalsContact C-N 3.29Å; A439-L441 PolarHBondContact O-N 2.95Å; A439-S442 PolarHBondContact O-N 3.02Å; A439-S442 VanDerWaalsContact O-N 3.13Å; A439-S442 PolarHBondContact O-OG 3.47Å
440	L	59.3	Low	64.3	Low	64 Å²	64	88.8 Å²	88.8	34%	0.335	47%	0.472	S	S	.	.	H	α-helix	trans	-65	-31	176.6	-93.7	147.1	0	0	0	113.1	K438 S442 F444	K438-L440 VanDerWaalsContact C-N 3.32Å; K438-L440 PolarHBondContact O-N 2.74Å; L440-S442 VanDerWaalsContact C-N 3.28Å; L440-S442 PolarHBondContact O-N 3.36Å; L440-F444 HydrophobicContact CD2-CE2 4.4Å
441	L	55.4	Low	61.5	Low	107 Å²	107	91 Å²	91	56%	0.56	49%	0.485	S	S	*	.	H	α-helix	trans	-71.2	-22.6	174.7	-72	162	0	0	0	112.7	N232 K438 A439 H443	N232-L441 WeakPolarHBondContact ND2-CD1 3.34Å; N232-L441 VanDerWaalsContact ND2-CG 3.28Å; N232-L441 WeakPolarHBondContact ND2-CG 3.41Å; K438-L441 PolarHBondContact O-N 3.26Å; A439-L441 VanDerWaalsContact C-N 3.29Å; A439-L441 PolarHBondContact O-N 2.95Å; L441-H443 VanDerWaalsContact C-N 3.31Å; L441-H443 PolarHBondContact O-N 2.98Å
442	S	45.4	Very low	59.2	Low	82 Å²	82	91.8 Å²	91.8	57%	0.573	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-12.7	-179.3	68.1	0	0	0	0	113.8	A439 L440	A439-S442 PolarHBondContact O-N 3.02Å; A439-S442 VanDerWaalsContact O-N 3.13Å; A439-S442 PolarHBondContact O-OG 3.47Å; L440-S442 VanDerWaalsContact C-N 3.28Å; L440-S442 PolarHBondContact O-N 3.36Å
443	H	36.3	Very low	56.8	Low	162 Å²	162	95.6 Å²	95.6	75%	0.75	52%	0.516	S	S	*	.	S	Bend	trans	-126.2	14.4	-174.5	-72.9	10.3	0	0	0	114.4	L441	L441-H443 VanDerWaalsContact C-N 3.31Å; L441-H443 PolarHBondContact O-N 2.98Å
444	F	39.4	Very low	54.6	Low	146 Å²	146	102.7 Å²	102.7	64%	0.64	55%	0.554	S	S	*	*			trans	-95.8	82.7	156.3	-88.2	-88	0	0	0	108.6	L440 A446	L440-F444 HydrophobicContact CD2-CE2 4.4Å; F444-A446 PolarHBondContact O-N 3.46Å
445	S	35.2	Very low	52.6	Low	94 Å²	94	104.9 Å²	104.9	66%	0.657	57%	0.574	S	S	*	*				-48.9	126.5	127.1	178.2	0	0	0	0	103.3
446	A	28.8	Very low	51.4	Low	66 Å²	66	105.9 Å²	105.9	55%	0.545	58%	0.584	S	S	.	*			trans	-40.3	151	169.8	0	0	0	0	0	107.5	F444 V448	F444-A446 PolarHBondContact O-N 3.46Å; A446-V448 PolarHBondContact O-N 3.15Å
447	P	36.1	Very low	50.6	Low	101 Å²	101	105.5 Å²	105.5	66%	0.656	59%	0.588	S	S	*	*			trans	-56.3	89.5	146.6	27.1	-26.8	0	0	0	104	R449	P447-R449 PolarHBondContact O-N 3.43Å
448	V	37.9	Very low	50.3	Low	110 Å²	110	106.7 Å²	106.7	67%	0.667	60%	0.602	S	S	*	*				-42.6	96.5	129.1	-176.7	0	0	0	0	99.2	A446 S450	A446-V448 PolarHBondContact O-N 3.15Å; V448-S450 VanDerWaalsContact C-N 3.26Å; V448-S450 PolarHBondContact O-N 3.36Å
449	R	39	Very low	50.4	Low	203 Å²	203	105.4 Å²	105.4	77%	0.766	60%	0.599	S	S	*	*			trans	-39.3	114.3	161.5	-75.6	-177.9	168.7	145.4	-1.5	101.3	P447 V451	P447-R449 PolarHBondContact O-N 3.43Å; R449-V451 HydrophobicContact CB-CB 4.19Å; R449-V451 HydrophobicContact CB-CG2 3.55Å; R449-V451 PolarHBondContact O-N 3.27Å
450	S	41.7	Very low	50.6	Low	129 Å²	129	104 Å²	104	90%	0.902	58%	0.583	S	S	*	*	S	Bend	trans	-69.5	67.7	174.4	-176.7	0	0	0	0	105.5	V448	V448-S450 VanDerWaalsContact C-N 3.26Å; V448-S450 PolarHBondContact O-N 3.36Å
451	V	37.9	Very low	51.4	Low	48 Å²	48	107.7 Å²	107.7	29%	0.291	60%	0.597	S	S	.	*			trans	-107.6	91.1	168.5	178.2	0	0	0	0	95.3	R449 E453 S455 L456	R449-V451 HydrophobicContact CB-CB 4.19Å; R449-V451 HydrophobicContact CB-CG2 3.55Å; R449-V451 PolarHBondContact O-N 3.27Å; V451-E453 PolarHBondContact O-N 2.91Å; V451-S455 VanDerWaalsContact CG1-C 3.49Å; V451-S455 VanDerWaalsContact CG1-CB 3.44Å; V451-L456 HydrophobicContact CG1-CD2 3.93Å; V451-L456 HydrophobicContact CG1-CG 4.1Å
452	S	45.2	Very low	52	Low	67 Å²	67	106.9 Å²	106.9	47%	0.469	60%	0.601	S	S	.	*			trans	-33.9	138.1	159	159.2	0	0	0	0	107.3	N454 S455	S452-N454 CarbonylContact O-C 3.6Å; S452-N454 PolarHBondContact O-N 3.07Å; S452-N454 VanDerWaalsContact OG-CB 3.31Å; S452-N454 WeakPolarHBondContact OG-CB 3.5Å; S452-N454 PolarHBondContact OG-N 3.44Å; S452-N454 PolarHBondContact OG-OD1 3.31Å; S452-S455 PolarHBondContact O-N 3.21Å
453	E	46.5	Very low	53.2	Low	177 Å²	177	105.2 Å²	105.2	83%	0.827	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-47.1	-22.1	176.7	-77.2	176.9	140.1	0	0	112.3	V451 S455	V451-E453 PolarHBondContact O-N 2.91Å; E453-S455 PolarHBondContact O-N 3.34Å
454	N	48.4	Very low	54.6	Low	153 Å²	153	110 Å²	110	82%	0.818	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-70.4	-3.7	173.7	-55	26.6	0	0	0	115.7	S452	S452-N454 CarbonylContact O-C 3.6Å; S452-N454 PolarHBondContact O-N 3.07Å; S452-N454 VanDerWaalsContact OG-CB 3.31Å; S452-N454 WeakPolarHBondContact OG-CB 3.5Å; S452-N454 PolarHBondContact OG-N 3.44Å; S452-N454 PolarHBondContact OG-OD1 3.31Å
455	S	53.6	Low	56	Low	79 Å²	79	109.3 Å²	109.3	55%	0.552	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-119.6	5.8	-175.9	-175.3	0	0	0	0	113.1	V451 S452 E453	V451-S455 VanDerWaalsContact CG1-C 3.49Å; V451-S455 VanDerWaalsContact CG1-CB 3.44Å; S452-S455 PolarHBondContact O-N 3.21Å; E453-S455 PolarHBondContact O-N 3.34Å
456	L	67.8	Low	57.7	Low	132 Å²	132	106.8 Å²	106.8	69%	0.691	60%	0.598	S	S	*	*			trans	-85.8	130.8	163.4	-63.8	175.9	0	0	0	108.8	V451	V451-L456 HydrophobicContact CG1-CD2 3.93Å; V451-L456 HydrophobicContact CG1-CG 4.1Å
457	V	73	Confident	60.2	Low	88 Å²	88	104.8 Å²	104.8	53%	0.533	58%	0.576	S	S	.	*			trans	-120.5	134.4	176.3	-64.1	0	0	0	0	109.1	M459 V468	V457-M459 HydrophobicContact CG2-CG 4.49Å; V457-V468 HydrophobicContact CB-CG1 3.51Å; V457-V468 HydrophobicContact CG1-CG1 4.18Å; V457-V468 HydrophobicContact CG2-CG1 3.53Å; V457-V468 HydrophobicContact CG2-CG2 4.21Å
458	A	78.2	Confident	62.5	Low	43 Å²	43	101.7 Å²	101.7	36%	0.355	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-65.8	137.4	173.9	0	0	0	0	0	108.8	I469 A475	A458-I469 HydrophobicContact CB-CB 4.03Å; A458-I469 HydrophobicContact CB-CD1 4.14Å; A458-I469 HydrophobicContact CB-CG1 4.4Å; A458-I469 PolarHBondContact O-N 3.12Å; A458-A475 HydrophobicContact CB-CB 3.91Å
459	M	81.1	Confident	64.6	Low	106 Å²	106	97.2 Å²	97.2	52%	0.522	53%	0.527	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	144.2	178.5	-67.8	-156.9	-66.9	0	0	110.7	V457 F461 R467 V468	V457-M459 HydrophobicContact CG2-CG 4.49Å; M459-F461 HydrophobicContact CB-CE2 4.08Å; M459-F461 HydrophobicContact CB-CZ 4.27Å; M459-F461 HydrophobicContact CE-CE2 4.23Å; M459-F461 HydrophobicContact CE-CZ 3.66Å; M459-F461 HydrophobicContact SD-CZ 4.41Å; M459-R467 CarbonylContact C-O 3.55Å; M459-R467 VanDerWaalsContact CA-O 3.29Å; M459-R467 WeakPolarHBondContact CA-O 3.24Å; M459-V468 HydrophobicContact CG-CG2 4.2Å; M459-V468 HydrophobicContact SD-CG2 4.27Å
460	D	75.6	Confident	66.3	Low	26 Å²	26	92.4 Å²	92.4	14%	0.139	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	120.7	178.5	175.7	17.2	0	0	0	110	S462 G466 R467 I469	D460-S462 VanDerWaalsContact CG-OG 3.24Å; D460-S462 WeakPolarHBondContact OD1-CB 3.4Å; D460-S462 PolarHBondContact OD1-N 3.41Å; D460-S462 PolarHBondContact OD1-OG 2.96Å; D460-S462 PolarHBondContact OD2-OG 2.84Å; D460-S462 VanDerWaalsContact OD2-OG 3.13Å; D460-G466 WeakPolarHBondContact O-CA 3.4Å; D460-R467 HydrophobicContact CB-CG 3.85Å; D460-R467 PolarHBondContact N-O 3.15Å; D460-R467 PolarHBondContact O-N 3.33Å; D460-R467 IonicContact OD2-CZ 2.69Å; D460-R467 IonicContact OD2-NE 2.63Å; D460-R467 PolarHBondContact OD2-NE 2.96Å; D460-R467 IonicContact OD2-NH2 3.72Å; D460-R467 PolarHBondContact OD2-NH2 3.15Å; D460-I469 HydrophobicContact CB-CD1 3.95Å; D460-I469 HydrophobicContact CB-CG1 3.88Å
461	F	76.1	Confident	68.2	Low	143 Å²	143	88.4 Å²	88.4	63%	0.627	49%	0.486	S	S	*	.			trans	-107.9	10.3	176.8	-60	-78.5	0	0	0	113.1	M459 G463	M459-F461 HydrophobicContact CB-CE2 4.08Å; M459-F461 HydrophobicContact CB-CZ 4.27Å; M459-F461 HydrophobicContact CE-CE2 4.23Å; M459-F461 HydrophobicContact CE-CZ 3.66Å; M459-F461 HydrophobicContact SD-CZ 4.41Å; F461-G463 PolarHBondContact O-N 3.46Å; F461-G463 VanDerWaalsContact O-N 3.16Å
462	S	69.8	Low	70	Confident	90 Å²	90	91 Å²	91	63%	0.629	50%	0.503	S	S	*	.	S	Bend	trans	-66.1	-13.6	179.9	64.8	0	0	0	0	113.8	D460	D460-S462 VanDerWaalsContact CG-OG 3.24Å; D460-S462 WeakPolarHBondContact OD1-CB 3.4Å; D460-S462 PolarHBondContact OD1-N 3.41Å; D460-S462 PolarHBondContact OD1-OG 2.96Å; D460-S462 PolarHBondContact OD2-OG 2.84Å; D460-S462 VanDerWaalsContact OD2-OG 3.13Å
463	G	68.9	Low	71.7	Confident	47 Å²	47	91.3 Å²	91.3	49%	0.485	50%	0.502	S	S	.	.	S	Bend	trans	-99.3	177.2	173.5	0	0	0	0	0	114	F461 I465	F461-G463 PolarHBondContact O-N 3.46Å; F461-G463 VanDerWaalsContact O-N 3.16Å; G463-I465 PolarHBondContact O-N 3.07Å
464	R	65.8	Low	73.5	Confident	262 Å²	262	83.9 Å²	83.9	99%	0.989	47%	0.468	S	S	*	.	S	Bend	trans	-67.6	-16.3	175.7	-68.8	-173.9	-178.8	-171.8	0.5	114.1
465	I	68.8	Low	75.1	Confident	132 Å²	132	77.7 Å²	77.7	68%	0.677	44%	0.438	S	S	*	.	S	Bend	trans	-132.9	125.8	179.9	-59	174.5	0	0	0	106.2	G463	G463-I465 PolarHBondContact O-N 3.07Å
466	G	71.3	Confident	76.2	Confident	40 Å²	40	79.9 Å²	79.9	41%	0.412	44%	0.439	S	S	.	.			trans	-63	137.3	176.1	0	0	0	0	0	110.8	D460	D460-G466 WeakPolarHBondContact O-CA 3.4Å
467	R	81.7	Confident	76.9	Confident	24 Å²	24	76.1 Å²	76.1	9%	0.091	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	155.1	178	67.7	177.1	179.5	117.5	8.6	111	S136 P138 M459 D460 E474	S136-R467 PolarHBondContact O-NH1 2.75Å; S136-R467 PolarHBondContact OG-NH1 3.15Å; P138-R467 HydrophobicContact CB-CB 4.42Å; M459-R467 CarbonylContact C-O 3.55Å; M459-R467 VanDerWaalsContact CA-O 3.29Å; M459-R467 WeakPolarHBondContact CA-O 3.24Å; D460-R467 HydrophobicContact CB-CG 3.85Å; D460-R467 PolarHBondContact N-O 3.15Å; D460-R467 PolarHBondContact O-N 3.33Å; D460-R467 IonicContact OD2-CZ 2.69Å; D460-R467 IonicContact OD2-NE 2.63Å; D460-R467 PolarHBondContact OD2-NE 2.96Å; D460-R467 IonicContact OD2-NH2 3.72Å; D460-R467 PolarHBondContact OD2-NH2 3.15Å; R467-E474 IonicContact CZ-OE1 2.8Å; R467-E474 VanDerWaalsContact CZ-OE1 3.23Å; R467-E474 IonicContact NH1-OE1 3.31Å; R467-E474 PolarHBondContact NH1-OE1 3.13Å; R467-E474 IonicContact NH1-OE2 3.8Å; R467-E474 IonicContact NH2-OE1 2.63Å; R467-E474 PolarHBondContact NH2-OE1 3.42Å
468	V	83.2	Confident	77.2	Confident	37 Å²	37	73.6 Å²	73.6	22%	0.224	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	135.7	170.2	-177.1	0	0	0	0	109	V457 M459 D470	V457-V468 HydrophobicContact CB-CG1 3.51Å; V457-V468 HydrophobicContact CG1-CG1 4.18Å; V457-V468 HydrophobicContact CG2-CG1 3.53Å; V457-V468 HydrophobicContact CG2-CG2 4.21Å; M459-V468 HydrophobicContact CG-CG2 4.2Å; M459-V468 HydrophobicContact SD-CG2 4.27Å; V468-D470 WeakPolarHBondContact CG1-OD1 3.23Å; V468-D470 PolarHBondContact O-N 3.31Å
469	I	82.4	Confident	77.1	Confident	15 Å²	15	74.4 Å²	74.4	8%	0.077	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	93.8	176	-51	177	0	0	0	108.2	A458 D460 E474 A475 A478	A458-I469 HydrophobicContact CB-CB 4.03Å; A458-I469 HydrophobicContact CB-CD1 4.14Å; A458-I469 HydrophobicContact CB-CG1 4.4Å; A458-I469 PolarHBondContact O-N 3.12Å; D460-I469 HydrophobicContact CB-CD1 3.95Å; D460-I469 HydrophobicContact CB-CG1 3.88Å; I469-E474 HydrophobicContact CG2-CB 3.73Å; I469-E474 HydrophobicContact CG2-CG 3.64Å; I469-A475 HydrophobicContact CG2-CB 3.93Å; I469-A478 HydrophobicContact CD1-CB 4.19Å
470	D	76.3	Confident	77	Confident	102 Å²	102	73.6 Å²	73.6	55%	0.545	42%	0.417	S	S	.	.			trans	-80.2	-21.8	-178.5	-60.9	-37.1	0	0	0	113	V468 P472	V468-D470 WeakPolarHBondContact CG1-OD1 3.23Å; V468-D470 PolarHBondContact O-N 3.31Å; D470-P472 WeakPolarHBondContact O-CD 3.44Å
471	N	80.6	Confident	77.1	Confident	46 Å²	46	78.8 Å²	78.8	25%	0.246	44%	0.44	C	S	.	.			trans	-81.2	116.4	-178.6	178	-9.8	0	0	0	110.1	V473 E474 A475	N471-V473 VanDerWaalsContact C-N 3.27Å; N471-V473 PolarHBondContact O-N 3.06Å; N471-V473 PolarHBondContact OD1-N 3.04Å; N471-E474 HydrophobicContact CB-CB 3.77Å; N471-E474 WeakPolarHBondContact O-CB 3.29Å; N471-E474 PolarHBondContact O-N 3.19Å; N471-E474 VanDerWaalsContact O-N 3.08Å; N471-E474 PolarHBondContact OD1-N 3.19Å; N471-A475 PolarHBondContact O-N 3.22Å
472	P	76.9	Confident	76.8	Confident	101 Å²	101	77.6 Å²	77.6	66%	0.656	44%	0.436	S	S	*	.	H	α-helix	trans	-63.6	-30.6	-175.8	24.9	-34	0	0	0	113.1	D470 Q476	D470-P472 WeakPolarHBondContact O-CD 3.44Å; P472-Q476 WeakPolarHBondContact O-CB 3.36Å; P472-Q476 PolarHBondContact O-N 3.29Å
473	V	80.8	Confident	76.8	Confident	75 Å²	75	74.5 Å²	74.5	46%	0.455	42%	0.418	S	S	.	.	H	α-helix	trans	-73.5	-36.1	177.1	-174.2	0	0	0	0	110.7	L133 N471 S477	L133-V473 HydrophobicContact CD2-CB 4.28Å; L133-V473 HydrophobicContact CD2-CG1 3.97Å; N471-V473 VanDerWaalsContact C-N 3.27Å; N471-V473 PolarHBondContact O-N 3.06Å; N471-V473 PolarHBondContact OD1-N 3.04Å; V473-S477 VanDerWaalsContact O-CB 3.29Å; V473-S477 WeakPolarHBondContact O-CB 3.42Å; V473-S477 PolarHBondContact O-N 3.24Å; V473-S477 PolarHBondContact O-OG 2.99Å
474	E	84.2	Confident	76.8	Confident	20 Å²	20	77.1 Å²	77.1	9%	0.093	42%	0.418	C	S	.	.	H	α-helix	trans	-66.7	-44.2	173.4	-172.8	-178.3	-175.2	0	0	110.5	S136 R467 I469 N471 S477 A478	S136-E474 PolarHBondContact N-OE2 3.47Å; S136-E474 PolarHBondContact OG-OE2 3.25Å; R467-E474 IonicContact CZ-OE1 2.8Å; R467-E474 VanDerWaalsContact CZ-OE1 3.23Å; R467-E474 IonicContact NH1-OE1 3.31Å; R467-E474 PolarHBondContact NH1-OE1 3.13Å; R467-E474 IonicContact NH1-OE2 3.8Å; R467-E474 IonicContact NH2-OE1 2.63Å; R467-E474 PolarHBondContact NH2-OE1 3.42Å; I469-E474 HydrophobicContact CG2-CB 3.73Å; I469-E474 HydrophobicContact CG2-CG 3.64Å; N471-E474 HydrophobicContact CB-CB 3.77Å; N471-E474 WeakPolarHBondContact O-CB 3.29Å; N471-E474 PolarHBondContact O-N 3.19Å; N471-E474 VanDerWaalsContact O-N 3.08Å; N471-E474 PolarHBondContact OD1-N 3.19Å; E474-S477 PolarHBondContact O-N 3.49Å; E474-A478 WeakPolarHBondContact O-CB 3.41Å; E474-A478 PolarHBondContact O-N 2.94Å
475	A	81.1	Confident	76.5	Confident	23 Å²	23	70.1 Å²	70.1	19%	0.19	40%	0.398	C	S	.	.	H	α-helix	trans	-63	-43.9	177.2	0	0	0	0	0	111.9	A458 I469 N471 A478 A479	A458-A475 HydrophobicContact CB-CB 3.91Å; I469-A475 HydrophobicContact CG2-CB 3.93Å; N471-A475 PolarHBondContact O-N 3.22Å; A475-A478 PolarHBondContact O-N 2.83Å; A475-A479 WeakPolarHBondContact O-CB 3.26Å; A475-A479 PolarHBondContact O-N 3.49Å
476	Q	77.8	Confident	75.6	Confident	126 Å²	126	72.2 Å²	72.2	59%	0.589	40%	0.397	S	S	*	.	H	α-helix	trans	-65.5	-39.7	175.9	-171.5	178.3	29.5	0	0	111.8	P472 A479 L480	P472-Q476 WeakPolarHBondContact O-CB 3.36Å; P472-Q476 PolarHBondContact O-N 3.29Å; Q476-A479 PolarHBondContact O-N 3.33Å; Q476-L480 HydrophobicContact CG-CD1 4.19Å; Q476-L480 WeakPolarHBondContact O-CB 3.18Å; Q476-L480 VanDerWaalsContact O-CG 3.32Å; Q476-L480 WeakPolarHBondContact O-CG 3.46Å; Q476-L480 PolarHBondContact O-N 3.43Å
477	S	81.1	Confident	75.2	Confident	52 Å²	52	76.7 Å²	76.7	36%	0.364	40%	0.401	S	S	.	.	H	α-helix	trans	-65.5	-42.9	176.3	-59.6	0	0	0	0	111.3	V473 E474 L480 E481	V473-S477 VanDerWaalsContact O-CB 3.29Å; V473-S477 WeakPolarHBondContact O-CB 3.42Å; V473-S477 PolarHBondContact O-N 3.24Å; V473-S477 PolarHBondContact O-OG 2.99Å; E474-S477 PolarHBondContact O-N 3.49Å; S477-L480 PolarHBondContact O-N 2.92Å; S477-E481 VanDerWaalsContact O-CB 3.26Å; S477-E481 WeakPolarHBondContact O-CB 3.37Å; S477-E481 PolarHBondContact O-N 2.97Å
478	A	78.9	Confident	73.7	Confident	36 Å²	36	82 Å²	82	30%	0.298	43%	0.425	S	S	.	.	H	α-helix	trans	-63.7	-42.3	175.5	0	0	0	0	0	111.7	I469 E474 A475 E481 E482	I469-A478 HydrophobicContact CD1-CB 4.19Å; E474-A478 WeakPolarHBondContact O-CB 3.41Å; E474-A478 PolarHBondContact O-N 2.94Å; A475-A478 PolarHBondContact O-N 2.83Å; A478-E481 PolarHBondContact O-N 2.9Å; A478-E482 VanDerWaalsContact O-CB 3.25Å; A478-E482 WeakPolarHBondContact O-CB 3.5Å; A478-E482 PolarHBondContact O-N 2.87Å
479	A	77.2	Confident	72.3	Confident	60 Å²	60	87.9 Å²	87.9	50%	0.496	44%	0.444	S	S	.	.	H	α-helix	trans	-66.3	-38.9	175.9	0	0	0	0	0	112.4	A475 Q476 G483	A475-A479 WeakPolarHBondContact O-CB 3.26Å; A475-A479 PolarHBondContact O-N 3.49Å; Q476-A479 PolarHBondContact O-N 3.33Å; A479-G483 PolarHBondContact O-N 3.09Å
480	L	77.9	Confident	70.5	Confident	89 Å²	89	93.4 Å²	93.4	47%	0.466	47%	0.473	S	S	.	.	H	α-helix	trans	-67.1	-46	174.1	-79.3	170.7	0	0	0	111	Q476 S477 G483 H484	Q476-L480 HydrophobicContact CG-CD1 4.19Å; Q476-L480 WeakPolarHBondContact O-CB 3.18Å; Q476-L480 VanDerWaalsContact O-CG 3.32Å; Q476-L480 WeakPolarHBondContact O-CG 3.46Å; Q476-L480 PolarHBondContact O-N 3.43Å; S477-L480 PolarHBondContact O-N 2.92Å; L480-G483 CarbonylContact O-C 3.6Å; L480-G483 PolarHBondContact O-N 3.5Å; L480-H484 VanDerWaalsContact O-CB 3.3Å; L480-H484 WeakPolarHBondContact O-CB 3.33Å; L480-H484 PolarHBondContact O-CD2 3.5Å; L480-H484 PolarHBondContact O-N 3.3Å
481	E	77.5	Confident	69	Low	134 Å²	134	98.2 Å²	98.2	63%	0.626	48%	0.484	S	S	*	.	H	α-helix	trans	-61	-45.9	177.1	-174.8	175.1	-172.1	0	0	111	S477 A478 H484 M485	S477-E481 VanDerWaalsContact O-CB 3.26Å; S477-E481 WeakPolarHBondContact O-CB 3.37Å; S477-E481 PolarHBondContact O-N 2.97Å; A478-E481 PolarHBondContact O-N 2.9Å; E481-H484 CarbonylContact O-C 3.55Å; E481-H484 PolarHBondContact O-N 3.04Å; E481-M485 WeakPolarHBondContact O-CB 3.28Å; E481-M485 VanDerWaalsContact O-CG 3.25Å; E481-M485 WeakPolarHBondContact O-CG 3.44Å; E481-M485 PolarHBondContact O-N 2.96Å
482	E	71.5	Confident	67.2	Low	119 Å²	119	99.7 Å²	99.7	56%	0.556	49%	0.494	S	S	*	.	H	α-helix	trans	-59.7	-50.1	172.2	-176.7	172	-171.5	0	0	110.4	A478 H484 M485 W486	A478-E482 VanDerWaalsContact O-CB 3.25Å; A478-E482 WeakPolarHBondContact O-CB 3.5Å; A478-E482 PolarHBondContact O-N 2.87Å; E482-H484 VanDerWaalsContact C-N 3.27Å; E482-H484 PolarHBondContact O-N 3.48Å; E482-M485 CarbonylContact O-C 3.58Å; E482-M485 WeakPolarHBondContact O-CA 3.42Å; E482-M485 WeakPolarHBondContact O-CB 3.05Å; E482-M485 PolarHBondContact O-N 2.73Å; E482-W486 WeakPolarHBondContact O-CB 3.46Å; E482-W486 PolarHBondContact O-N 3.13Å; E482-W486 PolarHBondContact OE1-NE1 2.91Å
483	G	68.6	Low	65.8	Low	24 Å²	24	100 Å²	100	25%	0.247	49%	0.49	C	S	.	.	H	α-helix	trans	-61.8	-30.8	177.1	0	0	0	0	0	114	A479 L480 R487	A479-G483 PolarHBondContact O-N 3.09Å; L480-G483 CarbonylContact O-C 3.6Å; L480-G483 PolarHBondContact O-N 3.5Å; G483-R487 WeakPolarHBondContact O-CB 3.24Å; G483-R487 WeakPolarHBondContact O-CG 3.41Å; G483-R487 PolarHBondContact O-N 3.16Å; G483-R487 VanDerWaalsContact O-N 3.09Å; G483-R487 PolarHBondContact O-NE 3.39Å
484	H	68.4	Low	64	Low	102 Å²	102	100 Å²	100	47%	0.472	50%	0.498	S	S	.	.	H	α-helix	trans	-76	-36.4	172.7	-83.2	-73.3	0	0	0	111.5	L480 E481 E482 R487 K488	L480-H484 VanDerWaalsContact O-CB 3.3Å; L480-H484 WeakPolarHBondContact O-CB 3.33Å; L480-H484 PolarHBondContact O-CD2 3.5Å; L480-H484 PolarHBondContact O-N 3.3Å; E481-H484 CarbonylContact O-C 3.55Å; E481-H484 PolarHBondContact O-N 3.04Å; E482-H484 VanDerWaalsContact C-N 3.27Å; E482-H484 PolarHBondContact O-N 3.48Å; H484-R487 PolarHBondContact CD2-NH2 2.99Å; H484-R487 PolarHBondContact CE1-NH1 3.41Å; H484-R487 VanDerWaalsContact CE1-NH1 3.31Å; H484-R487 PolarHBondContact CE1-NH2 3.49Å; H484-R487 VanDerWaalsContact CE1-NH2 3.29Å; H484-R487 PolarHBondContact ND1-NH2 3.43Å; H484-R487 PolarHBondContact NE2-NH2 2.89Å; H484-R487 CarbonylContact O-C 3.57Å; H484-R487 PolarHBondContact O-N 3.07Å; H484-K488 WeakPolarHBondContact O-CB 3.48Å; H484-K488 PolarHBondContact O-N 3.44Å
485	M	59.9	Low	61.9	Low	116 Å²	116	106 Å²	106	57%	0.571	53%	0.53	S	S	*	.	H	α-helix	trans	-67.6	-40.2	172.5	-77.1	-69.1	-73.1	0	0	111.6	E481 E482 K488 R489	E481-M485 WeakPolarHBondContact O-CB 3.28Å; E481-M485 VanDerWaalsContact O-CG 3.25Å; E481-M485 WeakPolarHBondContact O-CG 3.44Å; E481-M485 PolarHBondContact O-N 2.96Å; E482-M485 CarbonylContact O-C 3.58Å; E482-M485 WeakPolarHBondContact O-CA 3.42Å; E482-M485 WeakPolarHBondContact O-CB 3.05Å; E482-M485 PolarHBondContact O-N 2.73Å; M485-K488 PolarHBondContact O-N 2.85Å; M485-R489 VanDerWaalsContact O-CB 3.26Å; M485-R489 WeakPolarHBondContact O-CB 3.48Å; M485-R489 PolarHBondContact O-N 3.39Å
486	W	50.3	Low	60	Low	175 Å²	175	108.9 Å²	108.9	66%	0.663	56%	0.562	S	S	*	*	H	α-helix	trans	-60	-46.6	170.5	-87.2	77.9	0	0	0	110.9	E482 R489 N490	E482-W486 WeakPolarHBondContact O-CB 3.46Å; E482-W486 PolarHBondContact O-N 3.13Å; E482-W486 PolarHBondContact OE1-NE1 2.91Å; W486-R489 PolarHBondContact O-N 2.86Å; W486-N490 PolarHBondContact O-N 3.13Å; W486-N490 VanDerWaalsContact O-N 3.14Å
487	R	62.7	Low	57.8	Low	134 Å²	134	107.7 Å²	107.7	51%	0.506	57%	0.568	S	S	.	*	H	α-helix	trans	-66.9	-35.2	175.2	-80.1	177.2	-77.2	153.6	-3.1	113.3	G483 H484 N490 R491	G483-R487 WeakPolarHBondContact O-CB 3.24Å; G483-R487 WeakPolarHBondContact O-CG 3.41Å; G483-R487 PolarHBondContact O-N 3.16Å; G483-R487 VanDerWaalsContact O-N 3.09Å; G483-R487 PolarHBondContact O-NE 3.39Å; H484-R487 PolarHBondContact CD2-NH2 2.99Å; H484-R487 PolarHBondContact CE1-NH1 3.41Å; H484-R487 VanDerWaalsContact CE1-NH1 3.31Å; H484-R487 PolarHBondContact CE1-NH2 3.49Å; H484-R487 VanDerWaalsContact CE1-NH2 3.29Å; H484-R487 PolarHBondContact ND1-NH2 3.43Å; H484-R487 PolarHBondContact NE2-NH2 2.89Å; H484-R487 CarbonylContact O-C 3.57Å; H484-R487 PolarHBondContact O-N 3.07Å; R487-N490 PolarHBondContact O-N 3.39Å; R487-R491 PolarHBondContact O-N 3.29Å; R487-R491 VanDerWaalsContact O-N 3.08Å
488	K	51.4	Low	55.8	Low	135 Å²	135	113.7 Å²	113.7	59%	0.587	59%	0.59	S	S	*	*	H	α-helix	trans	-72.5	-36.9	176.4	-169.2	175.7	-179.6	-176.9	0	110.9	H484 M485 N490 R491 V492	H484-K488 WeakPolarHBondContact O-CB 3.48Å; H484-K488 PolarHBondContact O-N 3.44Å; M485-K488 PolarHBondContact O-N 2.85Å; K488-N490 VanDerWaalsContact C-N 3.27Å; K488-N490 PolarHBondContact O-N 3.27Å; K488-R491 CarbonylContact O-C 3.53Å; K488-R491 PolarHBondContact O-N 3.28Å; K488-V492 HydrophobicContact CG-CG2 3.77Å; K488-V492 WeakPolarHBondContact O-CB 3.31Å; K488-V492 WeakPolarHBondContact O-CG2 3.5Å; K488-V492 PolarHBondContact O-N 3.38Å
489	R	52.8	Low	53.5	Low	162 Å²	162	117.3 Å²	117.3	61%	0.611	61%	0.613	S	S	*	*	H	α-helix	trans	-62.3	-34.9	172.6	-162	167.1	-174.2	154	0.9	111.7	M485 W486 N507	M485-R489 VanDerWaalsContact O-CB 3.26Å; M485-R489 WeakPolarHBondContact O-CB 3.48Å; M485-R489 PolarHBondContact O-N 3.39Å; W486-R489 PolarHBondContact O-N 2.86Å; R489-N507 PolarHBondContact NH2-ND2 3.41Å
490	N	45.4	Very low	51.9	Low	131 Å²	131	119.8 Å²	119.8	70%	0.701	62%	0.624	S	S	*	*	H	α-helix	trans	-76.1	-21.1	171	-78.4	5	0	0	0	114.3	W486 R487 K488	W486-N490 PolarHBondContact O-N 3.13Å; W486-N490 VanDerWaalsContact O-N 3.14Å; R487-N490 PolarHBondContact O-N 3.39Å; K488-N490 VanDerWaalsContact C-N 3.27Å; K488-N490 PolarHBondContact O-N 3.27Å
491	R	43.9	Very low	49.9	Very low	203 Å²	203	122.7 Å²	122.7	77%	0.766	64%	0.639	S	S	*	*	H	α-helix	trans	-98.8	-23.9	179.5	-91.7	-171.4	161.5	-160	-4.4	115.1	R487 K488 N493 A494	R487-R491 PolarHBondContact O-N 3.29Å; R487-R491 VanDerWaalsContact O-N 3.08Å; K488-R491 CarbonylContact O-C 3.53Å; K488-R491 PolarHBondContact O-N 3.28Å; R491-N493 PolarHBondContact O-N 3.04Å; R491-A494 PolarHBondContact O-N 3.34Å
492	V	43.6	Very low	48	Very low	76 Å²	76	124.6 Å²	124.6	46%	0.461	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.3	-16.7	175	173.7	0	0	0	0	110.9	K488 A494	K488-V492 HydrophobicContact CG-CG2 3.77Å; K488-V492 WeakPolarHBondContact O-CB 3.31Å; K488-V492 WeakPolarHBondContact O-CG2 3.5Å; K488-V492 PolarHBondContact O-N 3.38Å; V492-A494 VanDerWaalsContact C-N 3.28Å; V492-A494 PolarHBondContact O-N 3.12Å
493	N	46.8	Very low	46.3	Very low	108 Å²	108	127.3 Å²	127.3	58%	0.578	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	0.1	168.2	-78.1	22.4	0	0	0	114.3	R491 Q575	R491-N493 PolarHBondContact O-N 3.04Å; N493-Q575 PolarHBondContact ND2-OE1 3.33Å
494	A	42	Very low	44.8	Very low	75 Å²	75	129.2 Å²	129.2	62%	0.62	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.4	-18.4	-179.7	0	0	0	0	0	114.5	R491 V492	R491-A494 PolarHBondContact O-N 3.34Å; V492-A494 VanDerWaalsContact C-N 3.28Å; V492-A494 PolarHBondContact O-N 3.12Å
495	L	40.8	Very low	43.5	Very low	145 Å²	145	129 Å²	129	76%	0.759	68%	0.68	S	S	*	*	S	Bend	trans	-137.9	111.1	172.4	-93.9	95	0	0	0	109.9	S497	L495-S497 PolarHBondContact O-N 2.87Å
496	G	42.6	Very low	42.6	Very low	84 Å²	84	130 Å²	130	87%	0.866	69%	0.687	S	S	*	*			trans	-55.2	104.7	-179.1	0	0	0	0	0	113.3
497	S	30.6	Very low	42.5	Very low	102 Å²	102	125.6 Å²	125.6	71%	0.713	68%	0.676	S	S	*	*			trans	-136.7	100.9	159.8	-167.4	0	0	0	0	108.5	L495 S499	L495-S497 PolarHBondContact O-N 2.87Å; S497-S499 PolarHBondContact O-N 2.86Å
498	H	39	Very low	41.9	Very low	178 Å²	178	123.1 Å²	123.1	82%	0.824	68%	0.679	S	S	*	*			trans	-65.1	124.5	174.4	-67.5	-81.5	0	0	0	110.1
499	S	31.5	Very low	42.7	Very low	112 Å²	112	120.1 Å²	120.1	78%	0.783	67%	0.672	S	S	*	*			trans	-114.4	111.5	152.7	-163.2	0	0	0	0	107.6	S497 L501	S497-S499 PolarHBondContact O-N 2.86Å; S499-L501 PolarHBondContact O-N 3.49Å
500	P	43.2	Very low	44	Very low	111 Å²	111	116.2 Å²	116.2	72%	0.721	66%	0.662	S	S	*	*			trans	-92	76.6	-169.8	34.9	-31.7	0	0	0	109.8
501	L	35.7	Very low	45.7	Very low	150 Å²	150	111.1 Å²	111.1	79%	0.785	64%	0.635	S	S	*	*	S	Bend	trans	-156	113.2	160.9	-90.2	124.2	0	0	0	110.5	S499	S499-L501 PolarHBondContact O-N 3.49Å
502	H	37.7	Very low	47.8	Very low	175 Å²	175	106.2 Å²	106.2	81%	0.81	62%	0.622	S	S	*	*			trans	62.2	72.4	166.6	-74.4	-80.8	0	0	0	117.7	S504	H502-S504 PolarHBondContact O-N 3.2Å
503	Q	35.4	Very low	49.8	Very low	176 Å²	176	106.6 Å²	106.6	82%	0.822	63%	0.634	S	S	*	*			trans	-69.5	109.5	146.6	-145.3	161.7	9.6	0	0	106.7	S505	Q503-S505 PolarHBondContact O-N 3.42Å; Q503-S505 VanDerWaalsContact O-N 3.16Å
504	S	36.2	Very low	51.9	Low	63 Å²	63	104.4 Å²	104.4	44%	0.441	62%	0.62	S	S	.	*			trans	-58.4	118.8	-173.1	46	0	0	0	0	111.2	H502 L506 N507	H502-S504 PolarHBondContact O-N 3.2Å; S504-L506 PolarHBondContact O-N 2.84Å; S504-N507 PolarHBondContact O-N 3.36Å
505	S	41.8	Very low	54.2	Low	98 Å²	98	106.2 Å²	106.2	69%	0.685	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	9.8	172.7	40.1	0	0	0	0	114.8	Q503 S508	Q503-S505 PolarHBondContact O-N 3.42Å; Q503-S505 VanDerWaalsContact O-N 3.16Å; S505-S508 PolarHBondContact O-OG 2.86Å
506	L	41.3	Very low	56.7	Low	137 Å²	137	100 Å²	100	72%	0.717	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-25.9	178.2	-69.6	169.2	0	0	0	112.7	S504 S508	S504-L506 PolarHBondContact O-N 2.84Å; L506-S508 VanDerWaalsContact C-N 3.32Å; L506-S508 PolarHBondContact O-N 3.03Å
507	N	47.1	Very low	59.2	Low	82 Å²	82	97.2 Å²	97.2	44%	0.439	55%	0.549	S	S	.	.	G	3₁₀ helix	trans	-72.9	-23	-178.2	-81.8	6.4	0	0	0	113.5	R489 S504 V509	R489-N507 PolarHBondContact NH2-ND2 3.41Å; S504-N507 PolarHBondContact O-N 3.36Å; N507-V509 VanDerWaalsContact C-N 3.26Å; N507-V509 PolarHBondContact O-N 3.01Å
508	S	51.8	Low	62.1	Low	82 Å²	82	94.1 Å²	94.1	57%	0.573	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-78.5	-2.1	-175.2	55	0	0	0	0	114.7	S505 L506 H511	S505-S508 PolarHBondContact O-OG 2.86Å; L506-S508 VanDerWaalsContact C-N 3.32Å; L506-S508 PolarHBondContact O-N 3.03Å; S508-H511 PolarHBondContact O-CE1 3.43Å; S508-H511 PolarHBondContact O-ND1 2.87Å
509	V	67.1	Low	64.7	Low	73 Å²	73	86.3 Å²	86.3	44%	0.442	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-123.4	-3.2	-170.6	-162.7	0	0	0	0	113.1	N507 H511 I512	N507-V509 VanDerWaalsContact C-N 3.26Å; N507-V509 PolarHBondContact O-N 3.01Å; V509-H511 PolarHBondContact O-N 3.39Å; V509-H511 VanDerWaalsContact O-N 3.15Å; V509-I512 HydrophobicContact CG1-CB 4.28Å; V509-I512 HydrophobicContact CG1-CD1 3.31Å; V509-I512 HydrophobicContact CG1-CG1 3.75Å; V509-I512 WeakPolarHBondContact O-CB 3.4Å; V509-I512 WeakPolarHBondContact O-CG1 3.33Å; V509-I512 PolarHBondContact O-N 3.02Å
510	I	80.2	Confident	67.5	Low	79 Å²	79	91.2 Å²	91.2	41%	0.405	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-63	-29.2	-174.5	-53.4	173.7	0	0	0	111.8	I512 A513 I591	I510-I512 PolarHBondContact O-N 3.43Å; I510-I512 VanDerWaalsContact O-N 3.15Å; I510-A513 PolarHBondContact O-N 3.04Å; I510-I591 HydrophobicContact CB-CD1 4.01Å; I510-I591 HydrophobicContact CG2-CD1 3.73Å
511	H	82.1	Confident	70	Confident	25 Å²	25	87.2 Å²	87.2	12%	0.116	46%	0.464	C	S	.	.	G	3₁₀ helix	trans	-59.7	-23.9	175.3	67.6	-94.1	0	0	0	113.1	S508 V509 A513 Q514 W516 F517 L590 I591	S508-H511 PolarHBondContact O-CE1 3.43Å; S508-H511 PolarHBondContact O-ND1 2.87Å; V509-H511 PolarHBondContact O-N 3.39Å; V509-H511 VanDerWaalsContact O-N 3.15Å; H511-A513 PolarHBondContact O-N 3.43Å; H511-Q514 VanDerWaalsContact O-CB 3.26Å; H511-Q514 WeakPolarHBondContact O-CB 3.48Å; H511-Q514 WeakPolarHBondContact O-CG 3.26Å; H511-Q514 PolarHBondContact O-N 3.35Å; H511-W516 HydrophobicContact CB-CH2 4.13Å; H511-F517 AromaticContact CD2-CD1 4Å; H511-F517 AromaticContact CD2-CD2 3.8Å; H511-F517 AromaticContact CD2-CE1 3.77Å; H511-F517 AromaticContact CD2-CE2 3.57Å; H511-F517 AromaticContact CD2-CG 3.99Å; H511-F517 AromaticContact CD2-CZ 3.54Å; H511-F517 AromaticContact NE2-CE2 3.99Å; H511-F517 AromaticContact NE2-CZ 3.64Å; H511-F517 VanDerWaalsContact O-CB 3.26Å; H511-F517 WeakPolarHBondContact O-CB 3.28Å; H511-L590 HydrophobicContact CB-CB 4.16Å; H511-L590 HydrophobicContact CB-CD1 4.22Å; H511-I591 HydrophobicContact CB-CG1 4.46Å
512	I	86.9	Confident	72.8	Confident	99 Å²	99	82.6 Å²	82.6	51%	0.508	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-65.8	-27.2	177.4	-57.5	-166.3	0	0	0	111.6	V509 I510 Q514 F517	V509-I512 HydrophobicContact CG1-CB 4.28Å; V509-I512 HydrophobicContact CG1-CD1 3.31Å; V509-I512 HydrophobicContact CG1-CG1 3.75Å; V509-I512 WeakPolarHBondContact O-CB 3.4Å; V509-I512 WeakPolarHBondContact O-CG1 3.33Å; V509-I512 PolarHBondContact O-N 3.02Å; I510-I512 PolarHBondContact O-N 3.43Å; I510-I512 VanDerWaalsContact O-N 3.15Å; I512-Q514 PolarHBondContact O-N 3.43Å; I512-F517 HydrophobicContact CB-CD1 4.49Å; I512-F517 HydrophobicContact CG1-CD1 4.38Å; I512-F517 HydrophobicContact CG1-CE1 3.96Å
513	A	86.9	Confident	75.6	Confident	85 Å²	85	80.3 Å²	80.3	70%	0.702	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-80.6	-4.3	175.7	0	0	0	0	0	113.2	I510 H511	I510-A513 PolarHBondContact O-N 3.04Å; H511-A513 PolarHBondContact O-N 3.43Å
514	Q	90.6	Very high	78.5	Confident	61 Å²	61	78.1 Å²	78.1	29%	0.285	42%	0.416	S	S	.	.	S	Bend	trans	-83.1	133.5	-176.9	-60.2	-65.1	-42.7	0	0	111.1	H511 I512 W516 F517 I591	H511-Q514 VanDerWaalsContact O-CB 3.26Å; H511-Q514 WeakPolarHBondContact O-CB 3.48Å; H511-Q514 WeakPolarHBondContact O-CG 3.26Å; H511-Q514 PolarHBondContact O-N 3.35Å; I512-Q514 PolarHBondContact O-N 3.43Å; Q514-W516 HydrophobicContact CB-CD2 3.82Å; Q514-W516 VanDerWaalsContact CB-CE2 3.44Å; Q514-W516 HydrophobicContact CB-CE3 4.31Å; Q514-W516 HydrophobicContact CB-CG 4.28Å; Q514-W516 HydrophobicContact CB-CH2 4.19Å; Q514-W516 HydrophobicContact CB-CZ2 3.67Å; Q514-W516 HydrophobicContact CB-CZ3 4.46Å; Q514-W516 HydrophobicContact CG-CH2 4.18Å; Q514-W516 HydrophobicContact CG-CZ2 3.58Å; Q514-W516 PolarHBondContact O-N 3.29Å; Q514-W516 VanDerWaalsContact O-N 3.12Å; Q514-F517 HydrophobicContact CB-CB 4.44Å; Q514-F517 PolarHBondContact O-N 3.31Å; Q514-I591 HydrophobicContact CG-CD1 4.38Å; Q514-I591 HydrophobicContact CG-CG1 4.24Å
515	L	88.9	Confident	81.2	Confident	114 Å²	114	78.1 Å²	78.1	60%	0.597	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-24.1	-176.1	-60.6	174.4	0	0	0	113.8	F517 T613	L515-F517 VanDerWaalsContact C-N 3.33Å; L515-T613 HydrophobicContact CB-CG2 3.51Å; L515-T613 HydrophobicContact CD1-CG2 4.05Å; L515-T613 HydrophobicContact CG-CG2 4.37Å
516	W	93.7	Very high	83.8	Confident	15 Å²	15	73.5 Å²	73.5	6%	0.057	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-6.8	176.7	47.9	-103.8	0	0	0	113.6	H511 Q514 F540 L541 L542 L590 I591 V594 P611	H511-W516 HydrophobicContact CB-CH2 4.13Å; Q514-W516 HydrophobicContact CB-CD2 3.82Å; Q514-W516 VanDerWaalsContact CB-CE2 3.44Å; Q514-W516 HydrophobicContact CB-CE3 4.31Å; Q514-W516 HydrophobicContact CB-CG 4.28Å; Q514-W516 HydrophobicContact CB-CH2 4.19Å; Q514-W516 HydrophobicContact CB-CZ2 3.67Å; Q514-W516 HydrophobicContact CB-CZ3 4.46Å; Q514-W516 HydrophobicContact CG-CH2 4.18Å; Q514-W516 HydrophobicContact CG-CZ2 3.58Å; Q514-W516 PolarHBondContact O-N 3.29Å; Q514-W516 VanDerWaalsContact O-N 3.12Å; W516-F540 HydrophobicContact CB-CE2 3.83Å; W516-F540 HydrophobicContact CB-CZ 4.19Å; W516-F540 HydrophobicContact CD2-CE2 4.48Å; W516-F540 AromaticContact CG-CE2 3.99Å; W516-F540 HydrophobicContact CG-CE2 3.99Å; W516-F540 HydrophobicContact CG-CZ 4.29Å; W516-L541 CarbonylContact O-C 3.48Å; W516-L541 WeakPolarHBondContact O-CA 3.48Å; W516-L542 HydrophobicContact CE3-CB 3.81Å; W516-L542 HydrophobicContact CE3-CD1 3.88Å; W516-L542 HydrophobicContact CE3-CD2 4.05Å; W516-L542 HydrophobicContact CE3-CG 4.11Å; W516-L542 HydrophobicContact CH2-CD2 4.22Å; W516-L542 HydrophobicContact CZ3-CB 3.87Å; W516-L542 HydrophobicContact CZ3-CD1 4.2Å; W516-L542 HydrophobicContact CZ3-CD2 3.5Å; W516-L542 HydrophobicContact CZ3-CG 4.05Å; W516-L542 PolarHBondContact O-N 2.91Å; W516-L590 HydrophobicContact CH2-CB 3.97Å; W516-I591 HydrophobicContact CZ2-CG1 4.3Å; W516-V594 HydrophobicContact CD2-CG2 4.21Å; W516-V594 HydrophobicContact CE3-CG2 4.27Å; W516-V594 HydrophobicContact CH2-CG2 3.85Å; W516-V594 HydrophobicContact CZ2-CB 4.04Å; W516-V594 HydrophobicContact CZ2-CG1 4.38Å; W516-V594 HydrophobicContact CZ2-CG2 3.76Å; W516-V594 HydrophobicContact CZ3-CG2 4.13Å; W516-P611 HydrophobicContact CB-CB 3.74Å; W516-P611 HydrophobicContact CG-CB 4.46Å
517	F	94.8	Very high	86.4	Confident	25 Å²	25	69.4 Å²	69.4	11%	0.11	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-99.7	121.1	-177.9	-174.9	-101.1	0	0	0	111.7	H511 I512 Q514 L515 G519 L542 V544 F552	H511-F517 AromaticContact CD2-CD1 4Å; H511-F517 AromaticContact CD2-CD2 3.8Å; H511-F517 AromaticContact CD2-CE1 3.77Å; H511-F517 AromaticContact CD2-CE2 3.57Å; H511-F517 AromaticContact CD2-CG 3.99Å; H511-F517 AromaticContact CD2-CZ 3.54Å; H511-F517 AromaticContact NE2-CE2 3.99Å; H511-F517 AromaticContact NE2-CZ 3.64Å; H511-F517 VanDerWaalsContact O-CB 3.26Å; H511-F517 WeakPolarHBondContact O-CB 3.28Å; I512-F517 HydrophobicContact CB-CD1 4.49Å; I512-F517 HydrophobicContact CG1-CD1 4.38Å; I512-F517 HydrophobicContact CG1-CE1 3.96Å; Q514-F517 HydrophobicContact CB-CB 4.44Å; Q514-F517 PolarHBondContact O-N 3.31Å; L515-F517 VanDerWaalsContact C-N 3.33Å; F517-G519 VanDerWaalsContact CE1-CA 3.49Å; F517-L542 HydrophobicContact CD2-CB 4.08Å; F517-V544 HydrophobicContact CZ-CG2 4.05Å; F517-F552 AromaticContact CE2-CD1 3.85Å; F517-F552 HydrophobicContact CE2-CD1 3.85Å; F517-F552 AromaticContact CE2-CE1 3.83Å; F517-F552 HydrophobicContact CE2-CE1 3.83Å; F517-F552 HydrophobicContact CZ-CD1 4.44Å; F517-F552 HydrophobicContact CZ-CE1 4.06Å
518	Y	92.9	Very high	88.6	Confident	36 Å²	36	70.1 Å²	70.1	14%	0.141	35%	0.35	C	S	.	.			trans	-107.3	3.8	-174.9	-77	-107.6	0	0	0	113.5	R520 I521 I529 L541 L542 C612 T613 V614	Y518-R520 PolarHBondContact O-N 2.76Å; Y518-I521 HydrophobicContact CD1-CD1 4.07Å; Y518-I521 HydrophobicContact CG-CD1 3.93Å; Y518-I529 HydrophobicContact CD1-CD1 3.61Å; Y518-I529 HydrophobicContact CE1-CD1 3.53Å; Y518-I529 HydrophobicContact CE1-CG1 4.32Å; Y518-I529 HydrophobicContact CE1-CG2 4.14Å; Y518-L541 HydrophobicContact CD2-CB 3.73Å; Y518-L541 HydrophobicContact CD2-CD1 4.35Å; Y518-L541 HydrophobicContact CD2-CD2 4.21Å; Y518-L541 HydrophobicContact CD2-CG 4.32Å; Y518-L541 HydrophobicContact CE2-CB 3.79Å; Y518-L541 HydrophobicContact CE2-CD2 4.22Å; Y518-L542 PolarHBondContact N-O 3.16Å; Y518-C612 HydrophobicContact CE2-CB 4.14Å; Y518-C612 VanDerWaalsContact CE2-O 3.24Å; Y518-C612 WeakPolarHBondContact CE2-O 3.39Å; Y518-C612 PolarHBondContact OH-O 3.26Å; Y518-T613 VanDerWaalsContact OH-C 3.29Å; Y518-T613 VanDerWaalsContact OH-CA 3.32Å; Y518-T613 WeakPolarHBondContact OH-CA 3.29Å; Y518-T613 PolarHBondContact OH-N 3.31Å; Y518-V614 HydrophobicContact CD1-CG2 4.35Å; Y518-V614 HydrophobicContact CE1-CG2 3.39Å; Y518-V614 PolarHBondContact OH-N 3.22Å
519	G	91.9	Very high	90.6	Very high	15 Å²	15	66.6 Å²	66.6	16%	0.155	33%	0.325	C	S	.	.	S	Bend	trans	58.2	-127	-178.9	0	0	0	0	0	112.2	F517 I521 R543 V544	F517-G519 VanDerWaalsContact CE1-CA 3.49Å; G519-I521 PolarHBondContact O-N 2.57Å; G519-R543 CarbonylContact O-C 3.56Å; G519-R543 WeakPolarHBondContact O-CA 3.43Å; G519-R543 WeakPolarHBondContact O-CB 3.35Å; G519-V544 PolarHBondContact O-N 2.79Å
520	R	91.8	Very high	91.9	Very high	214 Å²	214	63.1 Å²	63.1	81%	0.808	30%	0.304	S	S	*	.	S	Bend	trans	-93.3	68.6	-172.6	-64.1	-177.8	-175.5	-88.6	-0.7	112.3	Y518 V544	Y518-R520 PolarHBondContact O-N 2.76Å; R520-V544 HydrophobicContact CG-CB 4.19Å; R520-V544 HydrophobicContact CG-CG2 4.27Å
521	I	94.6	Very high	92.6	Very high	27 Å²	27	62.9 Å²	62.9	14%	0.138	30%	0.301	C	S	.	.			trans	-99.7	154.8	167.7	61.4	164.2	0	0	0	111.6	Y518 G519 E525 I529 L541 R543	Y518-I521 HydrophobicContact CD1-CD1 4.07Å; Y518-I521 HydrophobicContact CG-CD1 3.93Å; G519-I521 PolarHBondContact O-N 2.57Å; I521-E525 HydrophobicContact CB-CB 4.22Å; I521-E525 HydrophobicContact CB-CG 4.02Å; I521-E525 HydrophobicContact CG2-CG 4.18Å; I521-I529 HydrophobicContact CD1-CD1 3.77Å; I521-L541 HydrophobicContact CD1-CD1 3.98Å; I521-L541 HydrophobicContact CD1-CD2 4.4Å; I521-R543 HydrophobicContact CD1-CB 4.39Å; I521-R543 HydrophobicContact CG1-CB 3.73Å; I521-R543 HydrophobicContact CG1-CG 4.43Å
522	T	96.1	Very high	93	Very high	53 Å²	53	63.4 Å²	63.4	33%	0.325	30%	0.303	S	S	.	.			trans	-75.9	168.2	176.9	83.8	0	0	0	0	111.6	E524 E525 S526	T522-E524 VanDerWaalsContact C-N 3.3Å; T522-E524 WeakPolarHBondContact CB-OE2 3.3Å; T522-E524 PolarHBondContact OG1-N 3.31Å; T522-E524 PolarHBondContact OG1-OE2 3.24Å; T522-E525 PolarHBondContact O-N 2.82Å; T522-E525 PolarHBondContact OG1-N 3.45Å; T522-E525 VanDerWaalsContact OG1-N 3.1Å; T522-S526 PolarHBondContact O-N 3.3Å
523	R	95.8	Very high	93.3	Very high	128 Å²	128	58.7 Å²	58.7	48%	0.483	28%	0.279	S	S	.	.	H	α-helix	trans	-60.4	-43.3	172.7	-174.7	-179.5	-176.2	174.3	-3.6	111.2	E525 S526 H527 H564	R523-E525 VanDerWaalsContact C-N 3.34Å; R523-E525 PolarHBondContact O-N 3.31Å; R523-S526 PolarHBondContact O-N 3.23Å; R523-S526 PolarHBondContact O-OG 3.35Å; R523-H527 PolarHBondContact O-CD2 3.37Å; R523-H527 VanDerWaalsContact O-CD2 3.23Å; R523-H527 PolarHBondContact O-N 2.81Å; R523-H527 VanDerWaalsContact O-N 3.11Å; R523-H564 WeakPolarHBondContact CG-NE2 2.94Å; R523-H564 PolarHBondContact NE-CD2 3.15Å; R523-H564 PolarHBondContact NE-NE2 2.72Å; R523-H564 PolarHBondContact NH2-CD2 2.84Å
524	E	94.9	Very high	93.6	Very high	130 Å²	130	55 Å²	55	61%	0.607	25%	0.249	S	C	*	.	H	α-helix	trans	-65.7	-40.1	-178.9	-59.5	65.7	-139.3	0	0	110.7	T522 S526 H527 R528	T522-E524 VanDerWaalsContact C-N 3.3Å; T522-E524 WeakPolarHBondContact CB-OE2 3.3Å; T522-E524 PolarHBondContact OG1-N 3.31Å; T522-E524 PolarHBondContact OG1-OE2 3.24Å; E524-S526 VanDerWaalsContact C-N 3.34Å; E524-S526 PolarHBondContact O-N 2.97Å; E524-H527 WeakPolarHBondContact O-CB 3.24Å; E524-H527 PolarHBondContact O-N 2.78Å; E524-R528 PolarHBondContact O-N 2.77Å
525	E	94.6	Very high	93.8	Very high	63 Å²	63	53.1 Å²	53.1	29%	0.294	24%	0.24	S	C	.	.	H	α-helix	trans	-64.9	-39.7	175.6	-175	61.5	-174.3	0	0	111.7	I521 T522 R523 H527 R528 I529	I521-E525 HydrophobicContact CB-CB 4.22Å; I521-E525 HydrophobicContact CB-CG 4.02Å; I521-E525 HydrophobicContact CG2-CG 4.18Å; T522-E525 PolarHBondContact O-N 2.82Å; T522-E525 PolarHBondContact OG1-N 3.45Å; T522-E525 VanDerWaalsContact OG1-N 3.1Å; R523-E525 VanDerWaalsContact C-N 3.34Å; R523-E525 PolarHBondContact O-N 3.31Å; E525-H527 VanDerWaalsContact C-N 3.27Å; E525-H527 PolarHBondContact O-N 2.89Å; E525-R528 VanDerWaalsContact CD-NE 3.35Å; E525-R528 WeakPolarHBondContact O-CB 3.14Å; E525-R528 PolarHBondContact O-N 3.16Å; E525-R528 IonicContact OE1-CZ 3.65Å; E525-R528 VanDerWaalsContact OE1-CZ 3.31Å; E525-R528 IonicContact OE1-NE 2.71Å; E525-R528 PolarHBondContact OE1-NE 3.18Å; E525-R528 IonicContact OE1-NH2 3.53Å; E525-R528 PolarHBondContact OE1-NH2 3.49Å; E525-R528 IonicContact OE2-CZ 2.93Å; E525-R528 IonicContact OE2-NE 3.08Å; E525-R528 PolarHBondContact OE2-NE 2.85Å; E525-R528 IonicContact OE2-NH2 3.94Å; E525-I529 HydrophobicContact CG-CD1 4.16Å; E525-I529 WeakPolarHBondContact O-CD1 3.43Å; E525-I529 WeakPolarHBondContact O-CG1 3.45Å; E525-I529 PolarHBondContact O-N 3.25Å
526	S	96.1	Very high	94	Very high	0 Å²	0	48 Å²	48	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-33.9	174	71.6	0	0	0	0	113	T522 R523 E524 I530	T522-S526 PolarHBondContact O-N 3.3Å; R523-S526 PolarHBondContact O-N 3.23Å; R523-S526 PolarHBondContact O-OG 3.35Å; E524-S526 VanDerWaalsContact C-N 3.34Å; E524-S526 PolarHBondContact O-N 2.97Å; S526-I530 PolarHBondContact O-N 2.88Å
527	H	95.4	Very high	94.2	Very high	52 Å²	52	49.8 Å²	49.8	24%	0.241	23%	0.225	C	C	.	.	H	α-helix	trans	-66.5	-47.4	173.7	-77.3	-144.1	0	0	0	110.5	R523 E524 E525 I529 I530 H531 I562 H564	R523-H527 PolarHBondContact O-CD2 3.37Å; R523-H527 VanDerWaalsContact O-CD2 3.23Å; R523-H527 PolarHBondContact O-N 2.81Å; R523-H527 VanDerWaalsContact O-N 3.11Å; E524-H527 WeakPolarHBondContact O-CB 3.24Å; E524-H527 PolarHBondContact O-N 2.78Å; E525-H527 VanDerWaalsContact C-N 3.27Å; E525-H527 PolarHBondContact O-N 2.89Å; H527-I529 VanDerWaalsContact C-N 3.31Å; H527-I529 PolarHBondContact O-N 2.68Å; H527-I530 PolarHBondContact O-N 2.79Å; H527-H531 PolarHBondContact O-CD2 3.21Å; H527-H531 PolarHBondContact O-N 2.89Å; H527-I562 HydrophobicContact CB-CD1 3.97Å; H527-H564 AromaticContact CD2-CE1 3.68Å; H527-H564 AromaticContact CD2-NE2 3.65Å; H527-H564 AromaticContact CE1-NE2 3.98Å; H527-H564 AromaticContact NE2-CE1 3.39Å; H527-H564 PolarHBondContact NE2-CE1 2.72Å; H527-H564 AromaticContact NE2-NE2 2.88Å; H527-H564 PolarHBondContact NE2-NE2 2.89Å
528	R	92.8	Very high	94.3	Very high	97 Å²	97	48.6 Å²	48.6	37%	0.366	22%	0.219	S	C	.	.	H	α-helix	trans	-54.5	-46.4	178.4	-168.1	-173.5	70.5	72.7	1.9	111.8	E524 E525 H531 Q532	E524-R528 PolarHBondContact O-N 2.77Å; E525-R528 VanDerWaalsContact CD-NE 3.35Å; E525-R528 WeakPolarHBondContact O-CB 3.14Å; E525-R528 PolarHBondContact O-N 3.16Å; E525-R528 IonicContact OE1-CZ 3.65Å; E525-R528 VanDerWaalsContact OE1-CZ 3.31Å; E525-R528 IonicContact OE1-NE 2.71Å; E525-R528 PolarHBondContact OE1-NE 3.18Å; E525-R528 IonicContact OE1-NH2 3.53Å; E525-R528 PolarHBondContact OE1-NH2 3.49Å; E525-R528 IonicContact OE2-CZ 2.93Å; E525-R528 IonicContact OE2-NE 3.08Å; E525-R528 PolarHBondContact OE2-NE 2.85Å; E525-R528 IonicContact OE2-NH2 3.94Å; R528-H531 PolarHBondContact O-N 2.76Å; R528-Q532 WeakPolarHBondContact O-CG 3.41Å; R528-Q532 PolarHBondContact O-N 3.08Å
529	I	94.4	Very high	94.5	Very high	7 Å²	7	46.9 Å²	46.9	4%	0.036	21%	0.213	C	C	.	.	H	α-helix	trans	-62.7	-47.1	178.7	-67.1	157.3	0	0	0	111.2	Y518 I521 E525 H527 H531 Q532 Q533 L541 C612	Y518-I529 HydrophobicContact CD1-CD1 3.61Å; Y518-I529 HydrophobicContact CE1-CD1 3.53Å; Y518-I529 HydrophobicContact CE1-CG1 4.32Å; Y518-I529 HydrophobicContact CE1-CG2 4.14Å; I521-I529 HydrophobicContact CD1-CD1 3.77Å; E525-I529 HydrophobicContact CG-CD1 4.16Å; E525-I529 WeakPolarHBondContact O-CD1 3.43Å; E525-I529 WeakPolarHBondContact O-CG1 3.45Å; E525-I529 PolarHBondContact O-N 3.25Å; H527-I529 VanDerWaalsContact C-N 3.31Å; H527-I529 PolarHBondContact O-N 2.68Å; I529-H531 VanDerWaalsContact C-N 3.35Å; I529-H531 PolarHBondContact O-N 3.42Å; I529-Q532 PolarHBondContact O-N 3.05Å; I529-Q533 PolarHBondContact O-N 3.19Å; I529-Q533 VanDerWaalsContact O-N 3.13Å; I529-L541 HydrophobicContact CB-CD2 4.14Å; I529-L541 HydrophobicContact CD1-CD2 4.33Å; I529-L541 HydrophobicContact CG2-CD2 3.88Å; I529-C612 HydrophobicContact CG2-CB 3.83Å
530	I	95.4	Very high	94.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.2	-43.3	178	-77.3	-177.1	0	0	0	111.5	S526 H527 Q532 Q533 G534 Q535 L539 T555 C557 I562	S526-I530 PolarHBondContact O-N 2.88Å; H527-I530 PolarHBondContact O-N 2.79Å; I530-Q532 VanDerWaalsContact C-N 3.35Å; I530-Q532 PolarHBondContact O-N 3.36Å; I530-Q533 PolarHBondContact O-N 3.31Å; I530-G534 PolarHBondContact O-N 2.87Å; I530-Q535 HydrophobicContact CG2-CG 3.91Å; I530-L539 HydrophobicContact CB-CD2 4.46Å; I530-L539 HydrophobicContact CG1-CD2 4.48Å; I530-L539 HydrophobicContact CG2-CD2 4.09Å; I530-T555 HydrophobicContact CD1-CG2 3.59Å; I530-C557 HydrophobicContact CG2-CB 3.99Å; I530-I562 HydrophobicContact CB-CD1 3.91Å; I530-I562 HydrophobicContact CD1-CD1 4.47Å; I530-I562 HydrophobicContact CD1-CG2 4Å; I530-I562 HydrophobicContact CG2-CD1 3.6Å; I530-I562 HydrophobicContact CG2-CG1 3.89Å
531	H	93	Very high	95.1	Very high	74 Å²	74	36 Å²	36	34%	0.343	17%	0.167	S	C	.	.	H	α-helix	trans	-61.1	-43.4	176.7	-72.7	-59.2	0	0	0	111.8	H527 R528 I529 Q533 G534 Q535	H527-H531 PolarHBondContact O-CD2 3.21Å; H527-H531 PolarHBondContact O-N 2.89Å; R528-H531 PolarHBondContact O-N 2.76Å; I529-H531 VanDerWaalsContact C-N 3.35Å; I529-H531 PolarHBondContact O-N 3.42Å; H531-Q533 VanDerWaalsContact C-N 3.34Å; H531-Q533 PolarHBondContact O-N 3.02Å; H531-G534 PolarHBondContact O-N 2.64Å; H531-Q535 PolarHBondContact CE1-NE2 3.4Å; H531-Q535 VanDerWaalsContact CE1-NE2 3.34Å; H531-Q535 PolarHBondContact CE1-OE1 3.33Å; H531-Q535 PolarHBondContact ND1-NE2 3.13Å; H531-Q535 PolarHBondContact ND1-OE1 3.12Å
532	Q	92.2	Very high	95.2	Very high	36 Å²	36	34.7 Å²	34.7	17%	0.168	16%	0.16	C	C	.	.	H	α-helix	trans	-67.1	-32	-177.9	-77	-179.1	-27.3	0	0	113.9	R271 R528 I529 I530	R271-Q532 PolarHBondContact NE-O 3.37Å; R271-Q532 VanDerWaalsContact NE-O 3.09Å; R271-Q532 PolarHBondContact NH2-O 3.21Å; R528-Q532 WeakPolarHBondContact O-CG 3.41Å; R528-Q532 PolarHBondContact O-N 3.08Å; I529-Q532 PolarHBondContact O-N 3.05Å; I530-Q532 VanDerWaalsContact C-N 3.35Å; I530-Q532 PolarHBondContact O-N 3.36Å
533	Q	93	Very high	95.2	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	2.2	179.9	-59.7	-161.3	12.9	0	0	114.3	K272 N273 Y274 I529 I530 H531 L539 C612 T613	K272-Q533 HydrophobicContact CB-CG 4.43Å; K272-Q533 WeakPolarHBondContact O-CA 3.43Å; N273-Q533 CarbonylContact C-O 3.52Å; N273-Q533 WeakPolarHBondContact CA-O 3.44Å; Y274-Q533 HydrophobicContact CD2-CB 4.31Å; Y274-Q533 WeakPolarHBondContact CD2-O 3.3Å; Y274-Q533 PolarHBondContact N-O 3.1Å; I529-Q533 PolarHBondContact O-N 3.19Å; I529-Q533 VanDerWaalsContact O-N 3.13Å; I530-Q533 PolarHBondContact O-N 3.31Å; H531-Q533 VanDerWaalsContact C-N 3.34Å; H531-Q533 PolarHBondContact O-N 3.02Å; Q533-L539 HydrophobicContact CB-CD2 4.28Å; Q533-C612 VanDerWaalsContact OE1-CA 3.27Å; Q533-T613 PolarHBondContact NE2-O 3.1Å
534	G	93.1	Very high	95.1	Very high	8 Å²	8	27.6 Å²	27.6	8%	0.082	13%	0.13	C	C	.	.			trans	86	114.3	174	0	0	0	0	0	112.9	I530 H531 V536 L539	I530-G534 PolarHBondContact O-N 2.87Å; H531-G534 PolarHBondContact O-N 2.64Å; G534-V536 VanDerWaalsContact C-N 3.34Å; G534-V536 PolarHBondContact O-N 3.41Å; G534-L539 VanDerWaalsContact O-CD2 3.24Å; G534-L539 WeakPolarHBondContact O-CD2 3.5Å
535	Q	93.2	Very high	95.1	Very high	21 Å²	21	21.7 Å²	21.7	10%	0.098	10%	0.102	C	C	.	.			trans	-70.9	79	-173.4	-73.1	167	-89	0	0	113.6	E411 I530 H531 Q560	E411-Q535 VanDerWaalsContact CG-OE1 3.27Å; I530-Q535 HydrophobicContact CG2-CG 3.91Å; H531-Q535 PolarHBondContact CE1-NE2 3.4Å; H531-Q535 VanDerWaalsContact CE1-NE2 3.34Å; H531-Q535 PolarHBondContact CE1-OE1 3.33Å; H531-Q535 PolarHBondContact ND1-NE2 3.13Å; H531-Q535 PolarHBondContact ND1-OE1 3.12Å; Q535-Q560 HydrophobicContact CB-CB 4.38Å; Q535-Q560 HydrophobicContact CB-CG 4.03Å; Q535-Q560 PolarHBondContact NE2-O 3.45Å; Q535-Q560 WeakPolarHBondContact O-CG 3.34Å
536	V	95.1	Very high	95	Very high	6 Å²	6	24.6 Å²	24.6	4%	0.036	12%	0.116	C	C	.	.			trans	-102.4	160.5	169.8	-59.7	0	0	0	0	111.1	Y274 A275 E278 G534 G538 L539 H610	Y274-V536 HydrophobicContact CG-CG2 4.37Å; A275-V536 HydrophobicContact CB-CG1 3.9Å; E278-V536 HydrophobicContact CG-CG1 4.28Å; G534-V536 VanDerWaalsContact C-N 3.34Å; G534-V536 PolarHBondContact O-N 3.41Å; V536-G538 PolarHBondContact O-N 3.41Å; V536-L539 HydrophobicContact CG2-CB 4.2Å; V536-L539 WeakPolarHBondContact O-CB 3.31Å; V536-L539 PolarHBondContact O-N 3.21Å; V536-H610 VanDerWaalsContact CG2-CD2 3.5Å; V536-H610 WeakPolarHBondContact CG2-CD2 3.37Å
537	D	96.1	Very high	94.7	Very high	53 Å²	53	29.3 Å²	29.3	28%	0.283	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	133.7	177.7	-72	-8.3	0	0	0	111.9	L539 H558 H559	D537-L539 VanDerWaalsContact C-N 3.32Å; D537-H558 WeakPolarHBondContact OD1-CA 3.4Å; D537-H558 IonicContact OD1-CD2 2.82Å; D537-H558 IonicContact OD2-CD2 3.69Å; D537-H559 PolarHBondContact OD1-N 3.31Å; D537-H559 IonicContact OD2-CD2 2.72Å
538	G	96.9	Very high	94.5	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	6.5	179.5	0	0	0	0	0	113.9	V536 F540 C557 C606 K607 K609 H610	V536-G538 PolarHBondContact O-N 3.41Å; G538-F540 WeakPolarHBondContact O-CD1 3.32Å; G538-C557 PolarHBondContact N-O 3.18Å; G538-C606 PolarHBondContact N-SG 2.71Å; G538-K607 VanDerWaalsContact CA-O 3.3Å; G538-K607 WeakPolarHBondContact CA-O 2.96Å; G538-K609 PolarHBondContact O-N 2.95Å; G538-H610 PolarHBondContact O-N 3.22Å
539	L	97.6	Very high	94	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	126.6	168.7	-178.7	67.4	0	0	0	110	Y274 I530 Q533 G534 V536 D537 C557 H610 C612	Y274-L539 HydrophobicContact CD2-CD1 3.54Å; Y274-L539 HydrophobicContact CE2-CD1 3.68Å; Y274-L539 HydrophobicContact CG-CD1 4.49Å; I530-L539 HydrophobicContact CB-CD2 4.46Å; I530-L539 HydrophobicContact CG1-CD2 4.48Å; I530-L539 HydrophobicContact CG2-CD2 4.09Å; Q533-L539 HydrophobicContact CB-CD2 4.28Å; G534-L539 VanDerWaalsContact O-CD2 3.24Å; G534-L539 WeakPolarHBondContact O-CD2 3.5Å; V536-L539 HydrophobicContact CG2-CB 4.2Å; V536-L539 WeakPolarHBondContact O-CB 3.31Å; V536-L539 PolarHBondContact O-N 3.21Å; D537-L539 VanDerWaalsContact C-N 3.32Å; L539-C557 HydrophobicContact CB-CB 4.04Å; L539-C557 PolarHBondContact O-N 3.05Å; L539-H610 CarbonylContact C-O 3.56Å; L539-H610 VanDerWaalsContact CA-O 3.3Å; L539-H610 WeakPolarHBondContact CA-O 3.3Å; L539-H610 HydrophobicContact CB-CB 4.38Å; L539-H610 HydrophobicContact CD1-CB 3.81Å; L539-H610 WeakPolarHBondContact CD1-O 3.19Å; L539-C612 WeakPolarHBondContact CD1-SG 3.18Å; L539-C612 VanDerWaalsContact CG-SG 3.57Å
540	F	98.3	Very high	93.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	159.3	-170.7	78.4	-78.6	0	0	0	114.8	W516 G538 L542 L554 T555 L556 V594 L608 H610 P611 C612	W516-F540 HydrophobicContact CB-CE2 3.83Å; W516-F540 HydrophobicContact CB-CZ 4.19Å; W516-F540 HydrophobicContact CD2-CE2 4.48Å; W516-F540 AromaticContact CG-CE2 3.99Å; W516-F540 HydrophobicContact CG-CE2 3.99Å; W516-F540 HydrophobicContact CG-CZ 4.29Å; G538-F540 WeakPolarHBondContact O-CD1 3.32Å; F540-L542 HydrophobicContact CD2-CD1 3.9Å; F540-L542 HydrophobicContact CE2-CD1 4.1Å; F540-L554 HydrophobicContact CB-CD1 3.96Å; F540-L554 HydrophobicContact CD2-CD1 3.8Å; F540-L554 HydrophobicContact CG-CD1 4.28Å; F540-T555 CarbonylContact C-O 3.54Å; F540-T555 WeakPolarHBondContact CA-O 3.22Å; F540-T555 WeakPolarHBondContact CB-O 3.47Å; F540-L556 HydrophobicContact CB-CD1 4.08Å; F540-V594 HydrophobicContact CE2-CG1 3.81Å; F540-V594 HydrophobicContact CE2-CG2 4.29Å; F540-V594 HydrophobicContact CZ-CG1 3.75Å; F540-L608 HydrophobicContact CB-CD2 3.87Å; F540-L608 HydrophobicContact CD1-CB 3.79Å; F540-L608 HydrophobicContact CD1-CD2 4.11Å; F540-L608 HydrophobicContact CD1-CG 4.36Å; F540-L608 HydrophobicContact CD2-CD1 3.99Å; F540-L608 HydrophobicContact CD2-CD2 4.2Å; F540-L608 HydrophobicContact CD2-CG 4.49Å; F540-L608 HydrophobicContact CE1-CB 3.73Å; F540-L608 HydrophobicContact CE2-CD1 3.93Å; F540-L608 HydrophobicContact CG-CB 4.26Å; F540-L608 HydrophobicContact CG-CD1 4.32Å; F540-L608 HydrophobicContact CG-CD2 3.79Å; F540-L608 HydrophobicContact CG-CG 4.33Å; F540-L608 HydrophobicContact CZ-CB 4.14Å; F540-L608 HydrophobicContact CZ-CD1 4.22Å; F540-H610 VanDerWaalsContact CD1-O 3.24Å; F540-H610 WeakPolarHBondContact CD1-O 3.43Å; F540-H610 PolarHBondContact N-O 3.36Å; F540-P611 HydrophobicContact CE1-CB 4.08Å; F540-P611 HydrophobicContact CZ-CB 4.08Å; F540-C612 PolarHBondContact O-N 2.8Å
541	L	97.9	Very high	93.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	157.7	166.7	65.3	83.6	0	0	0	110.9	W516 Y518 I521 I529 R543 T555 C612	W516-L541 CarbonylContact O-C 3.48Å; W516-L541 WeakPolarHBondContact O-CA 3.48Å; Y518-L541 HydrophobicContact CD2-CB 3.73Å; Y518-L541 HydrophobicContact CD2-CD1 4.35Å; Y518-L541 HydrophobicContact CD2-CD2 4.21Å; Y518-L541 HydrophobicContact CD2-CG 4.32Å; Y518-L541 HydrophobicContact CE2-CB 3.79Å; Y518-L541 HydrophobicContact CE2-CD2 4.22Å; I521-L541 HydrophobicContact CD1-CD1 3.98Å; I521-L541 HydrophobicContact CD1-CD2 4.4Å; I529-L541 HydrophobicContact CB-CD2 4.14Å; I529-L541 HydrophobicContact CD1-CD2 4.33Å; I529-L541 HydrophobicContact CG2-CD2 3.88Å; L541-R543 HydrophobicContact CD1-CB 4.35Å; L541-R543 HydrophobicContact CD1-CG 4.45Å; L541-T555 PolarHBondContact N-O 3.31Å; L541-T555 PolarHBondContact O-N 3.28Å; L541-C612 HydrophobicContact CB-CB 4.11Å; L541-C612 HydrophobicContact CD2-CB 4.21Å
542	L	97.3	Very high	93.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	143.7	170.1	-80.8	67.3	0	0	0	110.4	W516 F517 Y518 F540 V553 L554 I567 L590 V594	W516-L542 HydrophobicContact CE3-CB 3.81Å; W516-L542 HydrophobicContact CE3-CD1 3.88Å; W516-L542 HydrophobicContact CE3-CD2 4.05Å; W516-L542 HydrophobicContact CE3-CG 4.11Å; W516-L542 HydrophobicContact CH2-CD2 4.22Å; W516-L542 HydrophobicContact CZ3-CB 3.87Å; W516-L542 HydrophobicContact CZ3-CD1 4.2Å; W516-L542 HydrophobicContact CZ3-CD2 3.5Å; W516-L542 HydrophobicContact CZ3-CG 4.05Å; W516-L542 PolarHBondContact O-N 2.91Å; F517-L542 HydrophobicContact CD2-CB 4.08Å; Y518-L542 PolarHBondContact N-O 3.16Å; F540-L542 HydrophobicContact CD2-CD1 3.9Å; F540-L542 HydrophobicContact CE2-CD1 4.1Å; L542-V553 WeakPolarHBondContact CA-O 3.34Å; L542-L554 HydrophobicContact CD1-CB 4.45Å; L542-L554 HydrophobicContact CD1-CD1 3.55Å; L542-L554 HydrophobicContact CG-CD1 4.47Å; L542-I567 HydrophobicContact CD2-CD1 3.64Å; L542-I567 HydrophobicContact CG-CD1 4.13Å; L542-L590 HydrophobicContact CD2-CB 4.44Å; L542-L590 HydrophobicContact CD2-CD1 4.41Å; L542-L590 HydrophobicContact CD2-CD2 4.31Å; L542-V594 HydrophobicContact CD1-CG2 3.94Å; L542-V594 HydrophobicContact CD2-CG2 4.03Å
543	R	96	Very high	94	Very high	14 Å²	14	33.7 Å²	33.7	5%	0.053	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	160.9	175	62.7	-177.8	179.8	81.9	0.1	110.5	G519 I521 L541 F552 V553	G519-R543 CarbonylContact O-C 3.56Å; G519-R543 WeakPolarHBondContact O-CA 3.43Å; G519-R543 WeakPolarHBondContact O-CB 3.35Å; I521-R543 HydrophobicContact CD1-CB 4.39Å; I521-R543 HydrophobicContact CG1-CB 3.73Å; I521-R543 HydrophobicContact CG1-CG 4.43Å; L541-R543 HydrophobicContact CD1-CB 4.35Å; L541-R543 HydrophobicContact CD1-CG 4.45Å; R543-F552 CarbonylContact O-C 3.53Å; R543-F552 WeakPolarHBondContact O-CA 3.38Å; R543-V553 HydrophobicContact CG-CB 4Å; R543-V553 PolarHBondContact N-O 2.65Å; R543-V553 PolarHBondContact O-N 2.97Å
544	V	94.8	Very high	94.2	Very high	19 Å²	19	33.7 Å²	33.7	12%	0.115	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	139.5	170	-179.2	0	0	0	0	109	F517 G519 R520 F552	F517-V544 HydrophobicContact CZ-CG2 4.05Å; G519-V544 PolarHBondContact O-N 2.79Å; R520-V544 HydrophobicContact CG-CB 4.19Å; R520-V544 HydrophobicContact CG-CG2 4.27Å; V544-F552 HydrophobicContact CG2-CD1 4.3Å; V544-F552 HydrophobicContact CG2-CE1 4.13Å
545	S	94	Very high	94.5	Very high	5 Å²	5	33.3 Å²	33.3	4%	0.035	18%	0.179	C	C	.	.			trans	-70.9	134.1	174.3	180	0	0	0	0	110.8	S547 N548 A551	S545-S547 PolarHBondContact OG-N 2.61Å; S545-S547 PolarHBondContact OG-OG 3.13Å; S545-N548 VanDerWaalsContact CB-O 3.29Å; S545-N548 WeakPolarHBondContact CB-O 3.36Å; S545-N548 PolarHBondContact OG-N 2.83Å; S545-N548 VanDerWaalsContact OG-N 3.15Å; S545-A551 VanDerWaalsContact CB-O 3.23Å; S545-A551 WeakPolarHBondContact CB-O 3.29Å; S545-A551 PolarHBondContact N-O 3.32Å
546	Q	91.9	Very high	94.7	Very high	125 Å²	125	32.3 Å²	32.3	58%	0.584	18%	0.175	S	C	*	.	S	Bend	trans	-81.6	-26.3	175.7	-68	-178.8	-62.5	0	0	112.1
547	S	90.4	Very high	94.9	Very high	99 Å²	99	32 Å²	32	69%	0.692	17%	0.173	S	C	*	.	S	Bend	trans	-92.2	-26.7	-178.9	54.1	0	0	0	0	113.3	S545	S545-S547 PolarHBondContact OG-N 2.61Å; S545-S547 PolarHBondContact OG-OG 3.13Å
548	N	90.3	Very high	94.9	Very high	55 Å²	55	31 Å²	31	29%	0.294	17%	0.166	S	C	.	.			trans	-127.9	103.9	178.2	-179.4	-10.7	0	0	0	110	S545 K550 A551	S545-N548 VanDerWaalsContact CB-O 3.29Å; S545-N548 WeakPolarHBondContact CB-O 3.36Å; S545-N548 PolarHBondContact OG-N 2.83Å; S545-N548 VanDerWaalsContact OG-N 3.15Å; N548-K550 PolarHBondContact O-N 2.6Å; N548-K550 PolarHBondContact OD1-N 3.21Å; N548-K550 VanDerWaalsContact OD1-N 3.13Å; N548-A551 HydrophobicContact CB-CB 3.81Å; N548-A551 PolarHBondContact O-N 3.36Å
549	P	83.5	Confident	94.7	Very high	114 Å²	114	37 Å²	37	74%	0.74	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-19.7	-175	-25.3	33.9	0	0	0	115.8
550	K	86.6	Confident	94.4	Very high	154 Å²	154	38.9 Å²	38.9	67%	0.67	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-7.3	178.7	-63.7	-172.7	176	-174.1	0	113.2	N548 P569	N548-K550 PolarHBondContact O-N 2.6Å; N548-K550 PolarHBondContact OD1-N 3.21Å; N548-K550 VanDerWaalsContact OD1-N 3.13Å; K550-P569 HydrophobicContact CB-CG 4.01Å; K550-P569 WeakPolarHBondContact O-CD 3.41Å; K550-P569 WeakPolarHBondContact O-CG 3.43Å
551	A	93.4	Very high	94.2	Very high	0 Å²	0	46 Å²	46	0%	0	23%	0.234	C	C	.	.			trans	-104.2	156.7	-175.1	0	0	0	0	0	112.7	S545 N548 I567 L568	S545-A551 VanDerWaalsContact CB-O 3.23Å; S545-A551 WeakPolarHBondContact CB-O 3.29Å; S545-A551 PolarHBondContact N-O 3.32Å; N548-A551 HydrophobicContact CB-CB 3.81Å; N548-A551 PolarHBondContact O-N 3.36Å; A551-I567 WeakPolarHBondContact CA-O 3.42Å; A551-I567 WeakPolarHBondContact CB-O 3.3Å; A551-L568 HydrophobicContact CB-CD2 3.83Å
552	F	96.4	Very high	94.2	Very high	29 Å²	29	47.3 Å²	47.3	13%	0.127	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	166.2	168.1	-58.3	-88.4	0	0	0	110	F517 R543 V544 I567 F578 L590	F517-F552 AromaticContact CE2-CD1 3.85Å; F517-F552 HydrophobicContact CE2-CD1 3.85Å; F517-F552 AromaticContact CE2-CE1 3.83Å; F517-F552 HydrophobicContact CE2-CE1 3.83Å; F517-F552 HydrophobicContact CZ-CD1 4.44Å; F517-F552 HydrophobicContact CZ-CE1 4.06Å; R543-F552 CarbonylContact O-C 3.53Å; R543-F552 WeakPolarHBondContact O-CA 3.38Å; V544-F552 HydrophobicContact CG2-CD1 4.3Å; V544-F552 HydrophobicContact CG2-CE1 4.13Å; F552-I567 HydrophobicContact CB-CB 4.08Å; F552-I567 HydrophobicContact CB-CD1 4.16Å; F552-I567 PolarHBondContact N-O 2.88Å; F552-I567 PolarHBondContact O-N 3.08Å; F552-F578 HydrophobicContact CD2-CD1 4.31Å; F552-F578 AromaticContact CD2-CE1 3.97Å; F552-F578 HydrophobicContact CD2-CE1 3.97Å; F552-F578 HydrophobicContact CE2-CD1 4.41Å; F552-F578 AromaticContact CE2-CE1 3.64Å; F552-F578 HydrophobicContact CE2-CE1 3.64Å; F552-F578 HydrophobicContact CE2-CZ 4.1Å; F552-L590 HydrophobicContact CB-CD2 4.5Å; F552-L590 HydrophobicContact CD1-CD1 3.86Å; F552-L590 HydrophobicContact CD2-CD1 3.86Å; F552-L590 HydrophobicContact CD2-CD2 3.91Å; F552-L590 HydrophobicContact CD2-CG 4.35Å; F552-L590 HydrophobicContact CE1-CD1 3.86Å; F552-L590 HydrophobicContact CE2-CD1 3.87Å; F552-L590 HydrophobicContact CE2-CD2 4.4Å; F552-L590 HydrophobicContact CE2-CG 4.42Å; F552-L590 HydrophobicContact CG-CD1 3.84Å; F552-L590 HydrophobicContact CG-CD2 4.26Å; F552-L590 HydrophobicContact CZ-CD1 3.86Å
553	V	97.9	Very high	94.2	Very high	6 Å²	6	51.6 Å²	51.6	4%	0.036	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	119.2	176.1	-177.3	0	0	0	0	108.7	L542 R543 H564 F565	L542-V553 WeakPolarHBondContact CA-O 3.34Å; R543-V553 HydrophobicContact CG-CB 4Å; R543-V553 PolarHBondContact N-O 2.65Å; R543-V553 PolarHBondContact O-N 2.97Å; V553-H564 HydrophobicContact CG1-CB 3.8Å; V553-F565 CarbonylContact C-O 3.59Å; V553-F565 WeakPolarHBondContact CA-O 3.49Å
554	L	98.3	Very high	94.3	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	118	163.9	169.1	64.7	0	0	0	108.1	F540 L542 H564 F565 I567 L580 L604 L608	F540-L554 HydrophobicContact CB-CD1 3.96Å; F540-L554 HydrophobicContact CD2-CD1 3.8Å; F540-L554 HydrophobicContact CG-CD1 4.28Å; L542-L554 HydrophobicContact CD1-CB 4.45Å; L542-L554 HydrophobicContact CD1-CD1 3.55Å; L542-L554 HydrophobicContact CG-CD1 4.47Å; L554-H564 CarbonylContact O-C 3.52Å; L554-H564 WeakPolarHBondContact O-CA 3.41Å; L554-F565 HydrophobicContact CB-CB 4.37Å; L554-F565 HydrophobicContact CD2-CD2 4.4Å; L554-F565 HydrophobicContact CG-CD2 4.47Å; L554-F565 PolarHBondContact N-O 3.41Å; L554-F565 PolarHBondContact O-N 2.82Å; L554-I567 HydrophobicContact CB-CD1 4.12Å; L554-I567 HydrophobicContact CB-CG1 4.46Å; L554-L580 HydrophobicContact CD2-CD1 4.08Å; L554-L604 HydrophobicContact CD2-CD1 3.73Å; L554-L604 HydrophobicContact CD2-CD2 3.77Å; L554-L604 HydrophobicContact CD2-CG 4.42Å; L554-L608 HydrophobicContact CD1-CD1 4.36Å; L554-L608 HydrophobicContact CD1-CD2 4.03Å; L554-L608 HydrophobicContact CD2-CD2 4.18Å
555	T	98.5	Very high	94.4	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	123.2	171.4	-55.7	0	0	0	0	108.3	I530 F540 L541 I562 K563 H564	I530-T555 HydrophobicContact CD1-CG2 3.59Å; F540-T555 CarbonylContact C-O 3.54Å; F540-T555 WeakPolarHBondContact CA-O 3.22Å; F540-T555 WeakPolarHBondContact CB-O 3.47Å; L541-T555 PolarHBondContact N-O 3.31Å; L541-T555 PolarHBondContact O-N 3.28Å; T555-I562 HydrophobicContact CG2-CG2 3.44Å; T555-I562 VanDerWaalsContact CG2-CG2 3.44Å; T555-K563 WeakPolarHBondContact CA-O 3.18Å; T555-H564 VanDerWaalsContact CG2-CE1 3.42Å; T555-H564 WeakPolarHBondContact CG2-CE1 3.19Å; T555-H564 WeakPolarHBondContact CG2-ND1 3.41Å; T555-H564 PolarHBondContact OG1-ND1 3.23Å
556	L	98.5	Very high	94.5	Very high	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	134.3	-170.2	173.6	64.6	0	0	0	110.9	F540 K563 F565 L604 P605 L608	F540-L556 HydrophobicContact CB-CD1 4.08Å; L556-K563 PolarHBondContact N-O 3.29Å; L556-K563 PolarHBondContact O-N 3.39Å; L556-F565 HydrophobicContact CB-CD2 4.44Å; L556-F565 HydrophobicContact CB-CE2 4.08Å; L556-F565 HydrophobicContact CD2-CE2 3.99Å; L556-L604 HydrophobicContact CD2-CB 4.27Å; L556-L604 HydrophobicContact CD2-CD1 4.41Å; L556-L604 HydrophobicContact CD2-CD2 4.45Å; L556-P605 HydrophobicContact CD2-CG 3.83Å; L556-L608 HydrophobicContact CD1-CD2 3.78Å; L556-L608 HydrophobicContact CD2-CD2 4.48Å
557	C	98	Very high	94.8	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130.7	170.3	-174.2	0	0	0	0	111	I530 G538 L539 K561	I530-C557 HydrophobicContact CG2-CB 3.99Å; G538-C557 PolarHBondContact N-O 3.18Å; L539-C557 HydrophobicContact CB-CB 4.04Å; L539-C557 PolarHBondContact O-N 3.05Å; C557-K561 WeakPolarHBondContact CA-O 3.23Å
558	H	96.2	Very high	95	Very high	30 Å²	30	51 Å²	51	14%	0.139	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	129.4	173.4	178.1	-113.1	0	0	0	110.4	D537 Q560 K561 P605 C606	D537-H558 WeakPolarHBondContact OD1-CA 3.4Å; D537-H558 IonicContact OD1-CD2 2.82Å; D537-H558 IonicContact OD2-CD2 3.69Å; H558-Q560 PolarHBondContact O-N 3.34Å; H558-K561 PolarHBondContact N-O 3.34Å; H558-K561 WeakPolarHBondContact O-CB 3.34Å; H558-K561 PolarHBondContact O-N 3.43Å; H558-P605 HydrophobicContact CB-CB 4.38Å; H558-P605 HydrophobicContact CB-CG 4.01Å; H558-C606 VanDerWaalsContact CD2-SG 3.59Å
559	H	92.9	Very high	95.2	Very high	126 Å²	126	50.4 Å²	50.4	58%	0.583	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.1	46	-171.1	-61.5	136.1	0	0	0	111.8	D537 K561	D537-H559 PolarHBondContact OD1-N 3.31Å; D537-H559 IonicContact OD2-CD2 2.72Å; H559-K561 PolarHBondContact O-N 3.38Å
560	Q	91.8	Very high	95.5	Very high	40 Å²	40	46.6 Å²	46.6	19%	0.187	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	11	-176.3	-66	158.3	37.9	0	0	115.3	E411 Q412 Q535 H558	E411-Q560 HydrophobicContact CG-CB 4.31Å; E411-Q560 HydrophobicContact CG-CG 4.47Å; Q412-Q560 VanDerWaalsContact N-OE1 3.1Å; Q412-Q560 VanDerWaalsContact OE1-CD 3.32Å; Q535-Q560 HydrophobicContact CB-CB 4.38Å; Q535-Q560 HydrophobicContact CB-CG 4.03Å; Q535-Q560 PolarHBondContact NE2-O 3.45Å; Q535-Q560 WeakPolarHBondContact O-CG 3.34Å; H558-Q560 PolarHBondContact O-N 3.34Å
561	K	93.9	Very high	95.6	Very high	149 Å²	149	46.6 Å²	46.6	65%	0.648	22%	0.222	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	135.3	173.3	-64.9	179.5	-177.4	179.7	0	109.7	C557 H558 H559	C557-K561 WeakPolarHBondContact CA-O 3.23Å; H558-K561 PolarHBondContact N-O 3.34Å; H558-K561 WeakPolarHBondContact O-CB 3.34Å; H558-K561 PolarHBondContact O-N 3.43Å; H559-K561 PolarHBondContact O-N 3.38Å
562	I	97	Very high	95.4	Very high	28 Å²	28	50.5 Å²	50.5	14%	0.144	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	120.1	177.3	-54.2	-178.8	0	0	0	108.9	H527 I530 T555	H527-I562 HydrophobicContact CB-CD1 3.97Å; I530-I562 HydrophobicContact CB-CD1 3.91Å; I530-I562 HydrophobicContact CD1-CD1 4.47Å; I530-I562 HydrophobicContact CD1-CG2 4Å; I530-I562 HydrophobicContact CG2-CD1 3.6Å; I530-I562 HydrophobicContact CG2-CG1 3.89Å; T555-I562 HydrophobicContact CG2-CG2 3.44Å; T555-I562 VanDerWaalsContact CG2-CG2 3.44Å
563	K	97.4	Very high	95.1	Very high	91 Å²	91	56.7 Å²	56.7	40%	0.396	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	150.9	176.9	-64.4	-173	179.2	-171.4	0	110.3	T555 L556 F565 P605	T555-K563 WeakPolarHBondContact CA-O 3.18Å; L556-K563 PolarHBondContact N-O 3.29Å; L556-K563 PolarHBondContact O-N 3.39Å; K563-F565 HydrophobicContact CB-CE2 3.62Å; K563-F565 HydrophobicContact CB-CZ 3.9Å; K563-F565 HydrophobicContact CD-CZ 4.09Å; K563-P605 HydrophobicContact CD-CG 4.28Å
564	H	97.8	Very high	94.5	Very high	47 Å²	47	60.1 Å²	60.1	22%	0.218	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	130.9	176.7	-56	-80.2	0	0	0	109.5	R523 H527 V553 L554 T555	R523-H564 WeakPolarHBondContact CG-NE2 2.94Å; R523-H564 PolarHBondContact NE-CD2 3.15Å; R523-H564 PolarHBondContact NE-NE2 2.72Å; R523-H564 PolarHBondContact NH2-CD2 2.84Å; H527-H564 AromaticContact CD2-CE1 3.68Å; H527-H564 AromaticContact CD2-NE2 3.65Å; H527-H564 AromaticContact CE1-NE2 3.98Å; H527-H564 AromaticContact NE2-CE1 3.39Å; H527-H564 PolarHBondContact NE2-CE1 2.72Å; H527-H564 AromaticContact NE2-NE2 2.88Å; H527-H564 PolarHBondContact NE2-NE2 2.89Å; V553-H564 HydrophobicContact CG1-CB 3.8Å; L554-H564 CarbonylContact O-C 3.52Å; L554-H564 WeakPolarHBondContact O-CA 3.41Å; T555-H564 VanDerWaalsContact CG2-CE1 3.42Å; T555-H564 WeakPolarHBondContact CG2-CE1 3.19Å; T555-H564 WeakPolarHBondContact CG2-ND1 3.41Å; T555-H564 PolarHBondContact OG1-ND1 3.23Å
565	F	97.7	Very high	94	Very high	45 Å²	45	62.8 Å²	62.8	20%	0.197	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	128.6	178.3	-55.4	-94.4	0	0	0	108.8	V553 L554 L556 K563 L580 L604 P605	V553-F565 CarbonylContact C-O 3.59Å; V553-F565 WeakPolarHBondContact CA-O 3.49Å; L554-F565 HydrophobicContact CB-CB 4.37Å; L554-F565 HydrophobicContact CD2-CD2 4.4Å; L554-F565 HydrophobicContact CG-CD2 4.47Å; L554-F565 PolarHBondContact N-O 3.41Å; L554-F565 PolarHBondContact O-N 2.82Å; L556-F565 HydrophobicContact CB-CD2 4.44Å; L556-F565 HydrophobicContact CB-CE2 4.08Å; L556-F565 HydrophobicContact CD2-CE2 3.99Å; K563-F565 HydrophobicContact CB-CE2 3.62Å; K563-F565 HydrophobicContact CB-CZ 3.9Å; K563-F565 HydrophobicContact CD-CZ 4.09Å; F565-L580 HydrophobicContact CB-CD2 3.43Å; F565-L580 VanDerWaalsContact CB-CD2 3.43Å; F565-L580 HydrophobicContact CG-CD2 4.49Å; F565-L604 HydrophobicContact CD1-CD2 3.95Å; F565-L604 HydrophobicContact CD2-CD2 3.88Å; F565-L604 HydrophobicContact CE1-CD2 4.07Å; F565-L604 HydrophobicContact CE2-CD2 4.01Å; F565-L604 HydrophobicContact CG-CD2 3.87Å; F565-L604 HydrophobicContact CZ-CD2 4.11Å; F565-P605 HydrophobicContact CZ-CG 4.22Å
566	Q	96.8	Very high	93.6	Very high	97 Å²	97	65.9 Å²	65.9	45%	0.453	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	128.5	176.8	-73.3	-169.2	-4.9	0	0	109.6	L568	Q566-L568 HydrophobicContact CB-CD2 4.35Å; Q566-L568 HydrophobicContact CB-CG 4.42Å
567	I	97.2	Very high	93.4	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	111.5	169.9	-56.4	167	0	0	0	106	L542 A551 F552 L554 F578 S579 L580 L590 L593	L542-I567 HydrophobicContact CD2-CD1 3.64Å; L542-I567 HydrophobicContact CG-CD1 4.13Å; A551-I567 WeakPolarHBondContact CA-O 3.42Å; A551-I567 WeakPolarHBondContact CB-O 3.3Å; F552-I567 HydrophobicContact CB-CB 4.08Å; F552-I567 HydrophobicContact CB-CD1 4.16Å; F552-I567 PolarHBondContact N-O 2.88Å; F552-I567 PolarHBondContact O-N 3.08Å; L554-I567 HydrophobicContact CB-CD1 4.12Å; L554-I567 HydrophobicContact CB-CG1 4.46Å; I567-F578 HydrophobicContact CG2-CB 3.8Å; I567-F578 HydrophobicContact CG2-CD1 4.13Å; I567-F578 HydrophobicContact CG2-CG 4.36Å; I567-S579 WeakPolarHBondContact CA-O 3.47Å; I567-L580 HydrophobicContact CG1-CD1 4.49Å; I567-L580 HydrophobicContact CG1-CD2 3.67Å; I567-L580 HydrophobicContact CG1-CG 3.92Å; I567-L590 HydrophobicContact CD1-CD2 4.2Å; I567-L590 HydrophobicContact CG2-CD2 3.97Å; I567-L593 HydrophobicContact CD1-CD1 4.25Å; I567-L593 HydrophobicContact CD1-CD2 4.18Å; I567-L593 HydrophobicContact CG1-CD1 4.27Å; I567-L593 HydrophobicContact CG2-CD1 3.66Å
568	L	95.6	Very high	93.2	Very high	60 Å²	60	68.8 Å²	68.8	31%	0.314	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	139.6	-176.2	-63.2	177.2	0	0	0	110.2	A551 Q566 F578 S579	A551-L568 HydrophobicContact CB-CD2 3.83Å; Q566-L568 HydrophobicContact CB-CD2 4.35Å; Q566-L568 HydrophobicContact CB-CG 4.42Å; L568-F578 WeakPolarHBondContact O-CA 3.2Å; L568-S579 PolarHBondContact N-O 2.73Å; L568-S579 PolarHBondContact O-N 3.47Å
569	P	92.9	Very high	93.2	Very high	43 Å²	43	67.6 Å²	67.6	28%	0.279	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	134.7	167.6	30.7	-31.7	0	0	0	109.9	K550 V576 F577 F578	K550-P569 HydrophobicContact CB-CG 4.01Å; K550-P569 WeakPolarHBondContact O-CD 3.41Å; K550-P569 WeakPolarHBondContact O-CG 3.43Å; P569-V576 HydrophobicContact CB-CG1 3.83Å; P569-F577 CarbonylContact C-O 3.55Å; P569-F577 WeakPolarHBondContact CA-O 3.34Å; P569-F578 HydrophobicContact CB-CD1 4.46Å; P569-F578 HydrophobicContact CB-CE1 4.28Å
570	C	90.6	Very high	93.4	Very high	34 Å²	34	62.7 Å²	62.7	23%	0.23	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	145.4	168.1	53.9	0	0	0	0	109.6	V576 F577	C570-V576 CarbonylContact O-C 3.53Å; C570-V576 WeakPolarHBondContact O-CA 3.36Å; C570-F577 PolarHBondContact N-O 3.26Å; C570-F577 PolarHBondContact O-N 2.74Å
571	E	89.7	Confident	93.5	Very high	154 Å²	154	62.1 Å²	62.1	72%	0.72	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.1	178.4	-74.9	178.9	-165.9	0	0	109.4	Q575 V576	E571-Q575 WeakPolarHBondContact CA-O 3.27Å; E571-V576 HydrophobicContact CG-CG2 3.97Å
572	E	89	Confident	93.3	Very high	82 Å²	82	62.6 Å²	62.6	38%	0.383	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	126.9	175	-178.6	173.9	-139.4	0	0	108.1	G574 Q575 F577 K586	E572-G574 PolarHBondContact O-N 2.75Å; E572-G574 VanDerWaalsContact O-N 3.08Å; E572-Q575 PolarHBondContact N-O 3.42Å; E572-Q575 PolarHBondContact O-N 3.31Å; E572-F577 HydrophobicContact CB-CD2 4.21Å; E572-F577 HydrophobicContact CB-CE2 4.03Å; E572-K586 IonicContact OE1-NZ 2.88Å; E572-K586 PolarHBondContact OE1-NZ 3.27Å; E572-K586 WeakPolarHBondContact OE2-CD 3.47Å; E572-K586 WeakPolarHBondContact OE2-CE 3.44Å; E572-K586 IonicContact OE2-NZ 3.18Å; E572-K586 PolarHBondContact OE2-NZ 3.47Å
573	D	89.4	Confident	93	Very high	159 Å²	159	61.9 Å²	61.9	85%	0.85	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	32.8	-177.6	-60.2	-33.4	0	0	0	114.7	Q575	D573-Q575 PolarHBondContact O-N 2.77Å
574	G	86.3	Confident	92.7	Very high	78 Å²	78	65.6 Å²	65.6	80%	0.804	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	4.9	-178	0	0	0	0	0	114.6	E572	E572-G574 PolarHBondContact O-N 2.75Å; E572-G574 VanDerWaalsContact O-N 3.08Å
575	Q	87.6	Confident	92.5	Very high	55 Å²	55	65.2 Å²	65.2	26%	0.257	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	137	171.1	-176	167.3	14.4	0	0	110.3	N493 E571 E572 D573 F577	N493-Q575 PolarHBondContact ND2-OE1 3.33Å; E571-Q575 WeakPolarHBondContact CA-O 3.27Å; E572-Q575 PolarHBondContact N-O 3.42Å; E572-Q575 PolarHBondContact O-N 3.31Å; D573-Q575 PolarHBondContact O-N 2.77Å; Q575-F577 HydrophobicContact CB-CE2 3.78Å; Q575-F577 HydrophobicContact CB-CZ 4.14Å; Q575-F577 HydrophobicContact CG-CD2 4.38Å; Q575-F577 HydrophobicContact CG-CE1 4.39Å; Q575-F577 HydrophobicContact CG-CE2 3.76Å; Q575-F577 HydrophobicContact CG-CZ 3.77Å
576	V	89.6	Confident	92.4	Very high	65 Å²	65	67.2 Å²	67.2	39%	0.394	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	130.1	173.8	-179.7	0	0	0	0	109.5	P569 C570 E571	P569-V576 HydrophobicContact CB-CG1 3.83Å; C570-V576 CarbonylContact O-C 3.53Å; C570-V576 WeakPolarHBondContact O-CA 3.36Å; E571-V576 HydrophobicContact CG-CG2 3.97Å
577	F	93.6	Very high	92.3	Very high	27 Å²	27	63.2 Å²	63.2	12%	0.118	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	163.2	170.9	-61.6	-89.7	0	0	0	110.2	P569 C570 E572 Q575 K586 F587 T588	P569-F577 CarbonylContact C-O 3.55Å; P569-F577 WeakPolarHBondContact CA-O 3.34Å; C570-F577 PolarHBondContact N-O 3.26Å; C570-F577 PolarHBondContact O-N 2.74Å; E572-F577 HydrophobicContact CB-CD2 4.21Å; E572-F577 HydrophobicContact CB-CE2 4.03Å; Q575-F577 HydrophobicContact CB-CE2 3.78Å; Q575-F577 HydrophobicContact CB-CZ 4.14Å; Q575-F577 HydrophobicContact CG-CD2 4.38Å; Q575-F577 HydrophobicContact CG-CE1 4.39Å; Q575-F577 HydrophobicContact CG-CE2 3.76Å; Q575-F577 HydrophobicContact CG-CZ 3.77Å; F577-K586 HydrophobicContact CB-CB 3.98Å; F577-K586 HydrophobicContact CB-CG 4.46Å; F577-K586 HydrophobicContact CD1-CB 4.1Å; F577-K586 HydrophobicContact CG-CB 4.13Å; F577-F587 CarbonylContact C-O 3.56Å; F577-F587 VanDerWaalsContact CA-O 3.27Å; F577-F587 WeakPolarHBondContact CA-O 3.41Å; F577-T588 HydrophobicContact CD1-CG2 4.14Å; F577-T588 HydrophobicContact CE1-CG2 3.83Å
578	F	95.1	Very high	92.1	Very high	35 Å²	35	65.9 Å²	65.9	15%	0.154	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	139.6	173.7	-63.6	-77.3	0	0	0	110	F552 I567 L568 P569 F587 L590 L593	F552-F578 HydrophobicContact CD2-CD1 4.31Å; F552-F578 AromaticContact CD2-CE1 3.97Å; F552-F578 HydrophobicContact CD2-CE1 3.97Å; F552-F578 HydrophobicContact CE2-CD1 4.41Å; F552-F578 AromaticContact CE2-CE1 3.64Å; F552-F578 HydrophobicContact CE2-CE1 3.64Å; F552-F578 HydrophobicContact CE2-CZ 4.1Å; I567-F578 HydrophobicContact CG2-CB 3.8Å; I567-F578 HydrophobicContact CG2-CD1 4.13Å; I567-F578 HydrophobicContact CG2-CG 4.36Å; L568-F578 WeakPolarHBondContact O-CA 3.2Å; P569-F578 HydrophobicContact CB-CD1 4.46Å; P569-F578 HydrophobicContact CB-CE1 4.28Å; F578-F587 PolarHBondContact N-O 2.94Å; F578-F587 WeakPolarHBondContact O-CD2 3.29Å; F578-F587 PolarHBondContact O-N 3.27Å; F578-L590 HydrophobicContact CB-CD2 4.46Å; F578-L590 HydrophobicContact CD1-CD2 4.23Å; F578-L590 HydrophobicContact CD2-CD2 4.47Å; F578-L590 HydrophobicContact CG-CD2 4.12Å; F578-L593 HydrophobicContact CB-CD1 4.25Å
579	S	95.8	Very high	91.9	Very high	4 Å²	4	65.3 Å²	65.3	3%	0.028	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	151.6	178.6	169.7	0	0	0	0	111.8	I567 L568 D581 D582 G583 T585	I567-S579 WeakPolarHBondContact CA-O 3.47Å; L568-S579 PolarHBondContact N-O 2.73Å; L568-S579 PolarHBondContact O-N 3.47Å; S579-D581 PolarHBondContact OG-N 2.74Å; S579-D581 PolarHBondContact OG-OD1 2.76Å; S579-D582 PolarHBondContact OG-N 3.05Å; S579-G583 WeakPolarHBondContact OG-CA 3.46Å; S579-G583 PolarHBondContact OG-N 3.31Å; S579-T585 WeakPolarHBondContact CB-O 3.23Å; S579-T585 PolarHBondContact OG-O 3.41Å
580	L	96.2	Very high	92	Very high	24 Å²	24	63.3 Å²	63.3	13%	0.126	35%	0.346	C	S	.	.	S	Bend	trans	-104.8	-7.1	172.8	-86.3	164.9	0	0	0	112.7	L554 F565 I567 L593 Y597 V603 L604	L554-L580 HydrophobicContact CD2-CD1 4.08Å; F565-L580 HydrophobicContact CB-CD2 3.43Å; F565-L580 VanDerWaalsContact CB-CD2 3.43Å; F565-L580 HydrophobicContact CG-CD2 4.49Å; I567-L580 HydrophobicContact CG1-CD1 4.49Å; I567-L580 HydrophobicContact CG1-CD2 3.67Å; I567-L580 HydrophobicContact CG1-CG 3.92Å; L580-L593 HydrophobicContact CD1-CD1 4.34Å; L580-L593 HydrophobicContact CD1-CD2 3.92Å; L580-L593 HydrophobicContact CD1-CG 4.4Å; L580-L593 HydrophobicContact CG-CD1 4.41Å; L580-Y597 HydrophobicContact CB-CE2 4.41Å; L580-Y597 HydrophobicContact CD1-CD2 3.8Å; L580-Y597 HydrophobicContact CD1-CE1 4.47Å; L580-Y597 HydrophobicContact CD1-CE2 3.34Å; L580-Y597 HydrophobicContact CG-CE2 4.38Å; L580-V603 HydrophobicContact CB-CG2 4.15Å; L580-L604 HydrophobicContact CD1-CD2 4.37Å
581	D	93.9	Very high	92.2	Very high	28 Å²	28	63.1 Å²	63.1	15%	0.15	34%	0.343	C	S	.	.	S	Bend	trans	-137.3	43	-166.3	57.2	-5.6	0	0	0	111.2	S579 G583 E584 T585 V603	S579-D581 PolarHBondContact OG-N 2.74Å; S579-D581 PolarHBondContact OG-OD1 2.76Å; D581-G583 PolarHBondContact O-N 3.44Å; D581-G583 VanDerWaalsContact O-N 3.13Å; D581-E584 HydrophobicContact CB-CB 4.35Å; D581-E584 WeakPolarHBondContact O-CB 2.98Å; D581-E584 WeakPolarHBondContact O-CG 3.45Å; D581-E584 PolarHBondContact O-N 3.4Å; D581-E584 VanDerWaalsContact O-N 3.12Å; D581-T585 VanDerWaalsContact CG-N 3.33Å; D581-T585 PolarHBondContact OD1-N 3.45Å; D581-T585 VanDerWaalsContact OD2-CB 3.23Å; D581-T585 WeakPolarHBondContact OD2-CB 3.19Å; D581-T585 PolarHBondContact OD2-N 3.14Å; D581-T585 PolarHBondContact OD2-OG1 3.32Å; D581-V603 HydrophobicContact CB-CG1 3.69Å; D581-V603 HydrophobicContact CB-CG2 4.26Å
582	D	89.9	Confident	92.5	Very high	158 Å²	158	59.9 Å²	59.9	85%	0.845	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	32.8	174.7	-153	27.2	0	0	0	115	S579	S579-D582 PolarHBondContact OG-N 3.05Å
583	G	90.9	Very high	92.9	Very high	14 Å²	14	56 Å²	56	14%	0.144	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.3	-0.2	177	0	0	0	0	0	115.1	S579 D581 K586	S579-G583 WeakPolarHBondContact OG-CA 3.46Å; S579-G583 PolarHBondContact OG-N 3.31Å; D581-G583 PolarHBondContact O-N 3.44Å; D581-G583 VanDerWaalsContact O-N 3.13Å; G583-K586 WeakPolarHBondContact O-CE 3.3Å; G583-K586 VanDerWaalsContact O-CG 3.3Å; G583-K586 WeakPolarHBondContact O-CG 3.42Å
584	E	90.8	Very high	93.2	Very high	168 Å²	168	48.5 Å²	48.5	79%	0.785	27%	0.269	S	S	*	.	S	Bend	trans	-62.5	-46.2	174.6	-69.5	-64.1	133.4	0	0	111.4	D581	D581-E584 HydrophobicContact CB-CB 4.35Å; D581-E584 WeakPolarHBondContact O-CB 2.98Å; D581-E584 WeakPolarHBondContact O-CG 3.45Å; D581-E584 PolarHBondContact O-N 3.4Å; D581-E584 VanDerWaalsContact O-N 3.12Å
585	T	94.3	Very high	93.7	Very high	40 Å²	40	49.8 Å²	49.8	25%	0.245	25%	0.254	C	S	.	.	S	Bend	trans	-111.8	116.7	172.4	-43.9	0	0	0	0	110.1	S579 D581 F587 F596	S579-T585 WeakPolarHBondContact CB-O 3.23Å; S579-T585 PolarHBondContact OG-O 3.41Å; D581-T585 VanDerWaalsContact CG-N 3.33Å; D581-T585 PolarHBondContact OD1-N 3.45Å; D581-T585 VanDerWaalsContact OD2-CB 3.23Å; D581-T585 WeakPolarHBondContact OD2-CB 3.19Å; D581-T585 PolarHBondContact OD2-N 3.14Å; D581-T585 PolarHBondContact OD2-OG1 3.32Å; T585-F587 HydrophobicContact CG2-CE1 4.02Å; T585-F587 HydrophobicContact CG2-CE2 3.68Å; T585-F587 HydrophobicContact CG2-CZ 3.3Å; T585-F596 HydrophobicContact CG2-CE1 4.35Å; T585-F596 HydrophobicContact CG2-CZ 4.29Å
586	K	94.6	Very high	94.1	Very high	86 Å²	86	50.2 Å²	50.2	37%	0.374	26%	0.255	S	S	.	.			trans	-109.7	134.7	-175	-60.3	176.2	-170.7	166.5	0	111.3	E572 F577 G583	E572-K586 IonicContact OE1-NZ 2.88Å; E572-K586 PolarHBondContact OE1-NZ 3.27Å; E572-K586 WeakPolarHBondContact OE2-CD 3.47Å; E572-K586 WeakPolarHBondContact OE2-CE 3.44Å; E572-K586 IonicContact OE2-NZ 3.18Å; E572-K586 PolarHBondContact OE2-NZ 3.47Å; F577-K586 HydrophobicContact CB-CB 3.98Å; F577-K586 HydrophobicContact CB-CG 4.46Å; F577-K586 HydrophobicContact CD1-CB 4.1Å; F577-K586 HydrophobicContact CG-CB 4.13Å; G583-K586 WeakPolarHBondContact O-CE 3.3Å; G583-K586 VanDerWaalsContact O-CG 3.3Å; G583-K586 WeakPolarHBondContact O-CG 3.42Å
587	F	94.9	Very high	94.5	Very high	13 Å²	13	47.1 Å²	47.1	6%	0.057	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-123.8	139.4	177.6	-55.6	-77.9	0	0	0	110.9	F577 F578 T585 D589 Q592 L593 F596 Y597	F577-F587 CarbonylContact C-O 3.56Å; F577-F587 VanDerWaalsContact CA-O 3.27Å; F577-F587 WeakPolarHBondContact CA-O 3.41Å; F578-F587 PolarHBondContact N-O 2.94Å; F578-F587 WeakPolarHBondContact O-CD2 3.29Å; F578-F587 PolarHBondContact O-N 3.27Å; T585-F587 HydrophobicContact CG2-CE1 4.02Å; T585-F587 HydrophobicContact CG2-CE2 3.68Å; T585-F587 HydrophobicContact CG2-CZ 3.3Å; F587-D589 VanDerWaalsContact C-N 3.29Å; F587-D589 PolarHBondContact O-N 2.89Å; F587-Q592 HydrophobicContact CB-CB 4.4Å; F587-Q592 HydrophobicContact CD1-CB 4.29Å; F587-L593 HydrophobicContact CB-CB 3.91Å; F587-L593 HydrophobicContact CD1-CB 4.29Å; F587-L593 HydrophobicContact CD2-CB 3.66Å; F587-L593 HydrophobicContact CD2-CD1 3.72Å; F587-L593 HydrophobicContact CD2-CG 3.63Å; F587-L593 HydrophobicContact CE2-CB 4.25Å; F587-L593 HydrophobicContact CE2-CD1 4.23Å; F587-L593 HydrophobicContact CE2-CG 3.9Å; F587-L593 HydrophobicContact CG-CB 3.66Å; F587-L593 HydrophobicContact CG-CD1 4.48Å; F587-L593 HydrophobicContact CG-CG 4.19Å; F587-F596 HydrophobicContact CD1-CB 4.32Å; F587-F596 HydrophobicContact CE1-CB 3.37Å; F587-F596 AromaticContact CE1-CD1 3.91Å; F587-F596 HydrophobicContact CE1-CD1 3.91Å; F587-F596 AromaticContact CE1-CD2 4Å; F587-F596 HydrophobicContact CE1-CD2 4Å; F587-F596 AromaticContact CE1-CG 3.49Å; F587-F596 HydrophobicContact CE1-CG 3.49Å; F587-F596 VanDerWaalsContact CE1-CG 3.49Å; F587-F596 HydrophobicContact CZ-CB 3.78Å; F587-F596 AromaticContact CZ-CD1 3.45Å; F587-F596 HydrophobicContact CZ-CD1 3.45Å; F587-F596 VanDerWaalsContact CZ-CD1 3.45Å; F587-F596 HydrophobicContact CZ-CD2 4.27Å; F587-F596 HydrophobicContact CZ-CE1 4.06Å; F587-F596 AromaticContact CZ-CG 3.57Å; F587-F596 HydrophobicContact CZ-CG 3.57Å; F587-Y597 AromaticContact CE2-CE2 3.76Å; F587-Y597 HydrophobicContact CE2-CE2 3.76Å; F587-Y597 AromaticContact CZ-CE2 3.94Å; F587-Y597 HydrophobicContact CZ-CE2 3.94Å
588	T	92.9	Very high	94.7	Very high	56 Å²	56	49.4 Å²	49.4	34%	0.344	25%	0.248	S	C	.	.	S	Bend	trans	-71.8	-26	-179.5	58.6	0	0	0	0	112.9	F577 Q592	F577-T588 HydrophobicContact CD1-CG2 4.14Å; F577-T588 HydrophobicContact CE1-CG2 3.83Å; T588-Q592 PolarHBondContact OG1-NE2 3.25Å; T588-Q592 PolarHBondContact OG1-OE1 3.43Å
589	D	92.5	Very high	94.8	Very high	48 Å²	48	53.5 Å²	53.5	26%	0.257	27%	0.271	S	S	.	.	S	Bend	trans	-150.7	172.3	174.9	63.5	46.4	0	0	0	111.6	F587 I591 Q592 L593	F587-D589 VanDerWaalsContact C-N 3.29Å; F587-D589 PolarHBondContact O-N 2.89Å; D589-I591 PolarHBondContact O-N 3.08Å; D589-I591 WeakPolarHBondContact OD1-CA 3.15Å; D589-I591 VanDerWaalsContact OD1-CB 3.32Å; D589-I591 WeakPolarHBondContact OD1-CB 3.49Å; D589-I591 PolarHBondContact OD1-N 2.92Å; D589-Q592 PolarHBondContact OD1-N 2.85Å; D589-L593 PolarHBondContact O-N 3.31Å
590	L	94.6	Very high	94.7	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-68.4	-22.2	179.1	-63.8	179.1	0	0	0	113.4	H511 W516 L542 F552 I567 F578 V594	H511-L590 HydrophobicContact CB-CB 4.16Å; H511-L590 HydrophobicContact CB-CD1 4.22Å; W516-L590 HydrophobicContact CH2-CB 3.97Å; L542-L590 HydrophobicContact CD2-CB 4.44Å; L542-L590 HydrophobicContact CD2-CD1 4.41Å; L542-L590 HydrophobicContact CD2-CD2 4.31Å; F552-L590 HydrophobicContact CB-CD2 4.5Å; F552-L590 HydrophobicContact CD1-CD1 3.86Å; F552-L590 HydrophobicContact CD2-CD1 3.86Å; F552-L590 HydrophobicContact CD2-CD2 3.91Å; F552-L590 HydrophobicContact CD2-CG 4.35Å; F552-L590 HydrophobicContact CE1-CD1 3.86Å; F552-L590 HydrophobicContact CE2-CD1 3.87Å; F552-L590 HydrophobicContact CE2-CD2 4.4Å; F552-L590 HydrophobicContact CE2-CG 4.42Å; F552-L590 HydrophobicContact CG-CD1 3.84Å; F552-L590 HydrophobicContact CG-CD2 4.26Å; F552-L590 HydrophobicContact CZ-CD1 3.86Å; I567-L590 HydrophobicContact CD1-CD2 4.2Å; I567-L590 HydrophobicContact CG2-CD2 3.97Å; F578-L590 HydrophobicContact CB-CD2 4.46Å; F578-L590 HydrophobicContact CD1-CD2 4.23Å; F578-L590 HydrophobicContact CD2-CD2 4.47Å; F578-L590 HydrophobicContact CG-CD2 4.12Å; L590-V594 WeakPolarHBondContact O-CG2 3.41Å; L590-V594 PolarHBondContact O-N 3.36Å
591	I	95.5	Very high	94.6	Very high	29 Å²	29	62.6 Å²	62.6	15%	0.149	31%	0.308	C	S	.	.	H	α-helix	trans	-72.4	-49.9	-178.9	-58.8	174.7	0	0	0	108.5	I510 H511 Q514 W516 D589 L593 V594 E595	I510-I591 HydrophobicContact CB-CD1 4.01Å; I510-I591 HydrophobicContact CG2-CD1 3.73Å; H511-I591 HydrophobicContact CB-CG1 4.46Å; Q514-I591 HydrophobicContact CG-CD1 4.38Å; Q514-I591 HydrophobicContact CG-CG1 4.24Å; W516-I591 HydrophobicContact CZ2-CG1 4.3Å; D589-I591 PolarHBondContact O-N 3.08Å; D589-I591 WeakPolarHBondContact OD1-CA 3.15Å; D589-I591 VanDerWaalsContact OD1-CB 3.32Å; D589-I591 WeakPolarHBondContact OD1-CB 3.49Å; D589-I591 PolarHBondContact OD1-N 2.92Å; I591-L593 VanDerWaalsContact C-N 3.27Å; I591-L593 PolarHBondContact O-N 3.43Å; I591-V594 PolarHBondContact O-N 3.25Å; I591-V594 VanDerWaalsContact O-N 3.12Å; I591-E595 HydrophobicContact CG2-CG 4.41Å; I591-E595 WeakPolarHBondContact O-CG 3.33Å; I591-E595 PolarHBondContact O-N 2.89Å
592	Q	95.3	Very high	94.6	Very high	87 Å²	87	63.4 Å²	63.4	41%	0.407	32%	0.323	S	S	.	.	H	α-helix	trans	-58.2	-40.2	174.3	-73.3	-171.8	-5.3	0	0	112.2	F587 T588 D589 E595 F596	F587-Q592 HydrophobicContact CB-CB 4.4Å; F587-Q592 HydrophobicContact CD1-CB 4.29Å; T588-Q592 PolarHBondContact OG1-NE2 3.25Å; T588-Q592 PolarHBondContact OG1-OE1 3.43Å; D589-Q592 PolarHBondContact OD1-N 2.85Å; Q592-E595 PolarHBondContact O-N 3.01Å; Q592-F596 VanDerWaalsContact O-CB 3.3Å; Q592-F596 WeakPolarHBondContact O-CB 3.39Å; Q592-F596 PolarHBondContact O-N 2.81Å
593	L	96.8	Very high	94.9	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.6	-51.3	174.7	-176	155.9	0	0	0	110.6	I567 F578 L580 F587 D589 I591 F596 Y597	I567-L593 HydrophobicContact CD1-CD1 4.25Å; I567-L593 HydrophobicContact CD1-CD2 4.18Å; I567-L593 HydrophobicContact CG1-CD1 4.27Å; I567-L593 HydrophobicContact CG2-CD1 3.66Å; F578-L593 HydrophobicContact CB-CD1 4.25Å; L580-L593 HydrophobicContact CD1-CD1 4.34Å; L580-L593 HydrophobicContact CD1-CD2 3.92Å; L580-L593 HydrophobicContact CD1-CG 4.4Å; L580-L593 HydrophobicContact CG-CD1 4.41Å; F587-L593 HydrophobicContact CB-CB 3.91Å; F587-L593 HydrophobicContact CD1-CB 4.29Å; F587-L593 HydrophobicContact CD2-CB 3.66Å; F587-L593 HydrophobicContact CD2-CD1 3.72Å; F587-L593 HydrophobicContact CD2-CG 3.63Å; F587-L593 HydrophobicContact CE2-CB 4.25Å; F587-L593 HydrophobicContact CE2-CD1 4.23Å; F587-L593 HydrophobicContact CE2-CG 3.9Å; F587-L593 HydrophobicContact CG-CB 3.66Å; F587-L593 HydrophobicContact CG-CD1 4.48Å; F587-L593 HydrophobicContact CG-CG 4.19Å; D589-L593 PolarHBondContact O-N 3.31Å; I591-L593 VanDerWaalsContact C-N 3.27Å; I591-L593 PolarHBondContact O-N 3.43Å; L593-F596 PolarHBondContact O-N 3.41Å; L593-Y597 HydrophobicContact CD2-CD2 3.83Å; L593-Y597 HydrophobicContact CD2-CE2 4.22Å; L593-Y597 HydrophobicContact CG-CD2 4.03Å; L593-Y597 HydrophobicContact CG-CE2 4.06Å; L593-Y597 VanDerWaalsContact O-CD2 3.22Å; L593-Y597 WeakPolarHBondContact O-CD2 3.47Å; L593-Y597 PolarHBondContact O-N 2.8Å
594	V	97.1	Very high	95.2	Very high	2 Å²	2	58.9 Å²	58.9	1%	0.012	30%	0.298	C	S	.	.	H	α-helix	trans	-62.8	-46	-179.8	169.4	0	0	0	0	111.3	W516 F540 L542 L590 I591 F596 Y597 Q598 L608	W516-V594 HydrophobicContact CD2-CG2 4.21Å; W516-V594 HydrophobicContact CE3-CG2 4.27Å; W516-V594 HydrophobicContact CH2-CG2 3.85Å; W516-V594 HydrophobicContact CZ2-CB 4.04Å; W516-V594 HydrophobicContact CZ2-CG1 4.38Å; W516-V594 HydrophobicContact CZ2-CG2 3.76Å; W516-V594 HydrophobicContact CZ3-CG2 4.13Å; F540-V594 HydrophobicContact CE2-CG1 3.81Å; F540-V594 HydrophobicContact CE2-CG2 4.29Å; F540-V594 HydrophobicContact CZ-CG1 3.75Å; L542-V594 HydrophobicContact CD1-CG2 3.94Å; L542-V594 HydrophobicContact CD2-CG2 4.03Å; L590-V594 WeakPolarHBondContact O-CG2 3.41Å; L590-V594 PolarHBondContact O-N 3.36Å; I591-V594 PolarHBondContact O-N 3.25Å; I591-V594 VanDerWaalsContact O-N 3.12Å; V594-F596 VanDerWaalsContact C-N 3.32Å; V594-F596 PolarHBondContact O-N 2.82Å; V594-Y597 CarbonylContact O-C 3.56Å; V594-Y597 PolarHBondContact O-N 3.27Å; V594-Q598 HydrophobicContact CG1-CG 4.27Å; V594-Q598 VanDerWaalsContact O-CG 3.29Å; V594-Q598 WeakPolarHBondContact O-CG 3.47Å; V594-Q598 PolarHBondContact O-N 2.76Å; V594-L608 HydrophobicContact CG1-CD1 4.27Å
595	E	95.9	Very high	95.5	Very high	104 Å²	104	52.1 Å²	52.1	49%	0.486	27%	0.268	S	S	.	.	H	α-helix	trans	-58.7	-43.7	177.6	-72.9	175.7	172.7	0	0	111.7	I591 Q592 Y597 Q598 L599	I591-E595 HydrophobicContact CG2-CG 4.41Å; I591-E595 WeakPolarHBondContact O-CG 3.33Å; I591-E595 PolarHBondContact O-N 2.89Å; Q592-E595 PolarHBondContact O-N 3.01Å; E595-Y597 PolarHBondContact O-N 2.73Å; E595-Q598 PolarHBondContact O-N 2.74Å; E595-L599 PolarHBondContact O-N 3.39Å
596	F	97.2	Very high	95.7	Very high	64 Å²	64	50.9 Å²	50.9	28%	0.281	26%	0.261	S	S	.	.	H	α-helix	trans	-59.6	-48.6	175.4	176.2	-90.5	0	0	0	111.5	T585 F587 Q592 L593 V594 Q598 L599 N600	T585-F596 HydrophobicContact CG2-CE1 4.35Å; T585-F596 HydrophobicContact CG2-CZ 4.29Å; F587-F596 HydrophobicContact CD1-CB 4.32Å; F587-F596 HydrophobicContact CE1-CB 3.37Å; F587-F596 AromaticContact CE1-CD1 3.91Å; F587-F596 HydrophobicContact CE1-CD1 3.91Å; F587-F596 AromaticContact CE1-CD2 4Å; F587-F596 HydrophobicContact CE1-CD2 4Å; F587-F596 AromaticContact CE1-CG 3.49Å; F587-F596 HydrophobicContact CE1-CG 3.49Å; F587-F596 VanDerWaalsContact CE1-CG 3.49Å; F587-F596 HydrophobicContact CZ-CB 3.78Å; F587-F596 AromaticContact CZ-CD1 3.45Å; F587-F596 HydrophobicContact CZ-CD1 3.45Å; F587-F596 VanDerWaalsContact CZ-CD1 3.45Å; F587-F596 HydrophobicContact CZ-CD2 4.27Å; F587-F596 HydrophobicContact CZ-CE1 4.06Å; F587-F596 AromaticContact CZ-CG 3.57Å; F587-F596 HydrophobicContact CZ-CG 3.57Å; Q592-F596 VanDerWaalsContact O-CB 3.3Å; Q592-F596 WeakPolarHBondContact O-CB 3.39Å; Q592-F596 PolarHBondContact O-N 2.81Å; L593-F596 PolarHBondContact O-N 3.41Å; V594-F596 VanDerWaalsContact C-N 3.32Å; V594-F596 PolarHBondContact O-N 2.82Å; F596-Q598 VanDerWaalsContact C-N 3.28Å; F596-Q598 PolarHBondContact O-N 3.08Å; F596-L599 PolarHBondContact O-N 3.09Å; F596-L599 VanDerWaalsContact O-N 3.16Å; F596-N600 HydrophobicContact CD1-CB 4.28Å; F596-N600 HydrophobicContact CE1-CB 3.9Å; F596-N600 HydrophobicContact CE2-CB 4.2Å; F596-N600 HydrophobicContact CZ-CB 3.86Å; F596-N600 WeakPolarHBondContact O-CB 3.31Å; F596-N600 PolarHBondContact O-N 2.99Å; F596-N600 PolarHBondContact O-ND2 2.74Å
597	Y	97.8	Very high	95.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-77.3	-11.2	-178.4	-75.5	-73.3	0	0	0	114.2	L580 F587 L593 V594 E595 N600 R601 V603 L604 K607 L608	L580-Y597 HydrophobicContact CB-CE2 4.41Å; L580-Y597 HydrophobicContact CD1-CD2 3.8Å; L580-Y597 HydrophobicContact CD1-CE1 4.47Å; L580-Y597 HydrophobicContact CD1-CE2 3.34Å; L580-Y597 HydrophobicContact CG-CE2 4.38Å; F587-Y597 AromaticContact CE2-CE2 3.76Å; F587-Y597 HydrophobicContact CE2-CE2 3.76Å; F587-Y597 AromaticContact CZ-CE2 3.94Å; F587-Y597 HydrophobicContact CZ-CE2 3.94Å; L593-Y597 HydrophobicContact CD2-CD2 3.83Å; L593-Y597 HydrophobicContact CD2-CE2 4.22Å; L593-Y597 HydrophobicContact CG-CD2 4.03Å; L593-Y597 HydrophobicContact CG-CE2 4.06Å; L593-Y597 VanDerWaalsContact O-CD2 3.22Å; L593-Y597 WeakPolarHBondContact O-CD2 3.47Å; L593-Y597 PolarHBondContact O-N 2.8Å; V594-Y597 CarbonylContact O-C 3.56Å; V594-Y597 PolarHBondContact O-N 3.27Å; E595-Y597 PolarHBondContact O-N 2.73Å; Y597-N600 CarbonylContact C-O 3.58Å; Y597-N600 VanDerWaalsContact CA-O 3.23Å; Y597-N600 WeakPolarHBondContact CA-O 3.33Å; Y597-R601 WeakPolarHBondContact CD1-O 3.41Å; Y597-V603 HydrophobicContact CE1-CG2 4.37Å; Y597-L604 HydrophobicContact CD1-CB 4.49Å; Y597-L604 HydrophobicContact CD1-CD1 3.42Å; Y597-L604 VanDerWaalsContact CD1-CD1 3.42Å; Y597-L604 HydrophobicContact CD1-CG 3.69Å; Y597-L604 HydrophobicContact CE1-CD1 4.09Å; Y597-L604 HydrophobicContact CE1-CG 3.87Å; Y597-L604 HydrophobicContact CG-CD1 3.67Å; Y597-L604 HydrophobicContact CG-CG 4.37Å; Y597-K607 WeakPolarHBondContact O-CA 3.43Å; Y597-L608 PolarHBondContact O-N 3.02Å
598	Q	97.1	Very high	96	Very high	75 Å²	75	51 Å²	51	35%	0.35	26%	0.262	S	S	.	.	H	α-helix	trans	-73.1	-36.7	165.5	-76.7	177	-25.4	0	0	111.5	V594 E595 F596 L608	V594-Q598 HydrophobicContact CG1-CG 4.27Å; V594-Q598 VanDerWaalsContact O-CG 3.29Å; V594-Q598 WeakPolarHBondContact O-CG 3.47Å; V594-Q598 PolarHBondContact O-N 2.76Å; E595-Q598 PolarHBondContact O-N 2.74Å; F596-Q598 VanDerWaalsContact C-N 3.28Å; F596-Q598 PolarHBondContact O-N 3.08Å; Q598-L608 WeakPolarHBondContact CA-O 3.25Å; Q598-L608 HydrophobicContact CG-CB 3.77Å
599	L	96.2	Very high	96.1	Very high	121 Å²	121	53.9 Å²	53.9	63%	0.634	27%	0.27	S	S	*	.	H	α-helix	trans	-87.5	-34	179.7	-63.8	175.7	0	0	0	112.6	E595 F596 K607	E595-L599 PolarHBondContact O-N 3.39Å; F596-L599 PolarHBondContact O-N 3.09Å; F596-L599 VanDerWaalsContact O-N 3.16Å; L599-K607 WeakPolarHBondContact O-CD 3.26Å; L599-K607 WeakPolarHBondContact O-CE 3.42Å; L599-K607 PolarHBondContact O-NZ 3.03Å
600	N	94.9	Very high	96.3	Very high	71 Å²	71	53.6 Å²	53.6	38%	0.38	27%	0.267	S	S	.	.			trans	-124.1	144.3	-171	-58.1	-69.8	0	0	0	111	F596 Y597	F596-N600 HydrophobicContact CD1-CB 4.28Å; F596-N600 HydrophobicContact CE1-CB 3.9Å; F596-N600 HydrophobicContact CE2-CB 4.2Å; F596-N600 HydrophobicContact CZ-CB 3.86Å; F596-N600 WeakPolarHBondContact O-CB 3.31Å; F596-N600 PolarHBondContact O-N 2.99Å; F596-N600 PolarHBondContact O-ND2 2.74Å; Y597-N600 CarbonylContact C-O 3.58Å; Y597-N600 VanDerWaalsContact CA-O 3.23Å; Y597-N600 WeakPolarHBondContact CA-O 3.33Å
601	R	94.6	Very high	96.3	Very high	149 Å²	149	55 Å²	55	56%	0.562	28%	0.276	S	S	*	.			trans	-75.2	-41.6	175.4	-173.9	-176.7	83.4	168.3	-0.3	111.4	Y597 V603 L604 P605 K607	Y597-R601 WeakPolarHBondContact CD1-O 3.41Å; R601-V603 PolarHBondContact O-N 3.01Å; R601-L604 WeakPolarHBondContact CD-O 3.25Å; R601-L604 WeakPolarHBondContact CG-O 3.26Å; R601-L604 PolarHBondContact NE-O 3.02Å; R601-L604 WeakPolarHBondContact O-CB 3.4Å; R601-L604 PolarHBondContact O-N 3.12Å; R601-P605 WeakPolarHBondContact CD-O 3.33Å; R601-K607 HydrophobicContact CB-CG 4.37Å
602	G	93.8	Very high	96.2	Very high	44 Å²	44	53.6 Å²	53.6	45%	0.454	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	-132.6	-171	0	0	0	0	0	111.5	L604	G602-L604 VanDerWaalsContact C-N 3.29Å; G602-L604 PolarHBondContact O-N 2.95Å
603	V	95.3	Very high	95.9	Very high	75 Å²	75	49.7 Å²	49.7	46%	0.455	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-7.2	177.4	-60.2	0	0	0	0	115	L580 D581 Y597 R601	L580-V603 HydrophobicContact CB-CG2 4.15Å; D581-V603 HydrophobicContact CB-CG1 3.69Å; D581-V603 HydrophobicContact CB-CG2 4.26Å; Y597-V603 HydrophobicContact CE1-CG2 4.37Å; R601-V603 PolarHBondContact O-N 3.01Å
604	L	97.6	Very high	95	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.01	27%	0.27	C	S	.	.	S	Bend	trans	-77.2	157	-179.8	-59.9	-179.1	0	0	0	111.2	L554 L556 F565 L580 Y597 R601 G602 C606 L608	L554-L604 HydrophobicContact CD2-CD1 3.73Å; L554-L604 HydrophobicContact CD2-CD2 3.77Å; L554-L604 HydrophobicContact CD2-CG 4.42Å; L556-L604 HydrophobicContact CD2-CB 4.27Å; L556-L604 HydrophobicContact CD2-CD1 4.41Å; L556-L604 HydrophobicContact CD2-CD2 4.45Å; F565-L604 HydrophobicContact CD1-CD2 3.95Å; F565-L604 HydrophobicContact CD2-CD2 3.88Å; F565-L604 HydrophobicContact CE1-CD2 4.07Å; F565-L604 HydrophobicContact CE2-CD2 4.01Å; F565-L604 HydrophobicContact CG-CD2 3.87Å; F565-L604 HydrophobicContact CZ-CD2 4.11Å; L580-L604 HydrophobicContact CD1-CD2 4.37Å; Y597-L604 HydrophobicContact CD1-CB 4.49Å; Y597-L604 HydrophobicContact CD1-CD1 3.42Å; Y597-L604 VanDerWaalsContact CD1-CD1 3.42Å; Y597-L604 HydrophobicContact CD1-CG 3.69Å; Y597-L604 HydrophobicContact CE1-CD1 4.09Å; Y597-L604 HydrophobicContact CE1-CG 3.87Å; Y597-L604 HydrophobicContact CG-CD1 3.67Å; Y597-L604 HydrophobicContact CG-CG 4.37Å; R601-L604 WeakPolarHBondContact CD-O 3.25Å; R601-L604 WeakPolarHBondContact CG-O 3.26Å; R601-L604 PolarHBondContact NE-O 3.02Å; R601-L604 WeakPolarHBondContact O-CB 3.4Å; R601-L604 PolarHBondContact O-N 3.12Å; G602-L604 VanDerWaalsContact C-N 3.29Å; G602-L604 PolarHBondContact O-N 2.95Å; L604-C606 VanDerWaalsContact C-N 3.29Å; L604-C606 WeakPolarHBondContact CB-O 3.36Å; L604-C606 PolarHBondContact O-N 3.5Å; L604-L608 HydrophobicContact CD1-CD2 3.9Å; L604-L608 HydrophobicContact CD1-CG 4.16Å
605	P	97.2	Very high	93.9	Very high	26 Å²	26	52.9 Å²	52.9	17%	0.169	27%	0.27	C	S	.	.	S	Bend	trans	-70	-26.2	175.8	28.6	-37.5	0	0	0	113.2	L556 H558 K563 F565 R601	L556-P605 HydrophobicContact CD2-CG 3.83Å; H558-P605 HydrophobicContact CB-CB 4.38Å; H558-P605 HydrophobicContact CB-CG 4.01Å; K563-P605 HydrophobicContact CD-CG 4.28Å; F565-P605 HydrophobicContact CZ-CG 4.22Å; R601-P605 WeakPolarHBondContact CD-O 3.33Å
606	C	97.3	Very high	92.7	Very high	15 Å²	15	51.4 Å²	51.4	10%	0.101	28%	0.276	C	S	.	.	S	Bend	trans	-151.5	165.4	175.4	65.1	0	0	0	0	110.2	G538 H558 L604	G538-C606 PolarHBondContact N-SG 2.71Å; H558-C606 VanDerWaalsContact CD2-SG 3.59Å; L604-C606 VanDerWaalsContact C-N 3.29Å; L604-C606 WeakPolarHBondContact CB-O 3.36Å; L604-C606 PolarHBondContact O-N 3.5Å
607	K	98.2	Very high	91.6	Very high	98 Å²	98	50.6 Å²	50.6	43%	0.426	27%	0.274	S	S	.	.			trans	-66.6	149.5	174.2	-57.8	-174.5	-174.7	-167.9	0	110.7	G538 Y597 L599 R601 K609	G538-K607 VanDerWaalsContact CA-O 3.3Å; G538-K607 WeakPolarHBondContact CA-O 2.96Å; Y597-K607 WeakPolarHBondContact O-CA 3.43Å; L599-K607 WeakPolarHBondContact O-CD 3.26Å; L599-K607 WeakPolarHBondContact O-CE 3.42Å; L599-K607 PolarHBondContact O-NZ 3.03Å; R601-K607 HydrophobicContact CB-CG 4.37Å; K607-K609 PolarHBondContact O-N 2.85Å
608	L	98.2	Very high	91.3	Very high	3 Å²	3	53.1 Å²	53.1	2%	0.016	29%	0.288	C	S	.	.			trans	-69.1	127.4	168.4	-55.9	-175.7	0	0	0	108.8	F540 L554 L556 V594 Y597 Q598 L604	F540-L608 HydrophobicContact CB-CD2 3.87Å; F540-L608 HydrophobicContact CD1-CB 3.79Å; F540-L608 HydrophobicContact CD1-CD2 4.11Å; F540-L608 HydrophobicContact CD1-CG 4.36Å; F540-L608 HydrophobicContact CD2-CD1 3.99Å; F540-L608 HydrophobicContact CD2-CD2 4.2Å; F540-L608 HydrophobicContact CD2-CG 4.49Å; F540-L608 HydrophobicContact CE1-CB 3.73Å; F540-L608 HydrophobicContact CE2-CD1 3.93Å; F540-L608 HydrophobicContact CG-CB 4.26Å; F540-L608 HydrophobicContact CG-CD1 4.32Å; F540-L608 HydrophobicContact CG-CD2 3.79Å; F540-L608 HydrophobicContact CG-CG 4.33Å; F540-L608 HydrophobicContact CZ-CB 4.14Å; F540-L608 HydrophobicContact CZ-CD1 4.22Å; L554-L608 HydrophobicContact CD1-CD1 4.36Å; L554-L608 HydrophobicContact CD1-CD2 4.03Å; L554-L608 HydrophobicContact CD2-CD2 4.18Å; L556-L608 HydrophobicContact CD1-CD2 3.78Å; L556-L608 HydrophobicContact CD2-CD2 4.48Å; V594-L608 HydrophobicContact CG1-CD1 4.27Å; Y597-L608 PolarHBondContact O-N 3.02Å; Q598-L608 WeakPolarHBondContact CA-O 3.25Å; Q598-L608 HydrophobicContact CG-CB 3.77Å; L604-L608 HydrophobicContact CD1-CD2 3.9Å; L604-L608 HydrophobicContact CD1-CG 4.16Å
609	K	95.6	Very high	91	Very high	117 Å²	117	51.9 Å²	51.9	51%	0.509	28%	0.284	S	S	.	.			trans	-126.9	-42.3	-174.9	-67	179.7	-175.3	173.2	0	112.7	G538 K607	G538-K609 PolarHBondContact O-N 2.95Å; K607-K609 PolarHBondContact O-N 2.85Å
610	H	95.6	Very high	90.7	Very high	42 Å²	42	48.1 Å²	48.1	19%	0.194	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	104.2	-167.8	-56.4	-54.3	0	0	0	108.8	Y274 V536 G538 L539 F540 C612	Y274-H610 HydrophobicContact CD1-CB 3.92Å; Y274-H610 AromaticContact CD1-CG 3.68Å; Y274-H610 AromaticContact CD1-ND1 3.64Å; Y274-H610 HydrophobicContact CD2-CB 4.1Å; Y274-H610 HydrophobicContact CE1-CB 3.79Å; Y274-H610 AromaticContact CE1-CG 3.84Å; Y274-H610 AromaticContact CE1-ND1 3.62Å; Y274-H610 HydrophobicContact CE2-CB 3.96Å; Y274-H610 HydrophobicContact CG-CB 4.07Å; V536-H610 VanDerWaalsContact CG2-CD2 3.5Å; V536-H610 WeakPolarHBondContact CG2-CD2 3.37Å; G538-H610 PolarHBondContact O-N 3.22Å; L539-H610 CarbonylContact C-O 3.56Å; L539-H610 VanDerWaalsContact CA-O 3.3Å; L539-H610 WeakPolarHBondContact CA-O 3.3Å; L539-H610 HydrophobicContact CB-CB 4.38Å; L539-H610 HydrophobicContact CD1-CB 3.81Å; L539-H610 WeakPolarHBondContact CD1-O 3.19Å; F540-H610 VanDerWaalsContact CD1-O 3.24Å; F540-H610 WeakPolarHBondContact CD1-O 3.43Å; F540-H610 PolarHBondContact N-O 3.36Å; H610-C612 PolarHBondContact O-N 3.37Å
611	P	94.8	Very high	90.4	Very high	31 Å²	31	46.8 Å²	46.8	20%	0.201	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	127.6	174	28.6	-32.5	0	0	0	108.8	Y274 W516 F540 T613	Y274-P611 PolarHBondContact OH-O 3.29Å; W516-P611 HydrophobicContact CB-CB 3.74Å; W516-P611 HydrophobicContact CG-CB 4.46Å; F540-P611 HydrophobicContact CE1-CB 4.08Å; F540-P611 HydrophobicContact CZ-CB 4.08Å; P611-T613 HydrophobicContact CB-CG2 4.32Å; P611-T613 HydrophobicContact CG-CG2 4.31Å; P611-T613 WeakPolarHBondContact O-CG2 3.32Å; P611-T613 PolarHBondContact O-N 2.94Å
612	C	94.1	Very high	90.2	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.239	C	C	.	.			trans	-64.5	128.8	166.9	-62.9	0	0	0	0	108	Y518 I529 Q533 L539 F540 L541 H610	Y518-C612 HydrophobicContact CE2-CB 4.14Å; Y518-C612 VanDerWaalsContact CE2-O 3.24Å; Y518-C612 WeakPolarHBondContact CE2-O 3.39Å; Y518-C612 PolarHBondContact OH-O 3.26Å; I529-C612 HydrophobicContact CG2-CB 3.83Å; Q533-C612 VanDerWaalsContact OE1-CA 3.27Å; L539-C612 WeakPolarHBondContact CD1-SG 3.18Å; L539-C612 VanDerWaalsContact CG-SG 3.57Å; F540-C612 PolarHBondContact O-N 2.8Å; L541-C612 HydrophobicContact CB-CB 4.11Å; L541-C612 HydrophobicContact CD2-CB 4.21Å; H610-C612 PolarHBondContact O-N 3.37Å
613	T	88.4	Confident	89.9	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.025	23%	0.225	C	C	.	.			trans	-129.8	133.4	-179.7	65.4	0	0	0	0	111.1	K272 L515 Y518 Q533 P611	K272-T613 VanDerWaalsContact CD-OG1 3.27Å; K272-T613 WeakPolarHBondContact CD-OG1 3.32Å; K272-T613 WeakPolarHBondContact CE-OG1 3.32Å; L515-T613 HydrophobicContact CB-CG2 3.51Å; L515-T613 HydrophobicContact CD1-CG2 4.05Å; L515-T613 HydrophobicContact CG-CG2 4.37Å; Y518-T613 VanDerWaalsContact OH-C 3.29Å; Y518-T613 VanDerWaalsContact OH-CA 3.32Å; Y518-T613 WeakPolarHBondContact OH-CA 3.29Å; Y518-T613 PolarHBondContact OH-N 3.31Å; Q533-T613 PolarHBondContact NE2-O 3.1Å; P611-T613 HydrophobicContact CB-CG2 4.32Å; P611-T613 HydrophobicContact CG-CG2 4.31Å; P611-T613 WeakPolarHBondContact O-CG2 3.32Å; P611-T613 PolarHBondContact O-N 2.94Å
614	V	78.8	Confident	89.5	Confident	67 Å²	67	37.6 Å²	37.6	41%	0.406	21%	0.209	S	C	.	.	P	Polyproline II helix	trans	-82.7	137.7	166.1	-174.4	0	0	0	0	108.5	E200 Y518	E200-V614 HydrophobicContact CB-CG1 4.41Å; Y518-V614 HydrophobicContact CD1-CG2 4.35Å; Y518-V614 HydrophobicContact CE1-CG2 3.39Å; Y518-V614 PolarHBondContact OH-N 3.22Å
615	V	72.6	Confident	88.9	Confident	3 Å²	3	40.4 Å²	40.4	2%	0.018	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-96.5	127.1	-178	-165.9	0	0	0	0	108.3	S199 W234 F270	S199-V615 WeakPolarHBondContact CB-O 3.08Å; W234-V615 HydrophobicContact CE3-CG2 4.33Å; W234-V615 HydrophobicContact CH2-CB 4.31Å; W234-V615 HydrophobicContact CH2-CG1 3.85Å; W234-V615 HydrophobicContact CH2-CG2 3.63Å; W234-V615 HydrophobicContact CZ3-CB 4.01Å; W234-V615 HydrophobicContact CZ3-CG1 3.59Å; W234-V615 HydrophobicContact CZ3-CG2 3.21Å; F270-V615 HydrophobicContact CD1-CG1 3.92Å; F270-V615 HydrophobicContact CE1-CG1 3.98Å
616	A	71.6	Confident	88.2	Confident	73 Å²	73	41.6 Å²	41.6	60%	0.603	23%	0.228	S	C	*	.	P	Polyproline II helix	trans	-97.1	119	163.2	0	0	0	0	0	108
617	L	73.9	Confident	87.4	Confident	46 Å²	46	44 Å²	44	24%	0.241	24%	0.24	C	C	.	.			trans	-85.2	0	-178.4	-87.2	-179.8	0	0	0	113.8	I197 K205 L222 F270	I197-L617 HydrophobicContact CB-CD1 4.37Å; I197-L617 HydrophobicContact CG2-CD1 3.86Å; K205-L617 HydrophobicContact CB-CB 4.2Å; K205-L617 HydrophobicContact CB-CD1 4.34Å; K205-L617 HydrophobicContact CD-CB 4.41Å; K205-L617 HydrophobicContact CD-CD2 4.43Å; K205-L617 WeakPolarHBondContact CD-OXT 3.12Å; K205-L617 WeakPolarHBondContact CE-OXT 3.34Å; K205-L617 PolarHBondContact NZ-OXT 3.32Å; L222-L617 HydrophobicContact CD2-CD2 4.04Å; F270-L617 HydrophobicContact CB-CD1 4.19Å; F270-L617 HydrophobicContact CB-CD2 4.46Å; F270-L617 HydrophobicContact CD1-CD2 3.53Å; F270-L617 HydrophobicContact CD1-CG 4.23Å; F270-L617 HydrophobicContact CE1-CD2 4.13Å; F270-L617 HydrophobicContact CG-CD2 4.31Å

Retrieved 617 of 617 residues in 635.9 ms (Link to these results)

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