A0A087Y118_POEFO Loading...

Kelch-like family member 13

AlphaFold DB (A0A3B3U0J6), UniProt , Accession A0A087Y118, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 640 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	36.5	Very low	27.5	Very low	241 Å²	241	161 Å²	161	100%	1.187	86%	0.857	S	S	*	*				0	98.6	0	-81.5	-173.4	-174.7	0	0	105.6
2	D	26	Very low	27.1	Very low	166 Å²	166	157.7 Å²	157.7	89%	0.888	85%	0.851	S	S	*	*			trans	-85.4	157.1	-162	-64.3	-60.1	0	0	0	113.8
3	H	28.7	Very low	27	Very low	180 Å²	180	156.8 Å²	156.8	83%	0.833	85%	0.853	S	S	*	*			trans	-59	158.6	164.7	-97.8	-48.9	0	0	0	112.5
4	P	36.3	Very low	26.7	Very low	131 Å²	131	150.1 Å²	150.1	85%	0.851	84%	0.84	S	S	*	*				-148.2	-178.8	69.5	37.4	-14.8	0	0	0	118
5	A	26.8	Very low	26.5	Very low	78 Å²	78	152.3 Å²	152.3	65%	0.645	85%	0.847	S	S	*	*			trans	-90.6	163.7	-168.8	0	0	0	0	0	115.8
6	H	26.9	Very low	26.4	Very low	160 Å²	160	154.2 Å²	154.2	74%	0.741	85%	0.847	S	S	*	*				177	137.5	119.7	-97.5	-51.6	0	0	0	114.4
7	R	25.3	Very low	26.3	Very low	228 Å²	228	153.5 Å²	153.5	86%	0.86	84%	0.842	S	S	*	*			trans	48.3	129.4	143	-61.9	175.7	180	-175.9	0.8	118.3
8	G	24.9	Very low	26.1	Very low	76 Å²	76	150.8 Å²	150.8	78%	0.784	84%	0.836	S	S	*	*			cis	105.2	75.9	31.9	0	0	0	0	0	110
9	E	24	Very low	26.4	Very low	192 Å²	192	148.7 Å²	148.7	90%	0.897	82%	0.819	S	S	*	*			trans	-137.1	122.2	167.9	-82.5	-173.7	167.5	0	0	110.8
10	T	24	Very low	26.3	Very low	139 Å²	139	150.8 Å²	150.8	85%	0.853	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-66.9	122.1	168.7	41.5	0	0	0	0	110.1
11	M	23.3	Very low	26.6	Very low	180 Å²	180	146.4 Å²	146.4	89%	0.887	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-72.8	132.1	171.5	-72.4	-146.6	-89.1	0	0	110.8
12	P	22.9	Very low	26	Very low	121 Å²	121	139.9 Å²	139.9	79%	0.786	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-73.9	138.4	174.2	29.4	-30.3	0	0	0	110.5	G14	P12-G14 PolarHBondContact O-N 3.49Å
13	V	25	Very low	26.4	Very low	146 Å²	146	135.8 Å²	135.8	89%	0.885	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-54.8	124.4	173.3	179.9	0	0	0	0	109.1
14	G	23.4	Very low	26.3	Very low	64 Å²	64	129.7 Å²	129.7	66%	0.66	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-60.2	139.6	-177.1	0	0	0	0	0	112.8	P12 H16	P12-G14 PolarHBondContact O-N 3.49Å; G14-H16 PolarHBondContact O-N 3.26Å
15	L	23.5	Very low	25.9	Very low	182 Å²	182	125.6 Å²	125.6	95%	0.953	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-50.7	125.4	173.9	-74	125.1	0	0	0	111.6
16	H	25	Very low	26.1	Very low	183 Å²	183	123.9 Å²	123.9	85%	0.847	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-69.5	141.5	166.5	-99.4	-54.4	0	0	0	110.7	G14 S18	G14-H16 PolarHBondContact O-N 3.26Å; H16-S18 PolarHBondContact O-N 3.41Å; H16-S18 VanDerWaalsContact O-N 3.1Å
17	D	24.3	Very low	26.2	Very low	143 Å²	143	118 Å²	118	77%	0.765	65%	0.646	S	S	*	*			trans	-44.5	106.9	178.8	-74.4	-48.1	0	0	0	113.3	H19	D17-H19 PolarHBondContact O-N 3.17Å
18	S	23	Very low	26.5	Very low	104 Å²	104	109.4 Å²	109.4	73%	0.727	62%	0.619	S	S	*	*			trans	-72.2	113.2	159.2	56.6	0	0	0	0	108.2	H16 Q20	H16-S18 PolarHBondContact O-N 3.41Å; H16-S18 VanDerWaalsContact O-N 3.1Å; S18-Q20 PolarHBondContact O-N 2.98Å
19	H	32	Very low	26.9	Very low	111 Å²	111	108.6 Å²	108.6	51%	0.514	60%	0.595	S	S	.	*			trans	-57.9	111	171.2	-71.5	-61.4	0	0	0	109.8	D17 H21	D17-H19 PolarHBondContact O-N 3.17Å; H19-H21 VanDerWaalsContact C-N 3.27Å; H19-H21 PolarHBondContact O-N 3.24Å
20	Q	23.6	Very low	27.1	Very low	191 Å²	191	103.1 Å²	103.1	89%	0.893	58%	0.578	S	S	*	*			trans	-68.9	87.9	168	-79.9	-173.6	-15.7	0	0	108.6	S18 S22	S18-Q20 PolarHBondContact O-N 2.98Å; Q20-S22 PolarHBondContact O-N 2.83Å; Q20-S22 VanDerWaalsContact O-N 3.17Å
21	H	33.3	Very low	27.3	Very low	58 Å²	58	100.5 Å²	100.5	27%	0.269	56%	0.558	S	S	.	*			trans	-69.9	104.8	164.9	-65.6	-64.5	0	0	0	107.5	H19 F23 E444 W453	H19-H21 VanDerWaalsContact C-N 3.27Å; H19-H21 PolarHBondContact O-N 3.24Å; H21-F23 VanDerWaalsContact O-CD2 3.31Å; H21-F23 WeakPolarHBondContact O-CD2 3.13Å; H21-F23 WeakPolarHBondContact O-CE2 3.38Å; H21-F23 PolarHBondContact O-N 2.93Å; H21-E444 IonicContact CD2-OE2 2.85Å; H21-E444 IonicContact NE2-OE2 3.76Å; H21-E444 PolarHBondContact NE2-OE2 2.77Å; H21-W453 AromaticContact CD2-CD1 3.7Å; H21-W453 AromaticContact CD2-CE2 3.98Å; H21-W453 AromaticContact CD2-NE1 3.63Å
22	S	23.1	Very low	27.5	Very low	105 Å²	105	97.9 Å²	97.9	73%	0.734	55%	0.547	S	S	*	.			trans	-71.9	121.8	172	61.3	0	0	0	0	109.2	Q20	Q20-S22 PolarHBondContact O-N 2.83Å; Q20-S22 VanDerWaalsContact O-N 3.17Å
23	F	34.4	Very low	27.6	Very low	80 Å²	80	97 Å²	97	35%	0.351	55%	0.55	S	S	.	.			trans	-89.1	151.3	-179.4	-66.1	-87.6	0	0	0	111.6	H21 Y446 W453	H21-F23 VanDerWaalsContact O-CD2 3.31Å; H21-F23 WeakPolarHBondContact O-CD2 3.13Å; H21-F23 WeakPolarHBondContact O-CE2 3.38Å; H21-F23 PolarHBondContact O-N 2.93Å; F23-Y446 HydrophobicContact CE1-CD2 4.28Å; F23-Y446 HydrophobicContact CE1-CE1 4.36Å; F23-Y446 AromaticContact CE1-CE2 3.91Å; F23-Y446 HydrophobicContact CE1-CE2 3.91Å; F23-Y446 AromaticContact CE1-CZ 3.94Å; F23-Y446 HydrophobicContact CE2-CE2 4.2Å; F23-Y446 AromaticContact CZ-CD2 3.8Å; F23-Y446 HydrophobicContact CZ-CD2 3.8Å; F23-Y446 AromaticContact CZ-CE2 3.36Å; F23-Y446 HydrophobicContact CZ-CE2 3.36Å; F23-Y446 AromaticContact CZ-CZ 3.81Å; F23-W453 AromaticContact CE1-NE1 3.86Å; F23-W453 AromaticContact CZ-CD1 3.95Å; F23-W453 AromaticContact CZ-NE1 3.24Å
24	M	27.7	Very low	27.6	Very low	51 Å²	51	94.9 Å²	94.9	25%	0.251	55%	0.548	S	S	.	.			trans	-126.7	100.6	154.9	-140.7	-176.4	-69.6	0	0	105.1	W26 D385 A386	M24-W26 HydrophobicContact CG-CZ2 4.42Å; M24-W26 PolarHBondContact O-N 3.46Å; M24-W26 HydrophobicContact SD-CZ2 3.49Å; M24-W26 WeakPolarHBondContact SD-CZ2 3.35Å; M24-W26 PolarHBondContact SD-NE1 3.29Å; M24-W26 VanDerWaalsContact SD-NE1 3.41Å; M24-D385 HydrophobicContact CE-CB 3.4Å; M24-D385 WeakPolarHBondContact CG-OD2 3.34Å; M24-D385 HydrophobicContact SD-CB 3.53Å; M24-D385 VanDerWaalsContact SD-CB 3.53Å; M24-D385 PolarHBondContact SD-N 2.79Å; M24-D385 VanDerWaalsContact SD-N 3.38Å; M24-A386 HydrophobicContact CE-CB 4.33Å
25	V	28.5	Very low	27.6	Very low	46 Å²	46	97.7 Å²	97.7	28%	0.279	56%	0.556	S	S	.	*			trans	-81.8	106.7	171.2	178	0	0	0	0	106.1	T27 F399	V25-T27 HydrophobicContact CG1-CG2 4.33Å; V25-T27 PolarHBondContact O-N 2.97Å; V25-F399 HydrophobicContact CG1-CD1 4.15Å
26	W	30.8	Very low	27.7	Very low	41 Å²	41	95.1 Å²	95.1	16%	0.155	55%	0.55	C	S	.	*			trans	-73.7	96.6	171.9	-74.2	81.9	0	0	0	108	M24 A382 P383 M384	M24-W26 HydrophobicContact CG-CZ2 4.42Å; M24-W26 PolarHBondContact O-N 3.46Å; M24-W26 HydrophobicContact SD-CZ2 3.49Å; M24-W26 WeakPolarHBondContact SD-CZ2 3.35Å; M24-W26 PolarHBondContact SD-NE1 3.29Å; M24-W26 VanDerWaalsContact SD-NE1 3.41Å; W26-A382 HydrophobicContact CZ3-CB 3.99Å; W26-P383 WeakPolarHBondContact CH2-O 3.34Å; W26-M384 VanDerWaalsContact CZ2-CA 3.42Å; W26-M384 HydrophobicContact CZ2-CB 4.38Å
27	T	29.1	Very low	27.6	Very low	37 Å²	37	91.6 Å²	91.6	23%	0.227	54%	0.542	C	S	.	.			trans	-73.6	139.9	163.4	68	0	0	0	0	107.5	V25 H29 S30 F399	V25-T27 HydrophobicContact CG1-CG2 4.33Å; V25-T27 PolarHBondContact O-N 2.97Å; T27-H29 PolarHBondContact O-N 2.8Å; T27-H29 WeakPolarHBondContact OG1-CB 3.19Å; T27-S30 PolarHBondContact O-N 2.9Å; T27-F399 HydrophobicContact CG2-CE1 4.16Å
28	T	31.8	Very low	27.5	Very low	48 Å²	48	94.1 Å²	94.1	29%	0.294	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-58.1	-5.4	169.4	40.3	0	0	0	0	112.9	I344	T28-I344 HydrophobicContact CG2-CG2 4.18Å
29	H	32.4	Very low	27.5	Very low	59 Å²	59	97.1 Å²	97.1	27%	0.273	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-73.8	-20.1	175.7	-106.6	-29	0	0	0	115.1	T27 L31 L295	T27-H29 PolarHBondContact O-N 2.8Å; T27-H29 WeakPolarHBondContact OG1-CB 3.19Å; H29-L31 PolarHBondContact O-N 2.62Å; H29-L295 PolarHBondContact CE1-O 3.18Å; H29-L295 PolarHBondContact NE2-O 2.95Å
30	S	27.6	Very low	27.1	Very low	76 Å²	76	99.6 Å²	99.6	53%	0.531	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-78.1	7.7	179.9	-55.6	0	0	0	0	114.5	T27	T27-S30 PolarHBondContact O-N 2.9Å
31	L	29.2	Very low	27	Very low	84 Å²	84	97.5 Å²	97.5	44%	0.44	56%	0.561	S	S	.	*	G	3₁₀ helix	trans	-106	7.8	179.2	-84.8	162.7	0	0	0	114.5	H29 A382	H29-L31 PolarHBondContact O-N 2.62Å; L31-A382 HydrophobicContact CD2-CB 3.85Å; L31-A382 HydrophobicContact CG-CB 4.24Å
32	L	27.9	Very low	26.5	Very low	125 Å²	125	98.1 Å²	98.1	65%	0.654	58%	0.583	S	S	*	*			trans	-130.1	65.2	-179.5	-75.4	168	0	0	0	112
33	A	24.7	Very low	26.4	Very low	102 Å²	102	98.3 Å²	98.3	84%	0.843	58%	0.584	S	S	*	*			trans	-153.4	83.6	167.5	0	0	0	0	0	112.3
34	A	23.9	Very low	26	Very low	102 Å²	102	103 Å²	103	84%	0.843	61%	0.612	S	S	*	*			trans	-167.4	93.7	146.2	0	0	0	0	0	110.3
35	C	23	Very low	25.8	Very low	124 Å²	124	106.2 Å²	106.2	84%	0.838	63%	0.634	S	S	*	*			trans	-104.9	146.1	148.6	-84.6	0	0	0	0	107.8
36	P	27	Very low	25.6	Very low	128 Å²	128	112.1 Å²	112.1	83%	0.831	66%	0.659	S	S	*	*				-132.4	151.7	112.7	23.2	-5.7	0	0	0	113.5
37	T	22.7	Very low	25.3	Very low	108 Å²	108	117.1 Å²	117.1	66%	0.663	69%	0.688	S	S	*	*			trans	-77.1	141.1	179.3	47.4	0	0	0	0	113.8
38	Y	22.6	Very low	25.1	Very low	197 Å²	197	122.6 Å²	122.6	77%	0.773	72%	0.716	S	S	*	*				133.5	139.4	125.5	-85.8	-69	0	0	0	118.4
39	H	22	Very low	24.8	Very low	167 Å²	167	128.6 Å²	128.6	77%	0.773	75%	0.747	S	S	*	*			trans	90.3	110.6	150.3	-76.2	-59	0	0	0	121.4
40	L	23.6	Very low	24.6	Very low	163 Å²	163	129.1 Å²	129.1	85%	0.853	76%	0.761	S	S	*	*			trans	-54.2	143.6	161.4	-76	102.1	0	0	0	112.8
41	T	21.8	Very low	24.6	Very low	147 Å²	147	134 Å²	134	90%	0.902	78%	0.775	S	S	*	*				-168	138.1	129.1	38.6	0	0	0	0	111.6
42	G	22.3	Very low	24.4	Very low	71 Å²	71	138.4 Å²	138.4	73%	0.732	80%	0.795	S	S	*	*			trans	91.1	92.1	152.1	0	0	0	0	0	115.9
43	S	22.4	Very low	24.2	Very low	108 Å²	108	142.3 Å²	142.3	76%	0.755	81%	0.807	S	S	*	*				66.6	110.8	88.9	174.7	0	0	0	0	113.3
44	L	24.1	Very low	24.2	Very low	178 Å²	178	143.5 Å²	143.5	93%	0.932	80%	0.804	S	S	*	*			trans	-156.6	139.3	131	-97.9	166.8	0	0	0	109.2
45	V	23.7	Very low	24.3	Very low	120 Å²	120	143.4 Å²	143.4	73%	0.727	80%	0.803	S	S	*	*			trans	-95.3	169.9	-172.6	178.2	0	0	0	0	108.7
46	E	24.2	Very low	24.4	Very low	170 Å²	170	145.2 Å²	145.2	79%	0.794	80%	0.803	S	S	*	*			trans	91.2	131.2	169.7	-53.4	-177.1	169.6	0	0	113.5
47	D	25.7	Very low	24.3	Very low	145 Å²	145	142.8 Å²	142.8	78%	0.775	80%	0.801	S	S	*	*			cis	-158.4	158.7	10.4	-133.2	-10.8	0	0	0	110.2
48	D	24.5	Very low	24.5	Very low	152 Å²	152	148.5 Å²	148.5	81%	0.813	81%	0.812	S	S	*	*			trans	-57	143	179.9	-80.6	-43.1	0	0	0	113.6
49	D	25.4	Very low	24.6	Very low	175 Å²	175	142.5 Å²	142.5	94%	0.936	81%	0.811	S	S	*	*			trans	-142.9	137.8	147.2	-134.6	-11.9	0	0	0	112.9
50	A	28	Very low	24.8	Very low	69 Å²	69	143.8 Å²	143.8	57%	0.57	82%	0.817	S	S	*	*			trans	-119.7	150.6	-148.4	0	0	0	0	0	113.2
51	H	27.6	Very low	25.3	Very low	178 Å²	178	145 Å²	145	82%	0.824	82%	0.821	S	S	*	*			trans	66.4	100	147.9	-68	-54.8	0	0	0	120	K53	H51-K53 PolarHBondContact O-N 3.01Å
52	M	24.5	Very low	25.8	Very low	177 Å²	177	141.2 Å²	141.2	87%	0.872	81%	0.811	S	S	*	*			trans	-48.2	120.3	143.3	-87.7	-172.6	75.4	0	0	110.7	V54	M52-V54 PolarHBondContact O-N 3.43Å; M52-V54 VanDerWaalsContact O-N 3.15Å
53	K	23.9	Very low	26.2	Very low	207 Å²	207	145.4 Å²	145.4	90%	0.9	82%	0.815	S	S	*	*			trans	-65.1	105.3	171.5	-75.4	176.2	176	173.6	0	110.8	H51	H51-K53 PolarHBondContact O-N 3.01Å
54	V	25.8	Very low	26.6	Very low	128 Å²	128	146.2 Å²	146.2	78%	0.776	82%	0.817	S	S	*	*			trans	-98.7	113.3	154.8	177.7	0	0	0	0	106.4	M52 L56	M52-V54 PolarHBondContact O-N 3.43Å; M52-V54 VanDerWaalsContact O-N 3.15Å; V54-L56 PolarHBondContact O-N 3.47Å
55	A	24.9	Very low	27.4	Very low	99 Å²	99	143.5 Å²	143.5	82%	0.818	81%	0.808	S	S	*	*			trans	-68.4	113.5	-177.1	0	0	0	0	0	110.7
56	L	25.6	Very low	28.4	Very low	162 Å²	162	144.4 Å²	144.4	85%	0.848	80%	0.804	S	S	*	*			trans	-85.9	114	157.4	-76.2	166.5	0	0	0	107.8	V54	V54-L56 PolarHBondContact O-N 3.47Å
57	G	24.2	Very low	29	Very low	77 Å²	77	143 Å²	143	79%	0.794	80%	0.801	S	S	*	*			trans	-117.2	90.1	166.1	0	0	0	0	0	109.4
58	Y	26.9	Very low	29.9	Very low	228 Å²	228	144 Å²	144	89%	0.894	80%	0.801	S	S	*	*			trans	-79.7	136.6	155.9	-96.2	-91.1	0	0	0	108.2
59	G	25.5	Very low	30.6	Very low	71 Å²	71	141.3 Å²	141.3	73%	0.732	80%	0.801	S	S	*	*			trans	-81.2	165.1	-161.4	0	0	0	0	0	116.5
60	E	25.9	Very low	31.3	Very low	194 Å²	194	136.5 Å²	136.5	91%	0.907	78%	0.781	S	S	*	*			trans	-133	151	142.7	-92.4	-171.5	157.7	0	0	108.7
61	M	34.1	Very low	32.5	Very low	190 Å²	190	142.7 Å²	142.7	94%	0.936	80%	0.795	S	S	*	*			trans	-37.3	139.7	-165	-66.7	-178.3	-92.3	0	0	118.2
62	G	33.8	Very low	33.7	Very low	67 Å²	67	140.5 Å²	140.5	69%	0.691	79%	0.794	S	S	*	*			trans	132.1	109.1	139.5	0	0	0	0	0	116.9
63	I	28.8	Very low	35	Very low	159 Å²	159	135 Å²	135	82%	0.815	78%	0.783	S	S	*	*			trans	86.1	116.8	157.3	-45.2	169.2	0	0	0	115.8	T65	I63-T65 PolarHBondContact O-N 2.91Å
64	P	32.7	Very low	36.9	Very low	125 Å²	125	133.8 Å²	133.8	81%	0.812	79%	0.786	S	S	*	*			trans	-77.6	120.7	170.1	10.1	4.6	0	0	0	110.6	H66	P64-H66 PolarHBondContact O-N 2.84Å
65	T	40.8	Very low	38.9	Very low	120 Å²	120	132 Å²	132	74%	0.736	78%	0.775	S	S	*	*			trans	-71.8	114.4	161	38.3	0	0	0	0	109	I63	I63-T65 PolarHBondContact O-N 2.91Å
66	H	42.9	Very low	41.6	Very low	140 Å²	140	138 Å²	138	65%	0.648	78%	0.777	S	S	*	*			trans	170.1	82.2	141.3	-95.6	-74.9	0	0	0	110.6	P64	P64-H66 PolarHBondContact O-N 2.84Å
67	L	38.6	Very low	44.4	Very low	140 Å²	140	136.9 Å²	136.9	73%	0.733	77%	0.765	S	S	*	*			trans	-117.7	95.7	157.1	-96.5	149.7	0	0	0	106.1	A69	L67-A69 PolarHBondContact O-N 2.81Å
68	Q	44.3	Very low	47.5	Very low	165 Å²	165	141.4 Å²	141.4	77%	0.771	76%	0.764	S	S	*	*			trans	-76.2	108.3	165	-90.1	-178.2	-9.1	0	0	107.8	S70	Q68-S70 PolarHBondContact O-N 3.38Å
69	A	38.4	Very low	50.4	Low	97 Å²	97	136.2 Å²	136.2	80%	0.802	76%	0.756	S	S	*	*			trans	-75.8	105.7	171.1	0	0	0	0	0	109.1	L67 K71	L67-A69 PolarHBondContact O-N 2.81Å; A69-K71 PolarHBondContact O-N 2.72Å
70	S	40.3	Very low	53.5	Low	74 Å²	74	134.8 Å²	134.8	52%	0.517	73%	0.734	S	S	.	*			trans	-70.7	121	163.2	177.7	0	0	0	0	109	Q68 T72	Q68-S70 PolarHBondContact O-N 3.38Å; S70-T72 PolarHBondContact O-N 3.42Å; S70-T72 VanDerWaalsContact O-N 3.17Å
71	K	53.3	Low	56.6	Low	198 Å²	198	132 Å²	132	86%	0.861	73%	0.726	S	S	*	*	S	Bend	trans	-77.5	95	165.4	-80.9	-176.5	177.9	177.7	0	107.9	A69	A69-K71 PolarHBondContact O-N 2.72Å
72	T	52.2	Low	59.3	Low	133 Å²	133	127 Å²	127	82%	0.816	71%	0.706	S	S	*	*	S	Bend	trans	139.3	112.8	153.8	49.9	0	0	0	0	110.3	S70	S70-T72 PolarHBondContact O-N 3.42Å; S70-T72 VanDerWaalsContact O-N 3.17Å
73	G	51.2	Low	62.2	Low	61 Å²	61	129.4 Å²	129.4	63%	0.629	70%	0.699	S	S	*	*	S	Bend	trans	109	136.9	-179.8	0	0	0	0	0	113.3	T75	G73-T75 PolarHBondContact O-N 3.29Å
74	N	65.1	Low	65.1	Low	182 Å²	182	125.5 Å²	125.5	97%	0.973	69%	0.686	S	S	*	*	S	Bend	trans	-71.2	26.5	-173.5	-135.2	11	0	0	0	114.1
75	T	66.6	Low	67.8	Low	89 Å²	89	122.4 Å²	122.4	55%	0.546	67%	0.667	S	S	.	*			trans	-111	123.9	-169.5	-45.8	0	0	0	0	110.1	G73 F77	G73-T75 PolarHBondContact O-N 3.29Å; T75-F77 HydrophobicContact CG2-CE1 4.16Å; T75-F77 HydrophobicContact CG2-CE2 4.07Å; T75-F77 HydrophobicContact CG2-CZ 3.8Å
76	R	81.6	Confident	70.3	Confident	225 Å²	225	120.8 Å²	120.8	85%	0.849	66%	0.657	S	S	*	*			trans	-102.1	130.5	171.6	-64.3	-176	-177.8	-179.6	0.8	109.1
77	F	84.4	Confident	72.7	Confident	139 Å²	139	116.8 Å²	116.8	61%	0.61	64%	0.642	S	S	*	*			trans	-100.9	128.6	176	-61.7	-84	0	0	0	109.4	T75	T75-F77 HydrophobicContact CG2-CE1 4.16Å; T75-F77 HydrophobicContact CG2-CE2 4.07Å; T75-F77 HydrophobicContact CG2-CZ 3.8Å
78	F	90.1	Very high	75.3	Confident	173 Å²	173	112.4 Å²	112.4	76%	0.759	62%	0.619	S	S	*	*			trans	-110.5	132.5	171.4	171.2	-102.4	0	0	0	108.6
79	T	87.6	Confident	77.6	Confident	119 Å²	119	110.5 Å²	110.5	73%	0.73	61%	0.61	S	S	*	*			trans	-130.6	120.4	175.1	-57.5	0	0	0	0	107.9
80	S	90.9	Very high	80.3	Confident	40 Å²	40	107.5 Å²	107.5	28%	0.28	59%	0.589	S	S	.	*			trans	-88.1	128.2	175.7	173.9	0	0	0	0	110.1	T82 H83	S80-T82 PolarHBondContact OG-N 2.99Å; S80-T82 PolarHBondContact OG-OG1 2.82Å; S80-H83 PolarHBondContact OG-N 3.34Å
81	N	90.9	Very high	82.9	Confident	136 Å²	136	107.2 Å²	107.2	73%	0.727	58%	0.579	S	S	*	*	S	Bend	trans	-82.2	-12.7	176.1	47	-4.8	0	0	0	113.6
82	T	91.4	Very high	84.9	Confident	84 Å²	84	99.3 Å²	99.3	52%	0.515	55%	0.546	S	S	.	.	S	Bend	trans	-103.8	-15.4	178.5	56.9	0	0	0	0	113.4	S80 S84 S85 V86	S80-T82 PolarHBondContact OG-N 2.99Å; S80-T82 PolarHBondContact OG-OG1 2.82Å; T82-S84 PolarHBondContact O-N 2.88Å; T82-S85 PolarHBondContact O-N 3.33Å; T82-V86 WeakPolarHBondContact O-CG2 3.4Å; T82-V86 PolarHBondContact O-N 3.14Å; T82-V86 VanDerWaalsContact O-N 3.09Å
83	H	93.2	Very high	86.9	Confident	118 Å²	118	97.5 Å²	97.5	55%	0.546	53%	0.528	S	S	.	.	H	α-helix	trans	-57.7	-43.6	-172.5	-177.7	56.6	0	0	0	113.1	S80 S85 V86 V87	S80-H83 PolarHBondContact OG-N 3.34Å; H83-S85 PolarHBondContact O-N 2.94Å; H83-V86 PolarHBondContact O-N 3.16Å; H83-V87 VanDerWaalsContact O-CG2 3.3Å; H83-V87 WeakPolarHBondContact O-CG2 3.42Å; H83-V87 PolarHBondContact O-N 3.38Å
84	S	89.6	Confident	89	Confident	78 Å²	78	97 Å²	97	55%	0.545	51%	0.511	S	S	.	.	H	α-helix	trans	-60	-43.9	178.4	50.7	0	0	0	0	112.8	T82 V87 L88	T82-S84 PolarHBondContact O-N 2.88Å; S84-V87 PolarHBondContact O-N 2.88Å; S84-L88 WeakPolarHBondContact O-CG 3.43Å; S84-L88 PolarHBondContact O-N 2.97Å
85	S	90.6	Very high	90.4	Very high	59 Å²	59	90 Å²	90	41%	0.413	47%	0.471	S	S	.	.	H	α-helix	trans	-65.8	-39.2	177.4	-179.4	0	0	0	0	112.2	T82 H83 Q89	T82-S85 PolarHBondContact O-N 3.33Å; H83-S85 PolarHBondContact O-N 2.94Å; S85-Q89 WeakPolarHBondContact O-CB 3.25Å; S85-Q89 VanDerWaalsContact O-CG 3.31Å; S85-Q89 WeakPolarHBondContact O-CG 3.43Å; S85-Q89 PolarHBondContact O-N 2.88Å
86	V	92.9	Very high	91.7	Very high	86 Å²	86	90.9 Å²	90.9	52%	0.521	47%	0.471	S	S	.	.	H	α-helix	trans	-67.9	-39.9	178.5	174.3	0	0	0	0	110.6	T82 H83 Q89 G90	T82-V86 WeakPolarHBondContact O-CG2 3.4Å; T82-V86 PolarHBondContact O-N 3.14Å; T82-V86 VanDerWaalsContact O-N 3.09Å; H83-V86 PolarHBondContact O-N 3.16Å; V86-Q89 PolarHBondContact O-N 3.45Å; V86-G90 PolarHBondContact O-N 2.85Å
87	V	93.4	Very high	92.2	Very high	57 Å²	57	85.4 Å²	85.4	35%	0.345	46%	0.455	S	S	.	.	H	α-helix	trans	-62.8	-46.7	175.5	170.5	0	0	0	0	110.9	H83 S84 Q89 G90 F91	H83-V87 VanDerWaalsContact O-CG2 3.3Å; H83-V87 WeakPolarHBondContact O-CG2 3.42Å; H83-V87 PolarHBondContact O-N 3.38Å; S84-V87 PolarHBondContact O-N 2.88Å; V87-Q89 PolarHBondContact O-N 3.48Å; V87-G90 PolarHBondContact O-N 3.42Å; V87-F91 HydrophobicContact CG1-CD2 3.79Å; V87-F91 HydrophobicContact CG1-CE2 3.86Å; V87-F91 WeakPolarHBondContact O-CD2 3.28Å; V87-F91 PolarHBondContact O-N 3.36Å
88	L	93.6	Very high	92.6	Very high	47 Å²	47	80.9 Å²	80.9	25%	0.246	45%	0.448	C	S	.	.	H	α-helix	trans	-59.7	-46.2	176.6	-77	174.5	0	0	0	112.2	S84 G90 F91 D92 M120 A164	S84-L88 WeakPolarHBondContact O-CG 3.43Å; S84-L88 PolarHBondContact O-N 2.97Å; L88-G90 VanDerWaalsContact C-N 3.32Å; L88-G90 PolarHBondContact O-N 3.18Å; L88-F91 PolarHBondContact O-N 3.49Å; L88-D92 PolarHBondContact O-N 3.04Å; L88-M120 HydrophobicContact CD2-CE 3.63Å; L88-A164 HydrophobicContact CD1-CB 4.4Å
89	Q	93.3	Very high	92.7	Very high	125 Å²	125	76.7 Å²	76.7	58%	0.584	43%	0.433	S	S	*	.	H	α-helix	trans	-60.4	-40.3	174.6	-75.7	173.8	-0.8	0	0	112.5	S85 V86 V87 D92 Q93	S85-Q89 WeakPolarHBondContact O-CB 3.25Å; S85-Q89 VanDerWaalsContact O-CG 3.31Å; S85-Q89 WeakPolarHBondContact O-CG 3.43Å; S85-Q89 PolarHBondContact O-N 2.88Å; V86-Q89 PolarHBondContact O-N 3.45Å; V87-Q89 PolarHBondContact O-N 3.48Å; Q89-D92 PolarHBondContact O-N 2.95Å; Q89-Q93 PolarHBondContact O-N 3.19Å
90	G	94.4	Very high	92.9	Very high	35 Å²	35	77.7 Å²	77.7	36%	0.361	43%	0.433	S	S	.	.	H	α-helix	trans	-61.6	-45.3	175.2	0	0	0	0	0	112.3	V86 V87 L88 D92 Q93 L94	V86-G90 PolarHBondContact O-N 2.85Å; V87-G90 PolarHBondContact O-N 3.42Å; L88-G90 VanDerWaalsContact C-N 3.32Å; L88-G90 PolarHBondContact O-N 3.18Å; G90-D92 VanDerWaalsContact C-N 3.35Å; G90-Q93 PolarHBondContact O-N 2.85Å; G90-L94 WeakPolarHBondContact O-CG 3.46Å; G90-L94 PolarHBondContact O-N 3.17Å
91	F	95	Very high	93.1	Very high	68 Å²	68	77.5 Å²	77.5	30%	0.298	43%	0.431	S	S	.	.	H	α-helix	trans	-65.9	-35.3	176.3	-89.8	-71	0	0	0	113.1	V87 L88 L94 R95 M120 Y162	V87-F91 HydrophobicContact CG1-CD2 3.79Å; V87-F91 HydrophobicContact CG1-CE2 3.86Å; V87-F91 WeakPolarHBondContact O-CD2 3.28Å; V87-F91 PolarHBondContact O-N 3.36Å; L88-F91 PolarHBondContact O-N 3.49Å; F91-L94 HydrophobicContact CD1-CD1 4.4Å; F91-L94 PolarHBondContact O-N 3.15Å; F91-R95 WeakPolarHBondContact O-CB 3.42Å; F91-R95 PolarHBondContact O-N 3.36Å; F91-M120 HydrophobicContact CB-SD 4.46Å; F91-M120 HydrophobicContact CD1-CG 4.01Å; F91-M120 HydrophobicContact CD1-SD 4.35Å; F91-M120 HydrophobicContact CD2-SD 4Å; F91-M120 HydrophobicContact CE1-CG 4.37Å; F91-M120 HydrophobicContact CE2-SD 4.32Å; F91-M120 HydrophobicContact CG-CG 4.18Å; F91-M120 HydrophobicContact CG-SD 4.02Å; F91-Y162 HydrophobicContact CB-CD1 4.03Å; F91-Y162 HydrophobicContact CB-CE1 3.95Å
92	D	94.3	Very high	93.2	Very high	31 Å²	31	74.1 Å²	74.1	17%	0.166	41%	0.413	C	S	.	.	H	α-helix	trans	-66.7	-41.4	175	-165.7	42.5	0	0	0	111.4	L88 Q89 G90 R95 I96 Y162	L88-D92 PolarHBondContact O-N 3.04Å; Q89-D92 PolarHBondContact O-N 2.95Å; G90-D92 VanDerWaalsContact C-N 3.35Å; D92-R95 WeakPolarHBondContact O-CB 3.35Å; D92-R95 PolarHBondContact O-N 3.48Å; D92-R95 IonicContact OD1-CZ 3.82Å; D92-R95 IonicContact OD1-NE 3.07Å; D92-R95 PolarHBondContact OD1-NE 3.19Å; D92-R95 VanDerWaalsContact OD1-NE 3.07Å; D92-R95 IonicContact OD1-NH2 3.15Å; D92-R95 PolarHBondContact OD1-NH2 3.46Å; D92-I96 WeakPolarHBondContact O-CG1 3.37Å; D92-I96 PolarHBondContact O-N 2.89Å; D92-Y162 HydrophobicContact CB-CD1 4.29Å
93	Q	94.4	Very high	93.4	Very high	96 Å²	96	70.3 Å²	70.3	45%	0.449	39%	0.389	S	S	.	.	H	α-helix	trans	-62.2	-45.4	174.4	-171.4	62.3	37.1	0	0	111.9	Q89 G90 R95 I96 E97	Q89-Q93 PolarHBondContact O-N 3.19Å; G90-Q93 PolarHBondContact O-N 2.85Å; Q93-R95 VanDerWaalsContact C-N 3.27Å; Q93-R95 PolarHBondContact O-N 3.05Å; Q93-I96 PolarHBondContact O-N 2.89Å; Q93-E97 PolarHBondContact NE2-OE1 3.36Å; Q93-E97 PolarHBondContact O-N 3.43Å
94	L	95.3	Very high	93.4	Very high	50 Å²	50	66.5 Å²	66.5	26%	0.262	38%	0.375	S	S	.	.	H	α-helix	trans	-58.4	-40.7	175.5	-71.9	172.4	0	0	0	111.7	G90 F91 E97 G98 L99 L100	G90-L94 WeakPolarHBondContact O-CG 3.46Å; G90-L94 PolarHBondContact O-N 3.17Å; F91-L94 HydrophobicContact CD1-CD1 4.4Å; F91-L94 PolarHBondContact O-N 3.15Å; L94-E97 PolarHBondContact O-N 3.42Å; L94-G98 PolarHBondContact O-N 2.88Å; L94-L99 HydrophobicContact CD2-CB 3.88Å; L94-L99 HydrophobicContact CD2-CD1 4.12Å; L94-L99 PolarHBondContact O-N 3.04Å; L94-L100 HydrophobicContact CD1-CD1 4.42Å
95	R	95.1	Very high	93.7	Very high	35 Å²	35	62.8 Å²	62.8	13%	0.132	35%	0.349	C	S	.	.	H	α-helix	trans	-63.4	-46.2	176.7	-177.7	-172.4	67.9	107.1	-12.2	111.9	F91 D92 Q93 E97 G98 P115 D159 Y162	F91-R95 WeakPolarHBondContact O-CB 3.42Å; F91-R95 PolarHBondContact O-N 3.36Å; D92-R95 WeakPolarHBondContact O-CB 3.35Å; D92-R95 PolarHBondContact O-N 3.48Å; D92-R95 IonicContact OD1-CZ 3.82Å; D92-R95 IonicContact OD1-NE 3.07Å; D92-R95 PolarHBondContact OD1-NE 3.19Å; D92-R95 VanDerWaalsContact OD1-NE 3.07Å; D92-R95 IonicContact OD1-NH2 3.15Å; D92-R95 PolarHBondContact OD1-NH2 3.46Å; Q93-R95 VanDerWaalsContact C-N 3.27Å; Q93-R95 PolarHBondContact O-N 3.05Å; R95-E97 VanDerWaalsContact C-N 3.28Å; R95-E97 PolarHBondContact O-N 3.08Å; R95-G98 PolarHBondContact O-N 3.23Å; R95-P115 WeakPolarHBondContact CG-O 3.34Å; R95-D159 IonicContact CZ-OD1 2.7Å; R95-D159 IonicContact NH1-OD1 3.71Å; R95-D159 IonicContact NH2-OD1 2.71Å; R95-D159 PolarHBondContact NH2-OD1 3.08Å; R95-D159 VanDerWaalsContact NH2-OD1 3.15Å; R95-Y162 HydrophobicContact CB-CD1 4.44Å; R95-Y162 HydrophobicContact CB-CE1 4.11Å
96	I	92.9	Very high	93.9	Very high	108 Å²	108	60.5 Å²	60.5	55%	0.554	33%	0.332	S	S	*	.	H	α-helix	trans	-62.1	-38.1	179.1	-68.5	165.2	0	0	0	111	D92 Q93 G98	D92-I96 WeakPolarHBondContact O-CG1 3.37Å; D92-I96 PolarHBondContact O-N 2.89Å; Q93-I96 PolarHBondContact O-N 2.89Å; I96-G98 VanDerWaalsContact C-N 3.27Å; I96-G98 PolarHBondContact O-N 3.36Å
97	E	93.8	Very high	93.9	Very high	110 Å²	110	56.5 Å²	56.5	51%	0.514	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-6.5	176.2	-67.1	175.9	-168	0	0	113.5	Q93 L94 R95 L99	Q93-E97 PolarHBondContact NE2-OE1 3.36Å; Q93-E97 PolarHBondContact O-N 3.43Å; L94-E97 PolarHBondContact O-N 3.42Å; R95-E97 VanDerWaalsContact C-N 3.28Å; R95-E97 PolarHBondContact O-N 3.08Å; E97-L99 HydrophobicContact CB-CD1 4.05Å; E97-L99 HydrophobicContact CB-CG 3.91Å; E97-L99 PolarHBondContact O-N 3.28Å; E97-L99 VanDerWaalsContact OE2-CD1 3.25Å; E97-L99 WeakPolarHBondContact OE2-CD1 3.18Å
98	G	91.5	Very high	93.5	Very high	44 Å²	44	54.8 Å²	54.8	45%	0.454	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	18.7	-177	0	0	0	0	0	113.9	L94 R95 I96	L94-G98 PolarHBondContact O-N 2.88Å; R95-G98 PolarHBondContact O-N 3.23Å; I96-G98 VanDerWaalsContact C-N 3.27Å; I96-G98 PolarHBondContact O-N 3.36Å
99	L	92.3	Very high	93.2	Very high	85 Å²	85	57.6 Å²	57.6	45%	0.445	32%	0.317	S	S	.	.			trans	-84.2	136.9	-179.5	-63.8	178.1	0	0	0	110.1	L94 E97 C101 H117	L94-L99 HydrophobicContact CD2-CB 3.88Å; L94-L99 HydrophobicContact CD2-CD1 4.12Å; L94-L99 PolarHBondContact O-N 3.04Å; E97-L99 HydrophobicContact CB-CD1 4.05Å; E97-L99 HydrophobicContact CB-CG 3.91Å; E97-L99 PolarHBondContact O-N 3.28Å; E97-L99 VanDerWaalsContact OE2-CD1 3.25Å; E97-L99 WeakPolarHBondContact OE2-CD1 3.18Å; L99-C101 PolarHBondContact O-N 2.61Å; L99-H117 PolarHBondContact O-NE2 3.23Å; L99-H117 VanDerWaalsContact O-NE2 3.17Å
100	L	92.9	Very high	92.6	Very high	139 Å²	139	52.5 Å²	52.5	73%	0.728	30%	0.299	S	S	*	.	S	Bend	trans	58.3	12.1	176.7	-53	177.1	0	0	0	115.4	L94 D102 H117	L94-L100 HydrophobicContact CD1-CD1 4.42Å; L100-D102 PolarHBondContact O-N 2.83Å; L100-H117 PolarHBondContact O-CD2 3.4Å
101	C	93.6	Very high	92.2	Very high	37 Å²	37	57.4 Å²	57.4	25%	0.25	32%	0.316	C	S	.	.			trans	-70.8	123.7	172.2	-65.4	0	0	0	0	109.7	L99 P115 V116	L99-C101 PolarHBondContact O-N 2.61Å; C101-P115 HydrophobicContact CB-CB 4.01Å; C101-V116 WeakPolarHBondContact CA-O 3.32Å
102	D	93.9	Very high	92	Very high	65 Å²	65	56.8 Å²	56.8	35%	0.348	31%	0.314	S	S	.	.			trans	-113.6	2.8	-172.3	60.7	-8.7	0	0	0	112.8	L100 V116 H117 R118	L100-D102 PolarHBondContact O-N 2.83Å; D102-V116 PolarHBondContact N-O 3.08Å; D102-H117 VanDerWaalsContact OD1-CA 3.28Å; D102-H117 WeakPolarHBondContact OD1-CA 3.4Å; D102-R118 WeakPolarHBondContact OD1-CG 3.42Å; D102-R118 PolarHBondContact OD1-N 3.48Å; D102-R118 WeakPolarHBondContact OD2-CB 3.25Å
103	V	95	Very high	91.9	Very high	3 Å²	3	58.2 Å²	58.2	2%	0.018	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	148.3	171.4	69.3	0	0	0	0	111	L105 V116 R118 F132 I144	V103-L105 HydrophobicContact CG2-CD2 4.43Å; V103-V116 HydrophobicContact CG1-CG2 3.5Å; V103-V116 PolarHBondContact N-O 3.19Å; V103-V116 PolarHBondContact O-N 3.36Å; V103-V116 VanDerWaalsContact O-O 3.06Å; V103-R118 HydrophobicContact CB-CG 3.82Å; V103-R118 HydrophobicContact CG1-CG 3.57Å; V103-F132 HydrophobicContact CG1-CZ 4.33Å; V103-I144 HydrophobicContact CG2-CD1 3.64Å; V103-I144 HydrophobicContact CG2-CG1 4.09Å
104	T	94.8	Very high	91.9	Very high	39 Å²	39	54.3 Å²	54.3	24%	0.239	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	126.7	170.7	-58.5	0	0	0	0	109.4	V106 A113 F114 M142 C143 I144	T104-V106 HydrophobicContact CG2-CG2 4.47Å; T104-A113 HydrophobicContact CG2-CB 3.52Å; T104-F114 WeakPolarHBondContact CA-O 3.5Å; T104-M142 PolarHBondContact N-O 2.96Å; T104-C143 CarbonylContact O-C 3.57Å; T104-C143 WeakPolarHBondContact O-CA 3.25Å; T104-I144 PolarHBondContact O-N 3.27Å
105	L	94.9	Very high	91.9	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	137.8	174.4	-59.2	-179.4	0	0	0	110	V103 F114 V116 M121 F128 I144 L146 L154 I158	V103-L105 HydrophobicContact CG2-CD2 4.43Å; L105-F114 PolarHBondContact N-O 3.24Å; L105-F114 PolarHBondContact O-N 3.07Å; L105-V116 HydrophobicContact CD1-CG2 3.87Å; L105-V116 HydrophobicContact CG-CG2 3.84Å; L105-M121 HydrophobicContact CD1-CE 4.01Å; L105-F128 HydrophobicContact CD1-CE1 3.87Å; L105-F128 HydrophobicContact CD1-CZ 3.76Å; L105-F128 HydrophobicContact CD2-CE1 4.21Å; L105-I144 HydrophobicContact CD2-CB 4.1Å; L105-L146 HydrophobicContact CB-CD1 4.45Å; L105-L146 HydrophobicContact CD1-CD1 4.32Å; L105-L146 HydrophobicContact CD2-CD1 4.3Å; L105-L154 HydrophobicContact CB-CD2 4.31Å; L105-L154 HydrophobicContact CD1-CD1 4.45Å; L105-I158 HydrophobicContact CD1-CD1 4.38Å
106	V	94.5	Very high	92	Very high	11 Å²	11	52.7 Å²	52.7	7%	0.067	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	130.4	176.3	-178.3	0	0	0	0	108.5	T104 G110 E112 I144 K145 L146	T104-V106 HydrophobicContact CG2-CG2 4.47Å; V106-G110 WeakPolarHBondContact CG1-O 3.44Å; V106-E112 WeakPolarHBondContact CA-O 3.4Å; V106-I144 PolarHBondContact N-O 3.16Å; V106-K145 HydrophobicContact CB-CG 4.49Å; V106-K145 HydrophobicContact CG1-CG 4.44Å; V106-K145 CarbonylContact O-C 3.53Å; V106-K145 WeakPolarHBondContact O-CA 3.19Å; V106-L146 PolarHBondContact O-N 3.4Å
107	A	93	Very high	92.1	Very high	1 Å²	1	48 Å²	48	1%	0.008	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	156.9	176.4	0	0	0	0	0	111.6	D109 K145 R151 L154	A107-D109 VanDerWaalsContact C-N 3.31Å; A107-D109 VanDerWaalsContact CB-OD1 3.26Å; A107-D109 WeakPolarHBondContact CB-OD1 3.28Å; A107-D109 PolarHBondContact O-N 2.94Å; A107-K145 WeakPolarHBondContact O-CE 3.32Å; A107-R151 HydrophobicContact CB-CB 4.2Å; A107-L154 HydrophobicContact CB-CD2 4.05Å
108	G	85.6	Confident	92.2	Very high	21 Å²	21	44.5 Å²	44.5	22%	0.216	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-33.6	-176.6	0	0	0	0	0	113.6	K145 L146 V149	G108-K145 WeakPolarHBondContact O-CE 3.42Å; G108-L146 VanDerWaalsContact CA-O 3.32Å; G108-L146 WeakPolarHBondContact CA-O 3.26Å; G108-L146 PolarHBondContact N-O 2.91Å; G108-V149 PolarHBondContact N-O 3.47Å; G108-V149 VanDerWaalsContact N-O 3.08Å
109	D	85.9	Confident	92.2	Very high	106 Å²	106	45.9 Å²	45.9	57%	0.567	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	1.6	-171.6	67.5	-29.5	0	0	0	114.2	A107 N150 R151	A107-D109 VanDerWaalsContact C-N 3.31Å; A107-D109 VanDerWaalsContact CB-OD1 3.26Å; A107-D109 WeakPolarHBondContact CB-OD1 3.28Å; A107-D109 PolarHBondContact O-N 2.94Å; D109-N150 WeakPolarHBondContact OD1-CA 3.32Å; D109-N150 VanDerWaalsContact OD2-CB 3.24Å; D109-N150 WeakPolarHBondContact OD2-CB 2.96Å; D109-R151 PolarHBondContact OD1-N 3.46Å; D109-R151 PolarHBondContact OD2-N 2.73Å
110	G	82.1	Confident	92.3	Very high	19 Å²	19	42.8 Å²	42.8	20%	0.196	26%	0.258	C	S	.	.	S	Bend	trans	-160.5	-171.1	178.9	0	0	0	0	0	113.3	V106 K145	V106-G110 WeakPolarHBondContact CG1-O 3.44Å; G110-K145 PolarHBondContact O-NZ 3.3Å
111	D	84.8	Confident	92.5	Very high	137 Å²	137	36.2 Å²	36.2	73%	0.733	22%	0.223	S	C	*	.			trans	-120.2	25.2	-180	-61.5	-37.3	0	0	0	111.8	A113 K145	D111-A113 PolarHBondContact O-N 2.92Å; D111-K145 IonicContact OD1-NZ 3.16Å; D111-K145 PolarHBondContact OD1-NZ 3.15Å; D111-K145 VanDerWaalsContact OD1-NZ 3.16Å
112	E	90.7	Very high	92.5	Very high	55 Å²	55	35.3 Å²	35.3	26%	0.257	22%	0.219	S	C	.	.			trans	-67.6	126.5	169.5	-147.4	168.4	-166.2	0	0	110.2	V106 F114 R151	V106-E112 WeakPolarHBondContact CA-O 3.4Å; E112-F114 HydrophobicContact CB-CD2 4.39Å; E112-F114 HydrophobicContact CB-CE2 3.75Å; E112-F114 HydrophobicContact CB-CZ 3.96Å; E112-F114 HydrophobicContact CG-CE1 4.23Å; E112-F114 HydrophobicContact CG-CE2 4.11Å; E112-F114 HydrophobicContact CG-CZ 3.87Å; E112-F114 WeakPolarHBondContact OE2-CZ 3.23Å; E112-R151 HydrophobicContact CB-CG 4.23Å; E112-R151 VanDerWaalsContact CG-CZ 3.42Å; E112-R151 IonicContact OE1-CZ 3.83Å; E112-R151 IonicContact OE1-NH1 3.07Å; E112-R151 PolarHBondContact OE1-NH1 3Å; E112-R151 VanDerWaalsContact OE1-NH1 3.07Å; E112-R151 WeakPolarHBondContact OE2-CD 3.33Å; E112-R151 WeakPolarHBondContact OE2-CG 3.36Å; E112-R151 IonicContact OE2-CZ 2.92Å; E112-R151 IonicContact OE2-NE 3Å; E112-R151 PolarHBondContact OE2-NE 2.75Å; E112-R151 IonicContact OE2-NH1 2.68Å; E112-R151 PolarHBondContact OE2-NH1 3.46Å; E112-R151 IonicContact OE2-NH2 3.79Å
113	A	92.2	Very high	92.5	Very high	61 Å²	61	36.4 Å²	36.4	50%	0.504	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	120.8	172.7	0	0	0	0	0	110.1	T104 D111 P115	T104-A113 HydrophobicContact CG2-CB 3.52Å; D111-A113 PolarHBondContact O-N 2.92Å; A113-P115 WeakPolarHBondContact O-CD 3.46Å
114	F	95.4	Very high	92.4	Very high	14 Å²	14	38.6 Å²	38.6	6%	0.061	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	99.1	172.6	-60.5	-80.9	0	0	0	109.7	T104 L105 E112 V116 R151 L154 K155 I158	T104-F114 WeakPolarHBondContact CA-O 3.5Å; L105-F114 PolarHBondContact N-O 3.24Å; L105-F114 PolarHBondContact O-N 3.07Å; E112-F114 HydrophobicContact CB-CD2 4.39Å; E112-F114 HydrophobicContact CB-CE2 3.75Å; E112-F114 HydrophobicContact CB-CZ 3.96Å; E112-F114 HydrophobicContact CG-CE1 4.23Å; E112-F114 HydrophobicContact CG-CE2 4.11Å; E112-F114 HydrophobicContact CG-CZ 3.87Å; E112-F114 WeakPolarHBondContact OE2-CZ 3.23Å; F114-V116 PolarHBondContact O-N 3.01Å; F114-R151 HydrophobicContact CE2-CG 4.37Å; F114-R151 HydrophobicContact CZ-CG 4.07Å; F114-L154 HydrophobicContact CD2-CD2 3.84Å; F114-L154 HydrophobicContact CD2-CG 4.33Å; F114-L154 HydrophobicContact CE2-CD2 4.04Å; F114-L154 HydrophobicContact CE2-CG 4.41Å; F114-K155 HydrophobicContact CE1-CB 3.89Å; F114-K155 HydrophobicContact CE1-CD 4.35Å; F114-K155 HydrophobicContact CE1-CG 4.03Å; F114-K155 HydrophobicContact CZ-CB 3.93Å; F114-I158 HydrophobicContact CB-CD1 3.65Å; F114-I158 HydrophobicContact CD1-CD1 4.34Å; F114-I158 HydrophobicContact CD2-CD1 4.42Å; F114-I158 HydrophobicContact CG-CD1 3.91Å
115	P	95.7	Very high	92.4	Very high	52 Å²	52	37 Å²	37	34%	0.338	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	129.1	172.6	27.9	-32.6	0	0	0	109.7	R95 C101 A113	R95-P115 WeakPolarHBondContact CG-O 3.34Å; C101-P115 HydrophobicContact CB-CB 4.01Å; A113-P115 WeakPolarHBondContact O-CD 3.46Å
116	V	96.6	Very high	92.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	173.5	-178.3	-59.6	0	0	0	0	111	C101 D102 V103 L105 F114 M121 I158 Y162	C101-V116 WeakPolarHBondContact CA-O 3.32Å; D102-V116 PolarHBondContact N-O 3.08Å; V103-V116 HydrophobicContact CG1-CG2 3.5Å; V103-V116 PolarHBondContact N-O 3.19Å; V103-V116 PolarHBondContact O-N 3.36Å; V103-V116 VanDerWaalsContact O-O 3.06Å; L105-V116 HydrophobicContact CD1-CG2 3.87Å; L105-V116 HydrophobicContact CG-CG2 3.84Å; F114-V116 PolarHBondContact O-N 3.01Å; V116-M121 HydrophobicContact CB-CG 4.19Å; V116-M121 HydrophobicContact CB-SD 4.23Å; V116-M121 HydrophobicContact CG1-SD 4.4Å; V116-M121 HydrophobicContact CG2-CG 3.81Å; V116-M121 HydrophobicContact CG2-SD 4.29Å; V116-I158 HydrophobicContact CG1-CD1 4Å; V116-I158 HydrophobicContact CG1-CG1 4.3Å; V116-I158 HydrophobicContact CG1-CG2 3.87Å; V116-Y162 HydrophobicContact CG1-CE2 4.49Å
117	H	96	Very high	92.3	Very high	10 Å²	10	44 Å²	44	5%	0.046	27%	0.271	C	S	.	.			trans	-105.8	121.2	178	-53.7	79.7	0	0	0	110	L99 L100 D102 A119 M120 M121 Y162	L99-H117 PolarHBondContact O-NE2 3.23Å; L99-H117 VanDerWaalsContact O-NE2 3.17Å; L100-H117 PolarHBondContact O-CD2 3.4Å; D102-H117 VanDerWaalsContact OD1-CA 3.28Å; D102-H117 WeakPolarHBondContact OD1-CA 3.4Å; H117-A119 PolarHBondContact O-N 3.5Å; H117-M120 HydrophobicContact CB-CB 4.24Å; H117-M120 HydrophobicContact CB-CG 4.14Å; H117-M120 PolarHBondContact O-N 3.49Å; H117-M121 WeakPolarHBondContact O-CG 3.34Å; H117-M121 PolarHBondContact O-N 3.42Å; H117-M121 VanDerWaalsContact O-N 3.15Å; H117-Y162 WeakPolarHBondContact CB-OH 3.34Å; H117-Y162 PolarHBondContact N-OH 2.97Å; H117-Y162 AromaticContact ND1-CE1 3.73Å; H117-Y162 AromaticContact ND1-CZ 3.68Å; H117-Y162 PolarHBondContact ND1-OH 3.02Å
118	R	94	Very high	92.4	Very high	36 Å²	36	44 Å²	44	14%	0.136	27%	0.27	C	S	.	.	H	α-helix	trans	-52.1	-41.7	-179.7	-73.2	173.5	165.1	-106.5	-7.8	112.1	D102 V103 M120 M121 A122 F132 E138 Q139 L141	D102-R118 WeakPolarHBondContact OD1-CG 3.42Å; D102-R118 PolarHBondContact OD1-N 3.48Å; D102-R118 WeakPolarHBondContact OD2-CB 3.25Å; V103-R118 HydrophobicContact CB-CG 3.82Å; V103-R118 HydrophobicContact CG1-CG 3.57Å; R118-M120 PolarHBondContact O-N 2.95Å; R118-M121 PolarHBondContact O-N 3.24Å; R118-A122 VanDerWaalsContact O-CB 3.23Å; R118-A122 WeakPolarHBondContact O-CB 3.36Å; R118-A122 PolarHBondContact O-N 3.35Å; R118-F132 HydrophobicContact CB-CD2 3.75Å; R118-F132 HydrophobicContact CB-CE2 3.94Å; R118-F132 HydrophobicContact CB-CG 4.38Å; R118-F132 HydrophobicContact CG-CD1 4.48Å; R118-F132 HydrophobicContact CG-CD2 3.91Å; R118-F132 HydrophobicContact CG-CE1 4.46Å; R118-F132 HydrophobicContact CG-CE2 3.88Å; R118-F132 HydrophobicContact CG-CG 4.23Å; R118-F132 HydrophobicContact CG-CZ 4.18Å; R118-E138 PolarHBondContact NH2-O 3.42Å; R118-Q139 PolarHBondContact NH1-O 2.85Å; R118-Q139 PolarHBondContact NH2-O 3.43Å; R118-L141 PolarHBondContact NH2-O 3.08Å
119	A	93.2	Very high	92.7	Very high	73 Å²	73	48.1 Å²	48.1	60%	0.603	28%	0.282	S	S	*	.	H	α-helix	trans	-60.9	-43.5	179.2	0	0	0	0	0	112.7	H117 S123	H117-A119 PolarHBondContact O-N 3.5Å; A119-S123 WeakPolarHBondContact O-CB 3.32Å; A119-S123 PolarHBondContact O-N 2.98Å; A119-S123 PolarHBondContact O-OG 3.2Å
120	M	94.6	Very high	93	Very high	20 Å²	20	45.6 Å²	45.6	10%	0.099	28%	0.276	C	S	.	.	H	α-helix	trans	-67.6	-39.4	178.5	-74.4	-59.7	-58.3	0	0	112.1	L88 F91 H117 R118 S123 S124 I161 Y162	L88-M120 HydrophobicContact CD2-CE 3.63Å; F91-M120 HydrophobicContact CB-SD 4.46Å; F91-M120 HydrophobicContact CD1-CG 4.01Å; F91-M120 HydrophobicContact CD1-SD 4.35Å; F91-M120 HydrophobicContact CD2-SD 4Å; F91-M120 HydrophobicContact CE1-CG 4.37Å; F91-M120 HydrophobicContact CE2-SD 4.32Å; F91-M120 HydrophobicContact CG-CG 4.18Å; F91-M120 HydrophobicContact CG-SD 4.02Å; H117-M120 HydrophobicContact CB-CB 4.24Å; H117-M120 HydrophobicContact CB-CG 4.14Å; H117-M120 PolarHBondContact O-N 3.49Å; R118-M120 PolarHBondContact O-N 2.95Å; M120-S123 PolarHBondContact O-OG 3Å; M120-S124 WeakPolarHBondContact O-CB 3.46Å; M120-S124 PolarHBondContact O-N 2.91Å; M120-S124 PolarHBondContact O-OG 2.76Å; M120-I161 HydrophobicContact CB-CG2 4.41Å; M120-I161 HydrophobicContact CE-CG2 4.31Å; M120-Y162 HydrophobicContact CB-CE1 4.34Å; M120-Y162 HydrophobicContact CB-CE2 4.37Å; M120-Y162 HydrophobicContact CG-CE1 4.02Å
121	M	95.1	Very high	93.5	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-70	-46.2	178.1	-58.5	-53.4	-64.4	0	0	111	L105 V116 H117 R118 S123 S124 S125 F128 F132 I158 I161 Y162	L105-M121 HydrophobicContact CD1-CE 4.01Å; V116-M121 HydrophobicContact CB-CG 4.19Å; V116-M121 HydrophobicContact CB-SD 4.23Å; V116-M121 HydrophobicContact CG1-SD 4.4Å; V116-M121 HydrophobicContact CG2-CG 3.81Å; V116-M121 HydrophobicContact CG2-SD 4.29Å; H117-M121 WeakPolarHBondContact O-CG 3.34Å; H117-M121 PolarHBondContact O-N 3.42Å; H117-M121 VanDerWaalsContact O-N 3.15Å; R118-M121 PolarHBondContact O-N 3.24Å; M121-S123 PolarHBondContact O-N 3.36Å; M121-S124 PolarHBondContact O-N 3.41Å; M121-S125 WeakPolarHBondContact O-CB 3.41Å; M121-S125 PolarHBondContact O-N 3.41Å; M121-S125 VanDerWaalsContact O-N 3.08Å; M121-F128 HydrophobicContact CB-CB 3.98Å; M121-F128 HydrophobicContact CB-CD1 4.48Å; M121-F128 HydrophobicContact CB-CD2 3.88Å; M121-F128 HydrophobicContact CB-CG 3.87Å; M121-F128 HydrophobicContact CE-CD2 3.68Å; M121-F128 HydrophobicContact CE-CE2 3.21Å; M121-F128 HydrophobicContact CE-CZ 3.7Å; M121-F132 HydrophobicContact CB-CE2 3.98Å; M121-I158 HydrophobicContact CE-CG1 4.19Å; M121-I161 HydrophobicContact CE-CD1 3.41Å; M121-I161 VanDerWaalsContact CE-CD1 3.41Å; M121-I161 HydrophobicContact SD-CD1 3.79Å; M121-I161 HydrophobicContact SD-CG2 4.26Å; M121-Y162 HydrophobicContact SD-CE2 4.31Å
122	A	94.4	Very high	93.9	Very high	19 Å²	19	39.2 Å²	39.2	16%	0.157	24%	0.236	C	C	.	.	H	α-helix	trans	-68.3	-28.7	178.9	0	0	0	0	0	113.7	R118 S124 K129 F132	R118-A122 VanDerWaalsContact O-CB 3.23Å; R118-A122 WeakPolarHBondContact O-CB 3.36Å; R118-A122 PolarHBondContact O-N 3.35Å; A122-S124 PolarHBondContact O-N 2.91Å; A122-K129 HydrophobicContact CB-CB 4.15Å; A122-F132 HydrophobicContact CB-CD2 4.21Å
123	S	93.4	Very high	93.8	Very high	88 Å²	88	41.4 Å²	41.4	62%	0.615	25%	0.254	S	S	*	.	H	α-helix	trans	-71	-23.9	174.1	64.2	0	0	0	0	112.9	A119 M120 M121	A119-S123 WeakPolarHBondContact O-CB 3.32Å; A119-S123 PolarHBondContact O-N 2.98Å; A119-S123 PolarHBondContact O-OG 3.2Å; M120-S123 PolarHBondContact O-OG 3Å; M121-S123 PolarHBondContact O-N 3.36Å
124	S	93	Very high	93.2	Very high	49 Å²	49	41.1 Å²	41.1	34%	0.343	26%	0.257	S	S	.	.	H	α-helix	trans	-108.1	-9.4	-169.5	-45.9	0	0	0	0	113.3	M120 M121 A122 I185	M120-S124 WeakPolarHBondContact O-CB 3.46Å; M120-S124 PolarHBondContact O-N 2.91Å; M120-S124 PolarHBondContact O-OG 2.76Å; M121-S124 PolarHBondContact O-N 3.41Å; A122-S124 PolarHBondContact O-N 2.91Å; S124-I185 WeakPolarHBondContact O-CD1 3.35Å
125	S	95.4	Very high	92.5	Very high	4 Å²	4	43.5 Å²	43.5	3%	0.028	29%	0.286	C	S	.	.			trans	-149.5	124.2	-173.8	170.6	0	0	0	0	110.9	M121 Y127 F128 K129 L183	M121-S125 WeakPolarHBondContact O-CB 3.41Å; M121-S125 PolarHBondContact O-N 3.41Å; M121-S125 VanDerWaalsContact O-N 3.08Å; S125-Y127 PolarHBondContact O-N 2.84Å; S125-Y127 WeakPolarHBondContact OG-CB 3.43Å; S125-Y127 PolarHBondContact OG-N 3.37Å; S125-F128 PolarHBondContact O-N 2.99Å; S125-F128 WeakPolarHBondContact OG-CD2 3.49Å; S125-F128 PolarHBondContact OG-N 3.49Å; S125-K129 WeakPolarHBondContact O-CB 3.4Å; S125-K129 PolarHBondContact O-N 3.27Å; S125-L183 PolarHBondContact OG-O 2.94Å
126	D	93.1	Very high	91.9	Very high	103 Å²	103	45.8 Å²	45.8	55%	0.551	29%	0.293	S	S	*	.	H	α-helix	trans	-66.6	-28.5	173.7	-73.6	-39.6	0	0	0	112.2	K129 A130	D126-K129 PolarHBondContact O-N 3.04Å; D126-A130 WeakPolarHBondContact O-CB 3.44Å; D126-A130 PolarHBondContact O-N 2.91Å
127	Y	93.9	Very high	91.3	Very high	57 Å²	57	53.7 Å²	53.7	22%	0.224	33%	0.327	C	S	.	.	H	α-helix	trans	-60.5	-52.5	172.9	176.3	-93.9	0	0	0	111.4	S125 K129 A130 M131 L146 F182 L183	S125-Y127 PolarHBondContact O-N 2.84Å; S125-Y127 WeakPolarHBondContact OG-CB 3.43Å; S125-Y127 PolarHBondContact OG-N 3.37Å; Y127-K129 VanDerWaalsContact C-N 3.33Å; Y127-K129 PolarHBondContact O-N 3.48Å; Y127-A130 PolarHBondContact O-N 2.9Å; Y127-M131 HydrophobicContact CD1-CE 4.29Å; Y127-M131 HydrophobicContact CE1-CE 3.3Å; Y127-M131 HydrophobicContact CE2-CE 4.47Å; Y127-M131 VanDerWaalsContact CZ-CE 3.42Å; Y127-M131 WeakPolarHBondContact O-CB 3.4Å; Y127-M131 PolarHBondContact O-N 2.9Å; Y127-M131 WeakPolarHBondContact OH-CE 3.41Å; Y127-L146 HydrophobicContact CE1-CD2 4.19Å; Y127-F182 HydrophobicContact CE1-CE1 4.15Å; Y127-F182 HydrophobicContact CE2-CE1 4.1Å; Y127-F182 HydrophobicContact CE2-CZ 4.29Å; Y127-F182 AromaticContact CZ-CE1 3.64Å; Y127-F182 WeakPolarHBondContact OH-CE1 3.33Å; Y127-L183 HydrophobicContact CD1-CD2 3.71Å; Y127-L183 HydrophobicContact CE1-CD2 3.76Å
128	F	94.5	Very high	90.8	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-67.7	-35.5	177.8	-73	-59.2	0	0	0	112.2	L105 M121 S125 M131 F132 L146 L183	L105-F128 HydrophobicContact CD1-CE1 3.87Å; L105-F128 HydrophobicContact CD1-CZ 3.76Å; L105-F128 HydrophobicContact CD2-CE1 4.21Å; M121-F128 HydrophobicContact CB-CB 3.98Å; M121-F128 HydrophobicContact CB-CD1 4.48Å; M121-F128 HydrophobicContact CB-CD2 3.88Å; M121-F128 HydrophobicContact CB-CG 3.87Å; M121-F128 HydrophobicContact CE-CD2 3.68Å; M121-F128 HydrophobicContact CE-CE2 3.21Å; M121-F128 HydrophobicContact CE-CZ 3.7Å; S125-F128 PolarHBondContact O-N 2.99Å; S125-F128 WeakPolarHBondContact OG-CD2 3.49Å; S125-F128 PolarHBondContact OG-N 3.49Å; F128-M131 HydrophobicContact CD1-SD 4.38Å; F128-M131 PolarHBondContact O-N 3.47Å; F128-F132 HydrophobicContact CB-CD2 4.27Å; F128-F132 HydrophobicContact CB-CE2 3.89Å; F128-F132 HydrophobicContact CB-CZ 4.4Å; F128-F132 HydrophobicContact CD1-CE1 4.45Å; F128-F132 HydrophobicContact CD1-CE2 4.03Å; F128-F132 AromaticContact CD1-CZ 3.72Å; F128-F132 HydrophobicContact CD1-CZ 3.72Å; F128-F132 HydrophobicContact CE1-CZ 4.46Å; F128-F132 HydrophobicContact CG-CE2 4.27Å; F128-F132 HydrophobicContact CG-CZ 4.41Å; F128-F132 WeakPolarHBondContact O-CB 3.33Å; F128-F132 VanDerWaalsContact O-CD2 3.28Å; F128-F132 WeakPolarHBondContact O-CD2 3.31Å; F128-F132 VanDerWaalsContact O-CG 3.25Å; F128-F132 WeakPolarHBondContact O-CG 3.41Å; F128-F132 PolarHBondContact O-N 2.95Å; F128-L146 HydrophobicContact CE1-CD1 4.17Å; F128-L146 HydrophobicContact CZ-CD1 4.1Å; F128-L183 HydrophobicContact CE1-CD2 4.28Å; F128-L183 HydrophobicContact CE2-CB 4.31Å; F128-L183 HydrophobicContact CE2-CD1 4.08Å; F128-L183 HydrophobicContact CE2-CD2 3.82Å; F128-L183 HydrophobicContact CE2-CG 4.29Å; F128-L183 HydrophobicContact CZ-CD1 4.14Å; F128-L183 HydrophobicContact CZ-CD2 3.55Å; F128-L183 HydrophobicContact CZ-CG 4.37Å
129	K	93.4	Very high	90.5	Very high	107 Å²	107	58 Å²	58	47%	0.465	35%	0.349	S	S	.	.	H	α-helix	trans	-59.2	-49.1	174.4	-170.9	177	176.9	-177	0	111.3	A122 S125 D126 Y127 F132 T133	A122-K129 HydrophobicContact CB-CB 4.15Å; S125-K129 WeakPolarHBondContact O-CB 3.4Å; S125-K129 PolarHBondContact O-N 3.27Å; D126-K129 PolarHBondContact O-N 3.04Å; Y127-K129 VanDerWaalsContact C-N 3.33Å; Y127-K129 PolarHBondContact O-N 3.48Å; K129-F132 PolarHBondContact O-N 3.05Å; K129-T133 WeakPolarHBondContact O-CB 3.3Å; K129-T133 PolarHBondContact O-N 2.68Å; K129-T133 PolarHBondContact O-OG1 3.07Å
130	A	92.2	Very high	90.2	Very high	53 Å²	53	61.1 Å²	61.1	44%	0.438	36%	0.355	S	S	.	.	H	α-helix	trans	-63.2	-43.5	176.5	0	0	0	0	0	111.7	D126 Y127 F132 G134	D126-A130 WeakPolarHBondContact O-CB 3.44Å; D126-A130 PolarHBondContact O-N 2.91Å; Y127-A130 PolarHBondContact O-N 2.9Å; A130-F132 PolarHBondContact O-N 3.37Å; A130-G134 WeakPolarHBondContact O-CA 3.24Å; A130-G134 PolarHBondContact O-N 3Å
131	M	91.6	Very high	89.9	Confident	9 Å²	9	63.4 Å²	63.4	4%	0.044	37%	0.368	C	S	.	.	H	α-helix	trans	-60.4	-42.9	178.2	-177.2	-177.6	-73.1	0	0	112.9	Y127 F128 E138 I144 L146	Y127-M131 HydrophobicContact CD1-CE 4.29Å; Y127-M131 HydrophobicContact CE1-CE 3.3Å; Y127-M131 HydrophobicContact CE2-CE 4.47Å; Y127-M131 VanDerWaalsContact CZ-CE 3.42Å; Y127-M131 WeakPolarHBondContact O-CB 3.4Å; Y127-M131 PolarHBondContact O-N 2.9Å; Y127-M131 WeakPolarHBondContact OH-CE 3.41Å; F128-M131 HydrophobicContact CD1-SD 4.38Å; F128-M131 PolarHBondContact O-N 3.47Å; M131-E138 HydrophobicContact CG-CB 3.7Å; M131-E138 HydrophobicContact CG-CG 4.37Å; M131-E138 HydrophobicContact SD-CB 4.09Å; M131-E138 HydrophobicContact SD-CG 4.41Å; M131-I144 HydrophobicContact SD-CD1 4.03Å; M131-I144 HydrophobicContact SD-CG2 4.08Å; M131-L146 HydrophobicContact CE-CD2 3.97Å
132	F	92.4	Very high	89.6	Confident	13 Å²	13	69.9 Å²	69.9	6%	0.057	40%	0.4	C	S	.	.	H	α-helix	trans	-88.5	-17.6	-174.4	-58.7	-26.8	0	0	0	114.3	V103 R118 M121 A122 F128 K129 A130 Q139 I144	V103-F132 HydrophobicContact CG1-CZ 4.33Å; R118-F132 HydrophobicContact CB-CD2 3.75Å; R118-F132 HydrophobicContact CB-CE2 3.94Å; R118-F132 HydrophobicContact CB-CG 4.38Å; R118-F132 HydrophobicContact CG-CD1 4.48Å; R118-F132 HydrophobicContact CG-CD2 3.91Å; R118-F132 HydrophobicContact CG-CE1 4.46Å; R118-F132 HydrophobicContact CG-CE2 3.88Å; R118-F132 HydrophobicContact CG-CG 4.23Å; R118-F132 HydrophobicContact CG-CZ 4.18Å; M121-F132 HydrophobicContact CB-CE2 3.98Å; A122-F132 HydrophobicContact CB-CD2 4.21Å; F128-F132 HydrophobicContact CB-CD2 4.27Å; F128-F132 HydrophobicContact CB-CE2 3.89Å; F128-F132 HydrophobicContact CB-CZ 4.4Å; F128-F132 HydrophobicContact CD1-CE1 4.45Å; F128-F132 HydrophobicContact CD1-CE2 4.03Å; F128-F132 AromaticContact CD1-CZ 3.72Å; F128-F132 HydrophobicContact CD1-CZ 3.72Å; F128-F132 HydrophobicContact CE1-CZ 4.46Å; F128-F132 HydrophobicContact CG-CE2 4.27Å; F128-F132 HydrophobicContact CG-CZ 4.41Å; F128-F132 WeakPolarHBondContact O-CB 3.33Å; F128-F132 VanDerWaalsContact O-CD2 3.28Å; F128-F132 WeakPolarHBondContact O-CD2 3.31Å; F128-F132 VanDerWaalsContact O-CG 3.25Å; F128-F132 WeakPolarHBondContact O-CG 3.41Å; F128-F132 PolarHBondContact O-N 2.95Å; K129-F132 PolarHBondContact O-N 3.05Å; A130-F132 PolarHBondContact O-N 3.37Å; F132-Q139 WeakPolarHBondContact O-CG 3.43Å; F132-I144 HydrophobicContact CD1-CD1 4.48Å; F132-I144 HydrophobicContact CE1-CD1 3.63Å; F132-I144 HydrophobicContact CZ-CD1 4.47Å
133	T	89	Confident	89.5	Confident	101 Å²	101	72.5 Å²	72.5	62%	0.62	42%	0.416	S	S	*	.	H	α-helix	trans	-121.6	-10.1	-176.3	68.6	0	0	0	0	114.2	K129 G135	K129-T133 WeakPolarHBondContact O-CB 3.3Å; K129-T133 PolarHBondContact O-N 2.68Å; K129-T133 PolarHBondContact O-OG1 3.07Å; T133-G135 PolarHBondContact O-N 3.26Å
134	G	81	Confident	89.4	Confident	56 Å²	56	68.5 Å²	68.5	58%	0.577	39%	0.388	S	S	*	.	S	Bend	trans	-89.5	10.4	-173.6	0	0	0	0	0	115.5	A130 M136	A130-G134 WeakPolarHBondContact O-CA 3.24Å; A130-G134 PolarHBondContact O-N 3Å; G134-M136 VanDerWaalsContact C-N 3.31Å; G134-M136 PolarHBondContact O-N 3.34Å
135	G	79.5	Confident	89.4	Confident	64 Å²	64	70.3 Å²	70.3	66%	0.66	39%	0.389	S	S	*	.			trans	72	22.2	-179.5	0	0	0	0	0	114.3	T133 Q139	T133-G135 PolarHBondContact O-N 3.26Å; G135-Q139 VanDerWaalsContact CA-OE1 3.32Å; G135-Q139 VanDerWaalsContact N-OE1 3.15Å
136	M	84.5	Confident	89.2	Confident	100 Å²	100	70.2 Å²	70.2	49%	0.493	39%	0.389	S	S	.	.			trans	-73.8	157.6	174.1	-54.5	-167.9	110.6	0	0	110.5	G134 E138 Q139	G134-M136 VanDerWaalsContact C-N 3.31Å; G134-M136 PolarHBondContact O-N 3.34Å; M136-E138 WeakPolarHBondContact CB-OE2 3.26Å; M136-E138 PolarHBondContact O-N 2.95Å; M136-E138 VanDerWaalsContact O-N 3.17Å; M136-Q139 WeakPolarHBondContact O-CB 3.34Å; M136-Q139 PolarHBondContact O-N 3.28Å
137	K	83.4	Confident	88.9	Confident	166 Å²	166	72.6 Å²	72.6	72%	0.722	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-59.4	-32	-178.7	-175.1	-179.4	177.1	-175.5	0	111.9	Q139 D140	K137-Q139 PolarHBondContact O-N 3.33Å; K137-D140 PolarHBondContact O-N 2.96Å
138	E	86.1	Confident	88.5	Confident	66 Å²	66	71 Å²	71	31%	0.308	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-63.8	-19.6	178	-65.9	74	-165.2	0	0	112.8	R118 M131 M136 D140 L141 I144	R118-E138 PolarHBondContact NH2-O 3.42Å; M131-E138 HydrophobicContact CG-CB 3.7Å; M131-E138 HydrophobicContact CG-CG 4.37Å; M131-E138 HydrophobicContact SD-CB 4.09Å; M131-E138 HydrophobicContact SD-CG 4.41Å; M136-E138 WeakPolarHBondContact CB-OE2 3.26Å; M136-E138 PolarHBondContact O-N 2.95Å; M136-E138 VanDerWaalsContact O-N 3.17Å; E138-D140 PolarHBondContact O-N 3.47Å; E138-L141 PolarHBondContact O-N 3.4Å; E138-I144 HydrophobicContact CB-CD1 4.08Å; E138-I144 HydrophobicContact CB-CG1 4.39Å; E138-I144 HydrophobicContact CG-CG2 4.19Å
139	Q	85.9	Confident	88.3	Confident	70 Å²	70	71.2 Å²	71.2	33%	0.327	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-58.5	-37	177.1	179.3	173.1	-27	0	0	112.1	R118 F132 G135 M136 K137	R118-Q139 PolarHBondContact NH1-O 2.85Å; R118-Q139 PolarHBondContact NH2-O 3.43Å; F132-Q139 WeakPolarHBondContact O-CG 3.43Å; G135-Q139 VanDerWaalsContact CA-OE1 3.32Å; G135-Q139 VanDerWaalsContact N-OE1 3.15Å; M136-Q139 WeakPolarHBondContact O-CB 3.34Å; M136-Q139 PolarHBondContact O-N 3.28Å; K137-Q139 PolarHBondContact O-N 3.33Å
140	D	86.9	Confident	88.3	Confident	138 Å²	138	67.2 Å²	67.2	74%	0.738	38%	0.382	S	S	*	.	G	3₁₀ helix	trans	-97.5	-0.7	-177.2	-60	-44.1	0	0	0	113.1	K137 E138	K137-D140 PolarHBondContact O-N 2.96Å; E138-D140 PolarHBondContact O-N 3.47Å
141	L	89.6	Confident	88.4	Confident	68 Å²	68	69.6 Å²	69.6	36%	0.356	38%	0.379	S	S	.	.			trans	-85.7	134.1	-179.3	-63.6	-178.9	0	0	0	111.7	R118 E138 I144	R118-L141 PolarHBondContact NH2-O 3.08Å; E138-L141 PolarHBondContact O-N 3.4Å; L141-I144 HydrophobicContact CB-CG1 4.07Å
142	M	88	Confident	88.4	Confident	137 Å²	137	73.4 Å²	73.4	68%	0.675	40%	0.399	S	S	*	.	S	Bend	trans	-81.7	-20.4	171.8	-69.7	-67.4	165.1	0	0	112.7	T104	T104-M142 PolarHBondContact N-O 2.96Å
143	C	91.9	Very high	88.5	Confident	73 Å²	73	72.8 Å²	72.8	49%	0.493	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	122.7	177.6	-175.4	0	0	0	0	109.4	T104	T104-C143 CarbonylContact O-C 3.57Å; T104-C143 WeakPolarHBondContact O-CA 3.25Å
144	I	93.1	Very high	88.7	Confident	4 Å²	4	68 Å²	68	2%	0.021	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	122.7	-175.3	-58.9	170.8	0	0	0	108.7	V103 T104 L105 V106 M131 F132 E138 L141 L146	V103-I144 HydrophobicContact CG2-CD1 3.64Å; V103-I144 HydrophobicContact CG2-CG1 4.09Å; T104-I144 PolarHBondContact O-N 3.27Å; L105-I144 HydrophobicContact CD2-CB 4.1Å; V106-I144 PolarHBondContact N-O 3.16Å; M131-I144 HydrophobicContact SD-CD1 4.03Å; M131-I144 HydrophobicContact SD-CG2 4.08Å; F132-I144 HydrophobicContact CD1-CD1 4.48Å; F132-I144 HydrophobicContact CE1-CD1 3.63Å; F132-I144 HydrophobicContact CZ-CD1 4.47Å; E138-I144 HydrophobicContact CB-CD1 4.08Å; E138-I144 HydrophobicContact CB-CG1 4.39Å; E138-I144 HydrophobicContact CG-CG2 4.19Å; L141-I144 HydrophobicContact CB-CG1 4.07Å; I144-L146 HydrophobicContact CG2-CD2 4.06Å
145	K	92	Very high	89.4	Confident	87 Å²	87	70.2 Å²	70.2	38%	0.378	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	122.3	175.4	-166.7	159.3	-173.2	155.6	0	110.3	V106 A107 G108 G110 D111	V106-K145 HydrophobicContact CB-CG 4.49Å; V106-K145 HydrophobicContact CG1-CG 4.44Å; V106-K145 CarbonylContact O-C 3.53Å; V106-K145 WeakPolarHBondContact O-CA 3.19Å; A107-K145 WeakPolarHBondContact O-CE 3.32Å; G108-K145 WeakPolarHBondContact O-CE 3.42Å; G110-K145 PolarHBondContact O-NZ 3.3Å; D111-K145 IonicContact OD1-NZ 3.16Å; D111-K145 PolarHBondContact OD1-NZ 3.15Å; D111-K145 VanDerWaalsContact OD1-NZ 3.16Å
146	L	92.2	Very high	90.1	Very high	3 Å²	3	69.3 Å²	69.3	2%	0.016	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	93.5	-176.5	-62.4	173.9	0	0	0	110	L105 V106 G108 Y127 F128 M131 I144 G148 V149 L154 L183	L105-L146 HydrophobicContact CB-CD1 4.45Å; L105-L146 HydrophobicContact CD1-CD1 4.32Å; L105-L146 HydrophobicContact CD2-CD1 4.3Å; V106-L146 PolarHBondContact O-N 3.4Å; G108-L146 VanDerWaalsContact CA-O 3.32Å; G108-L146 WeakPolarHBondContact CA-O 3.26Å; G108-L146 PolarHBondContact N-O 2.91Å; Y127-L146 HydrophobicContact CE1-CD2 4.19Å; F128-L146 HydrophobicContact CE1-CD1 4.17Å; F128-L146 HydrophobicContact CZ-CD1 4.1Å; M131-L146 HydrophobicContact CE-CD2 3.97Å; I144-L146 HydrophobicContact CG2-CD2 4.06Å; L146-G148 PolarHBondContact O-N 3.46Å; L146-V149 HydrophobicContact CB-CG2 3.61Å; L146-V149 HydrophobicContact CD1-CG2 4.15Å; L146-V149 PolarHBondContact O-N 3.3Å; L146-L154 HydrophobicContact CD1-CD1 3.97Å; L146-L154 HydrophobicContact CD1-CD2 4.33Å; L146-L183 HydrophobicContact CD1-CD2 4.31Å
147	H	86.8	Confident	90.7	Very high	153 Å²	153	64.5 Å²	64.5	71%	0.708	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-14	-174.5	-70	-69	0	0	0	115.5
148	G	83.9	Confident	91.2	Very high	22 Å²	22	56.7 Å²	56.7	23%	0.227	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	8.3	-178.6	0	0	0	0	0	115.3	L146	L146-G148 PolarHBondContact O-N 3.46Å
149	V	91.9	Very high	91.6	Very high	6 Å²	6	55.8 Å²	55.8	4%	0.036	28%	0.278	C	S	.	.	S	Bend	trans	-139	143.9	179.4	-60.5	0	0	0	0	111.2	G108 L146 L154 A179 F182 L183	G108-V149 PolarHBondContact N-O 3.47Å; G108-V149 VanDerWaalsContact N-O 3.08Å; L146-V149 HydrophobicContact CB-CG2 3.61Å; L146-V149 HydrophobicContact CD1-CG2 4.15Å; L146-V149 PolarHBondContact O-N 3.3Å; V149-L154 HydrophobicContact CG2-CB 4.11Å; V149-L154 HydrophobicContact CG2-CD1 4.3Å; V149-L154 HydrophobicContact CG2-CD2 4.34Å; V149-L154 HydrophobicContact CG2-CG 4.48Å; V149-A179 HydrophobicContact CB-CB 4.35Å; V149-A179 HydrophobicContact CG1-CB 4.04Å; V149-F182 HydrophobicContact CG1-CB 3.87Å; V149-F182 HydrophobicContact CG1-CD1 3.56Å; V149-F182 HydrophobicContact CG1-CE1 4.4Å; V149-F182 HydrophobicContact CG1-CG 3.92Å; V149-L183 HydrophobicContact CG1-CD1 4.36Å; V149-L183 HydrophobicContact CG1-CD2 4.5Å; V149-L183 HydrophobicContact CG1-CG 4.15Å
150	N	92.7	Very high	92.1	Very high	23 Å²	23	54.5 Å²	54.5	12%	0.123	27%	0.271	C	S	.	.			trans	-88.4	166.1	174.7	69.5	38	0	0	0	112.5	D109 I152 G153 L154 D175	D109-N150 WeakPolarHBondContact OD1-CA 3.32Å; D109-N150 VanDerWaalsContact OD2-CB 3.24Å; D109-N150 WeakPolarHBondContact OD2-CB 2.96Å; N150-I152 VanDerWaalsContact C-N 3.33Å; N150-I152 PolarHBondContact O-N 2.79Å; N150-I152 PolarHBondContact OD1-N 3.01Å; N150-G153 PolarHBondContact OD1-N 3.44Å; N150-L154 VanDerWaalsContact O-CB 3.26Å; N150-L154 WeakPolarHBondContact O-CB 3.44Å; N150-L154 PolarHBondContact O-N 3.3Å; N150-D175 WeakPolarHBondContact ND2-CB 2.96Å; N150-D175 PolarHBondContact ND2-OD1 3.07Å; N150-D175 WeakPolarHBondContact OD1-CB 3.41Å
151	R	93.4	Very high	92.5	Very high	103 Å²	103	48.3 Å²	48.3	39%	0.389	24%	0.239	S	C	.	.	H	α-helix	trans	-57.1	-42.7	-178.2	-175	-166	-102.5	-121.4	0.3	113	A107 D109 E112 F114 K155	A107-R151 HydrophobicContact CB-CB 4.2Å; D109-R151 PolarHBondContact OD1-N 3.46Å; D109-R151 PolarHBondContact OD2-N 2.73Å; E112-R151 HydrophobicContact CB-CG 4.23Å; E112-R151 VanDerWaalsContact CG-CZ 3.42Å; E112-R151 IonicContact OE1-CZ 3.83Å; E112-R151 IonicContact OE1-NH1 3.07Å; E112-R151 PolarHBondContact OE1-NH1 3Å; E112-R151 VanDerWaalsContact OE1-NH1 3.07Å; E112-R151 WeakPolarHBondContact OE2-CD 3.33Å; E112-R151 WeakPolarHBondContact OE2-CG 3.36Å; E112-R151 IonicContact OE2-CZ 2.92Å; E112-R151 IonicContact OE2-NE 3Å; E112-R151 PolarHBondContact OE2-NE 2.75Å; E112-R151 IonicContact OE2-NH1 2.68Å; E112-R151 PolarHBondContact OE2-NH1 3.46Å; E112-R151 IonicContact OE2-NH2 3.79Å; F114-R151 HydrophobicContact CE2-CG 4.37Å; F114-R151 HydrophobicContact CZ-CG 4.07Å; R151-K155 VanDerWaalsContact O-CB 3.32Å; R151-K155 WeakPolarHBondContact O-CB 3.05Å; R151-K155 PolarHBondContact O-N 2.62Å
152	I	92.6	Very high	92.8	Very high	89 Å²	89	45.1 Å²	45.1	46%	0.456	22%	0.222	S	C	.	.	H	α-helix	trans	-68.4	-51.1	-174.8	-62.1	173.4	0	0	0	110.3	N150 K155 K156 N172 D175	N150-I152 VanDerWaalsContact C-N 3.33Å; N150-I152 PolarHBondContact O-N 2.79Å; N150-I152 PolarHBondContact OD1-N 3.01Å; I152-K155 PolarHBondContact O-N 3.09Å; I152-K156 VanDerWaalsContact O-CG 3.32Å; I152-K156 WeakPolarHBondContact O-CG 3.36Å; I152-K156 PolarHBondContact O-N 3.37Å; I152-N172 HydrophobicContact CG2-CB 4.39Å; I152-D175 HydrophobicContact CB-CB 4.19Å; I152-D175 HydrophobicContact CG2-CB 4.19Å
153	G	93.4	Very high	93	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.8	-47.2	178	0	0	0	0	0	111.7	N150 K155 K156 I157 D175 A179	N150-G153 PolarHBondContact OD1-N 3.44Å; G153-K155 PolarHBondContact O-N 3.24Å; G153-K156 PolarHBondContact O-N 3.19Å; G153-I157 WeakPolarHBondContact O-CG1 3.22Å; G153-I157 PolarHBondContact O-N 3.44Å; G153-D175 WeakPolarHBondContact CA-O 3.32Å; G153-A179 VanDerWaalsContact C-CB 3.48Å
154	L	94.9	Very high	93	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59	-46.1	178.2	-179.3	59.3	0	0	0	111.7	L105 A107 F114 L146 V149 N150 K156 I157 I158 L183	L105-L154 HydrophobicContact CB-CD2 4.31Å; L105-L154 HydrophobicContact CD1-CD1 4.45Å; A107-L154 HydrophobicContact CB-CD2 4.05Å; F114-L154 HydrophobicContact CD2-CD2 3.84Å; F114-L154 HydrophobicContact CD2-CG 4.33Å; F114-L154 HydrophobicContact CE2-CD2 4.04Å; F114-L154 HydrophobicContact CE2-CG 4.41Å; L146-L154 HydrophobicContact CD1-CD1 3.97Å; L146-L154 HydrophobicContact CD1-CD2 4.33Å; V149-L154 HydrophobicContact CG2-CB 4.11Å; V149-L154 HydrophobicContact CG2-CD1 4.3Å; V149-L154 HydrophobicContact CG2-CD2 4.34Å; V149-L154 HydrophobicContact CG2-CG 4.48Å; N150-L154 VanDerWaalsContact O-CB 3.26Å; N150-L154 WeakPolarHBondContact O-CB 3.44Å; N150-L154 PolarHBondContact O-N 3.3Å; L154-K156 PolarHBondContact O-N 3.26Å; L154-I157 PolarHBondContact O-N 3.28Å; L154-I158 HydrophobicContact CD1-CD1 3.92Å; L154-I158 HydrophobicContact CD1-CG1 4.23Å; L154-I158 HydrophobicContact CG-CD1 3.86Å; L154-I158 VanDerWaalsContact O-CG1 3.31Å; L154-I158 WeakPolarHBondContact O-CG1 3.31Å; L154-I158 PolarHBondContact O-N 2.89Å; L154-L183 HydrophobicContact CD1-CD1 4Å
155	K	94.4	Very high	93	Very high	103 Å²	103	48.1 Å²	48.1	45%	0.448	24%	0.239	S	C	.	.	H	α-helix	trans	-59.4	-46.8	176.9	-177.6	178.8	176.8	-176.3	0	111.7	F114 R151 I152 G153 I157 I158 D159	F114-K155 HydrophobicContact CE1-CB 3.89Å; F114-K155 HydrophobicContact CE1-CD 4.35Å; F114-K155 HydrophobicContact CE1-CG 4.03Å; F114-K155 HydrophobicContact CZ-CB 3.93Å; R151-K155 VanDerWaalsContact O-CB 3.32Å; R151-K155 WeakPolarHBondContact O-CB 3.05Å; R151-K155 PolarHBondContact O-N 2.62Å; I152-K155 PolarHBondContact O-N 3.09Å; G153-K155 PolarHBondContact O-N 3.24Å; K155-I157 VanDerWaalsContact C-N 3.33Å; K155-I157 PolarHBondContact O-N 2.71Å; K155-I158 PolarHBondContact O-N 3.5Å; K155-D159 WeakPolarHBondContact O-CB 3.33Å; K155-D159 PolarHBondContact O-N 3.32Å
156	K	95.1	Very high	93.1	Very high	44 Å²	44	45.7 Å²	45.7	19%	0.191	23%	0.23	C	C	.	.	H	α-helix	trans	-60.6	-40.6	179	-74.9	-76.2	-176.6	162	0	112.6	I152 G153 L154 F160 L166 S167 T176	I152-K156 VanDerWaalsContact O-CG 3.32Å; I152-K156 WeakPolarHBondContact O-CG 3.36Å; I152-K156 PolarHBondContact O-N 3.37Å; G153-K156 PolarHBondContact O-N 3.19Å; L154-K156 PolarHBondContact O-N 3.26Å; K156-F160 WeakPolarHBondContact O-CB 3.45Å; K156-F160 PolarHBondContact O-N 3.4Å; K156-L166 HydrophobicContact CB-CD1 4.05Å; K156-L166 HydrophobicContact CD-CD1 4.06Å; K156-S167 PolarHBondContact NZ-O 3.49Å; K156-S167 PolarHBondContact NZ-OG 3.17Å; K156-T176 HydrophobicContact CB-CG2 4.24Å
157	I	96	Very high	93	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-67.4	-43.8	176.6	-66.1	-57.2	0	0	0	111.4	G153 L154 K155 F160 I161 T176 A179 A180 L183 I185 V188	G153-I157 WeakPolarHBondContact O-CG1 3.22Å; G153-I157 PolarHBondContact O-N 3.44Å; L154-I157 PolarHBondContact O-N 3.28Å; K155-I157 VanDerWaalsContact C-N 3.33Å; K155-I157 PolarHBondContact O-N 2.71Å; I157-F160 PolarHBondContact O-N 3.31Å; I157-I161 HydrophobicContact CG2-CD1 3.94Å; I157-I161 WeakPolarHBondContact O-CG1 3.36Å; I157-I161 PolarHBondContact O-N 2.78Å; I157-T176 HydrophobicContact CD1-CG2 4.48Å; I157-A179 HydrophobicContact CG1-CB 3.74Å; I157-A180 HydrophobicContact CD1-CB 3.88Å; I157-L183 HydrophobicContact CB-CD1 4.34Å; I157-L183 HydrophobicContact CG2-CD1 3.91Å; I157-I185 HydrophobicContact CD1-CB 4.47Å; I157-I185 HydrophobicContact CD1-CG1 4.37Å; I157-I185 HydrophobicContact CG2-CD1 4.25Å; I157-I185 HydrophobicContact CG2-CG1 3.73Å; I157-V188 HydrophobicContact CD1-CB 4.24Å; I157-V188 HydrophobicContact CD1-CG1 3.86Å; I157-V188 HydrophobicContact CD1-CG2 4.2Å
158	I	95.2	Very high	93.2	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-61.8	-50.2	176.2	-67.8	168.6	0	0	0	110	L105 F114 V116 M121 L154 K155 F160 I161 Y162	L105-I158 HydrophobicContact CD1-CD1 4.38Å; F114-I158 HydrophobicContact CB-CD1 3.65Å; F114-I158 HydrophobicContact CD1-CD1 4.34Å; F114-I158 HydrophobicContact CD2-CD1 4.42Å; F114-I158 HydrophobicContact CG-CD1 3.91Å; V116-I158 HydrophobicContact CG1-CD1 4Å; V116-I158 HydrophobicContact CG1-CG1 4.3Å; V116-I158 HydrophobicContact CG1-CG2 3.87Å; M121-I158 HydrophobicContact CE-CG1 4.19Å; L154-I158 HydrophobicContact CD1-CD1 3.92Å; L154-I158 HydrophobicContact CD1-CG1 4.23Å; L154-I158 HydrophobicContact CG-CD1 3.86Å; L154-I158 VanDerWaalsContact O-CG1 3.31Å; L154-I158 WeakPolarHBondContact O-CG1 3.31Å; L154-I158 PolarHBondContact O-N 2.89Å; K155-I158 PolarHBondContact O-N 3.5Å; I158-F160 PolarHBondContact O-N 3.38Å; I158-I161 PolarHBondContact O-N 3.25Å; I158-I161 VanDerWaalsContact O-N 3.08Å; I158-Y162 HydrophobicContact CG2-CD2 4.07Å; I158-Y162 HydrophobicContact CG2-CE2 4.24Å; I158-Y162 WeakPolarHBondContact O-CD2 3.28Å; I158-Y162 PolarHBondContact O-N 2.86Å; I158-Y162 VanDerWaalsContact O-N 3.16Å
159	D	94.6	Very high	93.4	Very high	48 Å²	48	45.1 Å²	45.1	26%	0.257	23%	0.232	S	C	.	.	H	α-helix	trans	-58.7	-38.2	178.5	-71	-20.7	0	0	0	111	R95 K155 Y162 T163	R95-D159 IonicContact CZ-OD1 2.7Å; R95-D159 IonicContact NH1-OD1 3.71Å; R95-D159 IonicContact NH2-OD1 2.71Å; R95-D159 PolarHBondContact NH2-OD1 3.08Å; R95-D159 VanDerWaalsContact NH2-OD1 3.15Å; K155-D159 WeakPolarHBondContact O-CB 3.33Å; K155-D159 PolarHBondContact O-N 3.32Å; D159-Y162 PolarHBondContact O-N 3.14Å; D159-T163 VanDerWaalsContact O-CB 3.28Å; D159-T163 WeakPolarHBondContact O-CB 3.41Å; D159-T163 VanDerWaalsContact O-CG2 3.31Å; D159-T163 WeakPolarHBondContact O-CG2 3.31Å; D159-T163 PolarHBondContact O-N 2.91Å; D159-T163 PolarHBondContact O-OG1 3.49Å
160	F	95.9	Very high	92.9	Very high	42 Å²	42	49.8 Å²	49.8	18%	0.184	26%	0.255	C	S	.	.	H	α-helix	trans	-63	-45.2	173.5	171.3	-98.7	0	0	0	112.9	K156 I157 I158 Y162 T163 A164 K165 L166 I185 P187 V188	K156-F160 WeakPolarHBondContact O-CB 3.45Å; K156-F160 PolarHBondContact O-N 3.4Å; I157-F160 PolarHBondContact O-N 3.31Å; I158-F160 PolarHBondContact O-N 3.38Å; F160-Y162 PolarHBondContact O-N 3.1Å; F160-T163 PolarHBondContact O-N 3.27Å; F160-A164 WeakPolarHBondContact O-CA 3.46Å; F160-A164 PolarHBondContact O-N 2.99Å; F160-K165 WeakPolarHBondContact CA-O 3.39Å; F160-L166 HydrophobicContact CD2-CB 4.11Å; F160-I185 HydrophobicContact CD1-CG2 4.03Å; F160-I185 HydrophobicContact CE1-CG2 3.81Å; F160-P187 HydrophobicContact CZ-CB 4.17Å; F160-V188 HydrophobicContact CB-CG2 4.44Å; F160-V188 HydrophobicContact CD1-CG2 3.43Å; F160-V188 VanDerWaalsContact CD1-CG2 3.43Å; F160-V188 HydrophobicContact CD2-CG2 3.98Å; F160-V188 HydrophobicContact CE1-CG2 3.54Å; F160-V188 HydrophobicContact CE2-CG2 4.07Å; F160-V188 HydrophobicContact CG-CG2 3.67Å; F160-V188 HydrophobicContact CZ-CG2 3.86Å
161	I	95.2	Very high	92.6	Very high	9 Å²	9	56.9 Å²	56.9	5%	0.046	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-37.5	-179.9	-72.5	166.8	0	0	0	111.4	M120 M121 I157 I158 I185	M120-I161 HydrophobicContact CB-CG2 4.41Å; M120-I161 HydrophobicContact CE-CG2 4.31Å; M121-I161 HydrophobicContact CE-CD1 3.41Å; M121-I161 VanDerWaalsContact CE-CD1 3.41Å; M121-I161 HydrophobicContact SD-CD1 3.79Å; M121-I161 HydrophobicContact SD-CG2 4.26Å; I157-I161 HydrophobicContact CG2-CD1 3.94Å; I157-I161 WeakPolarHBondContact O-CG1 3.36Å; I157-I161 PolarHBondContact O-N 2.78Å; I158-I161 PolarHBondContact O-N 3.25Å; I158-I161 VanDerWaalsContact O-N 3.08Å; I161-I185 HydrophobicContact CD1-CD1 4.17Å
162	Y	94.8	Very high	92.4	Very high	1 Å²	1	52.8 Å²	52.8	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-87.4	-28.7	-178	-79	-91.7	0	0	0	113.8	F91 D92 R95 V116 H117 M120 M121 I158 D159 F160	F91-Y162 HydrophobicContact CB-CD1 4.03Å; F91-Y162 HydrophobicContact CB-CE1 3.95Å; D92-Y162 HydrophobicContact CB-CD1 4.29Å; R95-Y162 HydrophobicContact CB-CD1 4.44Å; R95-Y162 HydrophobicContact CB-CE1 4.11Å; V116-Y162 HydrophobicContact CG1-CE2 4.49Å; H117-Y162 WeakPolarHBondContact CB-OH 3.34Å; H117-Y162 PolarHBondContact N-OH 2.97Å; H117-Y162 AromaticContact ND1-CE1 3.73Å; H117-Y162 AromaticContact ND1-CZ 3.68Å; H117-Y162 PolarHBondContact ND1-OH 3.02Å; M120-Y162 HydrophobicContact CB-CE1 4.34Å; M120-Y162 HydrophobicContact CB-CE2 4.37Å; M120-Y162 HydrophobicContact CG-CE1 4.02Å; M121-Y162 HydrophobicContact SD-CE2 4.31Å; I158-Y162 HydrophobicContact CG2-CD2 4.07Å; I158-Y162 HydrophobicContact CG2-CE2 4.24Å; I158-Y162 WeakPolarHBondContact O-CD2 3.28Å; I158-Y162 PolarHBondContact O-N 2.86Å; I158-Y162 VanDerWaalsContact O-N 3.16Å; D159-Y162 PolarHBondContact O-N 3.14Å; F160-Y162 PolarHBondContact O-N 3.1Å
163	T	93.4	Very high	92.3	Very high	51 Å²	51	48.7 Å²	48.7	31%	0.313	25%	0.252	S	S	.	.	H	α-helix	trans	-111.4	-13.2	-172.9	69.5	0	0	0	0	114.6	D159 F160 K165	D159-T163 VanDerWaalsContact O-CB 3.28Å; D159-T163 WeakPolarHBondContact O-CB 3.41Å; D159-T163 VanDerWaalsContact O-CG2 3.31Å; D159-T163 WeakPolarHBondContact O-CG2 3.31Å; D159-T163 PolarHBondContact O-N 2.91Å; D159-T163 PolarHBondContact O-OG1 3.49Å; F160-T163 PolarHBondContact O-N 3.27Å; T163-K165 PolarHBondContact O-N 3.14Å; T163-K165 PolarHBondContact OG1-N 3.22Å; T163-K165 PolarHBondContact OG1-O 3.04Å
164	A	92.3	Very high	92.2	Very high	65 Å²	65	52.9 Å²	52.9	54%	0.537	27%	0.272	S	S	.	.	S	Bend	trans	55.2	21.9	-167.5	0	0	0	0	0	114.2	L88 F160	L88-A164 HydrophobicContact CD1-CB 4.4Å; F160-A164 WeakPolarHBondContact O-CA 3.46Å; F160-A164 PolarHBondContact O-N 2.99Å
165	K	92.3	Very high	92	Very high	161 Å²	161	54.5 Å²	54.5	70%	0.7	28%	0.281	S	S	*	.			trans	-122.4	142.9	-179.3	-66.2	176.1	-176.7	178.7	0	110.7	F160 T163	F160-K165 WeakPolarHBondContact CA-O 3.39Å; T163-K165 PolarHBondContact O-N 3.14Å; T163-K165 PolarHBondContact OG1-N 3.22Å; T163-K165 PolarHBondContact OG1-O 3.04Å
166	L	93.7	Very high	92	Very high	36 Å²	36	49.6 Å²	49.6	19%	0.188	26%	0.26	C	S	.	.			trans	-141.5	138.3	176.2	-176	67.3	0	0	0	110.1	K156 F160 L168 T176 V188 F191	K156-L166 HydrophobicContact CB-CD1 4.05Å; K156-L166 HydrophobicContact CD-CD1 4.06Å; F160-L166 HydrophobicContact CD2-CB 4.11Å; L166-L168 HydrophobicContact CD2-CD1 4.28Å; L166-L168 HydrophobicContact CD2-CD2 4.18Å; L166-L168 HydrophobicContact CD2-CG 4.06Å; L166-L168 HydrophobicContact CG-CD2 4.39Å; L166-L168 HydrophobicContact CG-CG 4.22Å; L166-T176 HydrophobicContact CD1-CG2 4.14Å; L166-T176 HydrophobicContact CD2-CG2 4.18Å; L166-V188 HydrophobicContact CD2-CB 4.3Å; L166-V188 HydrophobicContact CD2-CG1 3.49Å; L166-V188 VanDerWaalsContact CD2-CG1 3.49Å; L166-V188 HydrophobicContact CD2-CG2 4.07Å; L166-F191 HydrophobicContact CD2-CD1 3.94Å; L166-F191 HydrophobicContact CD2-CE1 4.43Å
167	S	90.6	Very high	92	Very high	75 Å²	75	47.5 Å²	47.5	52%	0.524	25%	0.25	S	S	.	.			trans	-118	122.8	171.7	55.8	0	0	0	0	110.1	K156	K156-S167 PolarHBondContact NZ-O 3.49Å; K156-S167 PolarHBondContact NZ-OG 3.17Å
168	L	90.8	Very high	91.8	Very high	26 Å²	26	50.8 Å²	50.8	14%	0.136	27%	0.266	C	S	.	.			trans	-115.1	145	-179.2	-71.1	179.9	0	0	0	111.3	L166 N172 L173 T176 F191 C192 F195	L166-L168 HydrophobicContact CD2-CD1 4.28Å; L166-L168 HydrophobicContact CD2-CD2 4.18Å; L166-L168 HydrophobicContact CD2-CG 4.06Å; L166-L168 HydrophobicContact CG-CD2 4.39Å; L166-L168 HydrophobicContact CG-CG 4.22Å; L168-N172 WeakPolarHBondContact CA-OD1 3.41Å; L168-L173 HydrophobicContact CD1-CD1 4.18Å; L168-L173 HydrophobicContact CD2-CD1 4.47Å; L168-T176 HydrophobicContact CD2-CG2 3.72Å; L168-F191 HydrophobicContact CB-CE1 4.24Å; L168-F191 HydrophobicContact CD1-CD1 3.39Å; L168-F191 HydrophobicContact CD1-CE1 3.5Å; L168-F191 HydrophobicContact CD1-CG 4.48Å; L168-F191 HydrophobicContact CG-CD1 4.09Å; L168-F191 HydrophobicContact CG-CE1 3.82Å; L168-C192 HydrophobicContact CD1-CB 4.44Å; L168-C192 VanDerWaalsContact CD1-SG 3.59Å; L168-F195 HydrophobicContact CD1-CB 4.44Å
169	N	88.7	Confident	91.8	Very high	64 Å²	64	50.8 Å²	50.8	34%	0.342	27%	0.266	S	S	.	.			trans	-146.7	174.1	167.6	65.8	20.9	0	0	0	108.7	E171 N172 L173	N169-E171 PolarHBondContact O-N 2.95Å; N169-E171 WeakPolarHBondContact OD1-CB 3.27Å; N169-E171 PolarHBondContact OD1-N 3.29Å; N169-E171 VanDerWaalsContact OD1-N 3.09Å; N169-N172 PolarHBondContact N-OD1 3.31Å; N169-N172 PolarHBondContact O-N 3.23Å; N169-N172 PolarHBondContact O-OD1 3.21Å; N169-N172 PolarHBondContact OD1-N 2.99Å; N169-N172 PolarHBondContact OD1-ND2 3.22Å; N169-N172 VanDerWaalsContact OD1-ND2 3.08Å; N169-N172 PolarHBondContact OD1-OD1 3.45Å; N169-L173 VanDerWaalsContact O-CB 3.24Å; N169-L173 WeakPolarHBondContact O-CB 3.47Å; N169-L173 PolarHBondContact O-N 2.75Å
170	M	81.6	Confident	91.8	Very high	105 Å²	105	48.5 Å²	48.5	52%	0.517	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.9	-178.1	-67.1	-60.6	-71.5	0	0	113.9	L173 F195	M170-L173 HydrophobicContact SD-CD2 4.18Å; M170-F195 HydrophobicContact SD-CE1 3.9Å
171	E	86	Confident	91.7	Very high	171 Å²	171	48.8 Å²	48.8	80%	0.799	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-38.8	180	-61.3	177.7	167.6	0	0	112.2	N169	N169-E171 PolarHBondContact O-N 2.95Å; N169-E171 WeakPolarHBondContact OD1-CB 3.27Å; N169-E171 PolarHBondContact OD1-N 3.29Å; N169-E171 VanDerWaalsContact OD1-N 3.09Å
172	N	89.8	Confident	91.6	Very high	18 Å²	18	51.9 Å²	51.9	10%	0.096	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-3.3	-176.7	67.6	32.6	0	0	0	114	I152 L168 N169 T176	I152-N172 HydrophobicContact CG2-CB 4.39Å; L168-N172 WeakPolarHBondContact CA-OD1 3.41Å; N169-N172 PolarHBondContact N-OD1 3.31Å; N169-N172 PolarHBondContact O-N 3.23Å; N169-N172 PolarHBondContact O-OD1 3.21Å; N169-N172 PolarHBondContact OD1-N 2.99Å; N169-N172 PolarHBondContact OD1-ND2 3.22Å; N169-N172 VanDerWaalsContact OD1-ND2 3.08Å; N169-N172 PolarHBondContact OD1-OD1 3.45Å; N172-T176 WeakPolarHBondContact O-CB 3.24Å; N172-T176 PolarHBondContact O-N 3.1Å; N172-T176 PolarHBondContact O-OG1 3.27Å
173	L	90.6	Very high	91.6	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-62.6	-47.4	-174.4	178.4	62.9	0	0	0	112.1	L168 N169 M170 T176 L177 C192 F195 L196	L168-L173 HydrophobicContact CD1-CD1 4.18Å; L168-L173 HydrophobicContact CD2-CD1 4.47Å; N169-L173 VanDerWaalsContact O-CB 3.24Å; N169-L173 WeakPolarHBondContact O-CB 3.47Å; N169-L173 PolarHBondContact O-N 2.75Å; M170-L173 HydrophobicContact SD-CD2 4.18Å; L173-T176 PolarHBondContact O-N 3.46Å; L173-L177 WeakPolarHBondContact O-CB 3.36Å; L173-L177 PolarHBondContact O-N 3.36Å; L173-C192 HydrophobicContact CD1-CB 4.19Å; L173-F195 HydrophobicContact CD1-CD1 3.95Å; L173-F195 HydrophobicContact CD1-CE1 4.49Å; L173-F195 HydrophobicContact CD2-CD1 3.89Å; L173-F195 HydrophobicContact CD2-CE1 3.98Å; L173-L196 HydrophobicContact CD2-CD2 3.4Å; L173-L196 HydrophobicContact CD2-CG 3.98Å; L173-L196 HydrophobicContact CG-CD2 4.5Å
174	Q	90	Very high	91.6	Very high	88 Å²	88	54 Å²	54	41%	0.411	28%	0.281	S	S	.	.	H	α-helix	trans	-63.8	-46.7	-176.8	-173.3	172.6	-17.5	0	0	110.9	T176 L177 E178	Q174-T176 PolarHBondContact O-N 3.07Å; Q174-L177 PolarHBondContact O-N 3.27Å; Q174-E178 WeakPolarHBondContact O-CB 3.45Å; Q174-E178 PolarHBondContact O-N 2.81Å
175	D	92.2	Very high	91.7	Very high	35 Å²	35	51 Å²	51	19%	0.187	26%	0.256	C	S	.	.	H	α-helix	trans	-59.1	-45.9	176.9	-59.5	-28.1	0	0	0	112.2	N150 I152 G153 A179	N150-D175 WeakPolarHBondContact ND2-CB 2.96Å; N150-D175 PolarHBondContact ND2-OD1 3.07Å; N150-D175 WeakPolarHBondContact OD1-CB 3.41Å; I152-D175 HydrophobicContact CB-CB 4.19Å; I152-D175 HydrophobicContact CG2-CB 4.19Å; G153-D175 WeakPolarHBondContact CA-O 3.32Å; D175-A179 WeakPolarHBondContact O-CB 3.48Å; D175-A179 PolarHBondContact O-N 2.9Å; D175-A179 VanDerWaalsContact O-N 3.08Å
176	T	94.1	Very high	91.7	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-70.3	-39.1	-178.8	-52.4	0	0	0	0	111.4	K156 I157 L166 L168 N172 L173 Q174 A179 A180 V188	K156-T176 HydrophobicContact CB-CG2 4.24Å; I157-T176 HydrophobicContact CD1-CG2 4.48Å; L166-T176 HydrophobicContact CD1-CG2 4.14Å; L166-T176 HydrophobicContact CD2-CG2 4.18Å; L168-T176 HydrophobicContact CD2-CG2 3.72Å; N172-T176 WeakPolarHBondContact O-CB 3.24Å; N172-T176 PolarHBondContact O-N 3.1Å; N172-T176 PolarHBondContact O-OG1 3.27Å; L173-T176 PolarHBondContact O-N 3.46Å; Q174-T176 PolarHBondContact O-N 3.07Å; T176-A179 PolarHBondContact O-N 2.84Å; T176-A180 VanDerWaalsContact O-CB 3.24Å; T176-A180 WeakPolarHBondContact O-CB 3.49Å; T176-A180 PolarHBondContact O-N 2.74Å; T176-V188 HydrophobicContact CG2-CG1 4.04Å
177	L	93.6	Very high	91.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67.2	-43.3	178.1	-179	70	0	0	0	111.4	L173 Q174 A180 S181 L189 C192 I211 Y215 L217	L173-L177 WeakPolarHBondContact O-CB 3.36Å; L173-L177 PolarHBondContact O-N 3.36Å; Q174-L177 PolarHBondContact O-N 3.27Å; L177-A180 PolarHBondContact O-N 2.89Å; L177-S181 VanDerWaalsContact O-CB 3.27Å; L177-S181 WeakPolarHBondContact O-CB 3.38Å; L177-S181 PolarHBondContact O-N 3.48Å; L177-L189 HydrophobicContact CD1-CD2 3.72Å; L177-C192 HydrophobicContact CD1-CB 3.65Å; L177-I211 HydrophobicContact CD2-CG2 3.52Å; L177-Y215 HydrophobicContact CD2-CD2 3.36Å; L177-Y215 HydrophobicContact CD2-CE2 3.74Å; L177-Y215 HydrophobicContact CD2-CG 3.9Å; L177-Y215 HydrophobicContact CG-CD2 4.07Å; L177-Y215 HydrophobicContact CG-CE2 4.35Å; L177-Y215 HydrophobicContact CG-CG 4.2Å; L177-L217 HydrophobicContact CD1-CD1 4.14Å; L177-L217 HydrophobicContact CD2-CD1 4.01Å
178	E	92.5	Very high	91.9	Very high	69 Å²	69	47.3 Å²	47.3	32%	0.322	24%	0.242	S	C	.	.	H	α-helix	trans	-58.3	-49.6	174.6	-172.9	174.6	-168.7	0	0	110.6	Q174 A180 S181 F182 Y215	Q174-E178 WeakPolarHBondContact O-CB 3.45Å; Q174-E178 PolarHBondContact O-N 2.81Å; E178-A180 PolarHBondContact O-N 3.37Å; E178-S181 PolarHBondContact O-N 3.1Å; E178-F182 WeakPolarHBondContact O-CB 3.14Å; E178-F182 PolarHBondContact O-N 3.43Å; E178-Y215 HydrophobicContact CB-CE1 4.03Å; E178-Y215 HydrophobicContact CG-CE1 4.26Å
179	A	94.4	Very high	92	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.7	-42.7	178.1	0	0	0	0	0	112.8	V149 G153 I157 D175 T176 S181 L183	V149-A179 HydrophobicContact CB-CB 4.35Å; V149-A179 HydrophobicContact CG1-CB 4.04Å; G153-A179 VanDerWaalsContact C-CB 3.48Å; I157-A179 HydrophobicContact CG1-CB 3.74Å; D175-A179 WeakPolarHBondContact O-CB 3.48Å; D175-A179 PolarHBondContact O-N 2.9Å; D175-A179 VanDerWaalsContact O-N 3.08Å; T176-A179 PolarHBondContact O-N 2.84Å; A179-S181 VanDerWaalsContact C-N 3.32Å; A179-S181 PolarHBondContact O-N 3.03Å; A179-L183 WeakPolarHBondContact O-CB 3.47Å; A179-L183 VanDerWaalsContact O-CG 3.25Å; A179-L183 WeakPolarHBondContact O-CG 3.35Å; A179-L183 PolarHBondContact O-N 2.97Å
180	A	94.8	Very high	92.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.5	-37.4	177.5	0	0	0	0	0	112.2	I157 T176 L177 E178 Q184 I185 V188 L189	I157-A180 HydrophobicContact CD1-CB 3.88Å; T176-A180 VanDerWaalsContact O-CB 3.24Å; T176-A180 WeakPolarHBondContact O-CB 3.49Å; T176-A180 PolarHBondContact O-N 2.74Å; L177-A180 PolarHBondContact O-N 2.89Å; E178-A180 PolarHBondContact O-N 3.37Å; A180-Q184 WeakPolarHBondContact O-CA 3.28Å; A180-Q184 PolarHBondContact O-N 3.23Å; A180-I185 PolarHBondContact O-N 2.76Å; A180-V188 HydrophobicContact CB-CB 4.01Å; A180-V188 HydrophobicContact CB-CG1 3.64Å; A180-L189 HydrophobicContact CB-CD2 3.7Å; A180-L189 HydrophobicContact CB-CG 3.83Å
181	S	93.9	Very high	92.8	Very high	49 Å²	49	47.2 Å²	47.2	34%	0.343	24%	0.239	S	C	.	.	H	α-helix	trans	-68.9	-51.5	177.8	-172.5	0	0	0	0	110.8	L177 E178 A179 L183 Q184	L177-S181 VanDerWaalsContact O-CB 3.27Å; L177-S181 WeakPolarHBondContact O-CB 3.38Å; L177-S181 PolarHBondContact O-N 3.48Å; E178-S181 PolarHBondContact O-N 3.1Å; A179-S181 VanDerWaalsContact C-N 3.32Å; A179-S181 PolarHBondContact O-N 3.03Å; S181-L183 PolarHBondContact O-N 3.24Å; S181-Q184 PolarHBondContact O-N 3.28Å
182	F	93.4	Very high	93.2	Very high	74 Å²	74	39 Å²	39	33%	0.325	20%	0.201	S	C	.	.	H	α-helix	trans	-63	-43.9	-179.3	-174.2	-92.5	0	0	0	112.2	Y127 V149 E178 Q184	Y127-F182 HydrophobicContact CE1-CE1 4.15Å; Y127-F182 HydrophobicContact CE2-CE1 4.1Å; Y127-F182 HydrophobicContact CE2-CZ 4.29Å; Y127-F182 AromaticContact CZ-CE1 3.64Å; Y127-F182 WeakPolarHBondContact OH-CE1 3.33Å; V149-F182 HydrophobicContact CG1-CB 3.87Å; V149-F182 HydrophobicContact CG1-CD1 3.56Å; V149-F182 HydrophobicContact CG1-CE1 4.4Å; V149-F182 HydrophobicContact CG1-CG 3.92Å; E178-F182 WeakPolarHBondContact O-CB 3.14Å; E178-F182 PolarHBondContact O-N 3.43Å; F182-Q184 VanDerWaalsContact C-N 3.31Å; F182-Q184 PolarHBondContact O-N 2.88Å
183	L	94.6	Very high	93.3	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	4.4	-179	-56.7	174.6	0	0	0	113.4	S125 Y127 F128 L146 V149 L154 I157 A179 S181 I185	S125-L183 PolarHBondContact OG-O 2.94Å; Y127-L183 HydrophobicContact CD1-CD2 3.71Å; Y127-L183 HydrophobicContact CE1-CD2 3.76Å; F128-L183 HydrophobicContact CE1-CD2 4.28Å; F128-L183 HydrophobicContact CE2-CB 4.31Å; F128-L183 HydrophobicContact CE2-CD1 4.08Å; F128-L183 HydrophobicContact CE2-CD2 3.82Å; F128-L183 HydrophobicContact CE2-CG 4.29Å; F128-L183 HydrophobicContact CZ-CD1 4.14Å; F128-L183 HydrophobicContact CZ-CD2 3.55Å; F128-L183 HydrophobicContact CZ-CG 4.37Å; L146-L183 HydrophobicContact CD1-CD2 4.31Å; V149-L183 HydrophobicContact CG1-CD1 4.36Å; V149-L183 HydrophobicContact CG1-CD2 4.5Å; V149-L183 HydrophobicContact CG1-CG 4.15Å; L154-L183 HydrophobicContact CD1-CD1 4Å; I157-L183 HydrophobicContact CB-CD1 4.34Å; I157-L183 HydrophobicContact CG2-CD1 3.91Å; A179-L183 WeakPolarHBondContact O-CB 3.47Å; A179-L183 VanDerWaalsContact O-CG 3.25Å; A179-L183 WeakPolarHBondContact O-CG 3.35Å; A179-L183 PolarHBondContact O-N 2.97Å; S181-L183 PolarHBondContact O-N 3.24Å; L183-I185 HydrophobicContact CB-CG1 4.16Å; L183-I185 PolarHBondContact O-N 2.91Å
184	Q	94.1	Very high	93.5	Very high	97 Å²	97	44.6 Å²	44.6	45%	0.453	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	42.4	176.6	-56.6	-178.4	-0.1	0	0	114.4	A180 S181 F182 L186	A180-Q184 WeakPolarHBondContact O-CA 3.28Å; A180-Q184 PolarHBondContact O-N 3.23Å; S181-Q184 PolarHBondContact O-N 3.28Å; F182-Q184 VanDerWaalsContact C-N 3.31Å; F182-Q184 PolarHBondContact O-N 2.88Å; Q184-L186 PolarHBondContact O-N 2.9Å
185	I	95.1	Very high	93.6	Very high	2 Å²	2	43 Å²	43	1%	0.01	22%	0.223	C	C	.	.			trans	-90.5	82.2	176.1	-50.2	-65.6	0	0	0	109.4	S124 I157 F160 I161 A180 L183 V188 L189	S124-I185 WeakPolarHBondContact O-CD1 3.35Å; I157-I185 HydrophobicContact CD1-CB 4.47Å; I157-I185 HydrophobicContact CD1-CG1 4.37Å; I157-I185 HydrophobicContact CG2-CD1 4.25Å; I157-I185 HydrophobicContact CG2-CG1 3.73Å; F160-I185 HydrophobicContact CD1-CG2 4.03Å; F160-I185 HydrophobicContact CE1-CG2 3.81Å; I161-I185 HydrophobicContact CD1-CD1 4.17Å; A180-I185 PolarHBondContact O-N 2.76Å; L183-I185 HydrophobicContact CB-CG1 4.16Å; L183-I185 PolarHBondContact O-N 2.91Å; I185-V188 HydrophobicContact CB-CB 4.35Å; I185-V188 HydrophobicContact CB-CG2 4.45Å; I185-V188 HydrophobicContact CG2-CB 3.89Å; I185-V188 HydrophobicContact CG2-CG2 3.56Å; I185-V188 PolarHBondContact O-N 2.89Å; I185-V188 VanDerWaalsContact O-N 3.14Å; I185-L189 PolarHBondContact O-N 2.81Å; I185-L189 VanDerWaalsContact O-N 3.1Å
186	L	91.7	Very high	93.7	Very high	110 Å²	110	41.4 Å²	41.4	58%	0.576	22%	0.215	S	C	*	.	H	α-helix	trans	-54.5	-43.2	-173.7	-56.1	-178.3	0	0	0	114.7	Q184 V188 L189 D190	Q184-L186 PolarHBondContact O-N 2.9Å; L186-V188 VanDerWaalsContact C-N 3.27Å; L186-V188 PolarHBondContact O-N 3.45Å; L186-L189 HydrophobicContact CD2-CD1 4.14Å; L186-L189 WeakPolarHBondContact O-CB 3.48Å; L186-L189 PolarHBondContact O-N 2.66Å; L186-L189 VanDerWaalsContact O-N 3.14Å; L186-D190 PolarHBondContact O-N 3.05Å
187	P	94.2	Very high	93.7	Very high	83 Å²	83	43.7 Å²	43.7	54%	0.539	23%	0.226	S	C	.	.	H	α-helix	trans	-62.2	-33.8	179.7	-24.2	35.3	0	0	0	113.6	F160 F191	F160-P187 HydrophobicContact CZ-CB 4.17Å; P187-F191 PolarHBondContact O-N 3.09Å; P187-F191 VanDerWaalsContact O-N 3.1Å
188	V	94.3	Very high	93.7	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-72.9	-41.9	176.1	173.9	0	0	0	0	110.3	I157 F160 L166 T176 A180 I185 L186 D190 F191 C192	I157-V188 HydrophobicContact CD1-CB 4.24Å; I157-V188 HydrophobicContact CD1-CG1 3.86Å; I157-V188 HydrophobicContact CD1-CG2 4.2Å; F160-V188 HydrophobicContact CB-CG2 4.44Å; F160-V188 HydrophobicContact CD1-CG2 3.43Å; F160-V188 VanDerWaalsContact CD1-CG2 3.43Å; F160-V188 HydrophobicContact CD2-CG2 3.98Å; F160-V188 HydrophobicContact CE1-CG2 3.54Å; F160-V188 HydrophobicContact CE2-CG2 4.07Å; F160-V188 HydrophobicContact CG-CG2 3.67Å; F160-V188 HydrophobicContact CZ-CG2 3.86Å; L166-V188 HydrophobicContact CD2-CB 4.3Å; L166-V188 HydrophobicContact CD2-CG1 3.49Å; L166-V188 VanDerWaalsContact CD2-CG1 3.49Å; L166-V188 HydrophobicContact CD2-CG2 4.07Å; T176-V188 HydrophobicContact CG2-CG1 4.04Å; A180-V188 HydrophobicContact CB-CB 4.01Å; A180-V188 HydrophobicContact CB-CG1 3.64Å; I185-V188 HydrophobicContact CB-CB 4.35Å; I185-V188 HydrophobicContact CB-CG2 4.45Å; I185-V188 HydrophobicContact CG2-CB 3.89Å; I185-V188 HydrophobicContact CG2-CG2 3.56Å; I185-V188 PolarHBondContact O-N 2.89Å; I185-V188 VanDerWaalsContact O-N 3.14Å; L186-V188 VanDerWaalsContact C-N 3.27Å; L186-V188 PolarHBondContact O-N 3.45Å; V188-D190 VanDerWaalsContact C-N 3.32Å; V188-D190 PolarHBondContact O-N 3.45Å; V188-F191 PolarHBondContact O-N 3.46Å; V188-C192 PolarHBondContact O-N 3.39Å; V188-C192 PolarHBondContact O-SG 2.84Å
189	L	92.3	Very high	93.5	Very high	21 Å²	21	46.5 Å²	46.5	11%	0.11	26%	0.259	C	S	.	.	H	α-helix	trans	-56.8	-46.3	173.8	-73.7	174.7	0	0	0	111.7	L177 A180 I185 L186 F191 C192 K193	L177-L189 HydrophobicContact CD1-CD2 3.72Å; A180-L189 HydrophobicContact CB-CD2 3.7Å; A180-L189 HydrophobicContact CB-CG 3.83Å; I185-L189 PolarHBondContact O-N 2.81Å; I185-L189 VanDerWaalsContact O-N 3.1Å; L186-L189 HydrophobicContact CD2-CD1 4.14Å; L186-L189 WeakPolarHBondContact O-CB 3.48Å; L186-L189 PolarHBondContact O-N 2.66Å; L186-L189 VanDerWaalsContact O-N 3.14Å; L189-F191 VanDerWaalsContact C-N 3.34Å; L189-F191 PolarHBondContact O-N 2.91Å; L189-C192 WeakPolarHBondContact O-CB 3.41Å; L189-C192 PolarHBondContact O-N 3.04Å; L189-K193 WeakPolarHBondContact O-CG 3.35Å; L189-K193 PolarHBondContact O-N 3.32Å
190	D	93.3	Very high	93.5	Very high	79 Å²	79	47.3 Å²	47.3	42%	0.422	26%	0.264	S	S	.	.	H	α-helix	trans	-64.4	-39.6	178.9	-69.4	-24.2	0	0	0	111.8	L186 V188 K193 V194	L186-D190 PolarHBondContact O-N 3.05Å; V188-D190 VanDerWaalsContact C-N 3.32Å; V188-D190 PolarHBondContact O-N 3.45Å; D190-K193 WeakPolarHBondContact O-CB 3.39Å; D190-K193 PolarHBondContact O-N 3.16Å; D190-K193 IonicContact OD1-NZ 3.33Å; D190-K193 PolarHBondContact OD1-NZ 3.33Å; D190-V194 WeakPolarHBondContact O-CG2 3.39Å; D190-V194 PolarHBondContact O-N 3.26Å; D190-V194 VanDerWaalsContact O-N 3.08Å
191	F	94	Very high	93.5	Very high	92 Å²	92	49.3 Å²	49.3	40%	0.404	28%	0.278	S	S	.	.	H	α-helix	trans	-63.2	-41.5	173.1	-175.9	-115.8	0	0	0	112.5	L166 L168 P187 V188 L189 K193 V194 F195	L166-F191 HydrophobicContact CD2-CD1 3.94Å; L166-F191 HydrophobicContact CD2-CE1 4.43Å; L168-F191 HydrophobicContact CB-CE1 4.24Å; L168-F191 HydrophobicContact CD1-CD1 3.39Å; L168-F191 HydrophobicContact CD1-CE1 3.5Å; L168-F191 HydrophobicContact CD1-CG 4.48Å; L168-F191 HydrophobicContact CG-CD1 4.09Å; L168-F191 HydrophobicContact CG-CE1 3.82Å; P187-F191 PolarHBondContact O-N 3.09Å; P187-F191 VanDerWaalsContact O-N 3.1Å; V188-F191 PolarHBondContact O-N 3.46Å; L189-F191 VanDerWaalsContact C-N 3.34Å; L189-F191 PolarHBondContact O-N 2.91Å; F191-K193 VanDerWaalsContact C-N 3.33Å; F191-K193 PolarHBondContact O-N 3.01Å; F191-V194 PolarHBondContact O-N 2.65Å; F191-F195 WeakPolarHBondContact O-CB 3.24Å; F191-F195 PolarHBondContact O-N 2.93Å
192	C	93.7	Very high	93.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.4	-39.2	174	-68.1	0	0	0	0	112.1	L168 L173 L177 V188 L189 F195 L196	L168-C192 HydrophobicContact CD1-CB 4.44Å; L168-C192 VanDerWaalsContact CD1-SG 3.59Å; L173-C192 HydrophobicContact CD1-CB 4.19Å; L177-C192 HydrophobicContact CD1-CB 3.65Å; V188-C192 PolarHBondContact O-N 3.39Å; V188-C192 PolarHBondContact O-SG 2.84Å; L189-C192 WeakPolarHBondContact O-CB 3.41Å; L189-C192 PolarHBondContact O-N 3.04Å; C192-F195 PolarHBondContact O-N 2.97Å; C192-L196 WeakPolarHBondContact O-CB 3.47Å; C192-L196 WeakPolarHBondContact O-CG 3.47Å; C192-L196 PolarHBondContact O-N 3.19Å
193	K	93.5	Very high	93.3	Very high	42 Å²	42	51.8 Å²	51.8	18%	0.183	29%	0.29	C	S	.	.	H	α-helix	trans	-61.4	-47.9	175.5	-67.2	171	-165.3	163.6	0	111.4	L189 D190 F191 F195 L196 I197 L217 V220	L189-K193 WeakPolarHBondContact O-CG 3.35Å; L189-K193 PolarHBondContact O-N 3.32Å; D190-K193 WeakPolarHBondContact O-CB 3.39Å; D190-K193 PolarHBondContact O-N 3.16Å; D190-K193 IonicContact OD1-NZ 3.33Å; D190-K193 PolarHBondContact OD1-NZ 3.33Å; F191-K193 VanDerWaalsContact C-N 3.33Å; F191-K193 PolarHBondContact O-N 3.01Å; K193-F195 VanDerWaalsContact C-N 3.33Å; K193-F195 PolarHBondContact O-N 2.97Å; K193-L196 PolarHBondContact O-N 3.27Å; K193-I197 WeakPolarHBondContact O-CG1 3.48Å; K193-I197 PolarHBondContact O-N 3.16Å; K193-L217 HydrophobicContact CG-CD1 4.47Å; K193-L217 HydrophobicContact CG-CD2 4.23Å; K193-V220 HydrophobicContact CB-CG2 3.86Å; K193-V220 HydrophobicContact CG-CG2 3.94Å
194	V	93.5	Very high	93.2	Very high	94 Å²	94	53.3 Å²	53.3	57%	0.57	30%	0.299	S	S	*	.	H	α-helix	trans	-60.6	-44.7	178.4	173.4	0	0	0	0	110.6	D190 F191 I197 S198	D190-V194 WeakPolarHBondContact O-CG2 3.39Å; D190-V194 PolarHBondContact O-N 3.26Å; D190-V194 VanDerWaalsContact O-N 3.08Å; F191-V194 PolarHBondContact O-N 2.65Å; V194-I197 PolarHBondContact O-N 3.2Å; V194-S198 WeakPolarHBondContact O-CB 3.47Å; V194-S198 PolarHBondContact O-N 3.08Å; V194-S198 PolarHBondContact O-OG 3.46Å
195	F	93.2	Very high	93.1	Very high	54 Å²	54	48.7 Å²	48.7	24%	0.237	28%	0.277	C	S	.	.	H	α-helix	trans	-58.4	-49.5	176.3	-176.3	-96.9	0	0	0	111.6	L168 M170 L173 F191 C192 K193 I197 S198 G199	L168-F195 HydrophobicContact CD1-CB 4.44Å; M170-F195 HydrophobicContact SD-CE1 3.9Å; L173-F195 HydrophobicContact CD1-CD1 3.95Å; L173-F195 HydrophobicContact CD1-CE1 4.49Å; L173-F195 HydrophobicContact CD2-CD1 3.89Å; L173-F195 HydrophobicContact CD2-CE1 3.98Å; F191-F195 WeakPolarHBondContact O-CB 3.24Å; F191-F195 PolarHBondContact O-N 2.93Å; C192-F195 PolarHBondContact O-N 2.97Å; K193-F195 VanDerWaalsContact C-N 3.33Å; K193-F195 PolarHBondContact O-N 2.97Å; F195-I197 PolarHBondContact O-N 3.09Å; F195-S198 PolarHBondContact O-N 3.08Å; F195-S198 PolarHBondContact O-OG 3.34Å; F195-G199 PolarHBondContact O-N 3.47Å
196	L	93.2	Very high	93	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.016	28%	0.28	C	S	.	.	H	α-helix	trans	-58.3	-49.8	178	-77.4	169.6	0	0	0	111.9	L173 C192 K193 S198 G199 V200 V208 I211 L217 V220	L173-L196 HydrophobicContact CD2-CD2 3.4Å; L173-L196 HydrophobicContact CD2-CG 3.98Å; L173-L196 HydrophobicContact CG-CD2 4.5Å; C192-L196 WeakPolarHBondContact O-CB 3.47Å; C192-L196 WeakPolarHBondContact O-CG 3.47Å; C192-L196 PolarHBondContact O-N 3.19Å; K193-L196 PolarHBondContact O-N 3.27Å; L196-S198 VanDerWaalsContact C-N 3.33Å; L196-S198 PolarHBondContact O-N 2.89Å; L196-G199 PolarHBondContact O-N 2.94Å; L196-V200 WeakPolarHBondContact O-CG2 3.19Å; L196-V200 PolarHBondContact O-N 3.3Å; L196-V208 HydrophobicContact CB-CG1 4.27Å; L196-V208 HydrophobicContact CD2-CG1 3.98Å; L196-V208 HydrophobicContact CD2-CG2 4.16Å; L196-I211 HydrophobicContact CD1-CG2 4.17Å; L196-L217 HydrophobicContact CD1-CD1 3.83Å; L196-V220 HydrophobicContact CB-CG1 3.98Å; L196-V220 HydrophobicContact CD1-CG1 4.34Å
197	I	94.4	Very high	92.9	Very high	47 Å²	47	47.1 Å²	47.1	24%	0.241	27%	0.268	C	S	.	.	H	α-helix	trans	-59.3	-44.7	-179.9	-71.2	167.9	0	0	0	111	K193 V194 F195 G199 V220 Y223	K193-I197 WeakPolarHBondContact O-CG1 3.48Å; K193-I197 PolarHBondContact O-N 3.16Å; V194-I197 PolarHBondContact O-N 3.2Å; F195-I197 PolarHBondContact O-N 3.09Å; I197-G199 VanDerWaalsContact C-N 3.27Å; I197-G199 PolarHBondContact O-N 3.32Å; I197-V220 HydrophobicContact CD1-CG2 4.23Å; I197-V220 HydrophobicContact CG1-CB 4.48Å; I197-V220 HydrophobicContact CG1-CG1 4.41Å; I197-V220 HydrophobicContact CG1-CG2 4.1Å; I197-Y223 HydrophobicContact CB-CD1 4.4Å; I197-Y223 HydrophobicContact CG1-CD1 4.33Å; I197-Y223 HydrophobicContact CG1-CG 4.28Å; I197-Y223 HydrophobicContact CG2-CD1 3.95Å; I197-Y223 HydrophobicContact CG2-CD2 3.92Å; I197-Y223 HydrophobicContact CG2-CE1 3.88Å; I197-Y223 HydrophobicContact CG2-CE2 3.86Å; I197-Y223 HydrophobicContact CG2-CG 3.96Å; I197-Y223 WeakPolarHBondContact O-CE1 3.46Å
198	S	93	Very high	92.9	Very high	95 Å²	95	43.3 Å²	43.3	66%	0.664	24%	0.243	S	C	*	.	H	α-helix	trans	-69.5	-24.2	-179.7	71.3	0	0	0	0	113.7	V194 F195 L196	V194-S198 WeakPolarHBondContact O-CB 3.47Å; V194-S198 PolarHBondContact O-N 3.08Å; V194-S198 PolarHBondContact O-OG 3.46Å; F195-S198 PolarHBondContact O-N 3.08Å; F195-S198 PolarHBondContact O-OG 3.34Å; L196-S198 VanDerWaalsContact C-N 3.33Å; L196-S198 PolarHBondContact O-N 2.89Å
199	G	89.8	Confident	92.8	Very high	33 Å²	33	43.2 Å²	43.2	34%	0.34	24%	0.242	S	C	.	.	H	α-helix	trans	-94.8	-2.4	-177.3	0	0	0	0	0	115	F195 L196 I197 S201 N204	F195-G199 PolarHBondContact O-N 3.47Å; L196-G199 PolarHBondContact O-N 2.94Å; I197-G199 VanDerWaalsContact C-N 3.27Å; I197-G199 PolarHBondContact O-N 3.32Å; G199-S201 PolarHBondContact O-N 3.45Å; G199-N204 PolarHBondContact O-ND2 3.26Å; G199-N204 PolarHBondContact O-OD1 3.16Å
200	V	93.8	Very high	92.8	Very high	18 Å²	18	48.8 Å²	48.8	11%	0.109	26%	0.262	C	S	.	.			trans	-63.7	125.6	-179.1	174	0	0	0	0	111.2	L196 N204 C205 V208 Y223 V224 F227	L196-V200 WeakPolarHBondContact O-CG2 3.19Å; L196-V200 PolarHBondContact O-N 3.3Å; V200-N204 WeakPolarHBondContact CA-OD1 3.13Å; V200-C205 HydrophobicContact CG1-CB 4Å; V200-V208 HydrophobicContact CG2-CB 4.4Å; V200-V208 HydrophobicContact CG2-CG1 3.85Å; V200-Y223 HydrophobicContact CB-CE1 3.99Å; V200-Y223 HydrophobicContact CG1-CE1 4.45Å; V200-Y223 HydrophobicContact CG2-CD1 4.08Å; V200-Y223 HydrophobicContact CG2-CE1 3.97Å; V200-V224 HydrophobicContact CG2-CG2 4.15Å; V200-F227 HydrophobicContact CG1-CB 4.25Å; V200-F227 HydrophobicContact CG1-CD1 3.56Å; V200-F227 HydrophobicContact CG1-CD2 3.92Å; V200-F227 HydrophobicContact CG1-CE1 3.8Å; V200-F227 HydrophobicContact CG1-CE2 4.14Å; V200-F227 HydrophobicContact CG1-CG 3.63Å; V200-F227 HydrophobicContact CG1-CZ 4.09Å
201	S	93.9	Very high	92.7	Very high	42 Å²	42	45.7 Å²	45.7	29%	0.294	25%	0.245	S	C	.	.			trans	-134.2	172.9	175.1	77.3	0	0	0	0	111.1	G199 D203 N204 C205	G199-S201 PolarHBondContact O-N 3.45Å; S201-D203 PolarHBondContact O-N 3.42Å; S201-D203 PolarHBondContact OG-N 2.94Å; S201-N204 PolarHBondContact N-OD1 3.45Å; S201-N204 PolarHBondContact O-N 2.97Å; S201-N204 PolarHBondContact O-OD1 3.22Å; S201-N204 PolarHBondContact OG-N 3.06Å; S201-N204 PolarHBondContact OG-ND2 3.23Å; S201-N204 PolarHBondContact OG-OD1 3Å; S201-C205 WeakPolarHBondContact O-CB 3.44Å; S201-C205 PolarHBondContact O-N 3.19Å
202	L	93.1	Very high	92.6	Very high	54 Å²	54	41.3 Å²	41.3	28%	0.283	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-32.1	176.2	-70.4	175.4	0	0	0	112.8	F227 N231	L202-F227 HydrophobicContact CD2-CE1 4.22Å; L202-F227 HydrophobicContact CD2-CZ 4.44Å; L202-N231 HydrophobicContact CD2-CB 3.76Å
203	D	91.3	Very high	92.5	Very high	120 Å²	120	46.6 Å²	46.6	64%	0.642	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-24.1	-175.8	-54.3	-61.4	0	0	0	113.2	S201	S201-D203 PolarHBondContact O-N 3.42Å; S201-D203 PolarHBondContact OG-N 2.94Å
204	N	91.4	Very high	92.4	Very high	33 Å²	33	48.9 Å²	48.9	18%	0.176	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-6.8	-174.9	73.3	20.2	0	0	0	114.6	G199 V200 S201 V206 E207 V208	G199-N204 PolarHBondContact O-ND2 3.26Å; G199-N204 PolarHBondContact O-OD1 3.16Å; V200-N204 WeakPolarHBondContact CA-OD1 3.13Å; S201-N204 PolarHBondContact N-OD1 3.45Å; S201-N204 PolarHBondContact O-N 2.97Å; S201-N204 PolarHBondContact O-OD1 3.22Å; S201-N204 PolarHBondContact OG-N 3.06Å; S201-N204 PolarHBondContact OG-ND2 3.23Å; S201-N204 PolarHBondContact OG-OD1 3Å; N204-V206 PolarHBondContact O-N 2.85Å; N204-V206 VanDerWaalsContact O-N 3.16Å; N204-E207 PolarHBondContact O-N 3.24Å; N204-V208 HydrophobicContact CB-CG2 4.47Å; N204-V208 WeakPolarHBondContact O-CG2 3.24Å; N204-V208 PolarHBondContact O-N 2.83Å
205	C	93.6	Very high	92.1	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-56.8	-35.8	-174.1	60.5	0	0	0	0	113.7	V200 S201 G209 V224 F227 I228	V200-C205 HydrophobicContact CG1-CB 4Å; S201-C205 WeakPolarHBondContact O-CB 3.44Å; S201-C205 PolarHBondContact O-N 3.19Å; C205-G209 PolarHBondContact O-N 3.09Å; C205-V224 WeakPolarHBondContact O-CG1 3.38Å; C205-F227 HydrophobicContact CB-CD1 4Å; C205-F227 HydrophobicContact CB-CE1 4.06Å; C205-I228 HydrophobicContact CB-CG1 4.48Å
206	V	92.5	Very high	92	Very high	12 Å²	12	49.8 Å²	49.8	7%	0.073	27%	0.273	C	S	.	.	H	α-helix	trans	-67.2	-43.8	178.2	-176.8	0	0	0	0	110.8	N204 G209 R210 E240 K243 L244	N204-V206 PolarHBondContact O-N 2.85Å; N204-V206 VanDerWaalsContact O-N 3.16Å; V206-G209 PolarHBondContact O-N 2.79Å; V206-R210 PolarHBondContact O-N 2.81Å; V206-E240 HydrophobicContact CG2-CB 4Å; V206-K243 HydrophobicContact CG1-CB 4.14Å; V206-L244 HydrophobicContact CG1-CD2 4.29Å; V206-L244 HydrophobicContact CG2-CD2 3.77Å; V206-L244 HydrophobicContact CG2-CG 4.12Å
207	E	90.1	Very high	92	Very high	67 Å²	67	50.2 Å²	50.2	31%	0.313	28%	0.276	S	S	.	.	H	α-helix	trans	-70	-44.5	179.9	-177.1	52.2	-147.3	0	0	111.6	N204 G209 R210 I211	N204-E207 PolarHBondContact O-N 3.24Å; E207-G209 PolarHBondContact O-N 3.29Å; E207-R210 VanDerWaalsContact CD-NH2 3.33Å; E207-R210 WeakPolarHBondContact O-CA 3.37Å; E207-R210 WeakPolarHBondContact O-CB 3.34Å; E207-R210 PolarHBondContact O-N 2.8Å; E207-R210 IonicContact OE1-CZ 3.18Å; E207-R210 VanDerWaalsContact OE1-CZ 3.3Å; E207-R210 IonicContact OE1-NE 2.76Å; E207-R210 PolarHBondContact OE1-NE 3.12Å; E207-R210 VanDerWaalsContact OE1-NE 3.16Å; E207-R210 IonicContact OE1-NH2 2.84Å; E207-R210 PolarHBondContact OE1-NH2 2.94Å; E207-R210 IonicContact OE2-CZ 2.81Å; E207-R210 IonicContact OE2-NE 2.75Å; E207-R210 PolarHBondContact OE2-NE 3.17Å; E207-R210 IonicContact OE2-NH2 2.66Å; E207-R210 PolarHBondContact OE2-NH2 3.11Å; E207-I211 HydrophobicContact CG-CD1 4.38Å; E207-I211 WeakPolarHBondContact O-CG1 3.4Å; E207-I211 PolarHBondContact O-N 2.71Å
208	V	92.6	Very high	91.9	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.012	30%	0.296	C	S	.	.	H	α-helix	trans	-58.6	-40	173.1	173.4	0	0	0	0	110.9	L196 V200 N204 I211 A212 V220 V224	L196-V208 HydrophobicContact CB-CG1 4.27Å; L196-V208 HydrophobicContact CD2-CG1 3.98Å; L196-V208 HydrophobicContact CD2-CG2 4.16Å; V200-V208 HydrophobicContact CG2-CB 4.4Å; V200-V208 HydrophobicContact CG2-CG1 3.85Å; N204-V208 HydrophobicContact CB-CG2 4.47Å; N204-V208 WeakPolarHBondContact O-CG2 3.24Å; N204-V208 PolarHBondContact O-N 2.83Å; V208-I211 PolarHBondContact O-N 3.21Å; V208-A212 WeakPolarHBondContact O-CB 3.37Å; V208-A212 PolarHBondContact O-N 3.05Å; V208-V220 HydrophobicContact CG1-CG1 3.94Å; V208-V224 HydrophobicContact CB-CG2 4.41Å; V208-V224 HydrophobicContact CG1-CG2 3.78Å
209	G	92.9	Very high	92	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.8	-36.7	173.1	0	0	0	0	0	113.6	C205 V206 E207 A212 N213 R248	C205-G209 PolarHBondContact O-N 3.09Å; V206-G209 PolarHBondContact O-N 2.79Å; E207-G209 PolarHBondContact O-N 3.29Å; G209-A212 PolarHBondContact O-N 3.19Å; G209-N213 PolarHBondContact O-N 3.36Å; G209-R248 PolarHBondContact O-NH2 3.28Å; G209-R248 VanDerWaalsContact O-NH2 3.09Å
210	R	92	Very high	92.2	Very high	138 Å²	138	53 Å²	53	52%	0.521	28%	0.276	S	S	.	.	H	α-helix	trans	-66.5	-42.6	175.1	-171.9	178.9	72.5	112.8	1.1	111.6	V206 E207 N213 T214	V206-R210 PolarHBondContact O-N 2.81Å; E207-R210 VanDerWaalsContact CD-NH2 3.33Å; E207-R210 WeakPolarHBondContact O-CA 3.37Å; E207-R210 WeakPolarHBondContact O-CB 3.34Å; E207-R210 PolarHBondContact O-N 2.8Å; E207-R210 IonicContact OE1-CZ 3.18Å; E207-R210 VanDerWaalsContact OE1-CZ 3.3Å; E207-R210 IonicContact OE1-NE 2.76Å; E207-R210 PolarHBondContact OE1-NE 3.12Å; E207-R210 VanDerWaalsContact OE1-NE 3.16Å; E207-R210 IonicContact OE1-NH2 2.84Å; E207-R210 PolarHBondContact OE1-NH2 2.94Å; E207-R210 IonicContact OE2-CZ 2.81Å; E207-R210 IonicContact OE2-NE 2.75Å; E207-R210 PolarHBondContact OE2-NE 3.17Å; E207-R210 IonicContact OE2-NH2 2.66Å; E207-R210 PolarHBondContact OE2-NH2 3.11Å; R210-N213 PolarHBondContact O-N 3.16Å; R210-T214 WeakPolarHBondContact O-CB 3.46Å; R210-T214 PolarHBondContact O-N 3.46Å; R210-T214 PolarHBondContact O-OG1 2.87Å
211	I	90.9	Very high	92.2	Very high	13 Å²	13	54 Å²	54	7%	0.067	28%	0.28	C	S	.	.	H	α-helix	trans	-61.1	-49.1	174.1	-66.5	168.9	0	0	0	109.5	L177 L196 E207 V208 N213 T214 Y215	L177-I211 HydrophobicContact CD2-CG2 3.52Å; L196-I211 HydrophobicContact CD1-CG2 4.17Å; E207-I211 HydrophobicContact CG-CD1 4.38Å; E207-I211 WeakPolarHBondContact O-CG1 3.4Å; E207-I211 PolarHBondContact O-N 2.71Å; V208-I211 PolarHBondContact O-N 3.21Å; I211-N213 VanDerWaalsContact C-N 3.31Å; I211-N213 PolarHBondContact O-N 2.95Å; I211-T214 PolarHBondContact O-N 3.29Å; I211-Y215 HydrophobicContact CG2-CD2 3.87Å; I211-Y215 HydrophobicContact CG2-CE2 4.13Å; I211-Y215 VanDerWaalsContact O-CD2 3.28Å; I211-Y215 WeakPolarHBondContact O-CD2 3.38Å; I211-Y215 PolarHBondContact O-N 3.45Å; I211-Y215 VanDerWaalsContact O-N 3.1Å
212	A	92.9	Very high	92.2	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.008	30%	0.296	C	S	.	.	H	α-helix	trans	-58.2	-42.5	-179.9	0	0	0	0	0	112.4	V208 G209 N216 L217 V220 D221	V208-A212 WeakPolarHBondContact O-CB 3.37Å; V208-A212 PolarHBondContact O-N 3.05Å; G209-A212 PolarHBondContact O-N 3.19Å; A212-N216 CarbonylContact O-C 3.57Å; A212-N216 WeakPolarHBondContact O-CA 3.46Å; A212-N216 PolarHBondContact O-N 3.18Å; A212-L217 HydrophobicContact CB-CB 4.22Å; A212-L217 PolarHBondContact O-N 3.05Å; A212-V220 HydrophobicContact CB-CB 4.04Å; A212-V220 HydrophobicContact CB-CG1 3.98Å; A212-D221 HydrophobicContact CB-CB 4.06Å
213	N	91.6	Very high	92.4	Very high	111 Å²	111	61 Å²	61	59%	0.594	30%	0.301	S	S	*	.	H	α-helix	trans	-68.3	-43.9	177.4	-169	45.7	0	0	0	112.4	G209 R210 I211 Y215 N216	G209-N213 PolarHBondContact O-N 3.36Å; R210-N213 PolarHBondContact O-N 3.16Å; I211-N213 VanDerWaalsContact C-N 3.31Å; I211-N213 PolarHBondContact O-N 2.95Å; N213-Y215 VanDerWaalsContact C-N 3.28Å; N213-Y215 PolarHBondContact O-N 3.44Å; N213-N216 PolarHBondContact O-N 2.89Å
214	T	90.1	Very high	92.6	Very high	89 Å²	89	55.2 Å²	55.2	55%	0.546	27%	0.271	S	S	.	.	H	α-helix	trans	-58.4	-40	-180	-55.6	0	0	0	0	112.2	R210 I211	R210-T214 WeakPolarHBondContact O-CB 3.46Å; R210-T214 PolarHBondContact O-N 3.46Å; R210-T214 PolarHBondContact O-OG1 2.87Å; I211-T214 PolarHBondContact O-N 3.29Å
215	Y	88.8	Confident	92.7	Very high	36 Å²	36	54.6 Å²	54.6	14%	0.141	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	12.6	-177.8	-60.6	-73.8	0	0	0	114	L177 E178 I211 N213 L217	L177-Y215 HydrophobicContact CD2-CD2 3.36Å; L177-Y215 HydrophobicContact CD2-CE2 3.74Å; L177-Y215 HydrophobicContact CD2-CG 3.9Å; L177-Y215 HydrophobicContact CG-CD2 4.07Å; L177-Y215 HydrophobicContact CG-CE2 4.35Å; L177-Y215 HydrophobicContact CG-CG 4.2Å; E178-Y215 HydrophobicContact CB-CE1 4.03Å; E178-Y215 HydrophobicContact CG-CE1 4.26Å; I211-Y215 HydrophobicContact CG2-CD2 3.87Å; I211-Y215 HydrophobicContact CG2-CE2 4.13Å; I211-Y215 VanDerWaalsContact O-CD2 3.28Å; I211-Y215 WeakPolarHBondContact O-CD2 3.38Å; I211-Y215 PolarHBondContact O-N 3.45Å; I211-Y215 VanDerWaalsContact O-N 3.1Å; N213-Y215 VanDerWaalsContact C-N 3.28Å; N213-Y215 PolarHBondContact O-N 3.44Å; Y215-L217 VanDerWaalsContact C-N 3.28Å; Y215-L217 PolarHBondContact O-N 3.06Å
216	N	90.4	Very high	92.7	Very high	131 Å²	131	58.8 Å²	58.8	70%	0.701	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	39.1	-179	-63.6	-54.7	0	0	0	114.4	A212 N213 T218	A212-N216 CarbonylContact O-C 3.57Å; A212-N216 WeakPolarHBondContact O-CA 3.46Å; A212-N216 PolarHBondContact O-N 3.18Å; N213-N216 PolarHBondContact O-N 2.89Å; N216-T218 PolarHBondContact O-N 2.88Å
217	L	92.5	Very high	92.8	Very high	12 Å²	12	60 Å²	60	6%	0.063	29%	0.294	C	S	.	.			trans	-82.4	77.7	177.1	-54.6	-179.3	0	0	0	110.8	L177 K193 L196 A212 Y215 E219 V220 D221	L177-L217 HydrophobicContact CD1-CD1 4.14Å; L177-L217 HydrophobicContact CD2-CD1 4.01Å; K193-L217 HydrophobicContact CG-CD1 4.47Å; K193-L217 HydrophobicContact CG-CD2 4.23Å; L196-L217 HydrophobicContact CD1-CD1 3.83Å; A212-L217 HydrophobicContact CB-CB 4.22Å; A212-L217 PolarHBondContact O-N 3.05Å; Y215-L217 VanDerWaalsContact C-N 3.28Å; Y215-L217 PolarHBondContact O-N 3.06Å; L217-E219 VanDerWaalsContact C-N 3.32Å; L217-E219 PolarHBondContact O-N 3.46Å; L217-V220 HydrophobicContact CB-CB 4.07Å; L217-V220 HydrophobicContact CB-CG2 3.99Å; L217-V220 HydrophobicContact CD1-CG2 4.28Å; L217-V220 PolarHBondContact O-N 3.45Å; L217-D221 PolarHBondContact O-N 3.42Å
218	T	92.9	Very high	93.1	Very high	108 Å²	108	56.9 Å²	56.9	66%	0.663	28%	0.28	S	S	*	.	H	α-helix	trans	-57	-38.7	-173.3	55.6	0	0	0	0	114.3	N216 D221 K222	N216-T218 PolarHBondContact O-N 2.88Å; T218-D221 PolarHBondContact O-N 2.95Å; T218-K222 WeakPolarHBondContact O-CB 3.39Å; T218-K222 PolarHBondContact O-N 3.4Å
219	E	94.1	Very high	93.1	Very high	125 Å²	125	57.2 Å²	57.2	58%	0.584	28%	0.281	S	S	*	.	H	α-helix	trans	-65.7	-44.3	178.6	-66.5	177.3	166.7	0	0	112.2	L217 Y223	L217-E219 VanDerWaalsContact C-N 3.32Å; L217-E219 PolarHBondContact O-N 3.46Å; E219-Y223 PolarHBondContact O-N 3.22Å
220	V	95.2	Very high	93	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-66.4	-43.5	177.1	-175.7	0	0	0	0	109.6	K193 L196 I197 V208 A212 L217 K222 Y223 V224	K193-V220 HydrophobicContact CB-CG2 3.86Å; K193-V220 HydrophobicContact CG-CG2 3.94Å; L196-V220 HydrophobicContact CB-CG1 3.98Å; L196-V220 HydrophobicContact CD1-CG1 4.34Å; I197-V220 HydrophobicContact CD1-CG2 4.23Å; I197-V220 HydrophobicContact CG1-CB 4.48Å; I197-V220 HydrophobicContact CG1-CG1 4.41Å; I197-V220 HydrophobicContact CG1-CG2 4.1Å; V208-V220 HydrophobicContact CG1-CG1 3.94Å; A212-V220 HydrophobicContact CB-CB 4.04Å; A212-V220 HydrophobicContact CB-CG1 3.98Å; L217-V220 HydrophobicContact CB-CB 4.07Å; L217-V220 HydrophobicContact CB-CG2 3.99Å; L217-V220 HydrophobicContact CD1-CG2 4.28Å; L217-V220 PolarHBondContact O-N 3.45Å; V220-K222 PolarHBondContact O-N 3.41Å; V220-Y223 WeakPolarHBondContact O-CB 3.46Å; V220-Y223 PolarHBondContact O-N 3.02Å; V220-V224 HydrophobicContact CG1-CG2 4.36Å; V220-V224 VanDerWaalsContact O-CG2 3.32Å; V220-V224 WeakPolarHBondContact O-CG2 3.32Å; V220-V224 PolarHBondContact O-N 3.23Å
221	D	93.9	Very high	93	Very high	39 Å²	39	60.6 Å²	60.6	21%	0.209	30%	0.302	C	S	.	.	H	α-helix	trans	-61.3	-44.2	179.1	-171.2	62.1	0	0	0	112.3	A212 L217 T218 Y223 V224 N225 R248	A212-D221 HydrophobicContact CB-CB 4.06Å; L217-D221 PolarHBondContact O-N 3.42Å; T218-D221 PolarHBondContact O-N 2.95Å; D221-Y223 VanDerWaalsContact C-N 3.33Å; D221-Y223 PolarHBondContact O-N 2.86Å; D221-V224 PolarHBondContact O-N 3.34Å; D221-N225 WeakPolarHBondContact O-CB 3.34Å; D221-N225 PolarHBondContact O-N 3.18Å; D221-N225 PolarHBondContact O-ND2 3.25Å; D221-N225 PolarHBondContact OD2-ND2 3.18Å; D221-R248 IonicContact OD1-CZ 3.94Å; D221-R248 IonicContact OD1-NH1 3.77Å; D221-R248 PolarHBondContact OD1-NH1 3.49Å; D221-R248 IonicContact OD1-NH2 2.66Å; D221-R248 PolarHBondContact OD1-NH2 3.27Å
222	K	94.4	Very high	93.1	Very high	145 Å²	145	60 Å²	60	63%	0.63	30%	0.298	S	S	*	.	H	α-helix	trans	-60.7	-42.3	174.4	-174.1	178	-179.6	179.5	0	111.7	T218 V220 N225 N226	T218-K222 WeakPolarHBondContact O-CB 3.39Å; T218-K222 PolarHBondContact O-N 3.4Å; V220-K222 PolarHBondContact O-N 3.41Å; K222-N225 PolarHBondContact O-N 3.01Å; K222-N226 PolarHBondContact O-N 2.99Å; K222-N226 PolarHBondContact O-ND2 3.34Å
223	Y	95.8	Very high	93.1	Very high	98 Å²	98	62.1 Å²	62.1	38%	0.384	31%	0.312	S	S	.	.	H	α-helix	trans	-62.6	-46.1	176.2	-177.6	-93.1	0	0	0	111.7	I197 V200 E219 V220 D221 N225 N226 F227	I197-Y223 HydrophobicContact CB-CD1 4.4Å; I197-Y223 HydrophobicContact CG1-CD1 4.33Å; I197-Y223 HydrophobicContact CG1-CG 4.28Å; I197-Y223 HydrophobicContact CG2-CD1 3.95Å; I197-Y223 HydrophobicContact CG2-CD2 3.92Å; I197-Y223 HydrophobicContact CG2-CE1 3.88Å; I197-Y223 HydrophobicContact CG2-CE2 3.86Å; I197-Y223 HydrophobicContact CG2-CG 3.96Å; I197-Y223 WeakPolarHBondContact O-CE1 3.46Å; V200-Y223 HydrophobicContact CB-CE1 3.99Å; V200-Y223 HydrophobicContact CG1-CE1 4.45Å; V200-Y223 HydrophobicContact CG2-CD1 4.08Å; V200-Y223 HydrophobicContact CG2-CE1 3.97Å; E219-Y223 PolarHBondContact O-N 3.22Å; V220-Y223 WeakPolarHBondContact O-CB 3.46Å; V220-Y223 PolarHBondContact O-N 3.02Å; D221-Y223 VanDerWaalsContact C-N 3.33Å; D221-Y223 PolarHBondContact O-N 2.86Å; Y223-N225 PolarHBondContact O-N 3.2Å; Y223-N226 PolarHBondContact O-N 2.92Å; Y223-F227 WeakPolarHBondContact O-CB 3.44Å; Y223-F227 PolarHBondContact O-N 3.06Å
224	V	95.7	Very high	93.1	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.7	-43.8	176.7	172.3	0	0	0	0	111.3	V200 C205 V208 V220 D221 N226 F227 I228	V200-V224 HydrophobicContact CG2-CG2 4.15Å; C205-V224 WeakPolarHBondContact O-CG1 3.38Å; V208-V224 HydrophobicContact CB-CG2 4.41Å; V208-V224 HydrophobicContact CG1-CG2 3.78Å; V220-V224 HydrophobicContact CG1-CG2 4.36Å; V220-V224 VanDerWaalsContact O-CG2 3.32Å; V220-V224 WeakPolarHBondContact O-CG2 3.32Å; V220-V224 PolarHBondContact O-N 3.23Å; D221-V224 PolarHBondContact O-N 3.34Å; V224-N226 PolarHBondContact O-N 3.08Å; V224-F227 PolarHBondContact O-N 3.37Å; V224-I228 HydrophobicContact CG1-CD1 3.71Å; V224-I228 HydrophobicContact CG1-CG1 4.38Å; V224-I228 WeakPolarHBondContact O-CG1 3.37Å; V224-I228 PolarHBondContact O-N 2.94Å
225	N	94.3	Very high	93.2	Very high	19 Å²	19	55.9 Å²	55.9	10%	0.102	28%	0.281	C	S	.	.	H	α-helix	trans	-59.3	-46.1	176.5	-76.6	-30.5	0	0	0	111.9	D221 K222 Y223 I228 L229 R248 F251	D221-N225 WeakPolarHBondContact O-CB 3.34Å; D221-N225 PolarHBondContact O-N 3.18Å; D221-N225 PolarHBondContact O-ND2 3.25Å; D221-N225 PolarHBondContact OD2-ND2 3.18Å; K222-N225 PolarHBondContact O-N 3.01Å; Y223-N225 PolarHBondContact O-N 3.2Å; N225-I228 PolarHBondContact O-N 2.83Å; N225-L229 VanDerWaalsContact O-CG 3.32Å; N225-L229 WeakPolarHBondContact O-CG 3.42Å; N225-L229 PolarHBondContact O-N 3.31Å; N225-R248 WeakPolarHBondContact OD1-CG 3.49Å; N225-R248 PolarHBondContact OD1-NH1 3.17Å; N225-F251 HydrophobicContact CB-CD1 4.37Å; N225-F251 HydrophobicContact CB-CE1 3.81Å
226	N	93.8	Very high	93.3	Very high	88 Å²	88	55.7 Å²	55.7	47%	0.471	28%	0.282	S	S	.	.	H	α-helix	trans	-65.1	-39	176	-71.5	-19.8	0	0	0	112.4	K222 Y223 V224 L229 K230	K222-N226 PolarHBondContact O-N 2.99Å; K222-N226 PolarHBondContact O-ND2 3.34Å; Y223-N226 PolarHBondContact O-N 2.92Å; V224-N226 PolarHBondContact O-N 3.08Å; N226-L229 PolarHBondContact O-N 3.41Å; N226-K230 PolarHBondContact O-N 3.49Å
227	F	95	Very high	93.2	Very high	39 Å²	39	52.9 Å²	52.9	17%	0.171	28%	0.284	C	S	.	.	H	α-helix	trans	-62.6	-44.2	176.4	-179.3	-90.3	0	0	0	111.6	V200 L202 C205 Y223 V224 K230 N231	V200-F227 HydrophobicContact CG1-CB 4.25Å; V200-F227 HydrophobicContact CG1-CD1 3.56Å; V200-F227 HydrophobicContact CG1-CD2 3.92Å; V200-F227 HydrophobicContact CG1-CE1 3.8Å; V200-F227 HydrophobicContact CG1-CE2 4.14Å; V200-F227 HydrophobicContact CG1-CG 3.63Å; V200-F227 HydrophobicContact CG1-CZ 4.09Å; L202-F227 HydrophobicContact CD2-CE1 4.22Å; L202-F227 HydrophobicContact CD2-CZ 4.44Å; C205-F227 HydrophobicContact CB-CD1 4Å; C205-F227 HydrophobicContact CB-CE1 4.06Å; Y223-F227 WeakPolarHBondContact O-CB 3.44Å; Y223-F227 PolarHBondContact O-N 3.06Å; V224-F227 PolarHBondContact O-N 3.37Å; F227-K230 PolarHBondContact O-N 3.11Å; F227-N231 PolarHBondContact O-N 3.18Å; F227-N231 PolarHBondContact O-ND2 3.17Å
228	I	94.4	Very high	93.1	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-65.1	-45.3	176.9	-69	165	0	0	0	110.4	C205 V224 N225 K230 N231 F232 L235 L244 R248 V252	C205-I228 HydrophobicContact CB-CG1 4.48Å; V224-I228 HydrophobicContact CG1-CD1 3.71Å; V224-I228 HydrophobicContact CG1-CG1 4.38Å; V224-I228 WeakPolarHBondContact O-CG1 3.37Å; V224-I228 PolarHBondContact O-N 2.94Å; N225-I228 PolarHBondContact O-N 2.83Å; I228-K230 VanDerWaalsContact C-N 3.28Å; I228-K230 PolarHBondContact O-N 3.37Å; I228-N231 CarbonylContact O-C 3.56Å; I228-N231 PolarHBondContact O-N 2.9Å; I228-F232 HydrophobicContact CG2-CD2 4.04Å; I228-F232 VanDerWaalsContact O-CA 3.29Å; I228-F232 WeakPolarHBondContact O-CA 3.34Å; I228-F232 VanDerWaalsContact O-CB 3.3Å; I228-F232 WeakPolarHBondContact O-CB 3.41Å; I228-F232 PolarHBondContact O-N 3.22Å; I228-L235 HydrophobicContact CG1-CD2 4.43Å; I228-L235 HydrophobicContact CG2-CD2 3.97Å; I228-L244 HydrophobicContact CD1-CD2 4.07Å; I228-R248 VanDerWaalsContact CD1-CD 3.47Å; I228-R248 HydrophobicContact CD1-CG 4.36Å; I228-V252 HydrophobicContact CG2-CG2 3.74Å
229	L	92.6	Very high	92.8	Very high	9 Å²	9	50.7 Å²	50.7	5%	0.047	28%	0.28	C	S	.	.	H	α-helix	trans	-56.4	-42.2	177.1	-75.5	169.4	0	0	0	112.3	N225 N226 F251 V252 L258	N225-L229 VanDerWaalsContact O-CG 3.32Å; N225-L229 WeakPolarHBondContact O-CG 3.42Å; N225-L229 PolarHBondContact O-N 3.31Å; N226-L229 PolarHBondContact O-N 3.41Å; L229-F251 HydrophobicContact CD1-CE1 3.93Å; L229-F251 HydrophobicContact CD1-CZ 4.37Å; L229-F251 HydrophobicContact CG-CE1 4.47Å; L229-V252 HydrophobicContact CD2-CB 4.41Å; L229-V252 HydrophobicContact CD2-CG1 4.16Å; L229-V252 HydrophobicContact CD2-CG2 4.33Å; L229-L258 HydrophobicContact CD2-CB 4.37Å; L229-L258 HydrophobicContact CD2-CD1 4.19Å
230	K	91.3	Very high	92.6	Very high	168 Å²	168	46.8 Å²	46.8	73%	0.73	26%	0.262	S	S	*	.	H	α-helix	trans	-70.6	-36.3	180	-173.8	179.1	177.6	-175.6	0	113	N226 F227 I228	N226-K230 PolarHBondContact O-N 3.49Å; F227-K230 PolarHBondContact O-N 3.11Å; I228-K230 VanDerWaalsContact C-N 3.28Å; I228-K230 PolarHBondContact O-N 3.37Å
231	N	92.6	Very high	92.5	Very high	41 Å²	41	46.8 Å²	46.8	22%	0.219	26%	0.262	C	S	.	.	H	α-helix	trans	-111.3	17.5	-172.9	-57.4	-79.7	0	0	0	113.6	L202 F227 I228 P233 S234 L235	L202-N231 HydrophobicContact CD2-CB 3.76Å; F227-N231 PolarHBondContact O-N 3.18Å; F227-N231 PolarHBondContact O-ND2 3.17Å; I228-N231 CarbonylContact O-C 3.56Å; I228-N231 PolarHBondContact O-N 2.9Å; N231-P233 VanDerWaalsContact C-CD 3.48Å; N231-S234 PolarHBondContact O-N 3.31Å; N231-L235 PolarHBondContact O-N 3.31Å
232	F	93.2	Very high	92.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-56.4	-45	-175.3	-168	-107.5	0	0	0	113.5	I228 S234 L235 L236 F241 L249 V252 L258 L266	I228-F232 HydrophobicContact CG2-CD2 4.04Å; I228-F232 VanDerWaalsContact O-CA 3.29Å; I228-F232 WeakPolarHBondContact O-CA 3.34Å; I228-F232 VanDerWaalsContact O-CB 3.3Å; I228-F232 WeakPolarHBondContact O-CB 3.41Å; I228-F232 PolarHBondContact O-N 3.22Å; F232-S234 VanDerWaalsContact C-N 3.31Å; F232-S234 PolarHBondContact O-N 3.45Å; F232-L235 WeakPolarHBondContact O-CB 3.32Å; F232-L235 PolarHBondContact O-N 3.43Å; F232-L235 VanDerWaalsContact O-N 3.08Å; F232-L236 HydrophobicContact CD1-CD1 4.28Å; F232-L236 HydrophobicContact CD1-CD2 4.43Å; F232-L236 HydrophobicContact CD1-CG 4.26Å; F232-L236 HydrophobicContact CE1-CD1 4.06Å; F232-L236 HydrophobicContact CE1-CD2 3.8Å; F232-L236 HydrophobicContact CE1-CG 4.07Å; F232-L236 HydrophobicContact CE2-CD2 4.42Å; F232-L236 HydrophobicContact CZ-CD2 3.81Å; F232-L236 HydrophobicContact CZ-CG 4.5Å; F232-L236 WeakPolarHBondContact O-CG 3.28Å; F232-L236 PolarHBondContact O-N 3.1Å; F232-F241 HydrophobicContact CE2-CD2 4.16Å; F232-F241 AromaticContact CE2-CE2 3.88Å; F232-F241 HydrophobicContact CE2-CE2 3.88Å; F232-F241 HydrophobicContact CZ-CD2 4.4Å; F232-F241 AromaticContact CZ-CE2 3.78Å; F232-F241 HydrophobicContact CZ-CE2 3.78Å; F232-L249 HydrophobicContact CE2-CD1 4.33Å; F232-L249 HydrophobicContact CZ-CD1 4.29Å; F232-V252 HydrophobicContact CD2-CG1 3.58Å; F232-V252 HydrophobicContact CE2-CG1 3.58Å; F232-V252 HydrophobicContact CG-CG1 4.11Å; F232-V252 HydrophobicContact CZ-CG1 4.11Å; F232-L258 HydrophobicContact CB-CD1 3.55Å; F232-L258 HydrophobicContact CD1-CD1 3.85Å; F232-L258 HydrophobicContact CD1-CD2 4.36Å; F232-L258 HydrophobicContact CG-CD1 3.76Å; F232-L266 HydrophobicContact CD1-CD2 4.15Å; F232-L266 HydrophobicContact CE1-CD2 3.62Å
233	P	91.9	Very high	92.3	Very high	46 Å²	46	43.9 Å²	43.9	30%	0.299	25%	0.248	S	C	.	.	H	α-helix	trans	-57.9	-43.4	177.8	-18.2	26.9	0	0	0	112.5	N231 L235 L236 H260	N231-P233 VanDerWaalsContact C-CD 3.48Å; P233-L235 VanDerWaalsContact C-N 3.34Å; P233-L235 PolarHBondContact O-N 2.96Å; P233-L236 WeakPolarHBondContact O-CB 3.11Å; P233-L236 PolarHBondContact O-N 2.78Å; P233-H260 HydrophobicContact CG-CB 3.91Å
234	S	92.4	Very high	92.2	Very high	67 Å²	67	39.3 Å²	39.3	47%	0.469	23%	0.23	S	C	.	.	H	α-helix	trans	-65.9	-37.6	176.8	-52.8	0	0	0	0	111.7	N231 F232 L236 G237	N231-S234 PolarHBondContact O-N 3.31Å; F232-S234 VanDerWaalsContact C-N 3.31Å; F232-S234 PolarHBondContact O-N 3.45Å; S234-L236 VanDerWaalsContact C-N 3.32Å; S234-L236 PolarHBondContact O-N 3.5Å; S234-G237 PolarHBondContact O-N 3.14Å
235	L	92.8	Very high	92.1	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-65.1	-33.4	177.1	-171.9	68.2	0	0	0	112.3	I228 N231 F232 P233 G237 T238 E240 F241 L244	I228-L235 HydrophobicContact CG1-CD2 4.43Å; I228-L235 HydrophobicContact CG2-CD2 3.97Å; N231-L235 PolarHBondContact O-N 3.31Å; F232-L235 WeakPolarHBondContact O-CB 3.32Å; F232-L235 PolarHBondContact O-N 3.43Å; F232-L235 VanDerWaalsContact O-N 3.08Å; P233-L235 VanDerWaalsContact C-N 3.34Å; P233-L235 PolarHBondContact O-N 2.96Å; L235-G237 PolarHBondContact O-N 3.41Å; L235-T238 PolarHBondContact O-N 3.26Å; L235-T238 PolarHBondContact O-OG1 3.06Å; L235-E240 HydrophobicContact CD1-CB 4.4Å; L235-F241 HydrophobicContact CG-CB 4.26Å; L235-F241 WeakPolarHBondContact O-CB 3.32Å; L235-L244 HydrophobicContact CD2-CD1 4.1Å
236	L	91	Very high	92.1	Very high	33 Å²	33	42.9 Å²	42.9	17%	0.173	25%	0.252	C	S	.	.	H	α-helix	trans	-59.6	-29.3	175.7	-65.8	179.2	0	0	0	112.5	F232 P233 S234 T238 F241 A269 R272	F232-L236 HydrophobicContact CD1-CD1 4.28Å; F232-L236 HydrophobicContact CD1-CD2 4.43Å; F232-L236 HydrophobicContact CD1-CG 4.26Å; F232-L236 HydrophobicContact CE1-CD1 4.06Å; F232-L236 HydrophobicContact CE1-CD2 3.8Å; F232-L236 HydrophobicContact CE1-CG 4.07Å; F232-L236 HydrophobicContact CE2-CD2 4.42Å; F232-L236 HydrophobicContact CZ-CD2 3.81Å; F232-L236 HydrophobicContact CZ-CG 4.5Å; F232-L236 WeakPolarHBondContact O-CG 3.28Å; F232-L236 PolarHBondContact O-N 3.1Å; P233-L236 WeakPolarHBondContact O-CB 3.11Å; P233-L236 PolarHBondContact O-N 2.78Å; S234-L236 VanDerWaalsContact C-N 3.32Å; S234-L236 PolarHBondContact O-N 3.5Å; L236-T238 VanDerWaalsContact C-N 3.32Å; L236-F241 HydrophobicContact CD2-CD1 4.27Å; L236-F241 HydrophobicContact CD2-CD2 3.71Å; L236-F241 HydrophobicContact CD2-CE1 4.21Å; L236-F241 HydrophobicContact CD2-CE2 3.64Å; L236-F241 HydrophobicContact CD2-CG 4.04Å; L236-F241 HydrophobicContact CD2-CZ 3.92Å; L236-A269 HydrophobicContact CD1-CB 4.36Å; L236-A269 HydrophobicContact CD2-CB 3.5Å; L236-R272 PolarHBondContact O-NH1 3.07Å
237	G	87.5	Confident	92.1	Very high	71 Å²	71	45.4 Å²	45.4	73%	0.732	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-17.8	175.7	0	0	0	0	0	114.3	S234 L235	S234-G237 PolarHBondContact O-N 3.14Å; L235-G237 PolarHBondContact O-N 3.41Å
238	T	90.2	Very high	92.1	Very high	29 Å²	29	44.4 Å²	44.4	18%	0.178	26%	0.255	C	S	.	.	S	Bend	trans	-89.9	166.5	-176.9	79.6	0	0	0	0	112.4	L235 L236 E240 R272	L235-T238 PolarHBondContact O-N 3.26Å; L235-T238 PolarHBondContact O-OG1 3.06Å; L236-T238 VanDerWaalsContact C-N 3.32Å; T238-E240 VanDerWaalsContact C-N 3.26Å; T238-E240 PolarHBondContact OG1-N 2.75Å; T238-R272 PolarHBondContact O-NH2 3.45Å
239	G	87.1	Confident	92.1	Very high	46 Å²	46	44.3 Å²	44.3	47%	0.474	26%	0.255	S	S	.	.	S	Bend	trans	-76.9	-10.4	170.6	0	0	0	0	0	113.8	V242	G239-V242 VanDerWaalsContact O-CG2 3.31Å; G239-V242 WeakPolarHBondContact O-CG2 3.39Å
240	E	90.1	Very high	92.3	Very high	43 Å²	43	44.5 Å²	44.5	20%	0.201	26%	0.258	C	S	.	.	S	Bend	trans	-81.9	-28.8	-174.8	-61.2	-52.6	124.1	0	0	112.6	V206 L235 T238 V242 K243	V206-E240 HydrophobicContact CG2-CB 4Å; L235-E240 HydrophobicContact CD1-CB 4.4Å; T238-E240 VanDerWaalsContact C-N 3.26Å; T238-E240 PolarHBondContact OG1-N 2.75Å; E240-V242 VanDerWaalsContact C-N 3.27Å; E240-V242 PolarHBondContact O-N 3.37Å; E240-V242 VanDerWaalsContact O-N 3.17Å; E240-K243 WeakPolarHBondContact O-CB 3.39Å; E240-K243 PolarHBondContact O-N 3.11Å; E240-K243 IonicContact OE1-NZ 2.79Å; E240-K243 PolarHBondContact OE1-NZ 3.39Å; E240-K243 WeakPolarHBondContact OE2-CD 3.13Å; E240-K243 IonicContact OE2-NZ 2.65Å; E240-K243 PolarHBondContact OE2-NZ 3.43Å
241	F	92.6	Very high	92.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-49.8	-44.8	179.2	166.3	-104.1	0	0	0	113.6	F232 L235 L236 K243 L244 L249 A269 W273	F232-F241 HydrophobicContact CE2-CD2 4.16Å; F232-F241 AromaticContact CE2-CE2 3.88Å; F232-F241 HydrophobicContact CE2-CE2 3.88Å; F232-F241 HydrophobicContact CZ-CD2 4.4Å; F232-F241 AromaticContact CZ-CE2 3.78Å; F232-F241 HydrophobicContact CZ-CE2 3.78Å; L235-F241 HydrophobicContact CG-CB 4.26Å; L235-F241 WeakPolarHBondContact O-CB 3.32Å; L236-F241 HydrophobicContact CD2-CD1 4.27Å; L236-F241 HydrophobicContact CD2-CD2 3.71Å; L236-F241 HydrophobicContact CD2-CE1 4.21Å; L236-F241 HydrophobicContact CD2-CE2 3.64Å; L236-F241 HydrophobicContact CD2-CG 4.04Å; L236-F241 HydrophobicContact CD2-CZ 3.92Å; F241-K243 PolarHBondContact O-N 2.88Å; F241-L244 HydrophobicContact CD2-CD1 3.79Å; F241-L244 HydrophobicContact CE2-CD1 4.2Å; F241-L244 WeakPolarHBondContact O-CB 3.38Å; F241-L244 WeakPolarHBondContact O-CG 3.44Å; F241-L244 PolarHBondContact O-N 3.39Å; F241-L244 VanDerWaalsContact O-N 3.16Å; F241-L249 HydrophobicContact CE2-CD1 3.74Å; F241-L249 HydrophobicContact CZ-CD1 4.19Å; F241-A269 HydrophobicContact CE1-CB 4.27Å; F241-A269 WeakPolarHBondContact CE1-O 3.38Å; F241-A269 HydrophobicContact CE2-CB 4.43Å; F241-A269 HydrophobicContact CZ-CB 3.77Å; F241-A269 WeakPolarHBondContact CZ-O 3.47Å; F241-W273 HydrophobicContact CE1-CB 4.07Å; F241-W273 HydrophobicContact CZ-CB 4.11Å
242	V	92.6	Very high	92.6	Very high	10 Å²	10	38.8 Å²	38.8	6%	0.061	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-68.7	-16	-177.4	-65.7	0	0	0	0	113.2	G239 E240 R272 F276 R280	G239-V242 VanDerWaalsContact O-CG2 3.31Å; G239-V242 WeakPolarHBondContact O-CG2 3.39Å; E240-V242 VanDerWaalsContact C-N 3.27Å; E240-V242 PolarHBondContact O-N 3.37Å; E240-V242 VanDerWaalsContact O-N 3.17Å; V242-R272 HydrophobicContact CG1-CG 4.21Å; V242-F276 HydrophobicContact CB-CB 4.33Å; V242-F276 HydrophobicContact CB-CD1 4.16Å; V242-F276 HydrophobicContact CB-CD2 3.83Å; V242-F276 HydrophobicContact CB-CE1 4.47Å; V242-F276 HydrophobicContact CB-CE2 4.16Å; V242-F276 HydrophobicContact CB-CG 3.83Å; V242-F276 HydrophobicContact CB-CZ 4.47Å; V242-F276 HydrophobicContact CG1-CD2 4.14Å; V242-F276 HydrophobicContact CG1-CG 4.36Å; V242-F276 HydrophobicContact CG2-CD1 4.41Å; V242-F276 HydrophobicContact CG2-CD2 3.84Å; V242-F276 HydrophobicContact CG2-CE1 4.24Å; V242-F276 HydrophobicContact CG2-CE2 3.65Å; V242-F276 HydrophobicContact CG2-CG 4.23Å; V242-F276 HydrophobicContact CG2-CZ 3.86Å; V242-R280 PolarHBondContact O-NH1 3.14Å; V242-R280 PolarHBondContact O-NH2 3.15Å; V242-R280 VanDerWaalsContact O-NH2 3.12Å
243	K	92.6	Very high	92.7	Very high	113 Å²	113	38.8 Å²	38.8	49%	0.491	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-87.7	-4.3	177.2	-54.4	-177.3	-163.6	158.8	0	113.2	V206 E240 F241	V206-K243 HydrophobicContact CG1-CB 4.14Å; E240-K243 WeakPolarHBondContact O-CB 3.39Å; E240-K243 PolarHBondContact O-N 3.11Å; E240-K243 IonicContact OE1-NZ 2.79Å; E240-K243 PolarHBondContact OE1-NZ 3.39Å; E240-K243 WeakPolarHBondContact OE2-CD 3.13Å; E240-K243 IonicContact OE2-NZ 2.65Å; E240-K243 PolarHBondContact OE2-NZ 3.43Å; F241-K243 PolarHBondContact O-N 2.88Å
244	L	93.6	Very high	92.8	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	24%	0.235	C	C	.	.			trans	-59.2	137.4	177.7	-76.9	170.1	0	0	0	111.3	V206 I228 L235 F241 R248 L249 W273	V206-L244 HydrophobicContact CG1-CD2 4.29Å; V206-L244 HydrophobicContact CG2-CD2 3.77Å; V206-L244 HydrophobicContact CG2-CG 4.12Å; I228-L244 HydrophobicContact CD1-CD2 4.07Å; L235-L244 HydrophobicContact CD2-CD1 4.1Å; F241-L244 HydrophobicContact CD2-CD1 3.79Å; F241-L244 HydrophobicContact CE2-CD1 4.2Å; F241-L244 WeakPolarHBondContact O-CB 3.38Å; F241-L244 WeakPolarHBondContact O-CG 3.44Å; F241-L244 PolarHBondContact O-N 3.39Å; F241-L244 VanDerWaalsContact O-N 3.16Å; L244-R248 HydrophobicContact CD2-CG 4.42Å; L244-L249 HydrophobicContact CD1-CD1 4.5Å; L244-W273 PolarHBondContact O-NE1 2.89Å
245	P	93.6	Very high	92.8	Very high	64 Å²	64	36.8 Å²	36.8	42%	0.416	22%	0.218	S	C	.	.			trans	-69.2	152.1	172.7	29.1	-33.3	0	0	0	110.8	E247 R248 L249	P245-E247 VanDerWaalsContact C-N 3.33Å; P245-E247 PolarHBondContact O-N 3.16Å; P245-R248 HydrophobicContact CG-CB 3.82Å; P245-R248 PolarHBondContact O-N 2.93Å; P245-L249 PolarHBondContact O-N 3.47Å; P245-L249 VanDerWaalsContact O-N 3.11Å
246	F	94.2	Very high	92.8	Very high	31 Å²	31	38.8 Å²	38.8	14%	0.136	23%	0.229	C	C	.	.	H	α-helix	trans	-50.3	-50.6	-178.6	167.9	-101.3	0	0	0	112.5	R248 L249 A250 W273 Y283 K286 L287	F246-R248 VanDerWaalsContact C-N 3.28Å; F246-R248 PolarHBondContact O-N 3.43Å; F246-L249 PolarHBondContact O-N 3.27Å; F246-A250 HydrophobicContact CE1-CB 4.46Å; F246-A250 HydrophobicContact CE2-CB 4.35Å; F246-A250 HydrophobicContact CZ-CB 4.16Å; F246-A250 WeakPolarHBondContact O-CB 3.31Å; F246-A250 PolarHBondContact O-N 2.97Å; F246-W273 HydrophobicContact CB-CH2 3.9Å; F246-W273 HydrophobicContact CB-CZ2 4.21Å; F246-W273 HydrophobicContact CD2-CH2 4.21Å; F246-W273 HydrophobicContact CD2-CZ3 4.49Å; F246-Y283 HydrophobicContact CB-CD1 4.48Å; F246-Y283 AromaticContact CD1-CD1 3.98Å; F246-Y283 HydrophobicContact CD1-CD1 3.98Å; F246-Y283 HydrophobicContact CD1-CE1 4.16Å; F246-Y283 AromaticContact CD2-CD1 3.6Å; F246-Y283 HydrophobicContact CD2-CD1 3.6Å; F246-Y283 HydrophobicContact CD2-CE1 4.44Å; F246-Y283 AromaticContact CD2-CG 3.8Å; F246-Y283 HydrophobicContact CD2-CG 3.8Å; F246-Y283 HydrophobicContact CE1-CD1 4.13Å; F246-Y283 AromaticContact CE2-CD1 3.76Å; F246-Y283 HydrophobicContact CE2-CD1 3.76Å; F246-Y283 HydrophobicContact CE2-CG 4.12Å; F246-Y283 AromaticContact CG-CD1 3.73Å; F246-Y283 HydrophobicContact CG-CD1 3.73Å; F246-Y283 HydrophobicContact CG-CE1 4.12Å; F246-Y283 HydrophobicContact CG-CG 4.23Å; F246-Y283 HydrophobicContact CZ-CD1 4.03Å; F246-K286 HydrophobicContact CE2-CB 4.15Å; F246-K286 HydrophobicContact CZ-CB 3.83Å; F246-K286 HydrophobicContact CZ-CD 4.26Å; F246-L287 HydrophobicContact CE2-CB 4.44Å; F246-L287 HydrophobicContact CE2-CD1 4.29Å
247	E	93.7	Very high	92.7	Very high	141 Å²	141	40.4 Å²	40.4	66%	0.659	24%	0.243	S	C	*	.	H	α-helix	trans	-59.6	-39.4	-175.8	-61	-58.6	163.5	0	0	112.4	P245 F251	P245-E247 VanDerWaalsContact C-N 3.33Å; P245-E247 PolarHBondContact O-N 3.16Å; E247-F251 WeakPolarHBondContact O-CB 3.36Å; E247-F251 PolarHBondContact O-N 3.2Å
248	R	94.2	Very high	92.7	Very high	17 Å²	17	37.3 Å²	37.3	6%	0.064	21%	0.209	C	C	.	.	H	α-helix	trans	-71.6	-41.4	179.6	-164.8	175.9	-55.4	-93.3	2.7	111.3	G209 D221 N225 I228 L244 P245 F246 F251 V252	G209-R248 PolarHBondContact O-NH2 3.28Å; G209-R248 VanDerWaalsContact O-NH2 3.09Å; D221-R248 IonicContact OD1-CZ 3.94Å; D221-R248 IonicContact OD1-NH1 3.77Å; D221-R248 PolarHBondContact OD1-NH1 3.49Å; D221-R248 IonicContact OD1-NH2 2.66Å; D221-R248 PolarHBondContact OD1-NH2 3.27Å; N225-R248 WeakPolarHBondContact OD1-CG 3.49Å; N225-R248 PolarHBondContact OD1-NH1 3.17Å; I228-R248 VanDerWaalsContact CD1-CD 3.47Å; I228-R248 HydrophobicContact CD1-CG 4.36Å; L244-R248 HydrophobicContact CD2-CG 4.42Å; P245-R248 HydrophobicContact CG-CB 3.82Å; P245-R248 PolarHBondContact O-N 2.93Å; F246-R248 VanDerWaalsContact C-N 3.28Å; F246-R248 PolarHBondContact O-N 3.43Å; R248-F251 PolarHBondContact O-N 2.85Å; R248-V252 VanDerWaalsContact O-CG2 3.27Å; R248-V252 WeakPolarHBondContact O-CG2 3.29Å; R248-V252 PolarHBondContact O-N 3.24Å
249	L	95.5	Very high	92.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-65.7	-43.5	176.3	-177.2	63.1	0	0	0	111.4	F232 F241 L244 P245 F246 F251 V252 L253 W273 L287	F232-L249 HydrophobicContact CE2-CD1 4.33Å; F232-L249 HydrophobicContact CZ-CD1 4.29Å; F241-L249 HydrophobicContact CE2-CD1 3.74Å; F241-L249 HydrophobicContact CZ-CD1 4.19Å; L244-L249 HydrophobicContact CD1-CD1 4.5Å; P245-L249 PolarHBondContact O-N 3.47Å; P245-L249 VanDerWaalsContact O-N 3.11Å; F246-L249 PolarHBondContact O-N 3.27Å; L249-F251 VanDerWaalsContact C-N 3.34Å; L249-F251 PolarHBondContact O-N 2.69Å; L249-V252 PolarHBondContact O-N 3.23Å; L249-L253 HydrophobicContact CD1-CD1 4.26Å; L249-L253 HydrophobicContact CD1-CG 4.16Å; L249-L253 HydrophobicContact CG-CD1 4.07Å; L249-L253 HydrophobicContact CG-CG 4.34Å; L249-L253 WeakPolarHBondContact O-CB 3.38Å; L249-L253 WeakPolarHBondContact O-CG 3.36Å; L249-L253 PolarHBondContact O-N 2.86Å; L249-W273 HydrophobicContact CD2-CB 3.82Å; L249-W273 HydrophobicContact CD2-CD2 3.54Å; L249-W273 HydrophobicContact CD2-CE3 4.07Å; L249-W273 HydrophobicContact CD2-CG 3.4Å; L249-W273 VanDerWaalsContact CD2-CG 3.4Å; L249-L287 HydrophobicContact CD2-CD1 3.98Å; L249-L287 HydrophobicContact CD2-CD2 3.9Å; L249-L287 HydrophobicContact CG-CD1 4Å
250	A	96.1	Very high	92	Very high	12 Å²	12	44.4 Å²	44.4	10%	0.099	23%	0.226	C	C	.	.	H	α-helix	trans	-59.6	-44.6	175.6	0	0	0	0	0	111.3	F246 L253 S254 L287	F246-A250 HydrophobicContact CE1-CB 4.46Å; F246-A250 HydrophobicContact CE2-CB 4.35Å; F246-A250 HydrophobicContact CZ-CB 4.16Å; F246-A250 WeakPolarHBondContact O-CB 3.31Å; F246-A250 PolarHBondContact O-N 2.97Å; A250-L253 PolarHBondContact O-N 3.46Å; A250-S254 WeakPolarHBondContact O-CB 3.32Å; A250-S254 PolarHBondContact O-N 2.88Å; A250-S254 PolarHBondContact O-OG 3.47Å; A250-L287 HydrophobicContact CB-CD1 4.48Å
251	F	94.9	Very high	91.9	Very high	90 Å²	90	43.6 Å²	43.6	40%	0.395	23%	0.225	S	C	.	.	H	α-helix	trans	-56.8	-51.3	173.6	171.8	-97.3	0	0	0	111.9	N225 L229 E247 R248 L249 L253 S254 S255	N225-F251 HydrophobicContact CB-CD1 4.37Å; N225-F251 HydrophobicContact CB-CE1 3.81Å; L229-F251 HydrophobicContact CD1-CE1 3.93Å; L229-F251 HydrophobicContact CD1-CZ 4.37Å; L229-F251 HydrophobicContact CG-CE1 4.47Å; E247-F251 WeakPolarHBondContact O-CB 3.36Å; E247-F251 PolarHBondContact O-N 3.2Å; R248-F251 PolarHBondContact O-N 2.85Å; L249-F251 VanDerWaalsContact C-N 3.34Å; L249-F251 PolarHBondContact O-N 2.69Å; F251-L253 PolarHBondContact O-N 3.28Å; F251-S254 PolarHBondContact O-N 2.97Å; F251-S254 VanDerWaalsContact O-N 3.11Å; F251-S254 PolarHBondContact O-OG 3.48Å; F251-S255 PolarHBondContact O-N 3.38Å; F251-S255 VanDerWaalsContact O-N 3.14Å
252	V	94.4	Very high	91.9	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-59.5	-46.4	179.7	170.2	0	0	0	0	111.4	I228 L229 F232 R248 L249 S254 S255 L258	I228-V252 HydrophobicContact CG2-CG2 3.74Å; L229-V252 HydrophobicContact CD2-CB 4.41Å; L229-V252 HydrophobicContact CD2-CG1 4.16Å; L229-V252 HydrophobicContact CD2-CG2 4.33Å; F232-V252 HydrophobicContact CD2-CG1 3.58Å; F232-V252 HydrophobicContact CE2-CG1 3.58Å; F232-V252 HydrophobicContact CG-CG1 4.11Å; F232-V252 HydrophobicContact CZ-CG1 4.11Å; R248-V252 VanDerWaalsContact O-CG2 3.27Å; R248-V252 WeakPolarHBondContact O-CG2 3.29Å; R248-V252 PolarHBondContact O-N 3.24Å; L249-V252 PolarHBondContact O-N 3.23Å; V252-S254 VanDerWaalsContact C-N 3.28Å; V252-S254 PolarHBondContact O-N 3.35Å; V252-S255 WeakPolarHBondContact O-CB 3.27Å; V252-S255 PolarHBondContact O-N 3.28Å; V252-L258 HydrophobicContact CG1-CD1 3.96Å; V252-L258 HydrophobicContact CG1-CD2 4.4Å
253	L	94.9	Very high	92	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-70.2	-20.4	178.1	-65.7	179.6	0	0	0	113.2	L249 A250 F251 L266 A270 L287 N290 R345	L249-L253 HydrophobicContact CD1-CD1 4.26Å; L249-L253 HydrophobicContact CD1-CG 4.16Å; L249-L253 HydrophobicContact CG-CD1 4.07Å; L249-L253 HydrophobicContact CG-CG 4.34Å; L249-L253 WeakPolarHBondContact O-CB 3.38Å; L249-L253 WeakPolarHBondContact O-CG 3.36Å; L249-L253 PolarHBondContact O-N 2.86Å; A250-L253 PolarHBondContact O-N 3.46Å; F251-L253 PolarHBondContact O-N 3.28Å; L253-L266 HydrophobicContact CD2-CB 3.96Å; L253-L266 HydrophobicContact CD2-CD1 4.43Å; L253-L266 HydrophobicContact CD2-CD2 4.04Å; L253-L266 HydrophobicContact CD2-CG 4.35Å; L253-A270 HydrophobicContact CD1-CB 4.21Å; L253-L287 HydrophobicContact CD1-CD1 3.62Å; L253-L287 HydrophobicContact CD1-CG 3.87Å; L253-N290 HydrophobicContact CB-CB 3.74Å; L253-R345 PolarHBondContact O-NH1 3.39Å; L253-R345 PolarHBondContact O-NH2 3.16Å
254	S	94.4	Very high	92.1	Very high	54 Å²	54	41.5 Å²	41.5	38%	0.378	22%	0.22	S	C	.	.	H	α-helix	trans	-83	-21.6	174.5	71.7	0	0	0	0	112.9	A250 F251 V252 R292	A250-S254 WeakPolarHBondContact O-CB 3.32Å; A250-S254 PolarHBondContact O-N 2.88Å; A250-S254 PolarHBondContact O-OG 3.47Å; F251-S254 PolarHBondContact O-N 2.97Å; F251-S254 VanDerWaalsContact O-N 3.11Å; F251-S254 PolarHBondContact O-OG 3.48Å; V252-S254 VanDerWaalsContact C-N 3.28Å; V252-S254 PolarHBondContact O-N 3.35Å; S254-R292 PolarHBondContact O-NH2 2.78Å
255	S	93.8	Very high	92.1	Very high	16 Å²	16	44.5 Å²	44.5	11%	0.112	24%	0.236	C	C	.	.			trans	-70.7	139.1	-168.7	-174.9	0	0	0	0	114.1	F251 V252 S257 R345	F251-S255 PolarHBondContact O-N 3.38Å; F251-S255 VanDerWaalsContact O-N 3.14Å; V252-S255 WeakPolarHBondContact O-CB 3.27Å; V252-S255 PolarHBondContact O-N 3.28Å; S255-S257 VanDerWaalsContact C-N 3.29Å; S255-S257 PolarHBondContact OG-N 3.38Å; S255-R345 PolarHBondContact O-NH1 2.99Å
256	N	91.6	Very high	92.2	Very high	44 Å²	44	41.4 Å²	41.4	24%	0.235	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-6.1	167.5	-80.5	-21.3	0	0	0	113.2	R292 R345 D347	N256-R292 PolarHBondContact OD1-NH1 3.39Å; N256-R292 PolarHBondContact OD1-NH2 3.32Å; N256-R345 CarbonylContact O-C 3.6Å; N256-D347 WeakPolarHBondContact CB-OD1 2.98Å; N256-D347 WeakPolarHBondContact CB-OD2 3.28Å; N256-D347 PolarHBondContact ND2-OD1 3.48Å
257	S	89.5	Confident	92.3	Very high	67 Å²	67	40.1 Å²	40.1	47%	0.469	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-2.5	177.6	-63.6	0	0	0	0	113.3	S255 K259	S255-S257 VanDerWaalsContact C-N 3.29Å; S255-S257 PolarHBondContact OG-N 3.38Å; S257-K259 PolarHBondContact O-N 3.47Å
258	L	87.6	Confident	92.4	Very high	5 Å²	5	38 Å²	38	3%	0.026	20%	0.199	C	C	.	.			trans	-73.8	118.8	179.7	-168.6	65.9	0	0	0	109.9	L229 F232 V252 L266	L229-L258 HydrophobicContact CD2-CB 4.37Å; L229-L258 HydrophobicContact CD2-CD1 4.19Å; F232-L258 HydrophobicContact CB-CD1 3.55Å; F232-L258 HydrophobicContact CD1-CD1 3.85Å; F232-L258 HydrophobicContact CD1-CD2 4.36Å; F232-L258 HydrophobicContact CG-CD1 3.76Å; V252-L258 HydrophobicContact CG1-CD1 3.96Å; V252-L258 HydrophobicContact CG1-CD2 4.4Å; L258-L266 HydrophobicContact CD2-CD1 3.72Å; L258-L266 HydrophobicContact CD2-CD2 3.47Å; L258-L266 VanDerWaalsContact CD2-CD2 3.47Å; L258-L266 HydrophobicContact CD2-CG 4.24Å
259	K	79.6	Confident	92.4	Very high	113 Å²	113	37.5 Å²	37.5	49%	0.491	20%	0.199	S	C	.	.			trans	-113.5	160.5	-177.1	-61.3	-173.5	179.5	-169.5	0	111.3	S257 C261	S257-K259 PolarHBondContact O-N 3.47Å; K259-C261 VanDerWaalsContact C-N 3.28Å; K259-C261 PolarHBondContact O-N 3.33Å
260	H	82.4	Confident	92.5	Very high	111 Å²	111	37.5 Å²	37.5	51%	0.514	20%	0.199	S	C	.	.	S	Bend	trans	60.8	31.4	171	-41.7	-69.4	0	0	0	114.6	P233 E625	P233-H260 HydrophobicContact CG-CB 3.91Å; H260-E625 VanDerWaalsContact CE1-CD 3.43Å; H260-E625 IonicContact CE1-OE1 3.12Å; H260-E625 PolarHBondContact CE1-OE1 3.49Å; H260-E625 IonicContact CG-OE1 2.92Å; H260-E625 IonicContact ND1-OE1 2.8Å; H260-E625 PolarHBondContact ND1-OE1 3.04Å; H260-E625 IonicContact ND1-OE2 2.8Å
261	C	88.1	Confident	92.4	Very high	27 Å²	27	37.3 Å²	37.3	18%	0.182	20%	0.197	C	C	.	.			trans	-137.8	129.1	172.9	-75.2	0	0	0	0	109.1	K259 L266	K259-C261 VanDerWaalsContact C-N 3.28Å; K259-C261 PolarHBondContact O-N 3.33Å; C261-L266 HydrophobicContact CB-CD2 3.64Å; C261-L266 HydrophobicContact CB-CG 4.13Å
262	T	92	Very high	92.4	Very high	50 Å²	50	38.3 Å²	38.3	31%	0.307	20%	0.198	S	C	.	.			trans	-73.9	156.8	169	69	0	0	0	0	109.6	L264 D265 L266	T262-L264 PolarHBondContact O-N 2.78Å; T262-D265 WeakPolarHBondContact CB-OD2 3.34Å; T262-D265 PolarHBondContact N-OD2 2.91Å; T262-D265 WeakPolarHBondContact O-CB 3.45Å; T262-D265 PolarHBondContact O-N 3.15Å; T262-D265 PolarHBondContact OG1-N 3.47Å; T262-D265 PolarHBondContact OG1-OD2 3.11Å; T262-L266 WeakPolarHBondContact O-CG 3.21Å; T262-L266 PolarHBondContact O-N 3.2Å; T262-L266 VanDerWaalsContact O-N 3.12Å
263	E	94.4	Very high	92.5	Very high	17 Å²	17	38.6 Å²	38.6	8%	0.079	20%	0.199	C	C	.	.	H	α-helix	trans	-58.2	-31.5	174.4	-68.2	-62.6	150.3	0	0	111.7	L266 F267 R292 L295 M296 R345	E263-L266 PolarHBondContact O-N 3.42Å; E263-F267 WeakPolarHBondContact O-CB 3.41Å; E263-F267 PolarHBondContact O-N 2.92Å; E263-R292 HydrophobicContact CG-CB 4.01Å; E263-R292 PolarHBondContact OE2-N 3.03Å; E263-L295 HydrophobicContact CG-CB 4.13Å; E263-M296 VanDerWaalsContact C-CE 3.49Å; E263-M296 HydrophobicContact CB-CE 3.68Å; E263-M296 HydrophobicContact CB-CG 3.84Å; E263-M296 VanDerWaalsContact O-CE 3.29Å; E263-M296 WeakPolarHBondContact O-CE 3.29Å; E263-R345 WeakPolarHBondContact OE1-CD 3.4Å; E263-R345 IonicContact OE1-CZ 2.83Å; E263-R345 IonicContact OE1-NE 3.54Å; E263-R345 PolarHBondContact OE1-NE 3.12Å; E263-R345 IonicContact OE1-NH2 3.39Å; E263-R345 PolarHBondContact OE1-NH2 3.25Å; E263-R345 IonicContact OE2-CZ 3.9Å; E263-R345 IonicContact OE2-NE 3.01Å; E263-R345 IonicContact OE2-NH2 3.76Å; E263-R345 PolarHBondContact OE2-NH2 2.96Å; E263-R345 VanDerWaalsContact OE2-NH2 3.17Å
264	L	94.9	Very high	92.5	Very high	12 Å²	12	38.6 Å²	38.6	6%	0.063	20%	0.199	C	C	.	.	H	α-helix	trans	-63.1	-41.7	175.6	179.4	65.3	0	0	0	111.8	T262 L266 F267 K268 E300 H304	T262-L264 PolarHBondContact O-N 2.78Å; L264-L266 VanDerWaalsContact C-N 3.34Å; L264-F267 PolarHBondContact O-N 3.17Å; L264-K268 HydrophobicContact CG-CD 4.31Å; L264-K268 WeakPolarHBondContact O-CG 3.37Å; L264-K268 PolarHBondContact O-N 3.06Å; L264-E300 HydrophobicContact CD1-CB 4.44Å; L264-E300 HydrophobicContact CD2-CG 3.94Å; L264-H304 HydrophobicContact CD1-CB 3.65Å
265	D	94	Very high	92.5	Very high	63 Å²	63	43.5 Å²	43.5	34%	0.337	21%	0.209	S	C	.	.	H	α-helix	trans	-64.9	-41.3	176.9	-59.9	-42.9	0	0	0	110.9	T262 F267 K268 A269	T262-D265 WeakPolarHBondContact CB-OD2 3.34Å; T262-D265 PolarHBondContact N-OD2 2.91Å; T262-D265 WeakPolarHBondContact O-CB 3.45Å; T262-D265 PolarHBondContact O-N 3.15Å; T262-D265 PolarHBondContact OG1-N 3.47Å; T262-D265 PolarHBondContact OG1-OD2 3.11Å; D265-F267 VanDerWaalsContact C-N 3.33Å; D265-F267 PolarHBondContact O-N 3.12Å; D265-K268 PolarHBondContact O-N 3.2Å; D265-A269 VanDerWaalsContact O-CB 3.31Å; D265-A269 WeakPolarHBondContact O-CB 3.47Å; D265-A269 PolarHBondContact O-N 2.96Å
266	L	95.6	Very high	92.4	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.2	-40.9	174.9	-59.5	-175.6	0	0	0	112	F232 L253 L258 C261 T262 E263 L264 A269 A270	F232-L266 HydrophobicContact CD1-CD2 4.15Å; F232-L266 HydrophobicContact CE1-CD2 3.62Å; L253-L266 HydrophobicContact CD2-CB 3.96Å; L253-L266 HydrophobicContact CD2-CD1 4.43Å; L253-L266 HydrophobicContact CD2-CD2 4.04Å; L253-L266 HydrophobicContact CD2-CG 4.35Å; L258-L266 HydrophobicContact CD2-CD1 3.72Å; L258-L266 HydrophobicContact CD2-CD2 3.47Å; L258-L266 VanDerWaalsContact CD2-CD2 3.47Å; L258-L266 HydrophobicContact CD2-CG 4.24Å; C261-L266 HydrophobicContact CB-CD2 3.64Å; C261-L266 HydrophobicContact CB-CG 4.13Å; T262-L266 WeakPolarHBondContact O-CG 3.21Å; T262-L266 PolarHBondContact O-N 3.2Å; T262-L266 VanDerWaalsContact O-N 3.12Å; E263-L266 PolarHBondContact O-N 3.42Å; L264-L266 VanDerWaalsContact C-N 3.34Å; L266-A269 PolarHBondContact O-N 3.39Å; L266-A270 WeakPolarHBondContact O-CB 3.33Å; L266-A270 PolarHBondContact O-N 3.36Å
267	F	96.9	Very high	92.4	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.018	24%	0.236	C	C	.	.	H	α-helix	trans	-63.2	-46.3	174.5	172.6	-104.4	0	0	0	112.5	E263 L264 D265 A269 A270 C271 M288 I291 F293 M296 V305 V308 M311	E263-F267 WeakPolarHBondContact O-CB 3.41Å; E263-F267 PolarHBondContact O-N 2.92Å; L264-F267 PolarHBondContact O-N 3.17Å; D265-F267 VanDerWaalsContact C-N 3.33Å; D265-F267 PolarHBondContact O-N 3.12Å; F267-A269 VanDerWaalsContact C-N 3.31Å; F267-A269 PolarHBondContact O-N 3.41Å; F267-A270 PolarHBondContact O-N 2.66Å; F267-C271 VanDerWaalsContact CZ-SG 3.52Å; F267-C271 PolarHBondContact O-N 2.86Å; F267-C271 PolarHBondContact O-SG 3.46Å; F267-M288 HydrophobicContact CD2-CE 4.24Å; F267-M288 HydrophobicContact CD2-SD 3.69Å; F267-M288 HydrophobicContact CE2-CE 4.11Å; F267-M288 HydrophobicContact CE2-SD 3.72Å; F267-I291 HydrophobicContact CB-CD1 4.12Å; F267-I291 HydrophobicContact CB-CG2 4.37Å; F267-I291 HydrophobicContact CD2-CD1 4.16Å; F267-F293 AromaticContact CD2-CE1 3.63Å; F267-F293 HydrophobicContact CD2-CE1 3.63Å; F267-F293 AromaticContact CD2-CZ 3.92Å; F267-F293 HydrophobicContact CD2-CZ 3.92Å; F267-F293 HydrophobicContact CE2-CE1 4.09Å; F267-F293 HydrophobicContact CE2-CZ 4.29Å; F267-F293 HydrophobicContact CG-CE1 4.26Å; F267-M296 HydrophobicContact CB-CE 3.85Å; F267-V305 HydrophobicContact CD1-CG2 3.95Å; F267-V305 HydrophobicContact CD2-CG1 4.41Å; F267-V305 HydrophobicContact CE1-CB 4.19Å; F267-V305 HydrophobicContact CE1-CG1 4.29Å; F267-V305 HydrophobicContact CE1-CG2 3.93Å; F267-V305 HydrophobicContact CE2-CG1 3.85Å; F267-V305 HydrophobicContact CG-CG2 4.3Å; F267-V305 HydrophobicContact CZ-CB 4.14Å; F267-V305 HydrophobicContact CZ-CG1 3.77Å; F267-V305 HydrophobicContact CZ-CG2 4.25Å; F267-V308 HydrophobicContact CE1-CG2 4.14Å; F267-V308 HydrophobicContact CZ-CB 4.29Å; F267-V308 HydrophobicContact CZ-CG2 3.79Å; F267-M311 HydrophobicContact CE2-CG 4.13Å; F267-M311 HydrophobicContact CE2-SD 4.08Å; F267-M311 HydrophobicContact CZ-CG 4.24Å
268	K	95.1	Very high	92.1	Very high	96 Å²	96	54.9 Å²	54.9	42%	0.417	26%	0.255	S	S	.	.	H	α-helix	trans	-61.1	-42	175.7	-72.7	170.2	-179.2	167.4	0	111.2	L264 D265 C271 R272	L264-K268 HydrophobicContact CG-CD 4.31Å; L264-K268 WeakPolarHBondContact O-CG 3.37Å; L264-K268 PolarHBondContact O-N 3.06Å; D265-K268 PolarHBondContact O-N 3.2Å; K268-C271 PolarHBondContact O-N 3.45Å; K268-R272 WeakPolarHBondContact O-CB 3.36Å; K268-R272 PolarHBondContact O-N 3.37Å
269	A	95.4	Very high	92.2	Very high	7 Å²	7	57.1 Å²	57.1	6%	0.058	28%	0.28	C	S	.	.	H	α-helix	trans	-61.9	-47.3	176.3	0	0	0	0	0	111.9	L236 F241 D265 L266 F267 C271 R272 W273	L236-A269 HydrophobicContact CD1-CB 4.36Å; L236-A269 HydrophobicContact CD2-CB 3.5Å; F241-A269 HydrophobicContact CE1-CB 4.27Å; F241-A269 WeakPolarHBondContact CE1-O 3.38Å; F241-A269 HydrophobicContact CE2-CB 4.43Å; F241-A269 HydrophobicContact CZ-CB 3.77Å; F241-A269 WeakPolarHBondContact CZ-O 3.47Å; D265-A269 VanDerWaalsContact O-CB 3.31Å; D265-A269 WeakPolarHBondContact O-CB 3.47Å; D265-A269 PolarHBondContact O-N 2.96Å; L266-A269 PolarHBondContact O-N 3.39Å; F267-A269 VanDerWaalsContact C-N 3.31Å; F267-A269 PolarHBondContact O-N 3.41Å; A269-C271 VanDerWaalsContact C-N 3.35Å; A269-C271 PolarHBondContact O-N 3.17Å; A269-R272 PolarHBondContact O-N 3Å; A269-W273 PolarHBondContact O-N 3.33Å
270	A	96.4	Very high	92.9	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.8	-44	175.7	0	0	0	0	0	111.8	L253 L266 F267 R272 W273 L274 L287 M288 I291	L253-A270 HydrophobicContact CD1-CB 4.21Å; L266-A270 WeakPolarHBondContact O-CB 3.33Å; L266-A270 PolarHBondContact O-N 3.36Å; F267-A270 PolarHBondContact O-N 2.66Å; A270-R272 PolarHBondContact O-N 3.17Å; A270-W273 PolarHBondContact O-N 3.26Å; A270-L274 VanDerWaalsContact O-CG 3.29Å; A270-L274 WeakPolarHBondContact O-CG 3.47Å; A270-L274 PolarHBondContact O-N 3.27Å; A270-L287 HydrophobicContact CB-CD2 3.76Å; A270-L287 HydrophobicContact CB-CG 4.22Å; A270-M288 HydrophobicContact CB-CE 3.9Å; A270-I291 HydrophobicContact CB-CD1 3.84Å
271	C	95.3	Very high	93.3	Very high	8 Å²	8	51.3 Å²	51.3	5%	0.054	26%	0.255	C	S	.	.	H	α-helix	trans	-61.1	-42	175.1	-70.1	0	0	0	0	112.4	F267 K268 A269 W273 L274 R275	F267-C271 VanDerWaalsContact CZ-SG 3.52Å; F267-C271 PolarHBondContact O-N 2.86Å; F267-C271 PolarHBondContact O-SG 3.46Å; K268-C271 PolarHBondContact O-N 3.45Å; A269-C271 VanDerWaalsContact C-N 3.35Å; A269-C271 PolarHBondContact O-N 3.17Å; C271-W273 VanDerWaalsContact C-N 3.35Å; C271-L274 PolarHBondContact O-N 2.95Å; C271-R275 WeakPolarHBondContact O-CB 3.3Å; C271-R275 VanDerWaalsContact O-CG 3.3Å; C271-R275 WeakPolarHBondContact O-CG 3.46Å; C271-R275 PolarHBondContact O-N 2.93Å
272	R	94.9	Very high	93.5	Very high	110 Å²	110	57.8 Å²	57.8	42%	0.415	28%	0.282	S	S	.	.	H	α-helix	trans	-63	-41.4	176.3	178.8	177.7	164.9	-158.6	-8.8	111.5	L236 T238 V242 K268 A269 A270 F276	L236-R272 PolarHBondContact O-NH1 3.07Å; T238-R272 PolarHBondContact O-NH2 3.45Å; V242-R272 HydrophobicContact CG1-CG 4.21Å; K268-R272 WeakPolarHBondContact O-CB 3.36Å; K268-R272 PolarHBondContact O-N 3.37Å; A269-R272 PolarHBondContact O-N 3Å; A270-R272 PolarHBondContact O-N 3.17Å; R272-F276 PolarHBondContact O-N 3.2Å
273	W	96.1	Very high	93.7	Very high	7 Å²	7	59.4 Å²	59.4	3%	0.027	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-40.1	177.8	-176.3	94.5	0	0	0	112.6	F241 L244 F246 L249 A269 A270 C271 F276 R280 L287	F241-W273 HydrophobicContact CE1-CB 4.07Å; F241-W273 HydrophobicContact CZ-CB 4.11Å; L244-W273 PolarHBondContact O-NE1 2.89Å; F246-W273 HydrophobicContact CB-CH2 3.9Å; F246-W273 HydrophobicContact CB-CZ2 4.21Å; F246-W273 HydrophobicContact CD2-CH2 4.21Å; F246-W273 HydrophobicContact CD2-CZ3 4.49Å; L249-W273 HydrophobicContact CD2-CB 3.82Å; L249-W273 HydrophobicContact CD2-CD2 3.54Å; L249-W273 HydrophobicContact CD2-CE3 4.07Å; L249-W273 HydrophobicContact CD2-CG 3.4Å; L249-W273 VanDerWaalsContact CD2-CG 3.4Å; A269-W273 PolarHBondContact O-N 3.33Å; A270-W273 PolarHBondContact O-N 3.26Å; C271-W273 VanDerWaalsContact C-N 3.35Å; W273-F276 WeakPolarHBondContact O-CB 3.49Å; W273-F276 PolarHBondContact O-N 3.38Å; W273-R280 VanDerWaalsContact CE2-NH1 3.3Å; W273-R280 HydrophobicContact CE3-CB 4.45Å; W273-R280 HydrophobicContact CH2-CB 4.31Å; W273-R280 HydrophobicContact CH2-CG 3.94Å; W273-R280 HydrophobicContact CZ2-CG 4.48Å; W273-R280 HydrophobicContact CZ3-CB 3.92Å; W273-R280 HydrophobicContact CZ3-CG 4.03Å; W273-R280 VanDerWaalsContact NE1-NH1 3.16Å; W273-R280 VanDerWaalsContact O-CD 3.24Å; W273-R280 WeakPolarHBondContact O-CD 3.46Å; W273-R280 PolarHBondContact O-NH1 2.93Å; W273-R280 VanDerWaalsContact O-NH1 3.1Å; W273-L287 HydrophobicContact CE3-CD2 3.91Å; W273-L287 HydrophobicContact CZ3-CD2 4.36Å
274	L	95.4	Very high	93.7	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-67.2	-37.8	177.8	-71.4	167	0	0	0	112.7	A270 C271 F276 R280 M281 A284 L287 M288 F310	A270-L274 VanDerWaalsContact O-CG 3.29Å; A270-L274 WeakPolarHBondContact O-CG 3.47Å; A270-L274 PolarHBondContact O-N 3.27Å; C271-L274 PolarHBondContact O-N 2.95Å; L274-F276 VanDerWaalsContact C-N 3.26Å; L274-F276 PolarHBondContact O-N 3.45Å; L274-R280 HydrophobicContact CD2-CB 4.37Å; L274-R280 WeakPolarHBondContact CD2-O 3.4Å; L274-M281 HydrophobicContact CB-SD 4.27Å; L274-A284 HydrophobicContact CD1-CB 3.9Å; L274-A284 HydrophobicContact CD2-CB 4.19Å; L274-L287 HydrophobicContact CD1-CD2 4.3Å; L274-L287 HydrophobicContact CD2-CD2 4.23Å; L274-L287 HydrophobicContact CG-CD2 4.05Å; L274-M288 HydrophobicContact CD1-CE 3.55Å; L274-F310 HydrophobicContact CD1-CE1 4.44Å; L274-F310 HydrophobicContact CD1-CZ 4.02Å
275	R	93.4	Very high	93.7	Very high	157 Å²	157	59.1 Å²	59.1	59%	0.592	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-6.9	-179.6	-70.2	174.7	-177.9	176.9	1.2	114.1	C271 M281	C271-R275 WeakPolarHBondContact O-CB 3.3Å; C271-R275 VanDerWaalsContact O-CG 3.3Å; C271-R275 WeakPolarHBondContact O-CG 3.46Å; C271-R275 PolarHBondContact O-N 2.93Å; R275-M281 HydrophobicContact CG-CE 3.91Å
276	F	92.8	Very high	93.8	Very high	109 Å²	109	62 Å²	62	48%	0.478	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-33.9	-177.2	-174.3	-103.6	0	0	0	112.6	V242 R272 W273 L274	V242-F276 HydrophobicContact CB-CB 4.33Å; V242-F276 HydrophobicContact CB-CD1 4.16Å; V242-F276 HydrophobicContact CB-CD2 3.83Å; V242-F276 HydrophobicContact CB-CE1 4.47Å; V242-F276 HydrophobicContact CB-CE2 4.16Å; V242-F276 HydrophobicContact CB-CG 3.83Å; V242-F276 HydrophobicContact CB-CZ 4.47Å; V242-F276 HydrophobicContact CG1-CD2 4.14Å; V242-F276 HydrophobicContact CG1-CG 4.36Å; V242-F276 HydrophobicContact CG2-CD1 4.41Å; V242-F276 HydrophobicContact CG2-CD2 3.84Å; V242-F276 HydrophobicContact CG2-CE1 4.24Å; V242-F276 HydrophobicContact CG2-CE2 3.65Å; V242-F276 HydrophobicContact CG2-CG 4.23Å; V242-F276 HydrophobicContact CG2-CZ 3.86Å; R272-F276 PolarHBondContact O-N 3.2Å; W273-F276 WeakPolarHBondContact O-CB 3.49Å; W273-F276 PolarHBondContact O-N 3.38Å; L274-F276 VanDerWaalsContact C-N 3.26Å; L274-F276 PolarHBondContact O-N 3.45Å
277	E	91.5	Very high	93.8	Very high	94 Å²	94	62 Å²	62	44%	0.439	30%	0.295	S	S	.	.	S	Bend	trans	-137.7	134	178.3	-75.9	164.8	-158.3	0	0	109.9	G279 R280	E277-G279 VanDerWaalsContact C-N 3.26Å; E277-G279 PolarHBondContact O-N 2.62Å; E277-R280 HydrophobicContact CB-CG 3.92Å; E277-R280 VanDerWaalsContact CD-NE 3.27Å; E277-R280 WeakPolarHBondContact O-CB 3.38Å; E277-R280 PolarHBondContact O-N 2.85Å; E277-R280 IonicContact OE1-CZ 3.3Å; E277-R280 IonicContact OE1-NE 3.42Å; E277-R280 IonicContact OE1-NH2 3.26Å; E277-R280 PolarHBondContact OE1-NH2 3.06Å; E277-R280 IonicContact OE2-CZ 3.41Å; E277-R280 IonicContact OE2-NE 3.16Å; E277-R280 PolarHBondContact OE2-NE 3.38Å; E277-R280 IonicContact OE2-NH2 2.62Å; E277-R280 PolarHBondContact OE2-NH2 3.45Å
278	D	82	Confident	93.8	Very high	162 Å²	162	61.8 Å²	61.8	87%	0.866	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-58.7	-35.1	-174.2	-65.6	-39.4	0	0	0	113.4	R280	D278-R280 PolarHBondContact O-N 3.06Å
279	G	89.2	Confident	93.8	Very high	52 Å²	52	62.5 Å²	62.5	54%	0.536	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-68.9	-12.7	178.7	0	0	0	0	0	114.4	E277 M281	E277-G279 VanDerWaalsContact C-N 3.26Å; E277-G279 PolarHBondContact O-N 2.62Å; G279-M281 VanDerWaalsContact C-N 3.31Å; G279-M281 PolarHBondContact O-N 2.86Å
280	R	94.1	Very high	93.9	Very high	18 Å²	18	64.1 Å²	64.1	7%	0.068	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-78.6	-15.9	-176.2	-68.1	178.2	-174	-170.1	1.2	113.5	V242 W273 L274 E277 D278 E282 Y283	V242-R280 PolarHBondContact O-NH1 3.14Å; V242-R280 PolarHBondContact O-NH2 3.15Å; V242-R280 VanDerWaalsContact O-NH2 3.12Å; W273-R280 VanDerWaalsContact CE2-NH1 3.3Å; W273-R280 HydrophobicContact CE3-CB 4.45Å; W273-R280 HydrophobicContact CH2-CB 4.31Å; W273-R280 HydrophobicContact CH2-CG 3.94Å; W273-R280 HydrophobicContact CZ2-CG 4.48Å; W273-R280 HydrophobicContact CZ3-CB 3.92Å; W273-R280 HydrophobicContact CZ3-CG 4.03Å; W273-R280 VanDerWaalsContact NE1-NH1 3.16Å; W273-R280 VanDerWaalsContact O-CD 3.24Å; W273-R280 WeakPolarHBondContact O-CD 3.46Å; W273-R280 PolarHBondContact O-NH1 2.93Å; W273-R280 VanDerWaalsContact O-NH1 3.1Å; L274-R280 HydrophobicContact CD2-CB 4.37Å; L274-R280 WeakPolarHBondContact CD2-O 3.4Å; E277-R280 HydrophobicContact CB-CG 3.92Å; E277-R280 VanDerWaalsContact CD-NE 3.27Å; E277-R280 WeakPolarHBondContact O-CB 3.38Å; E277-R280 PolarHBondContact O-N 2.85Å; E277-R280 IonicContact OE1-CZ 3.3Å; E277-R280 IonicContact OE1-NE 3.42Å; E277-R280 IonicContact OE1-NH2 3.26Å; E277-R280 PolarHBondContact OE1-NH2 3.06Å; E277-R280 IonicContact OE2-CZ 3.41Å; E277-R280 IonicContact OE2-NE 3.16Å; E277-R280 PolarHBondContact OE2-NE 3.38Å; E277-R280 IonicContact OE2-NH2 2.62Å; E277-R280 PolarHBondContact OE2-NH2 3.45Å; D278-R280 PolarHBondContact O-N 3.06Å; R280-E282 PolarHBondContact O-N 3.17Å; R280-E282 VanDerWaalsContact O-N 3.16Å; R280-Y283 WeakPolarHBondContact O-CB 3.5Å; R280-Y283 PolarHBondContact O-N 3.37Å
281	M	92.4	Very high	93.8	Very high	84 Å²	84	64.1 Å²	64.1	41%	0.414	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-60.8	-26.1	-179.1	-70	-63.9	-176.9	0	0	113	L274 R275 G279 Y283 A284 F310	L274-M281 HydrophobicContact CB-SD 4.27Å; R275-M281 HydrophobicContact CG-CE 3.91Å; G279-M281 VanDerWaalsContact C-N 3.31Å; G279-M281 PolarHBondContact O-N 2.86Å; M281-Y283 PolarHBondContact O-N 2.65Å; M281-A284 WeakPolarHBondContact O-CB 3.32Å; M281-A284 PolarHBondContact O-N 2.92Å; M281-F310 HydrophobicContact SD-CD1 4.47Å
282	E	92.3	Very high	93.9	Very high	163 Å²	163	64.5 Å²	64.5	76%	0.762	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-61.7	-25.5	173.4	-62.1	-172.7	171.1	0	0	113.1	R280	R280-E282 PolarHBondContact O-N 3.17Å; R280-E282 VanDerWaalsContact O-N 3.16Å
283	Y	94.6	Very high	93.9	Very high	85 Å²	85	59.2 Å²	59.2	33%	0.333	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-87.2	-4.7	177.8	-60	-81.7	0	0	0	113.1	F246 R280 M281 A285 K286 L287	F246-Y283 HydrophobicContact CB-CD1 4.48Å; F246-Y283 AromaticContact CD1-CD1 3.98Å; F246-Y283 HydrophobicContact CD1-CD1 3.98Å; F246-Y283 HydrophobicContact CD1-CE1 4.16Å; F246-Y283 AromaticContact CD2-CD1 3.6Å; F246-Y283 HydrophobicContact CD2-CD1 3.6Å; F246-Y283 HydrophobicContact CD2-CE1 4.44Å; F246-Y283 AromaticContact CD2-CG 3.8Å; F246-Y283 HydrophobicContact CD2-CG 3.8Å; F246-Y283 HydrophobicContact CE1-CD1 4.13Å; F246-Y283 AromaticContact CE2-CD1 3.76Å; F246-Y283 HydrophobicContact CE2-CD1 3.76Å; F246-Y283 HydrophobicContact CE2-CG 4.12Å; F246-Y283 AromaticContact CG-CD1 3.73Å; F246-Y283 HydrophobicContact CG-CD1 3.73Å; F246-Y283 HydrophobicContact CG-CE1 4.12Å; F246-Y283 HydrophobicContact CG-CG 4.23Å; F246-Y283 HydrophobicContact CZ-CD1 4.03Å; R280-Y283 WeakPolarHBondContact O-CB 3.5Å; R280-Y283 PolarHBondContact O-N 3.37Å; M281-Y283 PolarHBondContact O-N 2.65Å; Y283-A285 PolarHBondContact O-N 2.71Å; Y283-K286 HydrophobicContact CD1-CD 4.46Å; Y283-K286 PolarHBondContact O-N 2.87Å; Y283-K286 VanDerWaalsContact O-N 3.09Å; Y283-L287 WeakPolarHBondContact O-CB 3.42Å; Y283-L287 PolarHBondContact O-N 3.39Å
284	A	94.7	Very high	93.9	Very high	6 Å²	6	58.9 Å²	58.9	5%	0.05	28%	0.284	C	S	.	.	H	α-helix	trans	-54.1	-54.2	-173.3	0	0	0	0	0	112	L274 M281 K286 L287 M288 F310	L274-A284 HydrophobicContact CD1-CB 3.9Å; L274-A284 HydrophobicContact CD2-CB 4.19Å; M281-A284 WeakPolarHBondContact O-CB 3.32Å; M281-A284 PolarHBondContact O-N 2.92Å; A284-K286 VanDerWaalsContact C-N 3.31Å; A284-K286 PolarHBondContact O-N 2.88Å; A284-L287 PolarHBondContact O-N 3.26Å; A284-M288 WeakPolarHBondContact O-CB 3.4Å; A284-M288 WeakPolarHBondContact O-CG 3.31Å; A284-M288 PolarHBondContact O-N 3.12Å; A284-F310 HydrophobicContact CB-CD2 4.05Å; A284-F310 HydrophobicContact CB-CE2 4.23Å; A284-F310 HydrophobicContact CB-CG 4.43Å
285	A	95.1	Very high	93.8	Very high	16 Å²	16	60.3 Å²	60.3	13%	0.132	29%	0.292	C	S	.	.	H	α-helix	trans	-59.3	-39.8	178.9	0	0	0	0	0	112.9	Y283 K289 T316	Y283-A285 PolarHBondContact O-N 2.71Å; A285-K289 WeakPolarHBondContact O-CG 3.35Å; A285-K289 PolarHBondContact O-N 2.64Å; A285-T316 HydrophobicContact CB-CG2 4.29Å
286	K	95.9	Very high	93.9	Very high	123 Å²	123	52.9 Å²	52.9	54%	0.535	26%	0.263	S	S	.	.	H	α-helix	trans	-68.8	-39.5	179.4	-65.1	179.6	-179	173.7	0	111.7	F246 Y283 A284 N290	F246-K286 HydrophobicContact CE2-CB 4.15Å; F246-K286 HydrophobicContact CZ-CB 3.83Å; F246-K286 HydrophobicContact CZ-CD 4.26Å; Y283-K286 HydrophobicContact CD1-CD 4.46Å; Y283-K286 PolarHBondContact O-N 2.87Å; Y283-K286 VanDerWaalsContact O-N 3.09Å; A284-K286 VanDerWaalsContact C-N 3.31Å; A284-K286 PolarHBondContact O-N 2.88Å; K286-N290 PolarHBondContact O-ND2 2.95Å
287	L	95.9	Very high	93.8	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-71.9	-43.7	-179.5	-165.2	65.1	0	0	0	111.4	F246 L249 A250 L253 A270 W273 L274 Y283 A284 K289 N290	F246-L287 HydrophobicContact CE2-CB 4.44Å; F246-L287 HydrophobicContact CE2-CD1 4.29Å; L249-L287 HydrophobicContact CD2-CD1 3.98Å; L249-L287 HydrophobicContact CD2-CD2 3.9Å; L249-L287 HydrophobicContact CG-CD1 4Å; A250-L287 HydrophobicContact CB-CD1 4.48Å; L253-L287 HydrophobicContact CD1-CD1 3.62Å; L253-L287 HydrophobicContact CD1-CG 3.87Å; A270-L287 HydrophobicContact CB-CD2 3.76Å; A270-L287 HydrophobicContact CB-CG 4.22Å; W273-L287 HydrophobicContact CE3-CD2 3.91Å; W273-L287 HydrophobicContact CZ3-CD2 4.36Å; L274-L287 HydrophobicContact CD1-CD2 4.3Å; L274-L287 HydrophobicContact CD2-CD2 4.23Å; L274-L287 HydrophobicContact CG-CD2 4.05Å; Y283-L287 WeakPolarHBondContact O-CB 3.42Å; Y283-L287 PolarHBondContact O-N 3.39Å; A284-L287 PolarHBondContact O-N 3.26Å; L287-K289 VanDerWaalsContact C-N 3.27Å; L287-K289 PolarHBondContact O-N 2.99Å; L287-N290 WeakPolarHBondContact O-CB 3.16Å; L287-N290 PolarHBondContact O-N 3.33Å; L287-N290 VanDerWaalsContact O-N 3.11Å; L287-N290 PolarHBondContact O-ND2 2.78Å
288	M	96.3	Very high	93.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.8	-27.7	-178.1	-66.8	-65.7	153.4	0	0	113.2	F267 A270 L274 A284 N290 I291 F293 F310 M311 L320	F267-M288 HydrophobicContact CD2-CE 4.24Å; F267-M288 HydrophobicContact CD2-SD 3.69Å; F267-M288 HydrophobicContact CE2-CE 4.11Å; F267-M288 HydrophobicContact CE2-SD 3.72Å; A270-M288 HydrophobicContact CB-CE 3.9Å; L274-M288 HydrophobicContact CD1-CE 3.55Å; A284-M288 WeakPolarHBondContact O-CB 3.4Å; A284-M288 WeakPolarHBondContact O-CG 3.31Å; A284-M288 PolarHBondContact O-N 3.12Å; M288-N290 PolarHBondContact O-N 3Å; M288-I291 PolarHBondContact O-N 2.97Å; M288-I291 HydrophobicContact SD-CD1 3.72Å; M288-F293 HydrophobicContact CB-CE2 4.32Å; M288-F293 HydrophobicContact CB-CZ 4.39Å; M288-F293 WeakPolarHBondContact O-CE2 3.14Å; M288-F293 HydrophobicContact SD-CZ 3.96Å; M288-F310 HydrophobicContact CE-CE2 3.68Å; M288-F310 HydrophobicContact CE-CZ 3.56Å; M288-F310 HydrophobicContact CG-CE2 4.01Å; M288-F310 HydrophobicContact SD-CE2 4.21Å; M288-M311 HydrophobicContact CG-SD 3.99Å; M288-M311 HydrophobicContact SD-SD 3.98Å; M288-L320 HydrophobicContact CB-CD1 3.99Å
289	K	95.9	Very high	94.5	Very high	112 Å²	112	48.2 Å²	48.2	49%	0.487	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.2	173.3	-78.2	179.5	-173.7	-169.5	0	113.3	A285 L287 I291 T316 L320	A285-K289 WeakPolarHBondContact O-CG 3.35Å; A285-K289 PolarHBondContact O-N 2.64Å; L287-K289 VanDerWaalsContact C-N 3.27Å; L287-K289 PolarHBondContact O-N 2.99Å; K289-I291 VanDerWaalsContact C-N 3.29Å; K289-I291 PolarHBondContact O-N 3.46Å; K289-T316 HydrophobicContact CD-CG2 4.4Å; K289-T316 HydrophobicContact CG-CG2 4.25Å; K289-L320 HydrophobicContact CG-CD1 4.18Å; K289-L320 HydrophobicContact CG-CD2 4.36Å
290	N	96.6	Very high	94.8	Very high	41 Å²	41	47.8 Å²	47.8	22%	0.219	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-9.5	-179.1	-55.8	-58	0	0	0	113.1	L253 K286 L287 M288 R345	L253-N290 HydrophobicContact CB-CB 3.74Å; K286-N290 PolarHBondContact O-ND2 2.95Å; L287-N290 WeakPolarHBondContact O-CB 3.16Å; L287-N290 PolarHBondContact O-N 3.33Å; L287-N290 VanDerWaalsContact O-N 3.11Å; L287-N290 PolarHBondContact O-ND2 2.78Å; M288-N290 PolarHBondContact O-N 3Å; N290-R345 PolarHBondContact O-NH2 3.33Å
291	I	96.4	Very high	94.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.227	C	C	.	.	S	Bend	trans	-91.7	134.6	177.3	-64.7	161.7	0	0	0	109.8	F267 A270 M288 K289 F293 M296 R341	F267-I291 HydrophobicContact CB-CD1 4.12Å; F267-I291 HydrophobicContact CB-CG2 4.37Å; F267-I291 HydrophobicContact CD2-CD1 4.16Å; A270-I291 HydrophobicContact CB-CD1 3.84Å; M288-I291 PolarHBondContact O-N 2.97Å; M288-I291 HydrophobicContact SD-CD1 3.72Å; K289-I291 VanDerWaalsContact C-N 3.29Å; K289-I291 PolarHBondContact O-N 3.46Å; I291-F293 VanDerWaalsContact C-N 3.35Å; I291-F293 HydrophobicContact CB-CD2 4.46Å; I291-F293 HydrophobicContact CB-CE1 4.46Å; I291-F293 HydrophobicContact CB-CE2 3.99Å; I291-F293 HydrophobicContact CB-CZ 3.98Å; I291-F293 HydrophobicContact CD1-CZ 4.41Å; I291-F293 HydrophobicContact CG2-CD1 4.05Å; I291-F293 HydrophobicContact CG2-CD2 4.32Å; I291-F293 HydrophobicContact CG2-CE1 3.82Å; I291-F293 HydrophobicContact CG2-CE2 4.12Å; I291-F293 HydrophobicContact CG2-CG 4.28Å; I291-F293 HydrophobicContact CG2-CZ 3.86Å; I291-F293 WeakPolarHBondContact O-CD2 3.46Å; I291-F293 PolarHBondContact O-N 3.21Å; I291-F293 VanDerWaalsContact O-N 3.17Å; I291-M296 HydrophobicContact CG2-CE 3.57Å; I291-R341 PolarHBondContact O-NH1 2.97Å
292	R	95.8	Very high	94.8	Very high	15 Å²	15	47.5 Å²	47.5	6%	0.057	23%	0.23	C	C	.	.			trans	-92.8	66.4	-175.6	-56.9	-172.6	-174.2	171.4	6.2	110.7	S254 N256 E263 P294 L295 E340 R341 A343 I344 R345	S254-R292 PolarHBondContact O-NH2 2.78Å; N256-R292 PolarHBondContact OD1-NH1 3.39Å; N256-R292 PolarHBondContact OD1-NH2 3.32Å; E263-R292 HydrophobicContact CG-CB 4.01Å; E263-R292 PolarHBondContact OE2-N 3.03Å; R292-P294 VanDerWaalsContact O-N 3.15Å; R292-L295 HydrophobicContact CB-CB 4.44Å; R292-L295 HydrophobicContact CB-CD1 3.96Å; R292-L295 HydrophobicContact CB-CG 4.18Å; R292-L295 WeakPolarHBondContact O-CB 3.44Å; R292-L295 PolarHBondContact O-N 3.04Å; R292-E340 PolarHBondContact NE-O 3.43Å; R292-R341 VanDerWaalsContact CB-O 3.25Å; R292-R341 WeakPolarHBondContact CB-O 3.36Å; R292-A343 WeakPolarHBondContact CD-O 3.44Å; R292-A343 PolarHBondContact NH1-O 3.42Å; R292-I344 PolarHBondContact NH1-O 2.97Å; R292-R345 VanDerWaalsContact NH1-CA 3.35Å
293	F	96.6	Very high	94.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-49.6	-34.9	177.5	-61.2	-74.2	0	0	0	115	F267 M288 I291 L295 M296 L301 V305 M311 L320 A324	F267-F293 AromaticContact CD2-CE1 3.63Å; F267-F293 HydrophobicContact CD2-CE1 3.63Å; F267-F293 AromaticContact CD2-CZ 3.92Å; F267-F293 HydrophobicContact CD2-CZ 3.92Å; F267-F293 HydrophobicContact CE2-CE1 4.09Å; F267-F293 HydrophobicContact CE2-CZ 4.29Å; F267-F293 HydrophobicContact CG-CE1 4.26Å; M288-F293 HydrophobicContact CB-CE2 4.32Å; M288-F293 HydrophobicContact CB-CZ 4.39Å; M288-F293 WeakPolarHBondContact O-CE2 3.14Å; M288-F293 HydrophobicContact SD-CZ 3.96Å; I291-F293 VanDerWaalsContact C-N 3.35Å; I291-F293 HydrophobicContact CB-CD2 4.46Å; I291-F293 HydrophobicContact CB-CE1 4.46Å; I291-F293 HydrophobicContact CB-CE2 3.99Å; I291-F293 HydrophobicContact CB-CZ 3.98Å; I291-F293 HydrophobicContact CD1-CZ 4.41Å; I291-F293 HydrophobicContact CG2-CD1 4.05Å; I291-F293 HydrophobicContact CG2-CD2 4.32Å; I291-F293 HydrophobicContact CG2-CE1 3.82Å; I291-F293 HydrophobicContact CG2-CE2 4.12Å; I291-F293 HydrophobicContact CG2-CG 4.28Å; I291-F293 HydrophobicContact CG2-CZ 3.86Å; I291-F293 WeakPolarHBondContact O-CD2 3.46Å; I291-F293 PolarHBondContact O-N 3.21Å; I291-F293 VanDerWaalsContact O-N 3.17Å; F293-L295 PolarHBondContact O-N 3.24Å; F293-L295 VanDerWaalsContact O-N 3.11Å; F293-M296 HydrophobicContact CD1-CE 3.5Å; F293-M296 VanDerWaalsContact CD1-CE 3.5Å; F293-M296 HydrophobicContact CD1-SD 3.77Å; F293-M296 HydrophobicContact CE1-CE 3.84Å; F293-M296 HydrophobicContact CE1-SD 4.46Å; F293-M296 HydrophobicContact CG-CE 4.41Å; F293-M296 WeakPolarHBondContact O-CB 3.49Å; F293-M296 PolarHBondContact O-N 2.82Å; F293-L301 HydrophobicContact CB-CD2 4.17Å; F293-L301 HydrophobicContact CD1-CD2 4.27Å; F293-V305 HydrophobicContact CD1-CG1 3.97Å; F293-V305 HydrophobicContact CD1-CG2 4.27Å; F293-V305 HydrophobicContact CE1-CG1 3.57Å; F293-V305 HydrophobicContact CE1-CG2 4.22Å; F293-V305 HydrophobicContact CZ-CG1 4.43Å; F293-M311 HydrophobicContact CE1-CE 4.13Å; F293-M311 HydrophobicContact CE2-CE 4.15Å; F293-M311 HydrophobicContact CZ-CE 3.7Å; F293-M311 HydrophobicContact CZ-SD 4.48Å; F293-L320 HydrophobicContact CD2-CB 3.99Å; F293-L320 HydrophobicContact CE2-CB 4.18Å; F293-L320 HydrophobicContact CE2-CD1 4.09Å; F293-A324 HydrophobicContact CB-CB 3.56Å
294	P	95.8	Very high	94.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-59.7	-18.4	174.3	-26.1	36.2	0	0	0	114.8	R292 A324 Y327 Q328 T342	R292-P294 VanDerWaalsContact O-N 3.15Å; P294-A324 HydrophobicContact CG-CB 4.3Å; P294-Y327 HydrophobicContact CB-CD1 3.69Å; P294-Y327 HydrophobicContact CB-CE1 4.21Å; P294-Y327 HydrophobicContact CB-CG 3.87Å; P294-Y327 WeakPolarHBondContact O-CD1 3.44Å; P294-Q328 PolarHBondContact O-NE2 3.34Å; P294-T342 HydrophobicContact CB-CG2 3.85Å; P294-T342 HydrophobicContact CG-CG2 4.03Å
295	L	93.1	Very high	94.9	Very high	30 Å²	30	43.9 Å²	43.9	16%	0.157	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-95.7	14.4	175.2	-59.7	-178.5	0	0	0	113.3	H29 E263 R292 F293 T342 A343	H29-L295 PolarHBondContact CE1-O 3.18Å; H29-L295 PolarHBondContact NE2-O 2.95Å; E263-L295 HydrophobicContact CG-CB 4.13Å; R292-L295 HydrophobicContact CB-CB 4.44Å; R292-L295 HydrophobicContact CB-CD1 3.96Å; R292-L295 HydrophobicContact CB-CG 4.18Å; R292-L295 WeakPolarHBondContact O-CB 3.44Å; R292-L295 PolarHBondContact O-N 3.04Å; F293-L295 PolarHBondContact O-N 3.24Å; F293-L295 VanDerWaalsContact O-N 3.11Å; L295-T342 WeakPolarHBondContact CD2-O 3.42Å; L295-A343 WeakPolarHBondContact CD1-O 3.3Å
296	M	94.4	Very high	94.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.228	C	C	.	.	S	Bend	trans	-97.9	148.4	168.3	-63.8	178.3	-170.6	0	0	109.3	E263 F267 I291 F293 E300 L301 V305 Q328	E263-M296 VanDerWaalsContact C-CE 3.49Å; E263-M296 HydrophobicContact CB-CE 3.68Å; E263-M296 HydrophobicContact CB-CG 3.84Å; E263-M296 VanDerWaalsContact O-CE 3.29Å; E263-M296 WeakPolarHBondContact O-CE 3.29Å; F267-M296 HydrophobicContact CB-CE 3.85Å; I291-M296 HydrophobicContact CG2-CE 3.57Å; F293-M296 HydrophobicContact CD1-CE 3.5Å; F293-M296 VanDerWaalsContact CD1-CE 3.5Å; F293-M296 HydrophobicContact CD1-SD 3.77Å; F293-M296 HydrophobicContact CE1-CE 3.84Å; F293-M296 HydrophobicContact CE1-SD 4.46Å; F293-M296 HydrophobicContact CG-CE 4.41Å; F293-M296 WeakPolarHBondContact O-CB 3.49Å; F293-M296 PolarHBondContact O-N 2.82Å; M296-E300 HydrophobicContact CB-CB 4.29Å; M296-L301 HydrophobicContact CB-CD2 3.94Å; M296-L301 HydrophobicContact CB-CG 3.98Å; M296-L301 HydrophobicContact CG-CD2 4.45Å; M296-L301 HydrophobicContact SD-CD2 3.8Å; M296-V305 HydrophobicContact CE-CG2 4.41Å; M296-V305 HydrophobicContact SD-CG2 3.68Å; M296-Q328 PolarHBondContact O-NE2 3.5Å
297	N	92.1	Very high	94.7	Very high	56 Å²	56	44.7 Å²	44.7	30%	0.299	23%	0.227	S	C	.	.			trans	-72.2	158.6	174.4	73.1	54	0	0	0	110.8	Q299 E300 L301	N297-Q299 VanDerWaalsContact C-N 3.26Å; N297-Q299 PolarHBondContact O-N 2.88Å; N297-Q299 WeakPolarHBondContact OD1-CB 3.4Å; N297-Q299 PolarHBondContact OD1-N 3.43Å; N297-E300 PolarHBondContact N-OE2 3.23Å; N297-E300 WeakPolarHBondContact ND2-CG 3.44Å; N297-E300 PolarHBondContact ND2-OE1 3.13Å; N297-E300 PolarHBondContact ND2-OE2 3.06Å; N297-E300 WeakPolarHBondContact O-CB 3.34Å; N297-E300 PolarHBondContact O-N 3.16Å; N297-E300 VanDerWaalsContact O-N 3.16Å; N297-E300 VanDerWaalsContact OD1-CG 3.3Å; N297-E300 WeakPolarHBondContact OD1-CG 3.35Å; N297-E300 PolarHBondContact OD1-N 3.27Å; N297-L301 PolarHBondContact O-N 3.41Å
298	P	93.8	Very high	94.7	Very high	68 Å²	68	45.2 Å²	45.2	44%	0.442	23%	0.23	S	C	.	.	H	α-helix	trans	-58.8	-33.1	-176.9	-27.4	35.5	0	0	0	114.5	I302 Q328	P298-I302 VanDerWaalsContact O-CG1 3.32Å; P298-I302 WeakPolarHBondContact O-CG1 3.21Å; P298-I302 PolarHBondContact O-N 3.06Å; P298-I302 VanDerWaalsContact O-N 3.17Å; P298-Q328 HydrophobicContact CG-CB 4.27Å
299	Q	93.6	Very high	94.5	Very high	144 Å²	144	50.3 Å²	50.3	67%	0.673	26%	0.258	S	S	*	.	H	α-helix	trans	-69.7	-38.2	179.7	-64.3	-177.1	-6.7	0	0	111.4	N297 I302 N303	N297-Q299 VanDerWaalsContact C-N 3.26Å; N297-Q299 PolarHBondContact O-N 2.88Å; N297-Q299 WeakPolarHBondContact OD1-CB 3.4Å; N297-Q299 PolarHBondContact OD1-N 3.43Å; Q299-I302 PolarHBondContact O-N 2.94Å; Q299-N303 WeakPolarHBondContact O-CB 3.33Å; Q299-N303 VanDerWaalsContact O-CG 3.28Å; Q299-N303 PolarHBondContact O-N 3.5Å; Q299-N303 PolarHBondContact O-ND2 3.22Å
300	E	94.6	Very high	94.4	Very high	42 Å²	42	46.4 Å²	46.4	20%	0.196	24%	0.241	C	C	.	.	H	α-helix	trans	-63.8	-44.2	175.7	-69.8	170.8	156.3	0	0	111.7	L264 M296 N297 I302 H304 V305	L264-E300 HydrophobicContact CD1-CB 4.44Å; L264-E300 HydrophobicContact CD2-CG 3.94Å; M296-E300 HydrophobicContact CB-CB 4.29Å; N297-E300 PolarHBondContact N-OE2 3.23Å; N297-E300 WeakPolarHBondContact ND2-CG 3.44Å; N297-E300 PolarHBondContact ND2-OE1 3.13Å; N297-E300 PolarHBondContact ND2-OE2 3.06Å; N297-E300 WeakPolarHBondContact O-CB 3.34Å; N297-E300 PolarHBondContact O-N 3.16Å; N297-E300 VanDerWaalsContact O-N 3.16Å; N297-E300 VanDerWaalsContact OD1-CG 3.3Å; N297-E300 WeakPolarHBondContact OD1-CG 3.35Å; N297-E300 PolarHBondContact OD1-N 3.27Å; E300-I302 VanDerWaalsContact C-N 3.35Å; E300-I302 PolarHBondContact O-N 3.07Å; E300-H304 WeakPolarHBondContact O-CB 3.38Å; E300-H304 PolarHBondContact O-N 3.05Å; E300-V305 PolarHBondContact O-N 2.93Å
301	L	94.4	Very high	94.3	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.021	23%	0.23	C	C	.	.	I	π-helix	trans	-59.2	-46.2	177.3	-68.7	173.6	0	0	0	111.3	F293 M296 N297 V305 Q306 L321 A324 Q328	F293-L301 HydrophobicContact CB-CD2 4.17Å; F293-L301 HydrophobicContact CD1-CD2 4.27Å; M296-L301 HydrophobicContact CB-CD2 3.94Å; M296-L301 HydrophobicContact CB-CG 3.98Å; M296-L301 HydrophobicContact CG-CD2 4.45Å; M296-L301 HydrophobicContact SD-CD2 3.8Å; N297-L301 PolarHBondContact O-N 3.41Å; L301-V305 HydrophobicContact CD2-CG2 4.19Å; L301-V305 WeakPolarHBondContact O-CB 3.45Å; L301-V305 PolarHBondContact O-N 2.88Å; L301-Q306 WeakPolarHBondContact O-CG 3.49Å; L301-Q306 PolarHBondContact O-N 3.23Å; L301-L321 HydrophobicContact CD2-CD2 4.3Å; L301-A324 HydrophobicContact CD1-CB 4.01Å; L301-A324 HydrophobicContact CD2-CB 4.25Å; L301-Q328 HydrophobicContact CD1-CG 4.29Å
302	I	93.6	Very high	94.1	Very high	92 Å²	92	51.4 Å²	51.4	47%	0.472	26%	0.257	S	S	.	.	I	π-helix	trans	-73	-50.1	-177.6	-64.8	166.9	0	0	0	111.4	P298 Q299 E300	P298-I302 VanDerWaalsContact O-CG1 3.32Å; P298-I302 WeakPolarHBondContact O-CG1 3.21Å; P298-I302 PolarHBondContact O-N 3.06Å; P298-I302 VanDerWaalsContact O-N 3.17Å; Q299-I302 PolarHBondContact O-N 2.94Å; E300-I302 VanDerWaalsContact C-N 3.35Å; E300-I302 PolarHBondContact O-N 3.07Å
303	N	94.3	Very high	94	Very high	97 Å²	97	56.1 Å²	56.1	52%	0.519	29%	0.287	S	S	.	.	I	π-helix	trans	-80.8	-24.4	-169.7	-64.4	-23	0	0	0	113.2	Q299 T307	Q299-N303 WeakPolarHBondContact O-CB 3.33Å; Q299-N303 VanDerWaalsContact O-CG 3.28Å; Q299-N303 PolarHBondContact O-N 3.5Å; Q299-N303 PolarHBondContact O-ND2 3.22Å; N303-T307 VanDerWaalsContact O-CG2 3.25Å; N303-T307 WeakPolarHBondContact O-CG2 3.32Å
304	H	94.5	Very high	93.9	Very high	81 Å²	81	58.9 Å²	58.9	38%	0.375	30%	0.302	S	S	.	.	I	π-helix	trans	-119.3	-44.2	-175.3	-61.3	-59.5	0	0	0	114	L264 E300 T307	L264-H304 HydrophobicContact CD1-CB 3.65Å; E300-H304 WeakPolarHBondContact O-CB 3.38Å; E300-H304 PolarHBondContact O-N 3.05Å; H304-T307 PolarHBondContact O-OG1 3.26Å
305	V	94.4	Very high	93.9	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	33%	0.331	C	S	.	.	I	π-helix	trans	-82.7	-48.1	-172.8	-171.7	0	0	0	0	111.6	F267 F293 M296 E300 L301 T307 V308 M311 L321	F267-V305 HydrophobicContact CD1-CG2 3.95Å; F267-V305 HydrophobicContact CD2-CG1 4.41Å; F267-V305 HydrophobicContact CE1-CB 4.19Å; F267-V305 HydrophobicContact CE1-CG1 4.29Å; F267-V305 HydrophobicContact CE1-CG2 3.93Å; F267-V305 HydrophobicContact CE2-CG1 3.85Å; F267-V305 HydrophobicContact CG-CG2 4.3Å; F267-V305 HydrophobicContact CZ-CB 4.14Å; F267-V305 HydrophobicContact CZ-CG1 3.77Å; F267-V305 HydrophobicContact CZ-CG2 4.25Å; F293-V305 HydrophobicContact CD1-CG1 3.97Å; F293-V305 HydrophobicContact CD1-CG2 4.27Å; F293-V305 HydrophobicContact CE1-CG1 3.57Å; F293-V305 HydrophobicContact CE1-CG2 4.22Å; F293-V305 HydrophobicContact CZ-CG1 4.43Å; M296-V305 HydrophobicContact CE-CG2 4.41Å; M296-V305 HydrophobicContact SD-CG2 3.68Å; E300-V305 PolarHBondContact O-N 2.93Å; L301-V305 HydrophobicContact CD2-CG2 4.19Å; L301-V305 WeakPolarHBondContact O-CB 3.45Å; L301-V305 PolarHBondContact O-N 2.88Å; V305-T307 PolarHBondContact O-N 3.28Å; V305-V308 PolarHBondContact O-N 2.7Å; V305-M311 HydrophobicContact CG1-CE 3.74Å; V305-M311 HydrophobicContact CG1-CG 4.2Å; V305-L321 HydrophobicContact CB-CD2 4.16Å; V305-L321 HydrophobicContact CG1-CD2 3.57Å; V305-L321 HydrophobicContact CG1-CG 4.33Å
306	Q	93.1	Very high	94	Very high	71 Å²	71	65 Å²	65	33%	0.332	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-20.7	-179.8	-73	-179.1	-0.6	0	0	113.5	L301 V308 R312 L321	L301-Q306 WeakPolarHBondContact O-CG 3.49Å; L301-Q306 PolarHBondContact O-N 3.23Å; Q306-V308 PolarHBondContact O-N 3.25Å; Q306-R312 WeakPolarHBondContact O-CD 3.29Å; Q306-R312 PolarHBondContact O-NE 3.25Å; Q306-L321 HydrophobicContact CG-CD1 4.12Å; Q306-L321 HydrophobicContact CG-CD2 4.39Å
307	T	94.3	Very high	94.1	Very high	86 Å²	86	65 Å²	65	53%	0.528	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-12.9	178.7	61.4	0	0	0	0	113.1	N303 H304 V305	N303-T307 VanDerWaalsContact O-CG2 3.25Å; N303-T307 WeakPolarHBondContact O-CG2 3.32Å; H304-T307 PolarHBondContact O-OG1 3.26Å; V305-T307 PolarHBondContact O-N 3.28Å
308	V	94.4	Very high	94.2	Very high	10 Å²	10	64.4 Å²	64.4	6%	0.061	34%	0.335	C	S	.	.	S	Bend	trans	-87.8	126.2	179.4	-179	0	0	0	0	111	F267 V305 Q306 F310 M311	F267-V308 HydrophobicContact CE1-CG2 4.14Å; F267-V308 HydrophobicContact CZ-CB 4.29Å; F267-V308 HydrophobicContact CZ-CG2 3.79Å; V305-V308 PolarHBondContact O-N 2.7Å; Q306-V308 PolarHBondContact O-N 3.25Å; V308-F310 HydrophobicContact CG1-CD1 3.56Å; V308-F310 HydrophobicContact CG1-CE1 3.19Å; V308-F310 HydrophobicContact CG1-CE2 4.25Å; V308-F310 HydrophobicContact CG1-CG 4.23Å; V308-F310 HydrophobicContact CG1-CZ 3.57Å; V308-F310 PolarHBondContact O-N 2.9Å; V308-M311 HydrophobicContact CB-CG 4.03Å; V308-M311 HydrophobicContact CG1-CG 4.26Å; V308-M311 WeakPolarHBondContact O-CB 3.46Å; V308-M311 PolarHBondContact O-N 3.45Å; V308-M311 VanDerWaalsContact O-N 3.12Å
309	D	92.5	Very high	94.4	Very high	107 Å²	107	65 Å²	65	57%	0.572	33%	0.334	S	S	*	.	H	α-helix	trans	-59.4	-47.8	-170	-66.5	-28.5	0	0	0	114.6	M311 R312 T313	D309-M311 PolarHBondContact O-N 3.37Å; D309-R312 PolarHBondContact O-N 3.35Å; D309-R312 IonicContact OD1-CZ 3.24Å; D309-R312 IonicContact OD1-NH2 3.57Å; D309-R312 PolarHBondContact OD1-NH2 2.89Å; D309-T313 PolarHBondContact O-N 2.9Å; D309-T313 VanDerWaalsContact O-N 3.11Å; D309-T313 PolarHBondContact O-OG1 3.33Å
310	F	93.3	Very high	94.5	Very high	30 Å²	30	58.9 Å²	58.9	13%	0.132	31%	0.306	C	S	.	.	H	α-helix	trans	-65.7	-20.7	-179.2	68	-102.3	0	0	0	113.1	L274 M281 A284 M288 V308 R312 T313 D314	L274-F310 HydrophobicContact CD1-CE1 4.44Å; L274-F310 HydrophobicContact CD1-CZ 4.02Å; M281-F310 HydrophobicContact SD-CD1 4.47Å; A284-F310 HydrophobicContact CB-CD2 4.05Å; A284-F310 HydrophobicContact CB-CE2 4.23Å; A284-F310 HydrophobicContact CB-CG 4.43Å; M288-F310 HydrophobicContact CE-CE2 3.68Å; M288-F310 HydrophobicContact CE-CZ 3.56Å; M288-F310 HydrophobicContact CG-CE2 4.01Å; M288-F310 HydrophobicContact SD-CE2 4.21Å; V308-F310 HydrophobicContact CG1-CD1 3.56Å; V308-F310 HydrophobicContact CG1-CE1 3.19Å; V308-F310 HydrophobicContact CG1-CE2 4.25Å; V308-F310 HydrophobicContact CG1-CG 4.23Å; V308-F310 HydrophobicContact CG1-CZ 3.57Å; V308-F310 PolarHBondContact O-N 2.9Å; F310-R312 PolarHBondContact O-N 3.25Å; F310-T313 WeakPolarHBondContact CA-OG1 3.45Å; F310-D314 VanDerWaalsContact O-CB 3.32Å; F310-D314 WeakPolarHBondContact O-CB 3.36Å; F310-D314 PolarHBondContact O-N 3.47Å; F310-D314 VanDerWaalsContact O-N 3.08Å
311	M	94.9	Very high	94.6	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-69.5	-20	173.3	-65.8	-60.3	-60.2	0	0	112.2	F267 M288 F293 V305 V308 D309 C317 V318 L321	F267-M311 HydrophobicContact CE2-CG 4.13Å; F267-M311 HydrophobicContact CE2-SD 4.08Å; F267-M311 HydrophobicContact CZ-CG 4.24Å; M288-M311 HydrophobicContact CG-SD 3.99Å; M288-M311 HydrophobicContact SD-SD 3.98Å; F293-M311 HydrophobicContact CE1-CE 4.13Å; F293-M311 HydrophobicContact CE2-CE 4.15Å; F293-M311 HydrophobicContact CZ-CE 3.7Å; F293-M311 HydrophobicContact CZ-SD 4.48Å; V305-M311 HydrophobicContact CG1-CE 3.74Å; V305-M311 HydrophobicContact CG1-CG 4.2Å; V308-M311 HydrophobicContact CB-CG 4.03Å; V308-M311 HydrophobicContact CG1-CG 4.26Å; V308-M311 WeakPolarHBondContact O-CB 3.46Å; V308-M311 PolarHBondContact O-N 3.45Å; V308-M311 VanDerWaalsContact O-N 3.12Å; D309-M311 PolarHBondContact O-N 3.37Å; M311-C317 HydrophobicContact CE-CB 3.99Å; M311-C317 HydrophobicContact SD-CB 3.78Å; M311-V318 WeakPolarHBondContact O-CG2 3.4Å; M311-L321 HydrophobicContact CB-CD1 3.92Å; M311-L321 HydrophobicContact CE-CD1 4.09Å; M311-L321 HydrophobicContact CE-CD2 4.36Å; M311-L321 HydrophobicContact CE-CG 3.79Å
312	R	92.7	Very high	94.6	Very high	147 Å²	147	61.4 Å²	61.4	56%	0.555	32%	0.32	S	S	*	.	H	α-helix	trans	-103.2	-20.9	179.3	-63	-176.6	-70.6	145.8	-0.6	113.7	Q306 D309 F310 V318	Q306-R312 WeakPolarHBondContact O-CD 3.29Å; Q306-R312 PolarHBondContact O-NE 3.25Å; D309-R312 PolarHBondContact O-N 3.35Å; D309-R312 IonicContact OD1-CZ 3.24Å; D309-R312 IonicContact OD1-NH2 3.57Å; D309-R312 PolarHBondContact OD1-NH2 2.89Å; F310-R312 PolarHBondContact O-N 3.25Å; R312-V318 WeakPolarHBondContact O-CG2 3.4Å
313	T	92.9	Very high	94.7	Very high	114 Å²	114	60.3 Å²	60.3	70%	0.699	31%	0.313	S	S	*	.	H	α-helix	trans	-101.8	-33.9	-176.7	59	0	0	0	0	113.3	D309 F310	D309-T313 PolarHBondContact O-N 2.9Å; D309-T313 VanDerWaalsContact O-N 3.11Å; D309-T313 PolarHBondContact O-OG1 3.33Å; F310-T313 WeakPolarHBondContact CA-OG1 3.45Å
314	D	94.8	Very high	94.7	Very high	57 Å²	57	55.7 Å²	55.7	31%	0.305	29%	0.288	S	S	.	.	S	Bend	trans	-79.7	125.9	177.9	-178.2	-88.9	0	0	0	111.2	F310 T316 C317 V318	F310-D314 VanDerWaalsContact O-CB 3.32Å; F310-D314 WeakPolarHBondContact O-CB 3.36Å; F310-D314 PolarHBondContact O-N 3.47Å; F310-D314 VanDerWaalsContact O-N 3.08Å; D314-T316 VanDerWaalsContact C-N 3.26Å; D314-T316 PolarHBondContact O-N 2.85Å; D314-T316 VanDerWaalsContact OD1-CA 3.32Å; D314-T316 WeakPolarHBondContact OD1-CA 3.46Å; D314-T316 WeakPolarHBondContact OD1-CB 3.42Å; D314-T316 PolarHBondContact OD1-N 3.35Å; D314-C317 HydrophobicContact CB-CB 4.1Å; D314-C317 PolarHBondContact O-N 2.97Å; D314-C317 PolarHBondContact OD1-N 3.18Å; D314-V318 VanDerWaalsContact O-CG2 3.28Å; D314-V318 WeakPolarHBondContact O-CG2 3.45Å; D314-V318 PolarHBondContact O-N 3.22Å
315	N	95.3	Very high	94.7	Very high	116 Å²	116	53.4 Å²	53.4	62%	0.62	28%	0.282	S	S	*	.	H	α-helix	trans	-60.3	-35.2	-176.6	-175.6	70	0	0	0	112.9	N319	N315-N319 VanDerWaalsContact O-CG 3.27Å; N315-N319 PolarHBondContact O-N 3.19Å; N315-N319 PolarHBondContact O-ND2 3.3Å
316	T	95.9	Very high	94.6	Very high	43 Å²	43	57.1 Å²	57.1	26%	0.264	30%	0.301	S	S	.	.	H	α-helix	trans	-67.5	-51.4	177.4	-52.2	0	0	0	0	109.6	A285 K289 D314 V318 N319 L320	A285-T316 HydrophobicContact CB-CG2 4.29Å; K289-T316 HydrophobicContact CD-CG2 4.4Å; K289-T316 HydrophobicContact CG-CG2 4.25Å; D314-T316 VanDerWaalsContact C-N 3.26Å; D314-T316 PolarHBondContact O-N 2.85Å; D314-T316 VanDerWaalsContact OD1-CA 3.32Å; D314-T316 WeakPolarHBondContact OD1-CA 3.46Å; D314-T316 WeakPolarHBondContact OD1-CB 3.42Å; D314-T316 PolarHBondContact OD1-N 3.35Å; T316-V318 VanDerWaalsContact C-N 3.31Å; T316-V318 PolarHBondContact O-N 2.71Å; T316-N319 WeakPolarHBondContact O-CB 3.21Å; T316-N319 PolarHBondContact O-N 3.11Å; T316-N319 VanDerWaalsContact O-N 3.12Å; T316-L320 WeakPolarHBondContact O-CG 3.3Å; T316-L320 PolarHBondContact O-N 3.37Å
317	C	95.9	Very high	94.7	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.3	-39.1	-178.9	-64.1	0	0	0	0	112.6	M311 D314 N319 L320 L321	M311-C317 HydrophobicContact CE-CB 3.99Å; M311-C317 HydrophobicContact SD-CB 3.78Å; D314-C317 HydrophobicContact CB-CB 4.1Å; D314-C317 PolarHBondContact O-N 2.97Å; D314-C317 PolarHBondContact OD1-N 3.18Å; C317-N319 VanDerWaalsContact C-N 3.34Å; C317-N319 PolarHBondContact O-N 2.89Å; C317-L320 PolarHBondContact O-N 2.85Å; C317-L321 PolarHBondContact O-N 3.46Å
318	V	96.1	Very high	94.7	Very high	44 Å²	44	51.6 Å²	51.6	27%	0.267	27%	0.269	S	S	.	.	H	α-helix	trans	-60	-44.1	174.2	171.2	0	0	0	0	110.9	M311 R312 D314 T316 L320 L321 L322	M311-V318 WeakPolarHBondContact O-CG2 3.4Å; R312-V318 WeakPolarHBondContact O-CG2 3.4Å; D314-V318 VanDerWaalsContact O-CG2 3.28Å; D314-V318 WeakPolarHBondContact O-CG2 3.45Å; D314-V318 PolarHBondContact O-N 3.22Å; T316-V318 VanDerWaalsContact C-N 3.31Å; T316-V318 PolarHBondContact O-N 2.71Å; V318-L320 VanDerWaalsContact C-N 3.32Å; V318-L320 PolarHBondContact O-N 3.16Å; V318-L321 WeakPolarHBondContact O-CB 3.36Å; V318-L321 PolarHBondContact O-N 2.99Å; V318-L322 HydrophobicContact CG1-CD1 4.06Å; V318-L322 HydrophobicContact CG1-CG 4.37Å; V318-L322 WeakPolarHBondContact O-CG 3.25Å; V318-L322 PolarHBondContact O-N 3Å
319	N	96.6	Very high	94.6	Very high	80 Å²	80	57.9 Å²	57.9	43%	0.428	30%	0.3	S	S	.	.	H	α-helix	trans	-63.2	-37.5	176.5	-71.9	-36.2	0	0	0	112.5	N315 T316 C317 L321 L322 E323	N315-N319 VanDerWaalsContact O-CG 3.27Å; N315-N319 PolarHBondContact O-N 3.19Å; N315-N319 PolarHBondContact O-ND2 3.3Å; T316-N319 WeakPolarHBondContact O-CB 3.21Å; T316-N319 PolarHBondContact O-N 3.11Å; T316-N319 VanDerWaalsContact O-N 3.12Å; C317-N319 VanDerWaalsContact C-N 3.34Å; C317-N319 PolarHBondContact O-N 2.89Å; N319-L321 VanDerWaalsContact C-N 3.31Å; N319-L321 PolarHBondContact O-N 3.1Å; N319-L322 PolarHBondContact O-N 3.13Å; N319-E323 WeakPolarHBondContact O-CB 3.45Å; N319-E323 PolarHBondContact O-N 2.94Å
320	L	96.6	Very high	94.5	Very high	15 Å²	15	55.9 Å²	55.9	8%	0.079	29%	0.288	C	S	.	.	H	α-helix	trans	-64.5	-36.3	175.7	-57.4	174.9	0	0	0	112	M288 K289 F293 T316 C317 V318 A324 R341	M288-L320 HydrophobicContact CB-CD1 3.99Å; K289-L320 HydrophobicContact CG-CD1 4.18Å; K289-L320 HydrophobicContact CG-CD2 4.36Å; F293-L320 HydrophobicContact CD2-CB 3.99Å; F293-L320 HydrophobicContact CE2-CB 4.18Å; F293-L320 HydrophobicContact CE2-CD1 4.09Å; T316-L320 WeakPolarHBondContact O-CG 3.3Å; T316-L320 PolarHBondContact O-N 3.37Å; C317-L320 PolarHBondContact O-N 2.85Å; V318-L320 VanDerWaalsContact C-N 3.32Å; V318-L320 PolarHBondContact O-N 3.16Å; L320-A324 PolarHBondContact O-N 3.18Å; L320-R341 VanDerWaalsContact CD2-CZ 3.41Å; L320-R341 PolarHBondContact O-NH2 3.15Å
321	L	95.5	Very high	94.3	Very high	12 Å²	12	57.5 Å²	57.5	6%	0.063	30%	0.301	C	S	.	.	H	α-helix	trans	-69.6	-44.2	174.5	-85.3	178.6	0	0	0	112.2	L301 V305 Q306 M311 C317 V318 N319 E323 A324 S325	L301-L321 HydrophobicContact CD2-CD2 4.3Å; V305-L321 HydrophobicContact CB-CD2 4.16Å; V305-L321 HydrophobicContact CG1-CD2 3.57Å; V305-L321 HydrophobicContact CG1-CG 4.33Å; Q306-L321 HydrophobicContact CG-CD1 4.12Å; Q306-L321 HydrophobicContact CG-CD2 4.39Å; M311-L321 HydrophobicContact CB-CD1 3.92Å; M311-L321 HydrophobicContact CE-CD1 4.09Å; M311-L321 HydrophobicContact CE-CD2 4.36Å; M311-L321 HydrophobicContact CE-CG 3.79Å; C317-L321 PolarHBondContact O-N 3.46Å; V318-L321 WeakPolarHBondContact O-CB 3.36Å; V318-L321 PolarHBondContact O-N 2.99Å; N319-L321 VanDerWaalsContact C-N 3.31Å; N319-L321 PolarHBondContact O-N 3.1Å; L321-E323 VanDerWaalsContact C-N 3.32Å; L321-E323 PolarHBondContact O-N 3.33Å; L321-A324 PolarHBondContact O-N 2.85Å; L321-S325 WeakPolarHBondContact O-CB 3.5Å; L321-S325 PolarHBondContact O-N 3.1Å; L321-S325 PolarHBondContact O-OG 2.74Å
322	L	94.6	Very high	94.1	Very high	88 Å²	88	60.8 Å²	60.8	46%	0.461	32%	0.316	S	S	.	.	H	α-helix	trans	-60.7	-42.8	177.1	-72.1	173.3	0	0	0	111.4	V318 N319 S325 N326	V318-L322 HydrophobicContact CG1-CD1 4.06Å; V318-L322 HydrophobicContact CG1-CG 4.37Å; V318-L322 WeakPolarHBondContact O-CG 3.25Å; V318-L322 PolarHBondContact O-N 3Å; N319-L322 PolarHBondContact O-N 3.13Å; L322-S325 PolarHBondContact O-N 2.85Å; L322-N326 WeakPolarHBondContact O-CB 3.48Å; L322-N326 PolarHBondContact O-N 2.66Å; L322-N326 PolarHBondContact O-ND2 3.09Å
323	E	95.6	Very high	94.1	Very high	68 Å²	68	55.3 Å²	55.3	32%	0.318	30%	0.297	S	S	.	.	H	α-helix	trans	-57.1	-50.3	173.2	-177.5	-170.4	169.8	0	0	111.3	N319 L321 N326 Y327 R341	N319-E323 WeakPolarHBondContact O-CB 3.45Å; N319-E323 PolarHBondContact O-N 2.94Å; L321-E323 VanDerWaalsContact C-N 3.32Å; L321-E323 PolarHBondContact O-N 3.33Å; E323-N326 PolarHBondContact O-N 2.88Å; E323-Y327 WeakPolarHBondContact O-CB 3.43Å; E323-Y327 PolarHBondContact O-N 3.47Å; E323-R341 IonicContact OE1-NE 3.03Å; E323-R341 PolarHBondContact OE1-NE 3.33Å; E323-R341 IonicContact OE1-NH2 2.86Å; E323-R341 IonicContact OE2-CZ 3.89Å; E323-R341 IonicContact OE2-NE 3.95Å; E323-R341 PolarHBondContact OE2-NE 3.12Å; E323-R341 IonicContact OE2-NH2 3.08Å; E323-R341 PolarHBondContact OE2-NH2 3.03Å
324	A	95.6	Very high	94.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.1	-43.9	-179.5	0	0	0	0	0	112.4	F293 P294 L301 L320 L321 Y327 Q328	F293-A324 HydrophobicContact CB-CB 3.56Å; P294-A324 HydrophobicContact CG-CB 4.3Å; L301-A324 HydrophobicContact CD1-CB 4.01Å; L301-A324 HydrophobicContact CD2-CB 4.25Å; L320-A324 PolarHBondContact O-N 3.18Å; L321-A324 PolarHBondContact O-N 2.85Å; A324-Y327 PolarHBondContact O-N 3.03Å; A324-Q328 WeakPolarHBondContact O-CB 3.44Å; A324-Q328 WeakPolarHBondContact O-CG 3.47Å; A324-Q328 PolarHBondContact O-N 3.23Å
325	S	93.3	Very high	94	Very high	34 Å²	34	47.8 Å²	47.8	24%	0.238	25%	0.252	C	S	.	.	H	α-helix	trans	-60.9	-46.3	175.3	-66.3	0	0	0	0	111.6	L321 L322 Y327 Q328 M329	L321-S325 WeakPolarHBondContact O-CB 3.5Å; L321-S325 PolarHBondContact O-N 3.1Å; L321-S325 PolarHBondContact O-OG 2.74Å; L322-S325 PolarHBondContact O-N 2.85Å; S325-Y327 PolarHBondContact O-N 2.99Å; S325-Q328 PolarHBondContact O-N 3.37Å; S325-M329 WeakPolarHBondContact O-CB 3.12Å; S325-M329 WeakPolarHBondContact O-CG 3.05Å; S325-M329 PolarHBondContact O-N 3.08Å
326	N	93.6	Very high	93.9	Very high	77 Å²	77	43.7 Å²	43.7	41%	0.412	23%	0.232	S	C	.	.	H	α-helix	trans	-62.7	-42.3	177.8	-71.5	-21.4	0	0	0	112	L322 E323 Q328 M329 M330	L322-N326 WeakPolarHBondContact O-CB 3.48Å; L322-N326 PolarHBondContact O-N 2.66Å; L322-N326 PolarHBondContact O-ND2 3.09Å; E323-N326 PolarHBondContact O-N 2.88Å; N326-Q328 PolarHBondContact O-N 3.16Å; N326-M329 PolarHBondContact O-N 2.81Å; N326-M330 PolarHBondContact O-N 3.13Å
327	Y	94.9	Very high	93.8	Very high	7 Å²	7	44.4 Å²	44.4	3%	0.027	23%	0.233	C	C	.	.	H	α-helix	trans	-62	-43.1	177.5	-173	-94.7	0	0	0	112	P294 E323 A324 S325 M330 Q334 M337 Q338 T342	P294-Y327 HydrophobicContact CB-CD1 3.69Å; P294-Y327 HydrophobicContact CB-CE1 4.21Å; P294-Y327 HydrophobicContact CB-CG 3.87Å; P294-Y327 WeakPolarHBondContact O-CD1 3.44Å; E323-Y327 WeakPolarHBondContact O-CB 3.43Å; E323-Y327 PolarHBondContact O-N 3.47Å; A324-Y327 PolarHBondContact O-N 3.03Å; S325-Y327 PolarHBondContact O-N 2.99Å; Y327-M330 PolarHBondContact O-N 2.88Å; Y327-Q334 HydrophobicContact CD1-CG 4Å; Y327-Q334 HydrophobicContact CD2-CG 4.16Å; Y327-Q334 HydrophobicContact CE1-CB 4.19Å; Y327-Q334 HydrophobicContact CE1-CG 3.66Å; Y327-Q334 HydrophobicContact CE2-CB 3.87Å; Y327-Q334 HydrophobicContact CE2-CG 3.83Å; Y327-Q334 HydrophobicContact CG-CG 4.24Å; Y327-Q334 WeakPolarHBondContact O-CG 3.34Å; Y327-Q334 PolarHBondContact O-NE2 3.22Å; Y327-M337 HydrophobicContact CD2-CB 4.11Å; Y327-M337 HydrophobicContact CD2-CE 4.41Å; Y327-M337 HydrophobicContact CE2-CB 4.1Å; Y327-Q338 PolarHBondContact OH-NE2 2.83Å; Y327-Q338 VanDerWaalsContact OH-NE2 3.13Å; Y327-T342 HydrophobicContact CD2-CG2 3.66Å; Y327-T342 HydrophobicContact CE2-CG2 3.47Å; Y327-T342 VanDerWaalsContact CE2-CG2 3.47Å; Y327-T342 HydrophobicContact CG-CG2 4.31Å
328	Q	93.4	Very high	93.6	Very high	34 Å²	34	47.7 Å²	47.7	16%	0.159	25%	0.248	C	C	.	.	H	α-helix	trans	-72.4	-28.5	178.4	-71.6	-66.4	-34.1	0	0	113	P294 M296 P298 L301 A324 S325 N326 M330	P294-Q328 PolarHBondContact O-NE2 3.34Å; M296-Q328 PolarHBondContact O-NE2 3.5Å; P298-Q328 HydrophobicContact CG-CB 4.27Å; L301-Q328 HydrophobicContact CD1-CG 4.29Å; A324-Q328 WeakPolarHBondContact O-CB 3.44Å; A324-Q328 WeakPolarHBondContact O-CG 3.47Å; A324-Q328 PolarHBondContact O-N 3.23Å; S325-Q328 PolarHBondContact O-N 3.37Å; N326-Q328 PolarHBondContact O-N 3.16Å; Q328-M330 VanDerWaalsContact C-N 3.3Å; Q328-M330 PolarHBondContact O-N 2.83Å
329	M	91.8	Very high	93.4	Very high	142 Å²	142	47.9 Å²	47.9	70%	0.7	25%	0.251	S	S	*	.	H	α-helix	trans	-74.5	-15.8	176.5	-76.3	177.2	64.2	0	0	114.1	S325 N326 P331	S325-M329 WeakPolarHBondContact O-CB 3.12Å; S325-M329 WeakPolarHBondContact O-CG 3.05Å; S325-M329 PolarHBondContact O-N 3.08Å; N326-M329 PolarHBondContact O-N 2.81Å; M329-P331 VanDerWaalsContact C-CD 3.46Å; M329-P331 WeakPolarHBondContact O-CD 3.3Å
330	M	90.9	Very high	93.1	Very high	65 Å²	65	52.6 Å²	52.6	32%	0.32	27%	0.271	S	S	.	.			trans	-124	65.9	-175.3	-56.5	-177.4	-166.3	0	0	112.9	N326 Y327 Q328 F332 M333 Q334	N326-M330 PolarHBondContact O-N 3.13Å; Y327-M330 PolarHBondContact O-N 2.88Å; Q328-M330 VanDerWaalsContact C-N 3.3Å; Q328-M330 PolarHBondContact O-N 2.83Å; M330-F332 VanDerWaalsContact C-N 3.27Å; M330-F332 PolarHBondContact O-N 3.02Å; M330-F332 VanDerWaalsContact O-N 3.16Å; M330-M333 HydrophobicContact CB-CB 3.98Å; M330-M333 HydrophobicContact CB-CG 4.11Å; M330-M333 HydrophobicContact CB-SD 4.31Å; M330-M333 HydrophobicContact CG-SD 4.44Å; M330-M333 PolarHBondContact O-N 2.99Å; M330-M333 HydrophobicContact SD-CE 4.47Å; M330-M333 HydrophobicContact SD-SD 3.55Å; M330-Q334 PolarHBondContact O-N 2.77Å
331	P	89.7	Confident	93	Very high	64 Å²	64	53.5 Å²	53.5	42%	0.416	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-39	-174.9	-27.1	34.8	0	0	0	114.6	M329 M333 Q334	M329-P331 VanDerWaalsContact C-CD 3.46Å; M329-P331 WeakPolarHBondContact O-CD 3.3Å; P331-M333 VanDerWaalsContact C-N 3.3Å; P331-M333 PolarHBondContact O-N 3.22Å; P331-Q334 PolarHBondContact O-N 2.79Å
332	F	90.6	Very high	92.9	Very high	69 Å²	69	53.2 Å²	53.2	30%	0.303	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-27.2	179.5	50.4	-86.9	0	0	0	113	M330 P335 P448 N451	M330-F332 VanDerWaalsContact C-N 3.27Å; M330-F332 PolarHBondContact O-N 3.02Å; M330-F332 VanDerWaalsContact O-N 3.16Å; F332-P335 WeakPolarHBondContact O-CD 3.44Å; F332-P448 CarbonylContact C-O 3.55Å; F332-P448 VanDerWaalsContact CD2-O 3.31Å; F332-P448 WeakPolarHBondContact CD2-O 3.34Å; F332-P448 WeakPolarHBondContact O-CB 3.28Å; F332-P448 VanDerWaalsContact O-O 3.13Å; F332-N451 HydrophobicContact CB-CB 4.15Å; F332-N451 HydrophobicContact CD2-CB 3.83Å; F332-N451 HydrophobicContact CE2-CB 4.43Å; F332-N451 HydrophobicContact CG-CB 3.96Å
333	M	92.1	Very high	92.7	Very high	32 Å²	32	50.9 Å²	50.9	16%	0.158	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-18.2	179.4	-60.6	-167.9	53.1	0	0	113.7	M330 P331 P335 V336 M337 P448 R449	M330-M333 HydrophobicContact CB-CB 3.98Å; M330-M333 HydrophobicContact CB-CG 4.11Å; M330-M333 HydrophobicContact CB-SD 4.31Å; M330-M333 HydrophobicContact CG-SD 4.44Å; M330-M333 PolarHBondContact O-N 2.99Å; M330-M333 HydrophobicContact SD-CE 4.47Å; M330-M333 HydrophobicContact SD-SD 3.55Å; P331-M333 VanDerWaalsContact C-N 3.3Å; P331-M333 PolarHBondContact O-N 3.22Å; M333-P335 VanDerWaalsContact C-N 3.27Å; M333-P335 VanDerWaalsContact O-N 3.13Å; M333-V336 WeakPolarHBondContact O-CG2 3.45Å; M333-V336 PolarHBondContact O-N 3.25Å; M333-M337 HydrophobicContact CB-CG 4.14Å; M333-M337 HydrophobicContact CB-SD 3.49Å; M333-M337 WeakPolarHBondContact CB-SD 3.16Å; M333-M337 HydrophobicContact CE-SD 4.15Å; M333-M337 VanDerWaalsContact O-CG 3.32Å; M333-M337 WeakPolarHBondContact O-CG 3.34Å; M333-M337 PolarHBondContact O-N 3.22Å; M333-M337 VanDerWaalsContact O-N 3.16Å; M333-P448 WeakPolarHBondContact CG-O 3.5Å; M333-R449 HydrophobicContact CE-CB 4.29Å; M333-R449 HydrophobicContact CE-CG 4.19Å
334	Q	93.6	Very high	92.4	Very high	11 Å²	11	48.2 Å²	48.2	5%	0.051	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-46.8	-44.3	-178.5	-68.1	-179.2	-4.1	0	0	113.2	Y327 M330 P331 V336 M337 Q338 F399	Y327-Q334 HydrophobicContact CD1-CG 4Å; Y327-Q334 HydrophobicContact CD2-CG 4.16Å; Y327-Q334 HydrophobicContact CE1-CB 4.19Å; Y327-Q334 HydrophobicContact CE1-CG 3.66Å; Y327-Q334 HydrophobicContact CE2-CB 3.87Å; Y327-Q334 HydrophobicContact CE2-CG 3.83Å; Y327-Q334 HydrophobicContact CG-CG 4.24Å; Y327-Q334 WeakPolarHBondContact O-CG 3.34Å; Y327-Q334 PolarHBondContact O-NE2 3.22Å; M330-Q334 PolarHBondContact O-N 2.77Å; P331-Q334 PolarHBondContact O-N 2.79Å; Q334-V336 PolarHBondContact O-N 2.83Å; Q334-V336 VanDerWaalsContact O-N 3.09Å; Q334-M337 PolarHBondContact O-N 3.23Å; Q334-Q338 PolarHBondContact O-NE2 2.88Å; Q334-F399 HydrophobicContact CB-CE1 4.19Å; Q334-F399 HydrophobicContact CB-CE2 4.45Å; Q334-F399 HydrophobicContact CB-CZ 3.81Å
335	P	92.9	Very high	92.2	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.019	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-61.5	-25.3	-178	-28.4	42.9	0	0	0	114.1	F332 M333 I396 F399 Y401	F332-P335 WeakPolarHBondContact O-CD 3.44Å; M333-P335 VanDerWaalsContact C-N 3.27Å; M333-P335 VanDerWaalsContact O-N 3.13Å; P335-I396 HydrophobicContact CB-CB 4.13Å; P335-I396 HydrophobicContact CB-CG2 4.02Å; P335-I396 WeakPolarHBondContact O-CG2 3.42Å; P335-F399 HydrophobicContact CB-CB 4.04Å; P335-F399 HydrophobicContact CB-CD2 3.92Å; P335-F399 HydrophobicContact CB-CG 4Å; P335-F399 HydrophobicContact CG-CB 3.81Å; P335-F399 HydrophobicContact CG-CD1 3.84Å; P335-F399 HydrophobicContact CG-CD2 3.84Å; P335-F399 HydrophobicContact CG-CE1 4.34Å; P335-F399 HydrophobicContact CG-CE2 4.4Å; P335-F399 HydrophobicContact CG-CG 3.56Å; P335-Y401 HydrophobicContact CB-CE2 4.11Å; P335-Y401 WeakPolarHBondContact CB-OH 3.4Å; P335-Y401 HydrophobicContact CG-CE2 4.16Å; P335-Y401 VanDerWaalsContact CG-OH 3.22Å; P335-Y401 WeakPolarHBondContact CG-OH 3.14Å
336	V	93.4	Very high	91.9	Very high	30 Å²	30	47.9 Å²	47.9	18%	0.182	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-105.7	5.9	178	-61.3	0	0	0	0	113.5	M333 Q334 I396 G426 P448 R449	M333-V336 WeakPolarHBondContact O-CG2 3.45Å; M333-V336 PolarHBondContact O-N 3.25Å; Q334-V336 PolarHBondContact O-N 2.83Å; Q334-V336 VanDerWaalsContact O-N 3.09Å; V336-I396 HydrophobicContact CG1-CG2 3.98Å; V336-G426 WeakPolarHBondContact CG1-O 3.16Å; V336-P448 HydrophobicContact CG1-CB 4.02Å; V336-P448 HydrophobicContact CG1-CG 3.98Å; V336-P448 HydrophobicContact CG2-CB 4.16Å; V336-R449 HydrophobicContact CG2-CG 4.02Å
337	M	92.2	Very high	91.5	Very high	58 Å²	58	49.7 Å²	49.7	29%	0.286	26%	0.259	S	S	.	.	S	Bend	trans	-110.2	34.4	176.8	-68.7	176.7	65.7	0	0	111.3	Y327 M333 Q334	Y327-M337 HydrophobicContact CD2-CB 4.11Å; Y327-M337 HydrophobicContact CD2-CE 4.41Å; Y327-M337 HydrophobicContact CE2-CB 4.1Å; M333-M337 HydrophobicContact CB-CG 4.14Å; M333-M337 HydrophobicContact CB-SD 3.49Å; M333-M337 WeakPolarHBondContact CB-SD 3.16Å; M333-M337 HydrophobicContact CE-SD 4.15Å; M333-M337 VanDerWaalsContact O-CG 3.32Å; M333-M337 WeakPolarHBondContact O-CG 3.34Å; M333-M337 PolarHBondContact O-N 3.22Å; M333-M337 VanDerWaalsContact O-N 3.16Å; Q334-M337 PolarHBondContact O-N 3.23Å
338	Q	91.8	Very high	91.1	Very high	68 Å²	68	51.9 Å²	51.9	32%	0.318	28%	0.275	S	S	.	.			trans	-75.9	134	-177	-66.2	-53.8	-61.4	0	0	113	Y327 Q334 T342	Y327-Q338 PolarHBondContact OH-NE2 2.83Å; Y327-Q338 VanDerWaalsContact OH-NE2 3.13Å; Q334-Q338 PolarHBondContact O-NE2 2.88Å; Q338-T342 VanDerWaalsContact CA-OG1 3.3Å; Q338-T342 WeakPolarHBondContact CA-OG1 3.23Å; Q338-T342 PolarHBondContact OE1-OG1 2.79Å; Q338-T342 VanDerWaalsContact OE1-OG1 3.1Å
339	S	92.6	Very high	90.9	Very high	49 Å²	49	51.9 Å²	51.9	34%	0.343	28%	0.281	S	S	.	.			trans	-142.1	172	171.2	80.8	0	0	0	0	109.6	R341 T342 A343	S339-R341 PolarHBondContact O-N 2.87Å; S339-R341 PolarHBondContact OG-N 2.59Å; S339-R341 VanDerWaalsContact OG-N 3.17Å; S339-T342 PolarHBondContact N-OG1 2.9Å; S339-T342 PolarHBondContact O-N 2.93Å; S339-T342 PolarHBondContact O-OG1 3.27Å; S339-T342 PolarHBondContact OG-N 3.06Å; S339-A343 PolarHBondContact O-N 2.94Å; S339-A343 VanDerWaalsContact O-N 3.14Å
340	E	90.6	Very high	90.9	Very high	179 Å²	179	45.8 Å²	45.8	84%	0.836	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-24.2	173.6	-63.8	-178.5	168.8	0	0	112.8	R292	R292-E340 PolarHBondContact NE-O 3.43Å
341	R	93.4	Very high	91	Very high	34 Å²	34	42.9 Å²	42.9	13%	0.128	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-13.8	179.7	-76.3	166.5	39.4	82.5	-0.3	114.3	I291 R292 L320 E323 S339	I291-R341 PolarHBondContact O-NH1 2.97Å; R292-R341 VanDerWaalsContact CB-O 3.25Å; R292-R341 WeakPolarHBondContact CB-O 3.36Å; L320-R341 VanDerWaalsContact CD2-CZ 3.41Å; L320-R341 PolarHBondContact O-NH2 3.15Å; E323-R341 IonicContact OE1-NE 3.03Å; E323-R341 PolarHBondContact OE1-NE 3.33Å; E323-R341 IonicContact OE1-NH2 2.86Å; E323-R341 IonicContact OE2-CZ 3.89Å; E323-R341 IonicContact OE2-NE 3.95Å; E323-R341 PolarHBondContact OE2-NE 3.12Å; E323-R341 IonicContact OE2-NH2 3.08Å; E323-R341 PolarHBondContact OE2-NH2 3.03Å; S339-R341 PolarHBondContact O-N 2.87Å; S339-R341 PolarHBondContact OG-N 2.59Å; S339-R341 VanDerWaalsContact OG-N 3.17Å
342	T	93.4	Very high	91.2	Very high	6 Å²	6	39.9 Å²	39.9	4%	0.037	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-9.5	175.7	67.8	0	0	0	0	112.1	P294 L295 Y327 Q338 S339	P294-T342 HydrophobicContact CB-CG2 3.85Å; P294-T342 HydrophobicContact CG-CG2 4.03Å; L295-T342 WeakPolarHBondContact CD2-O 3.42Å; Y327-T342 HydrophobicContact CD2-CG2 3.66Å; Y327-T342 HydrophobicContact CE2-CG2 3.47Å; Y327-T342 VanDerWaalsContact CE2-CG2 3.47Å; Y327-T342 HydrophobicContact CG-CG2 4.31Å; Q338-T342 VanDerWaalsContact CA-OG1 3.3Å; Q338-T342 WeakPolarHBondContact CA-OG1 3.23Å; Q338-T342 PolarHBondContact OE1-OG1 2.79Å; Q338-T342 VanDerWaalsContact OE1-OG1 3.1Å; S339-T342 PolarHBondContact N-OG1 2.9Å; S339-T342 PolarHBondContact O-N 2.93Å; S339-T342 PolarHBondContact O-OG1 3.27Å; S339-T342 PolarHBondContact OG-N 3.06Å
343	A	91.2	Very high	91.2	Very high	38 Å²	38	36.8 Å²	36.8	31%	0.314	20%	0.204	S	C	.	.	S	Bend	trans	-80.7	142.4	175.8	0	0	0	0	0	111.1	R292 L295 S339	R292-A343 WeakPolarHBondContact CD-O 3.44Å; R292-A343 PolarHBondContact NH1-O 3.42Å; L295-A343 WeakPolarHBondContact CD1-O 3.3Å; S339-A343 PolarHBondContact O-N 2.94Å; S339-A343 VanDerWaalsContact O-N 3.14Å
344	I	90.1	Very high	91.3	Very high	13 Å²	13	35.3 Å²	35.3	7%	0.067	20%	0.196	C	C	.	.			trans	-63.1	155.1	175.2	64.9	168.6	0	0	0	111.7	T28 R292 S346 T620 F622	T28-I344 HydrophobicContact CG2-CG2 4.18Å; R292-I344 PolarHBondContact NH1-O 2.97Å; I344-S346 PolarHBondContact O-N 3.2Å; I344-T620 HydrophobicContact CD1-CG2 4.17Å; I344-T620 VanDerWaalsContact CD1-O 3.22Å; I344-T620 WeakPolarHBondContact CD1-O 3.19Å; I344-T620 HydrophobicContact CG1-CG2 4.28Å; I344-F622 HydrophobicContact CB-CE2 3.78Å; I344-F622 HydrophobicContact CB-CZ 4.21Å; I344-F622 HydrophobicContact CD1-CD2 4.18Å; I344-F622 HydrophobicContact CD1-CE2 4.14Å; I344-F622 HydrophobicContact CG1-CE2 4.45Å; I344-F622 HydrophobicContact CG2-CE2 4.28Å
345	R	89.7	Confident	91.1	Very high	9 Å²	9	34.9 Å²	34.9	3%	0.034	19%	0.194	C	C	.	.	S	Bend	trans	-76.2	65.9	176	-67.2	-175.4	-177.3	-80.4	-5	111.9	L253 S255 N256 E263 N290 R292 F622	L253-R345 PolarHBondContact O-NH1 3.39Å; L253-R345 PolarHBondContact O-NH2 3.16Å; S255-R345 PolarHBondContact O-NH1 2.99Å; N256-R345 CarbonylContact O-C 3.6Å; E263-R345 WeakPolarHBondContact OE1-CD 3.4Å; E263-R345 IonicContact OE1-CZ 2.83Å; E263-R345 IonicContact OE1-NE 3.54Å; E263-R345 PolarHBondContact OE1-NE 3.12Å; E263-R345 IonicContact OE1-NH2 3.39Å; E263-R345 PolarHBondContact OE1-NH2 3.25Å; E263-R345 IonicContact OE2-CZ 3.9Å; E263-R345 IonicContact OE2-NE 3.01Å; E263-R345 IonicContact OE2-NH2 3.76Å; E263-R345 PolarHBondContact OE2-NH2 2.96Å; E263-R345 VanDerWaalsContact OE2-NH2 3.17Å; N290-R345 PolarHBondContact O-NH2 3.33Å; R292-R345 VanDerWaalsContact NH1-CA 3.35Å; R345-F622 HydrophobicContact CB-CE1 4.39Å; R345-F622 HydrophobicContact CB-CZ 4.03Å; R345-F622 WeakPolarHBondContact O-CE1 3.5Å; R345-F622 WeakPolarHBondContact O-CZ 3.42Å
346	S	87.9	Confident	90.9	Very high	17 Å²	17	34.7 Å²	34.7	12%	0.119	19%	0.193	C	C	.	.			trans	-152.7	135.9	174	-177.2	0	0	0	0	109	I344 S348 T620 V621	I344-S346 PolarHBondContact O-N 3.2Å; S346-S348 PolarHBondContact OG-N 2.93Å; S346-S348 VanDerWaalsContact OG-N 3.16Å; S346-T620 WeakPolarHBondContact O-CG2 3.32Å; S346-V621 PolarHBondContact OG-O 3.5Å
347	D	85.9	Confident	90.5	Very high	116 Å²	116	33.7 Å²	33.7	62%	0.62	19%	0.187	S	C	*	.			trans	-99.5	-2.8	167.5	-59.5	-49.8	0	0	0	111.5	N256 A349	N256-D347 WeakPolarHBondContact CB-OD1 2.98Å; N256-D347 WeakPolarHBondContact CB-OD2 3.28Å; N256-D347 PolarHBondContact ND2-OD1 3.48Å; D347-A349 PolarHBondContact O-N 3.45Å
348	S	85.2	Confident	90	Very high	53 Å²	53	32.3 Å²	32.3	37%	0.371	18%	0.181	S	C	.	.			trans	-84.9	102.7	-173.8	-164.3	0	0	0	0	109.6	S346 H350 T620	S346-S348 PolarHBondContact OG-N 2.93Å; S346-S348 VanDerWaalsContact OG-N 3.16Å; S348-H350 WeakPolarHBondContact CB-NE2 3.42Å; S348-H350 PolarHBondContact O-CD2 3.34Å; S348-H350 VanDerWaalsContact O-CD2 3.23Å; S348-H350 PolarHBondContact OG-CE1 2.99Å; S348-H350 PolarHBondContact OG-NE2 2.91Å; S348-T620 WeakPolarHBondContact O-CA 3.24Å
349	A	89.9	Confident	89	Confident	33 Å²	33	34 Å²	34	27%	0.273	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	148	165.5	0	0	0	0	0	109.4	D347 F570 T618 L619	D347-A349 PolarHBondContact O-N 3.45Å; A349-F570 VanDerWaalsContact C-CE2 3.49Å; A349-F570 HydrophobicContact CB-CE2 3.96Å; A349-F570 WeakPolarHBondContact O-CE2 3.29Å; A349-F570 WeakPolarHBondContact O-CZ 3.44Å; A349-T618 HydrophobicContact CB-CG2 3.81Å; A349-L619 CarbonylContact C-O 3.59Å
350	H	91.2	Very high	88	Confident	15 Å²	15	41 Å²	41	7%	0.069	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	151.9	179.2	-66.7	-83.1	0	0	0	111	S348 V352 L370 T618 L619	S348-H350 WeakPolarHBondContact CB-NE2 3.42Å; S348-H350 PolarHBondContact O-CD2 3.34Å; S348-H350 VanDerWaalsContact O-CD2 3.23Å; S348-H350 PolarHBondContact OG-CE1 2.99Å; S348-H350 PolarHBondContact OG-NE2 2.91Å; H350-V352 PolarHBondContact O-N 3.47Å; H350-L370 HydrophobicContact CB-CD1 3.41Å; H350-L370 VanDerWaalsContact CB-CD1 3.41Å; H350-L370 HydrophobicContact CB-CG 3.78Å; H350-L370 VanDerWaalsContact CG-CD1 3.44Å; H350-T618 WeakPolarHBondContact O-CA 3.36Å; H350-L619 PolarHBondContact N-O 3.4Å; H350-L619 PolarHBondContact O-N 3.47Å; H350-L619 VanDerWaalsContact O-N 3.07Å
351	L	92.8	Very high	87.2	Confident	4 Å²	4	38.2 Å²	38.2	2%	0.021	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	121.4	166.4	178.4	67	0	0	0	109	L370 F371 W378 A568 Y575 V577 F605 A616	L351-L370 WeakPolarHBondContact O-CA 3.4Å; L351-F371 HydrophobicContact CB-CB 4.16Å; L351-F371 HydrophobicContact CD2-CB 4.41Å; L351-F371 PolarHBondContact O-N 3.38Å; L351-W378 HydrophobicContact CD2-CH2 4.16Å; L351-A568 HydrophobicContact CD1-CB 3.37Å; L351-Y575 HydrophobicContact CD2-CD1 4.3Å; L351-Y575 HydrophobicContact CD2-CG 4.38Å; L351-V577 HydrophobicContact CD2-CG2 4.34Å; L351-F605 HydrophobicContact CD2-CE2 4.23Å; L351-F605 HydrophobicContact CD2-CZ 3.84Å; L351-A616 HydrophobicContact CD1-CB 4.33Å
352	V	93.7	Very high	86.4	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.3	177.4	179.4	0	0	0	0	109.2	H350 R369 L381 A616 C617 L619	H350-V352 PolarHBondContact O-N 3.47Å; V352-R369 CarbonylContact C-O 3.56Å; V352-R369 WeakPolarHBondContact CA-O 3.43Å; V352-L381 HydrophobicContact CG1-CD1 4Å; V352-L381 HydrophobicContact CG2-CD1 4.21Å; V352-A616 CarbonylContact O-C 3.44Å; V352-A616 VanDerWaalsContact O-CA 3.27Å; V352-A616 WeakPolarHBondContact O-CA 3.46Å; V352-C617 PolarHBondContact N-O 2.89Å; V352-C617 PolarHBondContact O-N 3.11Å; V352-L619 HydrophobicContact CB-CD1 4.32Å; V352-L619 HydrophobicContact CG1-CD1 4.39Å; V352-L619 HydrophobicContact CG2-CB 4.11Å; V352-L619 HydrophobicContact CG2-CD1 4.27Å
353	T	92.6	Very high	86	Confident	5 Å²	5	44.8 Å²	44.8	3%	0.031	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	148.7	174.9	60.9	0	0	0	0	110.2	L368 R369 W378 V577 I614 R615 A616	T353-L368 CarbonylContact O-C 3.57Å; T353-L368 WeakPolarHBondContact O-CA 3.39Å; T353-R369 PolarHBondContact N-O 3.35Å; T353-R369 PolarHBondContact O-N 3.33Å; T353-R369 PolarHBondContact OG1-O 2.89Å; T353-W378 HydrophobicContact CG2-CH2 3.4Å; T353-W378 VanDerWaalsContact CG2-CH2 3.4Å; T353-W378 HydrophobicContact CG2-CZ3 3.57Å; T353-W378 WeakPolarHBondContact OG1-CZ3 3.49Å; T353-V577 HydrophobicContact CG2-CG1 3.8Å; T353-I614 HydrophobicContact CG2-CD1 4.23Å; T353-R615 CarbonylContact C-O 3.58Å; T353-R615 VanDerWaalsContact CA-O 3.29Å; T353-R615 WeakPolarHBondContact CA-O 3.37Å; T353-A616 HydrophobicContact CG2-CB 4.3Å
354	L	92.6	Very high	85.8	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	146.2	-177.1	62.7	151.8	0	0	0	113.8	E367 L368 M384 I393 L400 V402 R615	L354-E367 WeakPolarHBondContact CA-O 3.48Å; L354-L368 HydrophobicContact CB-CD1 4.19Å; L354-L368 HydrophobicContact CB-CG 3.9Å; L354-M384 HydrophobicContact CD1-SD 4.33Å; L354-I393 HydrophobicContact CD1-CG2 3.8Å; L354-I393 HydrophobicContact CD2-CG2 4.24Å; L354-I393 HydrophobicContact CG-CG2 4.28Å; L354-L400 HydrophobicContact CD1-CD2 3.9Å; L354-L400 HydrophobicContact CD2-CD2 4.28Å; L354-V402 HydrophobicContact CD1-CG2 3.53Å; L354-R615 HydrophobicContact CD2-CB 4.25Å; L354-R615 HydrophobicContact CG-CB 4.27Å; L354-R615 PolarHBondContact N-O 2.6Å; L354-R615 PolarHBondContact O-N 3.28Å; L354-R615 VanDerWaalsContact O-N 3.09Å
355	G	90.1	Very high	85.8	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.01	23%	0.229	C	C	.	.			trans	59.7	-147.9	174.1	0	0	0	0	0	113.7	E367 R388	G355-E367 PolarHBondContact N-O 3.17Å; G355-E367 VanDerWaalsContact N-O 3.15Å; G355-R388 WeakPolarHBondContact CA-O 3.44Å
356	G	87.9	Confident	85.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.247	C	C	.	.			trans	96.5	-175.6	-175.4	0	0	0	0	0	112.7	S365 R388 G612	G356-S365 PolarHBondContact O-N 3.36Å; G356-R388 PolarHBondContact N-O 3.17Å; G356-G612 CarbonylContact C-O 3.5Å; G356-G612 VanDerWaalsContact CA-O 3.23Å; G356-G612 WeakPolarHBondContact CA-O 3.31Å
357	V	85.7	Confident	85.9	Confident	8 Å²	8	50 Å²	50	5%	0.048	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	134.6	-175.1	65.2	0	0	0	0	112.4	R359 V363 V364 Y389 Y409 G612	V357-R359 PolarHBondContact O-N 3.23Å; V357-V363 WeakPolarHBondContact CA-O 3.32Å; V357-V363 WeakPolarHBondContact CG2-O 3.47Å; V357-V364 HydrophobicContact CG2-CG2 4.35Å; V357-Y389 HydrophobicContact CB-CG 4.32Å; V357-Y389 HydrophobicContact CG1-CD2 4.35Å; V357-Y409 HydrophobicContact CG1-CD2 4.46Å; V357-Y409 HydrophobicContact CG1-CE2 4.48Å; V357-Y409 HydrophobicContact CG2-CD2 3.77Å; V357-Y409 HydrophobicContact CG2-CE2 4.37Å; V357-G612 PolarHBondContact N-O 3.04Å; V357-G612 PolarHBondContact O-N 3.01Å
358	L	82	Confident	86.2	Confident	30 Å²	30	45.1 Å²	45.1	16%	0.157	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	90.5	163.6	-71.9	100.3	0	0	0	108.9	Q360 Q361 L362 V363 L611	L358-Q360 PolarHBondContact O-N 3.45Å; L358-Q360 VanDerWaalsContact O-N 3.11Å; L358-Q361 HydrophobicContact CB-CB 4.27Å; L358-Q361 CarbonylContact O-C 3.56Å; L358-Q361 PolarHBondContact O-N 3.45Å; L358-L362 PolarHBondContact O-N 3.21Å; L358-V363 PolarHBondContact N-O 2.87Å; L358-V363 PolarHBondContact O-N 3.31Å; L358-L611 HydrophobicContact CB-CD2 4.48Å; L358-L611 HydrophobicContact CD1-CD2 3.44Å; L358-L611 VanDerWaalsContact CD1-CD2 3.44Å; L358-L611 HydrophobicContact CG-CD2 3.59Å
359	R	70.9	Confident	86.5	Confident	104 Å²	104	45 Å²	45	39%	0.392	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-27.5	-172.8	-170.6	175.6	-173.1	-179.1	1.6	114.4	V357 L362 M587	V357-R359 PolarHBondContact O-N 3.23Å; R359-L362 WeakPolarHBondContact O-CD2 3.26Å; R359-M587 HydrophobicContact CB-CE 3.27Å; R359-M587 VanDerWaalsContact CD-CE 3.46Å; R359-M587 HydrophobicContact CG-CE 4.02Å
360	Q	70.5	Confident	86.6	Confident	195 Å²	195	43.5 Å²	43.5	91%	0.911	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-32.7	175.9	-68.6	-180	-5.4	0	0	112.7	L358	L358-Q360 PolarHBondContact O-N 3.45Å; L358-Q360 VanDerWaalsContact O-N 3.11Å
361	Q	73.6	Confident	86.5	Confident	121 Å²	121	43 Å²	43	57%	0.565	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101	-9.7	-177.8	-62	176.6	1.5	0	0	112.2	L358 V363	L358-Q361 HydrophobicContact CB-CB 4.27Å; L358-Q361 CarbonylContact O-C 3.56Å; L358-Q361 PolarHBondContact O-N 3.45Å; Q361-V363 HydrophobicContact CB-CB 4.36Å; Q361-V363 HydrophobicContact CB-CG2 3.9Å; Q361-V363 PolarHBondContact O-N 2.98Å
362	L	78.3	Confident	86.2	Confident	104 Å²	104	44 Å²	44	55%	0.545	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	26	-173.9	-51.8	173.3	0	0	0	112.9	L358 R359 Y409	L358-L362 PolarHBondContact O-N 3.21Å; R359-L362 WeakPolarHBondContact O-CD2 3.26Å; L362-Y409 HydrophobicContact CD2-CD1 3.58Å; L362-Y409 HydrophobicContact CD2-CE1 3.62Å; L362-Y409 HydrophobicContact CD2-CG 4.17Å
363	V	84.4	Confident	85.5	Confident	73 Å²	73	46.9 Å²	46.9	44%	0.442	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.4	-179	178	0	0	0	0	109.8	V357 L358 Q361	V357-V363 WeakPolarHBondContact CA-O 3.32Å; V357-V363 WeakPolarHBondContact CG2-O 3.47Å; L358-V363 PolarHBondContact N-O 2.87Å; L358-V363 PolarHBondContact O-N 3.31Å; Q361-V363 HydrophobicContact CB-CB 4.36Å; Q361-V363 HydrophobicContact CB-CG2 3.9Å; Q361-V363 PolarHBondContact O-N 2.98Å
364	V	87.4	Confident	85	Confident	16 Å²	16	56.2 Å²	56.2	10%	0.097	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131.1	175.1	-175.9	0	0	0	0	108.9	V357 P387 Y389 S407	V357-V364 HydrophobicContact CG2-CG2 4.35Å; V364-P387 HydrophobicContact CB-CB 3.94Å; V364-P387 HydrophobicContact CG1-CB 3.78Å; V364-P387 VanDerWaalsContact O-CB 3.27Å; V364-P387 WeakPolarHBondContact O-CB 3.26Å; V364-Y389 HydrophobicContact CB-CD1 4.43Å; V364-Y389 HydrophobicContact CG1-CD1 3.91Å; V364-Y389 HydrophobicContact CG1-CG 4.45Å; V364-Y389 HydrophobicContact CG2-CD1 3.56Å; V364-Y389 HydrophobicContact CG2-CE1 4.04Å; V364-Y389 HydrophobicContact CG2-CG 4.45Å; V364-S407 WeakPolarHBondContact CB-O 3.5Å; V364-S407 WeakPolarHBondContact CG2-O 3.34Å
365	S	88.8	Confident	84.6	Confident	14 Å²	14	58.2 Å²	58.2	10%	0.098	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-82.2	144.4	-178.4	-176.4	0	0	0	0	111.8	G356 E367 P387 R388	G356-S365 PolarHBondContact O-N 3.36Å; S365-E367 WeakPolarHBondContact OG-CB 3.46Å; S365-E367 PolarHBondContact OG-N 2.81Å; S365-P387 WeakPolarHBondContact O-CA 3.34Å; S365-R388 PolarHBondContact O-N 2.88Å; S365-R388 VanDerWaalsContact O-N 3.11Å
366	K	90.8	Very high	84.3	Confident	94 Å²	94	64.7 Å²	64.7	41%	0.409	31%	0.311	S	S	.	.			trans	-106.9	-3	165.7	63.3	174.1	-176.8	173.1	0	112.6	P383 M384 P387	K366-P383 HydrophobicContact CD-CB 4.15Å; K366-P383 HydrophobicContact CG-CB 4.04Å; K366-P383 CarbonylContact O-C 3.5Å; K366-P383 WeakPolarHBondContact O-CA 3.18Å; K366-M384 HydrophobicContact CB-CB 4.23Å; K366-M384 PolarHBondContact O-N 2.66Å; K366-P387 HydrophobicContact CB-CB 4.23Å
367	E	90.1	Very high	84.2	Confident	64 Å²	64	70.4 Å²	70.4	30%	0.299	34%	0.338	S	S	.	.			trans	-73.2	143.2	-170.3	-62.2	-58	134.5	0	0	111.7	L354 G355 S365	L354-E367 WeakPolarHBondContact CA-O 3.48Å; G355-E367 PolarHBondContact N-O 3.17Å; G355-E367 VanDerWaalsContact N-O 3.15Å; S365-E367 WeakPolarHBondContact OG-CB 3.46Å; S365-E367 PolarHBondContact OG-N 2.81Å
368	L	91.8	Very high	84.3	Confident	12 Å²	12	71.9 Å²	71.9	6%	0.063	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.8	165.5	-82	70.5	0	0	0	107.6	T353 L354 L381 M384 L400	T353-L368 CarbonylContact O-C 3.57Å; T353-L368 WeakPolarHBondContact O-CA 3.39Å; L354-L368 HydrophobicContact CB-CD1 4.19Å; L354-L368 HydrophobicContact CB-CG 3.9Å; L368-L381 HydrophobicContact CB-CB 3.81Å; L368-L381 HydrophobicContact CB-CD1 4.38Å; L368-L381 PolarHBondContact O-N 3.18Å; L368-M384 HydrophobicContact CD1-CB 4.49Å; L368-M384 HydrophobicContact CD1-CG 3.41Å; L368-M384 VanDerWaalsContact CD1-CG 3.41Å; L368-M384 HydrophobicContact CD1-SD 4.36Å; L368-L400 HydrophobicContact CD2-CD2 4.23Å
369	R	91.1	Very high	84.6	Confident	52 Å²	52	71.7 Å²	71.7	20%	0.196	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	131.1	177	-61.4	-172.5	178.1	170.6	3.9	110.9	V352 T353 W378 K379 P608 E609	V352-R369 CarbonylContact C-O 3.56Å; V352-R369 WeakPolarHBondContact CA-O 3.43Å; T353-R369 PolarHBondContact N-O 3.35Å; T353-R369 PolarHBondContact O-N 3.33Å; T353-R369 PolarHBondContact OG1-O 2.89Å; R369-W378 HydrophobicContact CB-CE3 3.76Å; R369-W378 HydrophobicContact CB-CZ3 4.39Å; R369-K379 CarbonylContact C-O 3.58Å; R369-K379 WeakPolarHBondContact CA-O 3.49Å; R369-P608 VanDerWaalsContact NH1-CB 3.31Å; R369-P608 VanDerWaalsContact NH1-CG 3.3Å; R369-E609 IonicContact CZ-OE1 3.17Å; R369-E609 IonicContact NH1-OE1 3.83Å; R369-E609 IonicContact NH2-OE1 3.37Å; R369-E609 PolarHBondContact NH2-OE1 3.06Å
370	L	91.9	Very high	85.5	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	137.9	172.5	170.4	143.9	0	0	0	109.6	H350 L351 D372 W378 K379 L381 V621	H350-L370 HydrophobicContact CB-CD1 3.41Å; H350-L370 VanDerWaalsContact CB-CD1 3.41Å; H350-L370 HydrophobicContact CB-CG 3.78Å; H350-L370 VanDerWaalsContact CG-CD1 3.44Å; L351-L370 WeakPolarHBondContact O-CA 3.4Å; L370-D372 HydrophobicContact CD2-CB 4.3Å; L370-W378 CarbonylContact O-C 3.51Å; L370-W378 WeakPolarHBondContact O-CA 3.25Å; L370-K379 HydrophobicContact CD2-CB 4.34Å; L370-K379 PolarHBondContact N-O 2.96Å; L370-K379 PolarHBondContact O-N 3.09Å; L370-L381 HydrophobicContact CB-CD1 4.1Å; L370-L381 HydrophobicContact CB-CD2 4.12Å; L370-L381 HydrophobicContact CB-CG 4.05Å; L370-V621 HydrophobicContact CD1-CG2 3.09Å
371	F	89.3	Confident	86.5	Confident	6 Å²	6	61.1 Å²	61.1	3%	0.026	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	118.3	169.9	-173	-111.8	0	0	0	110.4	L351 E373 W378 F605	L351-F371 HydrophobicContact CB-CB 4.16Å; L351-F371 HydrophobicContact CD2-CB 4.41Å; L351-F371 PolarHBondContact O-N 3.38Å; F371-E373 HydrophobicContact CD1-CG 3.95Å; F371-E373 HydrophobicContact CE1-CB 4.45Å; F371-E373 HydrophobicContact CE1-CG 4.01Å; F371-W378 HydrophobicContact CB-CD2 4.41Å; F371-W378 HydrophobicContact CB-CE3 3.98Å; F371-W378 HydrophobicContact CB-CH2 4.09Å; F371-W378 HydrophobicContact CB-CZ3 3.8Å; F371-W378 HydrophobicContact CD2-CD2 4.06Å; F371-W378 AromaticContact CD2-CE2 3.9Å; F371-W378 HydrophobicContact CD2-CE3 4.48Å; F371-W378 HydrophobicContact CD2-CG 4.42Å; F371-W378 HydrophobicContact CD2-CZ2 4.26Å; F371-F605 HydrophobicContact CD1-CD1 4.33Å; F371-F605 AromaticContact CD1-CE1 3.66Å; F371-F605 HydrophobicContact CD1-CE1 3.66Å; F371-F605 HydrophobicContact CD1-CE2 4.44Å; F371-F605 AromaticContact CD1-CZ 3.71Å; F371-F605 HydrophobicContact CD1-CZ 3.71Å; F371-F605 HydrophobicContact CD2-CD1 4.32Å; F371-F605 HydrophobicContact CD2-CD2 4.11Å; F371-F605 HydrophobicContact CD2-CE1 4.23Å; F371-F605 AromaticContact CD2-CE2 3.98Å; F371-F605 HydrophobicContact CD2-CE2 3.98Å; F371-F605 HydrophobicContact CD2-CG 4.28Å; F371-F605 HydrophobicContact CD2-CZ 4.06Å; F371-F605 AromaticContact CE1-CD1 3.57Å; F371-F605 HydrophobicContact CE1-CD1 3.57Å; F371-F605 AromaticContact CE1-CE1 3.19Å; F371-F605 HydrophobicContact CE1-CE1 3.19Å; F371-F605 HydrophobicContact CE1-CG 4.43Å; F371-F605 AromaticContact CE1-CZ 3.76Å; F371-F605 HydrophobicContact CE1-CZ 3.76Å; F371-F605 HydrophobicContact CE2-CB 4.16Å; F371-F605 AromaticContact CE2-CD1 3.55Å; F371-F605 HydrophobicContact CE2-CD1 3.55Å; F371-F605 AromaticContact CE2-CD2 3.88Å; F371-F605 HydrophobicContact CE2-CD2 3.88Å; F371-F605 AromaticContact CE2-CE1 3.84Å; F371-F605 HydrophobicContact CE2-CE1 3.84Å; F371-F605 HydrophobicContact CE2-CE2 4.11Å; F371-F605 AromaticContact CE2-CG 3.6Å; F371-F605 HydrophobicContact CE2-CG 3.6Å; F371-F605 HydrophobicContact CE2-CZ 4.11Å; F371-F605 HydrophobicContact CG-CE1 4.16Å; F371-F605 HydrophobicContact CG-CE2 4.16Å; F371-F605 AromaticContact CG-CZ 3.88Å; F371-F605 HydrophobicContact CG-CZ 3.88Å; F371-F605 HydrophobicContact CZ-CB 4.34Å; F371-F605 AromaticContact CZ-CD1 3.12Å; F371-F605 HydrophobicContact CZ-CD1 3.12Å; F371-F605 HydrophobicContact CZ-CD2 4.3Å; F371-F605 AromaticContact CZ-CE1 3.31Å; F371-F605 HydrophobicContact CZ-CE1 3.31Å; F371-F605 HydrophobicContact CZ-CE2 4.4Å; F371-F605 AromaticContact CZ-CG 3.69Å; F371-F605 HydrophobicContact CZ-CG 3.69Å; F371-F605 AromaticContact CZ-CZ 3.97Å; F371-F605 HydrophobicContact CZ-CZ 3.97Å
372	D	85.7	Confident	87.2	Confident	23 Å²	23	56.5 Å²	56.5	12%	0.123	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	106.7	171.8	-173.8	-19.6	0	0	0	108.9	L370 K374 A375 H376 E377 K379	L370-D372 HydrophobicContact CD2-CB 4.3Å; D372-K374 VanDerWaalsContact C-N 3.28Å; D372-K374 PolarHBondContact O-N 2.96Å; D372-K374 PolarHBondContact OD1-N 2.75Å; D372-A375 HydrophobicContact CB-CB 4.16Å; D372-A375 PolarHBondContact O-N 3.43Å; D372-A375 PolarHBondContact OD1-N 3.26Å; D372-H376 VanDerWaalsContact O-CA 3.28Å; D372-H376 WeakPolarHBondContact O-CA 3.28Å; D372-H376 PolarHBondContact O-N 2.9Å; D372-E377 PolarHBondContact N-O 2.75Å; D372-E377 PolarHBondContact O-N 3.29Å; D372-K379 HydrophobicContact CB-CD 4.17Å; D372-K379 HydrophobicContact CB-CG 4.5Å; D372-K379 WeakPolarHBondContact OD2-CE 3.44Å; D372-K379 IonicContact OD2-NZ 3.93Å; D372-K379 PolarHBondContact OD2-NZ 2.94Å
373	E	80.7	Confident	87.7	Confident	61 Å²	61	53.9 Å²	53.9	29%	0.285	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-28.4	-177.1	-57.5	-160.5	130.4	0	0	113.6	F371 H376 F570	F371-E373 HydrophobicContact CD1-CG 3.95Å; F371-E373 HydrophobicContact CE1-CB 4.45Å; F371-E373 HydrophobicContact CE1-CG 4.01Å; E373-H376 PolarHBondContact O-CE1 2.92Å; E373-F570 HydrophobicContact CG-CE1 4.47Å; E373-F570 WeakPolarHBondContact OE1-CE1 3.46Å
374	K	82.2	Confident	88	Confident	201 Å²	201	50.7 Å²	50.7	87%	0.874	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-39.5	-178.5	-66.9	-177.9	-179.8	178.4	0	111	D372	D372-K374 VanDerWaalsContact C-N 3.28Å; D372-K374 PolarHBondContact O-N 2.96Å; D372-K374 PolarHBondContact OD1-N 2.75Å
375	A	82.9	Confident	88	Confident	44 Å²	44	55.9 Å²	55.9	36%	0.364	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-17.4	176.5	0	0	0	0	0	112.7	D372 E377	D372-A375 HydrophobicContact CB-CB 4.16Å; D372-A375 PolarHBondContact O-N 3.43Å; D372-A375 PolarHBondContact OD1-N 3.26Å; A375-E377 HydrophobicContact CB-CB 4.15Å; A375-E377 HydrophobicContact CB-CG 4.42Å; A375-E377 PolarHBondContact O-N 3.22Å
376	H	83.3	Confident	88	Confident	137 Å²	137	56.3 Å²	56.3	63%	0.634	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	37.2	-167.1	-67.4	-66.5	0	0	0	113	D372 E373	D372-H376 VanDerWaalsContact O-CA 3.28Å; D372-H376 WeakPolarHBondContact O-CA 3.28Å; D372-H376 PolarHBondContact O-N 2.9Å; E373-H376 PolarHBondContact O-CE1 2.92Å
377	E	86.5	Confident	87.9	Confident	120 Å²	120	53.8 Å²	53.8	56%	0.561	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.6	155	-174.5	-74.2	-175.2	171.7	0	0	112.4	D372 A375	D372-E377 PolarHBondContact N-O 2.75Å; D372-E377 PolarHBondContact O-N 3.29Å; A375-E377 HydrophobicContact CB-CB 4.15Å; A375-E377 HydrophobicContact CB-CG 4.42Å; A375-E377 PolarHBondContact O-N 3.22Å
378	W	87.1	Confident	87.8	Confident	39 Å²	39	53.3 Å²	53.3	15%	0.148	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	121.7	173.6	-69.7	94.4	0	0	0	110.4	L351 T353 R369 L370 F371 V591 F605 D606 L607 P608	L351-W378 HydrophobicContact CD2-CH2 4.16Å; T353-W378 HydrophobicContact CG2-CH2 3.4Å; T353-W378 VanDerWaalsContact CG2-CH2 3.4Å; T353-W378 HydrophobicContact CG2-CZ3 3.57Å; T353-W378 WeakPolarHBondContact OG1-CZ3 3.49Å; R369-W378 HydrophobicContact CB-CE3 3.76Å; R369-W378 HydrophobicContact CB-CZ3 4.39Å; L370-W378 CarbonylContact O-C 3.51Å; L370-W378 WeakPolarHBondContact O-CA 3.25Å; F371-W378 HydrophobicContact CB-CD2 4.41Å; F371-W378 HydrophobicContact CB-CE3 3.98Å; F371-W378 HydrophobicContact CB-CH2 4.09Å; F371-W378 HydrophobicContact CB-CZ3 3.8Å; F371-W378 HydrophobicContact CD2-CD2 4.06Å; F371-W378 AromaticContact CD2-CE2 3.9Å; F371-W378 HydrophobicContact CD2-CE3 4.48Å; F371-W378 HydrophobicContact CD2-CG 4.42Å; F371-W378 HydrophobicContact CD2-CZ2 4.26Å; W378-V591 HydrophobicContact CZ2-CG2 4.44Å; W378-F605 HydrophobicContact CH2-CE2 4.07Å; W378-F605 AromaticContact CZ2-CD2 3.76Å; W378-F605 HydrophobicContact CZ2-CD2 3.76Å; W378-F605 AromaticContact CZ2-CE2 3.41Å; W378-F605 HydrophobicContact CZ2-CE2 3.41Å; W378-F605 VanDerWaalsContact CZ2-CE2 3.41Å; W378-F605 AromaticContact NE1-CD2 3.94Å; W378-D606 PolarHBondContact NE1-O 2.65Å; W378-L607 HydrophobicContact CH2-CD2 4.06Å; W378-L607 HydrophobicContact CZ2-CD2 3.49Å; W378-L607 VanDerWaalsContact CZ2-CD2 3.49Å; W378-P608 HydrophobicContact CB-CG 3.98Å; W378-P608 VanDerWaalsContact CD1-CD 3.48Å; W378-P608 HydrophobicContact CG-CG 3.91Å
379	K	89.8	Confident	87.5	Confident	26 Å²	26	53.1 Å²	53.1	11%	0.113	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	132.2	176.3	-66.9	-176.3	171.2	177.3	0	110.2	R369 L370 D372 P624 D626	R369-K379 CarbonylContact C-O 3.58Å; R369-K379 WeakPolarHBondContact CA-O 3.49Å; L370-K379 HydrophobicContact CD2-CB 4.34Å; L370-K379 PolarHBondContact N-O 2.96Å; L370-K379 PolarHBondContact O-N 3.09Å; D372-K379 HydrophobicContact CB-CD 4.17Å; D372-K379 HydrophobicContact CB-CG 4.5Å; D372-K379 WeakPolarHBondContact OD2-CE 3.44Å; D372-K379 IonicContact OD2-NZ 3.93Å; D372-K379 PolarHBondContact OD2-NZ 2.94Å; K379-P624 HydrophobicContact CB-CG 4.15Å; K379-D626 WeakPolarHBondContact CE-OD1 3.44Å; K379-D626 IonicContact NZ-OD1 2.69Å; K379-D626 PolarHBondContact NZ-OD1 2.86Å; K379-D626 IonicContact NZ-OD2 2.85Å
380	A	89.8	Confident	87.2	Confident	61 Å²	61	52.5 Å²	52.5	50%	0.504	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	136.2	176.7	0	0	0	0	0	110.6	P624	A380-P624 WeakPolarHBondContact O-CG 3.47Å
381	L	90.4	Very high	87	Confident	16 Å²	16	52.6 Å²	52.6	8%	0.084	28%	0.277	C	S	.	.			trans	-101.5	177.7	167.7	-60.6	178.8	0	0	0	109.5	V352 L368 L370 P624	V352-L381 HydrophobicContact CG1-CD1 4Å; V352-L381 HydrophobicContact CG2-CD1 4.21Å; L368-L381 HydrophobicContact CB-CB 3.81Å; L368-L381 HydrophobicContact CB-CD1 4.38Å; L368-L381 PolarHBondContact O-N 3.18Å; L370-L381 HydrophobicContact CB-CD1 4.1Å; L370-L381 HydrophobicContact CB-CD2 4.12Å; L370-L381 HydrophobicContact CB-CG 4.05Å; L381-P624 HydrophobicContact CD2-CG 3.84Å
382	A	88.2	Confident	86.9	Confident	24 Å²	24	52.5 Å²	52.5	20%	0.198	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-55.9	126.4	172.5	0	0	0	0	0	110.3	W26 L31	W26-A382 HydrophobicContact CZ3-CB 3.99Å; L31-A382 HydrophobicContact CD2-CB 3.85Å; L31-A382 HydrophobicContact CG-CB 4.24Å
383	P	90.2	Very high	87.2	Confident	49 Å²	49	52.5 Å²	52.5	32%	0.318	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-74.9	155.2	-177	31.2	-35.8	0	0	0	111.3	W26 K366	W26-P383 WeakPolarHBondContact CH2-O 3.34Å; K366-P383 HydrophobicContact CD-CB 4.15Å; K366-P383 HydrophobicContact CG-CB 4.04Å; K366-P383 CarbonylContact O-C 3.5Å; K366-P383 WeakPolarHBondContact O-CA 3.18Å
384	M	90.3	Very high	87.8	Confident	5 Å²	5	50 Å²	50	3%	0.025	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-59.3	149	172.1	-59.7	-175.8	-72.6	0	0	111.7	W26 L354 K366 L368 A386 R388 V402	W26-M384 VanDerWaalsContact CZ2-CA 3.42Å; W26-M384 HydrophobicContact CZ2-CB 4.38Å; L354-M384 HydrophobicContact CD1-SD 4.33Å; K366-M384 HydrophobicContact CB-CB 4.23Å; K366-M384 PolarHBondContact O-N 2.66Å; L368-M384 HydrophobicContact CD1-CB 4.49Å; L368-M384 HydrophobicContact CD1-CG 3.41Å; L368-M384 VanDerWaalsContact CD1-CG 3.41Å; L368-M384 HydrophobicContact CD1-SD 4.36Å; M384-A386 VanDerWaalsContact CB-O 3.31Å; M384-A386 WeakPolarHBondContact CB-O 3.44Å; M384-A386 PolarHBondContact O-N 2.75Å; M384-R388 HydrophobicContact CE-CB 3.98Å; M384-R388 HydrophobicContact CE-CG 4.34Å; M384-R388 HydrophobicContact SD-CB 4.46Å; M384-R388 HydrophobicContact SD-CG 4.36Å; M384-V402 HydrophobicContact SD-CG1 4.02Å; M384-V402 HydrophobicContact SD-CG2 4.2Å
385	D	87.8	Confident	88.3	Confident	126 Å²	126	42.8 Å²	42.8	67%	0.674	24%	0.24	S	C	*	.	S	Bend	trans	-65.4	-27.4	175.6	-49.6	-28.6	0	0	0	111.3	M24	M24-D385 HydrophobicContact CE-CB 3.4Å; M24-D385 WeakPolarHBondContact CG-OD2 3.34Å; M24-D385 HydrophobicContact SD-CB 3.53Å; M24-D385 VanDerWaalsContact SD-CB 3.53Å; M24-D385 PolarHBondContact SD-N 2.79Å; M24-D385 VanDerWaalsContact SD-N 3.38Å
386	A	87.5	Confident	88.8	Confident	23 Å²	23	41.3 Å²	41.3	19%	0.19	23%	0.226	C	C	.	.	S	Bend	trans	-129.5	139.8	178.6	0	0	0	0	0	111.3	M24 M384	M24-A386 HydrophobicContact CE-CB 4.33Å; M384-A386 VanDerWaalsContact CB-O 3.31Å; M384-A386 WeakPolarHBondContact CB-O 3.44Å; M384-A386 PolarHBondContact O-N 2.75Å
387	P	88.6	Confident	89.1	Confident	41 Å²	41	36.3 Å²	36.3	27%	0.266	21%	0.211	S	C	.	.			trans	-66.2	144.4	173.5	29.9	-35.2	0	0	0	110.9	V364 S365 K366 S407	V364-P387 HydrophobicContact CB-CB 3.94Å; V364-P387 HydrophobicContact CG1-CB 3.78Å; V364-P387 VanDerWaalsContact O-CB 3.27Å; V364-P387 WeakPolarHBondContact O-CB 3.26Å; S365-P387 WeakPolarHBondContact O-CA 3.34Å; K366-P387 HydrophobicContact CB-CB 4.23Å; P387-S407 VanDerWaalsContact O-CA 3.27Å; P387-S407 WeakPolarHBondContact O-CA 3.21Å; P387-S407 WeakPolarHBondContact O-CB 3.39Å; P387-S407 PolarHBondContact O-OG 2.64Å
388	R	88.4	Confident	89.4	Confident	54 Å²	54	32.7 Å²	32.7	20%	0.204	20%	0.196	C	C	.	.			trans	-143.7	131.5	-177.8	-63.8	-67.3	177.6	-178.9	-2.1	112.3	G355 G356 S365 M384 H391 V402 Q406	G355-R388 WeakPolarHBondContact CA-O 3.44Å; G356-R388 PolarHBondContact N-O 3.17Å; S365-R388 PolarHBondContact O-N 2.88Å; S365-R388 VanDerWaalsContact O-N 3.11Å; M384-R388 HydrophobicContact CE-CB 3.98Å; M384-R388 HydrophobicContact CE-CG 4.34Å; M384-R388 HydrophobicContact SD-CB 4.46Å; M384-R388 HydrophobicContact SD-CG 4.36Å; R388-H391 HydrophobicContact CB-CB 4.13Å; R388-H391 PolarHBondContact O-ND1 2.79Å; R388-V402 HydrophobicContact CG-CG1 4.26Å; R388-Q406 WeakPolarHBondContact CA-O 3.44Å
389	Y	85.6	Confident	89.7	Confident	8 Å²	8	31.2 Å²	31.2	3%	0.031	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-128.7	156.9	164	81	-76.7	0	0	0	111.3	V357 V364 H391 G405 Q406 N408 Y409 D410	V357-Y389 HydrophobicContact CB-CG 4.32Å; V357-Y389 HydrophobicContact CG1-CD2 4.35Å; V364-Y389 HydrophobicContact CB-CD1 4.43Å; V364-Y389 HydrophobicContact CG1-CD1 3.91Å; V364-Y389 HydrophobicContact CG1-CG 4.45Å; V364-Y389 HydrophobicContact CG2-CD1 3.56Å; V364-Y389 HydrophobicContact CG2-CE1 4.04Å; V364-Y389 HydrophobicContact CG2-CG 4.45Å; Y389-H391 PolarHBondContact O-N 3.11Å; Y389-G405 WeakPolarHBondContact O-CA 3.44Å; Y389-Q406 HydrophobicContact CD1-CB 3.9Å; Y389-Q406 VanDerWaalsContact CD1-O 3.27Å; Y389-Q406 WeakPolarHBondContact CD1-O 3.5Å; Y389-Q406 HydrophobicContact CE1-CB 3.3Å; Y389-Q406 HydrophobicContact CE1-CG 4.36Å; Y389-Q406 PolarHBondContact N-O 3.08Å; Y389-Q406 PolarHBondContact O-N 2.62Å; Y389-Q406 PolarHBondContact OH-NE2 2.8Å; Y389-N408 WeakPolarHBondContact CE1-O 3.46Å; Y389-Y409 HydrophobicContact CE2-CD2 4.46Å; Y389-D410 PolarHBondContact OH-N 3.07Å; Y389-D410 PolarHBondContact OH-O 3.44Å
390	Q	84.8	Confident	89.8	Confident	39 Å²	39	30.4 Å²	30.4	18%	0.182	19%	0.188	C	C	.	.	S	Bend	trans	52.3	26	-173.7	-72.5	176.7	-26.2	0	0	114	V417	Q390-V417 HydrophobicContact CB-CB 3.99Å; Q390-V417 HydrophobicContact CB-CG1 4.11Å
391	H	87.6	Confident	89.9	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	16%	0.164	C	C	.	.			trans	-79.4	159.4	176.3	59.2	-85.5	0	0	0	110.1	R388 Y389 V402 R615	R388-H391 HydrophobicContact CB-CB 4.13Å; R388-H391 PolarHBondContact O-ND1 2.79Å; Y389-H391 PolarHBondContact O-N 3.11Å; H391-V402 HydrophobicContact CB-CG1 4.23Å; H391-R615 WeakPolarHBondContact NE2-CG 3.42Å; H391-R615 PolarHBondContact O-NE 3.39Å
392	G	88.1	Confident	89.9	Confident	5 Å²	5	28.2 Å²	28.2	5%	0.052	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	149.7	166.6	0	0	0	0	0	112.2	V402 V403	G392-V402 WeakPolarHBondContact O-CA 3.32Å; G392-V403 PolarHBondContact N-O 3.49Å; G392-V403 PolarHBondContact O-N 2.87Å
393	I	92.4	Very high	89.9	Confident	22 Å²	22	27.7 Å²	27.7	11%	0.113	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	147.7	169.7	57.2	157.7	0	0	0	110.7	L354 L400 Y401 V402 R615 A616 C617	L354-I393 HydrophobicContact CD1-CG2 3.8Å; L354-I393 HydrophobicContact CD2-CG2 4.24Å; L354-I393 HydrophobicContact CG-CG2 4.28Å; I393-L400 HydrophobicContact CB-CD1 4.32Å; I393-Y401 VanDerWaalsContact CA-O 3.27Å; I393-Y401 WeakPolarHBondContact CA-O 3.14Å; I393-V402 HydrophobicContact CG2-CG2 4.5Å; I393-R615 HydrophobicContact CB-CB 4.48Å; I393-R615 HydrophobicContact CD1-CB 3.74Å; I393-R615 HydrophobicContact CG1-CB 3.9Å; I393-R615 HydrophobicContact CG1-CG 4.32Å; I393-R615 HydrophobicContact CG2-CB 3.74Å; I393-R615 HydrophobicContact CG2-CG 4.08Å; I393-A616 WeakPolarHBondContact CD1-O 3.34Å; I393-C617 HydrophobicContact CD1-CB 3.92Å
394	A	92.8	Very high	89.7	Confident	10 Å²	10	26.4 Å²	26.4	8%	0.083	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	153.1	170.1	0	0	0	0	0	109.6	Y401 A423 L428	A394-Y401 PolarHBondContact N-O 3.2Å; A394-Y401 VanDerWaalsContact N-O 3.11Å; A394-Y401 PolarHBondContact O-N 2.83Å; A394-A423 HydrophobicContact CB-CB 4.49Å; A394-L428 HydrophobicContact CB-CD2 3.43Å; A394-L428 VanDerWaalsContact CB-CD2 3.43Å
395	V	93.2	Very high	89.5	Confident	48 Å²	48	26.1 Å²	26.1	29%	0.291	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.6	177.4	-179.1	0	0	0	0	108.8	F399 L400 A423 C617 L619	V395-F399 VanDerWaalsContact CA-O 3.3Å; V395-F399 WeakPolarHBondContact CA-O 3.26Å; V395-L400 HydrophobicContact CG2-CD1 4.12Å; V395-A423 VanDerWaalsContact O-CB 3.31Å; V395-A423 WeakPolarHBondContact O-CB 3.5Å; V395-C617 HydrophobicContact CG2-CB 4.15Å; V395-L619 HydrophobicContact CB-CD2 4.43Å; V395-L619 HydrophobicContact CG1-CD2 3.69Å; V395-L619 HydrophobicContact CG2-CD2 3.79Å
396	I	92.4	Very high	89.2	Confident	13 Å²	13	20.7 Å²	20.7	7%	0.067	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123	170.6	-58.8	178	0	0	0	107.4	P335 V336 N398 F399 Y401 A423 L428 P448	P335-I396 HydrophobicContact CB-CB 4.13Å; P335-I396 HydrophobicContact CB-CG2 4.02Å; P335-I396 WeakPolarHBondContact O-CG2 3.42Å; V336-I396 HydrophobicContact CG1-CG2 3.98Å; I396-N398 PolarHBondContact O-N 2.86Å; I396-N398 VanDerWaalsContact O-N 3.17Å; I396-F399 PolarHBondContact N-O 3.28Å; I396-F399 VanDerWaalsContact N-O 3.11Å; I396-F399 WeakPolarHBondContact O-CB 3.38Å; I396-F399 PolarHBondContact O-N 2.78Å; I396-Y401 HydrophobicContact CB-CE2 4.04Å; I396-Y401 HydrophobicContact CD1-CE2 4.22Å; I396-Y401 HydrophobicContact CG1-CE2 4.24Å; I396-A423 HydrophobicContact CD1-CB 4.28Å; I396-A423 HydrophobicContact CG1-CB 3.57Å; I396-L428 HydrophobicContact CD1-CD1 4.47Å; I396-L428 HydrophobicContact CD1-CD2 3.35Å; I396-L428 HydrophobicContact CD1-CG 3.59Å; I396-L428 HydrophobicContact CG1-CD2 3.78Å; I396-P448 HydrophobicContact CD1-CG 4.32Å
397	G	90	Very high	88.9	Confident	32 Å²	32	21.3 Å²	21.3	33%	0.33	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	33.5	174.9	0	0	0	0	0	114.1	F399	G397-F399 VanDerWaalsContact C-N 3.25Å; G397-F399 VanDerWaalsContact O-CD2 3.28Å; G397-F399 WeakPolarHBondContact O-CD2 3.39Å; G397-F399 PolarHBondContact O-N 2.85Å
398	N	92.7	Very high	88.4	Confident	44 Å²	44	25.5 Å²	25.5	24%	0.235	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	15.8	-173.4	-160.3	52.1	0	0	0	115.5	I396 T620	I396-N398 PolarHBondContact O-N 2.86Å; I396-N398 VanDerWaalsContact O-N 3.17Å; N398-T620 PolarHBondContact ND2-O 2.81Å; N398-T620 PolarHBondContact OD1-N 3.05Å; N398-T620 PolarHBondContact OD1-O 2.81Å
399	F	92.6	Very high	87.7	Confident	9 Å²	9	26.4 Å²	26.4	4%	0.039	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	127.1	168.1	-70.4	-108.5	0	0	0	109.9	V25 T27 Q334 P335 V395 I396 G397 Y401	V25-F399 HydrophobicContact CG1-CD1 4.15Å; T27-F399 HydrophobicContact CG2-CE1 4.16Å; Q334-F399 HydrophobicContact CB-CE1 4.19Å; Q334-F399 HydrophobicContact CB-CE2 4.45Å; Q334-F399 HydrophobicContact CB-CZ 3.81Å; P335-F399 HydrophobicContact CB-CB 4.04Å; P335-F399 HydrophobicContact CB-CD2 3.92Å; P335-F399 HydrophobicContact CB-CG 4Å; P335-F399 HydrophobicContact CG-CB 3.81Å; P335-F399 HydrophobicContact CG-CD1 3.84Å; P335-F399 HydrophobicContact CG-CD2 3.84Å; P335-F399 HydrophobicContact CG-CE1 4.34Å; P335-F399 HydrophobicContact CG-CE2 4.4Å; P335-F399 HydrophobicContact CG-CG 3.56Å; V395-F399 VanDerWaalsContact CA-O 3.3Å; V395-F399 WeakPolarHBondContact CA-O 3.26Å; I396-F399 PolarHBondContact N-O 3.28Å; I396-F399 VanDerWaalsContact N-O 3.11Å; I396-F399 WeakPolarHBondContact O-CB 3.38Å; I396-F399 PolarHBondContact O-N 2.78Å; G397-F399 VanDerWaalsContact C-N 3.25Å; G397-F399 VanDerWaalsContact O-CD2 3.28Å; G397-F399 WeakPolarHBondContact O-CD2 3.39Å; G397-F399 PolarHBondContact O-N 2.85Å; F399-Y401 HydrophobicContact CB-CE2 4.22Å
400	L	92.6	Very high	86.9	Confident	9 Å²	9	28.4 Å²	28.4	5%	0.047	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	120.3	176	-180	61.7	0	0	0	110.2	L354 L368 I393 V395 V402 L619	L354-L400 HydrophobicContact CD1-CD2 3.9Å; L354-L400 HydrophobicContact CD2-CD2 4.28Å; L368-L400 HydrophobicContact CD2-CD2 4.23Å; I393-L400 HydrophobicContact CB-CD1 4.32Å; V395-L400 HydrophobicContact CG2-CD1 4.12Å; L400-V402 HydrophobicContact CD2-CG2 4.38Å; L400-V402 HydrophobicContact CG-CG2 4.2Å; L400-L619 HydrophobicContact CB-CD1 4.02Å; L400-L619 HydrophobicContact CB-CD2 4.5Å; L400-L619 HydrophobicContact CD2-CD1 4.08Å; L400-L619 HydrophobicContact CG-CD1 4.46Å
401	Y	91.9	Very high	85.8	Confident	4 Å²	4	31.3 Å²	31.3	2%	0.016	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	130.1	169.7	-71.2	-96.3	0	0	0	109.7	P335 I393 A394 I396 F399 L428 Y446	P335-Y401 HydrophobicContact CB-CE2 4.11Å; P335-Y401 WeakPolarHBondContact CB-OH 3.4Å; P335-Y401 HydrophobicContact CG-CE2 4.16Å; P335-Y401 VanDerWaalsContact CG-OH 3.22Å; P335-Y401 WeakPolarHBondContact CG-OH 3.14Å; I393-Y401 VanDerWaalsContact CA-O 3.27Å; I393-Y401 WeakPolarHBondContact CA-O 3.14Å; A394-Y401 PolarHBondContact N-O 3.2Å; A394-Y401 VanDerWaalsContact N-O 3.11Å; A394-Y401 PolarHBondContact O-N 2.83Å; I396-Y401 HydrophobicContact CB-CE2 4.04Å; I396-Y401 HydrophobicContact CD1-CE2 4.22Å; I396-Y401 HydrophobicContact CG1-CE2 4.24Å; F399-Y401 HydrophobicContact CB-CE2 4.22Å; Y401-L428 HydrophobicContact CD1-CD1 3.41Å; Y401-L428 VanDerWaalsContact CD1-CD1 3.41Å; Y401-L428 HydrophobicContact CD2-CD1 4.01Å; Y401-L428 HydrophobicContact CD2-CD2 4.33Å; Y401-L428 HydrophobicContact CE1-CD1 3.71Å; Y401-L428 HydrophobicContact CE2-CD1 4.28Å; Y401-L428 HydrophobicContact CG-CD1 3.53Å; Y401-L428 HydrophobicContact CG-CD2 4.45Å; Y401-Y446 HydrophobicContact CE1-CE1 4.15Å
402	V	90.9	Very high	84.6	Confident	26 Å²	26	39.3 Å²	39.3	16%	0.158	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	115.7	173.3	-179.2	0	0	0	0	107.4	L354 M384 R388 H391 G392 I393 L400	L354-V402 HydrophobicContact CD1-CG2 3.53Å; M384-V402 HydrophobicContact SD-CG1 4.02Å; M384-V402 HydrophobicContact SD-CG2 4.2Å; R388-V402 HydrophobicContact CG-CG1 4.26Å; H391-V402 HydrophobicContact CB-CG1 4.23Å; G392-V402 WeakPolarHBondContact O-CA 3.32Å; I393-V402 HydrophobicContact CG2-CG2 4.5Å; L400-V402 HydrophobicContact CD2-CG2 4.38Å; L400-V402 HydrophobicContact CG-CG2 4.2Å
403	V	87.6	Confident	83.3	Confident	13 Å²	13	39.1 Å²	39.1	8%	0.079	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	142.2	-170.8	-167.5	0	0	0	0	111.1	G392 F421 W453	G392-V403 PolarHBondContact N-O 3.49Å; G392-V403 PolarHBondContact O-N 2.87Å; V403-F421 HydrophobicContact CB-CD1 3.97Å; V403-F421 HydrophobicContact CB-CE1 3.5Å; V403-F421 HydrophobicContact CB-CE2 4.29Å; V403-F421 HydrophobicContact CB-CZ 3.67Å; V403-F421 HydrophobicContact CG1-CD1 4.27Å; V403-F421 HydrophobicContact CG1-CE1 3.36Å; V403-F421 HydrophobicContact CG1-CE2 4.49Å; V403-F421 HydrophobicContact CG1-CZ 3.49Å; V403-F421 VanDerWaalsContact CG1-CZ 3.49Å; V403-F421 HydrophobicContact CG2-CD1 4.35Å; V403-F421 HydrophobicContact CG2-CE1 4.21Å; V403-W453 HydrophobicContact CG1-CZ2 4.24Å
404	G	86.6	Confident	81.9	Confident	22 Å²	22	45.9 Å²	45.9	23%	0.227	25%	0.247	C	C	.	.	S	Bend	trans	66.4	-151.6	179.8	0	0	0	0	0	113.1
405	G	85.5	Confident	80.9	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.26	C	S	.	.			trans	74.3	178.7	-177.9	0	0	0	0	0	113.5	Y389 T415 A416	Y389-G405 WeakPolarHBondContact O-CA 3.44Å; G405-T415 VanDerWaalsContact C-OG1 3.31Å; G405-T415 WeakPolarHBondContact O-CB 3.22Å; G405-T415 PolarHBondContact O-OG1 2.84Å; G405-A416 PolarHBondContact N-O 2.85Å
406	Q	80.4	Confident	79.8	Confident	11 Å²	11	47.2 Å²	47.2	5%	0.051	26%	0.257	C	S	.	.	B	Isolated β-bridge	trans	-118.1	145.9	-173.8	-69	-175.9	79.5	0	0	111.1	R388 Y389 D410 T415 V417	R388-Q406 WeakPolarHBondContact CA-O 3.44Å; Y389-Q406 HydrophobicContact CD1-CB 3.9Å; Y389-Q406 VanDerWaalsContact CD1-O 3.27Å; Y389-Q406 WeakPolarHBondContact CD1-O 3.5Å; Y389-Q406 HydrophobicContact CE1-CB 3.3Å; Y389-Q406 HydrophobicContact CE1-CG 4.36Å; Y389-Q406 PolarHBondContact N-O 3.08Å; Y389-Q406 PolarHBondContact O-N 2.62Å; Y389-Q406 PolarHBondContact OH-NE2 2.8Å; Q406-D410 PolarHBondContact NE2-O 3.37Å; Q406-D410 PolarHBondContact OE1-O 3.05Å; Q406-T415 VanDerWaalsContact CG-OG1 3.28Å; Q406-T415 WeakPolarHBondContact CG-OG1 3.49Å; Q406-V417 HydrophobicContact CG-CG1 3.72Å
407	S	81.6	Confident	79	Confident	36 Å²	36	46.7 Å²	46.7	25%	0.252	26%	0.255	S	S	.	.	S	Bend	trans	-94	-23.9	177.3	-62.8	0	0	0	0	113.7	V364 P387	V364-S407 WeakPolarHBondContact CB-O 3.5Å; V364-S407 WeakPolarHBondContact CG2-O 3.34Å; P387-S407 VanDerWaalsContact O-CA 3.27Å; P387-S407 WeakPolarHBondContact O-CA 3.21Å; P387-S407 WeakPolarHBondContact O-CB 3.39Å; P387-S407 PolarHBondContact O-OG 2.64Å
408	N	78.3	Confident	78.5	Confident	129 Å²	129	45.7 Å²	45.7	69%	0.69	24%	0.242	S	C	*	.	S	Bend	trans	-119.8	142.5	175.6	-64.6	-22.2	0	0	0	108.7	Y389 D410	Y389-N408 WeakPolarHBondContact CE1-O 3.46Å; N408-D410 PolarHBondContact O-N 2.83Å
409	Y	73.6	Confident	77.8	Confident	74 Å²	74	44.3 Å²	44.3	29%	0.29	24%	0.235	S	C	.	.			trans	-65.3	108.2	177.2	-174.4	-95.5	0	0	0	110.7	V357 L362 Y389 T411	V357-Y409 HydrophobicContact CG1-CD2 4.46Å; V357-Y409 HydrophobicContact CG1-CE2 4.48Å; V357-Y409 HydrophobicContact CG2-CD2 3.77Å; V357-Y409 HydrophobicContact CG2-CE2 4.37Å; L362-Y409 HydrophobicContact CD2-CD1 3.58Å; L362-Y409 HydrophobicContact CD2-CE1 3.62Å; L362-Y409 HydrophobicContact CD2-CG 4.17Å; Y389-Y409 HydrophobicContact CE2-CD2 4.46Å; Y409-T411 HydrophobicContact CE1-CG2 4.4Å
410	D	69.3	Low	77.2	Confident	50 Å²	50	44.3 Å²	44.3	27%	0.267	24%	0.236	S	C	.	.			trans	-138	128.6	175.8	-176.4	3	0	0	0	109.9	Y389 Q406 N408 K412	Y389-D410 PolarHBondContact OH-N 3.07Å; Y389-D410 PolarHBondContact OH-O 3.44Å; Q406-D410 PolarHBondContact NE2-O 3.37Å; Q406-D410 PolarHBondContact OE1-O 3.05Å; N408-D410 PolarHBondContact O-N 2.83Å; D410-K412 VanDerWaalsContact C-N 3.26Å; D410-K412 PolarHBondContact O-N 3.39Å; D410-K412 PolarHBondContact OD1-N 2.81Å
411	T	62.8	Low	76.8	Confident	99 Å²	99	44.4 Å²	44.4	61%	0.607	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-15.6	178.9	54.3	0	0	0	0	112.7	Y409 R434	Y409-T411 HydrophobicContact CE1-CG2 4.4Å; T411-R434 PolarHBondContact O-NH2 2.81Å; T411-R434 VanDerWaalsContact O-NH2 3.14Å
412	K	61.7	Low	76.7	Confident	169 Å²	169	46.8 Å²	46.8	74%	0.735	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-4.7	-178.4	-65.1	-173.2	179.1	-177.5	0	114.6	D410	D410-K412 VanDerWaalsContact C-N 3.26Å; D410-K412 PolarHBondContact O-N 3.39Å; D410-K412 PolarHBondContact OD1-N 2.81Å
413	G	61.3	Low	76.5	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.01	25%	0.25	C	C	.	.			trans	53.3	92	166.6	0	0	0	0	0	115.9	N435 A436	G413-N435 CarbonylContact O-C 3.41Å; G413-A436 PolarHBondContact O-N 2.83Å; G413-A436 VanDerWaalsContact O-N 3.11Å
414	K	62.5	Low	76.7	Confident	165 Å²	165	46.7 Å²	46.7	72%	0.717	25%	0.247	S	C	*	.	S	Bend	trans	-77.5	-24	177.2	-66.9	-176.2	-177.4	178.4	0	114.2
415	T	70.6	Confident	76.8	Confident	57 Å²	57	50.8 Å²	50.8	35%	0.35	26%	0.259	S	S	.	.	S	Bend	trans	-114.9	164.8	-178.1	49.7	0	0	0	0	110.5	G405 Q406 V417 R434	G405-T415 VanDerWaalsContact C-OG1 3.31Å; G405-T415 WeakPolarHBondContact O-CB 3.22Å; G405-T415 PolarHBondContact O-OG1 2.84Å; Q406-T415 VanDerWaalsContact CG-OG1 3.28Å; Q406-T415 WeakPolarHBondContact CG-OG1 3.49Å; T415-V417 PolarHBondContact O-N 3.42Å; T415-V417 VanDerWaalsContact O-N 3.16Å; T415-R434 VanDerWaalsContact O-O 3.14Å
416	A	70.3	Confident	77	Confident	29 Å²	29	52.1 Å²	52.1	24%	0.24	27%	0.273	C	S	.	.			trans	-59.5	117	172.8	0	0	0	0	0	110.2	G405 R434 L440	G405-A416 PolarHBondContact N-O 2.85Å; A416-R434 CarbonylContact C-O 3.59Å; A416-R434 VanDerWaalsContact CA-O 3.25Å; A416-R434 WeakPolarHBondContact CA-O 3.28Å; A416-L440 HydrophobicContact CB-CD1 4.45Å
417	V	77.3	Confident	77.7	Confident	1 Å²	1	54 Å²	54	1%	0.006	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-121.1	156.4	174	-61.7	0	0	0	0	110.7	Q390 Q406 T415 T419 G433 R434	Q390-V417 HydrophobicContact CB-CB 3.99Å; Q390-V417 HydrophobicContact CB-CG1 4.11Å; Q406-V417 HydrophobicContact CG-CG1 3.72Å; T415-V417 PolarHBondContact O-N 3.42Å; T415-V417 VanDerWaalsContact O-N 3.16Å; V417-T419 PolarHBondContact O-N 2.86Å; V417-T419 VanDerWaalsContact O-N 3.11Å; V417-G433 CarbonylContact O-C 3.49Å; V417-G433 WeakPolarHBondContact O-CA 3.4Å; V417-R434 HydrophobicContact CG2-CG 3.39Å; V417-R434 PolarHBondContact N-O 3.04Å; V417-R434 PolarHBondContact O-N 3.4Å
418	D	78.7	Confident	78.3	Confident	12 Å²	12	52.4 Å²	52.4	6%	0.064	27%	0.27	C	S	.	.	S	Bend	trans	55.6	25.8	-177.5	-52.7	-36.6	0	0	0	113.8
419	T	78.2	Confident	79.1	Confident	15 Å²	15	46.9 Å²	46.9	9%	0.092	24%	0.239	C	C	.	.			trans	-75.6	134.7	169	-59.4	0	0	0	0	108.8	V417 F421 A430 V431 G432	V417-T419 PolarHBondContact O-N 2.86Å; V417-T419 VanDerWaalsContact O-N 3.11Å; T419-F421 HydrophobicContact CG2-CD2 3.77Å; T419-F421 HydrophobicContact CG2-CE1 4.45Å; T419-F421 HydrophobicContact CG2-CE2 3.34Å; T419-F421 HydrophobicContact CG2-CZ 3.71Å; T419-F421 WeakPolarHBondContact O-CD2 3.31Å; T419-A430 HydrophobicContact CG2-CB 3.9Å; T419-V431 WeakPolarHBondContact CA-O 3.22Å; T419-V431 WeakPolarHBondContact CG2-O 3.48Å; T419-G432 WeakPolarHBondContact CB-O 3.5Å; T419-G432 WeakPolarHBondContact CG2-O 3.45Å; T419-G432 PolarHBondContact OG1-O 3.48Å
420	V	79.4	Confident	80.1	Confident	8 Å²	8	43.8 Å²	43.8	5%	0.048	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	124.9	172.5	167.6	0	0	0	0	109.7	R422 A430 V431 H466 I477	V420-R422 HydrophobicContact CG1-CG 3.83Å; V420-A430 WeakPolarHBondContact O-CA 3.37Å; V420-V431 HydrophobicContact CB-CB 4.34Å; V420-V431 PolarHBondContact N-O 3.37Å; V420-V431 PolarHBondContact O-N 3.3Å; V420-H466 WeakPolarHBondContact CG2-CD2 3.3Å; V420-H466 WeakPolarHBondContact CG2-NE2 3.45Å; V420-H466 WeakPolarHBondContact CG2-O 3.31Å; V420-I477 HydrophobicContact CB-CD1 4.08Å; V420-I477 HydrophobicContact CG1-CD1 3.69Å; V420-I477 HydrophobicContact CG2-CD1 4.46Å
421	F	85	Confident	81.3	Confident	11 Å²	11	41.4 Å²	41.4	5%	0.048	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	122.3	175.6	-75	-92.6	0	0	0	111.6	V403 T419 Y429 A430 W453	V403-F421 HydrophobicContact CB-CD1 3.97Å; V403-F421 HydrophobicContact CB-CE1 3.5Å; V403-F421 HydrophobicContact CB-CE2 4.29Å; V403-F421 HydrophobicContact CB-CZ 3.67Å; V403-F421 HydrophobicContact CG1-CD1 4.27Å; V403-F421 HydrophobicContact CG1-CE1 3.36Å; V403-F421 HydrophobicContact CG1-CE2 4.49Å; V403-F421 HydrophobicContact CG1-CZ 3.49Å; V403-F421 VanDerWaalsContact CG1-CZ 3.49Å; V403-F421 HydrophobicContact CG2-CD1 4.35Å; V403-F421 HydrophobicContact CG2-CE1 4.21Å; T419-F421 HydrophobicContact CG2-CD2 3.77Å; T419-F421 HydrophobicContact CG2-CE1 4.45Å; T419-F421 HydrophobicContact CG2-CE2 3.34Å; T419-F421 HydrophobicContact CG2-CZ 3.71Å; T419-F421 WeakPolarHBondContact O-CD2 3.31Å; F421-Y429 CarbonylContact C-O 3.58Å; F421-Y429 WeakPolarHBondContact CA-O 3.46Å; F421-A430 HydrophobicContact CD1-CB 3.75Å; F421-A430 HydrophobicContact CE1-CB 3.22Å; F421-A430 HydrophobicContact CZ-CB 3.71Å; F421-W453 HydrophobicContact CE1-CH2 4.1Å
422	R	89.1	Confident	82.8	Confident	55 Å²	55	36.8 Å²	36.8	21%	0.208	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	138.9	-179.8	-65.5	-64.5	175	-95.9	6.9	111.8	V420 L428 Y429 G468 V470 M475	V420-R422 HydrophobicContact CG1-CG 3.83Å; R422-L428 WeakPolarHBondContact O-CA 2.95Å; R422-Y429 PolarHBondContact N-O 2.82Å; R422-Y429 PolarHBondContact O-N 2.83Å; R422-G468 VanDerWaalsContact NE-C 3.28Å; R422-G468 PolarHBondContact NE-O 3.02Å; R422-G468 PolarHBondContact NH2-O 3.02Å; R422-V470 HydrophobicContact CB-CG2 3.8Å; R422-V470 HydrophobicContact CG-CG2 4.28Å; R422-M475 HydrophobicContact CB-SD 4.15Å; R422-M475 HydrophobicContact CG-SD 4.39Å
423	A	87.9	Confident	84.1	Confident	32 Å²	32	28.8 Å²	28.8	26%	0.264	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	122.6	168.2	0	0	0	0	0	109.4	A394 V395 I396 H427 L428	A394-A423 HydrophobicContact CB-CB 4.49Å; V395-A423 VanDerWaalsContact O-CB 3.31Å; V395-A423 WeakPolarHBondContact O-CB 3.5Å; I396-A423 HydrophobicContact CD1-CB 4.28Å; I396-A423 HydrophobicContact CG1-CB 3.57Å; A423-H427 CarbonylContact C-O 3.59Å; A423-H427 WeakPolarHBondContact CA-O 3.41Å; A423-L428 HydrophobicContact CB-CD2 4.26Å
424	L	91.4	Very high	85.4	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.021	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	124.1	179.2	172.6	62.6	0	0	0	109.5	G426 H427 Y429 V470 G473 M475 P495	L424-G426 PolarHBondContact O-N 3.03Å; L424-G426 VanDerWaalsContact O-N 3.1Å; L424-H427 PolarHBondContact N-O 3.29Å; L424-H427 PolarHBondContact O-N 2.89Å; L424-Y429 HydrophobicContact CB-CD2 3.85Å; L424-Y429 HydrophobicContact CB-CE2 3.76Å; L424-Y429 HydrophobicContact CD2-CD2 4.44Å; L424-Y429 HydrophobicContact CD2-CE2 4.11Å; L424-Y429 HydrophobicContact CG-CE2 4.16Å; L424-V470 HydrophobicContact CB-CG2 4.18Å; L424-V470 HydrophobicContact CD1-CG1 3.55Å; L424-V470 HydrophobicContact CD1-CG2 4.49Å; L424-G473 WeakPolarHBondContact CD1-O 3.48Å; L424-M475 HydrophobicContact CD2-CB 4.03Å; L424-P495 HydrophobicContact CD2-CB 4.12Å; L424-P495 HydrophobicContact CD2-CG 3.74Å; L424-P495 HydrophobicContact CG-CG 4.31Å
425	K	89	Confident	86.4	Confident	109 Å²	109	26.1 Å²	26.1	47%	0.474	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	30.2	179.9	-59.2	-172.5	-176.4	-176.2	0	115	H427 P495 D496	K425-H427 PolarHBondContact O-ND1 3Å; K425-P495 HydrophobicContact CD-CG 4.13Å; K425-D496 IonicContact NZ-OD1 2.81Å; K425-D496 PolarHBondContact NZ-OD1 3.19Å; K425-D496 IonicContact NZ-OD2 3.5Å; K425-D496 PolarHBondContact NZ-OD2 3.06Å
426	G	89.8	Confident	87.1	Confident	28 Å²	28	27.3 Å²	27.3	29%	0.289	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	6.7	-179.5	0	0	0	0	0	114.6	V336 L424 P448	V336-G426 WeakPolarHBondContact CG1-O 3.16Å; L424-G426 PolarHBondContact O-N 3.03Å; L424-G426 VanDerWaalsContact O-N 3.1Å; G426-P448 VanDerWaalsContact O-CD 3.26Å; G426-P448 WeakPolarHBondContact O-CD 3.44Å; G426-P448 WeakPolarHBondContact O-CG 3.27Å
427	H	93.6	Very high	87.7	Confident	50 Å²	50	30.5 Å²	30.5	23%	0.231	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	160	174	-60.3	81.1	0	0	0	110.6	A423 L424 K425 Y429 Y446	A423-H427 CarbonylContact C-O 3.59Å; A423-H427 WeakPolarHBondContact CA-O 3.41Å; L424-H427 PolarHBondContact N-O 3.29Å; L424-H427 PolarHBondContact O-N 2.89Å; K425-H427 PolarHBondContact O-ND1 3Å; H427-Y429 HydrophobicContact CB-CD2 4.49Å; H427-Y429 HydrophobicContact CB-CE2 3.8Å; H427-Y446 WeakPolarHBondContact CA-O 3.45Å; H427-Y446 WeakPolarHBondContact CB-O 3.26Å
428	L	94.5	Very high	88.2	Confident	2 Å²	2	32 Å²	32	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	135	169.5	-56.6	169.6	0	0	0	109.6	A394 I396 Y401 R422 A423 C445 Y446 W453	A394-L428 HydrophobicContact CB-CD2 3.43Å; A394-L428 VanDerWaalsContact CB-CD2 3.43Å; I396-L428 HydrophobicContact CD1-CD1 4.47Å; I396-L428 HydrophobicContact CD1-CD2 3.35Å; I396-L428 HydrophobicContact CD1-CG 3.59Å; I396-L428 HydrophobicContact CG1-CD2 3.78Å; Y401-L428 HydrophobicContact CD1-CD1 3.41Å; Y401-L428 VanDerWaalsContact CD1-CD1 3.41Å; Y401-L428 HydrophobicContact CD2-CD1 4.01Å; Y401-L428 HydrophobicContact CD2-CD2 4.33Å; Y401-L428 HydrophobicContact CE1-CD1 3.71Å; Y401-L428 HydrophobicContact CE2-CD1 4.28Å; Y401-L428 HydrophobicContact CG-CD1 3.53Å; Y401-L428 HydrophobicContact CG-CD2 4.45Å; R422-L428 WeakPolarHBondContact O-CA 2.95Å; A423-L428 HydrophobicContact CB-CD2 4.26Å; L428-C445 CarbonylContact O-C 3.57Å; L428-C445 VanDerWaalsContact O-CA 3.3Å; L428-C445 WeakPolarHBondContact O-CA 3.34Å; L428-Y446 HydrophobicContact CD1-CD1 3.81Å; L428-Y446 HydrophobicContact CG-CD1 4.24Å; L428-Y446 PolarHBondContact N-O 2.78Å; L428-Y446 VanDerWaalsContact N-O 3.09Å; L428-Y446 PolarHBondContact O-N 3.09Å; L428-W453 HydrophobicContact CB-CH2 4.37Å
429	Y	95.3	Very high	88.7	Confident	14 Å²	14	34 Å²	34	6%	0.055	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.1	173.9	-68.3	-96.7	0	0	0	109.5	F421 R422 L424 H427 V443 E444 C445 V456 M475 F493 P495	F421-Y429 CarbonylContact C-O 3.58Å; F421-Y429 WeakPolarHBondContact CA-O 3.46Å; R422-Y429 PolarHBondContact N-O 2.82Å; R422-Y429 PolarHBondContact O-N 2.83Å; L424-Y429 HydrophobicContact CB-CD2 3.85Å; L424-Y429 HydrophobicContact CB-CE2 3.76Å; L424-Y429 HydrophobicContact CD2-CD2 4.44Å; L424-Y429 HydrophobicContact CD2-CE2 4.11Å; L424-Y429 HydrophobicContact CG-CE2 4.16Å; H427-Y429 HydrophobicContact CB-CD2 4.49Å; H427-Y429 HydrophobicContact CB-CE2 3.8Å; Y429-V443 HydrophobicContact CD1-CG1 4.38Å; Y429-E444 CarbonylContact C-O 3.52Å; Y429-E444 VanDerWaalsContact CA-O 3.28Å; Y429-E444 WeakPolarHBondContact CA-O 3.47Å; Y429-C445 HydrophobicContact CD1-CB 4Å; Y429-C445 HydrophobicContact CE1-CB 3.73Å; Y429-C445 VanDerWaalsContact CZ-SG 3.58Å; Y429-V456 HydrophobicContact CD1-CG2 4.41Å; Y429-V456 HydrophobicContact CE1-CG2 4.38Å; Y429-M475 HydrophobicContact CD1-CE 4.33Å; Y429-M475 HydrophobicContact CG-CE 4.24Å; Y429-F493 HydrophobicContact CD1-CE1 4.1Å; Y429-F493 HydrophobicContact CE1-CD1 4.48Å; Y429-F493 AromaticContact CE1-CE1 3.64Å; Y429-F493 HydrophobicContact CE1-CE1 3.64Å; Y429-F493 HydrophobicContact CE1-CZ 4.41Å; Y429-P495 WeakPolarHBondContact OH-CB 3.47Å
430	A	94.5	Very high	89.4	Confident	8 Å²	8	34.8 Å²	34.8	7%	0.066	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117.3	170.9	0	0	0	0	0	108.1	T419 V420 F421 V443 E444 W453	T419-A430 HydrophobicContact CG2-CB 3.9Å; V420-A430 WeakPolarHBondContact O-CA 3.37Å; F421-A430 HydrophobicContact CD1-CB 3.75Å; F421-A430 HydrophobicContact CE1-CB 3.22Å; F421-A430 HydrophobicContact CZ-CB 3.71Å; A430-V443 CarbonylContact O-C 3.57Å; A430-V443 VanDerWaalsContact O-CA 3.3Å; A430-V443 WeakPolarHBondContact O-CA 3.45Å; A430-E444 HydrophobicContact CB-CB 4.22Å; A430-E444 PolarHBondContact N-O 3.22Å; A430-E444 PolarHBondContact O-N 3.03Å; A430-W453 HydrophobicContact CB-CH2 4.26Å; A430-W453 HydrophobicContact CB-CZ3 3.99Å
431	V	94.9	Very high	90.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	119.9	-173.9	-176.4	0	0	0	0	110	T419 V420 V443 M459 H466 M475 I477 W500	T419-V431 WeakPolarHBondContact CA-O 3.22Å; T419-V431 WeakPolarHBondContact CG2-O 3.48Å; V420-V431 HydrophobicContact CB-CB 4.34Å; V420-V431 PolarHBondContact N-O 3.37Å; V420-V431 PolarHBondContact O-N 3.3Å; V431-V443 HydrophobicContact CG1-CG2 4.21Å; V431-V443 HydrophobicContact CG2-CG1 3.99Å; V431-M459 HydrophobicContact CG1-CE 3.81Å; V431-M459 HydrophobicContact CG1-CG 4.35Å; V431-M459 HydrophobicContact CG1-SD 3.59Å; V431-M459 VanDerWaalsContact CG1-SD 3.59Å; V431-H466 PolarHBondContact O-CE1 3.45Å; V431-H466 PolarHBondContact O-NE2 3.24Å; V431-M475 HydrophobicContact CG2-CE 3.45Å; V431-M475 VanDerWaalsContact CG2-CE 3.45Å; V431-M475 HydrophobicContact CG2-SD 3.67Å; V431-I477 HydrophobicContact CB-CD1 4.36Å; V431-I477 HydrophobicContact CG1-CD1 4.25Å; V431-I477 HydrophobicContact CG1-CG1 4.15Å; V431-I477 HydrophobicContact CG2-CD1 4.31Å; V431-W500 HydrophobicContact CG1-CH2 4.17Å; V431-W500 HydrophobicContact CG1-CZ2 4.33Å; V431-W500 HydrophobicContact CG2-CH2 4.48Å
432	G	93.3	Very high	90.5	Very high	3 Å²	3	37.2 Å²	37.2	3%	0.031	23%	0.23	C	C	.	.			trans	54.5	-139.3	172.7	0	0	0	0	0	114.6	T419 L440 T442	T419-G432 WeakPolarHBondContact CB-O 3.5Å; T419-G432 WeakPolarHBondContact CG2-O 3.45Å; T419-G432 PolarHBondContact OG1-O 3.48Å; G432-L440 VanDerWaalsContact CA-O 3.25Å; G432-L440 WeakPolarHBondContact CA-O 3.45Å; G432-T442 PolarHBondContact N-O 3.12Å
433	G	90.6	Very high	90.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	22%	0.22	C	C	.	.			trans	98	-160.6	-173.3	0	0	0	0	0	111.5	V417 L440 H463	V417-G433 CarbonylContact O-C 3.49Å; V417-G433 WeakPolarHBondContact O-CA 3.4Å; G433-L440 WeakPolarHBondContact O-CB 3.23Å; G433-L440 PolarHBondContact O-N 3.2Å; G433-H463 PolarHBondContact N-O 2.83Å
434	R	86.9	Confident	91.2	Very high	74 Å²	74	34.3 Å²	34.3	28%	0.279	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	144.3	-179.7	55.9	178.1	-86.9	-177.5	-6.2	111	T411 T415 A416 V417 G438 Y464	T411-R434 PolarHBondContact O-NH2 2.81Å; T411-R434 VanDerWaalsContact O-NH2 3.14Å; T415-R434 VanDerWaalsContact O-O 3.14Å; A416-R434 CarbonylContact C-O 3.59Å; A416-R434 VanDerWaalsContact CA-O 3.25Å; A416-R434 WeakPolarHBondContact CA-O 3.28Å; V417-R434 HydrophobicContact CG2-CG 3.39Å; V417-R434 PolarHBondContact N-O 3.04Å; V417-R434 PolarHBondContact O-N 3.4Å; R434-G438 CarbonylContact C-O 3.58Å; R434-G438 VanDerWaalsContact CA-O 3.3Å; R434-G438 WeakPolarHBondContact CA-O 3.2Å; R434-Y464 HydrophobicContact CB-CG 4.47Å; R434-Y464 HydrophobicContact CG-CG 4.4Å
435	N	85.2	Confident	91.4	Very high	37 Å²	37	34.5 Å²	34.5	20%	0.198	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	-168.7	172.9	68.4	13.9	0	0	0	110.1	G413 A437 G438 L440	G413-N435 CarbonylContact O-C 3.41Å; N435-A437 PolarHBondContact O-N 3.39Å; N435-A437 VanDerWaalsContact O-N 3.15Å; N435-A437 WeakPolarHBondContact OD1-CA 3.19Å; N435-A437 WeakPolarHBondContact OD1-CB 3.36Å; N435-A437 PolarHBondContact OD1-N 2.83Å; N435-G438 PolarHBondContact N-O 3.46Å; N435-G438 PolarHBondContact O-N 2.85Å; N435-G438 PolarHBondContact OD1-N 3.2Å; N435-G438 PolarHBondContact OD1-O 2.88Å; N435-L440 HydrophobicContact CB-CD1 4.42Å
436	A	83.4	Confident	91.7	Very high	81 Å²	81	29.4 Å²	29.4	67%	0.669	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-21.1	179.9	0	0	0	0	0	114.2	G413	G413-A436 PolarHBondContact O-N 2.83Å; G413-A436 VanDerWaalsContact O-N 3.11Å
437	A	84.8	Confident	91.9	Very high	96 Å²	96	29.9 Å²	29.9	79%	0.793	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-13	177.1	0	0	0	0	0	113	N435	N435-A437 PolarHBondContact O-N 3.39Å; N435-A437 VanDerWaalsContact O-N 3.15Å; N435-A437 WeakPolarHBondContact OD1-CA 3.19Å; N435-A437 WeakPolarHBondContact OD1-CB 3.36Å; N435-A437 PolarHBondContact OD1-N 2.83Å
438	G	86.8	Confident	91.8	Very high	32 Å²	32	27.5 Å²	27.5	33%	0.33	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	125.5	-156.9	178.2	0	0	0	0	0	113.4	R434 N435	R434-G438 CarbonylContact C-O 3.58Å; R434-G438 VanDerWaalsContact CA-O 3.3Å; R434-G438 WeakPolarHBondContact CA-O 3.2Å; N435-G438 PolarHBondContact N-O 3.46Å; N435-G438 PolarHBondContact O-N 2.85Å; N435-G438 PolarHBondContact OD1-N 3.2Å; N435-G438 PolarHBondContact OD1-O 2.88Å
439	E	89.9	Confident	91.7	Very high	55 Å²	55	33.9 Å²	33.9	26%	0.257	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	141.9	179.3	-52.7	175.5	179.4	0	0	110.9	P462 Y464 H483	E439-P462 HydrophobicContact CB-CB 3.64Å; E439-P462 HydrophobicContact CB-CG 4.12Å; E439-Y464 HydrophobicContact CG-CD1 3.8Å; E439-Y464 HydrophobicContact CG-CE1 4.07Å; E439-Y464 WeakPolarHBondContact OE1-CE1 3.49Å; E439-H483 PolarHBondContact OE1-N 3.16Å; E439-H483 PolarHBondContact OE2-N 3.07Å; E439-H483 VanDerWaalsContact OE2-N 3.08Å
440	L	91.8	Very high	91.5	Very high	31 Å²	31	36.5 Å²	36.5	16%	0.162	22%	0.219	C	C	.	.			trans	-110.8	134.8	-173.9	-59.3	174.7	0	0	0	111.4	A416 G432 G433 N435 P462 H463	A416-L440 HydrophobicContact CB-CD1 4.45Å; G432-L440 VanDerWaalsContact CA-O 3.25Å; G432-L440 WeakPolarHBondContact CA-O 3.45Å; G433-L440 WeakPolarHBondContact O-CB 3.23Å; G433-L440 PolarHBondContact O-N 3.2Å; N435-L440 HydrophobicContact CB-CD1 4.42Å; L440-P462 WeakPolarHBondContact O-CA 3.48Å; L440-H463 PolarHBondContact O-N 3.36Å; L440-H463 VanDerWaalsContact O-N 3.17Å
441	A	93.9	Very high	91.4	Very high	22 Å²	22	39.5 Å²	39.5	18%	0.182	23%	0.234	C	C	.	.			trans	-101.8	-7.1	168.7	0	0	0	0	0	112.5	K458 M459 P462	A441-K458 WeakPolarHBondContact O-CA 3.21Å; A441-K458 WeakPolarHBondContact O-CB 3.37Å; A441-M459 HydrophobicContact CB-CB 4.48Å; A441-M459 PolarHBondContact O-N 3.02Å; A441-P462 HydrophobicContact CB-CB 4.2Å
442	T	94.7	Very high	91.3	Very high	49 Å²	49	45 Å²	45	30%	0.301	26%	0.26	S	S	.	.			trans	-67.3	149.6	-175.3	47.4	0	0	0	0	111.7	G432 Y455	G432-T442 PolarHBondContact N-O 3.12Å; T442-Y455 HydrophobicContact CG2-CE1 4.21Å
443	V	95.6	Very high	91.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	124.8	172.6	-173.2	0	0	0	0	107.6	Y429 A430 V431 V456 A457 M459 W500	Y429-V443 HydrophobicContact CD1-CG1 4.38Å; A430-V443 CarbonylContact O-C 3.57Å; A430-V443 VanDerWaalsContact O-CA 3.3Å; A430-V443 WeakPolarHBondContact O-CA 3.45Å; V431-V443 HydrophobicContact CG1-CG2 4.21Å; V431-V443 HydrophobicContact CG2-CG1 3.99Å; V443-V456 HydrophobicContact CB-CG2 3.64Å; V443-V456 HydrophobicContact CG1-CG2 3.37Å; V443-V456 PolarHBondContact O-N 3.02Å; V443-A457 WeakPolarHBondContact CG2-O 3.45Å; V443-M459 HydrophobicContact CG2-CG 4.36Å; V443-W500 HydrophobicContact CG2-CZ2 3.85Å
444	E	94.7	Very high	91.6	Very high	26 Å²	26	50.8 Å²	50.8	12%	0.121	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	138.3	179.7	-61.9	171.6	-136.9	0	0	109.3	H21 Y429 A430 W453 T454 Y455	H21-E444 IonicContact CD2-OE2 2.85Å; H21-E444 IonicContact NE2-OE2 3.76Å; H21-E444 PolarHBondContact NE2-OE2 2.77Å; Y429-E444 CarbonylContact C-O 3.52Å; Y429-E444 VanDerWaalsContact CA-O 3.28Å; Y429-E444 WeakPolarHBondContact CA-O 3.47Å; A430-E444 HydrophobicContact CB-CB 4.22Å; A430-E444 PolarHBondContact N-O 3.22Å; A430-E444 PolarHBondContact O-N 3.03Å; E444-W453 HydrophobicContact CB-CE3 3.61Å; E444-W453 HydrophobicContact CB-CZ3 3.95Å; E444-T454 CarbonylContact C-O 3.59Å; E444-T454 WeakPolarHBondContact CA-O 3.42Å; E444-Y455 HydrophobicContact CG-CD1 3.75Å; E444-Y455 HydrophobicContact CG-CE1 3.47Å; E444-Y455 VanDerWaalsContact CG-CE1 3.47Å
445	C	95.9	Very high	92.1	Very high	8 Å²	8	53.9 Å²	53.9	5%	0.054	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	119.9	177.2	179.1	0	0	0	0	109.6	L428 Y429 W453 T454 V456	L428-C445 CarbonylContact O-C 3.57Å; L428-C445 VanDerWaalsContact O-CA 3.3Å; L428-C445 WeakPolarHBondContact O-CA 3.34Å; Y429-C445 HydrophobicContact CD1-CB 4Å; Y429-C445 HydrophobicContact CE1-CB 3.73Å; Y429-C445 VanDerWaalsContact CZ-SG 3.58Å; C445-W453 CarbonylContact O-C 3.59Å; C445-W453 WeakPolarHBondContact O-CA 3.46Å; C445-T454 PolarHBondContact N-O 2.88Å; C445-T454 PolarHBondContact O-N 2.96Å; C445-T454 PolarHBondContact O-OG1 2.91Å; C445-V456 HydrophobicContact CB-CG1 3.64Å
446	Y	95.4	Very high	92.6	Very high	1 Å²	1	53.6 Å²	53.6	0%	0.004	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	129.2	172.2	179.2	-113.3	0	0	0	110.4	F23 Y401 H427 L428 P448 N451 E452 W453	F23-Y446 HydrophobicContact CE1-CD2 4.28Å; F23-Y446 HydrophobicContact CE1-CE1 4.36Å; F23-Y446 AromaticContact CE1-CE2 3.91Å; F23-Y446 HydrophobicContact CE1-CE2 3.91Å; F23-Y446 AromaticContact CE1-CZ 3.94Å; F23-Y446 HydrophobicContact CE2-CE2 4.2Å; F23-Y446 AromaticContact CZ-CD2 3.8Å; F23-Y446 HydrophobicContact CZ-CD2 3.8Å; F23-Y446 AromaticContact CZ-CE2 3.36Å; F23-Y446 HydrophobicContact CZ-CE2 3.36Å; F23-Y446 AromaticContact CZ-CZ 3.81Å; Y401-Y446 HydrophobicContact CE1-CE1 4.15Å; H427-Y446 WeakPolarHBondContact CA-O 3.45Å; H427-Y446 WeakPolarHBondContact CB-O 3.26Å; L428-Y446 HydrophobicContact CD1-CD1 3.81Å; L428-Y446 HydrophobicContact CG-CD1 4.24Å; L428-Y446 PolarHBondContact N-O 2.78Å; L428-Y446 VanDerWaalsContact N-O 3.09Å; L428-Y446 PolarHBondContact O-N 3.09Å; Y446-P448 HydrophobicContact CD1-CG 3.94Å; Y446-P448 HydrophobicContact CE1-CB 4.08Å; Y446-P448 HydrophobicContact CE1-CG 3.82Å; Y446-P448 WeakPolarHBondContact O-CD 3.48Å; Y446-N451 WeakPolarHBondContact CE2-OD1 3.43Å; Y446-N451 PolarHBondContact OH-OD1 2.86Å; Y446-E452 WeakPolarHBondContact CA-O 3.45Å; Y446-E452 WeakPolarHBondContact CD2-O 3.31Å; Y446-W453 AromaticContact CD2-CD1 3.83Å; Y446-W453 HydrophobicContact CD2-CD2 4.13Å; Y446-W453 AromaticContact CD2-CE2 3.87Å; Y446-W453 HydrophobicContact CD2-CG 4.13Å; Y446-W453 HydrophobicContact CD2-CZ2 4.44Å; Y446-W453 AromaticContact CD2-NE1 3.67Å; Y446-W453 HydrophobicContact CG-CD2 4.3Å; Y446-W453 HydrophobicContact CG-CZ2 4.16Å
447	N	93.4	Very high	93.2	Very high	39 Å²	39	51 Å²	51	21%	0.209	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	107.7	172.5	-174.3	-12.1	0	0	0	110.5	R449 T450 N451 E452	N447-R449 PolarHBondContact O-N 2.64Å; N447-R449 VanDerWaalsContact OD1-CB 3.28Å; N447-R449 WeakPolarHBondContact OD1-CB 3.22Å; N447-R449 PolarHBondContact OD1-N 3.41Å; N447-T450 PolarHBondContact O-N 3.29Å; N447-N451 WeakPolarHBondContact O-CA 3.32Å; N447-N451 PolarHBondContact O-N 2.83Å; N447-E452 PolarHBondContact N-O 2.81Å
448	P	92.4	Very high	93.8	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-15.5	176.8	-22.7	33.5	0	0	0	114	F332 M333 V336 I396 G426 Y446	F332-P448 CarbonylContact C-O 3.55Å; F332-P448 VanDerWaalsContact CD2-O 3.31Å; F332-P448 WeakPolarHBondContact CD2-O 3.34Å; F332-P448 WeakPolarHBondContact O-CB 3.28Å; F332-P448 VanDerWaalsContact O-O 3.13Å; M333-P448 WeakPolarHBondContact CG-O 3.5Å; V336-P448 HydrophobicContact CG1-CB 4.02Å; V336-P448 HydrophobicContact CG1-CG 3.98Å; V336-P448 HydrophobicContact CG2-CB 4.16Å; I396-P448 HydrophobicContact CD1-CG 4.32Å; G426-P448 VanDerWaalsContact O-CD 3.26Å; G426-P448 WeakPolarHBondContact O-CD 3.44Å; G426-P448 WeakPolarHBondContact O-CG 3.27Å; Y446-P448 HydrophobicContact CD1-CG 3.94Å; Y446-P448 HydrophobicContact CE1-CB 4.08Å; Y446-P448 HydrophobicContact CE1-CG 3.82Å; Y446-P448 WeakPolarHBondContact O-CD 3.48Å
449	R	91.6	Very high	94.1	Very high	135 Å²	135	52.2 Å²	52.2	51%	0.509	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-35.7	177.1	-58.5	-170.5	-179.2	-76	-6.1	113.1	M333 V336 N447	M333-R449 HydrophobicContact CE-CB 4.29Å; M333-R449 HydrophobicContact CE-CG 4.19Å; V336-R449 HydrophobicContact CG2-CG 4.02Å; N447-R449 PolarHBondContact O-N 2.64Å; N447-R449 VanDerWaalsContact OD1-CB 3.28Å; N447-R449 WeakPolarHBondContact OD1-CB 3.22Å; N447-R449 PolarHBondContact OD1-N 3.41Å
450	T	91.8	Very high	94.1	Very high	70 Å²	70	56.2 Å²	56.2	43%	0.429	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-12.1	-180	61.1	0	0	0	0	112.4	N447 E452	N447-T450 PolarHBondContact O-N 3.29Å; T450-E452 VanDerWaalsContact C-N 3.3Å
451	N	92.4	Very high	94	Very high	70 Å²	70	59.2 Å²	59.2	37%	0.374	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.4	40.5	-173.6	-170.1	39.1	0	0	0	112.8	F332 Y446 N447	F332-N451 HydrophobicContact CB-CB 4.15Å; F332-N451 HydrophobicContact CD2-CB 3.83Å; F332-N451 HydrophobicContact CE2-CB 4.43Å; F332-N451 HydrophobicContact CG-CB 3.96Å; Y446-N451 WeakPolarHBondContact CE2-OD1 3.43Å; Y446-N451 PolarHBondContact OH-OD1 2.86Å; N447-N451 WeakPolarHBondContact O-CA 3.32Å; N447-N451 PolarHBondContact O-N 2.83Å
452	E	93.6	Very high	93.9	Very high	117 Å²	117	59.2 Å²	59.2	55%	0.547	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	145.3	-175.5	-69.7	171.2	160.5	0	0	111.3	Y446 N447 T450	Y446-E452 WeakPolarHBondContact CA-O 3.45Å; Y446-E452 WeakPolarHBondContact CD2-O 3.31Å; N447-E452 PolarHBondContact N-O 2.81Å; T450-E452 VanDerWaalsContact C-N 3.3Å
453	W	93.7	Very high	93.6	Very high	51 Å²	51	58 Å²	58	19%	0.193	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	138.7	167.6	-73.6	95.2	0	0	0	109.8	H21 F23 V403 F421 L428 A430 E444 C445 Y446	H21-W453 AromaticContact CD2-CD1 3.7Å; H21-W453 AromaticContact CD2-CE2 3.98Å; H21-W453 AromaticContact CD2-NE1 3.63Å; F23-W453 AromaticContact CE1-NE1 3.86Å; F23-W453 AromaticContact CZ-CD1 3.95Å; F23-W453 AromaticContact CZ-NE1 3.24Å; V403-W453 HydrophobicContact CG1-CZ2 4.24Å; F421-W453 HydrophobicContact CE1-CH2 4.1Å; L428-W453 HydrophobicContact CB-CH2 4.37Å; A430-W453 HydrophobicContact CB-CH2 4.26Å; A430-W453 HydrophobicContact CB-CZ3 3.99Å; E444-W453 HydrophobicContact CB-CE3 3.61Å; E444-W453 HydrophobicContact CB-CZ3 3.95Å; C445-W453 CarbonylContact O-C 3.59Å; C445-W453 WeakPolarHBondContact O-CA 3.46Å; Y446-W453 AromaticContact CD2-CD1 3.83Å; Y446-W453 HydrophobicContact CD2-CD2 4.13Å; Y446-W453 AromaticContact CD2-CE2 3.87Å; Y446-W453 HydrophobicContact CD2-CG 4.13Å; Y446-W453 HydrophobicContact CD2-CZ2 4.44Å; Y446-W453 AromaticContact CD2-NE1 3.67Å; Y446-W453 HydrophobicContact CG-CD2 4.3Å; Y446-W453 HydrophobicContact CG-CZ2 4.16Å
454	T	95.6	Very high	93.4	Very high	72 Å²	72	59.3 Å²	59.3	44%	0.442	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	147.7	177.7	54.5	0	0	0	0	110.1	E444 C445	E444-T454 CarbonylContact C-O 3.59Å; E444-T454 WeakPolarHBondContact CA-O 3.42Å; C445-T454 PolarHBondContact N-O 2.88Å; C445-T454 PolarHBondContact O-N 2.96Å; C445-T454 PolarHBondContact O-OG1 2.91Å
455	Y	96.4	Very high	93.2	Very high	140 Å²	140	58.3 Å²	58.3	55%	0.549	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	137.2	172.1	-70	-71.9	0	0	0	110.3	T442 E444	T442-Y455 HydrophobicContact CG2-CE1 4.21Å; E444-Y455 HydrophobicContact CG-CD1 3.75Å; E444-Y455 HydrophobicContact CG-CE1 3.47Å; E444-Y455 VanDerWaalsContact CG-CE1 3.47Å
456	V	96.9	Very high	93.1	Very high	31 Å²	31	58.3 Å²	58.3	19%	0.188	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	-176.2	172.5	-58.6	0	0	0	0	109.4	Y429 V443 C445 K458 F493 D498	Y429-V456 HydrophobicContact CD1-CG2 4.41Å; Y429-V456 HydrophobicContact CE1-CG2 4.38Å; V443-V456 HydrophobicContact CB-CG2 3.64Å; V443-V456 HydrophobicContact CG1-CG2 3.37Å; V443-V456 PolarHBondContact O-N 3.02Å; C445-V456 HydrophobicContact CB-CG1 3.64Å; V456-K458 PolarHBondContact O-N 3.17Å; V456-K458 VanDerWaalsContact O-N 3.12Å; V456-F493 HydrophobicContact CB-CZ 4.25Å; V456-F493 HydrophobicContact CG2-CZ 3.95Å; V456-D498 WeakPolarHBondContact CB-OD1 3.44Å
457	A	96.8	Very high	93.1	Very high	27 Å²	27	58.5 Å²	58.5	22%	0.223	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-53.9	123.6	-178.8	0	0	0	0	0	111.6	V443 F493 D498 W500	V443-A457 WeakPolarHBondContact CG2-O 3.45Å; A457-F493 HydrophobicContact CB-CE2 4.21Å; A457-D498 WeakPolarHBondContact CB-O 3.36Å; A457-D498 VanDerWaalsContact CB-OD1 3.26Å; A457-D498 WeakPolarHBondContact CB-OD1 3.38Å; A457-D498 PolarHBondContact N-OD1 3.07Å; A457-D498 PolarHBondContact N-OD2 2.71Å; A457-W500 PolarHBondContact O-NE1 2.9Å
458	K	96.1	Very high	93.1	Very high	145 Å²	145	56.6 Å²	56.6	63%	0.63	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-71.7	160.2	178	63.5	172.6	-176.8	173.6	0	111.9	A441 V456	A441-K458 WeakPolarHBondContact O-CA 3.21Å; A441-K458 WeakPolarHBondContact O-CB 3.37Å; V456-K458 PolarHBondContact O-N 3.17Å; V456-K458 VanDerWaalsContact O-N 3.12Å
459	M	93.8	Very high	93.3	Very high	7 Å²	7	57.2 Å²	57.2	3%	0.034	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-69	157.2	165.5	-63	-175.5	-66.9	0	0	110.5	V431 A441 V443 E461 H463 W500	V431-M459 HydrophobicContact CG1-CE 3.81Å; V431-M459 HydrophobicContact CG1-CG 4.35Å; V431-M459 HydrophobicContact CG1-SD 3.59Å; V431-M459 VanDerWaalsContact CG1-SD 3.59Å; A441-M459 HydrophobicContact CB-CB 4.48Å; A441-M459 PolarHBondContact O-N 3.02Å; V443-M459 HydrophobicContact CG2-CG 4.36Å; M459-E461 WeakPolarHBondContact CB-O 3.41Å; M459-H463 HydrophobicContact CE-CB 4.03Å; M459-W500 HydrophobicContact CG-CZ2 4.18Å
460	N	89.8	Confident	93.6	Very high	140 Å²	140	52.6 Å²	52.6	75%	0.749	27%	0.266	S	S	*	.	S	Bend	trans	-66.8	-41.1	177.9	-70.9	-18.8	0	0	0	111.8
461	E	89.7	Confident	93.8	Very high	93 Å²	93	53 Å²	53	44%	0.435	26%	0.26	S	S	.	.	S	Bend	trans	-122.5	152.6	178.3	-67.6	-63.2	149.8	0	0	109.9	M459 H463 T482 H483	M459-E461 WeakPolarHBondContact CB-O 3.41Å; E461-H463 PolarHBondContact O-CE1 3.11Å; E461-H463 PolarHBondContact O-ND1 2.87Å; E461-T482 HydrophobicContact CB-CG2 3.91Å; E461-H483 IonicContact OE2-CD2 3.37Å; E461-H483 IonicContact OE2-NE2 3.86Å; E461-H483 PolarHBondContact OE2-NE2 3.16Å; E461-H483 VanDerWaalsContact OE2-NE2 3.12Å
462	P	90.6	Very high	94	Very high	23 Å²	23	52.4 Å²	52.4	15%	0.149	27%	0.271	C	S	.	.			trans	-70.4	142.9	173.3	32.4	-35.3	0	0	0	110.7	E439 L440 A441 T482	E439-P462 HydrophobicContact CB-CB 3.64Å; E439-P462 HydrophobicContact CB-CG 4.12Å; L440-P462 WeakPolarHBondContact O-CA 3.48Å; A441-P462 HydrophobicContact CB-CB 4.2Å; P462-T482 WeakPolarHBondContact O-CB 3.36Å; P462-T482 VanDerWaalsContact O-CG2 3.31Å; P462-T482 WeakPolarHBondContact O-CG2 3.36Å; P462-T482 PolarHBondContact O-OG1 2.87Å
463	H	89.1	Confident	94	Very high	23 Å²	23	48 Å²	48	11%	0.106	26%	0.256	C	S	.	.			trans	-140.8	139.8	-178.3	-67.2	76.1	0	0	0	110.4	G433 L440 M459 E461 H466 I481 T482	G433-H463 PolarHBondContact N-O 2.83Å; L440-H463 PolarHBondContact O-N 3.36Å; L440-H463 VanDerWaalsContact O-N 3.17Å; M459-H463 HydrophobicContact CE-CB 4.03Å; E461-H463 PolarHBondContact O-CE1 3.11Å; E461-H463 PolarHBondContact O-ND1 2.87Å; H463-H466 PolarHBondContact O-CE1 3.12Å; H463-H466 PolarHBondContact O-ND1 2.96Å; H463-I481 WeakPolarHBondContact CA-O 3.37Å; H463-T482 PolarHBondContact CD2-OG1 3Å; H463-T482 PolarHBondContact NE2-OG1 2.93Å
464	Y	91.2	Very high	94.2	Very high	28 Å²	28	49.8 Å²	49.8	11%	0.11	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-132.4	160.4	166	73.3	-82.2	0	0	0	110.6	R434 E439 H466 G480 I481	R434-Y464 HydrophobicContact CB-CG 4.47Å; R434-Y464 HydrophobicContact CG-CG 4.4Å; E439-Y464 HydrophobicContact CG-CD1 3.8Å; E439-Y464 HydrophobicContact CG-CE1 4.07Å; E439-Y464 WeakPolarHBondContact OE1-CE1 3.49Å; Y464-H466 PolarHBondContact O-N 3.2Å; Y464-H466 VanDerWaalsContact O-N 3.09Å; Y464-G480 WeakPolarHBondContact O-CA 3.22Å; Y464-I481 HydrophobicContact CD1-CB 4.16Å; Y464-I481 WeakPolarHBondContact CD1-O 3.1Å; Y464-I481 HydrophobicContact CD2-CD1 4.5Å; Y464-I481 HydrophobicContact CE1-CB 3.66Å; Y464-I481 HydrophobicContact CE1-CG2 3.61Å; Y464-I481 HydrophobicContact CE2-CB 4.14Å; Y464-I481 HydrophobicContact CE2-CD1 3.7Å; Y464-I481 HydrophobicContact CE2-CG1 4.49Å; Y464-I481 PolarHBondContact N-O 3.23Å; Y464-I481 PolarHBondContact O-N 2.79Å; Y464-I481 WeakPolarHBondContact OH-CG2 3.32Å
465	G	89.9	Confident	94.3	Very high	4 Å²	4	46.4 Å²	46.4	4%	0.041	24%	0.243	C	C	.	.	S	Bend	trans	62.7	17.2	-177.4	0	0	0	0	0	113.9	G511 L512	G465-G511 CarbonylContact O-C 3.36Å; G465-L512 PolarHBondContact O-N 2.78Å
466	H	94.5	Very high	94.4	Very high	9 Å²	9	40.3 Å²	40.3	4%	0.042	22%	0.219	C	C	.	.			trans	-78	164.2	171.2	57.2	-84.7	0	0	0	109.6	V420 V431 H463 Y464 I477 G479	V420-H466 WeakPolarHBondContact CG2-CD2 3.3Å; V420-H466 WeakPolarHBondContact CG2-NE2 3.45Å; V420-H466 WeakPolarHBondContact CG2-O 3.31Å; V431-H466 PolarHBondContact O-CE1 3.45Å; V431-H466 PolarHBondContact O-NE2 3.24Å; H463-H466 PolarHBondContact O-CE1 3.12Å; H463-H466 PolarHBondContact O-ND1 2.96Å; Y464-H466 PolarHBondContact O-N 3.2Å; Y464-H466 VanDerWaalsContact O-N 3.09Å; H466-I477 HydrophobicContact CB-CG2 3.95Å; H466-I477 WeakPolarHBondContact CD2-CG2 3.32Å; H466-G479 WeakPolarHBondContact CB-O 3.43Å
467	A	95.2	Very high	94.4	Very high	4 Å²	4	39.1 Å²	39.1	3%	0.033	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	145.9	176.2	0	0	0	0	0	110.5	I477 S478 H513 M515	A467-I477 CarbonylContact O-C 3.52Å; A467-I477 WeakPolarHBondContact O-CA 3.47Å; A467-S478 PolarHBondContact N-O 2.82Å; A467-S478 VanDerWaalsContact N-O 3.15Å; A467-S478 PolarHBondContact O-N 2.8Å; A467-S478 PolarHBondContact O-OG 2.93Å; A467-H513 VanDerWaalsContact CB-CD2 3.45Å; A467-H513 WeakPolarHBondContact CB-CD2 3.5Å; A467-H513 WeakPolarHBondContact CB-NE2 3.3Å; A467-H513 WeakPolarHBondContact CB-O 3.42Å; A467-M515 HydrophobicContact CB-CB 3.66Å
468	G	94.8	Very high	94.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	171	178.6	0	0	0	0	0	115.5	R422 Y476 M515	R422-G468 VanDerWaalsContact NE-C 3.28Å; R422-G468 PolarHBondContact NE-O 3.02Å; R422-G468 PolarHBondContact NH2-O 3.02Å; G468-Y476 CarbonylContact C-O 3.49Å; G468-Y476 WeakPolarHBondContact CA-O 3.37Å; G468-M515 VanDerWaalsContact O-O 3.09Å
469	T	96.6	Very high	94.4	Very high	12 Å²	12	31 Å²	31	7%	0.074	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	173	171.3	-161.6	0	0	0	0	110	Y476 M515 T517 L522	T469-Y476 PolarHBondContact N-O 2.86Å; T469-Y476 PolarHBondContact O-N 2.86Å; T469-M515 HydrophobicContact CG2-CE 3.75Å; T469-M515 HydrophobicContact CG2-CG 3.85Å; T469-M515 HydrophobicContact CG2-SD 3.94Å; T469-T517 WeakPolarHBondContact CG2-OG1 3.48Å; T469-T517 PolarHBondContact OG1-N 2.85Å; T469-T517 PolarHBondContact OG1-OG1 3.15Å; T469-L522 HydrophobicContact CG2-CB 4.08Å; T469-L522 HydrophobicContact CG2-CD2 3.66Å; T469-L522 HydrophobicContact CG2-CG 3.75Å
470	V	96.8	Very high	94.4	Very high	39 Å²	39	30.7 Å²	30.7	24%	0.236	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	130.5	-178.5	169.1	0	0	0	0	109.1	R422 L424 Y474 M475 T517	R422-V470 HydrophobicContact CB-CG2 3.8Å; R422-V470 HydrophobicContact CG-CG2 4.28Å; L424-V470 HydrophobicContact CB-CG2 4.18Å; L424-V470 HydrophobicContact CD1-CG1 3.55Å; L424-V470 HydrophobicContact CD1-CG2 4.49Å; V470-Y474 WeakPolarHBondContact CA-O 3.41Å; V470-M475 HydrophobicContact CG2-CB 4.32Å; V470-T517 PolarHBondContact O-OG1 3.15Å
471	Y	97	Very high	94.5	Very high	78 Å²	78	24.4 Å²	24.4	31%	0.306	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	139	175.2	176.7	-99.3	0	0	0	110.6	G473 Y474 T517 G519 D520 L522 P547	Y471-G473 PolarHBondContact O-N 2.79Å; Y471-G473 VanDerWaalsContact O-N 3.12Å; Y471-Y474 PolarHBondContact N-O 2.96Å; Y471-Y474 PolarHBondContact O-N 3.2Å; Y471-T517 HydrophobicContact CD2-CG2 3.8Å; Y471-T517 HydrophobicContact CG-CG2 4.36Å; Y471-G519 WeakPolarHBondContact CE2-O 3.38Å; Y471-D520 HydrophobicContact CE2-CB 4.24Å; Y471-D520 WeakPolarHBondContact OH-CB 3.49Å; Y471-L522 HydrophobicContact CD1-CD1 4.33Å; Y471-L522 HydrophobicContact CG-CD1 4.13Å; Y471-P547 HydrophobicContact CD1-CB 4.12Å; Y471-P547 HydrophobicContact CD1-CG 3.6Å; Y471-P547 HydrophobicContact CE1-CB 4.07Å; Y471-P547 HydrophobicContact CE1-CG 3.78Å; Y471-P547 HydrophobicContact CG-CG 4.47Å
472	G	95.1	Very high	94.6	Very high	58 Å²	58	20.3 Å²	20.3	60%	0.598	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.4	23.7	174.8	0	0	0	0	0	115.1	Y474	G472-Y474 VanDerWaalsContact C-N 3.33Å; G472-Y474 WeakPolarHBondContact O-CD2 3.28Å; G472-Y474 WeakPolarHBondContact O-CE2 3.3Å
473	G	95.6	Very high	94.5	Very high	23 Å²	23	24.6 Å²	24.6	24%	0.237	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.5	8.8	-175.9	0	0	0	0	0	115	L424 Y471 P495	L424-G473 WeakPolarHBondContact CD1-O 3.48Å; Y471-G473 PolarHBondContact O-N 2.79Å; Y471-G473 VanDerWaalsContact O-N 3.12Å; G473-P495 WeakPolarHBondContact O-CD 3.19Å
474	Y	97.2	Very high	94.3	Very high	90 Å²	90	29.2 Å²	29.2	35%	0.353	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	152.6	175.7	-60.2	-88.5	0	0	0	110.7	V470 Y471 G472 F493 D494	V470-Y474 WeakPolarHBondContact CA-O 3.41Å; Y471-Y474 PolarHBondContact N-O 2.96Å; Y471-Y474 PolarHBondContact O-N 3.2Å; G472-Y474 VanDerWaalsContact C-N 3.33Å; G472-Y474 WeakPolarHBondContact O-CD2 3.28Å; G472-Y474 WeakPolarHBondContact O-CE2 3.3Å; Y474-F493 WeakPolarHBondContact CA-O 3.45Å; Y474-D494 HydrophobicContact CD1-CB 3.88Å; Y474-D494 HydrophobicContact CE1-CB 3.68Å; Y474-D494 WeakPolarHBondContact CE1-OD2 3.34Å
475	M	97.5	Very high	94.3	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.1	171.2	173.8	172.6	59.8	0	0	109.8	R422 L424 Y429 V431 V470 I477 C492 F493 W500	R422-M475 HydrophobicContact CB-SD 4.15Å; R422-M475 HydrophobicContact CG-SD 4.39Å; L424-M475 HydrophobicContact CD2-CB 4.03Å; Y429-M475 HydrophobicContact CD1-CE 4.33Å; Y429-M475 HydrophobicContact CG-CE 4.24Å; V431-M475 HydrophobicContact CG2-CE 3.45Å; V431-M475 VanDerWaalsContact CG2-CE 3.45Å; V431-M475 HydrophobicContact CG2-SD 3.67Å; V470-M475 HydrophobicContact CG2-CB 4.32Å; M475-I477 HydrophobicContact CG-CD1 4.19Å; M475-I477 HydrophobicContact SD-CD1 4.33Å; M475-C492 CarbonylContact O-C 3.58Å; M475-C492 WeakPolarHBondContact O-CA 3.5Å; M475-F493 HydrophobicContact CB-CB 4.27Å; M475-F493 HydrophobicContact CE-CB 4.05Å; M475-F493 HydrophobicContact CE-CD1 3.76Å; M475-F493 HydrophobicContact CE-CG 4.14Å; M475-F493 PolarHBondContact N-O 3.37Å; M475-F493 VanDerWaalsContact N-O 3.09Å; M475-F493 PolarHBondContact O-N 3.37Å; M475-W500 HydrophobicContact CE-CH2 3.85Å; M475-W500 HydrophobicContact CE-CZ2 4.09Å
476	Y	97.9	Very high	94.4	Very high	13 Å²	13	32.4 Å²	32.4	5%	0.051	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.9	178.9	-65.3	-97.9	0	0	0	109.3	G468 T469 L490 M491 C492 L522 Y545	G468-Y476 CarbonylContact C-O 3.49Å; G468-Y476 WeakPolarHBondContact CA-O 3.37Å; T469-Y476 PolarHBondContact N-O 2.86Å; T469-Y476 PolarHBondContact O-N 2.86Å; Y476-L490 HydrophobicContact CD1-CD1 4.28Å; Y476-L490 HydrophobicContact CD1-CD2 4.34Å; Y476-L490 HydrophobicContact CD1-CG 4.42Å; Y476-M491 CarbonylContact C-O 3.56Å; Y476-M491 VanDerWaalsContact CA-O 3.31Å; Y476-M491 WeakPolarHBondContact CA-O 3.38Å; Y476-C492 HydrophobicContact CD1-CB 3.88Å; Y476-C492 HydrophobicContact CE1-CB 3.77Å; Y476-L522 HydrophobicContact CD1-CD2 3.87Å; Y476-L522 HydrophobicContact CD2-CD2 3.46Å; Y476-L522 VanDerWaalsContact CD2-CD2 3.46Å; Y476-L522 HydrophobicContact CE1-CD2 4.34Å; Y476-L522 HydrophobicContact CE2-CD2 3.98Å; Y476-L522 HydrophobicContact CG-CD2 3.4Å; Y476-L522 VanDerWaalsContact CG-CD2 3.4Å; Y476-Y545 HydrophobicContact CD1-CE1 4.4Å; Y476-Y545 HydrophobicContact CE1-CE1 4.03Å
477	I	97.3	Very high	94.5	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.026	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	130.6	176.8	-58.5	-59.7	0	0	0	108.6	V420 V431 H466 A467 M475 L490 M491 W500	V420-I477 HydrophobicContact CB-CD1 4.08Å; V420-I477 HydrophobicContact CG1-CD1 3.69Å; V420-I477 HydrophobicContact CG2-CD1 4.46Å; V431-I477 HydrophobicContact CB-CD1 4.36Å; V431-I477 HydrophobicContact CG1-CD1 4.25Å; V431-I477 HydrophobicContact CG1-CG1 4.15Å; V431-I477 HydrophobicContact CG2-CD1 4.31Å; H466-I477 HydrophobicContact CB-CG2 3.95Å; H466-I477 WeakPolarHBondContact CD2-CG2 3.32Å; A467-I477 CarbonylContact O-C 3.52Å; A467-I477 WeakPolarHBondContact O-CA 3.47Å; M475-I477 HydrophobicContact CG-CD1 4.19Å; M475-I477 HydrophobicContact SD-CD1 4.33Å; I477-L490 CarbonylContact O-C 3.35Å; I477-L490 WeakPolarHBondContact O-CA 3.21Å; I477-L490 WeakPolarHBondContact O-CD1 3.49Å; I477-M491 PolarHBondContact N-O 3.01Å; I477-M491 PolarHBondContact O-N 2.92Å; I477-W500 HydrophobicContact CB-CZ3 4.27Å; I477-W500 HydrophobicContact CG1-CH2 3.61Å; I477-W500 HydrophobicContact CG1-CZ3 3.75Å
478	S	96.6	Very high	94.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	142.1	-177.5	60.7	0	0	0	0	111.9	A467 E489 H513 M515	A467-S478 PolarHBondContact N-O 2.82Å; A467-S478 VanDerWaalsContact N-O 3.15Å; A467-S478 PolarHBondContact O-N 2.8Å; A467-S478 PolarHBondContact O-OG 2.93Å; S478-E489 WeakPolarHBondContact CA-O 3.48Å; S478-H513 PolarHBondContact O-CE1 2.81Å; S478-H513 PolarHBondContact O-NE2 2.95Å; S478-H513 VanDerWaalsContact O-NE2 3.12Å; S478-H513 PolarHBondContact OG-NE2 2.86Å; S478-M515 PolarHBondContact OG-SD 3.09Å; S478-M515 VanDerWaalsContact OG-SD 3.37Å
479	G	95.6	Very high	94.6	Very high	3 Å²	3	40 Å²	40	3%	0.031	22%	0.215	C	C	.	.			trans	54.9	-140.4	170.1	0	0	0	0	0	114	H466 Q487 E489	H466-G479 WeakPolarHBondContact CB-O 3.43Å; G479-Q487 WeakPolarHBondContact CA-O 3.44Å; G479-E489 PolarHBondContact N-O 3.02Å
480	G	94	Very high	94.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.			trans	96.4	-164.9	-174.5	0	0	0	0	0	112.4	Y464 F486 Q487 R510	Y464-G480 WeakPolarHBondContact O-CA 3.22Å; G480-F486 WeakPolarHBondContact O-CA 3.21Å; G480-Q487 PolarHBondContact O-N 2.85Å; G480-R510 PolarHBondContact N-O 2.9Å
481	I	92.1	Very high	94.7	Very high	7 Å²	7	39.1 Å²	39.1	4%	0.036	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	134.2	-175.7	-54.6	162	0	0	0	108.8	H463 Y464 T485 F486	H463-I481 WeakPolarHBondContact CA-O 3.37Å; Y464-I481 HydrophobicContact CD1-CB 4.16Å; Y464-I481 WeakPolarHBondContact CD1-O 3.1Å; Y464-I481 HydrophobicContact CD2-CD1 4.5Å; Y464-I481 HydrophobicContact CE1-CB 3.66Å; Y464-I481 HydrophobicContact CE1-CG2 3.61Å; Y464-I481 HydrophobicContact CE2-CB 4.14Å; Y464-I481 HydrophobicContact CE2-CD1 3.7Å; Y464-I481 HydrophobicContact CE2-CG1 4.49Å; Y464-I481 PolarHBondContact N-O 3.23Å; Y464-I481 PolarHBondContact O-N 2.79Å; Y464-I481 WeakPolarHBondContact OH-CG2 3.32Å; I481-T485 WeakPolarHBondContact CA-O 3.4Å; I481-F486 HydrophobicContact CD1-CD1 4.34Å; I481-F486 HydrophobicContact CD1-CE1 3.76Å; I481-F486 HydrophobicContact CD1-CZ 4.11Å; I481-F486 HydrophobicContact CG1-CD1 3.75Å; I481-F486 HydrophobicContact CG1-CE1 3.69Å; I481-F486 HydrophobicContact CG1-CG 4.44Å; I481-F486 HydrophobicContact CG1-CZ 4.32Å
482	T	91.7	Very high	94.7	Very high	7 Å²	7	35.6 Å²	35.6	4%	0.043	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	123.6	179.4	-65.5	0	0	0	0	107.7	E461 P462 H463 D484 T485	E461-T482 HydrophobicContact CB-CG2 3.91Å; P462-T482 WeakPolarHBondContact O-CB 3.36Å; P462-T482 VanDerWaalsContact O-CG2 3.31Å; P462-T482 WeakPolarHBondContact O-CG2 3.36Å; P462-T482 PolarHBondContact O-OG1 2.87Å; H463-T482 PolarHBondContact CD2-OG1 3Å; H463-T482 PolarHBondContact NE2-OG1 2.93Å; T482-D484 VanDerWaalsContact C-N 3.28Å; T482-D484 PolarHBondContact O-N 2.81Å; T482-T485 PolarHBondContact N-O 3.03Å; T482-T485 PolarHBondContact O-N 3.44Å; T482-T485 PolarHBondContact O-OG1 3.43Å
483	H	88.5	Confident	94.9	Very high	114 Å²	114	32.9 Å²	32.9	53%	0.528	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	48	48.8	-178.4	-50.6	-60.2	0	0	0	112.6	E439 E461 T485	E439-H483 PolarHBondContact OE1-N 3.16Å; E439-H483 PolarHBondContact OE2-N 3.07Å; E439-H483 VanDerWaalsContact OE2-N 3.08Å; E461-H483 IonicContact OE2-CD2 3.37Å; E461-H483 IonicContact OE2-NE2 3.86Å; E461-H483 PolarHBondContact OE2-NE2 3.16Å; E461-H483 VanDerWaalsContact OE2-NE2 3.12Å; H483-T485 PolarHBondContact O-N 2.81Å; H483-T485 VanDerWaalsContact O-N 3.14Å
484	D	84.6	Confident	94.9	Very high	120 Å²	120	33.3 Å²	33.3	64%	0.642	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.6	14.7	-176	-63.6	-48	0	0	0	116	T482	T482-D484 VanDerWaalsContact C-N 3.28Å; T482-D484 PolarHBondContact O-N 2.81Å
485	T	91.2	Very high	94.9	Very high	76 Å²	76	30.1 Å²	30.1	47%	0.466	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.4	178	61.9	0	0	0	0	112.1	I481 T482 H483 Q487	I481-T485 WeakPolarHBondContact CA-O 3.4Å; T482-T485 PolarHBondContact N-O 3.03Å; T482-T485 PolarHBondContact O-N 3.44Å; T482-T485 PolarHBondContact O-OG1 3.43Å; H483-T485 PolarHBondContact O-N 2.81Å; H483-T485 VanDerWaalsContact O-N 3.14Å; T485-Q487 PolarHBondContact O-NE2 3.35Å; T485-Q487 PolarHBondContact OG1-NE2 2.85Å
486	F	93.8	Very high	94.8	Very high	22 Å²	22	35.9 Å²	35.9	10%	0.096	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	131.2	176.5	-72.5	-84.1	0	0	0	111.2	G480 I481 V509 N528 H529 F530 Y536	G480-F486 WeakPolarHBondContact O-CA 3.21Å; I481-F486 HydrophobicContact CD1-CD1 4.34Å; I481-F486 HydrophobicContact CD1-CE1 3.76Å; I481-F486 HydrophobicContact CD1-CZ 4.11Å; I481-F486 HydrophobicContact CG1-CD1 3.75Å; I481-F486 HydrophobicContact CG1-CE1 3.69Å; I481-F486 HydrophobicContact CG1-CG 4.44Å; I481-F486 HydrophobicContact CG1-CZ 4.32Å; F486-V509 HydrophobicContact CB-CB 3.92Å; F486-V509 HydrophobicContact CB-CG2 4.08Å; F486-N528 WeakPolarHBondContact CE1-O 3.43Å; F486-N528 VanDerWaalsContact CE1-OD1 3.28Å; F486-N528 WeakPolarHBondContact CE1-OD1 3.45Å; F486-H529 HydrophobicContact CD1-CB 4.42Å; F486-H529 HydrophobicContact CD2-CB 4.25Å; F486-H529 HydrophobicContact CE2-CB 4.47Å; F486-H529 HydrophobicContact CG-CB 4.21Å; F486-F530 AromaticContact CD2-CD2 3.71Å; F486-F530 HydrophobicContact CD2-CD2 3.71Å; F486-F530 AromaticContact CD2-CE2 3.95Å; F486-F530 HydrophobicContact CD2-CE2 3.95Å; F486-F530 HydrophobicContact CD2-CG 4.25Å; F486-F530 HydrophobicContact CE2-CD1 4.08Å; F486-F530 AromaticContact CE2-CD2 3.51Å; F486-F530 HydrophobicContact CE2-CD2 3.51Å; F486-F530 HydrophobicContact CE2-CE1 4.13Å; F486-F530 AromaticContact CE2-CE2 3.57Å; F486-F530 HydrophobicContact CE2-CE2 3.57Å; F486-F530 AromaticContact CE2-CG 3.77Å; F486-F530 HydrophobicContact CE2-CG 3.77Å; F486-F530 AromaticContact CE2-CZ 3.88Å; F486-F530 HydrophobicContact CE2-CZ 3.88Å; F486-Y536 HydrophobicContact CE2-CE1 4.43Å; F486-Y536 HydrophobicContact CZ-CD1 4.22Å; F486-Y536 AromaticContact CZ-CE1 3.92Å; F486-Y536 HydrophobicContact CZ-CE1 3.92Å
487	Q	95.4	Very high	94.7	Very high	36 Å²	36	38.1 Å²	38.1	17%	0.168	21%	0.205	C	C	.	.			trans	-100	159.6	-178	-57.8	-51.2	-51.9	0	0	111	G479 G480 T485 E489 V509 R510	G479-Q487 WeakPolarHBondContact CA-O 3.44Å; G480-Q487 PolarHBondContact O-N 2.85Å; T485-Q487 PolarHBondContact O-NE2 3.35Å; T485-Q487 PolarHBondContact OG1-NE2 2.85Å; Q487-E489 VanDerWaalsContact CB-OE2 3.32Å; Q487-E489 WeakPolarHBondContact CB-OE2 3.27Å; Q487-E489 PolarHBondContact OE1-OE2 2.82Å; Q487-V509 WeakPolarHBondContact O-CA 3.36Å; Q487-R510 PolarHBondContact O-N 2.93Å; Q487-R510 VanDerWaalsContact O-N 3.15Å
488	K	96.1	Very high	94.7	Very high	82 Å²	82	41.5 Å²	41.5	36%	0.357	22%	0.223	S	C	.	.			trans	-127.5	-1.2	173	60.9	177.5	-176.9	173.8	0	113.4	P505 M506 V509	K488-P505 HydrophobicContact CD-CB 4.46Å; K488-P505 HydrophobicContact CG-CB 4.18Å; K488-P505 WeakPolarHBondContact O-CA 3.41Å; K488-M506 HydrophobicContact CB-CB 4.23Å; K488-M506 HydrophobicContact CB-CE 4.44Å; K488-M506 WeakPolarHBondContact O-CB 3.48Å; K488-M506 PolarHBondContact O-N 2.88Å; K488-V509 HydrophobicContact CB-CG1 3.88Å; K488-V509 HydrophobicContact CD-CG1 4.2Å; K488-V509 HydrophobicContact CG-CG1 4.13Å
489	E	96.6	Very high	94.7	Very high	56 Å²	56	47.7 Å²	47.7	26%	0.262	25%	0.25	S	S	.	.			trans	-65.5	147.4	-174.5	-71.6	65	-151.6	0	0	110.5	S478 G479 Q487	S478-E489 WeakPolarHBondContact CA-O 3.48Å; G479-E489 PolarHBondContact N-O 3.02Å; Q487-E489 VanDerWaalsContact CB-OE2 3.32Å; Q487-E489 WeakPolarHBondContact CB-OE2 3.27Å; Q487-E489 PolarHBondContact OE1-OE2 2.82Å
490	L	97.4	Very high	94.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	119.5	170.4	179.2	65.4	0	0	0	108.2	Y476 I477 K503 A504 M515 Y545 W552	Y476-L490 HydrophobicContact CD1-CD1 4.28Å; Y476-L490 HydrophobicContact CD1-CD2 4.34Å; Y476-L490 HydrophobicContact CD1-CG 4.42Å; I477-L490 CarbonylContact O-C 3.35Å; I477-L490 WeakPolarHBondContact O-CA 3.21Å; I477-L490 WeakPolarHBondContact O-CD1 3.49Å; L490-K503 HydrophobicContact CB-CB 4.14Å; L490-K503 HydrophobicContact CD2-CB 3.68Å; L490-K503 HydrophobicContact CD2-CG 4.38Å; L490-K503 HydrophobicContact CG-CB 3.9Å; L490-K503 PolarHBondContact O-N 2.93Å; L490-A504 WeakPolarHBondContact CB-O 3.42Å; L490-M515 HydrophobicContact CD1-CE 3.97Å; L490-Y545 HydrophobicContact CD2-CD1 3.73Å; L490-Y545 HydrophobicContact CD2-CD2 3.68Å; L490-Y545 HydrophobicContact CD2-CE1 3.68Å; L490-Y545 HydrophobicContact CD2-CE2 3.62Å; L490-Y545 HydrophobicContact CD2-CG 3.73Å; L490-W552 HydrophobicContact CB-CZ2 4.25Å; L490-W552 HydrophobicContact CD1-CZ2 4.19Å; L490-W552 HydrophobicContact CD2-CZ2 3.78Å; L490-W552 HydrophobicContact CG-CZ2 4.29Å
491	M	97.4	Very high	95	Very high	31 Å²	31	51.5 Å²	51.5	15%	0.153	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	132.8	177.6	-60.8	-58.1	-65.3	0	0	109.6	Y476 I477 W500 Q502	Y476-M491 CarbonylContact C-O 3.56Å; Y476-M491 VanDerWaalsContact CA-O 3.31Å; Y476-M491 WeakPolarHBondContact CA-O 3.38Å; I477-M491 PolarHBondContact N-O 3.01Å; I477-M491 PolarHBondContact O-N 2.92Å; M491-W500 HydrophobicContact CB-CE3 3.69Å; M491-W500 HydrophobicContact CB-CZ3 3.89Å; M491-W500 HydrophobicContact CE-CB 4.09Å; M491-Q502 HydrophobicContact CE-CB 4.38Å; M491-Q502 HydrophobicContact SD-CB 3.89Å; M491-Q502 HydrophobicContact SD-CG 4.02Å
492	C	97.6	Very high	95.2	Very high	4 Å²	4	57.2 Å²	57.2	3%	0.027	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	118.3	179.9	175.3	0	0	0	0	109.7	M475 Y476 W500 T501 K503	M475-C492 CarbonylContact O-C 3.58Å; M475-C492 WeakPolarHBondContact O-CA 3.5Å; Y476-C492 HydrophobicContact CD1-CB 3.88Å; Y476-C492 HydrophobicContact CE1-CB 3.77Å; C492-W500 CarbonylContact O-C 3.59Å; C492-W500 WeakPolarHBondContact O-CA 3.45Å; C492-T501 PolarHBondContact N-O 2.82Å; C492-T501 PolarHBondContact O-N 3.32Å; C492-T501 PolarHBondContact O-OG1 2.96Å; C492-T501 VanDerWaalsContact O-OG1 3.13Å; C492-K503 HydrophobicContact CB-CD 4.49Å; C492-K503 HydrophobicContact CB-CG 3.81Å
493	F	98	Very high	95.5	Very high	1 Å²	1	60 Å²	60	0%	0.004	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	125.1	176.3	-177.8	-113.9	0	0	0	111.1	Y429 V456 A457 Y474 M475 P495 D498 K499 W500	Y429-F493 HydrophobicContact CD1-CE1 4.1Å; Y429-F493 HydrophobicContact CE1-CD1 4.48Å; Y429-F493 AromaticContact CE1-CE1 3.64Å; Y429-F493 HydrophobicContact CE1-CE1 3.64Å; Y429-F493 HydrophobicContact CE1-CZ 4.41Å; V456-F493 HydrophobicContact CB-CZ 4.25Å; V456-F493 HydrophobicContact CG2-CZ 3.95Å; A457-F493 HydrophobicContact CB-CE2 4.21Å; Y474-F493 WeakPolarHBondContact CA-O 3.45Å; M475-F493 HydrophobicContact CB-CB 4.27Å; M475-F493 HydrophobicContact CE-CB 4.05Å; M475-F493 HydrophobicContact CE-CD1 3.76Å; M475-F493 HydrophobicContact CE-CG 4.14Å; M475-F493 PolarHBondContact N-O 3.37Å; M475-F493 VanDerWaalsContact N-O 3.09Å; M475-F493 PolarHBondContact O-N 3.37Å; F493-P495 HydrophobicContact CD1-CB 4.41Å; F493-P495 HydrophobicContact CE1-CB 3.91Å; F493-D498 WeakPolarHBondContact CE2-OD1 3.09Å; F493-D498 WeakPolarHBondContact CZ-OD1 3.44Å; F493-K499 WeakPolarHBondContact CA-O 3.38Å; F493-W500 HydrophobicContact CB-CD2 3.8Å; F493-W500 HydrophobicContact CB-CE3 3.64Å; F493-W500 HydrophobicContact CB-CH2 3.66Å; F493-W500 HydrophobicContact CB-CZ2 3.76Å; F493-W500 HydrophobicContact CB-CZ3 3.59Å; F493-W500 AromaticContact CD2-CD1 3.81Å; F493-W500 AromaticContact CD2-CD2 3.85Å; F493-W500 HydrophobicContact CD2-CD2 3.85Å; F493-W500 AromaticContact CD2-CE2 3.51Å; F493-W500 HydrophobicContact CD2-CG 4.04Å; F493-W500 AromaticContact CD2-CZ2 3.99Å; F493-W500 HydrophobicContact CD2-CZ2 3.99Å; F493-W500 AromaticContact CD2-NE1 3.45Å; F493-W500 AromaticContact CE2-NE1 3.93Å; F493-W500 HydrophobicContact CG-CD2 4.24Å; F493-W500 AromaticContact CG-CE2 3.91Å; F493-W500 HydrophobicContact CG-CH2 4.33Å; F493-W500 AromaticContact CG-CZ2 3.95Å; F493-W500 HydrophobicContact CG-CZ2 3.95Å
494	D	97.2	Very high	96	Very high	33 Å²	33	55.7 Å²	55.7	18%	0.176	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	111.5	167.4	-174.2	-21.4	0	0	0	109	Y474 D496 A497 D498 K499	Y474-D494 HydrophobicContact CD1-CB 3.88Å; Y474-D494 HydrophobicContact CE1-CB 3.68Å; Y474-D494 WeakPolarHBondContact CE1-OD2 3.34Å; D494-D496 VanDerWaalsContact C-N 3.3Å; D494-D496 PolarHBondContact O-N 2.79Å; D494-D496 WeakPolarHBondContact OD1-CB 3.49Å; D494-D496 PolarHBondContact OD1-N 3.02Å; D494-A497 HydrophobicContact CB-CB 4.04Å; D494-A497 PolarHBondContact OD1-N 2.98Å; D494-D498 WeakPolarHBondContact O-CA 3.29Å; D494-D498 PolarHBondContact O-N 3.31Å; D494-K499 PolarHBondContact N-O 3.37Å; D494-K499 PolarHBondContact O-N 2.99Å; D494-K499 VanDerWaalsContact O-N 3.15Å
495	P	95.5	Very high	96.6	Very high	22 Å²	22	52.8 Å²	52.8	14%	0.143	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-22.7	179.6	32.4	-38.7	0	0	0	113.4	L424 K425 Y429 G473 F493	L424-P495 HydrophobicContact CD2-CB 4.12Å; L424-P495 HydrophobicContact CD2-CG 3.74Å; L424-P495 HydrophobicContact CG-CG 4.31Å; K425-P495 HydrophobicContact CD-CG 4.13Å; Y429-P495 WeakPolarHBondContact OH-CB 3.47Å; G473-P495 WeakPolarHBondContact O-CD 3.19Å; F493-P495 HydrophobicContact CD1-CB 4.41Å; F493-P495 HydrophobicContact CE1-CB 3.91Å
496	D	95.6	Very high	96.9	Very high	121 Å²	121	49.3 Å²	49.3	65%	0.647	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-36.7	-179.3	-60.2	-21.6	0	0	0	110.7	K425 D494	K425-D496 IonicContact NZ-OD1 2.81Å; K425-D496 PolarHBondContact NZ-OD1 3.19Å; K425-D496 IonicContact NZ-OD2 3.5Å; K425-D496 PolarHBondContact NZ-OD2 3.06Å; D494-D496 VanDerWaalsContact C-N 3.3Å; D494-D496 PolarHBondContact O-N 2.79Å; D494-D496 WeakPolarHBondContact OD1-CB 3.49Å; D494-D496 PolarHBondContact OD1-N 3.02Å
497	A	96.8	Very high	97	Very high	61 Å²	61	53.5 Å²	53.5	50%	0.504	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-6.5	175.7	0	0	0	0	0	113.6	D494 K499	D494-A497 HydrophobicContact CB-CB 4.04Å; D494-A497 PolarHBondContact OD1-N 2.98Å; A497-K499 VanDerWaalsContact C-N 3.31Å; A497-K499 HydrophobicContact CB-CB 4.29Å; A497-K499 PolarHBondContact O-N 3.41Å
498	D	96.9	Very high	96.9	Very high	76 Å²	76	53.5 Å²	53.5	41%	0.406	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	44.6	53.9	-171	-168.8	27.9	0	0	0	112.4	V456 A457 F493 D494	V456-D498 WeakPolarHBondContact CB-OD1 3.44Å; A457-D498 WeakPolarHBondContact CB-O 3.36Å; A457-D498 VanDerWaalsContact CB-OD1 3.26Å; A457-D498 WeakPolarHBondContact CB-OD1 3.38Å; A457-D498 PolarHBondContact N-OD1 3.07Å; A457-D498 PolarHBondContact N-OD2 2.71Å; F493-D498 WeakPolarHBondContact CE2-OD1 3.09Å; F493-D498 WeakPolarHBondContact CZ-OD1 3.44Å; D494-D498 WeakPolarHBondContact O-CA 3.29Å; D494-D498 PolarHBondContact O-N 3.31Å
499	K	97.2	Very high	96.8	Very high	130 Å²	130	52 Å²	52	57%	0.565	29%	0.286	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.5	138.8	-170.5	-173.5	176.1	177.8	-176.9	0	113.3	F493 D494 A497	F493-K499 WeakPolarHBondContact CA-O 3.38Å; D494-K499 PolarHBondContact N-O 3.37Å; D494-K499 PolarHBondContact O-N 2.99Å; D494-K499 VanDerWaalsContact O-N 3.15Å; A497-K499 VanDerWaalsContact C-N 3.31Å; A497-K499 HydrophobicContact CB-CB 4.29Å; A497-K499 PolarHBondContact O-N 3.41Å
500	W	97.6	Very high	96.8	Very high	27 Å²	27	49.4 Å²	49.4	10%	0.102	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	139	169.7	-67.6	93.1	0	0	0	111.9	V431 V443 A457 M459 M475 I477 M491 C492 F493	V431-W500 HydrophobicContact CG1-CH2 4.17Å; V431-W500 HydrophobicContact CG1-CZ2 4.33Å; V431-W500 HydrophobicContact CG2-CH2 4.48Å; V443-W500 HydrophobicContact CG2-CZ2 3.85Å; A457-W500 PolarHBondContact O-NE1 2.9Å; M459-W500 HydrophobicContact CG-CZ2 4.18Å; M475-W500 HydrophobicContact CE-CH2 3.85Å; M475-W500 HydrophobicContact CE-CZ2 4.09Å; I477-W500 HydrophobicContact CB-CZ3 4.27Å; I477-W500 HydrophobicContact CG1-CH2 3.61Å; I477-W500 HydrophobicContact CG1-CZ3 3.75Å; M491-W500 HydrophobicContact CB-CE3 3.69Å; M491-W500 HydrophobicContact CB-CZ3 3.89Å; M491-W500 HydrophobicContact CE-CB 4.09Å; C492-W500 CarbonylContact O-C 3.59Å; C492-W500 WeakPolarHBondContact O-CA 3.45Å; F493-W500 HydrophobicContact CB-CD2 3.8Å; F493-W500 HydrophobicContact CB-CE3 3.64Å; F493-W500 HydrophobicContact CB-CH2 3.66Å; F493-W500 HydrophobicContact CB-CZ2 3.76Å; F493-W500 HydrophobicContact CB-CZ3 3.59Å; F493-W500 AromaticContact CD2-CD1 3.81Å; F493-W500 AromaticContact CD2-CD2 3.85Å; F493-W500 HydrophobicContact CD2-CD2 3.85Å; F493-W500 AromaticContact CD2-CE2 3.51Å; F493-W500 HydrophobicContact CD2-CG 4.04Å; F493-W500 AromaticContact CD2-CZ2 3.99Å; F493-W500 HydrophobicContact CD2-CZ2 3.99Å; F493-W500 AromaticContact CD2-NE1 3.45Å; F493-W500 AromaticContact CE2-NE1 3.93Å; F493-W500 HydrophobicContact CG-CD2 4.24Å; F493-W500 AromaticContact CG-CE2 3.91Å; F493-W500 HydrophobicContact CG-CH2 4.33Å; F493-W500 AromaticContact CG-CZ2 3.95Å; F493-W500 HydrophobicContact CG-CZ2 3.95Å
501	T	97.3	Very high	96.6	Very high	55 Å²	55	49.4 Å²	49.4	34%	0.337	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	135.6	174.3	56.4	0	0	0	0	109.7	C492	C492-T501 PolarHBondContact N-O 2.82Å; C492-T501 PolarHBondContact O-N 3.32Å; C492-T501 PolarHBondContact O-OG1 2.96Å; C492-T501 VanDerWaalsContact O-OG1 3.13Å
502	Q	97.4	Very high	96.4	Very high	127 Å²	127	49.4 Å²	49.4	59%	0.593	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	139.4	174.7	-172.1	172.1	-7.7	0	0	109.9	M491	M491-Q502 HydrophobicContact CE-CB 4.38Å; M491-Q502 HydrophobicContact SD-CB 3.89Å; M491-Q502 HydrophobicContact SD-CG 4.02Å
503	K	97.9	Very high	96.2	Very high	65 Å²	65	49.7 Å²	49.7	28%	0.283	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	178.3	176.1	-63.7	-60	-175.5	175.7	0	110.4	L490 C492	L490-K503 HydrophobicContact CB-CB 4.14Å; L490-K503 HydrophobicContact CD2-CB 3.68Å; L490-K503 HydrophobicContact CD2-CG 4.38Å; L490-K503 HydrophobicContact CG-CB 3.9Å; L490-K503 PolarHBondContact O-N 2.93Å; C492-K503 HydrophobicContact CB-CD 4.49Å; C492-K503 HydrophobicContact CB-CG 3.81Å
504	A	98	Very high	96.1	Very high	24 Å²	24	50.3 Å²	50.3	20%	0.198	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-54	129.7	176.2	0	0	0	0	0	110.5	L490 Y545 D550 W552	L490-A504 WeakPolarHBondContact CB-O 3.42Å; A504-Y545 HydrophobicContact CB-CE2 4.35Å; A504-D550 WeakPolarHBondContact CB-O 3.48Å; A504-D550 VanDerWaalsContact CB-OD1 3.3Å; A504-D550 WeakPolarHBondContact CB-OD1 3.47Å; A504-D550 PolarHBondContact N-OD1 2.9Å; A504-W552 PolarHBondContact O-NE1 2.86Å
505	P	97.9	Very high	96	Very high	60 Å²	60	48.9 Å²	48.9	39%	0.39	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-74.7	155.4	-179.4	31.5	-35.1	0	0	0	111.2	K488 W552	K488-P505 HydrophobicContact CD-CB 4.46Å; K488-P505 HydrophobicContact CG-CB 4.18Å; K488-P505 WeakPolarHBondContact O-CA 3.41Å; P505-W552 PolarHBondContact O-NE1 2.86Å
506	M	97.4	Very high	96.1	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.015	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-60.4	163.4	171.3	-65.9	-178.6	-60.5	0	0	111.7	K488 R510 V524 E543 W552	K488-M506 HydrophobicContact CB-CB 4.23Å; K488-M506 HydrophobicContact CB-CE 4.44Å; K488-M506 WeakPolarHBondContact O-CB 3.48Å; K488-M506 PolarHBondContact O-N 2.88Å; M506-R510 HydrophobicContact CE-CG 3.71Å; M506-R510 HydrophobicContact SD-CG 4.28Å; M506-V524 HydrophobicContact SD-CB 4.2Å; M506-V524 HydrophobicContact SD-CG1 3.67Å; M506-V524 HydrophobicContact SD-CG2 3.92Å; M506-E543 WeakPolarHBondContact CA-OE1 3.45Å; M506-E543 VanDerWaalsContact CB-OE1 3.23Å; M506-E543 WeakPolarHBondContact CB-OE1 3.31Å; M506-W552 HydrophobicContact CG-CD2 4.1Å; M506-W552 HydrophobicContact CG-CE3 4.34Å; M506-W552 HydrophobicContact CG-CH2 3.7Å; M506-W552 HydrophobicContact CG-CZ2 3.37Å; M506-W552 HydrophobicContact CG-CZ3 4.17Å; M506-W552 HydrophobicContact SD-CH2 4.17Å; M506-W552 HydrophobicContact SD-CZ2 4.33Å
507	T	95.3	Very high	96.2	Very high	109 Å²	109	44 Å²	44	67%	0.669	25%	0.247	S	C	*	.	S	Bend	trans	-76	-39.5	176.3	-52.6	0	0	0	0	111.5	E543	T507-E543 PolarHBondContact N-OE1 3.09Å
508	T	93.5	Very high	96.2	Very high	36 Å²	36	41.8 Å²	41.8	22%	0.221	23%	0.227	C	C	.	.	S	Bend	trans	-114.6	131.8	-174.8	-46.6	0	0	0	0	110.5	V539	T508-V539 HydrophobicContact CG2-CG1 4.21Å
509	V	95.1	Very high	96.1	Very high	52 Å²	52	41.3 Å²	41.3	32%	0.315	24%	0.239	S	C	.	.			trans	-65.4	139	169.8	-63.7	0	0	0	0	109.8	F486 Q487 K488 H529	F486-V509 HydrophobicContact CB-CB 3.92Å; F486-V509 HydrophobicContact CB-CG2 4.08Å; Q487-V509 WeakPolarHBondContact O-CA 3.36Å; K488-V509 HydrophobicContact CB-CG1 3.88Å; K488-V509 HydrophobicContact CD-CG1 4.2Å; K488-V509 HydrophobicContact CG-CG1 4.13Å; V509-H529 HydrophobicContact CG2-CB 4.18Å
510	R	95.4	Very high	96	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.233	C	C	.	.			trans	-160.1	148.7	-177.4	59.2	179.6	83.6	-147	7.5	112.3	G480 Q487 M506 H513 G526 N528 V539 S541 E543	G480-R510 PolarHBondContact N-O 2.9Å; Q487-R510 PolarHBondContact O-N 2.93Å; Q487-R510 VanDerWaalsContact O-N 3.15Å; M506-R510 HydrophobicContact CE-CG 3.71Å; M506-R510 HydrophobicContact SD-CG 4.28Å; R510-H513 HydrophobicContact CG-CB 4.27Å; R510-G526 PolarHBondContact NH1-O 2.76Å; R510-G526 VanDerWaalsContact NH1-O 3.16Å; R510-N528 WeakPolarHBondContact CA-O 3.3Å; R510-V539 HydrophobicContact CB-CG2 3.97Å; R510-V539 VanDerWaalsContact NH1-CG1 3.28Å; R510-S541 PolarHBondContact NH1-O 3.17Å; R510-S541 PolarHBondContact NH2-O 2.74Å; R510-E543 IonicContact NH2-OE2 3.34Å; R510-E543 PolarHBondContact NH2-OE2 3.38Å
511	G	93.9	Very high	96	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-136.1	165.6	170.4	0	0	0	0	0	110.8	G465 H513 G527 N528	G465-G511 CarbonylContact O-C 3.36Å; G511-H513 PolarHBondContact O-N 2.91Å; G511-G527 CarbonylContact O-C 3.53Å; G511-G527 WeakPolarHBondContact O-CA 3.41Å; G511-N528 PolarHBondContact N-O 3.44Å; G511-N528 PolarHBondContact O-N 2.83Å; G511-N528 PolarHBondContact O-OD1 3.06Å
512	L	92.6	Very high	96.1	Very high	32 Å²	32	39.4 Å²	39.4	17%	0.168	23%	0.229	C	C	.	.	S	Bend	trans	52.8	24.9	-173.7	-55.6	174.4	0	0	0	113.1	G465 D564	G465-L512 PolarHBondContact O-N 2.78Å; L512-D564 PolarHBondContact O-N 3.15Å
513	H	94.9	Very high	96.1	Very high	9 Å²	9	33.5 Å²	33.5	4%	0.042	20%	0.201	C	C	.	.			trans	-84.9	-178.3	175.9	64.1	-75.7	0	0	0	110.9	A467 S478 R510 G511 I525 G526	A467-H513 VanDerWaalsContact CB-CD2 3.45Å; A467-H513 WeakPolarHBondContact CB-CD2 3.5Å; A467-H513 WeakPolarHBondContact CB-NE2 3.3Å; A467-H513 WeakPolarHBondContact CB-O 3.42Å; S478-H513 PolarHBondContact O-CE1 2.81Å; S478-H513 PolarHBondContact O-NE2 2.95Å; S478-H513 VanDerWaalsContact O-NE2 3.12Å; S478-H513 PolarHBondContact OG-NE2 2.86Å; R510-H513 HydrophobicContact CG-CB 4.27Å; G511-H513 PolarHBondContact O-N 2.91Å; H513-I525 WeakPolarHBondContact CB-O 3.25Å; H513-G526 WeakPolarHBondContact CB-O 3.47Å
514	C	94.6	Very high	96.1	Very high	15 Å²	15	30.4 Å²	30.4	10%	0.101	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	154.2	175	-89.7	0	0	0	0	111.9	V524 I525 V565 V567	C514-V524 WeakPolarHBondContact O-CA 3.47Å; C514-I525 PolarHBondContact N-O 2.89Å; C514-I525 PolarHBondContact O-N 3.45Å; C514-V565 HydrophobicContact CB-CG2 3.83Å; C514-V565 WeakPolarHBondContact SG-CG2 3.38Å; C514-V567 HydrophobicContact CB-CB 3.82Å; C514-V567 HydrophobicContact CB-CG1 3.71Å; C514-V567 HydrophobicContact CB-CG2 4.4Å
515	M	96	Very high	96	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.01	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	135.1	178.6	-168.9	-178	-169.9	0	0	109.8	A467 G468 T469 S478 L490 L522 Y523 V524 W552	A467-M515 HydrophobicContact CB-CB 3.66Å; G468-M515 VanDerWaalsContact O-O 3.09Å; T469-M515 HydrophobicContact CG2-CE 3.75Å; T469-M515 HydrophobicContact CG2-CG 3.85Å; T469-M515 HydrophobicContact CG2-SD 3.94Å; S478-M515 PolarHBondContact OG-SD 3.09Å; S478-M515 VanDerWaalsContact OG-SD 3.37Å; L490-M515 HydrophobicContact CD1-CE 3.97Å; M515-L522 HydrophobicContact CE-CB 3.74Å; M515-L522 HydrophobicContact CE-CD2 3.81Å; M515-L522 HydrophobicContact CE-CG 4.35Å; M515-Y523 WeakPolarHBondContact CA-O 3.38Å; M515-Y523 WeakPolarHBondContact CG-O 3.43Å; M515-V524 HydrophobicContact CB-CG2 4.34Å; M515-V524 HydrophobicContact CE-CG2 4.36Å; M515-V524 HydrophobicContact CG-CG2 3.91Å; M515-V524 HydrophobicContact SD-CG2 4.3Å; M515-W552 HydrophobicContact CE-CH2 4.39Å
516	C	96.8	Very high	95.9	Very high	9 Å²	9	26.5 Å²	26.5	6%	0.061	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	161.9	178.7	65.2	0	0	0	0	111.1	L522 Y523 V567 V569 I574	C516-L522 CarbonylContact O-C 3.58Å; C516-L522 WeakPolarHBondContact O-CA 3.39Å; C516-Y523 PolarHBondContact N-O 3.28Å; C516-Y523 PolarHBondContact O-N 2.87Å; C516-V567 HydrophobicContact CB-CG2 4.14Å; C516-V569 HydrophobicContact CB-CG2 3.88Å; C516-I574 VanDerWaalsContact SG-CD1 3.59Å
517	T	97.3	Very high	95.7	Very high	32 Å²	32	26.4 Å²	26.4	20%	0.196	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.6	-179.6	-63	0	0	0	0	109.2	T469 V470 Y471 R521	T469-T517 WeakPolarHBondContact CG2-OG1 3.48Å; T469-T517 PolarHBondContact OG1-N 2.85Å; T469-T517 PolarHBondContact OG1-OG1 3.15Å; V470-T517 PolarHBondContact O-OG1 3.15Å; Y471-T517 HydrophobicContact CD2-CG2 3.8Å; Y471-T517 HydrophobicContact CG-CG2 4.36Å; T517-R521 WeakPolarHBondContact CA-O 3.27Å
518	V	97.1	Very high	95.7	Very high	15 Å²	15	21.2 Å²	21.2	9%	0.091	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	121.4	170.8	-174.2	0	0	0	0	108	D520 R521 Y523 V569 N572 I574 P596	V518-D520 PolarHBondContact O-N 2.96Å; V518-R521 PolarHBondContact N-O 3.15Å; V518-R521 PolarHBondContact O-N 3.04Å; V518-R521 VanDerWaalsContact O-N 3.13Å; V518-Y523 HydrophobicContact CB-CD2 4.22Å; V518-Y523 HydrophobicContact CB-CE2 3.8Å; V518-Y523 HydrophobicContact CG2-CD2 4.22Å; V518-Y523 HydrophobicContact CG2-CE2 4.23Å; V518-V569 HydrophobicContact CG2-CB 4.46Å; V518-V569 HydrophobicContact CG2-CG1 3.79Å; V518-V569 HydrophobicContact CG2-CG2 3.78Å; V518-N572 HydrophobicContact CG1-CB 4.37Å; V518-I574 HydrophobicContact CG2-CD1 3.84Å; V518-I574 HydrophobicContact CG2-CG1 3.6Å; V518-P596 HydrophobicContact CG1-CG 4.28Å
519	G	95.1	Very high	95.7	Very high	65 Å²	65	21.6 Å²	21.6	67%	0.67	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	-120.9	-172.7	0	0	0	0	0	111.5	Y471	Y471-G519 WeakPolarHBondContact CE2-O 3.38Å
520	D	95.4	Very high	95.4	Very high	82 Å²	82	22.4 Å²	22.4	44%	0.439	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	11.4	179.8	66.8	-24.7	0	0	0	114.3	Y471 V518 P547	Y471-D520 HydrophobicContact CE2-CB 4.24Å; Y471-D520 WeakPolarHBondContact OH-CB 3.49Å; V518-D520 PolarHBondContact O-N 2.96Å; D520-P547 WeakPolarHBondContact O-CD 3.33Å
521	R	97.9	Very high	94.7	Very high	90 Å²	90	30.2 Å²	30.2	34%	0.34	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	141.7	-172.7	-65.8	171.4	-167.9	-173.7	3.1	111.9	T517 V518 Y523 Y544	T517-R521 WeakPolarHBondContact CA-O 3.27Å; V518-R521 PolarHBondContact N-O 3.15Å; V518-R521 PolarHBondContact O-N 3.04Å; V518-R521 VanDerWaalsContact O-N 3.13Å; R521-Y523 HydrophobicContact CB-CD2 4.26Å; R521-Y523 HydrophobicContact CB-CE2 3.49Å; R521-Y523 VanDerWaalsContact CB-CE2 3.49Å; R521-Y523 WeakPolarHBondContact CD-OH 3.41Å; R521-Y544 HydrophobicContact CB-CD2 3.95Å; R521-Y544 HydrophobicContact CB-CG 4.26Å; R521-Y544 HydrophobicContact CG-CD2 3.69Å; R521-Y544 HydrophobicContact CG-CE2 3.95Å; R521-Y544 HydrophobicContact CG-CG 4.34Å
522	L	98.3	Very high	93.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	108.3	-178.8	-65.7	69.5	0	0	0	108.4	T469 Y471 Y476 M515 C516 Y544 Y545 P547	T469-L522 HydrophobicContact CG2-CB 4.08Å; T469-L522 HydrophobicContact CG2-CD2 3.66Å; T469-L522 HydrophobicContact CG2-CG 3.75Å; Y471-L522 HydrophobicContact CD1-CD1 4.33Å; Y471-L522 HydrophobicContact CG-CD1 4.13Å; Y476-L522 HydrophobicContact CD1-CD2 3.87Å; Y476-L522 HydrophobicContact CD2-CD2 3.46Å; Y476-L522 VanDerWaalsContact CD2-CD2 3.46Å; Y476-L522 HydrophobicContact CE1-CD2 4.34Å; Y476-L522 HydrophobicContact CE2-CD2 3.98Å; Y476-L522 HydrophobicContact CG-CD2 3.4Å; Y476-L522 VanDerWaalsContact CG-CD2 3.4Å; M515-L522 HydrophobicContact CE-CB 3.74Å; M515-L522 HydrophobicContact CE-CD2 3.81Å; M515-L522 HydrophobicContact CE-CG 4.35Å; C516-L522 CarbonylContact O-C 3.58Å; C516-L522 WeakPolarHBondContact O-CA 3.39Å; L522-Y544 CarbonylContact O-C 3.55Å; L522-Y544 VanDerWaalsContact O-CA 3.23Å; L522-Y544 WeakPolarHBondContact O-CA 3.39Å; L522-Y545 HydrophobicContact CD1-CD1 4.29Å; L522-Y545 HydrophobicContact CD2-CD1 4.15Å; L522-Y545 PolarHBondContact N-O 2.88Å; L522-Y545 PolarHBondContact O-N 3.08Å; L522-P547 HydrophobicContact CD1-CG 3.22Å; L522-P547 HydrophobicContact CD2-CG 4.49Å
523	Y	98.3	Very high	92.8	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.016	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	136.3	-174.1	-67	-97.4	0	0	0	110.7	M515 C516 V518 R521 Y544 I555 I574 Y594	M515-Y523 WeakPolarHBondContact CA-O 3.38Å; M515-Y523 WeakPolarHBondContact CG-O 3.43Å; C516-Y523 PolarHBondContact N-O 3.28Å; C516-Y523 PolarHBondContact O-N 2.87Å; V518-Y523 HydrophobicContact CB-CD2 4.22Å; V518-Y523 HydrophobicContact CB-CE2 3.8Å; V518-Y523 HydrophobicContact CG2-CD2 4.22Å; V518-Y523 HydrophobicContact CG2-CE2 4.23Å; R521-Y523 HydrophobicContact CB-CD2 4.26Å; R521-Y523 HydrophobicContact CB-CE2 3.49Å; R521-Y523 VanDerWaalsContact CB-CE2 3.49Å; R521-Y523 WeakPolarHBondContact CD-OH 3.41Å; Y523-Y544 HydrophobicContact CE1-CD1 4.12Å; Y523-Y544 HydrophobicContact CE1-CG 4.24Å; Y523-I555 HydrophobicContact CD1-CD1 3.79Å; Y523-I555 HydrophobicContact CE1-CD1 4.11Å; Y523-I574 HydrophobicContact CD1-CD1 3.86Å; Y523-I574 HydrophobicContact CD2-CD1 3.76Å; Y523-I574 HydrophobicContact CE1-CD1 4.46Å; Y523-I574 HydrophobicContact CE2-CD1 4.38Å; Y523-I574 HydrophobicContact CG-CD1 3.48Å; Y523-I574 VanDerWaalsContact CG-CD1 3.48Å; Y523-Y594 HydrophobicContact CD1-CE1 4.11Å; Y523-Y594 AromaticContact CE1-CE1 3.7Å; Y523-Y594 HydrophobicContact CE1-CE1 3.7Å
524	V	97.5	Very high	91.6	Very high	0 Å²	0	42 Å²	42	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.4	171.9	164.4	0	0	0	0	109.4	M506 C514 M515 E543 W552	M506-V524 HydrophobicContact SD-CB 4.2Å; M506-V524 HydrophobicContact SD-CG1 3.67Å; M506-V524 HydrophobicContact SD-CG2 3.92Å; C514-V524 WeakPolarHBondContact O-CA 3.47Å; M515-V524 HydrophobicContact CB-CG2 4.34Å; M515-V524 HydrophobicContact CE-CG2 4.36Å; M515-V524 HydrophobicContact CG-CG2 3.91Å; M515-V524 HydrophobicContact SD-CG2 4.3Å; V524-E543 HydrophobicContact CB-CG 4.37Å; V524-E543 PolarHBondContact N-O 2.81Å; V524-E543 PolarHBondContact O-N 3.01Å; V524-W552 HydrophobicContact CB-CH2 4.21Å; V524-W552 HydrophobicContact CB-CZ3 3.91Å; V524-W552 HydrophobicContact CG2-CH2 3.42Å; V524-W552 VanDerWaalsContact CG2-CH2 3.42Å; V524-W552 HydrophobicContact CG2-CZ3 3.6Å
525	I	96.4	Very high	91.1	Very high	1 Å²	1	46 Å²	46	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	133.2	-166.2	-63	161.6	0	0	0	110	H513 C514 M558 I574 V576 W601	H513-I525 WeakPolarHBondContact CB-O 3.25Å; C514-I525 PolarHBondContact N-O 2.89Å; C514-I525 PolarHBondContact O-N 3.45Å; I525-M558 HydrophobicContact CG2-CE 3.8Å; I525-M558 HydrophobicContact CG2-CG 4.13Å; I525-M558 HydrophobicContact CG2-SD 3.48Å; I525-M558 WeakPolarHBondContact CG2-SD 3.38Å; I525-I574 HydrophobicContact CD1-CB 4.36Å; I525-I574 HydrophobicContact CD1-CD1 3.96Å; I525-I574 HydrophobicContact CD1-CG2 3.54Å; I525-V576 HydrophobicContact CG2-CG2 3.85Å; I525-W601 HydrophobicContact CD1-CH2 4.04Å; I525-W601 HydrophobicContact CD1-CZ2 4.4Å; I525-W601 HydrophobicContact CG1-CH2 4.27Å; I525-W601 HydrophobicContact CG1-CZ2 4.28Å; I525-W601 HydrophobicContact CG2-CH2 3.64Å; I525-W601 HydrophobicContact CG2-CZ2 4.01Å
526	G	94.9	Very high	90.7	Very high	1 Å²	1	50 Å²	50	1%	0.01	28%	0.284	C	S	.	.			trans	68.3	-151.4	170.6	0	0	0	0	0	114.2	R510 H513 V539 M558	R510-G526 PolarHBondContact NH1-O 2.76Å; R510-G526 VanDerWaalsContact NH1-O 3.16Å; H513-G526 WeakPolarHBondContact CB-O 3.47Å; G526-V539 WeakPolarHBondContact CA-O 3.17Å; G526-M558 WeakPolarHBondContact CA-SD 3.5Å; G526-M558 PolarHBondContact N-SD 2.91Å; G526-M558 VanDerWaalsContact N-SD 3.44Å
527	G	94.4	Very high	90.5	Very high	0 Å²	0	51 Å²	51	0%	0	29%	0.289	C	S	.	.			trans	88.4	-166.9	-173	0	0	0	0	0	113.2	G511 V539 Q562 S563	G511-G527 CarbonylContact O-C 3.53Å; G511-G527 WeakPolarHBondContact O-CA 3.41Å; G527-V539 PolarHBondContact O-N 2.91Å; G527-Q562 PolarHBondContact N-O 3.33Å; G527-S563 PolarHBondContact O-OG 3.03Å
528	N	94.1	Very high	90.3	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	168.3	-179.4	65.5	8.9	0	0	0	111.9	F486 R510 G511 Y536 D537 W582	F486-N528 WeakPolarHBondContact CE1-O 3.43Å; F486-N528 VanDerWaalsContact CE1-OD1 3.28Å; F486-N528 WeakPolarHBondContact CE1-OD1 3.45Å; R510-N528 WeakPolarHBondContact CA-O 3.3Å; G511-N528 PolarHBondContact N-O 3.44Å; G511-N528 PolarHBondContact O-N 2.83Å; G511-N528 PolarHBondContact O-OD1 3.06Å; N528-Y536 HydrophobicContact CB-CD1 4.47Å; N528-Y536 VanDerWaalsContact ND2-CD1 3.34Å; N528-Y536 WeakPolarHBondContact ND2-CD1 3.33Å; N528-D537 WeakPolarHBondContact CA-O 3.4Å; N528-D537 WeakPolarHBondContact CB-O 3.36Å; N528-W582 HydrophobicContact CB-CG 4.38Å; N528-W582 WeakPolarHBondContact ND2-CZ2 3.29Å; N528-W582 PolarHBondContact ND2-NE1 2.78Å
529	H	93.1	Very high	90.2	Very high	45 Å²	45	49.4 Å²	49.4	21%	0.208	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	-179.5	164.9	65.3	97.7	0	0	0	109.7	F486 V509 Y536 D537 V539	F486-H529 HydrophobicContact CD1-CB 4.42Å; F486-H529 HydrophobicContact CD2-CB 4.25Å; F486-H529 HydrophobicContact CE2-CB 4.47Å; F486-H529 HydrophobicContact CG-CB 4.21Å; V509-H529 HydrophobicContact CG2-CB 4.18Å; H529-Y536 CarbonylContact O-C 3.51Å; H529-Y536 WeakPolarHBondContact O-CA 3.35Å; H529-D537 PolarHBondContact N-O 3.38Å; H529-D537 PolarHBondContact O-N 2.9Å; H529-V539 VanDerWaalsContact CD2-CG2 3.43Å; H529-V539 WeakPolarHBondContact CD2-CG2 3.43Å
530	F	89.6	Confident	90.3	Very high	69 Å²	69	49.5 Å²	49.5	30%	0.303	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	135	171	-65.3	-52.2	0	0	0	112.2	F486 D535 Y536	F486-F530 AromaticContact CD2-CD2 3.71Å; F486-F530 HydrophobicContact CD2-CD2 3.71Å; F486-F530 AromaticContact CD2-CE2 3.95Å; F486-F530 HydrophobicContact CD2-CE2 3.95Å; F486-F530 HydrophobicContact CD2-CG 4.25Å; F486-F530 HydrophobicContact CE2-CD1 4.08Å; F486-F530 AromaticContact CE2-CD2 3.51Å; F486-F530 HydrophobicContact CE2-CD2 3.51Å; F486-F530 HydrophobicContact CE2-CE1 4.13Å; F486-F530 AromaticContact CE2-CE2 3.57Å; F486-F530 HydrophobicContact CE2-CE2 3.57Å; F486-F530 AromaticContact CE2-CG 3.77Å; F486-F530 HydrophobicContact CE2-CG 3.77Å; F486-F530 AromaticContact CE2-CZ 3.88Å; F486-F530 HydrophobicContact CE2-CZ 3.88Å; F530-D535 CarbonylContact C-O 3.59Å; F530-D535 WeakPolarHBondContact CA-O 3.45Å; F530-Y536 HydrophobicContact CD1-CD1 4.34Å; F530-Y536 HydrophobicContact CD1-CE1 4.3Å; F530-Y536 HydrophobicContact CE1-CD1 4.18Å; F530-Y536 HydrophobicContact CE1-CD2 4.46Å; F530-Y536 AromaticContact CE1-CE1 3.71Å; F530-Y536 HydrophobicContact CE1-CE1 3.71Å; F530-Y536 AromaticContact CE1-CE2 4Å; F530-Y536 HydrophobicContact CE1-CE2 4Å; F530-Y536 AromaticContact CE1-CZ 3.6Å; F530-Y536 HydrophobicContact CZ-CE1 4.36Å
531	R	81.1	Confident	90.3	Very high	163 Å²	163	48 Å²	48	62%	0.615	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	109.4	159.5	176.1	175.1	-176.3	175.7	2.3	108.7	D535 D537	R531-D535 PolarHBondContact N-O 2.71Å; R531-D537 HydrophobicContact CB-CB 3.73Å
532	G	76.5	Confident	90.3	Very high	71 Å²	71	43.8 Å²	43.8	73%	0.732	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.1	-136.8	-174.3	0	0	0	0	0	111.8
533	T	68.9	Low	90.2	Very high	141 Å²	141	44 Å²	44	87%	0.865	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-19.1	-171.2	44.7	0	0	0	0	115.4
534	S	71.2	Confident	90.2	Very high	78 Å²	78	45.5 Å²	45.5	55%	0.545	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-163.2	-5	-174.9	57.8	0	0	0	0	117.1
535	D	83.5	Confident	90.3	Very high	97 Å²	97	45.5 Å²	45.5	52%	0.519	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	136	178.4	-76.9	-31.3	0	0	0	109.9	F530 R531	F530-D535 CarbonylContact C-O 3.59Å; F530-D535 WeakPolarHBondContact CA-O 3.45Å; R531-D535 PolarHBondContact N-O 2.71Å
536	Y	87.4	Confident	90.4	Very high	87 Å²	87	46.1 Å²	46.1	34%	0.341	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	141.3	175.2	-69.4	-90.4	0	0	0	110.8	F486 N528 H529 F530 W582	F486-Y536 HydrophobicContact CE2-CE1 4.43Å; F486-Y536 HydrophobicContact CZ-CD1 4.22Å; F486-Y536 AromaticContact CZ-CE1 3.92Å; F486-Y536 HydrophobicContact CZ-CE1 3.92Å; N528-Y536 HydrophobicContact CB-CD1 4.47Å; N528-Y536 VanDerWaalsContact ND2-CD1 3.34Å; N528-Y536 WeakPolarHBondContact ND2-CD1 3.33Å; H529-Y536 CarbonylContact O-C 3.51Å; H529-Y536 WeakPolarHBondContact O-CA 3.35Å; F530-Y536 HydrophobicContact CD1-CD1 4.34Å; F530-Y536 HydrophobicContact CD1-CE1 4.3Å; F530-Y536 HydrophobicContact CE1-CD1 4.18Å; F530-Y536 HydrophobicContact CE1-CD2 4.46Å; F530-Y536 AromaticContact CE1-CE1 3.71Å; F530-Y536 HydrophobicContact CE1-CE1 3.71Å; F530-Y536 AromaticContact CE1-CE2 4Å; F530-Y536 HydrophobicContact CE1-CE2 4Å; F530-Y536 AromaticContact CE1-CZ 3.6Å; F530-Y536 HydrophobicContact CZ-CE1 4.36Å; Y536-W582 HydrophobicContact CD1-CD2 4.48Å; Y536-W582 HydrophobicContact CD1-CH2 4.44Å; Y536-W582 HydrophobicContact CD1-CZ2 4.44Å; Y536-W582 HydrophobicContact CD2-CD2 4.5Å; Y536-W582 AromaticContact CD2-CE3 3.8Å; Y536-W582 HydrophobicContact CD2-CE3 3.8Å; Y536-W582 AromaticContact CD2-CH2 3.96Å; Y536-W582 HydrophobicContact CD2-CH2 3.96Å; Y536-W582 AromaticContact CD2-CZ3 3.48Å; Y536-W582 HydrophobicContact CD2-CZ3 3.48Å; Y536-W582 VanDerWaalsContact CD2-CZ3 3.48Å; Y536-W582 HydrophobicContact CE2-CH2 4.15Å; Y536-W582 HydrophobicContact CE2-CZ3 4.04Å; Y536-W582 AromaticContact CG-CD2 3.95Å; Y536-W582 HydrophobicContact CG-CD2 3.95Å; Y536-W582 AromaticContact CG-CE3 3.67Å; Y536-W582 HydrophobicContact CG-CE3 3.67Å; Y536-W582 HydrophobicContact CG-CH2 4.11Å; Y536-W582 HydrophobicContact CG-CZ2 4.41Å; Y536-W582 AromaticContact CG-CZ3 3.75Å; Y536-W582 HydrophobicContact CG-CZ3 3.75Å
537	D	92.3	Very high	90.5	Very high	31 Å²	31	47.4 Å²	47.4	17%	0.166	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	143.3	175.9	-165.4	5.2	0	0	0	110	N528 H529 R531 N583	N528-D537 WeakPolarHBondContact CA-O 3.4Å; N528-D537 WeakPolarHBondContact CB-O 3.36Å; H529-D537 PolarHBondContact N-O 3.38Å; H529-D537 PolarHBondContact O-N 2.9Å; R531-D537 HydrophobicContact CB-CB 3.73Å; D537-N583 VanDerWaalsContact OD1-CG 3.26Å; D537-N583 PolarHBondContact OD1-ND2 2.8Å; D537-N583 PolarHBondContact OD1-OD1 3.35Å
538	D	93.9	Very high	90.6	Very high	9 Å²	9	51.9 Å²	51.9	5%	0.048	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	133.6	-178.2	-70.3	-44.8	0	0	0	110.6	L540 S581 W582 N583	D538-L540 PolarHBondContact O-N 3.38Å; D538-S581 PolarHBondContact OD2-OG 2.92Å; D538-W582 VanDerWaalsContact CG-N 3.34Å; D538-W582 PolarHBondContact OD1-N 2.8Å; D538-W582 PolarHBondContact OD2-N 2.9Å; D538-W582 VanDerWaalsContact OD2-N 3.09Å; D538-N583 WeakPolarHBondContact OD2-CB 3.37Å; D538-N583 PolarHBondContact OD2-N 3.09Å
539	V	95.3	Very high	90.8	Very high	3 Å²	3	58 Å²	58	2%	0.018	33%	0.332	C	S	.	.			trans	-85.7	104.1	172.9	-173.4	0	0	0	0	109.5	T508 R510 G526 G527 H529 S541	T508-V539 HydrophobicContact CG2-CG1 4.21Å; R510-V539 HydrophobicContact CB-CG2 3.97Å; R510-V539 VanDerWaalsContact NH1-CG1 3.28Å; G526-V539 WeakPolarHBondContact CA-O 3.17Å; G527-V539 PolarHBondContact O-N 2.91Å; H529-V539 VanDerWaalsContact CD2-CG2 3.43Å; H529-V539 WeakPolarHBondContact CD2-CG2 3.43Å; V539-S541 WeakPolarHBondContact CG1-OG 3.2Å
540	L	95.3	Very high	91	Very high	68 Å²	68	59.1 Å²	59.1	36%	0.356	34%	0.339	S	S	.	.			trans	-84.1	-27.5	174.7	-58.8	-179.3	0	0	0	112.9	D538 C542 A557 M558 G561	D538-L540 PolarHBondContact O-N 3.38Å; L540-C542 PolarHBondContact O-N 2.83Å; L540-A557 HydrophobicContact CB-CB 4.3Å; L540-A557 CarbonylContact O-C 3.57Å; L540-A557 VanDerWaalsContact O-CA 3.27Å; L540-A557 WeakPolarHBondContact O-CA 3.31Å; L540-A557 WeakPolarHBondContact O-CB 3.19Å; L540-M558 HydrophobicContact CD2-CB 4.38Å; L540-M558 PolarHBondContact O-N 3.39Å; L540-G561 VanDerWaalsContact CD2-CA 3.47Å
541	S	96.2	Very high	91.4	Very high	49 Å²	49	60.5 Å²	60.5	34%	0.343	35%	0.349	S	S	.	.			trans	-65.3	128.7	-179.6	54.5	0	0	0	0	110.8	R510 V539	R510-S541 PolarHBondContact NH1-O 3.17Å; R510-S541 PolarHBondContact NH2-O 2.74Å; V539-S541 WeakPolarHBondContact CG1-OG 3.2Å
542	C	97.3	Very high	92.2	Very high	2 Å²	2	53.7 Å²	53.7	1%	0.014	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	150.9	175.3	-64.7	0	0	0	0	109.3	L540 I555 M558	L540-C542 PolarHBondContact O-N 2.83Å; C542-I555 HydrophobicContact CB-CD1 3.61Å; C542-I555 HydrophobicContact CB-CG1 3.54Å; C542-I555 VanDerWaalsContact O-CG1 3.29Å; C542-I555 WeakPolarHBondContact O-CG1 3.49Å; C542-I555 PolarHBondContact O-N 2.78Å; C542-M558 WeakPolarHBondContact SG-CG 3.37Å
543	E	97.8	Very high	93.2	Very high	5 Å²	5	52.5 Å²	52.5	2%	0.023	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	148.4	-178.7	49.9	-166.8	-87	0	0	109	M506 T507 R510 V524 W552 T553	M506-E543 WeakPolarHBondContact CA-OE1 3.45Å; M506-E543 VanDerWaalsContact CB-OE1 3.23Å; M506-E543 WeakPolarHBondContact CB-OE1 3.31Å; T507-E543 PolarHBondContact N-OE1 3.09Å; R510-E543 IonicContact NH2-OE2 3.34Å; R510-E543 PolarHBondContact NH2-OE2 3.38Å; V524-E543 HydrophobicContact CB-CG 4.37Å; V524-E543 PolarHBondContact N-O 2.81Å; V524-E543 PolarHBondContact O-N 3.01Å; E543-W552 HydrophobicContact CB-CE3 3.92Å; E543-W552 HydrophobicContact CG-CD2 4.47Å; E543-W552 HydrophobicContact CG-CE3 3.6Å; E543-W552 HydrophobicContact CG-CZ3 3.95Å; E543-T553 CarbonylContact C-O 3.56Å; E543-T553 VanDerWaalsContact CA-O 3.28Å; E543-T553 WeakPolarHBondContact CA-O 3.49Å
544	Y	98.1	Very high	94.6	Very high	36 Å²	36	50.6 Å²	50.6	14%	0.141	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	147.9	167.8	74.1	-100.1	0	0	0	110.8	R521 L522 Y523 W552 T553 I555	R521-Y544 HydrophobicContact CB-CD2 3.95Å; R521-Y544 HydrophobicContact CB-CG 4.26Å; R521-Y544 HydrophobicContact CG-CD2 3.69Å; R521-Y544 HydrophobicContact CG-CE2 3.95Å; R521-Y544 HydrophobicContact CG-CG 4.34Å; L522-Y544 CarbonylContact O-C 3.55Å; L522-Y544 VanDerWaalsContact O-CA 3.23Å; L522-Y544 WeakPolarHBondContact O-CA 3.39Å; Y523-Y544 HydrophobicContact CE1-CD1 4.12Å; Y523-Y544 HydrophobicContact CE1-CG 4.24Å; Y544-W552 VanDerWaalsContact C-CE3 3.5Å; Y544-W552 CarbonylContact O-C 3.19Å; Y544-W552 WeakPolarHBondContact O-CA 3.41Å; Y544-T553 HydrophobicContact CE1-CG2 3.78Å; Y544-T553 VanDerWaalsContact CZ-CB 3.42Å; Y544-T553 PolarHBondContact N-O 2.97Å; Y544-T553 PolarHBondContact O-N 3.12Å; Y544-T553 PolarHBondContact OH-OG1 2.79Å; Y544-I555 HydrophobicContact CD1-CG2 3.5Å; Y544-I555 VanDerWaalsContact CD1-CG2 3.5Å; Y544-I555 HydrophobicContact CE1-CG2 3.8Å
545	Y	98.6	Very high	95.9	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	134.6	174.7	174.5	-102	0	0	0	110.4	Y476 L490 A504 L522 P547 D550 L551 W552	Y476-Y545 HydrophobicContact CD1-CE1 4.4Å; Y476-Y545 HydrophobicContact CE1-CE1 4.03Å; L490-Y545 HydrophobicContact CD2-CD1 3.73Å; L490-Y545 HydrophobicContact CD2-CD2 3.68Å; L490-Y545 HydrophobicContact CD2-CE1 3.68Å; L490-Y545 HydrophobicContact CD2-CE2 3.62Å; L490-Y545 HydrophobicContact CD2-CG 3.73Å; A504-Y545 HydrophobicContact CB-CE2 4.35Å; L522-Y545 HydrophobicContact CD1-CD1 4.29Å; L522-Y545 HydrophobicContact CD2-CD1 4.15Å; L522-Y545 PolarHBondContact N-O 2.88Å; L522-Y545 PolarHBondContact O-N 3.08Å; Y545-P547 HydrophobicContact CD1-CG 3.98Å; Y545-P547 VanDerWaalsContact CE1-CA 3.47Å; Y545-P547 HydrophobicContact CE1-CB 3.97Å; Y545-P547 HydrophobicContact CE1-CG 3.84Å; Y545-D550 WeakPolarHBondContact CE2-OD1 2.92Å; Y545-D550 PolarHBondContact OH-OD1 3.23Å; Y545-L551 WeakPolarHBondContact CA-O 3.35Å; Y545-W552 AromaticContact CD2-CD1 3.94Å; Y545-W552 HydrophobicContact CD2-CD2 4.14Å; Y545-W552 AromaticContact CD2-CE2 3.78Å; Y545-W552 HydrophobicContact CD2-CG 4.25Å; Y545-W552 HydrophobicContact CD2-CZ2 4.27Å; Y545-W552 AromaticContact CD2-NE1 3.62Å; Y545-W552 HydrophobicContact CG-CD2 4.4Å; Y545-W552 HydrophobicContact CG-CZ2 4.19Å
546	S	97.9	Very high	96.6	Very high	14 Å²	14	44.8 Å²	44.8	10%	0.098	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	109.6	171	179.5	0	0	0	0	109.7	A548 L549 D550 L551	S546-A548 PolarHBondContact O-N 3.06Å; S546-L549 PolarHBondContact O-N 2.83Å; S546-L549 VanDerWaalsContact O-N 3.16Å; S546-D550 PolarHBondContact O-N 3.11Å; S546-L551 PolarHBondContact N-O 3.05Å
547	P	97.4	Very high	97	Very high	27 Å²	27	43.3 Å²	43.3	18%	0.175	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.6	-179.4	-25	36.4	0	0	0	113.9	Y471 D520 L522 Y545 L549	Y471-P547 HydrophobicContact CD1-CB 4.12Å; Y471-P547 HydrophobicContact CD1-CG 3.6Å; Y471-P547 HydrophobicContact CE1-CB 4.07Å; Y471-P547 HydrophobicContact CE1-CG 3.78Å; Y471-P547 HydrophobicContact CG-CG 4.47Å; D520-P547 WeakPolarHBondContact O-CD 3.33Å; L522-P547 HydrophobicContact CD1-CG 3.22Å; L522-P547 HydrophobicContact CD2-CG 4.49Å; Y545-P547 HydrophobicContact CD1-CG 3.98Å; Y545-P547 VanDerWaalsContact CE1-CA 3.47Å; Y545-P547 HydrophobicContact CE1-CB 3.97Å; Y545-P547 HydrophobicContact CE1-CG 3.84Å; P547-L549 VanDerWaalsContact C-N 3.33Å
548	A	97	Very high	97.2	Very high	95 Å²	95	42.1 Å²	42.1	79%	0.785	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-31.9	178.4	0	0	0	0	0	112.5	S546	S546-A548 PolarHBondContact O-N 3.06Å
549	L	97.5	Very high	97.1	Very high	129 Å²	129	46.6 Å²	46.6	68%	0.675	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	-12.4	-177.1	-59.6	178.5	0	0	0	113.3	S546 P547 L551	S546-L549 PolarHBondContact O-N 2.83Å; S546-L549 VanDerWaalsContact O-N 3.16Å; P547-L549 VanDerWaalsContact C-N 3.33Å; L549-L551 VanDerWaalsContact C-N 3.29Å; L549-L551 HydrophobicContact CB-CB 4.21Å; L549-L551 PolarHBondContact O-N 2.95Å
550	D	98.1	Very high	96.8	Very high	67 Å²	67	48.9 Å²	48.9	36%	0.358	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	49.7	-171.6	-163.9	14	0	0	0	111.7	A504 Y545 S546	A504-D550 WeakPolarHBondContact CB-O 3.48Å; A504-D550 VanDerWaalsContact CB-OD1 3.3Å; A504-D550 WeakPolarHBondContact CB-OD1 3.47Å; A504-D550 PolarHBondContact N-OD1 2.9Å; Y545-D550 WeakPolarHBondContact CE2-OD1 2.92Å; Y545-D550 PolarHBondContact OH-OD1 3.23Å; S546-D550 PolarHBondContact O-N 3.11Å
551	L	97.9	Very high	96.5	Very high	98 Å²	98	45.8 Å²	45.8	51%	0.513	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	144	-173.8	-173.4	70.5	0	0	0	111.7	Y545 S546 L549	Y545-L551 WeakPolarHBondContact CA-O 3.35Å; S546-L551 PolarHBondContact N-O 3.05Å; L549-L551 VanDerWaalsContact C-N 3.29Å; L549-L551 HydrophobicContact CB-CB 4.21Å; L549-L551 PolarHBondContact O-N 2.95Å
552	W	98.5	Very high	96.3	Very high	21 Å²	21	43.5 Å²	43.5	8%	0.08	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	136.7	170.2	-68.3	90.6	0	0	0	111.7	L490 A504 P505 M506 M515 V524 E543 Y544 Y545	L490-W552 HydrophobicContact CB-CZ2 4.25Å; L490-W552 HydrophobicContact CD1-CZ2 4.19Å; L490-W552 HydrophobicContact CD2-CZ2 3.78Å; L490-W552 HydrophobicContact CG-CZ2 4.29Å; A504-W552 PolarHBondContact O-NE1 2.86Å; P505-W552 PolarHBondContact O-NE1 2.86Å; M506-W552 HydrophobicContact CG-CD2 4.1Å; M506-W552 HydrophobicContact CG-CE3 4.34Å; M506-W552 HydrophobicContact CG-CH2 3.7Å; M506-W552 HydrophobicContact CG-CZ2 3.37Å; M506-W552 HydrophobicContact CG-CZ3 4.17Å; M506-W552 HydrophobicContact SD-CH2 4.17Å; M506-W552 HydrophobicContact SD-CZ2 4.33Å; M515-W552 HydrophobicContact CE-CH2 4.39Å; V524-W552 HydrophobicContact CB-CH2 4.21Å; V524-W552 HydrophobicContact CB-CZ3 3.91Å; V524-W552 HydrophobicContact CG2-CH2 3.42Å; V524-W552 VanDerWaalsContact CG2-CH2 3.42Å; V524-W552 HydrophobicContact CG2-CZ3 3.6Å; E543-W552 HydrophobicContact CB-CE3 3.92Å; E543-W552 HydrophobicContact CG-CD2 4.47Å; E543-W552 HydrophobicContact CG-CE3 3.6Å; E543-W552 HydrophobicContact CG-CZ3 3.95Å; Y544-W552 VanDerWaalsContact C-CE3 3.5Å; Y544-W552 CarbonylContact O-C 3.19Å; Y544-W552 WeakPolarHBondContact O-CA 3.41Å; Y545-W552 AromaticContact CD2-CD1 3.94Å; Y545-W552 HydrophobicContact CD2-CD2 4.14Å; Y545-W552 AromaticContact CD2-CE2 3.78Å; Y545-W552 HydrophobicContact CD2-CG 4.25Å; Y545-W552 HydrophobicContact CD2-CZ2 4.27Å; Y545-W552 AromaticContact CD2-NE1 3.62Å; Y545-W552 HydrophobicContact CG-CD2 4.4Å; Y545-W552 HydrophobicContact CG-CZ2 4.19Å
553	T	98.1	Very high	96	Very high	45 Å²	45	43.5 Å²	43.5	28%	0.276	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	128	175.8	-56.5	0	0	0	0	109.5	E543 Y544	E543-T553 CarbonylContact C-O 3.56Å; E543-T553 VanDerWaalsContact CA-O 3.28Å; E543-T553 WeakPolarHBondContact CA-O 3.49Å; Y544-T553 HydrophobicContact CE1-CG2 3.78Å; Y544-T553 VanDerWaalsContact CZ-CB 3.42Å; Y544-T553 PolarHBondContact N-O 2.97Å; Y544-T553 PolarHBondContact O-N 3.12Å; Y544-T553 PolarHBondContact OH-OG1 2.79Å
554	P	97.9	Very high	95.5	Very high	102 Å²	102	44.5 Å²	44.5	66%	0.662	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.5	147.7	175.3	29.7	-34.6	0	0	0	111
555	I	97.9	Very high	95.1	Very high	22 Å²	22	42.9 Å²	42.9	11%	0.113	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	176.2	175.9	51.5	160.5	0	0	0	110.4	Y523 C542 Y544 A557 Y594 D599	Y523-I555 HydrophobicContact CD1-CD1 3.79Å; Y523-I555 HydrophobicContact CE1-CD1 4.11Å; C542-I555 HydrophobicContact CB-CD1 3.61Å; C542-I555 HydrophobicContact CB-CG1 3.54Å; C542-I555 VanDerWaalsContact O-CG1 3.29Å; C542-I555 WeakPolarHBondContact O-CG1 3.49Å; C542-I555 PolarHBondContact O-N 2.78Å; Y544-I555 HydrophobicContact CD1-CG2 3.5Å; Y544-I555 VanDerWaalsContact CD1-CG2 3.5Å; Y544-I555 HydrophobicContact CE1-CG2 3.8Å; I555-A557 PolarHBondContact O-N 2.89Å; I555-Y594 WeakPolarHBondContact CB-OH 3.48Å; I555-Y594 HydrophobicContact CD1-CE1 3.86Å; I555-Y594 HydrophobicContact CD1-CE2 4.07Å; I555-Y594 WeakPolarHBondContact CG2-OH 2.94Å; I555-D599 VanDerWaalsContact CB-OD1 3.26Å; I555-D599 WeakPolarHBondContact CB-OD1 3.25Å
556	A	97.7	Very high	94.7	Very high	30 Å²	30	42.9 Å²	42.9	25%	0.248	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-50.5	136.6	177	0	0	0	0	0	112	Y594 D599 W601	A556-Y594 HydrophobicContact CB-CE2 4.38Å; A556-D599 WeakPolarHBondContact CB-O 3.41Å; A556-D599 WeakPolarHBondContact CB-OD1 3.28Å; A556-D599 PolarHBondContact N-OD1 2.7Å; A556-D599 PolarHBondContact N-OD2 2.93Å; A556-W601 PolarHBondContact O-NE1 3Å
557	A	96.9	Very high	94.6	Very high	56 Å²	56	43.4 Å²	43.4	46%	0.463	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-74	149.5	179.2	0	0	0	0	0	111.4	L540 I555	L540-A557 HydrophobicContact CB-CB 4.3Å; L540-A557 CarbonylContact O-C 3.57Å; L540-A557 VanDerWaalsContact O-CA 3.27Å; L540-A557 WeakPolarHBondContact O-CA 3.31Å; L540-A557 WeakPolarHBondContact O-CB 3.19Å; I555-A557 PolarHBondContact O-N 2.89Å
558	M	94.9	Very high	94.5	Very high	7 Å²	7	42.3 Å²	42.3	3%	0.034	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-59.7	149.5	175.9	-59.1	-179.5	73.2	0	0	111.3	I525 G526 L540 C542 R560 Q562 V576 W601	I525-M558 HydrophobicContact CG2-CE 3.8Å; I525-M558 HydrophobicContact CG2-CG 4.13Å; I525-M558 HydrophobicContact CG2-SD 3.48Å; I525-M558 WeakPolarHBondContact CG2-SD 3.38Å; G526-M558 WeakPolarHBondContact CA-SD 3.5Å; G526-M558 PolarHBondContact N-SD 2.91Å; G526-M558 VanDerWaalsContact N-SD 3.44Å; L540-M558 HydrophobicContact CD2-CB 4.38Å; L540-M558 PolarHBondContact O-N 3.39Å; C542-M558 WeakPolarHBondContact SG-CG 3.37Å; M558-R560 VanDerWaalsContact C-N 3.3Å; M558-Q562 HydrophobicContact CE-CB 4.32Å; M558-Q562 HydrophobicContact CE-CG 4.41Å; M558-V576 HydrophobicContact CE-CB 4.39Å; M558-V576 HydrophobicContact CE-CG1 4Å; M558-V576 HydrophobicContact CE-CG2 4.31Å; M558-W601 HydrophobicContact CG-CH2 4.21Å; M558-W601 HydrophobicContact CG-CZ2 3.86Å
559	L	92.5	Very high	94.4	Very high	102 Å²	102	40 Å²	40	53%	0.534	23%	0.23	S	C	.	.	S	Bend	trans	-71.3	-30.8	175.8	-51.2	172.5	0	0	0	111.6	W601	L559-W601 HydrophobicContact CD1-CB 4.2Å; L559-W601 HydrophobicContact CD2-CB 4.06Å; L559-W601 HydrophobicContact CG-CB 3.78Å
560	R	90.3	Very high	94.2	Very high	51 Å²	51	34.3 Å²	34.3	19%	0.192	20%	0.2	C	C	.	.	S	Bend	trans	-142.9	141.1	178.5	-167	169.5	-179.4	-175.6	-3.8	110.7	M558 C586 I590 Q592	M558-R560 VanDerWaalsContact C-N 3.3Å; R560-C586 PolarHBondContact NH2-SG 3.37Å; R560-I590 HydrophobicContact CB-CD1 3.81Å; R560-I590 HydrophobicContact CG-CD1 4.47Å; R560-Q592 VanDerWaalsContact N-OE1 3.16Å; R560-Q592 PolarHBondContact O-NE2 2.96Å
561	G	88.9	Confident	93.8	Very high	4 Å²	4	36.9 Å²	36.9	4%	0.041	21%	0.209	C	C	.	.			trans	-67.4	130.3	175.8	0	0	0	0	0	111.4	L540 S581	L540-G561 VanDerWaalsContact CD2-CA 3.47Å; G561-S581 WeakPolarHBondContact O-CB 3.21Å
562	Q	91.3	Very high	93.7	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	22%	0.215	C	C	.	.			trans	-140.5	124.8	176.5	-57.9	176.6	-85.4	0	0	110.3	G527 M558 V565 V576 G578 V588 I590	G527-Q562 PolarHBondContact N-O 3.33Å; M558-Q562 HydrophobicContact CE-CB 4.32Å; M558-Q562 HydrophobicContact CE-CG 4.41Å; Q562-V565 HydrophobicContact CB-CG1 3.23Å; Q562-V565 HydrophobicContact CG-CG1 4.3Å; Q562-V576 HydrophobicContact CB-CG1 4.49Å; Q562-V576 VanDerWaalsContact OE1-CG1 3.22Å; Q562-G578 PolarHBondContact NE2-O 3.3Å; Q562-V588 HydrophobicContact CG-CB 4.16Å; Q562-V588 HydrophobicContact CG-CG1 3.9Å; Q562-V588 HydrophobicContact CG-CG2 4.11Å; Q562-I590 PolarHBondContact NE2-O 3.14Å
563	S	90.9	Very high	93.5	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.007	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-111.7	154.2	170	-61.7	0	0	0	0	110.7	G527 V565 G579 Y580 W582	G527-S563 PolarHBondContact O-OG 3.03Å; S563-V565 VanDerWaalsContact C-N 3.34Å; S563-V565 PolarHBondContact O-N 3.41Å; S563-G579 CarbonylContact O-C 3.4Å; S563-G579 WeakPolarHBondContact O-CA 3.34Å; S563-Y580 PolarHBondContact N-O 3.25Å; S563-Y580 PolarHBondContact O-N 3.34Å; S563-W582 PolarHBondContact OG-NE1 3.02Å
564	D	87.8	Confident	93.5	Very high	26 Å²	26	37.3 Å²	37.3	14%	0.139	21%	0.209	C	C	.	.	S	Bend	trans	52.5	51.1	179.9	-166.3	21.4	0	0	0	112.5	L512 G613 R615	L512-D564 PolarHBondContact O-N 3.15Å; D564-G613 VanDerWaalsContact CG-CA 3.46Å; D564-G613 WeakPolarHBondContact O-CA 3.27Å; D564-G613 PolarHBondContact O-N 3.11Å; D564-G613 VanDerWaalsContact O-N 3.17Å; D564-G613 WeakPolarHBondContact OD2-CA 3.4Å; D564-G613 PolarHBondContact OD2-N 3.04Å; D564-R615 IonicContact OD1-CZ 3.13Å; D564-R615 IonicContact OD1-NH1 2.66Å; D564-R615 PolarHBondContact OD1-NH1 3.41Å; D564-R615 IonicContact OD1-NH2 2.62Å; D564-R615 PolarHBondContact OD1-NH2 3.11Å
565	V	88.8	Confident	93.4	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.018	18%	0.18	C	C	.	.			trans	-92.8	162.6	-175.9	-59.9	0	0	0	0	112.5	C514 Q562 S563 V576 I614 R615	C514-V565 HydrophobicContact CB-CG2 3.83Å; C514-V565 WeakPolarHBondContact SG-CG2 3.38Å; Q562-V565 HydrophobicContact CB-CG1 3.23Å; Q562-V565 HydrophobicContact CG-CG1 4.3Å; S563-V565 VanDerWaalsContact C-N 3.34Å; S563-V565 PolarHBondContact O-N 3.41Å; V565-V576 HydrophobicContact CB-CG1 3.79Å; V565-V576 HydrophobicContact CG1-CG1 3.81Å; V565-V576 HydrophobicContact CG2-CG1 3.73Å; V565-I614 CarbonylContact C-O 3.52Å; V565-R615 PolarHBondContact O-NH1 3.22Å
566	G	91.3	Very high	93.2	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	131.4	158	0	0	0	0	0	109.6	V577 I614	G566-V577 PolarHBondContact N-O 2.86Å; G566-V577 PolarHBondContact O-N 2.94Å; G566-I614 WeakPolarHBondContact CA-O 3.41Å; G566-I614 PolarHBondContact N-O 2.9Å
567	V	94.3	Very high	93	Very high	24 Å²	24	30.4 Å²	30.4	15%	0.145	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	133	172.5	67.7	0	0	0	0	110.1	C514 C516 I574 Y575	C514-V567 HydrophobicContact CB-CB 3.82Å; C514-V567 HydrophobicContact CB-CG1 3.71Å; C514-V567 HydrophobicContact CB-CG2 4.4Å; C516-V567 HydrophobicContact CB-CG2 4.14Å; V567-I574 HydrophobicContact CG2-CG2 3.73Å; V567-Y575 WeakPolarHBondContact CA-O 3.23Å
568	A	95.4	Very high	92.6	Very high	5 Å²	5	27.7 Å²	27.7	4%	0.041	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	146.4	174.6	0	0	0	0	0	110.6	L351 Y575 A616	L351-A568 HydrophobicContact CD1-CB 3.37Å; A568-Y575 PolarHBondContact N-O 3.21Å; A568-Y575 PolarHBondContact O-N 3.16Å; A568-A616 HydrophobicContact CB-CB 4.01Å
569	V	95.2	Very high	92.4	Very high	46 Å²	46	27.4 Å²	27.4	28%	0.279	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	114.9	173.2	178.6	0	0	0	0	107.8	C516 V518 K573 I574 T618	C516-V569 HydrophobicContact CB-CG2 3.88Å; V518-V569 HydrophobicContact CG2-CB 4.46Å; V518-V569 HydrophobicContact CG2-CG1 3.79Å; V518-V569 HydrophobicContact CG2-CG2 3.78Å; V569-K573 CarbonylContact C-O 3.52Å; V569-K573 WeakPolarHBondContact CA-O 3.36Å; V569-I574 HydrophobicContact CG2-CG1 4.49Å; V569-T618 PolarHBondContact O-OG1 3.17Å
570	F	93.4	Very high	92.2	Very high	10 Å²	10	24.4 Å²	24.4	4%	0.044	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.9	-178.3	-177	-100.5	0	0	0	109.4	A349 E373 N572 K573 Y575 T618	A349-F570 VanDerWaalsContact C-CE2 3.49Å; A349-F570 HydrophobicContact CB-CE2 3.96Å; A349-F570 WeakPolarHBondContact O-CE2 3.29Å; A349-F570 WeakPolarHBondContact O-CZ 3.44Å; E373-F570 HydrophobicContact CG-CE1 4.47Å; E373-F570 WeakPolarHBondContact OE1-CE1 3.46Å; F570-N572 VanDerWaalsContact C-N 3.29Å; F570-N572 PolarHBondContact O-N 3.05Å; F570-K573 PolarHBondContact N-O 2.85Å; F570-K573 WeakPolarHBondContact O-CB 3.31Å; F570-K573 PolarHBondContact O-N 2.96Å; F570-Y575 HydrophobicContact CB-CD2 3.85Å; F570-Y575 HydrophobicContact CB-CE2 3.76Å; F570-Y575 HydrophobicContact CD1-CE2 4.06Å; F570-Y575 HydrophobicContact CG-CE2 4.4Å; F570-T618 HydrophobicContact CD2-CG2 3.8Å; F570-T618 HydrophobicContact CE2-CG2 4.4Å
571	E	90.9	Very high	92.2	Very high	120 Å²	120	22 Å²	22	56%	0.561	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	48	47.4	-175	-64.2	-173.7	161	0	0	113.7	K573	E571-K573 PolarHBondContact O-N 2.84Å; E571-K573 VanDerWaalsContact O-N 3.07Å
572	N	93.9	Very high	92.2	Very high	119 Å²	119	24.7 Å²	24.7	64%	0.636	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.1	14.5	-176.7	-61.6	-19.1	0	0	0	115.5	V518 F570 P596	V518-N572 HydrophobicContact CG1-CB 4.37Å; F570-N572 VanDerWaalsContact C-N 3.29Å; F570-N572 PolarHBondContact O-N 3.05Å; N572-P596 WeakPolarHBondContact O-CD 3.41Å
573	K	96.2	Very high	92.1	Very high	54 Å²	54	28.2 Å²	28.2	24%	0.235	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	151.4	174.9	-63.9	173.5	-169.8	141.1	0	109.9	V569 F570 E571 Y575 K593 Y594	V569-K573 CarbonylContact C-O 3.52Å; V569-K573 WeakPolarHBondContact CA-O 3.36Å; F570-K573 PolarHBondContact N-O 2.85Å; F570-K573 WeakPolarHBondContact O-CB 3.31Å; F570-K573 PolarHBondContact O-N 2.96Å; E571-K573 PolarHBondContact O-N 2.84Å; E571-K573 VanDerWaalsContact O-N 3.07Å; K573-Y575 HydrophobicContact CB-CE2 3.97Å; K573-K593 HydrophobicContact CB-CD 4.34Å; K573-K593 HydrophobicContact CB-CG 4Å; K573-K593 HydrophobicContact CD-CD 3.78Å; K573-K593 HydrophobicContact CD-CG 4.27Å; K573-Y594 WeakPolarHBondContact CB-O 3.45Å
574	I	97.3	Very high	91.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	122.6	-178.1	-56.4	169.5	0	0	0	108.6	C516 V518 Y523 I525 V567 V569 K593 Y594	C516-I574 VanDerWaalsContact SG-CD1 3.59Å; V518-I574 HydrophobicContact CG2-CD1 3.84Å; V518-I574 HydrophobicContact CG2-CG1 3.6Å; Y523-I574 HydrophobicContact CD1-CD1 3.86Å; Y523-I574 HydrophobicContact CD2-CD1 3.76Å; Y523-I574 HydrophobicContact CE1-CD1 4.46Å; Y523-I574 HydrophobicContact CE2-CD1 4.38Å; Y523-I574 HydrophobicContact CG-CD1 3.48Å; Y523-I574 VanDerWaalsContact CG-CD1 3.48Å; I525-I574 HydrophobicContact CD1-CB 4.36Å; I525-I574 HydrophobicContact CD1-CD1 3.96Å; I525-I574 HydrophobicContact CD1-CG2 3.54Å; V567-I574 HydrophobicContact CG2-CG2 3.73Å; V569-I574 HydrophobicContact CG2-CG1 4.49Å; I574-K593 CarbonylContact O-C 3.59Å; I574-K593 VanDerWaalsContact O-CA 3.26Å; I574-K593 WeakPolarHBondContact O-CA 3.4Å; I574-Y594 HydrophobicContact CD1-CD1 4.05Å; I574-Y594 PolarHBondContact N-O 3.37Å; I574-Y594 PolarHBondContact O-N 2.96Å
575	Y	95.6	Very high	91.8	Very high	9 Å²	9	40.8 Å²	40.8	4%	0.035	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.8	176.3	-70.2	-99.3	0	0	0	109.9	L351 V567 A568 F570 K573 V591 Q592 K593 V604 F605	L351-Y575 HydrophobicContact CD2-CD1 4.3Å; L351-Y575 HydrophobicContact CD2-CG 4.38Å; V567-Y575 WeakPolarHBondContact CA-O 3.23Å; A568-Y575 PolarHBondContact N-O 3.21Å; A568-Y575 PolarHBondContact O-N 3.16Å; F570-Y575 HydrophobicContact CB-CD2 3.85Å; F570-Y575 HydrophobicContact CB-CE2 3.76Å; F570-Y575 HydrophobicContact CD1-CE2 4.06Å; F570-Y575 HydrophobicContact CG-CE2 4.4Å; K573-Y575 HydrophobicContact CB-CE2 3.97Å; Y575-V591 HydrophobicContact CD1-CG1 4.11Å; Y575-Q592 CarbonylContact C-O 3.55Å; Y575-Q592 WeakPolarHBondContact CA-O 3.41Å; Y575-K593 HydrophobicContact CD1-CB 4.03Å; Y575-K593 HydrophobicContact CD1-CG 4.22Å; Y575-K593 HydrophobicContact CD2-CG 4.47Å; Y575-K593 HydrophobicContact CE1-CB 3.88Å; Y575-K593 HydrophobicContact CE1-CD 3.77Å; Y575-K593 HydrophobicContact CE1-CG 3.79Å; Y575-K593 HydrophobicContact CE2-CD 4.24Å; Y575-K593 HydrophobicContact CE2-CG 4.07Å; Y575-K593 VanDerWaalsContact OH-CD 3.31Å; Y575-K593 WeakPolarHBondContact OH-CD 3.47Å; Y575-V604 HydrophobicContact CE1-CG2 4.3Å; Y575-F605 HydrophobicContact CD1-CE1 4.49Å; Y575-F605 HydrophobicContact CD1-CZ 4.16Å; Y575-F605 HydrophobicContact CE1-CE1 4.15Å; Y575-F605 HydrophobicContact CE1-CZ 4.23Å
576	V	94.8	Very high	91.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	121.6	176	-174.4	0	0	0	0	108.8	I525 M558 Q562 V565 V591 Q592 W601	I525-V576 HydrophobicContact CG2-CG2 3.85Å; M558-V576 HydrophobicContact CE-CB 4.39Å; M558-V576 HydrophobicContact CE-CG1 4Å; M558-V576 HydrophobicContact CE-CG2 4.31Å; Q562-V576 HydrophobicContact CB-CG1 4.49Å; Q562-V576 VanDerWaalsContact OE1-CG1 3.22Å; V565-V576 HydrophobicContact CB-CG1 3.79Å; V565-V576 HydrophobicContact CG1-CG1 3.81Å; V565-V576 HydrophobicContact CG2-CG1 3.73Å; V576-V591 WeakPolarHBondContact O-CA 3.47Å; V576-Q592 HydrophobicContact CB-CB 4.48Å; V576-Q592 PolarHBondContact N-O 2.9Å; V576-Q592 PolarHBondContact O-N 3.06Å; V576-W601 HydrophobicContact CG2-CH2 3.88Å; V576-W601 HydrophobicContact CG2-CZ3 3.86Å
577	V	92	Very high	91.5	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130	-166.1	-176	0	0	0	0	110.4	L351 T353 G566 V591 L607 I614 A616	L351-V577 HydrophobicContact CD2-CG2 4.34Å; T353-V577 HydrophobicContact CG2-CG1 3.8Å; G566-V577 PolarHBondContact N-O 2.86Å; G566-V577 PolarHBondContact O-N 2.94Å; V577-V591 HydrophobicContact CB-CG2 4.39Å; V577-V591 HydrophobicContact CG1-CG2 4Å; V577-V591 HydrophobicContact CG2-CG1 3.85Å; V577-V591 HydrophobicContact CG2-CG2 4.15Å; V577-L607 HydrophobicContact CG1-CD1 3.72Å; V577-L607 HydrophobicContact CG1-CD2 3.68Å; V577-L607 HydrophobicContact CG1-CG 3.98Å; V577-I614 HydrophobicContact CG1-CD1 4.3Å; V577-I614 HydrophobicContact CG1-CG2 4.45Å; V577-I614 WeakPolarHBondContact O-CG2 3.2Å; V577-A616 HydrophobicContact CG2-CB 4.36Å
578	G	89.6	Confident	91.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.207	C	C	.	.			trans	69	-147.7	172.2	0	0	0	0	0	114.6	Q562 V588	Q562-G578 PolarHBondContact NE2-O 3.3Å; G578-V588 WeakPolarHBondContact CA-O 3.28Å
579	G	89.3	Confident	90.7	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.22	C	C	.	.			trans	85.4	-167.9	178	0	0	0	0	0	114	S563 V588 L611	S563-G579 CarbonylContact O-C 3.4Å; S563-G579 WeakPolarHBondContact O-CA 3.34Å; G579-V588 PolarHBondContact O-N 3.23Å; G579-L611 PolarHBondContact N-O 3.05Å
580	Y	88.7	Confident	90.3	Very high	39 Å²	39	44.9 Å²	44.9	15%	0.153	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	136.4	-172	-172.1	-101.8	0	0	0	111.3	S563 W582 R585 C586 M587	S563-Y580 PolarHBondContact N-O 3.25Å; S563-Y580 PolarHBondContact O-N 3.34Å; Y580-W582 AromaticContact CD1-CD2 3.9Å; Y580-W582 HydrophobicContact CD1-CD2 3.9Å; Y580-W582 AromaticContact CD1-CE2 3.88Å; Y580-W582 HydrophobicContact CD1-CE3 4.37Å; Y580-W582 HydrophobicContact CD1-CG 4.14Å; Y580-W582 HydrophobicContact CD1-CZ2 4.41Å; Y580-W582 AromaticContact CD1-NE1 4Å; Y580-W582 AromaticContact CE1-CD2 3.84Å; Y580-W582 HydrophobicContact CE1-CD2 3.84Å; Y580-W582 AromaticContact CE1-CE3 3.88Å; Y580-W582 HydrophobicContact CE1-CE3 3.88Å; Y580-W582 HydrophobicContact CE1-CG 4.26Å; Y580-W582 HydrophobicContact CE1-CZ3 4.35Å; Y580-R585 VanDerWaalsContact CZ-C 3.48Å; Y580-R585 WeakPolarHBondContact OH-CA 3.41Å; Y580-R585 PolarHBondContact OH-O 2.72Å; Y580-R585 VanDerWaalsContact OH-O 3.11Å; Y580-C586 WeakPolarHBondContact CD2-O 3.15Å; Y580-M587 HydrophobicContact CD2-CE 4.11Å; Y580-M587 HydrophobicContact CD2-SD 3.78Å; Y580-M587 HydrophobicContact CG-SD 4.49Å
581	S	91.3	Very high	90.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	123.1	169	170.5	0	0	0	0	109.3	D538 G561 N584 R585 C586	D538-S581 PolarHBondContact OD2-OG 2.92Å; G561-S581 WeakPolarHBondContact O-CB 3.21Å; S581-N584 PolarHBondContact OG-N 3.25Å; S581-N584 PolarHBondContact OG-OD1 2.71Å; S581-R585 WeakPolarHBondContact O-CA 3.22Å; S581-R585 PolarHBondContact O-N 2.96Å; S581-C586 PolarHBondContact N-O 2.86Å; S581-C586 PolarHBondContact O-N 3.05Å
582	W	89.2	Confident	90.4	Very high	61 Å²	61	38.7 Å²	38.7	23%	0.231	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-35.1	177.7	-68.8	92.2	0	0	0	112.2	N528 Y536 D538 S563 Y580 R585	N528-W582 HydrophobicContact CB-CG 4.38Å; N528-W582 WeakPolarHBondContact ND2-CZ2 3.29Å; N528-W582 PolarHBondContact ND2-NE1 2.78Å; Y536-W582 HydrophobicContact CD1-CD2 4.48Å; Y536-W582 HydrophobicContact CD1-CH2 4.44Å; Y536-W582 HydrophobicContact CD1-CZ2 4.44Å; Y536-W582 HydrophobicContact CD2-CD2 4.5Å; Y536-W582 AromaticContact CD2-CE3 3.8Å; Y536-W582 HydrophobicContact CD2-CE3 3.8Å; Y536-W582 AromaticContact CD2-CH2 3.96Å; Y536-W582 HydrophobicContact CD2-CH2 3.96Å; Y536-W582 AromaticContact CD2-CZ3 3.48Å; Y536-W582 HydrophobicContact CD2-CZ3 3.48Å; Y536-W582 VanDerWaalsContact CD2-CZ3 3.48Å; Y536-W582 HydrophobicContact CE2-CH2 4.15Å; Y536-W582 HydrophobicContact CE2-CZ3 4.04Å; Y536-W582 AromaticContact CG-CD2 3.95Å; Y536-W582 HydrophobicContact CG-CD2 3.95Å; Y536-W582 AromaticContact CG-CE3 3.67Å; Y536-W582 HydrophobicContact CG-CE3 3.67Å; Y536-W582 HydrophobicContact CG-CH2 4.11Å; Y536-W582 HydrophobicContact CG-CZ2 4.41Å; Y536-W582 AromaticContact CG-CZ3 3.75Å; Y536-W582 HydrophobicContact CG-CZ3 3.75Å; D538-W582 VanDerWaalsContact CG-N 3.34Å; D538-W582 PolarHBondContact OD1-N 2.8Å; D538-W582 PolarHBondContact OD2-N 2.9Å; D538-W582 VanDerWaalsContact OD2-N 3.09Å; S563-W582 PolarHBondContact OG-NE1 3.02Å; Y580-W582 AromaticContact CD1-CD2 3.9Å; Y580-W582 HydrophobicContact CD1-CD2 3.9Å; Y580-W582 AromaticContact CD1-CE2 3.88Å; Y580-W582 HydrophobicContact CD1-CE3 4.37Å; Y580-W582 HydrophobicContact CD1-CG 4.14Å; Y580-W582 HydrophobicContact CD1-CZ2 4.41Å; Y580-W582 AromaticContact CD1-NE1 4Å; Y580-W582 AromaticContact CE1-CD2 3.84Å; Y580-W582 HydrophobicContact CE1-CD2 3.84Å; Y580-W582 AromaticContact CE1-CE3 3.88Å; Y580-W582 HydrophobicContact CE1-CE3 3.88Å; Y580-W582 HydrophobicContact CE1-CG 4.26Å; Y580-W582 HydrophobicContact CE1-CZ3 4.35Å; W582-R585 VanDerWaalsContact O-CG 3.24Å; W582-R585 WeakPolarHBondContact O-CG 3.45Å; W582-R585 PolarHBondContact O-N 2.92Å
583	N	88.9	Confident	90.5	Very high	76 Å²	76	34.3 Å²	34.3	41%	0.406	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-41.8	178.3	-77.6	-25.1	0	0	0	112.2	D537 D538	D537-N583 VanDerWaalsContact OD1-CG 3.26Å; D537-N583 PolarHBondContact OD1-ND2 2.8Å; D537-N583 PolarHBondContact OD1-OD1 3.35Å; D538-N583 WeakPolarHBondContact OD2-CB 3.37Å; D538-N583 PolarHBondContact OD2-N 3.09Å
584	N	86.3	Confident	90.6	Very high	107 Å²	107	31.9 Å²	31.9	57%	0.572	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-7.6	178.4	-65.7	74.5	0	0	0	113.1	S581 C586	S581-N584 PolarHBondContact OG-N 3.25Å; S581-N584 PolarHBondContact OG-OD1 2.71Å; N584-C586 VanDerWaalsContact CB-SG 3.55Å; N584-C586 PolarHBondContact O-N 2.87Å
585	R	86.4	Confident	90.6	Very high	184 Å²	184	32.5 Å²	32.5	69%	0.694	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	35.5	-178.4	-59.6	-176.5	176.8	-173.9	-2.7	114	Y580 S581 W582	Y580-R585 VanDerWaalsContact CZ-C 3.48Å; Y580-R585 WeakPolarHBondContact OH-CA 3.41Å; Y580-R585 PolarHBondContact OH-O 2.72Å; Y580-R585 VanDerWaalsContact OH-O 3.11Å; S581-R585 WeakPolarHBondContact O-CA 3.22Å; S581-R585 PolarHBondContact O-N 2.96Å; W582-R585 VanDerWaalsContact O-CG 3.24Å; W582-R585 WeakPolarHBondContact O-CG 3.45Å; W582-R585 PolarHBondContact O-N 2.92Å
586	C	86.6	Confident	90.6	Very high	44 Å²	44	33.2 Å²	33.2	30%	0.297	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	159.3	-176.1	64.2	0	0	0	0	112.6	R560 Y580 S581 N584	R560-C586 PolarHBondContact NH2-SG 3.37Å; Y580-C586 WeakPolarHBondContact CD2-O 3.15Å; S581-C586 PolarHBondContact N-O 2.86Å; S581-C586 PolarHBondContact O-N 3.05Å; N584-C586 VanDerWaalsContact CB-SG 3.55Å; N584-C586 PolarHBondContact O-N 2.87Å
587	M	86.8	Confident	90.7	Very high	32 Å²	32	41.6 Å²	41.6	16%	0.158	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	149	168.8	-67.6	-58.3	178.8	0	0	110.1	R359 Y580 S610	R359-M587 HydrophobicContact CB-CE 3.27Å; R359-M587 VanDerWaalsContact CD-CE 3.46Å; R359-M587 HydrophobicContact CG-CE 4.02Å; Y580-M587 HydrophobicContact CD2-CE 4.11Å; Y580-M587 HydrophobicContact CD2-SD 3.78Å; Y580-M587 HydrophobicContact CG-SD 4.49Å; M587-S610 VanDerWaalsContact CB-CB 3.46Å
588	V	86.7	Confident	91	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.222	C	C	.	.			trans	-106.7	110.5	-176.3	-176.5	0	0	0	0	109.3	Q562 G578 G579 I590	Q562-V588 HydrophobicContact CG-CB 4.16Å; Q562-V588 HydrophobicContact CG-CG1 3.9Å; Q562-V588 HydrophobicContact CG-CG2 4.11Å; G578-V588 WeakPolarHBondContact CA-O 3.28Å; G579-V588 PolarHBondContact O-N 3.23Å; V588-I590 HydrophobicContact CG1-CB 4.46Å; V588-I590 HydrophobicContact CG1-CG1 3.56Å
589	E	85	Confident	91.3	Very high	70 Å²	70	50.7 Å²	50.7	33%	0.327	24%	0.238	S	C	.	.			trans	-76.4	-25.2	172	55.9	-84.2	164.4	0	0	113.6	D606 L607 S610	E589-D606 HydrophobicContact CG-CB 4.45Å; E589-L607 PolarHBondContact O-N 2.94Å; E589-S610 WeakPolarHBondContact CB-OG 3.38Å; E589-S610 PolarHBondContact OE2-OG 3.41Å
590	I	88.6	Confident	91.7	Very high	18 Å²	18	55.5 Å²	55.5	9%	0.092	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	138.4	-171.9	74.1	169.7	0	0	0	110.9	R560 Q562 V588 Q592 K603 D606	R560-I590 HydrophobicContact CB-CD1 3.81Å; R560-I590 HydrophobicContact CG-CD1 4.47Å; Q562-I590 PolarHBondContact NE2-O 3.14Å; V588-I590 HydrophobicContact CG1-CB 4.46Å; V588-I590 HydrophobicContact CG1-CG1 3.56Å; I590-Q592 HydrophobicContact CD1-CG 3.88Å; I590-Q592 HydrophobicContact CG1-CG 4.13Å; I590-K603 HydrophobicContact CB-CD 4.41Å; I590-K603 HydrophobicContact CB-CG 4.45Å; I590-K603 HydrophobicContact CG2-CD 4.15Å; I590-D606 WeakPolarHBondContact CG2-OD1 3.32Å
591	V	91.5	Very high	92.1	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	123.4	166.5	179.1	0	0	0	0	109	W378 Y575 V576 V577 V604 F605 L607	W378-V591 HydrophobicContact CZ2-CG2 4.44Å; Y575-V591 HydrophobicContact CD1-CG1 4.11Å; V576-V591 WeakPolarHBondContact O-CA 3.47Å; V577-V591 HydrophobicContact CB-CG2 4.39Å; V577-V591 HydrophobicContact CG1-CG2 4Å; V577-V591 HydrophobicContact CG2-CG1 3.85Å; V577-V591 HydrophobicContact CG2-CG2 4.15Å; V591-V604 PolarHBondContact O-N 3.15Å; V591-F605 HydrophobicContact CB-CD2 3.6Å; V591-F605 HydrophobicContact CB-CE2 3.54Å; V591-F605 HydrophobicContact CB-CG 4.33Å; V591-F605 HydrophobicContact CB-CZ 4.19Å; V591-F605 WeakPolarHBondContact CB-O 3.33Å; V591-F605 HydrophobicContact CG1-CD2 4.08Å; V591-F605 HydrophobicContact CG1-CE1 4.49Å; V591-F605 HydrophobicContact CG1-CE2 3.49Å; V591-F605 VanDerWaalsContact CG1-CE2 3.49Å; V591-F605 HydrophobicContact CG1-CZ 3.72Å; V591-F605 HydrophobicContact CG2-CD2 3.54Å; V591-F605 HydrophobicContact CG2-CE2 3.5Å; V591-F605 PolarHBondContact N-O 3.26Å; V591-L607 HydrophobicContact CG2-CD2 4.47Å; V591-L607 HydrophobicContact CG2-CG 4.07Å
592	Q	94	Very high	92.4	Very high	0 Å²	0	58 Å²	58	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	135.7	178.6	-60.9	-173.4	78.8	0	0	109.5	R560 Y575 V576 I590 W601 Q602	R560-Q592 VanDerWaalsContact N-OE1 3.16Å; R560-Q592 PolarHBondContact O-NE2 2.96Å; Y575-Q592 CarbonylContact C-O 3.55Å; Y575-Q592 WeakPolarHBondContact CA-O 3.41Å; V576-Q592 HydrophobicContact CB-CB 4.48Å; V576-Q592 PolarHBondContact N-O 2.9Å; V576-Q592 PolarHBondContact O-N 3.06Å; I590-Q592 HydrophobicContact CD1-CG 3.88Å; I590-Q592 HydrophobicContact CG1-CG 4.13Å; Q592-W601 HydrophobicContact CB-CE3 3.87Å; Q592-W601 HydrophobicContact CB-CZ3 3.98Å; Q592-Q602 WeakPolarHBondContact CA-O 3.27Å
593	K	95.8	Very high	92.5	Very high	27 Å²	27	60.6 Å²	60.6	12%	0.117	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	128.3	175.8	178.2	-167.3	77.3	-164.2	0	109.5	K573 I574 Y575 W601 Q602 V604	K573-K593 HydrophobicContact CB-CD 4.34Å; K573-K593 HydrophobicContact CB-CG 4Å; K573-K593 HydrophobicContact CD-CD 3.78Å; K573-K593 HydrophobicContact CD-CG 4.27Å; I574-K593 CarbonylContact O-C 3.59Å; I574-K593 VanDerWaalsContact O-CA 3.26Å; I574-K593 WeakPolarHBondContact O-CA 3.4Å; Y575-K593 HydrophobicContact CD1-CB 4.03Å; Y575-K593 HydrophobicContact CD1-CG 4.22Å; Y575-K593 HydrophobicContact CD2-CG 4.47Å; Y575-K593 HydrophobicContact CE1-CB 3.88Å; Y575-K593 HydrophobicContact CE1-CD 3.77Å; Y575-K593 HydrophobicContact CE1-CG 3.79Å; Y575-K593 HydrophobicContact CE2-CD 4.24Å; Y575-K593 HydrophobicContact CE2-CG 4.07Å; Y575-K593 VanDerWaalsContact OH-CD 3.31Å; Y575-K593 WeakPolarHBondContact OH-CD 3.47Å; K593-W601 CarbonylContact O-C 3.57Å; K593-W601 WeakPolarHBondContact O-CA 3.36Å; K593-Q602 PolarHBondContact N-O 3.1Å; K593-Q602 PolarHBondContact O-N 3.03Å; K593-V604 HydrophobicContact CB-CG2 3.23Å; K593-V604 HydrophobicContact CD-CG2 3.95Å; K593-V604 HydrophobicContact CG-CG2 4.22Å
594	Y	97.8	Very high	92.5	Very high	3 Å²	3	59.5 Å²	59.5	1%	0.012	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	134	171.4	178.9	-106.8	0	0	0	110.2	Y523 I555 A556 K573 I574 P596 D599 E600 W601	Y523-Y594 HydrophobicContact CD1-CE1 4.11Å; Y523-Y594 AromaticContact CE1-CE1 3.7Å; Y523-Y594 HydrophobicContact CE1-CE1 3.7Å; I555-Y594 WeakPolarHBondContact CB-OH 3.48Å; I555-Y594 HydrophobicContact CD1-CE1 3.86Å; I555-Y594 HydrophobicContact CD1-CE2 4.07Å; I555-Y594 WeakPolarHBondContact CG2-OH 2.94Å; A556-Y594 HydrophobicContact CB-CE2 4.38Å; K573-Y594 WeakPolarHBondContact CB-O 3.45Å; I574-Y594 HydrophobicContact CD1-CD1 4.05Å; I574-Y594 PolarHBondContact N-O 3.37Å; I574-Y594 PolarHBondContact O-N 2.96Å; Y594-P596 HydrophobicContact CD1-CG 3.94Å; Y594-P596 HydrophobicContact CE1-CB 4.09Å; Y594-P596 HydrophobicContact CE1-CG 3.93Å; Y594-P596 WeakPolarHBondContact O-CD 3.3Å; Y594-D599 VanDerWaalsContact CE2-OD1 3.32Å; Y594-D599 WeakPolarHBondContact CE2-OD1 3.47Å; Y594-D599 PolarHBondContact OH-OD1 3.43Å; Y594-E600 WeakPolarHBondContact CA-O 3.34Å; Y594-E600 WeakPolarHBondContact CD2-O 3.21Å; Y594-W601 AromaticContact CD2-CD1 3.75Å; Y594-W601 AromaticContact CD2-CD2 3.88Å; Y594-W601 HydrophobicContact CD2-CD2 3.88Å; Y594-W601 AromaticContact CD2-CE2 3.55Å; Y594-W601 HydrophobicContact CD2-CG 4.01Å; Y594-W601 HydrophobicContact CD2-CZ2 4.05Å; Y594-W601 AromaticContact CD2-NE1 3.45Å; Y594-W601 AromaticContact CE2-NE1 3.97Å; Y594-W601 HydrophobicContact CG-CD2 4.27Å; Y594-W601 AromaticContact CG-CE2 3.94Å; Y594-W601 HydrophobicContact CG-CH2 4.38Å; Y594-W601 HydrophobicContact CG-CZ2 4.01Å
595	D	97.5	Very high	92.4	Very high	13 Å²	13	55.3 Å²	55.3	7%	0.07	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	104.3	173.8	-170.4	-30.2	0	0	0	109.5	E597 K598 D599 E600	D595-E597 PolarHBondContact O-N 3.1Å; D595-E597 PolarHBondContact OD1-N 3.03Å; D595-K598 HydrophobicContact CB-CB 4.33Å; D595-K598 PolarHBondContact O-N 3.17Å; D595-D599 PolarHBondContact O-N 3.43Å; D595-E600 PolarHBondContact N-O 3.32Å
596	P	97	Very high	92.4	Very high	24 Å²	24	50 Å²	50	16%	0.156	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-22.3	-178.9	-26.6	36.9	0	0	0	115.4	V518 N572 Y594	V518-P596 HydrophobicContact CG1-CG 4.28Å; N572-P596 WeakPolarHBondContact O-CD 3.41Å; Y594-P596 HydrophobicContact CD1-CG 3.94Å; Y594-P596 HydrophobicContact CE1-CB 4.09Å; Y594-P596 HydrophobicContact CE1-CG 3.93Å; Y594-P596 WeakPolarHBondContact O-CD 3.3Å
597	E	96.3	Very high	92.2	Very high	176 Å²	176	48.5 Å²	48.5	82%	0.822	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-31.8	179.4	-63	-172.3	162.3	0	0	111.6	D595	D595-E597 PolarHBondContact O-N 3.1Å; D595-E597 PolarHBondContact OD1-N 3.03Å
598	K	97	Very high	91.9	Very high	125 Å²	125	50.7 Å²	50.7	54%	0.543	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-16.7	-178	-63.1	-179.2	-177.4	174.7	0	113.8	D595 E600	D595-K598 HydrophobicContact CB-CB 4.33Å; D595-K598 PolarHBondContact O-N 3.17Å; K598-E600 HydrophobicContact CB-CB 4.2Å; K598-E600 HydrophobicContact CB-CG 4.15Å
599	D	97.6	Very high	91.6	Very high	66 Å²	66	53.7 Å²	53.7	35%	0.353	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.4	49.8	-168.7	-168.6	27.6	0	0	0	112.1	I555 A556 Y594 D595	I555-D599 VanDerWaalsContact CB-OD1 3.26Å; I555-D599 WeakPolarHBondContact CB-OD1 3.25Å; A556-D599 WeakPolarHBondContact CB-O 3.41Å; A556-D599 WeakPolarHBondContact CB-OD1 3.28Å; A556-D599 PolarHBondContact N-OD1 2.7Å; A556-D599 PolarHBondContact N-OD2 2.93Å; Y594-D599 VanDerWaalsContact CE2-OD1 3.32Å; Y594-D599 WeakPolarHBondContact CE2-OD1 3.47Å; Y594-D599 PolarHBondContact OH-OD1 3.43Å; D595-D599 PolarHBondContact O-N 3.43Å
600	E	97.4	Very high	91.4	Very high	101 Å²	101	52.3 Å²	52.3	47%	0.472	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	142.1	-175.3	-73.1	179.5	173.5	0	0	112.3	Y594 D595 K598	Y594-E600 WeakPolarHBondContact CA-O 3.34Å; Y594-E600 WeakPolarHBondContact CD2-O 3.21Å; D595-E600 PolarHBondContact N-O 3.32Å; K598-E600 HydrophobicContact CB-CB 4.2Å; K598-E600 HydrophobicContact CB-CG 4.15Å
601	W	97.4	Very high	91	Very high	22 Å²	22	52 Å²	52	8%	0.083	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	141.6	171.4	-71.7	92.9	0	0	0	111.5	I525 A556 M558 L559 V576 Q592 K593 Y594	I525-W601 HydrophobicContact CD1-CH2 4.04Å; I525-W601 HydrophobicContact CD1-CZ2 4.4Å; I525-W601 HydrophobicContact CG1-CH2 4.27Å; I525-W601 HydrophobicContact CG1-CZ2 4.28Å; I525-W601 HydrophobicContact CG2-CH2 3.64Å; I525-W601 HydrophobicContact CG2-CZ2 4.01Å; A556-W601 PolarHBondContact O-NE1 3Å; M558-W601 HydrophobicContact CG-CH2 4.21Å; M558-W601 HydrophobicContact CG-CZ2 3.86Å; L559-W601 HydrophobicContact CD1-CB 4.2Å; L559-W601 HydrophobicContact CD2-CB 4.06Å; L559-W601 HydrophobicContact CG-CB 3.78Å; V576-W601 HydrophobicContact CG2-CH2 3.88Å; V576-W601 HydrophobicContact CG2-CZ3 3.86Å; Q592-W601 HydrophobicContact CB-CE3 3.87Å; Q592-W601 HydrophobicContact CB-CZ3 3.98Å; K593-W601 CarbonylContact O-C 3.57Å; K593-W601 WeakPolarHBondContact O-CA 3.36Å; Y594-W601 AromaticContact CD2-CD1 3.75Å; Y594-W601 AromaticContact CD2-CD2 3.88Å; Y594-W601 HydrophobicContact CD2-CD2 3.88Å; Y594-W601 AromaticContact CD2-CE2 3.55Å; Y594-W601 HydrophobicContact CD2-CG 4.01Å; Y594-W601 HydrophobicContact CD2-CZ2 4.05Å; Y594-W601 AromaticContact CD2-NE1 3.45Å; Y594-W601 AromaticContact CE2-NE1 3.97Å; Y594-W601 HydrophobicContact CG-CD2 4.27Å; Y594-W601 AromaticContact CG-CE2 3.94Å; Y594-W601 HydrophobicContact CG-CH2 4.38Å; Y594-W601 HydrophobicContact CG-CZ2 4.01Å
602	Q	95.7	Very high	90.5	Very high	69 Å²	69	52.3 Å²	52.3	32%	0.322	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	137.7	177.1	-63.3	175.5	2.1	0	0	110.3	Q592 K593	Q592-Q602 WeakPolarHBondContact CA-O 3.27Å; K593-Q602 PolarHBondContact N-O 3.1Å; K593-Q602 PolarHBondContact O-N 3.03Å
603	K	93.1	Very high	89.8	Confident	115 Å²	115	52.3 Å²	52.3	50%	0.5	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	129.4	161.4	177.1	-179.1	173.2	175.1	0	107.9	I590 D606	I590-K603 HydrophobicContact CB-CD 4.41Å; I590-K603 HydrophobicContact CB-CG 4.45Å; I590-K603 HydrophobicContact CG2-CD 4.15Å; K603-D606 WeakPolarHBondContact CE-OD1 3.4Å; K603-D606 VanDerWaalsContact NZ-CG 3.28Å; K603-D606 IonicContact NZ-OD1 3.78Å; K603-D606 PolarHBondContact NZ-OD1 3.16Å; K603-D606 IonicContact NZ-OD2 2.86Å; K603-D606 PolarHBondContact NZ-OD2 2.86Å
604	V	88.2	Confident	89.5	Confident	53 Å²	53	51.2 Å²	51.2	32%	0.321	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	-54.9	-177.3	-158.7	0	0	0	0	112.3	Y575 V591 K593	Y575-V604 HydrophobicContact CE1-CG2 4.3Å; V591-V604 PolarHBondContact O-N 3.15Å; K593-V604 HydrophobicContact CB-CG2 3.23Å; K593-V604 HydrophobicContact CD-CG2 3.95Å; K593-V604 HydrophobicContact CG-CG2 4.22Å
605	F	84.4	Confident	89.2	Confident	19 Å²	19	52.8 Å²	52.8	8%	0.083	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	167	-178.8	38.5	-93.2	0	0	0	110.3	L351 F371 W378 Y575 V591	L351-F605 HydrophobicContact CD2-CE2 4.23Å; L351-F605 HydrophobicContact CD2-CZ 3.84Å; F371-F605 HydrophobicContact CD1-CD1 4.33Å; F371-F605 AromaticContact CD1-CE1 3.66Å; F371-F605 HydrophobicContact CD1-CE1 3.66Å; F371-F605 HydrophobicContact CD1-CE2 4.44Å; F371-F605 AromaticContact CD1-CZ 3.71Å; F371-F605 HydrophobicContact CD1-CZ 3.71Å; F371-F605 HydrophobicContact CD2-CD1 4.32Å; F371-F605 HydrophobicContact CD2-CD2 4.11Å; F371-F605 HydrophobicContact CD2-CE1 4.23Å; F371-F605 AromaticContact CD2-CE2 3.98Å; F371-F605 HydrophobicContact CD2-CE2 3.98Å; F371-F605 HydrophobicContact CD2-CG 4.28Å; F371-F605 HydrophobicContact CD2-CZ 4.06Å; F371-F605 AromaticContact CE1-CD1 3.57Å; F371-F605 HydrophobicContact CE1-CD1 3.57Å; F371-F605 AromaticContact CE1-CE1 3.19Å; F371-F605 HydrophobicContact CE1-CE1 3.19Å; F371-F605 HydrophobicContact CE1-CG 4.43Å; F371-F605 AromaticContact CE1-CZ 3.76Å; F371-F605 HydrophobicContact CE1-CZ 3.76Å; F371-F605 HydrophobicContact CE2-CB 4.16Å; F371-F605 AromaticContact CE2-CD1 3.55Å; F371-F605 HydrophobicContact CE2-CD1 3.55Å; F371-F605 AromaticContact CE2-CD2 3.88Å; F371-F605 HydrophobicContact CE2-CD2 3.88Å; F371-F605 AromaticContact CE2-CE1 3.84Å; F371-F605 HydrophobicContact CE2-CE1 3.84Å; F371-F605 HydrophobicContact CE2-CE2 4.11Å; F371-F605 AromaticContact CE2-CG 3.6Å; F371-F605 HydrophobicContact CE2-CG 3.6Å; F371-F605 HydrophobicContact CE2-CZ 4.11Å; F371-F605 HydrophobicContact CG-CE1 4.16Å; F371-F605 HydrophobicContact CG-CE2 4.16Å; F371-F605 AromaticContact CG-CZ 3.88Å; F371-F605 HydrophobicContact CG-CZ 3.88Å; F371-F605 HydrophobicContact CZ-CB 4.34Å; F371-F605 AromaticContact CZ-CD1 3.12Å; F371-F605 HydrophobicContact CZ-CD1 3.12Å; F371-F605 HydrophobicContact CZ-CD2 4.3Å; F371-F605 AromaticContact CZ-CE1 3.31Å; F371-F605 HydrophobicContact CZ-CE1 3.31Å; F371-F605 HydrophobicContact CZ-CE2 4.4Å; F371-F605 AromaticContact CZ-CG 3.69Å; F371-F605 HydrophobicContact CZ-CG 3.69Å; F371-F605 AromaticContact CZ-CZ 3.97Å; F371-F605 HydrophobicContact CZ-CZ 3.97Å; W378-F605 HydrophobicContact CH2-CE2 4.07Å; W378-F605 AromaticContact CZ2-CD2 3.76Å; W378-F605 HydrophobicContact CZ2-CD2 3.76Å; W378-F605 AromaticContact CZ2-CE2 3.41Å; W378-F605 HydrophobicContact CZ2-CE2 3.41Å; W378-F605 VanDerWaalsContact CZ2-CE2 3.41Å; W378-F605 AromaticContact NE1-CD2 3.94Å; Y575-F605 HydrophobicContact CD1-CE1 4.49Å; Y575-F605 HydrophobicContact CD1-CZ 4.16Å; Y575-F605 HydrophobicContact CE1-CE1 4.15Å; Y575-F605 HydrophobicContact CE1-CZ 4.23Å; V591-F605 HydrophobicContact CB-CD2 3.6Å; V591-F605 HydrophobicContact CB-CE2 3.54Å; V591-F605 HydrophobicContact CB-CG 4.33Å; V591-F605 HydrophobicContact CB-CZ 4.19Å; V591-F605 WeakPolarHBondContact CB-O 3.33Å; V591-F605 HydrophobicContact CG1-CD2 4.08Å; V591-F605 HydrophobicContact CG1-CE1 4.49Å; V591-F605 HydrophobicContact CG1-CE2 3.49Å; V591-F605 VanDerWaalsContact CG1-CE2 3.49Å; V591-F605 HydrophobicContact CG1-CZ 3.72Å; V591-F605 HydrophobicContact CG2-CD2 3.54Å; V591-F605 HydrophobicContact CG2-CE2 3.5Å; V591-F605 PolarHBondContact N-O 3.26Å
606	D	86.2	Confident	89	Confident	73 Å²	73	52.3 Å²	52.3	39%	0.39	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	141.2	173.4	-65.8	-32	0	0	0	109.3	W378 E589 I590 K603	W378-D606 PolarHBondContact NE1-O 2.65Å; E589-D606 HydrophobicContact CG-CB 4.45Å; I590-D606 WeakPolarHBondContact CG2-OD1 3.32Å; K603-D606 WeakPolarHBondContact CE-OD1 3.4Å; K603-D606 VanDerWaalsContact NZ-CG 3.28Å; K603-D606 IonicContact NZ-OD1 3.78Å; K603-D606 PolarHBondContact NZ-OD1 3.16Å; K603-D606 IonicContact NZ-OD2 2.86Å; K603-D606 PolarHBondContact NZ-OD2 2.86Å
607	L	82.9	Confident	88.9	Confident	13 Å²	13	51.7 Å²	51.7	7%	0.068	26%	0.259	C	S	.	.			trans	-66.2	143.6	167.3	-75.8	169.6	0	0	0	109.1	W378 V577 E589 V591 E609 I614	W378-L607 HydrophobicContact CH2-CD2 4.06Å; W378-L607 HydrophobicContact CZ2-CD2 3.49Å; W378-L607 VanDerWaalsContact CZ2-CD2 3.49Å; V577-L607 HydrophobicContact CG1-CD1 3.72Å; V577-L607 HydrophobicContact CG1-CD2 3.68Å; V577-L607 HydrophobicContact CG1-CG 3.98Å; E589-L607 PolarHBondContact O-N 2.94Å; V591-L607 HydrophobicContact CG2-CD2 4.47Å; V591-L607 HydrophobicContact CG2-CG 4.07Å; L607-E609 WeakPolarHBondContact CB-O 3.27Å; L607-E609 PolarHBondContact O-N 3.24Å; L607-I614 HydrophobicContact CD1-CD1 4.45Å; L607-I614 HydrophobicContact CD2-CD1 4.46Å
608	P	80.1	Confident	88.8	Confident	78 Å²	78	45.5 Å²	45.5	51%	0.506	23%	0.233	S	C	.	.	S	Bend	trans	-66.6	-24.8	176.2	-15.2	29.5	0	0	0	111.8	R369 W378	R369-P608 VanDerWaalsContact NH1-CB 3.31Å; R369-P608 VanDerWaalsContact NH1-CG 3.3Å; W378-P608 HydrophobicContact CB-CG 3.98Å; W378-P608 VanDerWaalsContact CD1-CD 3.48Å; W378-P608 HydrophobicContact CG-CG 3.91Å
609	E	80.4	Confident	88.6	Confident	62 Å²	62	40 Å²	40	29%	0.29	21%	0.209	S	C	.	.	S	Bend	trans	-136.2	132.2	175.3	-71.7	165	-129.5	0	0	110.3	R369 L607 L611	R369-E609 IonicContact CZ-OE1 3.17Å; R369-E609 IonicContact NH1-OE1 3.83Å; R369-E609 IonicContact NH2-OE1 3.37Å; R369-E609 PolarHBondContact NH2-OE1 3.06Å; L607-E609 WeakPolarHBondContact CB-O 3.27Å; L607-E609 PolarHBondContact O-N 3.24Å; E609-L611 HydrophobicContact CB-CG 4.28Å; E609-L611 PolarHBondContact O-N 3.32Å
610	S	80.9	Confident	88.3	Confident	41 Å²	41	38.7 Å²	38.7	29%	0.287	20%	0.203	S	C	.	.			trans	-77.2	91.5	178.2	-36.3	0	0	0	0	110.3	M587 E589	M587-S610 VanDerWaalsContact CB-CB 3.46Å; E589-S610 WeakPolarHBondContact CB-OG 3.38Å; E589-S610 PolarHBondContact OE2-OG 3.41Å
611	L	80.3	Confident	87.8	Confident	13 Å²	13	34.4 Å²	34.4	7%	0.068	18%	0.184	C	C	.	.			trans	-98.1	134.8	-176.7	-66.4	167	0	0	0	112.2	L358 G579 E609 I614	L358-L611 HydrophobicContact CB-CD2 4.48Å; L358-L611 HydrophobicContact CD1-CD2 3.44Å; L358-L611 VanDerWaalsContact CD1-CD2 3.44Å; L358-L611 HydrophobicContact CG-CD2 3.59Å; G579-L611 PolarHBondContact N-O 3.05Å; E609-L611 HydrophobicContact CB-CG 4.28Å; E609-L611 PolarHBondContact O-N 3.32Å; L611-I614 HydrophobicContact CB-CB 4.29Å; L611-I614 HydrophobicContact CB-CD1 4.39Å; L611-I614 HydrophobicContact CD1-CD1 4.1Å
612	G	80.4	Confident	86.9	Confident	6 Å²	6	37.7 Å²	37.7	6%	0.062	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	-90.1	147.4	167.9	0	0	0	0	0	111.6	G356 V357 I614	G356-G612 CarbonylContact C-O 3.5Å; G356-G612 VanDerWaalsContact CA-O 3.23Å; G356-G612 WeakPolarHBondContact CA-O 3.31Å; V357-G612 PolarHBondContact N-O 3.04Å; V357-G612 PolarHBondContact O-N 3.01Å; G612-I614 PolarHBondContact O-N 2.84Å
613	G	80.1	Confident	85.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.198	C	C	.	.	S	Bend	trans	63.6	23.7	177.9	0	0	0	0	0	114.2	D564	D564-G613 VanDerWaalsContact CG-CA 3.46Å; D564-G613 WeakPolarHBondContact O-CA 3.27Å; D564-G613 PolarHBondContact O-N 3.11Å; D564-G613 VanDerWaalsContact O-N 3.17Å; D564-G613 WeakPolarHBondContact OD2-CA 3.4Å; D564-G613 PolarHBondContact OD2-N 3.04Å
614	I	88.6	Confident	84.6	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.015	19%	0.187	C	C	.	.			trans	-66.7	146.7	171.3	-165.1	170.5	0	0	0	108.9	T353 V565 G566 V577 L607 L611 G612	T353-I614 HydrophobicContact CG2-CD1 4.23Å; V565-I614 CarbonylContact C-O 3.52Å; G566-I614 WeakPolarHBondContact CA-O 3.41Å; G566-I614 PolarHBondContact N-O 2.9Å; V577-I614 HydrophobicContact CG1-CD1 4.3Å; V577-I614 HydrophobicContact CG1-CG2 4.45Å; V577-I614 WeakPolarHBondContact O-CG2 3.2Å; L607-I614 HydrophobicContact CD1-CD1 4.45Å; L607-I614 HydrophobicContact CD2-CD1 4.46Å; L611-I614 HydrophobicContact CB-CB 4.29Å; L611-I614 HydrophobicContact CB-CD1 4.39Å; L611-I614 HydrophobicContact CD1-CD1 4.1Å; G612-I614 PolarHBondContact O-N 2.84Å
615	R	91.9	Very high	83.4	Confident	36 Å²	36	36.8 Å²	36.8	14%	0.136	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	149.9	171.8	-60.8	-58.9	-177.8	-129.9	-1.1	109.9	T353 L354 H391 I393 D564 V565	T353-R615 CarbonylContact C-O 3.58Å; T353-R615 VanDerWaalsContact CA-O 3.29Å; T353-R615 WeakPolarHBondContact CA-O 3.37Å; L354-R615 HydrophobicContact CD2-CB 4.25Å; L354-R615 HydrophobicContact CG-CB 4.27Å; L354-R615 PolarHBondContact N-O 2.6Å; L354-R615 PolarHBondContact O-N 3.28Å; L354-R615 VanDerWaalsContact O-N 3.09Å; H391-R615 WeakPolarHBondContact NE2-CG 3.42Å; H391-R615 PolarHBondContact O-NE 3.39Å; I393-R615 HydrophobicContact CB-CB 4.48Å; I393-R615 HydrophobicContact CD1-CB 3.74Å; I393-R615 HydrophobicContact CG1-CB 3.9Å; I393-R615 HydrophobicContact CG1-CG 4.32Å; I393-R615 HydrophobicContact CG2-CB 3.74Å; I393-R615 HydrophobicContact CG2-CG 4.08Å; D564-R615 IonicContact OD1-CZ 3.13Å; D564-R615 IonicContact OD1-NH1 2.66Å; D564-R615 PolarHBondContact OD1-NH1 3.41Å; D564-R615 IonicContact OD1-NH2 2.62Å; D564-R615 PolarHBondContact OD1-NH2 3.11Å; V565-R615 PolarHBondContact O-NH1 3.22Å
616	A	93.7	Very high	81.7	Confident	4 Å²	4	41.7 Å²	41.7	3%	0.033	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	142.3	-179.1	0	0	0	0	0	109.9	L351 V352 T353 I393 A568 V577	L351-A616 HydrophobicContact CD1-CB 4.33Å; V352-A616 CarbonylContact O-C 3.44Å; V352-A616 VanDerWaalsContact O-CA 3.27Å; V352-A616 WeakPolarHBondContact O-CA 3.46Å; T353-A616 HydrophobicContact CG2-CB 4.3Å; I393-A616 WeakPolarHBondContact CD1-O 3.34Å; A568-A616 HydrophobicContact CB-CB 4.01Å; V577-A616 HydrophobicContact CG2-CB 4.36Å
617	C	94.7	Very high	79.4	Confident	11 Å²	11	45 Å²	45	7%	0.074	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	174	175.1	61.9	0	0	0	0	110.3	V352 I393 V395	V352-C617 PolarHBondContact N-O 2.89Å; V352-C617 PolarHBondContact O-N 3.11Å; I393-C617 HydrophobicContact CD1-CB 3.92Å; V395-C617 HydrophobicContact CG2-CB 4.15Å
618	T	94.1	Very high	77	Confident	45 Å²	45	50.3 Å²	50.3	28%	0.276	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	127	171	-60.8	0	0	0	0	108.5	A349 H350 V569 F570	A349-T618 HydrophobicContact CB-CG2 3.81Å; H350-T618 WeakPolarHBondContact O-CA 3.36Å; V569-T618 PolarHBondContact O-OG1 3.17Å; F570-T618 HydrophobicContact CD2-CG2 3.8Å; F570-T618 HydrophobicContact CE2-CG2 4.4Å
619	L	92.9	Very high	74.6	Confident	11 Å²	11	48.9 Å²	48.9	6%	0.058	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	144.2	179.1	-70.6	170.6	0	0	0	110	A349 H350 V352 V395 L400 V621	A349-L619 CarbonylContact C-O 3.59Å; H350-L619 PolarHBondContact N-O 3.4Å; H350-L619 PolarHBondContact O-N 3.47Å; H350-L619 VanDerWaalsContact O-N 3.07Å; V352-L619 HydrophobicContact CB-CD1 4.32Å; V352-L619 HydrophobicContact CG1-CD1 4.39Å; V352-L619 HydrophobicContact CG2-CB 4.11Å; V352-L619 HydrophobicContact CG2-CD1 4.27Å; V395-L619 HydrophobicContact CB-CD2 4.43Å; V395-L619 HydrophobicContact CG1-CD2 3.69Å; V395-L619 HydrophobicContact CG2-CD2 3.79Å; L400-L619 HydrophobicContact CB-CD1 4.02Å; L400-L619 HydrophobicContact CB-CD2 4.5Å; L400-L619 HydrophobicContact CD2-CD1 4.08Å; L400-L619 HydrophobicContact CG-CD1 4.46Å; L619-V621 HydrophobicContact CB-CG1 3.97Å
620	T	91.1	Very high	72	Confident	37 Å²	37	50.9 Å²	50.9	23%	0.227	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	115.1	166.8	-57	0	0	0	0	107.5	I344 S346 S348 N398	I344-T620 HydrophobicContact CD1-CG2 4.17Å; I344-T620 VanDerWaalsContact CD1-O 3.22Å; I344-T620 WeakPolarHBondContact CD1-O 3.19Å; I344-T620 HydrophobicContact CG1-CG2 4.28Å; S346-T620 WeakPolarHBondContact O-CG2 3.32Å; S348-T620 WeakPolarHBondContact O-CA 3.24Å; N398-T620 PolarHBondContact ND2-O 2.81Å; N398-T620 PolarHBondContact OD1-N 3.05Å; N398-T620 PolarHBondContact OD1-O 2.81Å
621	V	85.8	Confident	69.5	Low	12 Å²	12	54.7 Å²	54.7	7%	0.073	33%	0.327	C	S	.	.			trans	-135.7	163.1	-179.6	-61.1	0	0	0	0	110.4	S346 L370 L619 P623	S346-V621 PolarHBondContact OG-O 3.5Å; L370-V621 HydrophobicContact CD1-CG2 3.09Å; L619-V621 HydrophobicContact CB-CG1 3.97Å; V621-P623 WeakPolarHBondContact O-CD 3.36Å
622	F	80.1	Confident	67.1	Low	91 Å²	91	57.8 Å²	57.8	40%	0.399	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-78.1	119.2	163	-68.9	-74	0	0	0	108	I344 R345	I344-F622 HydrophobicContact CB-CE2 3.78Å; I344-F622 HydrophobicContact CB-CZ 4.21Å; I344-F622 HydrophobicContact CD1-CD2 4.18Å; I344-F622 HydrophobicContact CD1-CE2 4.14Å; I344-F622 HydrophobicContact CG1-CE2 4.45Å; I344-F622 HydrophobicContact CG2-CE2 4.28Å; R345-F622 HydrophobicContact CB-CE1 4.39Å; R345-F622 HydrophobicContact CB-CZ 4.03Å; R345-F622 WeakPolarHBondContact O-CE1 3.5Å; R345-F622 WeakPolarHBondContact O-CZ 3.42Å
623	P	70.4	Confident	64.9	Low	44 Å²	44	69.6 Å²	69.6	29%	0.286	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-60.2	136.2	173.6	23.6	-30.9	0	0	0	108.7	V621 E625	V621-P623 WeakPolarHBondContact O-CD 3.36Å; P623-E625 PolarHBondContact O-N 3.14Å
624	P	68.5	Low	62.4	Low	43 Å²	43	77.4 Å²	77.4	28%	0.279	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-54.2	135.8	172	-20.5	30.4	0	0	0	109.4	K379 A380 L381	K379-P624 HydrophobicContact CB-CG 4.15Å; A380-P624 WeakPolarHBondContact O-CG 3.47Å; L381-P624 HydrophobicContact CD2-CG 3.84Å
625	E	64.4	Low	59.6	Low	130 Å²	130	81.7 Å²	81.7	61%	0.607	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-63.2	141.8	171.8	-69.7	177.8	-150.4	0	0	109.3	H260 P623 I627	H260-E625 VanDerWaalsContact CE1-CD 3.43Å; H260-E625 IonicContact CE1-OE1 3.12Å; H260-E625 PolarHBondContact CE1-OE1 3.49Å; H260-E625 IonicContact CG-OE1 2.92Å; H260-E625 IonicContact ND1-OE1 2.8Å; H260-E625 PolarHBondContact ND1-OE1 3.04Å; H260-E625 IonicContact ND1-OE2 2.8Å; P623-E625 PolarHBondContact O-N 3.14Å; E625-I627 PolarHBondContact O-N 2.97Å
626	D	47.7	Very low	56.8	Low	123 Å²	123	85.8 Å²	85.8	66%	0.658	49%	0.49	S	S	*	.			trans	-66.4	91.4	168	-65.5	-36.3	0	0	0	106.9	K379 S628	K379-D626 WeakPolarHBondContact CE-OD1 3.44Å; K379-D626 IonicContact NZ-OD1 2.69Å; K379-D626 PolarHBondContact NZ-OD1 2.86Å; K379-D626 IonicContact NZ-OD2 2.85Å; D626-S628 VanDerWaalsContact C-N 3.27Å; D626-S628 PolarHBondContact O-N 3.24Å
627	I	38.2	Very low	54.1	Low	141 Å²	141	93 Å²	93	72%	0.723	53%	0.527	S	S	*	.			trans	-62.3	101.1	165.4	-57.7	172.7	0	0	0	104.4	E625 G629	E625-I627 PolarHBondContact O-N 2.97Å; I627-G629 CarbonylContact O-C 3.58Å; I627-G629 PolarHBondContact O-N 2.84Å
628	S	32.4	Very low	50.9	Low	126 Å²	126	98.1 Å²	98.1	88%	0.881	56%	0.563	S	S	*	*	S	Bend	trans	-60.2	90.7	167.5	56.9	0	0	0	0	107.3	D626	D626-S628 VanDerWaalsContact C-N 3.27Å; D626-S628 PolarHBondContact O-N 3.24Å
629	G	29.2	Very low	47.9	Very low	48 Å²	48	100.1 Å²	100.1	50%	0.495	58%	0.584	S	S	.	*	S	Bend	trans	148.2	62.2	-161.1	0	0	0	0	0	108.1	I627 P631	I627-G629 CarbonylContact O-C 3.58Å; I627-G629 PolarHBondContact O-N 2.84Å; G629-P631 WeakPolarHBondContact O-CD 3.4Å
630	S	25.6	Very low	45.1	Very low	104 Å²	104	109.1 Å²	109.1	73%	0.727	64%	0.644	S	S	*	*			trans	-47.3	125.3	163.1	43.2	0	0	0	0	108.3	S632	S630-S632 PolarHBondContact O-N 2.97Å; S630-S632 VanDerWaalsContact O-N 3.16Å
631	P	29.9	Very low	42.8	Very low	121 Å²	121	112.8 Å²	112.8	79%	0.786	66%	0.664	S	S	*	*			trans	-60.2	120	141.3	9.9	4.8	0	0	0	103.4	G629	G629-P631 WeakPolarHBondContact O-CD 3.4Å
632	S	29.1	Very low	40.5	Very low	77 Å²	77	118.1 Å²	118.1	54%	0.538	70%	0.695	S	S	.	*			trans	-32.2	147.3	165.4	35.7	0	0	0	0	111.3	S630 E634	S630-S632 PolarHBondContact O-N 2.97Å; S630-S632 VanDerWaalsContact O-N 3.16Å; S632-E634 PolarHBondContact O-N 3.11Å
633	R	35.3	Very low	38.3	Very low	255 Å²	255	119.6 Å²	119.6	96%	0.962	71%	0.712	S	S	*	*			trans	-45.7	80.3	160.5	-77.5	174.7	160.6	179.5	-5.4	110.3
634	E	26.5	Very low	36.4	Very low	163 Å²	163	124 Å²	124	76%	0.762	74%	0.737	S	S	*	*			trans	-94.3	104.5	166.6	-75.3	-164.2	166.2	0	0	105.3	S632	S632-E634 PolarHBondContact O-N 3.11Å
635	S	30.1	Very low	34.4	Very low	94 Å²	94	129.1 Å²	129.1	66%	0.657	77%	0.766	S	S	*	*			trans	-50.2	138.8	162.7	-58.4	0	0	0	0	107.9	L637	S635-L637 PolarHBondContact O-N 2.73Å
636	P	32.4	Very low	32.4	Very low	122 Å²	122	129 Å²	129	79%	0.792	78%	0.776	S	S	*	*	S	Bend	trans	-73.6	74.7	178.2	30.4	-32.8	0	0	0	109.2
637	L	37.8	Very low	31.3	Very low	155 Å²	155	129.4 Å²	129.4	81%	0.812	79%	0.785	S	S	*	*			trans	-144.4	78.6	175	-77	174	0	0	0	109.1	S635	S635-L637 PolarHBondContact O-N 2.73Å
638	S	27.4	Very low	30.8	Very low	118 Å²	118	128.5 Å²	128.5	83%	0.825	79%	0.789	S	S	*	*			trans	-147	74.1	148.5	50.2	0	0	0	0	108.7
639	A	32	Very low	30.7	Very low	87 Å²	87	128.8 Å²	128.8	72%	0.719	78%	0.782	S	S	*	*			trans	-73.5	167.9	154.6	0	0	0	0	0	109.2
640	P	32.9	Very low	30.8	Very low	201 Å²	201	136.1 Å²	136.1	100%	1.305	81%	0.808	S	S	*	*				-103.6	0	111	27.3	-32.5	0	0	0	112.7

Retrieved 640 of 640 residues in 481.8 ms (Link to these results)

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