A0A087YED5_POEFO Loading...

DDHD domain containing 2

AlphaFold DB , UniProt , Accession A0A087YED5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 780 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	35.6	Very low	32.4	Very low	245 Å²	245	135.8 Å²	135.8	100%	1.207	83%	0.826	S	S	*	*				0	115.6	0	-59.8	178.3	177.1	0	0	106.4
2	S	39.3	Very low	32.1	Very low	105 Å²	105	134.6 Å²	134.6	73%	0.734	83%	0.827	S	S	*	*			cis	-160.8	105.5	-8.9	34.2	0	0	0	0	105.4
3	S	32	Very low	32.1	Very low	100 Å²	100	139.2 Å²	139.2	70%	0.699	83%	0.833	S	S	*	*				72.1	102.2	110.9	60.5	0	0	0	0	113.6
4	S	37.3	Very low	31.7	Very low	100 Å²	100	136.7 Å²	136.7	70%	0.699	84%	0.836	S	S	*	*				78.7	151	72.3	77.8	0	0	0	0	112.2
5	E	36.1	Very low	31.4	Very low	180 Å²	180	133.9 Å²	133.9	84%	0.841	83%	0.832	S	S	*	*			cis	-148.4	155.8	10.4	-114.8	128.7	156.9	0	0	108.3
6	G	30.5	Very low	31.4	Very low	74 Å²	74	133.3 Å²	133.3	76%	0.763	83%	0.83	S	S	*	*				99.9	156	82.8	0	0	0	0	0	110.9
7	D	31.9	Very low	31.2	Very low	124 Å²	124	133.8 Å²	133.8	66%	0.663	83%	0.826	S	S	*	*			cis	-167.8	160.3	-9.1	-179.7	25.1	0	0	0	108.4
8	R	30.8	Very low	31	Very low	226 Å²	226	133.2 Å²	133.2	85%	0.853	82%	0.817	S	S	*	*			trans	64.5	151	172.3	-61.4	151.3	-153.3	-126.8	-3.5	118.2
9	G	27.7	Very low	30.8	Very low	81 Å²	81	132.5 Å²	132.5	84%	0.835	81%	0.808	S	S	*	*			cis	142.5	126.7	-4.3	0	0	0	0	0	112.2
10	G	26.1	Very low	30.5	Very low	85 Å²	85	132.6 Å²	132.6	88%	0.876	80%	0.803	S	S	*	*			trans	168	115.6	175.9	0	0	0	0	0	114.6
11	L	28.9	Very low	30.5	Very low	174 Å²	174	132.7 Å²	132.7	91%	0.911	80%	0.798	S	S	*	*			trans	-103.4	149.1	174.3	-76.5	152.6	0	0	0	110.5
12	S	28.5	Very low	30.1	Very low	121 Å²	121	126.4 Å²	126.4	85%	0.846	77%	0.774	S	S	*	*				145.7	146.2	122.6	-72.4	0	0	0	0	115.6
13	Q	32.1	Very low	29.7	Very low	194 Å²	194	127.1 Å²	127.1	91%	0.907	77%	0.773	S	S	*	*			trans	-73.4	154.8	168.8	-56.7	163.6	-26.1	0	0	111.4
14	A	26.5	Very low	29.5	Very low	105 Å²	105	129.2 Å²	129.2	87%	0.868	77%	0.772	S	S	*	*			trans	-167.8	153.9	138.4	0	0	0	0	0	112
15	A	27.4	Very low	29	Very low	94 Å²	94	130.8 Å²	130.8	78%	0.777	77%	0.773	S	S	*	*			trans	-76.5	162.9	-177.1	0	0	0	0	0	114.2
16	P	32	Very low	28.8	Very low	124 Å²	124	127.3 Å²	127.3	81%	0.805	76%	0.76	S	S	*	*			trans	-81.3	136.3	162.5	33.8	-31.4	0	0	0	110.5
17	N	27.6	Very low	28.7	Very low	143 Å²	143	132.9 Å²	132.9	77%	0.765	76%	0.763	S	S	*	*			trans	-155.6	125.4	159.9	-139.4	-4.7	0	0	0	112.6
18	N	26.9	Very low	28.5	Very low	122 Å²	122	133.9 Å²	133.9	65%	0.652	77%	0.769	S	S	*	*			trans	55.4	114.3	147.8	-75.4	-0.9	0	0	0	122.8
19	N	27.2	Very low	28.4	Very low	120 Å²	120	129.9 Å²	129.9	64%	0.642	76%	0.764	S	S	*	*				98.6	131.2	114.7	-69.6	-1	0	0	0	121.5
20	N	26.5	Very low	28.8	Very low	134 Å²	134	131.1 Å²	131.1	72%	0.717	76%	0.758	S	S	*	*			trans	75.7	146.1	139.6	-68.5	2.3	0	0	0	117.9
21	I	30.1	Very low	28.8	Very low	135 Å²	135	133.4 Å²	133.4	69%	0.692	76%	0.755	S	S	*	*			cis	-156	140.6	7.9	-119.8	157	0	0	0	109.4
22	T	27.6	Very low	29.1	Very low	114 Å²	114	133.6 Å²	133.6	70%	0.699	75%	0.751	S	S	*	*			trans	38	147	132.9	-13.3	0	0	0	0	120.5
23	T	29.5	Very low	28.9	Very low	119 Å²	119	135 Å²	135	73%	0.73	76%	0.755	S	S	*	*			cis	-163.2	172.1	45.3	39.9	0	0	0	0	111.2
24	Q	27.9	Very low	28.6	Very low	145 Å²	145	130.6 Å²	130.6	68%	0.678	75%	0.751	S	S	*	*			cis	-156.1	-160.1	-6.7	-133.6	-169.5	-82.7	0	0	111.4	D26	Q24-D26 PolarHBondContact NE2-OD2 2.69Å
25	D	28	Very low	28.5	Very low	133 Å²	133	129.9 Å²	129.9	71%	0.711	75%	0.745	S	S	*	*			trans	74.4	85.9	164	-59.2	-7.9	0	0	0	114.9
26	D	30.2	Very low	28.2	Very low	106 Å²	106	131.6 Å²	131.6	57%	0.567	75%	0.747	S	S	*	*				70	133.8	56.6	-50	-43.6	0	0	0	111.9	Q24	Q24-D26 PolarHBondContact NE2-OD2 2.69Å
27	F	28.6	Very low	27.8	Very low	191 Å²	191	130.4 Å²	130.4	84%	0.838	74%	0.74	S	S	*	*			cis	-152.7	165.1	29.9	-84.7	-90.3	0	0	0	108.6
28	D	28.8	Very low	27.6	Very low	146 Å²	146	130.5 Å²	130.5	78%	0.781	74%	0.74	S	S	*	*			cis	-164.1	173.3	-11.7	-169.7	11.6	0	0	0	108.4
29	N	29.3	Very low	27.5	Very low	141 Å²	141	131.4 Å²	131.4	75%	0.754	75%	0.751	S	S	*	*			trans	-157.4	136.8	176.4	-176.1	27.3	0	0	0	111.9
30	P	36.1	Very low	27.8	Very low	108 Å²	108	130.4 Å²	130.4	70%	0.701	75%	0.751	S	S	*	*			trans	-130.5	114.9	169	33.4	-16.4	0	0	0	116.7
31	T	26.3	Very low	27.6	Very low	132 Å²	132	132.9 Å²	132.9	81%	0.81	76%	0.758	S	S	*	*				40.7	136.8	122.3	-35.3	0	0	0	0	122.5
32	Q	35.1	Very low	27.4	Very low	178 Å²	178	130.3 Å²	130.3	83%	0.832	76%	0.757	S	S	*	*			trans	-69.1	145.2	168.2	-63.5	175.1	-6.4	0	0	113.9
33	T	24.1	Very low	27.4	Very low	151 Å²	151	130.5 Å²	130.5	93%	0.926	76%	0.763	S	S	*	*			trans	-164	158.1	131.7	1.5	0	0	0	0	110.9
34	A	25.8	Very low	27.2	Very low	101 Å²	101	133.7 Å²	133.7	84%	0.835	77%	0.767	S	S	*	*			trans	-87.2	151.5	-167.9	0	0	0	0	0	114.7
35	A	22.9	Very low	27.2	Very low	90 Å²	90	131 Å²	131	74%	0.744	77%	0.769	S	S	*	*			trans	178	125.5	137.6	0	0	0	0	0	113.9
36	T	22.4	Very low	27.1	Very low	131 Å²	131	132.5 Å²	132.5	80%	0.804	77%	0.772	S	S	*	*			trans	28.9	144.8	141.7	54.7	0	0	0	0	124.7
37	C	22	Very low	26.9	Very low	98 Å²	98	135.5 Å²	135.5	66%	0.662	79%	0.787	S	S	*	*			trans	99.9	107.5	138.8	-82.2	0	0	0	0	121.6
38	N	23.4	Very low	26.8	Very low	145 Å²	145	130.8 Å²	130.8	78%	0.775	78%	0.778	S	S	*	*				72.4	134.9	120.5	-59.1	-3.5	0	0	0	122.1
39	T	26.4	Very low	26.6	Very low	142 Å²	142	131.5 Å²	131.5	87%	0.871	78%	0.781	S	S	*	*			trans	-156.2	161.3	148.3	5.8	0	0	0	0	107.5
40	P	32.4	Very low	27	Very low	98 Å²	98	129.8 Å²	129.8	64%	0.636	78%	0.777	S	S	*	*				-132.2	177.5	-115.2	41.5	-25.2	0	0	0	115.8
41	E	23.6	Very low	26.6	Very low	186 Å²	186	133.1 Å²	133.1	87%	0.869	78%	0.783	S	S	*	*			trans	55.8	154.7	148.7	-72.9	171.9	164.8	0	0	120.7
42	A	25.8	Very low	26.7	Very low	81 Å²	81	130.6 Å²	130.6	67%	0.669	78%	0.776	S	S	*	*			cis	-174.6	171.2	-27	0	0	0	0	0	108.8
43	S	25.9	Very low	26.3	Very low	118 Å²	118	130.5 Å²	130.5	83%	0.825	78%	0.776	S	S	*	*			trans	78.8	150.2	162.1	83.7	0	0	0	0	118.9
44	K	27.2	Very low	26.3	Very low	187 Å²	187	131.2 Å²	131.2	81%	0.813	77%	0.772	S	S	*	*			cis	-172.3	169.4	-40.1	-125.5	-171.7	178.5	-165.2	0	110.3
45	A	27.2	Very low	26.2	Very low	88 Å²	88	131.5 Å²	131.5	73%	0.727	77%	0.768	S	S	*	*			trans	96.4	111.5	170.6	0	0	0	0	0	114.9
46	E	26.3	Very low	26.6	Very low	165 Å²	165	133.3 Å²	133.3	77%	0.771	77%	0.772	S	S	*	*			cis	90	116.4	38.9	-71.2	-170.6	132.8	0	0	115.5
47	L	26.3	Very low	26.8	Very low	169 Å²	169	132.6 Å²	132.6	89%	0.885	77%	0.767	S	S	*	*			trans	161.4	142.2	146.4	-87.3	154.6	0	0	0	108.6
48	S	26	Very low	27.1	Very low	91 Å²	91	135.9 Å²	135.9	64%	0.636	78%	0.777	S	S	*	*			cis	-174.7	112.4	-43.3	48.4	0	0	0	0	110.6
49	L	23.9	Very low	27.3	Very low	162 Å²	162	135.2 Å²	135.2	85%	0.848	77%	0.774	S	S	*	*			trans	47.6	169.9	147.3	-72.4	171.7	0	0	0	121.1
50	P	38.3	Very low	27.4	Very low	105 Å²	105	136.8 Å²	136.8	68%	0.682	77%	0.771	S	S	*	*			cis	-132.5	155	7.8	39	-20.7	0	0	0	118.6
51	E	27.9	Very low	27.2	Very low	177 Å²	177	137.7 Å²	137.7	83%	0.827	78%	0.775	S	S	*	*			trans	51.8	149.1	132.7	-54.8	179.8	156.3	0	0	121.6
52	A	27.7	Very low	27.7	Very low	80 Å²	80	134.3 Å²	134.3	66%	0.661	77%	0.771	S	S	*	*			cis	-159.1	171.5	20.8	0	0	0	0	0	114.6
53	Q	25.9	Very low	28.2	Very low	176 Å²	176	135.6 Å²	135.6	82%	0.822	77%	0.773	S	S	*	*			trans	74.1	90.2	161.3	-58.3	-178.9	21.2	0	0	117
54	I	25.6	Very low	28.2	Very low	166 Å²	166	134.8 Å²	134.8	85%	0.851	77%	0.767	S	S	*	*				80.2	108.6	62.6	-58.6	162.8	0	0	0	114.1
55	S	23	Very low	28.7	Very low	107 Å²	107	131.8 Å²	131.8	75%	0.748	77%	0.77	S	S	*	*			trans	-137	136.9	151.9	54.7	0	0	0	0	108.2
56	P	31.5	Very low	28.6	Very low	127 Å²	127	131.9 Å²	131.9	83%	0.825	77%	0.771	S	S	*	*			trans	-81	141.3	-171.3	31.4	-34.4	0	0	0	113.7
57	V	27.2	Very low	29.2	Very low	116 Å²	116	129.2 Å²	129.2	70%	0.703	77%	0.771	S	S	*	*			trans	-68.9	154.1	164.8	174.3	0	0	0	0	110.2
58	L	28.6	Very low	29.3	Very low	167 Å²	167	127 Å²	127	87%	0.874	77%	0.769	S	S	*	*			trans	-158.5	136.5	130.4	-101.6	179.3	0	0	0	111
59	D	25.7	Very low	29.7	Very low	131 Å²	131	130.3 Å²	130.3	70%	0.701	77%	0.772	S	S	*	*			trans	-64.3	158	177.2	-53.3	-83.9	0	0	0	111.9
60	E	28.5	Very low	30.4	Very low	176 Å²	176	131.2 Å²	131.2	82%	0.822	77%	0.772	S	S	*	*				-173	153.6	78.8	-101.6	-160.2	140.9	0	0	113.9
61	V	28.2	Very low	30.2	Very low	117 Å²	117	134.9 Å²	134.9	71%	0.709	78%	0.782	S	S	*	*			trans	60.1	114.5	144.1	-179.9	0	0	0	0	119.3
62	S	34.5	Very low	30.7	Very low	114 Å²	114	133.3 Å²	133.3	80%	0.797	78%	0.779	S	S	*	*			trans	-79	150.3	155	-60.1	0	0	0	0	110.7
63	P	37.2	Very low	31.3	Very low	109 Å²	109	137.3 Å²	137.3	71%	0.708	79%	0.789	S	S	*	*				-149.2	153.7	94.3	37.8	-21.4	0	0	0	117.3
64	S	26.6	Very low	32.1	Very low	100 Å²	100	136.1 Å²	136.1	70%	0.699	79%	0.785	S	S	*	*			trans	63	124.1	145.7	64.1	0	0	0	0	121.6
65	S	36.8	Very low	33.2	Very low	124 Å²	124	136.6 Å²	136.6	87%	0.867	78%	0.784	S	S	*	*			trans	64.3	79.4	133.8	-54.2	0	0	0	0	118.8
66	A	25.3	Very low	34.4	Very low	91 Å²	91	136.5 Å²	136.5	75%	0.752	78%	0.784	S	S	*	*			trans	-137	122	152	0	0	0	0	0	111.5	S68	A66-S68 PolarHBondContact O-N 3.36Å
67	S	39	Very low	35.4	Very low	109 Å²	109	136.7 Å²	136.7	76%	0.762	78%	0.782	S	S	*	*			trans	-17.5	107.3	156	164.5	0	0	0	0	114.9
68	S	29	Very low	36.8	Very low	122 Å²	122	134.1 Å²	134.1	85%	0.853	77%	0.768	S	S	*	*			trans	-96.9	88.6	157.9	-69.6	0	0	0	0	108.8	A66 E70	A66-S68 PolarHBondContact O-N 3.36Å; S68-E70 PolarHBondContact O-N 2.93Å
69	F	33.4	Very low	38.5	Very low	160 Å²	160	131.1 Å²	131.1	70%	0.702	76%	0.758	S	S	*	*			trans	-72	102.9	169.2	-168.2	-85.8	0	0	0	106.6	M71 L72	F69-M71 PolarHBondContact O-N 3.49Å; F69-L72 HydrophobicContact CE1-CD1 4.33Å; F69-L72 HydrophobicContact CZ-CD1 4.38Å
70	E	38.1	Very low	41	Very low	182 Å²	182	130.4 Å²	130.4	85%	0.85	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-58.2	131.7	172.3	-79.8	-172.9	140	0	0	109.1	S68 L72	S68-E70 PolarHBondContact O-N 2.93Å; E70-L72 PolarHBondContact O-N 3.19Å; E70-L72 VanDerWaalsContact O-N 3.14Å
71	M	35.4	Very low	43.8	Very low	182 Å²	182	124.9 Å²	124.9	90%	0.897	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-60.9	118.7	-179.2	-78.2	167.9	44.2	0	0	109.3	F69 D73	F69-M71 PolarHBondContact O-N 3.49Å; M71-D73 PolarHBondContact O-N 3.11Å
72	L	38.5	Very low	46.5	Very low	144 Å²	144	126.7 Å²	126.7	75%	0.754	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-59.3	119.2	172.1	-73.2	163.6	0	0	0	109.2	F69 E70 M74	F69-L72 HydrophobicContact CE1-CD1 4.33Å; F69-L72 HydrophobicContact CZ-CD1 4.38Å; E70-L72 PolarHBondContact O-N 3.19Å; E70-L72 VanDerWaalsContact O-N 3.14Å; L72-M74 PolarHBondContact O-N 3.49Å
73	D	38.8	Very low	49	Very low	164 Å²	164	128.6 Å²	128.6	88%	0.877	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-59.6	124.5	168.4	-136.7	-6.2	0	0	0	108.2	M71	M71-D73 PolarHBondContact O-N 3.11Å
74	M	43.3	Very low	51.5	Low	150 Å²	150	124.2 Å²	124.2	74%	0.739	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-86	137	-172.5	-143	-172.9	82.3	0	0	109.8	L72	L72-M74 PolarHBondContact O-N 3.49Å
75	E	48.1	Very low	54.5	Low	176 Å²	176	127.4 Å²	127.4	82%	0.822	71%	0.705	S	S	*	*			trans	65.1	66.6	171.9	-57.5	-177.5	169.7	0	0	116.3
76	S	48.3	Very low	57.1	Low	106 Å²	106	122.8 Å²	122.8	74%	0.741	67%	0.672	S	S	*	*			trans	-104.1	125.6	136.8	53.3	0	0	0	0	108.8
77	V	53.7	Low	60.4	Low	131 Å²	131	119 Å²	119	79%	0.794	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-58.8	130.9	168.1	177.8	0	0	0	0	106.8
78	P	56.8	Low	63.1	Low	62 Å²	62	113.8 Å²	113.8	40%	0.403	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-51.5	129.6	175.4	-25.5	33.8	0	0	0	109.1
79	P	63.1	Low	66.2	Low	104 Å²	104	108.3 Å²	108.3	68%	0.675	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-56	138.8	179.4	23.2	-32.8	0	0	0	108.7	Y81	P79-Y81 PolarHBondContact O-N 3.42Å
80	P	79.3	Confident	69.1	Low	116 Å²	116	101 Å²	101	75%	0.753	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-56.1	144.7	-179.5	25.4	-34.6	0	0	0	109.6	Q82	P80-Q82 PolarHBondContact O-N 3.47Å; P80-Q82 VanDerWaalsContact O-N 3.11Å
81	Y	85.6	Confident	71.6	Confident	59 Å²	59	92.6 Å²	92.6	23%	0.231	49%	0.492	C	S	.	.	P	Polyproline II helix	trans	-52.4	122.1	178.5	170.2	-93.9	0	0	0	110.5	P79 E83 E182 Y185 M186	P79-Y81 PolarHBondContact O-N 3.42Å; Y81-E83 HydrophobicContact CE1-CG 3.85Å; Y81-E182 WeakPolarHBondContact CE2-OE1 3.21Å; Y81-E182 PolarHBondContact OH-OE1 3.17Å; Y81-Y185 HydrophobicContact CD2-CD1 4.33Å; Y81-Y185 HydrophobicContact CD2-CE1 4.41Å; Y81-Y185 HydrophobicContact CE2-CD1 4.21Å; Y81-M186 HydrophobicContact CD1-CG 3.94Å; Y81-M186 HydrophobicContact CD2-CB 3.94Å; Y81-M186 HydrophobicContact CD2-CG 3.99Å; Y81-M186 HydrophobicContact CE1-CB 4.42Å; Y81-M186 HydrophobicContact CE1-CG 3.85Å; Y81-M186 HydrophobicContact CE1-SD 4.1Å; Y81-M186 HydrophobicContact CE2-CB 3.6Å; Y81-M186 HydrophobicContact CE2-CG 3.88Å; Y81-M186 HydrophobicContact CG-CB 4.48Å; Y81-M186 HydrophobicContact CG-CG 4.01Å
82	Q	86.7	Confident	73.9	Confident	156 Å²	156	88.8 Å²	88.8	73%	0.729	47%	0.468	S	S	*	.			trans	-119	128.2	175.4	179.5	179.8	-0.5	0	0	107.9	P80 R241	P80-Q82 PolarHBondContact O-N 3.47Å; P80-Q82 VanDerWaalsContact O-N 3.11Å; Q82-R241 PolarHBondContact O-NH1 2.89Å; Q82-R241 PolarHBondContact O-NH2 2.87Å
83	E	86.1	Confident	75.5	Confident	154 Å²	154	89.1 Å²	89.1	72%	0.72	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-57.1	137.9	176.8	-64.6	-173.8	166.2	0	0	111.4	Y81	Y81-E83 HydrophobicContact CE1-CG 3.85Å
84	V	89.3	Confident	76.5	Confident	17 Å²	17	84 Å²	84	10%	0.103	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-76.7	128	176.5	48.5	0	0	0	0	109.3	T159 E182 R241 G242	V84-T159 HydrophobicContact CG1-CG2 3.84Å; V84-T159 HydrophobicContact CG2-CG2 4.31Å; V84-E182 WeakPolarHBondContact CG1-OE2 3.28Å; V84-R241 HydrophobicContact CB-CG 4.24Å; V84-R241 HydrophobicContact CG1-CG 4.42Å; V84-R241 HydrophobicContact CG2-CG 4.35Å; V84-R241 VanDerWaalsContact N-NH2 3.13Å; V84-G242 VanDerWaalsContact CG2-CA 3.5Å
85	Q	89.4	Confident	77	Confident	166 Å²	166	84.7 Å²	84.7	78%	0.776	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-67.4	125.5	170.2	-73.1	-175.6	-31.3	0	0	108.9
86	P	92.5	Very high	77.2	Confident	27 Å²	27	85.1 Å²	85.1	18%	0.175	46%	0.461	C	S	.	.	P	Polyproline II helix	trans	-68.6	149.6	174.3	33.7	-37.8	0	0	0	109.7	E112 R157 C158 T159	P86-E112 VanDerWaalsContact CG-CD 3.45Å; P86-E112 HydrophobicContact CG-CG 3.98Å; P86-R157 HydrophobicContact CB-CG 3.83Å; P86-C158 WeakPolarHBondContact CA-O 3.34Å; P86-T159 HydrophobicContact CB-CG2 3.94Å
87	H	95	Very high	77.7	Confident	12 Å²	12	83.6 Å²	83.6	6%	0.056	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	139.2	164.9	-164.1	83.6	0	0	0	109	F89 F103 S108 C158 V243	H87-F89 HydrophobicContact CB-CE2 4.05Å; H87-F89 AromaticContact CD2-CE2 3.7Å; H87-F103 PolarHBondContact CE1-O 3.13Å; H87-F103 PolarHBondContact NE2-O 3.16Å; H87-S108 VanDerWaalsContact CE1-CB 3.45Å; H87-S108 WeakPolarHBondContact CE1-CB 3.42Å; H87-S108 PolarHBondContact ND1-OG 2.89Å; H87-C158 PolarHBondContact N-O 3.19Å; H87-C158 WeakPolarHBondContact O-CA 3.4Å; H87-C158 WeakPolarHBondContact O-CB 3.27Å; H87-C158 PolarHBondContact O-N 3.2Å; H87-V243 HydrophobicContact CB-CG1 3.58Å; H87-V243 HydrophobicContact CB-CG2 4.25Å
88	W	95.1	Very high	78.8	Confident	0 Å²	0	82 Å²	82	0%	0	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	137.1	-179.3	-70.8	80.1	0	0	0	110.7	F103 S108 L111 E112 F115 I138 V155 R157	W88-F103 HydrophobicContact CB-CD2 3.72Å; W88-F103 HydrophobicContact CB-CE2 4.41Å; W88-F103 WeakPolarHBondContact O-CD2 2.99Å; W88-F103 PolarHBondContact O-N 3.03Å; W88-S108 PolarHBondContact N-OG 3.4Å; W88-L111 HydrophobicContact CB-CD1 3.7Å; W88-L111 HydrophobicContact CD2-CB 3.86Å; W88-L111 HydrophobicContact CD2-CD1 4.16Å; W88-L111 HydrophobicContact CE3-CD1 4.4Å; W88-L111 HydrophobicContact CG-CB 3.83Å; W88-L111 HydrophobicContact CG-CD1 3.88Å; W88-E112 PolarHBondContact NE1-OE2 3.38Å; W88-F115 HydrophobicContact CH2-CB 4.2Å; W88-F115 HydrophobicContact CH2-CG 4.26Å; W88-F115 HydrophobicContact CZ2-CB 3.68Å; W88-F115 HydrophobicContact CZ2-CD1 4.15Å; W88-F115 AromaticContact CZ2-CG 3.89Å; W88-F115 HydrophobicContact CZ2-CG 3.89Å; W88-I138 HydrophobicContact CH2-CD1 4.34Å; W88-V155 HydrophobicContact CE3-CG1 3.51Å; W88-V155 HydrophobicContact CZ3-CG1 3.83Å; W88-R157 HydrophobicContact CD2-CB 4Å; W88-R157 HydrophobicContact CD2-CG 4.29Å; W88-R157 HydrophobicContact CE3-CB 4.04Å; W88-R157 HydrophobicContact CH2-CB 3.9Å; W88-R157 HydrophobicContact CH2-CG 4.45Å; W88-R157 HydrophobicContact CZ2-CB 3.8Å; W88-R157 HydrophobicContact CZ2-CG 3.86Å; W88-R157 HydrophobicContact CZ3-CB 4Å
89	F	94.5	Very high	80.2	Confident	7 Å²	7	79.9 Å²	79.9	3%	0.031	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	158.2	175.6	-73.9	-112.4	0	0	0	110.2	H87 W100 H101 P102 V155 R156 C158 F161 V243 I246	H87-F89 HydrophobicContact CB-CE2 4.05Å; H87-F89 AromaticContact CD2-CE2 3.7Å; F89-W100 HydrophobicContact CB-CE3 3.91Å; F89-W100 HydrophobicContact CB-CZ3 4.49Å; F89-H101 CarbonylContact C-O 3.23Å; F89-H101 WeakPolarHBondContact CA-O 3.38Å; F89-H101 WeakPolarHBondContact CB-O 3.14Å; F89-H101 VanDerWaalsContact CD1-C 3.41Å; F89-H101 WeakPolarHBondContact CD1-O 3.5Å; F89-P102 HydrophobicContact CD1-CB 4.14Å; F89-P102 HydrophobicContact CE1-CB 3.78Å; F89-P102 HydrophobicContact CE1-CG 4.36Å; F89-P102 HydrophobicContact CE2-CB 4.48Å; F89-P102 HydrophobicContact CZ-CB 3.96Å; F89-V155 CarbonylContact O-C 3.55Å; F89-V155 WeakPolarHBondContact O-CA 3.44Å; F89-R156 PolarHBondContact N-O 2.99Å; F89-R156 PolarHBondContact O-N 2.91Å; F89-C158 HydrophobicContact CD2-CB 3.72Å; F89-C158 HydrophobicContact CE2-CB 4.11Å; F89-F161 HydrophobicContact CD2-CE1 4.27Å; F89-F161 HydrophobicContact CD2-CZ 4.39Å; F89-F161 HydrophobicContact CE1-CE1 4.24Å; F89-F161 AromaticContact CE2-CE1 3.68Å; F89-F161 HydrophobicContact CE2-CE1 3.68Å; F89-F161 AromaticContact CE2-CZ 3.58Å; F89-F161 HydrophobicContact CE2-CZ 3.58Å; F89-F161 AromaticContact CZ-CE1 3.67Å; F89-F161 HydrophobicContact CZ-CE1 3.67Å; F89-F161 AromaticContact CZ-CZ 3.83Å; F89-F161 HydrophobicContact CZ-CZ 3.83Å; F89-V243 HydrophobicContact CE2-CG1 3.85Å; F89-V243 HydrophobicContact CZ-CG1 3.99Å; F89-I246 HydrophobicContact CZ-CD1 4.4Å
90	F	93.4	Very high	81.5	Confident	7 Å²	7	76.2 Å²	76.2	3%	0.031	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	148.5	171.8	63.5	-83.5	0	0	0	111.5	R92 W100 H101 F103 E154 V155	F90-R92 HydrophobicContact CD2-CG 4.14Å; F90-R92 HydrophobicContact CE2-CG 3.77Å; F90-W100 WeakPolarHBondContact O-CA 3.41Å; F90-H101 HydrophobicContact CD1-CB 4.36Å; F90-H101 WeakPolarHBondContact CD1-O 3.33Å; F90-H101 HydrophobicContact CD2-CB 4.47Å; F90-H101 HydrophobicContact CE1-CB 3.85Å; F90-H101 HydrophobicContact CE2-CB 3.98Å; F90-H101 HydrophobicContact CZ-CB 3.65Å; F90-H101 PolarHBondContact N-O 3.28Å; F90-H101 PolarHBondContact O-N 2.81Å; F90-F103 HydrophobicContact CB-CE2 3.78Å; F90-F103 HydrophobicContact CB-CZ 3.75Å; F90-F103 AromaticContact CD1-CD1 3.91Å; F90-F103 HydrophobicContact CD1-CD1 3.91Å; F90-F103 AromaticContact CD1-CD2 3.93Å; F90-F103 HydrophobicContact CD1-CD2 3.93Å; F90-F103 AromaticContact CD1-CE1 3.68Å; F90-F103 HydrophobicContact CD1-CE1 3.68Å; F90-F103 AromaticContact CD1-CE2 3.73Å; F90-F103 HydrophobicContact CD1-CE2 3.73Å; F90-F103 HydrophobicContact CD1-CG 4.03Å; F90-F103 AromaticContact CD1-CZ 3.61Å; F90-F103 HydrophobicContact CD1-CZ 3.61Å; F90-F103 HydrophobicContact CE1-CD1 4.17Å; F90-F103 HydrophobicContact CE1-CE1 4.19Å; F90-F103 HydrophobicContact CE1-CG 4.47Å; F90-F103 HydrophobicContact CG-CE1 4.34Å; F90-F103 HydrophobicContact CG-CE2 4.19Å; F90-F103 AromaticContact CG-CZ 3.95Å; F90-F103 HydrophobicContact CG-CZ 3.95Å; F90-E154 CarbonylContact C-O 3.59Å; F90-E154 VanDerWaalsContact CA-O 3.29Å; F90-E154 WeakPolarHBondContact CA-O 3.44Å; F90-V155 HydrophobicContact CB-CG2 4.08Å
91	C	91	Very high	82	Confident	5 Å²	5	73 Å²	73	3%	0.034	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	127.5	177.1	-170.8	0	0	0	0	110.5	W100 A153 E154	C91-W100 HydrophobicContact CB-CD2 4.15Å; C91-W100 HydrophobicContact CB-CE3 4.22Å; C91-W100 HydrophobicContact CB-CH2 3.86Å; C91-W100 HydrophobicContact CB-CZ2 3.75Å; C91-W100 HydrophobicContact CB-CZ3 4.09Å; C91-A153 WeakPolarHBondContact O-CB 3.36Å; C91-E154 HydrophobicContact CB-CB 4.25Å; C91-E154 PolarHBondContact N-O 2.96Å
92	R	83.8	Confident	82.4	Confident	102 Å²	102	71.3 Å²	71.3	39%	0.385	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	114.8	161	-70	-174	175.1	161.2	6.4	107.9	F90 S99	F90-R92 HydrophobicContact CD2-CG 4.14Å; F90-R92 HydrophobicContact CE2-CG 3.77Å; R92-S99 PolarHBondContact N-O 3.29Å; R92-S99 PolarHBondContact O-N 3.32Å; R92-S99 PolarHBondContact O-OG 2.97Å
93	Q	72.1	Confident	82.8	Confident	151 Å²	151	64 Å²	64	71%	0.706	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	126.9	166.5	-69.2	176.8	-8.6	0	0	108.7
94	A	60.3	Low	83.2	Confident	55 Å²	55	57.1 Å²	57.1	46%	0.455	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	127.9	169.7	0	0	0	0	0	108.2	D96 C97	A94-D96 PolarHBondContact O-N 2.86Å; A94-C97 PolarHBondContact N-O 3.14Å; A94-C97 WeakPolarHBondContact O-CA 3.4Å; A94-C97 WeakPolarHBondContact O-CB 3.35Å; A94-C97 PolarHBondContact O-N 3.23Å
95	D	53.8	Low	83.3	Confident	165 Å²	165	61.3 Å²	61.3	88%	0.882	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	44.3	58.7	172.9	-50.9	-27.1	0	0	0	114	C97	D95-C97 PolarHBondContact O-N 3.06Å
96	D	52.1	Low	83.5	Confident	186 Å²	186	57.4 Å²	57.4	100%	0.995	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	12.3	-177.3	-60.5	-32.4	0	0	0	116.1	A94	A94-D96 PolarHBondContact O-N 2.86Å
97	C	58.8	Low	83.6	Confident	74 Å²	74	56.8 Å²	56.8	50%	0.5	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	120.4	176.6	-167.1	0	0	0	0	111.7	A94 D95	A94-C97 PolarHBondContact N-O 3.14Å; A94-C97 WeakPolarHBondContact O-CA 3.4Å; A94-C97 WeakPolarHBondContact O-CB 3.35Å; A94-C97 PolarHBondContact O-N 3.23Å; D95-C97 PolarHBondContact O-N 3.06Å
98	E	76.8	Confident	83.6	Confident	98 Å²	98	56.2 Å²	56.2	46%	0.458	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	125.5	171	-67.5	-164.7	159.6	0	0	111.2
99	S	85.6	Confident	83.5	Confident	17 Å²	17	61 Å²	61	12%	0.119	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	111.3	-179.5	62.6	0	0	0	0	112.2	R92 H101	R92-S99 PolarHBondContact N-O 3.29Å; R92-S99 PolarHBondContact O-N 3.32Å; R92-S99 PolarHBondContact O-OG 2.97Å; S99-H101 PolarHBondContact O-CE1 2.88Å; S99-H101 PolarHBondContact O-ND1 3.43Å; S99-H101 PolarHBondContact OG-CE1 2.98Å
100	W	89.4	Confident	83.5	Confident	27 Å²	27	64.2 Å²	64.2	10%	0.102	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	129.1	-178.3	-70.6	85.9	0	0	0	111.5	F89 F90 C91 E154 R156 P172	F89-W100 HydrophobicContact CB-CE3 3.91Å; F89-W100 HydrophobicContact CB-CZ3 4.49Å; F90-W100 WeakPolarHBondContact O-CA 3.41Å; C91-W100 HydrophobicContact CB-CD2 4.15Å; C91-W100 HydrophobicContact CB-CE3 4.22Å; C91-W100 HydrophobicContact CB-CH2 3.86Å; C91-W100 HydrophobicContact CB-CZ2 3.75Å; C91-W100 HydrophobicContact CB-CZ3 4.09Å; W100-E154 HydrophobicContact CH2-CB 4.07Å; W100-E154 HydrophobicContact CH2-CG 4.07Å; W100-R156 HydrophobicContact CE3-CB 4.45Å; W100-R156 HydrophobicContact CH2-CB 3.8Å; W100-R156 VanDerWaalsContact CZ2-NH2 3.3Å; W100-R156 HydrophobicContact CZ3-CB 3.51Å; W100-P172 HydrophobicContact CB-CG 3.9Å; W100-P172 HydrophobicContact CD2-CG 3.44Å; W100-P172 VanDerWaalsContact CD2-CG 3.44Å; W100-P172 HydrophobicContact CE3-CG 3.73Å; W100-P172 VanDerWaalsContact CG-CD 3.46Å; W100-P172 HydrophobicContact CG-CG 3.51Å; W100-P172 HydrophobicContact CZ3-CG 4.5Å
101	H	90.9	Very high	83.6	Confident	48 Å²	48	63.9 Å²	63.9	22%	0.222	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	138.2	-178.1	-66.5	75.7	0	0	0	109.7	F89 F90 S99	F89-H101 CarbonylContact C-O 3.23Å; F89-H101 WeakPolarHBondContact CA-O 3.38Å; F89-H101 WeakPolarHBondContact CB-O 3.14Å; F89-H101 VanDerWaalsContact CD1-C 3.41Å; F89-H101 WeakPolarHBondContact CD1-O 3.5Å; F90-H101 HydrophobicContact CD1-CB 4.36Å; F90-H101 WeakPolarHBondContact CD1-O 3.33Å; F90-H101 HydrophobicContact CD2-CB 4.47Å; F90-H101 HydrophobicContact CE1-CB 3.85Å; F90-H101 HydrophobicContact CE2-CB 3.98Å; F90-H101 HydrophobicContact CZ-CB 3.65Å; F90-H101 PolarHBondContact N-O 3.28Å; F90-H101 PolarHBondContact O-N 2.81Å; S99-H101 PolarHBondContact O-CE1 2.88Å; S99-H101 PolarHBondContact O-ND1 3.43Å; S99-H101 PolarHBondContact OG-CE1 2.98Å
102	P	93.2	Very high	83.7	Confident	23 Å²	23	64.8 Å²	64.8	15%	0.149	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	145.6	174.9	31.1	-35	0	0	0	110.3	F89 V248 I250	F89-P102 HydrophobicContact CD1-CB 4.14Å; F89-P102 HydrophobicContact CE1-CB 3.78Å; F89-P102 HydrophobicContact CE1-CG 4.36Å; F89-P102 HydrophobicContact CE2-CB 4.48Å; F89-P102 HydrophobicContact CZ-CB 3.96Å; P102-V248 HydrophobicContact CG-CG1 3.86Å; P102-I250 HydrophobicContact CB-CG1 4.27Å
103	F	95	Very high	84.1	Confident	2 Å²	2	65.1 Å²	65.1	1%	0.009	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-68.7	166.9	158.8	-77.4	-74.6	0	0	0	110.6	H87 W88 F90 D107 L111 V129 V136 V155	H87-F103 PolarHBondContact CE1-O 3.13Å; H87-F103 PolarHBondContact NE2-O 3.16Å; W88-F103 HydrophobicContact CB-CD2 3.72Å; W88-F103 HydrophobicContact CB-CE2 4.41Å; W88-F103 WeakPolarHBondContact O-CD2 2.99Å; W88-F103 PolarHBondContact O-N 3.03Å; F90-F103 HydrophobicContact CB-CE2 3.78Å; F90-F103 HydrophobicContact CB-CZ 3.75Å; F90-F103 AromaticContact CD1-CD1 3.91Å; F90-F103 HydrophobicContact CD1-CD1 3.91Å; F90-F103 AromaticContact CD1-CD2 3.93Å; F90-F103 HydrophobicContact CD1-CD2 3.93Å; F90-F103 AromaticContact CD1-CE1 3.68Å; F90-F103 HydrophobicContact CD1-CE1 3.68Å; F90-F103 AromaticContact CD1-CE2 3.73Å; F90-F103 HydrophobicContact CD1-CE2 3.73Å; F90-F103 HydrophobicContact CD1-CG 4.03Å; F90-F103 AromaticContact CD1-CZ 3.61Å; F90-F103 HydrophobicContact CD1-CZ 3.61Å; F90-F103 HydrophobicContact CE1-CD1 4.17Å; F90-F103 HydrophobicContact CE1-CE1 4.19Å; F90-F103 HydrophobicContact CE1-CG 4.47Å; F90-F103 HydrophobicContact CG-CE1 4.34Å; F90-F103 HydrophobicContact CG-CE2 4.19Å; F90-F103 AromaticContact CG-CZ 3.95Å; F90-F103 HydrophobicContact CG-CZ 3.95Å; F103-D107 HydrophobicContact CB-CB 4.14Å; F103-D107 HydrophobicContact CD1-CB 4.3Å; F103-L111 HydrophobicContact CD2-CD1 3.74Å; F103-L111 HydrophobicContact CE2-CD1 3.88Å; F103-L111 HydrophobicContact CG-CD1 4.07Å; F103-L111 HydrophobicContact CZ-CD1 4.32Å; F103-V129 HydrophobicContact CD1-CB 4.49Å; F103-V129 HydrophobicContact CD1-CG2 4.38Å; F103-V129 HydrophobicContact CE1-CB 4.27Å; F103-V129 HydrophobicContact CE1-CG2 3.7Å; F103-V129 HydrophobicContact CZ-CG2 4.44Å; F103-V136 HydrophobicContact CZ-CG2 4.03Å; F103-V155 HydrophobicContact CE2-CG1 3.92Å; F103-V155 HydrophobicContact CE2-CG2 4.06Å; F103-V155 HydrophobicContact CZ-CG2 3.99Å
104	S	94.3	Very high	85.1	Confident	11 Å²	11	58.6 Å²	58.6	8%	0.077	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-61.7	164	168.2	71.2	0	0	0	0	111.1	D107 S108 P251	S104-D107 VanDerWaalsContact OG-CB 3.23Å; S104-D107 WeakPolarHBondContact OG-CB 3.48Å; S104-D107 PolarHBondContact OG-N 3.36Å; S104-D107 PolarHBondContact OG-OD2 2.96Å; S104-S108 WeakPolarHBondContact O-CB 3.38Å; S104-S108 PolarHBondContact O-N 3.47Å; S104-P251 CarbonylContact C-O 3.53Å; S104-P251 WeakPolarHBondContact CA-O 3.49Å
105	R	92.6	Very high	86.5	Confident	105 Å²	105	57.2 Å²	57.2	40%	0.396	29%	0.293	S	S	.	.	H	α-helix	trans	-60.7	-48.9	173.4	-63.1	-164.9	-164.2	-75.1	-10.2	110.9	D107 S108 D109 I250 P251 E252	R105-D107 PolarHBondContact O-N 3.48Å; R105-S108 PolarHBondContact O-N 2.99Å; R105-D109 WeakPolarHBondContact O-CB 3.48Å; R105-D109 PolarHBondContact O-N 2.94Å; R105-I250 HydrophobicContact CG-CG2 3.77Å; R105-P251 PolarHBondContact N-O 3.49Å; R105-E252 VanDerWaalsContact CD-OE2 3.28Å; R105-E252 WeakPolarHBondContact CD-OE2 3.45Å; R105-E252 IonicContact CZ-OE1 3.6Å; R105-E252 PolarHBondContact N-O 3.22Å; R105-E252 VanDerWaalsContact NE-CD 3.29Å; R105-E252 IonicContact NE-OE1 3.35Å; R105-E252 PolarHBondContact NE-OE1 3.31Å; R105-E252 IonicContact NE-OE2 2.77Å; R105-E252 PolarHBondContact NE-OE2 3.06Å; R105-E252 IonicContact NH2-OE1 3.83Å; R105-E252 PolarHBondContact NH2-OE1 2.96Å
106	E	93.1	Very high	88.1	Confident	84 Å²	84	52.6 Å²	52.6	39%	0.393	27%	0.268	S	S	.	.	H	α-helix	trans	-56.9	-46.7	178.8	-69.7	171.7	-172	0	0	112.4	K110 E252 G253	E106-K110 WeakPolarHBondContact O-CB 3.38Å; E106-K110 WeakPolarHBondContact O-CD 3.43Å; E106-K110 VanDerWaalsContact O-CG 3.23Å; E106-K110 WeakPolarHBondContact O-CG 3.28Å; E106-K110 PolarHBondContact O-N 3.13Å; E106-E252 PolarHBondContact N-O 2.96Å; E106-G253 WeakPolarHBondContact OE2-CA 3.4Å
107	D	95	Very high	89.7	Confident	13 Å²	13	46.5 Å²	46.5	7%	0.07	24%	0.238	C	C	.	.	H	α-helix	trans	-68	-41.1	177.3	-66.4	-47.4	0	0	0	111.6	F103 S104 R105 D109 K110 L111 V129 E130	F103-D107 HydrophobicContact CB-CB 4.14Å; F103-D107 HydrophobicContact CD1-CB 4.3Å; S104-D107 VanDerWaalsContact OG-CB 3.23Å; S104-D107 WeakPolarHBondContact OG-CB 3.48Å; S104-D107 PolarHBondContact OG-N 3.36Å; S104-D107 PolarHBondContact OG-OD2 2.96Å; R105-D107 PolarHBondContact O-N 3.48Å; D107-D109 VanDerWaalsContact C-N 3.34Å; D107-D109 PolarHBondContact O-N 2.89Å; D107-K110 WeakPolarHBondContact O-CB 3.33Å; D107-K110 PolarHBondContact O-N 2.72Å; D107-L111 WeakPolarHBondContact O-CB 3.44Å; D107-L111 WeakPolarHBondContact O-CG 3.44Å; D107-L111 PolarHBondContact O-N 3.27Å; D107-V129 HydrophobicContact CB-CB 4.15Å; D107-V129 HydrophobicContact CB-CG1 4.15Å; D107-V129 WeakPolarHBondContact OD1-CA 3.48Å; D107-E130 PolarHBondContact OD1-N 3.17Å; D107-E130 PolarHBondContact OD2-N 3.07Å
108	S	95.3	Very high	90.4	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.007	22%	0.222	C	C	.	.	H	α-helix	trans	-62.9	-39.9	178	-175.8	0	0	0	0	111.9	H87 W88 S104 R105 L111 E112	H87-S108 VanDerWaalsContact CE1-CB 3.45Å; H87-S108 WeakPolarHBondContact CE1-CB 3.42Å; H87-S108 PolarHBondContact ND1-OG 2.89Å; W88-S108 PolarHBondContact N-OG 3.4Å; S104-S108 WeakPolarHBondContact O-CB 3.38Å; S104-S108 PolarHBondContact O-N 3.47Å; R105-S108 PolarHBondContact O-N 2.99Å; S108-L111 PolarHBondContact O-N 3.39Å; S108-E112 WeakPolarHBondContact O-CB 3.28Å; S108-E112 PolarHBondContact O-N 2.9Å
109	D	93.6	Very high	89.8	Confident	99 Å²	99	47.3 Å²	47.3	53%	0.529	23%	0.229	S	C	.	.	H	α-helix	trans	-68.4	-40.4	175	-73.1	-18.5	0	0	0	111.5	R105 D107 E112 N113	R105-D109 WeakPolarHBondContact O-CB 3.48Å; R105-D109 PolarHBondContact O-N 2.94Å; D107-D109 VanDerWaalsContact C-N 3.34Å; D107-D109 PolarHBondContact O-N 2.89Å; D109-E112 PolarHBondContact O-N 3.31Å; D109-N113 WeakPolarHBondContact O-CB 3.4Å; D109-N113 VanDerWaalsContact O-CG 3.24Å; D109-N113 PolarHBondContact O-N 3.47Å; D109-N113 PolarHBondContact O-ND2 2.72Å
110	K	93.4	Very high	88.8	Confident	75 Å²	75	54.7 Å²	54.7	33%	0.326	26%	0.262	S	S	.	.	H	α-helix	trans	-58.8	-47.2	172.3	-74.8	165.9	179.8	176.2	0	111.5	E106 D107 N113 A114 V127 E256	E106-K110 WeakPolarHBondContact O-CB 3.38Å; E106-K110 WeakPolarHBondContact O-CD 3.43Å; E106-K110 VanDerWaalsContact O-CG 3.23Å; E106-K110 WeakPolarHBondContact O-CG 3.28Å; E106-K110 PolarHBondContact O-N 3.13Å; D107-K110 WeakPolarHBondContact O-CB 3.33Å; D107-K110 PolarHBondContact O-N 2.72Å; K110-N113 PolarHBondContact O-N 3.12Å; K110-A114 WeakPolarHBondContact O-CB 3.44Å; K110-A114 PolarHBondContact O-N 2.65Å; K110-V127 HydrophobicContact CB-CG1 4.2Å; K110-E256 WeakPolarHBondContact CE-OE1 3.32Å; K110-E256 IonicContact NZ-OE1 3.9Å; K110-E256 PolarHBondContact NZ-OE1 3.4Å
111	L	94.7	Very high	87.7	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-63.5	-41.7	177.6	-69.3	171.3	0	0	0	112.3	W88 F103 D107 S108 A114 F115 V127 V129 V136 I138	W88-L111 HydrophobicContact CB-CD1 3.7Å; W88-L111 HydrophobicContact CD2-CB 3.86Å; W88-L111 HydrophobicContact CD2-CD1 4.16Å; W88-L111 HydrophobicContact CE3-CD1 4.4Å; W88-L111 HydrophobicContact CG-CB 3.83Å; W88-L111 HydrophobicContact CG-CD1 3.88Å; F103-L111 HydrophobicContact CD2-CD1 3.74Å; F103-L111 HydrophobicContact CE2-CD1 3.88Å; F103-L111 HydrophobicContact CG-CD1 4.07Å; F103-L111 HydrophobicContact CZ-CD1 4.32Å; D107-L111 WeakPolarHBondContact O-CB 3.44Å; D107-L111 WeakPolarHBondContact O-CG 3.44Å; D107-L111 PolarHBondContact O-N 3.27Å; S108-L111 PolarHBondContact O-N 3.39Å; L111-A114 PolarHBondContact O-N 2.71Å; L111-F115 VanDerWaalsContact O-CB 3.3Å; L111-F115 WeakPolarHBondContact O-CB 3.26Å; L111-F115 PolarHBondContact O-N 2.97Å; L111-V127 HydrophobicContact CD2-CB 3.86Å; L111-V127 HydrophobicContact CD2-CG1 3.98Å; L111-V127 HydrophobicContact CD2-CG2 4.27Å; L111-V129 HydrophobicContact CD1-CG1 4.27Å; L111-V129 HydrophobicContact CD2-CG1 3.96Å; L111-V129 HydrophobicContact CG-CG1 4.08Å; L111-V136 HydrophobicContact CD2-CB 3.71Å; L111-V136 HydrophobicContact CD2-CG1 3.68Å; L111-V136 HydrophobicContact CD2-CG2 4.09Å; L111-I138 HydrophobicContact CB-CD1 4.38Å; L111-I138 HydrophobicContact CD2-CD1 3.59Å
112	E	94.3	Very high	86.5	Confident	24 Å²	24	64.8 Å²	64.8	11%	0.112	31%	0.31	C	S	.	.	H	α-helix	trans	-69.4	-39.9	178.6	-172	60.6	-163.8	0	0	112.2	P86 W88 S108 D109 F115 N116 R157	P86-E112 VanDerWaalsContact CG-CD 3.45Å; P86-E112 HydrophobicContact CG-CG 3.98Å; W88-E112 PolarHBondContact NE1-OE2 3.38Å; S108-E112 WeakPolarHBondContact O-CB 3.28Å; S108-E112 PolarHBondContact O-N 2.9Å; D109-E112 PolarHBondContact O-N 3.31Å; E112-F115 PolarHBondContact O-N 2.92Å; E112-N116 WeakPolarHBondContact O-CB 3.48Å; E112-N116 PolarHBondContact O-N 3.11Å; E112-N116 PolarHBondContact O-ND2 3.38Å; E112-N116 PolarHBondContact OE1-ND2 3.45Å; E112-R157 VanDerWaalsContact CD-NE 3.34Å; E112-R157 IonicContact OE1-CZ 3.91Å; E112-R157 IonicContact OE1-NE 3.87Å; E112-R157 PolarHBondContact OE1-NE 3.08Å; E112-R157 VanDerWaalsContact OE1-NE 3.13Å; E112-R157 IonicContact OE1-NH2 3.04Å; E112-R157 PolarHBondContact OE1-NH2 3.34Å; E112-R157 WeakPolarHBondContact OE2-CD 3.29Å; E112-R157 IonicContact OE2-CZ 3.04Å; E112-R157 IonicContact OE2-NE 3.8Å; E112-R157 PolarHBondContact OE2-NE 2.93Å; E112-R157 IonicContact OE2-NH2 3.39Å
113	N	92.6	Very high	85.7	Confident	110 Å²	110	71.1 Å²	71.1	59%	0.588	34%	0.338	S	S	*	.	H	α-helix	trans	-62.9	-43.9	173.9	-74	-43.2	0	0	0	111.6	D109 K110 N116 T117	D109-N113 WeakPolarHBondContact O-CB 3.4Å; D109-N113 VanDerWaalsContact O-CG 3.24Å; D109-N113 PolarHBondContact O-N 3.47Å; D109-N113 PolarHBondContact O-ND2 2.72Å; K110-N113 PolarHBondContact O-N 3.12Å; N113-N116 PolarHBondContact O-N 2.84Å; N113-T117 PolarHBondContact O-N 3.17Å; N113-T117 VanDerWaalsContact O-N 3.16Å; N113-T117 PolarHBondContact O-OG1 3.22Å
114	A	91.8	Very high	85.1	Confident	13 Å²	13	73.2 Å²	73.2	11%	0.107	35%	0.349	C	S	.	.	H	α-helix	trans	-62.1	-47.1	173.8	0	0	0	0	0	111.7	K110 L111 N116 T117 V118 I125 V127 I138	K110-A114 WeakPolarHBondContact O-CB 3.44Å; K110-A114 PolarHBondContact O-N 2.65Å; L111-A114 PolarHBondContact O-N 2.71Å; A114-N116 VanDerWaalsContact C-N 3.33Å; A114-N116 PolarHBondContact O-N 3.28Å; A114-T117 CarbonylContact O-C 3.57Å; A114-T117 WeakPolarHBondContact O-CA 3.16Å; A114-T117 WeakPolarHBondContact O-CB 3.45Å; A114-T117 PolarHBondContact O-N 3.42Å; A114-V118 WeakPolarHBondContact O-CG2 3.41Å; A114-V118 PolarHBondContact O-N 3.16Å; A114-I125 HydrophobicContact CB-CG2 4.13Å; A114-V127 HydrophobicContact CB-CG2 3.39Å; A114-I138 HydrophobicContact CB-CD1 4.35Å; A114-I138 HydrophobicContact CB-CG1 4.21Å
115	F	90.3	Very high	84.9	Confident	27 Å²	27	74.7 Å²	74.7	12%	0.118	36%	0.356	C	S	.	.	H	α-helix	trans	-61.5	-37.2	178.9	174.2	-118.2	0	0	0	113.6	W88 L111 E112 T117 V118 R119 I138 R157	W88-F115 HydrophobicContact CH2-CB 4.2Å; W88-F115 HydrophobicContact CH2-CG 4.26Å; W88-F115 HydrophobicContact CZ2-CB 3.68Å; W88-F115 HydrophobicContact CZ2-CD1 4.15Å; W88-F115 AromaticContact CZ2-CG 3.89Å; W88-F115 HydrophobicContact CZ2-CG 3.89Å; L111-F115 VanDerWaalsContact O-CB 3.3Å; L111-F115 WeakPolarHBondContact O-CB 3.26Å; L111-F115 PolarHBondContact O-N 2.97Å; E112-F115 PolarHBondContact O-N 2.92Å; F115-T117 VanDerWaalsContact C-N 3.28Å; F115-T117 PolarHBondContact O-N 2.83Å; F115-V118 PolarHBondContact O-N 2.91Å; F115-R119 VanDerWaalsContact CE1-NH2 3.32Å; F115-I138 HydrophobicContact CB-CG2 4.08Å; F115-I138 HydrophobicContact CD2-CG2 3.94Å; F115-I138 HydrophobicContact CG-CG2 4.5Å; F115-R157 VanDerWaalsContact CE1-CD 3.5Å
116	N	88.1	Confident	84.9	Confident	67 Å²	67	73 Å²	73	36%	0.358	36%	0.357	S	S	.	.	H	α-helix	trans	-66.9	-31.7	173.1	-73.9	-51.3	0	0	0	112	E112 N113 A114	E112-N116 WeakPolarHBondContact O-CB 3.48Å; E112-N116 PolarHBondContact O-N 3.11Å; E112-N116 PolarHBondContact O-ND2 3.38Å; E112-N116 PolarHBondContact OE1-ND2 3.45Å; N113-N116 PolarHBondContact O-N 2.84Å; A114-N116 VanDerWaalsContact C-N 3.33Å; A114-N116 PolarHBondContact O-N 3.28Å
117	T	84.4	Confident	85	Confident	59 Å²	59	69.9 Å²	69.9	36%	0.362	34%	0.344	S	S	.	.	H	α-helix	trans	-73	-38.5	173.8	-50.3	0	0	0	0	112.6	N113 A114 F115 R119 E120 I125	N113-T117 PolarHBondContact O-N 3.17Å; N113-T117 VanDerWaalsContact O-N 3.16Å; N113-T117 PolarHBondContact O-OG1 3.22Å; A114-T117 CarbonylContact O-C 3.57Å; A114-T117 WeakPolarHBondContact O-CA 3.16Å; A114-T117 WeakPolarHBondContact O-CB 3.45Å; A114-T117 PolarHBondContact O-N 3.42Å; F115-T117 VanDerWaalsContact C-N 3.28Å; F115-T117 PolarHBondContact O-N 2.83Å; T117-R119 PolarHBondContact O-N 2.96Å; T117-R119 VanDerWaalsContact O-N 3.14Å; T117-E120 PolarHBondContact O-N 3.31Å; T117-I125 HydrophobicContact CG2-CD1 4.12Å
118	V	74.8	Confident	84.9	Confident	25 Å²	25	70.7 Å²	70.7	15%	0.152	35%	0.352	C	S	.	.	H	α-helix	trans	-57.7	-27.7	175.9	173.1	0	0	0	0	112.2	A114 F115 E120 Q121 I125 I138	A114-V118 WeakPolarHBondContact O-CG2 3.41Å; A114-V118 PolarHBondContact O-N 3.16Å; F115-V118 PolarHBondContact O-N 2.91Å; V118-E120 PolarHBondContact O-N 3.12Å; V118-Q121 PolarHBondContact O-N 2.98Å; V118-I125 HydrophobicContact CG2-CB 3.77Å; V118-I125 HydrophobicContact CG2-CD1 3.62Å; V118-I125 HydrophobicContact CG2-CG1 3.7Å; V118-I138 HydrophobicContact CB-CG2 4.42Å; V118-I138 HydrophobicContact CG2-CB 4.17Å; V118-I138 HydrophobicContact CG2-CG2 3.8Å
119	R	64.8	Low	84.8	Confident	163 Å²	163	70.7 Å²	70.7	62%	0.615	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-15.2	175.9	-65.7	179.8	-179.2	-173.4	3.1	113.7	F115 T117	F115-R119 VanDerWaalsContact CE1-NH2 3.32Å; T117-R119 PolarHBondContact O-N 2.96Å; T117-R119 VanDerWaalsContact O-N 3.14Å
120	E	64.1	Low	84.7	Confident	172 Å²	172	67.5 Å²	67.5	80%	0.804	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-7.1	-178.6	-53	-169.3	157.7	0	0	113.5	T117 V118	T117-E120 PolarHBondContact O-N 3.31Å; V118-E120 PolarHBondContact O-N 3.12Å
121	Q	65.2	Low	84.4	Confident	105 Å²	105	64.7 Å²	64.7	49%	0.491	33%	0.327	S	S	.	.			trans	-135.3	146.1	-171.3	-59.2	-175.1	5.4	0	0	112.5	V118	V118-Q121 PolarHBondContact O-N 2.98Å
122	E	66.1	Low	84.3	Confident	182 Å²	182	67.6 Å²	67.6	85%	0.85	34%	0.34	S	S	*	.	S	Bend	trans	-85.4	-19.7	-177.3	-69.5	-169	152.6	0	0	114.5	K139	E122-K139 PolarHBondContact O-NZ 3.27Å
123	E	77.3	Confident	84.2	Confident	156 Å²	156	66.9 Å²	66.9	73%	0.729	34%	0.337	S	S	*	.	S	Bend	trans	-74.1	152.5	-179.2	-64	-173.5	171	0	0	111.7
124	D	81.4	Confident	84.3	Confident	47 Å²	47	62 Å²	62	25%	0.251	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-81.1	120.4	173.7	-167.3	7.2	0	0	0	109.5	H137 I138 K139	D124-H137 IonicContact OD2-CG 3.93Å; D124-H137 IonicContact OD2-ND1 3.76Å; D124-I138 PolarHBondContact OD1-N 3.19Å; D124-K139 HydrophobicContact CB-CB 4Å; D124-K139 HydrophobicContact CB-CD 4.1Å; D124-K139 WeakPolarHBondContact OD1-CB 3.3Å; D124-K139 PolarHBondContact OD1-N 2.65Å
125	I	89.9	Confident	84.5	Confident	41 Å²	41	62.8 Å²	62.8	21%	0.21	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-86.4	119	178.5	-62.5	-176.7	0	0	0	108.1	A114 T117 V118 V127 I138	A114-I125 HydrophobicContact CB-CG2 4.13Å; T117-I125 HydrophobicContact CG2-CD1 4.12Å; V118-I125 HydrophobicContact CG2-CB 3.77Å; V118-I125 HydrophobicContact CG2-CD1 3.62Å; V118-I125 HydrophobicContact CG2-CG1 3.7Å; I125-V127 HydrophobicContact CG2-CG2 4.17Å; I125-I138 VanDerWaalsContact O-CG1 3.3Å; I125-I138 WeakPolarHBondContact O-CG1 3.3Å; I125-I138 PolarHBondContact O-N 2.99Å; I125-I138 VanDerWaalsContact O-N 3.16Å
126	V	93.3	Very high	84.8	Confident	71 Å²	71	61.5 Å²	61.5	43%	0.43	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127.3	173	-175.5	0	0	0	0	109.1	D135 V136	V126-D135 HydrophobicContact CG1-CB 3.61Å; V126-V136 WeakPolarHBondContact CA-O 3.39Å
127	V	94.1	Very high	85.1	Confident	17 Å²	17	60.5 Å²	60.5	10%	0.103	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.4	179.2	-176.5	0	0	0	0	109.6	K110 L111 A114 I125 V129 V136 I138	K110-V127 HydrophobicContact CB-CG1 4.2Å; L111-V127 HydrophobicContact CD2-CB 3.86Å; L111-V127 HydrophobicContact CD2-CG1 3.98Å; L111-V127 HydrophobicContact CD2-CG2 4.27Å; A114-V127 HydrophobicContact CB-CG2 3.39Å; I125-V127 HydrophobicContact CG2-CG2 4.17Å; V127-V129 HydrophobicContact CG1-CG1 4.07Å; V127-V136 PolarHBondContact N-O 2.74Å; V127-V136 PolarHBondContact O-N 2.92Å; V127-I138 HydrophobicContact CG2-CD1 4.06Å; V127-I138 HydrophobicContact CG2-CG1 3.9Å
128	A	94.1	Very high	85.5	Confident	30 Å²	30	57.7 Å²	57.7	25%	0.248	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	127.9	172.4	0	0	0	0	0	110	E132 R384	A128-E132 HydrophobicContact CB-CB 4.35Å; A128-E132 HydrophobicContact CB-CG 3.92Å; A128-R384 VanDerWaalsContact CB-NH2 3.3Å
129	V	93.5	Very high	86.2	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	166.9	-177.6	-58.3	0	0	0	0	111.4	F103 D107 L111 V127 G131 E132 R133 Y134 V136	F103-V129 HydrophobicContact CD1-CB 4.49Å; F103-V129 HydrophobicContact CD1-CG2 4.38Å; F103-V129 HydrophobicContact CE1-CB 4.27Å; F103-V129 HydrophobicContact CE1-CG2 3.7Å; F103-V129 HydrophobicContact CZ-CG2 4.44Å; D107-V129 HydrophobicContact CB-CB 4.15Å; D107-V129 HydrophobicContact CB-CG1 4.15Å; D107-V129 WeakPolarHBondContact OD1-CA 3.48Å; L111-V129 HydrophobicContact CD1-CG1 4.27Å; L111-V129 HydrophobicContact CD2-CG1 3.96Å; L111-V129 HydrophobicContact CG-CG1 4.08Å; V127-V129 HydrophobicContact CG1-CG1 4.07Å; V129-G131 PolarHBondContact O-N 2.68Å; V129-E132 PolarHBondContact O-N 3.46Å; V129-R133 PolarHBondContact O-N 3.14Å; V129-Y134 PolarHBondContact N-O 3.19Å; V129-Y134 PolarHBondContact O-N 2.75Å; V129-V136 HydrophobicContact CG1-CG2 4.07Å; V129-V136 HydrophobicContact CG2-CG2 3.64Å
130	E	90.4	Very high	87.4	Confident	32 Å²	32	60.2 Å²	60.2	15%	0.15	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	55.3	-179.2	-67.8	173.1	87.2	0	0	110.8	D107 E132 R133 Y134 R143	D107-E130 PolarHBondContact OD1-N 3.17Å; D107-E130 PolarHBondContact OD2-N 3.07Å; E130-E132 PolarHBondContact O-N 3.27Å; E130-R133 PolarHBondContact O-N 3.01Å; E130-R133 PolarHBondContact O-NE 3.09Å; E130-R133 VanDerWaalsContact O-NE 3.09Å; E130-R133 PolarHBondContact O-NH1 2.86Å; E130-R133 PolarHBondContact O-NH2 3.38Å; E130-Y134 HydrophobicContact CB-CD2 4.11Å; E130-Y134 VanDerWaalsContact OE2-CD2 3.32Å; E130-Y134 WeakPolarHBondContact OE2-CD2 3.23Å; E130-R143 IonicContact OE1-NH1 3.59Å; E130-R143 IonicContact OE2-CZ 3.04Å; E130-R143 IonicContact OE2-NH1 2.8Å; E130-R143 PolarHBondContact OE2-NH1 3.32Å
131	G	87.4	Confident	88.8	Confident	17 Å²	17	54.4 Å²	54.4	18%	0.175	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.9	35.2	177.5	0	0	0	0	0	114.7	V129 R133 R309	V129-G131 PolarHBondContact O-N 2.68Å; G131-R133 VanDerWaalsContact C-N 3.27Å; G131-R133 PolarHBondContact O-N 2.87Å; G131-R309 PolarHBondContact O-NH2 2.99Å
132	E	91.9	Very high	90.1	Very high	61 Å²	61	51.9 Å²	51.9	29%	0.285	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.6	17.5	-176.3	-57.2	-154	-157.8	0	0	116.5	A128 V129 E130 Y147 R384	A128-E132 HydrophobicContact CB-CB 4.35Å; A128-E132 HydrophobicContact CB-CG 3.92Å; V129-E132 PolarHBondContact O-N 3.46Å; E130-E132 PolarHBondContact O-N 3.27Å; E132-Y147 WeakPolarHBondContact O-CE2 3.36Å; E132-R384 IonicContact OE2-CZ 2.97Å; E132-R384 IonicContact OE2-NE 3.11Å; E132-R384 PolarHBondContact OE2-NE 3.38Å; E132-R384 IonicContact OE2-NH2 3.69Å
133	R	93.8	Very high	91.5	Very high	9 Å²	9	43.4 Å²	43.4	3%	0.034	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-19.5	178.6	-60.4	179.9	-61.9	-97.4	-0.1	113.1	V129 E130 G131 V146 Y147 W148 E254 R287 E311	V129-R133 PolarHBondContact O-N 3.14Å; E130-R133 PolarHBondContact O-N 3.01Å; E130-R133 PolarHBondContact O-NE 3.09Å; E130-R133 VanDerWaalsContact O-NE 3.09Å; E130-R133 PolarHBondContact O-NH1 2.86Å; E130-R133 PolarHBondContact O-NH2 3.38Å; G131-R133 VanDerWaalsContact C-N 3.27Å; G131-R133 PolarHBondContact O-N 2.87Å; R133-V146 WeakPolarHBondContact O-CB 3.49Å; R133-V146 PolarHBondContact O-N 3.35Å; R133-Y147 HydrophobicContact CB-CD2 4.34Å; R133-Y147 HydrophobicContact CG-CD2 4.28Å; R133-Y147 HydrophobicContact CG-CE2 4.23Å; R133-W148 HydrophobicContact CB-CH2 4Å; R133-E254 IonicContact CZ-OE1 3.75Å; R133-E254 IonicContact CZ-OE2 3.09Å; R133-E254 IonicContact NH1-OE1 3.43Å; R133-E254 PolarHBondContact NH1-OE1 3.25Å; R133-E254 IonicContact NH1-OE2 3.57Å; R133-E254 PolarHBondContact NH1-OE2 3.19Å; R133-E254 IonicContact NH2-OE1 2.78Å; R133-E254 PolarHBondContact NH2-OE1 2.91Å; R133-E254 IonicContact NH2-OE2 2.74Å; R133-E254 PolarHBondContact NH2-OE2 3.23Å; R133-R287 VanDerWaalsContact CD-CZ 3.46Å; R133-R287 VanDerWaalsContact NH1-NE 3.12Å; R133-E311 IonicContact CZ-OE2 2.74Å; R133-E311 IonicContact NH1-OE1 2.68Å; R133-E311 IonicContact NH1-OE2 3.76Å; R133-E311 PolarHBondContact NH1-OE2 2.83Å
134	Y	94.9	Very high	92.3	Very high	7 Å²	7	39 Å²	39	3%	0.027	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	143	178.7	-71.5	-80.5	0	0	0	110.5	V129 E130 R143 F144 A145 W148 Q150	V129-Y134 PolarHBondContact N-O 3.19Å; V129-Y134 PolarHBondContact O-N 2.75Å; E130-Y134 HydrophobicContact CB-CD2 4.11Å; E130-Y134 VanDerWaalsContact OE2-CD2 3.32Å; E130-Y134 WeakPolarHBondContact OE2-CD2 3.23Å; Y134-R143 HydrophobicContact CD1-CG 3.83Å; Y134-R143 VanDerWaalsContact CE1-CZ 3.44Å; Y134-R143 HydrophobicContact CG-CG 4.04Å; Y134-R143 VanDerWaalsContact CZ-NH1 3.26Å; Y134-F144 CarbonylContact C-O 3.56Å; Y134-F144 VanDerWaalsContact CA-O 3.27Å; Y134-F144 WeakPolarHBondContact CA-O 3.44Å; Y134-F144 WeakPolarHBondContact CD1-O 3.19Å; Y134-A145 HydrophobicContact CD1-CB 4.04Å; Y134-A145 HydrophobicContact CE1-CB 3.73Å; Y134-W148 HydrophobicContact CE1-CZ2 4.31Å; Y134-W148 AromaticContact CE2-CZ2 3.92Å; Y134-W148 HydrophobicContact CE2-CZ2 3.92Å; Y134-W148 AromaticContact CZ-CZ2 3.65Å; Y134-Q150 PolarHBondContact OH-OE1 3.16Å
135	D	95.9	Very high	93	Very high	29 Å²	29	37.9 Å²	37.9	16%	0.155	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	126.9	172.3	-81.3	-26.1	0	0	0	109	V126 R143 F144 V146 R384	V126-D135 HydrophobicContact CG1-CB 3.61Å; D135-R143 CarbonylContact O-C 3.43Å; D135-R143 WeakPolarHBondContact O-CA 3.02Å; D135-F144 PolarHBondContact N-O 3.03Å; D135-F144 PolarHBondContact O-N 2.91Å; D135-V146 HydrophobicContact CB-CG2 4.18Å; D135-V146 WeakPolarHBondContact OD2-CG2 3.49Å; D135-R384 IonicContact OD1-CZ 3.3Å; D135-R384 IonicContact OD1-NH1 3.25Å; D135-R384 PolarHBondContact OD1-NH1 3.05Å; D135-R384 IonicContact OD1-NH2 3.41Å; D135-R384 PolarHBondContact OD1-NH2 3.25Å; D135-R384 IonicContact OD2-CZ 3.54Å; D135-R384 IonicContact OD2-NH1 2.75Å; D135-R384 PolarHBondContact OD2-NH1 3.2Å; D135-R384 IonicContact OD2-NH2 3.4Å
136	V	96.3	Very high	93.2	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120	175.4	177.5	0	0	0	0	109.5	F103 L111 V126 V127 V129 I138 M142 R143 V155	F103-V136 HydrophobicContact CZ-CG2 4.03Å; L111-V136 HydrophobicContact CD2-CB 3.71Å; L111-V136 HydrophobicContact CD2-CG1 3.68Å; L111-V136 HydrophobicContact CD2-CG2 4.09Å; V126-V136 WeakPolarHBondContact CA-O 3.39Å; V127-V136 PolarHBondContact N-O 2.74Å; V127-V136 PolarHBondContact O-N 2.92Å; V129-V136 HydrophobicContact CG1-CG2 4.07Å; V129-V136 HydrophobicContact CG2-CG2 3.64Å; V136-I138 HydrophobicContact CG1-CD1 4.31Å; V136-I138 PolarHBondContact O-N 3.01Å; V136-M142 WeakPolarHBondContact CA-O 3.48Å; V136-R143 HydrophobicContact CG2-CB 4.07Å; V136-R143 HydrophobicContact CG2-CG 3.93Å; V136-V155 HydrophobicContact CG1-CB 4.34Å; V136-V155 HydrophobicContact CG1-CG1 4.02Å; V136-V155 HydrophobicContact CG1-CG2 4.18Å; V136-V155 HydrophobicContact CG2-CG2 4.27Å
137	H	94.6	Very high	93.2	Very high	47 Å²	47	33.8 Å²	33.8	22%	0.218	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	105.8	170.9	-75	-148.3	0	0	0	108.1	D124 K139 E140 R141 M142 F144	D124-H137 IonicContact OD2-CG 3.93Å; D124-H137 IonicContact OD2-ND1 3.76Å; H137-K139 VanDerWaalsContact C-N 3.34Å; H137-K139 PolarHBondContact O-N 3.25Å; H137-E140 HydrophobicContact CB-CB 4.05Å; H137-E140 IonicContact ND1-OE2 2.68Å; H137-E140 PolarHBondContact ND1-OE2 2.81Å; H137-R141 PolarHBondContact O-N 3.34Å; H137-M142 PolarHBondContact N-O 2.75Å; H137-M142 PolarHBondContact O-N 2.64Å; H137-F144 HydrophobicContact CB-CE2 4.06Å; H137-F144 AromaticContact CD2-CD2 3.63Å; H137-F144 AromaticContact CD2-CE2 3.72Å; H137-F144 AromaticContact CE1-CE2 3.92Å; H137-F144 AromaticContact CG-CD2 3.97Å; H137-F144 AromaticContact CG-CE2 3.57Å; H137-F144 AromaticContact ND1-CE2 3.7Å; H137-F144 AromaticContact NE2-CD2 3.85Å; H137-F144 AromaticContact NE2-CE2 3.96Å
138	I	91.7	Very high	93.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-44	-172.6	-65.3	-69.1	0	0	0	110.6	W88 L111 A114 F115 V118 D124 I125 V127 V136 R141	W88-I138 HydrophobicContact CH2-CD1 4.34Å; L111-I138 HydrophobicContact CB-CD1 4.38Å; L111-I138 HydrophobicContact CD2-CD1 3.59Å; A114-I138 HydrophobicContact CB-CD1 4.35Å; A114-I138 HydrophobicContact CB-CG1 4.21Å; F115-I138 HydrophobicContact CB-CG2 4.08Å; F115-I138 HydrophobicContact CD2-CG2 3.94Å; F115-I138 HydrophobicContact CG-CG2 4.5Å; V118-I138 HydrophobicContact CB-CG2 4.42Å; V118-I138 HydrophobicContact CG2-CB 4.17Å; V118-I138 HydrophobicContact CG2-CG2 3.8Å; D124-I138 PolarHBondContact OD1-N 3.19Å; I125-I138 VanDerWaalsContact O-CG1 3.3Å; I125-I138 WeakPolarHBondContact O-CG1 3.3Å; I125-I138 PolarHBondContact O-N 2.99Å; I125-I138 VanDerWaalsContact O-N 3.16Å; V127-I138 HydrophobicContact CG2-CD1 4.06Å; V127-I138 HydrophobicContact CG2-CG1 3.9Å; V136-I138 HydrophobicContact CG1-CD1 4.31Å; V136-I138 PolarHBondContact O-N 3.01Å; I138-R141 PolarHBondContact O-N 3.32Å; I138-R141 PolarHBondContact O-NH1 2.99Å
139	K	88.8	Confident	92.8	Very high	126 Å²	126	39.8 Å²	39.8	55%	0.548	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-41.7	-175.7	-167.1	177.9	-173.5	171.2	0	112.3	E122 D124 H137 R141	E122-K139 PolarHBondContact O-NZ 3.27Å; D124-K139 HydrophobicContact CB-CB 4Å; D124-K139 HydrophobicContact CB-CD 4.1Å; D124-K139 WeakPolarHBondContact OD1-CB 3.3Å; D124-K139 PolarHBondContact OD1-N 2.65Å; H137-K139 VanDerWaalsContact C-N 3.34Å; H137-K139 PolarHBondContact O-N 3.25Å; K139-R141 VanDerWaalsContact C-N 3.33Å
140	E	90.4	Very high	92.5	Very high	115 Å²	115	43.9 Å²	43.9	54%	0.537	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-17	179.5	-65	-174	163.1	0	0	113.4	H137 M142	H137-E140 HydrophobicContact CB-CB 4.05Å; H137-E140 IonicContact ND1-OE2 2.68Å; H137-E140 PolarHBondContact ND1-OE2 2.81Å; E140-M142 VanDerWaalsContact C-N 3.28Å; E140-M142 HydrophobicContact CB-CB 4.44Å; E140-M142 HydrophobicContact CB-CG 4.23Å; E140-M142 PolarHBondContact O-N 3.46Å
141	R	92.9	Very high	92.4	Very high	49 Å²	49	46 Å²	46	19%	0.185	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	37.3	-174.6	-66.7	-63.2	-161.1	-91.2	1	112.6	H137 I138 K139 V155 E175	H137-R141 PolarHBondContact O-N 3.34Å; I138-R141 PolarHBondContact O-N 3.32Å; I138-R141 PolarHBondContact O-NH1 2.99Å; K139-R141 VanDerWaalsContact C-N 3.33Å; R141-V155 WeakPolarHBondContact CB-O 3.42Å; R141-V155 PolarHBondContact O-N 2.93Å; R141-E175 IonicContact CZ-OE1 3.15Å; R141-E175 IonicContact CZ-OE2 3.89Å; R141-E175 IonicContact NE-OE1 3.13Å; R141-E175 PolarHBondContact NE-OE1 2.84Å; R141-E175 IonicContact NE-OE2 2.74Å; R141-E175 IonicContact NH2-OE1 3.58Å; R141-E175 PolarHBondContact NH2-OE1 3.31Å; R141-E175 IonicContact NH2-OE2 2.68Å; R141-E175 PolarHBondContact NH2-OE2 3.42Å
142	M	94.4	Very high	92.6	Very high	52 Å²	52	48.2 Å²	48.2	26%	0.256	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.6	-178.5	-61.7	-55.4	-67.7	0	0	111.9	V136 H137 E140 F144 P152 A153	V136-M142 WeakPolarHBondContact CA-O 3.48Å; H137-M142 PolarHBondContact N-O 2.75Å; H137-M142 PolarHBondContact O-N 2.64Å; E140-M142 VanDerWaalsContact C-N 3.28Å; E140-M142 HydrophobicContact CB-CB 4.44Å; E140-M142 HydrophobicContact CB-CG 4.23Å; E140-M142 PolarHBondContact O-N 3.46Å; M142-F144 HydrophobicContact CB-CD2 4.45Å; M142-F144 HydrophobicContact CB-CE2 3.65Å; M142-F144 HydrophobicContact CB-CZ 3.91Å; M142-P152 HydrophobicContact CE-CB 3.56Å; M142-P152 WeakPolarHBondContact CE-O 3.37Å; M142-A153 CarbonylContact C-O 3.56Å; M142-A153 WeakPolarHBondContact CA-O 3.42Å
143	R	94.6	Very high	92.7	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.015	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	125.7	173.3	-175.4	-173.7	68.8	127.3	19.3	110.1	E130 Y134 D135 V136 P152 A153 V155	E130-R143 IonicContact OE1-NH1 3.59Å; E130-R143 IonicContact OE2-CZ 3.04Å; E130-R143 IonicContact OE2-NH1 2.8Å; E130-R143 PolarHBondContact OE2-NH1 3.32Å; Y134-R143 HydrophobicContact CD1-CG 3.83Å; Y134-R143 VanDerWaalsContact CE1-CZ 3.44Å; Y134-R143 HydrophobicContact CG-CG 4.04Å; Y134-R143 VanDerWaalsContact CZ-NH1 3.26Å; D135-R143 CarbonylContact O-C 3.43Å; D135-R143 WeakPolarHBondContact O-CA 3.02Å; V136-R143 HydrophobicContact CG2-CB 4.07Å; V136-R143 HydrophobicContact CG2-CG 3.93Å; R143-P152 WeakPolarHBondContact O-CA 3.39Å; R143-A153 HydrophobicContact CB-CB 4.38Å; R143-A153 PolarHBondContact N-O 2.87Å; R143-A153 PolarHBondContact O-N 3.21Å; R143-V155 HydrophobicContact CB-CG2 3.58Å
144	F	95	Very high	92.7	Very high	63 Å²	63	48.6 Å²	48.6	28%	0.276	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	140.4	179.6	-60.3	-93.3	0	0	0	110.2	Y134 D135 H137 M142 P152	Y134-F144 CarbonylContact C-O 3.56Å; Y134-F144 VanDerWaalsContact CA-O 3.27Å; Y134-F144 WeakPolarHBondContact CA-O 3.44Å; Y134-F144 WeakPolarHBondContact CD1-O 3.19Å; D135-F144 PolarHBondContact N-O 3.03Å; D135-F144 PolarHBondContact O-N 2.91Å; H137-F144 HydrophobicContact CB-CE2 4.06Å; H137-F144 AromaticContact CD2-CD2 3.63Å; H137-F144 AromaticContact CD2-CE2 3.72Å; H137-F144 AromaticContact CE1-CE2 3.92Å; H137-F144 AromaticContact CG-CD2 3.97Å; H137-F144 AromaticContact CG-CE2 3.57Å; H137-F144 AromaticContact ND1-CE2 3.7Å; H137-F144 AromaticContact NE2-CD2 3.85Å; H137-F144 AromaticContact NE2-CE2 3.96Å; M142-F144 HydrophobicContact CB-CD2 4.45Å; M142-F144 HydrophobicContact CB-CE2 3.65Å; M142-F144 HydrophobicContact CB-CZ 3.91Å; F144-P152 HydrophobicContact CD1-CB 3.93Å; F144-P152 HydrophobicContact CD1-CG 3.65Å; F144-P152 HydrophobicContact CE1-CB 3.7Å; F144-P152 HydrophobicContact CE1-CG 3.41Å; F144-P152 VanDerWaalsContact CE1-CG 3.41Å; F144-P152 HydrophobicContact CZ-CB 4.23Å; F144-P152 HydrophobicContact CZ-CG 4.35Å
145	A	94.6	Very high	92.7	Very high	24 Å²	24	48.3 Å²	48.3	20%	0.198	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	138	171.2	0	0	0	0	0	110.1	Y134 W148 Q150	Y134-A145 HydrophobicContact CD1-CB 4.04Å; Y134-A145 HydrophobicContact CE1-CB 3.73Å; A145-W148 HydrophobicContact CB-CG 4.37Å; A145-W148 WeakPolarHBondContact CB-O 3.45Å; A145-Q150 HydrophobicContact CB-CB 3.79Å
146	V	94.8	Very high	92.6	Very high	24 Å²	24	48.8 Å²	48.8	15%	0.145	25%	0.253	C	S	.	.	S	Bend	trans	-89.3	-45.8	-176.4	175.3	0	0	0	0	111.5	R133 D135 L380	R133-V146 WeakPolarHBondContact O-CB 3.49Å; R133-V146 PolarHBondContact O-N 3.35Å; D135-V146 HydrophobicContact CB-CG2 4.18Å; D135-V146 WeakPolarHBondContact OD2-CG2 3.49Å; V146-L380 HydrophobicContact CG1-CD2 4.08Å; V146-L380 HydrophobicContact CG1-CG 4.39Å; V146-L380 WeakPolarHBondContact O-CD2 3.4Å
147	Y	93.3	Very high	92.5	Very high	3 Å²	3	51.1 Å²	51.1	1%	0.012	26%	0.262	C	S	.	.	S	Bend	trans	-90.5	-28.1	-170	-65.9	-75.7	0	0	0	113.7	E132 R133 L313 R376 L377 L380 F381	E132-Y147 WeakPolarHBondContact O-CE2 3.36Å; R133-Y147 HydrophobicContact CB-CD2 4.34Å; R133-Y147 HydrophobicContact CG-CD2 4.28Å; R133-Y147 HydrophobicContact CG-CE2 4.23Å; Y147-L313 HydrophobicContact CD1-CD1 3.84Å; Y147-L313 HydrophobicContact CD1-CD2 4.05Å; Y147-L313 HydrophobicContact CD2-CD2 3.84Å; Y147-L313 HydrophobicContact CE1-CD1 3.9Å; Y147-L313 HydrophobicContact CE1-CD2 4.34Å; Y147-L313 HydrophobicContact CE2-CD2 4.14Å; Y147-L313 HydrophobicContact CG-CD1 4.42Å; Y147-L313 HydrophobicContact CG-CD2 3.8Å; Y147-R376 PolarHBondContact O-NH2 3.49Å; Y147-L377 HydrophobicContact CD1-CD2 4.11Å; Y147-L377 WeakPolarHBondContact O-CD2 3.48Å; Y147-L380 HydrophobicContact CD1-CD2 3.91Å; Y147-L380 HydrophobicContact CD1-CG 4.25Å; Y147-L380 HydrophobicContact CE1-CB 4.47Å; Y147-L380 HydrophobicContact CE1-CD2 4.2Å; Y147-L380 HydrophobicContact CE1-CG 4.04Å; Y147-F381 HydrophobicContact CE1-CB 4.07Å; Y147-F381 HydrophobicContact CE1-CD2 4.4Å
148	W	91.6	Very high	92.4	Very high	13 Å²	13	49 Å²	49	5%	0.049	25%	0.252	C	S	.	.	S	Bend	trans	-132.8	155.4	-175.8	55.8	79.9	0	0	0	111.3	R133 Y134 A145 Q150 V280 P314	R133-W148 HydrophobicContact CB-CH2 4Å; Y134-W148 HydrophobicContact CE1-CZ2 4.31Å; Y134-W148 AromaticContact CE2-CZ2 3.92Å; Y134-W148 HydrophobicContact CE2-CZ2 3.92Å; Y134-W148 AromaticContact CZ-CZ2 3.65Å; A145-W148 HydrophobicContact CB-CG 4.37Å; A145-W148 WeakPolarHBondContact CB-O 3.45Å; W148-Q150 VanDerWaalsContact NE1-OE1 3.09Å; W148-Q150 PolarHBondContact O-N 3.26Å; W148-V280 HydrophobicContact CB-CG2 4.22Å; W148-V280 HydrophobicContact CD2-CG1 3.87Å; W148-V280 HydrophobicContact CD2-CG2 4Å; W148-V280 VanDerWaalsContact CE2-CG1 3.44Å; W148-V280 HydrophobicContact CE3-CG1 4.43Å; W148-V280 HydrophobicContact CG-CG1 4.32Å; W148-V280 HydrophobicContact CG-CG2 3.78Å; W148-V280 HydrophobicContact CH2-CG1 4.26Å; W148-V280 HydrophobicContact CZ2-CG1 3.66Å; W148-P314 HydrophobicContact CD2-CG 4.35Å; W148-P314 HydrophobicContact CE3-CG 3.57Å; W148-P314 HydrophobicContact CZ3-CG 3.91Å
149	D	87.2	Confident	92.5	Very high	159 Å²	159	49.6 Å²	49.6	85%	0.85	26%	0.256	S	S	*	.			trans	-69.8	123.4	174.6	-61.6	-42.5	0	0	0	110.7
150	Q	87.3	Confident	92.7	Very high	88 Å²	88	43.6 Å²	43.6	41%	0.411	23%	0.23	S	C	.	.			trans	-148.7	143.2	175.7	-173.5	169.5	10	0	0	109.5	Y134 A145 W148	Y134-Q150 PolarHBondContact OH-OE1 3.16Å; A145-Q150 HydrophobicContact CB-CB 3.79Å; W148-Q150 VanDerWaalsContact NE1-OE1 3.09Å; W148-Q150 PolarHBondContact O-N 3.26Å
151	A	88.9	Confident	92.8	Very high	77 Å²	77	38.2 Å²	38.2	64%	0.636	20%	0.204	S	C	*	.	P	Polyproline II helix	trans	-58.1	134.5	172.5	0	0	0	0	0	110.7	A153	A151-A153 PolarHBondContact O-N 3.25Å
152	P	92.5	Very high	92.6	Very high	63 Å²	63	38.9 Å²	38.9	41%	0.409	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-58.7	136.5	178.6	-25.8	35.8	0	0	0	112	M142 R143 F144	M142-P152 HydrophobicContact CE-CB 3.56Å; M142-P152 WeakPolarHBondContact CE-O 3.37Å; R143-P152 WeakPolarHBondContact O-CA 3.39Å; F144-P152 HydrophobicContact CD1-CB 3.93Å; F144-P152 HydrophobicContact CD1-CG 3.65Å; F144-P152 HydrophobicContact CE1-CB 3.7Å; F144-P152 HydrophobicContact CE1-CG 3.41Å; F144-P152 VanDerWaalsContact CE1-CG 3.41Å; F144-P152 HydrophobicContact CZ-CB 4.23Å; F144-P152 HydrophobicContact CZ-CG 4.35Å
153	A	92.6	Very high	92.4	Very high	12 Å²	12	39.5 Å²	39.5	10%	0.099	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	137.4	-176.9	0	0	0	0	0	111.6	C91 M142 R143 A151	C91-A153 WeakPolarHBondContact O-CB 3.36Å; M142-A153 CarbonylContact C-O 3.56Å; M142-A153 WeakPolarHBondContact CA-O 3.42Å; R143-A153 HydrophobicContact CB-CB 4.38Å; R143-A153 PolarHBondContact N-O 2.87Å; R143-A153 PolarHBondContact O-N 3.21Å; A151-A153 PolarHBondContact O-N 3.25Å
154	E	93.9	Very high	91.9	Very high	66 Å²	66	39.8 Å²	39.8	31%	0.308	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	138.6	174.7	-161	-160.1	141.2	0	0	110.7	F90 C91 W100 R156	F90-E154 CarbonylContact C-O 3.59Å; F90-E154 VanDerWaalsContact CA-O 3.29Å; F90-E154 WeakPolarHBondContact CA-O 3.44Å; C91-E154 HydrophobicContact CB-CB 4.25Å; C91-E154 PolarHBondContact N-O 2.96Å; W100-E154 HydrophobicContact CH2-CB 4.07Å; W100-E154 HydrophobicContact CH2-CG 4.07Å; E154-R156 IonicContact OE1-CZ 2.77Å; E154-R156 VanDerWaalsContact OE1-CZ 3.22Å; E154-R156 IonicContact OE1-NE 3.51Å; E154-R156 PolarHBondContact OE1-NE 3.49Å; E154-R156 IonicContact OE1-NH2 2.74Å; E154-R156 PolarHBondContact OE1-NH2 3.41Å; E154-R156 IonicContact OE2-CZ 2.65Å; E154-R156 IonicContact OE2-NH2 3.44Å; E154-R156 PolarHBondContact OE2-NH2 3.38Å
155	V	94.9	Very high	90.9	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	137.1	174.9	169.3	0	0	0	0	109.2	W88 F89 F90 F103 V136 R141 R143	W88-V155 HydrophobicContact CE3-CG1 3.51Å; W88-V155 HydrophobicContact CZ3-CG1 3.83Å; F89-V155 CarbonylContact O-C 3.55Å; F89-V155 WeakPolarHBondContact O-CA 3.44Å; F90-V155 HydrophobicContact CB-CG2 4.08Å; F103-V155 HydrophobicContact CE2-CG1 3.92Å; F103-V155 HydrophobicContact CE2-CG2 4.06Å; F103-V155 HydrophobicContact CZ-CG2 3.99Å; V136-V155 HydrophobicContact CG1-CB 4.34Å; V136-V155 HydrophobicContact CG1-CG1 4.02Å; V136-V155 HydrophobicContact CG1-CG2 4.18Å; V136-V155 HydrophobicContact CG2-CG2 4.27Å; R141-V155 WeakPolarHBondContact CB-O 3.42Å; R141-V155 PolarHBondContact O-N 2.93Å; R143-V155 HydrophobicContact CB-CG2 3.58Å
156	R	93.5	Very high	90	Very high	39 Å²	39	48.8 Å²	48.8	15%	0.147	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	134.9	-173.3	-164	176.4	-70.5	174.9	1	111.2	F89 W100 E154 C158 P172 Y173 E175	F89-R156 PolarHBondContact N-O 2.99Å; F89-R156 PolarHBondContact O-N 2.91Å; W100-R156 HydrophobicContact CE3-CB 4.45Å; W100-R156 HydrophobicContact CH2-CB 3.8Å; W100-R156 VanDerWaalsContact CZ2-NH2 3.3Å; W100-R156 HydrophobicContact CZ3-CB 3.51Å; E154-R156 IonicContact OE1-CZ 2.77Å; E154-R156 VanDerWaalsContact OE1-CZ 3.22Å; E154-R156 IonicContact OE1-NE 3.51Å; E154-R156 PolarHBondContact OE1-NE 3.49Å; E154-R156 IonicContact OE1-NH2 2.74Å; E154-R156 PolarHBondContact OE1-NH2 3.41Å; E154-R156 IonicContact OE2-CZ 2.65Å; E154-R156 IonicContact OE2-NH2 3.44Å; E154-R156 PolarHBondContact OE2-NH2 3.38Å; R156-C158 PolarHBondContact O-SG 2.89Å; R156-P172 PolarHBondContact NH1-O 3.42Å; R156-Y173 WeakPolarHBondContact CD-O 3.42Å; R156-E175 HydrophobicContact CG-CG 4.37Å
157	R	94.3	Very high	89.3	Confident	49 Å²	49	50.4 Å²	50.4	19%	0.185	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	109	173.1	-174.6	-176.4	176.6	-85.5	7	109.5	P86 W88 E112 F115 E175	P86-R157 HydrophobicContact CB-CG 3.83Å; W88-R157 HydrophobicContact CD2-CB 4Å; W88-R157 HydrophobicContact CD2-CG 4.29Å; W88-R157 HydrophobicContact CE3-CB 4.04Å; W88-R157 HydrophobicContact CH2-CB 3.9Å; W88-R157 HydrophobicContact CH2-CG 4.45Å; W88-R157 HydrophobicContact CZ2-CB 3.8Å; W88-R157 HydrophobicContact CZ2-CG 3.86Å; W88-R157 HydrophobicContact CZ3-CB 4Å; E112-R157 VanDerWaalsContact CD-NE 3.34Å; E112-R157 IonicContact OE1-CZ 3.91Å; E112-R157 IonicContact OE1-NE 3.87Å; E112-R157 PolarHBondContact OE1-NE 3.08Å; E112-R157 VanDerWaalsContact OE1-NE 3.13Å; E112-R157 IonicContact OE1-NH2 3.04Å; E112-R157 PolarHBondContact OE1-NH2 3.34Å; E112-R157 WeakPolarHBondContact OE2-CD 3.29Å; E112-R157 IonicContact OE2-CZ 3.04Å; E112-R157 IonicContact OE2-NE 3.8Å; E112-R157 PolarHBondContact OE2-NE 2.93Å; E112-R157 IonicContact OE2-NH2 3.39Å; F115-R157 VanDerWaalsContact CE1-CD 3.5Å; R157-E175 HydrophobicContact CB-CG 4.23Å; R157-E175 WeakPolarHBondContact CB-OE1 3.34Å; R157-E175 PolarHBondContact N-OE1 3.49Å; R157-E175 VanDerWaalsContact N-OE1 3.09Å; R157-E175 WeakPolarHBondContact O-CG 3.4Å
158	C	92.7	Very high	88.7	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.007	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.2	-165.5	-54.8	0	0	0	0	112.5	P86 H87 F89 R156 F161 P172	P86-C158 WeakPolarHBondContact CA-O 3.34Å; H87-C158 PolarHBondContact N-O 3.19Å; H87-C158 WeakPolarHBondContact O-CA 3.4Å; H87-C158 WeakPolarHBondContact O-CB 3.27Å; H87-C158 PolarHBondContact O-N 3.2Å; F89-C158 HydrophobicContact CD2-CB 3.72Å; F89-C158 HydrophobicContact CE2-CB 4.11Å; R156-C158 PolarHBondContact O-SG 2.89Å; C158-F161 HydrophobicContact CB-CE1 3.88Å; C158-F161 HydrophobicContact CB-CZ 3.7Å; C158-P172 HydrophobicContact CB-CB 3.96Å; C158-P172 WeakPolarHBondContact SG-CB 3.47Å
159	T	93.8	Very high	88.3	Confident	14 Å²	14	62 Å²	62	9%	0.086	32%	0.317	C	S	.	.	S	Bend	trans	-127.5	-17.5	171.9	52.4	0	0	0	0	113.4	V84 P86 G242	V84-T159 HydrophobicContact CG1-CG2 3.84Å; V84-T159 HydrophobicContact CG2-CG2 4.31Å; P86-T159 HydrophobicContact CB-CG2 3.94Å; T159-G242 PolarHBondContact O-N 3.48Å
160	W	93.3	Very high	88.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	143.9	178.9	-74.2	85.4	0	0	0	111.2	Y173 L181 E182 Y185 I214 V239 R241	W160-Y173 HydrophobicContact CB-CD2 3.87Å; W160-Y173 PolarHBondContact O-N 2.99Å; W160-L181 HydrophobicContact CB-CD1 4.02Å; W160-L181 HydrophobicContact CD2-CB 4.03Å; W160-L181 HydrophobicContact CD2-CD1 3.91Å; W160-L181 HydrophobicContact CE3-CD1 3.99Å; W160-L181 HydrophobicContact CG-CB 4.19Å; W160-L181 HydrophobicContact CG-CD1 3.95Å; W160-L181 HydrophobicContact CZ2-CB 4.41Å; W160-E182 PolarHBondContact NE1-OE2 3.04Å; W160-Y185 AromaticContact CH2-CD2 3.68Å; W160-Y185 HydrophobicContact CH2-CD2 3.68Å; W160-Y185 HydrophobicContact CH2-CE2 4.3Å; W160-Y185 AromaticContact CH2-CG 3.87Å; W160-Y185 HydrophobicContact CH2-CG 3.87Å; W160-Y185 HydrophobicContact CZ2-CD1 4.32Å; W160-Y185 HydrophobicContact CZ2-CD2 4.1Å; W160-Y185 AromaticContact CZ2-CG 3.79Å; W160-Y185 HydrophobicContact CZ2-CG 3.79Å; W160-I214 HydrophobicContact CH2-CD1 3.68Å; W160-I214 HydrophobicContact CZ3-CD1 3.57Å; W160-V239 HydrophobicContact CE3-CG1 3.5Å; W160-V239 VanDerWaalsContact CE3-CG1 3.5Å; W160-V239 HydrophobicContact CZ3-CG1 3.74Å; W160-R241 HydrophobicContact CD2-CB 4.13Å; W160-R241 HydrophobicContact CD2-CG 4.23Å; W160-R241 HydrophobicContact CE3-CB 3.92Å; W160-R241 HydrophobicContact CH2-CB 3.7Å; W160-R241 HydrophobicContact CH2-CG 4.03Å; W160-R241 HydrophobicContact CZ2-CB 3.88Å; W160-R241 HydrophobicContact CZ2-CG 3.67Å; W160-R241 HydrophobicContact CZ3-CB 3.72Å; W160-R241 HydrophobicContact CZ3-CG 4.42Å
161	F	92.3	Very high	88.3	Confident	1 Å²	1	54.4 Å²	54.4	0%	0.004	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	151.9	-175.8	-54.9	-91.6	0	0	0	111.4	F89 C158 F170 F171 P172 V239 K240 V243 I246	F89-F161 HydrophobicContact CD2-CE1 4.27Å; F89-F161 HydrophobicContact CD2-CZ 4.39Å; F89-F161 HydrophobicContact CE1-CE1 4.24Å; F89-F161 AromaticContact CE2-CE1 3.68Å; F89-F161 HydrophobicContact CE2-CE1 3.68Å; F89-F161 AromaticContact CE2-CZ 3.58Å; F89-F161 HydrophobicContact CE2-CZ 3.58Å; F89-F161 AromaticContact CZ-CE1 3.67Å; F89-F161 HydrophobicContact CZ-CE1 3.67Å; F89-F161 AromaticContact CZ-CZ 3.83Å; F89-F161 HydrophobicContact CZ-CZ 3.83Å; C158-F161 HydrophobicContact CB-CE1 3.88Å; C158-F161 HydrophobicContact CB-CZ 3.7Å; F161-F170 HydrophobicContact CB-CB 4.09Å; F161-F170 HydrophobicContact CB-CD1 3.98Å; F161-F170 HydrophobicContact CB-CG 4.42Å; F161-F171 CarbonylContact C-O 3.53Å; F161-F171 WeakPolarHBondContact CA-O 3.49Å; F161-P172 HydrophobicContact CD1-CB 4.03Å; F161-P172 HydrophobicContact CE1-CB 3.96Å; F161-V239 CarbonylContact O-C 3.53Å; F161-V239 WeakPolarHBondContact O-CA 3.28Å; F161-K240 PolarHBondContact N-O 3.45Å; F161-K240 PolarHBondContact O-N 3.04Å; F161-V243 HydrophobicContact CE2-CG1 3.92Å; F161-V243 HydrophobicContact CZ-CG1 3.69Å; F161-I246 HydrophobicContact CB-CG2 4.12Å; F161-I246 HydrophobicContact CD1-CD1 3.96Å; F161-I246 HydrophobicContact CD2-CD1 4.05Å; F161-I246 HydrophobicContact CD2-CG2 4.14Å; F161-I246 HydrophobicContact CE1-CD1 3.92Å; F161-I246 HydrophobicContact CE2-CD1 4.02Å; F161-I246 HydrophobicContact CG-CD1 4.04Å; F161-I246 HydrophobicContact CG-CG2 4.18Å; F161-I246 HydrophobicContact CZ-CD1 3.96Å
162	Y	90.3	Very high	88.4	Confident	63 Å²	63	50.9 Å²	50.9	25%	0.247	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	159.1	171.4	68.8	-82.8	0	0	0	112.5	F170 F171 Y173 T238	Y162-F170 CarbonylContact O-C 3.47Å; Y162-F170 WeakPolarHBondContact O-CA 3.43Å; Y162-F171 HydrophobicContact CD1-CB 4.21Å; Y162-F171 WeakPolarHBondContact CD1-O 3.47Å; Y162-F171 HydrophobicContact CE1-CB 3.68Å; Y162-F171 HydrophobicContact CE2-CB 4.05Å; Y162-F171 HydrophobicContact CE2-CD2 4.42Å; Y162-F171 PolarHBondContact N-O 2.75Å; Y162-F171 PolarHBondContact O-N 3.25Å; Y162-Y173 AromaticContact CD1-CD1 3.76Å; Y162-Y173 HydrophobicContact CD1-CD1 3.76Å; Y162-Y173 HydrophobicContact CD1-CD2 4.06Å; Y162-Y173 AromaticContact CD1-CE1 3.6Å; Y162-Y173 HydrophobicContact CD1-CE1 3.6Å; Y162-Y173 AromaticContact CD1-CE2 3.92Å; Y162-Y173 HydrophobicContact CD1-CE2 3.92Å; Y162-Y173 HydrophobicContact CD1-CG 4.01Å; Y162-Y173 AromaticContact CD1-CZ 3.71Å; Y162-Y173 HydrophobicContact CE1-CD1 4.17Å; Y162-Y173 HydrophobicContact CE1-CE1 4.24Å; Y162-Y173 HydrophobicContact CG-CE1 4.17Å; Y162-Y173 HydrophobicContact CG-CE2 4.24Å; Y162-Y173 AromaticContact CG-CZ 3.93Å; Y162-T238 CarbonylContact C-O 3.54Å; Y162-T238 VanDerWaalsContact CA-O 3.3Å; Y162-T238 WeakPolarHBondContact CA-O 3.28Å
163	K	89.1	Confident	88.3	Confident	65 Å²	65	48.5 Å²	48.5	28%	0.283	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	120.5	174.2	176.4	171.9	179.3	171.2	0	109.1	D167 T168 F170 C237 T238	K163-D167 WeakPolarHBondContact CE-O 3.19Å; K163-D167 HydrophobicContact CG-CB 4.19Å; K163-T168 WeakPolarHBondContact CE-O 3.32Å; K163-T168 PolarHBondContact NZ-O 3.21Å; K163-F170 HydrophobicContact CB-CD1 3.61Å; K163-F170 HydrophobicContact CB-CD2 4.43Å; K163-F170 HydrophobicContact CB-CE1 3.5Å; K163-F170 VanDerWaalsContact CB-CE1 3.5Å; K163-F170 HydrophobicContact CB-CE2 4.36Å; K163-F170 HydrophobicContact CB-CG 4.08Å; K163-F170 HydrophobicContact CB-CZ 3.9Å; K163-F170 HydrophobicContact CD-CD2 4.15Å; K163-F170 HydrophobicContact CD-CE1 4.43Å; K163-F170 HydrophobicContact CD-CE2 3.82Å; K163-F170 HydrophobicContact CD-CZ 3.97Å; K163-C237 CarbonylContact O-C 3.59Å; K163-C237 WeakPolarHBondContact O-CA 3.39Å; K163-T238 PolarHBondContact N-O 2.83Å; K163-T238 PolarHBondContact O-N 3.11Å
164	G	83.6	Confident	88.2	Confident	11 Å²	11	50.5 Å²	50.5	11%	0.113	24%	0.242	C	C	.	.			trans	-73.2	164	171.4	0	0	0	0	0	112.1	K166 D167	G164-K166 PolarHBondContact O-N 2.87Å; G164-D167 WeakPolarHBondContact CA-OD2 3.42Å; G164-D167 PolarHBondContact N-OD2 3.32Å; G164-D167 PolarHBondContact O-N 3.26Å; G164-D167 VanDerWaalsContact O-N 3.14Å
165	D	74.7	Confident	88.1	Confident	97 Å²	97	50.2 Å²	50.2	52%	0.519	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-27.1	-177.3	-171.1	70.6	0	0	0	113.3	R235	D165-R235 HydrophobicContact CB-CB 3.94Å; D165-R235 VanDerWaalsContact CG-NH1 3.34Å; D165-R235 WeakPolarHBondContact OD1-CD 3.24Å; D165-R235 IonicContact OD1-NH1 2.91Å; D165-R235 PolarHBondContact OD1-NH1 2.97Å; D165-R235 VanDerWaalsContact OD1-NH1 3.09Å; D165-R235 WeakPolarHBondContact OD2-CD 3.35Å; D165-R235 IonicContact OD2-CZ 2.86Å; D165-R235 IonicContact OD2-NE 3.01Å; D165-R235 IonicContact OD2-NH1 2.8Å; D165-R235 PolarHBondContact OD2-NH1 3.3Å
166	K	75.8	Confident	87.8	Confident	179 Å²	179	55.9 Å²	55.9	78%	0.778	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-10.5	176.9	-63.3	178.3	-177	172.2	0	113	G164	G164-K166 PolarHBondContact O-N 2.87Å
167	D	79.3	Confident	87.6	Confident	58 Å²	58	55 Å²	55	31%	0.31	26%	0.264	S	S	.	.			trans	-84.1	146.2	-175.8	-60.7	-40.2	0	0	0	111.3	K163 G164 F171	K163-D167 WeakPolarHBondContact CE-O 3.19Å; K163-D167 HydrophobicContact CG-CB 4.19Å; G164-D167 WeakPolarHBondContact CA-OD2 3.42Å; G164-D167 PolarHBondContact N-OD2 3.32Å; G164-D167 PolarHBondContact O-N 3.26Å; G164-D167 VanDerWaalsContact O-N 3.14Å; D167-F171 HydrophobicContact CB-CE2 4.17Å
168	T	80.4	Confident	87.6	Confident	116 Å²	116	52.7 Å²	52.7	71%	0.712	26%	0.256	S	S	*	.	S	Bend	trans	-90.3	-35.1	171.6	53.7	0	0	0	0	112	K163	K163-T168 WeakPolarHBondContact CE-O 3.32Å; K163-T168 PolarHBondContact NZ-O 3.21Å
169	R	83.2	Confident	87.5	Confident	143 Å²	143	58.9 Å²	58.9	54%	0.54	28%	0.282	S	S	.	.	S	Bend	trans	-106.2	164.8	-174	-70	-176.8	-78.1	-177.2	-2.9	112.3
170	F	86.7	Confident	87.3	Confident	39 Å²	39	63 Å²	63	17%	0.171	30%	0.296	C	S	.	.			trans	-91.6	139.6	171.2	-82.7	-86.6	0	0	0	110.1	F161 Y162 K163 K240 I246	F161-F170 HydrophobicContact CB-CB 4.09Å; F161-F170 HydrophobicContact CB-CD1 3.98Å; F161-F170 HydrophobicContact CB-CG 4.42Å; Y162-F170 CarbonylContact O-C 3.47Å; Y162-F170 WeakPolarHBondContact O-CA 3.43Å; K163-F170 HydrophobicContact CB-CD1 3.61Å; K163-F170 HydrophobicContact CB-CD2 4.43Å; K163-F170 HydrophobicContact CB-CE1 3.5Å; K163-F170 VanDerWaalsContact CB-CE1 3.5Å; K163-F170 HydrophobicContact CB-CE2 4.36Å; K163-F170 HydrophobicContact CB-CG 4.08Å; K163-F170 HydrophobicContact CB-CZ 3.9Å; K163-F170 HydrophobicContact CD-CD2 4.15Å; K163-F170 HydrophobicContact CD-CE1 4.43Å; K163-F170 HydrophobicContact CD-CE2 3.82Å; K163-F170 HydrophobicContact CD-CZ 3.97Å; F170-K240 HydrophobicContact CD1-CG 4.39Å; F170-K240 HydrophobicContact CE1-CB 4.06Å; F170-K240 HydrophobicContact CE1-CG 3.5Å; F170-K240 VanDerWaalsContact CE1-CG 3.5Å; F170-K240 HydrophobicContact CZ-CG 3.64Å; F170-I246 HydrophobicContact CB-CB 4.32Å; F170-I246 HydrophobicContact CB-CG2 3.95Å; F170-I246 HydrophobicContact CD1-CG2 3.87Å; F170-I246 HydrophobicContact CD2-CB 3.89Å; F170-I246 HydrophobicContact CD2-CG2 3.74Å; F170-I246 HydrophobicContact CE1-CG2 4.32Å; F170-I246 HydrophobicContact CE2-CB 4.45Å; F170-I246 HydrophobicContact CE2-CG2 4.19Å; F170-I246 HydrophobicContact CG-CB 4.11Å; F170-I246 HydrophobicContact CG-CG2 3.56Å; F170-I246 HydrophobicContact CZ-CG2 4.47Å
171	F	87.8	Confident	87.2	Confident	49 Å²	49	63 Å²	63	22%	0.215	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	139.1	177.4	-68.4	-88.7	0	0	0	110.4	F161 Y162 D167	F161-F171 CarbonylContact C-O 3.53Å; F161-F171 WeakPolarHBondContact CA-O 3.49Å; Y162-F171 HydrophobicContact CD1-CB 4.21Å; Y162-F171 WeakPolarHBondContact CD1-O 3.47Å; Y162-F171 HydrophobicContact CE1-CB 3.68Å; Y162-F171 HydrophobicContact CE2-CB 4.05Å; Y162-F171 HydrophobicContact CE2-CD2 4.42Å; Y162-F171 PolarHBondContact N-O 2.75Å; Y162-F171 PolarHBondContact O-N 3.25Å; D167-F171 HydrophobicContact CB-CE2 4.17Å
172	P	91.8	Very high	87.2	Confident	3 Å²	3	64 Å²	64	2%	0.019	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	131.1	178.6	29	-32.2	0	0	0	112.1	W100 R156 C158 F161	W100-P172 HydrophobicContact CB-CG 3.9Å; W100-P172 HydrophobicContact CD2-CG 3.44Å; W100-P172 VanDerWaalsContact CD2-CG 3.44Å; W100-P172 HydrophobicContact CE3-CG 3.73Å; W100-P172 VanDerWaalsContact CG-CD 3.46Å; W100-P172 HydrophobicContact CG-CG 3.51Å; W100-P172 HydrophobicContact CZ3-CG 4.5Å; R156-P172 PolarHBondContact NH1-O 3.42Å; C158-P172 HydrophobicContact CB-CB 3.96Å; C158-P172 WeakPolarHBondContact SG-CB 3.47Å; F161-P172 HydrophobicContact CD1-CB 4.03Å; F161-P172 HydrophobicContact CE1-CB 3.96Å
173	Y	91.1	Very high	87.3	Confident	12 Å²	12	65.4 Å²	65.4	5%	0.047	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-65.6	157.4	167.9	-78.9	-68.9	0	0	0	111.6	R156 W160 Y162 F177 S178 L181 H216 V239	R156-Y173 WeakPolarHBondContact CD-O 3.42Å; W160-Y173 HydrophobicContact CB-CD2 3.87Å; W160-Y173 PolarHBondContact O-N 2.99Å; Y162-Y173 AromaticContact CD1-CD1 3.76Å; Y162-Y173 HydrophobicContact CD1-CD1 3.76Å; Y162-Y173 HydrophobicContact CD1-CD2 4.06Å; Y162-Y173 AromaticContact CD1-CE1 3.6Å; Y162-Y173 HydrophobicContact CD1-CE1 3.6Å; Y162-Y173 AromaticContact CD1-CE2 3.92Å; Y162-Y173 HydrophobicContact CD1-CE2 3.92Å; Y162-Y173 HydrophobicContact CD1-CG 4.01Å; Y162-Y173 AromaticContact CD1-CZ 3.71Å; Y162-Y173 HydrophobicContact CE1-CD1 4.17Å; Y162-Y173 HydrophobicContact CE1-CE1 4.24Å; Y162-Y173 HydrophobicContact CG-CE1 4.17Å; Y162-Y173 HydrophobicContact CG-CE2 4.24Å; Y162-Y173 AromaticContact CG-CZ 3.93Å; Y173-F177 HydrophobicContact CD1-CB 4.48Å; Y173-F177 AromaticContact CD1-CD1 3.33Å; Y173-F177 HydrophobicContact CD1-CD1 3.33Å; Y173-F177 AromaticContact CD1-CE1 3.54Å; Y173-F177 HydrophobicContact CD1-CE1 3.54Å; Y173-F177 AromaticContact CD1-CG 3.92Å; Y173-F177 HydrophobicContact CD1-CG 3.92Å; Y173-F177 HydrophobicContact CD1-CZ 4.25Å; Y173-F177 HydrophobicContact CD2-CD1 4.31Å; Y173-F177 HydrophobicContact CD2-CE1 4.47Å; Y173-F177 AromaticContact CE1-CD1 3.6Å; Y173-F177 HydrophobicContact CE1-CD1 3.6Å; Y173-F177 AromaticContact CE1-CE1 3.23Å; Y173-F177 HydrophobicContact CE1-CE1 3.23Å; Y173-F177 HydrophobicContact CE1-CE2 4.48Å; Y173-F177 HydrophobicContact CE1-CG 4.37Å; Y173-F177 AromaticContact CE1-CZ 3.74Å; Y173-F177 HydrophobicContact CE1-CZ 3.74Å; Y173-F177 HydrophobicContact CE2-CE1 4.22Å; Y173-F177 AromaticContact CG-CD1 3.7Å; Y173-F177 HydrophobicContact CG-CD1 3.7Å; Y173-F177 HydrophobicContact CG-CE1 4.14Å; Y173-F177 HydrophobicContact CG-CG 4.46Å; Y173-F177 AromaticContact CZ-CE1 3.59Å; Y173-S178 WeakPolarHBondContact CB-OG 3.28Å; Y173-L181 HydrophobicContact CD2-CD1 4.07Å; Y173-L181 HydrophobicContact CE2-CD1 3.98Å; Y173-H216 AromaticContact CZ-ND1 3.93Å; Y173-H216 WeakPolarHBondContact OH-CB 3.06Å; Y173-H216 VanDerWaalsContact OH-CG 3.23Å; Y173-H216 PolarHBondContact OH-ND1 3.26Å; Y173-V239 HydrophobicContact CE2-CG1 4.04Å; Y173-V239 HydrophobicContact CE2-CG2 4.1Å; Y173-V239 VanDerWaalsContact OH-CG2 3.31Å; Y173-V239 WeakPolarHBondContact OH-CG2 3.39Å
174	S	90.4	Very high	87.3	Confident	55 Å²	55	62.7 Å²	62.7	39%	0.385	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-61.5	156.1	170.1	70.2	0	0	0	0	111.3	E176 F177 S178	S174-E176 VanDerWaalsContact C-N 3.3Å; S174-E176 PolarHBondContact O-N 3.07Å; S174-F177 PolarHBondContact O-N 3.3Å; S174-F177 WeakPolarHBondContact OG-CB 3.4Å; S174-F177 PolarHBondContact OG-N 3.1Å; S174-S178 VanDerWaalsContact O-CB 3.31Å; S174-S178 WeakPolarHBondContact O-CB 3.47Å; S174-S178 PolarHBondContact O-N 3.24Å; S174-S178 PolarHBondContact O-OG 3.11Å
175	E	90.4	Very high	87.7	Confident	59 Å²	59	63.5 Å²	63.5	28%	0.276	30%	0.299	S	S	.	.	H	α-helix	trans	-61.1	-38.2	-178	-69.9	-175.8	-149.1	0	0	112.5	R141 R156 R157 K179	R141-E175 IonicContact CZ-OE1 3.15Å; R141-E175 IonicContact CZ-OE2 3.89Å; R141-E175 IonicContact NE-OE1 3.13Å; R141-E175 PolarHBondContact NE-OE1 2.84Å; R141-E175 IonicContact NE-OE2 2.74Å; R141-E175 IonicContact NH2-OE1 3.58Å; R141-E175 PolarHBondContact NH2-OE1 3.31Å; R141-E175 IonicContact NH2-OE2 2.68Å; R141-E175 PolarHBondContact NH2-OE2 3.42Å; R156-E175 HydrophobicContact CG-CG 4.37Å; R157-E175 HydrophobicContact CB-CG 4.23Å; R157-E175 WeakPolarHBondContact CB-OE1 3.34Å; R157-E175 PolarHBondContact N-OE1 3.49Å; R157-E175 VanDerWaalsContact N-OE1 3.09Å; R157-E175 WeakPolarHBondContact O-CG 3.4Å; E175-K179 WeakPolarHBondContact O-CB 3.47Å; E175-K179 PolarHBondContact O-N 3.27Å
176	E	89.5	Confident	88.4	Confident	121 Å²	121	62.4 Å²	62.4	57%	0.565	29%	0.292	S	S	*	.	H	α-helix	trans	-67.9	-43.2	177.2	-167.1	-172.5	168.4	0	0	112.1	S174 K179 R180	S174-E176 VanDerWaalsContact C-N 3.3Å; S174-E176 PolarHBondContact O-N 3.07Å; E176-K179 PolarHBondContact O-N 2.74Å; E176-R180 WeakPolarHBondContact O-CG 3.41Å; E176-R180 PolarHBondContact O-N 3.18Å; E176-R180 VanDerWaalsContact O-N 3.16Å; E176-R180 IonicContact OE1-CZ 3.65Å; E176-R180 IonicContact OE1-NE 2.64Å; E176-R180 PolarHBondContact OE1-NE 3.27Å; E176-R180 IonicContact OE1-NH2 3.76Å; E176-R180 PolarHBondContact OE1-NH2 3.02Å
177	F	90.4	Very high	89	Confident	19 Å²	19	56.5 Å²	56.5	8%	0.083	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-45.5	177.8	-163.6	-78.4	0	0	0	110.5	Y173 S174 K179 R180 L181 F200 V206	Y173-F177 HydrophobicContact CD1-CB 4.48Å; Y173-F177 AromaticContact CD1-CD1 3.33Å; Y173-F177 HydrophobicContact CD1-CD1 3.33Å; Y173-F177 AromaticContact CD1-CE1 3.54Å; Y173-F177 HydrophobicContact CD1-CE1 3.54Å; Y173-F177 AromaticContact CD1-CG 3.92Å; Y173-F177 HydrophobicContact CD1-CG 3.92Å; Y173-F177 HydrophobicContact CD1-CZ 4.25Å; Y173-F177 HydrophobicContact CD2-CD1 4.31Å; Y173-F177 HydrophobicContact CD2-CE1 4.47Å; Y173-F177 AromaticContact CE1-CD1 3.6Å; Y173-F177 HydrophobicContact CE1-CD1 3.6Å; Y173-F177 AromaticContact CE1-CE1 3.23Å; Y173-F177 HydrophobicContact CE1-CE1 3.23Å; Y173-F177 HydrophobicContact CE1-CE2 4.48Å; Y173-F177 HydrophobicContact CE1-CG 4.37Å; Y173-F177 AromaticContact CE1-CZ 3.74Å; Y173-F177 HydrophobicContact CE1-CZ 3.74Å; Y173-F177 HydrophobicContact CE2-CE1 4.22Å; Y173-F177 AromaticContact CG-CD1 3.7Å; Y173-F177 HydrophobicContact CG-CD1 3.7Å; Y173-F177 HydrophobicContact CG-CE1 4.14Å; Y173-F177 HydrophobicContact CG-CG 4.46Å; Y173-F177 AromaticContact CZ-CE1 3.59Å; S174-F177 PolarHBondContact O-N 3.3Å; S174-F177 WeakPolarHBondContact OG-CB 3.4Å; S174-F177 PolarHBondContact OG-N 3.1Å; F177-K179 VanDerWaalsContact C-N 3.33Å; F177-K179 PolarHBondContact O-N 2.92Å; F177-R180 PolarHBondContact O-N 3.18Å; F177-L181 HydrophobicContact CD1-CD1 3.79Å; F177-L181 HydrophobicContact CD1-CG 3.92Å; F177-L181 HydrophobicContact CE1-CD1 3.74Å; F177-L181 HydrophobicContact CE1-CD2 4.22Å; F177-L181 HydrophobicContact CE1-CG 3.93Å; F177-L181 WeakPolarHBondContact O-CG 3.42Å; F177-L181 PolarHBondContact O-N 2.86Å; F177-F200 HydrophobicContact CD1-CE1 4.06Å; F177-F200 HydrophobicContact CD1-CZ 4.1Å; F177-F200 AromaticContact CD2-CD1 3.5Å; F177-F200 HydrophobicContact CD2-CD1 3.5Å; F177-F200 AromaticContact CD2-CE1 3.5Å; F177-F200 HydrophobicContact CD2-CE1 3.5Å; F177-F200 HydrophobicContact CD2-CG 4.14Å; F177-F200 HydrophobicContact CD2-CZ 4.15Å; F177-F200 HydrophobicContact CE1-CE1 4.07Å; F177-F200 HydrophobicContact CE1-CE2 4.13Å; F177-F200 AromaticContact CE1-CZ 3.74Å; F177-F200 HydrophobicContact CE1-CZ 3.74Å; F177-F200 HydrophobicContact CE2-CB 4.25Å; F177-F200 AromaticContact CE2-CD1 3.39Å; F177-F200 HydrophobicContact CE2-CD1 3.39Å; F177-F200 AromaticContact CE2-CD2 3.82Å; F177-F200 HydrophobicContact CE2-CD2 3.82Å; F177-F200 AromaticContact CE2-CE1 3.53Å; F177-F200 HydrophobicContact CE2-CE1 3.53Å; F177-F200 AromaticContact CE2-CE2 3.96Å; F177-F200 HydrophobicContact CE2-CE2 3.96Å; F177-F200 AromaticContact CE2-CG 3.55Å; F177-F200 HydrophobicContact CE2-CG 3.55Å; F177-F200 AromaticContact CE2-CZ 3.81Å; F177-F200 HydrophobicContact CE2-CZ 3.81Å; F177-F200 HydrophobicContact CG-CD1 4.25Å; F177-F200 AromaticContact CG-CE1 3.79Å; F177-F200 HydrophobicContact CG-CE1 3.79Å; F177-F200 HydrophobicContact CG-CZ 4.3Å; F177-F200 HydrophobicContact CZ-CD1 4.06Å; F177-F200 AromaticContact CZ-CD2 3.86Å; F177-F200 HydrophobicContact CZ-CD2 3.86Å; F177-F200 AromaticContact CZ-CE1 3.82Å; F177-F200 HydrophobicContact CZ-CE1 3.82Å; F177-F200 AromaticContact CZ-CE2 3.62Å; F177-F200 HydrophobicContact CZ-CE2 3.62Å; F177-F200 HydrophobicContact CZ-CG 4.08Å; F177-F200 AromaticContact CZ-CZ 3.59Å; F177-F200 HydrophobicContact CZ-CZ 3.59Å; F177-V206 HydrophobicContact CE1-CG2 4.13Å; F177-V206 HydrophobicContact CZ-CG2 3.93Å
178	S	92.2	Very high	89.5	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.007	25%	0.254	C	S	.	.	H	α-helix	trans	-59	-41	175.9	-58	0	0	0	0	112.2	Y173 S174 L181 E182	Y173-S178 WeakPolarHBondContact CB-OG 3.28Å; S174-S178 VanDerWaalsContact O-CB 3.31Å; S174-S178 WeakPolarHBondContact O-CB 3.47Å; S174-S178 PolarHBondContact O-N 3.24Å; S174-S178 PolarHBondContact O-OG 3.11Å; S178-L181 PolarHBondContact O-N 3.08Å; S178-E182 WeakPolarHBondContact O-CB 3.24Å; S178-E182 PolarHBondContact O-N 3.3Å
179	K	91.4	Very high	89.8	Confident	131 Å²	131	49.2 Å²	49.2	57%	0.57	23%	0.226	S	C	*	.	H	α-helix	trans	-62.4	-46.5	176.2	-179.3	178.5	173.2	-178.9	0	112.1	E175 E176 F177 L181 E182 E183	E175-K179 WeakPolarHBondContact O-CB 3.47Å; E175-K179 PolarHBondContact O-N 3.27Å; E176-K179 PolarHBondContact O-N 2.74Å; F177-K179 VanDerWaalsContact C-N 3.33Å; F177-K179 PolarHBondContact O-N 2.92Å; K179-L181 VanDerWaalsContact C-N 3.34Å; K179-L181 PolarHBondContact O-N 3.27Å; K179-E182 PolarHBondContact O-N 3.32Å; K179-E183 WeakPolarHBondContact CE-OE1 3.2Å; K179-E183 WeakPolarHBondContact O-CG 3.35Å; K179-E183 PolarHBondContact O-N 3.16Å
180	R	90.8	Very high	90	Very high	100 Å²	100	46.5 Å²	46.5	38%	0.377	23%	0.225	S	C	.	.	H	α-helix	trans	-65.2	-37.1	178.3	-65.9	176.1	-173.6	-145.8	7.6	112.1	E176 F177 A184 F200	E176-R180 WeakPolarHBondContact O-CG 3.41Å; E176-R180 PolarHBondContact O-N 3.18Å; E176-R180 VanDerWaalsContact O-N 3.16Å; E176-R180 IonicContact OE1-CZ 3.65Å; E176-R180 IonicContact OE1-NE 2.64Å; E176-R180 PolarHBondContact OE1-NE 3.27Å; E176-R180 IonicContact OE1-NH2 3.76Å; E176-R180 PolarHBondContact OE1-NH2 3.02Å; F177-R180 PolarHBondContact O-N 3.18Å; R180-A184 WeakPolarHBondContact O-CB 3.37Å; R180-A184 PolarHBondContact O-N 2.87Å; R180-F200 HydrophobicContact CB-CE1 3.99Å; R180-F200 HydrophobicContact CB-CZ 4.48Å
181	L	90.9	Very high	90	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-63	-45.5	171.6	-74.5	-175.4	0	0	0	111.9	W160 Y173 F177 S178 K179 A184 Y185 L198 F200 V206 V239	W160-L181 HydrophobicContact CB-CD1 4.02Å; W160-L181 HydrophobicContact CD2-CB 4.03Å; W160-L181 HydrophobicContact CD2-CD1 3.91Å; W160-L181 HydrophobicContact CE3-CD1 3.99Å; W160-L181 HydrophobicContact CG-CB 4.19Å; W160-L181 HydrophobicContact CG-CD1 3.95Å; W160-L181 HydrophobicContact CZ2-CB 4.41Å; Y173-L181 HydrophobicContact CD2-CD1 4.07Å; Y173-L181 HydrophobicContact CE2-CD1 3.98Å; F177-L181 HydrophobicContact CD1-CD1 3.79Å; F177-L181 HydrophobicContact CD1-CG 3.92Å; F177-L181 HydrophobicContact CE1-CD1 3.74Å; F177-L181 HydrophobicContact CE1-CD2 4.22Å; F177-L181 HydrophobicContact CE1-CG 3.93Å; F177-L181 WeakPolarHBondContact O-CG 3.42Å; F177-L181 PolarHBondContact O-N 2.86Å; S178-L181 PolarHBondContact O-N 3.08Å; K179-L181 VanDerWaalsContact C-N 3.34Å; K179-L181 PolarHBondContact O-N 3.27Å; L181-A184 PolarHBondContact O-N 2.92Å; L181-Y185 VanDerWaalsContact O-CB 3.29Å; L181-Y185 WeakPolarHBondContact O-CB 3.37Å; L181-Y185 PolarHBondContact O-N 2.83Å; L181-L198 HydrophobicContact CD2-CD1 3.87Å; L181-F200 HydrophobicContact CD2-CE2 4.38Å; L181-F200 HydrophobicContact CD2-CZ 3.91Å; L181-F200 HydrophobicContact CG-CZ 4.28Å; L181-V206 HydrophobicContact CD2-CB 4.02Å; L181-V206 HydrophobicContact CD2-CG1 3.77Å; L181-V206 HydrophobicContact CD2-CG2 4.1Å; L181-V239 HydrophobicContact CD1-CG1 4.38Å
182	E	92.4	Very high	89.9	Confident	22 Å²	22	52.1 Å²	52.1	10%	0.103	26%	0.259	C	S	.	.	H	α-helix	trans	-64.4	-45	-178.8	-168.5	58.2	-142	0	0	112	Y81 V84 W160 S178 K179 A184 Y185 M186 R241	Y81-E182 WeakPolarHBondContact CE2-OE1 3.21Å; Y81-E182 PolarHBondContact OH-OE1 3.17Å; V84-E182 WeakPolarHBondContact CG1-OE2 3.28Å; W160-E182 PolarHBondContact NE1-OE2 3.04Å; S178-E182 WeakPolarHBondContact O-CB 3.24Å; S178-E182 PolarHBondContact O-N 3.3Å; K179-E182 PolarHBondContact O-N 3.32Å; E182-A184 VanDerWaalsContact C-N 3.31Å; E182-A184 PolarHBondContact O-N 3.44Å; E182-Y185 PolarHBondContact O-N 2.83Å; E182-M186 WeakPolarHBondContact O-CB 3.47Å; E182-M186 PolarHBondContact O-N 3.33Å; E182-R241 IonicContact OE1-CZ 2.96Å; E182-R241 VanDerWaalsContact OE1-CZ 3.3Å; E182-R241 IonicContact OE1-NE 2.94Å; E182-R241 PolarHBondContact OE1-NE 2.86Å; E182-R241 VanDerWaalsContact OE1-NE 3.11Å; E182-R241 IonicContact OE1-NH2 3.58Å; E182-R241 PolarHBondContact OE1-NH2 2.87Å; E182-R241 IonicContact OE2-CZ 3.74Å; E182-R241 IonicContact OE2-NE 4Å; E182-R241 PolarHBondContact OE2-NE 2.75Å; E182-R241 IonicContact OE2-NH2 2.72Å
183	E	91.1	Very high	89.6	Confident	93 Å²	93	57.3 Å²	57.3	44%	0.435	28%	0.283	S	S	.	.	H	α-helix	trans	-57.2	-44.2	174.3	-73.7	172.8	-171.6	0	0	111.7	K179 I187	K179-E183 WeakPolarHBondContact CE-OE1 3.2Å; K179-E183 WeakPolarHBondContact O-CG 3.35Å; K179-E183 PolarHBondContact O-N 3.16Å; E183-I187 WeakPolarHBondContact O-CD1 3.42Å; E183-I187 VanDerWaalsContact O-CG1 3.28Å; E183-I187 WeakPolarHBondContact O-CG1 3.26Å; E183-I187 PolarHBondContact O-N 3.45Å
184	A	90.4	Very high	89.3	Confident	7 Å²	7	59.3 Å²	59.3	6%	0.058	29%	0.29	C	S	.	.	H	α-helix	trans	-70.8	-37.8	178.4	0	0	0	0	0	113.5	R180 L181 E182 I187 A188 L198 L208	R180-A184 WeakPolarHBondContact O-CB 3.37Å; R180-A184 PolarHBondContact O-N 2.87Å; L181-A184 PolarHBondContact O-N 2.92Å; E182-A184 VanDerWaalsContact C-N 3.31Å; E182-A184 PolarHBondContact O-N 3.44Å; A184-I187 PolarHBondContact O-N 2.98Å; A184-A188 WeakPolarHBondContact O-CB 3.39Å; A184-A188 PolarHBondContact O-N 3.44Å; A184-L198 HydrophobicContact CB-CD1 3.45Å; A184-L198 VanDerWaalsContact CB-CD1 3.45Å; A184-L198 HydrophobicContact CB-CD2 3.57Å; A184-L198 HydrophobicContact CB-CG 4.1Å; A184-L208 HydrophobicContact CB-CD1 3.95Å
185	Y	90.6	Very high	88.9	Confident	29 Å²	29	64.3 Å²	64.3	11%	0.114	31%	0.305	C	S	.	.	H	α-helix	trans	-66.1	-44.2	175.7	179.1	-94.4	0	0	0	111.3	Y81 W160 L181 E182 I187 A188 V189 W194 L208 I214	Y81-Y185 HydrophobicContact CD2-CD1 4.33Å; Y81-Y185 HydrophobicContact CD2-CE1 4.41Å; Y81-Y185 HydrophobicContact CE2-CD1 4.21Å; W160-Y185 AromaticContact CH2-CD2 3.68Å; W160-Y185 HydrophobicContact CH2-CD2 3.68Å; W160-Y185 HydrophobicContact CH2-CE2 4.3Å; W160-Y185 AromaticContact CH2-CG 3.87Å; W160-Y185 HydrophobicContact CH2-CG 3.87Å; W160-Y185 HydrophobicContact CZ2-CD1 4.32Å; W160-Y185 HydrophobicContact CZ2-CD2 4.1Å; W160-Y185 AromaticContact CZ2-CG 3.79Å; W160-Y185 HydrophobicContact CZ2-CG 3.79Å; L181-Y185 VanDerWaalsContact O-CB 3.29Å; L181-Y185 WeakPolarHBondContact O-CB 3.37Å; L181-Y185 PolarHBondContact O-N 2.83Å; E182-Y185 PolarHBondContact O-N 2.83Å; Y185-I187 VanDerWaalsContact C-N 3.33Å; Y185-I187 PolarHBondContact O-N 2.69Å; Y185-A188 PolarHBondContact O-N 3Å; Y185-V189 HydrophobicContact CD1-CG2 4.12Å; Y185-V189 HydrophobicContact CD2-CG2 4.48Å; Y185-V189 HydrophobicContact CE1-CG2 3.71Å; Y185-V189 HydrophobicContact CE2-CG2 4.13Å; Y185-V189 HydrophobicContact CG-CG2 4.49Å; Y185-V189 WeakPolarHBondContact O-CG2 3.39Å; Y185-V189 PolarHBondContact O-N 3.37Å; Y185-W194 HydrophobicContact CE2-CH2 4.2Å; Y185-W194 HydrophobicContact CE2-CZ3 4.49Å; Y185-L208 HydrophobicContact CD2-CD2 4.01Å; Y185-I214 HydrophobicContact CD2-CD1 4.16Å; Y185-I214 HydrophobicContact CE2-CD1 4.23Å
186	M	89.7	Confident	88.2	Confident	73 Å²	73	66.7 Å²	66.7	36%	0.36	31%	0.311	S	S	.	.	H	α-helix	trans	-55.9	-46.8	173.5	-178.7	-172.4	66.8	0	0	111.2	Y81 E182 V189 T190	Y81-M186 HydrophobicContact CD1-CG 3.94Å; Y81-M186 HydrophobicContact CD2-CB 3.94Å; Y81-M186 HydrophobicContact CD2-CG 3.99Å; Y81-M186 HydrophobicContact CE1-CB 4.42Å; Y81-M186 HydrophobicContact CE1-CG 3.85Å; Y81-M186 HydrophobicContact CE1-SD 4.1Å; Y81-M186 HydrophobicContact CE2-CB 3.6Å; Y81-M186 HydrophobicContact CE2-CG 3.88Å; Y81-M186 HydrophobicContact CG-CB 4.48Å; Y81-M186 HydrophobicContact CG-CG 4.01Å; E182-M186 WeakPolarHBondContact O-CB 3.47Å; E182-M186 PolarHBondContact O-N 3.33Å; M186-V189 PolarHBondContact O-N 3.41Å; M186-T190 HydrophobicContact CG-CG2 4.43Å; M186-T190 WeakPolarHBondContact O-CB 3.23Å; M186-T190 VanDerWaalsContact O-CG2 3.28Å; M186-T190 WeakPolarHBondContact O-CG2 3.38Å; M186-T190 PolarHBondContact O-N 3.16Å; M186-T190 PolarHBondContact O-OG1 3.23Å
187	I	89	Confident	88	Confident	56 Å²	56	66.4 Å²	66.4	29%	0.287	31%	0.308	S	S	.	.	H	α-helix	trans	-63.7	-44.2	176.7	-65	163.8	0	0	0	111	E183 A184 Y185 V189 T190 L191	E183-I187 WeakPolarHBondContact O-CD1 3.42Å; E183-I187 VanDerWaalsContact O-CG1 3.28Å; E183-I187 WeakPolarHBondContact O-CG1 3.26Å; E183-I187 PolarHBondContact O-N 3.45Å; A184-I187 PolarHBondContact O-N 2.98Å; Y185-I187 VanDerWaalsContact C-N 3.33Å; Y185-I187 PolarHBondContact O-N 2.69Å; I187-V189 PolarHBondContact O-N 3.41Å; I187-T190 PolarHBondContact O-N 3.18Å; I187-T190 PolarHBondContact O-OG1 3.38Å; I187-L191 HydrophobicContact CG2-CD1 3.74Å; I187-L191 HydrophobicContact CG2-CG 4.29Å; I187-L191 WeakPolarHBondContact O-CB 3.49Å; I187-L191 PolarHBondContact O-N 3.46Å
188	A	88.8	Confident	87.7	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.4	-41.1	179.2	0	0	0	0	0	112.7	A184 Y185 D192 E193 W194	A184-A188 WeakPolarHBondContact O-CB 3.39Å; A184-A188 PolarHBondContact O-N 3.44Å; Y185-A188 PolarHBondContact O-N 3Å; A188-D192 CarbonylContact O-C 3.44Å; A188-D192 WeakPolarHBondContact O-CA 3.5Å; A188-D192 PolarHBondContact O-N 3.42Å; A188-E193 PolarHBondContact O-N 3.3Å; A188-E193 VanDerWaalsContact O-N 3.13Å; A188-W194 HydrophobicContact CB-CD2 4.45Å; A188-W194 HydrophobicContact CB-CE3 4.1Å; A188-W194 HydrophobicContact CB-CH2 4.33Å; A188-W194 HydrophobicContact CB-CZ3 4.05Å
189	V	87.8	Confident	87.4	Confident	21 Å²	21	71.3 Å²	71.3	13%	0.127	34%	0.335	C	S	.	.	H	α-helix	trans	-72.3	-40.8	177.1	174	0	0	0	0	111.9	Y185 M186 I187 W194	Y185-V189 HydrophobicContact CD1-CG2 4.12Å; Y185-V189 HydrophobicContact CD2-CG2 4.48Å; Y185-V189 HydrophobicContact CE1-CG2 3.71Å; Y185-V189 HydrophobicContact CE2-CG2 4.13Å; Y185-V189 HydrophobicContact CG-CG2 4.49Å; Y185-V189 WeakPolarHBondContact O-CG2 3.39Å; Y185-V189 PolarHBondContact O-N 3.37Å; M186-V189 PolarHBondContact O-N 3.41Å; I187-V189 PolarHBondContact O-N 3.41Å; V189-W194 HydrophobicContact CG2-CH2 3.62Å; V189-W194 HydrophobicContact CG2-CZ2 3.84Å
190	T	87.4	Confident	86.9	Confident	86 Å²	86	66 Å²	66	53%	0.528	31%	0.312	S	S	.	.	H	α-helix	trans	-77.4	-27.3	-175.6	52.5	0	0	0	0	114.1	M186 I187	M186-T190 HydrophobicContact CG-CG2 4.43Å; M186-T190 WeakPolarHBondContact O-CB 3.23Å; M186-T190 VanDerWaalsContact O-CG2 3.28Å; M186-T190 WeakPolarHBondContact O-CG2 3.38Å; M186-T190 PolarHBondContact O-N 3.16Å; M186-T190 PolarHBondContact O-OG1 3.23Å; I187-T190 PolarHBondContact O-N 3.18Å; I187-T190 PolarHBondContact O-OG1 3.38Å
191	L	86.6	Confident	86.2	Confident	105 Å²	105	66.6 Å²	66.6	55%	0.55	33%	0.329	S	S	.	.	H	α-helix	trans	-103	-4.8	176.3	-56	-176.1	0	0	0	113.8	I187 E193	I187-L191 HydrophobicContact CG2-CD1 3.74Å; I187-L191 HydrophobicContact CG2-CG 4.29Å; I187-L191 WeakPolarHBondContact O-CB 3.49Å; I187-L191 PolarHBondContact O-N 3.46Å; L191-E193 HydrophobicContact CB-CB 4.26Å; L191-E193 HydrophobicContact CB-CG 3.9Å; L191-E193 PolarHBondContact O-N 3.41Å
192	D	84.3	Confident	85.4	Confident	101 Å²	101	70.7 Å²	70.7	54%	0.54	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	26.2	-168.4	-156.5	36.2	0	0	0	114	A188 W194	A188-D192 CarbonylContact O-C 3.44Å; A188-D192 WeakPolarHBondContact O-CA 3.5Å; A188-D192 PolarHBondContact O-N 3.42Å; D192-W194 PolarHBondContact O-N 2.88Å; D192-W194 PolarHBondContact OD1-NE1 3.26Å
193	E	85.5	Confident	84.7	Confident	111 Å²	111	72 Å²	72	52%	0.519	37%	0.374	S	S	.	.			trans	-91.5	82.2	-177.8	-73.3	-168.2	163.4	0	0	112.3	A188 L191	A188-E193 PolarHBondContact O-N 3.3Å; A188-E193 VanDerWaalsContact O-N 3.13Å; L191-E193 HydrophobicContact CB-CB 4.26Å; L191-E193 HydrophobicContact CB-CG 3.9Å; L191-E193 PolarHBondContact O-N 3.41Å
194	W	85.9	Confident	84.3	Confident	54 Å²	54	69.4 Å²	69.4	21%	0.205	36%	0.362	C	S	.	.			trans	-86.4	172.2	177.3	-58.8	96.9	0	0	0	114.1	Y185 A188 V189 D192 R196 L208 H209 N210 P211	Y185-W194 HydrophobicContact CE2-CH2 4.2Å; Y185-W194 HydrophobicContact CE2-CZ3 4.49Å; A188-W194 HydrophobicContact CB-CD2 4.45Å; A188-W194 HydrophobicContact CB-CE3 4.1Å; A188-W194 HydrophobicContact CB-CH2 4.33Å; A188-W194 HydrophobicContact CB-CZ3 4.05Å; V189-W194 HydrophobicContact CG2-CH2 3.62Å; V189-W194 HydrophobicContact CG2-CZ2 3.84Å; D192-W194 PolarHBondContact O-N 2.88Å; D192-W194 PolarHBondContact OD1-NE1 3.26Å; W194-R196 VanDerWaalsContact C-N 3.27Å; W194-R196 PolarHBondContact O-N 2.77Å; W194-L208 HydrophobicContact CE3-CB 4.4Å; W194-H209 WeakPolarHBondContact CB-O 3.31Å; W194-N210 VanDerWaalsContact CE3-CA 3.47Å; W194-P211 HydrophobicContact CH2-CB 4.44Å; W194-P211 HydrophobicContact CH2-CG 3.57Å; W194-P211 HydrophobicContact CZ2-CG 3.72Å; W194-P211 HydrophobicContact CZ3-CG 4.43Å
195	K	81.8	Confident	84.1	Confident	161 Å²	161	70 Å²	70	70%	0.7	37%	0.365	S	S	*	.	S	Bend	trans	67.8	20.6	-175.6	-51.3	168.3	-175	167.7	0	114.1	L208	K195-L208 VanDerWaalsContact CA-O 3.32Å; K195-L208 WeakPolarHBondContact CA-O 3.38Å; K195-L208 PolarHBondContact N-O 2.92Å
196	R	76.4	Confident	84.1	Confident	108 Å²	108	68.6 Å²	68.6	41%	0.408	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	130.5	174.3	-167.3	170.6	-175.5	148.8	-3.2	110.4	W194 L198 L208	W194-R196 VanDerWaalsContact C-N 3.27Å; W194-R196 PolarHBondContact O-N 2.77Å; R196-L198 HydrophobicContact CG-CD2 4.5Å; R196-L208 PolarHBondContact O-N 2.69Å
197	K	83.6	Confident	84	Confident	115 Å²	115	66.7 Å²	66.7	50%	0.5	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.2	171.8	-166.9	-175	-173.1	-113.8	0	109	D199 T205 I207	K197-D199 VanDerWaalsContact CE-OD1 3.23Å; K197-D199 WeakPolarHBondContact CE-OD1 3.49Å; K197-D199 IonicContact NZ-OD1 3.69Å; K197-D199 PolarHBondContact NZ-OD1 3.36Å; K197-D199 IonicContact NZ-OD2 3.5Å; K197-D199 PolarHBondContact NZ-OD2 2.66Å; K197-T205 HydrophobicContact CD-CG2 4.19Å; K197-T205 VanDerWaalsContact CE-CG2 3.49Å; K197-T205 VanDerWaalsContact CE-OG1 3.31Å; K197-T205 WeakPolarHBondContact CE-OG1 3.28Å; K197-T205 HydrophobicContact CG-CG2 3.64Å; K197-T205 PolarHBondContact NZ-OG1 3.47Å; K197-I207 HydrophobicContact CG-CG1 4.47Å
198	L	85.1	Confident	84.1	Confident	26 Å²	26	64 Å²	64	14%	0.136	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	116.6	173	-58.7	175.6	0	0	0	108.1	L181 A184 R196 F200 T205 V206 L208	L181-L198 HydrophobicContact CD2-CD1 3.87Å; A184-L198 HydrophobicContact CB-CD1 3.45Å; A184-L198 VanDerWaalsContact CB-CD1 3.45Å; A184-L198 HydrophobicContact CB-CD2 3.57Å; A184-L198 HydrophobicContact CB-CG 4.1Å; R196-L198 HydrophobicContact CG-CD2 4.5Å; L198-F200 HydrophobicContact CB-CE2 3.88Å; L198-T205 CarbonylContact O-C 3.45Å; L198-T205 VanDerWaalsContact O-CA 3.29Å; L198-T205 WeakPolarHBondContact O-CA 3.38Å; L198-V206 HydrophobicContact CB-CB 4.39Å; L198-V206 PolarHBondContact N-O 3.09Å; L198-V206 PolarHBondContact O-N 2.72Å; L198-L208 HydrophobicContact CD1-CD1 3.85Å; L198-L208 HydrophobicContact CG-CD1 4.37Å
199	D	84.9	Confident	83.9	Confident	98 Å²	98	67.1 Å²	67.1	52%	0.524	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.7	177.5	-69.2	-32.3	0	0	0	109.7	K197 T205	K197-D199 VanDerWaalsContact CE-OD1 3.23Å; K197-D199 WeakPolarHBondContact CE-OD1 3.49Å; K197-D199 IonicContact NZ-OD1 3.69Å; K197-D199 PolarHBondContact NZ-OD1 3.36Å; K197-D199 IonicContact NZ-OD2 3.5Å; K197-D199 PolarHBondContact NZ-OD2 2.66Å; D199-T205 PolarHBondContact OD1-OG1 2.8Å
200	F	82.4	Confident	83.8	Confident	19 Å²	19	69.1 Å²	69.1	8%	0.083	36%	0.361	C	S	.	.			trans	-98.8	154.6	-177.6	-69.9	-97.7	0	0	0	111.1	F177 R180 L181 L198 T202 G203 E204 V206	F177-F200 HydrophobicContact CD1-CE1 4.06Å; F177-F200 HydrophobicContact CD1-CZ 4.1Å; F177-F200 AromaticContact CD2-CD1 3.5Å; F177-F200 HydrophobicContact CD2-CD1 3.5Å; F177-F200 AromaticContact CD2-CE1 3.5Å; F177-F200 HydrophobicContact CD2-CE1 3.5Å; F177-F200 HydrophobicContact CD2-CG 4.14Å; F177-F200 HydrophobicContact CD2-CZ 4.15Å; F177-F200 HydrophobicContact CE1-CE1 4.07Å; F177-F200 HydrophobicContact CE1-CE2 4.13Å; F177-F200 AromaticContact CE1-CZ 3.74Å; F177-F200 HydrophobicContact CE1-CZ 3.74Å; F177-F200 HydrophobicContact CE2-CB 4.25Å; F177-F200 AromaticContact CE2-CD1 3.39Å; F177-F200 HydrophobicContact CE2-CD1 3.39Å; F177-F200 AromaticContact CE2-CD2 3.82Å; F177-F200 HydrophobicContact CE2-CD2 3.82Å; F177-F200 AromaticContact CE2-CE1 3.53Å; F177-F200 HydrophobicContact CE2-CE1 3.53Å; F177-F200 AromaticContact CE2-CE2 3.96Å; F177-F200 HydrophobicContact CE2-CE2 3.96Å; F177-F200 AromaticContact CE2-CG 3.55Å; F177-F200 HydrophobicContact CE2-CG 3.55Å; F177-F200 AromaticContact CE2-CZ 3.81Å; F177-F200 HydrophobicContact CE2-CZ 3.81Å; F177-F200 HydrophobicContact CG-CD1 4.25Å; F177-F200 AromaticContact CG-CE1 3.79Å; F177-F200 HydrophobicContact CG-CE1 3.79Å; F177-F200 HydrophobicContact CG-CZ 4.3Å; F177-F200 HydrophobicContact CZ-CD1 4.06Å; F177-F200 AromaticContact CZ-CD2 3.86Å; F177-F200 HydrophobicContact CZ-CD2 3.86Å; F177-F200 AromaticContact CZ-CE1 3.82Å; F177-F200 HydrophobicContact CZ-CE1 3.82Å; F177-F200 AromaticContact CZ-CE2 3.62Å; F177-F200 HydrophobicContact CZ-CE2 3.62Å; F177-F200 HydrophobicContact CZ-CG 4.08Å; F177-F200 AromaticContact CZ-CZ 3.59Å; F177-F200 HydrophobicContact CZ-CZ 3.59Å; R180-F200 HydrophobicContact CB-CE1 3.99Å; R180-F200 HydrophobicContact CB-CZ 4.48Å; L181-F200 HydrophobicContact CD2-CE2 4.38Å; L181-F200 HydrophobicContact CD2-CZ 3.91Å; L181-F200 HydrophobicContact CG-CZ 4.28Å; L198-F200 HydrophobicContact CB-CE2 3.88Å; F200-T202 PolarHBondContact O-N 3.32Å; F200-G203 PolarHBondContact O-N 3.14Å; F200-E204 HydrophobicContact CB-CB 4.18Å; F200-E204 PolarHBondContact N-O 3.39Å; F200-V206 HydrophobicContact CD2-CG2 4.42Å; F200-V206 HydrophobicContact CE2-CB 4.08Å; F200-V206 HydrophobicContact CE2-CG2 3.73Å
201	P	76.2	Confident	83.5	Confident	112 Å²	112	68.2 Å²	68.2	73%	0.727	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-20.9	-178.5	-24	34.8	0	0	0	114.5	G203	P201-G203 PolarHBondContact O-N 3.17Å
202	T	74	Confident	83.3	Confident	88 Å²	88	71.6 Å²	71.6	54%	0.54	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-8	175.4	43.8	0	0	0	0	114	F200 E204 P219	F200-T202 PolarHBondContact O-N 3.32Å; T202-E204 VanDerWaalsContact C-N 3.31Å; T202-E204 WeakPolarHBondContact CB-OE2 3.15Å; T202-E204 PolarHBondContact OG1-OE2 2.86Å; T202-P219 VanDerWaalsContact O-CG 3.29Å; T202-P219 WeakPolarHBondContact O-CG 3.35Å
203	G	76.6	Confident	83.3	Confident	50 Å²	50	70.8 Å²	70.8	52%	0.515	36%	0.362	S	S	.	.	S	Bend	trans	85.2	4.4	-172.4	0	0	0	0	0	114	F200 P201	F200-G203 PolarHBondContact O-N 3.14Å; P201-G203 PolarHBondContact O-N 3.17Å
204	E	83.7	Confident	83.4	Confident	37 Å²	37	65.6 Å²	65.6	17%	0.173	34%	0.338	C	S	.	.			trans	-77.2	145.7	175.2	-74.3	168.1	138.1	0	0	111.7	F200 T202 H216 P219	F200-E204 HydrophobicContact CB-CB 4.18Å; F200-E204 PolarHBondContact N-O 3.39Å; T202-E204 VanDerWaalsContact C-N 3.31Å; T202-E204 WeakPolarHBondContact CB-OE2 3.15Å; T202-E204 PolarHBondContact OG1-OE2 2.86Å; E204-H216 WeakPolarHBondContact CB-NE2 3.31Å; E204-H216 WeakPolarHBondContact CG-NE2 3.37Å; E204-H216 IonicContact OE1-CE1 3.78Å; E204-H216 PolarHBondContact OE1-CE1 2.8Å; E204-H216 VanDerWaalsContact OE1-CE1 3.3Å; E204-H216 IonicContact OE1-NE2 3.84Å; E204-H216 PolarHBondContact OE1-NE2 3.38Å; E204-P219 HydrophobicContact CG-CG 3.8Å
205	T	86.5	Confident	83.5	Confident	20 Å²	20	64.3 Å²	64.3	12%	0.123	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	128.4	176.2	-76.5	0	0	0	0	110.2	K197 L198 D199 I207 H216 Y217	K197-T205 HydrophobicContact CD-CG2 4.19Å; K197-T205 VanDerWaalsContact CE-CG2 3.49Å; K197-T205 VanDerWaalsContact CE-OG1 3.31Å; K197-T205 WeakPolarHBondContact CE-OG1 3.28Å; K197-T205 HydrophobicContact CG-CG2 3.64Å; K197-T205 PolarHBondContact NZ-OG1 3.47Å; L198-T205 CarbonylContact O-C 3.45Å; L198-T205 VanDerWaalsContact O-CA 3.29Å; L198-T205 WeakPolarHBondContact O-CA 3.38Å; D199-T205 PolarHBondContact OD1-OG1 2.8Å; T205-I207 HydrophobicContact CG2-CD1 4.26Å; T205-I207 HydrophobicContact CG2-CG1 3.83Å; T205-H216 PolarHBondContact O-CD2 3.48Å; T205-Y217 HydrophobicContact CG2-CD2 4.2Å; T205-Y217 PolarHBondContact N-O 2.83Å; T205-Y217 PolarHBondContact O-N 2.9Å
206	V	89.5	Confident	83.8	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	136.5	167.2	-178.1	0	0	0	0	110.5	F177 L181 L198 F200 I214 M215 H216	F177-V206 HydrophobicContact CE1-CG2 4.13Å; F177-V206 HydrophobicContact CZ-CG2 3.93Å; L181-V206 HydrophobicContact CD2-CB 4.02Å; L181-V206 HydrophobicContact CD2-CG1 3.77Å; L181-V206 HydrophobicContact CD2-CG2 4.1Å; L198-V206 HydrophobicContact CB-CB 4.39Å; L198-V206 PolarHBondContact N-O 3.09Å; L198-V206 PolarHBondContact O-N 2.72Å; F200-V206 HydrophobicContact CD2-CG2 4.42Å; F200-V206 HydrophobicContact CE2-CB 4.08Å; F200-V206 HydrophobicContact CE2-CG2 3.73Å; V206-I214 HydrophobicContact CG1-CG2 3.78Å; V206-M215 CarbonylContact C-O 3.59Å; V206-M215 WeakPolarHBondContact CA-O 3.33Å; V206-H216 HydrophobicContact CG2-CB 3.97Å
207	I	88.8	Confident	84.1	Confident	32 Å²	32	55.9 Å²	55.9	16%	0.164	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	120.8	178	-50.4	-177	0	0	0	110	K197 T205 H209 M215 Y217	K197-I207 HydrophobicContact CG-CG1 4.47Å; T205-I207 HydrophobicContact CG2-CD1 4.26Å; T205-I207 HydrophobicContact CG2-CG1 3.83Å; I207-H209 WeakPolarHBondContact CG2-NE2 3.18Å; I207-M215 PolarHBondContact N-O 3.4Å; I207-M215 PolarHBondContact O-N 2.98Å; I207-Y217 HydrophobicContact CD1-CD2 4.3Å; I207-Y217 HydrophobicContact CD1-CE2 3.71Å; I207-Y217 HydrophobicContact CG1-CD2 4.33Å; I207-Y217 HydrophobicContact CG1-CE2 3.97Å
208	L	89.4	Confident	83.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	94.4	178.9	-70.3	152.8	0	0	0	109.6	A184 Y185 W194 K195 R196 L198 I214	A184-L208 HydrophobicContact CB-CD1 3.95Å; Y185-L208 HydrophobicContact CD2-CD2 4.01Å; W194-L208 HydrophobicContact CE3-CB 4.4Å; K195-L208 VanDerWaalsContact CA-O 3.32Å; K195-L208 WeakPolarHBondContact CA-O 3.38Å; K195-L208 PolarHBondContact N-O 2.92Å; R196-L208 PolarHBondContact O-N 2.69Å; L198-L208 HydrophobicContact CD1-CD1 3.85Å; L198-L208 HydrophobicContact CG-CD1 4.37Å; L208-I214 HydrophobicContact CD2-CD1 3.75Å; L208-I214 HydrophobicContact CD2-CG1 4Å; L208-I214 HydrophobicContact CD2-CG2 3.92Å; L208-I214 HydrophobicContact CG-CG2 4.42Å
209	H	86.3	Confident	83	Confident	66 Å²	66	56.1 Å²	56.1	31%	0.306	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-39.3	-178	-73.5	-77.2	0	0	0	113.8	W194 I207 L213	W194-H209 WeakPolarHBondContact CB-O 3.31Å; I207-H209 WeakPolarHBondContact CG2-NE2 3.18Å; H209-L213 HydrophobicContact CB-CB 4.41Å; H209-L213 HydrophobicContact CB-CD2 4.03Å; H209-L213 HydrophobicContact CB-CG 4.21Å; H209-L213 WeakPolarHBondContact CB-O 3.45Å; H209-L213 PolarHBondContact N-O 2.88Å; H209-L213 VanDerWaalsContact N-O 3.11Å
210	N	84.4	Confident	81.7	Confident	63 Å²	63	60 Å²	60	34%	0.337	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	175.8	172.7	65.4	53.3	0	0	0	108.4	W194 K212 L213	W194-N210 VanDerWaalsContact CE3-CA 3.47Å; N210-K212 PolarHBondContact O-N 3.28Å; N210-K212 VanDerWaalsContact O-N 3.08Å; N210-K212 WeakPolarHBondContact OD1-CA 3.29Å; N210-K212 PolarHBondContact OD1-N 2.87Å; N210-L213 PolarHBondContact N-O 3.27Å; N210-L213 CarbonylContact O-C 3.54Å; N210-L213 PolarHBondContact O-N 2.95Å; N210-L213 PolarHBondContact OD1-N 2.8Å
211	P	81.6	Confident	80.2	Confident	67 Å²	67	62 Å²	62	44%	0.435	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-22.5	-178.4	-27.2	35.4	0	0	0	116.2	W194	W194-P211 HydrophobicContact CH2-CB 4.44Å; W194-P211 HydrophobicContact CH2-CG 3.57Å; W194-P211 HydrophobicContact CZ2-CG 3.72Å; W194-P211 HydrophobicContact CZ3-CG 4.43Å
212	K	82.2	Confident	78.7	Confident	176 Å²	176	65.4 Å²	65.4	77%	0.765	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-21.3	-177.3	-63.2	-177.3	179.1	179.1	0	113.4	N210 K240	N210-K212 PolarHBondContact O-N 3.28Å; N210-K212 VanDerWaalsContact O-N 3.08Å; N210-K212 WeakPolarHBondContact OD1-CA 3.29Å; N210-K212 PolarHBondContact OD1-N 2.87Å; K212-K240 PolarHBondContact O-NZ 3.48Å
213	L	84.1	Confident	77.2	Confident	83 Å²	83	67 Å²	67	44%	0.435	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	100.4	-173.6	-175.9	68.3	0	0	0	110.6	H209 N210 M215	H209-L213 HydrophobicContact CB-CB 4.41Å; H209-L213 HydrophobicContact CB-CD2 4.03Å; H209-L213 HydrophobicContact CB-CG 4.21Å; H209-L213 WeakPolarHBondContact CB-O 3.45Å; H209-L213 PolarHBondContact N-O 2.88Å; H209-L213 VanDerWaalsContact N-O 3.11Å; N210-L213 PolarHBondContact N-O 3.27Å; N210-L213 CarbonylContact O-C 3.54Å; N210-L213 PolarHBondContact O-N 2.95Å; N210-L213 PolarHBondContact OD1-N 2.8Å; L213-M215 HydrophobicContact CD1-CG 4.29Å; L213-M215 HydrophobicContact CD1-SD 3.63Å; L213-M215 HydrophobicContact CG-SD 4.41Å
214	I	88.7	Confident	75.4	Confident	3 Å²	3	71.9 Å²	71.9	2%	0.015	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	126.5	178.2	-54.4	172.2	0	0	0	106.7	W160 Y185 V206 L208 V239	W160-I214 HydrophobicContact CH2-CD1 3.68Å; W160-I214 HydrophobicContact CZ3-CD1 3.57Å; Y185-I214 HydrophobicContact CD2-CD1 4.16Å; Y185-I214 HydrophobicContact CE2-CD1 4.23Å; V206-I214 HydrophobicContact CG1-CG2 3.78Å; L208-I214 HydrophobicContact CD2-CD1 3.75Å; L208-I214 HydrophobicContact CD2-CG1 4Å; L208-I214 HydrophobicContact CD2-CG2 3.92Å; L208-I214 HydrophobicContact CG-CG2 4.42Å; I214-V239 HydrophobicContact CB-CB 3.99Å; I214-V239 HydrophobicContact CB-CG1 4.35Å; I214-V239 HydrophobicContact CG2-CB 3.82Å; I214-V239 HydrophobicContact CG2-CG1 3.94Å; I214-V239 HydrophobicContact CG2-CG2 4.47Å; I214-V239 PolarHBondContact O-N 3.29Å
215	M	86.8	Confident	73.3	Confident	26 Å²	26	79.4 Å²	79.4	13%	0.128	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.2	-168.4	-57.1	-51.9	-58.8	0	0	110.8	V206 I207 L213 Y217 P236	V206-M215 CarbonylContact C-O 3.59Å; V206-M215 WeakPolarHBondContact CA-O 3.33Å; I207-M215 PolarHBondContact N-O 3.4Å; I207-M215 PolarHBondContact O-N 2.98Å; L213-M215 HydrophobicContact CD1-CG 4.29Å; L213-M215 HydrophobicContact CD1-SD 3.63Å; L213-M215 HydrophobicContact CG-SD 4.41Å; M215-Y217 HydrophobicContact CB-CE2 3.93Å; M215-P236 HydrophobicContact CB-CB 4.23Å; M215-P236 HydrophobicContact CE-CB 3.72Å; M215-P236 HydrophobicContact CE-CG 3.7Å; M215-P236 WeakPolarHBondContact CE-O 3.49Å
216	H	87.6	Confident	71.6	Confident	3 Å²	3	90.8 Å²	90.8	1%	0.014	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	125.8	176.6	176.5	-147	0	0	0	110.8	Y173 E204 T205 V206 P236 C237 V239	Y173-H216 AromaticContact CZ-ND1 3.93Å; Y173-H216 WeakPolarHBondContact OH-CB 3.06Å; Y173-H216 VanDerWaalsContact OH-CG 3.23Å; Y173-H216 PolarHBondContact OH-ND1 3.26Å; E204-H216 WeakPolarHBondContact CB-NE2 3.31Å; E204-H216 WeakPolarHBondContact CG-NE2 3.37Å; E204-H216 IonicContact OE1-CE1 3.78Å; E204-H216 PolarHBondContact OE1-CE1 2.8Å; E204-H216 VanDerWaalsContact OE1-CE1 3.3Å; E204-H216 IonicContact OE1-NE2 3.84Å; E204-H216 PolarHBondContact OE1-NE2 3.38Å; T205-H216 PolarHBondContact O-CD2 3.48Å; V206-H216 HydrophobicContact CG2-CB 3.97Å; H216-P236 CarbonylContact O-C 3.6Å; H216-P236 VanDerWaalsContact O-CA 3.27Å; H216-P236 WeakPolarHBondContact O-CA 3.37Å; H216-C237 HydrophobicContact CB-CB 4.16Å; H216-C237 PolarHBondContact N-O 3.14Å; H216-C237 PolarHBondContact O-N 3.05Å; H216-V239 HydrophobicContact CB-CG2 3.62Å
217	Y	84.5	Confident	69.4	Low	90 Å²	90	95.2 Å²	95.2	35%	0.353	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	116.7	177	-60.5	-98.3	0	0	0	108.6	T205 I207 M215 P236	T205-Y217 HydrophobicContact CG2-CD2 4.2Å; T205-Y217 PolarHBondContact N-O 2.83Å; T205-Y217 PolarHBondContact O-N 2.9Å; I207-Y217 HydrophobicContact CD1-CD2 4.3Å; I207-Y217 HydrophobicContact CD1-CE2 3.71Å; I207-Y217 HydrophobicContact CG1-CD2 4.33Å; I207-Y217 HydrophobicContact CG1-CE2 3.97Å; M215-Y217 HydrophobicContact CB-CE2 3.93Å; Y217-P236 HydrophobicContact CD1-CB 3.86Å; Y217-P236 HydrophobicContact CD1-CG 4.47Å; Y217-P236 HydrophobicContact CD2-CB 4.4Å; Y217-P236 HydrophobicContact CE1-CB 3.64Å; Y217-P236 HydrophobicContact CE1-CG 3.85Å; Y217-P236 HydrophobicContact CE2-CB 4.19Å; Y217-P236 HydrophobicContact CG-CB 4.24Å
218	Q	76.8	Confident	66.9	Low	86 Å²	86	96.7 Å²	96.7	40%	0.402	50%	0.504	S	S	.	.			trans	-73.4	160.7	175.6	-75.5	179.6	-32.5	0	0	111.7
219	P	68.6	Low	64.5	Low	59 Å²	59	100.5 Å²	100.5	38%	0.383	53%	0.53	S	S	.	.			trans	-70.9	137.3	-178.2	-10.5	27.7	0	0	0	110.6	T202 E204 G221	T202-P219 VanDerWaalsContact O-CG 3.29Å; T202-P219 WeakPolarHBondContact O-CG 3.35Å; E204-P219 HydrophobicContact CG-CG 3.8Å; P219-G221 PolarHBondContact O-N 2.85Å
220	I	57.3	Low	62.5	Low	179 Å²	179	103.6 Å²	103.6	92%	0.918	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	30.9	-176.9	-52.1	166.1	0	0	0	111.1
221	G	51.3	Low	60.6	Low	62 Å²	62	105.5 Å²	105.5	64%	0.639	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.6	-0.3	-158.1	0	0	0	0	0	118.2	P219	P219-G221 PolarHBondContact O-N 2.85Å
222	L	43.3	Very low	59	Low	183 Å²	183	106.3 Å²	106.3	96%	0.958	58%	0.575	S	S	*	*			trans	-136.2	53.2	179.7	-75.3	172.7	0	0	0	112
223	Q	43.6	Very low	57.5	Low	123 Å²	123	106 Å²	106	58%	0.575	58%	0.576	S	S	*	*	S	Bend	trans	-118.1	130.8	162.7	-148	179.3	38.9	0	0	107	E225 S228	Q223-E225 PolarHBondContact O-N 3.02Å; Q223-S228 PolarHBondContact OE1-OG 2.87Å
224	D	37.4	Very low	56.3	Low	151 Å²	151	105.1 Å²	105.1	81%	0.807	58%	0.577	S	S	*	*			trans	-52.5	130.1	-176.6	-78.9	-51.3	0	0	0	111.4	W226	D224-W226 PolarHBondContact O-N 2.81Å
225	E	40.2	Very low	55.4	Low	196 Å²	196	112.9 Å²	112.9	92%	0.916	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	14.4	-161.9	-142.9	180	164.5	0	0	114.9	Q223	Q223-E225 PolarHBondContact O-N 3.02Å
226	W	50.5	Low	55.1	Low	258 Å²	258	113.7 Å²	113.7	98%	0.977	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.2	11.1	-173	-103	-34.1	0	0	0	117.6	D224	D224-W226 PolarHBondContact O-N 2.81Å
227	A	44.1	Very low	55	Low	93 Å²	93	114 Å²	114	77%	0.769	62%	0.616	S	S	*	*	S	Bend	trans	-151	49.5	178.8	0	0	0	0	0	117.6
228	S	35.9	Very low	55.2	Low	64 Å²	64	112.4 Å²	112.4	45%	0.448	62%	0.616	S	S	.	*			trans	-147	138.8	163.3	49.9	0	0	0	0	114.5	Q223	Q223-S228 PolarHBondContact OE1-OG 2.87Å
229	S	40.1	Very low	55.8	Low	80 Å²	80	108.4 Å²	108.4	56%	0.559	60%	0.597	S	S	*	*			trans	-74.7	152.1	173.9	-61.2	0	0	0	0	110	S231 D232	S229-S231 PolarHBondContact O-N 2.8Å; S229-D232 PolarHBondContact O-N 3.46Å
230	P	44.3	Very low	56.9	Low	130 Å²	130	108.2 Å²	108.2	84%	0.844	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	0.7	-178.8	26.9	-35.9	0	0	0	115.1
231	S	42.8	Very low	58.5	Low	103 Å²	103	101.1 Å²	101.1	72%	0.72	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-15.2	172.1	53.2	0	0	0	0	114.5	S229 Q233	S229-S231 PolarHBondContact O-N 2.8Å; S231-Q233 VanDerWaalsContact C-N 3.29Å; S231-Q233 PolarHBondContact O-N 2.96Å
232	D	48	Very low	60.3	Low	84 Å²	84	98.1 Å²	98.1	45%	0.449	52%	0.521	S	S	.	.			trans	-94.5	32.8	-173.4	-137.8	31	0	0	0	112.7	S229 S234	S229-D232 PolarHBondContact O-N 3.46Å; D232-S234 PolarHBondContact O-N 3.13Å; D232-S234 VanDerWaalsContact O-N 3.1Å
233	Q	52.6	Low	62.4	Low	169 Å²	169	90.7 Å²	90.7	79%	0.79	48%	0.484	S	S	*	.			trans	-56.2	116.8	168.2	-71.3	-175.6	-1.2	0	0	108.6	S231 R235	S231-Q233 VanDerWaalsContact C-N 3.29Å; S231-Q233 PolarHBondContact O-N 2.96Å; Q233-R235 PolarHBondContact O-N 2.93Å
234	S	57.6	Low	64.3	Low	66 Å²	66	90.7 Å²	90.7	46%	0.462	48%	0.484	S	S	.	.			trans	-53.5	113.9	-174.7	60.9	0	0	0	0	110.3	D232	D232-S234 PolarHBondContact O-N 3.13Å; D232-S234 VanDerWaalsContact O-N 3.1Å
235	R	70.4	Confident	66.5	Low	166 Å²	166	87.7 Å²	87.7	63%	0.626	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-56.6	136.2	175.5	-77.5	167.8	168.1	-166.4	-0.6	109.2	D165 Q233 C237	D165-R235 HydrophobicContact CB-CB 3.94Å; D165-R235 VanDerWaalsContact CG-NH1 3.34Å; D165-R235 WeakPolarHBondContact OD1-CD 3.24Å; D165-R235 IonicContact OD1-NH1 2.91Å; D165-R235 PolarHBondContact OD1-NH1 2.97Å; D165-R235 VanDerWaalsContact OD1-NH1 3.09Å; D165-R235 WeakPolarHBondContact OD2-CD 3.35Å; D165-R235 IonicContact OD2-CZ 2.86Å; D165-R235 IonicContact OD2-NE 3.01Å; D165-R235 IonicContact OD2-NH1 2.8Å; D165-R235 PolarHBondContact OD2-NH1 3.3Å; Q233-R235 PolarHBondContact O-N 2.93Å; R235-C237 PolarHBondContact O-N 2.84Å
236	P	80.3	Confident	68.6	Low	43 Å²	43	79 Å²	79	28%	0.279	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-60.4	132.6	-176.1	22.5	-32.9	0	0	0	111.3	M215 H216 Y217	M215-P236 HydrophobicContact CB-CB 4.23Å; M215-P236 HydrophobicContact CE-CB 3.72Å; M215-P236 HydrophobicContact CE-CG 3.7Å; M215-P236 WeakPolarHBondContact CE-O 3.49Å; H216-P236 CarbonylContact O-C 3.6Å; H216-P236 VanDerWaalsContact O-CA 3.27Å; H216-P236 WeakPolarHBondContact O-CA 3.37Å; Y217-P236 HydrophobicContact CD1-CB 3.86Å; Y217-P236 HydrophobicContact CD1-CG 4.47Å; Y217-P236 HydrophobicContact CD2-CB 4.4Å; Y217-P236 HydrophobicContact CE1-CB 3.64Å; Y217-P236 HydrophobicContact CE1-CG 3.85Å; Y217-P236 HydrophobicContact CE2-CB 4.19Å; Y217-P236 HydrophobicContact CG-CB 4.24Å
237	C	86	Confident	70	Confident	8 Å²	8	72.9 Å²	72.9	5%	0.054	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	140.3	176.8	-63.1	0	0	0	0	110	K163 H216 R235	K163-C237 CarbonylContact O-C 3.59Å; K163-C237 WeakPolarHBondContact O-CA 3.39Å; H216-C237 HydrophobicContact CB-CB 4.16Å; H216-C237 PolarHBondContact N-O 3.14Å; H216-C237 PolarHBondContact O-N 3.05Å; R235-C237 PolarHBondContact O-N 2.84Å
238	T	87.1	Confident	71.9	Confident	58 Å²	58	71 Å²	71	36%	0.356	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	131.5	174.3	-62.1	0	0	0	0	109.3	Y162 K163	Y162-T238 CarbonylContact C-O 3.54Å; Y162-T238 VanDerWaalsContact CA-O 3.3Å; Y162-T238 WeakPolarHBondContact CA-O 3.28Å; K163-T238 PolarHBondContact N-O 2.83Å; K163-T238 PolarHBondContact O-N 3.11Å
239	V	90.8	Very high	74.2	Confident	2 Å²	2	76.7 Å²	76.7	1%	0.012	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	139.4	178.7	176	0	0	0	0	110.7	W160 F161 Y173 L181 I214 H216	W160-V239 HydrophobicContact CE3-CG1 3.5Å; W160-V239 VanDerWaalsContact CE3-CG1 3.5Å; W160-V239 HydrophobicContact CZ3-CG1 3.74Å; F161-V239 CarbonylContact O-C 3.53Å; F161-V239 WeakPolarHBondContact O-CA 3.28Å; Y173-V239 HydrophobicContact CE2-CG1 4.04Å; Y173-V239 HydrophobicContact CE2-CG2 4.1Å; Y173-V239 VanDerWaalsContact OH-CG2 3.31Å; Y173-V239 WeakPolarHBondContact OH-CG2 3.39Å; L181-V239 HydrophobicContact CD1-CG1 4.38Å; I214-V239 HydrophobicContact CB-CB 3.99Å; I214-V239 HydrophobicContact CB-CG1 4.35Å; I214-V239 HydrophobicContact CG2-CB 3.82Å; I214-V239 HydrophobicContact CG2-CG1 3.94Å; I214-V239 HydrophobicContact CG2-CG2 4.47Å; I214-V239 PolarHBondContact O-N 3.29Å; H216-V239 HydrophobicContact CB-CG2 3.62Å
240	K	90.5	Very high	76.5	Confident	54 Å²	54	73.9 Å²	73.9	24%	0.235	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	145.6	176.5	-66.7	-62	-175.6	-176.5	0	111	F161 F170 K212 N245 I246	F161-K240 PolarHBondContact N-O 3.45Å; F161-K240 PolarHBondContact O-N 3.04Å; F170-K240 HydrophobicContact CD1-CG 4.39Å; F170-K240 HydrophobicContact CE1-CB 4.06Å; F170-K240 HydrophobicContact CE1-CG 3.5Å; F170-K240 VanDerWaalsContact CE1-CG 3.5Å; F170-K240 HydrophobicContact CZ-CG 3.64Å; K212-K240 PolarHBondContact O-NZ 3.48Å; K240-N245 HydrophobicContact CB-CB 4.29Å; K240-N245 HydrophobicContact CD-CB 4.29Å; K240-I246 HydrophobicContact CB-CG2 3.93Å; K240-I246 HydrophobicContact CG-CG2 4.4Å
241	R	91.4	Very high	78.6	Confident	30 Å²	30	71.1 Å²	71.1	11%	0.113	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	133.8	176.1	-174.8	178.5	-178.8	-102.7	12.2	109	Q82 V84 W160 E182 N245	Q82-R241 PolarHBondContact O-NH1 2.89Å; Q82-R241 PolarHBondContact O-NH2 2.87Å; V84-R241 HydrophobicContact CB-CG 4.24Å; V84-R241 HydrophobicContact CG1-CG 4.42Å; V84-R241 HydrophobicContact CG2-CG 4.35Å; V84-R241 VanDerWaalsContact N-NH2 3.13Å; W160-R241 HydrophobicContact CD2-CB 4.13Å; W160-R241 HydrophobicContact CD2-CG 4.23Å; W160-R241 HydrophobicContact CE3-CB 3.92Å; W160-R241 HydrophobicContact CH2-CB 3.7Å; W160-R241 HydrophobicContact CH2-CG 4.03Å; W160-R241 HydrophobicContact CZ2-CB 3.88Å; W160-R241 HydrophobicContact CZ2-CG 3.67Å; W160-R241 HydrophobicContact CZ3-CB 3.72Å; W160-R241 HydrophobicContact CZ3-CG 4.42Å; E182-R241 IonicContact OE1-CZ 2.96Å; E182-R241 VanDerWaalsContact OE1-CZ 3.3Å; E182-R241 IonicContact OE1-NE 2.94Å; E182-R241 PolarHBondContact OE1-NE 2.86Å; E182-R241 VanDerWaalsContact OE1-NE 3.11Å; E182-R241 IonicContact OE1-NH2 3.58Å; E182-R241 PolarHBondContact OE1-NH2 2.87Å; E182-R241 IonicContact OE2-CZ 3.74Å; E182-R241 IonicContact OE2-NE 4Å; E182-R241 PolarHBondContact OE2-NE 2.75Å; E182-R241 IonicContact OE2-NH2 2.72Å; R241-N245 WeakPolarHBondContact O-CB 3.46Å; R241-N245 PolarHBondContact O-ND2 2.88Å
242	G	88.5	Confident	80.6	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	38%	0.375	C	S	.	.	S	Bend	trans	70.3	162.8	177.7	0	0	0	0	0	114.5	V84 T159 E244	V84-G242 VanDerWaalsContact CG2-CA 3.5Å; T159-G242 PolarHBondContact O-N 3.48Å; G242-E244 VanDerWaalsContact C-N 3.35Å; G242-E244 VanDerWaalsContact C-OE2 3.27Å; G242-E244 VanDerWaalsContact CA-OE2 3.24Å; G242-E244 WeakPolarHBondContact CA-OE2 3.4Å
243	V	88	Confident	82.3	Confident	27 Å²	27	69.5 Å²	69.5	16%	0.164	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-78.1	-22.5	179.6	-71.3	0	0	0	0	112.7	H87 F89 F161 N245 I246 I250	H87-V243 HydrophobicContact CB-CG1 3.58Å; H87-V243 HydrophobicContact CB-CG2 4.25Å; F89-V243 HydrophobicContact CE2-CG1 3.85Å; F89-V243 HydrophobicContact CZ-CG1 3.99Å; F161-V243 HydrophobicContact CE2-CG1 3.92Å; F161-V243 HydrophobicContact CZ-CG1 3.69Å; V243-N245 PolarHBondContact O-N 3.17Å; V243-I246 HydrophobicContact CG1-CD1 4.35Å; V243-I246 VanDerWaalsContact O-CG1 3.28Å; V243-I246 WeakPolarHBondContact O-CG1 3.15Å; V243-I246 PolarHBondContact O-N 2.94Å; V243-I250 HydrophobicContact CB-CD1 3.9Å; V243-I250 HydrophobicContact CG1-CD1 4.29Å; V243-I250 HydrophobicContact CG2-CD1 3.8Å
244	E	84.1	Confident	84	Confident	123 Å²	123	63.3 Å²	63.3	58%	0.575	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-66	-18.3	176.3	72.1	-69.3	166.2	0	0	113.6	G242	G242-E244 VanDerWaalsContact C-N 3.35Å; G242-E244 VanDerWaalsContact C-OE2 3.27Å; G242-E244 VanDerWaalsContact CA-OE2 3.24Å; G242-E244 WeakPolarHBondContact CA-OE2 3.4Å
245	N	82.4	Confident	85.5	Confident	87 Å²	87	62.1 Å²	62.1	47%	0.465	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-103.3	6.3	-179.8	-70	-69.6	0	0	0	114	K240 R241 V243	K240-N245 HydrophobicContact CB-CB 4.29Å; K240-N245 HydrophobicContact CD-CB 4.29Å; R241-N245 WeakPolarHBondContact O-CB 3.46Å; R241-N245 PolarHBondContact O-ND2 2.88Å; V243-N245 PolarHBondContact O-N 3.17Å
246	I	84.4	Confident	86.2	Confident	14 Å²	14	60.7 Å²	60.7	7%	0.072	33%	0.333	C	S	.	.	S	Bend	trans	-118	146.7	173.9	64.8	177.5	0	0	0	110.3	F89 F161 F170 K240 V243 V248	F89-I246 HydrophobicContact CZ-CD1 4.4Å; F161-I246 HydrophobicContact CB-CG2 4.12Å; F161-I246 HydrophobicContact CD1-CD1 3.96Å; F161-I246 HydrophobicContact CD2-CD1 4.05Å; F161-I246 HydrophobicContact CD2-CG2 4.14Å; F161-I246 HydrophobicContact CE1-CD1 3.92Å; F161-I246 HydrophobicContact CE2-CD1 4.02Å; F161-I246 HydrophobicContact CG-CD1 4.04Å; F161-I246 HydrophobicContact CG-CG2 4.18Å; F161-I246 HydrophobicContact CZ-CD1 3.96Å; F170-I246 HydrophobicContact CB-CB 4.32Å; F170-I246 HydrophobicContact CB-CG2 3.95Å; F170-I246 HydrophobicContact CD1-CG2 3.87Å; F170-I246 HydrophobicContact CD2-CB 3.89Å; F170-I246 HydrophobicContact CD2-CG2 3.74Å; F170-I246 HydrophobicContact CE1-CG2 4.32Å; F170-I246 HydrophobicContact CE2-CB 4.45Å; F170-I246 HydrophobicContact CE2-CG2 4.19Å; F170-I246 HydrophobicContact CG-CB 4.11Å; F170-I246 HydrophobicContact CG-CG2 3.56Å; F170-I246 HydrophobicContact CZ-CG2 4.47Å; K240-I246 HydrophobicContact CB-CG2 3.93Å; K240-I246 HydrophobicContact CG-CG2 4.4Å; V243-I246 HydrophobicContact CG1-CD1 4.35Å; V243-I246 VanDerWaalsContact O-CG1 3.28Å; V243-I246 WeakPolarHBondContact O-CG1 3.15Å; V243-I246 PolarHBondContact O-N 2.94Å; I246-V248 HydrophobicContact CB-CG2 4.36Å; I246-V248 HydrophobicContact CD1-CB 4.05Å; I246-V248 HydrophobicContact CD1-CG2 3.61Å; I246-V248 HydrophobicContact CG1-CB 4.07Å; I246-V248 HydrophobicContact CG1-CG2 3.84Å; I246-V248 PolarHBondContact O-N 2.77Å
247	S	80.1	Confident	86.7	Confident	130 Å²	130	64 Å²	64	91%	0.909	34%	0.342	S	S	*	.			trans	-82.2	66.3	177.9	-51.7	0	0	0	0	111
248	V	83.6	Confident	87.1	Confident	53 Å²	53	64.1 Å²	64.1	32%	0.321	34%	0.343	S	S	.	.			trans	-121.5	129.3	178.3	176.4	0	0	0	0	109.3	P102 I246	P102-V248 HydrophobicContact CG-CG1 3.86Å; I246-V248 HydrophobicContact CB-CG2 4.36Å; I246-V248 HydrophobicContact CD1-CB 4.05Å; I246-V248 HydrophobicContact CD1-CG2 3.61Å; I246-V248 HydrophobicContact CG1-CB 4.07Å; I246-V248 HydrophobicContact CG1-CG2 3.84Å; I246-V248 PolarHBondContact O-N 2.77Å
249	E	85.9	Confident	87.5	Confident	184 Å²	184	61.9 Å²	61.9	86%	0.86	33%	0.329	S	S	*	.			trans	-81.4	125.5	172.9	-170.3	167.2	-157.6	0	0	109.2
250	I	87.7	Confident	87.7	Confident	20 Å²	20	61.8 Å²	61.8	10%	0.103	33%	0.329	C	S	.	.			trans	-106.8	120.3	-180	-64.1	173.3	0	0	0	107.4	P102 R105 V243	P102-I250 HydrophobicContact CB-CG1 4.27Å; R105-I250 HydrophobicContact CG-CG2 3.77Å; V243-I250 HydrophobicContact CB-CD1 3.9Å; V243-I250 HydrophobicContact CG1-CD1 4.29Å; V243-I250 HydrophobicContact CG2-CD1 3.8Å
251	P	88.4	Confident	88	Confident	73 Å²	73	59.2 Å²	59.2	47%	0.474	32%	0.317	S	S	.	.			trans	-61.9	143	173.4	-20.7	32.9	0	0	0	111.5	S104 R105	S104-P251 CarbonylContact C-O 3.53Å; S104-P251 WeakPolarHBondContact CA-O 3.49Å; R105-P251 PolarHBondContact N-O 3.49Å
252	E	83.9	Confident	88.4	Confident	117 Å²	117	57.8 Å²	57.8	55%	0.547	31%	0.312	S	S	.	.			trans	-70.6	-54	176.5	-62.4	-62.7	134.5	0	0	110.9	R105 E106	R105-E252 VanDerWaalsContact CD-OE2 3.28Å; R105-E252 WeakPolarHBondContact CD-OE2 3.45Å; R105-E252 IonicContact CZ-OE1 3.6Å; R105-E252 PolarHBondContact N-O 3.22Å; R105-E252 VanDerWaalsContact NE-CD 3.29Å; R105-E252 IonicContact NE-OE1 3.35Å; R105-E252 PolarHBondContact NE-OE1 3.31Å; R105-E252 IonicContact NE-OE2 2.77Å; R105-E252 PolarHBondContact NE-OE2 3.06Å; R105-E252 IonicContact NH2-OE1 3.83Å; R105-E252 PolarHBondContact NH2-OE1 2.96Å; E106-E252 PolarHBondContact N-O 2.96Å
253	G	84.5	Confident	88.8	Confident	35 Å²	35	57.8 Å²	57.8	36%	0.361	31%	0.312	S	S	.	.			trans	171.1	-173.7	-179.3	0	0	0	0	0	114.2	E106	E106-G253 WeakPolarHBondContact OE2-CA 3.4Å
254	E	88.3	Confident	89.2	Confident	39 Å²	39	56.5 Å²	56.5	18%	0.182	30%	0.304	C	S	.	.			trans	-123.6	139.9	168.5	-73.9	-170.4	-159.9	0	0	109.3	R133 E256 L291 R309	R133-E254 IonicContact CZ-OE1 3.75Å; R133-E254 IonicContact CZ-OE2 3.09Å; R133-E254 IonicContact NH1-OE1 3.43Å; R133-E254 PolarHBondContact NH1-OE1 3.25Å; R133-E254 IonicContact NH1-OE2 3.57Å; R133-E254 PolarHBondContact NH1-OE2 3.19Å; R133-E254 IonicContact NH2-OE1 2.78Å; R133-E254 PolarHBondContact NH2-OE1 2.91Å; R133-E254 IonicContact NH2-OE2 2.74Å; R133-E254 PolarHBondContact NH2-OE2 3.23Å; E254-E256 PolarHBondContact O-N 3.24Å; E254-L291 HydrophobicContact CG-CD1 3.73Å; E254-R309 IonicContact OE2-CZ 3.21Å; E254-R309 IonicContact OE2-NH1 3.45Å; E254-R309 PolarHBondContact OE2-NH1 2.9Å
255	P	88.3	Confident	89.6	Confident	41 Å²	41	50.7 Å²	50.7	27%	0.266	28%	0.277	S	S	.	.			trans	-56.9	125.5	178.4	-24.8	33.8	0	0	0	112.7	K257 R309	P255-K257 VanDerWaalsContact C-N 3.31Å; P255-K257 PolarHBondContact O-N 2.98Å; P255-R309 WeakPolarHBondContact O-CD 3.38Å; P255-R309 WeakPolarHBondContact O-CG 3.42Å; P255-R309 PolarHBondContact O-NE 3Å
256	E	86.3	Confident	89.9	Confident	136 Å²	136	46.7 Å²	46.7	64%	0.636	26%	0.255	S	S	*	.	S	Bend	trans	-61.5	-38.5	-177.1	-61.1	-172.1	147.2	0	0	112.5	K110 E254 V258	K110-E256 WeakPolarHBondContact CE-OE1 3.32Å; K110-E256 IonicContact NZ-OE1 3.9Å; K110-E256 PolarHBondContact NZ-OE1 3.4Å; E254-E256 PolarHBondContact O-N 3.24Å; E256-V258 PolarHBondContact O-N 3.19Å
257	K	90.5	Very high	89.6	Confident	112 Å²	112	46.2 Å²	46.2	49%	0.487	25%	0.254	S	S	.	.			trans	-68.3	118	179.2	-176.6	173.7	-178.3	-96.5	0	111.8	P255 D259 G308 R309	P255-K257 VanDerWaalsContact C-N 3.31Å; P255-K257 PolarHBondContact O-N 2.98Å; K257-D259 IonicContact NZ-OD1 2.89Å; K257-D259 PolarHBondContact NZ-OD1 3.02Å; K257-G308 WeakPolarHBondContact O-CA 3.33Å; K257-R309 PolarHBondContact O-N 3.44Å
258	V	94.4	Very high	88.7	Confident	11 Å²	11	40.5 Å²	40.5	7%	0.067	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	118.3	170.8	-174.4	0	0	0	0	109.6	E256 H260 R309 E311 F381 F388	E256-V258 PolarHBondContact O-N 3.19Å; V258-H260 WeakPolarHBondContact CG1-O 3.48Å; V258-R309 CarbonylContact C-O 3.52Å; V258-R309 WeakPolarHBondContact CA-O 3.43Å; V258-R309 HydrophobicContact CG2-CG 4.29Å; V258-E311 HydrophobicContact CG1-CB 3.69Å; V258-E311 HydrophobicContact CG2-CB 4.32Å; V258-F381 HydrophobicContact CB-CZ 4.31Å; V258-F381 HydrophobicContact CG1-CZ 4.05Å; V258-F381 HydrophobicContact CG2-CZ 4.39Å; V258-F388 HydrophobicContact CB-CD2 4.25Å; V258-F388 HydrophobicContact CB-CE2 4.38Å; V258-F388 HydrophobicContact CG1-CD2 4.3Å; V258-F388 HydrophobicContact CG1-CE2 3.96Å; V258-F388 WeakPolarHBondContact O-CD2 3.02Å
259	D	94.6	Very high	87.6	Confident	11 Å²	11	38 Å²	38	6%	0.059	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-30.5	179.9	-65.8	-31.9	0	0	0	112.6	K257 G308 R309 G390 Y768 L771	K257-D259 IonicContact NZ-OD1 2.89Å; K257-D259 PolarHBondContact NZ-OD1 3.02Å; D259-G308 PolarHBondContact OD2-N 3.17Å; D259-R309 PolarHBondContact N-O 3.37Å; D259-G390 VanDerWaalsContact O-CA 3.28Å; D259-G390 WeakPolarHBondContact O-CA 3.4Å; D259-Y768 HydrophobicContact CB-CE1 4.36Å; D259-Y768 PolarHBondContact OD2-OH 3.42Å; D259-L771 HydrophobicContact CB-CD1 4.18Å
260	H	96.3	Very high	85.9	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	144.5	-174.7	-157.9	103.6	0	0	0	111.1	V258 V310 E311 K391 S393 I767	V258-H260 WeakPolarHBondContact CG1-O 3.48Å; H260-V310 HydrophobicContact CB-CG1 4.27Å; H260-V310 HydrophobicContact CB-CG2 4.22Å; H260-V310 WeakPolarHBondContact O-CA 3.27Å; H260-E311 PolarHBondContact O-N 3.48Å; H260-K391 WeakPolarHBondContact CA-O 3.41Å; H260-K391 PolarHBondContact CD2-O 2.68Å; H260-K391 VanDerWaalsContact CE1-CB 3.41Å; H260-K391 WeakPolarHBondContact CE1-CB 3.33Å; H260-S393 WeakPolarHBondContact NE2-CB 3.42Å; H260-S393 PolarHBondContact NE2-N 3.5Å; H260-S393 PolarHBondContact NE2-OG 2.89Å; H260-I767 HydrophobicContact CB-CG2 3.67Å
261	L	97.4	Very high	84.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	134.8	178.5	179.9	65	0	0	0	110.8	F263 E311 L313 F381 F388 K391 V392 S393	L261-F263 HydrophobicContact CD2-CE1 4.41Å; L261-F263 HydrophobicContact CD2-CE2 3.81Å; L261-F263 HydrophobicContact CD2-CZ 3.57Å; L261-F263 HydrophobicContact CG-CE2 4.26Å; L261-F263 HydrophobicContact CG-CZ 4.19Å; L261-E311 HydrophobicContact CD1-CB 4.27Å; L261-E311 HydrophobicContact CD1-CG 4.35Å; L261-L313 HydrophobicContact CD1-CD1 3.88Å; L261-L313 HydrophobicContact CD1-CG 3.94Å; L261-F381 HydrophobicContact CD1-CD1 4.35Å; L261-F381 HydrophobicContact CD1-CD2 3.96Å; L261-F381 HydrophobicContact CD1-CE1 4.33Å; L261-F381 HydrophobicContact CD1-CE2 3.95Å; L261-F381 HydrophobicContact CD1-CG 4.16Å; L261-F381 HydrophobicContact CD1-CZ 4.14Å; L261-F381 HydrophobicContact CD2-CB 4.39Å; L261-F381 HydrophobicContact CD2-CD1 3.63Å; L261-F381 HydrophobicContact CD2-CE1 4.02Å; L261-F381 HydrophobicContact CD2-CG 3.93Å; L261-F388 HydrophobicContact CB-CE1 4.39Å; L261-F388 HydrophobicContact CB-CE2 4.48Å; L261-F388 HydrophobicContact CB-CZ 3.81Å; L261-K391 PolarHBondContact N-O 3.43Å; L261-V392 HydrophobicContact CB-CG1 4.35Å; L261-V392 HydrophobicContact CB-CG2 4.35Å; L261-V392 HydrophobicContact CD2-CG1 4.3Å; L261-V392 HydrophobicContact CD2-CG2 4.41Å; L261-V392 HydrophobicContact CG-CG1 4.35Å; L261-V392 CarbonylContact O-C 3.49Å; L261-V392 VanDerWaalsContact O-CA 3.26Å; L261-V392 WeakPolarHBondContact O-CA 3.25Å; L261-S393 PolarHBondContact O-N 2.94Å
262	V	98.1	Very high	82.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	119.1	-179.9	-176.4	0	0	0	0	110.3	M264 V310 E311 F312 L313 S393 V395 I767	V262-M264 HydrophobicContact CG1-CG 4.21Å; V262-V310 HydrophobicContact CG2-CG1 3.56Å; V262-E311 PolarHBondContact N-O 3.24Å; V262-F312 HydrophobicContact CB-CD1 3.63Å; V262-F312 HydrophobicContact CB-CE1 3.91Å; V262-F312 HydrophobicContact CB-CG 4.5Å; V262-F312 HydrophobicContact CG1-CD1 3.88Å; V262-F312 HydrophobicContact CG1-CE1 4.11Å; V262-F312 HydrophobicContact CG2-CD1 4.12Å; V262-F312 HydrophobicContact CG2-CE1 3.87Å; V262-F312 CarbonylContact O-C 3.59Å; V262-F312 WeakPolarHBondContact O-CA 3.42Å; V262-L313 PolarHBondContact O-N 3.44Å; V262-S393 WeakPolarHBondContact CA-O 3.48Å; V262-V395 HydrophobicContact CG1-CB 4.32Å; V262-V395 HydrophobicContact CG1-CG2 3.43Å; V262-V395 VanDerWaalsContact CG1-CG2 3.43Å; V262-I767 HydrophobicContact CG2-CD1 3.95Å
263	F	98	Very high	81.5	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	124.4	169.9	-66.2	-70.1	0	0	0	110.2	L261 L313 V315 V374 L377 H378 V392 S393 V394 V395 F567	L261-F263 HydrophobicContact CD2-CE1 4.41Å; L261-F263 HydrophobicContact CD2-CE2 3.81Å; L261-F263 HydrophobicContact CD2-CZ 3.57Å; L261-F263 HydrophobicContact CG-CE2 4.26Å; L261-F263 HydrophobicContact CG-CZ 4.19Å; F263-L313 HydrophobicContact CD1-CB 3.97Å; F263-L313 HydrophobicContact CE1-CB 4.07Å; F263-L313 HydrophobicContact CE1-CD1 3.86Å; F263-V315 HydrophobicContact CB-CG2 4Å; F263-V315 HydrophobicContact CD1-CG2 4.26Å; F263-V374 HydrophobicContact CD2-CG1 4.13Å; F263-V374 HydrophobicContact CE2-CG1 4.46Å; F263-V374 HydrophobicContact CG-CG1 4.26Å; F263-L377 HydrophobicContact CD1-CB 4.3Å; F263-L377 HydrophobicContact CD1-CD1 4.44Å; F263-L377 HydrophobicContact CE1-CB 3.61Å; F263-L377 HydrophobicContact CZ-CB 4.46Å; F263-H378 HydrophobicContact CE2-CB 4.1Å; F263-H378 HydrophobicContact CZ-CB 3.67Å; F263-V392 HydrophobicContact CD2-CG1 3.78Å; F263-V392 HydrophobicContact CE2-CG1 3.6Å; F263-S393 PolarHBondContact N-O 3.25Å; F263-V394 HydrophobicContact CB-CG1 4.38Å; F263-V394 WeakPolarHBondContact O-CA 3.18Å; F263-V395 PolarHBondContact O-N 3.25Å; F263-F567 HydrophobicContact CD2-CE1 4.11Å; F263-F567 HydrophobicContact CD2-CE2 4.11Å; F263-F567 AromaticContact CD2-CZ 3.45Å; F263-F567 HydrophobicContact CD2-CZ 3.45Å; F263-F567 VanDerWaalsContact CD2-CZ 3.45Å; F263-F567 AromaticContact CE2-CE1 3.66Å; F263-F567 HydrophobicContact CE2-CE1 3.66Å; F263-F567 HydrophobicContact CE2-CE2 4.14Å; F263-F567 AromaticContact CE2-CZ 3.44Å; F263-F567 HydrophobicContact CE2-CZ 3.44Å; F263-F567 VanDerWaalsContact CE2-CZ 3.44Å
264	M	95.8	Very high	80.2	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	112.4	179.7	-54.5	-168.2	88.3	0	0	109.8	V262 I279 V283 F286 F312 L313 V315 V395 F575 W754	V262-M264 HydrophobicContact CG1-CG 4.21Å; M264-I279 VanDerWaalsContact O-CD1 3.29Å; M264-I279 WeakPolarHBondContact O-CD1 3.27Å; M264-V283 HydrophobicContact CB-CG2 3.99Å; M264-V283 HydrophobicContact CG-CG2 4.36Å; M264-V283 HydrophobicContact SD-CB 4.34Å; M264-V283 HydrophobicContact SD-CG1 3.9Å; M264-V283 HydrophobicContact SD-CG2 3.71Å; M264-F286 HydrophobicContact CE-CD1 3.89Å; M264-F286 HydrophobicContact CE-CD2 4.43Å; M264-F286 HydrophobicContact CE-CE1 3.99Å; M264-F286 HydrophobicContact CE-CG 4.12Å; M264-F286 HydrophobicContact CE-CZ 4.29Å; M264-F286 HydrophobicContact SD-CD1 4.19Å; M264-F312 HydrophobicContact CE-CD1 4.49Å; M264-F312 HydrophobicContact CG-CB 4.48Å; M264-F312 HydrophobicContact CG-CD1 4.34Å; M264-F312 HydrophobicContact SD-CB 3.92Å; M264-F312 HydrophobicContact SD-CD1 3.75Å; M264-F312 HydrophobicContact SD-CG 4.19Å; M264-L313 PolarHBondContact N-O 2.71Å; M264-V315 WeakPolarHBondContact O-CB 3.41Å; M264-V315 PolarHBondContact O-N 3.42Å; M264-V395 WeakPolarHBondContact CA-O 3.38Å; M264-V395 HydrophobicContact CE-CB 4.21Å; M264-V395 HydrophobicContact CE-CG1 3.9Å; M264-V395 HydrophobicContact CE-CG2 4.31Å; M264-V395 HydrophobicContact CG-CB 4.21Å; M264-F575 HydrophobicContact CE-CE2 4.38Å; M264-W754 HydrophobicContact CB-CZ3 4.25Å; M264-W754 HydrophobicContact CE-CE3 4.08Å; M264-W754 HydrophobicContact CE-CZ3 3.66Å; M264-W754 HydrophobicContact SD-CZ3 4.18Å
265	V	93.4	Very high	78.6	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	114	178.8	-174.3	0	0	0	0	108.7	V315 V370 V374 V395 G396 H397 L404	V265-V315 HydrophobicContact CG2-CB 3.93Å; V265-V315 HydrophobicContact CG2-CG1 4.17Å; V265-V315 HydrophobicContact CG2-CG2 3.86Å; V265-V370 HydrophobicContact CG1-CG1 4.02Å; V265-V370 HydrophobicContact CG2-CG1 4.3Å; V265-V374 HydrophobicContact CG2-CG2 4.39Å; V265-V395 PolarHBondContact N-O 2.9Å; V265-G396 CarbonylContact O-C 3.51Å; V265-G396 WeakPolarHBondContact O-CA 3.11Å; V265-H397 PolarHBondContact O-N 3.3Å; V265-L404 HydrophobicContact CB-CD1 3.99Å; V265-L404 HydrophobicContact CB-CG 4.33Å; V265-L404 HydrophobicContact CG2-CD1 3.82Å; V265-L404 HydrophobicContact CG2-CD2 4.07Å; V265-L404 HydrophobicContact CG2-CG 4.03Å
266	H	88.1	Confident	77.4	Confident	3 Å²	3	37 Å²	37	1%	0.014	18%	0.181	C	C	.	.			trans	-77.1	170.1	171.1	69.1	123.5	0	0	0	111.9	G269 C272 I279 V315 W317 H397 G400 W754	H266-G269 PolarHBondContact CE1-O 2.72Å; H266-G269 PolarHBondContact ND1-O 2.8Å; H266-C272 PolarHBondContact ND1-SG 3.49Å; H266-I279 HydrophobicContact CB-CD1 3.93Å; H266-I279 HydrophobicContact CB-CG1 4.4Å; H266-I279 VanDerWaalsContact CD2-CD1 3.46Å; H266-I279 WeakPolarHBondContact CD2-CD1 3.48Å; H266-V315 PolarHBondContact CD2-O 3.47Å; H266-V315 VanDerWaalsContact CD2-O 3.31Å; H266-W317 AromaticContact CD2-CD1 3.83Å; H266-W317 AromaticContact CD2-NE1 3.81Å; H266-W317 AromaticContact NE2-CD1 3.79Å; H266-W317 AromaticContact NE2-NE1 3.95Å; H266-W317 PolarHBondContact O-NE1 2.83Å; H266-H397 CarbonylContact C-O 3.51Å; H266-G400 WeakPolarHBondContact O-CA 3.26Å; H266-W754 HydrophobicContact CB-CH2 4.47Å; H266-W754 HydrophobicContact CB-CZ2 4.23Å
267	G	78.1	Confident	76.7	Confident	4 Å²	4	32 Å²	32	4%	0.041	16%	0.156	C	C	.	.			trans	-65.8	-165.7	165.2	0	0	0	0	0	112.8	H397	G267-H397 PolarHBondContact N-O 2.91Å; G267-H397 VanDerWaalsContact N-O 3.15Å
268	I	61.6	Low	76.4	Confident	10 Å²	10	28.8 Å²	28.8	5%	0.051	15%	0.148	C	C	.	.	S	Bend	trans	-76.7	159.5	165	-73.9	167.6	0	0	0	107.3	W317 L321 H322 D353 F356 I366 L399	I268-W317 HydrophobicContact CB-CH2 4.46Å; I268-W317 HydrophobicContact CD1-CH2 3.67Å; I268-W317 HydrophobicContact CD1-CZ3 4.06Å; I268-W317 HydrophobicContact CG1-CH2 3.13Å; I268-W317 HydrophobicContact CG1-CZ2 3.75Å; I268-W317 HydrophobicContact CG1-CZ3 3.63Å; I268-L321 HydrophobicContact CD1-CD2 4.08Å; I268-H322 WeakPolarHBondContact CG2-NE2 3.12Å; I268-D353 HydrophobicContact CB-CB 3.75Å; I268-D353 WeakPolarHBondContact CB-OD2 3.39Å; I268-D353 HydrophobicContact CD1-CB 4.1Å; I268-D353 HydrophobicContact CG1-CB 4.36Å; I268-D353 HydrophobicContact CG2-CB 4.18Å; I268-D353 VanDerWaalsContact CG2-CG 3.44Å; I268-D353 WeakPolarHBondContact CG2-OD1 3.32Å; I268-F356 HydrophobicContact CD1-CB 4.4Å; I268-I366 HydrophobicContact CD1-CD1 4.22Å; I268-L399 HydrophobicContact CB-CD2 4.47Å; I268-L399 HydrophobicContact CD1-CD2 3.64Å; I268-L399 HydrophobicContact CG1-CD2 3.89Å
269	G	59.1	Low	76	Confident	2 Å²	2	28.4 Å²	28.4	2%	0.021	15%	0.146	C	C	.	.	S	Bend	trans	117.9	131.9	-171	0	0	0	0	0	113.1	H266 A271 H318	H266-G269 PolarHBondContact CE1-O 2.72Å; H266-G269 PolarHBondContact ND1-O 2.8Å; G269-A271 PolarHBondContact O-N 2.93Å; G269-H318 PolarHBondContact N-CD2 3.44Å; G269-H318 PolarHBondContact N-NE2 3.36Å; G269-H318 VanDerWaalsContact N-NE2 3.19Å
270	P	51.8	Low	75.7	Confident	91 Å²	91	28.6 Å²	28.6	59%	0.591	15%	0.147	S	C	*	.	S	Bend	trans	-71.9	-21.3	168.9	31.9	-33.4	0	0	0	111.6
271	A	55.5	Low	75.3	Confident	24 Å²	24	32.8 Å²	32.8	20%	0.198	17%	0.166	C	C	.	.			trans	-97.9	137.5	174.4	0	0	0	0	0	110.7	G269 F276 R277	G269-A271 PolarHBondContact O-N 2.93Å; A271-F276 HydrophobicContact CB-CB 4.06Å; A271-F276 HydrophobicContact CB-CD1 3.94Å; A271-F276 HydrophobicContact CB-CG 4.47Å; A271-R277 CarbonylContact C-O 3.5Å; A271-R277 WeakPolarHBondContact CA-O 3.29Å
272	C	54.9	Low	74.9	Confident	5 Å²	5	32.8 Å²	32.8	3%	0.034	17%	0.166	C	C	.	.			trans	-119.7	-5.9	-178.9	-69	0	0	0	0	113.7	H266 R277 I279 C282 W754	H266-C272 PolarHBondContact ND1-SG 3.49Å; C272-R277 PolarHBondContact N-O 3.44Å; C272-I279 VanDerWaalsContact SG-CA 3.59Å; C272-C282 HydrophobicContact CB-CB 4.34Å; C272-W754 VanDerWaalsContact O-CD1 3.3Å; C272-W754 PolarHBondContact O-NE1 3.33Å
273	D	57.5	Low	74.6	Confident	5 Å²	5	32.8 Å²	32.8	3%	0.027	17%	0.166	C	C	.	.	S	Bend	trans	-143	176.2	178.5	80.1	-11.3	0	0	0	113.5	R275 F276 R277	D273-R275 PolarHBondContact O-N 2.84Å; D273-R275 VanDerWaalsContact O-N 3.1Å; D273-R275 WeakPolarHBondContact OD1-CA 3.43Å; D273-R275 WeakPolarHBondContact OD1-CB 3.32Å; D273-R275 PolarHBondContact OD1-N 2.86Å; D273-R275 IonicContact OD2-NE 3.86Å; D273-R275 PolarHBondContact OD2-NE 2.7Å; D273-F276 PolarHBondContact O-N 3.31Å; D273-F276 PolarHBondContact OD1-N 2.81Å; D273-R277 WeakPolarHBondContact OD1-CB 3.4Å; D273-R277 PolarHBondContact OD1-N 2.96Å; D273-R277 IonicContact OD1-NE 3.48Å; D273-R277 IonicContact OD2-CZ 2.72Å; D273-R277 IonicContact OD2-NE 3.62Å; D273-R277 PolarHBondContact OD2-NE 2.87Å; D273-R277 IonicContact OD2-NH2 3.41Å; D273-R277 PolarHBondContact OD2-NH2 2.8Å
274	L	55.4	Low	74.3	Confident	81 Å²	81	34.2 Å²	34.2	42%	0.424	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.8	176.6	-78.9	174.9	0	0	0	114.9	F276 I747 Q748 L751	L274-F276 VanDerWaalsContact C-N 3.3Å; L274-I747 HydrophobicContact CD2-CG2 4.16Å; L274-Q748 HydrophobicContact CD1-CB 3.77Å; L274-Q748 HydrophobicContact CD1-CG 3.62Å; L274-Q748 HydrophobicContact CD2-CB 4.45Å; L274-L751 HydrophobicContact CD2-CD1 3.95Å; L274-L751 HydrophobicContact CG-CB 4.2Å; L274-L751 HydrophobicContact CG-CD1 4.1Å
275	R	54.8	Low	74	Confident	138 Å²	138	36.4 Å²	36.4	52%	0.521	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	7.2	179.4	-62.2	-174.9	-90.6	166.1	-10.2	111.5	D273 R277 D285 E755	D273-R275 PolarHBondContact O-N 2.84Å; D273-R275 VanDerWaalsContact O-N 3.1Å; D273-R275 WeakPolarHBondContact OD1-CA 3.43Å; D273-R275 WeakPolarHBondContact OD1-CB 3.32Å; D273-R275 PolarHBondContact OD1-N 2.86Å; D273-R275 IonicContact OD2-NE 3.86Å; D273-R275 PolarHBondContact OD2-NE 2.7Å; R275-R277 HydrophobicContact CB-CG 3.78Å; R275-R277 PolarHBondContact O-N 3.06Å; R275-D285 IonicContact CZ-OD2 3.87Å; R275-D285 IonicContact NH2-OD2 3.76Å; R275-D285 PolarHBondContact NH2-OD2 3.36Å; R275-E755 IonicContact CZ-OE1 3.77Å; R275-E755 IonicContact NE-OE1 3.24Å; R275-E755 PolarHBondContact NE-OE1 3.12Å; R275-E755 IonicContact NH2-OE1 3.47Å; R275-E755 PolarHBondContact NH2-OE1 3.34Å
276	F	63.5	Low	74	Confident	143 Å²	143	36.5 Å²	36.5	63%	0.627	19%	0.186	S	C	*	.			trans	56.6	30.5	-175.2	-60.2	-84.8	0	0	0	113.6	A271 D273 L274	A271-F276 HydrophobicContact CB-CB 4.06Å; A271-F276 HydrophobicContact CB-CD1 3.94Å; A271-F276 HydrophobicContact CB-CG 4.47Å; D273-F276 PolarHBondContact O-N 3.31Å; D273-F276 PolarHBondContact OD1-N 2.81Å; L274-F276 VanDerWaalsContact C-N 3.3Å
277	R	72.8	Confident	74.3	Confident	31 Å²	31	36.6 Å²	36.6	12%	0.117	19%	0.186	C	C	.	.			trans	-84.4	153.2	-176.6	-66.9	-173.9	-52.8	147.7	8.1	112.6	A271 C272 D273 R275 Q281 D285 E755	A271-R277 CarbonylContact C-O 3.5Å; A271-R277 WeakPolarHBondContact CA-O 3.29Å; C272-R277 PolarHBondContact N-O 3.44Å; D273-R277 WeakPolarHBondContact OD1-CB 3.4Å; D273-R277 PolarHBondContact OD1-N 2.96Å; D273-R277 IonicContact OD1-NE 3.48Å; D273-R277 IonicContact OD2-CZ 2.72Å; D273-R277 IonicContact OD2-NE 3.62Å; D273-R277 PolarHBondContact OD2-NE 2.87Å; D273-R277 IonicContact OD2-NH2 3.41Å; D273-R277 PolarHBondContact OD2-NH2 2.8Å; R275-R277 HydrophobicContact CB-CG 3.78Å; R275-R277 PolarHBondContact O-N 3.06Å; R277-Q281 HydrophobicContact CB-CB 4.04Å; R277-Q281 VanDerWaalsContact CB-OE1 3.31Å; R277-D285 IonicContact CZ-OD2 3.71Å; R277-D285 VanDerWaalsContact NH1-CG 3.27Å; R277-D285 IonicContact NH1-OD1 3.11Å; R277-D285 PolarHBondContact NH1-OD1 2.89Å; R277-D285 IonicContact NH1-OD2 3.75Å; R277-D285 PolarHBondContact NH1-OD2 3.09Å; R277-D285 IonicContact NH2-OD2 3.39Å; R277-D285 PolarHBondContact NH2-OD2 2.84Å; R277-E755 IonicContact NH2-OE1 2.66Å
278	S	83.3	Confident	74.9	Confident	44 Å²	44	40.1 Å²	40.1	31%	0.308	21%	0.21	S	C	.	.			trans	-64.6	155.4	176.1	63.2	0	0	0	0	112.8	V280 Q281 C282	S278-V280 PolarHBondContact O-N 2.91Å; S278-V280 VanDerWaalsContact O-N 3.15Å; S278-Q281 WeakPolarHBondContact O-CB 3.4Å; S278-Q281 PolarHBondContact O-N 2.74Å; S278-Q281 PolarHBondContact OG-N 2.92Å; S278-Q281 PolarHBondContact OG-OE1 2.75Å; S278-Q281 VanDerWaalsContact OG-OE1 3.1Å; S278-C282 PolarHBondContact O-N 2.83Å; S278-C282 VanDerWaalsContact O-N 3.15Å
279	I	86.5	Confident	76.4	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.021	22%	0.217	C	C	.	.	H	α-helix	trans	-49.4	-41.5	172.1	-180	175.5	0	0	0	111.8	M264 H266 C272 Q281 C282 V283 P314 N316	M264-I279 VanDerWaalsContact O-CD1 3.29Å; M264-I279 WeakPolarHBondContact O-CD1 3.27Å; H266-I279 HydrophobicContact CB-CD1 3.93Å; H266-I279 HydrophobicContact CB-CG1 4.4Å; H266-I279 VanDerWaalsContact CD2-CD1 3.46Å; H266-I279 WeakPolarHBondContact CD2-CD1 3.48Å; C272-I279 VanDerWaalsContact SG-CA 3.59Å; I279-Q281 VanDerWaalsContact C-N 3.29Å; I279-Q281 PolarHBondContact O-N 2.8Å; I279-C282 PolarHBondContact O-N 2.72Å; I279-C282 VanDerWaalsContact O-N 3.15Å; I279-V283 HydrophobicContact CD1-CG2 4.43Å; I279-V283 HydrophobicContact CG1-CG2 3.84Å; I279-V283 WeakPolarHBondContact O-CB 3.44Å; I279-V283 WeakPolarHBondContact O-CG2 3.41Å; I279-V283 PolarHBondContact O-N 2.7Å; I279-P314 HydrophobicContact CD1-CB 3.84Å; I279-P314 HydrophobicContact CG1-CB 3.75Å; I279-P314 HydrophobicContact CG2-CB 4.29Å; I279-N316 HydrophobicContact CG2-CB 4.07Å
280	V	88.6	Confident	78	Confident	14 Å²	14	41 Å²	41	9%	0.085	22%	0.216	C	C	.	.	H	α-helix	trans	-57.8	-42.6	-179.7	-179.9	0	0	0	0	111.2	W148 S278 N284 P314	W148-V280 HydrophobicContact CB-CG2 4.22Å; W148-V280 HydrophobicContact CD2-CG1 3.87Å; W148-V280 HydrophobicContact CD2-CG2 4Å; W148-V280 VanDerWaalsContact CE2-CG1 3.44Å; W148-V280 HydrophobicContact CE3-CG1 4.43Å; W148-V280 HydrophobicContact CG-CG1 4.32Å; W148-V280 HydrophobicContact CG-CG2 3.78Å; W148-V280 HydrophobicContact CH2-CG1 4.26Å; W148-V280 HydrophobicContact CZ2-CG1 3.66Å; S278-V280 PolarHBondContact O-N 2.91Å; S278-V280 VanDerWaalsContact O-N 3.15Å; V280-N284 WeakPolarHBondContact O-CB 3.41Å; V280-N284 PolarHBondContact O-N 2.9Å; V280-N284 PolarHBondContact O-ND2 3.03Å; V280-P314 HydrophobicContact CG2-CB 4.37Å; V280-P314 HydrophobicContact CG2-CG 4.02Å
281	Q	87.3	Confident	79.9	Confident	89 Å²	89	38.4 Å²	38.4	42%	0.416	20%	0.197	S	C	.	.	H	α-helix	trans	-68.4	-41.6	177.3	-71.3	165.5	-46.4	0	0	111.7	R277 S278 I279 N284 D285	R277-Q281 HydrophobicContact CB-CB 4.04Å; R277-Q281 VanDerWaalsContact CB-OE1 3.31Å; S278-Q281 WeakPolarHBondContact O-CB 3.4Å; S278-Q281 PolarHBondContact O-N 2.74Å; S278-Q281 PolarHBondContact OG-N 2.92Å; S278-Q281 PolarHBondContact OG-OE1 2.75Å; S278-Q281 VanDerWaalsContact OG-OE1 3.1Å; I279-Q281 VanDerWaalsContact C-N 3.29Å; I279-Q281 PolarHBondContact O-N 2.8Å; Q281-N284 PolarHBondContact O-N 2.88Å; Q281-D285 PolarHBondContact O-N 2.6Å
282	C	88.3	Confident	81.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.4	-40.7	177.1	-61.9	0	0	0	0	112.6	C272 S278 I279 D285 F286 W754	C272-C282 HydrophobicContact CB-CB 4.34Å; S278-C282 PolarHBondContact O-N 2.83Å; S278-C282 VanDerWaalsContact O-N 3.15Å; I279-C282 PolarHBondContact O-N 2.72Å; I279-C282 VanDerWaalsContact O-N 3.15Å; C282-D285 PolarHBondContact O-N 3.06Å; C282-F286 PolarHBondContact O-N 3.22Å; C282-W754 HydrophobicContact CB-CB 4Å; C282-W754 HydrophobicContact CB-CD2 3.92Å; C282-W754 HydrophobicContact CB-CE3 4.27Å; C282-W754 HydrophobicContact CB-CG 3.79Å
283	V	92.4	Very high	83.3	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-70.7	-31.8	176.2	174.2	0	0	0	0	111.7	M264 I279 F286 R287 F312 P314 W754	M264-V283 HydrophobicContact CB-CG2 3.99Å; M264-V283 HydrophobicContact CG-CG2 4.36Å; M264-V283 HydrophobicContact SD-CB 4.34Å; M264-V283 HydrophobicContact SD-CG1 3.9Å; M264-V283 HydrophobicContact SD-CG2 3.71Å; I279-V283 HydrophobicContact CD1-CG2 4.43Å; I279-V283 HydrophobicContact CG1-CG2 3.84Å; I279-V283 WeakPolarHBondContact O-CB 3.44Å; I279-V283 WeakPolarHBondContact O-CG2 3.41Å; I279-V283 PolarHBondContact O-N 2.7Å; V283-F286 PolarHBondContact O-N 3.46Å; V283-R287 WeakPolarHBondContact O-CB 3.34Å; V283-R287 PolarHBondContact O-N 2.65Å; V283-F312 HydrophobicContact CG1-CB 3.72Å; V283-F312 VanDerWaalsContact CG1-O 3.3Å; V283-F312 WeakPolarHBondContact CG1-O 3.27Å; V283-P314 HydrophobicContact CB-CB 4.21Å; V283-P314 HydrophobicContact CG1-CB 4.47Å; V283-P314 HydrophobicContact CG2-CB 3.95Å; V283-W754 HydrophobicContact CG2-CE3 4.42Å; V283-W754 HydrophobicContact CG2-CZ3 3.97Å
284	N	91.1	Very high	84.9	Confident	31 Å²	31	40.6 Å²	40.6	17%	0.166	21%	0.211	C	C	.	.	H	α-helix	trans	-67	-40	172.5	-71.6	-19.8	0	0	0	112.6	V280 Q281 R287 S288	V280-N284 WeakPolarHBondContact O-CB 3.41Å; V280-N284 PolarHBondContact O-N 2.9Å; V280-N284 PolarHBondContact O-ND2 3.03Å; Q281-N284 PolarHBondContact O-N 2.88Å; N284-R287 PolarHBondContact O-N 3.45Å; N284-R287 PolarHBondContact OD1-NH1 3.48Å; N284-S288 PolarHBondContact O-N 2.9Å; N284-S288 PolarHBondContact O-OG 3.4Å
285	D	90.3	Very high	86.5	Confident	46 Å²	46	38.8 Å²	38.8	25%	0.246	21%	0.208	C	C	.	.	H	α-helix	trans	-62.2	-47.2	171.3	-72.6	12	0	0	0	110.3	R275 R277 Q281 C282 R287 S288 V289	R275-D285 IonicContact CZ-OD2 3.87Å; R275-D285 IonicContact NH2-OD2 3.76Å; R275-D285 PolarHBondContact NH2-OD2 3.36Å; R277-D285 IonicContact CZ-OD2 3.71Å; R277-D285 VanDerWaalsContact NH1-CG 3.27Å; R277-D285 IonicContact NH1-OD1 3.11Å; R277-D285 PolarHBondContact NH1-OD1 2.89Å; R277-D285 IonicContact NH1-OD2 3.75Å; R277-D285 PolarHBondContact NH1-OD2 3.09Å; R277-D285 IonicContact NH2-OD2 3.39Å; R277-D285 PolarHBondContact NH2-OD2 2.84Å; Q281-D285 PolarHBondContact O-N 2.6Å; C282-D285 PolarHBondContact O-N 3.06Å; D285-R287 VanDerWaalsContact C-N 3.35Å; D285-R287 PolarHBondContact O-N 2.93Å; D285-S288 WeakPolarHBondContact O-CB 3.48Å; D285-S288 PolarHBondContact O-N 3.44Å; D285-S288 VanDerWaalsContact O-N 3.1Å; D285-V289 PolarHBondContact O-N 2.98Å
286	F	92.8	Very high	88	Confident	1 Å²	1	33.7 Å²	33.7	0%	0.004	19%	0.193	C	C	.	.	H	α-helix	trans	-60	-40.4	178.4	-165.6	-90.9	0	0	0	112.7	M264 C282 V283 V289 S290 F312 F575 W754 A760 L763	M264-F286 HydrophobicContact CE-CD1 3.89Å; M264-F286 HydrophobicContact CE-CD2 4.43Å; M264-F286 HydrophobicContact CE-CE1 3.99Å; M264-F286 HydrophobicContact CE-CG 4.12Å; M264-F286 HydrophobicContact CE-CZ 4.29Å; M264-F286 HydrophobicContact SD-CD1 4.19Å; C282-F286 PolarHBondContact O-N 3.22Å; V283-F286 PolarHBondContact O-N 3.46Å; F286-V289 PolarHBondContact O-N 3.11Å; F286-S290 VanDerWaalsContact O-CB 3.3Å; F286-S290 WeakPolarHBondContact O-CB 3.2Å; F286-S290 PolarHBondContact O-N 3.04Å; F286-F312 AromaticContact CD1-CD1 3.97Å; F286-F312 HydrophobicContact CD1-CD1 3.97Å; F286-F312 AromaticContact CD1-CE1 3.9Å; F286-F312 HydrophobicContact CD1-CE1 3.9Å; F286-F312 HydrophobicContact CD1-CE2 4.43Å; F286-F312 HydrophobicContact CD1-CG 4.3Å; F286-F312 HydrophobicContact CD1-CZ 4.13Å; F286-F312 AromaticContact CE1-CD1 3.99Å; F286-F312 HydrophobicContact CE1-CD1 3.99Å; F286-F312 AromaticContact CE1-CE1 3.5Å; F286-F312 HydrophobicContact CE1-CE1 3.5Å; F286-F312 VanDerWaalsContact CE1-CE1 3.5Å; F286-F312 AromaticContact CE1-CZ 3.79Å; F286-F312 HydrophobicContact CE1-CZ 3.79Å; F286-F575 HydrophobicContact CE2-CE2 4.29Å; F286-F575 HydrophobicContact CE2-CZ 4.48Å; F286-F575 HydrophobicContact CZ-CZ 4.42Å; F286-W754 WeakPolarHBondContact CD2-O 3.4Å; F286-A760 HydrophobicContact CD2-CB 4.46Å; F286-A760 HydrophobicContact CE1-CB 4.37Å; F286-A760 HydrophobicContact CE2-CB 3.82Å; F286-A760 HydrophobicContact CZ-CB 3.78Å; F286-L763 HydrophobicContact CE1-CD1 4.49Å; F286-L763 HydrophobicContact CZ-CD1 4.33Å
287	R	94.1	Very high	89.1	Confident	5 Å²	5	27.1 Å²	27.1	2%	0.019	16%	0.164	C	C	.	.	H	α-helix	trans	-64	-41.6	173.6	-169.9	-172.5	-60.6	94	-2.5	111.8	R133 V283 N284 D285 S290 L291 E311 F312	R133-R287 VanDerWaalsContact CD-CZ 3.46Å; R133-R287 VanDerWaalsContact NH1-NE 3.12Å; V283-R287 WeakPolarHBondContact O-CB 3.34Å; V283-R287 PolarHBondContact O-N 2.65Å; N284-R287 PolarHBondContact O-N 3.45Å; N284-R287 PolarHBondContact OD1-NH1 3.48Å; D285-R287 VanDerWaalsContact C-N 3.35Å; D285-R287 PolarHBondContact O-N 2.93Å; R287-S290 WeakPolarHBondContact O-CB 3.35Å; R287-S290 PolarHBondContact O-N 3.49Å; R287-L291 HydrophobicContact CG-CD1 4.14Å; R287-L291 WeakPolarHBondContact O-CG 3.43Å; R287-L291 PolarHBondContact O-N 3.5Å; R287-E311 IonicContact CZ-OE1 2.95Å; R287-E311 IonicContact NE-OE1 2.8Å; R287-E311 PolarHBondContact NE-OE1 2.99Å; R287-E311 IonicContact NE-OE2 3.21Å; R287-E311 IonicContact NH2-OE1 3.94Å; R287-E311 PolarHBondContact NH2-OE1 3.45Å; R287-F312 HydrophobicContact CB-CD2 4.29Å; R287-F312 HydrophobicContact CG-CD2 4.28Å; R287-F312 PolarHBondContact NH2-O 2.87Å
288	S	91.5	Very high	89.8	Confident	78 Å²	78	25.6 Å²	25.6	55%	0.545	16%	0.159	S	C	.	.	H	α-helix	trans	-63.4	-43.4	178.5	-54.8	0	0	0	0	111.4	N284 D285 L291 S292	N284-S288 PolarHBondContact O-N 2.9Å; N284-S288 PolarHBondContact O-OG 3.4Å; D285-S288 WeakPolarHBondContact O-CB 3.48Å; D285-S288 PolarHBondContact O-N 3.44Å; D285-S288 VanDerWaalsContact O-N 3.1Å; S288-L291 PolarHBondContact O-N 3.23Å; S288-S292 PolarHBondContact O-N 3.3Å; S288-S292 VanDerWaalsContact O-N 3.15Å
289	V	92.3	Very high	90	Very high	31 Å²	31	29.1 Å²	29.1	19%	0.188	17%	0.165	C	C	.	.	H	α-helix	trans	-60.4	-48	171.5	167.7	0	0	0	0	110.7	D285 F286 L291 S292 L293 E757 A760	D285-V289 PolarHBondContact O-N 2.98Å; F286-V289 PolarHBondContact O-N 3.11Å; V289-L291 PolarHBondContact O-N 2.9Å; V289-S292 WeakPolarHBondContact O-CB 3.35Å; V289-S292 PolarHBondContact O-N 2.67Å; V289-L293 HydrophobicContact CG1-CD1 3.75Å; V289-L293 HydrophobicContact CG1-CG 4.32Å; V289-L293 WeakPolarHBondContact O-CG 3.3Å; V289-L293 PolarHBondContact O-N 3.24Å; V289-E757 HydrophobicContact CG1-CB 4.3Å; V289-E757 HydrophobicContact CG1-CG 3.9Å; V289-A760 HydrophobicContact CG1-CB 3.8Å
290	S	93.6	Very high	89.9	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.007	19%	0.19	C	C	.	.	H	α-helix	trans	-56.2	-46.9	178.4	176.6	0	0	0	0	112.6	F286 R287 L293 L294 F312 L764	F286-S290 VanDerWaalsContact O-CB 3.3Å; F286-S290 WeakPolarHBondContact O-CB 3.2Å; F286-S290 PolarHBondContact O-N 3.04Å; R287-S290 WeakPolarHBondContact O-CB 3.35Å; R287-S290 PolarHBondContact O-N 3.49Å; S290-L293 PolarHBondContact O-N 2.95Å; S290-L294 WeakPolarHBondContact O-CG 3.45Å; S290-L294 PolarHBondContact O-N 3.26Å; S290-F312 WeakPolarHBondContact OG-CE2 3.34Å; S290-L764 WeakPolarHBondContact OG-CD2 3.47Å
291	L	92.2	Very high	89.8	Confident	35 Å²	35	35.8 Å²	35.8	18%	0.183	19%	0.191	C	C	.	.	H	α-helix	trans	-63.9	-40.9	178.7	-70.2	163.7	0	0	0	112.1	E254 R287 S288 V289 L293 L294 A295 R309	E254-L291 HydrophobicContact CG-CD1 3.73Å; R287-L291 HydrophobicContact CG-CD1 4.14Å; R287-L291 WeakPolarHBondContact O-CG 3.43Å; R287-L291 PolarHBondContact O-N 3.5Å; S288-L291 PolarHBondContact O-N 3.23Å; V289-L291 PolarHBondContact O-N 2.9Å; L291-L293 VanDerWaalsContact C-N 3.33Å; L291-L293 PolarHBondContact O-N 3.48Å; L291-L294 PolarHBondContact O-N 2.92Å; L291-A295 PolarHBondContact O-N 3.15Å; L291-R309 HydrophobicContact CD2-CB 4.12Å
292	S	91.3	Very high	89.7	Confident	76 Å²	76	34.1 Å²	34.1	53%	0.531	18%	0.183	S	C	.	.	H	α-helix	trans	-61.9	-40.1	173.9	-175.3	0	0	0	0	112.3	S288 V289 A295 S296	S288-S292 PolarHBondContact O-N 3.3Å; S288-S292 VanDerWaalsContact O-N 3.15Å; V289-S292 WeakPolarHBondContact O-CB 3.35Å; V289-S292 PolarHBondContact O-N 2.67Å; S292-A295 PolarHBondContact O-N 2.8Å; S292-S296 PolarHBondContact O-N 2.9Å; S292-S296 PolarHBondContact O-OG 2.98Å
293	L	90.5	Very high	89.5	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-67.9	-38.1	175.7	-69.4	171.2	0	0	0	112	V289 S290 L291 S296 H297 H635 A760 L761 L764	V289-L293 HydrophobicContact CG1-CD1 3.75Å; V289-L293 HydrophobicContact CG1-CG 4.32Å; V289-L293 WeakPolarHBondContact O-CG 3.3Å; V289-L293 PolarHBondContact O-N 3.24Å; S290-L293 PolarHBondContact O-N 2.95Å; L291-L293 VanDerWaalsContact C-N 3.33Å; L291-L293 PolarHBondContact O-N 3.48Å; L293-S296 WeakPolarHBondContact CA-OG 3.35Å; L293-S296 PolarHBondContact O-N 2.65Å; L293-S296 PolarHBondContact O-OG 3.04Å; L293-S296 VanDerWaalsContact O-OG 3.11Å; L293-H297 WeakPolarHBondContact O-CB 3.39Å; L293-H297 PolarHBondContact O-N 2.86Å; L293-H635 HydrophobicContact CD2-CB 4.14Å; L293-A760 HydrophobicContact CD1-CB 3.7Å; L293-L761 HydrophobicContact CB-CD1 4.26Å; L293-L761 HydrophobicContact CD1-CB 4.04Å; L293-L761 HydrophobicContact CD1-CD1 4.45Å; L293-L761 HydrophobicContact CD2-CD1 4.27Å; L293-L764 HydrophobicContact CB-CD1 3.8Å; L293-L764 HydrophobicContact CD1-CD1 4.36Å
294	L	90.6	Very high	89.1	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.8	-46.9	172.9	-69.1	174.8	0	0	0	111.8	S290 L291 S296 Y298 V307 L764 Y768	S290-L294 WeakPolarHBondContact O-CG 3.45Å; S290-L294 PolarHBondContact O-N 3.26Å; L291-L294 PolarHBondContact O-N 2.92Å; L294-S296 PolarHBondContact O-N 3.23Å; L294-S296 VanDerWaalsContact O-N 3.13Å; L294-Y298 HydrophobicContact CD2-CD2 3.75Å; L294-Y298 HydrophobicContact CD2-CE2 4.34Å; L294-Y298 HydrophobicContact CD2-CG 4.28Å; L294-Y298 CarbonylContact O-C 3.54Å; L294-Y298 WeakPolarHBondContact O-CA 3.38Å; L294-Y298 PolarHBondContact O-N 2.78Å; L294-V307 HydrophobicContact CD2-CG1 4.14Å; L294-L764 HydrophobicContact CD2-CD1 4.25Å; L294-L764 HydrophobicContact CD2-CD2 4.19Å; L294-L764 HydrophobicContact CG-CD1 4.23Å; L294-L764 HydrophobicContact CG-CD2 4.45Å; L294-Y768 HydrophobicContact CD2-CD2 4.19Å; L294-Y768 HydrophobicContact CD2-CE2 3.54Å
295	A	87.9	Confident	88.7	Confident	43 Å²	43	48 Å²	48	36%	0.355	26%	0.261	S	S	.	.	H	α-helix	trans	-65.9	-13.6	178.6	0	0	0	0	0	114.6	L291 S292 R299	L291-A295 PolarHBondContact O-N 3.15Å; S292-A295 PolarHBondContact O-N 2.8Å; A295-R299 PolarHBondContact O-NE 3.09Å; A295-R299 VanDerWaalsContact O-NE 3.1Å; A295-R299 PolarHBondContact O-NH2 3.32Å
296	S	87.3	Confident	88.4	Confident	31 Å²	31	51.5 Å²	51.5	22%	0.217	28%	0.276	C	S	.	.	H	α-helix	trans	-107.9	-36.2	179.3	50.1	0	0	0	0	114.4	S292 L293 L294	S292-S296 PolarHBondContact O-N 2.9Å; S292-S296 PolarHBondContact O-OG 2.98Å; L293-S296 WeakPolarHBondContact CA-OG 3.35Å; L293-S296 PolarHBondContact O-N 2.65Å; L293-S296 PolarHBondContact O-OG 3.04Å; L293-S296 VanDerWaalsContact O-OG 3.11Å; L294-S296 PolarHBondContact O-N 3.23Å; L294-S296 VanDerWaalsContact O-N 3.13Å
297	H	86.9	Confident	88.1	Confident	5 Å²	5	51.7 Å²	51.7	2%	0.023	28%	0.277	C	S	.	.	H	α-helix	trans	-107	-10.8	-175	-71.1	-84.6	0	0	0	115.5	L293 H635 L761 F775 E776 P778	L293-H297 WeakPolarHBondContact O-CB 3.39Å; L293-H297 PolarHBondContact O-N 2.86Å; H297-H635 PolarHBondContact CE1-O 2.77Å; H297-H635 PolarHBondContact NE2-O 3.49Å; H297-L761 HydrophobicContact CB-CD1 4.2Å; H297-F775 HydrophobicContact CB-CE2 4.11Å; H297-F775 AromaticContact CE1-CZ 3.98Å; H297-F775 AromaticContact ND1-CE2 3.64Å; H297-F775 AromaticContact ND1-CZ 3.39Å; H297-F775 WeakPolarHBondContact ND1-CZ 3.43Å; H297-E776 WeakPolarHBondContact CA-O 3.37Å; H297-E776 PolarHBondContact ND1-O 3.11Å; H297-E776 WeakPolarHBondContact O-CA 3.03Å; H297-E776 WeakPolarHBondContact O-CB 3.27Å; H297-E776 PolarHBondContact O-N 3.34Å; H297-P778 VanDerWaalsContact CE1-CD 3.44Å; H297-P778 WeakPolarHBondContact CE1-CD 3.22Å
298	Y	87.9	Confident	87.9	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.278	C	S	.	.	S	Bend	trans	-133.2	23.9	-179.6	-66	-86	0	0	0	111.9	L294 R300 S301 Q302 R765 Y768 V773 F775	L294-Y298 HydrophobicContact CD2-CD2 3.75Å; L294-Y298 HydrophobicContact CD2-CE2 4.34Å; L294-Y298 HydrophobicContact CD2-CG 4.28Å; L294-Y298 CarbonylContact O-C 3.54Å; L294-Y298 WeakPolarHBondContact O-CA 3.38Å; L294-Y298 PolarHBondContact O-N 2.78Å; Y298-R300 VanDerWaalsContact C-N 3.35Å; Y298-R300 PolarHBondContact O-N 2.89Å; Y298-S301 PolarHBondContact O-N 3.07Å; Y298-S301 VanDerWaalsContact O-N 3.16Å; Y298-Q302 WeakPolarHBondContact O-CB 3.22Å; Y298-Q302 PolarHBondContact O-N 3.48Å; Y298-R765 WeakPolarHBondContact OH-CA 3.41Å; Y298-Y768 HydrophobicContact CE1-CG 4.18Å; Y298-Y768 HydrophobicContact CE2-CD2 4.42Å; Y298-V773 HydrophobicContact CD1-CG1 3.93Å; Y298-V773 HydrophobicContact CE1-CG1 4.21Å; Y298-F775 HydrophobicContact CE2-CD2 4.27Å; Y298-F775 AromaticContact CZ-CD2 3.95Å
299	R	85.6	Confident	88	Confident	117 Å²	117	48.1 Å²	48.1	44%	0.442	25%	0.253	S	S	.	.	H	α-helix	trans	-56.1	-43.7	-169.3	-174.8	-179.3	-60	123.9	2.9	113	A295 Q303 E776	A295-R299 PolarHBondContact O-NE 3.09Å; A295-R299 VanDerWaalsContact O-NE 3.1Å; A295-R299 PolarHBondContact O-NH2 3.32Å; R299-Q303 WeakPolarHBondContact O-CB 3.32Å; R299-Q303 VanDerWaalsContact O-CG 3.28Å; R299-Q303 WeakPolarHBondContact O-CG 3.31Å; R299-Q303 PolarHBondContact O-N 3.21Å; R299-E776 PolarHBondContact N-OE2 2.9Å
300	R	85.3	Confident	88.1	Confident	143 Å²	143	46.8 Å²	46.8	54%	0.54	25%	0.245	S	C	.	.	H	α-helix	trans	-64.9	-50.9	178.6	-176	-176.1	-68.2	124.6	-6.6	110.7	Y298 Q302 Q303 E304 E776	Y298-R300 VanDerWaalsContact C-N 3.35Å; Y298-R300 PolarHBondContact O-N 2.89Å; R300-Q302 PolarHBondContact O-N 2.84Å; R300-Q303 PolarHBondContact O-N 3.33Å; R300-Q303 VanDerWaalsContact O-N 3.12Å; R300-E304 HydrophobicContact CG-CG 4.44Å; R300-E304 VanDerWaalsContact CG-OE1 3.27Å; R300-E304 WeakPolarHBondContact CG-OE1 3.45Å; R300-E304 WeakPolarHBondContact O-CG 3.35Å; R300-E304 PolarHBondContact O-N 3.2Å; R300-E776 VanDerWaalsContact CB-OE1 3.26Å; R300-E776 WeakPolarHBondContact CB-OE1 3.23Å; R300-E776 WeakPolarHBondContact CB-OE2 3.22Å; R300-E776 IonicContact CZ-OE1 3.27Å; R300-E776 PolarHBondContact N-OE2 3.02Å; R300-E776 IonicContact NE-OE1 2.65Å; R300-E776 IonicContact NH1-OE1 3.79Å; R300-E776 PolarHBondContact NH1-OE1 3.08Å
301	S	85.8	Confident	88.3	Confident	15 Å²	15	46.8 Å²	46.8	11%	0.105	25%	0.245	C	C	.	.	H	α-helix	trans	-60.3	-33.4	-179.8	-48.3	0	0	0	0	112.5	Y298 G305 H306 V307	Y298-S301 PolarHBondContact O-N 3.07Å; Y298-S301 VanDerWaalsContact O-N 3.16Å; S301-G305 PolarHBondContact O-N 3.19Å; S301-H306 WeakPolarHBondContact O-CB 3.33Å; S301-H306 PolarHBondContact O-N 2.94Å; S301-V307 PolarHBondContact O-N 2.84Å; S301-V307 VanDerWaalsContact O-N 3.12Å
302	Q	85.1	Confident	88.5	Confident	54 Å²	54	45.1 Å²	45.1	25%	0.252	24%	0.236	S	C	.	.	H	α-helix	trans	-72.2	-43.8	174.2	-168.7	176.2	47.5	0	0	112	Y298 R300 E304 G305 V307	Y298-Q302 WeakPolarHBondContact O-CB 3.22Å; Y298-Q302 PolarHBondContact O-N 3.48Å; R300-Q302 PolarHBondContact O-N 2.84Å; Q302-E304 VanDerWaalsContact C-N 3.27Å; Q302-E304 PolarHBondContact O-N 3.38Å; Q302-G305 PolarHBondContact O-N 2.83Å; Q302-G305 VanDerWaalsContact O-N 3.08Å; Q302-V307 HydrophobicContact CB-CB 4.4Å
303	Q	84.7	Confident	88.8	Confident	155 Å²	155	41.5 Å²	41.5	72%	0.724	21%	0.211	S	C	*	.	H	α-helix	trans	-64.3	-30.4	174.8	-74.8	175.9	-4.8	0	0	113.3	R299 R300 G305	R299-Q303 WeakPolarHBondContact O-CB 3.32Å; R299-Q303 VanDerWaalsContact O-CG 3.28Å; R299-Q303 WeakPolarHBondContact O-CG 3.31Å; R299-Q303 PolarHBondContact O-N 3.21Å; R300-Q303 PolarHBondContact O-N 3.33Å; R300-Q303 VanDerWaalsContact O-N 3.12Å; Q303-G305 VanDerWaalsContact C-N 3.3Å
304	E	85.1	Confident	89	Confident	116 Å²	116	41.4 Å²	41.4	54%	0.542	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-3.7	174.7	-67.7	174.4	-174.2	0	0	113.4	R300 Q302 H306	R300-E304 HydrophobicContact CG-CG 4.44Å; R300-E304 VanDerWaalsContact CG-OE1 3.27Å; R300-E304 WeakPolarHBondContact CG-OE1 3.45Å; R300-E304 WeakPolarHBondContact O-CG 3.35Å; R300-E304 PolarHBondContact O-N 3.2Å; Q302-E304 VanDerWaalsContact C-N 3.27Å; Q302-E304 PolarHBondContact O-N 3.38Å; E304-H306 VanDerWaalsContact C-N 3.26Å; E304-H306 WeakPolarHBondContact CB-ND1 3.3Å; E304-H306 PolarHBondContact O-N 3.05Å; E304-H306 IonicContact OE2-CE1 3.13Å; E304-H306 IonicContact OE2-ND1 3.35Å; E304-H306 PolarHBondContact OE2-ND1 3.49Å
305	G	82.1	Confident	89.1	Confident	52 Å²	52	41.4 Å²	41.4	54%	0.536	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	75	8.6	-179.4	0	0	0	0	0	115.1	S301 Q302 Q303	S301-G305 PolarHBondContact O-N 3.19Å; Q302-G305 PolarHBondContact O-N 2.83Å; Q302-G305 VanDerWaalsContact O-N 3.08Å; Q303-G305 VanDerWaalsContact C-N 3.3Å
306	H	83.4	Confident	89	Confident	120 Å²	120	42.1 Å²	42.1	56%	0.556	21%	0.208	S	C	*	.	S	Bend	trans	-74.7	-27.8	174.9	-67	111.9	0	0	0	112.5	S301 E304	S301-H306 WeakPolarHBondContact O-CB 3.33Å; S301-H306 PolarHBondContact O-N 2.94Å; E304-H306 VanDerWaalsContact C-N 3.26Å; E304-H306 WeakPolarHBondContact CB-ND1 3.3Å; E304-H306 PolarHBondContact O-N 3.05Å; E304-H306 IonicContact OE2-CE1 3.13Å; E304-H306 IonicContact OE2-ND1 3.35Å; E304-H306 PolarHBondContact OE2-ND1 3.49Å
307	V	87.2	Confident	88.9	Confident	5 Å²	5	40.7 Å²	40.7	3%	0.03	20%	0.198	C	C	.	.			trans	-117.7	122.2	178.7	171.1	0	0	0	0	110.1	L294 S301 Q302 Y768 V773	L294-V307 HydrophobicContact CD2-CG1 4.14Å; S301-V307 PolarHBondContact O-N 2.84Å; S301-V307 VanDerWaalsContact O-N 3.12Å; Q302-V307 HydrophobicContact CB-CB 4.4Å; V307-Y768 HydrophobicContact CB-CE1 4.3Å; V307-Y768 HydrophobicContact CG1-CE1 3.8Å; V307-Y768 HydrophobicContact CG2-CD1 4.03Å; V307-Y768 HydrophobicContact CG2-CE1 3.83Å; V307-V773 HydrophobicContact CG2-CG1 3.73Å; V307-V773 HydrophobicContact CG2-CG2 4.27Å
308	G	89.4	Confident	88.3	Confident	4 Å²	4	41.2 Å²	41.2	4%	0.041	20%	0.2	C	C	.	.			trans	-96	-110.3	168.4	0	0	0	0	0	110.8	K257 D259	K257-G308 WeakPolarHBondContact O-CA 3.33Å; D259-G308 PolarHBondContact OD2-N 3.17Å
309	R	93.4	Very high	87.4	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.015	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	159.6	177.1	64.5	-178.3	176.7	121.6	16.6	113.2	G131 E254 P255 K257 V258 D259 L291 E311	G131-R309 PolarHBondContact O-NH2 2.99Å; E254-R309 IonicContact OE2-CZ 3.21Å; E254-R309 IonicContact OE2-NH1 3.45Å; E254-R309 PolarHBondContact OE2-NH1 2.9Å; P255-R309 WeakPolarHBondContact O-CD 3.38Å; P255-R309 WeakPolarHBondContact O-CG 3.42Å; P255-R309 PolarHBondContact O-NE 3Å; K257-R309 PolarHBondContact O-N 3.44Å; V258-R309 CarbonylContact C-O 3.52Å; V258-R309 WeakPolarHBondContact CA-O 3.43Å; V258-R309 HydrophobicContact CG2-CG 4.29Å; D259-R309 PolarHBondContact N-O 3.37Å; L291-R309 HydrophobicContact CD2-CB 4.12Å; R309-E311 IonicContact CZ-OE2 3.16Å; R309-E311 IonicContact NH1-OE2 3.17Å; R309-E311 PolarHBondContact NH1-OE2 3.17Å; R309-E311 IonicContact NH2-OE2 2.65Å
310	V	95.8	Very high	86.3	Confident	3 Å²	3	42.1 Å²	42.1	2%	0.018	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	127.7	164.5	-179	0	0	0	0	107.9	H260 V262 F312 L764 I767 Y768	H260-V310 HydrophobicContact CB-CG1 4.27Å; H260-V310 HydrophobicContact CB-CG2 4.22Å; H260-V310 WeakPolarHBondContact O-CA 3.27Å; V262-V310 HydrophobicContact CG2-CG1 3.56Å; V310-F312 HydrophobicContact CB-CE2 3.84Å; V310-F312 HydrophobicContact CB-CZ 3.88Å; V310-F312 HydrophobicContact CG1-CD2 4.42Å; V310-F312 HydrophobicContact CG1-CE1 3.92Å; V310-F312 HydrophobicContact CG1-CE2 3.76Å; V310-F312 HydrophobicContact CG1-CZ 3.47Å; V310-F312 VanDerWaalsContact CG1-CZ 3.47Å; V310-F312 WeakPolarHBondContact O-CD2 3.44Å; V310-F312 WeakPolarHBondContact O-CE2 3.34Å; V310-L764 HydrophobicContact CB-CD2 4.28Å; V310-L764 HydrophobicContact CG2-CD2 3.74Å; V310-I767 HydrophobicContact CG1-CD1 4Å; V310-I767 HydrophobicContact CG2-CD1 4.31Å; V310-I767 HydrophobicContact CG2-CG2 4.16Å; V310-Y768 HydrophobicContact CG2-CE2 3.75Å
311	E	96.4	Very high	85.2	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	137	175.9	-175.8	52.6	-96.5	0	0	110.5	R133 V258 H260 L261 V262 R287 R309 L313 F381	R133-E311 IonicContact CZ-OE2 2.74Å; R133-E311 IonicContact NH1-OE1 2.68Å; R133-E311 IonicContact NH1-OE2 3.76Å; R133-E311 PolarHBondContact NH1-OE2 2.83Å; V258-E311 HydrophobicContact CG1-CB 3.69Å; V258-E311 HydrophobicContact CG2-CB 4.32Å; H260-E311 PolarHBondContact O-N 3.48Å; L261-E311 HydrophobicContact CD1-CB 4.27Å; L261-E311 HydrophobicContact CD1-CG 4.35Å; V262-E311 PolarHBondContact N-O 3.24Å; R287-E311 IonicContact CZ-OE1 2.95Å; R287-E311 IonicContact NE-OE1 2.8Å; R287-E311 PolarHBondContact NE-OE1 2.99Å; R287-E311 IonicContact NE-OE2 3.21Å; R287-E311 IonicContact NH2-OE1 3.94Å; R287-E311 PolarHBondContact NH2-OE1 3.45Å; R309-E311 IonicContact CZ-OE2 3.16Å; R309-E311 IonicContact NH1-OE2 3.17Å; R309-E311 PolarHBondContact NH1-OE2 3.17Å; R309-E311 IonicContact NH2-OE2 2.65Å; E311-L313 HydrophobicContact CG-CD2 4.19Å; E311-L313 HydrophobicContact CG-CG 4.47Å; E311-F381 HydrophobicContact CB-CE2 4.4Å; E311-F381 HydrophobicContact CG-CE2 4.15Å
312	F	96.9	Very high	83.9	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	106.7	-174.6	-62.7	-85.8	0	0	0	109.5	V262 M264 V283 F286 R287 S290 V310 L763	V262-F312 HydrophobicContact CB-CD1 3.63Å; V262-F312 HydrophobicContact CB-CE1 3.91Å; V262-F312 HydrophobicContact CB-CG 4.5Å; V262-F312 HydrophobicContact CG1-CD1 3.88Å; V262-F312 HydrophobicContact CG1-CE1 4.11Å; V262-F312 HydrophobicContact CG2-CD1 4.12Å; V262-F312 HydrophobicContact CG2-CE1 3.87Å; V262-F312 CarbonylContact O-C 3.59Å; V262-F312 WeakPolarHBondContact O-CA 3.42Å; M264-F312 HydrophobicContact CE-CD1 4.49Å; M264-F312 HydrophobicContact CG-CB 4.48Å; M264-F312 HydrophobicContact CG-CD1 4.34Å; M264-F312 HydrophobicContact SD-CB 3.92Å; M264-F312 HydrophobicContact SD-CD1 3.75Å; M264-F312 HydrophobicContact SD-CG 4.19Å; V283-F312 HydrophobicContact CG1-CB 3.72Å; V283-F312 VanDerWaalsContact CG1-O 3.3Å; V283-F312 WeakPolarHBondContact CG1-O 3.27Å; F286-F312 AromaticContact CD1-CD1 3.97Å; F286-F312 HydrophobicContact CD1-CD1 3.97Å; F286-F312 AromaticContact CD1-CE1 3.9Å; F286-F312 HydrophobicContact CD1-CE1 3.9Å; F286-F312 HydrophobicContact CD1-CE2 4.43Å; F286-F312 HydrophobicContact CD1-CG 4.3Å; F286-F312 HydrophobicContact CD1-CZ 4.13Å; F286-F312 AromaticContact CE1-CD1 3.99Å; F286-F312 HydrophobicContact CE1-CD1 3.99Å; F286-F312 AromaticContact CE1-CE1 3.5Å; F286-F312 HydrophobicContact CE1-CE1 3.5Å; F286-F312 VanDerWaalsContact CE1-CE1 3.5Å; F286-F312 AromaticContact CE1-CZ 3.79Å; F286-F312 HydrophobicContact CE1-CZ 3.79Å; R287-F312 HydrophobicContact CB-CD2 4.29Å; R287-F312 HydrophobicContact CG-CD2 4.28Å; R287-F312 PolarHBondContact NH2-O 2.87Å; S290-F312 WeakPolarHBondContact OG-CE2 3.34Å; V310-F312 HydrophobicContact CB-CE2 3.84Å; V310-F312 HydrophobicContact CB-CZ 3.88Å; V310-F312 HydrophobicContact CG1-CD2 4.42Å; V310-F312 HydrophobicContact CG1-CE1 3.92Å; V310-F312 HydrophobicContact CG1-CE2 3.76Å; V310-F312 HydrophobicContact CG1-CZ 3.47Å; V310-F312 VanDerWaalsContact CG1-CZ 3.47Å; V310-F312 WeakPolarHBondContact O-CD2 3.44Å; V310-F312 WeakPolarHBondContact O-CE2 3.34Å; F312-L763 HydrophobicContact CE1-CD2 3.7Å; F312-L763 HydrophobicContact CZ-CD2 3.89Å
313	L	96.7	Very high	82.5	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	121.2	-180	-65.1	-174.9	0	0	0	110.8	Y147 L261 V262 F263 M264 E311 F381	Y147-L313 HydrophobicContact CD1-CD1 3.84Å; Y147-L313 HydrophobicContact CD1-CD2 4.05Å; Y147-L313 HydrophobicContact CD2-CD2 3.84Å; Y147-L313 HydrophobicContact CE1-CD1 3.9Å; Y147-L313 HydrophobicContact CE1-CD2 4.34Å; Y147-L313 HydrophobicContact CE2-CD2 4.14Å; Y147-L313 HydrophobicContact CG-CD1 4.42Å; Y147-L313 HydrophobicContact CG-CD2 3.8Å; L261-L313 HydrophobicContact CD1-CD1 3.88Å; L261-L313 HydrophobicContact CD1-CG 3.94Å; V262-L313 PolarHBondContact O-N 3.44Å; F263-L313 HydrophobicContact CD1-CB 3.97Å; F263-L313 HydrophobicContact CE1-CB 4.07Å; F263-L313 HydrophobicContact CE1-CD1 3.86Å; M264-L313 PolarHBondContact N-O 2.71Å; E311-L313 HydrophobicContact CG-CD2 4.19Å; E311-L313 HydrophobicContact CG-CG 4.47Å; L313-F381 HydrophobicContact CD1-CB 4.17Å; L313-F381 HydrophobicContact CD1-CD2 4.12Å; L313-F381 HydrophobicContact CD1-CG 4.43Å
314	P	94.7	Very high	80.9	Confident	2 Å²	2	35.4 Å²	35.4	1%	0.013	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	128	174.9	30	-33.1	0	0	0	109.9	W148 I279 V280 V283 N316	W148-P314 HydrophobicContact CD2-CG 4.35Å; W148-P314 HydrophobicContact CE3-CG 3.57Å; W148-P314 HydrophobicContact CZ3-CG 3.91Å; I279-P314 HydrophobicContact CD1-CB 3.84Å; I279-P314 HydrophobicContact CG1-CB 3.75Å; I279-P314 HydrophobicContact CG2-CB 4.29Å; V280-P314 HydrophobicContact CG2-CB 4.37Å; V280-P314 HydrophobicContact CG2-CG 4.02Å; V283-P314 HydrophobicContact CB-CB 4.21Å; V283-P314 HydrophobicContact CG1-CB 4.47Å; V283-P314 HydrophobicContact CG2-CB 3.95Å; P314-N316 PolarHBondContact O-N 2.99Å
315	V	92.7	Very high	79.1	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	93.8	173.4	-177.4	0	0	0	0	107.4	F263 M264 V265 H266 E373 V374 L377	F263-V315 HydrophobicContact CB-CG2 4Å; F263-V315 HydrophobicContact CD1-CG2 4.26Å; M264-V315 WeakPolarHBondContact O-CB 3.41Å; M264-V315 PolarHBondContact O-N 3.42Å; V265-V315 HydrophobicContact CG2-CB 3.93Å; V265-V315 HydrophobicContact CG2-CG1 4.17Å; V265-V315 HydrophobicContact CG2-CG2 3.86Å; H266-V315 PolarHBondContact CD2-O 3.47Å; H266-V315 VanDerWaalsContact CD2-O 3.31Å; V315-E373 HydrophobicContact CG1-CB 4.23Å; V315-E373 HydrophobicContact CG1-CG 3.84Å; V315-V374 HydrophobicContact CB-CG2 4.47Å; V315-V374 HydrophobicContact CG1-CG2 3.89Å; V315-V374 HydrophobicContact CG2-CG2 3.73Å; V315-L377 HydrophobicContact CB-CD1 4.49Å; V315-L377 HydrophobicContact CG2-CD1 4.02Å
316	N	87.1	Confident	78.2	Confident	57 Å²	57	35.6 Å²	35.6	31%	0.305	22%	0.224	S	C	.	.			trans	-86.9	115.2	175.8	-176.9	12.4	0	0	0	109.7	I279 P314	I279-N316 HydrophobicContact CG2-CB 4.07Å; P314-N316 PolarHBondContact O-N 2.99Å
317	W	84.4	Confident	77.3	Confident	2 Å²	2	31.1 Å²	31.1	1%	0.008	21%	0.211	C	C	.	.			trans	-131	-15.6	-175.1	65.4	-89.8	0	0	0	113.4	H266 I268 S319 A320 I366 T369 V370 L399 I403	H266-W317 AromaticContact CD2-CD1 3.83Å; H266-W317 AromaticContact CD2-NE1 3.81Å; H266-W317 AromaticContact NE2-CD1 3.79Å; H266-W317 AromaticContact NE2-NE1 3.95Å; H266-W317 PolarHBondContact O-NE1 2.83Å; I268-W317 HydrophobicContact CB-CH2 4.46Å; I268-W317 HydrophobicContact CD1-CH2 3.67Å; I268-W317 HydrophobicContact CD1-CZ3 4.06Å; I268-W317 HydrophobicContact CG1-CH2 3.13Å; I268-W317 HydrophobicContact CG1-CZ2 3.75Å; I268-W317 HydrophobicContact CG1-CZ3 3.63Å; W317-S319 VanDerWaalsContact C-N 3.33Å; W317-S319 PolarHBondContact O-N 2.96Å; W317-A320 WeakPolarHBondContact O-CB 3.36Å; W317-A320 PolarHBondContact O-N 3.13Å; W317-I366 HydrophobicContact CE3-CG2 4.38Å; W317-I366 HydrophobicContact CH2-CG1 4.34Å; W317-I366 HydrophobicContact CH2-CG2 3.56Å; W317-I366 HydrophobicContact CZ2-CG2 4.44Å; W317-I366 HydrophobicContact CZ3-CB 4.24Å; W317-I366 HydrophobicContact CZ3-CD1 4.49Å; W317-I366 HydrophobicContact CZ3-CG1 3.88Å; W317-I366 HydrophobicContact CZ3-CG2 3.61Å; W317-T369 HydrophobicContact CB-CG2 3.96Å; W317-V370 HydrophobicContact CB-CG2 3.9Å; W317-V370 HydrophobicContact CD2-CG2 3.55Å; W317-V370 HydrophobicContact CE3-CG2 4.08Å; W317-V370 HydrophobicContact CG-CG2 3.51Å; W317-V370 HydrophobicContact CZ2-CG2 4.46Å; W317-L399 HydrophobicContact CH2-CD2 4.37Å; W317-I403 HydrophobicContact CH2-CD1 3.54Å; W317-I403 HydrophobicContact CZ2-CD1 3.33Å
318	H	73.9	Confident	76.5	Confident	16 Å²	16	32.2 Å²	32.2	7%	0.074	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-43	-176.7	-178.9	-99	0	0	0	113.7	G269 A320 L321 H322	G269-H318 PolarHBondContact N-CD2 3.44Å; G269-H318 PolarHBondContact N-NE2 3.36Å; G269-H318 VanDerWaalsContact N-NE2 3.19Å; H318-A320 PolarHBondContact O-N 3.43Å; H318-A320 VanDerWaalsContact O-N 3.16Å; H318-L321 PolarHBondContact O-N 3.03Å; H318-H322 AromaticContact CD2-CD2 3.43Å; H318-H322 PolarHBondContact CD2-CD2 2.81Å; H318-H322 VanDerWaalsContact CD2-CD2 3.43Å; H318-H322 WeakPolarHBondContact CE1-CB 3.11Å; H318-H322 AromaticContact CE1-CD2 3.86Å; H318-H322 AromaticContact CE1-CG 3.69Å; H318-H322 AromaticContact NE2-CD2 3.2Å; H318-H322 PolarHBondContact NE2-CD2 3.06Å; H318-H322 AromaticContact NE2-CG 3.41Å; H318-H322 AromaticContact NE2-NE2 3.97Å; H318-H322 PolarHBondContact O-N 3.23Å
319	S	68.9	Low	75.5	Confident	72 Å²	72	34.3 Å²	34.3	50%	0.503	23%	0.227	S	C	.	.	H	α-helix	trans	-58.6	-28	-178.1	51.1	0	0	0	0	113.5	W317 L321 G323	W317-S319 VanDerWaalsContact C-N 3.33Å; W317-S319 PolarHBondContact O-N 2.96Å; S319-L321 VanDerWaalsContact C-N 3.33Å; S319-G323 PolarHBondContact O-N 3.44Å; S319-G323 VanDerWaalsContact O-N 3.1Å
320	A	64.3	Low	74.5	Confident	63 Å²	63	40.4 Å²	40.4	52%	0.521	26%	0.256	S	S	.	.	H	α-helix	trans	-74.5	-21.6	178	0	0	0	0	0	113.5	W317 H318 T369	W317-A320 WeakPolarHBondContact O-CB 3.36Å; W317-A320 PolarHBondContact O-N 3.13Å; H318-A320 PolarHBondContact O-N 3.43Å; H318-A320 VanDerWaalsContact O-N 3.16Å; A320-T369 HydrophobicContact CB-CG2 3.7Å
321	L	61.8	Low	73.5	Confident	9 Å²	9	44.2 Å²	44.2	5%	0.047	28%	0.276	C	S	.	.	H	α-helix	trans	-100.2	-35	179.6	-150.4	83.3	0	0	0	112.4	I268 H318 S319 T326 Y362 T365 I366	I268-L321 HydrophobicContact CD1-CD2 4.08Å; H318-L321 PolarHBondContact O-N 3.03Å; S319-L321 VanDerWaalsContact C-N 3.33Å; L321-T326 WeakPolarHBondContact O-CG2 3.4Å; L321-T326 PolarHBondContact O-OG1 3.42Å; L321-Y362 HydrophobicContact CD1-CD1 4.41Å; L321-T365 HydrophobicContact CD1-CG2 3.83Å; L321-I366 HydrophobicContact CD1-CG1 3.74Å; L321-I366 HydrophobicContact CD2-CD1 3.79Å; L321-I366 HydrophobicContact CD2-CG1 3.72Å; L321-I366 HydrophobicContact CG-CG1 4.38Å
322	H	58.7	Low	72.6	Confident	20 Å²	20	45.3 Å²	45.3	9%	0.093	28%	0.282	C	S	.	.	H	α-helix	trans	-116.7	7.5	-168.8	-69.7	-82.9	0	0	0	114.9	I268 H318 D329 F356	I268-H322 WeakPolarHBondContact CG2-NE2 3.12Å; H318-H322 AromaticContact CD2-CD2 3.43Å; H318-H322 PolarHBondContact CD2-CD2 2.81Å; H318-H322 VanDerWaalsContact CD2-CD2 3.43Å; H318-H322 WeakPolarHBondContact CE1-CB 3.11Å; H318-H322 AromaticContact CE1-CD2 3.86Å; H318-H322 AromaticContact CE1-CG 3.69Å; H318-H322 AromaticContact NE2-CD2 3.2Å; H318-H322 PolarHBondContact NE2-CD2 3.06Å; H318-H322 AromaticContact NE2-CG 3.41Å; H318-H322 AromaticContact NE2-NE2 3.97Å; H318-H322 PolarHBondContact O-N 3.23Å; H322-D329 IonicContact CE1-OD1 2.75Å; H322-D329 IonicContact CG-OD1 2.7Å; H322-D329 IonicContact CG-OD2 3.46Å; H322-D329 IonicContact ND1-OD1 3.92Å; H322-D329 PolarHBondContact ND1-OD1 2.86Å; H322-D329 IonicContact ND1-OD2 3.53Å; H322-F356 AromaticContact CE1-CE2 3.77Å
323	G	54.9	Low	71.6	Confident	29 Å²	29	51.9 Å²	51.9	30%	0.299	31%	0.313	S	S	.	.	S	Bend	trans	-61.1	162.1	169	0	0	0	0	0	112.3	S319 A325 T326	S319-G323 PolarHBondContact O-N 3.44Å; S319-G323 VanDerWaalsContact O-N 3.1Å; G323-A325 PolarHBondContact O-N 3.47Å; G323-T326 PolarHBondContact O-N 2.77Å; G323-T326 VanDerWaalsContact O-N 3.09Å
324	D	50.5	Low	70.9	Confident	169 Å²	169	59.6 Å²	59.6	90%	0.904	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-14.9	-178.8	-50.8	-26.2	0	0	0	115.3
325	A	47	Very low	70.4	Confident	105 Å²	105	66 Å²	66	87%	0.868	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-26.7	176.3	0	0	0	0	0	115.2	G323	G323-A325 PolarHBondContact O-N 3.47Å
326	T	63.2	Low	69.9	Low	66 Å²	66	67.5 Å²	67.5	41%	0.405	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-25.8	-178.5	63.9	0	0	0	0	113.6	L321 G323 V328	L321-T326 WeakPolarHBondContact O-CG2 3.4Å; L321-T326 PolarHBondContact O-OG1 3.42Å; G323-T326 PolarHBondContact O-N 2.77Å; G323-T326 VanDerWaalsContact O-N 3.09Å; T326-V328 PolarHBondContact O-N 2.96Å; T326-V328 VanDerWaalsContact O-N 3.13Å
327	G	64.9	Low	69.8	Low	27 Å²	27	69.7 Å²	69.7	28%	0.278	40%	0.395	S	S	.	.			trans	68.4	0.8	179.9	0	0	0	0	0	115.3	D329 E330 D331	G327-D329 VanDerWaalsContact C-N 3.34Å; G327-D329 PolarHBondContact O-N 3.06Å; G327-E330 PolarHBondContact O-N 2.94Å; G327-D331 PolarHBondContact O-N 3.49Å
328	V	69.9	Low	69.7	Low	28 Å²	28	75 Å²	75	17%	0.17	43%	0.43	C	S	.	.	H	α-helix	trans	-67.8	-34.2	-172.1	178.9	0	0	0	0	111.8	T326 D331 I332 F356	T326-V328 PolarHBondContact O-N 2.96Å; T326-V328 VanDerWaalsContact O-N 3.13Å; V328-D331 WeakPolarHBondContact O-CB 3.35Å; V328-D331 PolarHBondContact O-N 3.32Å; V328-I332 HydrophobicContact CG1-CD1 3.82Å; V328-I332 HydrophobicContact CG1-CG1 4.42Å; V328-I332 VanDerWaalsContact O-CG1 3.3Å; V328-I332 WeakPolarHBondContact O-CG1 3.49Å; V328-I332 PolarHBondContact O-N 3.05Å; V328-F356 HydrophobicContact CG1-CE1 3.89Å; V328-F356 HydrophobicContact CG1-CZ 3.52Å
329	D	69.6	Low	70.2	Confident	47 Å²	47	78.3 Å²	78.3	25%	0.251	46%	0.455	S	S	.	.	H	α-helix	trans	-68.9	-40.6	178.9	-73.4	15.7	0	0	0	112.1	H322 G327 D331 I332 Q333	H322-D329 IonicContact CE1-OD1 2.75Å; H322-D329 IonicContact CG-OD1 2.7Å; H322-D329 IonicContact CG-OD2 3.46Å; H322-D329 IonicContact ND1-OD1 3.92Å; H322-D329 PolarHBondContact ND1-OD1 2.86Å; H322-D329 IonicContact ND1-OD2 3.53Å; G327-D329 VanDerWaalsContact C-N 3.34Å; G327-D329 PolarHBondContact O-N 3.06Å; D329-D331 VanDerWaalsContact C-N 3.3Å; D329-D331 PolarHBondContact O-N 3.21Å; D329-I332 PolarHBondContact O-N 3.04Å; D329-Q333 WeakPolarHBondContact O-CB 3.44Å; D329-Q333 VanDerWaalsContact O-CG 3.25Å; D329-Q333 WeakPolarHBondContact O-CG 3.41Å; D329-Q333 PolarHBondContact O-N 2.93Å
330	E	72.1	Confident	70.7	Confident	132 Å²	132	80.2 Å²	80.2	62%	0.617	46%	0.458	S	S	*	.	H	α-helix	trans	-61.7	-41.2	172.3	-66	-164.5	165	0	0	111.2	G327 Q333 R334	G327-E330 PolarHBondContact O-N 2.94Å; E330-Q333 PolarHBondContact O-N 3.17Å; E330-R334 VanDerWaalsContact O-CB 3.23Å; E330-R334 WeakPolarHBondContact O-CB 3.33Å; E330-R334 PolarHBondContact O-N 3.04Å
331	D	74.9	Confident	71.1	Confident	83 Å²	83	80.1 Å²	80.1	44%	0.444	45%	0.453	S	S	.	.	H	α-helix	trans	-63.2	-44.1	177.1	-80.4	3.1	0	0	0	111.5	G327 V328 D329 R334 I335	G327-D331 PolarHBondContact O-N 3.49Å; V328-D331 WeakPolarHBondContact O-CB 3.35Å; V328-D331 PolarHBondContact O-N 3.32Å; D329-D331 VanDerWaalsContact C-N 3.3Å; D329-D331 PolarHBondContact O-N 3.21Å; D331-R334 PolarHBondContact O-N 3.1Å; D331-R334 IonicContact OD1-CZ 3.14Å; D331-R334 IonicContact OD1-NH1 2.65Å; D331-R334 PolarHBondContact OD1-NH1 2.88Å; D331-R334 IonicContact OD1-NH2 2.65Å; D331-R334 PolarHBondContact OD1-NH2 2.61Å; D331-I335 WeakPolarHBondContact O-CG1 3.2Å; D331-I335 PolarHBondContact O-N 2.77Å
332	I	76.9	Confident	71.5	Confident	24 Å²	24	90.1 Å²	90.1	12%	0.123	49%	0.491	C	S	.	.	H	α-helix	trans	-62.8	-48.6	174.9	-72.2	161.4	0	0	0	111.3	V328 D329 R334 I335 T336 N348 L352 F356	V328-I332 HydrophobicContact CG1-CD1 3.82Å; V328-I332 HydrophobicContact CG1-CG1 4.42Å; V328-I332 VanDerWaalsContact O-CG1 3.3Å; V328-I332 WeakPolarHBondContact O-CG1 3.49Å; V328-I332 PolarHBondContact O-N 3.05Å; D329-I332 PolarHBondContact O-N 3.04Å; I332-R334 VanDerWaalsContact C-N 3.28Å; I332-R334 PolarHBondContact O-N 3.4Å; I332-I335 WeakPolarHBondContact O-CG1 3.2Å; I332-I335 PolarHBondContact O-N 2.75Å; I332-T336 WeakPolarHBondContact O-CB 3.43Å; I332-T336 PolarHBondContact O-N 3Å; I332-T336 PolarHBondContact O-OG1 3.32Å; I332-N348 HydrophobicContact CG2-CB 4.31Å; I332-L352 HydrophobicContact CB-CD1 4.4Å; I332-L352 HydrophobicContact CD1-CD1 3.68Å; I332-L352 HydrophobicContact CG1-CD1 3.95Å; I332-L352 HydrophobicContact CG2-CD1 3.52Å; I332-F356 HydrophobicContact CD1-CE2 4.12Å; I332-F356 HydrophobicContact CD1-CZ 3.93Å
333	Q	77.2	Confident	72.2	Confident	139 Å²	139	93.3 Å²	93.3	65%	0.65	51%	0.508	S	S	*	.	H	α-helix	trans	-60.5	-40.1	178.7	-72.8	177.1	24.1	0	0	110.8	D329 E330 I335 T336	D329-Q333 WeakPolarHBondContact O-CB 3.44Å; D329-Q333 VanDerWaalsContact O-CG 3.25Å; D329-Q333 WeakPolarHBondContact O-CG 3.41Å; D329-Q333 PolarHBondContact O-N 2.93Å; E330-Q333 PolarHBondContact O-N 3.17Å; Q333-I335 VanDerWaalsContact C-N 3.33Å; Q333-I335 PolarHBondContact O-N 2.89Å; Q333-T336 WeakPolarHBondContact O-CB 3.29Å; Q333-T336 PolarHBondContact O-N 2.83Å; Q333-T336 VanDerWaalsContact O-N 3.14Å
334	R	81.8	Confident	73.3	Confident	161 Å²	161	95.5 Å²	95.5	61%	0.608	51%	0.507	S	S	*	.	H	α-helix	trans	-64.4	-31.1	178.3	-161.5	-174.8	-46	115.5	7.3	113.9	E330 D331 I332	E330-R334 VanDerWaalsContact O-CB 3.23Å; E330-R334 WeakPolarHBondContact O-CB 3.33Å; E330-R334 PolarHBondContact O-N 3.04Å; D331-R334 PolarHBondContact O-N 3.1Å; D331-R334 IonicContact OD1-CZ 3.14Å; D331-R334 IonicContact OD1-NH1 2.65Å; D331-R334 PolarHBondContact OD1-NH1 2.88Å; D331-R334 IonicContact OD1-NH2 2.65Å; D331-R334 PolarHBondContact OD1-NH2 2.61Å; I332-R334 VanDerWaalsContact C-N 3.28Å; I332-R334 PolarHBondContact O-N 3.4Å
335	I	83.9	Confident	74.4	Confident	136 Å²	136	91.9 Å²	91.9	70%	0.697	49%	0.485	S	S	*	.	H	α-helix	trans	-91	-8.3	175.2	64.4	167.2	0	0	0	113.3	D331 I332 Q333 L337	D331-I335 WeakPolarHBondContact O-CG1 3.2Å; D331-I335 PolarHBondContact O-N 2.77Å; I332-I335 WeakPolarHBondContact O-CG1 3.2Å; I332-I335 PolarHBondContact O-N 2.75Å; Q333-I335 VanDerWaalsContact C-N 3.33Å; Q333-I335 PolarHBondContact O-N 2.89Å; I335-L337 PolarHBondContact O-N 3.38Å
336	T	82.1	Confident	75.7	Confident	32 Å²	32	87.9 Å²	87.9	20%	0.196	45%	0.448	C	S	.	.	S	Bend	trans	-75.9	115.2	-179	-66.2	0	0	0	0	110.4	I332 Q333 R344 N348	I332-T336 WeakPolarHBondContact O-CB 3.43Å; I332-T336 PolarHBondContact O-N 3Å; I332-T336 PolarHBondContact O-OG1 3.32Å; Q333-T336 WeakPolarHBondContact O-CB 3.29Å; Q333-T336 PolarHBondContact O-N 2.83Å; Q333-T336 VanDerWaalsContact O-N 3.14Å; T336-R344 HydrophobicContact CG2-CB 3.93Å; T336-N348 PolarHBondContact OG1-ND2 2.91Å
337	L	84.9	Confident	76.3	Confident	103 Å²	103	87.1 Å²	87.1	54%	0.539	44%	0.443	S	S	.	.			trans	-65.9	144.7	178.6	-65.4	170.1	0	0	0	111.6	I335 S339 R344	I335-L337 PolarHBondContact O-N 3.38Å; L337-S339 VanDerWaalsContact C-N 3.32Å; L337-S339 PolarHBondContact O-N 3.06Å; L337-R344 WeakPolarHBondContact O-CD 3.37Å
338	P	82.8	Confident	76.7	Confident	115 Å²	115	87.3 Å²	87.3	75%	0.747	44%	0.438	S	S	*	.	S	Bend	trans	-73.3	-20	-175.6	28.9	-36.2	0	0	0	114.1
339	S	83.1	Confident	76.6	Confident	85 Å²	85	88.6 Å²	88.6	59%	0.594	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	144.7	176	-49.4	0	0	0	0	111.2	L337 S341 R344	L337-S339 VanDerWaalsContact C-N 3.32Å; L337-S339 PolarHBondContact O-N 3.06Å; S339-S341 VanDerWaalsContact C-N 3.25Å; S339-S341 PolarHBondContact O-N 3.39Å; S339-R344 VanDerWaalsContact O-CD 3.27Å; S339-R344 WeakPolarHBondContact O-CD 3.26Å; S339-R344 PolarHBondContact O-NE 3.02Å; S339-R344 VanDerWaalsContact O-NE 3.16Å
340	I	79.4	Confident	76.6	Confident	112 Å²	112	86.8 Å²	86.8	57%	0.574	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	39.4	-178.3	61.7	164.1	0	0	0	113.9	R342 L343 R344	I340-R342 PolarHBondContact O-N 3.38Å; I340-R342 VanDerWaalsContact O-N 3.16Å; I340-L343 HydrophobicContact CD1-CD2 4.21Å; I340-L343 PolarHBondContact O-N 3.5Å; I340-R344 HydrophobicContact CG1-CG 4.23Å; I340-R344 PolarHBondContact O-N 2.86Å; I340-R344 VanDerWaalsContact O-N 3.14Å
341	S	73.5	Confident	76.5	Confident	60 Å²	60	83.7 Å²	83.7	42%	0.42	42%	0.422	S	S	.	.	H	α-helix	trans	-44.2	-51.3	-173.3	57.4	0	0	0	0	114.2	S339 L343 R344 H345	S339-S341 VanDerWaalsContact C-N 3.25Å; S339-S341 PolarHBondContact O-N 3.39Å; S341-L343 VanDerWaalsContact C-N 3.34Å; S341-L343 PolarHBondContact O-N 3.34Å; S341-R344 WeakPolarHBondContact O-CB 3.21Å; S341-R344 PolarHBondContact O-N 3.08Å; S341-H345 PolarHBondContact O-N 2.93Å; S341-H345 PolarHBondContact O-ND1 3.1Å
342	R	70.5	Confident	76.4	Confident	219 Å²	219	81.9 Å²	81.9	83%	0.826	41%	0.412	S	S	*	.	H	α-helix	trans	-55.5	-43.1	-179.8	-66	-176.3	-178.6	176.3	-0.5	113.8	I340 R344 F346	I340-R342 PolarHBondContact O-N 3.38Å; I340-R342 VanDerWaalsContact O-N 3.16Å; R342-R344 VanDerWaalsContact C-N 3.35Å; R342-F346 PolarHBondContact O-N 2.78Å
343	L	73.4	Confident	76.1	Confident	88 Å²	88	81 Å²	81	46%	0.461	41%	0.407	S	S	.	.	H	α-helix	trans	-73.4	-30.2	179	-177.9	59.1	0	0	0	111.6	I340 S341 F346 T347 I747	I340-L343 HydrophobicContact CD1-CD2 4.21Å; I340-L343 PolarHBondContact O-N 3.5Å; S341-L343 VanDerWaalsContact C-N 3.34Å; S341-L343 PolarHBondContact O-N 3.34Å; L343-F346 HydrophobicContact CD1-CD1 4.38Å; L343-T347 WeakPolarHBondContact O-CB 3.4Å; L343-T347 PolarHBondContact O-N 3.04Å; L343-T347 PolarHBondContact O-OG1 3.47Å; L343-I747 HydrophobicContact CD1-CD1 4.19Å
344	R	78	Confident	76.1	Confident	75 Å²	75	74.9 Å²	74.9	28%	0.283	38%	0.379	S	S	.	.	H	α-helix	trans	-72.5	-37.7	174.3	-75.3	-179.9	178.6	-80	-8.1	113.2	T336 L337 S339 I340 S341 R342 T347 N348	T336-R344 HydrophobicContact CG2-CB 3.93Å; L337-R344 WeakPolarHBondContact O-CD 3.37Å; S339-R344 VanDerWaalsContact O-CD 3.27Å; S339-R344 WeakPolarHBondContact O-CD 3.26Å; S339-R344 PolarHBondContact O-NE 3.02Å; S339-R344 VanDerWaalsContact O-NE 3.16Å; I340-R344 HydrophobicContact CG1-CG 4.23Å; I340-R344 PolarHBondContact O-N 2.86Å; I340-R344 VanDerWaalsContact O-N 3.14Å; S341-R344 WeakPolarHBondContact O-CB 3.21Å; S341-R344 PolarHBondContact O-N 3.08Å; R342-R344 VanDerWaalsContact C-N 3.35Å; R344-T347 PolarHBondContact O-N 3.06Å; R344-N348 WeakPolarHBondContact O-CB 3.36Å; R344-N348 PolarHBondContact O-N 3.34Å; R344-N348 PolarHBondContact O-OD1 3.48Å
345	H	73.7	Confident	75.9	Confident	92 Å²	92	74 Å²	74	43%	0.426	38%	0.38	S	S	.	.	H	α-helix	trans	-60.6	-53.6	171.5	-71.7	66.7	0	0	0	108.9	S341 T347 N348 D349	S341-H345 PolarHBondContact O-N 2.93Å; S341-H345 PolarHBondContact O-ND1 3.1Å; H345-T347 VanDerWaalsContact C-N 3.27Å; H345-T347 PolarHBondContact O-N 3.41Å; H345-T347 VanDerWaalsContact O-N 3.14Å; H345-N348 CarbonylContact O-C 3.56Å; H345-N348 WeakPolarHBondContact O-CA 3.37Å; H345-N348 WeakPolarHBondContact O-CB 3.36Å; H345-N348 PolarHBondContact O-N 3.49Å; H345-D349 WeakPolarHBondContact O-CB 3.27Å; H345-D349 PolarHBondContact O-N 3.34Å; H345-D349 VanDerWaalsContact O-OD2 3.13Å
346	F	74.6	Confident	75.6	Confident	22 Å²	22	68.8 Å²	68.8	10%	0.096	35%	0.352	C	S	.	.	H	α-helix	trans	-54.3	-37.9	173.4	178.6	-100.9	0	0	0	114.5	R342 L343 T350 P612 V613 I747 H750	R342-F346 PolarHBondContact O-N 2.78Å; L343-F346 HydrophobicContact CD1-CD1 4.38Å; F346-T350 HydrophobicContact CE2-CG2 4.3Å; F346-T350 HydrophobicContact CZ-CG2 4.24Å; F346-T350 VanDerWaalsContact O-CB 3.23Å; F346-T350 WeakPolarHBondContact O-CB 3.47Å; F346-T350 PolarHBondContact O-N 3.29Å; F346-T350 PolarHBondContact O-OG1 2.91Å; F346-P612 HydrophobicContact CE1-CG 4.24Å; F346-P612 HydrophobicContact CZ-CG 4.03Å; F346-V613 HydrophobicContact CZ-CG2 4.35Å; F346-I747 HydrophobicContact CB-CD1 4.01Å; F346-I747 HydrophobicContact CB-CG1 4.34Å; F346-I747 HydrophobicContact CB-CG2 4.47Å; F346-I747 HydrophobicContact CD1-CD1 4.38Å; F346-I747 HydrophobicContact CD1-CG1 4.04Å; F346-I747 HydrophobicContact CD2-CB 4.39Å; F346-I747 HydrophobicContact CD2-CG1 4.14Å; F346-I747 HydrophobicContact CD2-CG2 3.77Å; F346-I747 HydrophobicContact CE1-CG1 4.41Å; F346-I747 HydrophobicContact CE2-CG1 4.49Å; F346-I747 HydrophobicContact CE2-CG2 4.3Å; F346-I747 HydrophobicContact CG-CD1 4.1Å; F346-I747 HydrophobicContact CG-CG1 3.89Å; F346-I747 HydrophobicContact CG-CG2 4.2Å; F346-H750 HydrophobicContact CE2-CB 4.29Å
347	T	74.4	Confident	75.6	Confident	50 Å²	50	67.4 Å²	67.4	31%	0.307	34%	0.343	S	S	.	.	H	α-helix	trans	-65.9	-41.1	174.4	-62.6	0	0	0	0	111.8	L343 R344 H345 L351 L352	L343-T347 WeakPolarHBondContact O-CB 3.4Å; L343-T347 PolarHBondContact O-N 3.04Å; L343-T347 PolarHBondContact O-OG1 3.47Å; R344-T347 PolarHBondContact O-N 3.06Å; H345-T347 VanDerWaalsContact C-N 3.27Å; H345-T347 PolarHBondContact O-N 3.41Å; H345-T347 VanDerWaalsContact O-N 3.14Å; T347-L351 HydrophobicContact CG2-CB 4.34Å; T347-L351 HydrophobicContact CG2-CD1 4.16Å; T347-L351 WeakPolarHBondContact O-CA 3.3Å; T347-L351 VanDerWaalsContact O-CB 3.31Å; T347-L351 WeakPolarHBondContact O-CB 3.46Å; T347-L351 PolarHBondContact O-N 2.93Å; T347-L352 PolarHBondContact O-N 2.84Å
348	N	73.5	Confident	75.4	Confident	30 Å²	30	64.4 Å²	64.4	16%	0.16	33%	0.328	C	S	.	.	I	π-helix	trans	-69.5	-46.1	178.6	-67.2	-4.9	0	0	0	110.9	I332 T336 R344 H345 T350 L352	I332-N348 HydrophobicContact CG2-CB 4.31Å; T336-N348 PolarHBondContact OG1-ND2 2.91Å; R344-N348 WeakPolarHBondContact O-CB 3.36Å; R344-N348 PolarHBondContact O-N 3.34Å; R344-N348 PolarHBondContact O-OD1 3.48Å; H345-N348 CarbonylContact O-C 3.56Å; H345-N348 WeakPolarHBondContact O-CA 3.37Å; H345-N348 WeakPolarHBondContact O-CB 3.36Å; H345-N348 PolarHBondContact O-N 3.49Å; N348-T350 VanDerWaalsContact C-N 3.27Å; N348-T350 PolarHBondContact O-N 3.49Å; N348-L352 HydrophobicContact CB-CD1 3.91Å; N348-L352 WeakPolarHBondContact O-CB 3.37Å
349	D	69.1	Low	75.3	Confident	56 Å²	56	60.9 Å²	60.9	30%	0.299	31%	0.306	S	S	.	.	I	π-helix	trans	-84.1	13.7	-174.8	-45.4	-27.1	0	0	0	113.6	H345	H345-D349 WeakPolarHBondContact O-CB 3.27Å; H345-D349 PolarHBondContact O-N 3.34Å; H345-D349 VanDerWaalsContact O-OD2 3.13Å
350	T	69.1	Low	74.9	Confident	8 Å²	8	58.7 Å²	58.7	5%	0.049	29%	0.29	C	S	.	.	I	π-helix	trans	-156.2	-35.9	-179	-53	0	0	0	0	113.8	F346 N348 D353 L354 V613	F346-T350 HydrophobicContact CE2-CG2 4.3Å; F346-T350 HydrophobicContact CZ-CG2 4.24Å; F346-T350 VanDerWaalsContact O-CB 3.23Å; F346-T350 WeakPolarHBondContact O-CB 3.47Å; F346-T350 PolarHBondContact O-N 3.29Å; F346-T350 PolarHBondContact O-OG1 2.91Å; N348-T350 VanDerWaalsContact C-N 3.27Å; N348-T350 PolarHBondContact O-N 3.49Å; T350-D353 VanDerWaalsContact CA-OD2 3.29Å; T350-D353 WeakPolarHBondContact CA-OD2 3.39Å; T350-D353 PolarHBondContact N-OD2 3.35Å; T350-L354 WeakPolarHBondContact O-CG 3.41Å; T350-V613 HydrophobicContact CG2-CG2 3.8Å
351	L	70.5	Confident	74.6	Confident	68 Å²	68	58.5 Å²	58.5	36%	0.356	29%	0.294	S	S	.	.	I	π-helix	trans	-96.4	-31.9	-179.8	-65.9	176.3	0	0	0	113.4	T347 D353 L354 F355	T347-L351 HydrophobicContact CG2-CB 4.34Å; T347-L351 HydrophobicContact CG2-CD1 4.16Å; T347-L351 WeakPolarHBondContact O-CA 3.3Å; T347-L351 VanDerWaalsContact O-CB 3.31Å; T347-L351 WeakPolarHBondContact O-CB 3.46Å; T347-L351 PolarHBondContact O-N 2.93Å; L351-D353 VanDerWaalsContact C-N 3.26Å; L351-D353 PolarHBondContact O-N 3.4Å; L351-L354 HydrophobicContact CD2-CD1 3.92Å; L351-L354 PolarHBondContact O-N 3.15Å; L351-F355 WeakPolarHBondContact O-CD2 3.18Å; L351-F355 PolarHBondContact O-N 2.8Å
352	L	71.5	Confident	74.9	Confident	45 Å²	45	59.4 Å²	59.4	24%	0.236	29%	0.289	C	S	.	.	I	π-helix	trans	-64	-37.3	173.5	-64.2	178.1	0	0	0	111.3	I332 T347 N348 L354 F355 F356	I332-L352 HydrophobicContact CB-CD1 4.4Å; I332-L352 HydrophobicContact CD1-CD1 3.68Å; I332-L352 HydrophobicContact CG1-CD1 3.95Å; I332-L352 HydrophobicContact CG2-CD1 3.52Å; T347-L352 PolarHBondContact O-N 2.84Å; N348-L352 HydrophobicContact CB-CD1 3.91Å; N348-L352 WeakPolarHBondContact O-CB 3.37Å; L352-L354 VanDerWaalsContact C-N 3.28Å; L352-L354 PolarHBondContact O-N 3.13Å; L352-F355 HydrophobicContact CD2-CD2 4.41Å; L352-F355 CarbonylContact O-C 3.48Å; L352-F355 WeakPolarHBondContact O-CA 3.32Å; L352-F355 WeakPolarHBondContact O-CB 3.45Å; L352-F355 PolarHBondContact O-N 3.14Å; L352-F356 HydrophobicContact CB-CD2 4.32Å; L352-F356 HydrophobicContact CB-CE2 3.99Å; L352-F356 WeakPolarHBondContact O-CD2 3.29Å; L352-F356 PolarHBondContact O-N 3.3Å
353	D	71.9	Confident	75.7	Confident	4 Å²	4	49.1 Å²	49.1	2%	0.021	25%	0.25	C	S	.	.	H	α-helix	trans	-47.2	-48.4	171.8	-51.8	3.1	0	0	0	112.9	I268 T350 L351 F355 F356 Y357 L399	I268-D353 HydrophobicContact CB-CB 3.75Å; I268-D353 WeakPolarHBondContact CB-OD2 3.39Å; I268-D353 HydrophobicContact CD1-CB 4.1Å; I268-D353 HydrophobicContact CG1-CB 4.36Å; I268-D353 HydrophobicContact CG2-CB 4.18Å; I268-D353 VanDerWaalsContact CG2-CG 3.44Å; I268-D353 WeakPolarHBondContact CG2-OD1 3.32Å; T350-D353 VanDerWaalsContact CA-OD2 3.29Å; T350-D353 WeakPolarHBondContact CA-OD2 3.39Å; T350-D353 PolarHBondContact N-OD2 3.35Å; L351-D353 VanDerWaalsContact C-N 3.26Å; L351-D353 PolarHBondContact O-N 3.4Å; D353-F355 VanDerWaalsContact C-N 3.31Å; D353-F355 PolarHBondContact O-N 2.83Å; D353-F356 PolarHBondContact O-N 2.77Å; D353-Y357 PolarHBondContact O-N 3.36Å; D353-L399 HydrophobicContact CB-CD2 3.85Å
354	L	76.5	Confident	76.3	Confident	11 Å²	11	47.1 Å²	47.1	6%	0.058	24%	0.239	C	C	.	.	H	α-helix	trans	-65.6	-36.1	178.6	-58.8	-174.9	0	0	0	110.9	T350 L351 L352 N358 L399 P578 M581 F582	T350-L354 WeakPolarHBondContact O-CG 3.41Å; L351-L354 HydrophobicContact CD2-CD1 3.92Å; L351-L354 PolarHBondContact O-N 3.15Å; L352-L354 VanDerWaalsContact C-N 3.28Å; L352-L354 PolarHBondContact O-N 3.13Å; L354-N358 VanDerWaalsContact O-CB 3.31Å; L354-N358 WeakPolarHBondContact O-CB 3.36Å; L354-N358 PolarHBondContact O-N 2.89Å; L354-N358 VanDerWaalsContact O-N 3.09Å; L354-L399 HydrophobicContact CD2-CB 4.14Å; L354-L399 HydrophobicContact CD2-CD1 3.97Å; L354-P578 HydrophobicContact CD2-CG 4.11Å; L354-M581 HydrophobicContact CD1-CE 4.1Å; L354-F582 HydrophobicContact CB-CE2 4.03Å; L354-F582 HydrophobicContact CB-CZ 3.78Å; L354-F582 HydrophobicContact CD1-CE2 4.13Å; L354-F582 HydrophobicContact CD2-CE2 3.78Å; L354-F582 HydrophobicContact CD2-CZ 4.1Å; L354-F582 HydrophobicContact CG-CE2 4.16Å; L354-F582 HydrophobicContact CG-CZ 4.37Å
355	F	77.5	Confident	76.7	Confident	143 Å²	143	46.6 Å²	46.6	63%	0.627	24%	0.244	S	C	*	.	H	α-helix	trans	-73.3	-36.1	174	-63.6	-58.9	0	0	0	112.8	L351 L352 D353 N358 S359	L351-F355 WeakPolarHBondContact O-CD2 3.18Å; L351-F355 PolarHBondContact O-N 2.8Å; L352-F355 HydrophobicContact CD2-CD2 4.41Å; L352-F355 CarbonylContact O-C 3.48Å; L352-F355 WeakPolarHBondContact O-CA 3.32Å; L352-F355 WeakPolarHBondContact O-CB 3.45Å; L352-F355 PolarHBondContact O-N 3.14Å; D353-F355 VanDerWaalsContact C-N 3.31Å; D353-F355 PolarHBondContact O-N 2.83Å; F355-N358 PolarHBondContact O-N 2.94Å; F355-S359 PolarHBondContact O-N 3.42Å
356	F	77.2	Confident	77.4	Confident	27 Å²	27	42.2 Å²	42.2	12%	0.118	22%	0.223	C	C	.	.	H	α-helix	trans	-62.3	-50.3	172	-74.8	-60.1	0	0	0	110.8	I268 H322 V328 I332 L352 D353 N358 S359 Y362	I268-F356 HydrophobicContact CD1-CB 4.4Å; H322-F356 AromaticContact CE1-CE2 3.77Å; V328-F356 HydrophobicContact CG1-CE1 3.89Å; V328-F356 HydrophobicContact CG1-CZ 3.52Å; I332-F356 HydrophobicContact CD1-CE2 4.12Å; I332-F356 HydrophobicContact CD1-CZ 3.93Å; L352-F356 HydrophobicContact CB-CD2 4.32Å; L352-F356 HydrophobicContact CB-CE2 3.99Å; L352-F356 WeakPolarHBondContact O-CD2 3.29Å; L352-F356 PolarHBondContact O-N 3.3Å; D353-F356 PolarHBondContact O-N 2.77Å; F356-N358 VanDerWaalsContact C-N 3.25Å; F356-N358 PolarHBondContact O-N 3.19Å; F356-S359 VanDerWaalsContact O-CB 3.3Å; F356-S359 WeakPolarHBondContact O-CB 3.37Å; F356-S359 PolarHBondContact O-N 3.25Å; F356-Y362 HydrophobicContact CD1-CD1 4.44Å; F356-Y362 AromaticContact CD1-CD2 3.77Å; F356-Y362 HydrophobicContact CD1-CD2 3.77Å; F356-Y362 AromaticContact CD1-CE2 3.89Å; F356-Y362 HydrophobicContact CD1-CE2 3.89Å; F356-Y362 HydrophobicContact CD1-CG 4.06Å; F356-Y362 HydrophobicContact CE1-CD2 4.45Å; F356-Y362 HydrophobicContact CE1-CE2 4.11Å; F356-Y362 WeakPolarHBondContact O-CB 2.9Å
357	Y	82.6	Confident	78.2	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.008	22%	0.219	C	C	.	.	H	α-helix	trans	-66.9	-25.8	179.9	-168	-107.9	0	0	0	113.5	D353 S359 C363 I366 V367 L399 L402 I403 D406	D353-Y357 PolarHBondContact O-N 3.36Å; Y357-S359 VanDerWaalsContact C-N 3.3Å; Y357-C363 WeakPolarHBondContact CE2-SG 3.45Å; Y357-C363 VanDerWaalsContact O-CB 3.3Å; Y357-C363 WeakPolarHBondContact O-CB 3.34Å; Y357-C363 PolarHBondContact O-SG 3.02Å; Y357-C363 VanDerWaalsContact O-SG 3.41Å; Y357-I366 HydrophobicContact CD2-CB 4.17Å; Y357-I366 HydrophobicContact CD2-CD1 3.91Å; Y357-I366 HydrophobicContact CD2-CG2 3.82Å; Y357-I366 HydrophobicContact CE2-CB 4.41Å; Y357-I366 HydrophobicContact CE2-CG2 3.98Å; Y357-V367 HydrophobicContact CE2-CG1 3.85Å; Y357-L399 HydrophobicContact CD1-CD1 3.85Å; Y357-L399 HydrophobicContact CG-CD1 3.75Å; Y357-L402 HydrophobicContact CD1-CD2 3.59Å; Y357-L402 HydrophobicContact CD1-CG 4.15Å; Y357-L402 HydrophobicContact CE1-CD2 3.74Å; Y357-L402 HydrophobicContact CE1-CG 3.79Å; Y357-I403 HydrophobicContact CD2-CG1 3.95Å; Y357-I403 HydrophobicContact CE2-CG1 3.62Å; Y357-D406 VanDerWaalsContact CE1-OD2 3.3Å; Y357-D406 WeakPolarHBondContact CE1-OD2 3.27Å; Y357-D406 PolarHBondContact OH-OD2 3.08Å
358	N	80.4	Confident	79	Confident	41 Å²	41	41.8 Å²	41.8	22%	0.219	22%	0.22	C	C	.	.	H	α-helix	trans	-77.7	-11.5	171.7	-164.1	57.6	0	0	0	113.7	L354 F355 F356 F582	L354-N358 VanDerWaalsContact O-CB 3.31Å; L354-N358 WeakPolarHBondContact O-CB 3.36Å; L354-N358 PolarHBondContact O-N 2.89Å; L354-N358 VanDerWaalsContact O-N 3.09Å; F355-N358 PolarHBondContact O-N 2.94Å; F356-N358 VanDerWaalsContact C-N 3.25Å; F356-N358 PolarHBondContact O-N 3.19Å; N358-F582 HydrophobicContact CB-CE1 4.41Å
359	S	80.9	Confident	79.8	Confident	40 Å²	40	41.9 Å²	41.9	28%	0.28	22%	0.222	S	C	.	.	S	Bend	trans	-85.4	120.1	174.1	-180	0	0	0	0	110.2	F355 F356 Y357 T361 Y362 C363	F355-S359 PolarHBondContact O-N 3.42Å; F356-S359 VanDerWaalsContact O-CB 3.3Å; F356-S359 WeakPolarHBondContact O-CB 3.37Å; F356-S359 PolarHBondContact O-N 3.25Å; Y357-S359 VanDerWaalsContact C-N 3.3Å; S359-T361 PolarHBondContact O-N 3.09Å; S359-T361 VanDerWaalsContact O-N 3.1Å; S359-Y362 PolarHBondContact O-N 3.09Å; S359-Y362 VanDerWaalsContact O-N 3.1Å; S359-C363 WeakPolarHBondContact O-CB 3.07Å; S359-C363 PolarHBondContact O-N 3.37Å
360	P	74.1	Confident	81	Confident	40 Å²	40	39.2 Å²	39.2	26%	0.26	21%	0.208	S	C	.	.	H	α-helix	trans	-56.1	-33.9	-174.4	-27	33.8	0	0	0	114.7	Q364 F542 V558	P360-Q364 PolarHBondContact O-N 3.06Å; P360-F542 HydrophobicContact CG-CZ 4.2Å; P360-V558 HydrophobicContact CB-CB 3.75Å; P360-V558 HydrophobicContact CB-CG1 3.78Å; P360-V558 HydrophobicContact CB-CG2 4.16Å; P360-V558 HydrophobicContact CG-CB 4.28Å
361	T	74.3	Confident	82.2	Confident	108 Å²	108	38.9 Å²	38.9	66%	0.663	21%	0.205	S	C	*	.	H	α-helix	trans	-66.1	-42.8	179.4	-49.5	0	0	0	0	112.4	S359 T365	S359-T361 PolarHBondContact O-N 3.09Å; S359-T361 VanDerWaalsContact O-N 3.1Å; T361-T365 PolarHBondContact O-OG1 3.12Å
362	Y	79.9	Confident	83.4	Confident	79 Å²	79	39.1 Å²	39.1	31%	0.31	21%	0.213	S	C	.	.	H	α-helix	trans	-81.4	-37.9	178.9	-67.5	-72.1	0	0	0	110.8	L321 F356 S359 Q364 T365 I366	L321-Y362 HydrophobicContact CD1-CD1 4.41Å; F356-Y362 HydrophobicContact CD1-CD1 4.44Å; F356-Y362 AromaticContact CD1-CD2 3.77Å; F356-Y362 HydrophobicContact CD1-CD2 3.77Å; F356-Y362 AromaticContact CD1-CE2 3.89Å; F356-Y362 HydrophobicContact CD1-CE2 3.89Å; F356-Y362 HydrophobicContact CD1-CG 4.06Å; F356-Y362 HydrophobicContact CE1-CD2 4.45Å; F356-Y362 HydrophobicContact CE1-CE2 4.11Å; F356-Y362 WeakPolarHBondContact O-CB 2.9Å; S359-Y362 PolarHBondContact O-N 3.09Å; S359-Y362 VanDerWaalsContact O-N 3.1Å; Y362-Q364 VanDerWaalsContact C-N 3.33Å; Y362-Q364 PolarHBondContact O-N 2.9Å; Y362-T365 PolarHBondContact O-N 2.82Å; Y362-T365 VanDerWaalsContact O-N 3.16Å; Y362-I366 WeakPolarHBondContact O-CB 3.02Å; Y362-I366 WeakPolarHBondContact O-CG1 3.5Å; Y362-I366 PolarHBondContact O-N 3.38Å
363	C	85.8	Confident	84.5	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.014	21%	0.209	C	C	.	.	H	α-helix	trans	-51.3	-48.6	178	-167.3	0	0	0	0	112.5	Y357 S359 I366 V367 I560	Y357-C363 WeakPolarHBondContact CE2-SG 3.45Å; Y357-C363 VanDerWaalsContact O-CB 3.3Å; Y357-C363 WeakPolarHBondContact O-CB 3.34Å; Y357-C363 PolarHBondContact O-SG 3.02Å; Y357-C363 VanDerWaalsContact O-SG 3.41Å; S359-C363 WeakPolarHBondContact O-CB 3.07Å; S359-C363 PolarHBondContact O-N 3.37Å; C363-I366 PolarHBondContact O-N 3.01Å; C363-V367 PolarHBondContact O-N 2.88Å; C363-I560 HydrophobicContact CB-CD1 4.18Å; C363-I560 WeakPolarHBondContact SG-CD1 3.48Å
364	Q	86.8	Confident	85.6	Confident	47 Å²	47	38.3 Å²	38.3	22%	0.22	21%	0.208	C	C	.	.	H	α-helix	trans	-58.2	-52.3	177.5	-172.7	62.2	58.4	0	0	111.7	P360 Y362 I366 V367 D368 D561	P360-Q364 PolarHBondContact O-N 3.06Å; Y362-Q364 VanDerWaalsContact C-N 3.33Å; Y362-Q364 PolarHBondContact O-N 2.9Å; Q364-I366 VanDerWaalsContact C-N 3.28Å; Q364-I366 PolarHBondContact O-N 3.36Å; Q364-V367 VanDerWaalsContact O-CG2 3.27Å; Q364-V367 WeakPolarHBondContact O-CG2 3.26Å; Q364-V367 PolarHBondContact O-N 3.46Å; Q364-D368 WeakPolarHBondContact CG-OD2 3.49Å; Q364-D368 VanDerWaalsContact NE2-CG 3.27Å; Q364-D368 PolarHBondContact NE2-OD1 2.68Å; Q364-D368 PolarHBondContact NE2-OD2 3.06Å; Q364-D368 WeakPolarHBondContact O-CB 3.36Å; Q364-D368 VanDerWaalsContact O-CG 3.23Å; Q364-D368 PolarHBondContact O-N 3.4Å; Q364-D561 PolarHBondContact NE2-O 3.06Å
365	T	86.6	Confident	86.6	Confident	64 Å²	64	39.3 Å²	39.3	39%	0.393	21%	0.213	S	C	.	.	H	α-helix	trans	-59	-38.4	177.8	-52	0	0	0	0	112.4	L321 T361 Y362 T369	L321-T365 HydrophobicContact CD1-CG2 3.83Å; T361-T365 PolarHBondContact O-OG1 3.12Å; Y362-T365 PolarHBondContact O-N 2.82Å; Y362-T365 VanDerWaalsContact O-N 3.16Å; T365-T369 VanDerWaalsContact O-CB 3.27Å; T365-T369 WeakPolarHBondContact O-CB 3.37Å; T365-T369 PolarHBondContact O-N 3.07Å; T365-T369 PolarHBondContact O-OG1 3.02Å
366	I	88.4	Confident	87.5	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.9	-51.5	178	-67.7	166	0	0	0	110.7	I268 W317 L321 Y357 Y362 C363 Q364 D368 T369 V370 I403	I268-I366 HydrophobicContact CD1-CD1 4.22Å; W317-I366 HydrophobicContact CE3-CG2 4.38Å; W317-I366 HydrophobicContact CH2-CG1 4.34Å; W317-I366 HydrophobicContact CH2-CG2 3.56Å; W317-I366 HydrophobicContact CZ2-CG2 4.44Å; W317-I366 HydrophobicContact CZ3-CB 4.24Å; W317-I366 HydrophobicContact CZ3-CD1 4.49Å; W317-I366 HydrophobicContact CZ3-CG1 3.88Å; W317-I366 HydrophobicContact CZ3-CG2 3.61Å; L321-I366 HydrophobicContact CD1-CG1 3.74Å; L321-I366 HydrophobicContact CD2-CD1 3.79Å; L321-I366 HydrophobicContact CD2-CG1 3.72Å; L321-I366 HydrophobicContact CG-CG1 4.38Å; Y357-I366 HydrophobicContact CD2-CB 4.17Å; Y357-I366 HydrophobicContact CD2-CD1 3.91Å; Y357-I366 HydrophobicContact CD2-CG2 3.82Å; Y357-I366 HydrophobicContact CE2-CB 4.41Å; Y357-I366 HydrophobicContact CE2-CG2 3.98Å; Y362-I366 WeakPolarHBondContact O-CB 3.02Å; Y362-I366 WeakPolarHBondContact O-CG1 3.5Å; Y362-I366 PolarHBondContact O-N 3.38Å; C363-I366 PolarHBondContact O-N 3.01Å; Q364-I366 VanDerWaalsContact C-N 3.28Å; Q364-I366 PolarHBondContact O-N 3.36Å; I366-D368 VanDerWaalsContact C-N 3.34Å; I366-D368 PolarHBondContact O-N 2.81Å; I366-T369 PolarHBondContact O-N 2.95Å; I366-V370 HydrophobicContact CG2-CG2 4.49Å; I366-V370 WeakPolarHBondContact O-CB 3.34Å; I366-V370 WeakPolarHBondContact O-CG2 3.41Å; I366-V370 PolarHBondContact O-N 3.37Å; I366-I403 HydrophobicContact CG2-CD1 3.49Å; I366-I403 VanDerWaalsContact CG2-CD1 3.49Å; I366-I403 HydrophobicContact CG2-CG1 3.94Å
367	V	91	Very high	88.4	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67	-36.8	-179.1	-58.9	0	0	0	0	111.9	Y357 C363 Q364 A371 I403 L407 I560 Y562	Y357-V367 HydrophobicContact CE2-CG1 3.85Å; C363-V367 PolarHBondContact O-N 2.88Å; Q364-V367 VanDerWaalsContact O-CG2 3.27Å; Q364-V367 WeakPolarHBondContact O-CG2 3.26Å; Q364-V367 PolarHBondContact O-N 3.46Å; V367-A371 WeakPolarHBondContact O-CB 3.29Å; V367-A371 PolarHBondContact O-N 2.74Å; V367-I403 HydrophobicContact CG1-CG2 4.48Å; V367-L407 HydrophobicContact CB-CD2 4.3Å; V367-I560 HydrophobicContact CG2-CG2 4.06Å; V367-Y562 HydrophobicContact CB-CD1 4.34Å; V367-Y562 HydrophobicContact CG1-CD1 4.07Å; V367-Y562 HydrophobicContact CG1-CE1 3.86Å; V367-Y562 HydrophobicContact CG2-CD1 4.38Å
368	D	91.1	Very high	89.1	Confident	62 Å²	62	37.4 Å²	37.4	33%	0.332	20%	0.202	S	C	.	.	H	α-helix	trans	-63.5	-45	175	-72.1	-26	0	0	0	111.6	Q364 I366 S372 P563	Q364-D368 WeakPolarHBondContact CG-OD2 3.49Å; Q364-D368 VanDerWaalsContact NE2-CG 3.27Å; Q364-D368 PolarHBondContact NE2-OD1 2.68Å; Q364-D368 PolarHBondContact NE2-OD2 3.06Å; Q364-D368 WeakPolarHBondContact O-CB 3.36Å; Q364-D368 VanDerWaalsContact O-CG 3.23Å; Q364-D368 PolarHBondContact O-N 3.4Å; I366-D368 VanDerWaalsContact C-N 3.34Å; I366-D368 PolarHBondContact O-N 2.81Å; D368-S372 WeakPolarHBondContact O-CB 3.44Å; D368-S372 PolarHBondContact O-N 2.8Å; D368-S372 PolarHBondContact O-OG 2.92Å; D368-P563 WeakPolarHBondContact OD1-CG 3.49Å
369	T	91.3	Very high	89.8	Confident	33 Å²	33	38.2 Å²	38.2	20%	0.202	21%	0.214	C	C	.	.	H	α-helix	trans	-64.6	-54.1	177.8	-57.7	0	0	0	0	111	W317 A320 T365 I366 A371 S372 E373	W317-T369 HydrophobicContact CB-CG2 3.96Å; A320-T369 HydrophobicContact CB-CG2 3.7Å; T365-T369 VanDerWaalsContact O-CB 3.27Å; T365-T369 WeakPolarHBondContact O-CB 3.37Å; T365-T369 PolarHBondContact O-N 3.07Å; T365-T369 PolarHBondContact O-OG1 3.02Å; I366-T369 PolarHBondContact O-N 2.95Å; T369-A371 PolarHBondContact O-N 2.95Å; T369-S372 PolarHBondContact O-N 2.86Å; T369-E373 VanDerWaalsContact O-CB 3.31Å; T369-E373 WeakPolarHBondContact O-CB 3.45Å; T369-E373 PolarHBondContact O-N 2.82Å
370	V	93.4	Very high	90.6	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-62.4	-44.5	-176.3	171.7	0	0	0	0	111.4	V265 W317 I366 E373 V374 I403 L407	V265-V370 HydrophobicContact CG1-CG1 4.02Å; V265-V370 HydrophobicContact CG2-CG1 4.3Å; W317-V370 HydrophobicContact CB-CG2 3.9Å; W317-V370 HydrophobicContact CD2-CG2 3.55Å; W317-V370 HydrophobicContact CE3-CG2 4.08Å; W317-V370 HydrophobicContact CG-CG2 3.51Å; W317-V370 HydrophobicContact CZ2-CG2 4.46Å; I366-V370 HydrophobicContact CG2-CG2 4.49Å; I366-V370 WeakPolarHBondContact O-CB 3.34Å; I366-V370 WeakPolarHBondContact O-CG2 3.41Å; I366-V370 PolarHBondContact O-N 3.37Å; V370-E373 PolarHBondContact O-N 2.77Å; V370-V374 HydrophobicContact CG1-CG2 4.47Å; V370-V374 WeakPolarHBondContact O-CB 3.27Å; V370-V374 VanDerWaalsContact O-CG2 3.27Å; V370-V374 WeakPolarHBondContact O-CG2 3.4Å; V370-V374 PolarHBondContact O-N 2.93Å; V370-I403 HydrophobicContact CB-CG2 4.05Å; V370-I403 HydrophobicContact CG1-CG2 3.91Å; V370-I403 HydrophobicContact CG2-CG2 4.18Å; V370-L407 HydrophobicContact CG1-CD1 4.27Å
371	A	95.1	Very high	91.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-70.1	-37.2	179.1	0	0	0	0	0	112.5	V367 T369 N375 L407 P563 L565	V367-A371 WeakPolarHBondContact O-CB 3.29Å; V367-A371 PolarHBondContact O-N 2.74Å; T369-A371 PolarHBondContact O-N 2.95Å; A371-N375 VanDerWaalsContact O-CB 3.26Å; A371-N375 WeakPolarHBondContact O-CB 3.45Å; A371-N375 PolarHBondContact O-N 2.88Å; A371-N375 PolarHBondContact O-ND2 2.86Å; A371-N375 VanDerWaalsContact O-ND2 3.12Å; A371-L407 HydrophobicContact CB-CD1 4.24Å; A371-L407 HydrophobicContact CB-CD2 4.01Å; A371-P563 HydrophobicContact CB-CB 3.68Å; A371-P563 HydrophobicContact CB-CG 4.02Å; A371-L565 HydrophobicContact CB-CD2 4.42Å
372	S	94.4	Very high	92.6	Very high	74 Å²	74	34.2 Å²	34.2	52%	0.517	18%	0.182	S	C	.	.	H	α-helix	trans	-64.5	-42	174.6	-62.1	0	0	0	0	111.5	D368 T369 N375 R376	D368-S372 WeakPolarHBondContact O-CB 3.44Å; D368-S372 PolarHBondContact O-N 2.8Å; D368-S372 PolarHBondContact O-OG 2.92Å; T369-S372 PolarHBondContact O-N 2.86Å; S372-N375 PolarHBondContact O-N 2.96Å; S372-R376 WeakPolarHBondContact O-CB 3.31Å; S372-R376 PolarHBondContact O-N 2.85Å
373	E	94.4	Very high	93.3	Very high	31 Å²	31	37.7 Å²	37.7	15%	0.145	20%	0.2	C	C	.	.	H	α-helix	trans	-69	-45.4	180	-178.8	58.9	-169.6	0	0	112	V315 T369 V370 N375 R376 L377	V315-E373 HydrophobicContact CG1-CB 4.23Å; V315-E373 HydrophobicContact CG1-CG 3.84Å; T369-E373 VanDerWaalsContact O-CB 3.31Å; T369-E373 WeakPolarHBondContact O-CB 3.45Å; T369-E373 PolarHBondContact O-N 2.82Å; V370-E373 PolarHBondContact O-N 2.77Å; E373-N375 VanDerWaalsContact C-N 3.29Å; E373-N375 PolarHBondContact O-N 2.95Å; E373-R376 WeakPolarHBondContact O-CB 3.42Å; E373-R376 PolarHBondContact O-N 3.32Å; E373-R376 VanDerWaalsContact O-N 3.17Å; E373-R376 IonicContact OE1-CZ 2.77Å; E373-R376 IonicContact OE1-NE 3.26Å; E373-R376 IonicContact OE1-NH2 3.63Å; E373-R376 PolarHBondContact OE1-NH2 3.15Å; E373-R376 IonicContact OE2-CZ 3.39Å; E373-R376 IonicContact OE2-NE 3.45Å; E373-R376 PolarHBondContact OE2-NE 3Å; E373-R376 IonicContact OE2-NH2 2.75Å; E373-R376 PolarHBondContact OE2-NH2 3.24Å; E373-L377 HydrophobicContact CG-CD1 4.04Å; E373-L377 HydrophobicContact CG-CG 4.46Å; E373-L377 WeakPolarHBondContact O-CB 3.15Å; E373-L377 VanDerWaalsContact O-CG 3.29Å; E373-L377 WeakPolarHBondContact O-CG 3.29Å; E373-L377 PolarHBondContact O-N 3.15Å
374	V	96.3	Very high	93.7	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-43.1	172.2	167.7	0	0	0	0	111.3	F263 V265 V315 V370 H378 L565 F567	F263-V374 HydrophobicContact CD2-CG1 4.13Å; F263-V374 HydrophobicContact CE2-CG1 4.46Å; F263-V374 HydrophobicContact CG-CG1 4.26Å; V265-V374 HydrophobicContact CG2-CG2 4.39Å; V315-V374 HydrophobicContact CB-CG2 4.47Å; V315-V374 HydrophobicContact CG1-CG2 3.89Å; V315-V374 HydrophobicContact CG2-CG2 3.73Å; V370-V374 HydrophobicContact CG1-CG2 4.47Å; V370-V374 WeakPolarHBondContact O-CB 3.27Å; V370-V374 VanDerWaalsContact O-CG2 3.27Å; V370-V374 WeakPolarHBondContact O-CG2 3.4Å; V370-V374 PolarHBondContact O-N 2.93Å; V374-H378 WeakPolarHBondContact O-CB 3.29Å; V374-H378 PolarHBondContact O-N 3.23Å; V374-L565 HydrophobicContact CB-CD2 4.38Å; V374-L565 HydrophobicContact CG1-CD2 3.88Å; V374-F567 HydrophobicContact CG1-CE1 3.61Å; V374-F567 HydrophobicContact CG1-CZ 3.57Å
375	N	96.8	Very high	94	Very high	31 Å²	31	39.3 Å²	39.3	17%	0.166	21%	0.205	C	C	.	.	H	α-helix	trans	-68.2	-37.3	177	-75.2	-28.7	0	0	0	112.6	A371 S372 E373 A379 Q564 L565 V566	A371-N375 VanDerWaalsContact O-CB 3.26Å; A371-N375 WeakPolarHBondContact O-CB 3.45Å; A371-N375 PolarHBondContact O-N 2.88Å; A371-N375 PolarHBondContact O-ND2 2.86Å; A371-N375 VanDerWaalsContact O-ND2 3.12Å; S372-N375 PolarHBondContact O-N 2.96Å; E373-N375 VanDerWaalsContact C-N 3.29Å; E373-N375 PolarHBondContact O-N 2.95Å; N375-A379 WeakPolarHBondContact O-CB 3.2Å; N375-A379 PolarHBondContact O-N 2.88Å; N375-Q564 PolarHBondContact ND2-O 3.16Å; N375-L565 WeakPolarHBondContact OD1-CA 3.43Å; N375-V566 HydrophobicContact CB-CG1 4.35Å; N375-V566 WeakPolarHBondContact OD1-CG2 3.27Å; N375-V566 PolarHBondContact OD1-N 3.16Å
376	R	96	Very high	94.3	Very high	108 Å²	108	41.5 Å²	41.5	41%	0.408	22%	0.22	S	C	.	.	H	α-helix	trans	-63.2	-51	175.1	-174.5	-169.2	72.5	84.4	-0	110.9	Y147 S372 E373 H378 A379 L380	Y147-R376 PolarHBondContact O-NH2 3.49Å; S372-R376 WeakPolarHBondContact O-CB 3.31Å; S372-R376 PolarHBondContact O-N 2.85Å; E373-R376 WeakPolarHBondContact O-CB 3.42Å; E373-R376 PolarHBondContact O-N 3.32Å; E373-R376 VanDerWaalsContact O-N 3.17Å; E373-R376 IonicContact OE1-CZ 2.77Å; E373-R376 IonicContact OE1-NE 3.26Å; E373-R376 IonicContact OE1-NH2 3.63Å; E373-R376 PolarHBondContact OE1-NH2 3.15Å; E373-R376 IonicContact OE2-CZ 3.39Å; E373-R376 IonicContact OE2-NE 3.45Å; E373-R376 PolarHBondContact OE2-NE 3Å; E373-R376 IonicContact OE2-NH2 2.75Å; E373-R376 PolarHBondContact OE2-NH2 3.24Å; R376-H378 VanDerWaalsContact C-N 3.33Å; R376-H378 PolarHBondContact O-N 2.77Å; R376-A379 PolarHBondContact O-N 3.1Å; R376-L380 WeakPolarHBondContact O-CB 3.42Å; R376-L380 PolarHBondContact O-N 3.29Å
377	L	96.8	Very high	94.4	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-41.1	178.8	-68.2	169.3	0	0	0	111.4	Y147 F263 V315 E373 L380 F381	Y147-L377 HydrophobicContact CD1-CD2 4.11Å; Y147-L377 WeakPolarHBondContact O-CD2 3.48Å; F263-L377 HydrophobicContact CD1-CB 4.3Å; F263-L377 HydrophobicContact CD1-CD1 4.44Å; F263-L377 HydrophobicContact CE1-CB 3.61Å; F263-L377 HydrophobicContact CZ-CB 4.46Å; V315-L377 HydrophobicContact CB-CD1 4.49Å; V315-L377 HydrophobicContact CG2-CD1 4.02Å; E373-L377 HydrophobicContact CG-CD1 4.04Å; E373-L377 HydrophobicContact CG-CG 4.46Å; E373-L377 WeakPolarHBondContact O-CB 3.15Å; E373-L377 VanDerWaalsContact O-CG 3.29Å; E373-L377 WeakPolarHBondContact O-CG 3.29Å; E373-L377 PolarHBondContact O-N 3.15Å; L377-L380 PolarHBondContact O-N 3.21Å; L377-F381 WeakPolarHBondContact O-CB 3.29Å; L377-F381 PolarHBondContact O-N 2.74Å
378	H	96.9	Very high	94.6	Very high	24 Å²	24	51.5 Å²	51.5	11%	0.111	27%	0.267	C	S	.	.	H	α-helix	trans	-61.9	-46.2	173.7	-178.4	-87.5	0	0	0	112.5	F263 V374 R376 L380 F381 Q382 V566 F567	F263-H378 HydrophobicContact CE2-CB 4.1Å; F263-H378 HydrophobicContact CZ-CB 3.67Å; V374-H378 WeakPolarHBondContact O-CB 3.29Å; V374-H378 PolarHBondContact O-N 3.23Å; R376-H378 VanDerWaalsContact C-N 3.33Å; R376-H378 PolarHBondContact O-N 2.77Å; H378-L380 VanDerWaalsContact C-N 3.35Å; H378-L380 PolarHBondContact O-N 2.96Å; H378-F381 PolarHBondContact O-N 2.84Å; H378-Q382 WeakPolarHBondContact O-CB 3.49Å; H378-Q382 WeakPolarHBondContact O-CG 3.37Å; H378-Q382 PolarHBondContact O-N 2.83Å; H378-V566 HydrophobicContact CB-CG2 4.41Å; H378-V566 WeakPolarHBondContact ND1-CG2 3.47Å; H378-F567 HydrophobicContact CB-CD1 3.99Å; H378-F567 HydrophobicContact CB-CE1 3.95Å; H378-F567 AromaticContact CD2-CD1 3.38Å; H378-F567 WeakPolarHBondContact CD2-CD1 3.46Å; H378-F567 AromaticContact CD2-CE1 3.93Å; H378-F567 AromaticContact CD2-CG 3.82Å; H378-F567 AromaticContact CG-CD1 3.55Å; H378-F567 AromaticContact CG-CE1 4Å; H378-F567 AromaticContact NE2-CD1 3.88Å; H378-F567 AromaticContact NE2-CG 3.95Å
379	A	96.6	Very high	94.5	Very high	58 Å²	58	55.2 Å²	55.2	48%	0.479	29%	0.287	S	S	.	.	H	α-helix	trans	-62.2	-41.8	177.8	0	0	0	0	0	112.2	N375 R376 Q383	N375-A379 WeakPolarHBondContact O-CB 3.2Å; N375-A379 PolarHBondContact O-N 2.88Å; R376-A379 PolarHBondContact O-N 3.1Å; A379-Q383 WeakPolarHBondContact O-CB 3.5Å; A379-Q383 PolarHBondContact O-N 2.74Å
380	L	96.1	Very high	94.5	Very high	37 Å²	37	54.5 Å²	54.5	19%	0.194	29%	0.285	C	S	.	.	H	α-helix	trans	-66.2	-43.7	177.3	-177.6	59.3	0	0	0	112.1	V146 Y147 R376 L377 H378 Q382 Q383 R384	V146-L380 HydrophobicContact CG1-CD2 4.08Å; V146-L380 HydrophobicContact CG1-CG 4.39Å; V146-L380 WeakPolarHBondContact O-CD2 3.4Å; Y147-L380 HydrophobicContact CD1-CD2 3.91Å; Y147-L380 HydrophobicContact CD1-CG 4.25Å; Y147-L380 HydrophobicContact CE1-CB 4.47Å; Y147-L380 HydrophobicContact CE1-CD2 4.2Å; Y147-L380 HydrophobicContact CE1-CG 4.04Å; R376-L380 WeakPolarHBondContact O-CB 3.42Å; R376-L380 PolarHBondContact O-N 3.29Å; L377-L380 PolarHBondContact O-N 3.21Å; H378-L380 VanDerWaalsContact C-N 3.35Å; H378-L380 PolarHBondContact O-N 2.96Å; L380-Q382 PolarHBondContact O-N 2.77Å; L380-Q383 WeakPolarHBondContact O-CB 3.5Å; L380-Q383 PolarHBondContact O-N 2.87Å; L380-R384 PolarHBondContact O-N 2.8Å
381	F	96.4	Very high	94.5	Very high	1 Å²	1	59.3 Å²	59.3	0%	0.004	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-46.1	176.9	-179.1	-91.3	0	0	0	111.7	Y147 V258 L261 E311 L313 L377 H378 Q383 R384 H385 F388	Y147-F381 HydrophobicContact CE1-CB 4.07Å; Y147-F381 HydrophobicContact CE1-CD2 4.4Å; V258-F381 HydrophobicContact CB-CZ 4.31Å; V258-F381 HydrophobicContact CG1-CZ 4.05Å; V258-F381 HydrophobicContact CG2-CZ 4.39Å; L261-F381 HydrophobicContact CD1-CD1 4.35Å; L261-F381 HydrophobicContact CD1-CD2 3.96Å; L261-F381 HydrophobicContact CD1-CE1 4.33Å; L261-F381 HydrophobicContact CD1-CE2 3.95Å; L261-F381 HydrophobicContact CD1-CG 4.16Å; L261-F381 HydrophobicContact CD1-CZ 4.14Å; L261-F381 HydrophobicContact CD2-CB 4.39Å; L261-F381 HydrophobicContact CD2-CD1 3.63Å; L261-F381 HydrophobicContact CD2-CE1 4.02Å; L261-F381 HydrophobicContact CD2-CG 3.93Å; E311-F381 HydrophobicContact CB-CE2 4.4Å; E311-F381 HydrophobicContact CG-CE2 4.15Å; L313-F381 HydrophobicContact CD1-CB 4.17Å; L313-F381 HydrophobicContact CD1-CD2 4.12Å; L313-F381 HydrophobicContact CD1-CG 4.43Å; L377-F381 WeakPolarHBondContact O-CB 3.29Å; L377-F381 PolarHBondContact O-N 2.74Å; H378-F381 PolarHBondContact O-N 2.84Å; F381-Q383 VanDerWaalsContact C-N 3.31Å; F381-Q383 PolarHBondContact O-N 3.45Å; F381-R384 PolarHBondContact O-N 2.8Å; F381-H385 AromaticContact CD2-CE1 3.77Å; F381-H385 AromaticContact CD2-ND1 3.6Å; F381-H385 HydrophobicContact CE1-CB 4.17Å; F381-H385 AromaticContact CE2-CE1 3.4Å; F381-H385 VanDerWaalsContact CE2-CE1 3.4Å; F381-H385 WeakPolarHBondContact CE2-CE1 3.49Å; F381-H385 AromaticContact CE2-CG 3.99Å; F381-H385 AromaticContact CE2-ND1 3.42Å; F381-H385 WeakPolarHBondContact CE2-ND1 3.31Å; F381-H385 AromaticContact CE2-NE2 3.92Å; F381-H385 HydrophobicContact CZ-CB 4.26Å; F381-H385 AromaticContact CZ-CG 3.82Å; F381-H385 AromaticContact CZ-ND1 3.71Å; F381-H385 PolarHBondContact O-N 3.33Å; F381-H385 PolarHBondContact O-ND1 3.33Å; F381-H385 VanDerWaalsContact O-ND1 3.17Å; F381-F388 HydrophobicContact CE1-CB 4.2Å; F381-F388 AromaticContact CE1-CD1 3.87Å; F381-F388 HydrophobicContact CE1-CD1 3.87Å; F381-F388 AromaticContact CE1-CD2 3.89Å; F381-F388 HydrophobicContact CE1-CD2 3.89Å; F381-F388 HydrophobicContact CE1-CE1 4.17Å; F381-F388 HydrophobicContact CE1-CE2 4.19Å; F381-F388 AromaticContact CE1-CG 3.71Å; F381-F388 HydrophobicContact CE1-CG 3.71Å; F381-F388 HydrophobicContact CE1-CZ 4.31Å; F381-F388 HydrophobicContact CZ-CD2 4.18Å; F381-F388 HydrophobicContact CZ-CE2 4.43Å; F381-F388 HydrophobicContact CZ-CG 4.41Å
382	Q	95.3	Very high	94.6	Very high	67 Å²	67	59.9 Å²	59.9	31%	0.313	31%	0.31	S	S	.	.	H	α-helix	trans	-64.5	-32.6	177.1	-69.1	-78.1	-29.3	0	0	112.9	H378 L380 R384 H385	H378-Q382 WeakPolarHBondContact O-CB 3.49Å; H378-Q382 WeakPolarHBondContact O-CG 3.37Å; H378-Q382 PolarHBondContact O-N 2.83Å; L380-Q382 PolarHBondContact O-N 2.77Å; Q382-R384 VanDerWaalsContact C-N 3.33Å; Q382-H385 CarbonylContact O-C 3.48Å
383	Q	94.6	Very high	94.7	Very high	151 Å²	151	56.4 Å²	56.4	71%	0.706	29%	0.285	S	S	*	.	H	α-helix	trans	-65.9	-36.4	174.2	-178.2	-179.6	-4	0	0	112	A379 L380 F381	A379-Q383 WeakPolarHBondContact O-CB 3.5Å; A379-Q383 PolarHBondContact O-N 2.74Å; L380-Q383 WeakPolarHBondContact O-CB 3.5Å; L380-Q383 PolarHBondContact O-N 2.87Å; F381-Q383 VanDerWaalsContact C-N 3.31Å; F381-Q383 PolarHBondContact O-N 3.45Å
384	R	93.2	Very high	94.9	Very high	62 Å²	62	54.9 Å²	54.9	23%	0.234	28%	0.279	C	S	.	.	H	α-helix	trans	-85.5	-30.8	-179.6	-65.8	-163.8	73.6	120.2	-4	114	A128 E132 D135 L380 F381 Q382 P386	A128-R384 VanDerWaalsContact CB-NH2 3.3Å; E132-R384 IonicContact OE2-CZ 2.97Å; E132-R384 IonicContact OE2-NE 3.11Å; E132-R384 PolarHBondContact OE2-NE 3.38Å; E132-R384 IonicContact OE2-NH2 3.69Å; D135-R384 IonicContact OD1-CZ 3.3Å; D135-R384 IonicContact OD1-NH1 3.25Å; D135-R384 PolarHBondContact OD1-NH1 3.05Å; D135-R384 IonicContact OD1-NH2 3.41Å; D135-R384 PolarHBondContact OD1-NH2 3.25Å; D135-R384 IonicContact OD2-CZ 3.54Å; D135-R384 IonicContact OD2-NH1 2.75Å; D135-R384 PolarHBondContact OD2-NH1 3.2Å; D135-R384 IonicContact OD2-NH2 3.4Å; L380-R384 PolarHBondContact O-N 2.8Å; F381-R384 PolarHBondContact O-N 2.8Å; Q382-R384 VanDerWaalsContact C-N 3.33Å; R384-P386 WeakPolarHBondContact O-CD 3.43Å
385	H	93.6	Very high	95	Very high	22 Å²	22	54.9 Å²	54.9	10%	0.102	28%	0.278	C	S	.	.			trans	-114.1	68.8	177.2	-54.1	79.2	0	0	0	111.9	F381 Q382 E387 F388	F381-H385 AromaticContact CD2-CE1 3.77Å; F381-H385 AromaticContact CD2-ND1 3.6Å; F381-H385 HydrophobicContact CE1-CB 4.17Å; F381-H385 AromaticContact CE2-CE1 3.4Å; F381-H385 VanDerWaalsContact CE2-CE1 3.4Å; F381-H385 WeakPolarHBondContact CE2-CE1 3.49Å; F381-H385 AromaticContact CE2-CG 3.99Å; F381-H385 AromaticContact CE2-ND1 3.42Å; F381-H385 WeakPolarHBondContact CE2-ND1 3.31Å; F381-H385 AromaticContact CE2-NE2 3.92Å; F381-H385 HydrophobicContact CZ-CB 4.26Å; F381-H385 AromaticContact CZ-CG 3.82Å; F381-H385 AromaticContact CZ-ND1 3.71Å; F381-H385 PolarHBondContact O-N 3.33Å; F381-H385 PolarHBondContact O-ND1 3.33Å; F381-H385 VanDerWaalsContact O-ND1 3.17Å; Q382-H385 CarbonylContact O-C 3.48Å; H385-E387 PolarHBondContact O-N 3.24Å; H385-E387 VanDerWaalsContact O-N 3.09Å; H385-F388 HydrophobicContact CB-CB 3.93Å; H385-F388 WeakPolarHBondContact O-CB 3.47Å; H385-F388 PolarHBondContact O-N 3.21Å; H385-F388 VanDerWaalsContact O-N 3.07Å
386	P	91.9	Very high	94.9	Very high	109 Å²	109	53.4 Å²	53.4	71%	0.708	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.7	179	-25.1	33.6	0	0	0	115.3	R384	R384-P386 WeakPolarHBondContact O-CD 3.43Å
387	E	91.5	Very high	94.7	Very high	185 Å²	185	48.6 Å²	48.6	86%	0.864	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-0.4	-179.8	-57.8	-167.6	166.2	0	0	113.4	H385 D389	H385-E387 PolarHBondContact O-N 3.24Å; H385-E387 VanDerWaalsContact O-N 3.09Å; E387-D389 PolarHBondContact O-N 2.95Å
388	F	94.1	Very high	94.4	Very high	26 Å²	26	48.7 Å²	48.7	11%	0.114	25%	0.253	C	S	.	.			trans	-70.4	109.9	-179.8	177.1	-98.2	0	0	0	112	V258 L261 F381 H385 G390 V392	V258-F388 HydrophobicContact CB-CD2 4.25Å; V258-F388 HydrophobicContact CB-CE2 4.38Å; V258-F388 HydrophobicContact CG1-CD2 4.3Å; V258-F388 HydrophobicContact CG1-CE2 3.96Å; V258-F388 WeakPolarHBondContact O-CD2 3.02Å; L261-F388 HydrophobicContact CB-CE1 4.39Å; L261-F388 HydrophobicContact CB-CE2 4.48Å; L261-F388 HydrophobicContact CB-CZ 3.81Å; F381-F388 HydrophobicContact CE1-CB 4.2Å; F381-F388 AromaticContact CE1-CD1 3.87Å; F381-F388 HydrophobicContact CE1-CD1 3.87Å; F381-F388 AromaticContact CE1-CD2 3.89Å; F381-F388 HydrophobicContact CE1-CD2 3.89Å; F381-F388 HydrophobicContact CE1-CE1 4.17Å; F381-F388 HydrophobicContact CE1-CE2 4.19Å; F381-F388 AromaticContact CE1-CG 3.71Å; F381-F388 HydrophobicContact CE1-CG 3.71Å; F381-F388 HydrophobicContact CE1-CZ 4.31Å; F381-F388 HydrophobicContact CZ-CD2 4.18Å; F381-F388 HydrophobicContact CZ-CE2 4.43Å; F381-F388 HydrophobicContact CZ-CG 4.41Å; H385-F388 HydrophobicContact CB-CB 3.93Å; H385-F388 WeakPolarHBondContact O-CB 3.47Å; H385-F388 PolarHBondContact O-N 3.21Å; H385-F388 VanDerWaalsContact O-N 3.07Å; F388-G390 WeakPolarHBondContact CE1-O 3.49Å; F388-G390 VanDerWaalsContact CZ-C 3.48Å; F388-V392 HydrophobicContact CE1-CG2 4.42Å
389	D	89.9	Confident	94	Very high	140 Å²	140	47.6 Å²	47.6	75%	0.749	25%	0.248	S	C	*	.			trans	-103.3	-1.5	174.6	69.7	-18.8	0	0	0	113.7	E387	E387-D389 PolarHBondContact O-N 2.95Å
390	G	90.3	Very high	93.8	Very high	17 Å²	17	44.8 Å²	44.8	18%	0.175	23%	0.225	C	C	.	.			trans	-62.5	173.1	-177.7	0	0	0	0	0	114.9	D259 F388	D259-G390 VanDerWaalsContact O-CA 3.28Å; D259-G390 WeakPolarHBondContact O-CA 3.4Å; F388-G390 WeakPolarHBondContact CE1-O 3.49Å; F388-G390 VanDerWaalsContact CZ-C 3.48Å
391	K	94.4	Very high	93.7	Very high	102 Å²	102	43 Å²	43	44%	0.443	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	163.7	179.2	-60.5	-64.8	177.7	-128.2	0	110.9	H260 L261 E570	H260-K391 WeakPolarHBondContact CA-O 3.41Å; H260-K391 PolarHBondContact CD2-O 2.68Å; H260-K391 VanDerWaalsContact CE1-CB 3.41Å; H260-K391 WeakPolarHBondContact CE1-CB 3.33Å; L261-K391 PolarHBondContact N-O 3.43Å; K391-E570 HydrophobicContact CB-CB 4.47Å; K391-E570 VanDerWaalsContact CB-OE2 3.27Å; K391-E570 WeakPolarHBondContact CB-OE2 3.48Å; K391-E570 VanDerWaalsContact CG-OE2 3.24Å; K391-E570 WeakPolarHBondContact CG-OE2 3.49Å
392	V	96.9	Very high	93.5	Very high	12 Å²	12	43 Å²	43	7%	0.073	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	133.6	-177.4	-169.2	0	0	0	0	108.6	L261 F263 F388 F567 P569 E570	L261-V392 HydrophobicContact CB-CG1 4.35Å; L261-V392 HydrophobicContact CB-CG2 4.35Å; L261-V392 HydrophobicContact CD2-CG1 4.3Å; L261-V392 HydrophobicContact CD2-CG2 4.41Å; L261-V392 HydrophobicContact CG-CG1 4.35Å; L261-V392 CarbonylContact O-C 3.49Å; L261-V392 VanDerWaalsContact O-CA 3.26Å; L261-V392 WeakPolarHBondContact O-CA 3.25Å; F263-V392 HydrophobicContact CD2-CG1 3.78Å; F263-V392 HydrophobicContact CE2-CG1 3.6Å; F388-V392 HydrophobicContact CE1-CG2 4.42Å; V392-F567 HydrophobicContact CB-CD2 3.73Å; V392-F567 HydrophobicContact CB-CE2 3.97Å; V392-F567 HydrophobicContact CG1-CD2 3.57Å; V392-F567 HydrophobicContact CG1-CE2 3.31Å; V392-F567 HydrophobicContact CG1-CG 4.38Å; V392-F567 HydrophobicContact CG1-CZ 3.96Å; V392-F567 HydrophobicContact CG2-CD2 4.26Å; V392-P569 CarbonylContact O-C 3.56Å; V392-P569 VanDerWaalsContact O-CA 3.26Å; V392-P569 WeakPolarHBondContact O-CA 3.39Å; V392-E570 PolarHBondContact O-N 3.33Å
393	S	97.7	Very high	93.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	165.6	173.3	-70.8	0	0	0	0	110.6	H260 L261 V262 F263 T571	H260-S393 WeakPolarHBondContact NE2-CB 3.42Å; H260-S393 PolarHBondContact NE2-N 3.5Å; H260-S393 PolarHBondContact NE2-OG 2.89Å; L261-S393 PolarHBondContact O-N 2.94Å; V262-S393 WeakPolarHBondContact CA-O 3.48Å; F263-S393 PolarHBondContact N-O 3.25Å; S393-T571 WeakPolarHBondContact CA-O 3.5Å; S393-T571 WeakPolarHBondContact CB-O 3.3Å; S393-T571 PolarHBondContact OG-N 2.84Å; S393-T571 PolarHBondContact OG-O 3.26Å
394	V	97.8	Very high	93.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	139.1	176.9	-62.6	0	0	0	0	110.5	F263 L404 L408 F567 P569 T571 F572 F573	F263-V394 HydrophobicContact CB-CG1 4.38Å; F263-V394 WeakPolarHBondContact O-CA 3.18Å; V394-L404 HydrophobicContact CB-CD1 3.96Å; V394-L404 HydrophobicContact CB-CD2 4.2Å; V394-L404 HydrophobicContact CG1-CD2 4.43Å; V394-L404 HydrophobicContact CG2-CD1 4.18Å; V394-L404 HydrophobicContact CG2-CD2 4.33Å; V394-L408 HydrophobicContact CG2-CD1 4.12Å; V394-F567 HydrophobicContact CG1-CE2 4.33Å; V394-F567 HydrophobicContact CG1-CZ 4.47Å; V394-P569 HydrophobicContact CG1-CB 4.23Å; V394-P569 HydrophobicContact CG1-CG 4.02Å; V394-P569 HydrophobicContact CG2-CB 4.15Å; V394-P569 HydrophobicContact CG2-CG 4.4Å; V394-T571 PolarHBondContact N-O 3.3Å; V394-F572 HydrophobicContact CG2-CB 4.03Å; V394-F572 HydrophobicContact CG2-CD2 3.83Å; V394-F572 HydrophobicContact CG2-CG 4.18Å; V394-F572 WeakPolarHBondContact O-CA 3.3Å; V394-F573 PolarHBondContact O-N 3.42Å
395	V	97.7	Very high	93.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	127.3	174.7	177.1	0	0	0	0	107.4	V262 F263 M264 V265 F573 F575 L763	V262-V395 HydrophobicContact CG1-CB 4.32Å; V262-V395 HydrophobicContact CG1-CG2 3.43Å; V262-V395 VanDerWaalsContact CG1-CG2 3.43Å; F263-V395 PolarHBondContact O-N 3.25Å; M264-V395 WeakPolarHBondContact CA-O 3.38Å; M264-V395 HydrophobicContact CE-CB 4.21Å; M264-V395 HydrophobicContact CE-CG1 3.9Å; M264-V395 HydrophobicContact CE-CG2 4.31Å; M264-V395 HydrophobicContact CG-CB 4.21Å; V265-V395 PolarHBondContact N-O 2.9Å; V395-F573 CarbonylContact C-O 3.59Å; V395-F573 VanDerWaalsContact CA-O 3.29Å; V395-F573 WeakPolarHBondContact CA-O 3.49Å; V395-F573 HydrophobicContact CG2-CB 4.14Å; V395-F573 HydrophobicContact CG2-CD2 4.04Å; V395-F573 HydrophobicContact CG2-CG 4.49Å; V395-F575 HydrophobicContact CG1-CD1 4.48Å; V395-F575 HydrophobicContact CG1-CD2 3.82Å; V395-F575 HydrophobicContact CG1-CE1 4.28Å; V395-F575 HydrophobicContact CG1-CE2 3.6Å; V395-F575 HydrophobicContact CG1-CG 4.28Å; V395-F575 HydrophobicContact CG1-CZ 3.85Å; V395-L763 HydrophobicContact CG2-CD1 3.6Å
396	G	95	Very high	93.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.2	171.7	0	0	0	0	0	110.6	V265 S401 F573 A574 F575	V265-G396 CarbonylContact O-C 3.51Å; V265-G396 WeakPolarHBondContact O-CA 3.11Å; G396-S401 WeakPolarHBondContact O-CB 3.28Å; G396-F573 PolarHBondContact N-O 2.67Å; G396-A574 CarbonylContact O-C 3.56Å; G396-A574 WeakPolarHBondContact O-CA 3.39Å; G396-F575 PolarHBondContact O-N 2.8Å
397	H	92.3	Very high	93.6	Very high	7 Å²	7	23.8 Å²	23.8	3%	0.032	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	138.8	170.4	168.8	-102.5	0	0	0	110.2	V265 H266 G267 L399 G400 F575 H750 Y753 W754	V265-H397 PolarHBondContact O-N 3.3Å; H266-H397 CarbonylContact C-O 3.51Å; G267-H397 PolarHBondContact N-O 2.91Å; G267-H397 VanDerWaalsContact N-O 3.15Å; H397-L399 PolarHBondContact O-N 3.1Å; H397-G400 WeakPolarHBondContact O-CA 3.42Å; H397-G400 PolarHBondContact O-N 2.8Å; H397-F575 WeakPolarHBondContact CA-O 3.18Å; H397-F575 HydrophobicContact CB-CB 4.3Å; H397-H750 AromaticContact CE1-NE2 3.83Å; H397-H750 AromaticContact NE2-NE2 3.85Å; H397-H750 PolarHBondContact NE2-O 2.83Å; H397-Y753 AromaticContact CD2-CD2 3.68Å; H397-Y753 AromaticContact NE2-CD2 3.82Å; H397-W754 HydrophobicContact CB-CH2 3.9Å; H397-W754 HydrophobicContact CB-CZ2 3.48Å; H397-W754 VanDerWaalsContact CB-CZ2 3.48Å; H397-W754 AromaticContact CG-CZ2 3.64Å; H397-W754 AromaticContact ND1-CZ2 3.74Å; H397-W754 AromaticContact ND1-NE1 4Å
398	S	89.3	Confident	93.7	Very high	3 Å²	3	15 Å²	15	2%	0.021	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	-131.4	178.4	-166.7	0	0	0	0	111.5	G400 S401 F575 P578 H750	S398-G400 PolarHBondContact O-N 2.63Å; S398-G400 VanDerWaalsContact O-N 3.16Å; S398-S401 WeakPolarHBondContact O-CB 3.41Å; S398-S401 PolarHBondContact O-N 3.4Å; S398-S401 PolarHBondContact O-OG 3.39Å; S398-F575 PolarHBondContact N-O 2.78Å; S398-P578 WeakPolarHBondContact O-CD 3.4Å; S398-H750 VanDerWaalsContact CB-NE2 3.29Å; S398-H750 WeakPolarHBondContact CB-NE2 3.12Å; S398-H750 PolarHBondContact OG-CE1 3.43Å; S398-H750 VanDerWaalsContact OG-CE1 3.31Å; S398-H750 PolarHBondContact OG-NE2 3Å
399	L	89.1	Confident	93.5	Very high	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-53.5	-31.3	175	176	64.1	0	0	0	113.7	I268 W317 D353 L354 Y357 H397 S401 L402 I403	I268-L399 HydrophobicContact CB-CD2 4.47Å; I268-L399 HydrophobicContact CD1-CD2 3.64Å; I268-L399 HydrophobicContact CG1-CD2 3.89Å; W317-L399 HydrophobicContact CH2-CD2 4.37Å; D353-L399 HydrophobicContact CB-CD2 3.85Å; L354-L399 HydrophobicContact CD2-CB 4.14Å; L354-L399 HydrophobicContact CD2-CD1 3.97Å; Y357-L399 HydrophobicContact CD1-CD1 3.85Å; Y357-L399 HydrophobicContact CG-CD1 3.75Å; H397-L399 PolarHBondContact O-N 3.1Å; L399-S401 PolarHBondContact O-N 3.35Å; L399-S401 VanDerWaalsContact O-N 3.16Å; L399-L402 HydrophobicContact CD1-CB 4.25Å; L399-L402 HydrophobicContact CD1-CD2 3.98Å; L399-L402 WeakPolarHBondContact O-CB 3.34Å; L399-L402 PolarHBondContact O-N 2.78Å; L399-I403 HydrophobicContact CD1-CG1 4.37Å; L399-I403 HydrophobicContact CD2-CD1 4.29Å; L399-I403 HydrophobicContact CG-CD1 3.88Å; L399-I403 HydrophobicContact CG-CG1 4.24Å; L399-I403 PolarHBondContact O-N 2.93Å
400	G	92.3	Very high	93.6	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-57	-30.4	176	0	0	0	0	0	113.2	H266 H397 S398 L404	H266-G400 WeakPolarHBondContact O-CA 3.26Å; H397-G400 WeakPolarHBondContact O-CA 3.42Å; H397-G400 PolarHBondContact O-N 2.8Å; S398-G400 PolarHBondContact O-N 2.63Å; S398-G400 VanDerWaalsContact O-N 3.16Å; G400-L404 WeakPolarHBondContact O-CB 3.36Å; G400-L404 WeakPolarHBondContact O-CG 3.22Å; G400-L404 PolarHBondContact O-N 2.85Å; G400-L404 VanDerWaalsContact O-N 3.09Å
401	S	94.1	Very high	93.6	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-68.1	-39.6	172.6	69.5	0	0	0	0	113.1	G396 S398 L399 F405 F572 S577	G396-S401 WeakPolarHBondContact O-CB 3.28Å; S398-S401 WeakPolarHBondContact O-CB 3.41Å; S398-S401 PolarHBondContact O-N 3.4Å; S398-S401 PolarHBondContact O-OG 3.39Å; L399-S401 PolarHBondContact O-N 3.35Å; L399-S401 VanDerWaalsContact O-N 3.16Å; S401-F405 VanDerWaalsContact O-CB 3.27Å; S401-F405 WeakPolarHBondContact O-CB 3.32Å; S401-F405 PolarHBondContact O-N 3.17Å; S401-F572 VanDerWaalsContact O-CZ 3.32Å; S401-F572 WeakPolarHBondContact O-CZ 3.48Å; S401-S577 WeakPolarHBondContact OG-CB 3.13Å; S401-S577 PolarHBondContact OG-OG 3Å
402	L	92.6	Very high	93.3	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-69.3	-40.9	178.1	178.3	66.2	0	0	0	111.3	Y357 L399 F405 D406 I579 F582	Y357-L402 HydrophobicContact CD1-CD2 3.59Å; Y357-L402 HydrophobicContact CD1-CG 4.15Å; Y357-L402 HydrophobicContact CE1-CD2 3.74Å; Y357-L402 HydrophobicContact CE1-CG 3.79Å; L399-L402 HydrophobicContact CD1-CB 4.25Å; L399-L402 HydrophobicContact CD1-CD2 3.98Å; L399-L402 WeakPolarHBondContact O-CB 3.34Å; L399-L402 PolarHBondContact O-N 2.78Å; L402-F405 PolarHBondContact O-N 2.89Å; L402-D406 PolarHBondContact O-N 2.99Å; L402-I579 HydrophobicContact CB-CG1 4.34Å; L402-I579 HydrophobicContact CD1-CG1 4.23Å; L402-F582 HydrophobicContact CD1-CB 3.8Å; L402-F582 HydrophobicContact CD1-CG 4.17Å; L402-F582 HydrophobicContact CD2-CB 4Å; L402-F582 HydrophobicContact CD2-CD1 3.43Å; L402-F582 VanDerWaalsContact CD2-CD1 3.43Å; L402-F582 HydrophobicContact CD2-CD2 3.69Å; L402-F582 HydrophobicContact CD2-CE1 3.69Å; L402-F582 HydrophobicContact CD2-CE2 3.94Å; L402-F582 HydrophobicContact CD2-CG 3.4Å; L402-F582 HydrophobicContact CD2-CZ 3.92Å; L402-F582 HydrophobicContact CG-CG 4.44Å
403	I	92.9	Very high	92.2	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-59.6	-48.6	175.4	-63.4	162.4	0	0	0	110.2	W317 Y357 I366 V367 V370 L399 D406 L407	W317-I403 HydrophobicContact CH2-CD1 3.54Å; W317-I403 HydrophobicContact CZ2-CD1 3.33Å; Y357-I403 HydrophobicContact CD2-CG1 3.95Å; Y357-I403 HydrophobicContact CE2-CG1 3.62Å; I366-I403 HydrophobicContact CG2-CD1 3.49Å; I366-I403 VanDerWaalsContact CG2-CD1 3.49Å; I366-I403 HydrophobicContact CG2-CG1 3.94Å; V367-I403 HydrophobicContact CG1-CG2 4.48Å; V370-I403 HydrophobicContact CB-CG2 4.05Å; V370-I403 HydrophobicContact CG1-CG2 3.91Å; V370-I403 HydrophobicContact CG2-CG2 4.18Å; L399-I403 HydrophobicContact CD1-CG1 4.37Å; L399-I403 HydrophobicContact CD2-CD1 4.29Å; L399-I403 HydrophobicContact CG-CD1 3.88Å; L399-I403 HydrophobicContact CG-CG1 4.24Å; L399-I403 PolarHBondContact O-N 2.93Å; I403-D406 PolarHBondContact O-N 3.47Å; I403-L407 HydrophobicContact CG2-CD1 4Å; I403-L407 WeakPolarHBondContact O-CB 3.41Å; I403-L407 WeakPolarHBondContact O-CG 3.46Å; I403-L407 PolarHBondContact O-N 3.26Å
404	L	95.6	Very high	90.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-63.7	-41.6	175.8	-75.9	174.2	0	0	0	112.3	V265 V394 G400 D406 L407 L408 F572	V265-L404 HydrophobicContact CB-CD1 3.99Å; V265-L404 HydrophobicContact CB-CG 4.33Å; V265-L404 HydrophobicContact CG2-CD1 3.82Å; V265-L404 HydrophobicContact CG2-CD2 4.07Å; V265-L404 HydrophobicContact CG2-CG 4.03Å; V394-L404 HydrophobicContact CB-CD1 3.96Å; V394-L404 HydrophobicContact CB-CD2 4.2Å; V394-L404 HydrophobicContact CG1-CD2 4.43Å; V394-L404 HydrophobicContact CG2-CD1 4.18Å; V394-L404 HydrophobicContact CG2-CD2 4.33Å; G400-L404 WeakPolarHBondContact O-CB 3.36Å; G400-L404 WeakPolarHBondContact O-CG 3.22Å; G400-L404 PolarHBondContact O-N 2.85Å; G400-L404 VanDerWaalsContact O-N 3.09Å; L404-D406 PolarHBondContact O-N 2.97Å; L404-L407 PolarHBondContact O-N 2.76Å; L404-L408 VanDerWaalsContact O-CB 3.29Å; L404-L408 WeakPolarHBondContact O-CB 3.37Å; L404-L408 WeakPolarHBondContact O-CG 3.46Å; L404-L408 PolarHBondContact O-N 2.65Å; L404-F572 HydrophobicContact CB-CD2 4.48Å; L404-F572 HydrophobicContact CB-CE2 3.84Å; L404-F572 HydrophobicContact CB-CZ 3.95Å; L404-F572 HydrophobicContact CD1-CD2 4.42Å; L404-F572 HydrophobicContact CD1-CE2 4Å
405	F	94.9	Very high	87.8	Confident	1 Å²	1	27.5 Å²	27.5	0%	0.004	13%	0.127	C	C	.	.	H	α-helix	trans	-60	-45.3	178	-176.5	-82.1	0	0	0	112.1	S401 L402 T409 I546 F572 I579 L583 F597 F603	S401-F405 VanDerWaalsContact O-CB 3.27Å; S401-F405 WeakPolarHBondContact O-CB 3.32Å; S401-F405 PolarHBondContact O-N 3.17Å; L402-F405 PolarHBondContact O-N 2.89Å; F405-T409 VanDerWaalsContact O-CB 3.28Å; F405-T409 WeakPolarHBondContact O-CB 3.46Å; F405-T409 PolarHBondContact O-N 3.02Å; F405-T409 PolarHBondContact O-OG1 3.24Å; F405-I546 HydrophobicContact CE1-CD1 3.53Å; F405-I546 HydrophobicContact CZ-CD1 3.46Å; F405-I546 VanDerWaalsContact CZ-CD1 3.46Å; F405-F572 HydrophobicContact CB-CE1 3.96Å; F405-F572 HydrophobicContact CB-CZ 4.37Å; F405-F572 HydrophobicContact CD2-CE1 4.16Å; F405-I579 HydrophobicContact CB-CD1 3.69Å; F405-I579 HydrophobicContact CB-CG1 4.04Å; F405-I579 HydrophobicContact CD1-CG2 4.26Å; F405-I579 HydrophobicContact CD2-CD1 3.77Å; F405-I579 HydrophobicContact CD2-CG1 4.37Å; F405-I579 HydrophobicContact CD2-CG2 3.84Å; F405-I579 HydrophobicContact CE1-CG2 4.36Å; F405-I579 HydrophobicContact CE2-CG2 3.92Å; F405-I579 HydrophobicContact CG-CD1 3.94Å; F405-I579 HydrophobicContact CG-CG1 4.21Å; F405-I579 HydrophobicContact CG-CG2 4.02Å; F405-I579 HydrophobicContact CZ-CG2 4.19Å; F405-L583 HydrophobicContact CE1-CD1 4.21Å; F405-L583 HydrophobicContact CE1-CD2 3.79Å; F405-L583 HydrophobicContact CE1-CG 4.48Å; F405-L583 HydrophobicContact CZ-CD1 3.93Å; F405-L583 HydrophobicContact CZ-CD2 4.32Å; F405-F597 HydrophobicContact CD2-CE1 4.06Å; F405-F597 AromaticContact CD2-CZ 3.64Å; F405-F597 HydrophobicContact CD2-CZ 3.64Å; F405-F597 HydrophobicContact CE2-CE1 4.05Å; F405-F597 AromaticContact CE2-CZ 3.61Å; F405-F597 HydrophobicContact CE2-CZ 3.61Å; F405-F597 HydrophobicContact CG-CZ 4.48Å; F405-F597 HydrophobicContact CZ-CE1 4.48Å; F405-F597 HydrophobicContact CZ-CZ 4.41Å; F405-F603 HydrophobicContact CD2-CZ 4.43Å
406	D	92.8	Very high	85.1	Confident	6 Å²	6	38 Å²	38	3%	0.032	17%	0.166	C	C	.	.	H	α-helix	trans	-67	-43.8	177.5	-73	-11.5	0	0	0	111.2	Y357 L402 I403 L404 L408 T409 N410 Y562 R586	Y357-D406 VanDerWaalsContact CE1-OD2 3.3Å; Y357-D406 WeakPolarHBondContact CE1-OD2 3.27Å; Y357-D406 PolarHBondContact OH-OD2 3.08Å; L402-D406 PolarHBondContact O-N 2.99Å; I403-D406 PolarHBondContact O-N 3.47Å; L404-D406 PolarHBondContact O-N 2.97Å; D406-L408 PolarHBondContact O-N 2.7Å; D406-T409 PolarHBondContact O-N 2.66Å; D406-N410 PolarHBondContact O-N 3.25Å; D406-N410 PolarHBondContact O-ND2 2.98Å; D406-Y562 HydrophobicContact CB-CD1 4.39Å; D406-Y562 HydrophobicContact CB-CE1 3.55Å; D406-R586 VanDerWaalsContact CG-NH1 3.31Å; D406-R586 IonicContact OD1-CZ 3.67Å; D406-R586 IonicContact OD1-NH1 3.94Å; D406-R586 PolarHBondContact OD1-NH1 2.96Å; D406-R586 IonicContact OD1-NH2 3.69Å; D406-R586 IonicContact OD2-CZ 2.87Å; D406-R586 IonicContact OD2-NH1 2.71Å; D406-R586 PolarHBondContact OD2-NH1 2.69Å; D406-R586 VanDerWaalsContact OD2-NH1 3.11Å; D406-R586 IonicContact OD2-NH2 3.61Å; D406-R586 PolarHBondContact OD2-NH2 2.8Å
407	L	93.4	Very high	82.4	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-58.2	-48.6	174.3	-78.8	170.1	0	0	0	111.5	V367 V370 A371 I403 L404 N410 Q411 Y562	V367-L407 HydrophobicContact CB-CD2 4.3Å; V370-L407 HydrophobicContact CG1-CD1 4.27Å; A371-L407 HydrophobicContact CB-CD1 4.24Å; A371-L407 HydrophobicContact CB-CD2 4.01Å; I403-L407 HydrophobicContact CG2-CD1 4Å; I403-L407 WeakPolarHBondContact O-CB 3.41Å; I403-L407 WeakPolarHBondContact O-CG 3.46Å; I403-L407 PolarHBondContact O-N 3.26Å; L404-L407 PolarHBondContact O-N 2.76Å; L407-N410 CarbonylContact O-C 3.58Å; L407-N410 PolarHBondContact O-N 3Å; L407-Q411 WeakPolarHBondContact O-CG 3.37Å; L407-Q411 PolarHBondContact O-N 3.44Å; L407-Q411 PolarHBondContact O-NE2 3.34Å; L407-Y562 HydrophobicContact CD2-CD1 4.22Å
408	L	93.8	Very high	79.7	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-42.8	-178.8	-70.9	175	0	0	0	112.3	V394 L404 D406 N410 Q411 L565 P569 F572 F597 P598 C600	V394-L408 HydrophobicContact CG2-CD1 4.12Å; L404-L408 VanDerWaalsContact O-CB 3.29Å; L404-L408 WeakPolarHBondContact O-CB 3.37Å; L404-L408 WeakPolarHBondContact O-CG 3.46Å; L404-L408 PolarHBondContact O-N 2.65Å; D406-L408 PolarHBondContact O-N 2.7Å; L408-N410 PolarHBondContact O-N 2.98Å; L408-Q411 PolarHBondContact O-N 2.93Å; L408-L565 HydrophobicContact CD2-CD1 4.42Å; L408-P569 HydrophobicContact CD2-CB 4.45Å; L408-P569 HydrophobicContact CD2-CG 3.87Å; L408-F572 HydrophobicContact CD1-CB 3.71Å; L408-F572 HydrophobicContact CD1-CD1 3.48Å; L408-F572 VanDerWaalsContact CD1-CD1 3.48Å; L408-F572 HydrophobicContact CD1-CD2 4.33Å; L408-F572 HydrophobicContact CD1-CE1 4.19Å; L408-F572 HydrophobicContact CD1-CG 3.58Å; L408-F597 HydrophobicContact CB-CD1 3.73Å; L408-F597 HydrophobicContact CB-CE1 3.9Å; L408-F597 HydrophobicContact CB-CG 4.44Å; L408-P598 WeakPolarHBondContact O-CD 3.04Å; L408-C600 HydrophobicContact CD2-CB 4.4Å
409	T	90.9	Very high	77	Confident	13 Å²	13	60 Å²	60	8%	0.08	27%	0.273	C	S	.	.	H	α-helix	trans	-57.6	-35	175.1	-66	0	0	0	0	111.9	F405 D406 I546 Y595	F405-T409 VanDerWaalsContact O-CB 3.28Å; F405-T409 WeakPolarHBondContact O-CB 3.46Å; F405-T409 PolarHBondContact O-N 3.02Å; F405-T409 PolarHBondContact O-OG1 3.24Å; D406-T409 PolarHBondContact O-N 2.66Å; T409-I546 HydrophobicContact CG2-CD1 4.33Å; T409-I546 HydrophobicContact CG2-CG1 3.84Å; T409-Y595 WeakPolarHBondContact CG2-OH 3.07Å; T409-Y595 PolarHBondContact OG1-OH 3.27Å
410	N	91.2	Very high	74.5	Confident	57 Å²	57	63 Å²	63	31%	0.305	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	12.4	-177.8	-69.3	-80.5	0	0	0	114.5	D406 L407 L408 Y562 Q564	D406-N410 PolarHBondContact O-N 3.25Å; D406-N410 PolarHBondContact O-ND2 2.98Å; L407-N410 CarbonylContact O-C 3.58Å; L407-N410 PolarHBondContact O-N 3Å; L408-N410 PolarHBondContact O-N 2.98Å; N410-Y562 HydrophobicContact CB-CD2 3.81Å; N410-Y562 HydrophobicContact CB-CG 3.76Å; N410-Y562 VanDerWaalsContact CG-CD2 3.42Å; N410-Y562 WeakPolarHBondContact ND2-CD2 3.4Å; N410-Y562 WeakPolarHBondContact ND2-CE2 3.44Å; N410-Q564 PolarHBondContact O-NE2 3.31Å
411	Q	91.1	Very high	71.6	Confident	9 Å²	9	68.3 Å²	68.3	4%	0.042	34%	0.336	C	S	.	.			trans	-72.8	145.7	174.2	-66.8	-52.3	-65	0	0	112.8	L407 L408 P563 P598 T599	L407-Q411 WeakPolarHBondContact O-CG 3.37Å; L407-Q411 PolarHBondContact O-N 3.44Å; L407-Q411 PolarHBondContact O-NE2 3.34Å; L408-Q411 PolarHBondContact O-N 2.93Å; Q411-P563 PolarHBondContact NE2-O 2.94Å; Q411-P598 HydrophobicContact CB-CB 4.49Å; Q411-P598 WeakPolarHBondContact O-CB 3.37Å; Q411-P598 WeakPolarHBondContact O-CG 3.42Å; Q411-T599 HydrophobicContact CB-CG2 3.67Å; Q411-T599 WeakPolarHBondContact CB-OG1 3.4Å
412	R	87.3	Confident	68.7	Low	169 Å²	169	74.2 Å²	74.2	64%	0.638	37%	0.374	S	S	*	.			trans	-100.3	114.5	178.8	-62.2	173.5	-168.1	159.9	9.9	110.1	R414 Y568	R412-R414 PolarHBondContact O-N 3.3Å; R412-R414 VanDerWaalsContact O-N 3.17Å; R412-Y568 PolarHBondContact O-OH 3.19Å
413	N	74	Confident	65.9	Low	69 Å²	69	80.3 Å²	80.3	37%	0.369	42%	0.416	S	S	.	.			trans	-70.5	110.3	177.8	-165.5	-20.3	0	0	0	111.2	S415 R416 P598	N413-S415 VanDerWaalsContact CG-OG 3.29Å; N413-S415 PolarHBondContact O-N 3.24Å; N413-S415 PolarHBondContact OD1-N 3.19Å; N413-S415 PolarHBondContact OD1-OG 3.49Å; N413-R416 PolarHBondContact O-N 2.96Å; N413-P598 WeakPolarHBondContact CB-O 3.35Å; N413-P598 PolarHBondContact ND2-O 3.23Å
414	R	56.4	Low	63	Low	177 Å²	177	83.6 Å²	83.6	67%	0.668	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.6	-178.6	-79.3	171.8	164.8	175.7	-4.1	113.3	R412 A417 R418 Y568	R412-R414 PolarHBondContact O-N 3.3Å; R412-R414 VanDerWaalsContact O-N 3.17Å; R414-A417 PolarHBondContact O-N 3.5Å; R414-R418 PolarHBondContact O-N 2.83Å; R414-Y568 WeakPolarHBondContact CB-OH 3.38Å; R414-Y568 WeakPolarHBondContact CD-OH 3.39Å; R414-Y568 WeakPolarHBondContact CG-OH 3.38Å; R414-Y568 PolarHBondContact N-OH 3.2Å
415	S	46.8	Very low	59.8	Low	66 Å²	66	92.9 Å²	92.9	46%	0.462	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-44.5	176.6	65.1	0	0	0	0	111.3	N413 A417 R418 E419	N413-S415 VanDerWaalsContact CG-OG 3.29Å; N413-S415 PolarHBondContact O-N 3.24Å; N413-S415 PolarHBondContact OD1-N 3.19Å; N413-S415 PolarHBondContact OD1-OG 3.49Å; S415-A417 PolarHBondContact O-N 2.81Å; S415-R418 PolarHBondContact O-N 3.35Å; S415-E419 PolarHBondContact O-N 2.97Å
416	R	40.8	Very low	56.7	Low	221 Å²	221	101.7 Å²	101.7	83%	0.834	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-18.7	176.1	-119.2	-179.7	-177.5	176.9	1.9	113.9	N413	N413-R416 PolarHBondContact O-N 2.96Å
417	A	38.9	Very low	53.9	Low	77 Å²	77	107.2 Å²	107.2	64%	0.636	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-11.6	173.5	0	0	0	0	0	113.6	R414 S415	R414-A417 PolarHBondContact O-N 3.5Å; S415-A417 PolarHBondContact O-N 2.81Å
418	R	34.9	Very low	51.1	Low	214 Å²	214	111.5 Å²	111.5	81%	0.808	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	-22.9	-178.8	-77.9	-172.8	170.3	-177.5	-2	114.8	R414 S415 G420	R414-R418 PolarHBondContact O-N 2.83Å; S415-R418 PolarHBondContact O-N 3.35Å; R418-G420 PolarHBondContact O-N 3.46Å
419	E	33.5	Very low	48.4	Very low	181 Å²	181	119.6 Å²	119.6	85%	0.846	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	4.1	176.8	-66.3	-171.5	145.3	0	0	114.2	S415	S415-E419 PolarHBondContact O-N 2.97Å
420	G	36	Very low	46.3	Very low	63 Å²	63	125.5 Å²	125.5	65%	0.649	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	-3.4	-179.8	0	0	0	0	0	116.6	R418	R418-G420 PolarHBondContact O-N 3.46Å
421	V	31.2	Very low	44.3	Very low	111 Å²	111	127.2 Å²	127.2	67%	0.673	70%	0.699	S	S	*	*			trans	-147.2	117.2	-175.7	-173.4	0	0	0	0	112.1
422	P	33	Very low	43	Very low	123 Å²	123	127.9 Å²	127.9	80%	0.799	70%	0.703	S	S	*	*			trans	-68.4	128.9	162.7	-10.8	26.7	0	0	0	109.7	G424	P422-G424 PolarHBondContact O-N 3.48Å; P422-G424 VanDerWaalsContact O-N 3.16Å
423	S	33.7	Very low	42.6	Very low	128 Å²	128	123 Å²	123	90%	0.895	69%	0.692	S	S	*	*	S	Bend	trans	-71.1	107.3	177.2	54.6	0	0	0	0	111.3
424	G	33	Very low	42.8	Very low	69 Å²	69	120.5 Å²	120.5	71%	0.711	68%	0.679	S	S	*	*			trans	145.9	62.9	165.5	0	0	0	0	0	116.9	P422	P422-G424 PolarHBondContact O-N 3.48Å; P422-G424 VanDerWaalsContact O-N 3.16Å
425	E	27.3	Very low	44	Very low	196 Å²	196	117.3 Å²	117.3	92%	0.916	67%	0.671	S	S	*	*	S	Bend	trans	-163.6	155.9	141.6	-113.9	169	-151.8	0	0	110.7
426	H	30.4	Very low	45.5	Very low	185 Å²	185	118.9 Å²	118.9	86%	0.856	67%	0.671	S	S	*	*			trans	-66.7	147.6	-172.6	-81.5	-102.6	0	0	0	112.9	A428	H426-A428 PolarHBondContact O-N 3.48Å
427	S	35.1	Very low	47.6	Very low	123 Å²	123	108.3 Å²	108.3	86%	0.86	63%	0.632	S	S	*	*			trans	-56.9	101.8	176.1	33.3	0	0	0	0	113.1
428	A	33.6	Very low	49.7	Very low	90 Å²	90	104.7 Å²	104.7	74%	0.744	60%	0.601	S	S	*	*			trans	-116.4	49	171.5	0	0	0	0	0	112	H426 N430	H426-A428 PolarHBondContact O-N 3.48Å; A428-N430 PolarHBondContact O-N 2.84Å
429	L	37	Very low	52	Low	170 Å²	170	97.9 Å²	97.9	89%	0.89	58%	0.584	S	S	*	*			trans	-70.1	120.2	162.3	-82	168.5	0	0	0	108.4	S431	L429-S431 PolarHBondContact O-N 3.04Å
430	N	47.4	Very low	54.3	Low	138 Å²	138	95.1 Å²	95.1	74%	0.738	57%	0.569	S	S	*	*			trans	-52.8	101.9	-170	-71.5	-59.1	0	0	0	113.8	A428 D432 K488	A428-N430 PolarHBondContact O-N 2.84Å; N430-D432 VanDerWaalsContact C-N 3.29Å; N430-D432 PolarHBondContact O-N 2.88Å; N430-K488 PolarHBondContact O-NZ 2.83Å
431	S	49.6	Very low	56.6	Low	93 Å²	93	93.5 Å²	93.5	65%	0.65	55%	0.545	S	S	*	.			trans	-75.1	85.4	162.5	-166.8	0	0	0	0	108.8	L429 T433	L429-S431 PolarHBondContact O-N 3.04Å; S431-T433 PolarHBondContact O-N 2.86Å; S431-T433 VanDerWaalsContact O-N 3.08Å
432	D	63.3	Low	59	Low	22 Å²	22	94.6 Å²	94.6	12%	0.118	55%	0.547	C	S	.	.			trans	-46.8	116.8	162.3	-78.8	-25.7	0	0	0	108.9	N430 K440 Y484	N430-D432 VanDerWaalsContact C-N 3.29Å; N430-D432 PolarHBondContact O-N 2.88Å; D432-K440 IonicContact OD1-NZ 3.25Å; D432-K440 PolarHBondContact OD1-NZ 2.8Å; D432-K440 IonicContact OD2-NZ 2.8Å; D432-K440 PolarHBondContact OD2-NZ 2.99Å; D432-Y484 PolarHBondContact OD2-OH 3.28Å
433	T	78.8	Confident	61.6	Low	68 Å²	68	89 Å²	89	42%	0.417	51%	0.511	S	S	.	.			trans	-64.4	158.1	172.7	54.9	0	0	0	0	110.6	S431 E435 Q436 M437	S431-T433 PolarHBondContact O-N 2.86Å; S431-T433 VanDerWaalsContact O-N 3.08Å; T433-E435 PolarHBondContact O-N 3.02Å; T433-E435 VanDerWaalsContact O-N 3.17Å; T433-Q436 WeakPolarHBondContact O-CB 3.36Å; T433-Q436 PolarHBondContact O-N 2.79Å; T433-Q436 VanDerWaalsContact OG1-CG 3.25Å; T433-Q436 WeakPolarHBondContact OG1-CG 3.25Å; T433-Q436 PolarHBondContact OG1-OE1 3.02Å; T433-M437 PolarHBondContact O-N 3.09Å
434	L	79.2	Confident	64.1	Low	16 Å²	16	88.4 Å²	88.4	8%	0.084	49%	0.494	C	S	.	.	H	α-helix	trans	-52.1	-41.4	-179.1	-174.3	69.4	0	0	0	112.2	M437 L438 L447 L450 L451 V455 M457 L460	L434-M437 HydrophobicContact CD1-CE 3.81Å; L434-M437 PolarHBondContact O-N 2.79Å; L434-L438 HydrophobicContact CG-CD1 4.3Å; L434-L438 WeakPolarHBondContact O-CG 3.35Å; L434-L438 PolarHBondContact O-N 3.15Å; L434-L447 HydrophobicContact CD2-CD1 3.95Å; L434-L447 HydrophobicContact CG-CD1 4.1Å; L434-L450 HydrophobicContact CD1-CD1 4.03Å; L434-L450 HydrophobicContact CD2-CB 4.07Å; L434-L450 HydrophobicContact CD2-CD1 4.48Å; L434-L451 HydrophobicContact CD2-CD2 4.1Å; L434-L451 HydrophobicContact CD2-CG 4.48Å; L434-V455 WeakPolarHBondContact CD2-O 3.37Å; L434-M457 HydrophobicContact CB-CG 4.12Å; L434-M457 HydrophobicContact CB-SD 4.22Å; L434-M457 HydrophobicContact CD1-CG 4.47Å; L434-M457 HydrophobicContact CD1-SD 3.83Å; L434-L460 HydrophobicContact CD1-CD2 3.8Å
435	E	79.7	Confident	66.5	Low	109 Å²	109	92 Å²	92	51%	0.509	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-43.7	177.6	-45	-162.3	147.3	0	0	112.2	T433 T439 L447	T433-E435 PolarHBondContact O-N 3.02Å; T433-E435 VanDerWaalsContact O-N 3.17Å; E435-T439 VanDerWaalsContact O-CB 3.28Å; E435-T439 WeakPolarHBondContact O-CB 3.39Å; E435-T439 PolarHBondContact O-N 3.31Å; E435-T439 PolarHBondContact O-OG1 2.83Å; E435-L447 HydrophobicContact CB-CD1 4.48Å; E435-L447 HydrophobicContact CB-CD2 4.06Å; E435-L447 HydrophobicContact CG-CD1 3.86Å; E435-L447 HydrophobicContact CG-CD2 3.7Å; E435-L447 HydrophobicContact CG-CG 4.43Å
436	Q	80.1	Confident	69.3	Low	99 Å²	99	84.3 Å²	84.3	46%	0.463	46%	0.455	S	S	.	.	H	α-helix	trans	-67.2	-39.4	178.7	-70.8	164.4	-20.2	0	0	111.4	T433 T439 K440	T433-Q436 WeakPolarHBondContact O-CB 3.36Å; T433-Q436 PolarHBondContact O-N 2.79Å; T433-Q436 VanDerWaalsContact OG1-CG 3.25Å; T433-Q436 WeakPolarHBondContact OG1-CG 3.25Å; T433-Q436 PolarHBondContact OG1-OE1 3.02Å; Q436-T439 PolarHBondContact O-N 2.79Å; Q436-K440 VanDerWaalsContact O-CG 3.32Å; Q436-K440 WeakPolarHBondContact O-CG 3.36Å; Q436-K440 PolarHBondContact O-N 2.82Å
437	M	84.5	Confident	71.8	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	42%	0.419	C	S	.	.	H	α-helix	trans	-64.1	-49.8	175.3	179.8	-81.8	-63.6	0	0	111.8	T433 L434 T439 K440 L441 M457 L460 Y484	T433-M437 PolarHBondContact O-N 3.09Å; L434-M437 HydrophobicContact CD1-CE 3.81Å; L434-M437 PolarHBondContact O-N 2.79Å; M437-T439 VanDerWaalsContact C-N 3.27Å; M437-T439 PolarHBondContact O-N 3.1Å; M437-K440 PolarHBondContact O-N 2.78Å; M437-K440 VanDerWaalsContact O-N 3.16Å; M437-L441 PolarHBondContact O-N 2.88Å; M437-L441 VanDerWaalsContact O-N 3.13Å; M437-L441 HydrophobicContact SD-CD1 3.53Å; M437-L441 VanDerWaalsContact SD-CD1 3.53Å; M437-L441 HydrophobicContact SD-CG 4.26Å; M437-M457 HydrophobicContact CB-CE 4.41Å; M437-M457 HydrophobicContact CB-SD 4.26Å; M437-M457 HydrophobicContact CE-SD 4.13Å; M437-M457 HydrophobicContact CG-CE 4.47Å; M437-L460 HydrophobicContact CE-CD2 3.4Å; M437-L460 VanDerWaalsContact CE-CD2 3.4Å; M437-Y484 HydrophobicContact CB-CE1 4.22Å; M437-Y484 HydrophobicContact CG-CD1 3.45Å; M437-Y484 VanDerWaalsContact CG-CD1 3.45Å; M437-Y484 HydrophobicContact CG-CE1 3.37Å; M437-Y484 HydrophobicContact CG-CG 4.3Å; M437-Y484 HydrophobicContact SD-CD1 4.28Å
438	L	82.8	Confident	74	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	41%	0.41	C	S	.	.	H	α-helix	trans	-64.7	-32.5	177.9	-68.4	174.5	0	0	0	112.4	L434 L441 D442 L443 L447 L450 I481	L434-L438 HydrophobicContact CG-CD1 4.3Å; L434-L438 WeakPolarHBondContact O-CG 3.35Å; L434-L438 PolarHBondContact O-N 3.15Å; L438-L441 PolarHBondContact O-N 3.42Å; L438-D442 PolarHBondContact O-N 3.44Å; L438-L443 HydrophobicContact CD2-CB 3.94Å; L438-L443 PolarHBondContact O-N 2.75Å; L438-L447 HydrophobicContact CD1-CB 3.71Å; L438-L447 HydrophobicContact CD1-CD1 3.9Å; L438-L447 HydrophobicContact CD1-CG 4.4Å; L438-L450 HydrophobicContact CD1-CD1 4.19Å; L438-L450 HydrophobicContact CD2-CD1 4.47Å; L438-I481 HydrophobicContact CD2-CD1 4.12Å; L438-I481 HydrophobicContact CD2-CG1 4.36Å
439	T	83.6	Confident	76.4	Confident	71 Å²	71	75.6 Å²	75.6	44%	0.436	39%	0.39	S	S	.	.	H	α-helix	trans	-63.9	-45.9	172.1	-59.2	0	0	0	0	111.5	E435 Q436 M437 L441 D442 Q444	E435-T439 VanDerWaalsContact O-CB 3.28Å; E435-T439 WeakPolarHBondContact O-CB 3.39Å; E435-T439 PolarHBondContact O-N 3.31Å; E435-T439 PolarHBondContact O-OG1 2.83Å; Q436-T439 PolarHBondContact O-N 2.79Å; M437-T439 VanDerWaalsContact C-N 3.27Å; M437-T439 PolarHBondContact O-N 3.1Å; T439-L441 PolarHBondContact O-N 3.31Å; T439-D442 PolarHBondContact O-N 2.91Å; T439-Q444 PolarHBondContact OG1-NE2 3.31Å
440	K	81.8	Confident	78.6	Confident	123 Å²	123	67.5 Å²	67.5	54%	0.535	35%	0.347	S	S	.	.	H	α-helix	trans	-63.3	-26.9	176.8	-71.5	174.5	-167.6	-177.5	0	113.7	D432 Q436 M437	D432-K440 IonicContact OD1-NZ 3.25Å; D432-K440 PolarHBondContact OD1-NZ 2.8Å; D432-K440 IonicContact OD2-NZ 2.8Å; D432-K440 PolarHBondContact OD2-NZ 2.99Å; Q436-K440 VanDerWaalsContact O-CG 3.32Å; Q436-K440 WeakPolarHBondContact O-CG 3.36Å; Q436-K440 PolarHBondContact O-N 2.82Å; M437-K440 PolarHBondContact O-N 2.78Å; M437-K440 VanDerWaalsContact O-N 3.16Å
441	L	83.1	Confident	80.3	Confident	29 Å²	29	64.6 Å²	64.6	15%	0.152	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-4.4	179.4	-66.1	-176.2	0	0	0	114.8	M437 L438 T439 L443 K480 I481 Y484	M437-L441 PolarHBondContact O-N 2.88Å; M437-L441 VanDerWaalsContact O-N 3.13Å; M437-L441 HydrophobicContact SD-CD1 3.53Å; M437-L441 VanDerWaalsContact SD-CD1 3.53Å; M437-L441 HydrophobicContact SD-CG 4.26Å; L438-L441 PolarHBondContact O-N 3.42Å; T439-L441 PolarHBondContact O-N 3.31Å; L441-L443 HydrophobicContact CB-CB 4.3Å; L441-L443 HydrophobicContact CB-CD1 3.82Å; L441-L443 HydrophobicContact CB-CG 3.91Å; L441-L443 HydrophobicContact CD1-CD1 4.16Å; L441-K480 HydrophobicContact CD1-CB 4.46Å; L441-K480 PolarHBondContact O-NZ 2.98Å; L441-I481 HydrophobicContact CD1-CG1 4.15Å; L441-Y484 HydrophobicContact CD1-CG 4.22Å; L441-Y484 HydrophobicContact CD2-CD2 3.81Å; L441-Y484 HydrophobicContact CD2-CG 4.23Å; L441-Y484 HydrophobicContact CG-CD2 4.34Å; L441-Y484 HydrophobicContact CG-CG 4.46Å
442	D	83	Confident	81.8	Confident	135 Å²	135	63.8 Å²	63.8	72%	0.722	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	49.7	-170.1	-165.7	35.3	0	0	0	112.1	L438 T439	L438-D442 PolarHBondContact O-N 3.44Å; T439-D442 PolarHBondContact O-N 2.91Å
443	L	87.7	Confident	82.7	Confident	5 Å²	5	68.8 Å²	68.8	3%	0.026	35%	0.353	C	S	.	.			trans	-131.7	19.2	-173.1	-67.3	-177.2	0	0	0	113.4	L438 L441 Q445 Y446 P477 K480 I481	L438-L443 HydrophobicContact CD2-CB 3.94Å; L438-L443 PolarHBondContact O-N 2.75Å; L441-L443 HydrophobicContact CB-CB 4.3Å; L441-L443 HydrophobicContact CB-CD1 3.82Å; L441-L443 HydrophobicContact CB-CG 3.91Å; L441-L443 HydrophobicContact CD1-CD1 4.16Å; L443-Q445 PolarHBondContact O-N 3.03Å; L443-Y446 HydrophobicContact CB-CD2 4.22Å; L443-Y446 HydrophobicContact CD2-CD2 4.15Å; L443-Y446 HydrophobicContact CD2-CE2 4.01Å; L443-Y446 PolarHBondContact O-N 2.94Å; L443-P477 HydrophobicContact CD1-CB 4.17Å; L443-P477 HydrophobicContact CD2-CB 3.66Å; L443-P477 HydrophobicContact CD2-CG 3.78Å; L443-K480 HydrophobicContact CD1-CB 3.98Å; L443-K480 HydrophobicContact CD1-CD 4.08Å; L443-K480 HydrophobicContact CD2-CD 4.32Å; L443-K480 HydrophobicContact CG-CD 4.33Å; L443-I481 HydrophobicContact CD1-CD1 4.04Å; L443-I481 HydrophobicContact CD1-CG1 3.7Å
444	Q	85.4	Confident	82.8	Confident	116 Å²	116	72.3 Å²	72.3	54%	0.542	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-51.7	-30.7	-178.1	-67.1	-175.5	-25.3	0	0	113.8	T439 Y446 L447	T439-Q444 PolarHBondContact OG1-NE2 3.31Å; Q444-Y446 PolarHBondContact O-N 3.21Å; Q444-L447 VanDerWaalsContact O-CB 3.23Å; Q444-L447 WeakPolarHBondContact O-CB 3.4Å; Q444-L447 PolarHBondContact O-N 2.97Å
445	Q	83.4	Confident	82.9	Confident	144 Å²	144	72.3 Å²	72.3	67%	0.673	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-58.6	-19.5	178.2	70.6	-172	17.3	0	0	114.6	L443	L443-Q445 PolarHBondContact O-N 3.03Å
446	Y	86.1	Confident	82.9	Confident	34 Å²	34	71 Å²	71	13%	0.133	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-95.8	-3	177.1	-59.1	-68.5	0	0	0	113.9	L443 Q444 Q448 T449 L450 I473 P474 P477	L443-Y446 HydrophobicContact CB-CD2 4.22Å; L443-Y446 HydrophobicContact CD2-CD2 4.15Å; L443-Y446 HydrophobicContact CD2-CE2 4.01Å; L443-Y446 PolarHBondContact O-N 2.94Å; Q444-Y446 PolarHBondContact O-N 3.21Å; Y446-Q448 PolarHBondContact O-N 2.7Å; Y446-T449 WeakPolarHBondContact O-CB 3.4Å; Y446-T449 PolarHBondContact O-N 3.35Å; Y446-T449 VanDerWaalsContact O-N 3.16Å; Y446-L450 PolarHBondContact O-N 2.9Å; Y446-I473 HydrophobicContact CD1-CG1 4.02Å; Y446-I473 HydrophobicContact CD1-CG2 4.3Å; Y446-I473 HydrophobicContact CE1-CG2 4.28Å; Y446-I473 HydrophobicContact CG-CG1 4.47Å; Y446-I473 HydrophobicContact CG-CG2 4.44Å; Y446-P474 VanDerWaalsContact OH-CD 3.23Å; Y446-P474 WeakPolarHBondContact OH-CD 3.48Å; Y446-P477 HydrophobicContact CD2-CB 4.24Å; Y446-P477 HydrophobicContact CE2-CB 3.68Å; Y446-P477 HydrophobicContact CE2-CG 3.66Å
447	L	83.2	Confident	82.8	Confident	22 Å²	22	68.2 Å²	68.2	12%	0.115	35%	0.354	C	S	.	.	H	α-helix	trans	-59.9	-47.5	-178.5	175.5	59.9	0	0	0	111.7	L434 E435 L438 Q444 T449 L450 L451	L434-L447 HydrophobicContact CD2-CD1 3.95Å; L434-L447 HydrophobicContact CG-CD1 4.1Å; E435-L447 HydrophobicContact CB-CD1 4.48Å; E435-L447 HydrophobicContact CB-CD2 4.06Å; E435-L447 HydrophobicContact CG-CD1 3.86Å; E435-L447 HydrophobicContact CG-CD2 3.7Å; E435-L447 HydrophobicContact CG-CG 4.43Å; L438-L447 HydrophobicContact CD1-CB 3.71Å; L438-L447 HydrophobicContact CD1-CD1 3.9Å; L438-L447 HydrophobicContact CD1-CG 4.4Å; Q444-L447 VanDerWaalsContact O-CB 3.23Å; Q444-L447 WeakPolarHBondContact O-CB 3.4Å; Q444-L447 PolarHBondContact O-N 2.97Å; L447-T449 VanDerWaalsContact C-N 3.26Å; L447-T449 PolarHBondContact O-N 2.73Å; L447-L450 PolarHBondContact O-N 3.31Å; L447-L451 HydrophobicContact CD1-CD1 3.81Å; L447-L451 HydrophobicContact CD1-CG 3.94Å; L447-L451 HydrophobicContact CG-CD1 3.9Å; L447-L451 HydrophobicContact CG-CG 4.39Å; L447-L451 WeakPolarHBondContact O-CB 3.49Å; L447-L451 WeakPolarHBondContact O-CG 3.32Å; L447-L451 PolarHBondContact O-N 2.84Å
448	Q	80.7	Confident	82.3	Confident	140 Å²	140	75.7 Å²	75.7	65%	0.654	39%	0.389	S	S	*	.	H	α-helix	trans	-64.1	-31.1	178.1	-67.9	-64.3	-31.5	0	0	112.4	Y446 A452	Y446-Q448 PolarHBondContact O-N 2.7Å; Q448-A452 WeakPolarHBondContact O-CB 3.24Å; Q448-A452 PolarHBondContact O-N 2.99Å
449	T	84.8	Confident	82.1	Confident	53 Å²	53	78.1 Å²	78.1	33%	0.325	41%	0.406	S	S	.	.	H	α-helix	trans	-69	-42.6	175.4	-48.5	0	0	0	0	111.9	Y446 L447 L471	Y446-T449 WeakPolarHBondContact O-CB 3.4Å; Y446-T449 PolarHBondContact O-N 3.35Å; Y446-T449 VanDerWaalsContact O-N 3.16Å; L447-T449 VanDerWaalsContact C-N 3.26Å; L447-T449 PolarHBondContact O-N 2.73Å; T449-L471 WeakPolarHBondContact CG2-O 3.39Å
450	L	82.8	Confident	81.9	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-70.7	-40.2	177.3	-65.4	-175.8	0	0	0	111.9	L434 L438 Y446 L447 E453 N454 V455 L460 L471 I473	L434-L450 HydrophobicContact CD1-CD1 4.03Å; L434-L450 HydrophobicContact CD2-CB 4.07Å; L434-L450 HydrophobicContact CD2-CD1 4.48Å; L438-L450 HydrophobicContact CD1-CD1 4.19Å; L438-L450 HydrophobicContact CD2-CD1 4.47Å; Y446-L450 PolarHBondContact O-N 2.9Å; L447-L450 PolarHBondContact O-N 3.31Å; L450-E453 PolarHBondContact O-N 2.91Å; L450-N454 PolarHBondContact O-N 3.14Å; L450-V455 HydrophobicContact CB-CB 4.28Å; L450-V455 HydrophobicContact CD2-CB 4.3Å; L450-V455 HydrophobicContact CD2-CG1 4.39Å; L450-V455 PolarHBondContact O-N 3.06Å; L450-L460 HydrophobicContact CD1-CD1 3.99Å; L450-L460 HydrophobicContact CD1-CD2 4.36Å; L450-L460 HydrophobicContact CD2-CD1 4.22Å; L450-L471 HydrophobicContact CD2-CD1 3.76Å; L450-I473 HydrophobicContact CD2-CD1 3.98Å
451	L	82	Confident	81.8	Confident	77 Å²	77	70.3 Å²	70.3	40%	0.403	37%	0.371	S	S	.	.	H	α-helix	trans	-67.3	-38.1	177	-69.4	177.1	0	0	0	112.8	L434 L447 E453 N454	L434-L451 HydrophobicContact CD2-CD2 4.1Å; L434-L451 HydrophobicContact CD2-CG 4.48Å; L447-L451 HydrophobicContact CD1-CD1 3.81Å; L447-L451 HydrophobicContact CD1-CG 3.94Å; L447-L451 HydrophobicContact CG-CD1 3.9Å; L447-L451 HydrophobicContact CG-CG 4.39Å; L447-L451 WeakPolarHBondContact O-CB 3.49Å; L447-L451 WeakPolarHBondContact O-CG 3.32Å; L447-L451 PolarHBondContact O-N 2.84Å; L451-E453 PolarHBondContact O-N 3.29Å; L451-N454 PolarHBondContact O-N 2.84Å; L451-N454 VanDerWaalsContact O-N 3.1Å
452	A	81.5	Confident	81.5	Confident	76 Å²	76	75.2 Å²	75.2	63%	0.628	40%	0.397	S	S	*	.	H	α-helix	trans	-61.9	-29.4	177.6	0	0	0	0	0	113.2	Q448	Q448-A452 WeakPolarHBondContact O-CB 3.24Å; Q448-A452 PolarHBondContact O-N 2.99Å
453	E	82.4	Confident	81.2	Confident	128 Å²	128	70 Å²	70	60%	0.598	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	13.7	178.7	-64	-73.2	165.1	0	0	112.1	L450 L451 V455 L471	L450-E453 PolarHBondContact O-N 2.91Å; L451-E453 PolarHBondContact O-N 3.29Å; E453-V455 VanDerWaalsContact C-N 3.25Å; E453-V455 HydrophobicContact CB-CG2 4.15Å; E453-V455 PolarHBondContact O-N 3.45Å; E453-L471 HydrophobicContact CB-CD2 3.82Å; E453-L471 HydrophobicContact CG-CD2 3.6Å
454	N	80.7	Confident	80.9	Confident	141 Å²	141	76.2 Å²	76.2	75%	0.754	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	29.8	-179.8	-55.9	-78.3	0	0	0	115.1	L450 L451 D456	L450-N454 PolarHBondContact O-N 3.14Å; L451-N454 PolarHBondContact O-N 2.84Å; L451-N454 VanDerWaalsContact O-N 3.1Å; N454-D456 PolarHBondContact O-N 3.23Å
455	V	80.8	Confident	80.9	Confident	16 Å²	16	72.4 Å²	72.4	10%	0.097	38%	0.383	C	S	.	.			trans	-83.2	104	-179.9	-175	0	0	0	0	110.3	L434 L450 E453 L460 L471	L434-V455 WeakPolarHBondContact CD2-O 3.37Å; L450-V455 HydrophobicContact CB-CB 4.28Å; L450-V455 HydrophobicContact CD2-CB 4.3Å; L450-V455 HydrophobicContact CD2-CG1 4.39Å; L450-V455 PolarHBondContact O-N 3.06Å; E453-V455 VanDerWaalsContact C-N 3.25Å; E453-V455 HydrophobicContact CB-CG2 4.15Å; E453-V455 PolarHBondContact O-N 3.45Å; V455-L460 HydrophobicContact CG1-CB 4.06Å; V455-L460 HydrophobicContact CG1-CD1 3.73Å; V455-L471 HydrophobicContact CG2-CD1 4.26Å
456	D	80.1	Confident	80.8	Confident	83 Å²	83	68.2 Å²	68.2	44%	0.444	37%	0.369	S	S	.	.			trans	-87.3	-178.5	173.1	68.2	12.3	0	0	0	113.2	N454 E458 S459 L460	N454-D456 PolarHBondContact O-N 3.23Å; D456-E458 VanDerWaalsContact C-N 3.29Å; D456-E458 PolarHBondContact O-N 2.76Å; D456-E458 PolarHBondContact OD1-N 3.04Å; D456-S459 WeakPolarHBondContact OD1-CB 3.5Å; D456-S459 PolarHBondContact OD1-N 2.84Å; D456-S459 PolarHBondContact OD1-OG 2.7Å; D456-L460 VanDerWaalsContact O-CB 3.23Å; D456-L460 WeakPolarHBondContact O-CB 3.46Å; D456-L460 PolarHBondContact O-N 3.26Å
457	M	78.8	Confident	80.7	Confident	40 Å²	40	69.4 Å²	69.4	20%	0.197	38%	0.378	C	S	.	.	H	α-helix	trans	-66.5	-26.5	-176.8	-80.1	-64.4	-64.9	0	0	113.9	L434 M437 A461	L434-M457 HydrophobicContact CB-CG 4.12Å; L434-M457 HydrophobicContact CB-SD 4.22Å; L434-M457 HydrophobicContact CD1-CG 4.47Å; L434-M457 HydrophobicContact CD1-SD 3.83Å; M437-M457 HydrophobicContact CB-CE 4.41Å; M437-M457 HydrophobicContact CB-SD 4.26Å; M437-M457 HydrophobicContact CE-SD 4.13Å; M437-M457 HydrophobicContact CG-CE 4.47Å; M457-A461 PolarHBondContact O-N 3.48Å
458	E	73.4	Confident	80.8	Confident	157 Å²	157	68.4 Å²	68.4	73%	0.734	37%	0.373	S	S	*	.	H	α-helix	trans	-81.9	-44.8	178.5	-64.8	-173.2	-177.5	0	0	110.4	D456 L460 A461 L462	D456-E458 VanDerWaalsContact C-N 3.29Å; D456-E458 PolarHBondContact O-N 2.76Å; D456-E458 PolarHBondContact OD1-N 3.04Å; E458-L460 VanDerWaalsContact C-N 3.32Å; E458-L460 PolarHBondContact O-N 2.8Å; E458-A461 WeakPolarHBondContact O-CB 3.42Å; E458-A461 PolarHBondContact O-N 3Å; E458-L462 PolarHBondContact O-N 3.11Å
459	S	78.6	Confident	80.9	Confident	51 Å²	51	69.9 Å²	69.9	36%	0.357	37%	0.372	S	S	.	.	H	α-helix	trans	-56.5	-45.8	171.5	-55.8	0	0	0	0	111.4	D456 A461 L462 C463	D456-S459 WeakPolarHBondContact OD1-CB 3.5Å; D456-S459 PolarHBondContact OD1-N 2.84Å; D456-S459 PolarHBondContact OD1-OG 2.7Å; S459-A461 PolarHBondContact O-N 3.12Å; S459-L462 PolarHBondContact O-N 3.25Å; S459-C463 PolarHBondContact O-N 2.8Å; S459-C463 VanDerWaalsContact O-N 3.17Å; S459-C463 PolarHBondContact O-SG 2.89Å; S459-C463 VanDerWaalsContact O-SG 3.33Å
460	L	80.6	Confident	80.9	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.005	39%	0.392	C	S	.	.	H	α-helix	trans	-63	-29.3	177.4	-159.1	73.6	0	0	0	112.5	L434 M437 L450 V455 D456 E458 L462 C463 L468 I481 I485	L434-L460 HydrophobicContact CD1-CD2 3.8Å; M437-L460 HydrophobicContact CE-CD2 3.4Å; M437-L460 VanDerWaalsContact CE-CD2 3.4Å; L450-L460 HydrophobicContact CD1-CD1 3.99Å; L450-L460 HydrophobicContact CD1-CD2 4.36Å; L450-L460 HydrophobicContact CD2-CD1 4.22Å; V455-L460 HydrophobicContact CG1-CB 4.06Å; V455-L460 HydrophobicContact CG1-CD1 3.73Å; D456-L460 VanDerWaalsContact O-CB 3.23Å; D456-L460 WeakPolarHBondContact O-CB 3.46Å; D456-L460 PolarHBondContact O-N 3.26Å; E458-L460 VanDerWaalsContact C-N 3.32Å; E458-L460 PolarHBondContact O-N 2.8Å; L460-L462 PolarHBondContact O-N 2.81Å; L460-C463 PolarHBondContact O-N 3.28Å; L460-L468 HydrophobicContact CD1-CD2 3.7Å; L460-I481 HydrophobicContact CD1-CG2 4.29Å; L460-I481 HydrophobicContact CD2-CG2 3.8Å; L460-I481 HydrophobicContact CG-CG2 4.08Å; L460-I485 HydrophobicContact CB-CD1 4.23Å; L460-I485 HydrophobicContact CD2-CD1 3.87Å; L460-I485 HydrophobicContact CG-CD1 3.69Å; L460-I485 VanDerWaalsContact O-CD1 3.3Å; L460-I485 WeakPolarHBondContact O-CD1 3.34Å
461	A	78.1	Confident	81	Confident	29 Å²	29	75.4 Å²	75.4	24%	0.24	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-9.6	175.8	0	0	0	0	0	114.1	M457 E458 S459 I485 R489	M457-A461 PolarHBondContact O-N 3.48Å; E458-A461 WeakPolarHBondContact O-CB 3.42Å; E458-A461 PolarHBondContact O-N 3Å; S459-A461 PolarHBondContact O-N 3.12Å; A461-I485 HydrophobicContact CB-CG2 4.15Å; A461-R489 PolarHBondContact O-NH1 3.45Å
462	L	76.7	Confident	80.9	Confident	131 Å²	131	74.7 Å²	74.7	69%	0.686	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.7	-18.3	175.1	-58.6	177	0	0	0	113	E458 S459 L460	E458-L462 PolarHBondContact O-N 3.11Å; S459-L462 PolarHBondContact O-N 3.25Å; L460-L462 PolarHBondContact O-N 2.81Å
463	C	78.3	Confident	81.2	Confident	25 Å²	25	71.1 Å²	71.1	17%	0.169	38%	0.382	C	S	.	.			trans	-59.4	138.4	178.3	-68.3	0	0	0	0	113.7	S459 L460 D467 L468 L482	S459-C463 PolarHBondContact O-N 2.8Å; S459-C463 VanDerWaalsContact O-N 3.17Å; S459-C463 PolarHBondContact O-SG 2.89Å; S459-C463 VanDerWaalsContact O-SG 3.33Å; L460-C463 PolarHBondContact O-N 3.28Å; C463-D467 HydrophobicContact CB-CB 4.43Å; C463-L468 HydrophobicContact CB-CD2 4.15Å; C463-L468 HydrophobicContact CB-CG 4.21Å; C463-L482 VanDerWaalsContact O-CD2 3.28Å; C463-L482 WeakPolarHBondContact O-CD2 3.32Å
464	Q	80.7	Confident	81.2	Confident	137 Å²	137	68.1 Å²	68.1	64%	0.64	37%	0.373	S	S	*	.			trans	-96.2	174.4	167.8	-57.5	-155	13.6	0	0	112.1	S466 D467 L468	Q464-S466 PolarHBondContact O-N 3.28Å; Q464-D467 PolarHBondContact N-OD2 2.97Å; Q464-D467 PolarHBondContact O-N 2.74Å; Q464-D467 VanDerWaalsContact O-N 3.1Å; Q464-L468 PolarHBondContact O-N 3.29Å
465	D	85.4	Confident	80.8	Confident	36 Å²	36	66.2 Å²	66.2	19%	0.193	36%	0.362	C	S	.	.	H	α-helix	trans	-63.4	-28.9	-179.5	-158.7	106	0	0	0	112.6	D467 R469 R478 K479 L482	D465-D467 VanDerWaalsContact C-N 3.33Å; D465-R469 WeakPolarHBondContact O-CB 3.22Å; D465-R469 PolarHBondContact O-N 2.85Å; D465-R478 PolarHBondContact O-NE 3.24Å; D465-R478 IonicContact OD1-NE 3.3Å; D465-R478 IonicContact OD2-CZ 2.65Å; D465-R478 VanDerWaalsContact OD2-CZ 3.3Å; D465-R478 IonicContact OD2-NE 3.48Å; D465-R478 PolarHBondContact OD2-NE 3.29Å; D465-R478 IonicContact OD2-NH2 3.64Å; D465-R478 PolarHBondContact OD2-NH2 3.45Å; D465-K479 VanDerWaalsContact OD1-CE 3.31Å; D465-K479 WeakPolarHBondContact OD1-CE 3.47Å; D465-K479 IonicContact OD1-NZ 2.74Å; D465-K479 PolarHBondContact OD1-NZ 2.81Å; D465-L482 HydrophobicContact CB-CD1 3.99Å
466	S	81	Confident	80.8	Confident	55 Å²	55	67.6 Å²	67.6	39%	0.385	38%	0.379	S	S	.	.	H	α-helix	trans	-59.2	-42	171.7	44.7	0	0	0	0	112.4	Q464 R469 N470	Q464-S466 PolarHBondContact O-N 3.28Å; S466-R469 VanDerWaalsContact O-CB 3.32Å; S466-R469 WeakPolarHBondContact O-CB 3.35Å; S466-R469 PolarHBondContact O-N 3.46Å; S466-N470 PolarHBondContact O-N 3.29Å; S466-N470 PolarHBondContact O-ND2 3.4Å; S466-N470 PolarHBondContact O-OD1 2.8Å
467	D	84.6	Confident	81.2	Confident	60 Å²	60	64.8 Å²	64.8	32%	0.321	37%	0.366	S	S	.	.	H	α-helix	trans	-80.4	-46.2	-166.3	-42.8	-29.2	0	0	0	108.3	C463 Q464 D465 R469 N470 L471	C463-D467 HydrophobicContact CB-CB 4.43Å; Q464-D467 PolarHBondContact N-OD2 2.97Å; Q464-D467 PolarHBondContact O-N 2.74Å; Q464-D467 VanDerWaalsContact O-N 3.1Å; D465-D467 VanDerWaalsContact C-N 3.33Å; D467-R469 PolarHBondContact O-N 2.98Å; D467-N470 PolarHBondContact O-N 3.38Å; D467-L471 WeakPolarHBondContact O-CG 3.43Å; D467-L471 PolarHBondContact O-N 3.1Å
468	L	84.6	Confident	81.7	Confident	0 Å²	0	64 Å²	64	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-59.5	-27	168.2	-59.9	-176.5	0	0	0	112.5	L460 C463 Q464 L471 I473 R478 I481 L482	L460-L468 HydrophobicContact CD1-CD2 3.7Å; C463-L468 HydrophobicContact CB-CD2 4.15Å; C463-L468 HydrophobicContact CB-CG 4.21Å; Q464-L468 PolarHBondContact O-N 3.29Å; L468-L471 HydrophobicContact CD2-CD1 4.17Å; L468-I473 HydrophobicContact CD2-CD1 4.34Å; L468-I473 VanDerWaalsContact O-CB 3.26Å; L468-I473 WeakPolarHBondContact O-CB 3.22Å; L468-I473 PolarHBondContact O-N 2.92Å; L468-R478 HydrophobicContact CB-CB 4.32Å; L468-R478 HydrophobicContact CB-CG 3.76Å; L468-R478 HydrophobicContact CD1-CB 4.36Å; L468-R478 WeakPolarHBondContact O-CD 3.48Å; L468-I481 HydrophobicContact CD1-CB 4.37Å; L468-I481 HydrophobicContact CD1-CG2 4.09Å; L468-L482 HydrophobicContact CD1-CD1 4.23Å; L468-L482 HydrophobicContact CD1-CD2 3.88Å; L468-L482 HydrophobicContact CD1-CG 3.76Å
469	R	82.9	Confident	82.2	Confident	171 Å²	171	61.9 Å²	61.9	65%	0.645	35%	0.349	S	S	*	.	H	α-helix	trans	-73.4	-39.4	173.7	178.3	-178.4	179	-178.2	-2	111.7	D465 S466 D467 L471 G472 R478	D465-R469 WeakPolarHBondContact O-CB 3.22Å; D465-R469 PolarHBondContact O-N 2.85Å; S466-R469 VanDerWaalsContact O-CB 3.32Å; S466-R469 WeakPolarHBondContact O-CB 3.35Å; S466-R469 PolarHBondContact O-N 3.46Å; D467-R469 PolarHBondContact O-N 2.98Å; R469-L471 VanDerWaalsContact C-N 3.28Å; R469-G472 PolarHBondContact O-N 2.87Å; R469-G472 VanDerWaalsContact O-N 3.08Å; R469-R478 VanDerWaalsContact N-CD 3.27Å
470	N	85.8	Confident	82.5	Confident	136 Å²	136	64 Å²	64	73%	0.727	35%	0.352	S	S	*	.	H	α-helix	trans	-66.7	-33.2	177.2	-65.2	-19.2	0	0	0	111.2	S466 D467 G472	S466-N470 PolarHBondContact O-N 3.29Å; S466-N470 PolarHBondContact O-ND2 3.4Å; S466-N470 PolarHBondContact O-OD1 2.8Å; D467-N470 PolarHBondContact O-N 3.38Å; N470-G472 PolarHBondContact O-N 2.67Å
471	L	83.6	Confident	82.7	Confident	33 Å²	33	64 Å²	64	17%	0.173	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	10.4	169	-61.5	172.3	0	0	0	114.2	T449 L450 E453 V455 D467 L468 R469 I473	T449-L471 WeakPolarHBondContact CG2-O 3.39Å; L450-L471 HydrophobicContact CD2-CD1 3.76Å; E453-L471 HydrophobicContact CB-CD2 3.82Å; E453-L471 HydrophobicContact CG-CD2 3.6Å; V455-L471 HydrophobicContact CG2-CD1 4.26Å; D467-L471 WeakPolarHBondContact O-CG 3.43Å; D467-L471 PolarHBondContact O-N 3.1Å; L468-L471 HydrophobicContact CD2-CD1 4.17Å; R469-L471 VanDerWaalsContact C-N 3.28Å; L471-I473 HydrophobicContact CB-CD1 4.36Å; L471-I473 HydrophobicContact CB-CG1 4.25Å; L471-I473 PolarHBondContact O-N 2.93Å
472	G	79.8	Confident	83	Confident	62 Å²	62	63.2 Å²	63.2	64%	0.639	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	5.4	177	0	0	0	0	0	115.5	R469 N470	R469-G472 PolarHBondContact O-N 2.87Å; R469-G472 VanDerWaalsContact O-N 3.08Å; N470-G472 PolarHBondContact O-N 2.67Å
473	I	87.6	Confident	83.2	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.01	34%	0.339	C	S	.	.			trans	-75.4	127.1	-175.5	-54.2	178.1	0	0	0	109.8	Y446 L450 L468 L471 P477 R478	Y446-I473 HydrophobicContact CD1-CG1 4.02Å; Y446-I473 HydrophobicContact CD1-CG2 4.3Å; Y446-I473 HydrophobicContact CE1-CG2 4.28Å; Y446-I473 HydrophobicContact CG-CG1 4.47Å; Y446-I473 HydrophobicContact CG-CG2 4.44Å; L450-I473 HydrophobicContact CD2-CD1 3.98Å; L468-I473 HydrophobicContact CD2-CD1 4.34Å; L468-I473 VanDerWaalsContact O-CB 3.26Å; L468-I473 WeakPolarHBondContact O-CB 3.22Å; L468-I473 PolarHBondContact O-N 2.92Å; L471-I473 HydrophobicContact CB-CD1 4.36Å; L471-I473 HydrophobicContact CB-CG1 4.25Å; L471-I473 PolarHBondContact O-N 2.93Å; I473-P477 HydrophobicContact CG2-CB 3.59Å; I473-R478 HydrophobicContact CB-CG 3.81Å; I473-R478 HydrophobicContact CG2-CG 3.66Å; I473-R478 VanDerWaalsContact O-CD 3.25Å; I473-R478 WeakPolarHBondContact O-CD 3.36Å; I473-R478 WeakPolarHBondContact O-CG 3.29Å; I473-R478 PolarHBondContact O-NH1 3.36Å
474	P	83.3	Confident	83.4	Confident	65 Å²	65	64.2 Å²	64.2	42%	0.422	34%	0.34	S	S	.	.			trans	-65.9	155.4	178.5	-21.1	33.4	0	0	0	113.4	Y446 G476 P477 R478	Y446-P474 VanDerWaalsContact OH-CD 3.23Å; Y446-P474 WeakPolarHBondContact OH-CD 3.48Å; P474-G476 VanDerWaalsContact C-N 3.31Å; P474-G476 PolarHBondContact O-N 2.89Å; P474-G476 VanDerWaalsContact O-N 3.12Å; P474-P477 VanDerWaalsContact O-CD 3.27Å; P474-P477 WeakPolarHBondContact O-CD 3.37Å; P474-R478 WeakPolarHBondContact O-CG 3.45Å; P474-R478 PolarHBondContact O-N 3.3Å; P474-R478 VanDerWaalsContact O-N 3.12Å
475	L	72.7	Confident	83.4	Confident	101 Å²	101	58.5 Å²	58.5	53%	0.529	31%	0.314	S	S	.	.	H	α-helix	trans	-50.2	-43.8	-171.7	-174.8	68.6	0	0	0	114.1	R478 K479	L475-R478 PolarHBondContact O-N 3.16Å; L475-K479 HydrophobicContact CD1-CG 4.46Å; L475-K479 WeakPolarHBondContact O-CG 3.3Å; L475-K479 PolarHBondContact O-N 3Å
476	G	81.2	Confident	83	Confident	44 Å²	44	64.9 Å²	64.9	45%	0.454	34%	0.335	S	S	.	.	H	α-helix	trans	-59.5	-61.3	-179.6	0	0	0	0	0	113.1	P474 R478 K479 K480	P474-G476 VanDerWaalsContact C-N 3.31Å; P474-G476 PolarHBondContact O-N 2.89Å; P474-G476 VanDerWaalsContact O-N 3.12Å; G476-R478 VanDerWaalsContact C-N 3.31Å; G476-R478 PolarHBondContact O-N 2.99Å; G476-K479 PolarHBondContact O-N 3.13Å; G476-K480 PolarHBondContact O-N 2.9Å
477	P	87	Confident	82.6	Confident	24 Å²	24	67 Å²	67	16%	0.156	34%	0.338	C	S	.	.	H	α-helix	trans	-49.3	-43.1	170.5	-33.4	37.9	0	0	0	114.9	L443 Y446 I473 P474 K479 K480 I481	L443-P477 HydrophobicContact CD1-CB 4.17Å; L443-P477 HydrophobicContact CD2-CB 3.66Å; L443-P477 HydrophobicContact CD2-CG 3.78Å; Y446-P477 HydrophobicContact CD2-CB 4.24Å; Y446-P477 HydrophobicContact CE2-CB 3.68Å; Y446-P477 HydrophobicContact CE2-CG 3.66Å; I473-P477 HydrophobicContact CG2-CB 3.59Å; P474-P477 VanDerWaalsContact O-CD 3.27Å; P474-P477 WeakPolarHBondContact O-CD 3.37Å; P477-K479 PolarHBondContact O-N 3.31Å; P477-K480 WeakPolarHBondContact O-CB 3.3Å; P477-K480 PolarHBondContact O-N 3.26Å; P477-I481 WeakPolarHBondContact O-CG1 3.28Å; P477-I481 PolarHBondContact O-N 3.24Å
478	R	88.9	Confident	81.7	Confident	23 Å²	23	69.2 Å²	69.2	9%	0.087	34%	0.344	C	S	.	.	H	α-helix	trans	-59.1	-47.7	176.5	-61.4	-163.9	-50	-108.3	15.4	112.4	D465 L468 R469 I473 P474 L475 G476 K480 I481 L482	D465-R478 PolarHBondContact O-NE 3.24Å; D465-R478 IonicContact OD1-NE 3.3Å; D465-R478 IonicContact OD2-CZ 2.65Å; D465-R478 VanDerWaalsContact OD2-CZ 3.3Å; D465-R478 IonicContact OD2-NE 3.48Å; D465-R478 PolarHBondContact OD2-NE 3.29Å; D465-R478 IonicContact OD2-NH2 3.64Å; D465-R478 PolarHBondContact OD2-NH2 3.45Å; L468-R478 HydrophobicContact CB-CB 4.32Å; L468-R478 HydrophobicContact CB-CG 3.76Å; L468-R478 HydrophobicContact CD1-CB 4.36Å; L468-R478 WeakPolarHBondContact O-CD 3.48Å; R469-R478 VanDerWaalsContact N-CD 3.27Å; I473-R478 HydrophobicContact CB-CG 3.81Å; I473-R478 HydrophobicContact CG2-CG 3.66Å; I473-R478 VanDerWaalsContact O-CD 3.25Å; I473-R478 WeakPolarHBondContact O-CD 3.36Å; I473-R478 WeakPolarHBondContact O-CG 3.29Å; I473-R478 PolarHBondContact O-NH1 3.36Å; P474-R478 WeakPolarHBondContact O-CG 3.45Å; P474-R478 PolarHBondContact O-N 3.3Å; P474-R478 VanDerWaalsContact O-N 3.12Å; L475-R478 PolarHBondContact O-N 3.16Å; G476-R478 VanDerWaalsContact C-N 3.31Å; G476-R478 PolarHBondContact O-N 2.99Å; R478-K480 VanDerWaalsContact C-N 3.34Å; R478-K480 PolarHBondContact O-N 3.37Å; R478-I481 PolarHBondContact O-N 3.05Å; R478-L482 WeakPolarHBondContact O-CG 3.39Å; R478-L482 PolarHBondContact O-N 3.35Å
479	K	83.9	Confident	80.5	Confident	113 Å²	113	77 Å²	77	49%	0.491	37%	0.374	S	S	.	.	H	α-helix	trans	-63.4	-38	178.4	-66.4	-52.7	-174.6	-161.7	0	112.1	D465 L475 G476 P477 H483	D465-K479 VanDerWaalsContact OD1-CE 3.31Å; D465-K479 WeakPolarHBondContact OD1-CE 3.47Å; D465-K479 IonicContact OD1-NZ 2.74Å; D465-K479 PolarHBondContact OD1-NZ 2.81Å; L475-K479 HydrophobicContact CD1-CG 4.46Å; L475-K479 WeakPolarHBondContact O-CG 3.3Å; L475-K479 PolarHBondContact O-N 3Å; G476-K479 PolarHBondContact O-N 3.13Å; P477-K479 PolarHBondContact O-N 3.31Å; K479-H483 WeakPolarHBondContact O-CB 3.19Å; K479-H483 PolarHBondContact O-N 3.43Å
480	K	85.4	Confident	78.6	Confident	97 Å²	97	74.8 Å²	74.8	42%	0.422	37%	0.374	S	S	.	.	H	α-helix	trans	-59.3	-49.9	173.7	-75.7	-176.6	169	-169.2	0	111.9	L441 L443 G476 P477 R478 H483 Y484	L441-K480 HydrophobicContact CD1-CB 4.46Å; L441-K480 PolarHBondContact O-NZ 2.98Å; L443-K480 HydrophobicContact CD1-CB 3.98Å; L443-K480 HydrophobicContact CD1-CD 4.08Å; L443-K480 HydrophobicContact CD2-CD 4.32Å; L443-K480 HydrophobicContact CG-CD 4.33Å; G476-K480 PolarHBondContact O-N 2.9Å; P477-K480 WeakPolarHBondContact O-CB 3.3Å; P477-K480 PolarHBondContact O-N 3.26Å; R478-K480 VanDerWaalsContact C-N 3.34Å; R478-K480 PolarHBondContact O-N 3.37Å; K480-H483 PolarHBondContact O-N 3.34Å; K480-Y484 PolarHBondContact O-N 3.28Å
481	I	85.2	Confident	76.3	Confident	0 Å²	0	74.4 Å²	74.4	0%	0	38%	0.379	C	S	.	.	H	α-helix	trans	-61.5	-52.1	-179	-68.6	166.7	0	0	0	110.8	L438 L441 L443 L460 L468 P477 R478 H483 Y484 I485	L438-I481 HydrophobicContact CD2-CD1 4.12Å; L438-I481 HydrophobicContact CD2-CG1 4.36Å; L441-I481 HydrophobicContact CD1-CG1 4.15Å; L443-I481 HydrophobicContact CD1-CD1 4.04Å; L443-I481 HydrophobicContact CD1-CG1 3.7Å; L460-I481 HydrophobicContact CD1-CG2 4.29Å; L460-I481 HydrophobicContact CD2-CG2 3.8Å; L460-I481 HydrophobicContact CG-CG2 4.08Å; L468-I481 HydrophobicContact CD1-CB 4.37Å; L468-I481 HydrophobicContact CD1-CG2 4.09Å; P477-I481 WeakPolarHBondContact O-CG1 3.28Å; P477-I481 PolarHBondContact O-N 3.24Å; R478-I481 PolarHBondContact O-N 3.05Å; I481-H483 VanDerWaalsContact C-N 3.3Å; I481-H483 PolarHBondContact O-N 3.41Å; I481-Y484 PolarHBondContact O-N 3.02Å; I481-I485 HydrophobicContact CG2-CD1 3.91Å; I481-I485 PolarHBondContact O-N 3.46Å
482	L	83.4	Confident	73.8	Confident	13 Å²	13	78.1 Å²	78.1	7%	0.068	40%	0.396	C	S	.	.	H	α-helix	trans	-63.2	-34.6	179.7	-67	173.3	0	0	0	112.6	C463 D465 L468 R478 R486	C463-L482 VanDerWaalsContact O-CD2 3.28Å; C463-L482 WeakPolarHBondContact O-CD2 3.32Å; D465-L482 HydrophobicContact CB-CD1 3.99Å; L468-L482 HydrophobicContact CD1-CD1 4.23Å; L468-L482 HydrophobicContact CD1-CD2 3.88Å; L468-L482 HydrophobicContact CD1-CG 3.76Å; R478-L482 WeakPolarHBondContact O-CG 3.39Å; R478-L482 PolarHBondContact O-N 3.35Å; L482-R486 VanDerWaalsContact O-CG 3.3Å; L482-R486 WeakPolarHBondContact O-CG 3.36Å; L482-R486 PolarHBondContact O-N 3.37Å
483	H	82.7	Confident	71.6	Confident	129 Å²	129	82.2 Å²	82.2	60%	0.597	40%	0.403	S	S	*	.	H	α-helix	trans	-68	-43.4	174.9	-179.9	76.8	0	0	0	111.9	K479 K480 I481 I485 R486 K487	K479-H483 WeakPolarHBondContact O-CB 3.19Å; K479-H483 PolarHBondContact O-N 3.43Å; K480-H483 PolarHBondContact O-N 3.34Å; I481-H483 VanDerWaalsContact C-N 3.3Å; I481-H483 PolarHBondContact O-N 3.41Å; H483-I485 PolarHBondContact O-N 3.17Å; H483-R486 PolarHBondContact O-N 3.04Å; H483-K487 VanDerWaalsContact O-CB 3.31Å; H483-K487 WeakPolarHBondContact O-CB 3.32Å; H483-K487 PolarHBondContact O-N 3.28Å
484	Y	81.6	Confident	68.9	Low	47 Å²	47	92.8 Å²	92.8	18%	0.184	44%	0.444	C	S	.	.	H	α-helix	trans	-59.8	-45.6	176.6	-171.7	-94.9	0	0	0	111.9	D432 M437 L441 K480 I481 K487 K488	D432-Y484 PolarHBondContact OD2-OH 3.28Å; M437-Y484 HydrophobicContact CB-CE1 4.22Å; M437-Y484 HydrophobicContact CG-CD1 3.45Å; M437-Y484 VanDerWaalsContact CG-CD1 3.45Å; M437-Y484 HydrophobicContact CG-CE1 3.37Å; M437-Y484 HydrophobicContact CG-CG 4.3Å; M437-Y484 HydrophobicContact SD-CD1 4.28Å; L441-Y484 HydrophobicContact CD1-CG 4.22Å; L441-Y484 HydrophobicContact CD2-CD2 3.81Å; L441-Y484 HydrophobicContact CD2-CG 4.23Å; L441-Y484 HydrophobicContact CG-CD2 4.34Å; L441-Y484 HydrophobicContact CG-CG 4.46Å; K480-Y484 PolarHBondContact O-N 3.28Å; I481-Y484 PolarHBondContact O-N 3.02Å; Y484-K487 PolarHBondContact O-N 3.33Å; Y484-K488 PolarHBondContact O-N 3.25Å
485	I	80.5	Confident	66.3	Low	18 Å²	18	97.3 Å²	97.3	9%	0.092	46%	0.457	C	S	.	.	H	α-helix	trans	-62.7	-48.3	178	-74.6	163.3	0	0	0	111.2	L460 A461 I481 H483 K487 K488 R489	L460-I485 HydrophobicContact CB-CD1 4.23Å; L460-I485 HydrophobicContact CD2-CD1 3.87Å; L460-I485 HydrophobicContact CG-CD1 3.69Å; L460-I485 VanDerWaalsContact O-CD1 3.3Å; L460-I485 WeakPolarHBondContact O-CD1 3.34Å; A461-I485 HydrophobicContact CB-CG2 4.15Å; I481-I485 HydrophobicContact CG2-CD1 3.91Å; I481-I485 PolarHBondContact O-N 3.46Å; H483-I485 PolarHBondContact O-N 3.17Å; I485-K487 VanDerWaalsContact C-N 3.28Å; I485-K487 PolarHBondContact O-N 3.19Å; I485-K488 PolarHBondContact O-N 3.48Å; I485-R489 PolarHBondContact O-N 2.9Å
486	R	76.6	Confident	64.1	Low	170 Å²	170	101.9 Å²	101.9	64%	0.642	48%	0.478	S	S	*	.	H	α-helix	trans	-59.7	-40.2	175.6	-72.8	177.2	-159	-178.9	2.4	112	L482 H483 R489 L490	L482-R486 VanDerWaalsContact O-CG 3.3Å; L482-R486 WeakPolarHBondContact O-CG 3.36Å; L482-R486 PolarHBondContact O-N 3.37Å; H483-R486 PolarHBondContact O-N 3.04Å; R486-R489 PolarHBondContact O-N 3.42Å; R486-L490 PolarHBondContact O-N 3.19Å
487	K	72.9	Confident	61.6	Low	99 Å²	99	104.5 Å²	104.5	43%	0.43	50%	0.496	S	S	.	.	H	α-helix	trans	-64.1	-40.2	176.9	-170.7	-177.9	176.9	-163.1	0	111.8	H483 Y484 I485 R489 L490 E492	H483-K487 VanDerWaalsContact O-CB 3.31Å; H483-K487 WeakPolarHBondContact O-CB 3.32Å; H483-K487 PolarHBondContact O-N 3.28Å; Y484-K487 PolarHBondContact O-N 3.33Å; I485-K487 VanDerWaalsContact C-N 3.28Å; I485-K487 PolarHBondContact O-N 3.19Å; K487-R489 VanDerWaalsContact C-N 3.25Å; K487-R489 PolarHBondContact O-N 2.82Å; K487-L490 PolarHBondContact O-N 2.78Å; K487-E492 WeakPolarHBondContact CE-OE1 3.39Å; K487-E492 IonicContact NZ-OE1 3.19Å; K487-E492 PolarHBondContact NZ-OE1 2.91Å
488	K	65.9	Low	59.2	Low	106 Å²	106	109.5 Å²	109.5	46%	0.461	53%	0.528	S	S	.	.	H	α-helix	trans	-71.7	-17.2	175.5	-156.3	-176.7	-178.3	-174.4	0	113.1	N430 Y484 I485	N430-K488 PolarHBondContact O-NZ 2.83Å; Y484-K488 PolarHBondContact O-N 3.25Å; I485-K488 PolarHBondContact O-N 3.48Å
489	R	60.2	Low	56.3	Low	165 Å²	165	111.6 Å²	111.6	62%	0.623	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-6	178.9	-143.1	178.1	-164	144.2	4.2	113.9	A461 I485 R486 K487	A461-R489 PolarHBondContact O-NH1 3.45Å; I485-R489 PolarHBondContact O-N 2.9Å; R486-R489 PolarHBondContact O-N 3.42Å; K487-R489 VanDerWaalsContact C-N 3.25Å; K487-R489 PolarHBondContact O-N 2.82Å
490	L	42	Very low	53.6	Low	124 Å²	124	115.7 Å²	115.7	65%	0.649	58%	0.577	S	S	*	*	S	Bend	trans	-106.2	133.5	173.4	-78.2	157.6	0	0	0	109.1	R486 K487 E492	R486-L490 PolarHBondContact O-N 3.19Å; K487-L490 PolarHBondContact O-N 2.78Å; L490-E492 PolarHBondContact O-N 3.14Å
491	P	37.8	Very low	50.9	Low	128 Å²	128	119.7 Å²	119.7	83%	0.831	60%	0.597	S	S	*	*			trans	-60.1	121.9	169.5	-22	33.9	0	0	0	110.3	D493	P491-D493 PolarHBondContact O-N 2.89Å; P491-D493 VanDerWaalsContact O-N 3.14Å
492	E	31.9	Very low	48.1	Very low	111 Å²	111	125.9 Å²	125.9	52%	0.519	64%	0.635	S	S	.	*			trans	-76.5	97.2	175.3	-79.6	-162.8	137.3	0	0	110.2	K487 L490 K495	K487-E492 WeakPolarHBondContact CE-OE1 3.39Å; K487-E492 IonicContact NZ-OE1 3.19Å; K487-E492 PolarHBondContact NZ-OE1 2.91Å; L490-E492 PolarHBondContact O-N 3.14Å; E492-K495 WeakPolarHBondContact OE1-CE 3.23Å; E492-K495 IonicContact OE1-NZ 2.7Å; E492-K495 PolarHBondContact OE1-NZ 3.07Å; E492-K495 IonicContact OE2-NZ 3.54Å; E492-K495 PolarHBondContact OE2-NZ 2.93Å
493	D	32.7	Very low	45.4	Very low	148 Å²	148	130.5 Å²	130.5	79%	0.791	67%	0.668	S	S	*	*			trans	-124.8	156.9	146.4	-106.4	-41.1	0	0	0	109.8	P491	P491-D493 PolarHBondContact O-N 2.89Å; P491-D493 VanDerWaalsContact O-N 3.14Å
494	Y	30.2	Very low	42.7	Very low	224 Å²	224	131.9 Å²	131.9	88%	0.878	68%	0.68	S	S	*	*			trans	71.4	93.2	-167.1	-58.4	-82.9	0	0	0	116.5
495	K	28.7	Very low	40.1	Very low	159 Å²	159	135 Å²	135	69%	0.691	71%	0.709	S	S	*	*			trans	-115.7	121	151.6	-76.7	169.5	-176.9	140.7	0	108.9	E492	E492-K495 WeakPolarHBondContact OE1-CE 3.23Å; E492-K495 IonicContact OE1-NZ 2.7Å; E492-K495 PolarHBondContact OE1-NZ 3.07Å; E492-K495 IonicContact OE2-NZ 3.54Å; E492-K495 PolarHBondContact OE2-NZ 2.93Å
496	M	28.1	Very low	37.4	Very low	198 Å²	198	137.8 Å²	137.8	98%	0.975	74%	0.742	S	S	*	*			trans	-112.6	148.7	165.4	-99.4	-172.1	145.9	0	0	110.9
497	A	26.9	Very low	35.5	Very low	99 Å²	99	135.5 Å²	135.5	82%	0.818	75%	0.749	S	S	*	*			trans	-83.2	165.3	-175.3	0	0	0	0	0	112.7
498	P	36.7	Very low	34.2	Very low	129 Å²	129	136 Å²	136	84%	0.838	76%	0.763	S	S	*	*			trans	-99.8	138.9	-157	36.2	-33.8	0	0	0	116.2
499	G	28.4	Very low	32.2	Very low	66 Å²	66	139.4 Å²	139.4	68%	0.68	78%	0.78	S	S	*	*				83.6	127.6	117.6	0	0	0	0	0	120.5
500	H	27.4	Very low	30.5	Very low	199 Å²	199	137.5 Å²	137.5	92%	0.921	79%	0.786	S	S	*	*			trans	-137.1	145.9	136.3	-108.3	54.4	0	0	0	109.3
501	Q	29.3	Very low	29.6	Very low	182 Å²	182	138.4 Å²	138.4	85%	0.85	80%	0.797	S	S	*	*			trans	-112.4	153.5	-172.4	-58.4	173.4	4	0	0	111
502	T	25.6	Very low	29.1	Very low	130 Å²	130	137.6 Å²	137.6	80%	0.798	79%	0.794	S	S	*	*			trans	-161.5	119.3	137.5	35.3	0	0	0	0	110.2
503	S	26.9	Very low	28.7	Very low	109 Å²	109	141.4 Å²	141.4	76%	0.762	81%	0.812	S	S	*	*			trans	36	145.8	131.3	64.8	0	0	0	0	120.7
504	D	25.9	Very low	28.2	Very low	159 Å²	159	137.7 Å²	137.7	85%	0.85	81%	0.809	S	S	*	*			cis	-159	173.6	18.3	-156.8	-4.5	0	0	0	111
505	S	27.1	Very low	28	Very low	113 Å²	113	135.2 Å²	135.2	79%	0.79	81%	0.809	S	S	*	*			trans	-143.2	132.8	178.4	65.1	0	0	0	0	114.4
506	G	25.1	Very low	27.7	Very low	75 Å²	75	136.3 Å²	136.3	77%	0.773	82%	0.817	S	S	*	*			trans	-168	119.5	173.4	0	0	0	0	0	115.5
507	P	35	Very low	27.5	Very low	123 Å²	123	131.5 Å²	131.5	80%	0.799	80%	0.802	S	S	*	*			trans	-110.2	-159.9	168.8	43.2	-34.1	0	0	0	110.6
508	P	47.2	Very low	27.2	Very low	110 Å²	110	131.9 Å²	131.9	71%	0.714	80%	0.799	S	S	*	*			cis	-128.4	-174.6	-31.3	29.1	-7.6	0	0	0	113.3
509	Q	24.2	Very low	26.6	Very low	176 Å²	176	135 Å²	135	82%	0.822	80%	0.802	S	S	*	*			trans	154.7	122.9	134.7	-85.9	-176.4	-26.1	0	0	113.1
510	V	24.3	Very low	26.2	Very low	125 Å²	125	139.9 Å²	139.9	76%	0.758	81%	0.812	S	S	*	*				75.2	112	82.7	177.3	0	0	0	0	115.5
511	T	23.2	Very low	26.5	Very low	144 Å²	144	136.3 Å²	136.3	88%	0.883	81%	0.807	S	S	*	*				179.3	156.3	118.9	35.1	0	0	0	0	113.1
512	S	25.5	Very low	26.2	Very low	110 Å²	110	131.2 Å²	131.2	77%	0.769	80%	0.803	S	S	*	*			trans	-100.8	155.2	177.5	171.8	0	0	0	0	111.3
513	E	24.7	Very low	26.1	Very low	192 Å²	192	133.1 Å²	133.1	90%	0.897	80%	0.803	S	S	*	*			trans	176.4	161.7	130.4	-100.3	176.5	-159	0	0	112.8
514	G	22.5	Very low	25.8	Very low	70 Å²	70	135.4 Å²	135.4	72%	0.722	80%	0.801	S	S	*	*			trans	-161.7	162.2	173.9	0	0	0	0	0	111.8
515	I	25.2	Very low	25.6	Very low	172 Å²	172	133.1 Å²	133.1	88%	0.882	80%	0.798	S	S	*	*			trans	-155.8	154.4	177.2	-100.4	150.3	0	0	0	110.3
516	Q	22.5	Very low	25.5	Very low	182 Å²	182	133 Å²	133	85%	0.85	80%	0.797	S	S	*	*			trans	-83	179.1	-179.2	-59.1	166.9	-18.8	0	0	110.9
517	S	23.5	Very low	25.5	Very low	96 Å²	96	137.5 Å²	137.5	67%	0.671	80%	0.802	S	S	*	*			cis	-175.8	160	34.3	50.5	0	0	0	0	113.7
518	S	22.4	Very low	25.1	Very low	108 Å²	108	140.5 Å²	140.5	76%	0.755	81%	0.806	S	S	*	*			trans	62.9	146.1	144.6	65.9	0	0	0	0	120.6
519	E	22.1	Very low	24.1	Very low	193 Å²	193	142.7 Å²	142.7	90%	0.902	81%	0.811	S	S	*	*			cis	-142.4	-178.9	20.6	-71.1	-174.3	124.3	0	0	114.7
520	L	21.2	Very low	24.2	Very low	169 Å²	169	143.2 Å²	143.2	89%	0.885	81%	0.811	S	S	*	*			trans	-102.7	-170.3	-171.7	-81.9	159.1	0	0	0	112.9
521	P	33.9	Very low	24.3	Very low	125 Å²	125	143.1 Å²	143.1	81%	0.812	81%	0.813	S	S	*	*			cis	-136.2	175.4	0.1	41.1	-23.6	0	0	0	117.1
522	G	22	Very low	24.4	Very low	74 Å²	74	141.5 Å²	141.5	76%	0.763	81%	0.807	S	S	*	*			trans	153.1	99.5	152	0	0	0	0	0	120.2
523	Q	24.2	Very low	24.5	Very low	170 Å²	170	142.7 Å²	142.7	79%	0.794	81%	0.81	S	S	*	*			trans	64.2	111	153.5	-92.7	-176.5	-48.8	0	0	124.5
524	E	20.7	Very low	24.7	Very low	157 Å²	157	139.9 Å²	139.9	73%	0.734	81%	0.806	S	S	*	*				69.9	117.6	128.1	-75.4	172.6	-131.7	0	0	124.5
525	S	21.9	Very low	24.9	Very low	112 Å²	112	139.4 Å²	139.4	78%	0.783	80%	0.801	S	S	*	*			trans	105.1	145.9	135.5	81.7	0	0	0	0	120.3
526	S	24.4	Very low	25.1	Very low	111 Å²	111	135.9 Å²	135.9	78%	0.776	80%	0.798	S	S	*	*			trans	73.1	121.3	179.4	76.8	0	0	0	0	118.1
527	L	25.5	Very low	25.5	Very low	168 Å²	168	132.6 Å²	132.6	88%	0.88	79%	0.79	S	S	*	*			trans	-78.5	121.3	169.2	-72.9	153.4	0	0	0	108.9
528	H	25.9	Very low	25.5	Very low	187 Å²	187	134.9 Å²	134.9	87%	0.866	80%	0.795	S	S	*	*			trans	-111	106.3	166.5	-110.6	26.2	0	0	0	110.3
529	N	27.4	Very low	26	Very low	155 Å²	155	138.5 Å²	138.5	83%	0.829	79%	0.793	S	S	*	*			trans	-67.8	147.7	169.7	-87.7	-25.7	0	0	0	110.3
530	K	25.7	Very low	26.6	Very low	188 Å²	188	135.1 Å²	135.1	82%	0.817	78%	0.777	S	S	*	*			trans	-57.7	140.1	175.5	-61	169.2	179.4	175.5	0	110.4	S532	K530-S532 PolarHBondContact O-N 3.06Å; K530-S532 VanDerWaalsContact O-N 3.11Å
531	P	26.1	Very low	27.7	Very low	123 Å²	123	131.1 Å²	131.1	80%	0.799	75%	0.751	S	S	*	*			trans	-70	105.2	161.9	29.3	-31	0	0	0	108.4	T533	P531-T533 PolarHBondContact O-N 2.82Å
532	S	24.7	Very low	28.1	Very low	110 Å²	110	127.2 Å²	127.2	77%	0.769	72%	0.721	S	S	*	*			trans	-67.7	119.8	167	-70.9	0	0	0	0	108.9	K530 T534	K530-S532 PolarHBondContact O-N 3.06Å; K530-S532 VanDerWaalsContact O-N 3.11Å; S532-T534 PolarHBondContact O-N 2.93Å
533	T	27.4	Very low	28.9	Very low	135 Å²	135	128.9 Å²	128.9	83%	0.828	71%	0.713	S	S	*	*			trans	-71.1	92	-179.1	-45.1	0	0	0	0	110.9	P531 G535	P531-T533 PolarHBondContact O-N 2.82Å; T533-G535 PolarHBondContact O-N 3.47Å
534	T	29.7	Very low	30.1	Very low	133 Å²	133	121.6 Å²	121.6	82%	0.816	68%	0.68	S	S	*	*			trans	-70.3	100.8	152.4	50.8	0	0	0	0	106.9	S532 A536	S532-T534 PolarHBondContact O-N 2.93Å; T534-A536 PolarHBondContact O-N 3.3Å
535	G	27.5	Very low	31.5	Very low	59 Å²	59	116.3 Å²	116.3	61%	0.608	67%	0.667	S	S	*	*			trans	-56.3	132.1	171.4	0	0	0	0	0	109.1	T533 V537	T533-G535 PolarHBondContact O-N 3.47Å; G535-V537 PolarHBondContact O-N 2.97Å
536	A	27.6	Very low	32.4	Very low	99 Å²	99	111.1 Å²	111.1	82%	0.818	63%	0.631	S	S	*	*			trans	-57.3	131.6	169.9	0	0	0	0	0	108.2	T534 D538	T534-A536 PolarHBondContact O-N 3.3Å; A536-D538 PolarHBondContact O-N 3.31Å; A536-D538 VanDerWaalsContact O-N 3.15Å
537	V	30.7	Very low	33.3	Very low	112 Å²	112	108.1 Å²	108.1	68%	0.679	62%	0.617	S	S	*	*			trans	-68.6	111.5	169.4	178.6	0	0	0	0	106.2	G535 Y539	G535-V537 PolarHBondContact O-N 2.97Å; V537-Y539 HydrophobicContact CB-CE2 4.45Å; V537-Y539 HydrophobicContact CG1-CE2 4.48Å; V537-Y539 WeakPolarHBondContact O-CD2 3.38Å; V537-Y539 PolarHBondContact O-N 3.25Å
538	D	24.5	Very low	33.7	Very low	145 Å²	145	106.2 Å²	106.2	78%	0.775	60%	0.603	S	S	*	*			trans	-72	108.7	175.3	-130.9	-21.4	0	0	0	107.6	A536 E540	A536-D538 PolarHBondContact O-N 3.31Å; A536-D538 VanDerWaalsContact O-N 3.15Å; D538-E540 PolarHBondContact O-N 2.86Å
539	Y	33.5	Very low	34.1	Very low	184 Å²	184	102.7 Å²	102.7	72%	0.722	60%	0.6	S	S	*	*			trans	-78.1	72.3	178.1	-79	-89.9	0	0	0	109.5	V537 Y541	V537-Y539 HydrophobicContact CB-CE2 4.45Å; V537-Y539 HydrophobicContact CG1-CE2 4.48Å; V537-Y539 WeakPolarHBondContact O-CD2 3.38Å; V537-Y539 PolarHBondContact O-N 3.25Å; Y539-Y541 PolarHBondContact O-N 2.68Å
540	E	34.3	Very low	34.2	Very low	122 Å²	122	102.4 Å²	102.4	57%	0.57	60%	0.599	S	S	*	*			trans	-69.4	97.5	169.5	-75	-159.6	151.6	0	0	110.4	D538	D538-E540 PolarHBondContact O-N 2.86Å
541	Y	43.7	Very low	34.6	Very low	84 Å²	84	97.6 Å²	97.6	33%	0.329	60%	0.602	S	S	.	*			trans	47.2	124.7	148.7	-158.8	-105.7	0	0	0	118.4	Y539 D543 Q548 Q557	Y539-Y541 PolarHBondContact O-N 2.68Å; Y541-D543 HydrophobicContact CE1-CB 4.07Å; Y541-Q548 PolarHBondContact OH-NE2 3.11Å; Y541-Q548 VanDerWaalsContact OH-NE2 3.13Å; Y541-Q548 PolarHBondContact OH-OE1 2.75Å; Y541-Q557 VanDerWaalsContact O-CG 3.28Å; Y541-Q557 WeakPolarHBondContact O-CG 3.42Å; Y541-Q557 PolarHBondContact O-OE1 3.32Å
542	F	41.8	Very low	34.8	Very low	44 Å²	44	94.7 Å²	94.7	19%	0.193	60%	0.595	C	S	.	*			trans	-103.8	122.5	157.5	-82.9	-93.7	0	0	0	109.2	P360 V544 I560 R586	P360-F542 HydrophobicContact CG-CZ 4.2Å; F542-V544 VanDerWaalsContact O-CG2 3.3Å; F542-V544 WeakPolarHBondContact O-CG2 3.2Å; F542-V544 PolarHBondContact O-N 3.1Å; F542-V544 VanDerWaalsContact O-N 3.17Å; F542-I560 HydrophobicContact CE1-CD1 4.02Å; F542-R586 HydrophobicContact CB-CB 4.44Å; F542-R586 HydrophobicContact CB-CG 4.25Å
543	D	40.8	Very low	35.3	Very low	108 Å²	108	97.6 Å²	97.6	58%	0.578	60%	0.6	S	S	*	*			trans	-65.6	112.6	166.7	-171.6	-4.7	0	0	0	109.6	Y541 G545	Y541-D543 HydrophobicContact CE1-CB 4.07Å; D543-G545 VanDerWaalsContact C-N 3.31Å; D543-G545 PolarHBondContact OD1-N 3.01Å; D543-G545 VanDerWaalsContact OD1-N 3.08Å
544	V	48.5	Very low	35.6	Very low	18 Å²	18	92.5 Å²	92.5	11%	0.109	57%	0.571	C	S	.	*			trans	-86.3	-3.3	-174.2	-166.2	0	0	0	0	111.6	F542 I546 L583 R586 L588	F542-V544 VanDerWaalsContact O-CG2 3.3Å; F542-V544 WeakPolarHBondContact O-CG2 3.2Å; F542-V544 PolarHBondContact O-N 3.1Å; F542-V544 VanDerWaalsContact O-N 3.17Å; V544-I546 PolarHBondContact O-N 2.89Å; V544-L583 HydrophobicContact CG1-CD2 3.48Å; V544-L583 VanDerWaalsContact CG1-CD2 3.48Å; V544-R586 HydrophobicContact CG2-CB 3.6Å; V544-L588 HydrophobicContact CG1-CD2 4.22Å; V544-L588 HydrophobicContact CG2-CB 4.46Å
545	G	50.5	Low	35.6	Very low	45 Å²	45	96.1 Å²	96.1	46%	0.464	58%	0.576	S	S	.	*	S	Bend	trans	69.2	-12.9	179.3	0	0	0	0	0	115.4	D543	D543-G545 VanDerWaalsContact C-N 3.31Å; D543-G545 PolarHBondContact OD1-N 3.01Å; D543-G545 VanDerWaalsContact OD1-N 3.08Å
546	I	41.3	Very low	36.2	Very low	4 Å²	4	96.6 Å²	96.6	2%	0.021	58%	0.58	C	S	.	*	S	Bend	trans	-98.5	108.1	179	-56.3	179.7	0	0	0	109.2	F405 T409 V544 L588 I591 Y595	F405-I546 HydrophobicContact CE1-CD1 3.53Å; F405-I546 HydrophobicContact CZ-CD1 3.46Å; F405-I546 VanDerWaalsContact CZ-CD1 3.46Å; T409-I546 HydrophobicContact CG2-CD1 4.33Å; T409-I546 HydrophobicContact CG2-CG1 3.84Å; V544-I546 PolarHBondContact O-N 2.89Å; I546-L588 HydrophobicContact CB-CD2 4.02Å; I546-L588 HydrophobicContact CD1-CD2 4.44Å; I546-L588 HydrophobicContact CG2-CD2 4.1Å; I546-L588 VanDerWaalsContact O-CD1 3.3Å; I546-L588 WeakPolarHBondContact O-CD1 2.95Å; I546-I591 HydrophobicContact CG2-CB 4.42Å; I546-I591 HydrophobicContact CG2-CG1 4.36Å; I546-I591 HydrophobicContact CG2-CG2 3.95Å; I546-Y595 HydrophobicContact CD1-CD1 4.44Å; I546-Y595 HydrophobicContact CD1-CE1 3.82Å; I546-Y595 HydrophobicContact CG1-CD1 4.44Å; I546-Y595 HydrophobicContact CG1-CE1 3.91Å; I546-Y595 HydrophobicContact CG1-CE2 4.12Å; I546-Y595 HydrophobicContact CG2-CD1 3.91Å; I546-Y595 HydrophobicContact CG2-CD2 4.22Å; I546-Y595 HydrophobicContact CG2-CE1 4.23Å; I546-Y595 HydrophobicContact CG2-CG 3.92Å
547	G	41.9	Very low	36.9	Very low	47 Å²	47	95 Å²	95	49%	0.485	56%	0.556	S	S	.	*	S	Bend	trans	86.9	18.9	158.8	0	0	0	0	0	118.5
548	Q	34.5	Very low	38	Very low	128 Å²	128	93.8 Å²	93.8	60%	0.598	55%	0.549	S	S	*	.			trans	-120.6	79.2	170.6	-68.3	-154.8	20	0	0	114.5	Y541 N550	Y541-Q548 PolarHBondContact OH-NE2 3.11Å; Y541-Q548 VanDerWaalsContact OH-NE2 3.13Å; Y541-Q548 PolarHBondContact OH-OE1 2.75Å; Q548-N550 VanDerWaalsContact C-N 3.27Å; Q548-N550 PolarHBondContact O-N 2.75Å
549	S	34.1	Very low	40	Very low	113 Å²	113	91.7 Å²	91.7	79%	0.79	55%	0.546	S	S	*	.			trans	-76	79.6	154.7	61.3	0	0	0	0	110.2
550	N	29.9	Very low	42.3	Very low	150 Å²	150	84.1 Å²	84.1	80%	0.802	52%	0.517	S	S	*	.	S	Bend	trans	169.5	99.6	144.9	-85.9	-25.7	0	0	0	113.7	Q548	Q548-N550 VanDerWaalsContact C-N 3.27Å; Q548-N550 PolarHBondContact O-N 2.75Å
551	G	33.8	Very low	44.9	Very low	87 Å²	87	83.2 Å²	83.2	90%	0.897	52%	0.516	S	S	*	.			trans	63.9	86.9	135.9	0	0	0	0	0	119.7
552	G	30	Very low	47.1	Very low	62 Å²	62	80.5 Å²	80.5	64%	0.639	51%	0.506	S	S	*	.			trans	-179.4	70.8	164.7	0	0	0	0	0	115.3	A554	G552-A554 PolarHBondContact O-N 2.95Å; G552-A554 VanDerWaalsContact O-N 3.1Å
553	I	34.4	Very low	49.5	Very low	170 Å²	170	79.9 Å²	79.9	87%	0.872	51%	0.506	S	S	*	.			trans	-68.7	109.1	167.8	-59.4	178.2	0	0	0	108.5	K555	I553-K555 PolarHBondContact O-N 2.74Å
554	A	34	Very low	52.1	Low	28 Å²	28	77.4 Å²	77.4	23%	0.231	49%	0.491	C	S	.	.			trans	-62	123.6	168.9	0	0	0	0	0	109.5	G552 G556	G552-A554 PolarHBondContact O-N 2.95Å; G552-A554 VanDerWaalsContact O-N 3.1Å; A554-G556 VanDerWaalsContact C-N 3.31Å; A554-G556 PolarHBondContact O-N 3.21Å
555	K	30.7	Very low	54.3	Low	210 Å²	210	77 Å²	77	91%	0.913	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	78.3	-179	-79.1	-177.7	174.7	174.5	0	110.9	I553	I553-K555 PolarHBondContact O-N 2.74Å
556	G	40.1	Very low	56.4	Low	68 Å²	68	79 Å²	79	70%	0.701	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	167.2	-17.3	175.1	0	0	0	0	0	115.1	A554	A554-G556 VanDerWaalsContact C-N 3.31Å; A554-G556 PolarHBondContact O-N 3.21Å
557	Q	41.7	Very low	58.9	Low	65 Å²	65	79.5 Å²	79.5	30%	0.304	49%	0.493	S	S	.	.			trans	-69	136.5	-177.5	-159.3	-156.4	-27.9	0	0	111.8	Y541 S559	Y541-Q557 VanDerWaalsContact O-CG 3.28Å; Y541-Q557 WeakPolarHBondContact O-CG 3.42Å; Y541-Q557 PolarHBondContact O-OE1 3.32Å; Q557-S559 PolarHBondContact O-N 3.16Å
558	V	53.3	Low	61.4	Low	87 Å²	87	81.8 Å²	81.8	53%	0.527	49%	0.488	S	S	.	.			trans	-73	111.7	166.7	179.3	0	0	0	0	107.9	P360 I560	P360-V558 HydrophobicContact CB-CB 3.75Å; P360-V558 HydrophobicContact CB-CG1 3.78Å; P360-V558 HydrophobicContact CB-CG2 4.16Å; P360-V558 HydrophobicContact CG-CB 4.28Å; V558-I560 PolarHBondContact O-N 3.02Å
559	S	67.6	Low	64.2	Low	102 Å²	102	75.8 Å²	75.8	71%	0.713	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-75.1	120.2	172.2	56.4	0	0	0	0	110	Q557	Q557-S559 PolarHBondContact O-N 3.16Å
560	I	82.1	Confident	67.1	Low	24 Å²	24	71.5 Å²	71.5	12%	0.123	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-76.9	130.7	170.5	-61.9	151.3	0	0	0	107.9	C363 V367 F542 V558 Y562	C363-I560 HydrophobicContact CB-CD1 4.18Å; C363-I560 WeakPolarHBondContact SG-CD1 3.48Å; V367-I560 HydrophobicContact CG2-CG2 4.06Å; F542-I560 HydrophobicContact CE1-CD1 4.02Å; V558-I560 PolarHBondContact O-N 3.02Å; I560-Y562 HydrophobicContact CB-CD2 4.49Å; I560-Y562 HydrophobicContact CB-CE2 3.93Å; I560-Y562 HydrophobicContact CG2-CD1 4.28Å; I560-Y562 HydrophobicContact CG2-CD2 4.09Å; I560-Y562 HydrophobicContact CG2-CE1 3.95Å; I560-Y562 HydrophobicContact CG2-CE2 3.76Å; I560-Y562 HydrophobicContact CG2-CG 4.36Å
561	D	87.6	Confident	70.3	Confident	103 Å²	103	64.4 Å²	64.4	55%	0.551	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-93.1	121.1	169.3	-169.1	23.3	0	0	0	108.4	Q364 P563	Q364-D561 PolarHBondContact NE2-O 3.06Å; D561-P563 WeakPolarHBondContact O-CD 3.34Å
562	Y	90.5	Very high	73.3	Confident	28 Å²	28	60.2 Å²	60.2	11%	0.11	35%	0.346	C	S	.	.			trans	-96	115.5	-176.1	-72.4	-83.6	0	0	0	110.5	V367 D406 L407 N410 I560 Q564	V367-Y562 HydrophobicContact CB-CD1 4.34Å; V367-Y562 HydrophobicContact CG1-CD1 4.07Å; V367-Y562 HydrophobicContact CG1-CE1 3.86Å; V367-Y562 HydrophobicContact CG2-CD1 4.38Å; D406-Y562 HydrophobicContact CB-CD1 4.39Å; D406-Y562 HydrophobicContact CB-CE1 3.55Å; L407-Y562 HydrophobicContact CD2-CD1 4.22Å; N410-Y562 HydrophobicContact CB-CD2 3.81Å; N410-Y562 HydrophobicContact CB-CG 3.76Å; N410-Y562 VanDerWaalsContact CG-CD2 3.42Å; N410-Y562 WeakPolarHBondContact ND2-CD2 3.4Å; N410-Y562 WeakPolarHBondContact ND2-CE2 3.44Å; I560-Y562 HydrophobicContact CB-CD2 4.49Å; I560-Y562 HydrophobicContact CB-CE2 3.93Å; I560-Y562 HydrophobicContact CG2-CD1 4.28Å; I560-Y562 HydrophobicContact CG2-CD2 4.09Å; I560-Y562 HydrophobicContact CG2-CE1 3.95Å; I560-Y562 HydrophobicContact CG2-CE2 3.76Å; I560-Y562 HydrophobicContact CG2-CG 4.36Å; Y562-Q564 PolarHBondContact O-NE2 2.95Å
563	P	93.1	Very high	76.5	Confident	30 Å²	30	57.3 Å²	57.3	20%	0.195	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-61.5	157.6	178.7	-21.5	32	0	0	0	112.6	D368 A371 Q411 D561	D368-P563 WeakPolarHBondContact OD1-CG 3.49Å; A371-P563 HydrophobicContact CB-CB 3.68Å; A371-P563 HydrophobicContact CB-CG 4.02Å; Q411-P563 PolarHBondContact NE2-O 2.94Å; D561-P563 WeakPolarHBondContact O-CD 3.34Å
564	Q	94.7	Very high	79.5	Confident	57 Å²	57	49.2 Å²	49.2	27%	0.266	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-99	134.8	-176.2	-56	-65.4	-72.3	0	0	109.7	N375 N410 Y562	N375-Q564 PolarHBondContact ND2-O 3.16Å; N410-Q564 PolarHBondContact O-NE2 3.31Å; Y562-Q564 PolarHBondContact O-NE2 2.95Å
565	L	95.1	Very high	82.4	Confident	10 Å²	10	47.9 Å²	47.9	5%	0.052	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-74	141	171.9	-60.5	-178.4	0	0	0	109.1	A371 V374 N375 L408 F567 P569	A371-L565 HydrophobicContact CB-CD2 4.42Å; V374-L565 HydrophobicContact CB-CD2 4.38Å; V374-L565 HydrophobicContact CG1-CD2 3.88Å; N375-L565 WeakPolarHBondContact OD1-CA 3.43Å; L408-L565 HydrophobicContact CD2-CD1 4.42Å; L565-F567 HydrophobicContact CD1-CZ 4.44Å; L565-F567 PolarHBondContact O-N 2.9Å; L565-P569 HydrophobicContact CD1-CG 4.06Å
566	V	93.9	Very high	85.2	Confident	85 Å²	85	37.9 Å²	37.9	52%	0.515	22%	0.22	S	C	.	.	S	Bend	trans	-74.5	-13.8	-179.6	-61.8	0	0	0	0	113.2	N375 H378	N375-V566 HydrophobicContact CB-CG1 4.35Å; N375-V566 WeakPolarHBondContact OD1-CG2 3.27Å; N375-V566 PolarHBondContact OD1-N 3.16Å; H378-V566 HydrophobicContact CB-CG2 4.41Å; H378-V566 WeakPolarHBondContact ND1-CG2 3.47Å
567	F	93.5	Very high	87.7	Confident	15 Å²	15	34.7 Å²	34.7	7%	0.066	19%	0.187	C	C	.	.	S	Bend	trans	-123.9	169.9	178.7	62.8	-87.4	0	0	0	111	F263 V374 H378 V392 V394 L565 P569	F263-F567 HydrophobicContact CD2-CE1 4.11Å; F263-F567 HydrophobicContact CD2-CE2 4.11Å; F263-F567 AromaticContact CD2-CZ 3.45Å; F263-F567 HydrophobicContact CD2-CZ 3.45Å; F263-F567 VanDerWaalsContact CD2-CZ 3.45Å; F263-F567 AromaticContact CE2-CE1 3.66Å; F263-F567 HydrophobicContact CE2-CE1 3.66Å; F263-F567 HydrophobicContact CE2-CE2 4.14Å; F263-F567 AromaticContact CE2-CZ 3.44Å; F263-F567 HydrophobicContact CE2-CZ 3.44Å; F263-F567 VanDerWaalsContact CE2-CZ 3.44Å; V374-F567 HydrophobicContact CG1-CE1 3.61Å; V374-F567 HydrophobicContact CG1-CZ 3.57Å; H378-F567 HydrophobicContact CB-CD1 3.99Å; H378-F567 HydrophobicContact CB-CE1 3.95Å; H378-F567 AromaticContact CD2-CD1 3.38Å; H378-F567 WeakPolarHBondContact CD2-CD1 3.46Å; H378-F567 AromaticContact CD2-CE1 3.93Å; H378-F567 AromaticContact CD2-CG 3.82Å; H378-F567 AromaticContact CG-CD1 3.55Å; H378-F567 AromaticContact CG-CE1 4Å; H378-F567 AromaticContact NE2-CD1 3.88Å; H378-F567 AromaticContact NE2-CG 3.95Å; V392-F567 HydrophobicContact CB-CD2 3.73Å; V392-F567 HydrophobicContact CB-CE2 3.97Å; V392-F567 HydrophobicContact CG1-CD2 3.57Å; V392-F567 HydrophobicContact CG1-CE2 3.31Å; V392-F567 HydrophobicContact CG1-CG 4.38Å; V392-F567 HydrophobicContact CG1-CZ 3.96Å; V392-F567 HydrophobicContact CG2-CD2 4.26Å; V394-F567 HydrophobicContact CG1-CE2 4.33Å; V394-F567 HydrophobicContact CG1-CZ 4.47Å; L565-F567 HydrophobicContact CD1-CZ 4.44Å; L565-F567 PolarHBondContact O-N 2.9Å; F567-P569 HydrophobicContact CD2-CG 4.09Å; F567-P569 HydrophobicContact CE2-CG 3.72Å
568	Y	94.1	Very high	90.1	Very high	96 Å²	96	31.6 Å²	31.6	38%	0.376	17%	0.172	S	C	.	.			trans	-112.1	108.3	177.2	-63.5	-33	0	0	0	110.1	R412 R414 E570 T599	R412-Y568 PolarHBondContact O-OH 3.19Å; R414-Y568 WeakPolarHBondContact CB-OH 3.38Å; R414-Y568 WeakPolarHBondContact CD-OH 3.39Å; R414-Y568 WeakPolarHBondContact CG-OH 3.38Å; R414-Y568 PolarHBondContact N-OH 3.2Å; Y568-E570 PolarHBondContact O-N 2.95Å; Y568-T599 HydrophobicContact CD1-CG2 3.46Å; Y568-T599 VanDerWaalsContact CD1-CG2 3.46Å; Y568-T599 HydrophobicContact CE1-CG2 3.44Å; Y568-T599 VanDerWaalsContact CE1-CG2 3.44Å; Y568-T599 HydrophobicContact CG-CG2 4.26Å
569	P	95	Very high	91.9	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.006	15%	0.147	C	C	.	.			trans	-61.2	133	178.1	-24	35.2	0	0	0	110.9	V392 V394 L408 L565 F567 C600	V392-P569 CarbonylContact O-C 3.56Å; V392-P569 VanDerWaalsContact O-CA 3.26Å; V392-P569 WeakPolarHBondContact O-CA 3.39Å; V394-P569 HydrophobicContact CG1-CB 4.23Å; V394-P569 HydrophobicContact CG1-CG 4.02Å; V394-P569 HydrophobicContact CG2-CB 4.15Å; V394-P569 HydrophobicContact CG2-CG 4.4Å; L408-P569 HydrophobicContact CD2-CB 4.45Å; L408-P569 HydrophobicContact CD2-CG 3.87Å; L565-P569 HydrophobicContact CD1-CG 4.06Å; F567-P569 HydrophobicContact CD2-CG 4.09Å; F567-P569 HydrophobicContact CE2-CG 3.72Å; P569-C600 VanDerWaalsContact O-CA 3.29Å; P569-C600 WeakPolarHBondContact O-CA 3.4Å
570	E	94.6	Very high	93	Very high	23 Å²	23	22.8 Å²	22.8	11%	0.107	12%	0.115	C	C	.	.	S	Bend	trans	-75.8	-48.4	175.9	-178.1	145.9	-113.1	0	0	111.2	K391 V392 Y568 C600 K601 S602	K391-E570 HydrophobicContact CB-CB 4.47Å; K391-E570 VanDerWaalsContact CB-OE2 3.27Å; K391-E570 WeakPolarHBondContact CB-OE2 3.48Å; K391-E570 VanDerWaalsContact CG-OE2 3.24Å; K391-E570 WeakPolarHBondContact CG-OE2 3.49Å; V392-E570 PolarHBondContact O-N 3.33Å; Y568-E570 PolarHBondContact O-N 2.95Å; E570-C600 PolarHBondContact O-SG 3.38Å; E570-K601 HydrophobicContact CG-CD 4.48Å; E570-K601 PolarHBondContact O-N 3.45Å; E570-K601 VanDerWaalsContact O-N 3.13Å; E570-K601 IonicContact OE1-NZ 3.67Å; E570-K601 PolarHBondContact OE1-NZ 3.45Å; E570-S602 PolarHBondContact O-N 3.48Å
571	T	96.1	Very high	93.4	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.006	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	139.3	-178.9	-54.8	0	0	0	0	111.4	S393 V394 F573 S602 Y604 E766	S393-T571 WeakPolarHBondContact CA-O 3.5Å; S393-T571 WeakPolarHBondContact CB-O 3.3Å; S393-T571 PolarHBondContact OG-N 2.84Å; S393-T571 PolarHBondContact OG-O 3.26Å; V394-T571 PolarHBondContact N-O 3.3Å; T571-F573 HydrophobicContact CG2-CD1 4.29Å; T571-F573 HydrophobicContact CG2-CD2 3.96Å; T571-F573 HydrophobicContact CG2-CE1 3.83Å; T571-F573 HydrophobicContact CG2-CE2 3.46Å; T571-F573 VanDerWaalsContact CG2-CE2 3.46Å; T571-F573 HydrophobicContact CG2-CG 4.36Å; T571-F573 HydrophobicContact CG2-CZ 3.4Å; T571-S602 WeakPolarHBondContact CA-O 3.27Å; T571-S602 WeakPolarHBondContact OG1-CB 3.43Å; T571-Y604 HydrophobicContact CG2-CD2 3.57Å; T571-Y604 HydrophobicContact CG2-CE2 3.83Å; T571-E766 HydrophobicContact CG2-CG 4.24Å
572	F	97.4	Very high	93.4	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	121.9	168.9	172.8	-148.7	0	0	0	110.1	V394 S401 L404 F405 L408 A574 I579 F597 S602 F603 Y604	V394-F572 HydrophobicContact CG2-CB 4.03Å; V394-F572 HydrophobicContact CG2-CD2 3.83Å; V394-F572 HydrophobicContact CG2-CG 4.18Å; V394-F572 WeakPolarHBondContact O-CA 3.3Å; S401-F572 VanDerWaalsContact O-CZ 3.32Å; S401-F572 WeakPolarHBondContact O-CZ 3.48Å; L404-F572 HydrophobicContact CB-CD2 4.48Å; L404-F572 HydrophobicContact CB-CE2 3.84Å; L404-F572 HydrophobicContact CB-CZ 3.95Å; L404-F572 HydrophobicContact CD1-CD2 4.42Å; L404-F572 HydrophobicContact CD1-CE2 4Å; F405-F572 HydrophobicContact CB-CE1 3.96Å; F405-F572 HydrophobicContact CB-CZ 4.37Å; F405-F572 HydrophobicContact CD2-CE1 4.16Å; L408-F572 HydrophobicContact CD1-CB 3.71Å; L408-F572 HydrophobicContact CD1-CD1 3.48Å; L408-F572 VanDerWaalsContact CD1-CD1 3.48Å; L408-F572 HydrophobicContact CD1-CD2 4.33Å; L408-F572 HydrophobicContact CD1-CE1 4.19Å; L408-F572 HydrophobicContact CD1-CG 3.58Å; F572-A574 HydrophobicContact CE2-CB 4.2Å; F572-A574 HydrophobicContact CZ-CB 3.98Å; F572-I579 HydrophobicContact CE1-CD1 4.37Å; F572-I579 HydrophobicContact CZ-CD1 4.29Å; F572-F597 HydrophobicContact CD1-CE2 4.4Å; F572-F597 HydrophobicContact CD1-CZ 4.24Å; F572-S602 PolarHBondContact N-O 3.25Å; F572-F603 HydrophobicContact CB-CD2 4.2Å; F572-F603 AromaticContact CD1-CD2 3.33Å; F572-F603 HydrophobicContact CD1-CD2 3.33Å; F572-F603 AromaticContact CD1-CE2 3.45Å; F572-F603 HydrophobicContact CD1-CE2 3.45Å; F572-F603 VanDerWaalsContact CD1-CE2 3.45Å; F572-F603 HydrophobicContact CD1-CG 4.45Å; F572-F603 AromaticContact CE1-CD2 3.82Å; F572-F603 HydrophobicContact CE1-CD2 3.82Å; F572-F603 AromaticContact CE1-CE2 3.4Å; F572-F603 HydrophobicContact CE1-CE2 3.4Å; F572-F603 HydrophobicContact CE1-CZ 4.34Å; F572-F603 AromaticContact CG-CD2 3.91Å; F572-F603 HydrophobicContact CG-CD2 3.91Å; F572-F603 HydrophobicContact CG-CE2 4.21Å; F572-F603 HydrophobicContact CZ-CE2 4.11Å; F572-F603 WeakPolarHBondContact O-CA 3.42Å; F572-Y604 PolarHBondContact O-N 2.82Å
573	F	97.4	Very high	93.2	Very high	1 Å²	1	18.5 Å²	18.5	0%	0.004	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.7	171.1	-53.8	-90.1	0	0	0	109.8	V394 V395 G396 T571 F575 Y604 I606 L763 E766	V394-F573 PolarHBondContact O-N 3.42Å; V395-F573 CarbonylContact C-O 3.59Å; V395-F573 VanDerWaalsContact CA-O 3.29Å; V395-F573 WeakPolarHBondContact CA-O 3.49Å; V395-F573 HydrophobicContact CG2-CB 4.14Å; V395-F573 HydrophobicContact CG2-CD2 4.04Å; V395-F573 HydrophobicContact CG2-CG 4.49Å; G396-F573 PolarHBondContact N-O 2.67Å; T571-F573 HydrophobicContact CG2-CD1 4.29Å; T571-F573 HydrophobicContact CG2-CD2 3.96Å; T571-F573 HydrophobicContact CG2-CE1 3.83Å; T571-F573 HydrophobicContact CG2-CE2 3.46Å; T571-F573 VanDerWaalsContact CG2-CE2 3.46Å; T571-F573 HydrophobicContact CG2-CG 4.36Å; T571-F573 HydrophobicContact CG2-CZ 3.4Å; F573-F575 HydrophobicContact CB-CE1 4.09Å; F573-Y604 CarbonylContact C-O 3.54Å; F573-Y604 WeakPolarHBondContact CA-O 3.33Å; F573-Y604 AromaticContact CD1-CD2 3.92Å; F573-Y604 HydrophobicContact CD1-CD2 3.92Å; F573-Y604 HydrophobicContact CD1-CG 4.05Å; F573-Y604 AromaticContact CE1-CD2 3.69Å; F573-Y604 HydrophobicContact CE1-CD2 3.69Å; F573-Y604 HydrophobicContact CE1-CE2 4.35Å; F573-Y604 HydrophobicContact CE1-CG 4.13Å; F573-Y604 HydrophobicContact CZ-CD2 4.47Å; F573-I606 HydrophobicContact CD1-CD1 4.09Å; F573-L763 HydrophobicContact CD2-CD1 3.77Å; F573-L763 HydrophobicContact CD2-CG 4.15Å; F573-L763 HydrophobicContact CE1-CB 4.31Å; F573-L763 HydrophobicContact CE1-CG 4.31Å; F573-L763 HydrophobicContact CE2-CD1 3.9Å; F573-L763 HydrophobicContact CE2-CG 3.76Å; F573-L763 HydrophobicContact CG-CD1 4.12Å; F573-L763 HydrophobicContact CZ-CB 4.27Å; F573-L763 HydrophobicContact CZ-CD1 4.37Å; F573-L763 HydrophobicContact CZ-CG 3.85Å; F573-E766 HydrophobicContact CE1-CB 4.28Å; F573-E766 HydrophobicContact CE1-CG 4.4Å; F573-E766 HydrophobicContact CZ-CB 4.1Å; F573-E766 HydrophobicContact CZ-CG 4.09Å
574	A	96.8	Very high	92.9	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	121.2	175.4	0	0	0	0	0	109.2	G396 F572 I579 F603 Y604 I606	G396-A574 CarbonylContact O-C 3.56Å; G396-A574 WeakPolarHBondContact O-CA 3.39Å; F572-A574 HydrophobicContact CE2-CB 4.2Å; F572-A574 HydrophobicContact CZ-CB 3.98Å; A574-I579 HydrophobicContact CB-CD1 4.29Å; A574-F603 HydrophobicContact CB-CE2 3.98Å; A574-F603 HydrophobicContact CB-CZ 4.43Å; A574-Y604 PolarHBondContact N-O 2.61Å; A574-I606 PolarHBondContact O-N 3.3Å
575	F	94.6	Very high	92.4	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	126.3	178.6	-64.3	-10	0	0	0	109.9	M264 F286 V395 G396 H397 S398 F573 S577 I606 Y753 L763	M264-F575 HydrophobicContact CE-CE2 4.38Å; F286-F575 HydrophobicContact CE2-CE2 4.29Å; F286-F575 HydrophobicContact CE2-CZ 4.48Å; F286-F575 HydrophobicContact CZ-CZ 4.42Å; V395-F575 HydrophobicContact CG1-CD1 4.48Å; V395-F575 HydrophobicContact CG1-CD2 3.82Å; V395-F575 HydrophobicContact CG1-CE1 4.28Å; V395-F575 HydrophobicContact CG1-CE2 3.6Å; V395-F575 HydrophobicContact CG1-CG 4.28Å; V395-F575 HydrophobicContact CG1-CZ 3.85Å; G396-F575 PolarHBondContact O-N 2.8Å; H397-F575 WeakPolarHBondContact CA-O 3.18Å; H397-F575 HydrophobicContact CB-CB 4.3Å; S398-F575 PolarHBondContact N-O 2.78Å; F573-F575 HydrophobicContact CB-CE1 4.09Å; F575-S577 PolarHBondContact O-N 3.37Å; F575-I606 WeakPolarHBondContact CA-O 3.23Å; F575-I606 HydrophobicContact CD1-CB 4.05Å; F575-I606 HydrophobicContact CD1-CD1 4.18Å; F575-I606 HydrophobicContact CD1-CG2 4.34Å; F575-I606 HydrophobicContact CE1-CB 4.43Å; F575-I606 HydrophobicContact CE1-CD1 3.77Å; F575-Y753 HydrophobicContact CB-CD1 4.09Å; F575-Y753 HydrophobicContact CB-CD2 4.25Å; F575-Y753 HydrophobicContact CB-CG 3.9Å; F575-Y753 HydrophobicContact CD2-CG 4.43Å; F575-Y753 HydrophobicContact CG-CD1 4.4Å; F575-Y753 HydrophobicContact CG-CG 4.33Å; F575-L763 HydrophobicContact CZ-CD1 4.46Å
576	G	90.6	Very high	91.8	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	58.8	45.1	174.7	0	0	0	0	0	113.5	I606 D611 Y753	G576-I606 PolarHBondContact N-O 3.42Å; G576-D611 WeakPolarHBondContact CA-OD2 3.16Å; G576-Y753 VanDerWaalsContact CA-OH 3.3Å; G576-Y753 WeakPolarHBondContact CA-OH 3.35Å
577	S	91.9	Very high	91.1	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.128	C	C	.	.			trans	-89.3	131.6	-157.4	-174	0	0	0	0	115.4	S401 F575 I579 N605 V613 A614 Y615	S401-S577 WeakPolarHBondContact OG-CB 3.13Å; S401-S577 PolarHBondContact OG-OG 3Å; F575-S577 PolarHBondContact O-N 3.37Å; S577-I579 VanDerWaalsContact C-N 3.3Å; S577-I579 PolarHBondContact O-N 3.31Å; S577-I579 WeakPolarHBondContact OG-CD1 3.46Å; S577-I579 WeakPolarHBondContact OG-CG1 3.29Å; S577-I579 PolarHBondContact OG-N 2.93Å; S577-N605 WeakPolarHBondContact CB-OD1 3.14Å; S577-V613 CarbonylContact C-O 3.4Å; S577-A614 CarbonylContact O-C 3.54Å; S577-A614 WeakPolarHBondContact O-CA 3.43Å; S577-Y615 PolarHBondContact O-N 3.15Å
578	P	92.1	Very high	90.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.129	C	C	.	.			trans	-83.7	5.5	173.2	34.9	-35.8	0	0	0	114.5	L354 S398 G580 M581 F582 V613	L354-P578 HydrophobicContact CD2-CG 4.11Å; S398-P578 WeakPolarHBondContact O-CD 3.4Å; P578-G580 PolarHBondContact O-N 3.15Å; P578-M581 HydrophobicContact CB-CE 4.28Å; P578-M581 PolarHBondContact O-N 2.93Å; P578-M581 VanDerWaalsContact O-N 3.15Å; P578-F582 HydrophobicContact CB-CD2 4.08Å; P578-F582 HydrophobicContact CB-CE2 4.32Å; P578-F582 PolarHBondContact O-N 3.13Å; P578-F582 VanDerWaalsContact O-N 3.09Å; P578-V613 WeakPolarHBondContact CA-O 3.32Å; P578-V613 HydrophobicContact CB-CG1 3.96Å; P578-V613 HydrophobicContact CG-CG1 4.29Å
579	I	92.1	Very high	89.7	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-52.1	-49.2	-172.1	-70.1	160.8	0	0	0	112	L402 F405 F572 A574 S577 M581 F582 L583 F603 I617	L402-I579 HydrophobicContact CB-CG1 4.34Å; L402-I579 HydrophobicContact CD1-CG1 4.23Å; F405-I579 HydrophobicContact CB-CD1 3.69Å; F405-I579 HydrophobicContact CB-CG1 4.04Å; F405-I579 HydrophobicContact CD1-CG2 4.26Å; F405-I579 HydrophobicContact CD2-CD1 3.77Å; F405-I579 HydrophobicContact CD2-CG1 4.37Å; F405-I579 HydrophobicContact CD2-CG2 3.84Å; F405-I579 HydrophobicContact CE1-CG2 4.36Å; F405-I579 HydrophobicContact CE2-CG2 3.92Å; F405-I579 HydrophobicContact CG-CD1 3.94Å; F405-I579 HydrophobicContact CG-CG1 4.21Å; F405-I579 HydrophobicContact CG-CG2 4.02Å; F405-I579 HydrophobicContact CZ-CG2 4.19Å; F572-I579 HydrophobicContact CE1-CD1 4.37Å; F572-I579 HydrophobicContact CZ-CD1 4.29Å; A574-I579 HydrophobicContact CB-CD1 4.29Å; S577-I579 VanDerWaalsContact C-N 3.3Å; S577-I579 PolarHBondContact O-N 3.31Å; S577-I579 WeakPolarHBondContact OG-CD1 3.46Å; S577-I579 WeakPolarHBondContact OG-CG1 3.29Å; S577-I579 PolarHBondContact OG-N 2.93Å; I579-M581 VanDerWaalsContact C-N 3.31Å; I579-M581 PolarHBondContact O-N 2.96Å; I579-F582 PolarHBondContact O-N 2.97Å; I579-F582 VanDerWaalsContact O-N 3.08Å; I579-L583 HydrophobicContact CG2-CD1 3.62Å; I579-L583 HydrophobicContact CG2-CG 3.94Å; I579-L583 WeakPolarHBondContact O-CG 3.27Å; I579-L583 PolarHBondContact O-N 2.82Å; I579-F603 HydrophobicContact CD1-CZ 4.31Å; I579-I617 HydrophobicContact CB-CD1 3.94Å; I579-I617 HydrophobicContact CG2-CD1 3.61Å
580	G	90.3	Very high	89.2	Confident	4 Å²	4	34 Å²	34	4%	0.041	18%	0.176	C	C	.	.	H	α-helix	trans	-60.3	-37.9	-177.1	0	0	0	0	0	113.8	P578 T584	P578-G580 PolarHBondContact O-N 3.15Å; G580-T584 WeakPolarHBondContact O-CB 3.3Å; G580-T584 PolarHBondContact O-N 2.86Å; G580-T584 PolarHBondContact O-OG1 3.03Å
581	M	89.4	Confident	88.8	Confident	53 Å²	53	33 Å²	33	26%	0.261	17%	0.172	S	C	.	.	H	α-helix	trans	-65	-48.1	172.9	179.6	-177	68	0	0	111	L354 P578 I579 T584 V585 Y615	L354-M581 HydrophobicContact CD1-CE 4.1Å; P578-M581 HydrophobicContact CB-CE 4.28Å; P578-M581 PolarHBondContact O-N 2.93Å; P578-M581 VanDerWaalsContact O-N 3.15Å; I579-M581 VanDerWaalsContact C-N 3.31Å; I579-M581 PolarHBondContact O-N 2.96Å; M581-T584 WeakPolarHBondContact O-CB 3.32Å; M581-T584 PolarHBondContact O-N 3.1Å; M581-V585 HydrophobicContact CG-CG2 4.28Å; M581-V585 WeakPolarHBondContact O-CG2 3.16Å; M581-V585 PolarHBondContact O-N 2.75Å; M581-Y615 HydrophobicContact CB-CD1 3.97Å; M581-Y615 HydrophobicContact CB-CD2 3.68Å; M581-Y615 HydrophobicContact CB-CE1 4.05Å; M581-Y615 HydrophobicContact CB-CE2 3.78Å; M581-Y615 HydrophobicContact CB-CG 3.79Å; M581-Y615 HydrophobicContact CE-CE2 4.42Å; M581-Y615 HydrophobicContact CG-CE1 4.5Å; M581-Y615 HydrophobicContact CG-CE2 4.33Å; M581-Y615 HydrophobicContact SD-CE2 3.86Å
582	F	87.6	Confident	88.2	Confident	13 Å²	13	36.3 Å²	36.3	6%	0.057	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-42.7	-177.5	-95.4	-96.1	0	0	0	113.5	L354 N358 L402 P578 I579 T584 V585 R586	L354-F582 HydrophobicContact CB-CE2 4.03Å; L354-F582 HydrophobicContact CB-CZ 3.78Å; L354-F582 HydrophobicContact CD1-CE2 4.13Å; L354-F582 HydrophobicContact CD2-CE2 3.78Å; L354-F582 HydrophobicContact CD2-CZ 4.1Å; L354-F582 HydrophobicContact CG-CE2 4.16Å; L354-F582 HydrophobicContact CG-CZ 4.37Å; N358-F582 HydrophobicContact CB-CE1 4.41Å; L402-F582 HydrophobicContact CD1-CB 3.8Å; L402-F582 HydrophobicContact CD1-CG 4.17Å; L402-F582 HydrophobicContact CD2-CB 4Å; L402-F582 HydrophobicContact CD2-CD1 3.43Å; L402-F582 VanDerWaalsContact CD2-CD1 3.43Å; L402-F582 HydrophobicContact CD2-CD2 3.69Å; L402-F582 HydrophobicContact CD2-CE1 3.69Å; L402-F582 HydrophobicContact CD2-CE2 3.94Å; L402-F582 HydrophobicContact CD2-CG 3.4Å; L402-F582 HydrophobicContact CD2-CZ 3.92Å; L402-F582 HydrophobicContact CG-CG 4.44Å; P578-F582 HydrophobicContact CB-CD2 4.08Å; P578-F582 HydrophobicContact CB-CE2 4.32Å; P578-F582 PolarHBondContact O-N 3.13Å; P578-F582 VanDerWaalsContact O-N 3.09Å; I579-F582 PolarHBondContact O-N 2.97Å; I579-F582 VanDerWaalsContact O-N 3.08Å; F582-T584 VanDerWaalsContact C-N 3.28Å; F582-T584 PolarHBondContact O-N 3.06Å; F582-V585 PolarHBondContact O-N 3.23Å; F582-R586 WeakPolarHBondContact O-CB 3.26Å; F582-R586 VanDerWaalsContact O-CG 3.23Å; F582-R586 WeakPolarHBondContact O-CG 3.34Å; F582-R586 PolarHBondContact O-N 2.92Å
583	L	87.4	Confident	87.6	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.9	-45	173.7	-66.4	179.2	0	0	0	110.5	F405 V544 I579 R586 G587 L588 I591 M620	F405-L583 HydrophobicContact CE1-CD1 4.21Å; F405-L583 HydrophobicContact CE1-CD2 3.79Å; F405-L583 HydrophobicContact CE1-CG 4.48Å; F405-L583 HydrophobicContact CZ-CD1 3.93Å; F405-L583 HydrophobicContact CZ-CD2 4.32Å; V544-L583 HydrophobicContact CG1-CD2 3.48Å; V544-L583 VanDerWaalsContact CG1-CD2 3.48Å; I579-L583 HydrophobicContact CG2-CD1 3.62Å; I579-L583 HydrophobicContact CG2-CG 3.94Å; I579-L583 WeakPolarHBondContact O-CG 3.27Å; I579-L583 PolarHBondContact O-N 2.82Å; L583-R586 PolarHBondContact O-N 2.86Å; L583-G587 PolarHBondContact O-N 3.01Å; L583-L588 HydrophobicContact CB-CB 4.31Å; L583-L588 HydrophobicContact CB-CD2 4.22Å; L583-L588 HydrophobicContact CD1-CD2 4.34Å; L583-L588 HydrophobicContact CD2-CD2 4.04Å; L583-L588 HydrophobicContact CG-CD2 4.43Å; L583-L588 WeakPolarHBondContact O-CA 3.13Å; L583-L588 VanDerWaalsContact O-CB 3.29Å; L583-L588 WeakPolarHBondContact O-CB 3.41Å; L583-L588 PolarHBondContact O-N 2.9Å; L583-I591 HydrophobicContact CD1-CD1 4.07Å; L583-M620 HydrophobicContact CB-CE 3.68Å; L583-M620 HydrophobicContact CB-SD 4.15Å; L583-M620 HydrophobicContact CD1-CE 4.5Å; L583-M620 HydrophobicContact CD1-SD 4.28Å
584	T	86.5	Confident	87.1	Confident	85 Å²	85	45.5 Å²	45.5	52%	0.521	24%	0.243	S	C	.	.	H	α-helix	trans	-63	-45.5	177.2	-56.7	0	0	0	0	112.4	G580 M581 F582 G587	G580-T584 WeakPolarHBondContact O-CB 3.3Å; G580-T584 PolarHBondContact O-N 2.86Å; G580-T584 PolarHBondContact O-OG1 3.03Å; M581-T584 WeakPolarHBondContact O-CB 3.32Å; M581-T584 PolarHBondContact O-N 3.1Å; F582-T584 VanDerWaalsContact C-N 3.28Å; F582-T584 PolarHBondContact O-N 3.06Å; T584-G587 WeakPolarHBondContact O-CA 3.31Å; T584-G587 PolarHBondContact O-N 3.17Å
585	V	84.1	Confident	86.7	Confident	107 Å²	107	47.2 Å²	47.2	65%	0.648	25%	0.249	S	C	*	.	H	α-helix	trans	-65.9	-37.2	179	169.4	0	0	0	0	111.9	M581 F582 G587	M581-V585 HydrophobicContact CG-CG2 4.28Å; M581-V585 WeakPolarHBondContact O-CG2 3.16Å; M581-V585 PolarHBondContact O-N 2.75Å; F582-V585 PolarHBondContact O-N 3.23Å; V585-G587 PolarHBondContact O-N 3.34Å
586	R	83.1	Confident	86.4	Confident	23 Å²	23	50.1 Å²	50.1	9%	0.087	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-2.1	171.9	-67.2	168.5	174.8	176.3	-5.7	113.2	D406 F542 V544 F582 L583	D406-R586 VanDerWaalsContact CG-NH1 3.31Å; D406-R586 IonicContact OD1-CZ 3.67Å; D406-R586 IonicContact OD1-NH1 3.94Å; D406-R586 PolarHBondContact OD1-NH1 2.96Å; D406-R586 IonicContact OD1-NH2 3.69Å; D406-R586 IonicContact OD2-CZ 2.87Å; D406-R586 IonicContact OD2-NH1 2.71Å; D406-R586 PolarHBondContact OD2-NH1 2.69Å; D406-R586 VanDerWaalsContact OD2-NH1 3.11Å; D406-R586 IonicContact OD2-NH2 3.61Å; D406-R586 PolarHBondContact OD2-NH2 2.8Å; F542-R586 HydrophobicContact CB-CB 4.44Å; F542-R586 HydrophobicContact CB-CG 4.25Å; V544-R586 HydrophobicContact CG2-CB 3.6Å; F582-R586 WeakPolarHBondContact O-CB 3.26Å; F582-R586 VanDerWaalsContact O-CG 3.23Å; F582-R586 WeakPolarHBondContact O-CG 3.34Å; F582-R586 PolarHBondContact O-N 2.92Å; L583-R586 PolarHBondContact O-N 2.86Å
587	G	78.3	Confident	86.4	Confident	49 Å²	49	50.5 Å²	50.5	51%	0.505	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.8	1.4	174.3	0	0	0	0	0	115.2	L583 T584 V585 K589	L583-G587 PolarHBondContact O-N 3.01Å; T584-G587 WeakPolarHBondContact O-CA 3.31Å; T584-G587 PolarHBondContact O-N 3.17Å; V585-G587 PolarHBondContact O-N 3.34Å; G587-K589 PolarHBondContact O-N 3.48Å
588	L	81.1	Confident	86.2	Confident	17 Å²	17	52.4 Å²	52.4	9%	0.089	28%	0.284	C	S	.	.			trans	-77.2	102.7	176.6	-170	70.5	0	0	0	109.9	V544 I546 L583 R590 I591 M620	V544-L588 HydrophobicContact CG1-CD2 4.22Å; V544-L588 HydrophobicContact CG2-CB 4.46Å; I546-L588 HydrophobicContact CB-CD2 4.02Å; I546-L588 HydrophobicContact CD1-CD2 4.44Å; I546-L588 HydrophobicContact CG2-CD2 4.1Å; I546-L588 VanDerWaalsContact O-CD1 3.3Å; I546-L588 WeakPolarHBondContact O-CD1 2.95Å; L583-L588 HydrophobicContact CB-CB 4.31Å; L583-L588 HydrophobicContact CB-CD2 4.22Å; L583-L588 HydrophobicContact CD1-CD2 4.34Å; L583-L588 HydrophobicContact CD2-CD2 4.04Å; L583-L588 HydrophobicContact CG-CD2 4.43Å; L583-L588 WeakPolarHBondContact O-CA 3.13Å; L583-L588 VanDerWaalsContact O-CB 3.29Å; L583-L588 WeakPolarHBondContact O-CB 3.41Å; L583-L588 PolarHBondContact O-N 2.9Å; L588-R590 WeakPolarHBondContact CD1-O 3.45Å; L588-I591 HydrophobicContact CD2-CG1 3.97Å; L588-M620 WeakPolarHBondContact O-CE 3.3Å
589	K	78.3	Confident	86.1	Confident	184 Å²	184	53.2 Å²	53.2	80%	0.8	29%	0.289	S	S	*	.			trans	-82	-27.4	-179.3	-66.6	-178.5	179.3	178.8	0	114	G587	G587-K589 PolarHBondContact O-N 3.48Å
590	R	83.9	Confident	86	Confident	153 Å²	153	53.5 Å²	53.5	58%	0.577	29%	0.291	S	S	*	.			trans	-148.9	146.3	177.3	-68.3	-169.3	-66.2	-171.2	2.9	110.2	L588 M620 S623	L588-R590 WeakPolarHBondContact CD1-O 3.45Å; R590-M620 CarbonylContact C-O 3.58Å; R590-M620 WeakPolarHBondContact CA-O 3.34Å; R590-S623 WeakPolarHBondContact CD-OG 3.44Å
591	I	85.6	Confident	86	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.015	32%	0.317	C	S	.	.			trans	-89.6	136.8	168.6	-63.6	168.5	0	0	0	107	I546 L583 L588 P593 Y595 I617 M620 I621 L722	I546-I591 HydrophobicContact CG2-CB 4.42Å; I546-I591 HydrophobicContact CG2-CG1 4.36Å; I546-I591 HydrophobicContact CG2-CG2 3.95Å; L583-I591 HydrophobicContact CD1-CD1 4.07Å; L588-I591 HydrophobicContact CD2-CG1 3.97Å; I591-P593 WeakPolarHBondContact O-CD 3.39Å; I591-Y595 HydrophobicContact CG2-CD1 4.09Å; I591-I617 HydrophobicContact CD1-CG2 3.98Å; I591-M620 HydrophobicContact CD1-CB 4.17Å; I591-M620 HydrophobicContact CG1-CB 4.31Å; I591-M620 PolarHBondContact N-O 3.41Å; I591-I621 HydrophobicContact CB-CG1 3.96Å; I591-I621 HydrophobicContact CD1-CG1 4.15Å; I591-I621 HydrophobicContact CG2-CG1 4.19Å; I591-L722 HydrophobicContact CD1-CD2 4.41Å
592	D	84.6	Confident	86.2	Confident	71 Å²	71	57.6 Å²	57.6	38%	0.38	31%	0.307	S	S	.	.			trans	-63.5	126.6	174.9	-171	-42.3	0	0	0	109.5	N594 Y595	D592-N594 PolarHBondContact O-N 2.74Å; D592-N594 WeakPolarHBondContact OD1-CB 3.48Å; D592-N594 PolarHBondContact OD1-N 2.73Å; D592-N594 PolarHBondContact OD1-ND2 2.6Å; D592-Y595 VanDerWaalsContact O-CB 3.22Å; D592-Y595 WeakPolarHBondContact O-CB 3.14Å; D592-Y595 PolarHBondContact O-N 2.93Å
593	P	85.1	Confident	86.5	Confident	69 Å²	69	57 Å²	57	45%	0.448	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-19.3	177.5	-27	36.3	0	0	0	114.6	I591 G720 M721	I591-P593 WeakPolarHBondContact O-CD 3.39Å; P593-G720 CarbonylContact O-C 3.55Å; P593-G720 WeakPolarHBondContact O-CA 3.36Å; P593-M721 PolarHBondContact O-N 3.19Å
594	N	86.3	Confident	86.9	Confident	125 Å²	125	57.3 Å²	57.3	67%	0.668	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.7	175.4	-53.2	-83.1	0	0	0	113.3	D592	D592-N594 PolarHBondContact O-N 2.74Å; D592-N594 WeakPolarHBondContact OD1-CB 3.48Å; D592-N594 PolarHBondContact OD1-N 2.73Å; D592-N594 PolarHBondContact OD1-ND2 2.6Å
595	Y	87.3	Confident	87.4	Confident	35 Å²	35	53.3 Å²	53.3	14%	0.137	28%	0.281	C	S	.	.			trans	-68.6	136.6	178.6	178.2	-103.3	0	0	0	111	T409 I546 I591 D592 M721 L722	T409-Y595 WeakPolarHBondContact CG2-OH 3.07Å; T409-Y595 PolarHBondContact OG1-OH 3.27Å; I546-Y595 HydrophobicContact CD1-CD1 4.44Å; I546-Y595 HydrophobicContact CD1-CE1 3.82Å; I546-Y595 HydrophobicContact CG1-CD1 4.44Å; I546-Y595 HydrophobicContact CG1-CE1 3.91Å; I546-Y595 HydrophobicContact CG1-CE2 4.12Å; I546-Y595 HydrophobicContact CG2-CD1 3.91Å; I546-Y595 HydrophobicContact CG2-CD2 4.22Å; I546-Y595 HydrophobicContact CG2-CE1 4.23Å; I546-Y595 HydrophobicContact CG2-CG 3.92Å; I591-Y595 HydrophobicContact CG2-CD1 4.09Å; D592-Y595 VanDerWaalsContact O-CB 3.22Å; D592-Y595 WeakPolarHBondContact O-CB 3.14Å; D592-Y595 PolarHBondContact O-N 2.93Å; Y595-M721 CarbonylContact O-C 3.57Å; Y595-M721 VanDerWaalsContact O-C 3.23Å; Y595-L722 HydrophobicContact CD1-CD1 3.86Å; Y595-L722 HydrophobicContact CE1-CD1 3.76Å; Y595-L722 WeakPolarHBondContact O-CA 3.18Å; Y595-L722 PolarHBondContact O-N 3.07Å
596	S	89.3	Confident	87.9	Confident	62 Å²	62	48.2 Å²	48.2	43%	0.434	25%	0.25	S	C	.	.			trans	-142.1	153.3	173.4	47.6	0	0	0	0	108.3	M721	S596-M721 WeakPolarHBondContact CB-O 3.33Å
597	F	90.3	Very high	88.4	Confident	8 Å²	8	48.1 Å²	48.1	4%	0.035	25%	0.25	C	C	.	.			trans	-64.1	138.4	177.7	-71.1	-71.6	0	0	0	110.6	F405 L408 F572 T599 C600 F603 L722	F405-F597 HydrophobicContact CD2-CE1 4.06Å; F405-F597 AromaticContact CD2-CZ 3.64Å; F405-F597 HydrophobicContact CD2-CZ 3.64Å; F405-F597 HydrophobicContact CE2-CE1 4.05Å; F405-F597 AromaticContact CE2-CZ 3.61Å; F405-F597 HydrophobicContact CE2-CZ 3.61Å; F405-F597 HydrophobicContact CG-CZ 4.48Å; F405-F597 HydrophobicContact CZ-CE1 4.48Å; F405-F597 HydrophobicContact CZ-CZ 4.41Å; L408-F597 HydrophobicContact CB-CD1 3.73Å; L408-F597 HydrophobicContact CB-CE1 3.9Å; L408-F597 HydrophobicContact CB-CG 4.44Å; F572-F597 HydrophobicContact CD1-CE2 4.4Å; F572-F597 HydrophobicContact CD1-CZ 4.24Å; F597-T599 PolarHBondContact O-N 3.07Å; F597-C600 HydrophobicContact CB-CB 3.8Å; F597-C600 HydrophobicContact CD2-CB 4.33Å; F597-C600 HydrophobicContact CG-CB 4.26Å; F597-F603 HydrophobicContact CE2-CB 3.88Å; F597-F603 HydrophobicContact CE2-CD1 4.35Å; F597-F603 HydrophobicContact CE2-CD2 4.24Å; F597-F603 AromaticContact CE2-CG 3.89Å; F597-F603 HydrophobicContact CE2-CG 3.89Å; F597-L722 HydrophobicContact CD2-CD1 3.68Å; F597-L722 HydrophobicContact CE2-CD1 3.42Å; F597-L722 VanDerWaalsContact CE2-CD1 3.42Å; F597-L722 HydrophobicContact CE2-CG 4.29Å; F597-L722 HydrophobicContact CG-CD1 4.34Å; F597-L722 HydrophobicContact CZ-CD1 3.89Å
598	P	87.9	Confident	89	Confident	40 Å²	40	46.2 Å²	46.2	26%	0.26	23%	0.227	S	C	.	.	S	Bend	trans	-55.9	-28.3	-179.1	-29.3	34.8	0	0	0	115.6	L408 Q411 N413	L408-P598 WeakPolarHBondContact O-CD 3.04Å; Q411-P598 HydrophobicContact CB-CB 4.49Å; Q411-P598 WeakPolarHBondContact O-CB 3.37Å; Q411-P598 WeakPolarHBondContact O-CG 3.42Å; N413-P598 WeakPolarHBondContact CB-O 3.35Å; N413-P598 PolarHBondContact ND2-O 3.23Å
599	T	89.1	Confident	89.3	Confident	16 Å²	16	48 Å²	48	10%	0.098	24%	0.24	C	C	.	.	S	Bend	trans	-135.1	-2.2	-172.7	57.6	0	0	0	0	114.8	Q411 Y568 F597	Q411-T599 HydrophobicContact CB-CG2 3.67Å; Q411-T599 WeakPolarHBondContact CB-OG1 3.4Å; Y568-T599 HydrophobicContact CD1-CG2 3.46Å; Y568-T599 VanDerWaalsContact CD1-CG2 3.46Å; Y568-T599 HydrophobicContact CE1-CG2 3.44Å; Y568-T599 VanDerWaalsContact CE1-CG2 3.44Å; Y568-T599 HydrophobicContact CG-CG2 4.26Å; F597-T599 PolarHBondContact O-N 3.07Å
600	C	91.3	Very high	89.6	Confident	7 Å²	7	41.1 Å²	41.1	5%	0.047	21%	0.21	C	C	.	.			trans	-119.7	137.9	-178.4	-171.7	0	0	0	0	110.1	L408 P569 E570 F597 S602	L408-C600 HydrophobicContact CD2-CB 4.4Å; P569-C600 VanDerWaalsContact O-CA 3.29Å; P569-C600 WeakPolarHBondContact O-CA 3.4Å; E570-C600 PolarHBondContact O-SG 3.38Å; F597-C600 HydrophobicContact CB-CB 3.8Å; F597-C600 HydrophobicContact CD2-CB 4.33Å; F597-C600 HydrophobicContact CG-CB 4.26Å; C600-S602 PolarHBondContact SG-O 3.27Å
601	K	89.1	Confident	89.8	Confident	137 Å²	137	34.3 Å²	34.3	60%	0.596	19%	0.185	S	C	*	.			trans	-92.7	-35	-174.8	-58.8	176	-170	162.1	0	112.6	E570	E570-K601 HydrophobicContact CG-CD 4.48Å; E570-K601 PolarHBondContact O-N 3.45Å; E570-K601 VanDerWaalsContact O-N 3.13Å; E570-K601 IonicContact OE1-NZ 3.67Å; E570-K601 PolarHBondContact OE1-NZ 3.45Å
602	S	93.4	Very high	89.7	Confident	6 Å²	6	37.2 Å²	37.2	4%	0.042	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	134.7	-162.5	-56.1	0	0	0	0	110.9	E570 T571 F572 C600 N723 R726	E570-S602 PolarHBondContact O-N 3.48Å; T571-S602 WeakPolarHBondContact CA-O 3.27Å; T571-S602 WeakPolarHBondContact OG1-CB 3.43Å; F572-S602 PolarHBondContact N-O 3.25Å; C600-S602 PolarHBondContact SG-O 3.27Å; S602-N723 VanDerWaalsContact CA-OD1 3.27Å; S602-N723 WeakPolarHBondContact CA-OD1 3.35Å; S602-R726 VanDerWaalsContact CB-NH2 3.3Å; S602-R726 PolarHBondContact OG-NH2 3.46Å
603	F	95.5	Very high	89.7	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	127.1	-178.9	178.1	-126.1	0	0	0	112.9	F405 F572 A574 I579 F597 N605 I617 L722 N723 I728	F405-F603 HydrophobicContact CD2-CZ 4.43Å; F572-F603 HydrophobicContact CB-CD2 4.2Å; F572-F603 AromaticContact CD1-CD2 3.33Å; F572-F603 HydrophobicContact CD1-CD2 3.33Å; F572-F603 AromaticContact CD1-CE2 3.45Å; F572-F603 HydrophobicContact CD1-CE2 3.45Å; F572-F603 VanDerWaalsContact CD1-CE2 3.45Å; F572-F603 HydrophobicContact CD1-CG 4.45Å; F572-F603 AromaticContact CE1-CD2 3.82Å; F572-F603 HydrophobicContact CE1-CD2 3.82Å; F572-F603 AromaticContact CE1-CE2 3.4Å; F572-F603 HydrophobicContact CE1-CE2 3.4Å; F572-F603 HydrophobicContact CE1-CZ 4.34Å; F572-F603 AromaticContact CG-CD2 3.91Å; F572-F603 HydrophobicContact CG-CD2 3.91Å; F572-F603 HydrophobicContact CG-CE2 4.21Å; F572-F603 HydrophobicContact CZ-CE2 4.11Å; F572-F603 WeakPolarHBondContact O-CA 3.42Å; A574-F603 HydrophobicContact CB-CE2 3.98Å; A574-F603 HydrophobicContact CB-CZ 4.43Å; I579-F603 HydrophobicContact CD1-CZ 4.31Å; F597-F603 HydrophobicContact CE2-CB 3.88Å; F597-F603 HydrophobicContact CE2-CD1 4.35Å; F597-F603 HydrophobicContact CE2-CD2 4.24Å; F597-F603 AromaticContact CE2-CG 3.89Å; F597-F603 HydrophobicContact CE2-CG 3.89Å; F603-N605 HydrophobicContact CZ-CB 4.34Å; F603-I617 HydrophobicContact CE1-CG1 4.2Å; F603-I617 HydrophobicContact CE1-CG2 4.28Å; F603-I617 HydrophobicContact CZ-CG1 4.46Å; F603-L722 HydrophobicContact CD1-CD2 3.89Å; F603-L722 HydrophobicContact CD1-CG 4Å; F603-L722 HydrophobicContact CE1-CD2 4.24Å; F603-N723 PolarHBondContact N-OD1 3.12Å; F603-N723 VanDerWaalsContact N-OD1 3.1Å; F603-N723 VanDerWaalsContact O-CG 3.3Å; F603-N723 PolarHBondContact O-ND2 3.03Å; F603-N723 VanDerWaalsContact O-ND2 3.1Å; F603-I728 HydrophobicContact CD1-CG2 3.58Å; F603-I728 HydrophobicContact CE1-CG2 3.62Å
604	Y	96	Very high	90	Very high	7 Å²	7	31.7 Å²	31.7	3%	0.027	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	118.5	-176.1	-69.8	-77.2	0	0	0	110.8	T571 F572 F573 A574 R726 Y730 E766	T571-Y604 HydrophobicContact CG2-CD2 3.57Å; T571-Y604 HydrophobicContact CG2-CE2 3.83Å; F572-Y604 PolarHBondContact O-N 2.82Å; F573-Y604 CarbonylContact C-O 3.54Å; F573-Y604 WeakPolarHBondContact CA-O 3.33Å; F573-Y604 AromaticContact CD1-CD2 3.92Å; F573-Y604 HydrophobicContact CD1-CD2 3.92Å; F573-Y604 HydrophobicContact CD1-CG 4.05Å; F573-Y604 AromaticContact CE1-CD2 3.69Å; F573-Y604 HydrophobicContact CE1-CD2 3.69Å; F573-Y604 HydrophobicContact CE1-CE2 4.35Å; F573-Y604 HydrophobicContact CE1-CG 4.13Å; F573-Y604 HydrophobicContact CZ-CD2 4.47Å; A574-Y604 PolarHBondContact N-O 2.61Å; Y604-R726 PolarHBondContact OH-NH1 3.27Å; Y604-R726 PolarHBondContact OH-NH2 3.2Å; Y604-Y730 AromaticContact CD1-CD2 3.83Å; Y604-Y730 HydrophobicContact CD1-CD2 3.83Å; Y604-Y730 AromaticContact CD1-CE2 3.38Å; Y604-Y730 HydrophobicContact CD1-CE2 3.38Å; Y604-Y730 AromaticContact CD1-CZ 3.98Å; Y604-Y730 HydrophobicContact CE1-CD2 4.46Å; Y604-Y730 AromaticContact CE1-CE2 3.6Å; Y604-Y730 HydrophobicContact CE1-CE2 3.6Å; Y604-Y730 AromaticContact CE1-CZ 3.78Å; Y604-E766 HydrophobicContact CD2-CG 4.48Å; Y604-E766 HydrophobicContact CE2-CB 4.46Å; Y604-E766 HydrophobicContact CE2-CG 3.62Å; Y604-E766 PolarHBondContact OH-OE1 3.14Å; Y604-E766 PolarHBondContact OH-OE2 3.33Å
605	N	96.1	Very high	90.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	106.1	172.9	-176.7	39.1	0	0	0	109.3	S577 F603 Y615 I617 I728 D729 Y730	S577-N605 WeakPolarHBondContact CB-OD1 3.14Å; F603-N605 HydrophobicContact CZ-CB 4.34Å; N605-Y615 PolarHBondContact ND2-O 3.3Å; N605-I617 HydrophobicContact CB-CG1 4.27Å; N605-I728 HydrophobicContact CB-CG2 4.09Å; N605-I728 PolarHBondContact N-O 2.95Å; N605-D729 PolarHBondContact ND2-OD1 3.19Å; N605-Y730 PolarHBondContact O-N 3.47Å
606	I	95.5	Very high	90.6	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	125.4	-173.4	-65.9	155.4	0	0	0	109.2	F573 A574 F575 G576 I632 Y730 L732 L762	F573-I606 HydrophobicContact CD1-CD1 4.09Å; A574-I606 PolarHBondContact O-N 3.3Å; F575-I606 WeakPolarHBondContact CA-O 3.23Å; F575-I606 HydrophobicContact CD1-CB 4.05Å; F575-I606 HydrophobicContact CD1-CD1 4.18Å; F575-I606 HydrophobicContact CD1-CG2 4.34Å; F575-I606 HydrophobicContact CE1-CB 4.43Å; F575-I606 HydrophobicContact CE1-CD1 3.77Å; G576-I606 PolarHBondContact N-O 3.42Å; I606-I632 HydrophobicContact CG1-CD1 4.38Å; I606-I632 HydrophobicContact CG2-CD1 3.75Å; I606-Y730 WeakPolarHBondContact CA-O 3.19Å; I606-L732 HydrophobicContact CG2-CG 4.4Å; I606-L762 HydrophobicContact CD1-CD2 3.77Å; I606-L762 HydrophobicContact CG1-CD2 4.01Å
607	Y	93.6	Very high	90.7	Very high	22 Å²	22	28.8 Å²	28.8	9%	0.086	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	160.1	-178.1	60.1	-92	0	0	0	114.3	A614 R616 P629 D729 Y730 V731 L732 Y753	Y607-A614 VanDerWaalsContact CB-CB 3.48Å; Y607-A614 HydrophobicContact CG-CB 4.19Å; Y607-R616 HydrophobicContact CE1-CG 4.05Å; Y607-R616 VanDerWaalsContact OH-CD 3.32Å; Y607-R616 WeakPolarHBondContact OH-CD 3.33Å; Y607-R616 WeakPolarHBondContact OH-CG 3.5Å; Y607-P629 WeakPolarHBondContact OH-CB 3.39Å; Y607-P629 VanDerWaalsContact OH-CG 3.31Å; Y607-P629 WeakPolarHBondContact OH-CG 3.43Å; Y607-D729 HydrophobicContact CE1-CB 3.99Å; Y607-Y730 PolarHBondContact N-O 3.1Å; Y607-V731 HydrophobicContact CD2-CG2 4.17Å; Y607-V731 HydrophobicContact CE2-CB 4.09Å; Y607-V731 HydrophobicContact CE2-CG2 3.84Å; Y607-V731 WeakPolarHBondContact O-CA 3.2Å; Y607-L732 PolarHBondContact O-N 3.2Å; Y607-Y753 WeakPolarHBondContact CA-OH 3.43Å
608	H	90	Very high	90.8	Very high	8 Å²	8	28.4 Å²	28.4	4%	0.037	14%	0.142	C	C	.	.			trans	-92.9	140	169.4	-165.3	-89.6	0	0	0	110.3	Y610 D611 E738 S749 Y753	H608-Y610 AromaticContact CE1-CD2 3.75Å; H608-Y610 PolarHBondContact ND1-N 3.24Å; H608-Y610 PolarHBondContact O-N 3.1Å; H608-D611 HydrophobicContact CB-CB 4.27Å; H608-D611 WeakPolarHBondContact O-CB 3.28Å; H608-D611 PolarHBondContact O-N 2.93Å; H608-E738 IonicContact NE2-OE2 2.72Å; H608-S749 WeakPolarHBondContact ND1-CB 3.44Å; H608-Y753 HydrophobicContact CB-CE1 4.49Å; H608-Y753 PolarHBondContact N-OH 3.36Å
609	P	87	Confident	90.9	Very high	55 Å²	55	29.2 Å²	29.2	36%	0.357	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-29.9	-178.2	-29.6	34.9	0	0	0	116.1	V731 L732 E734	P609-V731 HydrophobicContact CG-CG2 3.58Å; P609-L732 WeakPolarHBondContact CD-O 3.41Å; P609-E734 HydrophobicContact CG-CG 4.08Å
610	Y	85.4	Confident	90.9	Very high	40 Å²	40	29.1 Å²	29.1	16%	0.157	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.2	2.3	-177.9	-55.6	-43.9	0	0	0	114.5	H608 P612 E734 E738 E742 A746 S749	H608-Y610 AromaticContact CE1-CD2 3.75Å; H608-Y610 PolarHBondContact ND1-N 3.24Å; H608-Y610 PolarHBondContact O-N 3.1Å; Y610-P612 VanDerWaalsContact O-CD 3.3Å; Y610-P612 WeakPolarHBondContact O-CD 3.31Å; Y610-E734 HydrophobicContact CE2-CG 4.07Å; Y610-E738 HydrophobicContact CE2-CB 4.32Å; Y610-E742 HydrophobicContact CD1-CB 4.45Å; Y610-E742 HydrophobicContact CD1-CG 4.3Å; Y610-E742 HydrophobicContact CE1-CB 4.47Å; Y610-E742 HydrophobicContact CE1-CG 3.85Å; Y610-A746 WeakPolarHBondContact O-CA 3.3Å; Y610-S749 PolarHBondContact O-OG 2.87Å; Y610-S749 VanDerWaalsContact O-OG 3.1Å
611	D	87.2	Confident	90.6	Very high	10 Å²	10	29.3 Å²	29.3	5%	0.053	15%	0.146	C	C	.	.			trans	-69	115	179	-177.2	-19.7	0	0	0	109.9	G576 H608 V613 A614 S749 H750 Y753	G576-D611 WeakPolarHBondContact CA-OD2 3.16Å; H608-D611 HydrophobicContact CB-CB 4.27Å; H608-D611 WeakPolarHBondContact O-CB 3.28Å; H608-D611 PolarHBondContact O-N 2.93Å; D611-V613 PolarHBondContact O-N 3.2Å; D611-V613 PolarHBondContact OD1-N 3.39Å; D611-A614 HydrophobicContact CB-CB 3.79Å; D611-A614 PolarHBondContact O-N 3.24Å; D611-A614 PolarHBondContact OD1-N 2.83Å; D611-S749 PolarHBondContact N-OG 2.94Å; D611-H750 VanDerWaalsContact CG-ND1 3.28Å; D611-H750 IonicContact OD1-CE1 3.89Å; D611-H750 IonicContact OD1-CG 2.91Å; D611-H750 IonicContact OD1-ND1 3.22Å; D611-H750 PolarHBondContact OD1-ND1 3.18Å; D611-H750 IonicContact OD2-CE1 2.87Å; D611-H750 IonicContact OD2-CG 2.8Å; D611-H750 IonicContact OD2-ND1 2.72Å; D611-H750 PolarHBondContact OD2-ND1 2.77Å; D611-Y753 WeakPolarHBondContact OD2-CE2 3.46Å; D611-Y753 PolarHBondContact OD2-OH 3.38Å
612	P	83.1	Confident	90.4	Very high	63 Å²	63	24.1 Å²	24.1	41%	0.409	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-7.7	-174.4	31.4	-35	0	0	0	113.7	F346 Y610 A746	F346-P612 HydrophobicContact CE1-CG 4.24Å; F346-P612 HydrophobicContact CZ-CG 4.03Å; Y610-P612 VanDerWaalsContact O-CD 3.3Å; Y610-P612 WeakPolarHBondContact O-CD 3.31Å; P612-A746 WeakPolarHBondContact CD-O 3.34Å; P612-A746 HydrophobicContact CG-CB 4.3Å
613	V	85.5	Confident	89.7	Confident	6 Å²	6	26.9 Å²	26.9	4%	0.036	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110	-9.8	-177.6	-174.6	0	0	0	0	111.6	F346 T350 S577 P578 D611 Y615	F346-V613 HydrophobicContact CZ-CG2 4.35Å; T350-V613 HydrophobicContact CG2-CG2 3.8Å; S577-V613 CarbonylContact C-O 3.4Å; P578-V613 WeakPolarHBondContact CA-O 3.32Å; P578-V613 HydrophobicContact CB-CG1 3.96Å; P578-V613 HydrophobicContact CG-CG1 4.29Å; D611-V613 PolarHBondContact O-N 3.2Å; D611-V613 PolarHBondContact OD1-N 3.39Å; V613-Y615 VanDerWaalsContact O-CD2 3.25Å; V613-Y615 WeakPolarHBondContact O-CD2 3.3Å
614	A	90.8	Very high	88.7	Confident	19 Å²	19	35.4 Å²	35.4	16%	0.157	19%	0.185	C	C	.	.			trans	-81.8	130.4	179.2	0	0	0	0	0	113.1	S577 Y607 D611	S577-A614 CarbonylContact O-C 3.54Å; S577-A614 WeakPolarHBondContact O-CA 3.43Å; Y607-A614 VanDerWaalsContact CB-CB 3.48Å; Y607-A614 HydrophobicContact CG-CB 4.19Å; D611-A614 HydrophobicContact CB-CB 3.79Å; D611-A614 PolarHBondContact O-N 3.24Å; D611-A614 PolarHBondContact OD1-N 2.83Å
615	Y	92.8	Very high	87.9	Confident	99 Å²	99	38.8 Å²	38.8	39%	0.388	21%	0.206	S	C	.	.			trans	-128.3	146.8	176.7	-69.5	-96.2	0	0	0	111.7	S577 M581 N605 V613	S577-Y615 PolarHBondContact O-N 3.15Å; M581-Y615 HydrophobicContact CB-CD1 3.97Å; M581-Y615 HydrophobicContact CB-CD2 3.68Å; M581-Y615 HydrophobicContact CB-CE1 4.05Å; M581-Y615 HydrophobicContact CB-CE2 3.78Å; M581-Y615 HydrophobicContact CB-CG 3.79Å; M581-Y615 HydrophobicContact CE-CE2 4.42Å; M581-Y615 HydrophobicContact CG-CE1 4.5Å; M581-Y615 HydrophobicContact CG-CE2 4.33Å; M581-Y615 HydrophobicContact SD-CE2 3.86Å; N605-Y615 PolarHBondContact ND2-O 3.3Å; V613-Y615 VanDerWaalsContact O-CD2 3.25Å; V613-Y615 WeakPolarHBondContact O-CD2 3.3Å
616	R	93.5	Very high	87.1	Confident	61 Å²	61	45.8 Å²	45.8	23%	0.23	24%	0.244	C	C	.	.			trans	-77.3	148.8	179.4	-72.2	-168	64.7	-170.4	3.4	112.9	Y607 E618 P619 L627 D729	Y607-R616 HydrophobicContact CE1-CG 4.05Å; Y607-R616 VanDerWaalsContact OH-CD 3.32Å; Y607-R616 WeakPolarHBondContact OH-CD 3.33Å; Y607-R616 WeakPolarHBondContact OH-CG 3.5Å; R616-E618 IonicContact NH2-OE2 2.9Å; R616-E618 PolarHBondContact NH2-OE2 3.47Å; R616-E618 VanDerWaalsContact NH2-OE2 3.14Å; R616-P619 HydrophobicContact CB-CG 4.18Å; R616-L627 PolarHBondContact NH1-O 2.8Å; R616-L627 PolarHBondContact NH2-O 3.1Å; R616-D729 VanDerWaalsContact CB-OD2 3.27Å; R616-D729 WeakPolarHBondContact CB-OD2 3.43Å; R616-D729 IonicContact CZ-OD2 3.3Å; R616-D729 IonicContact NE-OD2 2.95Å; R616-D729 PolarHBondContact NE-OD2 3.29Å; R616-D729 IonicContact NH2-OD2 2.76Å; R616-D729 PolarHBondContact NH2-OD2 2.93Å
617	I	92.1	Very high	86.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	-108.5	-34.3	178.3	-57.1	-59.8	0	0	0	112.2	I579 I591 F603 N605 P619 M620 I621 L722 I728 D729	I579-I617 HydrophobicContact CB-CD1 3.94Å; I579-I617 HydrophobicContact CG2-CD1 3.61Å; I591-I617 HydrophobicContact CD1-CG2 3.98Å; F603-I617 HydrophobicContact CE1-CG1 4.2Å; F603-I617 HydrophobicContact CE1-CG2 4.28Å; F603-I617 HydrophobicContact CZ-CG1 4.46Å; N605-I617 HydrophobicContact CB-CG1 4.27Å; I617-P619 VanDerWaalsContact C-CD 3.47Å; I617-M620 WeakPolarHBondContact O-CB 3.48Å; I617-M620 PolarHBondContact O-N 3.05Å; I617-I621 HydrophobicContact CG2-CD1 4.26Å; I617-L722 HydrophobicContact CG2-CD2 4.3Å; I617-I728 HydrophobicContact CB-CG2 4.21Å; I617-I728 HydrophobicContact CG2-CG2 4.42Å; I617-D729 PolarHBondContact N-OD1 2.77Å; I617-D729 PolarHBondContact N-OD2 3.28Å
618	E	91.9	Very high	86.1	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-57.7	-39.9	-175.1	-63.2	177.6	154.1	0	0	114.3	R616 M620 I621 V622 M719 R727 I728 D729	R616-E618 IonicContact NH2-OE2 2.9Å; R616-E618 PolarHBondContact NH2-OE2 3.47Å; R616-E618 VanDerWaalsContact NH2-OE2 3.14Å; E618-M620 PolarHBondContact O-N 3.31Å; E618-M620 VanDerWaalsContact O-N 3.13Å; E618-I621 PolarHBondContact O-N 2.89Å; E618-V622 PolarHBondContact O-N 2.81Å; E618-M719 HydrophobicContact CB-CE 3.93Å; E618-M719 VanDerWaalsContact CD-CE 3.49Å; E618-M719 HydrophobicContact CG-CE 3.48Å; E618-M719 VanDerWaalsContact CG-CE 3.48Å; E618-M719 WeakPolarHBondContact OE1-CE 3.26Å; E618-R727 IonicContact OE1-CZ 3.72Å; E618-R727 IonicContact OE1-NE 3.6Å; E618-R727 PolarHBondContact OE1-NE 3.05Å; E618-R727 IonicContact OE1-NH2 3.42Å; E618-R727 PolarHBondContact OE1-NH2 3.36Å; E618-R727 IonicContact OE2-CZ 2.71Å; E618-R727 IonicContact OE2-NE 2.83Å; E618-R727 IonicContact OE2-NH2 3.66Å; E618-R727 PolarHBondContact OE2-NH2 3.32Å; E618-I728 HydrophobicContact CG-CB 3.98Å; E618-I728 PolarHBondContact OE1-N 3.07Å; E618-D729 WeakPolarHBondContact CB-OD2 3.3Å; E618-D729 HydrophobicContact CG-CB 3.92Å; E618-D729 WeakPolarHBondContact CG-OD2 3.18Å; E618-D729 PolarHBondContact N-OD2 3.26Å; E618-D729 PolarHBondContact OE1-N 2.92Å
619	P	90.8	Very high	85.9	Confident	56 Å²	56	54.6 Å²	54.6	36%	0.364	29%	0.29	S	S	.	.	H	α-helix	trans	-62.5	-18.7	176.2	-23.4	35.7	0	0	0	114.3	R616 I617	R616-P619 HydrophobicContact CB-CG 4.18Å; I617-P619 VanDerWaalsContact C-CD 3.47Å
620	M	87.4	Confident	85.9	Confident	15 Å²	15	55.4 Å²	55.4	7%	0.074	29%	0.289	C	S	.	.	H	α-helix	trans	-81.6	-19	174.5	-55.6	-170	72.2	0	0	112.7	L583 L588 R590 I591 I617 E618	L583-M620 HydrophobicContact CB-CE 3.68Å; L583-M620 HydrophobicContact CB-SD 4.15Å; L583-M620 HydrophobicContact CD1-CE 4.5Å; L583-M620 HydrophobicContact CD1-SD 4.28Å; L588-M620 WeakPolarHBondContact O-CE 3.3Å; R590-M620 CarbonylContact C-O 3.58Å; R590-M620 WeakPolarHBondContact CA-O 3.34Å; I591-M620 HydrophobicContact CD1-CB 4.17Å; I591-M620 HydrophobicContact CG1-CB 4.31Å; I591-M620 PolarHBondContact N-O 3.41Å; I617-M620 WeakPolarHBondContact O-CB 3.48Å; I617-M620 PolarHBondContact O-N 3.05Å; E618-M620 PolarHBondContact O-N 3.31Å; E618-M620 VanDerWaalsContact O-N 3.13Å
621	I	86.9	Confident	86	Confident	10 Å²	10	56.2 Å²	56.2	5%	0.051	30%	0.296	C	S	.	.	H	α-helix	trans	-96.2	-53	178	-56.8	167.2	0	0	0	109.4	I591 I617 E618 L722 I728	I591-I621 HydrophobicContact CB-CG1 3.96Å; I591-I621 HydrophobicContact CD1-CG1 4.15Å; I591-I621 HydrophobicContact CG2-CG1 4.19Å; I617-I621 HydrophobicContact CG2-CD1 4.26Å; E618-I621 PolarHBondContact O-N 2.89Å; I621-L722 HydrophobicContact CD1-CB 4.39Å; I621-L722 HydrophobicContact CD1-CD2 4.03Å; I621-I728 HydrophobicContact CD1-CD1 3.49Å; I621-I728 VanDerWaalsContact CD1-CD1 3.49Å
622	V	84.9	Confident	85.9	Confident	29 Å²	29	55.9 Å²	55.9	18%	0.176	29%	0.294	C	S	.	.			trans	-109.3	83.4	-177.7	-174.2	0	0	0	0	108.8	E618 E624 V625 L627	E618-V622 PolarHBondContact O-N 2.81Å; V622-E624 VanDerWaalsContact C-N 3.25Å; V622-E624 PolarHBondContact O-N 3.02Å; V622-V625 HydrophobicContact CG1-CB 4.39Å; V622-V625 HydrophobicContact CG1-CG2 4.5Å; V622-L627 HydrophobicContact CB-CD1 4.47Å
623	S	77.5	Confident	85.8	Confident	64 Å²	64	56.8 Å²	56.8	45%	0.448	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-5.4	-176.4	61.2	0	0	0	0	114.9	R590	R590-S623 WeakPolarHBondContact CD-OG 3.44Å
624	E	75.7	Confident	85.6	Confident	178 Å²	178	58.2 Å²	58.2	83%	0.832	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-17.3	-171.7	-60.2	-171.7	178.9	0	0	113.6	V622	V622-E624 VanDerWaalsContact C-N 3.25Å; V622-E624 PolarHBondContact O-N 3.02Å
625	V	78.9	Confident	84.7	Confident	78 Å²	78	58.1 Å²	58.1	47%	0.473	30%	0.303	S	S	.	.	S	Bend	trans	-130.4	127.2	-178.5	-171.4	0	0	0	0	108.6	V622 L627	V622-V625 HydrophobicContact CG1-CB 4.39Å; V622-V625 HydrophobicContact CG1-CG2 4.5Å; V625-L627 HydrophobicContact CB-CD2 4.07Å; V625-L627 HydrophobicContact CG1-CD2 3.65Å; V625-L627 HydrophobicContact CG1-CG 4.47Å; V625-L627 PolarHBondContact O-N 2.99Å; V625-L627 VanDerWaalsContact O-N 3.17Å
626	D	77.7	Confident	83.7	Confident	147 Å²	147	60.5 Å²	60.5	79%	0.786	32%	0.315	S	S	*	.			trans	-77.8	99.6	169.6	-168.9	12.7	0	0	0	108.9
627	L	83.4	Confident	81.8	Confident	11 Å²	11	59.7 Å²	59.7	6%	0.058	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-84.2	131.9	-179.3	-58.9	179.7	0	0	0	109.8	R616 V622 V625 I717 M719	R616-L627 PolarHBondContact NH1-O 2.8Å; R616-L627 PolarHBondContact NH2-O 3.1Å; V622-L627 HydrophobicContact CB-CD1 4.47Å; V625-L627 HydrophobicContact CB-CD2 4.07Å; V625-L627 HydrophobicContact CG1-CD2 3.65Å; V625-L627 HydrophobicContact CG1-CG 4.47Å; V625-L627 PolarHBondContact O-N 2.99Å; V625-L627 VanDerWaalsContact O-N 3.17Å; L627-I717 HydrophobicContact CD1-CG2 4.23Å; L627-I717 HydrophobicContact CD2-CD1 3.59Å; L627-I717 HydrophobicContact CD2-CG2 4.38Å; L627-M719 HydrophobicContact CD1-CE 3.9Å; L627-M719 HydrophobicContact CD1-SD 3.74Å
628	E	84.9	Confident	80	Confident	167 Å²	167	66.4 Å²	66.4	78%	0.78	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-73.6	136.9	165.5	-67.7	-172.9	159.1	0	0	110.2	R727	E628-R727 PolarHBondContact O-NH1 3.1Å; E628-R727 PolarHBondContact O-NH2 3.45Å
629	P	87	Confident	78	Confident	38 Å²	38	70.3 Å²	70.3	25%	0.247	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-66	155.2	-179.3	30.3	-38	0	0	0	112.5	Y607 L631 D729 V731	Y607-P629 WeakPolarHBondContact OH-CB 3.39Å; Y607-P629 VanDerWaalsContact OH-CG 3.31Å; Y607-P629 WeakPolarHBondContact OH-CG 3.43Å; P629-L631 PolarHBondContact O-N 3.07Å; P629-D729 HydrophobicContact CB-CB 4.1Å; P629-V731 HydrophobicContact CB-CB 4.25Å; P629-V731 HydrophobicContact CB-CG1 4.16Å; P629-V731 HydrophobicContact CG-CB 4.13Å; P629-V731 HydrophobicContact CG-CG1 3.86Å
630	M	87.2	Confident	76.1	Confident	72 Å²	72	70.2 Å²	70.2	36%	0.355	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	114.6	179.7	-76.9	-158.2	69.6	0	0	111.8	I632 R727 D729 Y730 V731	M630-I632 PolarHBondContact O-N 3.34Å; M630-R727 HydrophobicContact CG-CB 3.87Å; M630-R727 HydrophobicContact CG-CG 3.94Å; M630-R727 HydrophobicContact SD-CB 3.43Å; M630-R727 WeakPolarHBondContact SD-CB 3.46Å; M630-R727 HydrophobicContact SD-CG 3.54Å; M630-R727 VanDerWaalsContact SD-CG 3.54Å; M630-D729 PolarHBondContact N-O 3.02Å; M630-Y730 HydrophobicContact CB-CD1 3.57Å; M630-Y730 HydrophobicContact CB-CE1 3.67Å; M630-Y730 HydrophobicContact CB-CG 4.07Å; M630-Y730 HydrophobicContact CE-CE1 4.08Å; M630-Y730 HydrophobicContact CG-CE1 4.24Å; M630-Y730 CarbonylContact O-C 3.57Å; M630-Y730 VanDerWaalsContact O-CA 3.24Å; M630-Y730 WeakPolarHBondContact O-CA 3.28Å; M630-Y730 HydrophobicContact SD-CE1 3.67Å; M630-Y730 PolarHBondContact SD-OH 3.36Å; M630-V731 PolarHBondContact O-N 3.02Å
631	L	87.1	Confident	74.1	Confident	56 Å²	56	75.3 Å²	75.3	29%	0.293	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	123.4	173.1	-171.7	79.8	0	0	0	111	P629 P633 K639 L643 V731 Q733	P629-L631 PolarHBondContact O-N 3.07Å; L631-P633 WeakPolarHBondContact O-CD 3.37Å; L631-K639 HydrophobicContact CD2-CD 4.21Å; L631-K639 HydrophobicContact CD2-CG 4.05Å; L631-L643 HydrophobicContact CD1-CD2 3.81Å; L631-L643 HydrophobicContact CD2-CD2 3.36Å; L631-L643 HydrophobicContact CG-CD2 4.21Å; L631-V731 HydrophobicContact CD1-CG1 4.14Å; L631-Q733 HydrophobicContact CD1-CG 3.87Å; L631-Q733 HydrophobicContact CD2-CG 4.41Å; L631-Q733 HydrophobicContact CG-CG 4.18Å
632	I	85.4	Confident	72.2	Confident	3 Å²	3	78.9 Å²	78.9	2%	0.015	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-70.7	124.4	172.9	-59.8	178.1	0	0	0	108.8	I606 M630 Y730 V731 L732 Q733 D758 L762	I606-I632 HydrophobicContact CG1-CD1 4.38Å; I606-I632 HydrophobicContact CG2-CD1 3.75Å; M630-I632 PolarHBondContact O-N 3.34Å; I632-Y730 HydrophobicContact CG1-CD1 4.25Å; I632-V731 PolarHBondContact N-O 3.16Å; I632-L732 HydrophobicContact CB-CD2 4.47Å; I632-L732 HydrophobicContact CD1-CD2 3.74Å; I632-L732 HydrophobicContact CD1-CG 4.13Å; I632-Q733 PolarHBondContact O-NE2 3.03Å; I632-D758 HydrophobicContact CG2-CB 4.17Å; I632-D758 WeakPolarHBondContact CG2-O 3.32Å; I632-L762 HydrophobicContact CD1-CD2 3.68Å; I632-L762 HydrophobicContact CG1-CD2 3.96Å; I632-L762 HydrophobicContact CG2-CB 4.43Å
633	P	81	Confident	70.4	Confident	83 Å²	83	79 Å²	79	54%	0.539	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-61.3	150.5	174.4	-22.2	34	0	0	0	111.9	L631	L631-P633 WeakPolarHBondContact O-CD 3.37Å
634	H	79.9	Confident	69.2	Low	36 Å²	36	79.8 Å²	79.8	17%	0.167	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-70.4	141.5	173.6	-167.7	-114.9	0	0	0	109.1	K636 G637 R638 R640 Q733 D758	H634-K636 PolarHBondContact O-N 3.03Å; H634-K636 VanDerWaalsContact O-N 3.08Å; H634-G637 PolarHBondContact O-N 3.41Å; H634-R638 WeakPolarHBondContact CB-O 3.34Å; H634-R638 PolarHBondContact N-O 2.97Å; H634-R640 PolarHBondContact CD2-NE 2.85Å; H634-R640 VanDerWaalsContact CD2-NE 3.25Å; H634-R640 PolarHBondContact NE2-NE 3.04Å; H634-Q733 VanDerWaalsContact N-NE2 3.11Å; H634-D758 WeakPolarHBondContact CA-OD1 3.2Å; H634-D758 IonicContact CD2-OD1 3.45Å; H634-D758 PolarHBondContact CD2-OD1 2.93Å; H634-D758 IonicContact CD2-OD2 3.96Å; H634-D758 PolarHBondContact CD2-OD2 2.68Å; H634-D758 IonicContact CG-OD1 3.47Å
635	H	71.8	Confident	68.1	Low	16 Å²	16	76.5 Å²	76.5	7%	0.074	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-39.1	179.6	58.7	-78.3	0	0	0	112.9	L293 H297 G637 E757 D758 L761	L293-H635 HydrophobicContact CD2-CB 4.14Å; H297-H635 PolarHBondContact CE1-O 2.77Å; H297-H635 PolarHBondContact NE2-O 3.49Å; H635-G637 PolarHBondContact O-N 3.39Å; H635-E757 HydrophobicContact CB-CB 4.29Å; H635-E757 IonicContact CD2-OE2 2.78Å; H635-E757 PolarHBondContact CD2-OE2 2.95Å; H635-E757 IonicContact CE1-OE2 3.26Å; H635-E757 IonicContact CG-OE2 3.73Å; H635-E757 IonicContact ND1-OE2 2.75Å; H635-E757 IonicContact NE2-OE2 3.69Å; H635-E757 PolarHBondContact NE2-OE2 3.4Å; H635-E757 VanDerWaalsContact NE2-OE2 3.15Å; H635-D758 IonicContact CE1-OD1 3.14Å; H635-D758 IonicContact CG-OD1 3.35Å; H635-D758 PolarHBondContact N-OD1 3.25Å; H635-D758 IonicContact ND1-OD1 2.7Å; H635-D758 PolarHBondContact ND1-OD1 3.38Å; H635-L761 HydrophobicContact CB-CD2 3.87Å
636	K	71.9	Confident	67	Low	149 Å²	149	76.6 Å²	76.6	65%	0.648	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	15	175.3	-44.9	-164.5	-178.6	-173.1	0	115.8	H634	H634-K636 PolarHBondContact O-N 3.03Å; H634-K636 VanDerWaalsContact O-N 3.08Å
637	G	54.5	Low	65.9	Low	45 Å²	45	72.1 Å²	72.1	46%	0.464	36%	0.356	S	S	.	.	S	Bend	trans	76.5	23.5	169.7	0	0	0	0	0	116.9	H634 H635	H634-G637 PolarHBondContact O-N 3.41Å; H635-G637 PolarHBondContact O-N 3.39Å
638	R	53.8	Low	64.4	Low	140 Å²	140	73.9 Å²	73.9	53%	0.528	37%	0.369	S	S	.	.	S	Bend	trans	-133.5	170.4	173	-62.7	-168.2	-169.8	-178.6	5.7	111.5	H634	H634-R638 WeakPolarHBondContact CB-O 3.34Å; H634-R638 PolarHBondContact N-O 2.97Å
639	K	49.6	Very low	62.8	Low	84 Å²	84	71.7 Å²	71.7	37%	0.365	36%	0.362	S	S	.	.			trans	-74.8	145.6	153.1	-75.4	178.9	170	-175.2	0	107.3	L631 M641 L643 E644 D647	L631-K639 HydrophobicContact CD2-CD 4.21Å; L631-K639 HydrophobicContact CD2-CG 4.05Å; K639-M641 PolarHBondContact O-N 3.02Å; K639-L643 HydrophobicContact CD-CD2 4.39Å; K639-L643 HydrophobicContact CG-CD2 4.46Å; K639-E644 HydrophobicContact CB-CG 3.63Å; K639-E644 HydrophobicContact CD-CG 4.48Å; K639-D647 IonicContact NZ-OD2 3.59Å; K639-D647 PolarHBondContact NZ-OD2 2.87Å
640	R	51.4	Low	61.4	Low	53 Å²	53	73.2 Å²	73.2	20%	0.2	37%	0.371	C	S	.	.			trans	-60.3	134.2	172.6	-72.4	179.8	-171.7	155.6	14.4	108.2	H634 H642 L643 E644 Q733 E734 D758	H634-R640 PolarHBondContact CD2-NE 2.85Å; H634-R640 VanDerWaalsContact CD2-NE 3.25Å; H634-R640 PolarHBondContact NE2-NE 3.04Å; R640-H642 PolarHBondContact O-N 3.34Å; R640-L643 WeakPolarHBondContact O-CA 3.33Å; R640-L643 WeakPolarHBondContact O-CB 3.29Å; R640-L643 PolarHBondContact O-N 3.06Å; R640-E644 PolarHBondContact O-N 3.39Å; R640-Q733 PolarHBondContact NH1-O 3.1Å; R640-E734 PolarHBondContact NH1-O 3.1Å; R640-D758 IonicContact CZ-OD2 2.74Å; R640-D758 IonicContact NH2-OD2 3.92Å; R640-D758 PolarHBondContact NH2-OD2 2.99Å
641	M	45.7	Very low	59.9	Low	123 Å²	123	78.5 Å²	78.5	61%	0.606	39%	0.387	S	S	*	.	H	α-helix	trans	-47.8	-34.3	-171.6	-66.6	-68	-60.3	0	0	114.6	K639 L643 E644 L645	K639-M641 PolarHBondContact O-N 3.02Å; M641-L643 VanDerWaalsContact C-N 3.33Å; M641-L643 PolarHBondContact O-N 3.45Å; M641-E644 PolarHBondContact O-N 3.06Å; M641-L645 WeakPolarHBondContact O-CB 3.48Å; M641-L645 PolarHBondContact O-N 3.2Å
642	H	46.8	Very low	58.1	Low	84 Å²	84	81.8 Å²	81.8	39%	0.389	40%	0.402	S	S	.	.	H	α-helix	trans	-66	-33.1	177.4	-175.7	69.2	0	0	0	113.1	R640 L645 K646 P736	R640-H642 PolarHBondContact O-N 3.34Å; H642-L645 CarbonylContact O-C 3.48Å; H642-L645 WeakPolarHBondContact O-CB 3.16Å; H642-L645 PolarHBondContact O-N 3.31Å; H642-K646 WeakPolarHBondContact O-CB 3.48Å; H642-K646 PolarHBondContact O-N 3.32Å; H642-P736 HydrophobicContact CB-CG 4.24Å
643	L	48	Very low	56.3	Low	32 Å²	32	85 Å²	85	17%	0.168	43%	0.425	C	S	.	.	H	α-helix	trans	-76.4	-33.4	176.5	-165.7	70	0	0	0	111.8	L631 K639 R640 M641 L645 K646 D647 Q733	L631-L643 HydrophobicContact CD1-CD2 3.81Å; L631-L643 HydrophobicContact CD2-CD2 3.36Å; L631-L643 HydrophobicContact CG-CD2 4.21Å; K639-L643 HydrophobicContact CD-CD2 4.39Å; K639-L643 HydrophobicContact CG-CD2 4.46Å; R640-L643 WeakPolarHBondContact O-CA 3.33Å; R640-L643 WeakPolarHBondContact O-CB 3.29Å; R640-L643 PolarHBondContact O-N 3.06Å; M641-L643 VanDerWaalsContact C-N 3.33Å; M641-L643 PolarHBondContact O-N 3.45Å; L643-L645 VanDerWaalsContact C-N 3.29Å; L643-K646 HydrophobicContact CD1-CB 4.47Å; L643-K646 HydrophobicContact CD1-CD 4.13Å; L643-K646 PolarHBondContact O-N 2.87Å; L643-D647 WeakPolarHBondContact O-CB 3.43Å; L643-D647 PolarHBondContact O-N 2.89Å; L643-Q733 HydrophobicContact CD2-CG 4.33Å
644	E	51.4	Low	54.9	Low	81 Å²	81	86.8 Å²	86.8	38%	0.379	43%	0.428	S	S	.	.	H	α-helix	trans	-64.7	-36.8	168.3	-61	-176.3	164.7	0	0	110.9	K639 R640 M641 S648	K639-E644 HydrophobicContact CB-CG 3.63Å; K639-E644 HydrophobicContact CD-CG 4.48Å; R640-E644 PolarHBondContact O-N 3.39Å; M641-E644 PolarHBondContact O-N 3.06Å; E644-S648 WeakPolarHBondContact O-CB 3.23Å; E644-S648 PolarHBondContact O-N 3.47Å; E644-S648 PolarHBondContact O-OG 3.49Å
645	L	53.1	Low	53.6	Low	108 Å²	108	89.8 Å²	89.8	57%	0.565	45%	0.445	S	S	*	.	H	α-helix	trans	-64.7	-44.1	170	-107.8	150.8	0	0	0	112.2	M641 H642 L643 S648 L649	M641-L645 WeakPolarHBondContact O-CB 3.48Å; M641-L645 PolarHBondContact O-N 3.2Å; H642-L645 CarbonylContact O-C 3.48Å; H642-L645 WeakPolarHBondContact O-CB 3.16Å; H642-L645 PolarHBondContact O-N 3.31Å; L643-L645 VanDerWaalsContact C-N 3.29Å; L645-S648 WeakPolarHBondContact CA-OG 3.35Å; L645-S648 PolarHBondContact O-N 3.38Å; L645-S648 PolarHBondContact O-OG 3.08Å; L645-L649 VanDerWaalsContact O-CB 3.29Å; L645-L649 WeakPolarHBondContact O-CB 3.38Å; L645-L649 PolarHBondContact O-N 3.16Å
646	K	55.7	Low	52.6	Low	81 Å²	81	94.6 Å²	94.6	35%	0.352	47%	0.47	S	S	.	.	H	α-helix	trans	-63.5	-42.7	176	-164.1	173.5	-179.6	-179	0	111.1	H642 L643 L649 T650 E734	H642-K646 WeakPolarHBondContact O-CB 3.48Å; H642-K646 PolarHBondContact O-N 3.32Å; L643-K646 HydrophobicContact CD1-CB 4.47Å; L643-K646 HydrophobicContact CD1-CD 4.13Å; L643-K646 PolarHBondContact O-N 2.87Å; K646-L649 PolarHBondContact O-N 3.19Å; K646-T650 WeakPolarHBondContact O-CG2 3.08Å; K646-T650 PolarHBondContact O-N 3.3Å; K646-T650 PolarHBondContact O-OG1 3.24Å; K646-T650 VanDerWaalsContact O-OG1 3.11Å; K646-E734 IonicContact NZ-OE1 2.68Å; K646-E734 IonicContact NZ-OE2 3.98Å; K646-E734 PolarHBondContact NZ-OE2 3.13Å
647	D	53.5	Low	51.5	Low	52 Å²	52	95.9 Å²	95.9	28%	0.278	47%	0.471	S	S	.	.	H	α-helix	trans	-65.5	-37.4	173.3	-77.7	-9.9	0	0	0	112.2	K639 L643 T650 R651	K639-D647 IonicContact NZ-OD2 3.59Å; K639-D647 PolarHBondContact NZ-OD2 2.87Å; L643-D647 WeakPolarHBondContact O-CB 3.43Å; L643-D647 PolarHBondContact O-N 2.89Å; D647-T650 WeakPolarHBondContact CA-OG1 3.34Å; D647-T650 PolarHBondContact O-OG1 3.13Å; D647-T650 VanDerWaalsContact O-OG1 3.12Å; D647-R651 VanDerWaalsContact O-CB 3.3Å; D647-R651 WeakPolarHBondContact O-CB 3.42Å; D647-R651 WeakPolarHBondContact O-CG 3.23Å; D647-R651 PolarHBondContact O-N 3.17Å
648	S	53.6	Low	51.4	Low	49 Å²	49	99 Å²	99	34%	0.343	48%	0.477	S	S	.	.	H	α-helix	trans	-67.5	-38.9	172.6	78	0	0	0	0	111.5	E644 L645 M652	E644-S648 WeakPolarHBondContact O-CB 3.23Å; E644-S648 PolarHBondContact O-N 3.47Å; E644-S648 PolarHBondContact O-OG 3.49Å; L645-S648 WeakPolarHBondContact CA-OG 3.35Å; L645-S648 PolarHBondContact O-N 3.38Å; L645-S648 PolarHBondContact O-OG 3.08Å; S648-M652 VanDerWaalsContact O-CB 3.3Å; S648-M652 WeakPolarHBondContact O-CB 3.29Å; S648-M652 WeakPolarHBondContact O-CG 3.41Å; S648-M652 PolarHBondContact O-N 3.43Å
649	L	51.3	Low	51.3	Low	120 Å²	120	98.2 Å²	98.2	63%	0.628	48%	0.484	S	S	*	.	H	α-helix	trans	-71	-38.3	178.5	-166.9	77.7	0	0	0	111.8	L645 K646 S653	L645-L649 VanDerWaalsContact O-CB 3.29Å; L645-L649 WeakPolarHBondContact O-CB 3.38Å; L645-L649 PolarHBondContact O-N 3.16Å; K646-L649 PolarHBondContact O-N 3.19Å; L649-S653 WeakPolarHBondContact O-CB 3.25Å; L649-S653 PolarHBondContact O-N 2.72Å
650	T	55.8	Low	51.3	Low	70 Å²	70	97.6 Å²	97.6	43%	0.429	49%	0.486	S	S	.	.	H	α-helix	trans	-70.8	-39.2	174.6	53.4	0	0	0	0	111.5	K646 D647 S653 M654	K646-T650 WeakPolarHBondContact O-CG2 3.08Å; K646-T650 PolarHBondContact O-N 3.3Å; K646-T650 PolarHBondContact O-OG1 3.24Å; K646-T650 VanDerWaalsContact O-OG1 3.11Å; D647-T650 WeakPolarHBondContact CA-OG1 3.34Å; D647-T650 PolarHBondContact O-OG1 3.13Å; D647-T650 VanDerWaalsContact O-OG1 3.12Å; T650-S653 PolarHBondContact O-N 3.09Å; T650-M654 WeakPolarHBondContact O-CG 3.3Å; T650-M654 PolarHBondContact O-N 2.71Å
651	R	56.7	Low	51.2	Low	184 Å²	184	100.1 Å²	100.1	69%	0.694	50%	0.504	S	S	*	.	H	α-helix	trans	-61.2	-51.4	170.8	-75.1	173.3	172.9	-169	-4.1	111.8	D647 S653 M654 D655	D647-R651 VanDerWaalsContact O-CB 3.3Å; D647-R651 WeakPolarHBondContact O-CB 3.42Å; D647-R651 WeakPolarHBondContact O-CG 3.23Å; D647-R651 PolarHBondContact O-N 3.17Å; R651-S653 VanDerWaalsContact C-N 3.25Å; R651-S653 PolarHBondContact O-N 3.41Å; R651-M654 PolarHBondContact O-N 2.89Å; R651-M654 VanDerWaalsContact O-N 3.15Å; R651-D655 PolarHBondContact O-N 2.9Å
652	M	49.7	Very low	51.1	Low	125 Å²	125	96.3 Å²	96.3	62%	0.616	50%	0.496	S	S	*	.	H	α-helix	trans	-61.3	-32.6	175.1	-70.7	175.7	80.1	0	0	112.5	S648 L656	S648-M652 VanDerWaalsContact O-CB 3.3Å; S648-M652 WeakPolarHBondContact O-CB 3.29Å; S648-M652 WeakPolarHBondContact O-CG 3.41Å; S648-M652 PolarHBondContact O-N 3.43Å; M652-L656 WeakPolarHBondContact O-CB 3.1Å; M652-L656 PolarHBondContact O-N 2.89Å
653	S	47.8	Very low	51.1	Low	70 Å²	70	96.2 Å²	96.2	49%	0.49	50%	0.504	S	S	.	.	H	α-helix	trans	-71.4	-38.3	174.8	179.5	0	0	0	0	112.5	L649 T650 R651 L656 R657	L649-S653 WeakPolarHBondContact O-CB 3.25Å; L649-S653 PolarHBondContact O-N 2.72Å; T650-S653 PolarHBondContact O-N 3.09Å; R651-S653 VanDerWaalsContact C-N 3.25Å; R651-S653 PolarHBondContact O-N 3.41Å; S653-L656 PolarHBondContact O-N 2.88Å; S653-R657 WeakPolarHBondContact O-CB 3.48Å; S653-R657 PolarHBondContact O-N 3.2Å
654	M	51.7	Low	51	Low	121 Å²	121	99.1 Å²	99.1	60%	0.596	52%	0.519	S	S	*	.	H	α-helix	trans	-64.7	-42.5	172.5	-74.1	174.4	68.7	0	0	111.1	T650 R651 R657 N658	T650-M654 WeakPolarHBondContact O-CG 3.3Å; T650-M654 PolarHBondContact O-N 2.71Å; R651-M654 PolarHBondContact O-N 2.89Å; R651-M654 VanDerWaalsContact O-N 3.15Å; M654-R657 PolarHBondContact O-N 3.31Å; M654-N658 WeakPolarHBondContact O-CB 3.39Å; M654-N658 PolarHBondContact O-N 3.42Å; M654-N658 PolarHBondContact O-ND2 3.47Å
655	D	51.8	Low	50.8	Low	99 Å²	99	104.2 Å²	104.2	53%	0.529	54%	0.535	S	S	.	.	H	α-helix	trans	-65.9	-39.6	174.5	-70.1	-28.2	0	0	0	112.3	R651 N659	R651-D655 PolarHBondContact O-N 2.9Å; D655-N659 WeakPolarHBondContact O-CB 3.47Å; D655-N659 PolarHBondContact O-N 2.78Å; D655-N659 VanDerWaalsContact O-N 3.1Å; D655-N659 PolarHBondContact O-ND2 3.43Å
656	L	51	Low	50.7	Low	117 Å²	117	103.9 Å²	103.9	61%	0.613	54%	0.538	S	S	*	.	H	α-helix	trans	-62.8	-45.7	172	-123.5	91.8	0	0	0	111.3	M652 S653 N658 N659 V660	M652-L656 WeakPolarHBondContact O-CB 3.1Å; M652-L656 PolarHBondContact O-N 2.89Å; S653-L656 PolarHBondContact O-N 2.88Å; L656-N658 VanDerWaalsContact C-N 3.35Å; L656-N658 PolarHBondContact O-N 3.28Å; L656-N659 PolarHBondContact O-N 3.22Å; L656-V660 VanDerWaalsContact O-CB 3.27Å; L656-V660 WeakPolarHBondContact O-CB 3.27Å; L656-V660 WeakPolarHBondContact O-CG2 3.31Å; L656-V660 PolarHBondContact O-N 3.31Å
657	R	47.8	Very low	50.3	Low	176 Å²	176	102.1 Å²	102.1	66%	0.664	54%	0.539	S	S	*	.	H	α-helix	trans	-63.8	-40.7	-178	-174.5	173.6	178.3	-178.8	-1.7	111.4	S653 M654 L661	S653-R657 WeakPolarHBondContact O-CB 3.48Å; S653-R657 PolarHBondContact O-N 3.2Å; M654-R657 PolarHBondContact O-N 3.31Å; R657-L661 HydrophobicContact CG-CD1 3.85Å; R657-L661 WeakPolarHBondContact O-CB 3.22Å; R657-L661 WeakPolarHBondContact O-CD1 3.2Å; R657-L661 VanDerWaalsContact O-CG 3.22Å; R657-L661 WeakPolarHBondContact O-CG 3.36Å; R657-L661 PolarHBondContact O-N 3.23Å; R657-L661 VanDerWaalsContact O-N 3.17Å
658	N	53.5	Low	49.5	Very low	110 Å²	110	109.5 Å²	109.5	59%	0.588	56%	0.562	S	S	*	*	H	α-helix	trans	-65	-42.2	175.5	-71.4	-22.4	0	0	0	112	M654 L656	M654-N658 WeakPolarHBondContact O-CB 3.39Å; M654-N658 PolarHBondContact O-N 3.42Å; M654-N658 PolarHBondContact O-ND2 3.47Å; L656-N658 VanDerWaalsContact C-N 3.35Å; L656-N658 PolarHBondContact O-N 3.28Å
659	N	51.3	Low	49.2	Very low	124 Å²	124	114.1 Å²	114.1	66%	0.663	58%	0.579	S	S	*	*	H	α-helix	trans	-75	-37	179.3	-73.3	-39.4	0	0	0	113.7	D655 L656 S663	D655-N659 WeakPolarHBondContact O-CB 3.47Å; D655-N659 PolarHBondContact O-N 2.78Å; D655-N659 VanDerWaalsContact O-N 3.1Å; D655-N659 PolarHBondContact O-ND2 3.43Å; L656-N659 PolarHBondContact O-N 3.22Å; N659-S663 PolarHBondContact O-N 3.3Å
660	V	50.3	Low	48.9	Very low	70 Å²	70	112.8 Å²	112.8	42%	0.424	58%	0.579	S	S	.	*	H	α-helix	trans	-73.4	-37	-178.4	170.6	0	0	0	0	112	L656 G662 S663 L664	L656-V660 VanDerWaalsContact O-CB 3.27Å; L656-V660 WeakPolarHBondContact O-CB 3.27Å; L656-V660 WeakPolarHBondContact O-CG2 3.31Å; L656-V660 PolarHBondContact O-N 3.31Å; V660-G662 VanDerWaalsContact C-N 3.31Å; V660-G662 PolarHBondContact O-N 3.08Å; V660-S663 PolarHBondContact O-N 3.15Å; V660-L664 HydrophobicContact CG1-CD1 3.64Å; V660-L664 HydrophobicContact CG1-CG 4.19Å; V660-L664 WeakPolarHBondContact O-CG 3.27Å; V660-L664 PolarHBondContact O-N 3.42Å; V660-L664 VanDerWaalsContact O-N 3.12Å
661	L	48.4	Very low	48.1	Very low	107 Å²	107	118 Å²	118	56%	0.56	60%	0.597	S	S	*	*	H	α-helix	trans	-66.4	-29.3	178.3	-73.9	169.9	0	0	0	113.3	R657	R657-L661 HydrophobicContact CG-CD1 3.85Å; R657-L661 WeakPolarHBondContact O-CB 3.22Å; R657-L661 WeakPolarHBondContact O-CD1 3.2Å; R657-L661 VanDerWaalsContact O-CG 3.22Å; R657-L661 WeakPolarHBondContact O-CG 3.36Å; R657-L661 PolarHBondContact O-N 3.23Å; R657-L661 VanDerWaalsContact O-N 3.17Å
662	G	43.3	Very low	47.2	Very low	43 Å²	43	114.9 Å²	114.9	44%	0.443	60%	0.598	S	S	.	*	H	α-helix	trans	-72.6	-41.6	172.8	0	0	0	0	0	113.4	V660 T666	V660-G662 VanDerWaalsContact C-N 3.31Å; V660-G662 PolarHBondContact O-N 3.08Å; G662-T666 PolarHBondContact O-OG1 3.09Å
663	S	48	Very low	46.6	Very low	81 Å²	81	119.8 Å²	119.8	57%	0.566	61%	0.61	S	S	*	*	H	α-helix	trans	-65.6	-49.6	-179.4	-177.7	0	0	0	0	112.4	N659 V660 R665 T666 A667	N659-S663 PolarHBondContact O-N 3.3Å; V660-S663 PolarHBondContact O-N 3.15Å; S663-R665 VanDerWaalsContact C-N 3.32Å; S663-R665 PolarHBondContact O-N 3.24Å; S663-T666 PolarHBondContact O-N 3.37Å; S663-T666 VanDerWaalsContact O-N 3.15Å; S663-A667 PolarHBondContact O-N 2.92Å
664	L	45.2	Very low	45.9	Very low	93 Å²	93	122.8 Å²	122.8	49%	0.487	63%	0.627	S	S	.	*	H	α-helix	trans	-66.2	-32.1	-176.1	-66.8	174.1	0	0	0	113.2	V660 T666 A667 W668	V660-L664 HydrophobicContact CG1-CD1 3.64Å; V660-L664 HydrophobicContact CG1-CG 4.19Å; V660-L664 WeakPolarHBondContact O-CG 3.27Å; V660-L664 PolarHBondContact O-N 3.42Å; V660-L664 VanDerWaalsContact O-N 3.12Å; L664-T666 VanDerWaalsContact C-N 3.26Å; L664-T666 PolarHBondContact O-N 3.43Å; L664-A667 PolarHBondContact O-N 3.29Å; L664-W668 PolarHBondContact O-N 3.22Å
665	R	47.2	Very low	45	Very low	189 Å²	189	123.9 Å²	123.9	71%	0.713	64%	0.641	S	S	*	*	H	α-helix	trans	-65.2	-30.8	176.6	-168.1	171.9	-174	159.1	1.4	112.7	S663	S663-R665 VanDerWaalsContact C-N 3.32Å; S663-R665 PolarHBondContact O-N 3.24Å
666	T	50.9	Low	43.9	Very low	101 Å²	101	123.6 Å²	123.6	62%	0.62	65%	0.652	S	S	*	*	H	α-helix	trans	-76.6	-39.4	177.1	-50	0	0	0	0	110.9	G662 S663 L664 W668 Q669	G662-T666 PolarHBondContact O-OG1 3.09Å; S663-T666 PolarHBondContact O-N 3.37Å; S663-T666 VanDerWaalsContact O-N 3.15Å; L664-T666 VanDerWaalsContact C-N 3.26Å; L664-T666 PolarHBondContact O-N 3.43Å; T666-W668 VanDerWaalsContact C-N 3.34Å; T666-W668 PolarHBondContact O-N 3.33Å; T666-Q669 PolarHBondContact O-N 3.43Å
667	A	47	Very low	42.8	Very low	44 Å²	44	122.9 Å²	122.9	36%	0.364	66%	0.663	S	S	.	*	H	α-helix	trans	-65.8	-31.2	174.9	0	0	0	0	0	113.6	S663 L664 Q669 S670	S663-A667 PolarHBondContact O-N 2.92Å; L664-A667 PolarHBondContact O-N 3.29Å; A667-Q669 VanDerWaalsContact C-N 3.32Å; A667-Q669 PolarHBondContact O-N 3.04Å; A667-S670 PolarHBondContact O-N 3.35Å; A667-S670 PolarHBondContact O-OG 3.04Å
668	W	37.1	Very low	42	Very low	206 Å²	206	122.3 Å²	122.3	78%	0.78	67%	0.672	S	S	*	*	H	α-helix	trans	-73.1	-22.1	177.9	-82.4	43.8	0	0	0	113.5	L664 T666 F671	L664-W668 PolarHBondContact O-N 3.22Å; T666-W668 VanDerWaalsContact C-N 3.34Å; T666-W668 PolarHBondContact O-N 3.33Å; W668-F671 PolarHBondContact O-N 2.74Å
669	Q	47	Very low	41.1	Very low	147 Å²	147	122.5 Å²	122.5	69%	0.687	68%	0.679	S	S	*	*	H	α-helix	trans	-79.1	-17.2	177.2	-70.3	-175.6	-9.1	0	0	113.6	T666 A667	T666-Q669 PolarHBondContact O-N 3.43Å; A667-Q669 VanDerWaalsContact C-N 3.32Å; A667-Q669 PolarHBondContact O-N 3.04Å
670	S	45	Very low	40.4	Very low	91 Å²	91	121.9 Å²	121.9	64%	0.636	68%	0.682	S	S	*	*	H	α-helix	trans	-83	-16.4	171.1	47.2	0	0	0	0	114.2	A667	A667-S670 PolarHBondContact O-N 3.35Å; A667-S670 PolarHBondContact O-OG 3.04Å
671	F	39	Very low	39.2	Very low	181 Å²	181	122.9 Å²	122.9	79%	0.794	70%	0.698	S	S	*	*	S	Bend	trans	-86.1	-1.2	-176.2	-98.8	-86.4	0	0	0	115.2	W668	W668-F671 PolarHBondContact O-N 2.74Å
672	T	37.9	Very low	38.1	Very low	118 Å²	118	127 Å²	127	72%	0.724	71%	0.714	S	S	*	*			trans	-115.4	62.4	-179.7	45.3	0	0	0	0	112.9
673	R	37.9	Very low	37.3	Very low	228 Å²	228	134.4 Å²	134.4	86%	0.86	74%	0.737	S	S	*	*			trans	-122.6	129.3	161.1	-101.1	-177.8	169.1	177	-2.7	110.4
674	P	33.4	Very low	36.2	Very low	132 Å²	132	134.5 Å²	134.5	86%	0.857	75%	0.751	S	S	*	*			trans	-71.1	136.7	-178.7	-15.1	29.6	0	0	0	112.1
675	V	32	Very low	35.2	Very low	145 Å²	145	139.5 Å²	139.5	88%	0.879	77%	0.771	S	S	*	*			trans	-84.8	142.1	173.7	175.6	0	0	0	0	110.3
676	A	29.2	Very low	34.2	Very low	93 Å²	93	134.3 Å²	134.3	77%	0.769	77%	0.769	S	S	*	*			trans	-130	121.8	168.3	0	0	0	0	0	111.4
677	A	27.6	Very low	32.9	Very low	101 Å²	101	135.2 Å²	135.2	84%	0.835	78%	0.775	S	S	*	*			trans	65.3	125.1	163.2	0	0	0	0	0	121
678	L	30.2	Very low	31.9	Very low	164 Å²	164	139.8 Å²	139.8	86%	0.859	79%	0.793	S	S	*	*			trans	-60.6	169	164.1	-77.3	158.8	0	0	0	112.7
679	P	34.6	Very low	31.2	Very low	115 Å²	115	136.7 Å²	136.7	75%	0.747	79%	0.792	S	S	*	*			cis	-147.3	-147.6	41.3	47.1	-23.3	0	0	0	115
680	P	36.6	Very low	30.2	Very low	110 Å²	110	135.1 Å²	135.1	71%	0.714	79%	0.792	S	S	*	*				-130.3	-179.4	-115.8	37.7	-15.2	0	0	0	117.2
681	A	25.7	Very low	29.3	Very low	92 Å²	92	136.7 Å²	136.7	76%	0.76	80%	0.798	S	S	*	*			trans	70.7	157.1	168.3	0	0	0	0	0	115.6
682	E	25	Very low	29.3	Very low	192 Å²	192	133.7 Å²	133.7	90%	0.897	80%	0.797	S	S	*	*			cis	-136.5	179.3	13.2	-74.3	-177.6	143.5	0	0	112.8
683	E	26.1	Very low	28.6	Very low	200 Å²	200	136.3 Å²	136.3	94%	0.935	80%	0.801	S	S	*	*			trans	-77.1	151.7	169.8	-57.8	172.7	142.2	0	0	111.6
684	G	25.3	Very low	28	Very low	82 Å²	82	133.8 Å²	133.8	85%	0.845	80%	0.799	S	S	*	*			trans	177.4	122.4	174.4	0	0	0	0	0	116.3
685	E	25	Very low	27.6	Very low	198 Å²	198	133.5 Å²	133.5	93%	0.925	79%	0.79	S	S	*	*			trans	-71.5	167.7	-173.1	-60.6	171.9	107.1	0	0	117.6
686	A	25.4	Very low	27.3	Very low	80 Å²	80	134.9 Å²	134.9	66%	0.661	79%	0.787	S	S	*	*			trans	94.2	110.4	133.2	0	0	0	0	0	123
687	T	24.2	Very low	27.2	Very low	121 Å²	121	135.5 Å²	135.5	74%	0.742	79%	0.792	S	S	*	*				72.3	140	126.1	59.4	0	0	0	0	123.7
688	N	25.5	Very low	27	Very low	140 Å²	140	134.4 Å²	134.4	75%	0.749	79%	0.79	S	S	*	*			trans	73.6	152.5	157.7	-57.3	-3.6	0	0	0	116.5
689	D	23.1	Very low	26.6	Very low	140 Å²	140	133.2 Å²	133.2	75%	0.749	79%	0.79	S	S	*	*			cis	-150.7	179.9	17.8	-136.3	-38.2	0	0	0	115
690	T	24.9	Very low	26	Very low	115 Å²	115	133.2 Å²	133.2	71%	0.706	79%	0.791	S	S	*	*			trans	-67.2	157.9	-169.7	-53.3	0	0	0	0	116.9
691	T	27.6	Very low	25.3	Very low	124 Å²	124	134.7 Å²	134.7	76%	0.761	80%	0.799	S	S	*	*			trans	-29.5	166.8	164.6	12	0	0	0	0	118.5
692	P	38.8	Very low	25.3	Very low	118 Å²	118	139.7 Å²	139.7	77%	0.766	81%	0.806	S	S	*	*			cis	-150	171.7	47.6	43	-22.4	0	0	0	119
693	Q	23.2	Very low	25.3	Very low	173 Å²	173	135 Å²	135	81%	0.808	80%	0.8	S	S	*	*				170.7	134.5	109.4	-175.4	160.6	-5.9	0	0	112.7
694	E	25	Very low	25.3	Very low	174 Å²	174	134.9 Å²	134.9	81%	0.813	80%	0.799	S	S	*	*			trans	-97	158.5	170	-59.4	175.2	123.9	0	0	111
695	D	24.8	Very low	25.1	Very low	127 Å²	127	136.6 Å²	136.6	68%	0.679	80%	0.797	S	S	*	*			trans	-168.8	111	131.9	-105.5	-34.2	0	0	0	114.9
696	Q	26.3	Very low	25.4	Very low	174 Å²	174	133.1 Å²	133.1	81%	0.813	80%	0.795	S	S	*	*			trans	43.5	113.8	133.3	-63.7	179.2	68.1	0	0	124.6
697	A	26.7	Very low	25.4	Very low	106 Å²	106	133.4 Å²	133.4	88%	0.876	80%	0.797	S	S	*	*				60	128	116.7	0	0	0	0	0	123.5
698	G	23.3	Very low	25.4	Very low	77 Å²	77	132.4 Å²	132.4	79%	0.794	80%	0.795	S	S	*	*			trans	-158.7	148.6	163.9	0	0	0	0	0	111.2
699	V	21.8	Very low	25.4	Very low	140 Å²	140	130.6 Å²	130.6	85%	0.848	80%	0.799	S	S	*	*			trans	-107.9	152.2	-160.7	168.8	0	0	0	0	114.1
700	C	22.6	Very low	25.5	Very low	114 Å²	114	132.5 Å²	132.5	77%	0.77	80%	0.804	S	S	*	*			trans	-0.6	137.8	168.6	-53.4	0	0	0	0	121.4
701	T	21.3	Very low	25.6	Very low	142 Å²	142	135.8 Å²	135.8	87%	0.871	81%	0.811	S	S	*	*			trans	-144.3	124.3	131.6	20	0	0	0	0	109.7
702	E	26.1	Very low	25.7	Very low	197 Å²	197	134.3 Å²	134.3	92%	0.921	81%	0.811	S	S	*	*			trans	-71.7	133.5	164.3	-66.2	171.2	151.8	0	0	108.5
703	A	24.8	Very low	25.3	Very low	92 Å²	92	137.7 Å²	137.7	76%	0.76	82%	0.817	S	S	*	*			trans	-134.3	94.7	171.5	0	0	0	0	0	108.2	C705	A703-C705 PolarHBondContact O-N 3.47Å
704	E	26.2	Very low	26.1	Very low	198 Å²	198	137.3 Å²	137.3	93%	0.925	82%	0.815	S	S	*	*			trans	-58.4	120.2	162.7	-64.3	-177	139.3	0	0	108.1
705	C	21.1	Very low	26.9	Very low	118 Å²	118	133.8 Å²	133.8	80%	0.797	81%	0.807	S	S	*	*			trans	-126.2	94.3	168.5	-158.7	0	0	0	0	108.3	A703 A707	A703-C705 PolarHBondContact O-N 3.47Å; C705-A707 VanDerWaalsContact C-N 3.25Å; C705-A707 PolarHBondContact O-N 3.35Å
706	S	31.6	Very low	28.2	Very low	126 Å²	126	137.1 Å²	137.1	88%	0.881	82%	0.819	S	S	*	*			trans	-69	80.4	172.9	37.1	0	0	0	0	110.4
707	A	24.4	Very low	30	Very low	86 Å²	86	131.7 Å²	131.7	71%	0.711	80%	0.795	S	S	*	*			trans	-87.8	107.7	166	0	0	0	0	0	109	C705 A709	C705-A707 VanDerWaalsContact C-N 3.25Å; C705-A707 PolarHBondContact O-N 3.35Å; A707-A709 PolarHBondContact O-N 3.28Å
708	S	23.6	Very low	31.9	Very low	100 Å²	100	135.3 Å²	135.3	70%	0.699	79%	0.794	S	S	*	*			trans	-49.1	135.5	167.7	40.8	0	0	0	0	110.7	E710	S708-E710 VanDerWaalsContact C-N 3.32Å; S708-E710 PolarHBondContact O-N 3.13Å
709	A	27	Very low	34.3	Very low	101 Å²	101	132 Å²	132	84%	0.835	76%	0.757	S	S	*	*			trans	-65.8	93.3	171.9	0	0	0	0	0	109.4	A707 Q711	A707-A709 PolarHBondContact O-N 3.28Å; A709-Q711 PolarHBondContact O-N 3Å; A709-Q711 VanDerWaalsContact O-N 3.07Å
710	E	24.6	Very low	37.2	Very low	180 Å²	180	125.5 Å²	125.5	84%	0.841	72%	0.719	S	S	*	*			trans	-57.8	113.1	164.2	-70.5	-179.2	168.1	0	0	107.1	S708 A712	S708-E710 VanDerWaalsContact C-N 3.32Å; S708-E710 PolarHBondContact O-N 3.13Å; E710-A712 PolarHBondContact O-N 3.21Å; E710-A712 VanDerWaalsContact O-N 3.09Å
711	Q	26.3	Very low	40.2	Very low	184 Å²	184	124.6 Å²	124.6	86%	0.86	71%	0.705	S	S	*	*			trans	-59.2	115.3	167.3	-70.9	172.9	-25	0	0	106	A709 E713	A709-Q711 PolarHBondContact O-N 3Å; A709-Q711 VanDerWaalsContact O-N 3.07Å; Q711-E713 PolarHBondContact O-N 3.17Å
712	A	30	Very low	43.3	Very low	93 Å²	93	118 Å²	118	77%	0.769	66%	0.664	S	S	*	*			trans	-59.9	108.9	169	0	0	0	0	0	106.9	E710 Q714	E710-A712 PolarHBondContact O-N 3.21Å; E710-A712 VanDerWaalsContact O-N 3.09Å; A712-Q714 PolarHBondContact O-N 2.82Å
713	E	31.6	Very low	46.3	Very low	190 Å²	190	108.7 Å²	108.7	89%	0.888	62%	0.621	S	S	*	*			trans	-55.7	105	176.8	-69.9	-179.7	154	0	0	108	Q711	Q711-E713 PolarHBondContact O-N 3.17Å
714	Q	40	Very low	49.1	Very low	164 Å²	164	106.5 Å²	106.5	77%	0.766	61%	0.607	S	S	*	*			trans	-62.4	135.9	163	-67.8	-173.9	-22.6	0	0	106.2	A712 E716	A712-Q714 PolarHBondContact O-N 2.82Å; Q714-E716 PolarHBondContact O-N 3.32Å
715	P	41.9	Very low	51.8	Low	100 Å²	100	98.9 Å²	98.9	65%	0.649	58%	0.582	S	S	*	*			trans	-55.2	140.2	178.7	23.1	-33	0	0	0	109.7	I717	P715-I717 VanDerWaalsContact C-N 3.28Å; P715-I717 HydrophobicContact CG-CD1 4.15Å; P715-I717 HydrophobicContact CG-CG1 4.25Å; P715-I717 PolarHBondContact O-N 3.23Å
716	E	50.9	Low	55.1	Low	197 Å²	197	97.4 Å²	97.4	92%	0.921	56%	0.56	S	S	*	*			trans	-62.2	93.8	169.7	-80	-174.2	135.7	0	0	108.6	Q714 E718	Q714-E716 PolarHBondContact O-N 3.32Å; E716-E718 PolarHBondContact O-N 3.41Å
717	I	64.3	Low	57.9	Low	61 Å²	61	93.7 Å²	93.7	31%	0.313	53%	0.526	S	S	.	.			trans	-87.2	104.7	172.8	-65.1	151.8	0	0	0	105.7	L627 P715 M719	L627-I717 HydrophobicContact CD1-CG2 4.23Å; L627-I717 HydrophobicContact CD2-CD1 3.59Å; L627-I717 HydrophobicContact CD2-CG2 4.38Å; P715-I717 VanDerWaalsContact C-N 3.28Å; P715-I717 HydrophobicContact CG-CD1 4.15Å; P715-I717 HydrophobicContact CG-CG1 4.25Å; P715-I717 PolarHBondContact O-N 3.23Å; I717-M719 VanDerWaalsContact C-N 3.3Å; I717-M719 HydrophobicContact CG2-SD 3.71Å; I717-M719 PolarHBondContact O-N 3.39Å
718	E	65.9	Low	61.1	Low	181 Å²	181	89.6 Å²	89.6	85%	0.846	49%	0.492	S	S	*	.			trans	-62.4	93.1	170.7	-70.9	-172	155.9	0	0	109.2	E716	E716-E718 PolarHBondContact O-N 3.41Å
719	M	75.1	Confident	64.5	Low	7 Å²	7	84.8 Å²	84.8	3%	0.034	46%	0.459	C	S	.	.			trans	-66.1	146.2	168.4	-54.2	-60.9	-68.5	0	0	108.4	E618 L627 I717 G725 R726	E618-M719 HydrophobicContact CB-CE 3.93Å; E618-M719 VanDerWaalsContact CD-CE 3.49Å; E618-M719 HydrophobicContact CG-CE 3.48Å; E618-M719 VanDerWaalsContact CG-CE 3.48Å; E618-M719 WeakPolarHBondContact OE1-CE 3.26Å; L627-M719 HydrophobicContact CD1-CE 3.9Å; L627-M719 HydrophobicContact CD1-SD 3.74Å; I717-M719 VanDerWaalsContact C-N 3.3Å; I717-M719 HydrophobicContact CG2-SD 3.71Å; I717-M719 PolarHBondContact O-N 3.39Å; M719-G725 VanDerWaalsContact O-CA 3.32Å; M719-G725 WeakPolarHBondContact O-CA 3.41Å; M719-R726 VanDerWaalsContact CB-O 3.31Å; M719-R726 WeakPolarHBondContact CB-O 3.23Å
720	G	81.5	Confident	67.6	Low	4 Å²	4	81.2 Å²	81.2	4%	0.041	42%	0.424	C	S	.	.			trans	-57.9	164.1	-179.2	0	0	0	0	0	113.9	P593 L722 G725	P593-G720 CarbonylContact O-C 3.55Å; P593-G720 WeakPolarHBondContact O-CA 3.36Å; G720-L722 PolarHBondContact O-N 3.22Å; G720-G725 PolarHBondContact O-N 3.33Å
721	M	86.5	Confident	70.8	Confident	96 Å²	96	73.4 Å²	73.4	47%	0.473	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-62.2	-6.3	-178.4	-63.1	-55.6	-61.1	0	0	114.4	P593 Y595 S596 N723 G724	P593-M721 PolarHBondContact O-N 3.19Å; Y595-M721 CarbonylContact O-C 3.57Å; Y595-M721 VanDerWaalsContact O-C 3.23Å; S596-M721 WeakPolarHBondContact CB-O 3.33Å; M721-N723 PolarHBondContact O-N 3.08Å; M721-G724 PolarHBondContact O-N 3.38Å
722	L	86.2	Confident	73.8	Confident	3 Å²	3	64.9 Å²	64.9	2%	0.016	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-59.5	-30.2	178.7	-173.1	60.1	0	0	0	113.4	I591 Y595 F597 F603 I617 I621 G720 I728	I591-L722 HydrophobicContact CD1-CD2 4.41Å; Y595-L722 HydrophobicContact CD1-CD1 3.86Å; Y595-L722 HydrophobicContact CE1-CD1 3.76Å; Y595-L722 WeakPolarHBondContact O-CA 3.18Å; Y595-L722 PolarHBondContact O-N 3.07Å; F597-L722 HydrophobicContact CD2-CD1 3.68Å; F597-L722 HydrophobicContact CE2-CD1 3.42Å; F597-L722 VanDerWaalsContact CE2-CD1 3.42Å; F597-L722 HydrophobicContact CE2-CG 4.29Å; F597-L722 HydrophobicContact CG-CD1 4.34Å; F597-L722 HydrophobicContact CZ-CD1 3.89Å; F603-L722 HydrophobicContact CD1-CD2 3.89Å; F603-L722 HydrophobicContact CD1-CG 4Å; F603-L722 HydrophobicContact CE1-CD2 4.24Å; I617-L722 HydrophobicContact CG2-CD2 4.3Å; I621-L722 HydrophobicContact CD1-CB 4.39Å; I621-L722 HydrophobicContact CD1-CD2 4.03Å; G720-L722 PolarHBondContact O-N 3.22Å; L722-I728 HydrophobicContact CB-CD1 4.07Å; L722-I728 HydrophobicContact CD2-CD1 4.1Å; L722-I728 HydrophobicContact CG-CD1 4.24Å
723	N	89.7	Confident	76.1	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-128	32.3	167.1	-167.1	20.9	0	0	0	111.1	S602 F603 M721 G725 R726 R727 I728	S602-N723 VanDerWaalsContact CA-OD1 3.27Å; S602-N723 WeakPolarHBondContact CA-OD1 3.35Å; F603-N723 PolarHBondContact N-OD1 3.12Å; F603-N723 VanDerWaalsContact N-OD1 3.1Å; F603-N723 VanDerWaalsContact O-CG 3.3Å; F603-N723 PolarHBondContact O-ND2 3.03Å; F603-N723 VanDerWaalsContact O-ND2 3.1Å; M721-N723 PolarHBondContact O-N 3.08Å; N723-G725 PolarHBondContact O-N 3.05Å; N723-R726 HydrophobicContact CB-CB 4.47Å; N723-R726 WeakPolarHBondContact O-CB 3.48Å; N723-R726 PolarHBondContact O-N 3.03Å; N723-R726 PolarHBondContact OD1-NH2 3.19Å; N723-R727 PolarHBondContact ND2-O 3.33Å; N723-I728 HydrophobicContact CB-CD1 4.17Å; N723-I728 HydrophobicContact CB-CG1 3.71Å
724	G	82.7	Confident	77.9	Confident	47 Å²	47	53.6 Å²	53.6	49%	0.485	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	42.3	175.3	0	0	0	0	0	115.3	M721	M721-G724 PolarHBondContact O-N 3.38Å
725	G	83.4	Confident	79.2	Confident	38 Å²	38	50.4 Å²	50.4	39%	0.392	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.5	-11.4	-177.6	0	0	0	0	0	115	M719 G720 N723	M719-G725 VanDerWaalsContact O-CA 3.32Å; M719-G725 WeakPolarHBondContact O-CA 3.41Å; G720-G725 PolarHBondContact O-N 3.33Å; N723-G725 PolarHBondContact O-N 3.05Å
726	R	89	Confident	79.7	Confident	87 Å²	87	48.9 Å²	48.9	33%	0.328	25%	0.254	S	S	.	.	S	Bend	trans	-86.4	157.7	180	-57.4	-174.8	-62.7	175.7	4.6	112.2	S602 Y604 M719 N723 E766	S602-R726 VanDerWaalsContact CB-NH2 3.3Å; S602-R726 PolarHBondContact OG-NH2 3.46Å; Y604-R726 PolarHBondContact OH-NH1 3.27Å; Y604-R726 PolarHBondContact OH-NH2 3.2Å; M719-R726 VanDerWaalsContact CB-O 3.31Å; M719-R726 WeakPolarHBondContact CB-O 3.23Å; N723-R726 HydrophobicContact CB-CB 4.47Å; N723-R726 WeakPolarHBondContact O-CB 3.48Å; N723-R726 PolarHBondContact O-N 3.03Å; N723-R726 PolarHBondContact OD1-NH2 3.19Å; R726-E766 IonicContact CZ-OE1 3.51Å; R726-E766 IonicContact CZ-OE2 2.75Å; R726-E766 IonicContact NH1-OE1 3.51Å; R726-E766 PolarHBondContact NH1-OE1 3.14Å; R726-E766 IonicContact NH1-OE2 3.72Å; R726-E766 PolarHBondContact NH1-OE2 3.49Å; R726-E766 IonicContact NH2-OE1 3.62Å; R726-E766 PolarHBondContact NH2-OE1 3.07Å
727	R	90.6	Very high	80.1	Confident	47 Å²	47	45.4 Å²	45.4	18%	0.177	24%	0.24	C	C	.	.			trans	-60.2	153.4	171.7	-64.1	-64.3	-55.8	-88.9	-1.7	111.5	E618 E628 M630 N723 Y730	E618-R727 IonicContact OE1-CZ 3.72Å; E618-R727 IonicContact OE1-NE 3.6Å; E618-R727 PolarHBondContact OE1-NE 3.05Å; E618-R727 IonicContact OE1-NH2 3.42Å; E618-R727 PolarHBondContact OE1-NH2 3.36Å; E618-R727 IonicContact OE2-CZ 2.71Å; E618-R727 IonicContact OE2-NE 2.83Å; E618-R727 IonicContact OE2-NH2 3.66Å; E618-R727 PolarHBondContact OE2-NH2 3.32Å; E628-R727 PolarHBondContact O-NH1 3.1Å; E628-R727 PolarHBondContact O-NH2 3.45Å; M630-R727 HydrophobicContact CG-CB 3.87Å; M630-R727 HydrophobicContact CG-CG 3.94Å; M630-R727 HydrophobicContact SD-CB 3.43Å; M630-R727 WeakPolarHBondContact SD-CB 3.46Å; M630-R727 HydrophobicContact SD-CG 3.54Å; M630-R727 VanDerWaalsContact SD-CG 3.54Å; N723-R727 PolarHBondContact ND2-O 3.33Å; R727-Y730 HydrophobicContact CB-CE2 4.46Å
728	I	92.4	Very high	79.8	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.228	C	C	.	.			trans	-123.2	-40.7	-172.2	-62.8	173.4	0	0	0	111.7	F603 N605 I617 E618 I621 L722 N723 Y730	F603-I728 HydrophobicContact CD1-CG2 3.58Å; F603-I728 HydrophobicContact CE1-CG2 3.62Å; N605-I728 HydrophobicContact CB-CG2 4.09Å; N605-I728 PolarHBondContact N-O 2.95Å; I617-I728 HydrophobicContact CB-CG2 4.21Å; I617-I728 HydrophobicContact CG2-CG2 4.42Å; E618-I728 HydrophobicContact CG-CB 3.98Å; E618-I728 PolarHBondContact OE1-N 3.07Å; I621-I728 HydrophobicContact CD1-CD1 3.49Å; I621-I728 VanDerWaalsContact CD1-CD1 3.49Å; L722-I728 HydrophobicContact CB-CD1 4.07Å; L722-I728 HydrophobicContact CD2-CD1 4.1Å; L722-I728 HydrophobicContact CG-CD1 4.24Å; N723-I728 HydrophobicContact CB-CD1 4.17Å; N723-I728 HydrophobicContact CB-CG1 3.71Å; I728-Y730 WeakPolarHBondContact O-CD2 3.15Å
729	D	94.1	Very high	79.5	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	116.5	-177.9	-72.2	-28.7	0	0	0	110.4	N605 Y607 R616 I617 E618 P629 M630	N605-D729 PolarHBondContact ND2-OD1 3.19Å; Y607-D729 HydrophobicContact CE1-CB 3.99Å; R616-D729 VanDerWaalsContact CB-OD2 3.27Å; R616-D729 WeakPolarHBondContact CB-OD2 3.43Å; R616-D729 IonicContact CZ-OD2 3.3Å; R616-D729 IonicContact NE-OD2 2.95Å; R616-D729 PolarHBondContact NE-OD2 3.29Å; R616-D729 IonicContact NH2-OD2 2.76Å; R616-D729 PolarHBondContact NH2-OD2 2.93Å; I617-D729 PolarHBondContact N-OD1 2.77Å; I617-D729 PolarHBondContact N-OD2 3.28Å; E618-D729 WeakPolarHBondContact CB-OD2 3.3Å; E618-D729 HydrophobicContact CG-CB 3.92Å; E618-D729 WeakPolarHBondContact CG-OD2 3.18Å; E618-D729 PolarHBondContact N-OD2 3.26Å; E618-D729 PolarHBondContact OE1-N 2.92Å; P629-D729 HydrophobicContact CB-CB 4.1Å; M630-D729 PolarHBondContact N-O 3.02Å
730	Y	93.3	Very high	78.7	Confident	25 Å²	25	44.5 Å²	44.5	10%	0.098	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136	177.9	-71.4	-102.3	0	0	0	110.8	Y604 N605 I606 Y607 M630 I632 R727 I728 L762	Y604-Y730 AromaticContact CD1-CD2 3.83Å; Y604-Y730 HydrophobicContact CD1-CD2 3.83Å; Y604-Y730 AromaticContact CD1-CE2 3.38Å; Y604-Y730 HydrophobicContact CD1-CE2 3.38Å; Y604-Y730 AromaticContact CD1-CZ 3.98Å; Y604-Y730 HydrophobicContact CE1-CD2 4.46Å; Y604-Y730 AromaticContact CE1-CE2 3.6Å; Y604-Y730 HydrophobicContact CE1-CE2 3.6Å; Y604-Y730 AromaticContact CE1-CZ 3.78Å; N605-Y730 PolarHBondContact O-N 3.47Å; I606-Y730 WeakPolarHBondContact CA-O 3.19Å; Y607-Y730 PolarHBondContact N-O 3.1Å; M630-Y730 HydrophobicContact CB-CD1 3.57Å; M630-Y730 HydrophobicContact CB-CE1 3.67Å; M630-Y730 HydrophobicContact CB-CG 4.07Å; M630-Y730 HydrophobicContact CE-CE1 4.08Å; M630-Y730 HydrophobicContact CG-CE1 4.24Å; M630-Y730 CarbonylContact O-C 3.57Å; M630-Y730 VanDerWaalsContact O-CA 3.24Å; M630-Y730 WeakPolarHBondContact O-CA 3.28Å; M630-Y730 HydrophobicContact SD-CE1 3.67Å; M630-Y730 PolarHBondContact SD-OH 3.36Å; I632-Y730 HydrophobicContact CG1-CD1 4.25Å; R727-Y730 HydrophobicContact CB-CE2 4.46Å; I728-Y730 WeakPolarHBondContact O-CD2 3.15Å; Y730-L762 HydrophobicContact CD1-CD2 4.09Å; Y730-L762 HydrophobicContact CG-CD2 4.28Å
731	V	91.7	Very high	77.8	Confident	17 Å²	17	47.7 Å²	47.7	10%	0.103	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.3	-174.3	67.9	0	0	0	0	112	Y607 P609 P629 M630 L631 I632	Y607-V731 HydrophobicContact CD2-CG2 4.17Å; Y607-V731 HydrophobicContact CE2-CB 4.09Å; Y607-V731 HydrophobicContact CE2-CG2 3.84Å; Y607-V731 WeakPolarHBondContact O-CA 3.2Å; P609-V731 HydrophobicContact CG-CG2 3.58Å; P629-V731 HydrophobicContact CB-CB 4.25Å; P629-V731 HydrophobicContact CB-CG1 4.16Å; P629-V731 HydrophobicContact CG-CB 4.13Å; P629-V731 HydrophobicContact CG-CG1 3.86Å; M630-V731 PolarHBondContact O-N 3.02Å; L631-V731 HydrophobicContact CD1-CG1 4.14Å; I632-V731 PolarHBondContact N-O 3.16Å
732	L	88.2	Confident	76.9	Confident	5 Å²	5	48.3 Å²	48.3	3%	0.026	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-72.6	153.3	176	-73.5	171.7	0	0	0	112	I606 Y607 P609 I632 Y753 D758 A759	I606-L732 HydrophobicContact CG2-CG 4.4Å; Y607-L732 PolarHBondContact O-N 3.2Å; P609-L732 WeakPolarHBondContact CD-O 3.41Å; I632-L732 HydrophobicContact CB-CD2 4.47Å; I632-L732 HydrophobicContact CD1-CD2 3.74Å; I632-L732 HydrophobicContact CD1-CG 4.13Å; L732-Y753 HydrophobicContact CD1-CD1 3.77Å; L732-Y753 HydrophobicContact CD1-CE1 3.76Å; L732-D758 HydrophobicContact CD2-CB 4.02Å; L732-A759 HydrophobicContact CD2-CB 4.25Å
733	Q	79.5	Confident	75.7	Confident	7 Å²	7	57.7 Å²	57.7	3%	0.033	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-79.1	130.6	175.2	-67.4	-177.2	44.8	0	0	111.2	L631 I632 H634 R640 L643	L631-Q733 HydrophobicContact CD1-CG 3.87Å; L631-Q733 HydrophobicContact CD2-CG 4.41Å; L631-Q733 HydrophobicContact CG-CG 4.18Å; I632-Q733 PolarHBondContact O-NE2 3.03Å; H634-Q733 VanDerWaalsContact N-NE2 3.11Å; R640-Q733 PolarHBondContact NH1-O 3.1Å; L643-Q733 HydrophobicContact CD2-CG 4.33Å
734	E	69.9	Low	74.2	Confident	39 Å²	39	63.3 Å²	63.3	18%	0.182	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-59.4	147.4	171.4	-62.9	159.3	-170.7	0	0	111	P609 Y610 R640 K646	P609-E734 HydrophobicContact CG-CG 4.08Å; Y610-E734 HydrophobicContact CE2-CG 4.07Å; R640-E734 PolarHBondContact NH1-O 3.1Å; K646-E734 IonicContact NZ-OE1 2.68Å; K646-E734 IonicContact NZ-OE2 3.98Å; K646-E734 PolarHBondContact NZ-OE2 3.13Å
735	K	65.8	Low	73.5	Confident	96 Å²	96	62.5 Å²	62.5	42%	0.417	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-84	147.5	162.6	-58.9	179.1	-161.4	142.9	0	109.4	I737 E738	K735-I737 PolarHBondContact O-N 2.97Å; K735-E738 HydrophobicContact CB-CG 4.09Å; K735-E738 VanDerWaalsContact CB-OE2 3.32Å; K735-E738 WeakPolarHBondContact CB-OE2 3.2Å; K735-E738 VanDerWaalsContact CD-OE1 3.22Å; K735-E738 WeakPolarHBondContact CD-OE1 3.38Å; K735-E738 WeakPolarHBondContact CE-OE1 3.37Å; K735-E738 WeakPolarHBondContact CG-OE2 3.42Å; K735-E738 PolarHBondContact N-OE2 3.41Å; K735-E738 IonicContact NZ-OE1 3.68Å; K735-E738 PolarHBondContact NZ-OE1 3.22Å; K735-E738 WeakPolarHBondContact O-CB 3.31Å; K735-E738 PolarHBondContact O-N 3.3Å
736	P	53.6	Low	72.8	Confident	69 Å²	69	61.7 Å²	61.7	45%	0.448	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-18.5	-177.2	-26.5	35	0	0	0	115.9	H642 S739 F740	H642-P736 HydrophobicContact CB-CG 4.24Å; P736-S739 PolarHBondContact O-OG 3.19Å; P736-F740 WeakPolarHBondContact O-CD2 3.25Å; P736-F740 WeakPolarHBondContact O-CE2 3.3Å
737	I	58.8	Low	71.8	Confident	123 Å²	123	59.8 Å²	59.8	63%	0.631	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-29.4	177.4	-58.5	176.5	0	0	0	111.2	K735 S739 F740 F745	K735-I737 PolarHBondContact O-N 2.97Å; I737-S739 VanDerWaalsContact C-N 3.29Å; I737-S739 PolarHBondContact O-N 3.39Å; I737-F740 PolarHBondContact O-N 3.09Å; I737-F745 HydrophobicContact CG2-CZ 4.05Å; I737-F745 VanDerWaalsContact O-CE2 3.31Å; I737-F745 WeakPolarHBondContact O-CE2 3.46Å
738	E	58.5	Low	71.1	Confident	13 Å²	13	60.6 Å²	60.6	6%	0.061	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-69	-29.7	-175.6	-69	159.8	179.2	0	0	111.5	H608 Y610 K735 F740 F745	H608-E738 IonicContact NE2-OE2 2.72Å; Y610-E738 HydrophobicContact CE2-CB 4.32Å; K735-E738 HydrophobicContact CB-CG 4.09Å; K735-E738 VanDerWaalsContact CB-OE2 3.32Å; K735-E738 WeakPolarHBondContact CB-OE2 3.2Å; K735-E738 VanDerWaalsContact CD-OE1 3.22Å; K735-E738 WeakPolarHBondContact CD-OE1 3.38Å; K735-E738 WeakPolarHBondContact CE-OE1 3.37Å; K735-E738 WeakPolarHBondContact CG-OE2 3.42Å; K735-E738 PolarHBondContact N-OE2 3.41Å; K735-E738 IonicContact NZ-OE1 3.68Å; K735-E738 PolarHBondContact NZ-OE1 3.22Å; K735-E738 WeakPolarHBondContact O-CB 3.31Å; K735-E738 PolarHBondContact O-N 3.3Å; E738-F740 PolarHBondContact O-N 3.44Å; E738-F745 VanDerWaalsContact CA-CD2 3.49Å; E738-F745 HydrophobicContact CB-CB 4.43Å; E738-F745 HydrophobicContact CB-CD2 4.24Å; E738-F745 HydrophobicContact CB-CG 4.2Å; E738-F745 HydrophobicContact CG-CB 4.41Å; E738-F745 HydrophobicContact CG-CD1 4.05Å; E738-F745 HydrophobicContact CG-CD2 4.47Å; E738-F745 HydrophobicContact CG-CE1 4.47Å; E738-F745 HydrophobicContact CG-CG 4.06Å; E738-F745 VanDerWaalsContact O-CD2 3.27Å; E738-F745 WeakPolarHBondContact O-CD2 3.47Å
739	S	58.9	Low	70.5	Confident	39 Å²	39	60.8 Å²	60.8	27%	0.273	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-71.1	-4.7	175.9	58.8	0	0	0	0	115.4	P736 I737	P736-S739 PolarHBondContact O-OG 3.19Å; I737-S739 VanDerWaalsContact C-N 3.29Å; I737-S739 PolarHBondContact O-N 3.39Å
740	F	58.1	Low	70	Confident	178 Å²	178	60.9 Å²	60.9	78%	0.781	30%	0.297	S	S	*	.	G	3₁₀ helix	trans	-91.3	-16.2	178.7	-72.9	-82.8	0	0	0	114.1	P736 I737 E738	P736-F740 WeakPolarHBondContact O-CD2 3.25Å; P736-F740 WeakPolarHBondContact O-CE2 3.3Å; I737-F740 PolarHBondContact O-N 3.09Å; E738-F740 PolarHBondContact O-N 3.44Å
741	N	63.4	Low	69.3	Low	72 Å²	72	61.1 Å²	61.1	39%	0.385	30%	0.3	S	S	.	.			trans	-157.7	81.5	178	-169	-14.7	0	0	0	113.2	Y743 L744 F745	N741-Y743 VanDerWaalsContact C-N 3.27Å; N741-Y743 PolarHBondContact O-N 3.19Å; N741-Y743 VanDerWaalsContact O-N 3.13Å; N741-L744 HydrophobicContact CB-CB 4.01Å; N741-L744 PolarHBondContact O-N 3.02Å; N741-L744 PolarHBondContact OD1-N 2.79Å; N741-F745 HydrophobicContact CB-CD2 4.35Å; N741-F745 HydrophobicContact CB-CE2 4.15Å; N741-F745 WeakPolarHBondContact O-CD2 3.38Å; N741-F745 PolarHBondContact O-N 3.3Å
742	E	66.4	Low	68.9	Low	109 Å²	109	61.4 Å²	61.4	51%	0.509	30%	0.302	S	S	.	.	H	α-helix	trans	-45	-46.2	-177.9	-56.9	173.5	162.7	0	0	113.4	Y610 L744 F745 A746	Y610-E742 HydrophobicContact CD1-CB 4.45Å; Y610-E742 HydrophobicContact CD1-CG 4.3Å; Y610-E742 HydrophobicContact CE1-CB 4.47Å; Y610-E742 HydrophobicContact CE1-CG 3.85Å; E742-L744 PolarHBondContact O-N 2.94Å; E742-F745 PolarHBondContact O-N 3.4Å; E742-A746 PolarHBondContact O-N 3.32Å
743	Y	61	Low	68.9	Low	200 Å²	200	61.2 Å²	61.2	78%	0.784	30%	0.301	S	S	*	.	H	α-helix	trans	-71.9	-28	-177.2	-63.5	-82.6	0	0	0	114.3	N741	N741-Y743 VanDerWaalsContact C-N 3.27Å; N741-Y743 PolarHBondContact O-N 3.19Å; N741-Y743 VanDerWaalsContact O-N 3.13Å
744	L	59.3	Low	69.2	Low	119 Å²	119	60.9 Å²	60.9	62%	0.623	30%	0.3	S	S	*	.	H	α-helix	trans	-75.7	-31.6	176.4	-172.7	66.6	0	0	0	111.3	N741 E742	N741-L744 HydrophobicContact CB-CB 4.01Å; N741-L744 PolarHBondContact O-N 3.02Å; N741-L744 PolarHBondContact OD1-N 2.79Å; E742-L744 PolarHBondContact O-N 2.94Å
745	F	66.8	Low	69.9	Low	30 Å²	30	63.3 Å²	63.3	13%	0.132	31%	0.311	C	S	.	.	H	α-helix	trans	-96.3	-10.2	-175.3	-62.2	-65.7	0	0	0	114.6	I737 E738 N741 E742 I747 Q748 S749	I737-F745 HydrophobicContact CG2-CZ 4.05Å; I737-F745 VanDerWaalsContact O-CE2 3.31Å; I737-F745 WeakPolarHBondContact O-CE2 3.46Å; E738-F745 VanDerWaalsContact CA-CD2 3.49Å; E738-F745 HydrophobicContact CB-CB 4.43Å; E738-F745 HydrophobicContact CB-CD2 4.24Å; E738-F745 HydrophobicContact CB-CG 4.2Å; E738-F745 HydrophobicContact CG-CB 4.41Å; E738-F745 HydrophobicContact CG-CD1 4.05Å; E738-F745 HydrophobicContact CG-CD2 4.47Å; E738-F745 HydrophobicContact CG-CE1 4.47Å; E738-F745 HydrophobicContact CG-CG 4.06Å; E738-F745 VanDerWaalsContact O-CD2 3.27Å; E738-F745 WeakPolarHBondContact O-CD2 3.47Å; N741-F745 HydrophobicContact CB-CD2 4.35Å; N741-F745 HydrophobicContact CB-CE2 4.15Å; N741-F745 WeakPolarHBondContact O-CD2 3.38Å; N741-F745 PolarHBondContact O-N 3.3Å; E742-F745 PolarHBondContact O-N 3.4Å; F745-I747 PolarHBondContact O-N 3.34Å; F745-Q748 CarbonylContact O-C 3.56Å; F745-Q748 WeakPolarHBondContact O-CA 3.31Å; F745-Q748 WeakPolarHBondContact O-CB 3.42Å; F745-Q748 PolarHBondContact O-N 2.86Å; F745-S749 PolarHBondContact O-N 3.26Å; F745-S749 PolarHBondContact O-OG 2.93Å
746	A	68.6	Low	71	Confident	21 Å²	21	59.7 Å²	59.7	17%	0.174	30%	0.298	C	S	.	.	H	α-helix	trans	-51.6	-50.8	178.5	0	0	0	0	0	113.6	Y610 P612 E742 Q748 S749 H750	Y610-A746 WeakPolarHBondContact O-CA 3.3Å; P612-A746 WeakPolarHBondContact CD-O 3.34Å; P612-A746 HydrophobicContact CG-CB 4.3Å; E742-A746 PolarHBondContact O-N 3.32Å; A746-Q748 VanDerWaalsContact C-N 3.33Å; A746-Q748 PolarHBondContact O-N 3.46Å; A746-S749 WeakPolarHBondContact CA-OG 3.49Å; A746-S749 PolarHBondContact O-N 2.93Å; A746-S749 PolarHBondContact O-OG 2.85Å; A746-H750 PolarHBondContact O-N 3.14Å
747	I	69.9	Low	72.8	Confident	47 Å²	47	60.2 Å²	60.2	24%	0.241	29%	0.294	C	S	.	.	H	α-helix	trans	-63	-40.2	177	-60.6	175.6	0	0	0	110.9	L274 L343 F346 F745 S749 H750 L751	L274-I747 HydrophobicContact CD2-CG2 4.16Å; L343-I747 HydrophobicContact CD1-CD1 4.19Å; F346-I747 HydrophobicContact CB-CD1 4.01Å; F346-I747 HydrophobicContact CB-CG1 4.34Å; F346-I747 HydrophobicContact CB-CG2 4.47Å; F346-I747 HydrophobicContact CD1-CD1 4.38Å; F346-I747 HydrophobicContact CD1-CG1 4.04Å; F346-I747 HydrophobicContact CD2-CB 4.39Å; F346-I747 HydrophobicContact CD2-CG1 4.14Å; F346-I747 HydrophobicContact CD2-CG2 3.77Å; F346-I747 HydrophobicContact CE1-CG1 4.41Å; F346-I747 HydrophobicContact CE2-CG1 4.49Å; F346-I747 HydrophobicContact CE2-CG2 4.3Å; F346-I747 HydrophobicContact CG-CD1 4.1Å; F346-I747 HydrophobicContact CG-CG1 3.89Å; F346-I747 HydrophobicContact CG-CG2 4.2Å; F745-I747 PolarHBondContact O-N 3.34Å; I747-S749 VanDerWaalsContact C-N 3.33Å; I747-S749 PolarHBondContact O-N 2.77Å; I747-H750 PolarHBondContact O-N 3.28Å; I747-L751 HydrophobicContact CG2-CD1 4.23Å
748	Q	74.8	Confident	74.3	Confident	64 Å²	64	54.6 Å²	54.6	30%	0.299	27%	0.265	S	S	.	.	H	α-helix	trans	-63.6	-38.9	177.3	170.6	155.2	18.4	0	0	112.2	L274 F745 A746 L751 C752	L274-Q748 HydrophobicContact CD1-CB 3.77Å; L274-Q748 HydrophobicContact CD1-CG 3.62Å; L274-Q748 HydrophobicContact CD2-CB 4.45Å; F745-Q748 CarbonylContact O-C 3.56Å; F745-Q748 WeakPolarHBondContact O-CA 3.31Å; F745-Q748 WeakPolarHBondContact O-CB 3.42Å; F745-Q748 PolarHBondContact O-N 2.86Å; A746-Q748 VanDerWaalsContact C-N 3.33Å; A746-Q748 PolarHBondContact O-N 3.46Å; Q748-L751 PolarHBondContact O-N 2.87Å; Q748-C752 WeakPolarHBondContact O-CB 3.43Å; Q748-C752 PolarHBondContact O-N 3.05Å
749	S	79.9	Confident	75.9	Confident	4 Å²	4	54 Å²	54	3%	0.028	26%	0.262	C	S	.	.	H	α-helix	trans	-72	-26.7	-179.1	54.1	0	0	0	0	114.6	H608 Y610 D611 F745 A746 I747 L751 C752 Y753	H608-S749 WeakPolarHBondContact ND1-CB 3.44Å; Y610-S749 PolarHBondContact O-OG 2.87Å; Y610-S749 VanDerWaalsContact O-OG 3.1Å; D611-S749 PolarHBondContact N-OG 2.94Å; F745-S749 PolarHBondContact O-N 3.26Å; F745-S749 PolarHBondContact O-OG 2.93Å; A746-S749 WeakPolarHBondContact CA-OG 3.49Å; A746-S749 PolarHBondContact O-N 2.93Å; A746-S749 PolarHBondContact O-OG 2.85Å; I747-S749 VanDerWaalsContact C-N 3.33Å; I747-S749 PolarHBondContact O-N 2.77Å; S749-L751 VanDerWaalsContact C-N 3.25Å; S749-L751 PolarHBondContact O-N 2.91Å; S749-C752 PolarHBondContact O-SG 3.31Å; S749-Y753 WeakPolarHBondContact O-CE2 3.27Å
750	H	83.4	Confident	77.6	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.009	25%	0.249	C	C	.	.	H	α-helix	trans	-70.3	-25.1	173.4	-170.4	64	0	0	0	112.9	F346 H397 S398 D611 A746 I747 Y753	F346-H750 HydrophobicContact CE2-CB 4.29Å; H397-H750 AromaticContact CE1-NE2 3.83Å; H397-H750 AromaticContact NE2-NE2 3.85Å; H397-H750 PolarHBondContact NE2-O 2.83Å; S398-H750 VanDerWaalsContact CB-NE2 3.29Å; S398-H750 WeakPolarHBondContact CB-NE2 3.12Å; S398-H750 PolarHBondContact OG-CE1 3.43Å; S398-H750 VanDerWaalsContact OG-CE1 3.31Å; S398-H750 PolarHBondContact OG-NE2 3Å; D611-H750 VanDerWaalsContact CG-ND1 3.28Å; D611-H750 IonicContact OD1-CE1 3.89Å; D611-H750 IonicContact OD1-CG 2.91Å; D611-H750 IonicContact OD1-ND1 3.22Å; D611-H750 PolarHBondContact OD1-ND1 3.18Å; D611-H750 IonicContact OD2-CE1 2.87Å; D611-H750 IonicContact OD2-CG 2.8Å; D611-H750 IonicContact OD2-ND1 2.72Å; D611-H750 PolarHBondContact OD2-ND1 2.77Å; A746-H750 PolarHBondContact O-N 3.14Å; I747-H750 PolarHBondContact O-N 3.28Å; H750-Y753 VanDerWaalsContact O-CD2 3.25Å; H750-Y753 WeakPolarHBondContact O-CD2 3.5Å; H750-Y753 VanDerWaalsContact O-CE2 3.26Å; H750-Y753 WeakPolarHBondContact O-CE2 3.42Å
751	L	79	Confident	79.2	Confident	29 Å²	29	44.3 Å²	44.3	15%	0.152	22%	0.216	C	C	.	.	H	α-helix	trans	-108	-1.1	-169.7	-64.2	174.3	0	0	0	113.4	L274 I747 Q748 S749	L274-L751 HydrophobicContact CD2-CD1 3.95Å; L274-L751 HydrophobicContact CG-CB 4.2Å; L274-L751 HydrophobicContact CG-CD1 4.1Å; I747-L751 HydrophobicContact CG2-CD1 4.23Å; Q748-L751 PolarHBondContact O-N 2.87Å; S749-L751 VanDerWaalsContact C-N 3.25Å; S749-L751 PolarHBondContact O-N 2.91Å
752	C	82.9	Confident	80.5	Confident	24 Å²	24	42.2 Å²	42.2	16%	0.162	20%	0.204	C	C	.	.			trans	-85.4	-10	-173.4	71.8	0	0	0	0	115.1	Q748 S749 W754 E755 S756	Q748-C752 WeakPolarHBondContact O-CB 3.43Å; Q748-C752 PolarHBondContact O-N 3.05Å; S749-C752 PolarHBondContact O-SG 3.31Å; C752-W754 VanDerWaalsContact C-N 3.31Å; C752-W754 PolarHBondContact O-N 3.15Å; C752-E755 PolarHBondContact O-N 3.12Å; C752-S756 PolarHBondContact O-N 2.76Å
753	Y	87.9	Confident	81.9	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-60.3	-36.6	-173.6	-58.6	-77.7	0	0	0	113.6	H397 F575 G576 Y607 H608 D611 L732 S749 H750 E755 S756	H397-Y753 AromaticContact CD2-CD2 3.68Å; H397-Y753 AromaticContact NE2-CD2 3.82Å; F575-Y753 HydrophobicContact CB-CD1 4.09Å; F575-Y753 HydrophobicContact CB-CD2 4.25Å; F575-Y753 HydrophobicContact CB-CG 3.9Å; F575-Y753 HydrophobicContact CD2-CG 4.43Å; F575-Y753 HydrophobicContact CG-CD1 4.4Å; F575-Y753 HydrophobicContact CG-CG 4.33Å; G576-Y753 VanDerWaalsContact CA-OH 3.3Å; G576-Y753 WeakPolarHBondContact CA-OH 3.35Å; Y607-Y753 WeakPolarHBondContact CA-OH 3.43Å; H608-Y753 HydrophobicContact CB-CE1 4.49Å; H608-Y753 PolarHBondContact N-OH 3.36Å; D611-Y753 WeakPolarHBondContact OD2-CE2 3.46Å; D611-Y753 PolarHBondContact OD2-OH 3.38Å; L732-Y753 HydrophobicContact CD1-CD1 3.77Å; L732-Y753 HydrophobicContact CD1-CE1 3.76Å; S749-Y753 WeakPolarHBondContact O-CE2 3.27Å; H750-Y753 VanDerWaalsContact O-CD2 3.25Å; H750-Y753 WeakPolarHBondContact O-CD2 3.5Å; H750-Y753 VanDerWaalsContact O-CE2 3.26Å; H750-Y753 WeakPolarHBondContact O-CE2 3.42Å; Y753-E755 VanDerWaalsContact C-N 3.26Å; Y753-E755 PolarHBondContact O-N 3.02Å; Y753-S756 WeakPolarHBondContact O-CB 3.25Å; Y753-S756 PolarHBondContact O-N 3.16Å
754	W	86.2	Confident	83.4	Confident	1 Å²	1	27.5 Å²	27.5	0%	0.004	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-66.6	-24.1	-179.3	-50.9	108.1	0	0	0	114.1	M264 H266 C272 C282 V283 F286 H397 C752	M264-W754 HydrophobicContact CB-CZ3 4.25Å; M264-W754 HydrophobicContact CE-CE3 4.08Å; M264-W754 HydrophobicContact CE-CZ3 3.66Å; M264-W754 HydrophobicContact SD-CZ3 4.18Å; H266-W754 HydrophobicContact CB-CH2 4.47Å; H266-W754 HydrophobicContact CB-CZ2 4.23Å; C272-W754 VanDerWaalsContact O-CD1 3.3Å; C272-W754 PolarHBondContact O-NE1 3.33Å; C282-W754 HydrophobicContact CB-CB 4Å; C282-W754 HydrophobicContact CB-CD2 3.92Å; C282-W754 HydrophobicContact CB-CE3 4.27Å; C282-W754 HydrophobicContact CB-CG 3.79Å; V283-W754 HydrophobicContact CG2-CE3 4.42Å; V283-W754 HydrophobicContact CG2-CZ3 3.97Å; F286-W754 WeakPolarHBondContact CD2-O 3.4Å; H397-W754 HydrophobicContact CB-CH2 3.9Å; H397-W754 HydrophobicContact CB-CZ2 3.48Å; H397-W754 VanDerWaalsContact CB-CZ2 3.48Å; H397-W754 AromaticContact CG-CZ2 3.64Å; H397-W754 AromaticContact ND1-CZ2 3.74Å; H397-W754 AromaticContact ND1-NE1 4Å; C752-W754 VanDerWaalsContact C-N 3.31Å; C752-W754 PolarHBondContact O-N 3.15Å
755	E	85.1	Confident	85	Confident	90 Å²	90	27.5 Å²	27.5	42%	0.421	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-104	2	180	-61.1	178.2	179.6	0	0	111.9	R275 R277 C752 Y753 E757	R275-E755 IonicContact CZ-OE1 3.77Å; R275-E755 IonicContact NE-OE1 3.24Å; R275-E755 PolarHBondContact NE-OE1 3.12Å; R275-E755 IonicContact NH2-OE1 3.47Å; R275-E755 PolarHBondContact NH2-OE1 3.34Å; R277-E755 IonicContact NH2-OE1 2.66Å; C752-E755 PolarHBondContact O-N 3.12Å; Y753-E755 VanDerWaalsContact C-N 3.26Å; Y753-E755 PolarHBondContact O-N 3.02Å; E755-E757 PolarHBondContact O-N 3.27Å
756	S	88.9	Confident	86.2	Confident	19 Å²	19	26.9 Å²	26.9	13%	0.133	13%	0.132	C	C	.	.			trans	-84.9	99.7	-171.7	-173.2	0	0	0	0	111.7	C752 Y753 D758 A759 A760	C752-S756 PolarHBondContact O-N 2.76Å; Y753-S756 WeakPolarHBondContact O-CB 3.25Å; Y753-S756 PolarHBondContact O-N 3.16Å; S756-D758 PolarHBondContact O-N 2.78Å; S756-A759 PolarHBondContact O-N 2.89Å; S756-A759 PolarHBondContact OG-N 3.28Å; S756-A760 PolarHBondContact O-N 2.74Å
757	E	90.7	Very high	87.4	Confident	81 Å²	81	26 Å²	26	38%	0.379	12%	0.124	S	C	.	.	H	α-helix	trans	-51.9	-36.2	170.9	-60.6	-175.9	-134	0	0	112.1	V289 H635 E755 L761	V289-E757 HydrophobicContact CG1-CB 4.3Å; V289-E757 HydrophobicContact CG1-CG 3.9Å; H635-E757 HydrophobicContact CB-CB 4.29Å; H635-E757 IonicContact CD2-OE2 2.78Å; H635-E757 PolarHBondContact CD2-OE2 2.95Å; H635-E757 IonicContact CE1-OE2 3.26Å; H635-E757 IonicContact CG-OE2 3.73Å; H635-E757 IonicContact ND1-OE2 2.75Å; H635-E757 IonicContact NE2-OE2 3.69Å; H635-E757 PolarHBondContact NE2-OE2 3.4Å; H635-E757 VanDerWaalsContact NE2-OE2 3.15Å; E755-E757 PolarHBondContact O-N 3.27Å; E757-L761 WeakPolarHBondContact O-CB 3.31Å; E757-L761 PolarHBondContact O-N 2.65Å
758	D	90.6	Very high	88.4	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.021	11%	0.113	C	C	.	.	H	α-helix	trans	-68.2	-37.6	179.5	-59.7	-25.4	0	0	0	111.5	I632 H634 H635 R640 L732 S756 L762	I632-D758 HydrophobicContact CG2-CB 4.17Å; I632-D758 WeakPolarHBondContact CG2-O 3.32Å; H634-D758 WeakPolarHBondContact CA-OD1 3.2Å; H634-D758 IonicContact CD2-OD1 3.45Å; H634-D758 PolarHBondContact CD2-OD1 2.93Å; H634-D758 IonicContact CD2-OD2 3.96Å; H634-D758 PolarHBondContact CD2-OD2 2.68Å; H634-D758 IonicContact CG-OD1 3.47Å; H635-D758 IonicContact CE1-OD1 3.14Å; H635-D758 IonicContact CG-OD1 3.35Å; H635-D758 PolarHBondContact N-OD1 3.25Å; H635-D758 IonicContact ND1-OD1 2.7Å; H635-D758 PolarHBondContact ND1-OD1 3.38Å; R640-D758 IonicContact CZ-OD2 2.74Å; R640-D758 IonicContact NH2-OD2 3.92Å; R640-D758 PolarHBondContact NH2-OD2 2.99Å; L732-D758 HydrophobicContact CD2-CB 4.02Å; S756-D758 PolarHBondContact O-N 2.78Å; D758-L762 PolarHBondContact O-N 3.46Å
759	A	91.9	Very high	89.1	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-74.6	-41.6	175.2	0	0	0	0	0	112.2	L732 S756 L761 L762 L763	L732-A759 HydrophobicContact CD2-CB 4.25Å; S756-A759 PolarHBondContact O-N 2.89Å; S756-A759 PolarHBondContact OG-N 3.28Å; A759-L761 VanDerWaalsContact C-N 3.34Å; A759-L761 PolarHBondContact O-N 3.19Å; A759-L762 PolarHBondContact O-N 3.48Å; A759-L763 PolarHBondContact O-N 3.02Å; A759-L763 VanDerWaalsContact O-N 3.08Å
760	A	93.8	Very high	89.4	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.3	-42.4	176.2	0	0	0	0	0	111.5	F286 V289 L293 S756 L763 L764	F286-A760 HydrophobicContact CD2-CB 4.46Å; F286-A760 HydrophobicContact CE1-CB 4.37Å; F286-A760 HydrophobicContact CE2-CB 3.82Å; F286-A760 HydrophobicContact CZ-CB 3.78Å; V289-A760 HydrophobicContact CG1-CB 3.8Å; L293-A760 HydrophobicContact CD1-CB 3.7Å; S756-A760 PolarHBondContact O-N 2.74Å; A760-L763 PolarHBondContact O-N 2.71Å; A760-L764 WeakPolarHBondContact O-CG 3.4Å; A760-L764 PolarHBondContact O-N 3.23Å
761	L	92.1	Very high	89.5	Confident	14 Å²	14	30.8 Å²	30.8	7%	0.073	15%	0.152	C	C	.	.	H	α-helix	trans	-66.9	-37.6	177.8	-168.1	63.6	0	0	0	112.6	L293 H297 H635 E757 A759 L764 R765 F775	L293-L761 HydrophobicContact CB-CD1 4.26Å; L293-L761 HydrophobicContact CD1-CB 4.04Å; L293-L761 HydrophobicContact CD1-CD1 4.45Å; L293-L761 HydrophobicContact CD2-CD1 4.27Å; H297-L761 HydrophobicContact CB-CD1 4.2Å; H635-L761 HydrophobicContact CB-CD2 3.87Å; E757-L761 WeakPolarHBondContact O-CB 3.31Å; E757-L761 PolarHBondContact O-N 2.65Å; A759-L761 VanDerWaalsContact C-N 3.34Å; A759-L761 PolarHBondContact O-N 3.19Å; L761-L764 PolarHBondContact O-N 3.41Å; L761-R765 WeakPolarHBondContact O-CB 3.3Å; L761-R765 PolarHBondContact O-N 2.93Å; L761-F775 HydrophobicContact CD1-CE2 3.97Å; L761-F775 HydrophobicContact CD2-CE2 4.18Å; L761-F775 HydrophobicContact CD2-CZ 4.19Å; L761-F775 HydrophobicContact CG-CE2 4.19Å
762	L	92.1	Very high	89.7	Confident	28 Å²	28	32.7 Å²	32.7	15%	0.147	18%	0.178	C	C	.	.	H	α-helix	trans	-61.8	-44.7	174.4	178.1	64	0	0	0	111.5	I606 I632 Y730 D758 A759 R765 E766	I606-L762 HydrophobicContact CD1-CD2 3.77Å; I606-L762 HydrophobicContact CG1-CD2 4.01Å; I632-L762 HydrophobicContact CD1-CD2 3.68Å; I632-L762 HydrophobicContact CG1-CD2 3.96Å; I632-L762 HydrophobicContact CG2-CB 4.43Å; Y730-L762 HydrophobicContact CD1-CD2 4.09Å; Y730-L762 HydrophobicContact CG-CD2 4.28Å; D758-L762 PolarHBondContact O-N 3.46Å; A759-L762 PolarHBondContact O-N 3.48Å; L762-R765 PolarHBondContact O-N 3.23Å; L762-E766 PolarHBondContact O-N 3.3Å
763	L	94.8	Very high	89.8	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.4	-46.6	177.7	180	150.3	0	0	0	111.5	F286 F312 V395 F573 F575 A759 A760 R765 E766 I767	F286-L763 HydrophobicContact CE1-CD1 4.49Å; F286-L763 HydrophobicContact CZ-CD1 4.33Å; F312-L763 HydrophobicContact CE1-CD2 3.7Å; F312-L763 HydrophobicContact CZ-CD2 3.89Å; V395-L763 HydrophobicContact CG2-CD1 3.6Å; F573-L763 HydrophobicContact CD2-CD1 3.77Å; F573-L763 HydrophobicContact CD2-CG 4.15Å; F573-L763 HydrophobicContact CE1-CB 4.31Å; F573-L763 HydrophobicContact CE1-CG 4.31Å; F573-L763 HydrophobicContact CE2-CD1 3.9Å; F573-L763 HydrophobicContact CE2-CG 3.76Å; F573-L763 HydrophobicContact CG-CD1 4.12Å; F573-L763 HydrophobicContact CZ-CB 4.27Å; F573-L763 HydrophobicContact CZ-CD1 4.37Å; F573-L763 HydrophobicContact CZ-CG 3.85Å; F575-L763 HydrophobicContact CZ-CD1 4.46Å; A759-L763 PolarHBondContact O-N 3.02Å; A759-L763 VanDerWaalsContact O-N 3.08Å; A760-L763 PolarHBondContact O-N 2.71Å; L763-R765 VanDerWaalsContact C-N 3.33Å; L763-R765 PolarHBondContact O-N 3.38Å; L763-E766 PolarHBondContact O-N 2.96Å; L763-I767 HydrophobicContact CD2-CD1 3.59Å; L763-I767 HydrophobicContact CG-CD1 4.31Å; L763-I767 WeakPolarHBondContact O-CG1 3.1Å; L763-I767 PolarHBondContact O-N 3.06Å; L763-I767 VanDerWaalsContact O-N 3.11Å
764	L	93.5	Very high	89.4	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-60.6	-44.2	175.8	-73.3	175.5	0	0	0	111.5	S290 L293 L294 V310 A760 L761 I767 Y768	S290-L764 WeakPolarHBondContact OG-CD2 3.47Å; L293-L764 HydrophobicContact CB-CD1 3.8Å; L293-L764 HydrophobicContact CD1-CD1 4.36Å; L294-L764 HydrophobicContact CD2-CD1 4.25Å; L294-L764 HydrophobicContact CD2-CD2 4.19Å; L294-L764 HydrophobicContact CG-CD1 4.23Å; L294-L764 HydrophobicContact CG-CD2 4.45Å; V310-L764 HydrophobicContact CB-CD2 4.28Å; V310-L764 HydrophobicContact CG2-CD2 3.74Å; A760-L764 WeakPolarHBondContact O-CG 3.4Å; A760-L764 PolarHBondContact O-N 3.23Å; L761-L764 PolarHBondContact O-N 3.41Å; L764-I767 PolarHBondContact O-N 3.44Å; L764-Y768 HydrophobicContact CD2-CD2 4.49Å; L764-Y768 HydrophobicContact CD2-CE2 4.01Å; L764-Y768 VanDerWaalsContact O-CD2 3.28Å; L764-Y768 WeakPolarHBondContact O-CD2 3.2Å; L764-Y768 PolarHBondContact O-N 3.32Å
765	R	91.7	Very high	89.2	Confident	118 Å²	118	39.2 Å²	39.2	45%	0.445	22%	0.22	S	C	.	.	H	α-helix	trans	-59.4	-49.6	178.6	179.8	176.1	170.2	-168.2	-2.1	112.1	Y298 L761 L762 L763 I767 Y768 D769	Y298-R765 WeakPolarHBondContact OH-CA 3.41Å; L761-R765 WeakPolarHBondContact O-CB 3.3Å; L761-R765 PolarHBondContact O-N 2.93Å; L762-R765 PolarHBondContact O-N 3.23Å; L763-R765 VanDerWaalsContact C-N 3.33Å; L763-R765 PolarHBondContact O-N 3.38Å; R765-I767 VanDerWaalsContact C-N 3.29Å; R765-I767 PolarHBondContact O-N 3.32Å; R765-Y768 PolarHBondContact O-N 3.47Å; R765-D769 VanDerWaalsContact CG-OD2 3.22Å; R765-D769 WeakPolarHBondContact CG-OD2 3.48Å; R765-D769 IonicContact CZ-OD2 2.63Å; R765-D769 IonicContact NE-OD2 2.76Å; R765-D769 PolarHBondContact NE-OD2 3.19Å; R765-D769 IonicContact NH2-OD2 3.42Å; R765-D769 WeakPolarHBondContact O-CB 3.46Å; R765-D769 PolarHBondContact O-N 2.87Å
766	E	92.3	Very high	88.9	Confident	17 Å²	17	36.9 Å²	36.9	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-37.6	177.4	176	69.2	-169.6	0	0	111.8	T571 F573 Y604 R726 L762 L763 N770	T571-E766 HydrophobicContact CG2-CG 4.24Å; F573-E766 HydrophobicContact CE1-CB 4.28Å; F573-E766 HydrophobicContact CE1-CG 4.4Å; F573-E766 HydrophobicContact CZ-CB 4.1Å; F573-E766 HydrophobicContact CZ-CG 4.09Å; Y604-E766 HydrophobicContact CD2-CG 4.48Å; Y604-E766 HydrophobicContact CE2-CB 4.46Å; Y604-E766 HydrophobicContact CE2-CG 3.62Å; Y604-E766 PolarHBondContact OH-OE1 3.14Å; Y604-E766 PolarHBondContact OH-OE2 3.33Å; R726-E766 IonicContact CZ-OE1 3.51Å; R726-E766 IonicContact CZ-OE2 2.75Å; R726-E766 IonicContact NH1-OE1 3.51Å; R726-E766 PolarHBondContact NH1-OE1 3.14Å; R726-E766 IonicContact NH1-OE2 3.72Å; R726-E766 PolarHBondContact NH1-OE2 3.49Å; R726-E766 IonicContact NH2-OE1 3.62Å; R726-E766 PolarHBondContact NH2-OE1 3.07Å; L762-E766 PolarHBondContact O-N 3.3Å; L763-E766 PolarHBondContact O-N 2.96Å; E766-N770 WeakPolarHBondContact O-CB 3.23Å; E766-N770 PolarHBondContact O-N 3.15Å; E766-N770 PolarHBondContact O-ND2 3.34Å; E766-N770 PolarHBondContact OE1-ND2 3.16Å
767	I	93.2	Very high	87.8	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	24%	0.235	C	C	.	.	H	α-helix	trans	-64.4	-52.8	176.8	-71.8	173.4	0	0	0	110.9	H260 V262 V310 L763 L764 R765 N770 L771	H260-I767 HydrophobicContact CB-CG2 3.67Å; V262-I767 HydrophobicContact CG2-CD1 3.95Å; V310-I767 HydrophobicContact CG1-CD1 4Å; V310-I767 HydrophobicContact CG2-CD1 4.31Å; V310-I767 HydrophobicContact CG2-CG2 4.16Å; L763-I767 HydrophobicContact CD2-CD1 3.59Å; L763-I767 HydrophobicContact CG-CD1 4.31Å; L763-I767 WeakPolarHBondContact O-CG1 3.1Å; L763-I767 PolarHBondContact O-N 3.06Å; L763-I767 VanDerWaalsContact O-N 3.11Å; L764-I767 PolarHBondContact O-N 3.44Å; R765-I767 VanDerWaalsContact C-N 3.29Å; R765-I767 PolarHBondContact O-N 3.32Å; I767-N770 PolarHBondContact O-N 3.49Å; I767-L771 HydrophobicContact CG2-CD1 4.24Å; I767-L771 WeakPolarHBondContact O-CG 3.44Å; I767-L771 PolarHBondContact O-N 3.36Å; I767-L771 VanDerWaalsContact O-N 3.14Å
768	Y	91.6	Very high	86.4	Confident	1 Å²	1	41.2 Å²	41.2	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-76.1	-29.4	-175.5	-75.4	-72.8	0	0	0	113.9	D259 L294 Y298 V307 V310 L764 R765 N770 L771 G772 V773	D259-Y768 HydrophobicContact CB-CE1 4.36Å; D259-Y768 PolarHBondContact OD2-OH 3.42Å; L294-Y768 HydrophobicContact CD2-CD2 4.19Å; L294-Y768 HydrophobicContact CD2-CE2 3.54Å; Y298-Y768 HydrophobicContact CE1-CG 4.18Å; Y298-Y768 HydrophobicContact CE2-CD2 4.42Å; V307-Y768 HydrophobicContact CB-CE1 4.3Å; V307-Y768 HydrophobicContact CG1-CE1 3.8Å; V307-Y768 HydrophobicContact CG2-CD1 4.03Å; V307-Y768 HydrophobicContact CG2-CE1 3.83Å; V310-Y768 HydrophobicContact CG2-CE2 3.75Å; L764-Y768 HydrophobicContact CD2-CD2 4.49Å; L764-Y768 HydrophobicContact CD2-CE2 4.01Å; L764-Y768 VanDerWaalsContact O-CD2 3.28Å; L764-Y768 WeakPolarHBondContact O-CD2 3.2Å; L764-Y768 PolarHBondContact O-N 3.32Å; R765-Y768 PolarHBondContact O-N 3.47Å; Y768-N770 VanDerWaalsContact C-N 3.3Å; Y768-N770 PolarHBondContact O-N 3.37Å; Y768-L771 HydrophobicContact CD1-CD1 3.91Å; Y768-L771 HydrophobicContact CE1-CD1 4.05Å; Y768-L771 CarbonylContact O-C 3.52Å; Y768-L771 PolarHBondContact O-N 3.33Å; Y768-L771 VanDerWaalsContact O-N 3.17Å; Y768-G772 PolarHBondContact O-N 3.35Å; Y768-V773 HydrophobicContact CD1-CB 4.23Å; Y768-V773 HydrophobicContact CD1-CG2 4.17Å; Y768-V773 PolarHBondContact O-N 3.19Å
769	D	89.7	Confident	84.4	Confident	65 Å²	65	49.8 Å²	49.8	35%	0.348	27%	0.271	S	S	.	.	H	α-helix	trans	-62.2	-38.9	170.3	-75.5	-8.8	0	0	0	109.9	R765 G772	R765-D769 VanDerWaalsContact CG-OD2 3.22Å; R765-D769 WeakPolarHBondContact CG-OD2 3.48Å; R765-D769 IonicContact CZ-OD2 2.63Å; R765-D769 IonicContact NE-OD2 2.76Å; R765-D769 PolarHBondContact NE-OD2 3.19Å; R765-D769 IonicContact NH2-OD2 3.42Å; R765-D769 WeakPolarHBondContact O-CB 3.46Å; R765-D769 PolarHBondContact O-N 2.87Å; D769-G772 PolarHBondContact O-N 2.93Å; D769-G772 VanDerWaalsContact O-N 3.14Å
770	N	85.3	Confident	82.1	Confident	76 Å²	76	61 Å²	61	41%	0.406	32%	0.323	S	S	.	.	H	α-helix	trans	-70.5	-27.6	173.7	-78.8	-59.4	0	0	0	113.5	E766 I767 Y768 G772	E766-N770 WeakPolarHBondContact O-CB 3.23Å; E766-N770 PolarHBondContact O-N 3.15Å; E766-N770 PolarHBondContact O-ND2 3.34Å; E766-N770 PolarHBondContact OE1-ND2 3.16Å; I767-N770 PolarHBondContact O-N 3.49Å; Y768-N770 VanDerWaalsContact C-N 3.3Å; Y768-N770 PolarHBondContact O-N 3.37Å; N770-G772 VanDerWaalsContact C-N 3.25Å
771	L	85.3	Confident	81.5	Confident	77 Å²	77	64 Å²	64	40%	0.403	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-3.9	170.4	-64.6	172.5	0	0	0	113.1	D259 I767 Y768 V773	D259-L771 HydrophobicContact CB-CD1 4.18Å; I767-L771 HydrophobicContact CG2-CD1 4.24Å; I767-L771 WeakPolarHBondContact O-CG 3.44Å; I767-L771 PolarHBondContact O-N 3.36Å; I767-L771 VanDerWaalsContact O-N 3.14Å; Y768-L771 HydrophobicContact CD1-CD1 3.91Å; Y768-L771 HydrophobicContact CE1-CD1 4.05Å; Y768-L771 CarbonylContact O-C 3.52Å; Y768-L771 PolarHBondContact O-N 3.33Å; Y768-L771 VanDerWaalsContact O-N 3.17Å; L771-V773 VanDerWaalsContact C-N 3.34Å; L771-V773 HydrophobicContact CB-CG2 4.36Å
772	G	83.7	Confident	80.9	Confident	68 Å²	68	66.6 Å²	66.6	70%	0.701	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	16.5	-180	0	0	0	0	0	114.8	Y768 D769 N770	Y768-G772 PolarHBondContact O-N 3.35Å; D769-G772 PolarHBondContact O-N 2.93Å; D769-G772 VanDerWaalsContact O-N 3.14Å; N770-G772 VanDerWaalsContact C-N 3.25Å
773	V	84.9	Confident	80.3	Confident	25 Å²	25	68.8 Å²	68.8	15%	0.152	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-88.8	124.8	178.9	-179.8	0	0	0	0	109.8	Y298 V307 Y768 L771 F775	Y298-V773 HydrophobicContact CD1-CG1 3.93Å; Y298-V773 HydrophobicContact CE1-CG1 4.21Å; V307-V773 HydrophobicContact CG2-CG1 3.73Å; V307-V773 HydrophobicContact CG2-CG2 4.27Å; Y768-V773 HydrophobicContact CD1-CB 4.23Å; Y768-V773 HydrophobicContact CD1-CG2 4.17Å; Y768-V773 PolarHBondContact O-N 3.19Å; L771-V773 VanDerWaalsContact C-N 3.34Å; L771-V773 HydrophobicContact CB-CG2 4.36Å; V773-F775 PolarHBondContact O-N 2.97Å
774	A	80.6	Confident	79.4	Confident	74 Å²	74	72.8 Å²	72.8	61%	0.612	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-67.7	130.5	-179.1	0	0	0	0	0	112.6
775	F	82.5	Confident	78.6	Confident	63 Å²	63	77.3 Å²	77.3	28%	0.276	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-70	127.8	172.3	177.3	-95.6	0	0	0	112	H297 Y298 L761 V773 Q777	H297-F775 HydrophobicContact CB-CE2 4.11Å; H297-F775 AromaticContact CE1-CZ 3.98Å; H297-F775 AromaticContact ND1-CE2 3.64Å; H297-F775 AromaticContact ND1-CZ 3.39Å; H297-F775 WeakPolarHBondContact ND1-CZ 3.43Å; Y298-F775 HydrophobicContact CE2-CD2 4.27Å; Y298-F775 AromaticContact CZ-CD2 3.95Å; L761-F775 HydrophobicContact CD1-CE2 3.97Å; L761-F775 HydrophobicContact CD2-CE2 4.18Å; L761-F775 HydrophobicContact CD2-CZ 4.19Å; L761-F775 HydrophobicContact CG-CE2 4.19Å; V773-F775 PolarHBondContact O-N 2.97Å; F775-Q777 HydrophobicContact CD1-CG 4.45Å; F775-Q777 HydrophobicContact CE1-CG 3.86Å
776	E	77.9	Confident	77.7	Confident	41 Å²	41	74.6 Å²	74.6	19%	0.192	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-99.3	129.5	174.7	-43.8	-166.6	115.8	0	0	110.8	H297 R299 R300	H297-E776 WeakPolarHBondContact CA-O 3.37Å; H297-E776 PolarHBondContact ND1-O 3.11Å; H297-E776 WeakPolarHBondContact O-CA 3.03Å; H297-E776 WeakPolarHBondContact O-CB 3.27Å; H297-E776 PolarHBondContact O-N 3.34Å; R299-E776 PolarHBondContact N-OE2 2.9Å; R300-E776 VanDerWaalsContact CB-OE1 3.26Å; R300-E776 WeakPolarHBondContact CB-OE1 3.23Å; R300-E776 WeakPolarHBondContact CB-OE2 3.22Å; R300-E776 IonicContact CZ-OE1 3.27Å; R300-E776 PolarHBondContact N-OE2 3.02Å; R300-E776 IonicContact NE-OE1 2.65Å; R300-E776 IonicContact NH1-OE1 3.79Å; R300-E776 PolarHBondContact NH1-OE1 3.08Å
777	Q	66.1	Low	76.6	Confident	144 Å²	144	78.7 Å²	78.7	67%	0.673	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-77.8	136.8	166.1	-74.8	-175	-0.7	0	0	109.5	F775 Q779	F775-Q777 HydrophobicContact CD1-CG 4.45Å; F775-Q777 HydrophobicContact CE1-CG 3.86Å; Q777-Q779 PolarHBondContact O-N 2.88Å
778	P	60.5	Low	75.4	Confident	48 Å²	48	84.6 Å²	84.6	31%	0.312	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-66.8	124.2	-178.6	24.3	-29.5	0	0	0	109.5	H297	H297-P778 VanDerWaalsContact CE1-CD 3.44Å; H297-P778 WeakPolarHBondContact CE1-CD 3.22Å
779	Q	49.3	Very low	74	Confident	183 Å²	183	91.6 Å²	91.6	86%	0.855	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-64.9	134.1	169.8	-67.3	179.8	-18.2	0	0	108.9	Q777	Q777-Q779 PolarHBondContact O-N 2.88Å
780	Q	42.4	Very low	72.6	Confident	235 Å²	235	94 Å²	94	100%	1.098	52%	0.516	S	S	*	.			trans	-73.7	0	-178.1	-72.9	171.6	23	0	0	112.2

Retrieved 780 of 780 residues in 326.8 ms (Link to these results)

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