A0A087YDR8_POEFO Loading...

WD repeat-containing protein 76

Specifically binds 5-hydroxymethylcytosine (5hmC), suggesting that it acts as a specific reader of 5hmC.

AlphaFold DB , UniProt , Accession A0A087YDR8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 589 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	37.4	Very low	33.8	Very low	248 Å²	248	141.5 Å²	141.5	100%	1.222	79%	0.788	S	S	*	*				0	106.1	0	-53.3	166.3	-168	0	0	104.6
2	G	33.6	Very low	33.3	Very low	87 Å²	87	140.2 Å²	140.2	90%	0.897	79%	0.792	S	S	*	*			cis	94.8	121.9	39.7	0	0	0	0	0	108
3	G	32.4	Very low	32.8	Very low	67 Å²	67	135.8 Å²	135.8	69%	0.691	80%	0.797	S	S	*	*			cis	164.9	-179.8	0.4	0	0	0	0	0	110.4
4	I	34.6	Very low	32.3	Very low	164 Å²	164	131.2 Å²	131.2	84%	0.841	79%	0.793	S	S	*	*			trans	82.8	123.7	175.9	-54.1	156.9	0	0	0	113.5
5	C	34.2	Very low	32.1	Very low	92 Å²	92	136.7 Å²	136.7	62%	0.622	80%	0.802	S	S	*	*			cis	84.6	157.3	26.2	-55.5	0	0	0	0	114.2
6	Y	31.9	Very low	32.1	Very low	189 Å²	189	139.3 Å²	139.3	74%	0.741	80%	0.804	S	S	*	*			cis	-169.3	162.8	-18	-101.2	-8.3	0	0	0	106.2
7	K	33.3	Very low	31.8	Very low	156 Å²	156	143.9 Å²	143.9	68%	0.678	81%	0.813	S	S	*	*			cis	-157.7	178	1.5	-129	171.6	-174	178.3	0	111.9
8	T	30.9	Very low	31.6	Very low	97 Å²	97	140.7 Å²	140.7	60%	0.595	81%	0.807	S	S	*	*			trans	-37.5	151.9	159.8	49.8	0	0	0	0	118.4
9	Y	29	Very low	31.4	Very low	214 Å²	214	138.9 Å²	138.9	84%	0.839	81%	0.805	S	S	*	*				-178.1	154	99.5	-107.2	-73.4	0	0	0	115.7
10	T	32.9	Very low	31.1	Very low	111 Å²	111	137.7 Å²	137.7	68%	0.681	80%	0.804	S	S	*	*			trans	-99.9	170.4	160.9	48.4	0	0	0	0	111.1
11	P	41	Very low	30.9	Very low	132 Å²	132	136.7 Å²	136.7	86%	0.857	81%	0.805	S	S	*	*			trans	-132.6	171.6	132.4	37.8	-28.7	0	0	0	113.7
12	C	27.9	Very low	30.3	Very low	125 Å²	125	129.6 Å²	129.6	85%	0.845	78%	0.78	S	S	*	*			trans	-119.2	161.9	-169.9	-58.5	0	0	0	0	113.5
13	G	26.9	Very low	30	Very low	83 Å²	83	131.6 Å²	131.6	86%	0.856	77%	0.774	S	S	*	*			trans	93.6	144.2	162.4	0	0	0	0	0	115.3
14	G	26.8	Very low	29.6	Very low	72 Å²	72	135.6 Å²	135.6	74%	0.742	78%	0.78	S	S	*	*			cis	128.6	122.8	-9.1	0	0	0	0	0	114.1
15	K	28.6	Very low	29.2	Very low	213 Å²	213	133.2 Å²	133.2	93%	0.926	77%	0.772	S	S	*	*			trans	-173.8	148.7	156.4	-107.9	160.7	-173.7	178	0	111.2
16	Q	31.5	Very low	28.8	Very low	178 Å²	178	138 Å²	138	83%	0.832	78%	0.782	S	S	*	*			trans	-87.9	155.3	164.4	-61.3	162.6	-46.9	0	0	109.4
17	F	27.6	Very low	28.5	Very low	218 Å²	218	134.7 Å²	134.7	96%	0.956	78%	0.782	S	S	*	*			trans	-162.1	173.8	133.2	-110.5	-71.4	0	0	0	109.3
18	A	28.7	Very low	28.2	Very low	86 Å²	86	135.2 Å²	135.2	71%	0.711	79%	0.786	S	S	*	*			trans	-134.3	-170.3	-159.2	0	0	0	0	0	113.5
19	S	26.8	Very low	27.9	Very low	108 Å²	108	135.7 Å²	135.7	76%	0.755	79%	0.794	S	S	*	*			trans	90.4	105.1	163.4	72.6	0	0	0	0	119.8
20	S	26.3	Very low	27.6	Very low	113 Å²	113	131.4 Å²	131.4	79%	0.79	79%	0.794	S	S	*	*				34.8	111.4	129.4	60.2	0	0	0	0	121.5
21	S	25.9	Very low	27.3	Very low	117 Å²	117	130.1 Å²	130.1	82%	0.818	80%	0.795	S	S	*	*				-170	178.2	128.9	45.8	0	0	0	0	110
22	S	25.7	Very low	26.5	Very low	100 Å²	100	131.3 Å²	131.3	70%	0.699	79%	0.792	S	S	*	*				-165.6	155.8	-78.6	53.5	0	0	0	0	110.3
23	V	26.5	Very low	26.4	Very low	129 Å²	129	130.2 Å²	130.2	78%	0.782	79%	0.786	S	S	*	*			trans	70.8	145.1	174.2	-176.1	0	0	0	0	111.7
24	N	25.6	Very low	26.3	Very low	151 Å²	151	135.7 Å²	135.7	81%	0.807	79%	0.786	S	S	*	*			cis	-136.1	163.5	18	-145	-20.9	0	0	0	114.4
25	V	25.9	Very low	26.2	Very low	113 Å²	113	139.6 Å²	139.6	69%	0.685	79%	0.79	S	S	*	*			trans	-90.6	143.8	176.3	173.7	0	0	0	0	110.9	V27	V25-V27 HydrophobicContact CG1-CG2 3.91Å
26	K	25	Very low	26.3	Very low	192 Å²	192	134.2 Å²	134.2	84%	0.835	78%	0.78	S	S	*	*			trans	-142.7	100.7	157.2	-135	175.4	-173	-178.7	0	111.5
27	V	26.5	Very low	26	Very low	120 Å²	120	136.8 Å²	136.8	73%	0.727	78%	0.782	S	S	*	*			trans	-78.9	131.3	172	-179.5	0	0	0	0	108.3	V25	V25-V27 HydrophobicContact CG1-CG2 3.91Å
28	H	25.9	Very low	26	Very low	167 Å²	167	133.6 Å²	133.6	77%	0.773	77%	0.774	S	S	*	*			trans	-120.2	112.3	158.4	-101.6	-75.3	0	0	0	109.6
29	S	24.6	Very low	26	Very low	107 Å²	107	137.2 Å²	137.2	75%	0.748	78%	0.781	S	S	*	*			trans	-63	138.1	165.6	177.4	0	0	0	0	109.5
30	C	23.8	Very low	26.1	Very low	124 Å²	124	140.8 Å²	140.8	84%	0.838	78%	0.783	S	S	*	*			trans	-124.6	119.1	161.7	-163.7	0	0	0	0	107.3
31	A	25.4	Very low	26.3	Very low	85 Å²	85	141.3 Å²	141.3	70%	0.702	78%	0.782	S	S	*	*			trans	-80	132.6	-171.3	0	0	0	0	0	111.5	S33	A31-S33 PolarHBondContact O-N 3.26Å
32	I	25.6	Very low	26.5	Very low	157 Å²	157	143.3 Å²	143.3	81%	0.805	78%	0.778	S	S	*	*			trans	-80.2	97.6	171.7	-60.5	173.7	0	0	0	108.2	F34	I32-F34 PolarHBondContact O-N 3.19Å
33	S	24.5	Very low	26.5	Very low	102 Å²	102	147 Å²	147	71%	0.713	78%	0.782	S	S	*	*			trans	-76.6	109.7	167.7	56.2	0	0	0	0	109.7	A31 N35	A31-S33 PolarHBondContact O-N 3.26Å; S33-N35 PolarHBondContact O-N 2.7Å
34	F	25.7	Very low	26.6	Very low	198 Å²	198	146 Å²	146	87%	0.868	78%	0.776	S	S	*	*			trans	-60.9	124.6	165.8	-97.9	-101.7	0	0	0	109.8	I32	I32-F34 PolarHBondContact O-N 3.19Å
35	N	24.7	Very low	26.8	Very low	153 Å²	153	146 Å²	146	82%	0.818	77%	0.772	S	S	*	*			trans	-124.7	138.2	156	-97.8	-31.6	0	0	0	108.8	S33	S33-N35 PolarHBondContact O-N 2.7Å
36	S	30.4	Very low	26.8	Very low	101 Å²	101	145 Å²	145	71%	0.706	77%	0.769	S	S	*	*			trans	-74.4	-179.3	172.2	-172.6	0	0	0	0	110.4
37	W	26.1	Very low	27.1	Very low	232 Å²	232	143.1 Å²	143.1	88%	0.879	76%	0.76	S	S	*	*			trans	74.5	90.5	179.7	-54	74.5	0	0	0	115.1
38	D	25.7	Very low	27.6	Very low	150 Å²	150	140.7 Å²	140.7	80%	0.802	74%	0.743	S	S	*	*				-162.3	102.2	109.2	-111	-19.9	0	0	0	111.9	F40	D38-F40 PolarHBondContact O-N 3.24Å
39	L	29.3	Very low	28	Very low	162 Å²	162	137.8 Å²	137.8	85%	0.848	73%	0.731	S	S	*	*			trans	-104.5	51.3	-170.5	-135.5	172	0	0	0	111.1
40	F	28.3	Very low	28.3	Very low	184 Å²	184	135.3 Å²	135.3	81%	0.807	71%	0.714	S	S	*	*			trans	-133.9	28.3	-165.8	-118.4	-81.6	0	0	0	116.9	D38	D38-F40 PolarHBondContact O-N 3.24Å
41	T	30.7	Very low	29.4	Very low	124 Å²	124	132.8 Å²	132.8	76%	0.761	70%	0.695	S	S	*	*	S	Bend	trans	-121.6	11.9	-174	-12.2	0	0	0	0	116.1
42	Q	29.7	Very low	30.6	Very low	159 Å²	159	133.4 Å²	133.4	74%	0.743	68%	0.679	S	S	*	*	S	Bend	trans	-112	2	-177.1	-78.1	-173.9	-22.7	0	0	116.2
43	F	25.8	Very low	31.9	Very low	177 Å²	177	131.3 Å²	131.3	78%	0.776	67%	0.666	S	S	*	*	S	Bend	trans	-96.9	-0	-174.1	-95.6	-78.3	0	0	0	116.5
44	T	30.2	Very low	33.1	Very low	108 Å²	108	130.2 Å²	130.2	66%	0.663	66%	0.655	S	S	*	*	S	Bend	trans	-90.8	-43.9	-179.8	38.3	0	0	0	0	113.3	C46 K47	T44-C46 PolarHBondContact O-N 2.97Å; T44-K47 PolarHBondContact O-N 3.11Å
45	E	29.9	Very low	34.4	Very low	152 Å²	152	125.1 Å²	125.1	71%	0.71	63%	0.632	S	S	*	*	H	α-helix	trans	-66.7	-37	-175	-62.4	-169.7	126.5	0	0	113.5	K47 D48 M49	E45-K47 PolarHBondContact O-N 3.21Å; E45-K47 VanDerWaalsContact O-N 3.14Å; E45-D48 PolarHBondContact O-N 3.03Å; E45-D48 VanDerWaalsContact O-N 3.1Å; E45-M49 PolarHBondContact O-N 3.41Å
46	C	25.1	Very low	35.9	Very low	91 Å²	91	121.5 Å²	121.5	62%	0.615	61%	0.607	S	S	*	*	H	α-helix	trans	-60.5	-24.6	178.5	-72.1	0	0	0	0	114.3	T44 S50	T44-C46 PolarHBondContact O-N 2.97Å; C46-S50 PolarHBondContact O-N 3.25Å; C46-S50 PolarHBondContact O-OG 3.12Å
47	K	31.2	Very low	36.6	Very low	152 Å²	152	122 Å²	122	66%	0.661	60%	0.598	S	S	*	*	H	α-helix	trans	-79.4	-35.2	175.8	-72.2	-179.5	177.5	174.5	0	112.3	T44 E45 S50 T51	T44-K47 PolarHBondContact O-N 3.11Å; E45-K47 PolarHBondContact O-N 3.21Å; E45-K47 VanDerWaalsContact O-N 3.14Å; K47-S50 PolarHBondContact O-OG 3.4Å; K47-T51 WeakPolarHBondContact O-CG2 3.49Å; K47-T51 PolarHBondContact O-N 3.43Å; K47-T51 PolarHBondContact O-OG1 2.89Å
48	D	37.3	Very low	37.5	Very low	69 Å²	69	113.1 Å²	113.1	37%	0.369	58%	0.575	S	S	.	*	H	α-helix	trans	-73.7	-37	176.4	-133.6	57.5	0	0	0	110.8	E45 T51 R52	E45-D48 PolarHBondContact O-N 3.03Å; E45-D48 VanDerWaalsContact O-N 3.1Å; D48-T51 PolarHBondContact O-OG1 3.24Å; D48-T51 VanDerWaalsContact O-OG1 3.08Å; D48-R52 WeakPolarHBondContact O-CB 3.45Å; D48-R52 WeakPolarHBondContact O-CG 3.02Å; D48-R52 PolarHBondContact O-N 3.44Å; D48-R52 IonicContact OD2-CZ 3.77Å; D48-R52 IonicContact OD2-NE 2.75Å; D48-R52 PolarHBondContact OD2-NE 3.39Å; D48-R52 VanDerWaalsContact OD2-NE 3.16Å; D48-R52 IonicContact OD2-NH2 2.92Å; D48-R52 PolarHBondContact OD2-NH2 2.84Å
49	M	33.4	Very low	38.4	Very low	107 Å²	107	106.5 Å²	106.5	53%	0.527	54%	0.54	S	S	.	.	H	α-helix	trans	-63.9	-44.7	174.3	-75.9	-66.3	-78.4	0	0	113.1	E45 R52 Q53	E45-M49 PolarHBondContact O-N 3.41Å; M49-R52 PolarHBondContact O-N 3.3Å; M49-Q53 WeakPolarHBondContact O-CG 3.33Å; M49-Q53 PolarHBondContact O-N 3.08Å
50	S	31.5	Very low	38.9	Very low	55 Å²	55	104.1 Å²	104.1	39%	0.385	53%	0.525	S	S	.	.	H	α-helix	trans	-70	-33.1	179.4	60.2	0	0	0	0	113	C46 K47 T54	C46-S50 PolarHBondContact O-N 3.25Å; C46-S50 PolarHBondContact O-OG 3.12Å; K47-S50 PolarHBondContact O-OG 3.4Å; S50-T54 WeakPolarHBondContact O-CB 3.48Å; S50-T54 WeakPolarHBondContact O-CG2 3.48Å; S50-T54 PolarHBondContact O-N 3.06Å; S50-T54 PolarHBondContact O-OG1 3.04Å
51	T	46.7	Very low	39.2	Very low	71 Å²	71	101.6 Å²	101.6	44%	0.436	51%	0.514	S	S	.	.	H	α-helix	trans	-72.8	-30.6	172.9	54.2	0	0	0	0	112.8	K47 D48 T54 K55	K47-T51 WeakPolarHBondContact O-CG2 3.49Å; K47-T51 PolarHBondContact O-N 3.43Å; K47-T51 PolarHBondContact O-OG1 2.89Å; D48-T51 PolarHBondContact O-OG1 3.24Å; D48-T51 VanDerWaalsContact O-OG1 3.08Å; T51-T54 WeakPolarHBondContact CA-OG1 3.31Å; T51-T54 PolarHBondContact O-OG1 2.62Å; T51-K55 WeakPolarHBondContact O-CB 3.48Å; T51-K55 WeakPolarHBondContact O-CG 3.4Å; T51-K55 PolarHBondContact O-N 2.88Å; T51-K55 VanDerWaalsContact O-N 3.11Å
52	R	51	Low	39.5	Very low	98 Å²	98	103.3 Å²	103.3	37%	0.37	51%	0.508	S	S	.	.	H	α-helix	trans	-68	-46.5	168.5	-71.7	169	-165.2	-143.8	8.2	112	D48 M49 K55 R56	D48-R52 WeakPolarHBondContact O-CB 3.45Å; D48-R52 WeakPolarHBondContact O-CG 3.02Å; D48-R52 PolarHBondContact O-N 3.44Å; D48-R52 IonicContact OD2-CZ 3.77Å; D48-R52 IonicContact OD2-NE 2.75Å; D48-R52 PolarHBondContact OD2-NE 3.39Å; D48-R52 VanDerWaalsContact OD2-NE 3.16Å; D48-R52 IonicContact OD2-NH2 2.92Å; D48-R52 PolarHBondContact OD2-NH2 2.84Å; M49-R52 PolarHBondContact O-N 3.3Å; R52-K55 PolarHBondContact O-N 3.25Å; R52-R56 VanDerWaalsContact O-CG 3.28Å; R52-R56 WeakPolarHBondContact O-CG 3.13Å; R52-R56 PolarHBondContact O-N 2.9Å
53	Q	52.1	Low	39.8	Very low	113 Å²	113	99.2 Å²	99.2	53%	0.528	49%	0.491	S	S	.	.	H	α-helix	trans	-60.1	-49.7	177.1	-77.5	177.7	-26.7	0	0	111.8	M49 K55 R56 E57	M49-Q53 WeakPolarHBondContact O-CG 3.33Å; M49-Q53 PolarHBondContact O-N 3.08Å; Q53-K55 VanDerWaalsContact C-N 3.34Å; Q53-K55 PolarHBondContact O-N 3.12Å; Q53-R56 CarbonylContact O-C 3.54Å; Q53-R56 WeakPolarHBondContact O-CA 3.29Å; Q53-R56 WeakPolarHBondContact O-CB 3.37Å; Q53-R56 PolarHBondContact O-N 3.39Å; Q53-E57 WeakPolarHBondContact O-CG 3.29Å; Q53-E57 PolarHBondContact O-N 3.27Å
54	T	50	Low	39.9	Very low	78 Å²	78	94.8 Å²	94.8	48%	0.479	48%	0.478	S	S	.	.	H	α-helix	trans	-65	-32.5	178.1	49.9	0	0	0	0	113.3	S50 T51 A58	S50-T54 WeakPolarHBondContact O-CB 3.48Å; S50-T54 WeakPolarHBondContact O-CG2 3.48Å; S50-T54 PolarHBondContact O-N 3.06Å; S50-T54 PolarHBondContact O-OG1 3.04Å; T51-T54 WeakPolarHBondContact CA-OG1 3.31Å; T51-T54 PolarHBondContact O-OG1 2.62Å; T54-A58 VanDerWaalsContact O-CB 3.26Å; T54-A58 WeakPolarHBondContact O-CB 3.45Å; T54-A58 PolarHBondContact O-N 3.35Å
55	K	52.8	Low	39.9	Very low	91 Å²	91	93.2 Å²	93.2	40%	0.396	47%	0.47	S	S	.	.	H	α-helix	trans	-63.5	-42.2	167.8	-83.1	-176.9	175.1	-171.4	0	112.5	T51 R52 Q53 A58 T59	T51-K55 WeakPolarHBondContact O-CB 3.48Å; T51-K55 WeakPolarHBondContact O-CG 3.4Å; T51-K55 PolarHBondContact O-N 2.88Å; T51-K55 VanDerWaalsContact O-N 3.11Å; R52-K55 PolarHBondContact O-N 3.25Å; Q53-K55 VanDerWaalsContact C-N 3.34Å; Q53-K55 PolarHBondContact O-N 3.12Å; K55-A58 PolarHBondContact O-N 3.35Å; K55-T59 WeakPolarHBondContact O-CB 3.36Å; K55-T59 PolarHBondContact O-N 3.06Å; K55-T59 PolarHBondContact O-OG1 3.48Å
56	R	56.8	Low	39.7	Very low	78 Å²	78	91.8 Å²	91.8	29%	0.294	47%	0.467	S	S	.	.	H	α-helix	trans	-66.1	-44.6	178	-71.2	167.7	-174.7	-133.8	-8.6	111.5	R52 Q53 T59 M60 D366 F387	R52-R56 VanDerWaalsContact O-CG 3.28Å; R52-R56 WeakPolarHBondContact O-CG 3.13Å; R52-R56 PolarHBondContact O-N 2.9Å; Q53-R56 CarbonylContact O-C 3.54Å; Q53-R56 WeakPolarHBondContact O-CA 3.29Å; Q53-R56 WeakPolarHBondContact O-CB 3.37Å; Q53-R56 PolarHBondContact O-N 3.39Å; R56-T59 PolarHBondContact O-N 2.76Å; R56-M60 WeakPolarHBondContact O-CB 3.26Å; R56-M60 VanDerWaalsContact O-CG 3.27Å; R56-M60 WeakPolarHBondContact O-CG 3.37Å; R56-M60 PolarHBondContact O-N 3.3Å; R56-D366 VanDerWaalsContact CZ-CG 3.43Å; R56-D366 IonicContact CZ-OD1 2.67Å; R56-D366 IonicContact CZ-OD2 3.41Å; R56-D366 IonicContact NE-OD1 3.95Å; R56-D366 IonicContact NH1-OD1 3.93Å; R56-D366 PolarHBondContact NH1-OD1 3.01Å; R56-D366 IonicContact NH1-OD2 2.79Å; R56-D366 PolarHBondContact NH1-OD2 2.86Å; R56-D366 IonicContact NH2-OD1 3.57Å; R56-D366 IonicContact NH2-OD2 3.45Å; R56-D366 PolarHBondContact NH2-OD2 3.34Å; R56-F387 HydrophobicContact CB-CD1 4.3Å; R56-F387 HydrophobicContact CB-CE1 4.01Å; R56-F387 HydrophobicContact CB-CZ 4.44Å; R56-F387 HydrophobicContact CG-CD1 3.9Å; R56-F387 HydrophobicContact CG-CD2 4.4Å; R56-F387 HydrophobicContact CG-CE1 3.96Å; R56-F387 HydrophobicContact CG-CE2 4.45Å; R56-F387 HydrophobicContact CG-CG 4.13Å; R56-F387 HydrophobicContact CG-CZ 4.24Å
57	E	45.4	Very low	40.3	Very low	111 Å²	111	93.5 Å²	93.5	52%	0.519	48%	0.475	S	S	.	.	H	α-helix	trans	-60.4	-46.5	173	-72.3	175.5	-169.1	0	0	112.6	Q53 T59 M60 K61	Q53-E57 WeakPolarHBondContact O-CG 3.29Å; Q53-E57 PolarHBondContact O-N 3.27Å; E57-T59 VanDerWaalsContact C-N 3.26Å; E57-T59 PolarHBondContact O-N 3.07Å; E57-M60 WeakPolarHBondContact O-CB 3.35Å; E57-M60 PolarHBondContact O-N 3.31Å; E57-K61 WeakPolarHBondContact O-CG 3.44Å; E57-K61 PolarHBondContact O-N 3.28Å
58	A	44.6	Very low	40.4	Very low	46 Å²	46	92.8 Å²	92.8	38%	0.38	48%	0.478	S	S	.	.	H	α-helix	trans	-62.4	-35	177.5	0	0	0	0	0	112.1	T54 K55 Y62	T54-A58 VanDerWaalsContact O-CB 3.26Å; T54-A58 WeakPolarHBondContact O-CB 3.45Å; T54-A58 PolarHBondContact O-N 3.35Å; K55-A58 PolarHBondContact O-N 3.35Å; A58-Y62 WeakPolarHBondContact O-CD2 3.36Å; A58-Y62 WeakPolarHBondContact O-CE2 3.49Å
59	T	45	Very low	40	Very low	11 Å²	11	93.1 Å²	93.1	7%	0.067	49%	0.491	C	S	.	.	H	α-helix	trans	-77.4	-35.5	176.6	-58.5	0	0	0	0	112.3	K55 R56 E57 K61 Y62 L63 F387	K55-T59 WeakPolarHBondContact O-CB 3.36Å; K55-T59 PolarHBondContact O-N 3.06Å; K55-T59 PolarHBondContact O-OG1 3.48Å; R56-T59 PolarHBondContact O-N 2.76Å; E57-T59 VanDerWaalsContact C-N 3.26Å; E57-T59 PolarHBondContact O-N 3.07Å; T59-K61 VanDerWaalsContact C-N 3.28Å; T59-K61 PolarHBondContact O-N 3.4Å; T59-Y62 PolarHBondContact O-N 3.35Å; T59-L63 PolarHBondContact O-N 3.44Å; T59-F387 HydrophobicContact CG2-CD1 3.67Å; T59-F387 HydrophobicContact CG2-CE1 3.75Å
60	M	39.8	Very low	39.9	Very low	111 Å²	111	94.8 Å²	94.8	55%	0.547	51%	0.507	S	S	.	.	H	α-helix	trans	-58.5	-38.4	170	-79.4	-90.3	-81.1	0	0	112	R56 E57 Y62 L63 T64	R56-M60 WeakPolarHBondContact O-CB 3.26Å; R56-M60 VanDerWaalsContact O-CG 3.27Å; R56-M60 WeakPolarHBondContact O-CG 3.37Å; R56-M60 PolarHBondContact O-N 3.3Å; E57-M60 WeakPolarHBondContact O-CB 3.35Å; E57-M60 PolarHBondContact O-N 3.31Å; M60-Y62 PolarHBondContact O-N 3.22Å; M60-Y62 VanDerWaalsContact O-N 3.14Å; M60-L63 WeakPolarHBondContact O-CB 3.28Å; M60-L63 PolarHBondContact O-N 3.27Å; M60-L63 HydrophobicContact SD-CD1 4.05Å; M60-T64 PolarHBondContact O-N 2.64Å; M60-T64 PolarHBondContact O-OG1 3.04Å
61	K	34.3	Very low	39.7	Very low	131 Å²	131	98 Å²	98	57%	0.57	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-12.4	173.5	-72.3	178.2	-177.7	177.5	0	114.6	E57 T59 T64	E57-K61 WeakPolarHBondContact O-CG 3.44Å; E57-K61 PolarHBondContact O-N 3.28Å; T59-K61 VanDerWaalsContact C-N 3.28Å; T59-K61 PolarHBondContact O-N 3.4Å; K61-T64 PolarHBondContact O-OG1 3.14Å
62	Y	37.3	Very low	38.9	Very low	160 Å²	160	106.3 Å²	106.3	63%	0.627	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	-9.3	168.1	-63	-73.9	0	0	0	113.8	A58 T59 M60 T64	A58-Y62 WeakPolarHBondContact O-CD2 3.36Å; A58-Y62 WeakPolarHBondContact O-CE2 3.49Å; T59-Y62 PolarHBondContact O-N 3.35Å; M60-Y62 PolarHBondContact O-N 3.22Å; M60-Y62 VanDerWaalsContact O-N 3.14Å; Y62-T64 CarbonylContact C-O 3.49Å
63	L	36.5	Very low	37.8	Very low	74 Å²	74	113.1 Å²	113.1	39%	0.387	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.8	-37	170.5	-66	175.5	0	0	0	110.8	T59 M60 W386	T59-L63 PolarHBondContact O-N 3.44Å; M60-L63 WeakPolarHBondContact O-CB 3.28Å; M60-L63 PolarHBondContact O-N 3.27Å; M60-L63 HydrophobicContact SD-CD1 4.05Å; L63-W386 HydrophobicContact CD2-CD2 4.46Å; L63-W386 HydrophobicContact CD2-CE3 3.78Å; L63-W386 HydrophobicContact CD2-CH2 4.12Å; L63-W386 HydrophobicContact CD2-CZ3 3.57Å
64	T	27.8	Very low	36.8	Very low	83 Å²	83	112.6 Å²	112.6	51%	0.509	58%	0.582	S	S	.	*	S	Bend	trans	-75.6	131.6	158.5	49.4	0	0	0	0	109.6	M60 K61 Y62 D66	M60-T64 PolarHBondContact O-N 2.64Å; M60-T64 PolarHBondContact O-OG1 3.04Å; K61-T64 PolarHBondContact O-OG1 3.14Å; Y62-T64 CarbonylContact C-O 3.49Å; T64-D66 PolarHBondContact O-N 2.66Å
65	P	29.6	Very low	35.8	Very low	76 Å²	76	114.7 Å²	114.7	49%	0.494	60%	0.6	S	S	.	*			trans	-70.5	119.3	165.8	-12	27.6	0	0	0	109.1	T67	P65-T67 PolarHBondContact O-N 2.69Å; P65-T67 VanDerWaalsContact O-N 3.09Å
66	D	26.3	Very low	34.8	Very low	121 Å²	121	121.4 Å²	121.4	65%	0.647	62%	0.623	S	S	*	*			trans	-57.4	112.1	174.6	-116.1	-30.9	0	0	0	110.3	T64 N68	T64-D66 PolarHBondContact O-N 2.66Å; D66-N68 VanDerWaalsContact C-N 3.34Å
67	T	37.6	Very low	33.6	Very low	127 Å²	127	129.1 Å²	129.1	78%	0.779	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-18.4	-179.4	42.7	0	0	0	0	113	P65	P65-T67 PolarHBondContact O-N 2.69Å; P65-T67 VanDerWaalsContact O-N 3.09Å
68	N	33.1	Very low	32.8	Very low	138 Å²	138	128.7 Å²	128.7	74%	0.738	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	26.6	-168.4	-72.8	-27	0	0	0	114.8	D66 T70	D66-N68 VanDerWaalsContact C-N 3.34Å; N68-T70 PolarHBondContact O-N 3.1Å; N68-T70 VanDerWaalsContact O-N 3.14Å
69	A	27.9	Very low	32.3	Very low	76 Å²	76	133.1 Å²	133.1	63%	0.628	69%	0.689	S	S	*	*			trans	-72.9	100.4	167.1	0	0	0	0	0	110.6	V71	A69-V71 VanDerWaalsContact C-N 3.33Å; A69-V71 PolarHBondContact O-N 2.8Å
70	T	31.3	Very low	31.8	Very low	141 Å²	141	136.4 Å²	136.4	87%	0.865	72%	0.718	S	S	*	*			trans	-70.6	81.4	179.9	37.4	0	0	0	0	112.5	N68 R72	N68-T70 PolarHBondContact O-N 3.1Å; N68-T70 VanDerWaalsContact O-N 3.14Å; T70-R72 PolarHBondContact O-N 2.86Å; T70-R72 VanDerWaalsContact O-N 3.07Å
71	V	28.1	Very low	31.3	Very low	123 Å²	123	137.1 Å²	137.1	75%	0.745	73%	0.73	S	S	*	*			trans	-58.4	112.4	174.3	179.3	0	0	0	0	110.2	A69 R73	A69-V71 VanDerWaalsContact C-N 3.33Å; A69-V71 PolarHBondContact O-N 2.8Å; V71-R73 PolarHBondContact O-N 3.18Å
72	R	28.9	Very low	31.1	Very low	245 Å²	245	140.3 Å²	140.3	93%	0.925	74%	0.744	S	S	*	*			trans	-57.3	102.3	168.2	-81.3	-177.3	168.3	179.5	-3.1	109.5	T70 S74	T70-R72 PolarHBondContact O-N 2.86Å; T70-R72 VanDerWaalsContact O-N 3.07Å; R72-S74 PolarHBondContact O-N 3.5Å; R72-S74 VanDerWaalsContact O-N 3.12Å
73	R	28.3	Very low	30.8	Very low	241 Å²	241	142.6 Å²	142.6	91%	0.909	75%	0.752	S	S	*	*			trans	-63.7	110.5	173.1	-77.5	-176.2	171.7	178.9	-1.5	109.8	V71	V71-R73 PolarHBondContact O-N 3.18Å
74	S	30.9	Very low	30.4	Very low	102 Å²	102	147 Å²	147	71%	0.713	78%	0.775	S	S	*	*			trans	-69.7	132	165.3	52	0	0	0	0	109.7	R72 R76	R72-S74 PolarHBondContact O-N 3.5Å; R72-S74 VanDerWaalsContact O-N 3.12Å; S74-R76 VanDerWaalsContact C-N 3.3Å; S74-R76 PolarHBondContact O-N 3.24Å
75	S	30.4	Very low	30.5	Very low	123 Å²	123	149.3 Å²	149.3	86%	0.86	78%	0.784	S	S	*	*			trans	-80.3	67	-169.6	42.8	0	0	0	0	113.1	R77	S75-R77 PolarHBondContact O-N 2.57Å
76	R	30	Very low	30.2	Very low	232 Å²	232	155.7 Å²	155.7	88%	0.875	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-68.4	116.4	165.9	-68.3	-169.1	179.4	-161.7	-0.1	109.3	S74 A78	S74-R76 VanDerWaalsContact C-N 3.3Å; S74-R76 PolarHBondContact O-N 3.24Å; R76-A78 PolarHBondContact O-N 2.57Å
77	R	31.7	Very low	30.4	Very low	239 Å²	239	155.1 Å²	155.1	90%	0.902	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-57.8	120.2	172	-76.8	178.8	169.7	172.3	-3.7	109.5	S75 V79	S75-R77 PolarHBondContact O-N 2.57Å; R77-V79 PolarHBondContact O-N 3.07Å
78	A	29.9	Very low	30.1	Very low	102 Å²	102	154.5 Å²	154.5	84%	0.843	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-75.4	118.7	167.9	0	0	0	0	0	109.1	R76	R76-A78 PolarHBondContact O-N 2.57Å
79	V	34.2	Very low	30	Very low	139 Å²	139	155.2 Å²	155.2	84%	0.842	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-79.4	126.5	166.4	178.6	0	0	0	0	107.3	R77	R77-V79 PolarHBondContact O-N 3.07Å
80	A	33.6	Very low	30	Very low	80 Å²	80	160.4 Å²	160.4	66%	0.661	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-67.1	143.2	177.9	0	0	0	0	0	110.8	K82	A80-K82 PolarHBondContact O-N 2.88Å
81	P	30.2	Very low	29.9	Very low	126 Å²	126	157.5 Å²	157.5	82%	0.818	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-65.5	123.6	176.6	27.5	-33.6	0	0	0	109.9
82	K	30.6	Very low	29.9	Very low	198 Å²	198	158.7 Å²	158.7	86%	0.861	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-66.4	133.3	169.4	-69.8	-174.4	175.1	-174	0	109	A80	A80-K82 PolarHBondContact O-N 2.88Å
83	R	29.4	Very low	30	Very low	208 Å²	208	155.4 Å²	155.4	79%	0.785	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-71.7	149.6	157.8	-73.8	-175.8	173	-176.2	-3.2	109
84	L	28.7	Very low	29.9	Very low	166 Å²	166	150 Å²	150	87%	0.869	81%	0.807	S	S	*	*			trans	-96.6	92.7	165.7	-75.2	166.3	0	0	0	106.7
85	D	29.7	Very low	29.8	Very low	133 Å²	133	151.4 Å²	151.4	71%	0.711	81%	0.811	S	S	*	*			trans	-92.6	117.5	173.9	-57.6	-48.2	0	0	0	107.7
86	F	24.4	Very low	29.7	Very low	210 Å²	210	149 Å²	149	92%	0.921	80%	0.799	S	S	*	*			trans	-94.7	129	177.1	-110.3	-89.8	0	0	0	109.6
87	S	29.5	Very low	29.6	Very low	108 Å²	108	147.1 Å²	147.1	76%	0.755	80%	0.797	S	S	*	*			trans	-152.1	140.7	168.2	-174.3	0	0	0	0	108.8
88	P	32.3	Very low	29.4	Very low	115 Å²	115	145.1 Å²	145.1	75%	0.747	80%	0.795	S	S	*	*			trans	-77.1	172.6	-178.5	32.3	-36.3	0	0	0	113.5
89	D	29.6	Very low	29.1	Very low	153 Å²	153	150 Å²	150	82%	0.818	80%	0.797	S	S	*	*			trans	-68.9	152.5	-166.3	-48.4	-88.5	0	0	0	115.9
90	M	29.2	Very low	28.7	Very low	185 Å²	185	147.7 Å²	147.7	91%	0.911	79%	0.792	S	S	*	*				-175.1	170.3	109.3	-97.9	-58.9	-150.7	0	0	112.1
91	A	28.1	Very low	28.3	Very low	80 Å²	80	153.3 Å²	153.3	66%	0.661	80%	0.802	S	S	*	*			trans	-70.7	173.9	171.6	0	0	0	0	0	111.6
92	D	29.1	Very low	27.9	Very low	148 Å²	148	152.5 Å²	152.5	79%	0.791	80%	0.795	S	S	*	*			cis	-159.3	178.8	21.2	-146.4	-19.2	0	0	0	113.5
93	E	29.9	Very low	27.6	Very low	176 Å²	176	152 Å²	152	82%	0.822	79%	0.793	S	S	*	*			trans	58	147.1	158.9	-64.4	-143.7	122.4	0	0	122.2
94	T	26.3	Very low	27.3	Very low	127 Å²	127	149.9 Å²	149.9	78%	0.779	79%	0.789	S	S	*	*			trans	-103.8	160.7	-171.9	56.6	0	0	0	0	111.7
95	V	29.6	Very low	27.2	Very low	132 Å²	132	148.9 Å²	148.9	80%	0.8	78%	0.78	S	S	*	*				162.2	124.2	122.9	159.6	0	0	0	0	114.6
96	A	28.7	Very low	27.3	Very low	73 Å²	73	150.8 Å²	150.8	60%	0.603	79%	0.786	S	S	*	*			trans	45.1	112.8	144.3	0	0	0	0	0	125.5
97	K	26.7	Very low	27.5	Very low	191 Å²	191	146.5 Å²	146.5	83%	0.83	78%	0.78	S	S	*	*				74	135	112.6	-69	171.4	-176.2	163.8	0	122.9
98	K	27.1	Very low	27.4	Very low	198 Å²	198	149.1 Å²	149.1	86%	0.861	78%	0.78	S	S	*	*			trans	91	114.4	143.4	-79.5	175.9	177	-177	0	120.5
99	K	24.7	Very low	27.4	Very low	205 Å²	205	153.9 Å²	153.9	89%	0.891	79%	0.789	S	S	*	*			trans	-33.3	152.1	150	-52.4	167.8	177.4	176.9	0	112.2
100	A	25.6	Very low	27.4	Very low	89 Å²	89	155.2 Å²	155.2	74%	0.736	79%	0.788	S	S	*	*			cis	-170.3	167.4	43.6	0	0	0	0	0	116.1
101	K	24.3	Very low	27.4	Very low	199 Å²	199	158 Å²	158	87%	0.865	79%	0.788	S	S	*	*			trans	70.8	105.3	137.7	-101.5	-174.2	179.6	-175	0	120.7
102	T	23	Very low	27.7	Very low	109 Å²	109	161.7 Å²	161.7	67%	0.669	80%	0.795	S	S	*	*				137	127.2	102.5	-47.8	0	0	0	0	117.3
103	K	23.8	Very low	27.8	Very low	188 Å²	188	161.8 Å²	161.8	82%	0.817	79%	0.788	S	S	*	*			trans	69.1	149.5	152	-85.8	176.7	179	-179.4	0	122.8
104	K	24.1	Very low	28	Very low	163 Å²	163	161.2 Å²	161.2	71%	0.709	79%	0.791	S	S	*	*			trans	68	143.5	160.3	-76.6	179.3	160.5	-108.7	0	115.6
105	E	25.1	Very low	28.3	Very low	144 Å²	144	161.9 Å²	161.9	67%	0.673	79%	0.785	S	S	*	*			cis	-151.6	157	-7.7	-141.5	137.5	-151.2	0	0	110.7
106	M	31.7	Very low	28.7	Very low	173 Å²	173	163 Å²	163	85%	0.852	79%	0.787	S	S	*	*			trans	-114	132.7	164.4	-87.9	-175.9	64.4	0	0	109.2
107	P	29.8	Very low	29	Very low	120 Å²	120	168.7 Å²	168.7	78%	0.779	80%	0.801	S	S	*	*			trans	-108	141.1	154.3	22.6	-6.5	0	0	0	111.3
108	E	27.2	Very low	29.6	Very low	164 Å²	164	167.1 Å²	167.1	77%	0.766	80%	0.8	S	S	*	*			trans	-69.9	152	172.6	-55.6	166.9	105.5	0	0	111.3
109	K	32	Very low	29.9	Very low	215 Å²	215	164.3 Å²	164.3	94%	0.935	80%	0.795	S	S	*	*			trans	-98.7	110.6	152.7	-85	-168.5	171.9	-174	0	109.1
110	K	30.1	Very low	30.8	Very low	181 Å²	181	162.6 Å²	162.6	79%	0.787	79%	0.79	S	S	*	*			trans	-67.3	152.6	169.9	-75.4	-178.4	175.9	177.1	0	110.5
111	R	29.1	Very low	31.3	Very low	244 Å²	244	165.1 Å²	165.1	92%	0.921	80%	0.797	S	S	*	*			trans	-68.4	143.6	166.3	-64.5	174.9	175.7	174.8	-4.4	109.8
112	I	33.7	Very low	32.3	Very low	157 Å²	157	163.8 Å²	163.8	81%	0.805	80%	0.799	S	S	*	*			trans	-122.4	133	153.1	-70.5	178.2	0	0	0	105.2
113	K	31.7	Very low	33.4	Very low	150 Å²	150	165.5 Å²	165.5	65%	0.652	80%	0.804	S	S	*	*			trans	-78.2	153.1	163	-76.4	178	150.5	-157.6	0	107.2	E115	K113-E115 WeakPolarHBondContact CE-OE1 3.5Å; K113-E115 IonicContact NZ-OE1 2.7Å; K113-E115 PolarHBondContact NZ-OE1 3.47Å
114	D	33	Very low	34.8	Very low	163 Å²	163	160.3 Å²	160.3	87%	0.872	80%	0.804	S	S	*	*				-143.3	161.7	125.8	-83.9	-47.4	0	0	0	107.8
115	E	33.9	Very low	36.3	Very low	141 Å²	141	155.3 Å²	155.3	66%	0.659	80%	0.799	S	S	*	*			trans	-110.9	174.3	-167.4	-71.4	174	170.8	0	0	112	K113	K113-E115 WeakPolarHBondContact CE-OE1 3.5Å; K113-E115 IonicContact NZ-OE1 2.7Å; K113-E115 PolarHBondContact NZ-OE1 3.47Å
116	D	38.2	Very low	38.6	Very low	156 Å²	156	152.9 Å²	152.9	83%	0.834	79%	0.79	S	S	*	*			trans	-65	145.9	-161.4	-47.4	-82.3	0	0	0	115.4
117	E	34.4	Very low	41	Very low	192 Å²	192	147.9 Å²	147.9	90%	0.897	77%	0.772	S	S	*	*				-154.8	164.3	122.2	-121.5	174.2	-166	0	0	111.6
118	L	39.9	Very low	43.4	Very low	158 Å²	158	146 Å²	146	83%	0.827	77%	0.766	S	S	*	*			trans	-98.6	154.2	-166.3	-52.7	89.7	0	0	0	112.5
119	D	32.9	Very low	45.7	Very low	140 Å²	140	145.8 Å²	145.8	75%	0.749	76%	0.76	S	S	*	*				-157.4	176.5	104.8	-140.9	-20.5	0	0	0	112.9
120	Q	42.7	Very low	48	Very low	169 Å²	169	139.2 Å²	139.2	79%	0.79	73%	0.732	S	S	*	*			trans	-87.8	133.6	-163.9	-59.6	146.7	78.6	0	0	114.1
121	T	35.9	Very low	50.5	Low	142 Å²	142	135.2 Å²	135.2	87%	0.871	72%	0.719	S	S	*	*			trans	-131.1	130	139.8	46.5	0	0	0	0	110.3
122	N	46.6	Very low	53.2	Low	170 Å²	170	129 Å²	129	91%	0.909	70%	0.7	S	S	*	*			trans	-98	92.3	-178.9	179.8	31.2	0	0	0	109
123	D	45.4	Very low	55.9	Low	145 Å²	145	128.2 Å²	128.2	78%	0.775	69%	0.687	S	S	*	*			trans	-120.2	128.8	172.4	-168.7	14.7	0	0	0	110.7	G125	D123-G125 PolarHBondContact O-N 2.74Å
124	G	53.3	Low	58.5	Low	80 Å²	80	125 Å²	125	83%	0.825	68%	0.677	S	S	*	*			trans	-79.8	23.6	-169.8	0	0	0	0	0	114.7	L126	G124-L126 PolarHBondContact O-N 3.47Å
125	G	55.2	Low	61.2	Low	58 Å²	58	122.1 Å²	122.1	60%	0.598	66%	0.658	S	S	*	*			trans	-82	112	-175.5	0	0	0	0	0	112.9	D123	D123-G125 PolarHBondContact O-N 2.74Å
126	L	74.8	Confident	63.7	Low	92 Å²	92	118.6 Å²	118.6	48%	0.482	64%	0.644	S	S	.	*			trans	-59.2	136.5	166.4	-74.8	157.8	0	0	0	110.2	G124 E130 L131 L134	G124-L126 PolarHBondContact O-N 3.47Å; L126-E130 HydrophobicContact CB-CB 4.27Å; L126-E130 HydrophobicContact CD2-CB 4.12Å; L126-L131 HydrophobicContact CB-CD2 4.02Å; L126-L131 HydrophobicContact CB-CG 4.17Å; L126-L131 HydrophobicContact CD1-CD2 4.44Å; L126-L134 HydrophobicContact CD1-CD1 3.67Å
127	S	81.9	Confident	66.1	Low	68 Å²	68	114.2 Å²	114.2	48%	0.476	62%	0.62	S	S	.	*			trans	-60.6	152.8	180	179.6	0	0	0	0	111.5	Y129 E130 L131	S127-Y129 PolarHBondContact O-N 2.87Å; S127-Y129 VanDerWaalsContact O-N 3.11Å; S127-E130 WeakPolarHBondContact CB-OE2 3.3Å; S127-E130 PolarHBondContact N-OE2 3.24Å; S127-E130 CarbonylContact O-C 3.52Å; S127-E130 WeakPolarHBondContact O-CA 3.45Å; S127-E130 WeakPolarHBondContact O-CB 3.47Å; S127-E130 PolarHBondContact O-N 2.78Å; S127-L131 PolarHBondContact O-N 2.75Å
128	A	78.7	Confident	68.8	Low	80 Å²	80	112.4 Å²	112.4	66%	0.661	61%	0.609	S	S	*	*	H	α-helix	trans	-53.1	-36.5	178.4	0	0	0	0	0	112.8	E132	A128-E132 PolarHBondContact O-N 2.77Å
129	Y	76.8	Confident	71.1	Confident	160 Å²	160	109.8 Å²	109.8	63%	0.627	59%	0.591	S	S	*	*	H	α-helix	trans	-67.2	-34.5	173.5	175.8	-106.4	0	0	0	113.2	S127 R133	S127-Y129 PolarHBondContact O-N 2.87Å; S127-Y129 VanDerWaalsContact O-N 3.11Å; Y129-R133 WeakPolarHBondContact O-CB 3.43Å; Y129-R133 PolarHBondContact O-N 2.73Å
130	E	80.4	Confident	73.6	Confident	78 Å²	78	107.8 Å²	107.8	36%	0.364	58%	0.58	S	S	.	*	H	α-helix	trans	-75.4	-35.5	178.1	-62.9	179	121.5	0	0	111.6	L126 S127 R133 L134	L126-E130 HydrophobicContact CB-CB 4.27Å; L126-E130 HydrophobicContact CD2-CB 4.12Å; S127-E130 WeakPolarHBondContact CB-OE2 3.3Å; S127-E130 PolarHBondContact N-OE2 3.24Å; S127-E130 CarbonylContact O-C 3.52Å; S127-E130 WeakPolarHBondContact O-CA 3.45Å; S127-E130 WeakPolarHBondContact O-CB 3.47Å; S127-E130 PolarHBondContact O-N 2.78Å; E130-R133 PolarHBondContact O-N 2.9Å; E130-L134 WeakPolarHBondContact O-CB 3.35Å; E130-L134 VanDerWaalsContact O-CG 3.26Å; E130-L134 WeakPolarHBondContact O-CG 3.49Å; E130-L134 PolarHBondContact O-N 2.83Å
131	L	83.1	Confident	75.6	Confident	97 Å²	97	105.6 Å²	105.6	51%	0.508	57%	0.57	S	S	.	*	H	α-helix	trans	-62.7	-48.8	170.4	-67	172.7	0	0	0	111.2	L126 S127 R133 L134 E135	L126-L131 HydrophobicContact CB-CD2 4.02Å; L126-L131 HydrophobicContact CB-CG 4.17Å; L126-L131 HydrophobicContact CD1-CD2 4.44Å; S127-L131 PolarHBondContact O-N 2.75Å; L131-R133 VanDerWaalsContact C-N 3.32Å; L131-R133 PolarHBondContact O-N 2.96Å; L131-L134 PolarHBondContact O-N 3.01Å; L131-E135 PolarHBondContact O-N 2.89Å
132	E	84.3	Confident	78	Confident	113 Å²	113	101.5 Å²	101.5	53%	0.528	55%	0.55	S	S	.	*	H	α-helix	trans	-60.2	-41.9	174.5	-168.5	-165.5	167.2	0	0	111.5	A128 E135 N136	A128-E132 PolarHBondContact O-N 2.77Å; E132-E135 PolarHBondContact O-N 3.49Å; E132-N136 WeakPolarHBondContact O-CB 3.35Å; E132-N136 PolarHBondContact O-N 3.35Å; E132-N136 PolarHBondContact O-ND2 3.32Å; E132-N136 VanDerWaalsContact O-ND2 3.09Å
133	R	90.6	Very high	79.8	Confident	140 Å²	140	99.5 Å²	99.5	53%	0.528	53%	0.534	S	S	.	.	H	α-helix	trans	-63.3	-41.3	176	179.2	174.3	172.9	-110.6	-2.8	112.1	Y129 E130 L131 N136 I137	Y129-R133 WeakPolarHBondContact O-CB 3.43Å; Y129-R133 PolarHBondContact O-N 2.73Å; E130-R133 PolarHBondContact O-N 2.9Å; L131-R133 VanDerWaalsContact C-N 3.32Å; L131-R133 PolarHBondContact O-N 2.96Å; R133-N136 PolarHBondContact O-N 2.84Å; R133-I137 HydrophobicContact CG-CD1 4.11Å; R133-I137 WeakPolarHBondContact O-CD1 3.39Å; R133-I137 VanDerWaalsContact O-CG1 3.23Å; R133-I137 WeakPolarHBondContact O-CG1 3.47Å; R133-I137 PolarHBondContact O-N 3.01Å
134	L	86.9	Confident	81.4	Confident	83 Å²	83	97.7 Å²	97.7	44%	0.435	52%	0.524	S	S	.	.	H	α-helix	trans	-68.5	-38.8	175.7	-77	168.2	0	0	0	111.9	L126 E130 L131 I137 K138	L126-L134 HydrophobicContact CD1-CD1 3.67Å; E130-L134 WeakPolarHBondContact O-CB 3.35Å; E130-L134 VanDerWaalsContact O-CG 3.26Å; E130-L134 WeakPolarHBondContact O-CG 3.49Å; E130-L134 PolarHBondContact O-N 2.83Å; L131-L134 PolarHBondContact O-N 3.01Å; L134-I137 PolarHBondContact O-N 2.92Å; L134-K138 WeakPolarHBondContact O-CB 3.34Å; L134-K138 PolarHBondContact O-N 2.83Å
135	E	88.6	Confident	82.7	Confident	102 Å²	102	97.8 Å²	97.8	48%	0.477	51%	0.512	S	S	.	.	H	α-helix	trans	-65.2	-41.2	175.1	-153.3	-154.4	166.4	0	0	111.2	L131 E132 K138 K139	L131-E135 PolarHBondContact O-N 2.89Å; E132-E135 PolarHBondContact O-N 3.49Å; E135-K138 PolarHBondContact O-N 3.18Å; E135-K139 VanDerWaalsContact CD-CE 3.42Å; E135-K139 WeakPolarHBondContact O-CB 3.48Å; E135-K139 VanDerWaalsContact O-CG 3.31Å; E135-K139 WeakPolarHBondContact O-CG 3.46Å; E135-K139 PolarHBondContact O-N 3.41Å; E135-K139 WeakPolarHBondContact OE1-CE 3.41Å; E135-K139 IonicContact OE1-NZ 2.6Å; E135-K139 PolarHBondContact OE1-NZ 3.1Å; E135-K139 IonicContact OE2-NZ 3.36Å; E135-K139 PolarHBondContact OE2-NZ 2.9Å
136	N	87.4	Confident	84	Confident	67 Å²	67	99.1 Å²	99.1	36%	0.358	51%	0.512	S	S	.	.	H	α-helix	trans	-65.8	-37.3	173.2	-79.2	-46.4	0	0	0	112.6	E132 R133 N140	E132-N136 WeakPolarHBondContact O-CB 3.35Å; E132-N136 PolarHBondContact O-N 3.35Å; E132-N136 PolarHBondContact O-ND2 3.32Å; E132-N136 VanDerWaalsContact O-ND2 3.09Å; R133-N136 PolarHBondContact O-N 2.84Å; N136-N140 WeakPolarHBondContact O-CB 3.41Å; N136-N140 VanDerWaalsContact O-CG 3.27Å; N136-N140 PolarHBondContact O-N 3.42Å; N136-N140 PolarHBondContact O-ND2 3.12Å
137	I	88.6	Confident	84.3	Confident	65 Å²	65	98.1 Å²	98.1	33%	0.333	51%	0.506	S	S	.	.	H	α-helix	trans	-61.8	-45.3	170.5	-72.7	162.7	0	0	0	110.3	R133 L134 N140 Q141	R133-I137 HydrophobicContact CG-CD1 4.11Å; R133-I137 WeakPolarHBondContact O-CD1 3.39Å; R133-I137 VanDerWaalsContact O-CG1 3.23Å; R133-I137 WeakPolarHBondContact O-CG1 3.47Å; R133-I137 PolarHBondContact O-N 3.01Å; L134-I137 PolarHBondContact O-N 2.92Å; I137-N140 PolarHBondContact O-N 3.5Å; I137-Q141 HydrophobicContact CG2-CG 4.38Å; I137-Q141 WeakPolarHBondContact O-CB 3.43Å; I137-Q141 WeakPolarHBondContact O-CG 3.48Å; I137-Q141 PolarHBondContact O-N 2.92Å
138	K	90.8	Very high	84.1	Confident	153 Å²	153	99.2 Å²	99.2	67%	0.665	51%	0.507	S	S	*	.	H	α-helix	trans	-64.2	-42.4	179.3	-169.8	177.4	-177.6	-179.7	0	112.4	L134 E135 Q141 A142	L134-K138 WeakPolarHBondContact O-CB 3.34Å; L134-K138 PolarHBondContact O-N 2.83Å; E135-K138 PolarHBondContact O-N 3.18Å; K138-Q141 PolarHBondContact O-N 2.89Å; K138-A142 WeakPolarHBondContact O-CB 3.27Å; K138-A142 PolarHBondContact O-N 3.07Å
139	K	89	Confident	83.9	Confident	104 Å²	104	100.5 Å²	100.5	45%	0.452	50%	0.502	S	S	.	.	H	α-helix	trans	-60.9	-46.3	173.4	-74	165.2	-178.9	163.2	0	111.4	E135 A142 F143	E135-K139 VanDerWaalsContact CD-CE 3.42Å; E135-K139 WeakPolarHBondContact O-CB 3.48Å; E135-K139 VanDerWaalsContact O-CG 3.31Å; E135-K139 WeakPolarHBondContact O-CG 3.46Å; E135-K139 PolarHBondContact O-N 3.41Å; E135-K139 WeakPolarHBondContact OE1-CE 3.41Å; E135-K139 IonicContact OE1-NZ 2.6Å; E135-K139 PolarHBondContact OE1-NZ 3.1Å; E135-K139 IonicContact OE2-NZ 3.36Å; E135-K139 PolarHBondContact OE2-NZ 2.9Å; K139-A142 PolarHBondContact O-N 2.86Å; K139-F143 WeakPolarHBondContact O-CB 3.29Å; K139-F143 PolarHBondContact O-N 3.49Å
140	N	84.9	Confident	83.6	Confident	98 Å²	98	99.1 Å²	99.1	52%	0.524	51%	0.505	S	S	.	.	H	α-helix	trans	-66.3	-38.1	177	-74.4	-40.8	0	0	0	112.7	N136 I137 F143 L144	N136-N140 WeakPolarHBondContact O-CB 3.41Å; N136-N140 VanDerWaalsContact O-CG 3.27Å; N136-N140 PolarHBondContact O-N 3.42Å; N136-N140 PolarHBondContact O-ND2 3.12Å; I137-N140 PolarHBondContact O-N 3.5Å; N140-F143 PolarHBondContact O-N 2.87Å; N140-L144 WeakPolarHBondContact O-CB 3.13Å; N140-L144 VanDerWaalsContact O-CG 3.27Å; N140-L144 WeakPolarHBondContact O-CG 3.22Å; N140-L144 PolarHBondContact O-N 3.12Å
141	Q	84.6	Confident	83.4	Confident	123 Å²	123	100.3 Å²	100.3	58%	0.575	51%	0.51	S	S	*	.	H	α-helix	trans	-64.8	-44.9	173.6	-77.3	174.2	-16.8	0	0	111.7	I137 K138 F143 L144 S145	I137-Q141 HydrophobicContact CG2-CG 4.38Å; I137-Q141 WeakPolarHBondContact O-CB 3.43Å; I137-Q141 WeakPolarHBondContact O-CG 3.48Å; I137-Q141 PolarHBondContact O-N 2.92Å; K138-Q141 PolarHBondContact O-N 2.89Å; Q141-F143 PolarHBondContact O-N 3.25Å; Q141-L144 PolarHBondContact O-N 2.91Å; Q141-S145 WeakPolarHBondContact O-CB 2.98Å; Q141-S145 PolarHBondContact O-N 3.3Å; Q141-S145 PolarHBondContact O-OG 3.25Å
142	A	85.6	Confident	82.9	Confident	55 Å²	55	98.1 Å²	98.1	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-58.4	-47.1	175.4	0	0	0	0	0	111.4	K138 K139 L144 S145 S146	K138-A142 WeakPolarHBondContact O-CB 3.27Å; K138-A142 PolarHBondContact O-N 3.07Å; K139-A142 PolarHBondContact O-N 2.86Å; A142-L144 PolarHBondContact O-N 3.42Å; A142-S145 WeakPolarHBondContact CA-OG 3.45Å; A142-S145 PolarHBondContact O-N 3.34Å; A142-S145 VanDerWaalsContact O-N 3.13Å; A142-S145 PolarHBondContact O-OG 3.2Å; A142-S146 PolarHBondContact O-N 3.21Å; A142-S146 PolarHBondContact O-OG 2.96Å
143	F	86	Confident	82.3	Confident	128 Å²	128	99.9 Å²	99.9	56%	0.561	51%	0.508	S	S	*	.	H	α-helix	trans	-62.1	-40.6	175.6	-179.1	-102.9	0	0	0	113.4	K139 N140 Q141 S145 S146 I147	K139-F143 WeakPolarHBondContact O-CB 3.29Å; K139-F143 PolarHBondContact O-N 3.49Å; N140-F143 PolarHBondContact O-N 2.87Å; Q141-F143 PolarHBondContact O-N 3.25Å; F143-S145 PolarHBondContact O-N 3.14Å; F143-S146 PolarHBondContact O-N 3.49Å; F143-S146 PolarHBondContact O-OG 3.13Å; F143-I147 HydrophobicContact CD1-CD1 4.09Å; F143-I147 HydrophobicContact CE1-CD1 3.58Å; F143-I147 HydrophobicContact CE2-CD1 4.45Å; F143-I147 HydrophobicContact CZ-CD1 3.79Å; F143-I147 WeakPolarHBondContact O-CG1 3.27Å; F143-I147 PolarHBondContact O-N 2.78Å; F143-I147 VanDerWaalsContact O-N 3.14Å
144	L	78	Confident	81.5	Confident	108 Å²	108	98.6 Å²	98.6	57%	0.565	51%	0.508	S	S	*	.	H	α-helix	trans	-72.2	-16.2	175.1	-72.2	171.5	0	0	0	113.7	N140 Q141 A142 I147	N140-L144 WeakPolarHBondContact O-CB 3.13Å; N140-L144 VanDerWaalsContact O-CG 3.27Å; N140-L144 WeakPolarHBondContact O-CG 3.22Å; N140-L144 PolarHBondContact O-N 3.12Å; Q141-L144 PolarHBondContact O-N 2.91Å; A142-L144 PolarHBondContact O-N 3.42Å; L144-I147 VanDerWaalsContact O-O 3.09Å
145	S	80.8	Confident	80.8	Confident	82 Å²	82	98.3 Å²	98.3	57%	0.573	51%	0.507	S	S	*	.	H	α-helix	trans	-90.6	-29.1	172	67.5	0	0	0	0	113.9	Q141 A142 F143 N148	Q141-S145 WeakPolarHBondContact O-CB 2.98Å; Q141-S145 PolarHBondContact O-N 3.3Å; Q141-S145 PolarHBondContact O-OG 3.25Å; A142-S145 WeakPolarHBondContact CA-OG 3.45Å; A142-S145 PolarHBondContact O-N 3.34Å; A142-S145 VanDerWaalsContact O-N 3.13Å; A142-S145 PolarHBondContact O-OG 3.2Å; F143-S145 PolarHBondContact O-N 3.14Å; S145-N148 PolarHBondContact O-OD1 3.37Å
146	S	83	Confident	79.6	Confident	86 Å²	86	99.6 Å²	99.6	60%	0.601	52%	0.516	S	S	*	.	H	α-helix	trans	-79.4	-23.1	174.7	63	0	0	0	0	112.8	A142 F143 N148	A142-S146 PolarHBondContact O-N 3.21Å; A142-S146 PolarHBondContact O-OG 2.96Å; F143-S146 PolarHBondContact O-N 3.49Å; F143-S146 PolarHBondContact O-OG 3.13Å; S146-N148 PolarHBondContact O-N 3.07Å
147	I	80.2	Confident	78.5	Confident	70 Å²	70	102.9 Å²	102.9	36%	0.359	53%	0.529	S	S	.	.	S	Bend	trans	-74.1	104.2	155	-59.6	169.6	0	0	0	106.7	F143 L144 L149	F143-I147 HydrophobicContact CD1-CD1 4.09Å; F143-I147 HydrophobicContact CE1-CD1 3.58Å; F143-I147 HydrophobicContact CE2-CD1 4.45Å; F143-I147 HydrophobicContact CZ-CD1 3.79Å; F143-I147 WeakPolarHBondContact O-CG1 3.27Å; F143-I147 PolarHBondContact O-N 2.78Å; F143-I147 VanDerWaalsContact O-N 3.14Å; L144-I147 VanDerWaalsContact O-O 3.09Å; I147-L149 HydrophobicContact CG2-CB 4.25Å; I147-L149 HydrophobicContact CG2-CD1 3.83Å; I147-L149 HydrophobicContact CG2-CG 3.8Å; I147-L149 PolarHBondContact O-N 3.29Å
148	N	77.6	Confident	77.1	Confident	91 Å²	91	106.7 Å²	106.7	49%	0.487	55%	0.546	S	S	.	.			trans	-69.5	52	-179.4	-70.9	7	0	0	0	113.4	S145 S146 L150 Q151 A152	S145-N148 PolarHBondContact O-OD1 3.37Å; S146-N148 PolarHBondContact O-N 3.07Å; N148-L150 VanDerWaalsContact C-N 3.3Å; N148-L150 PolarHBondContact O-N 2.63Å; N148-Q151 HydrophobicContact CB-CB 4.09Å; N148-Q151 PolarHBondContact ND2-OE1 3.43Å; N148-Q151 VanDerWaalsContact ND2-OE1 3.13Å; N148-Q151 PolarHBondContact O-N 2.81Å; N148-A152 WeakPolarHBondContact O-CB 3.18Å; N148-A152 PolarHBondContact O-N 2.94Å
149	L	75.2	Confident	75.2	Confident	108 Å²	108	104 Å²	104	57%	0.565	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-28.2	-175.1	-111.9	164.6	0	0	0	113.4	I147 R153	I147-L149 HydrophobicContact CG2-CB 4.25Å; I147-L149 HydrophobicContact CG2-CD1 3.83Å; I147-L149 HydrophobicContact CG2-CG 3.8Å; I147-L149 PolarHBondContact O-N 3.29Å; L149-R153 VanDerWaalsContact O-CB 3.3Å; L149-R153 WeakPolarHBondContact O-CB 3.5Å; L149-R153 PolarHBondContact O-N 2.74Å
150	L	70.4	Confident	73.3	Confident	130 Å²	130	104.2 Å²	104.2	68%	0.681	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-45.5	172.9	-65.2	177.4	0	0	0	110.9	N148 R153 E154	N148-L150 VanDerWaalsContact C-N 3.3Å; N148-L150 PolarHBondContact O-N 2.63Å; L150-R153 CarbonylContact O-C 3.56Å; L150-R153 WeakPolarHBondContact O-CA 3.46Å; L150-R153 WeakPolarHBondContact O-CB 3.43Å; L150-R153 PolarHBondContact O-N 2.75Å; L150-R153 VanDerWaalsContact O-N 3.12Å; L150-E154 PolarHBondContact O-N 2.85Å
151	Q	75.3	Confident	71.9	Confident	103 Å²	103	110.2 Å²	110.2	48%	0.481	57%	0.568	S	S	.	*	H	α-helix	trans	-65.7	-46	177.6	-158.6	169.9	10.5	0	0	111.1	N148 R153 E154 D155	N148-Q151 HydrophobicContact CB-CB 4.09Å; N148-Q151 PolarHBondContact ND2-OE1 3.43Å; N148-Q151 VanDerWaalsContact ND2-OE1 3.13Å; N148-Q151 PolarHBondContact O-N 2.81Å; Q151-R153 PolarHBondContact O-N 2.99Å; Q151-R153 VanDerWaalsContact O-N 3.11Å; Q151-E154 CarbonylContact O-C 3.52Å; Q151-E154 WeakPolarHBondContact O-CA 3.44Å; Q151-E154 WeakPolarHBondContact O-CB 3.48Å; Q151-E154 PolarHBondContact O-N 3.35Å; Q151-D155 PolarHBondContact O-N 3.05Å
152	A	73.1	Confident	70.6	Confident	51 Å²	51	107.6 Å²	107.6	42%	0.421	56%	0.562	S	S	.	*	H	α-helix	trans	-61.4	-21.9	173.3	0	0	0	0	0	113.7	N148 L156	N148-A152 WeakPolarHBondContact O-CB 3.18Å; N148-A152 PolarHBondContact O-N 2.94Å; A152-L156 WeakPolarHBondContact O-CB 2.99Å; A152-L156 PolarHBondContact O-N 2.81Å
153	R	72.8	Confident	69.1	Low	150 Å²	150	113.2 Å²	113.2	57%	0.566	58%	0.575	S	S	*	*	H	α-helix	trans	-80.6	-37.2	169.9	171.2	-178.4	175.1	-162.9	-6.3	111.8	L149 L150 Q151 L156 H157	L149-R153 VanDerWaalsContact O-CB 3.3Å; L149-R153 WeakPolarHBondContact O-CB 3.5Å; L149-R153 PolarHBondContact O-N 2.74Å; L150-R153 CarbonylContact O-C 3.56Å; L150-R153 WeakPolarHBondContact O-CA 3.46Å; L150-R153 WeakPolarHBondContact O-CB 3.43Å; L150-R153 PolarHBondContact O-N 2.75Å; L150-R153 VanDerWaalsContact O-N 3.12Å; Q151-R153 PolarHBondContact O-N 2.99Å; Q151-R153 VanDerWaalsContact O-N 3.11Å; R153-L156 CarbonylContact O-C 3.58Å; R153-L156 WeakPolarHBondContact O-CB 3.42Å; R153-L156 PolarHBondContact O-N 3.03Å; R153-H157 PolarHBondContact NE-NE2 2.68Å; R153-H157 PolarHBondContact NH2-NE2 3.03Å; R153-H157 PolarHBondContact O-CD2 2.89Å; R153-H157 PolarHBondContact O-N 3.39Å
154	E	73.1	Confident	67.8	Low	113 Å²	113	111.3 Å²	111.3	53%	0.528	58%	0.576	S	S	.	*	H	α-helix	trans	-68.3	-40.7	174	-73.5	172.5	-179.4	0	0	111.2	L150 Q151 L156 H157 Q158	L150-E154 PolarHBondContact O-N 2.85Å; Q151-E154 CarbonylContact O-C 3.52Å; Q151-E154 WeakPolarHBondContact O-CA 3.44Å; Q151-E154 WeakPolarHBondContact O-CB 3.48Å; Q151-E154 PolarHBondContact O-N 3.35Å; E154-L156 PolarHBondContact O-N 2.96Å; E154-H157 CarbonylContact O-C 3.57Å; E154-H157 WeakPolarHBondContact O-CA 3.47Å; E154-H157 PolarHBondContact O-N 3Å; E154-Q158 WeakPolarHBondContact O-CG 3.16Å; E154-Q158 PolarHBondContact O-N 2.97Å
155	D	71.9	Confident	67.2	Low	78 Å²	78	106.9 Å²	106.9	42%	0.417	55%	0.554	S	S	.	*	H	α-helix	trans	-58.4	-37.5	170.1	-58.5	-30.8	0	0	0	111.2	Q151 H157 Q158 T159	Q151-D155 PolarHBondContact O-N 3.05Å; D155-H157 VanDerWaalsContact C-N 3.31Å; D155-H157 PolarHBondContact O-N 2.81Å; D155-Q158 PolarHBondContact O-N 3.38Å; D155-T159 WeakPolarHBondContact O-CB 3.34Å; D155-T159 WeakPolarHBondContact O-CG2 3.49Å; D155-T159 PolarHBondContact O-N 3.5Å; D155-T159 PolarHBondContact O-OG1 3.33Å
156	L	64.3	Low	66.6	Low	129 Å²	129	110.4 Å²	110.4	68%	0.675	56%	0.562	S	S	*	*	H	α-helix	trans	-71.8	-19.9	173.3	-110.2	160.2	0	0	0	114.2	A152 R153 E154 T159	A152-L156 WeakPolarHBondContact O-CB 2.99Å; A152-L156 PolarHBondContact O-N 2.81Å; R153-L156 CarbonylContact O-C 3.58Å; R153-L156 WeakPolarHBondContact O-CB 3.42Å; R153-L156 PolarHBondContact O-N 3.03Å; E154-L156 PolarHBondContact O-N 2.96Å; L156-T159 WeakPolarHBondContact CA-OG1 3.41Å
157	H	63.5	Low	66.4	Low	135 Å²	135	109.8 Å²	109.8	63%	0.625	55%	0.546	S	S	*	.	H	α-helix	trans	-92.4	-27.6	171.8	-77.3	-60.1	0	0	0	112.6	R153 E154 D155 T160	R153-H157 PolarHBondContact NE-NE2 2.68Å; R153-H157 PolarHBondContact NH2-NE2 3.03Å; R153-H157 PolarHBondContact O-CD2 2.89Å; R153-H157 PolarHBondContact O-N 3.39Å; E154-H157 CarbonylContact O-C 3.57Å; E154-H157 WeakPolarHBondContact O-CA 3.47Å; E154-H157 PolarHBondContact O-N 3Å; D155-H157 VanDerWaalsContact C-N 3.31Å; D155-H157 PolarHBondContact O-N 2.81Å; H157-T160 WeakPolarHBondContact O-CG2 2.99Å
158	Q	58.6	Low	66.6	Low	146 Å²	146	106.7 Å²	106.7	68%	0.682	53%	0.531	S	S	*	.	H	α-helix	trans	-74.4	-35.4	171.1	-69.6	176.3	45.7	0	0	110.9	E154 D155 T160	E154-Q158 WeakPolarHBondContact O-CG 3.16Å; E154-Q158 PolarHBondContact O-N 2.97Å; D155-Q158 PolarHBondContact O-N 3.38Å; Q158-T160 PolarHBondContact O-N 3.5Å; Q158-T160 PolarHBondContact O-OG1 3.17Å
159	T	52	Low	66.9	Low	97 Å²	97	102.6 Å²	102.6	60%	0.595	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	43.1	167.6	54.8	0	0	0	0	112.7	D155 L156 R161	D155-T159 WeakPolarHBondContact O-CB 3.34Å; D155-T159 WeakPolarHBondContact O-CG2 3.49Å; D155-T159 PolarHBondContact O-N 3.5Å; D155-T159 PolarHBondContact O-OG1 3.33Å; L156-T159 WeakPolarHBondContact CA-OG1 3.41Å; T159-R161 PolarHBondContact O-N 2.88Å
160	T	49.5	Very low	66.9	Low	108 Å²	108	106.9 Å²	106.9	66%	0.663	52%	0.518	S	S	*	.			trans	-56.8	102.1	164.9	28.6	0	0	0	0	109.9	H157 Q158	H157-T160 WeakPolarHBondContact O-CG2 2.99Å; Q158-T160 PolarHBondContact O-N 3.5Å; Q158-T160 PolarHBondContact O-OG1 3.17Å
161	R	55.2	Low	66.4	Low	223 Å²	223	105.1 Å²	105.1	84%	0.842	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-54.1	143.7	163.7	-63.5	-179	-178.3	174.7	1	109.1	T159 K163	T159-R161 PolarHBondContact O-N 2.88Å; R161-K163 PolarHBondContact O-N 2.93Å
162	P	56.1	Low	65.4	Low	69 Å²	69	107.7 Å²	107.7	45%	0.448	53%	0.527	S	S	.	.	P	Polyproline II helix	trans	-51.7	133.7	175.5	20.6	-31.9	0	0	0	109.9
163	K	55.4	Low	64.4	Low	172 Å²	172	110.3 Å²	110.3	75%	0.748	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-68	127.3	178.7	-71.1	171.9	-176.3	166.3	0	107	R161 S165	R161-K163 PolarHBondContact O-N 2.93Å; K163-S165 PolarHBondContact O-N 2.89Å
164	P	59.1	Low	63.2	Low	89 Å²	89	107.2 Å²	107.2	58%	0.578	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-59.6	132	-179.8	25.7	-34.4	0	0	0	109.5
165	S	63.8	Low	61.9	Low	14 Å²	14	108.5 Å²	108.5	10%	0.098	56%	0.563	C	S	.	*			trans	-39	139	-172.5	63.8	0	0	0	0	113.1	K163 V271 R578	K163-S165 PolarHBondContact O-N 2.89Å; S165-V271 WeakPolarHBondContact OG-CG1 3.46Å; S165-V271 PolarHBondContact OG-O 2.84Å; S165-R578 PolarHBondContact O-NH1 2.95Å; S165-R578 PolarHBondContact O-NH2 3.28Å; S165-R578 PolarHBondContact OG-NH1 3.22Å
166	Q	67.9	Low	61.1	Low	157 Å²	157	113.8 Å²	113.8	73%	0.734	58%	0.583	S	S	*	*			trans	-102.7	13.4	179.2	-57.6	-161.7	8.7	0	0	113.2
167	R	79.8	Confident	60.8	Low	72 Å²	72	115.4 Å²	115.4	27%	0.272	59%	0.587	S	S	.	*			trans	-67	148.8	179.3	-72.3	-160	73.2	164	-7.3	113.8	D269 V272 K273 D314	R167-D269 IonicContact CZ-OD1 3.26Å; R167-D269 IonicContact NH1-OD1 3.14Å; R167-D269 PolarHBondContact NH1-OD1 3.06Å; R167-D269 IonicContact NH1-OD2 2.66Å; R167-V272 HydrophobicContact CB-CG2 4.09Å; R167-K273 PolarHBondContact O-N 3.12Å; R167-D314 WeakPolarHBondContact CA-OD2 3.42Å; R167-D314 WeakPolarHBondContact CB-OD2 3.38Å; R167-D314 WeakPolarHBondContact CG-OD2 3.18Å; R167-D314 IonicContact CZ-OD1 3.73Å; R167-D314 VanDerWaalsContact CZ-OD1 3.26Å; R167-D314 IonicContact CZ-OD2 2.75Å; R167-D314 IonicContact NE-OD1 2.79Å; R167-D314 PolarHBondContact NE-OD1 3.03Å; R167-D314 VanDerWaalsContact NE-OD1 3.14Å; R167-D314 IonicContact NE-OD2 3.12Å; R167-D314 PolarHBondContact NE-OD2 3.18Å; R167-D314 IonicContact NH2-OD1 3.81Å; R167-D314 PolarHBondContact NH2-OD1 3.31Å; R167-D314 IonicContact NH2-OD2 3.46Å
168	G	84.3	Confident	60.6	Low	5 Å²	5	113.8 Å²	113.8	5%	0.052	60%	0.597	C	S	.	*	B	Isolated β-bridge	trans	73.3	-151.7	-173.9	0	0	0	0	0	114.7	R170 D314	G168-R170 PolarHBondContact O-N 3.49Å; G168-R170 VanDerWaalsContact O-N 3.1Å; G168-D314 PolarHBondContact N-OD2 3.29Å
169	L	84.1	Confident	61	Low	5 Å²	5	113.5 Å²	113.5	3%	0.026	60%	0.599	C	S	.	*	S	Bend	trans	-55.9	114.4	-173.6	-62.7	171	0	0	0	112.5	N226 K273 V274 K276 D313 V316 L318	L169-N226 HydrophobicContact CD2-CB 3.61Å; L169-K273 HydrophobicContact CB-CG 4.33Å; L169-K273 VanDerWaalsContact CB-O 3.26Å; L169-K273 WeakPolarHBondContact CB-O 3.27Å; L169-K273 VanDerWaalsContact CG-O 3.28Å; L169-K273 WeakPolarHBondContact CG-O 3.37Å; L169-K273 PolarHBondContact N-O 3.24Å; L169-K273 WeakPolarHBondContact O-CD 3.35Å; L169-V274 VanDerWaalsContact CD1-O 3.27Å; L169-V274 WeakPolarHBondContact CD1-O 3.24Å; L169-K276 HydrophobicContact CD1-CG 4.35Å; L169-D313 HydrophobicContact CD2-CB 4.23Å; L169-D313 WeakPolarHBondContact CD2-OD2 3.4Å; L169-V316 HydrophobicContact CD1-CG1 4.37Å; L169-V316 HydrophobicContact CD2-CG1 4.21Å; L169-V316 HydrophobicContact CG-CG1 4Å; L169-L318 HydrophobicContact CD1-CB 4.39Å; L169-L318 HydrophobicContact CD1-CD1 4.09Å; L169-L318 HydrophobicContact CD1-CD2 3.8Å; L169-L318 HydrophobicContact CD1-CG 4.32Å; L169-L318 HydrophobicContact CD2-CB 4.3Å; L169-L318 HydrophobicContact CD2-CD2 4.26Å
170	R	75.3	Confident	62	Low	198 Å²	198	114.1 Å²	114.1	75%	0.747	61%	0.605	S	S	*	*			trans	-57.2	133.2	-180	-62.6	-176.9	-176.5	-175.6	1.2	111.5	G168 Q172	G168-R170 PolarHBondContact O-N 3.49Å; G168-R170 VanDerWaalsContact O-N 3.1Å; R170-Q172 PolarHBondContact O-N 3.17Å
171	P	60	Low	63	Low	94 Å²	94	114.3 Å²	114.3	61%	0.61	61%	0.608	S	S	*	*			trans	-63.5	109.2	171.7	-18.6	31.2	0	0	0	109.8	S173	P171-S173 PolarHBondContact O-N 3.44Å
172	Q	55	Low	63.4	Low	157 Å²	157	115.7 Å²	115.7	73%	0.734	61%	0.613	S	S	*	*			trans	-63.6	106.5	169.8	-75.9	178.8	-55.8	0	0	108.1	R170 A174	R170-Q172 PolarHBondContact O-N 3.17Å; Q172-A174 VanDerWaalsContact C-N 3.35Å; Q172-A174 PolarHBondContact O-N 3.14Å
173	S	50.4	Low	63.8	Low	106 Å²	106	119.9 Å²	119.9	74%	0.741	62%	0.624	S	S	*	*			trans	-64.9	98.7	168.9	53.4	0	0	0	0	107.6	P171 V175	P171-S173 PolarHBondContact O-N 3.44Å; S173-V175 PolarHBondContact O-N 2.84Å
174	A	47.3	Very low	64.8	Low	85 Å²	85	114.6 Å²	114.6	70%	0.702	61%	0.609	S	S	*	*			trans	-51.5	118.7	168.9	0	0	0	0	0	107.7	Q172 K176	Q172-A174 VanDerWaalsContact C-N 3.35Å; Q172-A174 PolarHBondContact O-N 3.14Å; A174-K176 PolarHBondContact O-N 3.15Å
175	V	47.2	Very low	65.4	Low	139 Å²	139	115.5 Å²	115.5	84%	0.842	61%	0.609	S	S	*	*			trans	-67.2	90	178.9	-179.3	0	0	0	0	106.8	S173 E177	S173-V175 PolarHBondContact O-N 2.84Å; V175-E177 PolarHBondContact O-N 2.94Å; V175-E177 VanDerWaalsContact O-N 3.11Å
176	K	54	Low	65.4	Low	189 Å²	189	125.4 Å²	125.4	82%	0.822	64%	0.644	S	S	*	*			trans	-64.7	111.4	165.9	-67.6	-179.4	-178.8	178.2	0	105.3	A174 A178	A174-K176 PolarHBondContact O-N 3.15Å; K176-A178 PolarHBondContact O-N 2.96Å
177	E	58.3	Low	65.6	Low	163 Å²	163	125 Å²	125	76%	0.762	65%	0.646	S	S	*	*			trans	-45.8	131.6	160.6	-66.8	-173.4	124.6	0	0	107.8	V175 L179	V175-E177 PolarHBondContact O-N 2.94Å; V175-E177 VanDerWaalsContact O-N 3.11Å; E177-L179 PolarHBondContact O-N 2.65Å
178	A	59	Low	65.3	Low	101 Å²	101	125.3 Å²	125.3	84%	0.835	65%	0.651	S	S	*	*			trans	-74.5	70.7	-177.6	0	0	0	0	0	109.5	K176	K176-A178 PolarHBondContact O-N 2.96Å
179	L	68	Low	64.7	Low	141 Å²	141	132.4 Å²	132.4	74%	0.738	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-48.7	125.8	178.5	-67	179.7	0	0	0	108.4	E177	E177-L179 PolarHBondContact O-N 2.65Å
180	P	73.3	Confident	64.3	Low	110 Å²	110	137.8 Å²	137.8	71%	0.714	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-57.8	134.6	-169.4	21	-32.8	0	0	0	109.9	R182	P180-R182 PolarHBondContact O-N 2.69Å; P180-R182 VanDerWaalsContact O-N 3.14Å
181	P	69.2	Low	64.1	Low	112 Å²	112	134 Å²	134	73%	0.727	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-55.5	124.3	-172	20.7	-32.8	0	0	0	110.1	K183	P181-K183 PolarHBondContact O-N 2.85Å
182	R	63.8	Low	64.1	Low	251 Å²	251	134.5 Å²	134.5	95%	0.947	72%	0.724	S	S	*	*			trans	-62.4	87.6	-167.3	-174.7	-179.5	176.5	169.1	0.6	112	P180	P180-R182 PolarHBondContact O-N 2.69Å; P180-R182 VanDerWaalsContact O-N 3.14Å
183	K	65.8	Low	64.7	Low	157 Å²	157	134.9 Å²	134.9	68%	0.683	73%	0.725	S	S	*	*			trans	-64.4	138.2	172.8	-67.3	-176.7	-178.5	-179.4	0	109.8	P181	P181-K183 PolarHBondContact O-N 2.85Å
184	S	75.5	Confident	65.2	Low	62 Å²	62	139.4 Å²	139.4	43%	0.434	73%	0.732	S	S	.	*			trans	-65.1	133.6	-180	178.7	0	0	0	0	111.4	R186 L187 Q188	S184-R186 PolarHBondContact O-N 2.99Å; S184-R186 PolarHBondContact OG-N 2.86Å; S184-L187 WeakPolarHBondContact O-CA 3.49Å; S184-L187 WeakPolarHBondContact O-CB 3.06Å; S184-L187 PolarHBondContact O-N 2.87Å; S184-Q188 PolarHBondContact O-N 3.3Å
185	L	71.3	Confident	65.7	Low	107 Å²	107	142.3 Å²	142.3	56%	0.56	73%	0.734	S	S	*	*	G	3₁₀ helix	trans	-58.5	-32.4	175.4	-69.8	168.3	0	0	0	112.2	L187 Q188 N189 K190	L185-L187 VanDerWaalsContact C-N 3.29Å; L185-L187 PolarHBondContact O-N 2.79Å; L185-Q188 CarbonylContact O-C 3.58Å; L185-Q188 WeakPolarHBondContact O-CA 3.24Å; L185-Q188 WeakPolarHBondContact O-CB 3.3Å; L185-Q188 PolarHBondContact O-N 3.47Å; L185-N189 PolarHBondContact O-N 3.28Å; L185-K190 HydrophobicContact CD2-CD 3.88Å; L185-K190 PolarHBondContact O-N 2.95Å
186	R	65.1	Low	66.5	Low	222 Å²	222	141.5 Å²	141.5	84%	0.838	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-65.2	-30.2	173.8	-177.6	177	172.6	-173.7	-2.8	112.8	S184 Q188	S184-R186 PolarHBondContact O-N 2.99Å; S184-R186 PolarHBondContact OG-N 2.86Å; R186-Q188 VanDerWaalsContact C-N 3.28Å
187	L	71.1	Confident	66.5	Low	148 Å²	148	140.2 Å²	140.2	78%	0.775	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-83.1	-4.7	172.8	-65.6	174.4	0	0	0	112.7	S184 L185	S184-L187 WeakPolarHBondContact O-CA 3.49Å; S184-L187 WeakPolarHBondContact O-CB 3.06Å; S184-L187 PolarHBondContact O-N 2.87Å; L185-L187 VanDerWaalsContact C-N 3.29Å; L185-L187 PolarHBondContact O-N 2.79Å
188	Q	72.9	Confident	66.6	Low	80 Å²	80	137.4 Å²	137.4	37%	0.374	73%	0.727	S	S	.	*	G	3₁₀ helix	trans	-102.4	6.3	173.2	-62.6	-176.8	6.9	0	0	112.4	S184 L185 R186 K190	S184-Q188 PolarHBondContact O-N 3.3Å; L185-Q188 CarbonylContact O-C 3.58Å; L185-Q188 WeakPolarHBondContact O-CA 3.24Å; L185-Q188 WeakPolarHBondContact O-CB 3.3Å; L185-Q188 PolarHBondContact O-N 3.47Å; R186-Q188 VanDerWaalsContact C-N 3.28Å; Q188-K190 HydrophobicContact CB-CD 4.22Å; Q188-K190 HydrophobicContact CB-CG 4.19Å; Q188-K190 PolarHBondContact O-N 2.75Å
189	N	71.6	Confident	66.5	Low	153 Å²	153	142.2 Å²	142.2	82%	0.818	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.3	23.1	-174.2	-67.1	-15.9	0	0	0	114.8	L185	L185-N189 PolarHBondContact O-N 3.28Å
190	K	76.6	Confident	65.3	Low	119 Å²	119	143.7 Å²	143.7	52%	0.517	73%	0.733	S	S	.	*			trans	-76.4	133.4	177	-73.7	175.3	178.1	166.4	0	109.5	L185 Q188	L185-K190 HydrophobicContact CD2-CD 3.88Å; L185-K190 PolarHBondContact O-N 2.95Å; Q188-K190 HydrophobicContact CB-CD 4.22Å; Q188-K190 HydrophobicContact CB-CG 4.19Å; Q188-K190 PolarHBondContact O-N 2.75Å
191	P	71.7	Confident	63.8	Low	119 Å²	119	143.7 Å²	143.7	77%	0.773	73%	0.733	S	S	*	*			trans	-62.2	153.5	177.3	27.4	-34.7	0	0	0	110.6	E193	P191-E193 PolarHBondContact O-N 3.46Å
192	A	58.9	Low	62.6	Low	104 Å²	104	145.4 Å²	145.4	86%	0.86	73%	0.734	S	S	*	*			trans	-69.6	97	172.5	0	0	0	0	0	109.2	K194	A192-K194 PolarHBondContact O-N 2.86Å
193	E	68	Low	61.4	Low	164 Å²	164	139.9 Å²	139.9	77%	0.766	72%	0.723	S	S	*	*			trans	-54.8	131.6	173.3	-173.5	165.7	-141.5	0	0	109.7	P191 L195	P191-E193 PolarHBondContact O-N 3.46Å; E193-L195 PolarHBondContact O-N 3.39Å
194	K	60.8	Low	59.9	Low	202 Å²	202	137.3 Å²	137.3	88%	0.878	73%	0.725	S	S	*	*			trans	-73.3	82.2	176.3	-76.8	-172.8	178.7	178.7	0	108.8	A192 T196	A192-K194 PolarHBondContact O-N 2.86Å; K194-T196 VanDerWaalsContact C-N 3.34Å; K194-T196 PolarHBondContact O-N 2.98Å
195	L	57.7	Low	58.1	Low	145 Å²	145	140.5 Å²	140.5	76%	0.759	74%	0.736	S	S	*	*			trans	-56.5	99.7	166.1	-63.9	175.6	0	0	0	108.3	E193 L197	E193-L195 PolarHBondContact O-N 3.39Å; L195-L197 PolarHBondContact O-N 2.91Å
196	T	64.4	Low	56.2	Low	123 Å²	123	141.9 Å²	141.9	76%	0.755	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-50.7	131.4	141.7	40.4	0	0	0	0	105.9	K194 P198	K194-T196 VanDerWaalsContact C-N 3.34Å; K194-T196 PolarHBondContact O-N 2.98Å; T196-P198 WeakPolarHBondContact O-CD 3.26Å; T196-P198 VanDerWaalsContact O-N 3.14Å
197	L	53.7	Low	54.9	Low	162 Å²	162	136.5 Å²	136.5	85%	0.848	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-52.5	127.4	163.5	-74.5	167.1	0	0	0	105.8	L195 K199	L195-L197 PolarHBondContact O-N 2.91Å; L197-K199 PolarHBondContact O-N 3.13Å
198	P	59.5	Low	53.1	Low	104 Å²	104	135.1 Å²	135.1	68%	0.675	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-47.4	143.8	158.4	-22.2	33.3	0	0	0	106.7	T196 E200	T196-P198 WeakPolarHBondContact O-CD 3.26Å; T196-P198 VanDerWaalsContact O-N 3.14Å; P198-E200 PolarHBondContact O-N 3.49Å; P198-E200 VanDerWaalsContact O-N 3.1Å
199	K	57	Low	51.6	Low	202 Å²	202	138.2 Å²	138.2	88%	0.878	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-46.5	130.9	160.8	-73.1	-176.3	178	179.6	0	105.7	L197 P201	L197-K199 PolarHBondContact O-N 3.13Å; K199-P201 VanDerWaalsContact O-N 3.16Å
200	E	43	Very low	50	Low	172 Å²	172	134 Å²	134	80%	0.804	73%	0.731	S	S	*	*			trans	-44.4	132.1	174.2	-68.6	-174.4	144.4	0	0	106.7	P198 I202	P198-E200 PolarHBondContact O-N 3.49Å; P198-E200 VanDerWaalsContact O-N 3.1Å; E200-I202 PolarHBondContact O-N 2.86Å
201	P	41.4	Very low	48.8	Very low	110 Å²	110	139 Å²	139	71%	0.714	75%	0.747	S	S	*	*			trans	-59.8	98.8	169.5	25.6	-31.2	0	0	0	105.5	K199 D203	K199-P201 VanDerWaalsContact O-N 3.16Å; P201-D203 PolarHBondContact O-N 2.82Å; P201-D203 VanDerWaalsContact O-N 3.14Å
202	I	44.8	Very low	48.1	Very low	147 Å²	147	138 Å²	138	75%	0.754	74%	0.735	S	S	*	*			trans	-41.7	122.5	142.3	-59.4	173.2	0	0	0	102.8	E200 S204	E200-I202 PolarHBondContact O-N 2.86Å; I202-S204 PolarHBondContact O-N 3.06Å; I202-S204 PolarHBondContact O-OG 2.99Å
203	D	38.5	Very low	48.5	Very low	136 Å²	136	139.9 Å²	139.9	73%	0.727	73%	0.729	S	S	*	*			trans	-68.1	72.4	173.7	-79.7	-48	0	0	0	108.2	P201 L205	P201-D203 PolarHBondContact O-N 2.82Å; P201-D203 VanDerWaalsContact O-N 3.14Å; D203-L205 PolarHBondContact O-N 2.81Å
204	S	34.9	Very low	49.2	Very low	102 Å²	102	135 Å²	135	71%	0.713	71%	0.705	S	S	*	*			trans	-57.8	74.9	137.2	58.2	0	0	0	0	106.4	I202 H206	I202-S204 PolarHBondContact O-N 3.06Å; I202-S204 PolarHBondContact O-OG 2.99Å; S204-H206 PolarHBondContact O-N 2.99Å
205	L	37.7	Very low	50.5	Low	129 Å²	129	127.7 Å²	127.7	68%	0.675	67%	0.674	S	S	*	*			trans	-34.6	112.7	148.4	-64.9	165.3	0	0	0	105.7	D203 P207	D203-L205 PolarHBondContact O-N 2.81Å; L205-P207 VanDerWaalsContact O-CD 3.29Å; L205-P207 WeakPolarHBondContact O-CD 3.48Å
206	H	31.3	Very low	51.8	Low	136 Å²	136	125 Å²	125	63%	0.63	67%	0.665	S	S	*	*			trans	-50.3	122.9	170	-115.3	-84.1	0	0	0	106	S204 D208 L209	S204-H206 PolarHBondContact O-N 2.99Å; H206-D208 HydrophobicContact CB-CB 4.49Å; H206-D208 IonicContact CE1-OD2 3.15Å; H206-D208 IonicContact CG-OD2 3.71Å; H206-D208 IonicContact ND1-OD2 2.82Å; H206-D208 PolarHBondContact ND1-OD2 2.69Å; H206-D208 PolarHBondContact O-N 2.85Å; H206-L209 PolarHBondContact O-N 3.41Å
207	P	37.7	Very low	52.6	Low	110 Å²	110	122.8 Å²	122.8	71%	0.714	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.4	-19.8	174.9	-25.3	35.9	0	0	0	111.9	L205 L209	L205-P207 VanDerWaalsContact O-CD 3.29Å; L205-P207 WeakPolarHBondContact O-CD 3.48Å; P207-L209 VanDerWaalsContact C-N 3.33Å; P207-L209 CarbonylContact O-C 3.6Å
208	D	32.4	Very low	54.1	Low	119 Å²	119	116.4 Å²	116.4	64%	0.636	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	3.8	178.7	-35.6	-72.5	0	0	0	114.5	H206 A210	H206-D208 HydrophobicContact CB-CB 4.49Å; H206-D208 IonicContact CE1-OD2 3.15Å; H206-D208 IonicContact CG-OD2 3.71Å; H206-D208 IonicContact ND1-OD2 2.82Å; H206-D208 PolarHBondContact ND1-OD2 2.69Å; H206-D208 PolarHBondContact O-N 2.85Å; D208-A210 PolarHBondContact O-N 2.95Å
209	L	41.9	Very low	55.5	Low	144 Å²	144	114.4 Å²	114.4	75%	0.754	62%	0.62	S	S	*	*	S	Bend	trans	-68.6	68.3	137.6	-84.2	-178.2	0	0	0	107.3	H206 P207 R211	H206-L209 PolarHBondContact O-N 3.41Å; P207-L209 VanDerWaalsContact C-N 3.33Å; P207-L209 CarbonylContact O-C 3.6Å; L209-R211 PolarHBondContact O-N 3.25Å
210	A	39.1	Very low	57.2	Low	64 Å²	64	106.4 Å²	106.4	53%	0.529	59%	0.587	S	S	.	*			trans	-49.3	135.5	-172.2	0	0	0	0	0	109	D208 I212	D208-A210 PolarHBondContact O-N 2.95Å; A210-I212 PolarHBondContact O-N 2.87Å
211	R	49.4	Very low	59.5	Low	225 Å²	225	105 Å²	105	85%	0.849	58%	0.58	S	S	*	*			trans	-40.5	107.9	169.1	-71	173.6	172.8	165.3	-4.6	106.8	L209 L213	L209-R211 PolarHBondContact O-N 3.25Å; R211-L213 VanDerWaalsContact C-N 3.31Å; R211-L213 HydrophobicContact CB-CD2 4.43Å; R211-L213 WeakPolarHBondContact O-CA 3.38Å; R211-L213 WeakPolarHBondContact O-CD2 3.28Å; R211-L213 WeakPolarHBondContact O-CG 3.27Å; R211-L213 PolarHBondContact O-N 3.3Å
212	I	57	Low	61.9	Low	99 Å²	99	100 Å²	100	51%	0.508	55%	0.547	S	S	.	.			trans	-63.5	102.6	-172.3	-58.5	-179.8	0	0	0	105.5	A210 K214 W299	A210-I212 PolarHBondContact O-N 2.87Å; I212-K214 PolarHBondContact O-N 3.31Å; I212-W299 HydrophobicContact CD1-CE3 4.5Å; I212-W299 HydrophobicContact CD1-CZ3 4.03Å
213	L	69.2	Low	64	Low	142 Å²	142	98.3 Å²	98.3	74%	0.743	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-62.2	130.3	-160.9	-69	178.9	0	0	0	108	R211 K215 S323	R211-L213 VanDerWaalsContact C-N 3.31Å; R211-L213 HydrophobicContact CB-CD2 4.43Å; R211-L213 WeakPolarHBondContact O-CA 3.38Å; R211-L213 WeakPolarHBondContact O-CD2 3.28Å; R211-L213 WeakPolarHBondContact O-CG 3.27Å; R211-L213 PolarHBondContact O-N 3.3Å; L213-K215 PolarHBondContact O-N 3.25Å; L213-S323 PolarHBondContact O-OG 3.17Å
214	K	82.4	Confident	66.4	Low	62 Å²	62	92.3 Å²	92.3	27%	0.27	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-55.9	132.6	175.6	-160.9	176.4	-177.4	-167.2	0	107.1	I212 D345 D363 I364	I212-K214 PolarHBondContact O-N 3.31Å; K214-D345 VanDerWaalsContact CE-O 3.28Å; K214-D345 WeakPolarHBondContact CE-O 3.34Å; K214-D363 WeakPolarHBondContact CE-OD1 3.47Å; K214-D363 WeakPolarHBondContact CE-OD2 3.16Å; K214-D363 IonicContact NZ-OD1 2.76Å; K214-D363 PolarHBondContact NZ-OD1 3.39Å; K214-D363 IonicContact NZ-OD2 3.01Å; K214-D363 PolarHBondContact NZ-OD2 2.86Å; K214-I364 PolarHBondContact NZ-O 3.07Å
215	K	87.5	Confident	69	Low	48 Å²	48	91.6 Å²	91.6	21%	0.209	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-56.3	137.6	174.5	-61.6	-65.6	-177.1	172.7	0	107.7	L213 S217 L220 E320 H322 R349	L213-K215 PolarHBondContact O-N 3.25Å; K215-S217 PolarHBondContact O-N 2.79Å; K215-L220 HydrophobicContact CB-CD1 4.04Å; K215-E320 VanDerWaalsContact CE-O 3.27Å; K215-E320 WeakPolarHBondContact CE-O 3.44Å; K215-E320 IonicContact NZ-OE1 2.74Å; K215-E320 PolarHBondContact NZ-OE1 3.5Å; K215-H322 WeakPolarHBondContact CE-O 3.26Å; K215-R349 PolarHBondContact O-NH2 2.91Å; K215-R349 VanDerWaalsContact O-NH2 3.15Å
216	P	84.2	Confident	71.4	Confident	89 Å²	89	86.7 Å²	86.7	58%	0.578	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-55.1	139.1	-171.4	21.9	-32.2	0	0	0	110.7	L220 R349	P216-L220 HydrophobicContact CG-CD2 3.91Å; P216-R349 PolarHBondContact O-NH2 2.86Å
217	S	82.2	Confident	73.9	Confident	77 Å²	77	82.9 Å²	82.9	54%	0.538	45%	0.452	S	S	.	.	S	Bend	trans	-65.3	145.8	178.5	-47	0	0	0	0	110	K215 D360 D363	K215-S217 PolarHBondContact O-N 2.79Å; S217-D360 VanDerWaalsContact CA-OD2 3.31Å; S217-D360 WeakPolarHBondContact CA-OD2 3.25Å; S217-D360 WeakPolarHBondContact CB-OD2 3.31Å; S217-D363 PolarHBondContact OG-OD2 3.15Å
218	G	85.3	Confident	75.5	Confident	28 Å²	28	86.9 Å²	86.9	29%	0.289	46%	0.461	S	S	.	.	S	Bend	trans	93.2	-178.1	-167.6	0	0	0	0	0	114.4	D360	G218-D360 PolarHBondContact N-OD2 2.78Å
219	A	89.3	Confident	76.6	Confident	61 Å²	61	85.1 Å²	85.1	50%	0.504	47%	0.472	S	S	.	.			trans	-71.4	134.4	-166.8	0	0	0	0	0	113.9	V357 F358	A219-V357 HydrophobicContact CB-CB 4.34Å; A219-V357 HydrophobicContact CB-CG2 4.49Å; A219-F358 WeakPolarHBondContact CA-O 3.47Å
220	L	92.4	Very high	77.6	Confident	34 Å²	34	82 Å²	82	18%	0.178	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	133.7	175.7	-49.8	175.5	0	0	0	110.2	K215 P216 V357 F358	K215-L220 HydrophobicContact CB-CD1 4.04Å; P216-L220 HydrophobicContact CG-CD2 3.91Å; L220-V357 CarbonylContact O-C 3.55Å; L220-V357 VanDerWaalsContact O-CA 3.24Å; L220-V357 WeakPolarHBondContact O-CA 3.36Å; L220-F358 HydrophobicContact CB-CB 4.33Å; L220-F358 PolarHBondContact N-O 2.94Å; L220-F358 PolarHBondContact O-N 2.82Å
221	H	91.3	Very high	79.1	Confident	142 Å²	142	81.5 Å²	81.5	66%	0.657	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65	141.6	177.1	-67.9	-68	0	0	0	113	N223	H221-N223 PolarHBondContact O-N 2.95Å
222	M	90.7	Very high	80.5	Confident	5 Å²	5	79.5 Å²	79.5	3%	0.025	46%	0.457	C	S	.	.			trans	-75.5	62.2	174.5	-71.7	-179.6	65.8	0	0	112.3	P224 L233 F319 M351 D352 V353 A356 F358	M222-P224 WeakPolarHBondContact O-CD 3.49Å; M222-L233 HydrophobicContact CB-CD1 4.05Å; M222-L233 HydrophobicContact CB-CD2 4.33Å; M222-L233 HydrophobicContact CE-CD1 3.8Å; M222-L233 HydrophobicContact CE-CD2 4.29Å; M222-L233 HydrophobicContact SD-CD1 4.02Å; M222-F319 HydrophobicContact CB-CD1 4.41Å; M222-F319 HydrophobicContact CB-CE1 4.04Å; M222-F319 HydrophobicContact CE-CE1 4.49Å; M222-F319 HydrophobicContact CE-CE2 4.5Å; M222-F319 HydrophobicContact CE-CZ 4.15Å; M222-F319 WeakPolarHBondContact O-CE1 3.2Å; M222-M351 HydrophobicContact CE-CE 4.28Å; M222-M351 HydrophobicContact CE-CG 3.46Å; M222-M351 VanDerWaalsContact CE-CG 3.46Å; M222-M351 HydrophobicContact CE-SD 3.63Å; M222-M351 HydrophobicContact CG-CG 4.31Å; M222-M351 HydrophobicContact SD-CG 3.54Å; M222-M351 VanDerWaalsContact SD-CG 3.54Å; M222-D352 VanDerWaalsContact SD-O 3.42Å; M222-V353 HydrophobicContact CE-CG2 4.3Å; M222-A356 HydrophobicContact CB-CB 4.47Å; M222-A356 WeakPolarHBondContact CB-O 3.3Å; M222-A356 PolarHBondContact N-O 3.28Å; M222-F358 HydrophobicContact CB-CE2 4.29Å; M222-F358 HydrophobicContact CG-CD2 3.8Å; M222-F358 HydrophobicContact CG-CE2 3.58Å; M222-F358 HydrophobicContact CG-CZ 4.2Å
223	N	89.6	Confident	81.7	Confident	113 Å²	113	75.9 Å²	75.9	60%	0.604	44%	0.439	S	S	*	.			trans	-92.1	115.6	174.4	-63.8	-13.4	0	0	0	109.2	H221 I225	H221-N223 PolarHBondContact O-N 2.95Å; N223-I225 PolarHBondContact O-N 3.1Å
224	P	89.4	Confident	82.5	Confident	9 Å²	9	70 Å²	70	6%	0.058	41%	0.409	C	S	.	.			trans	-73.8	127.7	-179.9	24.7	-27.1	0	0	0	111.6	M222 N226 Q227 F231 L317 L318 F319	M222-P224 WeakPolarHBondContact O-CD 3.49Å; P224-N226 PolarHBondContact O-N 3.02Å; P224-Q227 HydrophobicContact CB-CG 4.41Å; P224-Q227 HydrophobicContact CG-CB 4.13Å; P224-Q227 HydrophobicContact CG-CG 4.11Å; P224-Q227 PolarHBondContact O-N 2.76Å; P224-F231 HydrophobicContact CG-CB 4.4Å; P224-F231 HydrophobicContact CG-CD1 3.36Å; P224-F231 HydrophobicContact CG-CE1 3.82Å; P224-F231 HydrophobicContact CG-CG 4.08Å; P224-L317 HydrophobicContact CB-CB 4.3Å; P224-L317 HydrophobicContact CB-CD2 4.35Å; P224-L317 HydrophobicContact CG-CD2 4.35Å; P224-L318 CarbonylContact C-O 3.58Å; P224-L318 VanDerWaalsContact CA-O 3.3Å; P224-L318 WeakPolarHBondContact CA-O 3.35Å; P224-F319 HydrophobicContact CB-CD1 4.29Å; P224-F319 HydrophobicContact CB-CE1 3.85Å; P224-F319 HydrophobicContact CB-CZ 4.27Å; P224-F319 HydrophobicContact CG-CE1 4.26Å
225	I	89.9	Confident	82.6	Confident	87 Å²	87	71.4 Å²	71.4	45%	0.446	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-26.5	-177.1	-40.3	160.8	0	0	0	111.7	N223 Q227 K301 L318 E320	N223-I225 PolarHBondContact O-N 3.1Å; I225-Q227 VanDerWaalsContact C-N 3.3Å; I225-K301 HydrophobicContact CD1-CD 4.37Å; I225-L318 HydrophobicContact CD1-CD2 4.26Å; I225-L318 HydrophobicContact CD1-CG 4.13Å; I225-L318 WeakPolarHBondContact CG1-O 3.46Å; I225-L318 PolarHBondContact N-O 3.08Å; I225-E320 HydrophobicContact CD1-CB 3.43Å; I225-E320 VanDerWaalsContact CD1-CB 3.43Å; I225-E320 HydrophobicContact CG1-CB 4.3Å
226	N	87.6	Confident	82.5	Confident	26 Å²	26	74.2 Å²	74.2	14%	0.139	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	10.2	-176.2	74.7	-61.1	0	0	0	113.2	L169 P224 D313 V316 L318	L169-N226 HydrophobicContact CD2-CB 3.61Å; P224-N226 PolarHBondContact O-N 3.02Å; N226-D313 WeakPolarHBondContact CB-OD2 3.17Å; N226-D313 PolarHBondContact ND2-OD2 3.42Å; N226-V316 PolarHBondContact ND2-O 2.93Å; N226-L318 HydrophobicContact CB-CB 4.18Å; N226-L318 WeakPolarHBondContact OD1-CB 3.44Å; N226-L318 PolarHBondContact OD1-N 3.11Å
227	Q	83	Confident	82.7	Confident	57 Å²	57	70.1 Å²	70.1	27%	0.266	41%	0.411	S	S	.	.	S	Bend	trans	-125	141.2	173.5	-63.2	-68.5	-83.6	0	0	109.5	P224 I225 F231 L317	P224-Q227 HydrophobicContact CB-CG 4.41Å; P224-Q227 HydrophobicContact CG-CB 4.13Å; P224-Q227 HydrophobicContact CG-CG 4.11Å; P224-Q227 PolarHBondContact O-N 2.76Å; I225-Q227 VanDerWaalsContact C-N 3.3Å; Q227-F231 HydrophobicContact CB-CB 3.86Å; Q227-F231 HydrophobicContact CB-CD2 3.88Å; Q227-F231 HydrophobicContact CB-CG 3.85Å; Q227-F231 HydrophobicContact CG-CD1 4.39Å; Q227-F231 HydrophobicContact CG-CD2 3.74Å; Q227-F231 HydrophobicContact CG-CE2 3.93Å; Q227-F231 HydrophobicContact CG-CG 3.99Å; Q227-F231 HydrophobicContact CG-CZ 4.33Å; Q227-F231 VanDerWaalsContact OE1-CE2 3.31Å; Q227-L317 HydrophobicContact CG-CD2 4.43Å
228	E	71.6	Confident	82.9	Confident	193 Å²	193	72 Å²	72	90%	0.902	41%	0.407	S	S	*	.			trans	-91.9	146.8	178.6	-62.2	-175.1	-179.6	0	0	110.7
229	G	55.4	Low	83	Confident	83 Å²	83	77.7 Å²	77.7	86%	0.856	43%	0.426	S	S	*	.	S	Bend	trans	60.8	80.7	161.8	0	0	0	0	0	117.8	F231	G229-F231 VanDerWaalsContact C-N 3.27Å; G229-F231 PolarHBondContact O-N 2.79Å
230	G	62.4	Low	82.8	Confident	77 Å²	77	75.6 Å²	75.6	79%	0.794	41%	0.406	S	S	*	.	S	Bend	trans	68.7	19.1	160.7	0	0	0	0	0	116.2	K232	G230-K232 PolarHBondContact O-N 3.45Å
231	F	70.9	Confident	82.5	Confident	55 Å²	55	74.2 Å²	74.2	24%	0.241	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-49.1	121.4	176.7	-177.3	-86.7	0	0	0	112	P224 Q227 G229 P234 L317	P224-F231 HydrophobicContact CG-CB 4.4Å; P224-F231 HydrophobicContact CG-CD1 3.36Å; P224-F231 HydrophobicContact CG-CE1 3.82Å; P224-F231 HydrophobicContact CG-CG 4.08Å; Q227-F231 HydrophobicContact CB-CB 3.86Å; Q227-F231 HydrophobicContact CB-CD2 3.88Å; Q227-F231 HydrophobicContact CB-CG 3.85Å; Q227-F231 HydrophobicContact CG-CD1 4.39Å; Q227-F231 HydrophobicContact CG-CD2 3.74Å; Q227-F231 HydrophobicContact CG-CE2 3.93Å; Q227-F231 HydrophobicContact CG-CG 3.99Å; Q227-F231 HydrophobicContact CG-CZ 4.33Å; Q227-F231 VanDerWaalsContact OE1-CE2 3.31Å; G229-F231 VanDerWaalsContact C-N 3.27Å; G229-F231 PolarHBondContact O-N 2.79Å; F231-P234 HydrophobicContact CE1-CG 4.22Å; F231-P234 HydrophobicContact CZ-CG 3.77Å; F231-L317 HydrophobicContact CE1-CD1 4.12Å; F231-L317 HydrophobicContact CE1-CD2 3.68Å; F231-L317 HydrophobicContact CZ-CD2 3.64Å
232	K	78.7	Confident	82.1	Confident	182 Å²	182	72 Å²	72	79%	0.791	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-88.2	141.7	173.3	-64.5	179.8	-178.7	176.8	0	109.1	G230 P234	G230-K232 PolarHBondContact O-N 3.45Å; K232-P234 WeakPolarHBondContact O-CD 3.27Å
233	L	83.7	Confident	81.6	Confident	23 Å²	23	73.8 Å²	73.8	12%	0.12	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-54.8	127	172.4	-63.8	-178.4	0	0	0	109.8	M222 L317 F319 A356	M222-L233 HydrophobicContact CB-CD1 4.05Å; M222-L233 HydrophobicContact CB-CD2 4.33Å; M222-L233 HydrophobicContact CE-CD1 3.8Å; M222-L233 HydrophobicContact CE-CD2 4.29Å; M222-L233 HydrophobicContact SD-CD1 4.02Å; L233-L317 HydrophobicContact CD2-CD1 4.28Å; L233-F319 HydrophobicContact CD2-CE1 4.2Å; L233-F319 HydrophobicContact CD2-CZ 3.99Å; L233-A356 HydrophobicContact CD1-CB 3.63Å; L233-A356 HydrophobicContact CG-CB 4.46Å
234	P	84.6	Confident	80.4	Confident	19 Å²	19	73.6 Å²	73.6	12%	0.123	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-62.9	142	-176.7	-27.4	38.8	0	0	0	112.2	F231 K232 E236 L237 W311	F231-P234 HydrophobicContact CE1-CG 4.22Å; F231-P234 HydrophobicContact CZ-CG 3.77Å; K232-P234 WeakPolarHBondContact O-CD 3.27Å; P234-E236 WeakPolarHBondContact CB-OE2 3.14Å; P234-E236 PolarHBondContact O-N 2.96Å; P234-L237 WeakPolarHBondContact O-CB 3.43Å; P234-L237 PolarHBondContact O-N 3Å; P234-L237 VanDerWaalsContact O-N 3.11Å; P234-W311 HydrophobicContact CB-CE3 4.42Å; P234-W311 HydrophobicContact CG-CB 4.03Å; P234-W311 HydrophobicContact CG-CE3 3.93Å
235	P	84.6	Confident	79.1	Confident	91 Å²	91	75.7 Å²	75.7	59%	0.591	42%	0.422	S	S	*	.	H	α-helix	trans	-61.8	-26.9	-176.2	25.9	-34.3	0	0	0	112.8	L237 R238 Q239	P235-L237 VanDerWaalsContact C-N 3.3Å; P235-L237 PolarHBondContact O-N 3.15Å; P235-R238 WeakPolarHBondContact O-CB 3.36Å; P235-R238 PolarHBondContact O-N 2.93Å; P235-R238 VanDerWaalsContact O-N 3.12Å; P235-Q239 PolarHBondContact O-N 3.09Å
236	E	86.3	Confident	77.3	Confident	108 Å²	108	79.4 Å²	79.4	51%	0.505	44%	0.435	S	S	.	.	H	α-helix	trans	-61	-37.9	176.3	-55.1	73.3	-160	0	0	111.1	P234 R238 Q239 L240	P234-E236 WeakPolarHBondContact CB-OE2 3.14Å; P234-E236 PolarHBondContact O-N 2.96Å; E236-R238 VanDerWaalsContact C-N 3.32Å; E236-R238 PolarHBondContact O-N 2.87Å; E236-Q239 PolarHBondContact O-N 3.46Å; E236-L240 VanDerWaalsContact O-CG 3.29Å; E236-L240 WeakPolarHBondContact O-CG 3.32Å; E236-L240 PolarHBondContact O-N 3.35Å
237	L	87.3	Confident	75.8	Confident	2 Å²	2	82.6 Å²	82.6	1%	0.01	45%	0.449	C	S	.	.	H	α-helix	trans	-61.8	-42.1	175.3	178.3	65.1	0	0	0	111.1	P234 P235 C241 L292 L304 W311 V353	P234-L237 WeakPolarHBondContact O-CB 3.43Å; P234-L237 PolarHBondContact O-N 3Å; P234-L237 VanDerWaalsContact O-N 3.11Å; P235-L237 VanDerWaalsContact C-N 3.3Å; P235-L237 PolarHBondContact O-N 3.15Å; L237-C241 VanDerWaalsContact O-CB 3.31Å; L237-C241 WeakPolarHBondContact O-CB 3.4Å; L237-C241 PolarHBondContact O-N 2.7Å; L237-C241 PolarHBondContact O-SG 2.77Å; L237-L292 HydrophobicContact CD1-CD1 4.27Å; L237-L292 HydrophobicContact CD1-CD2 3.76Å; L237-L304 HydrophobicContact CD1-CD1 4.45Å; L237-L304 HydrophobicContact CD2-CD1 4.26Å; L237-W311 HydrophobicContact CB-CZ3 3.81Å; L237-W311 HydrophobicContact CD1-CH2 3.86Å; L237-W311 HydrophobicContact CD1-CZ3 3.92Å; L237-W311 HydrophobicContact CD2-CH2 4.5Å; L237-W311 HydrophobicContact CD2-CZ3 3.96Å; L237-W311 HydrophobicContact CG-CH2 4.5Å; L237-W311 HydrophobicContact CG-CZ3 4.07Å; L237-V353 HydrophobicContact CD2-CG1 3.85Å; L237-V353 HydrophobicContact CD2-CG2 4.19Å; L237-V353 HydrophobicContact CG-CG1 3.74Å; L237-V353 HydrophobicContact CG-CG2 4.46Å
238	R	87	Confident	74.3	Confident	118 Å²	118	88.2 Å²	88.2	45%	0.445	48%	0.475	S	S	.	.	H	α-helix	trans	-66.6	-39.5	176.9	-78.2	175.2	166.8	-177.6	-5	111.4	P235 E236 C241 S242 V353 E354	P235-R238 WeakPolarHBondContact O-CB 3.36Å; P235-R238 PolarHBondContact O-N 2.93Å; P235-R238 VanDerWaalsContact O-N 3.12Å; E236-R238 VanDerWaalsContact C-N 3.32Å; E236-R238 PolarHBondContact O-N 2.87Å; R238-C241 CarbonylContact O-C 3.6Å; R238-C241 PolarHBondContact O-N 3.11Å; R238-S242 WeakPolarHBondContact O-CB 3.42Å; R238-S242 PolarHBondContact O-N 3.03Å; R238-S242 PolarHBondContact O-OG 3.1Å; R238-V353 HydrophobicContact CG-CG1 3.84Å; R238-V353 PolarHBondContact NE-O 3.24Å; R238-E354 PolarHBondContact NH2-O 3.04Å
239	Q	86.8	Confident	73.5	Confident	147 Å²	147	84.3 Å²	84.3	69%	0.687	46%	0.457	S	S	*	.	H	α-helix	trans	-62.6	-47.6	175.4	-174.1	176.4	-5.8	0	0	112.1	P235 E236 C241 S242 E243	P235-Q239 PolarHBondContact O-N 3.09Å; E236-Q239 PolarHBondContact O-N 3.46Å; Q239-C241 VanDerWaalsContact C-N 3.3Å; Q239-C241 PolarHBondContact O-N 2.92Å; Q239-S242 CarbonylContact O-C 3.55Å; Q239-S242 PolarHBondContact O-N 2.82Å; Q239-E243 PolarHBondContact O-N 3.29Å
240	L	85.9	Confident	73.7	Confident	16 Å²	16	87.7 Å²	87.7	8%	0.084	45%	0.452	C	S	.	.	H	α-helix	trans	-58.1	-42.7	174.7	-69.1	171.7	0	0	0	111.7	E236 S242 E243 H285 S289 L292	E236-L240 VanDerWaalsContact O-CG 3.29Å; E236-L240 WeakPolarHBondContact O-CG 3.32Å; E236-L240 PolarHBondContact O-N 3.35Å; L240-S242 PolarHBondContact O-N 3.43Å; L240-E243 WeakPolarHBondContact O-CB 3.43Å; L240-E243 PolarHBondContact O-N 2.63Å; L240-H285 PolarHBondContact O-CE1 3Å; L240-S289 WeakPolarHBondContact CD2-OG 3.49Å; L240-L292 HydrophobicContact CB-CD2 4.42Å; L240-L292 HydrophobicContact CD1-CD2 4.41Å
241	C	85.3	Confident	74.1	Confident	5 Å²	5	90.1 Å²	90.1	3%	0.034	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-2.5	176.6	-77.2	0	0	0	0	115	L237 R238 Q239 H285 N337 V353	L237-C241 VanDerWaalsContact O-CB 3.31Å; L237-C241 WeakPolarHBondContact O-CB 3.4Å; L237-C241 PolarHBondContact O-N 2.7Å; L237-C241 PolarHBondContact O-SG 2.77Å; R238-C241 CarbonylContact O-C 3.6Å; R238-C241 PolarHBondContact O-N 3.11Å; Q239-C241 VanDerWaalsContact C-N 3.3Å; Q239-C241 PolarHBondContact O-N 2.92Å; C241-H285 PolarHBondContact SG-NE2 3.39Å; C241-H285 VanDerWaalsContact SG-NE2 3.42Å; C241-N337 HydrophobicContact CB-CB 3.98Å; C241-N337 PolarHBondContact O-N 2.82Å; C241-V353 HydrophobicContact CB-CB 4.42Å; C241-V353 HydrophobicContact CB-CG1 4.12Å
242	S	83.2	Confident	74.6	Confident	96 Å²	96	90 Å²	90	67%	0.671	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.9	9.2	172.4	-61.7	0	0	0	0	112.7	R238 Q239 L240 D244	R238-S242 WeakPolarHBondContact O-CB 3.42Å; R238-S242 PolarHBondContact O-N 3.03Å; R238-S242 PolarHBondContact O-OG 3.1Å; Q239-S242 CarbonylContact O-C 3.55Å; Q239-S242 PolarHBondContact O-N 2.82Å; L240-S242 PolarHBondContact O-N 3.43Å; S242-D244 PolarHBondContact O-N 3.49Å
243	E	81.1	Confident	75.2	Confident	42 Å²	42	85.2 Å²	85.2	20%	0.196	43%	0.425	C	S	.	.			trans	-77.5	115.7	177.4	-169.6	179.8	172.8	0	0	111	Q239 L240 S245 C287 S288 S289	Q239-E243 PolarHBondContact O-N 3.29Å; L240-E243 WeakPolarHBondContact O-CB 3.43Å; L240-E243 PolarHBondContact O-N 2.63Å; E243-S245 PolarHBondContact O-N 3.47Å; E243-S245 VanDerWaalsContact O-N 3.1Å; E243-C287 VanDerWaalsContact OE2-CB 3.26Å; E243-C287 WeakPolarHBondContact OE2-CB 3.19Å; E243-S288 WeakPolarHBondContact OE1-CA 3.44Å; E243-S288 WeakPolarHBondContact OE1-CB 3.34Å; E243-S288 PolarHBondContact OE1-N 2.87Å; E243-S288 PolarHBondContact OE1-OG 3.04Å; E243-S288 PolarHBondContact OE2-N 3.13Å; E243-S289 PolarHBondContact OE1-N 2.97Å; E243-S289 VanDerWaalsContact OE2-CB 3.29Å; E243-S289 WeakPolarHBondContact OE2-CB 3.28Å; E243-S289 PolarHBondContact OE2-N 2.83Å; E243-S289 PolarHBondContact OE2-OG 2.93Å
244	D	64.8	Low	75.5	Confident	110 Å²	110	86.5 Å²	86.5	59%	0.588	43%	0.432	S	S	*	.			trans	-64.2	105.6	169.2	-82.1	-29.9	0	0	0	110.1	S242 K246	S242-D244 PolarHBondContact O-N 3.49Å; D244-K246 VanDerWaalsContact C-N 3.26Å; D244-K246 HydrophobicContact CB-CD 3.75Å; D244-K246 HydrophobicContact CB-CG 4.05Å; D244-K246 PolarHBondContact O-N 2.72Å; D244-K246 WeakPolarHBondContact OD2-CE 3.39Å; D244-K246 IonicContact OD2-NZ 2.62Å; D244-K246 PolarHBondContact OD2-NZ 3.35Å
245	S	61.2	Low	76	Confident	53 Å²	53	93.1 Å²	93.1	37%	0.371	46%	0.459	S	S	.	.			trans	-71.3	77.5	176.2	63.6	0	0	0	0	111.6	E243 E247 P286	E243-S245 PolarHBondContact O-N 3.47Å; E243-S245 VanDerWaalsContact O-N 3.1Å; S245-E247 VanDerWaalsContact C-N 3.35Å; S245-E247 PolarHBondContact O-N 2.81Å; S245-P286 WeakPolarHBondContact CB-O 3.31Å
246	K	53.3	Low	76.3	Confident	165 Å²	165	94.1 Å²	94.1	72%	0.717	46%	0.456	S	S	*	.			trans	-93.8	29.1	-175	-79.3	165.3	173.8	160.7	0	114	D244	D244-K246 VanDerWaalsContact C-N 3.26Å; D244-K246 HydrophobicContact CB-CD 3.75Å; D244-K246 HydrophobicContact CB-CG 4.05Å; D244-K246 PolarHBondContact O-N 2.72Å; D244-K246 WeakPolarHBondContact OD2-CE 3.39Å; D244-K246 IonicContact OD2-NZ 2.62Å; D244-K246 PolarHBondContact OD2-NZ 3.35Å
247	E	54.4	Low	76.7	Confident	93 Å²	93	89.1 Å²	89.1	44%	0.435	43%	0.433	S	S	.	.			trans	-88.1	114.8	173.6	-64.5	-175	132.2	0	0	110	S245 Q249 T566	S245-E247 VanDerWaalsContact C-N 3.35Å; S245-E247 PolarHBondContact O-N 2.81Å; E247-Q249 PolarHBondContact O-N 2.88Å; E247-T566 HydrophobicContact CB-CG2 4.26Å; E247-T566 WeakPolarHBondContact OE2-CB 3.45Å; E247-T566 PolarHBondContact OE2-OG1 3.09Å
248	E	52.5	Low	77	Confident	174 Å²	174	90.1 Å²	90.1	81%	0.813	44%	0.438	S	S	*	.			trans	-61.6	134.3	168.8	-65.6	-172.7	153.5	0	0	109.7	M250	E248-M250 VanDerWaalsContact C-N 3.31Å; E248-M250 PolarHBondContact O-N 2.71Å
249	Q	55.3	Low	77.3	Confident	111 Å²	111	87.8 Å²	87.8	52%	0.519	44%	0.439	S	S	.	.			trans	-70.9	84.7	179	-68.9	-167.8	-54.2	0	0	111.2	E247 K251 P519	E247-Q249 PolarHBondContact O-N 2.88Å; Q249-K251 PolarHBondContact O-N 3.14Å; Q249-P519 PolarHBondContact NE2-O 2.89Å
250	M	57.9	Low	77.6	Confident	155 Å²	155	81.5 Å²	81.5	76%	0.764	41%	0.412	S	S	*	.			trans	-64.3	102.6	171.4	-73	-164.5	173.6	0	0	110.4	E248 L252	E248-M250 VanDerWaalsContact C-N 3.31Å; E248-M250 PolarHBondContact O-N 2.71Å; M250-L252 PolarHBondContact O-N 2.91Å
251	K	71.9	Confident	78	Confident	128 Å²	128	80.9 Å²	80.9	56%	0.557	41%	0.409	S	S	*	.			trans	-67.6	96	171	-170	-176	-178.4	177.2	0	109.5	Q249 D523	Q249-K251 PolarHBondContact O-N 3.14Å; K251-D523 IonicContact NZ-OD2 2.85Å; K251-D523 PolarHBondContact NZ-OD2 2.91Å
252	L	81.6	Confident	78.4	Confident	52 Å²	52	86.8 Å²	86.8	27%	0.272	43%	0.434	S	S	.	.			trans	-57.2	148.4	171.7	-56.8	177.5	0	0	0	111.1	M250 E256 A260 Q521	M250-L252 PolarHBondContact O-N 2.91Å; L252-E256 HydrophobicContact CB-CB 4.1Å; L252-A260 HydrophobicContact CD1-CB 4.37Å; L252-Q521 PolarHBondContact O-NE2 3.41Å
253	D	90.6	Very high	78.8	Confident	81 Å²	81	84.9 Å²	84.9	43%	0.433	42%	0.421	S	S	.	.			trans	-62.1	155	166.3	174.7	52.9	0	0	0	110.5	K255 E256 Y257	D253-K255 PolarHBondContact O-N 3.4Å; D253-K255 VanDerWaalsContact O-N 3.14Å; D253-K255 WeakPolarHBondContact OD2-CB 3.2Å; D253-K255 WeakPolarHBondContact OD2-CD 3.11Å; D253-K255 VanDerWaalsContact OD2-CG 3.24Å; D253-K255 WeakPolarHBondContact OD2-CG 3.36Å; D253-K255 PolarHBondContact OD2-N 2.73Å; D253-E256 HydrophobicContact CB-CG 4.22Å; D253-E256 PolarHBondContact N-OE2 3.5Å; D253-E256 WeakPolarHBondContact O-CB 3.44Å; D253-E256 PolarHBondContact O-N 2.94Å; D253-Y257 WeakPolarHBondContact O-CB 3.39Å; D253-Y257 PolarHBondContact O-N 3.04Å
254	L	90.9	Very high	79.4	Confident	50 Å²	50	83.4 Å²	83.4	26%	0.262	42%	0.415	S	S	.	.	H	α-helix	trans	-57.8	-30.9	178.6	-174.5	60.1	0	0	0	112.4	Y257 I258 L546	L254-Y257 HydrophobicContact CD1-CD1 4.4Å; L254-I258 HydrophobicContact CD1-CD1 4.33Å; L254-I258 HydrophobicContact CD1-CG1 4.44Å; L254-I258 HydrophobicContact CG-CD1 4.07Å; L254-I258 WeakPolarHBondContact O-CB 3.46Å; L254-I258 VanDerWaalsContact O-CD1 3.24Å; L254-I258 WeakPolarHBondContact O-CD1 3.31Å; L254-I258 WeakPolarHBondContact O-CG1 3.33Å; L254-I258 PolarHBondContact O-N 2.84Å; L254-L546 HydrophobicContact CD1-CD1 3.86Å; L254-L546 HydrophobicContact CD1-CD2 4.13Å
255	K	93.5	Very high	80.6	Confident	159 Å²	159	84.4 Å²	84.4	69%	0.691	41%	0.413	S	S	*	.	H	α-helix	trans	-71	-39.9	174.8	-61.5	167.8	-173.5	163.4	0	112.3	D253 S259	D253-K255 PolarHBondContact O-N 3.4Å; D253-K255 VanDerWaalsContact O-N 3.14Å; D253-K255 WeakPolarHBondContact OD2-CB 3.2Å; D253-K255 WeakPolarHBondContact OD2-CD 3.11Å; D253-K255 VanDerWaalsContact OD2-CG 3.24Å; D253-K255 WeakPolarHBondContact OD2-CG 3.36Å; D253-K255 PolarHBondContact OD2-N 2.73Å; K255-S259 WeakPolarHBondContact O-CB 3.45Å; K255-S259 PolarHBondContact O-N 2.81Å; K255-S259 VanDerWaalsContact O-N 3.1Å; K255-S259 PolarHBondContact O-OG 2.76Å
256	E	92.8	Very high	81.9	Confident	111 Å²	111	82.6 Å²	82.6	52%	0.519	40%	0.399	S	S	.	.	H	α-helix	trans	-69.3	-45.9	178.8	-64.9	171.6	158.2	0	0	109.7	L252 D253 I258 S259 A260	L252-E256 HydrophobicContact CB-CB 4.1Å; D253-E256 HydrophobicContact CB-CG 4.22Å; D253-E256 PolarHBondContact N-OE2 3.5Å; D253-E256 WeakPolarHBondContact O-CB 3.44Å; D253-E256 PolarHBondContact O-N 2.94Å; E256-I258 PolarHBondContact O-N 3.41Å; E256-S259 CarbonylContact O-C 3.59Å; E256-S259 WeakPolarHBondContact O-CA 3.27Å; E256-S259 WeakPolarHBondContact O-CB 3.48Å; E256-S259 PolarHBondContact O-N 2.88Å; E256-A260 PolarHBondContact O-N 2.95Å
257	Y	93.1	Very high	83.3	Confident	4 Å²	4	75.8 Å²	75.8	2%	0.016	38%	0.376	C	S	.	.	H	α-helix	trans	-60	-44.6	174.4	179.8	-115.8	0	0	0	112.4	D253 L254 S259 A260 L261 Q521 C524 L546	D253-Y257 WeakPolarHBondContact O-CB 3.39Å; D253-Y257 PolarHBondContact O-N 3.04Å; L254-Y257 HydrophobicContact CD1-CD1 4.4Å; Y257-S259 PolarHBondContact O-N 3.23Å; Y257-A260 PolarHBondContact O-N 2.52Å; Y257-L261 HydrophobicContact CD1-CD1 4.06Å; Y257-L261 HydrophobicContact CD2-CG 4.49Å; Y257-L261 HydrophobicContact CE1-CD1 3.62Å; Y257-L261 HydrophobicContact CE1-CG 4.27Å; Y257-L261 HydrophobicContact CE2-CD1 4.4Å; Y257-L261 HydrophobicContact CE2-CD2 4.22Å; Y257-L261 HydrophobicContact CE2-CG 4.16Å; Y257-L261 WeakPolarHBondContact O-CB 3.33Å; Y257-L261 WeakPolarHBondContact O-CG 3.49Å; Y257-L261 PolarHBondContact O-N 2.99Å; Y257-Q521 HydrophobicContact CD1-CG 4.43Å; Y257-Q521 HydrophobicContact CD2-CG 3.92Å; Y257-Q521 HydrophobicContact CE1-CG 4.46Å; Y257-Q521 HydrophobicContact CE2-CG 3.96Å; Y257-Q521 HydrophobicContact CG-CG 4.17Å; Y257-C524 HydrophobicContact CD1-CB 4.48Å; Y257-C524 HydrophobicContact CE1-CB 3.57Å; Y257-C524 WeakPolarHBondContact CE1-SG 3.49Å; Y257-L546 HydrophobicContact CD1-CD1 4.15Å; Y257-L546 HydrophobicContact CE1-CD1 3.93Å
258	I	94.4	Very high	84.3	Confident	23 Å²	23	77.2 Å²	77.2	12%	0.118	38%	0.383	C	S	.	.	H	α-helix	trans	-59	-31.7	171.5	-72	163.7	0	0	0	111.8	L254 E256 K262 L546	L254-I258 HydrophobicContact CD1-CD1 4.33Å; L254-I258 HydrophobicContact CD1-CG1 4.44Å; L254-I258 HydrophobicContact CG-CD1 4.07Å; L254-I258 WeakPolarHBondContact O-CB 3.46Å; L254-I258 VanDerWaalsContact O-CD1 3.24Å; L254-I258 WeakPolarHBondContact O-CD1 3.31Å; L254-I258 WeakPolarHBondContact O-CG1 3.33Å; L254-I258 PolarHBondContact O-N 2.84Å; E256-I258 PolarHBondContact O-N 3.41Å; I258-K262 HydrophobicContact CG2-CD 4.43Å; I258-K262 WeakPolarHBondContact O-CD 3.38Å; I258-K262 VanDerWaalsContact O-CG 3.26Å; I258-K262 WeakPolarHBondContact O-CG 3.36Å; I258-K262 PolarHBondContact O-N 3.14Å; I258-L546 HydrophobicContact CD1-CD2 3.95Å; I258-L546 HydrophobicContact CG1-CB 4.28Å; I258-L546 HydrophobicContact CG1-CD2 4.09Å
259	S	93.8	Very high	85.6	Confident	68 Å²	68	73.1 Å²	73.1	48%	0.476	37%	0.366	S	S	.	.	H	α-helix	trans	-79.3	-39.1	179.3	-56.2	0	0	0	0	111.9	K255 E256 Y257 K262 S263	K255-S259 WeakPolarHBondContact O-CB 3.45Å; K255-S259 PolarHBondContact O-N 2.81Å; K255-S259 VanDerWaalsContact O-N 3.1Å; K255-S259 PolarHBondContact O-OG 2.76Å; E256-S259 CarbonylContact O-C 3.59Å; E256-S259 WeakPolarHBondContact O-CA 3.27Å; E256-S259 WeakPolarHBondContact O-CB 3.48Å; E256-S259 PolarHBondContact O-N 2.88Å; Y257-S259 PolarHBondContact O-N 3.23Å; S259-K262 WeakPolarHBondContact O-CB 3.49Å; S259-K262 PolarHBondContact O-N 3.13Å; S259-K262 VanDerWaalsContact O-N 3.17Å; S259-S263 PolarHBondContact O-N 3.27Å; S259-S263 VanDerWaalsContact O-N 3.15Å
260	A	92.8	Very high	87.2	Confident	15 Å²	15	68 Å²	68	12%	0.124	34%	0.343	C	S	.	.	H	α-helix	trans	-62.4	-43.5	170.7	0	0	0	0	0	111.6	L252 E256 Y257 K262 S263 L264	L252-A260 HydrophobicContact CD1-CB 4.37Å; E256-A260 PolarHBondContact O-N 2.95Å; Y257-A260 PolarHBondContact O-N 2.52Å; A260-K262 PolarHBondContact O-N 3.21Å; A260-S263 PolarHBondContact O-N 3.12Å; A260-S263 VanDerWaalsContact O-N 3.07Å; A260-S263 PolarHBondContact O-OG 3Å; A260-L264 WeakPolarHBondContact O-CD2 3.49Å; A260-L264 WeakPolarHBondContact O-CG 3.47Å; A260-L264 PolarHBondContact O-N 3.37Å
261	L	93.8	Very high	88.8	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.016	31%	0.307	C	S	.	.	H	α-helix	trans	-58.3	-34	173.1	-72.3	175	0	0	0	112.5	Y257 V538 L546 H547 F549 F563	Y257-L261 HydrophobicContact CD1-CD1 4.06Å; Y257-L261 HydrophobicContact CD2-CG 4.49Å; Y257-L261 HydrophobicContact CE1-CD1 3.62Å; Y257-L261 HydrophobicContact CE1-CG 4.27Å; Y257-L261 HydrophobicContact CE2-CD1 4.4Å; Y257-L261 HydrophobicContact CE2-CD2 4.22Å; Y257-L261 HydrophobicContact CE2-CG 4.16Å; Y257-L261 WeakPolarHBondContact O-CB 3.33Å; Y257-L261 WeakPolarHBondContact O-CG 3.49Å; Y257-L261 PolarHBondContact O-N 2.99Å; L261-V538 HydrophobicContact CD1-CB 4.33Å; L261-V538 HydrophobicContact CD1-CG1 3.85Å; L261-V538 HydrophobicContact CD2-CG2 4.43Å; L261-L546 HydrophobicContact CD1-CB 4.34Å; L261-H547 HydrophobicContact CB-CB 4.03Å; L261-H547 HydrophobicContact CD1-CB 4.08Å; L261-F549 HydrophobicContact CB-CZ 4.34Å; L261-F549 HydrophobicContact CD2-CE2 4.22Å; L261-F549 HydrophobicContact CD2-CZ 3.92Å; L261-F549 WeakPolarHBondContact O-CE1 3.48Å; L261-F549 WeakPolarHBondContact O-CZ 3.09Å; L261-F563 HydrophobicContact CD2-CE1 4.11Å; L261-F563 HydrophobicContact CD2-CZ 4.25Å
262	K	93.3	Very high	89.8	Confident	129 Å²	129	54.7 Å²	54.7	56%	0.561	28%	0.281	S	S	*	.	H	α-helix	trans	-77.6	-19.1	176.8	-71.9	166.5	-176.7	175	0	114.1	I258 S259 A260	I258-K262 HydrophobicContact CG2-CD 4.43Å; I258-K262 WeakPolarHBondContact O-CD 3.38Å; I258-K262 VanDerWaalsContact O-CG 3.26Å; I258-K262 WeakPolarHBondContact O-CG 3.36Å; I258-K262 PolarHBondContact O-N 3.14Å; S259-K262 WeakPolarHBondContact O-CB 3.49Å; S259-K262 PolarHBondContact O-N 3.13Å; S259-K262 VanDerWaalsContact O-N 3.17Å; A260-K262 PolarHBondContact O-N 3.21Å
263	S	92.5	Very high	90.3	Very high	57 Å²	57	53.2 Å²	53.2	40%	0.399	27%	0.272	S	S	.	.	H	α-helix	trans	-84.2	-15.8	176.1	69.9	0	0	0	0	112.7	S259 A260 K265	S259-S263 PolarHBondContact O-N 3.27Å; S259-S263 VanDerWaalsContact O-N 3.15Å; A260-S263 PolarHBondContact O-N 3.12Å; A260-S263 VanDerWaalsContact O-N 3.07Å; A260-S263 PolarHBondContact O-OG 3Å; S263-K265 PolarHBondContact O-N 3.22Å
264	L	92.8	Very high	90.5	Very high	11 Å²	11	49.4 Å²	49.4	6%	0.058	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	126	176.1	-41.4	-171.9	0	0	0	110.4	A260 F549 N568 F582 H583	A260-L264 WeakPolarHBondContact O-CD2 3.49Å; A260-L264 WeakPolarHBondContact O-CG 3.47Å; A260-L264 PolarHBondContact O-N 3.37Å; L264-F549 HydrophobicContact CB-CE1 3.9Å; L264-F549 HydrophobicContact CB-CZ 4.37Å; L264-F549 HydrophobicContact CD1-CE1 4.43Å; L264-F549 HydrophobicContact CD1-CZ 4.06Å; L264-F549 HydrophobicContact CG-CE1 4.48Å; L264-F549 HydrophobicContact CG-CZ 4.49Å; L264-N568 HydrophobicContact CD2-CB 4.06Å; L264-N568 VanDerWaalsContact CD2-O 3.27Å; L264-N568 WeakPolarHBondContact CD2-O 3.34Å; L264-F582 HydrophobicContact CB-CB 4.11Å; L264-H583 WeakPolarHBondContact CA-O 3.43Å
265	K	90.2	Very high	90.8	Very high	130 Å²	130	47 Å²	47	57%	0.565	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-126.8	169.8	176.9	-63.1	176.8	-173	168.6	0	109.7	S263 F582 H583	S263-K265 PolarHBondContact O-N 3.22Å; K265-F582 VanDerWaalsContact O-CA 3.31Å; K265-F582 WeakPolarHBondContact O-CA 3.43Å; K265-H583 PolarHBondContact N-O 3.24Å; K265-H583 PolarHBondContact O-N 2.91Å
266	M	88.8	Confident	90.7	Very high	15 Å²	15	43 Å²	43	7%	0.074	22%	0.222	C	C	.	.			trans	-125.2	128.1	172.3	-176.2	-145.2	-50	0	0	107.6	D270 V271 D551 N553 L554 H580 V581 F582	M266-D270 WeakPolarHBondContact CA-OD2 3.27Å; M266-D270 HydrophobicContact CG-CB 3.86Å; M266-V271 HydrophobicContact CG-CG2 4.01Å; M266-V271 HydrophobicContact SD-CG2 3.31Å; M266-V271 WeakPolarHBondContact SD-CG2 3.43Å; M266-D551 HydrophobicContact CE-CB 3.7Å; M266-D551 HydrophobicContact SD-CB 4.45Å; M266-N553 HydrophobicContact SD-CB 3.84Å; M266-L554 HydrophobicContact CE-CB 4.34Å; M266-L554 HydrophobicContact CE-CD1 4.13Å; M266-H580 HydrophobicContact CE-CB 4.48Å; M266-V581 WeakPolarHBondContact CG-O 3.41Å; M266-F582 HydrophobicContact CB-CD1 3.85Å; M266-F582 HydrophobicContact CB-CE1 3.95Å; M266-F582 HydrophobicContact CE-CD1 4.36Å; M266-F582 HydrophobicContact CE-CE1 3.46Å; M266-F582 VanDerWaalsContact CE-CE1 3.46Å; M266-F582 HydrophobicContact CE-CE2 4.38Å; M266-F582 HydrophobicContact CE-CZ 3.47Å; M266-F582 VanDerWaalsContact CE-CZ 3.47Å
267	G	81.9	Confident	90.8	Very high	22 Å²	22	40.4 Å²	40.4	23%	0.227	21%	0.211	C	C	.	.			trans	-92.9	175.7	164.1	0	0	0	0	0	112	D269 D270	G267-D269 PolarHBondContact O-N 2.81Å; G267-D270 PolarHBondContact N-OD2 3.09Å; G267-D270 PolarHBondContact O-N 2.76Å
268	E	75.7	Confident	90.9	Very high	124 Å²	124	41.9 Å²	41.9	58%	0.579	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-60.7	-27.1	172.8	-60.5	-166.4	176.6	0	0	112.3
269	D	81.1	Confident	91.1	Very high	87 Å²	87	40.8 Å²	40.8	47%	0.465	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-73.8	-23.8	-179.1	-71.6	-29.8	0	0	0	114.1	R167 G267 V271	R167-D269 IonicContact CZ-OD1 3.26Å; R167-D269 IonicContact NH1-OD1 3.14Å; R167-D269 PolarHBondContact NH1-OD1 3.06Å; R167-D269 IonicContact NH1-OD2 2.66Å; G267-D269 PolarHBondContact O-N 2.81Å; D269-V271 PolarHBondContact O-N 2.93Å
270	D	87.2	Confident	91.2	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.021	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-82.5	9.4	-178.8	-55.8	-36.1	0	0	0	113	M266 G267 W305 M307 H580 V581 H583 W585	M266-D270 WeakPolarHBondContact CA-OD2 3.27Å; M266-D270 HydrophobicContact CG-CB 3.86Å; G267-D270 PolarHBondContact N-OD2 3.09Å; G267-D270 PolarHBondContact O-N 2.76Å; D270-W305 WeakPolarHBondContact O-CH2 3.45Å; D270-M307 HydrophobicContact CB-CE 4.21Å; D270-M307 WeakPolarHBondContact OD1-CE 3.42Å; D270-H580 WeakPolarHBondContact O-CA 3.02Å; D270-V581 HydrophobicContact CB-CB 4.32Å; D270-V581 WeakPolarHBondContact CB-O 3.31Å; D270-V581 PolarHBondContact O-N 2.93Å; D270-H583 IonicContact OD1-CD2 2.94Å; D270-H583 IonicContact OD1-NE2 3.89Å; D270-H583 PolarHBondContact OD1-NE2 3.15Å; D270-H583 IonicContact OD2-CD2 2.75Å; D270-H583 IonicContact OD2-NE2 2.69Å; D270-W585 WeakPolarHBondContact OD2-CZ2 3.11Å
271	V	91.4	Very high	91.4	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.018	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	85.6	-175.3	-172.2	0	0	0	0	110.7	S165 M266 D269 N553 M579 H580	S165-V271 WeakPolarHBondContact OG-CG1 3.46Å; S165-V271 PolarHBondContact OG-O 2.84Å; M266-V271 HydrophobicContact CG-CG2 4.01Å; M266-V271 HydrophobicContact SD-CG2 3.31Å; M266-V271 WeakPolarHBondContact SD-CG2 3.43Å; D269-V271 PolarHBondContact O-N 2.93Å; V271-N553 HydrophobicContact CG2-CB 4.47Å; V271-M579 WeakPolarHBondContact CA-O 3.49Å; V271-H580 WeakPolarHBondContact CG1-CE1 3.41Å; V271-H580 WeakPolarHBondContact CG1-ND1 3.26Å; V271-H580 WeakPolarHBondContact CG2-ND1 3.46Å
272	V	92.7	Very high	91.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	140.7	-172.7	178.9	0	0	0	0	111.2	R167 V274 W305 V316 R578 M579	R167-V272 HydrophobicContact CB-CG2 4.09Å; V272-V274 HydrophobicContact CB-CG2 4.24Å; V272-V274 HydrophobicContact CG1-CG2 4Å; V272-V274 PolarHBondContact O-N 2.9Å; V272-W305 HydrophobicContact CB-CD2 4Å; V272-W305 HydrophobicContact CB-CE3 4.34Å; V272-W305 HydrophobicContact CB-CH2 4.04Å; V272-W305 HydrophobicContact CB-CZ2 3.67Å; V272-W305 HydrophobicContact CB-CZ3 4.34Å; V272-W305 HydrophobicContact CG1-CD2 4.29Å; V272-W305 HydrophobicContact CG1-CG 4.41Å; V272-W305 HydrophobicContact CG2-CD2 4.38Å; V272-W305 VanDerWaalsContact CG2-CE2 3.48Å; V272-W305 HydrophobicContact CG2-CH2 3.93Å; V272-W305 HydrophobicContact CG2-CZ2 3.24Å; V272-V316 HydrophobicContact CG1-CG2 3.53Å; V272-R578 VanDerWaalsContact O-CA 3.32Å; V272-R578 WeakPolarHBondContact O-CA 3.04Å; V272-M579 PolarHBondContact N-O 2.84Å; V272-M579 VanDerWaalsContact N-O 3.15Å; V272-M579 PolarHBondContact O-N 2.78Å
273	K	94.1	Very high	91.7	Very high	22 Å²	22	34.5 Å²	34.5	10%	0.096	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	89.6	174.3	-173.2	165.1	164.8	54.5	0	111	R167 L169 V275 K276 S576 G577 R578	R167-K273 PolarHBondContact O-N 3.12Å; L169-K273 HydrophobicContact CB-CG 4.33Å; L169-K273 VanDerWaalsContact CB-O 3.26Å; L169-K273 WeakPolarHBondContact CB-O 3.27Å; L169-K273 VanDerWaalsContact CG-O 3.28Å; L169-K273 WeakPolarHBondContact CG-O 3.37Å; L169-K273 PolarHBondContact N-O 3.24Å; L169-K273 WeakPolarHBondContact O-CD 3.35Å; K273-V275 PolarHBondContact NZ-O 3.5Å; K273-K276 PolarHBondContact NZ-O 3.33Å; K273-S576 PolarHBondContact NZ-O 2.87Å; K273-G577 CarbonylContact C-O 3.55Å; K273-R578 HydrophobicContact CB-CG 4.2Å; K273-R578 HydrophobicContact CG-CG 4.43Å
274	V	94.8	Very high	91.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.162	C	C	.	.			trans	-83.5	-25.5	-172.6	-178.4	0	0	0	0	113.9	L169 V272 A295 W305 V316 G577 M579	L169-V274 VanDerWaalsContact CD1-O 3.27Å; L169-V274 WeakPolarHBondContact CD1-O 3.24Å; V272-V274 HydrophobicContact CB-CG2 4.24Å; V272-V274 HydrophobicContact CG1-CG2 4Å; V272-V274 PolarHBondContact O-N 2.9Å; V274-A295 HydrophobicContact CG1-CB 4.47Å; V274-W305 HydrophobicContact CB-CB 4.31Å; V274-W305 HydrophobicContact CG1-CB 3.79Å; V274-W305 HydrophobicContact CG2-CB 3.51Å; V274-W305 HydrophobicContact CG2-CD2 3.75Å; V274-W305 HydrophobicContact CG2-CE3 3.64Å; V274-W305 HydrophobicContact CG2-CG 3.7Å; V274-V316 HydrophobicContact CG1-CG1 4.22Å; V274-V316 HydrophobicContact CG2-CG2 4.16Å; V274-V316 WeakPolarHBondContact O-CG1 3.26Å; V274-G577 PolarHBondContact N-O 2.95Å; V274-M579 HydrophobicContact CB-CG 4.13Å; V274-M579 HydrophobicContact CB-SD 3.55Å; V274-M579 VanDerWaalsContact CB-SD 3.55Å; V274-M579 HydrophobicContact CG1-SD 3.65Å; V274-M579 HydrophobicContact CG2-CB 4.1Å; V274-M579 HydrophobicContact CG2-CG 3.96Å; V274-M579 HydrophobicContact CG2-SD 3.49Å; V274-M579 WeakPolarHBondContact CG2-SD 3.43Å
275	V	95.6	Very high	91.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	S	Bend	trans	-135.7	164.2	174.7	-67	0	0	0	0	112.1	K273 D277 I279 A295 D297 L318 G577	K273-V275 PolarHBondContact NZ-O 3.5Å; V275-D277 WeakPolarHBondContact CG2-O 3.35Å; V275-I279 HydrophobicContact CG2-CD1 4.32Å; V275-I279 HydrophobicContact CG2-CG1 3.63Å; V275-A295 HydrophobicContact CG1-CB 4.37Å; V275-A295 WeakPolarHBondContact CG1-O 3.47Å; V275-D297 HydrophobicContact CB-CB 3.81Å; V275-D297 HydrophobicContact CG1-CB 4.23Å; V275-D297 HydrophobicContact CG2-CB 3.77Å; V275-L318 HydrophobicContact CB-CD1 4.37Å; V275-L318 HydrophobicContact CG1-CD1 3.96Å; V275-G577 PolarHBondContact N-O 3.04Å; V275-G577 VanDerWaalsContact N-O 3.12Å; V275-G577 WeakPolarHBondContact O-CA 3.23Å
276	K	92.6	Very high	91.9	Very high	76 Å²	76	26.7 Å²	26.7	33%	0.33	14%	0.139	S	C	.	.	S	Bend	trans	-75.9	-43.6	-176.2	-69.3	-168	178	-174.7	0	112.4	L169 K273 L318	L169-K276 HydrophobicContact CD1-CG 4.35Å; K273-K276 PolarHBondContact NZ-O 3.33Å; K276-L318 HydrophobicContact CD-CD2 4.45Å; K276-L318 HydrophobicContact CG-CD2 4.2Å
277	D	94.7	Very high	91.9	Very high	55 Å²	55	26 Å²	26	29%	0.294	14%	0.136	S	C	.	.	S	Bend	trans	-106.5	-176.2	-176.9	-85.3	-111.6	0	0	0	114.1	V275 I279 D297 K298 W299 G577	V275-D277 WeakPolarHBondContact CG2-O 3.35Å; D277-I279 PolarHBondContact O-N 3.33Å; D277-D297 HydrophobicContact CB-CB 4.37Å; D277-D297 PolarHBondContact N-OD2 2.9Å; D277-K298 HydrophobicContact CB-CB 3.92Å; D277-W299 VanDerWaalsContact CG-NE1 3.28Å; D277-W299 PolarHBondContact OD1-NE1 2.75Å; D277-W299 VanDerWaalsContact OD2-CD1 3.27Å; D277-W299 PolarHBondContact OD2-NE1 2.99Å; D277-G577 WeakPolarHBondContact O-CA 3.16Å; D277-G577 PolarHBondContact O-N 3.36Å
278	R	95.5	Very high	92	Very high	35 Å²	35	26.2 Å²	26.2	13%	0.132	13%	0.134	C	C	.	.			trans	-49.2	130.1	172.5	159.1	170.8	37.5	169.7	-10.9	112.1	F280 D297 K298 R508 W509 L510 S511 S575	R278-F280 HydrophobicContact CG-CD2 3.99Å; R278-F280 HydrophobicContact CG-CE2 3.82Å; R278-D297 CarbonylContact O-C 3.5Å; R278-D297 WeakPolarHBondContact O-CA 3.42Å; R278-K298 PolarHBondContact O-N 3.2Å; R278-K298 VanDerWaalsContact O-N 3.09Å; R278-R508 PolarHBondContact NH1-O 2.91Å; R278-W509 WeakPolarHBondContact CD-O 3.32Å; R278-W509 PolarHBondContact NE-O 2.77Å; R278-W509 PolarHBondContact NH1-O 2.89Å; R278-L510 PolarHBondContact NH1-O 3.37Å; R278-S511 VanDerWaalsContact CD-OG 3.3Å; R278-S511 WeakPolarHBondContact CD-OG 3.18Å; R278-S511 WeakPolarHBondContact CG-OG 3.4Å; R278-S575 WeakPolarHBondContact CA-O 3.18Å; R278-S575 WeakPolarHBondContact CB-O 3.37Å
279	I	97.4	Very high	92.5	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	126.2	172.3	-60.3	175.6	0	0	0	109.5	V275 D277 S281 A282 A295 G296 S511 V560 N574 R578 M579	V275-I279 HydrophobicContact CG2-CD1 4.32Å; V275-I279 HydrophobicContact CG2-CG1 3.63Å; D277-I279 PolarHBondContact O-N 3.33Å; I279-S281 VanDerWaalsContact CG2-O 3.28Å; I279-S281 WeakPolarHBondContact CG2-O 3.38Å; I279-A282 HydrophobicContact CG2-CB 4.16Å; I279-A295 HydrophobicContact CD1-CB 4Å; I279-A295 HydrophobicContact CG1-CB 4.22Å; I279-A295 HydrophobicContact CG2-CB 4.14Å; I279-G296 WeakPolarHBondContact CA-O 3.43Å; I279-S511 PolarHBondContact O-OG 3.11Å; I279-V560 HydrophobicContact CG2-CB 4.48Å; I279-V560 HydrophobicContact CG2-CG2 4.24Å; I279-N574 PolarHBondContact N-O 3.41Å; I279-N574 VanDerWaalsContact N-O 3.17Å; I279-R578 WeakPolarHBondContact CD1-O 3.44Å; I279-M579 HydrophobicContact CD1-CG 3.71Å
280	F	96.4	Very high	92.8	Very high	47 Å²	47	20.8 Å²	20.8	21%	0.206	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-32.6	175.6	-91.4	-103.7	0	0	0	112.7	R278 G296 K298 P325 V326 Y344	R278-F280 HydrophobicContact CG-CD2 3.99Å; R278-F280 HydrophobicContact CG-CE2 3.82Å; F280-G296 PolarHBondContact N-O 2.96Å; F280-K298 HydrophobicContact CD2-CB 4.1Å; F280-K298 HydrophobicContact CE2-CB 3.71Å; F280-K298 HydrophobicContact CE2-CG 3.77Å; F280-K298 HydrophobicContact CZ-CG 4.42Å; F280-P325 HydrophobicContact CD1-CB 3.83Å; F280-P325 HydrophobicContact CD2-CB 4.03Å; F280-P325 HydrophobicContact CE1-CB 3.96Å; F280-P325 HydrophobicContact CE1-CG 4.34Å; F280-P325 HydrophobicContact CE2-CB 4.17Å; F280-P325 HydrophobicContact CE2-CG 4.4Å; F280-P325 HydrophobicContact CG-CB 3.87Å; F280-P325 HydrophobicContact CZ-CB 4.13Å; F280-P325 HydrophobicContact CZ-CG 4.2Å; F280-V326 WeakPolarHBondContact CB-O 3.49Å; F280-Y344 HydrophobicContact CD1-CE2 4.44Å; F280-Y344 HydrophobicContact CE1-CE2 4.17Å
281	S	97.1	Very high	93.1	Very high	10 Å²	10	20.9 Å²	20.9	7%	0.07	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	155.6	176	56	0	0	0	0	109.8	I279 G296 V326 S328	I279-S281 VanDerWaalsContact CG2-O 3.28Å; I279-S281 WeakPolarHBondContact CG2-O 3.38Å; S281-G296 PolarHBondContact O-N 3.14Å; S281-V326 PolarHBondContact OG-O 3.47Å; S281-S328 PolarHBondContact OG-N 3.27Å
282	A	97.3	Very high	93.2	Very high	15 Å²	15	20.8 Å²	20.8	12%	0.124	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	154.2	178.2	0	0	0	0	0	110.3	I279 A294 A295 V560 L571 M579	I279-A282 HydrophobicContact CG2-CB 4.16Å; A282-A294 CarbonylContact C-O 3.53Å; A282-A294 WeakPolarHBondContact CA-O 3.28Å; A282-A294 VanDerWaalsContact CB-O 3.27Å; A282-A294 WeakPolarHBondContact CB-O 3.27Å; A282-A295 HydrophobicContact CB-CB 4.26Å; A282-V560 HydrophobicContact CB-CG1 4.03Å; A282-L571 HydrophobicContact CB-CD2 3.78Å; A282-M579 HydrophobicContact CB-CE 4.33Å
283	A	96.5	Very high	93.3	Very high	12 Å²	12	20.8 Å²	20.8	10%	0.099	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	153.3	-178.3	0	0	0	0	0	111.8	L293 A294 M329 F331	A283-L293 CarbonylContact O-C 3.59Å; A283-L293 WeakPolarHBondContact O-CA 3.03Å; A283-A294 PolarHBondContact N-O 3.48Å; A283-A294 PolarHBondContact O-N 3.01Å; A283-M329 HydrophobicContact CB-CG 4.35Å; A283-F331 HydrophobicContact CB-CD2 3.95Å; A283-F331 HydrophobicContact CB-CE2 4.07Å
284	F	95.4	Very high	93.4	Very high	12 Å²	12	19.7 Å²	19.7	5%	0.053	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	141.9	164.3	-83.2	-74.3	0	0	0	110	L291 L293 F331 A562 H564 A569 L571	F284-L291 HydrophobicContact CE1-CD2 4.2Å; F284-L293 HydrophobicContact CD1-CD2 3.77Å; F284-L293 HydrophobicContact CD1-CG 3.73Å; F284-L293 HydrophobicContact CE1-CD2 3.32Å; F284-L293 HydrophobicContact CE1-CG 3.7Å; F284-L293 HydrophobicContact CZ-CD2 3.84Å; F284-F331 WeakPolarHBondContact O-CD2 3.4Å; F284-A562 WeakPolarHBondContact CE2-O 3.42Å; F284-H564 HydrophobicContact CD1-CB 4.31Å; F284-H564 AromaticContact CD1-CD2 3.48Å; F284-H564 VanDerWaalsContact CD1-CD2 3.48Å; F284-H564 WeakPolarHBondContact CD1-CD2 3.36Å; F284-H564 HydrophobicContact CD2-CB 3.94Å; F284-H564 HydrophobicContact CE1-CB 4.35Å; F284-H564 AromaticContact CE1-CD2 3.89Å; F284-H564 HydrophobicContact CE2-CB 3.97Å; F284-H564 HydrophobicContact CG-CB 4.09Å; F284-H564 AromaticContact CG-CD2 3.83Å; F284-H564 HydrophobicContact CZ-CB 4.19Å; F284-A569 HydrophobicContact CZ-CB 4.16Å; F284-L571 HydrophobicContact CD2-CB 4.19Å; F284-L571 HydrophobicContact CE2-CB 3.43Å; F284-L571 VanDerWaalsContact CE2-CB 3.43Å; F284-L571 HydrophobicContact CZ-CB 3.7Å
285	H	94.4	Very high	93.6	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	11%	0.112	C	C	.	.			trans	-71.9	147.3	162.5	-175.5	-89.7	0	0	0	109.1	L240 C241 C287 L292 F331 P336	L240-H285 PolarHBondContact O-CE1 3Å; C241-H285 PolarHBondContact SG-NE2 3.39Å; C241-H285 VanDerWaalsContact SG-NE2 3.42Å; H285-C287 VanDerWaalsContact ND1-CB 3.27Å; H285-C287 WeakPolarHBondContact ND1-CB 3.41Å; H285-C287 PolarHBondContact ND1-N 3.23Å; H285-C287 PolarHBondContact ND1-SG 3.12Å; H285-C287 PolarHBondContact O-N 3.19Å; H285-C287 VanDerWaalsContact O-N 3.14Å; H285-L292 HydrophobicContact CB-CB 3.91Å; H285-L292 HydrophobicContact CB-CD2 3.88Å; H285-L292 HydrophobicContact CB-CG 3.81Å; H285-L292 WeakPolarHBondContact CB-O 3.15Å; H285-L292 PolarHBondContact N-O 2.9Å; H285-F331 HydrophobicContact CB-CD1 4.39Å; H285-F331 HydrophobicContact CB-CD2 4.34Å; H285-F331 HydrophobicContact CB-CE1 4.12Å; H285-F331 HydrophobicContact CB-CE2 4.06Å; H285-F331 HydrophobicContact CB-CG 4.49Å; H285-F331 HydrophobicContact CB-CZ 3.94Å; H285-F331 AromaticContact CD2-CD1 3.6Å; H285-F331 AromaticContact CD2-CE1 3.63Å; H285-P336 PolarHBondContact CD2-O 2.7Å; H285-P336 WeakPolarHBondContact NE2-CB 3.3Å; H285-P336 PolarHBondContact NE2-O 2.73Å; H285-P336 VanDerWaalsContact NE2-O 3.07Å
286	P	90.1	Very high	93.7	Very high	20 Å²	20	19.7 Å²	19.7	13%	0.13	11%	0.112	C	C	.	.			trans	-78.3	15.3	-176.3	32.6	-38.2	0	0	0	115.4	S245 P336 P565	S245-P286 WeakPolarHBondContact CB-O 3.31Å; P286-P336 HydrophobicContact CG-CB 4.3Å; P286-P565 HydrophobicContact CB-CB 4.46Å; P286-P565 HydrophobicContact CB-CG 4.33Å
287	C	88.7	Confident	93.9	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.007	10%	0.096	C	C	.	.			trans	-71.8	137.6	-175.4	48.4	0	0	0	0	112.4	E243 H285 S290 H564	E243-C287 VanDerWaalsContact OE2-CB 3.26Å; E243-C287 WeakPolarHBondContact OE2-CB 3.19Å; H285-C287 VanDerWaalsContact ND1-CB 3.27Å; H285-C287 WeakPolarHBondContact ND1-CB 3.41Å; H285-C287 PolarHBondContact ND1-N 3.23Å; H285-C287 PolarHBondContact ND1-SG 3.12Å; H285-C287 PolarHBondContact O-N 3.19Å; H285-C287 VanDerWaalsContact O-N 3.14Å; C287-S290 PolarHBondContact SG-O 2.88Å; C287-H564 PolarHBondContact O-CE1 3.32Å; C287-H564 PolarHBondContact O-NE2 2.7Å
288	S	83.9	Confident	93.9	Very high	27 Å²	27	15.8 Å²	15.8	19%	0.189	9%	0.092	C	C	.	.	S	Bend	trans	-80.2	-36.7	175.1	21.9	0	0	0	0	112.2	E243 R567	E243-S288 WeakPolarHBondContact OE1-CA 3.44Å; E243-S288 WeakPolarHBondContact OE1-CB 3.34Å; E243-S288 PolarHBondContact OE1-N 2.87Å; E243-S288 PolarHBondContact OE1-OG 3.04Å; E243-S288 PolarHBondContact OE2-N 3.13Å; S288-R567 WeakPolarHBondContact O-CD 3.5Å; S288-R567 PolarHBondContact O-NH1 3.47Å
289	S	85.4	Confident	93.9	Very high	73 Å²	73	19 Å²	19	51%	0.51	11%	0.105	S	C	.	.	S	Bend	trans	-64.1	-49.4	-174.8	61.1	0	0	0	0	114.3	L240 E243 R567	L240-S289 WeakPolarHBondContact CD2-OG 3.49Å; E243-S289 PolarHBondContact OE1-N 2.97Å; E243-S289 VanDerWaalsContact OE2-CB 3.29Å; E243-S289 WeakPolarHBondContact OE2-CB 3.28Å; E243-S289 PolarHBondContact OE2-N 2.83Å; E243-S289 PolarHBondContact OE2-OG 2.93Å; S289-R567 PolarHBondContact O-NH1 2.95Å
290	S	88.6	Confident	93.7	Very high	24 Å²	24	19 Å²	19	17%	0.168	11%	0.105	C	C	.	.	S	Bend	trans	-128.6	164.1	-177.3	-163.1	0	0	0	0	113.4	C287 L292 N306	C287-S290 PolarHBondContact SG-O 2.88Å; S290-L292 PolarHBondContact O-N 3.23Å; S290-N306 WeakPolarHBondContact CB-OD1 3.4Å; S290-N306 PolarHBondContact OG-OD1 2.91Å
291	L	91.6	Very high	93.7	Very high	5 Å²	5	18.3 Å²	18.3	3%	0.026	10%	0.101	C	C	.	.			trans	-92	88.8	169.2	-63.7	178.9	0	0	0	109.5	F284 L293 N306 M307 H564 A569 V581 H583	F284-L291 HydrophobicContact CE1-CD2 4.2Å; L291-L293 HydrophobicContact CB-CD1 4.46Å; L291-L293 WeakPolarHBondContact O-CD1 3.32Å; L291-N306 PolarHBondContact O-OD1 3.07Å; L291-M307 HydrophobicContact CB-CB 4.11Å; L291-M307 HydrophobicContact CB-SD 4.48Å; L291-M307 HydrophobicContact CD1-CE 4.43Å; L291-M307 HydrophobicContact CD1-SD 3.87Å; L291-M307 PolarHBondContact O-N 2.97Å; L291-H564 VanDerWaalsContact CD2-CD2 3.44Å; L291-H564 WeakPolarHBondContact CD2-CD2 3.19Å; L291-A569 HydrophobicContact CD1-CB 4.14Å; L291-A569 HydrophobicContact CD2-CB 3.97Å; L291-V581 HydrophobicContact CD1-CG1 4.21Å; L291-H583 HydrophobicContact CD1-CB 3.96Å
292	L	93.8	Very high	93.7	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.005	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	129.4	169.8	172.2	63.8	0	0	0	110	L237 L240 H285 S290 N306 W311	L237-L292 HydrophobicContact CD1-CD1 4.27Å; L237-L292 HydrophobicContact CD1-CD2 3.76Å; L240-L292 HydrophobicContact CB-CD2 4.42Å; L240-L292 HydrophobicContact CD1-CD2 4.41Å; H285-L292 HydrophobicContact CB-CB 3.91Å; H285-L292 HydrophobicContact CB-CD2 3.88Å; H285-L292 HydrophobicContact CB-CG 3.81Å; H285-L292 WeakPolarHBondContact CB-O 3.15Å; H285-L292 PolarHBondContact N-O 2.9Å; S290-L292 PolarHBondContact O-N 3.23Å; L292-N306 HydrophobicContact CD1-CB 4.11Å; L292-W311 HydrophobicContact CD1-CH2 4.14Å; L292-W311 HydrophobicContact CD1-CZ2 4.24Å
293	L	95.1	Very high	93.7	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	154.4	-173.6	-43.1	91.9	0	0	0	111	A283 F284 L291 L304 W305 L571 M579 V581	A283-L293 CarbonylContact O-C 3.59Å; A283-L293 WeakPolarHBondContact O-CA 3.03Å; F284-L293 HydrophobicContact CD1-CD2 3.77Å; F284-L293 HydrophobicContact CD1-CG 3.73Å; F284-L293 HydrophobicContact CE1-CD2 3.32Å; F284-L293 HydrophobicContact CE1-CG 3.7Å; F284-L293 HydrophobicContact CZ-CD2 3.84Å; L291-L293 HydrophobicContact CB-CD1 4.46Å; L291-L293 WeakPolarHBondContact O-CD1 3.32Å; L293-L304 WeakPolarHBondContact O-CA 3.27Å; L293-W305 HydrophobicContact CD1-CD2 4.09Å; L293-W305 HydrophobicContact CD1-CE3 3.82Å; L293-W305 HydrophobicContact CD1-CG 4.5Å; L293-W305 HydrophobicContact CD1-CZ3 4.29Å; L293-W305 WeakPolarHBondContact CD1-O 3.3Å; L293-W305 HydrophobicContact CD2-CE3 4.44Å; L293-W305 HydrophobicContact CD2-CZ3 4.49Å; L293-W305 PolarHBondContact N-O 2.92Å; L293-W305 PolarHBondContact O-N 2.56Å; L293-L571 HydrophobicContact CD2-CB 4.25Å; L293-L571 HydrophobicContact CD2-CD1 3.9Å; L293-L571 HydrophobicContact CD2-CD2 4.13Å; L293-L571 HydrophobicContact CD2-CG 4.31Å; L293-M579 HydrophobicContact CB-CE 3.52Å; L293-M579 HydrophobicContact CD2-CE 4.02Å; L293-M579 HydrophobicContact CG-CE 4.4Å; L293-V581 HydrophobicContact CD2-CG2 3.66Å
294	A	97.4	Very high	93.7	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	144.9	171.9	0	0	0	0	0	111.1	A282 A283 G303 L304 M329 F331 L339	A282-A294 CarbonylContact C-O 3.53Å; A282-A294 WeakPolarHBondContact CA-O 3.28Å; A282-A294 VanDerWaalsContact CB-O 3.27Å; A282-A294 WeakPolarHBondContact CB-O 3.27Å; A283-A294 PolarHBondContact N-O 3.48Å; A283-A294 PolarHBondContact O-N 3.01Å; A294-G303 CarbonylContact C-O 3.44Å; A294-G303 WeakPolarHBondContact CA-O 3.44Å; A294-L304 HydrophobicContact CB-CD2 3.81Å; A294-M329 HydrophobicContact CB-SD 3.86Å; A294-F331 HydrophobicContact CB-CE2 3.91Å; A294-F331 HydrophobicContact CB-CZ 3.89Å; A294-L339 HydrophobicContact CB-CD1 4.48Å; A294-L339 HydrophobicContact CB-CD2 3.6Å
295	A	98	Very high	93.6	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	134.8	171.3	0	0	0	0	0	112	V274 V275 I279 A282 I302 G303 M579	V274-A295 HydrophobicContact CG1-CB 4.47Å; V275-A295 HydrophobicContact CG1-CB 4.37Å; V275-A295 WeakPolarHBondContact CG1-O 3.47Å; I279-A295 HydrophobicContact CD1-CB 4Å; I279-A295 HydrophobicContact CG1-CB 4.22Å; I279-A295 HydrophobicContact CG2-CB 4.14Å; A282-A295 HydrophobicContact CB-CB 4.26Å; A295-I302 WeakPolarHBondContact O-CA 3.39Å; A295-G303 PolarHBondContact N-O 2.79Å; A295-G303 PolarHBondContact O-N 2.74Å; A295-M579 HydrophobicContact CB-CE 3.95Å; A295-M579 HydrophobicContact CB-CG 4.2Å; A295-M579 HydrophobicContact CB-SD 3.5Å; A295-M579 WeakPolarHBondContact CB-SD 3.38Å
296	G	97.9	Very high	93.6	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.2	178.2	0	0	0	0	0	112.1	I279 F280 S281 K301 M329	I279-G296 WeakPolarHBondContact CA-O 3.43Å; F280-G296 PolarHBondContact N-O 2.96Å; S281-G296 PolarHBondContact O-N 3.14Å; G296-K301 WeakPolarHBondContact CA-O 3.48Å; G296-M329 VanDerWaalsContact CA-CE 3.48Å; G296-M329 VanDerWaalsContact N-CE 3.28Å
297	D	96.5	Very high	93.5	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	178.2	-172.4	96.1	-5.9	0	0	0	114.8	V275 D277 R278 W299 G300 K301 P325 V326	V275-D297 HydrophobicContact CB-CB 3.81Å; V275-D297 HydrophobicContact CG1-CB 4.23Å; V275-D297 HydrophobicContact CG2-CB 3.77Å; D277-D297 HydrophobicContact CB-CB 4.37Å; D277-D297 PolarHBondContact N-OD2 2.9Å; R278-D297 CarbonylContact O-C 3.5Å; R278-D297 WeakPolarHBondContact O-CA 3.42Å; D297-W299 PolarHBondContact O-N 3.39Å; D297-W299 WeakPolarHBondContact OD1-CA 3.41Å; D297-W299 PolarHBondContact OD1-N 3.35Å; D297-G300 PolarHBondContact OD1-N 2.8Å; D297-K301 PolarHBondContact N-O 2.75Å; D297-K301 PolarHBondContact OD1-N 2.67Å; D297-P325 WeakPolarHBondContact O-CA 3.36Å; D297-V326 PolarHBondContact O-N 2.85Å; D297-V326 VanDerWaalsContact O-N 3.11Å
298	K	94.6	Very high	93.2	Very high	49 Å²	49	20.9 Å²	20.9	21%	0.213	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-19.6	-179.1	-173.4	-177.4	160.9	-65.4	0	114.5	D277 R278 F280 P325	D277-K298 HydrophobicContact CB-CB 3.92Å; R278-K298 PolarHBondContact O-N 3.2Å; R278-K298 VanDerWaalsContact O-N 3.09Å; F280-K298 HydrophobicContact CD2-CB 4.1Å; F280-K298 HydrophobicContact CE2-CB 3.71Å; F280-K298 HydrophobicContact CE2-CG 3.77Å; F280-K298 HydrophobicContact CZ-CG 4.42Å; K298-P325 HydrophobicContact CG-CG 4.35Å; K298-P325 WeakPolarHBondContact O-CA 3.37Å; K298-P325 WeakPolarHBondContact O-CD 3.47Å; K298-P325 WeakPolarHBondContact O-CG 3.44Å
299	W	94.9	Very high	93.3	Very high	103 Å²	103	21 Å²	21	39%	0.39	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	14.1	-172.8	-59.9	118.6	0	0	0	113.2	I212 D277 D297 S323	I212-W299 HydrophobicContact CD1-CE3 4.5Å; I212-W299 HydrophobicContact CD1-CZ3 4.03Å; D277-W299 VanDerWaalsContact CG-NE1 3.28Å; D277-W299 PolarHBondContact OD1-NE1 2.75Å; D277-W299 VanDerWaalsContact OD2-CD1 3.27Å; D277-W299 PolarHBondContact OD2-NE1 2.99Å; D297-W299 PolarHBondContact O-N 3.39Å; D297-W299 WeakPolarHBondContact OD1-CA 3.41Å; D297-W299 PolarHBondContact OD1-N 3.35Å; W299-S323 CarbonylContact O-C 3.51Å; W299-S323 WeakPolarHBondContact O-CA 2.9Å
300	G	94.4	Very high	93	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.148	C	C	.	.	S	Bend	trans	91.5	9.5	173.9	0	0	0	0	0	114.7	D297 P321 H322 R324	D297-G300 PolarHBondContact OD1-N 2.8Å; G300-P321 WeakPolarHBondContact O-CD 3.4Å; G300-H322 WeakPolarHBondContact O-CB 3.35Å; G300-H322 PolarHBondContact O-N 3.49Å; G300-H322 VanDerWaalsContact O-N 3.1Å; G300-R324 WeakPolarHBondContact CA-O 3.15Å; G300-R324 PolarHBondContact N-O 3.47Å
301	K	96.5	Very high	92.6	Very high	31 Å²	31	27 Å²	27	14%	0.135	15%	0.145	C	C	.	.			trans	-80.3	145.2	173.7	-51.7	-177.1	173.5	42.5	0	110.1	I225 G296 D297 L318 F319 E320	I225-K301 HydrophobicContact CD1-CD 4.37Å; G296-K301 WeakPolarHBondContact CA-O 3.48Å; D297-K301 PolarHBondContact N-O 2.75Å; D297-K301 PolarHBondContact OD1-N 2.67Å; K301-L318 HydrophobicContact CB-CD1 3.89Å; K301-L318 HydrophobicContact CD-CD1 4.28Å; K301-L318 HydrophobicContact CD-CD2 4.13Å; K301-L318 HydrophobicContact CD-CG 4.39Å; K301-F319 VanDerWaalsContact CA-O 3.24Å; K301-F319 WeakPolarHBondContact CA-O 3.24Å; K301-E320 WeakPolarHBondContact CE-OE2 3.4Å; K301-E320 HydrophobicContact CG-CB 4.11Å; K301-E320 HydrophobicContact CG-CG 4.2Å; K301-E320 WeakPolarHBondContact CG-OE2 3.45Å; K301-E320 IonicContact NZ-OE2 3.73Å; K301-E320 PolarHBondContact NZ-OE2 2.91Å
302	I	97.6	Very high	91.8	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	120.7	169.6	-62.2	-177.4	0	0	0	107.5	A295 F319 P321 V326 M329 L339 S341	A295-I302 WeakPolarHBondContact O-CA 3.39Å; I302-F319 PolarHBondContact N-O 2.87Å; I302-F319 PolarHBondContact O-N 3.09Å; I302-P321 HydrophobicContact CB-CG 4.18Å; I302-P321 HydrophobicContact CD1-CG 3.71Å; I302-P321 HydrophobicContact CG1-CG 3.78Å; I302-V326 HydrophobicContact CD1-CG1 4.44Å; I302-V326 HydrophobicContact CG1-CG2 4.16Å; I302-M329 HydrophobicContact CD1-CE 4.04Å; I302-M329 HydrophobicContact CG1-CE 4.03Å; I302-M329 HydrophobicContact CG2-CE 4.1Å; I302-L339 HydrophobicContact CG2-CD2 4.19Å; I302-S341 VanDerWaalsContact CD1-CB 3.46Å; I302-S341 WeakPolarHBondContact CD1-OG 3.15Å
303	G	96.3	Very high	91.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	128.8	169.7	0	0	0	0	0	110	A294 A295 L317	A294-G303 CarbonylContact C-O 3.44Å; A294-G303 WeakPolarHBondContact CA-O 3.44Å; A295-G303 PolarHBondContact N-O 2.79Å; A295-G303 PolarHBondContact O-N 2.74Å; G303-L317 CarbonylContact C-O 3.46Å; G303-L317 WeakPolarHBondContact CA-O 3.09Å
304	L	95.8	Very high	90.8	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	140.6	161.4	-59.4	-177.5	0	0	0	108.5	L237 L293 A294 W311 V316 L317 F319 L339 M351	L237-L304 HydrophobicContact CD1-CD1 4.45Å; L237-L304 HydrophobicContact CD2-CD1 4.26Å; L293-L304 WeakPolarHBondContact O-CA 3.27Å; A294-L304 HydrophobicContact CB-CD2 3.81Å; L304-W311 HydrophobicContact CB-CH2 4.2Å; L304-V316 WeakPolarHBondContact O-CA 3.5Å; L304-L317 PolarHBondContact N-O 3.1Å; L304-L317 PolarHBondContact O-N 2.84Å; L304-F319 HydrophobicContact CD1-CE2 3.87Å; L304-F319 HydrophobicContact CG-CD2 4.47Å; L304-F319 HydrophobicContact CG-CE2 3.97Å; L304-L339 HydrophobicContact CD2-CD2 4.05Å; L304-M351 HydrophobicContact CD1-CE 3.84Å; L304-M351 HydrophobicContact CD1-SD 3.93Å; L304-M351 HydrophobicContact CD2-CE 4.04Å; L304-M351 HydrophobicContact CD2-SD 4.18Å; L304-M351 HydrophobicContact CG-CE 4.49Å; L304-M351 HydrophobicContact CG-SD 4.33Å
305	W	95	Very high	90.3	Very high	3 Å²	3	32.7 Å²	32.7	1%	0.011	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	128.4	173.4	172.4	37.6	0	0	0	109.8	D270 V272 V274 L293 M307 G315 V316 M579 V581	D270-W305 WeakPolarHBondContact O-CH2 3.45Å; V272-W305 HydrophobicContact CB-CD2 4Å; V272-W305 HydrophobicContact CB-CE3 4.34Å; V272-W305 HydrophobicContact CB-CH2 4.04Å; V272-W305 HydrophobicContact CB-CZ2 3.67Å; V272-W305 HydrophobicContact CB-CZ3 4.34Å; V272-W305 HydrophobicContact CG1-CD2 4.29Å; V272-W305 HydrophobicContact CG1-CG 4.41Å; V272-W305 HydrophobicContact CG2-CD2 4.38Å; V272-W305 VanDerWaalsContact CG2-CE2 3.48Å; V272-W305 HydrophobicContact CG2-CH2 3.93Å; V272-W305 HydrophobicContact CG2-CZ2 3.24Å; V274-W305 HydrophobicContact CB-CB 4.31Å; V274-W305 HydrophobicContact CG1-CB 3.79Å; V274-W305 HydrophobicContact CG2-CB 3.51Å; V274-W305 HydrophobicContact CG2-CD2 3.75Å; V274-W305 HydrophobicContact CG2-CE3 3.64Å; V274-W305 HydrophobicContact CG2-CG 3.7Å; L293-W305 HydrophobicContact CD1-CD2 4.09Å; L293-W305 HydrophobicContact CD1-CE3 3.82Å; L293-W305 HydrophobicContact CD1-CG 4.5Å; L293-W305 HydrophobicContact CD1-CZ3 4.29Å; L293-W305 WeakPolarHBondContact CD1-O 3.3Å; L293-W305 HydrophobicContact CD2-CE3 4.44Å; L293-W305 HydrophobicContact CD2-CZ3 4.49Å; L293-W305 PolarHBondContact N-O 2.92Å; L293-W305 PolarHBondContact O-N 2.56Å; W305-M307 HydrophobicContact CH2-CE 4.23Å; W305-M307 HydrophobicContact CZ2-CE 4.27Å; W305-G315 VanDerWaalsContact CA-O 3.27Å; W305-G315 WeakPolarHBondContact CA-O 3.48Å; W305-V316 HydrophobicContact CB-CG2 4.39Å; W305-V316 HydrophobicContact CG-CG2 4.4Å; W305-M579 HydrophobicContact CE3-CB 3.77Å; W305-M579 HydrophobicContact CE3-SD 4.09Å; W305-M579 HydrophobicContact CZ3-CB 3.61Å; W305-V581 HydrophobicContact CH2-CB 4.47Å; W305-V581 HydrophobicContact CH2-CG2 3.74Å; W305-V581 HydrophobicContact CZ3-CG2 3.59Å
306	N	92.8	Very high	90.1	Very high	13 Å²	13	32.7 Å²	32.7	7%	0.07	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	124	170.3	-173.3	35.3	0	0	0	108.2	S290 L291 L292 A309 W311 G315	S290-N306 WeakPolarHBondContact CB-OD1 3.4Å; S290-N306 PolarHBondContact OG-OD1 2.91Å; L291-N306 PolarHBondContact O-OD1 3.07Å; L292-N306 HydrophobicContact CD1-CB 4.11Å; N306-A309 HydrophobicContact CB-CB 4.15Å; N306-A309 WeakPolarHBondContact ND2-CB 3.34Å; N306-W311 HydrophobicContact CB-CH2 4.4Å; N306-W311 HydrophobicContact CB-CZ2 3.42Å; N306-W311 VanDerWaalsContact CB-CZ2 3.42Å; N306-G315 PolarHBondContact N-O 2.76Å; N306-G315 VanDerWaalsContact N-O 3.12Å
307	M	88.4	Confident	89.9	Confident	36 Å²	36	32.7 Å²	32.7	18%	0.177	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	135.9	179.6	-176.4	175.5	-85	0	0	110.6	D270 L291 W305 A309 V581	D270-M307 HydrophobicContact CB-CE 4.21Å; D270-M307 WeakPolarHBondContact OD1-CE 3.42Å; L291-M307 HydrophobicContact CB-CB 4.11Å; L291-M307 HydrophobicContact CB-SD 4.48Å; L291-M307 HydrophobicContact CD1-CE 4.43Å; L291-M307 HydrophobicContact CD1-SD 3.87Å; L291-M307 PolarHBondContact O-N 2.97Å; W305-M307 HydrophobicContact CH2-CE 4.23Å; W305-M307 HydrophobicContact CZ2-CE 4.27Å; M307-A309 VanDerWaalsContact C-N 3.27Å; M307-A309 PolarHBondContact O-N 2.61Å; M307-V581 HydrophobicContact CE-CB 3.76Å; M307-V581 HydrophobicContact CE-CG1 3.83Å; M307-V581 HydrophobicContact CE-CG2 4.15Å
308	G	83.2	Confident	89.8	Confident	73 Å²	73	32.7 Å²	32.7	75%	0.753	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.7	-0.8	177	0	0	0	0	0	116.8
309	A	84.9	Confident	89.8	Confident	29 Å²	29	30.4 Å²	30.4	24%	0.24	17%	0.172	C	C	.	.			trans	-95.6	135.5	179.9	0	0	0	0	0	112.8	N306 M307 W311 G315	N306-A309 HydrophobicContact CB-CB 4.15Å; N306-A309 WeakPolarHBondContact ND2-CB 3.34Å; M307-A309 VanDerWaalsContact C-N 3.27Å; M307-A309 PolarHBondContact O-N 2.61Å; A309-W311 HydrophobicContact CB-CG 4.27Å; A309-W311 PolarHBondContact O-N 2.81Å; A309-G315 WeakPolarHBondContact O-CA 3.49Å; A309-G315 PolarHBondContact O-N 2.78Å
310	E	79.2	Confident	89.8	Confident	197 Å²	197	28.8 Å²	28.8	92%	0.921	17%	0.169	S	C	*	.			trans	-83.9	15.3	-177.3	-57.8	-166	145.4	0	0	114.6
311	W	80.8	Confident	89.9	Confident	26 Å²	26	28.8 Å²	28.8	10%	0.098	17%	0.169	C	C	.	.	S	Bend	trans	-70.2	137.2	171.5	64.6	-17.1	0	0	0	113	P234 L237 L292 L304 N306 A309 G315 V316 L317	P234-W311 HydrophobicContact CB-CE3 4.42Å; P234-W311 HydrophobicContact CG-CB 4.03Å; P234-W311 HydrophobicContact CG-CE3 3.93Å; L237-W311 HydrophobicContact CB-CZ3 3.81Å; L237-W311 HydrophobicContact CD1-CH2 3.86Å; L237-W311 HydrophobicContact CD1-CZ3 3.92Å; L237-W311 HydrophobicContact CD2-CH2 4.5Å; L237-W311 HydrophobicContact CD2-CZ3 3.96Å; L237-W311 HydrophobicContact CG-CH2 4.5Å; L237-W311 HydrophobicContact CG-CZ3 4.07Å; L292-W311 HydrophobicContact CD1-CH2 4.14Å; L292-W311 HydrophobicContact CD1-CZ2 4.24Å; L304-W311 HydrophobicContact CB-CH2 4.2Å; N306-W311 HydrophobicContact CB-CH2 4.4Å; N306-W311 HydrophobicContact CB-CZ2 3.42Å; N306-W311 VanDerWaalsContact CB-CZ2 3.42Å; A309-W311 HydrophobicContact CB-CG 4.27Å; A309-W311 PolarHBondContact O-N 2.81Å; W311-G315 VanDerWaalsContact CD1-CA 3.46Å; W311-G315 PolarHBondContact NE1-O 3.25Å; W311-G315 CarbonylContact O-C 3.53Å; W311-G315 WeakPolarHBondContact O-CA 3.44Å; W311-G315 PolarHBondContact O-N 3.46Å; W311-V316 PolarHBondContact O-N 3.38Å; W311-L317 HydrophobicContact CD2-CD1 4.39Å; W311-L317 HydrophobicContact CD2-CG 4.23Å; W311-L317 HydrophobicContact CE3-CD1 3.53Å; W311-L317 HydrophobicContact CE3-CG 3.85Å; W311-L317 HydrophobicContact CH2-CD1 4.09Å; W311-L317 HydrophobicContact CH2-CG 4.28Å; W311-L317 HydrophobicContact CZ3-CD1 3.36Å; W311-L317 HydrophobicContact CZ3-CG 3.88Å
312	G	75.7	Confident	89.9	Confident	25 Å²	25	27.3 Å²	27.3	26%	0.258	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.1	-146	167.1	0	0	0	0	0	115.7	D314	G312-D314 VanDerWaalsContact C-N 3.31Å; G312-D314 PolarHBondContact O-N 3.24Å
313	D	82.3	Confident	89.7	Confident	41 Å²	41	27.6 Å²	27.6	22%	0.219	16%	0.164	C	C	.	.	B	Isolated β-bridge	trans	-76.6	85.6	166.5	-78.9	-69.2	0	0	0	108.4	L169 N226 G315 V316	L169-D313 HydrophobicContact CD2-CB 4.23Å; L169-D313 WeakPolarHBondContact CD2-OD2 3.4Å; N226-D313 WeakPolarHBondContact CB-OD2 3.17Å; N226-D313 PolarHBondContact ND2-OD2 3.42Å; D313-G315 PolarHBondContact O-N 2.93Å; D313-V316 PolarHBondContact N-O 3.12Å; D313-V316 VanDerWaalsContact O-CB 3.29Å; D313-V316 WeakPolarHBondContact O-CB 3.45Å; D313-V316 WeakPolarHBondContact O-CG2 3.24Å; D313-V316 PolarHBondContact O-N 2.93Å; D313-V316 VanDerWaalsContact O-N 3.12Å
314	D	84.6	Confident	89.6	Confident	57 Å²	57	32.7 Å²	32.7	31%	0.305	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	57.2	165.4	177.8	35.9	0	0	0	112.7	R167 G168 G312	R167-D314 WeakPolarHBondContact CA-OD2 3.42Å; R167-D314 WeakPolarHBondContact CB-OD2 3.38Å; R167-D314 WeakPolarHBondContact CG-OD2 3.18Å; R167-D314 IonicContact CZ-OD1 3.73Å; R167-D314 VanDerWaalsContact CZ-OD1 3.26Å; R167-D314 IonicContact CZ-OD2 2.75Å; R167-D314 IonicContact NE-OD1 2.79Å; R167-D314 PolarHBondContact NE-OD1 3.03Å; R167-D314 VanDerWaalsContact NE-OD1 3.14Å; R167-D314 IonicContact NE-OD2 3.12Å; R167-D314 PolarHBondContact NE-OD2 3.18Å; R167-D314 IonicContact NH2-OD1 3.81Å; R167-D314 PolarHBondContact NH2-OD1 3.31Å; R167-D314 IonicContact NH2-OD2 3.46Å; G168-D314 PolarHBondContact N-OD2 3.29Å; G312-D314 VanDerWaalsContact C-N 3.31Å; G312-D314 PolarHBondContact O-N 3.24Å
315	G	86.9	Confident	89.6	Confident	2 Å²	2	33.5 Å²	33.5	2%	0.021	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	-5.5	-177.2	0	0	0	0	0	114.9	W305 N306 A309 W311 D313	W305-G315 VanDerWaalsContact CA-O 3.27Å; W305-G315 WeakPolarHBondContact CA-O 3.48Å; N306-G315 PolarHBondContact N-O 2.76Å; N306-G315 VanDerWaalsContact N-O 3.12Å; A309-G315 WeakPolarHBondContact O-CA 3.49Å; A309-G315 PolarHBondContact O-N 2.78Å; W311-G315 VanDerWaalsContact CD1-CA 3.46Å; W311-G315 PolarHBondContact NE1-O 3.25Å; W311-G315 CarbonylContact O-C 3.53Å; W311-G315 WeakPolarHBondContact O-CA 3.44Å; W311-G315 PolarHBondContact O-N 3.46Å; D313-G315 PolarHBondContact O-N 2.93Å
316	V	93	Very high	89.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	129.4	-164.3	-175	0	0	0	0	114.8	L169 N226 V272 V274 L304 W305 W311 D313	L169-V316 HydrophobicContact CD1-CG1 4.37Å; L169-V316 HydrophobicContact CD2-CG1 4.21Å; L169-V316 HydrophobicContact CG-CG1 4Å; N226-V316 PolarHBondContact ND2-O 2.93Å; V272-V316 HydrophobicContact CG1-CG2 3.53Å; V274-V316 HydrophobicContact CG1-CG1 4.22Å; V274-V316 HydrophobicContact CG2-CG2 4.16Å; V274-V316 WeakPolarHBondContact O-CG1 3.26Å; L304-V316 WeakPolarHBondContact O-CA 3.5Å; W305-V316 HydrophobicContact CB-CG2 4.39Å; W305-V316 HydrophobicContact CG-CG2 4.4Å; W311-V316 PolarHBondContact O-N 3.38Å; D313-V316 PolarHBondContact N-O 3.12Å; D313-V316 VanDerWaalsContact O-CB 3.29Å; D313-V316 WeakPolarHBondContact O-CB 3.45Å; D313-V316 WeakPolarHBondContact O-CG2 3.24Å; D313-V316 PolarHBondContact O-N 2.93Å; D313-V316 VanDerWaalsContact O-N 3.12Å
317	L	93.9	Very high	89.8	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.8	164.3	-58.3	-173.3	0	0	0	110.7	P224 Q227 F231 L233 G303 L304 W311 F319	P224-L317 HydrophobicContact CB-CB 4.3Å; P224-L317 HydrophobicContact CB-CD2 4.35Å; P224-L317 HydrophobicContact CG-CD2 4.35Å; Q227-L317 HydrophobicContact CG-CD2 4.43Å; F231-L317 HydrophobicContact CE1-CD1 4.12Å; F231-L317 HydrophobicContact CE1-CD2 3.68Å; F231-L317 HydrophobicContact CZ-CD2 3.64Å; L233-L317 HydrophobicContact CD2-CD1 4.28Å; G303-L317 CarbonylContact C-O 3.46Å; G303-L317 WeakPolarHBondContact CA-O 3.09Å; L304-L317 PolarHBondContact N-O 3.1Å; L304-L317 PolarHBondContact O-N 2.84Å; W311-L317 HydrophobicContact CD2-CD1 4.39Å; W311-L317 HydrophobicContact CD2-CG 4.23Å; W311-L317 HydrophobicContact CE3-CD1 3.53Å; W311-L317 HydrophobicContact CE3-CG 3.85Å; W311-L317 HydrophobicContact CH2-CD1 4.09Å; W311-L317 HydrophobicContact CH2-CG 4.28Å; W311-L317 HydrophobicContact CZ3-CD1 3.36Å; W311-L317 HydrophobicContact CZ3-CG 3.88Å; L317-F319 HydrophobicContact CB-CE2 3.68Å; L317-F319 HydrophobicContact CB-CZ 3.75Å; L317-F319 HydrophobicContact CD1-CZ 4.03Å
318	L	95.1	Very high	90.2	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.9	-175.9	-177.1	71.4	0	0	0	111.6	L169 P224 I225 N226 V275 K276 K301	L169-L318 HydrophobicContact CD1-CB 4.39Å; L169-L318 HydrophobicContact CD1-CD1 4.09Å; L169-L318 HydrophobicContact CD1-CD2 3.8Å; L169-L318 HydrophobicContact CD1-CG 4.32Å; L169-L318 HydrophobicContact CD2-CB 4.3Å; L169-L318 HydrophobicContact CD2-CD2 4.26Å; P224-L318 CarbonylContact C-O 3.58Å; P224-L318 VanDerWaalsContact CA-O 3.3Å; P224-L318 WeakPolarHBondContact CA-O 3.35Å; I225-L318 HydrophobicContact CD1-CD2 4.26Å; I225-L318 HydrophobicContact CD1-CG 4.13Å; I225-L318 WeakPolarHBondContact CG1-O 3.46Å; I225-L318 PolarHBondContact N-O 3.08Å; N226-L318 HydrophobicContact CB-CB 4.18Å; N226-L318 WeakPolarHBondContact OD1-CB 3.44Å; N226-L318 PolarHBondContact OD1-N 3.11Å; V275-L318 HydrophobicContact CB-CD1 4.37Å; V275-L318 HydrophobicContact CG1-CD1 3.96Å; K276-L318 HydrophobicContact CD-CD2 4.45Å; K276-L318 HydrophobicContact CG-CD2 4.2Å; K301-L318 HydrophobicContact CB-CD1 3.89Å; K301-L318 HydrophobicContact CD-CD1 4.28Å; K301-L318 HydrophobicContact CD-CD2 4.13Å; K301-L318 HydrophobicContact CD-CG 4.39Å
319	F	95.3	Very high	90.9	Very high	1 Å²	1	29.8 Å²	29.8	0%	0.004	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	152.2	-175	-56.5	-80.3	0	0	0	113.6	M222 P224 L233 K301 I302 L304 L317 P321 F358	M222-F319 HydrophobicContact CB-CD1 4.41Å; M222-F319 HydrophobicContact CB-CE1 4.04Å; M222-F319 HydrophobicContact CE-CE1 4.49Å; M222-F319 HydrophobicContact CE-CE2 4.5Å; M222-F319 HydrophobicContact CE-CZ 4.15Å; M222-F319 WeakPolarHBondContact O-CE1 3.2Å; P224-F319 HydrophobicContact CB-CD1 4.29Å; P224-F319 HydrophobicContact CB-CE1 3.85Å; P224-F319 HydrophobicContact CB-CZ 4.27Å; P224-F319 HydrophobicContact CG-CE1 4.26Å; L233-F319 HydrophobicContact CD2-CE1 4.2Å; L233-F319 HydrophobicContact CD2-CZ 3.99Å; K301-F319 VanDerWaalsContact CA-O 3.24Å; K301-F319 WeakPolarHBondContact CA-O 3.24Å; I302-F319 PolarHBondContact N-O 2.87Å; I302-F319 PolarHBondContact O-N 3.09Å; L304-F319 HydrophobicContact CD1-CE2 3.87Å; L304-F319 HydrophobicContact CG-CD2 4.47Å; L304-F319 HydrophobicContact CG-CE2 3.97Å; L317-F319 HydrophobicContact CB-CE2 3.68Å; L317-F319 HydrophobicContact CB-CZ 3.75Å; L317-F319 HydrophobicContact CD1-CZ 4.03Å; F319-P321 WeakPolarHBondContact O-CD 3.4Å; F319-F358 HydrophobicContact CB-CE2 3.72Å; F319-F358 HydrophobicContact CB-CZ 3.45Å; F319-F358 VanDerWaalsContact CB-CZ 3.45Å; F319-F358 HydrophobicContact CD1-CE2 4.05Å; F319-F358 HydrophobicContact CD1-CZ 4.22Å; F319-F358 HydrophobicContact CD2-CZ 4.13Å; F319-F358 AromaticContact CG-CE2 3.94Å; F319-F358 HydrophobicContact CG-CE2 3.94Å; F319-F358 AromaticContact CG-CZ 3.68Å; F319-F358 HydrophobicContact CG-CZ 3.68Å
320	E	94.9	Very high	91.4	Very high	68 Å²	68	29.8 Å²	29.8	32%	0.318	16%	0.157	S	C	.	.			trans	-88.6	29.3	179	-165.6	-148.4	120.2	0	0	121	K215 I225 K301 H322	K215-E320 VanDerWaalsContact CE-O 3.27Å; K215-E320 WeakPolarHBondContact CE-O 3.44Å; K215-E320 IonicContact NZ-OE1 2.74Å; K215-E320 PolarHBondContact NZ-OE1 3.5Å; I225-E320 HydrophobicContact CD1-CB 3.43Å; I225-E320 VanDerWaalsContact CD1-CB 3.43Å; I225-E320 HydrophobicContact CG1-CB 4.3Å; K301-E320 WeakPolarHBondContact CE-OE2 3.4Å; K301-E320 HydrophobicContact CG-CB 4.11Å; K301-E320 HydrophobicContact CG-CG 4.2Å; K301-E320 WeakPolarHBondContact CG-OE2 3.45Å; K301-E320 IonicContact NZ-OE2 3.73Å; K301-E320 PolarHBondContact NZ-OE2 2.91Å; E320-H322 WeakPolarHBondContact CG-O 3.46Å; E320-H322 PolarHBondContact O-N 2.86Å
321	P	95.3	Very high	92.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.117	C	C	.	.			trans	-76.6	-17	-160.1	31.3	-37.1	0	0	0	115.6	G300 I302 F319 R349 F358	G300-P321 WeakPolarHBondContact O-CD 3.4Å; I302-P321 HydrophobicContact CB-CG 4.18Å; I302-P321 HydrophobicContact CD1-CG 3.71Å; I302-P321 HydrophobicContact CG1-CG 3.78Å; F319-P321 WeakPolarHBondContact O-CD 3.4Å; P321-R349 WeakPolarHBondContact O-CD 3.34Å; P321-R349 PolarHBondContact O-NH1 2.92Å; P321-F358 HydrophobicContact CB-CB 4.28Å; P321-F358 HydrophobicContact CB-CD1 3.51Å; P321-F358 HydrophobicContact CB-CD2 4.04Å; P321-F358 HydrophobicContact CB-CE1 3.72Å; P321-F358 HydrophobicContact CB-CE2 4.22Å; P321-F358 HydrophobicContact CB-CG 3.69Å; P321-F358 HydrophobicContact CB-CZ 4.09Å; P321-F358 HydrophobicContact CG-CD1 4.03Å; P321-F358 HydrophobicContact CG-CE1 3.73Å; P321-F358 HydrophobicContact CG-CZ 4.04Å
322	H	96	Very high	92.7	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.			trans	-131.6	176.9	-178.8	-63.7	-73.2	0	0	0	110.4	K215 G300 E320 S341 S343 D345 S347	K215-H322 WeakPolarHBondContact CE-O 3.26Å; G300-H322 WeakPolarHBondContact O-CB 3.35Å; G300-H322 PolarHBondContact O-N 3.49Å; G300-H322 VanDerWaalsContact O-N 3.1Å; E320-H322 WeakPolarHBondContact CG-O 3.46Å; E320-H322 PolarHBondContact O-N 2.86Å; H322-S341 PolarHBondContact CE1-O 2.73Å; H322-S341 PolarHBondContact NE2-O 2.62Å; H322-S341 PolarHBondContact NE2-OG 3.17Å; H322-S343 VanDerWaalsContact CG-CB 3.45Å; H322-S343 VanDerWaalsContact ND1-CB 3.27Å; H322-S343 WeakPolarHBondContact ND1-CB 3.18Å; H322-D345 WeakPolarHBondContact CB-OD2 3.43Å; H322-D345 IonicContact ND1-OD1 3.59Å; H322-D345 IonicContact ND1-OD2 2.7Å; H322-S347 PolarHBondContact CE1-O 2.84Å; H322-S347 PolarHBondContact ND1-OG 3.3Å
323	S	94.4	Very high	93.2	Very high	6 Å²	6	26.3 Å²	26.3	4%	0.042	13%	0.128	C	C	.	.	S	Bend	trans	-128.2	-1.1	178.2	73.3	0	0	0	0	115.2	L213 W299 D345	L213-S323 PolarHBondContact O-OG 3.17Å; W299-S323 CarbonylContact O-C 3.51Å; W299-S323 WeakPolarHBondContact O-CA 2.9Å; S323-D345 PolarHBondContact N-OD2 2.91Å
324	R	95.1	Very high	93.4	Very high	107 Å²	107	27.7 Å²	27.7	40%	0.404	14%	0.14	S	C	.	.	S	Bend	trans	-136.1	175.4	176.4	-63.5	-176.5	81.6	-165.4	14.4	109.8	G300 V326 S343 Y344 D345	G300-R324 WeakPolarHBondContact CA-O 3.15Å; G300-R324 PolarHBondContact N-O 3.47Å; R324-V326 PolarHBondContact O-N 2.86Å; R324-S343 PolarHBondContact O-OG 3.01Å; R324-S343 VanDerWaalsContact O-OG 3.12Å; R324-Y344 PolarHBondContact NH1-O 2.99Å; R324-D345 HydrophobicContact CB-CB 3.97Å; R324-D345 HydrophobicContact CG-CB 3.87Å; R324-D345 PolarHBondContact N-OD2 3.3Å
325	P	95.6	Very high	93.6	Very high	18 Å²	18	28.6 Å²	28.6	12%	0.117	14%	0.142	C	C	.	.			trans	-55.8	131.1	-172	-24.9	29.3	0	0	0	114.1	F280 D297 K298 G327 Y344	F280-P325 HydrophobicContact CD1-CB 3.83Å; F280-P325 HydrophobicContact CD2-CB 4.03Å; F280-P325 HydrophobicContact CE1-CB 3.96Å; F280-P325 HydrophobicContact CE1-CG 4.34Å; F280-P325 HydrophobicContact CE2-CB 4.17Å; F280-P325 HydrophobicContact CE2-CG 4.4Å; F280-P325 HydrophobicContact CG-CB 3.87Å; F280-P325 HydrophobicContact CZ-CB 4.13Å; F280-P325 HydrophobicContact CZ-CG 4.2Å; D297-P325 WeakPolarHBondContact O-CA 3.36Å; K298-P325 HydrophobicContact CG-CG 4.35Å; K298-P325 WeakPolarHBondContact O-CA 3.37Å; K298-P325 WeakPolarHBondContact O-CD 3.47Å; K298-P325 WeakPolarHBondContact O-CG 3.44Å; P325-G327 PolarHBondContact O-N 3.34Å; P325-G327 VanDerWaalsContact O-N 3.1Å; P325-Y344 HydrophobicContact CB-CD2 3.71Å; P325-Y344 HydrophobicContact CB-CE2 3.74Å; P325-Y344 HydrophobicContact CB-CG 4.16Å; P325-Y344 HydrophobicContact CG-CD2 3.62Å; P325-Y344 HydrophobicContact CG-CE2 3.9Å; P325-Y344 HydrophobicContact CG-CG 4.35Å; P325-Y344 WeakPolarHBondContact O-CD1 3.28Å; P325-Y344 PolarHBondContact O-N 3.25Å; P325-Y344 VanDerWaalsContact O-N 3.08Å
326	V	97.2	Very high	93.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	96.4	173	-170.5	0	0	0	0	108.3	F280 S281 D297 I302 R324 M329 A342	F280-V326 WeakPolarHBondContact CB-O 3.49Å; S281-V326 PolarHBondContact OG-O 3.47Å; D297-V326 PolarHBondContact O-N 2.85Å; D297-V326 VanDerWaalsContact O-N 3.11Å; I302-V326 HydrophobicContact CD1-CG1 4.44Å; I302-V326 HydrophobicContact CG1-CG2 4.16Å; R324-V326 PolarHBondContact O-N 2.86Å; V326-M329 HydrophobicContact CG1-CE 3.86Å; V326-A342 CarbonylContact C-O 3.58Å
327	G	94.8	Very high	93.7	Very high	10 Å²	10	31 Å²	31	10%	0.103	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	-12.9	-166.4	0	0	0	0	0	116	P325 A342 K369	P325-G327 PolarHBondContact O-N 3.34Å; P325-G327 VanDerWaalsContact O-N 3.1Å; G327-A342 PolarHBondContact N-O 2.91Å; G327-K369 CarbonylContact C-O 3.59Å; G327-K369 PolarHBondContact O-NZ 3.09Å
328	S	96.3	Very high	93.7	Very high	22 Å²	22	31.9 Å²	31.9	15%	0.154	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	142.2	-178.4	168.3	0	0	0	0	108.4	S281 A342 F371	S281-S328 PolarHBondContact OG-N 3.27Å; S328-A342 PolarHBondContact O-N 3.14Å; S328-F371 WeakPolarHBondContact OG-CD1 3.29Å
329	M	96.8	Very high	93.8	Very high	15 Å²	15	31.9 Å²	31.9	7%	0.074	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	150.1	173.6	60.9	171.9	45.5	0	0	110.5	A283 A294 G296 I302 V326 L339 L340	A283-M329 HydrophobicContact CB-CG 4.35Å; A294-M329 HydrophobicContact CB-SD 3.86Å; G296-M329 VanDerWaalsContact CA-CE 3.48Å; G296-M329 VanDerWaalsContact N-CE 3.28Å; I302-M329 HydrophobicContact CD1-CE 4.04Å; I302-M329 HydrophobicContact CG1-CE 4.03Å; I302-M329 HydrophobicContact CG2-CE 4.1Å; V326-M329 HydrophobicContact CG1-CE 3.86Å; M329-L339 HydrophobicContact CB-CD1 4.26Å; M329-L340 CarbonylContact C-O 3.51Å; M329-L340 WeakPolarHBondContact CA-O 3.07Å; M329-L340 WeakPolarHBondContact CB-O 3.45Å
330	A	96.1	Very high	93.9	Very high	30 Å²	30	31.8 Å²	31.8	25%	0.248	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	138.8	176.2	0	0	0	0	0	111	L340 F371 F373	A330-L340 PolarHBondContact N-O 2.75Å; A330-L340 PolarHBondContact O-N 3.32Å; A330-F371 HydrophobicContact CB-CE2 4.4Å; A330-F371 HydrophobicContact CB-CZ 4.02Å; A330-F373 HydrophobicContact CB-CE2 3.79Å; A330-F373 HydrophobicContact CB-CZ 4.39Å
331	F	95.4	Very high	94	Very high	18 Å²	18	28.6 Å²	28.6	8%	0.079	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	145.7	167.2	-68.4	-88.6	0	0	0	110	A283 F284 H285 A294 Q338 L339	A283-F331 HydrophobicContact CB-CD2 3.95Å; A283-F331 HydrophobicContact CB-CE2 4.07Å; F284-F331 WeakPolarHBondContact O-CD2 3.4Å; H285-F331 HydrophobicContact CB-CD1 4.39Å; H285-F331 HydrophobicContact CB-CD2 4.34Å; H285-F331 HydrophobicContact CB-CE1 4.12Å; H285-F331 HydrophobicContact CB-CE2 4.06Å; H285-F331 HydrophobicContact CB-CG 4.49Å; H285-F331 HydrophobicContact CB-CZ 3.94Å; H285-F331 AromaticContact CD2-CD1 3.6Å; H285-F331 AromaticContact CD2-CE1 3.63Å; A294-F331 HydrophobicContact CB-CE2 3.91Å; A294-F331 HydrophobicContact CB-CZ 3.89Å; F331-Q338 WeakPolarHBondContact CA-O 3.27Å; F331-L339 HydrophobicContact CD1-CB 3.79Å; F331-L339 HydrophobicContact CD1-CD1 4.15Å; F331-L339 HydrophobicContact CD1-CG 4.48Å; F331-L339 HydrophobicContact CD2-CD1 3.93Å; F331-L339 HydrophobicContact CE1-CB 3.75Å; F331-L339 HydrophobicContact CE1-CD1 4.2Å; F331-L339 HydrophobicContact CE1-CD2 4.26Å; F331-L339 HydrophobicContact CE1-CG 4.29Å; F331-L339 HydrophobicContact CE2-CD1 3.99Å; F331-L339 HydrophobicContact CG-CB 4.46Å; F331-L339 HydrophobicContact CG-CD1 4.03Å; F331-L339 HydrophobicContact CZ-CB 4.38Å; F331-L339 HydrophobicContact CZ-CD1 4.13Å; F331-L339 HydrophobicContact CZ-CD2 4.11Å; F331-L339 HydrophobicContact CZ-CG 4.44Å
332	S	92.6	Very high	94.1	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.145	C	C	.	.			trans	-72.8	131.9	175.3	167.7	0	0	0	0	110.5	C334 H335 Q338 C378	S332-C334 VanDerWaalsContact C-N 3.3Å; S332-C334 PolarHBondContact O-N 3.23Å; S332-H335 WeakPolarHBondContact CB-O 3.34Å; S332-H335 CarbonylContact O-C 3.52Å; S332-H335 PolarHBondContact O-N 2.85Å; S332-H335 WeakPolarHBondContact OG-CB 3.41Å; S332-H335 PolarHBondContact OG-N 3.02Å; S332-H335 PolarHBondContact OG-ND1 3.36Å; S332-Q338 PolarHBondContact N-O 3.43Å; S332-C378 VanDerWaalsContact OG-CB 3.31Å; S332-C378 WeakPolarHBondContact OG-CB 3.27Å
333	R	85.8	Confident	94.2	Very high	156 Å²	156	28.6 Å²	28.6	59%	0.589	15%	0.145	S	C	*	.	S	Bend	trans	-73.7	-19	-178.7	-73.7	179.4	-103.2	133.1	-9.8	113.7
334	C	86.6	Confident	94.2	Very high	70 Å²	70	29.9 Å²	29.9	47%	0.473	15%	0.149	S	C	.	.	S	Bend	trans	-107.5	-8.2	175.7	-68.6	0	0	0	0	113.7	S332 H376	S332-C334 VanDerWaalsContact C-N 3.3Å; S332-C334 PolarHBondContact O-N 3.23Å; C334-H376 PolarHBondContact SG-O 2.86Å
335	H	89.2	Confident	94.1	Very high	77 Å²	77	25.3 Å²	25.3	36%	0.356	13%	0.133	S	C	.	.			trans	-140.6	79.7	-176.4	-55.2	93.9	0	0	0	108.7	S332 N337 Q338 D377	S332-H335 WeakPolarHBondContact CB-O 3.34Å; S332-H335 CarbonylContact O-C 3.52Å; S332-H335 PolarHBondContact O-N 2.85Å; S332-H335 WeakPolarHBondContact OG-CB 3.41Å; S332-H335 PolarHBondContact OG-N 3.02Å; S332-H335 PolarHBondContact OG-ND1 3.36Å; H335-N337 PolarHBondContact O-N 3.32Å; H335-N337 PolarHBondContact O-OD1 3.46Å; H335-Q338 HydrophobicContact CB-CB 4.21Å; H335-Q338 HydrophobicContact CB-CG 4.37Å; H335-Q338 WeakPolarHBondContact O-CB 3.33Å; H335-Q338 PolarHBondContact O-N 3.21Å; H335-D377 PolarHBondContact CE1-O 2.85Å; H335-D377 PolarHBondContact ND1-O 3.3Å
336	P	88.9	Confident	94	Very high	28 Å²	28	24.5 Å²	24.5	18%	0.182	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-29	-173	-24.2	34.9	0	0	0	113.3	H285 P286 Q338	H285-P336 PolarHBondContact CD2-O 2.7Å; H285-P336 WeakPolarHBondContact NE2-CB 3.3Å; H285-P336 PolarHBondContact NE2-O 2.73Å; H285-P336 VanDerWaalsContact NE2-O 3.07Å; P286-P336 HydrophobicContact CG-CB 4.3Å; P336-Q338 PolarHBondContact O-N 3.37Å
337	N	92	Very high	93.9	Very high	23 Å²	23	24.5 Å²	24.5	12%	0.123	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-4.7	168.9	67.1	-10	0	0	0	115.7	C241 H335 V353 E354	C241-N337 HydrophobicContact CB-CB 3.98Å; C241-N337 PolarHBondContact O-N 2.82Å; H335-N337 PolarHBondContact O-N 3.32Å; H335-N337 PolarHBondContact O-OD1 3.46Å; N337-V353 HydrophobicContact CB-CB 4.4Å; N337-V353 PolarHBondContact O-N 2.81Å; N337-E354 PolarHBondContact ND2-OE2 3.14Å; N337-E354 VanDerWaalsContact ND2-OE2 3.08Å
338	Q	94.8	Very high	94	Very high	20 Å²	20	24 Å²	24	9%	0.093	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	119	-176	-72.5	171.6	1	0	0	113.9	F331 S332 H335 P336 M351 D352	F331-Q338 WeakPolarHBondContact CA-O 3.27Å; S332-Q338 PolarHBondContact N-O 3.43Å; H335-Q338 HydrophobicContact CB-CB 4.21Å; H335-Q338 HydrophobicContact CB-CG 4.37Å; H335-Q338 WeakPolarHBondContact O-CB 3.33Å; H335-Q338 PolarHBondContact O-N 3.21Å; P336-Q338 PolarHBondContact O-N 3.37Å; Q338-M351 VanDerWaalsContact CA-O 3.26Å; Q338-M351 WeakPolarHBondContact CA-O 3.34Å; Q338-D352 HydrophobicContact CG-CB 4.35Å; Q338-D352 PolarHBondContact NE2-OD2 2.98Å
339	L	96.6	Very high	94	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	120.2	171.1	170.6	64.9	0	0	0	109.8	A294 I302 L304 M329 F331 M351	A294-L339 HydrophobicContact CB-CD1 4.48Å; A294-L339 HydrophobicContact CB-CD2 3.6Å; I302-L339 HydrophobicContact CG2-CD2 4.19Å; L304-L339 HydrophobicContact CD2-CD2 4.05Å; M329-L339 HydrophobicContact CB-CD1 4.26Å; F331-L339 HydrophobicContact CD1-CB 3.79Å; F331-L339 HydrophobicContact CD1-CD1 4.15Å; F331-L339 HydrophobicContact CD1-CG 4.48Å; F331-L339 HydrophobicContact CD2-CD1 3.93Å; F331-L339 HydrophobicContact CE1-CB 3.75Å; F331-L339 HydrophobicContact CE1-CD1 4.2Å; F331-L339 HydrophobicContact CE1-CD2 4.26Å; F331-L339 HydrophobicContact CE1-CG 4.29Å; F331-L339 HydrophobicContact CE2-CD1 3.99Å; F331-L339 HydrophobicContact CG-CB 4.46Å; F331-L339 HydrophobicContact CG-CD1 4.03Å; F331-L339 HydrophobicContact CZ-CB 4.38Å; F331-L339 HydrophobicContact CZ-CD1 4.13Å; F331-L339 HydrophobicContact CZ-CD2 4.11Å; F331-L339 HydrophobicContact CZ-CG 4.44Å; L339-M351 HydrophobicContact CB-CB 4.15Å; L339-M351 HydrophobicContact CB-CE 3.7Å; L339-M351 HydrophobicContact CB-SD 4.49Å; L339-M351 HydrophobicContact CD2-CE 4.01Å; L339-M351 HydrophobicContact CD2-SD 4.18Å; L339-M351 HydrophobicContact CG-CE 4.49Å; L339-M351 PolarHBondContact N-O 3.42Å; L339-M351 WeakPolarHBondContact O-CB 3.49Å; L339-M351 PolarHBondContact O-N 2.81Å
340	L	97.3	Very high	93.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	141.8	175.9	-76.4	77.1	0	0	0	110.7	M329 A330 R349 C350 F371 F373 L381	M329-L340 CarbonylContact C-O 3.51Å; M329-L340 WeakPolarHBondContact CA-O 3.07Å; M329-L340 WeakPolarHBondContact CB-O 3.45Å; A330-L340 PolarHBondContact N-O 2.75Å; A330-L340 PolarHBondContact O-N 3.32Å; L340-R349 WeakPolarHBondContact CA-O 3.13Å; L340-C350 HydrophobicContact CD1-CB 4.42Å; L340-C350 HydrophobicContact CG-CB 4.15Å; L340-F371 HydrophobicContact CB-CE1 4.42Å; L340-F371 HydrophobicContact CB-CE2 3.7Å; L340-F371 HydrophobicContact CB-CZ 3.49Å; L340-F371 VanDerWaalsContact CB-CZ 3.49Å; L340-F371 HydrophobicContact CD2-CE2 4.23Å; L340-F371 WeakPolarHBondContact O-CZ 3.31Å; L340-F373 HydrophobicContact CD1-CE1 4.14Å; L340-F373 HydrophobicContact CD1-CZ 4.19Å; L340-F373 HydrophobicContact CD2-CE1 3.95Å; L340-F373 HydrophobicContact CD2-CZ 4.45Å; L340-L381 HydrophobicContact CD2-CD1 3.54Å; L340-L381 HydrophobicContact CD2-CD2 3.87Å; L340-L381 HydrophobicContact CD2-CG 4.37Å
341	S	97.9	Very high	93.9	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	133	-177.5	54.3	0	0	0	0	112.7	I302 H322 L348 R349	I302-S341 VanDerWaalsContact CD1-CB 3.46Å; I302-S341 WeakPolarHBondContact CD1-OG 3.15Å; H322-S341 PolarHBondContact CE1-O 2.73Å; H322-S341 PolarHBondContact NE2-O 2.62Å; H322-S341 PolarHBondContact NE2-OG 3.17Å; S341-L348 WeakPolarHBondContact O-CA 3.45Å; S341-R349 PolarHBondContact N-O 3.01Å; S341-R349 PolarHBondContact O-N 3.23Å
342	A	97.3	Very high	93.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.2	180	0	0	0	0	0	111.4	V326 G327 S328 L348 L368 F371	V326-A342 CarbonylContact C-O 3.58Å; G327-A342 PolarHBondContact N-O 2.91Å; S328-A342 PolarHBondContact O-N 3.14Å; A342-L348 HydrophobicContact CB-CD1 3.59Å; A342-L368 HydrophobicContact CB-CB 4.4Å; A342-F371 HydrophobicContact CB-CD1 3.73Å; A342-F371 HydrophobicContact CB-CE1 4.3Å
343	S	96.6	Very high	93.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	151.5	-177.5	176.3	0	0	0	0	113.9	H322 R324 D345 G346 S347 L368	H322-S343 VanDerWaalsContact CG-CB 3.45Å; H322-S343 VanDerWaalsContact ND1-CB 3.27Å; H322-S343 WeakPolarHBondContact ND1-CB 3.18Å; R324-S343 PolarHBondContact O-OG 3.01Å; R324-S343 VanDerWaalsContact O-OG 3.12Å; S343-D345 VanDerWaalsContact CB-OD1 3.3Å; S343-D345 WeakPolarHBondContact CB-OD1 3.27Å; S343-D345 WeakPolarHBondContact CB-OD2 3.38Å; S343-D345 PolarHBondContact O-N 2.84Å; S343-D345 VanDerWaalsContact O-N 3.1Å; S343-D345 PolarHBondContact OG-N 2.89Å; S343-D345 PolarHBondContact OG-OD1 3.09Å; S343-D345 PolarHBondContact OG-OD2 3.07Å; S343-G346 PolarHBondContact O-N 3.18Å; S343-G346 VanDerWaalsContact O-N 3.13Å; S343-S347 PolarHBondContact N-O 3.3Å; S343-L368 WeakPolarHBondContact O-CB 3.49Å; S343-L368 PolarHBondContact O-N 3.41Å
344	Y	95.1	Very high	94.1	Very high	33 Å²	33	19 Å²	19	13%	0.129	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-2	173.9	-60.3	0.2	0	0	0	112.9	F280 R324 P325 G346 G367 L368 K369 W386	F280-Y344 HydrophobicContact CD1-CE2 4.44Å; F280-Y344 HydrophobicContact CE1-CE2 4.17Å; R324-Y344 PolarHBondContact NH1-O 2.99Å; P325-Y344 HydrophobicContact CB-CD2 3.71Å; P325-Y344 HydrophobicContact CB-CE2 3.74Å; P325-Y344 HydrophobicContact CB-CG 4.16Å; P325-Y344 HydrophobicContact CG-CD2 3.62Å; P325-Y344 HydrophobicContact CG-CE2 3.9Å; P325-Y344 HydrophobicContact CG-CG 4.35Å; P325-Y344 WeakPolarHBondContact O-CD1 3.28Å; P325-Y344 PolarHBondContact O-N 3.25Å; P325-Y344 VanDerWaalsContact O-N 3.08Å; Y344-G346 VanDerWaalsContact C-N 3.3Å; Y344-G367 VanDerWaalsContact O-CA 3.3Å; Y344-G367 WeakPolarHBondContact O-CA 3.46Å; Y344-L368 WeakPolarHBondContact CD1-O 3.33Å; Y344-K369 HydrophobicContact CE1-CD 3.77Å; Y344-K369 WeakPolarHBondContact OH-CE 3.48Å; Y344-W386 AromaticContact CD1-NE1 3.37Å; Y344-W386 HydrophobicContact CD2-CZ2 4.09Å; Y344-W386 AromaticContact CD2-NE1 3.97Å; Y344-W386 HydrophobicContact CE1-CZ2 4.11Å; Y344-W386 AromaticContact CE1-NE1 3.49Å; Y344-W386 AromaticContact CE2-CZ2 3.58Å; Y344-W386 HydrophobicContact CE2-CZ2 3.58Å; Y344-W386 AromaticContact CG-NE1 3.63Å; Y344-W386 AromaticContact CZ-CZ2 3.6Å; Y344-W386 AromaticContact CZ-NE1 3.89Å
345	D	93.3	Very high	94.3	Very high	12 Å²	12	21.4 Å²	21.4	6%	0.064	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-4.2	169.8	56.2	41	0	0	0	114	K214 H322 S323 R324 S343 S347	K214-D345 VanDerWaalsContact CE-O 3.28Å; K214-D345 WeakPolarHBondContact CE-O 3.34Å; H322-D345 WeakPolarHBondContact CB-OD2 3.43Å; H322-D345 IonicContact ND1-OD1 3.59Å; H322-D345 IonicContact ND1-OD2 2.7Å; S323-D345 PolarHBondContact N-OD2 2.91Å; R324-D345 HydrophobicContact CB-CB 3.97Å; R324-D345 HydrophobicContact CG-CB 3.87Å; R324-D345 PolarHBondContact N-OD2 3.3Å; S343-D345 VanDerWaalsContact CB-OD1 3.3Å; S343-D345 WeakPolarHBondContact CB-OD1 3.27Å; S343-D345 WeakPolarHBondContact CB-OD2 3.38Å; S343-D345 PolarHBondContact O-N 2.84Å; S343-D345 VanDerWaalsContact O-N 3.1Å; S343-D345 PolarHBondContact OG-N 2.89Å; S343-D345 PolarHBondContact OG-OD1 3.09Å; S343-D345 PolarHBondContact OG-OD2 3.07Å; D345-S347 WeakPolarHBondContact OD1-CB 3.42Å; D345-S347 PolarHBondContact OD1-N 2.52Å; D345-S347 PolarHBondContact OD1-OG 3.1Å
346	G	93.3	Very high	94.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.093	C	C	.	.	S	Bend	trans	94	-0.5	177.5	0	0	0	0	0	114.5	S343 Y344 I364 D366	S343-G346 PolarHBondContact O-N 3.18Å; S343-G346 VanDerWaalsContact O-N 3.13Å; Y344-G346 VanDerWaalsContact C-N 3.3Å; G346-I364 CarbonylContact C-O 3.51Å; G346-I364 WeakPolarHBondContact CA-O 3.04Å; G346-I364 PolarHBondContact O-N 2.84Å; G346-D366 VanDerWaalsContact CA-O 3.3Å; G346-D366 WeakPolarHBondContact CA-O 3.37Å
347	S	95.2	Very high	94.8	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	138.8	175.5	64.5	0	0	0	0	113.3	H322 S343 D345 R349 Y362 D363	H322-S347 PolarHBondContact CE1-O 2.84Å; H322-S347 PolarHBondContact ND1-OG 3.3Å; S343-S347 PolarHBondContact N-O 3.3Å; D345-S347 WeakPolarHBondContact OD1-CB 3.42Å; D345-S347 PolarHBondContact OD1-N 2.52Å; D345-S347 PolarHBondContact OD1-OG 3.1Å; S347-R349 PolarHBondContact OG-NH1 2.86Å; S347-Y362 CarbonylContact C-O 3.46Å; S347-D363 WeakPolarHBondContact CA-OD1 3.47Å; S347-D363 WeakPolarHBondContact CB-OD1 3.49Å
348	L	96.4	Very high	94.9	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	115.6	165.8	-162	101	0	0	0	108	S341 A342 V361 Y362 L368 F371 L381 V383	S341-L348 WeakPolarHBondContact O-CA 3.45Å; A342-L348 HydrophobicContact CB-CD1 3.59Å; L348-V361 HydrophobicContact CD2-CB 4.15Å; L348-V361 HydrophobicContact CD2-CG1 3.87Å; L348-V361 PolarHBondContact O-N 3.35Å; L348-Y362 PolarHBondContact N-O 2.91Å; L348-Y362 PolarHBondContact O-N 2.58Å; L348-L368 HydrophobicContact CB-CD1 3.74Å; L348-L368 HydrophobicContact CD1-CD1 3.99Å; L348-F371 HydrophobicContact CD1-CB 4.16Å; L348-F371 HydrophobicContact CD1-CD1 4.07Å; L348-F371 HydrophobicContact CD1-CG 4.09Å; L348-L381 HydrophobicContact CD2-CD1 3.51Å; L348-V383 HydrophobicContact CD1-CG1 4.25Å; L348-V383 HydrophobicContact CD1-CG2 4.35Å
349	R	96	Very high	94.9	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	153.2	179.5	-70.2	-165.6	170	76.5	13	111.8	K215 P216 P321 L340 S341 S347 F358 D359 D360	K215-R349 PolarHBondContact O-NH2 2.91Å; K215-R349 VanDerWaalsContact O-NH2 3.15Å; P216-R349 PolarHBondContact O-NH2 2.86Å; P321-R349 WeakPolarHBondContact O-CD 3.34Å; P321-R349 PolarHBondContact O-NH1 2.92Å; L340-R349 WeakPolarHBondContact CA-O 3.13Å; S341-R349 PolarHBondContact N-O 3.01Å; S341-R349 PolarHBondContact O-N 3.23Å; S347-R349 PolarHBondContact OG-NH1 2.86Å; R349-F358 HydrophobicContact CB-CB 4.4Å; R349-D359 CarbonylContact C-O 3.6Å; R349-D359 VanDerWaalsContact CA-O 3.26Å; R349-D359 WeakPolarHBondContact CA-O 3.49Å; R349-D360 IonicContact CZ-OD1 2.76Å; R349-D360 IonicContact NE-OD1 3.67Å; R349-D360 IonicContact NH2-OD1 3Å
350	C	96	Very high	94.7	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.007	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	105.6	175.3	-179.3	0	0	0	0	108.7	L340 D352 F358 D359 V361 R395	L340-C350 HydrophobicContact CD1-CB 4.42Å; L340-C350 HydrophobicContact CG-CB 4.15Å; C350-D352 PolarHBondContact O-N 3.4Å; C350-F358 CarbonylContact O-C 3.54Å; C350-F358 WeakPolarHBondContact O-CA 3.19Å; C350-D359 PolarHBondContact N-O 3.02Å; C350-D359 PolarHBondContact O-N 2.72Å; C350-V361 HydrophobicContact CB-CG2 3.63Å; C350-R395 PolarHBondContact SG-NH2 3.26Å; C350-R395 VanDerWaalsContact SG-NH2 3.39Å
351	M	96.2	Very high	94.6	Very high	2 Å²	2	20.3 Å²	20.3	1%	0.01	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	115.9	170.3	-173	-169.5	82.4	0	0	108.9	M222 L304 Q338 L339 V353 F358	M222-M351 HydrophobicContact CE-CE 4.28Å; M222-M351 HydrophobicContact CE-CG 3.46Å; M222-M351 VanDerWaalsContact CE-CG 3.46Å; M222-M351 HydrophobicContact CE-SD 3.63Å; M222-M351 HydrophobicContact CG-CG 4.31Å; M222-M351 HydrophobicContact SD-CG 3.54Å; M222-M351 VanDerWaalsContact SD-CG 3.54Å; L304-M351 HydrophobicContact CD1-CE 3.84Å; L304-M351 HydrophobicContact CD1-SD 3.93Å; L304-M351 HydrophobicContact CD2-CE 4.04Å; L304-M351 HydrophobicContact CD2-SD 4.18Å; L304-M351 HydrophobicContact CG-CE 4.49Å; L304-M351 HydrophobicContact CG-SD 4.33Å; Q338-M351 VanDerWaalsContact CA-O 3.26Å; Q338-M351 WeakPolarHBondContact CA-O 3.34Å; L339-M351 HydrophobicContact CB-CB 4.15Å; L339-M351 HydrophobicContact CB-CE 3.7Å; L339-M351 HydrophobicContact CB-SD 4.49Å; L339-M351 HydrophobicContact CD2-CE 4.01Å; L339-M351 HydrophobicContact CD2-SD 4.18Å; L339-M351 HydrophobicContact CG-CE 4.49Å; L339-M351 PolarHBondContact N-O 3.42Å; L339-M351 WeakPolarHBondContact O-CB 3.49Å; L339-M351 PolarHBondContact O-N 2.81Å; M351-V353 HydrophobicContact CE-CG2 3.69Å; M351-F358 HydrophobicContact CB-CD1 3.51Å; M351-F358 HydrophobicContact CB-CE1 3.45Å; M351-F358 VanDerWaalsContact CB-CE1 3.45Å; M351-F358 HydrophobicContact CB-CG 4.46Å; M351-F358 HydrophobicContact CB-CZ 4.35Å; M351-F358 HydrophobicContact CG-CD1 3.84Å; M351-F358 HydrophobicContact CG-CE1 3.41Å; M351-F358 VanDerWaalsContact CG-CE1 3.41Å; M351-F358 HydrophobicContact CG-CZ 3.81Å; M351-F358 HydrophobicContact SD-CE1 3.9Å; M351-F358 HydrophobicContact SD-CZ 4.1Å
352	D	94.3	Very high	94.4	Very high	4 Å²	4	20.5 Å²	20.5	2%	0.021	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	106	179	-171.1	-51.8	0	0	0	109.3	M222 Q338 C350 E354 K355 A356 V357	M222-D352 VanDerWaalsContact SD-O 3.42Å; Q338-D352 HydrophobicContact CG-CB 4.35Å; Q338-D352 PolarHBondContact NE2-OD2 2.98Å; C350-D352 PolarHBondContact O-N 3.4Å; D352-E354 VanDerWaalsContact C-N 3.26Å; D352-E354 PolarHBondContact O-N 3.37Å; D352-E354 WeakPolarHBondContact OD1-CB 3.48Å; D352-E354 PolarHBondContact OD1-N 2.86Å; D352-E354 VanDerWaalsContact OD1-N 3.12Å; D352-K355 HydrophobicContact CB-CB 4.21Å; D352-K355 HydrophobicContact CB-CG 4.39Å; D352-K355 WeakPolarHBondContact OD1-CG 3.43Å; D352-K355 PolarHBondContact OD1-N 2.75Å; D352-K355 IonicContact OD2-NZ 3.79Å; D352-K355 PolarHBondContact OD2-NZ 2.83Å; D352-A356 WeakPolarHBondContact O-CA 3.47Å; D352-A356 PolarHBondContact O-N 3.21Å; D352-V357 PolarHBondContact N-O 3.1Å; D352-V357 PolarHBondContact O-N 3.13Å
353	V	92.7	Very high	94.2	Very high	1 Å²	1	22 Å²	22	1%	0.006	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-26.5	-175.3	170.4	0	0	0	0	112.5	M222 L237 R238 C241 N337 M351	M222-V353 HydrophobicContact CE-CG2 4.3Å; L237-V353 HydrophobicContact CD2-CG1 3.85Å; L237-V353 HydrophobicContact CD2-CG2 4.19Å; L237-V353 HydrophobicContact CG-CG1 3.74Å; L237-V353 HydrophobicContact CG-CG2 4.46Å; R238-V353 HydrophobicContact CG-CG1 3.84Å; R238-V353 PolarHBondContact NE-O 3.24Å; C241-V353 HydrophobicContact CB-CB 4.42Å; C241-V353 HydrophobicContact CB-CG1 4.12Å; N337-V353 HydrophobicContact CB-CB 4.4Å; N337-V353 PolarHBondContact O-N 2.81Å; M351-V353 HydrophobicContact CE-CG2 3.69Å
354	E	90.9	Very high	94	Very high	129 Å²	129	23.7 Å²	23.7	60%	0.603	12%	0.118	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-51.5	178.9	-170.2	-178.6	160.5	0	0	109.9	R238 N337 D352 A356	R238-E354 PolarHBondContact NH2-O 3.04Å; N337-E354 PolarHBondContact ND2-OE2 3.14Å; N337-E354 VanDerWaalsContact ND2-OE2 3.08Å; D352-E354 VanDerWaalsContact C-N 3.26Å; D352-E354 PolarHBondContact O-N 3.37Å; D352-E354 WeakPolarHBondContact OD1-CB 3.48Å; D352-E354 PolarHBondContact OD1-N 2.86Å; D352-E354 VanDerWaalsContact OD1-N 3.12Å; E354-A356 VanDerWaalsContact C-N 3.27Å; E354-A356 PolarHBondContact O-N 3Å
355	K	91	Very high	93.6	Very high	119 Å²	119	29.4 Å²	29.4	52%	0.517	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-19.7	174.7	-60.3	-169	-153.9	100.1	0	114	D352 V357 D359	D352-K355 HydrophobicContact CB-CB 4.21Å; D352-K355 HydrophobicContact CB-CG 4.39Å; D352-K355 WeakPolarHBondContact OD1-CG 3.43Å; D352-K355 PolarHBondContact OD1-N 2.75Å; D352-K355 IonicContact OD2-NZ 3.79Å; D352-K355 PolarHBondContact OD2-NZ 2.83Å; K355-V357 HydrophobicContact CB-CG2 3.76Å; K355-V357 HydrophobicContact CD-CG2 4.17Å; K355-D359 IonicContact NZ-OD2 3.73Å; K355-D359 PolarHBondContact NZ-OD2 2.96Å
356	A	92.8	Very high	93.3	Very high	25 Å²	25	30 Å²	30	21%	0.207	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	42.1	-170.5	0	0	0	0	0	113.8	M222 L233 D352 E354	M222-A356 HydrophobicContact CB-CB 4.47Å; M222-A356 WeakPolarHBondContact CB-O 3.3Å; M222-A356 PolarHBondContact N-O 3.28Å; L233-A356 HydrophobicContact CD1-CB 3.63Å; L233-A356 HydrophobicContact CG-CB 4.46Å; D352-A356 WeakPolarHBondContact O-CA 3.47Å; D352-A356 PolarHBondContact O-N 3.21Å; E354-A356 VanDerWaalsContact C-N 3.27Å; E354-A356 PolarHBondContact O-N 3Å
357	V	94.9	Very high	93.2	Very high	16 Å²	16	30.3 Å²	30.3	10%	0.097	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	157.6	177.2	-60.4	0	0	0	0	112.7	A219 L220 D352 K355 D359	A219-V357 HydrophobicContact CB-CB 4.34Å; A219-V357 HydrophobicContact CB-CG2 4.49Å; L220-V357 CarbonylContact O-C 3.55Å; L220-V357 VanDerWaalsContact O-CA 3.24Å; L220-V357 WeakPolarHBondContact O-CA 3.36Å; D352-V357 PolarHBondContact N-O 3.1Å; D352-V357 PolarHBondContact O-N 3.13Å; K355-V357 HydrophobicContact CB-CG2 3.76Å; K355-V357 HydrophobicContact CD-CG2 4.17Å; V357-D359 VanDerWaalsContact CG2-OD1 3.28Å; V357-D359 WeakPolarHBondContact CG2-OD1 3.47Å
358	F	95.6	Very high	93.1	Very high	3 Å²	3	30.4 Å²	30.4	1%	0.013	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	95.9	159.6	-62.6	-91.9	0	0	0	108.1	A219 L220 M222 F319 P321 R349 C350 M351	A219-F358 WeakPolarHBondContact CA-O 3.47Å; L220-F358 HydrophobicContact CB-CB 4.33Å; L220-F358 PolarHBondContact N-O 2.94Å; L220-F358 PolarHBondContact O-N 2.82Å; M222-F358 HydrophobicContact CB-CE2 4.29Å; M222-F358 HydrophobicContact CG-CD2 3.8Å; M222-F358 HydrophobicContact CG-CE2 3.58Å; M222-F358 HydrophobicContact CG-CZ 4.2Å; F319-F358 HydrophobicContact CB-CE2 3.72Å; F319-F358 HydrophobicContact CB-CZ 3.45Å; F319-F358 VanDerWaalsContact CB-CZ 3.45Å; F319-F358 HydrophobicContact CD1-CE2 4.05Å; F319-F358 HydrophobicContact CD1-CZ 4.22Å; F319-F358 HydrophobicContact CD2-CZ 4.13Å; F319-F358 AromaticContact CG-CE2 3.94Å; F319-F358 HydrophobicContact CG-CE2 3.94Å; F319-F358 AromaticContact CG-CZ 3.68Å; F319-F358 HydrophobicContact CG-CZ 3.68Å; P321-F358 HydrophobicContact CB-CB 4.28Å; P321-F358 HydrophobicContact CB-CD1 3.51Å; P321-F358 HydrophobicContact CB-CD2 4.04Å; P321-F358 HydrophobicContact CB-CE1 3.72Å; P321-F358 HydrophobicContact CB-CE2 4.22Å; P321-F358 HydrophobicContact CB-CG 3.69Å; P321-F358 HydrophobicContact CB-CZ 4.09Å; P321-F358 HydrophobicContact CG-CD1 4.03Å; P321-F358 HydrophobicContact CG-CE1 3.73Å; P321-F358 HydrophobicContact CG-CZ 4.04Å; R349-F358 HydrophobicContact CB-CB 4.4Å; C350-F358 CarbonylContact O-C 3.54Å; C350-F358 WeakPolarHBondContact O-CA 3.19Å; M351-F358 HydrophobicContact CB-CD1 3.51Å; M351-F358 HydrophobicContact CB-CE1 3.45Å; M351-F358 VanDerWaalsContact CB-CE1 3.45Å; M351-F358 HydrophobicContact CB-CG 4.46Å; M351-F358 HydrophobicContact CB-CZ 4.35Å; M351-F358 HydrophobicContact CG-CD1 3.84Å; M351-F358 HydrophobicContact CG-CE1 3.41Å; M351-F358 VanDerWaalsContact CG-CE1 3.41Å; M351-F358 HydrophobicContact CG-CZ 3.81Å; M351-F358 HydrophobicContact SD-CE1 3.9Å; M351-F358 HydrophobicContact SD-CZ 4.1Å
359	D	94.1	Very high	93	Very high	45 Å²	45	31.9 Å²	31.9	24%	0.241	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	142.8	173.4	-74.9	-32.9	0	0	0	110.1	R349 C350 K355 V357	R349-D359 CarbonylContact C-O 3.6Å; R349-D359 VanDerWaalsContact CA-O 3.26Å; R349-D359 WeakPolarHBondContact CA-O 3.49Å; C350-D359 PolarHBondContact N-O 3.02Å; C350-D359 PolarHBondContact O-N 2.72Å; K355-D359 IonicContact NZ-OD2 3.73Å; K355-D359 PolarHBondContact NZ-OD2 2.96Å; V357-D359 VanDerWaalsContact CG2-OD1 3.28Å; V357-D359 WeakPolarHBondContact CG2-OD1 3.47Å
360	D	92.3	Very high	93	Very high	19 Å²	19	32.2 Å²	32.2	10%	0.102	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	110	-177.2	-168.7	37.8	0	0	0	110	S217 G218 R349 N400	S217-D360 VanDerWaalsContact CA-OD2 3.31Å; S217-D360 WeakPolarHBondContact CA-OD2 3.25Å; S217-D360 WeakPolarHBondContact CB-OD2 3.31Å; G218-D360 PolarHBondContact N-OD2 2.78Å; R349-D360 IonicContact CZ-OD1 2.76Å; R349-D360 IonicContact NE-OD1 3.67Å; R349-D360 IonicContact NH2-OD1 3Å; D360-N400 PolarHBondContact OD2-ND2 3.29Å
361	V	94	Very high	93	Very high	18 Å²	18	32.7 Å²	32.7	11%	0.109	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-39.2	-164.2	171.2	0	0	0	0	112.4	L348 C350 L381 V393 R395	L348-V361 HydrophobicContact CD2-CB 4.15Å; L348-V361 HydrophobicContact CD2-CG1 3.87Å; L348-V361 PolarHBondContact O-N 3.35Å; C350-V361 HydrophobicContact CB-CG2 3.63Å; V361-L381 HydrophobicContact CG1-CD1 4.08Å; V361-V393 HydrophobicContact CG1-CG1 4.2Å; V361-R395 HydrophobicContact CG1-CG 3.81Å
362	Y	94.8	Very high	93.1	Very high	4 Å²	4	33 Å²	33	2%	0.016	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	122.9	177.2	-179.7	-123.4	0	0	0	110.2	S347 L348 I364 L368 V383 A391 V393 N400 H402	S347-Y362 CarbonylContact C-O 3.46Å; L348-Y362 PolarHBondContact N-O 2.91Å; L348-Y362 PolarHBondContact O-N 2.58Å; Y362-I364 HydrophobicContact CE1-CD1 4.02Å; Y362-I364 HydrophobicContact CE1-CG1 4.25Å; Y362-I364 HydrophobicContact CE1-CG2 4.14Å; Y362-I364 HydrophobicContact CE2-CG2 3.8Å; Y362-I364 WeakPolarHBondContact OH-CG2 3.33Å; Y362-L368 HydrophobicContact CD1-CD1 4.17Å; Y362-L368 HydrophobicContact CD1-CD2 4.12Å; Y362-L368 HydrophobicContact CE1-CD2 3.91Å; Y362-V383 HydrophobicContact CD1-CG1 4.19Å; Y362-V383 HydrophobicContact CE1-CG1 4.37Å; Y362-A391 HydrophobicContact CE1-CB 4.09Å; Y362-V393 HydrophobicContact CD1-CG2 3.97Å; Y362-V393 HydrophobicContact CD2-CG2 3.7Å; Y362-V393 HydrophobicContact CE1-CG2 4.33Å; Y362-V393 HydrophobicContact CE2-CG2 4.12Å; Y362-V393 HydrophobicContact CG-CG1 4.46Å; Y362-V393 HydrophobicContact CG-CG2 3.62Å; Y362-N400 WeakPolarHBondContact CA-O 3.49Å; Y362-N400 WeakPolarHBondContact CD2-O 3.46Å; Y362-H402 HydrophobicContact CD2-CB 4.39Å; Y362-H402 HydrophobicContact CE2-CB 3.62Å; Y362-H402 AromaticContact CE2-CG 3.98Å; Y362-H402 AromaticContact CE2-ND1 3.55Å; Y362-H402 AromaticContact CZ-ND1 3.69Å; Y362-H402 PolarHBondContact OH-ND1 2.87Å
363	D	93.2	Very high	93.2	Very high	31 Å²	31	33.3 Å²	33.3	17%	0.166	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	115.1	-169.6	-156.5	45.4	0	0	0	112.2	K214 S217 S347 N400	K214-D363 WeakPolarHBondContact CE-OD1 3.47Å; K214-D363 WeakPolarHBondContact CE-OD2 3.16Å; K214-D363 IonicContact NZ-OD1 2.76Å; K214-D363 PolarHBondContact NZ-OD1 3.39Å; K214-D363 IonicContact NZ-OD2 3.01Å; K214-D363 PolarHBondContact NZ-OD2 2.86Å; S217-D363 PolarHBondContact OG-OD2 3.15Å; S347-D363 WeakPolarHBondContact CA-OD1 3.47Å; S347-D363 WeakPolarHBondContact CB-OD1 3.49Å; D363-N400 HydrophobicContact CB-CB 3.95Å; D363-N400 PolarHBondContact N-O 3.45Å
364	I	92.1	Very high	93.2	Very high	35 Å²	35	34.5 Å²	34.5	18%	0.179	18%	0.179	C	C	.	.			trans	-136	165.3	179.7	60.1	169.2	0	0	0	112	K214 G346 Y362 D366 L368	K214-I364 PolarHBondContact NZ-O 3.07Å; G346-I364 CarbonylContact C-O 3.51Å; G346-I364 WeakPolarHBondContact CA-O 3.04Å; G346-I364 PolarHBondContact O-N 2.84Å; Y362-I364 HydrophobicContact CE1-CD1 4.02Å; Y362-I364 HydrophobicContact CE1-CG1 4.25Å; Y362-I364 HydrophobicContact CE1-CG2 4.14Å; Y362-I364 HydrophobicContact CE2-CG2 3.8Å; Y362-I364 WeakPolarHBondContact OH-CG2 3.33Å; I364-D366 VanDerWaalsContact C-N 3.32Å; I364-D366 HydrophobicContact CD1-CB 4.04Å; I364-D366 WeakPolarHBondContact CD1-O 3.3Å; I364-D366 WeakPolarHBondContact CG1-O 3.45Å; I364-L368 HydrophobicContact CD1-CD2 3.69Å; I364-L368 HydrophobicContact CG1-CD2 3.92Å
365	D	87.7	Confident	93.3	Very high	153 Å²	153	29.3 Å²	29.3	82%	0.818	16%	0.157	S	C	*	.	S	Bend	trans	-73.9	-23.2	177.8	-65.7	-44.2	0	0	0	113.5
366	D	86.5	Confident	93.2	Very high	24 Å²	24	29.6 Å²	29.6	13%	0.128	16%	0.16	C	C	.	.	S	Bend	trans	-88	131.6	-177.9	-65.1	-67.8	0	0	0	111.7	R56 G346 I364 L368 F387	R56-D366 VanDerWaalsContact CZ-CG 3.43Å; R56-D366 IonicContact CZ-OD1 2.67Å; R56-D366 IonicContact CZ-OD2 3.41Å; R56-D366 IonicContact NE-OD1 3.95Å; R56-D366 IonicContact NH1-OD1 3.93Å; R56-D366 PolarHBondContact NH1-OD1 3.01Å; R56-D366 IonicContact NH1-OD2 2.79Å; R56-D366 PolarHBondContact NH1-OD2 2.86Å; R56-D366 IonicContact NH2-OD1 3.57Å; R56-D366 IonicContact NH2-OD2 3.45Å; R56-D366 PolarHBondContact NH2-OD2 3.34Å; G346-D366 VanDerWaalsContact CA-O 3.3Å; G346-D366 WeakPolarHBondContact CA-O 3.37Å; I364-D366 VanDerWaalsContact C-N 3.32Å; I364-D366 HydrophobicContact CD1-CB 4.04Å; I364-D366 WeakPolarHBondContact CD1-O 3.3Å; I364-D366 WeakPolarHBondContact CG1-O 3.45Å; D366-L368 PolarHBondContact O-N 3.5Å; D366-F387 HydrophobicContact CB-CD2 3.88Å; D366-F387 HydrophobicContact CB-CE2 3.78Å; D366-F387 WeakPolarHBondContact OD1-CD2 3.45Å; D366-F387 WeakPolarHBondContact OD1-CE2 3.49Å
367	G	89.9	Confident	93	Very high	8 Å²	8	31.8 Å²	31.8	8%	0.082	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-55.6	126.3	-179.8	0	0	0	0	0	112.8	Y344 W386	Y344-G367 VanDerWaalsContact O-CA 3.3Å; Y344-G367 WeakPolarHBondContact O-CA 3.46Å; G367-W386 VanDerWaalsContact O-CD1 3.31Å; G367-W386 PolarHBondContact O-N 2.82Å
368	L	94.4	Very high	92.8	Very high	1 Å²	1	31 Å²	31	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	155.4	167.1	-52.1	-176.6	0	0	0	109.2	A342 S343 Y344 L348 Y362 I364 D366 V383 W386	A342-L368 HydrophobicContact CB-CB 4.4Å; S343-L368 WeakPolarHBondContact O-CB 3.49Å; S343-L368 PolarHBondContact O-N 3.41Å; Y344-L368 WeakPolarHBondContact CD1-O 3.33Å; L348-L368 HydrophobicContact CB-CD1 3.74Å; L348-L368 HydrophobicContact CD1-CD1 3.99Å; Y362-L368 HydrophobicContact CD1-CD1 4.17Å; Y362-L368 HydrophobicContact CD1-CD2 4.12Å; Y362-L368 HydrophobicContact CE1-CD2 3.91Å; I364-L368 HydrophobicContact CD1-CD2 3.69Å; I364-L368 HydrophobicContact CG1-CD2 3.92Å; D366-L368 PolarHBondContact O-N 3.5Å; L368-V383 HydrophobicContact CD1-CG1 3.95Å; L368-V383 HydrophobicContact CD2-CG1 3.87Å; L368-V383 HydrophobicContact CG-CG1 4.33Å; L368-W386 VanDerWaalsContact O-CD1 3.29Å; L368-W386 PolarHBondContact O-NE1 2.85Å
369	K	92.9	Very high	92.7	Very high	32 Å²	32	31.5 Å²	31.5	14%	0.139	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	-37.6	176.7	174	61.2	-150.5	59.2	0	112.8	G327 Y344 G384 W386 R414	G327-K369 CarbonylContact C-O 3.59Å; G327-K369 PolarHBondContact O-NZ 3.09Å; Y344-K369 HydrophobicContact CE1-CD 3.77Å; Y344-K369 WeakPolarHBondContact OH-CE 3.48Å; K369-G384 PolarHBondContact N-O 2.91Å; K369-W386 HydrophobicContact CB-CG 4.45Å; K369-W386 HydrophobicContact CD-CZ2 3.83Å; K369-R414 VanDerWaalsContact CE-O 3.25Å; K369-R414 WeakPolarHBondContact CE-O 3.36Å; K369-R414 VanDerWaalsContact CG-O 3.29Å; K369-R414 WeakPolarHBondContact CG-O 3.15Å; K369-R414 PolarHBondContact NZ-O 3.26Å; K369-R414 VanDerWaalsContact NZ-O 3.14Å
370	T	96.2	Very high	92.7	Very high	6 Å²	6	30.3 Å²	30.3	4%	0.037	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	151.2	-161.1	-177.1	0	0	0	0	109.7	G384 V413 V416	T370-G384 PolarHBondContact N-O 3.24Å; T370-G384 PolarHBondContact O-N 2.84Å; T370-V413 HydrophobicContact CG2-CG1 4.02Å; T370-V416 HydrophobicContact CG2-CB 4.34Å; T370-V416 HydrophobicContact CG2-CG1 4Å; T370-V416 HydrophobicContact CG2-CG2 3.95Å; T370-V416 PolarHBondContact OG1-N 3.14Å; T370-V416 VanDerWaalsContact OG1-N 3.09Å
371	F	97.4	Very high	92.9	Very high	11 Å²	11	29.4 Å²	29.4	5%	0.048	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	165	168.2	76.2	-77.9	0	0	0	111.3	S328 A330 L340 A342 L348 F373 L382 V383	S328-F371 WeakPolarHBondContact OG-CD1 3.29Å; A330-F371 HydrophobicContact CB-CE2 4.4Å; A330-F371 HydrophobicContact CB-CZ 4.02Å; L340-F371 HydrophobicContact CB-CE1 4.42Å; L340-F371 HydrophobicContact CB-CE2 3.7Å; L340-F371 HydrophobicContact CB-CZ 3.49Å; L340-F371 VanDerWaalsContact CB-CZ 3.49Å; L340-F371 HydrophobicContact CD2-CE2 4.23Å; L340-F371 WeakPolarHBondContact O-CZ 3.31Å; A342-F371 HydrophobicContact CB-CD1 3.73Å; A342-F371 HydrophobicContact CB-CE1 4.3Å; L348-F371 HydrophobicContact CD1-CB 4.16Å; L348-F371 HydrophobicContact CD1-CD1 4.07Å; L348-F371 HydrophobicContact CD1-CG 4.09Å; F371-F373 HydrophobicContact CE2-CE1 4.48Å; F371-F373 HydrophobicContact CE2-CE2 4.4Å; F371-F373 HydrophobicContact CE2-CZ 4.16Å; F371-L382 CarbonylContact C-O 3.59Å; F371-L382 WeakPolarHBondContact CA-O 3.5Å; F371-L382 WeakPolarHBondContact CB-O 3.31Å; F371-V383 HydrophobicContact CB-CG2 4.15Å
372	A	97.1	Very high	93.1	Very high	9 Å²	9	28.6 Å²	28.6	7%	0.074	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	155.4	171.2	0	0	0	0	0	110.2	L382 V416 V418	A372-L382 PolarHBondContact N-O 2.77Å; A372-L382 PolarHBondContact O-N 3.4Å; A372-V416 HydrophobicContact CB-CG2 4.27Å; A372-V418 HydrophobicContact CB-CB 4.48Å; A372-V418 HydrophobicContact CB-CG2 3.87Å
373	F	95.9	Very high	93.2	Very high	10 Å²	10	28.5 Å²	28.5	4%	0.044	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	124.8	174	-60.8	-77.4	0	0	0	109.8	A330 L340 F371 C378 L381 M423	A330-F373 HydrophobicContact CB-CE2 3.79Å; A330-F373 HydrophobicContact CB-CZ 4.39Å; L340-F373 HydrophobicContact CD1-CE1 4.14Å; L340-F373 HydrophobicContact CD1-CZ 4.19Å; L340-F373 HydrophobicContact CD2-CE1 3.95Å; L340-F373 HydrophobicContact CD2-CZ 4.45Å; F371-F373 HydrophobicContact CE2-CE1 4.48Å; F371-F373 HydrophobicContact CE2-CE2 4.4Å; F371-F373 HydrophobicContact CE2-CZ 4.16Å; F373-C378 HydrophobicContact CD1-CB 3.49Å; F373-C378 VanDerWaalsContact CD1-CB 3.49Å; F373-C378 HydrophobicContact CE1-CB 3.71Å; F373-C378 HydrophobicContact CG-CB 4.2Å; F373-L381 HydrophobicContact CD1-CD2 3.37Å; F373-L381 HydrophobicContact CE1-CD2 3.72Å; F373-L381 HydrophobicContact CG-CD2 4.35Å; F373-M423 VanDerWaalsContact O-CE 3.3Å; F373-M423 WeakPolarHBondContact O-CE 3.35Å
374	M	94.3	Very high	93.3	Very high	27 Å²	27	27 Å²	27	13%	0.133	14%	0.143	C	C	.	.			trans	-101.7	-4.6	-177.4	-159.5	175.6	65.4	0	0	113.2	T380 L382 I392 V418 M423 C439	M374-T380 HydrophobicContact CE-CG2 3.82Å; M374-T380 PolarHBondContact N-O 2.91Å; M374-L382 HydrophobicContact CB-CB 4.39Å; M374-L382 HydrophobicContact SD-CB 4.4Å; M374-L382 HydrophobicContact SD-CD1 4Å; M374-I392 HydrophobicContact CE-CB 4.37Å; M374-I392 HydrophobicContact CE-CD1 3.98Å; M374-I392 HydrophobicContact CE-CG1 3.84Å; M374-I392 HydrophobicContact CE-CG2 3.62Å; M374-I392 HydrophobicContact SD-CD1 4.47Å; M374-I392 HydrophobicContact SD-CG1 4.3Å; M374-V418 HydrophobicContact CB-CG2 4.36Å; M374-V418 HydrophobicContact CG-CG1 4.5Å; M374-V418 HydrophobicContact CG-CG2 4.31Å; M374-M423 VanDerWaalsContact C-CE 3.45Å; M374-C439 HydrophobicContact SD-CB 3.84Å
375	S	92.1	Very high	93.4	Very high	20 Å²	20	25.7 Å²	25.7	14%	0.14	14%	0.137	C	C	.	.	S	Bend	trans	-129.2	152.6	174.3	65.3	0	0	0	0	110.9	D377 C378 S379 T380	S375-D377 WeakPolarHBondContact CB-OD1 3.35Å; S375-D377 PolarHBondContact O-N 3.21Å; S375-D377 PolarHBondContact OG-OD1 3.22Å; S375-C378 PolarHBondContact O-N 2.82Å; S375-S379 PolarHBondContact OG-N 3.41Å; S375-S379 PolarHBondContact OG-OG 3.08Å; S375-T380 PolarHBondContact N-O 3.5Å; S375-T380 PolarHBondContact OG-N 3.38Å
376	H	88.3	Confident	93.4	Very high	124 Å²	124	20.4 Å²	20.4	57%	0.574	11%	0.106	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-42.4	-178.9	-69.3	-70	0	0	0	112.4	C334 C378	C334-H376 PolarHBondContact SG-O 2.86Å; H376-C378 PolarHBondContact O-N 3.27Å; H376-C378 VanDerWaalsContact O-N 3.14Å
377	D	89.8	Confident	93.5	Very high	72 Å²	72	20.5 Å²	20.5	39%	0.385	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-5.4	177.6	69.5	-15.8	0	0	0	114.5	H335 S375 S379	H335-D377 PolarHBondContact CE1-O 2.85Å; H335-D377 PolarHBondContact ND1-O 3.3Å; S375-D377 WeakPolarHBondContact CB-OD1 3.35Å; S375-D377 PolarHBondContact O-N 3.21Å; S375-D377 PolarHBondContact OG-OD1 3.22Å; D377-S379 PolarHBondContact O-N 2.92Å; D377-S379 PolarHBondContact OD1-N 2.83Å; D377-S379 PolarHBondContact OD1-OG 3.34Å; D377-S379 VanDerWaalsContact OD2-CB 3.25Å; D377-S379 WeakPolarHBondContact OD2-CB 3.06Å; D377-S379 PolarHBondContact OD2-OG 3.49Å
378	C	91.1	Very high	93.5	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.101	C	C	.	.	S	Bend	trans	59.8	27.3	-175.7	-56.6	0	0	0	0	114.2	S332 F373 S375 H376 R395	S332-C378 VanDerWaalsContact OG-CB 3.31Å; S332-C378 WeakPolarHBondContact OG-CB 3.27Å; F373-C378 HydrophobicContact CD1-CB 3.49Å; F373-C378 VanDerWaalsContact CD1-CB 3.49Å; F373-C378 HydrophobicContact CE1-CB 3.71Å; F373-C378 HydrophobicContact CG-CB 4.2Å; S375-C378 PolarHBondContact O-N 2.82Å; H376-C378 PolarHBondContact O-N 3.27Å; H376-C378 VanDerWaalsContact O-N 3.14Å; C378-R395 WeakPolarHBondContact O-CD 3.2Å; C378-R395 PolarHBondContact O-NH1 3.49Å
379	S	92.5	Very high	93.4	Very high	12 Å²	12	21 Å²	21	8%	0.084	11%	0.105	C	C	.	.			trans	-82.1	-42.5	171.3	64.9	0	0	0	0	112.8	S375 D377 R395	S375-S379 PolarHBondContact OG-N 3.41Å; S375-S379 PolarHBondContact OG-OG 3.08Å; D377-S379 PolarHBondContact O-N 2.92Å; D377-S379 PolarHBondContact OD1-N 2.83Å; D377-S379 PolarHBondContact OD1-OG 3.34Å; D377-S379 VanDerWaalsContact OD2-CB 3.25Å; D377-S379 WeakPolarHBondContact OD2-CB 3.06Å; D377-S379 PolarHBondContact OD2-OG 3.49Å; S379-R395 WeakPolarHBondContact O-CB 3.45Å; S379-R395 WeakPolarHBondContact O-CD 3.38Å; S379-R395 WeakPolarHBondContact O-CG 3.14Å; S379-R395 PolarHBondContact O-N 2.92Å
380	T	95.1	Very high	93.5	Very high	21 Å²	21	19.5 Å²	19.5	13%	0.129	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	134.4	-179.7	-33.4	0	0	0	0	111.8	M374 S375 I392 V393 D394	M374-T380 HydrophobicContact CE-CG2 3.82Å; M374-T380 PolarHBondContact N-O 2.91Å; S375-T380 PolarHBondContact N-O 3.5Å; S375-T380 PolarHBondContact OG-N 3.38Å; T380-I392 HydrophobicContact CG2-CG2 3.8Å; T380-V393 CarbonylContact C-O 3.57Å; T380-D394 HydrophobicContact CG2-CB 4.29Å; T380-D394 PolarHBondContact OG1-OD2 3.13Å
381	L	96.6	Very high	93.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	142.4	-173.6	-50.3	177.6	0	0	0	111	L340 L348 V361 F373 V383 I392 V393 R395	L340-L381 HydrophobicContact CD2-CD1 3.54Å; L340-L381 HydrophobicContact CD2-CD2 3.87Å; L340-L381 HydrophobicContact CD2-CG 4.37Å; L348-L381 HydrophobicContact CD2-CD1 3.51Å; V361-L381 HydrophobicContact CG1-CD1 4.08Å; F373-L381 HydrophobicContact CD1-CD2 3.37Å; F373-L381 HydrophobicContact CE1-CD2 3.72Å; F373-L381 HydrophobicContact CG-CD2 4.35Å; L381-V383 HydrophobicContact CB-CG2 4.21Å; L381-I392 WeakPolarHBondContact O-CA 3.39Å; L381-V393 HydrophobicContact CB-CB 4.4Å; L381-V393 PolarHBondContact N-O 3.4Å; L381-V393 PolarHBondContact O-N 2.94Å; L381-R395 HydrophobicContact CD1-CG 4.01Å; L381-R395 HydrophobicContact CG-CG 4.28Å
382	L	97.4	Very high	93.4	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	117.6	169.6	-171.8	80.1	0	0	0	108.8	F371 A372 M374 V390 I392 V416 V418 F426	F371-L382 CarbonylContact C-O 3.59Å; F371-L382 WeakPolarHBondContact CA-O 3.5Å; F371-L382 WeakPolarHBondContact CB-O 3.31Å; A372-L382 PolarHBondContact N-O 2.77Å; A372-L382 PolarHBondContact O-N 3.4Å; M374-L382 HydrophobicContact CB-CB 4.39Å; M374-L382 HydrophobicContact SD-CB 4.4Å; M374-L382 HydrophobicContact SD-CD1 4Å; L382-V390 HydrophobicContact CD1-CG1 3.42Å; L382-V390 VanDerWaalsContact CD1-CG1 3.42Å; L382-V390 HydrophobicContact CD2-CG1 4.35Å; L382-V390 HydrophobicContact CG-CG1 3.64Å; L382-I392 HydrophobicContact CD1-CG1 4.1Å; L382-V416 HydrophobicContact CD2-CB 4.09Å; L382-V416 HydrophobicContact CD2-CG2 4.23Å; L382-V418 HydrophobicContact CB-CG2 4.31Å; L382-V418 HydrophobicContact CD2-CG2 4.03Å; L382-F426 HydrophobicContact CD1-CD1 4.33Å; L382-F426 HydrophobicContact CD1-CE1 4.35Å; L382-F426 HydrophobicContact CD1-CG 4.49Å; L382-F426 HydrophobicContact CD2-CB 3.48Å; L382-F426 VanDerWaalsContact CD2-CB 3.48Å; L382-F426 HydrophobicContact CD2-CD1 4.02Å; L382-F426 HydrophobicContact CD2-CD2 3.47Å; L382-F426 VanDerWaalsContact CD2-CD2 3.47Å; L382-F426 HydrophobicContact CD2-CE2 4.1Å; L382-F426 HydrophobicContact CD2-CG 3.39Å
383	V	97.1	Very high	93.4	Very high	2 Å²	2	19.1 Å²	19.1	1%	0.012	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	118	-171.3	-172.1	0	0	0	0	111	L348 Y362 L368 F371 L381 V390 A391 V393	L348-V383 HydrophobicContact CD1-CG1 4.25Å; L348-V383 HydrophobicContact CD1-CG2 4.35Å; Y362-V383 HydrophobicContact CD1-CG1 4.19Å; Y362-V383 HydrophobicContact CE1-CG1 4.37Å; L368-V383 HydrophobicContact CD1-CG1 3.95Å; L368-V383 HydrophobicContact CD2-CG1 3.87Å; L368-V383 HydrophobicContact CG-CG1 4.33Å; F371-V383 HydrophobicContact CB-CG2 4.15Å; L381-V383 HydrophobicContact CB-CG2 4.21Å; V383-V390 CarbonylContact O-C 3.51Å; V383-V390 WeakPolarHBondContact O-CA 3.41Å; V383-A391 PolarHBondContact N-O 3.45Å; V383-A391 PolarHBondContact O-N 2.76Å; V383-V393 HydrophobicContact CG2-CB 4.5Å; V383-V393 HydrophobicContact CG2-CG2 3.99Å
384	G	95.6	Very high	93.3	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	129.6	179.5	0	0	0	0	0	113.1	K369 T370	K369-G384 PolarHBondContact N-O 2.91Å; T370-G384 PolarHBondContact N-O 3.24Å; T370-G384 PolarHBondContact O-N 2.84Å
385	N	92.9	Very high	93.2	Very high	7 Å²	7	20.7 Å²	20.7	4%	0.037	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	169.6	178.2	87.4	2	0	0	0	113.5	F387 G388 E389	N385-F387 PolarHBondContact O-N 3.33Å; N385-F387 WeakPolarHBondContact OD1-CA 3.28Å; N385-F387 PolarHBondContact OD1-N 2.85Å; N385-G388 PolarHBondContact OD1-N 2.89Å; N385-E389 PolarHBondContact N-O 2.87Å; N385-E389 PolarHBondContact ND2-OE2 3.36Å; N385-E389 PolarHBondContact OD1-N 2.92Å; N385-E389 PolarHBondContact OD1-O 3.48Å
386	W	88.6	Confident	93.1	Very high	43 Å²	43	28.1 Å²	28.1	16%	0.163	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-13.4	-179.9	-91.5	83.6	0	0	0	115.6	L63 Y344 G367 L368 K369 A412	L63-W386 HydrophobicContact CD2-CD2 4.46Å; L63-W386 HydrophobicContact CD2-CE3 3.78Å; L63-W386 HydrophobicContact CD2-CH2 4.12Å; L63-W386 HydrophobicContact CD2-CZ3 3.57Å; Y344-W386 AromaticContact CD1-NE1 3.37Å; Y344-W386 HydrophobicContact CD2-CZ2 4.09Å; Y344-W386 AromaticContact CD2-NE1 3.97Å; Y344-W386 HydrophobicContact CE1-CZ2 4.11Å; Y344-W386 AromaticContact CE1-NE1 3.49Å; Y344-W386 AromaticContact CE2-CZ2 3.58Å; Y344-W386 HydrophobicContact CE2-CZ2 3.58Å; Y344-W386 AromaticContact CG-NE1 3.63Å; Y344-W386 AromaticContact CZ-CZ2 3.6Å; Y344-W386 AromaticContact CZ-NE1 3.89Å; G367-W386 VanDerWaalsContact O-CD1 3.31Å; G367-W386 PolarHBondContact O-N 2.82Å; L368-W386 VanDerWaalsContact O-CD1 3.29Å; L368-W386 PolarHBondContact O-NE1 2.85Å; K369-W386 HydrophobicContact CB-CG 4.45Å; K369-W386 HydrophobicContact CD-CZ2 3.83Å; W386-A412 WeakPolarHBondContact O-CA 3.16Å; W386-A412 WeakPolarHBondContact O-CB 3.39Å
387	F	88.3	Confident	93	Very high	26 Å²	26	24.8 Å²	24.8	11%	0.114	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109	6.2	-169.2	-59.3	-70	0	0	0	114.8	R56 T59 D366 N385 K411	R56-F387 HydrophobicContact CB-CD1 4.3Å; R56-F387 HydrophobicContact CB-CE1 4.01Å; R56-F387 HydrophobicContact CB-CZ 4.44Å; R56-F387 HydrophobicContact CG-CD1 3.9Å; R56-F387 HydrophobicContact CG-CD2 4.4Å; R56-F387 HydrophobicContact CG-CE1 3.96Å; R56-F387 HydrophobicContact CG-CE2 4.45Å; R56-F387 HydrophobicContact CG-CG 4.13Å; R56-F387 HydrophobicContact CG-CZ 4.24Å; T59-F387 HydrophobicContact CG2-CD1 3.67Å; T59-F387 HydrophobicContact CG2-CE1 3.75Å; D366-F387 HydrophobicContact CB-CD2 3.88Å; D366-F387 HydrophobicContact CB-CE2 3.78Å; D366-F387 WeakPolarHBondContact OD1-CD2 3.45Å; D366-F387 WeakPolarHBondContact OD1-CE2 3.49Å; N385-F387 PolarHBondContact O-N 3.33Å; N385-F387 WeakPolarHBondContact OD1-CA 3.28Å; N385-F387 PolarHBondContact OD1-N 2.85Å; F387-K411 CarbonylContact C-O 3.53Å
388	G	89.1	Confident	92.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	94.1	18.4	175.8	0	0	0	0	0	114.6	N385 L408	N385-G388 PolarHBondContact OD1-N 2.89Å; G388-L408 PolarHBondContact O-N 2.91Å; G388-L408 VanDerWaalsContact O-N 3.07Å
389	E	92.9	Very high	92.3	Very high	20 Å²	20	29.6 Å²	29.6	9%	0.093	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	148.3	175.9	-55.4	161.4	135.9	0	0	109.9	N385 L405 H406	N385-E389 PolarHBondContact N-O 2.87Å; N385-E389 PolarHBondContact ND2-OE2 3.36Å; N385-E389 PolarHBondContact OD1-N 2.92Å; N385-E389 PolarHBondContact OD1-O 3.48Å; E389-L405 HydrophobicContact CB-CD1 4.07Å; E389-H406 CarbonylContact C-O 3.57Å; E389-H406 WeakPolarHBondContact CA-O 3.43Å
390	V	95.4	Very high	92	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.5	176	-179.7	0	0	0	0	108.4	L382 V383 H406 L408 V413 V416	L382-V390 HydrophobicContact CD1-CG1 3.42Å; L382-V390 VanDerWaalsContact CD1-CG1 3.42Å; L382-V390 HydrophobicContact CD2-CG1 4.35Å; L382-V390 HydrophobicContact CG-CG1 3.64Å; V383-V390 CarbonylContact O-C 3.51Å; V383-V390 WeakPolarHBondContact O-CA 3.41Å; V390-H406 PolarHBondContact N-O 2.81Å; V390-H406 PolarHBondContact O-N 3.27Å; V390-L408 HydrophobicContact CG2-CD1 3.73Å; V390-L408 HydrophobicContact CG2-CG 4.03Å; V390-V413 HydrophobicContact CG2-CG2 4.14Å; V390-V416 HydrophobicContact CG2-CG1 4.44Å
391	A	95.7	Very high	91.7	Very high	2 Å²	2	34.2 Å²	34.2	2%	0.017	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	146.2	175.9	0	0	0	0	0	110.7	Y362 V383 V393 H402 S404 L405	Y362-A391 HydrophobicContact CE1-CB 4.09Å; V383-A391 PolarHBondContact N-O 3.45Å; V383-A391 PolarHBondContact O-N 2.76Å; A391-V393 HydrophobicContact CB-CG2 4.33Å; A391-H402 HydrophobicContact CB-CB 3.93Å; A391-S404 CarbonylContact C-O 3.59Å; A391-S404 VanDerWaalsContact CA-O 3.29Å; A391-S404 WeakPolarHBondContact CA-O 3.29Å; A391-L405 HydrophobicContact CB-CD1 3.96Å
392	I	96	Very high	91.5	Very high	15 Å²	15	37.7 Å²	37.7	8%	0.077	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	126.1	163.1	-67.1	162.7	0	0	0	106.9	M374 T380 L381 L382 H402 E403 S404 C439 L442	M374-I392 HydrophobicContact CE-CB 4.37Å; M374-I392 HydrophobicContact CE-CD1 3.98Å; M374-I392 HydrophobicContact CE-CG1 3.84Å; M374-I392 HydrophobicContact CE-CG2 3.62Å; M374-I392 HydrophobicContact SD-CD1 4.47Å; M374-I392 HydrophobicContact SD-CG1 4.3Å; T380-I392 HydrophobicContact CG2-CG2 3.8Å; L381-I392 WeakPolarHBondContact O-CA 3.39Å; L382-I392 HydrophobicContact CD1-CG1 4.1Å; I392-H402 CarbonylContact O-C 3.54Å; I392-H402 WeakPolarHBondContact O-CA 3.36Å; I392-H402 WeakPolarHBondContact O-CB 3.3Å; I392-E403 PolarHBondContact O-N 2.79Å; I392-S404 PolarHBondContact N-O 3.4Å; I392-S404 PolarHBondContact O-N 2.76Å; I392-C439 HydrophobicContact CD1-CB 4.36Å; I392-L442 HydrophobicContact CD1-CD1 4.39Å
393	V	96.3	Very high	91.2	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.006	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	121.1	-176.6	178	0	0	0	0	107.9	V361 Y362 T380 L381 V383 A391 H402	V361-V393 HydrophobicContact CG1-CG1 4.2Å; Y362-V393 HydrophobicContact CD1-CG2 3.97Å; Y362-V393 HydrophobicContact CD2-CG2 3.7Å; Y362-V393 HydrophobicContact CE1-CG2 4.33Å; Y362-V393 HydrophobicContact CE2-CG2 4.12Å; Y362-V393 HydrophobicContact CG-CG1 4.46Å; Y362-V393 HydrophobicContact CG-CG2 3.62Å; T380-V393 CarbonylContact C-O 3.57Å; L381-V393 HydrophobicContact CB-CB 4.4Å; L381-V393 PolarHBondContact N-O 3.4Å; L381-V393 PolarHBondContact O-N 2.94Å; V383-V393 HydrophobicContact CG2-CB 4.5Å; V383-V393 HydrophobicContact CG2-CG2 3.99Å; A391-V393 HydrophobicContact CB-CG2 4.33Å; V393-H402 HydrophobicContact CG2-CB 4.12Å
394	D	94.2	Very high	91	Very high	3 Å²	3	43.9 Å²	43.9	2%	0.016	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	125.2	169.6	-161.8	-65.6	0	0	0	110.9	T380 R396 T397 E403	T380-D394 HydrophobicContact CG2-CB 4.29Å; T380-D394 PolarHBondContact OG1-OD2 3.13Å; D394-R396 VanDerWaalsContact CG-NH2 3.26Å; D394-R396 PolarHBondContact O-N 3.16Å; D394-R396 VanDerWaalsContact O-N 3.14Å; D394-R396 VanDerWaalsContact OD1-CB 3.23Å; D394-R396 WeakPolarHBondContact OD1-CB 3.34Å; D394-R396 VanDerWaalsContact OD1-CG 3.3Å; D394-R396 WeakPolarHBondContact OD1-CG 3.37Å; D394-R396 IonicContact OD1-CZ 2.89Å; D394-R396 PolarHBondContact OD1-N 3.14Å; D394-R396 IonicContact OD1-NE 3.81Å; D394-R396 PolarHBondContact OD1-NE 3.46Å; D394-R396 IonicContact OD1-NH2 3.75Å; D394-R396 PolarHBondContact OD1-NH2 3.44Å; D394-R396 IonicContact OD2-CZ 3.89Å; D394-R396 IonicContact OD2-NE 3.62Å; D394-R396 PolarHBondContact OD2-NE 2.99Å; D394-R396 IonicContact OD2-NH2 3.37Å; D394-R396 PolarHBondContact OD2-NH2 3.39Å; D394-T397 WeakPolarHBondContact O-CB 3.44Å; D394-T397 PolarHBondContact O-N 2.83Å; D394-T397 VanDerWaalsContact O-N 3.09Å; D394-E403 VanDerWaalsContact CB-CD 3.47Å; D394-E403 HydrophobicContact CB-CG 4.11Å; D394-E403 VanDerWaalsContact CB-OE1 3.27Å; D394-E403 WeakPolarHBondContact CB-OE1 3.3Å
395	R	91.8	Very high	90.9	Very high	66 Å²	66	46.4 Å²	46.4	25%	0.249	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-10.8	-177	-62.7	168	67.9	-149.7	-4.4	113.8	C350 V361 C378 S379 L381	C350-R395 PolarHBondContact SG-NH2 3.26Å; C350-R395 VanDerWaalsContact SG-NH2 3.39Å; V361-R395 HydrophobicContact CG1-CG 3.81Å; C378-R395 WeakPolarHBondContact O-CD 3.2Å; C378-R395 PolarHBondContact O-NH1 3.49Å; S379-R395 WeakPolarHBondContact O-CB 3.45Å; S379-R395 WeakPolarHBondContact O-CD 3.38Å; S379-R395 WeakPolarHBondContact O-CG 3.14Å; S379-R395 PolarHBondContact O-N 2.92Å; L381-R395 HydrophobicContact CD1-CG 4.01Å; L381-R395 HydrophobicContact CG-CG 4.28Å
396	R	90.1	Very high	90.9	Very high	176 Å²	176	47 Å²	47	66%	0.664	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-19.2	176.3	-54.5	167.6	-63.3	134	2.6	112.1	D394	D394-R396 VanDerWaalsContact CG-NH2 3.26Å; D394-R396 PolarHBondContact O-N 3.16Å; D394-R396 VanDerWaalsContact O-N 3.14Å; D394-R396 VanDerWaalsContact OD1-CB 3.23Å; D394-R396 WeakPolarHBondContact OD1-CB 3.34Å; D394-R396 VanDerWaalsContact OD1-CG 3.3Å; D394-R396 WeakPolarHBondContact OD1-CG 3.37Å; D394-R396 IonicContact OD1-CZ 2.89Å; D394-R396 PolarHBondContact OD1-N 3.14Å; D394-R396 IonicContact OD1-NE 3.81Å; D394-R396 PolarHBondContact OD1-NE 3.46Å; D394-R396 IonicContact OD1-NH2 3.75Å; D394-R396 PolarHBondContact OD1-NH2 3.44Å; D394-R396 IonicContact OD2-CZ 3.89Å; D394-R396 IonicContact OD2-NE 3.62Å; D394-R396 PolarHBondContact OD2-NE 2.99Å; D394-R396 IonicContact OD2-NH2 3.37Å; D394-R396 PolarHBondContact OD2-NH2 3.39Å
397	T	87.3	Confident	91.1	Very high	55 Å²	55	45.8 Å²	45.8	34%	0.337	25%	0.248	S	C	.	.	S	Bend	trans	-74.1	125.7	176.1	-74.4	0	0	0	0	108.8	D394 G399 E403	D394-T397 WeakPolarHBondContact O-CB 3.44Å; D394-T397 PolarHBondContact O-N 2.83Å; D394-T397 VanDerWaalsContact O-N 3.09Å; T397-G399 PolarHBondContact O-N 3.08Å; T397-E403 PolarHBondContact OG1-OE1 3.13Å
398	P	81.4	Confident	91.1	Very high	123 Å²	123	44.8 Å²	44.8	80%	0.799	24%	0.244	S	C	*	.	S	Bend	trans	-71.7	130.2	-168.4	26.6	-34.7	0	0	0	112.7
399	G	84.8	Confident	90.8	Very high	50 Å²	50	49.4 Å²	49.4	52%	0.515	27%	0.269	S	S	.	.	S	Bend	trans	101.9	-171.1	-178.8	0	0	0	0	0	113.1	T397 S401	T397-G399 PolarHBondContact O-N 3.08Å; G399-S401 PolarHBondContact O-N 2.8Å
400	N	86.3	Confident	90.4	Very high	56 Å²	56	49.1 Å²	49.1	30%	0.299	27%	0.268	S	S	.	.	S	Bend	trans	-100.7	28.5	-165.6	-35.4	48.9	0	0	0	111.7	D360 Y362 D363	D360-N400 PolarHBondContact OD2-ND2 3.29Å; Y362-N400 WeakPolarHBondContact CA-O 3.49Å; Y362-N400 WeakPolarHBondContact CD2-O 3.46Å; D363-N400 HydrophobicContact CB-CB 3.95Å; D363-N400 PolarHBondContact N-O 3.45Å
401	S	88.8	Confident	89.9	Confident	73 Å²	73	55 Å²	55	51%	0.51	29%	0.294	S	S	.	.			trans	-111.3	160.1	-161.2	-67.7	0	0	0	0	113.5	G399	G399-S401 PolarHBondContact O-N 2.8Å
402	H	91.3	Very high	89.5	Confident	73 Å²	73	55 Å²	55	34%	0.338	29%	0.294	S	S	.	.			trans	-85.8	150.8	169.2	56.2	-109.3	0	0	0	111.5	Y362 A391 I392 V393	Y362-H402 HydrophobicContact CD2-CB 4.39Å; Y362-H402 HydrophobicContact CE2-CB 3.62Å; Y362-H402 AromaticContact CE2-CG 3.98Å; Y362-H402 AromaticContact CE2-ND1 3.55Å; Y362-H402 AromaticContact CZ-ND1 3.69Å; Y362-H402 PolarHBondContact OH-ND1 2.87Å; A391-H402 HydrophobicContact CB-CB 3.93Å; I392-H402 CarbonylContact O-C 3.54Å; I392-H402 WeakPolarHBondContact O-CA 3.36Å; I392-H402 WeakPolarHBondContact O-CB 3.3Å; V393-H402 HydrophobicContact CG2-CB 4.12Å
403	E	91.4	Very high	89.4	Confident	102 Å²	102	54.3 Å²	54.3	48%	0.477	29%	0.29	S	S	.	.	S	Bend	trans	-75.3	-37.7	166.9	-56.6	-164.2	136.9	0	0	110.7	I392 D394 T397	I392-E403 PolarHBondContact O-N 2.79Å; D394-E403 VanDerWaalsContact CB-CD 3.47Å; D394-E403 HydrophobicContact CB-CG 4.11Å; D394-E403 VanDerWaalsContact CB-OE1 3.27Å; D394-E403 WeakPolarHBondContact CB-OE1 3.3Å; T397-E403 PolarHBondContact OG1-OE1 3.13Å
404	S	92.3	Very high	89.2	Confident	31 Å²	31	56.5 Å²	56.5	22%	0.217	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	154.4	175.9	71.8	0	0	0	0	112.8	A391 I392 H406	A391-S404 CarbonylContact C-O 3.59Å; A391-S404 VanDerWaalsContact CA-O 3.29Å; A391-S404 WeakPolarHBondContact CA-O 3.29Å; I392-S404 PolarHBondContact N-O 3.4Å; I392-S404 PolarHBondContact O-N 2.76Å; S404-H406 VanDerWaalsContact CB-NE2 3.29Å; S404-H406 WeakPolarHBondContact CB-NE2 3.47Å; S404-H406 PolarHBondContact OG-CD2 2.34Å; S404-H406 PolarHBondContact OG-NE2 2.51Å
405	L	93.8	Very high	89.3	Confident	52 Å²	52	56.6 Å²	56.6	27%	0.272	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	130.4	178.2	-178.4	67.9	0	0	0	109.7	E389 A391	E389-L405 HydrophobicContact CB-CD1 4.07Å; A391-L405 HydrophobicContact CB-CD1 3.96Å
406	H	93.9	Very high	89.6	Confident	20 Å²	20	53.7 Å²	53.7	9%	0.093	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	125.4	-168.9	-60	-79.6	0	0	0	111.5	E389 V390 S404 L442 K443	E389-H406 CarbonylContact C-O 3.57Å; E389-H406 WeakPolarHBondContact CA-O 3.43Å; V390-H406 PolarHBondContact N-O 2.81Å; V390-H406 PolarHBondContact O-N 3.27Å; S404-H406 VanDerWaalsContact CB-NE2 3.29Å; S404-H406 WeakPolarHBondContact CB-NE2 3.47Å; S404-H406 PolarHBondContact OG-CD2 2.34Å; S404-H406 PolarHBondContact OG-NE2 2.51Å; H406-L442 HydrophobicContact CB-CB 4.07Å; H406-L442 HydrophobicContact CB-CD1 4.1Å; H406-L442 PolarHBondContact CE1-O 3.32Å; H406-L442 VanDerWaalsContact ND1-CB 3.32Å; H406-L442 WeakPolarHBondContact ND1-CB 3.29Å; H406-K443 PolarHBondContact ND1-O 2.85Å
407	S	92.3	Very high	90	Very high	17 Å²	17	47 Å²	47	12%	0.119	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	123.8	171.7	-170.7	0	0	0	0	111.3	N409 K444 S447	S407-N409 PolarHBondContact O-N 3.15Å; S407-N409 PolarHBondContact OG-N 3.45Å; S407-K444 PolarHBondContact N-O 3.45Å; S407-S447 PolarHBondContact O-N 2.82Å
408	L	88.7	Confident	90.4	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.026	25%	0.253	C	S	.	.			trans	-79.4	5.9	172.8	-53.6	-170.9	0	0	0	112.5	G388 V390 T410 V413 F426 A428 Y437 L442	G388-L408 PolarHBondContact O-N 2.91Å; G388-L408 VanDerWaalsContact O-N 3.07Å; V390-L408 HydrophobicContact CG2-CD1 3.73Å; V390-L408 HydrophobicContact CG2-CG 4.03Å; L408-T410 HydrophobicContact CB-CG2 4.37Å; L408-T410 PolarHBondContact O-N 3.18Å; L408-T410 VanDerWaalsContact O-N 3.07Å; L408-V413 HydrophobicContact CD1-CG2 3.91Å; L408-F426 HydrophobicContact CD1-CE2 4.47Å; L408-F426 HydrophobicContact CD2-CZ 4.41Å; L408-A428 HydrophobicContact CD1-CB 3.64Å; L408-Y437 HydrophobicContact CB-CE1 4.48Å; L408-Y437 HydrophobicContact CD1-CD2 4.4Å; L408-Y437 HydrophobicContact CD1-CE2 3.93Å; L408-Y437 HydrophobicContact CD2-CD1 4.02Å; L408-Y437 HydrophobicContact CD2-CE1 3.83Å; L408-Y437 HydrophobicContact CD2-CE2 4.4Å; L408-Y437 HydrophobicContact CD2-CG 4.38Å; L408-L442 HydrophobicContact CD2-CD2 4.21Å
409	N	82.1	Confident	91.2	Very high	97 Å²	97	39.2 Å²	39.2	52%	0.519	22%	0.216	S	C	.	.	S	Bend	trans	58	12.7	-174.2	-162	37.4	0	0	0	115.7	S407	S407-N409 PolarHBondContact O-N 3.15Å; S407-N409 PolarHBondContact OG-N 3.45Å
410	T	84.4	Confident	91.6	Very high	14 Å²	14	38.4 Å²	38.4	9%	0.086	20%	0.202	C	C	.	.	S	Bend	trans	-88.6	170.9	176.9	-157.2	0	0	0	0	112.3	L408 V413 E430	L408-T410 HydrophobicContact CB-CG2 4.37Å; L408-T410 PolarHBondContact O-N 3.18Å; L408-T410 VanDerWaalsContact O-N 3.07Å; T410-V413 HydrophobicContact CG2-CG2 4.09Å; T410-E430 WeakPolarHBondContact CB-OE2 3.46Å; T410-E430 HydrophobicContact CG2-CB 4.42Å; T410-E430 HydrophobicContact CG2-CG 4.27Å; T410-E430 WeakPolarHBondContact OG1-CB 3.35Å; T410-E430 PolarHBondContact OG1-OE2 2.75Å
411	K	84.5	Confident	91.9	Very high	125 Å²	125	41.2 Å²	41.2	54%	0.543	22%	0.216	S	C	.	.	S	Bend	trans	-79.5	-31.5	176.9	-74.5	-170.6	172.6	-172.4	0	113.4	F387	F387-K411 CarbonylContact C-O 3.53Å
412	A	88.6	Confident	92.2	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.008	21%	0.211	C	C	.	.			trans	-164.9	142.2	178.9	0	0	0	0	0	110.1	W386	W386-A412 WeakPolarHBondContact O-CA 3.16Å; W386-A412 WeakPolarHBondContact O-CB 3.39Å
413	V	92.9	Very high	92.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.199	C	C	.	.			trans	-91.1	141.2	163.4	171.2	0	0	0	0	108.4	T370 V390 L408 T410 V416	T370-V413 HydrophobicContact CG2-CG1 4.02Å; V390-V413 HydrophobicContact CG2-CG2 4.14Å; L408-V413 HydrophobicContact CD1-CG2 3.91Å; T410-V413 HydrophobicContact CG2-CG2 4.09Å; V413-V416 HydrophobicContact CG1-CG1 3.52Å
414	R	93.4	Very high	92.5	Very high	48 Å²	48	36.7 Å²	36.7	18%	0.181	19%	0.187	C	C	.	.			trans	-111.9	-37.8	-175.3	-60.4	-53.4	-177.6	-159.8	3.5	113.2	K369 A429	K369-R414 VanDerWaalsContact CE-O 3.25Å; K369-R414 WeakPolarHBondContact CE-O 3.36Å; K369-R414 VanDerWaalsContact CG-O 3.29Å; K369-R414 WeakPolarHBondContact CG-O 3.15Å; K369-R414 PolarHBondContact NZ-O 3.26Å; K369-R414 VanDerWaalsContact NZ-O 3.14Å; R414-A429 HydrophobicContact CB-CB 4.25Å; R414-A429 PolarHBondContact N-O 2.83Å
415	C	95.9	Very high	92.7	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.034	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	144.3	177.6	-164.3	0	0	0	0	107.3	A429 Y464	C415-A429 HydrophobicContact CB-CB 3.79Å; C415-A429 PolarHBondContact O-N 2.82Å; C415-Y464 WeakPolarHBondContact SG-CE1 3.49Å
416	V	97.3	Very high	92.8	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.024	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	147.6	163.1	-60.2	0	0	0	0	108	T370 A372 L382 V390 V413 V427	T370-V416 HydrophobicContact CG2-CB 4.34Å; T370-V416 HydrophobicContact CG2-CG1 4Å; T370-V416 HydrophobicContact CG2-CG2 3.95Å; T370-V416 PolarHBondContact OG1-N 3.14Å; T370-V416 VanDerWaalsContact OG1-N 3.09Å; A372-V416 HydrophobicContact CB-CG2 4.27Å; L382-V416 HydrophobicContact CD2-CB 4.09Å; L382-V416 HydrophobicContact CD2-CG2 4.23Å; V390-V416 HydrophobicContact CG2-CG1 4.44Å; V413-V416 HydrophobicContact CG1-CG1 3.52Å; V416-V427 VanDerWaalsContact CA-O 3.31Å; V416-V427 WeakPolarHBondContact CA-O 3.25Å
417	D	97.8	Very high	93	Very high	37 Å²	37	33.8 Å²	33.8	20%	0.198	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	151.3	172.7	-174	31.5	0	0	0	109.8	F426 V427 Y464 F465	D417-F426 CarbonylContact O-C 3.59Å; D417-F426 VanDerWaalsContact O-CA 3.26Å; D417-F426 WeakPolarHBondContact O-CA 3.35Å; D417-F426 WeakPolarHBondContact O-CB 3.26Å; D417-V427 HydrophobicContact CB-CG1 3.79Å; D417-V427 PolarHBondContact N-O 2.79Å; D417-V427 VanDerWaalsContact N-O 3.08Å; D417-V427 PolarHBondContact O-N 3.06Å; D417-Y464 HydrophobicContact CB-CD1 3.98Å; D417-Y464 VanDerWaalsContact OD2-CA 3.27Å; D417-Y464 WeakPolarHBondContact OD2-CA 3.3Å; D417-F465 PolarHBondContact OD2-N 3.12Å
418	V	97.4	Very high	93.2	Very high	10 Å²	10	33 Å²	33	6%	0.061	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	135.9	-174	174.2	0	0	0	0	109.4	A372 M374 L382 M423 F426	A372-V418 HydrophobicContact CB-CB 4.48Å; A372-V418 HydrophobicContact CB-CG2 3.87Å; M374-V418 HydrophobicContact CB-CG2 4.36Å; M374-V418 HydrophobicContact CG-CG1 4.5Å; M374-V418 HydrophobicContact CG-CG2 4.31Å; L382-V418 HydrophobicContact CB-CG2 4.31Å; L382-V418 HydrophobicContact CD2-CG2 4.03Å; V418-M423 HydrophobicContact CG1-CB 3.91Å; V418-M423 HydrophobicContact CG1-CE 4.01Å; V418-M423 HydrophobicContact CG1-CG 4.33Å; V418-M423 WeakPolarHBondContact CG1-O 3.39Å; V418-F426 HydrophobicContact CG2-CB 4.1Å
419	H	96.8	Very high	93.5	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.019	16%	0.161	C	C	.	.			trans	-62.2	127.2	-179.8	-176.5	-43.2	0	0	0	110	L421 Q422 M423 Y425 F465 T469	H419-L421 PolarHBondContact ND1-N 3Å; H419-L421 PolarHBondContact O-N 2.94Å; H419-Q422 PolarHBondContact ND1-N 3.5Å; H419-M423 WeakPolarHBondContact O-CA 3.37Å; H419-M423 PolarHBondContact O-N 3.03Å; H419-Y425 WeakPolarHBondContact CB-O 3.42Å; H419-Y425 PolarHBondContact N-O 2.74Å; H419-F465 HydrophobicContact CB-CD1 4.35Å; H419-F465 HydrophobicContact CB-CD2 4.04Å; H419-F465 HydrophobicContact CB-CE1 4.2Å; H419-F465 HydrophobicContact CB-CE2 3.85Å; H419-F465 HydrophobicContact CB-CG 4.28Å; H419-F465 HydrophobicContact CB-CZ 3.94Å; H419-T469 PolarHBondContact CE1-O 2.76Å
420	P	93.9	Very high	94	Very high	33 Å²	33	28.9 Å²	28.9	21%	0.214	14%	0.14	C	C	.	.	S	Bend	trans	-63	-41.1	-167	21.5	-34.6	0	0	0	114.3	S466 P467	P420-S466 WeakPolarHBondContact CG-O 3.26Å; P420-P467 VanDerWaalsContact CB-O 3.27Å; P420-P467 WeakPolarHBondContact CB-O 3.07Å; P420-P467 WeakPolarHBondContact CG-O 3.45Å
421	L	93.4	Very high	94.1	Very high	115 Å²	115	29.9 Å²	29.9	60%	0.602	15%	0.147	S	C	*	.	S	Bend	trans	-90.9	-37.7	178.4	-55.3	179.8	0	0	0	113.8	H419	H419-L421 PolarHBondContact ND1-N 3Å; H419-L421 PolarHBondContact O-N 2.94Å
422	Q	94.1	Very high	94.2	Very high	84 Å²	84	32 Å²	32	39%	0.393	15%	0.152	S	C	.	.			trans	-109.1	63	-173.4	-62.4	-167.5	36.7	0	0	110.3	H419 Q424 Y425	H419-Q422 PolarHBondContact ND1-N 3.5Å; Q422-Q424 PolarHBondContact O-N 2.88Å; Q422-Q424 PolarHBondContact O-OE1 2.9Å; Q422-Y425 HydrophobicContact CB-CD2 3.93Å; Q422-Y425 PolarHBondContact O-N 2.95Å; Q422-Y425 VanDerWaalsContact OE1-CE2 3.28Å
423	M	94	Very high	94.4	Very high	21 Å²	21	34 Å²	34	10%	0.103	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-10.2	-166.1	-55.3	-165	81.4	0	0	115.5	F373 M374 V418 H419 Y425	F373-M423 VanDerWaalsContact O-CE 3.3Å; F373-M423 WeakPolarHBondContact O-CE 3.35Å; M374-M423 VanDerWaalsContact C-CE 3.45Å; V418-M423 HydrophobicContact CG1-CB 3.91Å; V418-M423 HydrophobicContact CG1-CE 4.01Å; V418-M423 HydrophobicContact CG1-CG 4.33Å; V418-M423 WeakPolarHBondContact CG1-O 3.39Å; H419-M423 WeakPolarHBondContact O-CA 3.37Å; H419-M423 PolarHBondContact O-N 3.03Å; M423-Y425 PolarHBondContact O-N 3.29Å
424	Q	94.6	Very high	94.6	Very high	48 Å²	48	34 Å²	34	22%	0.224	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-25.4	167.1	74	-80.1	0.8	0	0	113.3	Q422 D438 C439 R440	Q422-Q424 PolarHBondContact O-N 2.88Å; Q422-Q424 PolarHBondContact O-OE1 2.9Å; Q424-D438 CarbonylContact O-C 3.58Å; Q424-D438 WeakPolarHBondContact O-CA 3.3Å; Q424-C439 PolarHBondContact O-N 2.89Å; Q424-C439 PolarHBondContact O-SG 3.03Å; Q424-R440 HydrophobicContact CB-CG 4.35Å
425	Y	96.3	Very high	94.6	Very high	39 Å²	39	31.7 Å²	31.7	15%	0.153	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	131.2	179.6	-63.7	-56.4	0	0	0	111.3	H419 Q422 M423 Y437 D438 V450 L490	H419-Y425 WeakPolarHBondContact CB-O 3.42Å; H419-Y425 PolarHBondContact N-O 2.74Å; Q422-Y425 HydrophobicContact CB-CD2 3.93Å; Q422-Y425 PolarHBondContact O-N 2.95Å; Q422-Y425 VanDerWaalsContact OE1-CE2 3.28Å; M423-Y425 PolarHBondContact O-N 3.29Å; Y425-Y437 WeakPolarHBondContact CA-O 3.36Å; Y425-D438 HydrophobicContact CD1-CB 3.93Å; Y425-D438 HydrophobicContact CE1-CB 3.78Å; Y425-V450 HydrophobicContact CE1-CG2 4.31Å; Y425-L490 HydrophobicContact CD1-CD1 3.92Å; Y425-L490 HydrophobicContact CD2-CD1 3.56Å; Y425-L490 HydrophobicContact CE1-CD1 3.86Å; Y425-L490 HydrophobicContact CE2-CD1 3.47Å; Y425-L490 VanDerWaalsContact CE2-CD1 3.47Å; Y425-L490 HydrophobicContact CG-CD1 3.78Å
426	F	97.3	Very high	94.7	Very high	2 Å²	2	31.5 Å²	31.5	1%	0.009	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	151.6	172.9	71.8	-89.8	0	0	0	111.1	L382 L408 D417 V418 A428 I436 Y437 C439 L442	L382-F426 HydrophobicContact CD1-CD1 4.33Å; L382-F426 HydrophobicContact CD1-CE1 4.35Å; L382-F426 HydrophobicContact CD1-CG 4.49Å; L382-F426 HydrophobicContact CD2-CB 3.48Å; L382-F426 VanDerWaalsContact CD2-CB 3.48Å; L382-F426 HydrophobicContact CD2-CD1 4.02Å; L382-F426 HydrophobicContact CD2-CD2 3.47Å; L382-F426 VanDerWaalsContact CD2-CD2 3.47Å; L382-F426 HydrophobicContact CD2-CE2 4.1Å; L382-F426 HydrophobicContact CD2-CG 3.39Å; L408-F426 HydrophobicContact CD1-CE2 4.47Å; L408-F426 HydrophobicContact CD2-CZ 4.41Å; D417-F426 CarbonylContact O-C 3.59Å; D417-F426 VanDerWaalsContact O-CA 3.26Å; D417-F426 WeakPolarHBondContact O-CA 3.35Å; D417-F426 WeakPolarHBondContact O-CB 3.26Å; V418-F426 HydrophobicContact CG2-CB 4.1Å; F426-A428 HydrophobicContact CE2-CB 4.31Å; F426-I436 CarbonylContact O-C 3.58Å; F426-I436 WeakPolarHBondContact O-CA 3.27Å; F426-Y437 HydrophobicContact CE2-CD2 4.04Å; F426-Y437 HydrophobicContact CE2-CG 4.21Å; F426-Y437 VanDerWaalsContact CZ-CB 3.44Å; F426-Y437 HydrophobicContact CZ-CD2 4.3Å; F426-Y437 AromaticContact CZ-CG 3.99Å; F426-Y437 HydrophobicContact CZ-CG 3.99Å; F426-Y437 PolarHBondContact N-O 3.31Å; F426-Y437 PolarHBondContact O-N 2.87Å; F426-C439 HydrophobicContact CD1-CB 4.4Å; F426-C439 HydrophobicContact CE1-CB 4.4Å; F426-L442 HydrophobicContact CE1-CD1 3.81Å; F426-L442 HydrophobicContact CE1-CD2 3.98Å; F426-L442 HydrophobicContact CE1-CG 4.22Å; F426-L442 HydrophobicContact CZ-CD1 3.99Å; F426-L442 HydrophobicContact CZ-CD2 3.87Å; F426-L442 HydrophobicContact CZ-CG 4.46Å
427	V	97.3	Very high	94.6	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	134.6	175.5	66.2	0	0	0	0	109.2	V416 D417 V434 G435 I436 A463 F465 V473	V416-V427 VanDerWaalsContact CA-O 3.31Å; V416-V427 WeakPolarHBondContact CA-O 3.25Å; D417-V427 HydrophobicContact CB-CG1 3.79Å; D417-V427 PolarHBondContact N-O 2.79Å; D417-V427 VanDerWaalsContact N-O 3.08Å; D417-V427 PolarHBondContact O-N 3.06Å; V427-V434 HydrophobicContact CG2-CG1 3.2Å; V427-G435 WeakPolarHBondContact CA-O 3.44Å; V427-I436 HydrophobicContact CB-CG1 4.26Å; V427-I436 HydrophobicContact CG2-CG1 4.12Å; V427-A463 HydrophobicContact CG1-CB 4.47Å; V427-A463 HydrophobicContact CG2-CB 4.09Å; V427-F465 HydrophobicContact CB-CD2 4.31Å; V427-F465 HydrophobicContact CB-CE2 3.64Å; V427-F465 HydrophobicContact CB-CZ 3.89Å; V427-F465 HydrophobicContact CG1-CD2 3.76Å; V427-F465 HydrophobicContact CG1-CE2 3.58Å; V427-F465 HydrophobicContact CG1-CZ 4.26Å; V427-V473 HydrophobicContact CG2-CG1 4.3Å
428	A	96.8	Very high	94.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	117.2	175.8	0	0	0	0	0	109.8	L408 F426 E430 V434 G435 Y437	L408-A428 HydrophobicContact CD1-CB 3.64Å; F426-A428 HydrophobicContact CE2-CB 4.31Å; A428-E430 PolarHBondContact O-N 2.76Å; A428-V434 WeakPolarHBondContact O-CA 3.31Å; A428-G435 PolarHBondContact N-O 2.93Å; A428-G435 PolarHBondContact O-N 2.7Å; A428-G435 VanDerWaalsContact O-N 3.11Å; A428-Y437 HydrophobicContact CB-CD2 4.26Å; A428-Y437 HydrophobicContact CB-CE2 4.07Å
429	A	95.5	Very high	94.3	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	108.1	169.5	0	0	0	0	0	109.3	R414 C415 I460 A463	R414-A429 HydrophobicContact CB-CB 4.25Å; R414-A429 PolarHBondContact N-O 2.83Å; C415-A429 HydrophobicContact CB-CB 3.79Å; C415-A429 PolarHBondContact O-N 2.82Å; A429-I460 HydrophobicContact CB-CB 4.35Å; A429-I460 HydrophobicContact CB-CG2 3.71Å; A429-A463 HydrophobicContact CB-CB 3.94Å
430	E	92.1	Very high	94.1	Very high	17 Å²	17	37.9 Å²	37.9	8%	0.079	18%	0.177	C	C	.	.			trans	-91.6	-148.3	-178.7	-52.7	-179	-114.4	0	0	112.2	T410 A428 T433	T410-E430 WeakPolarHBondContact CB-OE2 3.46Å; T410-E430 HydrophobicContact CG2-CB 4.42Å; T410-E430 HydrophobicContact CG2-CG 4.27Å; T410-E430 WeakPolarHBondContact OG1-CB 3.35Å; T410-E430 PolarHBondContact OG1-OE2 2.75Å; A428-E430 PolarHBondContact O-N 2.76Å; E430-T433 VanDerWaalsContact CB-O 3.22Å; E430-T433 WeakPolarHBondContact CB-O 3.42Å; E430-T433 VanDerWaalsContact CD-OG1 3.26Å; E430-T433 PolarHBondContact N-O 3.2Å; E430-T433 PolarHBondContact OE1-OG1 3.49Å
431	S	85.9	Confident	93.9	Very high	34 Å²	34	44.5 Å²	44.5	24%	0.238	20%	0.199	C	C	.	.	S	Bend	trans	-82.8	-37.4	-178.3	-62.2	0	0	0	0	114.7	T459	S431-T459 WeakPolarHBondContact O-CA 3.48Å
432	R	87.6	Confident	93.8	Very high	171 Å²	171	40 Å²	40	65%	0.645	18%	0.175	S	C	*	.	S	Bend	trans	-150.1	6.3	176.9	-67.4	-168.2	-60	179	1.4	113.7	I460	R432-I460 VanDerWaalsContact C-CD1 3.46Å
433	T	92.2	Very high	93.6	Very high	42 Å²	42	42.5 Å²	42.5	26%	0.258	19%	0.185	S	C	.	.			trans	-133	155.2	179.3	40.2	0	0	0	0	107.4	E430 I460	E430-T433 VanDerWaalsContact CB-O 3.22Å; E430-T433 WeakPolarHBondContact CB-O 3.42Å; E430-T433 VanDerWaalsContact CD-OG1 3.26Å; E430-T433 PolarHBondContact N-O 3.2Å; E430-T433 PolarHBondContact OE1-OG1 3.49Å; T433-I460 WeakPolarHBondContact O-CD1 3.27Å
434	V	96.1	Very high	93.3	Very high	0 Å²	0	50 Å²	50	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	125.3	165.6	178.9	0	0	0	0	106.7	V427 A428 L453 I460 A463 T475	V427-V434 HydrophobicContact CG2-CG1 3.2Å; A428-V434 WeakPolarHBondContact O-CA 3.31Å; V434-L453 HydrophobicContact CB-CB 3.95Å; V434-L453 HydrophobicContact CB-CD2 4.12Å; V434-L453 HydrophobicContact CG1-CD2 3.9Å; V434-L453 PolarHBondContact N-O 3.41Å; V434-L453 WeakPolarHBondContact O-CB 3.37Å; V434-L453 PolarHBondContact O-N 2.88Å; V434-I460 HydrophobicContact CG2-CB 4.34Å; V434-I460 HydrophobicContact CG2-CD1 3.95Å; V434-I460 HydrophobicContact CG2-CG1 3.82Å; V434-I460 HydrophobicContact CG2-CG2 3.93Å; V434-A463 HydrophobicContact CG1-CB 3.65Å; V434-A463 HydrophobicContact CG2-CB 4.25Å; V434-T475 HydrophobicContact CG2-CG2 4.1Å
435	G	95.4	Very high	92.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	136.2	-176.6	0	0	0	0	0	110.9	V427 A428 Y437	V427-G435 WeakPolarHBondContact CA-O 3.44Å; A428-G435 PolarHBondContact N-O 2.93Å; A428-G435 PolarHBondContact O-N 2.7Å; A428-G435 VanDerWaalsContact O-N 3.11Å; G435-Y437 WeakPolarHBondContact O-CD2 3.33Å
436	I	96.6	Very high	92.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	129.7	168.5	-61	174.5	0	0	0	108.2	F426 V427 A449 V450 A451 L453 F465 V473 T487 L490	F426-I436 CarbonylContact O-C 3.58Å; F426-I436 WeakPolarHBondContact O-CA 3.27Å; V427-I436 HydrophobicContact CB-CG1 4.26Å; V427-I436 HydrophobicContact CG2-CG1 4.12Å; I436-A449 CarbonylContact O-C 3.59Å; I436-A449 VanDerWaalsContact O-CA 3.31Å; I436-A449 WeakPolarHBondContact O-CA 3.39Å; I436-A449 WeakPolarHBondContact O-CB 3.27Å; I436-V450 PolarHBondContact O-N 3.23Å; I436-A451 HydrophobicContact CB-CB 4.29Å; I436-A451 PolarHBondContact N-O 3.49Å; I436-A451 PolarHBondContact O-N 2.83Å; I436-L453 HydrophobicContact CD1-CD1 3.83Å; I436-L453 HydrophobicContact CG1-CD1 3.98Å; I436-F465 HydrophobicContact CD1-CE1 4.19Å; I436-F465 HydrophobicContact CD1-CZ 4.29Å; I436-F465 HydrophobicContact CG1-CZ 4.37Å; I436-F465 HydrophobicContact CG2-CZ 4.37Å; I436-V473 HydrophobicContact CD1-CG2 4.45Å; I436-T487 HydrophobicContact CD1-CG2 3.59Å; I436-L490 HydrophobicContact CD1-CD2 3.76Å; I436-L490 HydrophobicContact CG2-CD2 4.15Å
437	Y	95.8	Very high	91.8	Very high	5 Å²	5	56.1 Å²	56.1	2%	0.02	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	149.1	-175	-65.9	-97.8	0	0	0	110.2	L408 Y425 F426 A428 G435 L442 K448 A449	L408-Y437 HydrophobicContact CB-CE1 4.48Å; L408-Y437 HydrophobicContact CD1-CD2 4.4Å; L408-Y437 HydrophobicContact CD1-CE2 3.93Å; L408-Y437 HydrophobicContact CD2-CD1 4.02Å; L408-Y437 HydrophobicContact CD2-CE1 3.83Å; L408-Y437 HydrophobicContact CD2-CE2 4.4Å; L408-Y437 HydrophobicContact CD2-CG 4.38Å; Y425-Y437 WeakPolarHBondContact CA-O 3.36Å; F426-Y437 HydrophobicContact CE2-CD2 4.04Å; F426-Y437 HydrophobicContact CE2-CG 4.21Å; F426-Y437 VanDerWaalsContact CZ-CB 3.44Å; F426-Y437 HydrophobicContact CZ-CD2 4.3Å; F426-Y437 AromaticContact CZ-CG 3.99Å; F426-Y437 HydrophobicContact CZ-CG 3.99Å; F426-Y437 PolarHBondContact N-O 3.31Å; F426-Y437 PolarHBondContact O-N 2.87Å; A428-Y437 HydrophobicContact CB-CD2 4.26Å; A428-Y437 HydrophobicContact CB-CE2 4.07Å; G435-Y437 WeakPolarHBondContact O-CD2 3.33Å; Y437-L442 HydrophobicContact CD1-CD2 4.18Å; Y437-L442 HydrophobicContact CG-CD2 4.49Å; Y437-K448 VanDerWaalsContact CD1-O 3.28Å; Y437-K448 WeakPolarHBondContact CD1-O 3.27Å; Y437-K448 VanDerWaalsContact CE1-C 3.48Å; Y437-A449 HydrophobicContact CD1-CB 4.29Å; Y437-A449 HydrophobicContact CE1-CB 3.99Å; Y437-A449 VanDerWaalsContact CE1-N 3.35Å; Y437-A449 HydrophobicContact CE2-CB 4.21Å
438	D	95	Very high	91.4	Very high	7 Å²	7	65 Å²	65	4%	0.037	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	121.3	169.1	-170.6	-36.8	0	0	0	109	Q424 Y425 R440 Y441 L442 V450	Q424-D438 CarbonylContact O-C 3.58Å; Q424-D438 WeakPolarHBondContact O-CA 3.3Å; Y425-D438 HydrophobicContact CD1-CB 3.93Å; Y425-D438 HydrophobicContact CE1-CB 3.78Å; D438-R440 PolarHBondContact O-N 3.2Å; D438-R440 WeakPolarHBondContact OD1-CB 3.42Å; D438-R440 VanDerWaalsContact OD1-CG 3.3Å; D438-R440 WeakPolarHBondContact OD1-CG 3.41Å; D438-R440 IonicContact OD1-CZ 2.86Å; D438-R440 PolarHBondContact OD1-N 2.89Å; D438-R440 IonicContact OD1-NE 3.81Å; D438-R440 PolarHBondContact OD1-NE 3.02Å; D438-R440 IonicContact OD1-NH2 3.34Å; D438-R440 IonicContact OD2-CZ 3.83Å; D438-R440 IonicContact OD2-NE 3.73Å; D438-R440 PolarHBondContact OD2-NE 3.25Å; D438-R440 IonicContact OD2-NH2 2.8Å; D438-R440 PolarHBondContact OD2-NH2 2.9Å; D438-Y441 HydrophobicContact CB-CD2 3.99Å; D438-Y441 PolarHBondContact O-N 2.8Å; D438-Y441 VanDerWaalsContact O-N 3.13Å; D438-L442 PolarHBondContact O-N 3.11Å; D438-V450 HydrophobicContact CB-CG2 4.08Å
439	C	93.4	Very high	91.2	Very high	25 Å²	25	66 Å²	66	17%	0.169	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-58.1	-30.2	-178.4	71.7	0	0	0	0	112.4	M374 I392 Q424 F426 Y441	M374-C439 HydrophobicContact SD-CB 3.84Å; I392-C439 HydrophobicContact CD1-CB 4.36Å; Q424-C439 PolarHBondContact O-N 2.89Å; Q424-C439 PolarHBondContact O-SG 3.03Å; F426-C439 HydrophobicContact CD1-CB 4.4Å; F426-C439 HydrophobicContact CE1-CB 4.4Å; C439-Y441 VanDerWaalsContact C-N 3.3Å; C439-Y441 PolarHBondContact O-N 2.97Å
440	R	92.1	Very high	91.2	Very high	152 Å²	152	68.8 Å²	68.8	57%	0.574	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-73.9	-19.3	-177.5	-52.2	171.3	-64.2	176.8	4.4	113.2	Q424 D438	Q424-R440 HydrophobicContact CB-CG 4.35Å; D438-R440 PolarHBondContact O-N 3.2Å; D438-R440 WeakPolarHBondContact OD1-CB 3.42Å; D438-R440 VanDerWaalsContact OD1-CG 3.3Å; D438-R440 WeakPolarHBondContact OD1-CG 3.41Å; D438-R440 IonicContact OD1-CZ 2.86Å; D438-R440 PolarHBondContact OD1-N 2.89Å; D438-R440 IonicContact OD1-NE 3.81Å; D438-R440 PolarHBondContact OD1-NE 3.02Å; D438-R440 IonicContact OD1-NH2 3.34Å; D438-R440 IonicContact OD2-CZ 3.83Å; D438-R440 IonicContact OD2-NE 3.73Å; D438-R440 PolarHBondContact OD2-NE 3.25Å; D438-R440 IonicContact OD2-NH2 2.8Å; D438-R440 PolarHBondContact OD2-NH2 2.9Å
441	Y	90.9	Very high	91.3	Very high	173 Å²	173	68 Å²	68	68%	0.678	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-113.7	11	-178.5	-65.5	-75	0	0	0	113.4	D438 C439	D438-Y441 HydrophobicContact CB-CD2 3.99Å; D438-Y441 PolarHBondContact O-N 2.8Å; D438-Y441 VanDerWaalsContact O-N 3.13Å; C439-Y441 VanDerWaalsContact C-N 3.3Å; C439-Y441 PolarHBondContact O-N 2.97Å
442	L	91.8	Very high	91.6	Very high	20 Å²	20	69.8 Å²	69.8	11%	0.105	32%	0.318	C	S	.	.			trans	-65.2	140.8	174	-64.6	178.8	0	0	0	111.8	I392 H406 L408 F426 Y437 D438	I392-L442 HydrophobicContact CD1-CD1 4.39Å; H406-L442 HydrophobicContact CB-CB 4.07Å; H406-L442 HydrophobicContact CB-CD1 4.1Å; H406-L442 PolarHBondContact CE1-O 3.32Å; H406-L442 VanDerWaalsContact ND1-CB 3.32Å; H406-L442 WeakPolarHBondContact ND1-CB 3.29Å; L408-L442 HydrophobicContact CD2-CD2 4.21Å; F426-L442 HydrophobicContact CE1-CD1 3.81Å; F426-L442 HydrophobicContact CE1-CD2 3.98Å; F426-L442 HydrophobicContact CE1-CG 4.22Å; F426-L442 HydrophobicContact CZ-CD1 3.99Å; F426-L442 HydrophobicContact CZ-CD2 3.87Å; F426-L442 HydrophobicContact CZ-CG 4.46Å; Y437-L442 HydrophobicContact CD1-CD2 4.18Å; Y437-L442 HydrophobicContact CG-CD2 4.49Å; D438-L442 PolarHBondContact O-N 3.11Å
443	K	89.8	Confident	92	Very high	136 Å²	136	61.6 Å²	61.6	59%	0.591	29%	0.287	S	S	*	.			trans	-111.3	150.7	178	-61.8	-173.2	179.7	-170.7	0	109.7	H406 T445 S447	H406-K443 PolarHBondContact ND1-O 2.85Å; K443-T445 WeakPolarHBondContact CB-O 3.35Å; K443-T445 PolarHBondContact O-N 3.4Å; K443-S447 PolarHBondContact N-OG 2.9Å; K443-S447 PolarHBondContact O-OG 2.91Å
444	K	86.8	Confident	92	Very high	178 Å²	178	62.7 Å²	62.7	77%	0.774	29%	0.291	S	S	*	.	S	Bend	trans	-54.2	-42.3	175.6	-67.1	-171.9	176.9	-173.8	0	110.6	S407	S407-K444 PolarHBondContact N-O 3.45Å
445	T	85.6	Confident	91.8	Very high	75 Å²	75	65.4 Å²	65.4	46%	0.46	32%	0.319	S	S	.	.	S	Bend	trans	-126	147.6	172.3	54.3	0	0	0	0	110.7	K443 S447	K443-T445 WeakPolarHBondContact CB-O 3.35Å; K443-T445 PolarHBondContact O-N 3.4Å; T445-S447 PolarHBondContact O-N 2.8Å
446	Q	81.4	Confident	91.8	Very high	136 Å²	136	66.2 Å²	66.2	64%	0.636	32%	0.323	S	S	*	.			trans	54.1	52.7	176.6	-56.2	-175.5	4	0	0	114.5	K448	Q446-K448 PolarHBondContact O-N 2.77Å
447	S	89.5	Confident	91.6	Very high	7 Å²	7	69.4 Å²	69.4	5%	0.049	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-60.9	133.3	164.2	-65.6	0	0	0	0	110.1	S407 K443 T445	S407-S447 PolarHBondContact O-N 2.82Å; K443-S447 PolarHBondContact N-OG 2.9Å; K443-S447 PolarHBondContact O-OG 2.91Å; T445-S447 PolarHBondContact O-N 2.8Å
448	K	89.6	Confident	91.5	Very high	187 Å²	187	73.4 Å²	73.4	81%	0.813	37%	0.371	S	S	*	.	P	Polyproline II helix	trans	-96.5	142.3	174.5	-68.1	-170.7	175.9	-171.9	0	110	Y437 Q446	Y437-K448 VanDerWaalsContact CD1-O 3.28Å; Y437-K448 WeakPolarHBondContact CD1-O 3.27Å; Y437-K448 VanDerWaalsContact CE1-C 3.48Å; Q446-K448 PolarHBondContact O-N 2.77Å
449	A	92.9	Very high	91.4	Very high	21 Å²	21	75.8 Å²	75.8	17%	0.174	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-71	151.2	167.3	0	0	0	0	0	110.1	I436 Y437	I436-A449 CarbonylContact O-C 3.59Å; I436-A449 VanDerWaalsContact O-CA 3.31Å; I436-A449 WeakPolarHBondContact O-CA 3.39Å; I436-A449 WeakPolarHBondContact O-CB 3.27Å; Y437-A449 HydrophobicContact CD1-CB 4.29Å; Y437-A449 HydrophobicContact CE1-CB 3.99Å; Y437-A449 VanDerWaalsContact CE1-N 3.35Å; Y437-A449 HydrophobicContact CE2-CB 4.21Å
450	V	94.1	Very high	91.5	Very high	59 Å²	59	74.7 Å²	74.7	36%	0.358	38%	0.378	S	S	.	.	S	Bend	trans	-77.1	-38.7	167.2	-178.2	0	0	0	0	109.7	Y425 I436 D438 L490	Y425-V450 HydrophobicContact CE1-CG2 4.31Å; I436-V450 PolarHBondContact O-N 3.23Å; D438-V450 HydrophobicContact CB-CG2 4.08Å; V450-L490 HydrophobicContact CG1-CB 4.31Å
451	A	94.2	Very high	91.6	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	145.9	-178.4	0	0	0	0	0	111.7	I436 T491 T494	I436-A451 HydrophobicContact CB-CB 4.29Å; I436-A451 PolarHBondContact N-O 3.49Å; I436-A451 PolarHBondContact O-N 2.83Å; A451-T491 WeakPolarHBondContact CB-O 3.48Å; A451-T494 HydrophobicContact CB-CG2 3.95Å
452	H	93.9	Very high	91.9	Very high	71 Å²	71	60.3 Å²	60.3	33%	0.329	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	128.2	176.7	-73.1	-69.7	0	0	0	112	A492 T494	H452-A492 PolarHBondContact N-O 3.42Å; H452-T494 PolarHBondContact O-N 3.07Å; H452-T494 PolarHBondContact O-OG1 2.92Å
453	L	94.8	Very high	92.1	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	105.5	174.1	-73.5	59.9	0	0	0	107.5	V434 I436 V473 T475 Y485 T494	V434-L453 HydrophobicContact CB-CB 3.95Å; V434-L453 HydrophobicContact CB-CD2 4.12Å; V434-L453 HydrophobicContact CG1-CD2 3.9Å; V434-L453 PolarHBondContact N-O 3.41Å; V434-L453 WeakPolarHBondContact O-CB 3.37Å; V434-L453 PolarHBondContact O-N 2.88Å; I436-L453 HydrophobicContact CD1-CD1 3.83Å; I436-L453 HydrophobicContact CG1-CD1 3.98Å; L453-V473 HydrophobicContact CD2-CB 3.85Å; L453-V473 HydrophobicContact CD2-CG1 3.52Å; L453-T475 HydrophobicContact CD2-CG2 4.1Å; L453-Y485 HydrophobicContact CB-CD1 4.22Å; L453-Y485 HydrophobicContact CB-CD2 4.18Å; L453-Y485 HydrophobicContact CB-CE1 4.13Å; L453-Y485 HydrophobicContact CB-CE2 4.11Å; L453-Y485 HydrophobicContact CB-CG 4.24Å; L453-Y485 HydrophobicContact CD2-CD2 3.71Å; L453-Y485 HydrophobicContact CD2-CE2 4.28Å; L453-Y485 HydrophobicContact CD2-CG 3.97Å; L453-Y485 HydrophobicContact CG-CD1 4.12Å; L453-Y485 HydrophobicContact CG-CD2 3.96Å; L453-Y485 HydrophobicContact CG-CE2 4.4Å; L453-Y485 HydrophobicContact CG-CG 3.81Å; L453-T494 HydrophobicContact CD1-CG2 3.68Å; L453-T494 WeakPolarHBondContact CD1-OG1 3.36Å; L453-T494 HydrophobicContact CG-CG2 4.37Å; L453-T494 VanDerWaalsContact CG-OG1 3.28Å; L453-T494 WeakPolarHBondContact CG-OG1 3.32Å
454	N	92.7	Very high	92.5	Very high	64 Å²	64	55.8 Å²	55.8	34%	0.342	30%	0.303	S	S	.	.			trans	-103.2	161.8	-170.5	-74.4	-29.4	0	0	0	112.6	Y485 E493	N454-Y485 WeakPolarHBondContact O-CE1 3.46Å; N454-Y485 PolarHBondContact O-OH 3.01Å; N454-E493 PolarHBondContact ND2-OE1 3.09Å
455	G	91.2	Very high	93	Very high	58 Å²	58	47.6 Å²	47.6	60%	0.598	27%	0.268	S	S	*	.			trans	106.9	10.9	173.1	0	0	0	0	0	116.6	R483	G455-R483 PolarHBondContact O-NE 3.42Å; G455-R483 PolarHBondContact O-NH2 3.25Å
456	H	95.2	Very high	93.6	Very high	16 Å²	16	44 Å²	44	7%	0.074	25%	0.246	C	C	.	.			trans	-85.4	131.8	170.8	-52.1	-66.1	0	0	0	111.5	I460 T475 R483	H456-I460 HydrophobicContact CB-CD1 4.19Å; H456-I460 HydrophobicContact CB-CG1 4.29Å; H456-T475 PolarHBondContact CE1-OG1 3.39Å; H456-R483 PolarHBondContact ND1-NH1 3.39Å
457	A	93.8	Very high	94.1	Very high	67 Å²	67	39.3 Å²	39.3	55%	0.554	23%	0.227	S	C	*	.	S	Bend	trans	-90.3	-29.5	178.4	0	0	0	0	0	113	D479	A457-D479 HydrophobicContact CB-CB 3.98Å; A457-D479 PolarHBondContact N-OD2 2.91Å
458	L	93.5	Very high	94.2	Very high	90 Å²	90	41.2 Å²	41.2	47%	0.471	24%	0.24	S	C	.	.	S	Bend	trans	-127.7	-170.3	-176.8	-63.5	179.8	0	0	0	111.3	I460 C477 L478 D479	L458-I460 PolarHBondContact O-N 3.02Å; L458-C477 VanDerWaalsContact C-SG 3.57Å; L458-C477 PolarHBondContact O-SG 2.91Å; L458-L478 HydrophobicContact CB-CB 4.27Å; L458-D479 HydrophobicContact CB-CB 4.09Å; L458-D479 HydrophobicContact CD1-CB 4.27Å; L458-D479 HydrophobicContact CG-CB 4.13Å
459	T	92.7	Very high	94.4	Very high	56 Å²	56	34.5 Å²	34.5	34%	0.344	21%	0.214	S	C	.	.			trans	-65.8	130.3	-177.3	-37.5	0	0	0	0	112.3	S431 C477 L478	S431-T459 WeakPolarHBondContact O-CA 3.48Å; T459-C477 PolarHBondContact O-SG 2.61Å; T459-L478 WeakPolarHBondContact O-CG 3.23Å; T459-L478 PolarHBondContact O-N 3.37Å
460	I	95.1	Very high	94.4	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.01	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	138.1	168.3	-58.9	104.5	0	0	0	109.5	A429 R432 T433 V434 H456 L458 S462 S476	A429-I460 HydrophobicContact CB-CB 4.35Å; A429-I460 HydrophobicContact CB-CG2 3.71Å; R432-I460 VanDerWaalsContact C-CD1 3.46Å; T433-I460 WeakPolarHBondContact O-CD1 3.27Å; V434-I460 HydrophobicContact CG2-CB 4.34Å; V434-I460 HydrophobicContact CG2-CD1 3.95Å; V434-I460 HydrophobicContact CG2-CG1 3.82Å; V434-I460 HydrophobicContact CG2-CG2 3.93Å; H456-I460 HydrophobicContact CB-CD1 4.19Å; H456-I460 HydrophobicContact CB-CG1 4.29Å; L458-I460 PolarHBondContact O-N 3.02Å; I460-S462 VanDerWaalsContact CG2-O 3.25Å; I460-S462 WeakPolarHBondContact CG2-O 3.33Å; I460-S476 CarbonylContact C-O 3.5Å; I460-S476 WeakPolarHBondContact CA-O 3.4Å; I460-S476 VanDerWaalsContact CG2-O 3.3Å; I460-S476 WeakPolarHBondContact CG2-O 3.17Å
461	T	94.4	Very high	94.5	Very high	23 Å²	23	33.7 Å²	33.7	14%	0.141	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-41.1	177.3	59	0	0	0	0	111.6	S476 L478 K512 L513	T461-S476 PolarHBondContact N-O 2.87Å; T461-S476 WeakPolarHBondContact OG1-CB 3.41Å; T461-S476 PolarHBondContact OG1-O 3.25Å; T461-L478 HydrophobicContact CG2-CD2 3.56Å; T461-L478 HydrophobicContact CG2-CG 3.82Å; T461-K512 HydrophobicContact CG2-CB 3.78Å; T461-K512 HydrophobicContact CG2-CG 4.22Å; T461-L513 WeakPolarHBondContact CB-O 3.24Å; T461-L513 PolarHBondContact OG1-O 3.13Å
462	S	95.9	Very high	94.6	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.007	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	157	175.3	63.8	0	0	0	0	112.6	I460 Y464 T475 S476 S514	I460-S462 VanDerWaalsContact CG2-O 3.25Å; I460-S462 WeakPolarHBondContact CG2-O 3.33Å; S462-Y464 VanDerWaalsContact CB-CE2 3.41Å; S462-T475 WeakPolarHBondContact O-CA 3.46Å; S462-S476 PolarHBondContact O-N 2.94Å; S462-S476 WeakPolarHBondContact OG-CB 3.47Å; S462-S476 PolarHBondContact OG-OG 3.17Å; S462-S514 VanDerWaalsContact OG-CB 3.27Å; S462-S514 WeakPolarHBondContact OG-CB 3.44Å
463	A	97.6	Very high	94.8	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	132.7	166.9	0	0	0	0	0	108.5	V427 A429 V434 V473 L474 T475	V427-A463 HydrophobicContact CG1-CB 4.47Å; V427-A463 HydrophobicContact CG2-CB 4.09Å; A429-A463 HydrophobicContact CB-CB 3.94Å; V434-A463 HydrophobicContact CG1-CB 3.65Å; V434-A463 HydrophobicContact CG2-CB 4.25Å; A463-V473 HydrophobicContact CB-CG1 4.48Å; A463-L474 CarbonylContact C-O 3.57Å; A463-L474 VanDerWaalsContact CA-O 3.27Å; A463-L474 WeakPolarHBondContact CA-O 3.43Å; A463-T475 HydrophobicContact CB-CG2 4.08Å
464	Y	97.9	Very high	94.9	Very high	60 Å²	60	32.9 Å²	32.9	24%	0.235	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	138	-175.6	-59.6	-63.7	0	0	0	111.6	C415 D417 S462 V473 L474 A515 V516 W517	C415-Y464 WeakPolarHBondContact SG-CE1 3.49Å; D417-Y464 HydrophobicContact CB-CD1 3.98Å; D417-Y464 VanDerWaalsContact OD2-CA 3.27Å; D417-Y464 WeakPolarHBondContact OD2-CA 3.3Å; S462-Y464 VanDerWaalsContact CB-CE2 3.41Å; Y464-V473 WeakPolarHBondContact O-CA 3.39Å; Y464-L474 PolarHBondContact N-O 2.96Å; Y464-L474 PolarHBondContact O-N 2.89Å; Y464-A515 WeakPolarHBondContact CD2-O 3.4Å; Y464-V516 HydrophobicContact CE2-CG2 4Å; Y464-W517 PolarHBondContact O-NE1 2.85Å
465	F	97.8	Very high	95.2	Very high	6 Å²	6	29.8 Å²	29.8	3%	0.026	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	152.2	168.9	-74.3	-75.5	0	0	0	111	D417 H419 V427 I436 G470 R472 V473 W517	D417-F465 PolarHBondContact OD2-N 3.12Å; H419-F465 HydrophobicContact CB-CD1 4.35Å; H419-F465 HydrophobicContact CB-CD2 4.04Å; H419-F465 HydrophobicContact CB-CE1 4.2Å; H419-F465 HydrophobicContact CB-CE2 3.85Å; H419-F465 HydrophobicContact CB-CG 4.28Å; H419-F465 HydrophobicContact CB-CZ 3.94Å; V427-F465 HydrophobicContact CB-CD2 4.31Å; V427-F465 HydrophobicContact CB-CE2 3.64Å; V427-F465 HydrophobicContact CB-CZ 3.89Å; V427-F465 HydrophobicContact CG1-CD2 3.76Å; V427-F465 HydrophobicContact CG1-CE2 3.58Å; V427-F465 HydrophobicContact CG1-CZ 4.26Å; I436-F465 HydrophobicContact CD1-CE1 4.19Å; I436-F465 HydrophobicContact CD1-CZ 4.29Å; I436-F465 HydrophobicContact CG1-CZ 4.37Å; I436-F465 HydrophobicContact CG2-CZ 4.37Å; F465-G470 WeakPolarHBondContact CD1-O 3.5Å; F465-R472 CarbonylContact C-O 3.59Å; F465-R472 WeakPolarHBondContact CA-O 3.5Å; F465-V473 HydrophobicContact CD1-CG2 3.39Å; F465-V473 HydrophobicContact CE1-CG2 3.53Å; F465-V473 HydrophobicContact CG-CG2 4.11Å; F465-V473 HydrophobicContact CZ-CG2 4.36Å; F465-W517 PolarHBondContact O-NE1 2.79Å; F465-W517 VanDerWaalsContact O-NE1 3.14Å
466	S	96.8	Very high	95.5	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.154	C	C	.	.			trans	-66.4	135.4	170.4	60.5	0	0	0	0	110.2	P420 C468 G470 N471 R472 E522	P420-S466 WeakPolarHBondContact CG-O 3.26Å; S466-C468 PolarHBondContact O-N 3.32Å; S466-G470 WeakPolarHBondContact O-CA 3.34Å; S466-G470 PolarHBondContact O-N 2.94Å; S466-G470 PolarHBondContact OG-N 3.42Å; S466-N471 PolarHBondContact OG-N 2.87Å; S466-R472 PolarHBondContact N-O 3.17Å; S466-R472 PolarHBondContact OG-N 3.28Å; S466-R472 PolarHBondContact OG-O 3.02Å; S466-E522 WeakPolarHBondContact CB-OE1 3.27Å; S466-E522 PolarHBondContact OG-OE1 3.1Å
467	P	93.2	Very high	95.5	Very high	38 Å²	38	26.3 Å²	26.3	25%	0.247	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-29.8	-153.1	24.7	-35.7	0	0	0	115.4	P420 W517 D518 E522	P420-P467 VanDerWaalsContact CB-O 3.27Å; P420-P467 WeakPolarHBondContact CB-O 3.07Å; P420-P467 WeakPolarHBondContact CG-O 3.45Å; P467-W517 HydrophobicContact CG-CB 4.2Å; P467-D518 WeakPolarHBondContact CG-O 3.3Å; P467-E522 WeakPolarHBondContact CD-OE2 3.25Å
468	C	90.8	Very high	95.6	Very high	47 Å²	47	24.6 Å²	24.6	32%	0.318	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-40.7	-173.8	-55	0	0	0	0	112.1	S466 E522	S466-C468 PolarHBondContact O-N 3.32Å; C468-E522 WeakPolarHBondContact CA-OE2 3.44Å; C468-E522 WeakPolarHBondContact CB-OE2 3.19Å; C468-E522 PolarHBondContact N-OE2 3.02Å
469	T	93.4	Very high	95.6	Very high	45 Å²	45	21.4 Å²	21.4	28%	0.276	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-27.4	-177	80.1	0	0	0	0	114.7	H419 N471 E522	H419-T469 PolarHBondContact CE1-O 2.76Å; T469-N471 WeakPolarHBondContact CB-ND2 3.26Å; T469-N471 PolarHBondContact O-N 2.84Å; T469-N471 VanDerWaalsContact OG1-CB 3.27Å; T469-N471 WeakPolarHBondContact OG1-CB 3.29Å; T469-N471 PolarHBondContact OG1-N 2.86Å; T469-N471 PolarHBondContact OG1-ND2 2.68Å; T469-N471 VanDerWaalsContact OG1-ND2 3.07Å; T469-E522 VanDerWaalsContact CB-OE1 3.28Å; T469-E522 WeakPolarHBondContact CB-OE1 3.39Å; T469-E522 HydrophobicContact CG2-CG 4.21Å; T469-E522 PolarHBondContact N-OE1 2.94Å; T469-E522 VanDerWaalsContact N-OE1 3.1Å; T469-E522 PolarHBondContact N-OE2 3Å; T469-E522 PolarHBondContact OG1-OE1 2.86Å
470	G	94.4	Very high	95.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.109	C	C	.	.			trans	70.2	2.5	-171	0	0	0	0	0	115.1	F465 S466 R472 T487	F465-G470 WeakPolarHBondContact CD1-O 3.5Å; S466-G470 WeakPolarHBondContact O-CA 3.34Å; S466-G470 PolarHBondContact O-N 2.94Å; S466-G470 PolarHBondContact OG-N 3.42Å; G470-R472 PolarHBondContact O-N 3.2Å; G470-R472 VanDerWaalsContact O-N 3.13Å; G470-T487 PolarHBondContact O-OG1 2.72Å
471	N	95.3	Very high	95.8	Very high	63 Å²	63	23.3 Å²	23.3	34%	0.337	12%	0.122	S	C	.	.			trans	-70.1	-4.6	-179.3	-69.5	-34	0	0	0	114	S466 T469 T487 S488	S466-N471 PolarHBondContact OG-N 2.87Å; T469-N471 WeakPolarHBondContact CB-ND2 3.26Å; T469-N471 PolarHBondContact O-N 2.84Å; T469-N471 VanDerWaalsContact OG1-CB 3.27Å; T469-N471 WeakPolarHBondContact OG1-CB 3.29Å; T469-N471 PolarHBondContact OG1-N 2.86Å; T469-N471 PolarHBondContact OG1-ND2 2.68Å; T469-N471 VanDerWaalsContact OG1-ND2 3.07Å; N471-T487 CarbonylContact O-C 3.36Å; N471-T487 PolarHBondContact O-N 3.02Å; N471-T487 PolarHBondContact O-OG1 3.39Å; N471-S488 PolarHBondContact O-N 2.73Å; N471-S488 VanDerWaalsContact O-N 3.15Å; N471-S488 WeakPolarHBondContact OD1-CA 3.47Å
472	R	96.2	Very high	96	Very high	54 Å²	54	22.2 Å²	22.2	20%	0.204	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	150.6	173.5	-74.4	169.6	-81	-136.6	20.1	111.6	F465 S466 G470 I484 Y485 T487 I497 W517 E541	F465-R472 CarbonylContact C-O 3.59Å; F465-R472 WeakPolarHBondContact CA-O 3.5Å; S466-R472 PolarHBondContact N-O 3.17Å; S466-R472 PolarHBondContact OG-N 3.28Å; S466-R472 PolarHBondContact OG-O 3.02Å; G470-R472 PolarHBondContact O-N 3.2Å; G470-R472 VanDerWaalsContact O-N 3.13Å; R472-I484 HydrophobicContact CB-CG2 4.31Å; R472-I484 HydrophobicContact CG-CG2 4.46Å; R472-Y485 VanDerWaalsContact CA-O 3.26Å; R472-Y485 WeakPolarHBondContact CA-O 3.11Å; R472-T487 WeakPolarHBondContact CA-OG1 3.48Å; R472-T487 PolarHBondContact N-OG1 3.14Å; R472-T487 VanDerWaalsContact N-OG1 3.17Å; R472-I497 HydrophobicContact CG-CD1 3.77Å; R472-W517 HydrophobicContact CB-CH2 4.37Å; R472-W517 HydrophobicContact CB-CZ2 4.19Å; R472-E541 WeakPolarHBondContact CD-OE2 3.32Å; R472-E541 VanDerWaalsContact CZ-CD 3.49Å; R472-E541 IonicContact CZ-OE1 3.51Å; R472-E541 IonicContact CZ-OE2 3.46Å; R472-E541 IonicContact NE-OE2 2.9Å; R472-E541 PolarHBondContact NE-OE2 2.91Å; R472-E541 IonicContact NH1-OE1 2.81Å; R472-E541 PolarHBondContact NH1-OE1 2.82Å; R472-E541 IonicContact NH1-OE2 3.35Å; R472-E541 PolarHBondContact NH1-OE2 3.36Å; R472-E541 IonicContact NH2-OE1 3.47Å; R472-E541 IonicContact NH2-OE2 2.72Å; R472-E541 PolarHBondContact NH2-OE2 2.97Å; R472-E541 VanDerWaalsContact NH2-OE2 3.12Å
473	V	97.8	Very high	96.1	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	122.1	170	172.6	0	0	0	0	110.8	V427 I436 L453 A463 Y464 F465 T475 I484 Y485 T487	V427-V473 HydrophobicContact CG2-CG1 4.3Å; I436-V473 HydrophobicContact CD1-CG2 4.45Å; L453-V473 HydrophobicContact CD2-CB 3.85Å; L453-V473 HydrophobicContact CD2-CG1 3.52Å; A463-V473 HydrophobicContact CB-CG1 4.48Å; Y464-V473 WeakPolarHBondContact O-CA 3.39Å; F465-V473 HydrophobicContact CD1-CG2 3.39Å; F465-V473 HydrophobicContact CE1-CG2 3.53Å; F465-V473 HydrophobicContact CG-CG2 4.11Å; F465-V473 HydrophobicContact CZ-CG2 4.36Å; V473-T475 HydrophobicContact CG1-CG2 3.9Å; V473-I484 WeakPolarHBondContact O-CA 3.35Å; V473-Y485 PolarHBondContact N-O 2.97Å; V473-Y485 PolarHBondContact O-N 2.93Å; V473-T487 HydrophobicContact CB-CG2 4.25Å; V473-T487 HydrophobicContact CG2-CG2 3.71Å
474	L	98.1	Very high	96.1	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	131.7	171.6	178.7	65.2	0	0	0	109.3	A463 Y464 I482 I484 A515 W517 F525	A463-L474 CarbonylContact C-O 3.57Å; A463-L474 VanDerWaalsContact CA-O 3.27Å; A463-L474 WeakPolarHBondContact CA-O 3.43Å; Y464-L474 PolarHBondContact N-O 2.96Å; Y464-L474 PolarHBondContact O-N 2.89Å; L474-I482 HydrophobicContact CD1-CG2 3.47Å; L474-I482 VanDerWaalsContact CD1-CG2 3.47Å; L474-I484 HydrophobicContact CD1-CD1 4.41Å; L474-I484 HydrophobicContact CD1-CG1 3.9Å; L474-A515 HydrophobicContact CD1-CB 4.21Å; L474-A515 HydrophobicContact CD2-CB 3.83Å; L474-A515 HydrophobicContact CG-CB 4.13Å; L474-W517 HydrophobicContact CB-CD2 4.34Å; L474-W517 VanDerWaalsContact CB-CE2 3.46Å; L474-W517 HydrophobicContact CB-CH2 4.46Å; L474-W517 HydrophobicContact CB-CZ2 3.57Å; L474-W517 HydrophobicContact CD2-CD2 4.1Å; L474-W517 HydrophobicContact CD2-CG 4.25Å; L474-F525 HydrophobicContact CD1-CD1 4.2Å; L474-F525 HydrophobicContact CD1-CD2 4.13Å; L474-F525 HydrophobicContact CD1-CE1 4.27Å; L474-F525 HydrophobicContact CD1-CE2 4.17Å; L474-F525 HydrophobicContact CD1-CG 4.13Å; L474-F525 HydrophobicContact CD1-CZ 4.22Å; L474-F525 HydrophobicContact CD2-CB 3.66Å; L474-F525 HydrophobicContact CD2-CD1 4.45Å; L474-F525 HydrophobicContact CD2-CD2 4.03Å; L474-F525 HydrophobicContact CD2-CG 3.79Å
475	T	97.9	Very high	96	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	141.1	179.5	60.6	0	0	0	0	110.9	V434 L453 H456 S462 A463 V473 I482 R483 Y485	V434-T475 HydrophobicContact CG2-CG2 4.1Å; L453-T475 HydrophobicContact CD2-CG2 4.1Å; H456-T475 PolarHBondContact CE1-OG1 3.39Å; S462-T475 WeakPolarHBondContact O-CA 3.46Å; A463-T475 HydrophobicContact CB-CG2 4.08Å; V473-T475 HydrophobicContact CG1-CG2 3.9Å; T475-I482 WeakPolarHBondContact O-CA 3.37Å; T475-R483 PolarHBondContact N-O 3.01Å; T475-R483 PolarHBondContact O-N 3.4Å; T475-R483 WeakPolarHBondContact OG1-CB 3.48Å; T475-R483 PolarHBondContact OG1-O 3.29Å; T475-Y485 HydrophobicContact CG2-CD2 4.1Å; T475-Y485 HydrophobicContact CG2-CE2 3.95Å
476	S	97.1	Very high	95.9	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	128.2	178.5	-68.8	0	0	0	0	110.2	I460 T461 S462 A515	I460-S476 CarbonylContact C-O 3.5Å; I460-S476 WeakPolarHBondContact CA-O 3.4Å; I460-S476 VanDerWaalsContact CG2-O 3.3Å; I460-S476 WeakPolarHBondContact CG2-O 3.17Å; T461-S476 PolarHBondContact N-O 2.87Å; T461-S476 WeakPolarHBondContact OG1-CB 3.41Å; T461-S476 PolarHBondContact OG1-O 3.25Å; S462-S476 PolarHBondContact O-N 2.94Å; S462-S476 WeakPolarHBondContact OG-CB 3.47Å; S462-S476 PolarHBondContact OG-OG 3.17Å; S476-A515 WeakPolarHBondContact OG-CB 3.38Å; S476-A515 PolarHBondContact OG-N 3.21Å
477	C	96	Very high	95.8	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	147.7	-176.2	-172.3	0	0	0	0	112.4	L458 T459 D479 N480 H481 M504	L458-C477 VanDerWaalsContact C-SG 3.57Å; L458-C477 PolarHBondContact O-SG 2.91Å; T459-C477 PolarHBondContact O-SG 2.61Å; C477-D479 VanDerWaalsContact CB-OD1 3.3Å; C477-D479 WeakPolarHBondContact CB-OD1 3.29Å; C477-D479 PolarHBondContact O-N 2.89Å; C477-D479 VanDerWaalsContact O-N 3.13Å; C477-D479 PolarHBondContact SG-OD1 2.87Å; C477-D479 PolarHBondContact SG-OD2 3.18Å; C477-D479 VanDerWaalsContact SG-OD2 3.42Å; C477-N480 PolarHBondContact O-N 3.23Å; C477-H481 PolarHBondContact N-O 2.94Å; C477-M504 WeakPolarHBondContact O-CB 3.47Å; C477-M504 WeakPolarHBondContact O-CG 3.47Å
478	L	94.8	Very high	95.7	Very high	32 Å²	32	23.8 Å²	23.8	17%	0.168	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-0.5	175.6	-62	-178.1	0	0	0	113.9	L458 T459 T461 N480 M504 K512	L458-L478 HydrophobicContact CB-CB 4.27Å; T459-L478 WeakPolarHBondContact O-CG 3.23Å; T459-L478 PolarHBondContact O-N 3.37Å; T461-L478 HydrophobicContact CG2-CD2 3.56Å; T461-L478 HydrophobicContact CG2-CG 3.82Å; L478-N480 PolarHBondContact O-N 2.87Å; L478-M504 WeakPolarHBondContact CD2-O 3.39Å; L478-K512 HydrophobicContact CD2-CD 4.24Å
479	D	94.6	Very high	95.6	Very high	22 Å²	22	25.3 Å²	25.3	12%	0.118	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	19.9	170.9	67.2	14.3	0	0	0	114	A457 L458 C477 H481 R483	A457-D479 HydrophobicContact CB-CB 3.98Å; A457-D479 PolarHBondContact N-OD2 2.91Å; L458-D479 HydrophobicContact CB-CB 4.09Å; L458-D479 HydrophobicContact CD1-CB 4.27Å; L458-D479 HydrophobicContact CG-CB 4.13Å; C477-D479 VanDerWaalsContact CB-OD1 3.3Å; C477-D479 WeakPolarHBondContact CB-OD1 3.29Å; C477-D479 PolarHBondContact O-N 2.89Å; C477-D479 VanDerWaalsContact O-N 3.13Å; C477-D479 PolarHBondContact SG-OD1 2.87Å; C477-D479 PolarHBondContact SG-OD2 3.18Å; C477-D479 VanDerWaalsContact SG-OD2 3.42Å; D479-H481 PolarHBondContact O-N 2.81Å; D479-H481 PolarHBondContact O-ND1 3.01Å; D479-H481 PolarHBondContact OD1-N 3.45Å; D479-R483 VanDerWaalsContact CG-NH2 3.33Å; D479-R483 IonicContact OD1-CZ 3.36Å; D479-R483 IonicContact OD1-NH1 3.27Å; D479-R483 PolarHBondContact OD1-NH1 2.82Å; D479-R483 IonicContact OD1-NH2 3.16Å; D479-R483 PolarHBondContact OD1-NH2 2.83Å; D479-R483 IonicContact OD2-CZ 3.22Å; D479-R483 IonicContact OD2-NH1 2.51Å; D479-R483 PolarHBondContact OD2-NH1 2.94Å; D479-R483 IonicContact OD2-NH2 2.83Å; D479-R483 PolarHBondContact OD2-NH2 2.79Å
480	N	96	Very high	95.2	Very high	38 Å²	38	25.3 Å²	25.3	20%	0.203	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	31.5	179.2	-70.4	-7.6	0	0	0	114.4	C477 L478 S501 H502 M504 Q505	C477-N480 PolarHBondContact O-N 3.23Å; L478-N480 PolarHBondContact O-N 2.87Å; N480-S501 WeakPolarHBondContact O-CA 3.21Å; N480-S501 PolarHBondContact O-OG 3.47Å; N480-H502 CarbonylContact C-O 3.48Å; N480-H502 WeakPolarHBondContact CA-O 3.25Å; N480-H502 WeakPolarHBondContact CB-O 3.16Å; N480-H502 PolarHBondContact O-N 3Å; N480-M504 PolarHBondContact OD1-N 3.11Å; N480-Q505 PolarHBondContact ND2-NE2 2.75Å; N480-Q505 WeakPolarHBondContact OD1-CG 3.37Å
481	H	96.6	Very high	94.7	Very high	60 Å²	60	28.7 Å²	28.7	28%	0.278	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	129	173.5	-66.9	83.9	0	0	0	112.1	C477 D479 R483 S499 I500	C477-H481 PolarHBondContact N-O 2.94Å; D479-H481 PolarHBondContact O-N 2.81Å; D479-H481 PolarHBondContact O-ND1 3.01Å; D479-H481 PolarHBondContact OD1-N 3.45Å; H481-R483 PolarHBondContact O-NH1 3.41Å; H481-S499 PolarHBondContact CD2-OG 2.9Å; H481-S499 VanDerWaalsContact CD2-OG 3.29Å; H481-I500 WeakPolarHBondContact CA-O 3.36Å
482	I	97.6	Very high	94.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	131.9	163.7	-62	164.2	0	0	0	106.4	L474 T475 I500 H502 M504 A515 F525 V527	L474-I482 HydrophobicContact CD1-CG2 3.47Å; L474-I482 VanDerWaalsContact CD1-CG2 3.47Å; T475-I482 WeakPolarHBondContact O-CA 3.37Å; I482-I500 HydrophobicContact CB-CB 4.48Å; I482-I500 PolarHBondContact N-O 2.8Å; I482-I500 PolarHBondContact O-N 2.99Å; I482-H502 HydrophobicContact CD1-CB 3.89Å; I482-H502 HydrophobicContact CG1-CB 4.4Å; I482-M504 HydrophobicContact CG1-CE 4.25Å; I482-M504 HydrophobicContact CG1-SD 4.45Å; I482-A515 HydrophobicContact CD1-CB 4.1Å; I482-A515 HydrophobicContact CG1-CB 4.37Å; I482-A515 HydrophobicContact CG2-CB 4.07Å; I482-F525 HydrophobicContact CD1-CE2 4.36Å; I482-F525 HydrophobicContact CG2-CE2 3.95Å; I482-F525 HydrophobicContact CG2-CZ 4.13Å; I482-V527 HydrophobicContact CD1-CB 4.19Å; I482-V527 HydrophobicContact CD1-CG1 3.8Å; I482-V527 HydrophobicContact CD1-CG2 4.14Å
483	R	97.6	Very high	93.5	Very high	18 Å²	18	33 Å²	33	7%	0.068	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	144.3	-177.4	-63.9	173.3	-171.2	74.9	-10.8	111.4	G455 H456 T475 D479 H481 Y485 L496 K498	G455-R483 PolarHBondContact O-NE 3.42Å; G455-R483 PolarHBondContact O-NH2 3.25Å; H456-R483 PolarHBondContact ND1-NH1 3.39Å; T475-R483 PolarHBondContact N-O 3.01Å; T475-R483 PolarHBondContact O-N 3.4Å; T475-R483 WeakPolarHBondContact OG1-CB 3.48Å; T475-R483 PolarHBondContact OG1-O 3.29Å; D479-R483 VanDerWaalsContact CG-NH2 3.33Å; D479-R483 IonicContact OD1-CZ 3.36Å; D479-R483 IonicContact OD1-NH1 3.27Å; D479-R483 PolarHBondContact OD1-NH1 2.82Å; D479-R483 IonicContact OD1-NH2 3.16Å; D479-R483 PolarHBondContact OD1-NH2 2.83Å; D479-R483 IonicContact OD2-CZ 3.22Å; D479-R483 IonicContact OD2-NH1 2.51Å; D479-R483 PolarHBondContact OD2-NH1 2.94Å; D479-R483 IonicContact OD2-NH2 2.83Å; D479-R483 PolarHBondContact OD2-NH2 2.79Å; H481-R483 PolarHBondContact O-NH1 3.41Å; R483-Y485 HydrophobicContact CB-CD2 4.48Å; R483-Y485 HydrophobicContact CB-CE2 3.71Å; R483-Y485 VanDerWaalsContact CD-OH 3.26Å; R483-Y485 WeakPolarHBondContact CD-OH 3.34Å; R483-L496 HydrophobicContact CB-CD1 3.78Å; R483-L496 HydrophobicContact CG-CD1 4.11Å; R483-K498 CarbonylContact C-O 3.59Å; R483-K498 VanDerWaalsContact CA-O 3.28Å; R483-K498 WeakPolarHBondContact CA-O 3.13Å
484	I	97.8	Very high	93.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122	-179.1	-53.1	175.7	0	0	0	107.8	R472 V473 L474 I497 K498 I500 W517 F525 E541	R472-I484 HydrophobicContact CB-CG2 4.31Å; R472-I484 HydrophobicContact CG-CG2 4.46Å; V473-I484 WeakPolarHBondContact O-CA 3.35Å; L474-I484 HydrophobicContact CD1-CD1 4.41Å; L474-I484 HydrophobicContact CD1-CG1 3.9Å; I484-I497 HydrophobicContact CG2-CD1 4.39Å; I484-I497 WeakPolarHBondContact O-CB 3.35Å; I484-I497 PolarHBondContact O-N 2.81Å; I484-K498 HydrophobicContact CB-CB 4.49Å; I484-K498 PolarHBondContact N-O 3.28Å; I484-K498 PolarHBondContact O-N 3.4Å; I484-I500 HydrophobicContact CD1-CD1 4.32Å; I484-W517 HydrophobicContact CG2-CH2 4.25Å; I484-F525 HydrophobicContact CD1-CD1 4.37Å; I484-F525 HydrophobicContact CD1-CE1 3.66Å; I484-F525 HydrophobicContact CD1-CZ 4.32Å; I484-E541 HydrophobicContact CD1-CB 3.9Å
485	Y	97	Very high	92.8	Very high	3 Å²	3	36.9 Å²	36.9	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	148.8	-179.9	-62	-94.5	0	0	0	110.4	L453 N454 R472 V473 T475 R483 P495 L496	L453-Y485 HydrophobicContact CB-CD1 4.22Å; L453-Y485 HydrophobicContact CB-CD2 4.18Å; L453-Y485 HydrophobicContact CB-CE1 4.13Å; L453-Y485 HydrophobicContact CB-CE2 4.11Å; L453-Y485 HydrophobicContact CB-CG 4.24Å; L453-Y485 HydrophobicContact CD2-CD2 3.71Å; L453-Y485 HydrophobicContact CD2-CE2 4.28Å; L453-Y485 HydrophobicContact CD2-CG 3.97Å; L453-Y485 HydrophobicContact CG-CD1 4.12Å; L453-Y485 HydrophobicContact CG-CD2 3.96Å; L453-Y485 HydrophobicContact CG-CE2 4.4Å; L453-Y485 HydrophobicContact CG-CG 3.81Å; N454-Y485 WeakPolarHBondContact O-CE1 3.46Å; N454-Y485 PolarHBondContact O-OH 3.01Å; R472-Y485 VanDerWaalsContact CA-O 3.26Å; R472-Y485 WeakPolarHBondContact CA-O 3.11Å; V473-Y485 PolarHBondContact N-O 2.97Å; V473-Y485 PolarHBondContact O-N 2.93Å; T475-Y485 HydrophobicContact CG2-CD2 4.1Å; T475-Y485 HydrophobicContact CG2-CE2 3.95Å; R483-Y485 HydrophobicContact CB-CD2 4.48Å; R483-Y485 HydrophobicContact CB-CE2 3.71Å; R483-Y485 VanDerWaalsContact CD-OH 3.26Å; R483-Y485 WeakPolarHBondContact CD-OH 3.34Å; Y485-P495 CarbonylContact C-O 3.54Å; Y485-P495 VanDerWaalsContact CA-O 3.26Å; Y485-P495 WeakPolarHBondContact CA-O 3.31Å; Y485-L496 HydrophobicContact CD1-CB 4.22Å; Y485-L496 HydrophobicContact CD1-CD1 4.11Å; Y485-L496 HydrophobicContact CE1-CB 4.13Å; Y485-L496 HydrophobicContact CE1-CD1 3.78Å; Y485-L496 HydrophobicContact CE2-CD1 4.25Å; Y485-L496 HydrophobicContact CG-CD1 4.49Å
486	D	95.4	Very high	92.6	Very high	50 Å²	50	41.1 Å²	41.1	27%	0.267	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	127.1	168.2	-165.9	-24.5	0	0	0	109.1	S488 T494 P495 I497	D486-S488 VanDerWaalsContact OD1-CB 3.24Å; D486-S488 WeakPolarHBondContact OD1-CB 3.27Å; D486-S488 PolarHBondContact OD1-N 2.9Å; D486-S488 PolarHBondContact OD1-OG 3.22Å; D486-T494 WeakPolarHBondContact O-CB 3.3Å; D486-P495 HydrophobicContact CB-CB 4.16Å; D486-P495 HydrophobicContact CB-CG 4.23Å; D486-P495 PolarHBondContact N-O 3.38Å; D486-I497 HydrophobicContact CB-CD1 3.86Å; D486-I497 HydrophobicContact CB-CG1 3.91Å
487	T	94.4	Very high	92.5	Very high	4 Å²	4	44.6 Å²	44.6	3%	0.025	26%	0.257	C	S	.	.			trans	-127.5	13.2	176.7	49.6	0	0	0	0	112.4	I436 G470 N471 R472 V473 S489 T494	I436-T487 HydrophobicContact CD1-CG2 3.59Å; G470-T487 PolarHBondContact O-OG1 2.72Å; N471-T487 CarbonylContact O-C 3.36Å; N471-T487 PolarHBondContact O-N 3.02Å; N471-T487 PolarHBondContact O-OG1 3.39Å; R472-T487 WeakPolarHBondContact CA-OG1 3.48Å; R472-T487 PolarHBondContact N-OG1 3.14Å; R472-T487 VanDerWaalsContact N-OG1 3.17Å; V473-T487 HydrophobicContact CB-CG2 4.25Å; V473-T487 HydrophobicContact CG2-CG2 3.71Å; T487-S489 PolarHBondContact O-N 3.28Å; T487-T494 HydrophobicContact CG2-CG2 4.03Å
488	S	91.8	Very high	92.6	Very high	64 Å²	64	48.3 Å²	48.3	45%	0.448	27%	0.273	S	S	.	.	S	Bend	trans	-60.1	-24.9	172	64.9	0	0	0	0	113.1	N471 D486	N471-S488 PolarHBondContact O-N 2.73Å; N471-S488 VanDerWaalsContact O-N 3.15Å; N471-S488 WeakPolarHBondContact OD1-CA 3.47Å; D486-S488 VanDerWaalsContact OD1-CB 3.24Å; D486-S488 WeakPolarHBondContact OD1-CB 3.27Å; D486-S488 PolarHBondContact OD1-N 2.9Å; D486-S488 PolarHBondContact OD1-OG 3.22Å
489	S	87.8	Confident	92.7	Very high	78 Å²	78	49.3 Å²	49.3	55%	0.545	28%	0.283	S	S	.	.	S	Bend	trans	-130.3	121.3	167.1	-69	0	0	0	0	109.2	T487 T491	T487-S489 PolarHBondContact O-N 3.28Å; S489-T491 PolarHBondContact O-N 3.01Å
490	L	84.9	Confident	92.8	Very high	46 Å²	46	48.9 Å²	48.9	24%	0.241	28%	0.28	C	S	.	.			trans	-79.2	69.1	179.8	-65.2	177.9	0	0	0	111.4	Y425 I436 V450	Y425-L490 HydrophobicContact CD1-CD1 3.92Å; Y425-L490 HydrophobicContact CD2-CD1 3.56Å; Y425-L490 HydrophobicContact CE1-CD1 3.86Å; Y425-L490 HydrophobicContact CE2-CD1 3.47Å; Y425-L490 VanDerWaalsContact CE2-CD1 3.47Å; Y425-L490 HydrophobicContact CG-CD1 3.78Å; I436-L490 HydrophobicContact CD1-CD2 3.76Å; I436-L490 HydrophobicContact CG2-CD2 4.15Å; V450-L490 HydrophobicContact CG1-CB 4.31Å
491	T	84.6	Confident	92.8	Very high	70 Å²	70	51.2 Å²	51.2	43%	0.429	30%	0.3	S	S	.	.			trans	-75.9	152.5	170.7	48.3	0	0	0	0	111.3	A451 S489 E493	A451-T491 WeakPolarHBondContact CB-O 3.48Å; S489-T491 PolarHBondContact O-N 3.01Å; T491-E493 WeakPolarHBondContact CB-O 3.25Å; T491-E493 CarbonylContact O-C 3.56Å; T491-E493 PolarHBondContact O-N 3Å; T491-E493 VanDerWaalsContact O-N 3.1Å; T491-E493 PolarHBondContact OG1-O 3.36Å
492	A	82.5	Confident	92.8	Very high	73 Å²	73	48.6 Å²	48.6	60%	0.603	29%	0.288	S	S	*	.	S	Bend	trans	-55.2	-33.2	-175.7	0	0	0	0	0	113.8	H452	H452-A492 PolarHBondContact N-O 3.42Å
493	E	83.6	Confident	92.6	Very high	135 Å²	135	51.2 Å²	51.2	63%	0.631	30%	0.302	S	S	*	.	B	Isolated β-bridge	trans	-115.1	130.8	161	-58.5	-161.5	121.7	0	0	108.9	N454 T491	N454-E493 PolarHBondContact ND2-OE1 3.09Å; T491-E493 WeakPolarHBondContact CB-O 3.25Å; T491-E493 CarbonylContact O-C 3.56Å; T491-E493 PolarHBondContact O-N 3Å; T491-E493 VanDerWaalsContact O-N 3.1Å; T491-E493 PolarHBondContact OG1-O 3.36Å
494	T	89.2	Confident	92.5	Very high	12 Å²	12	50.3 Å²	50.3	7%	0.074	30%	0.298	C	S	.	.			trans	-89	133.8	179.3	51.9	0	0	0	0	111.3	A451 H452 L453 D486 T487	A451-T494 HydrophobicContact CB-CG2 3.95Å; H452-T494 PolarHBondContact O-N 3.07Å; H452-T494 PolarHBondContact O-OG1 2.92Å; L453-T494 HydrophobicContact CD1-CG2 3.68Å; L453-T494 WeakPolarHBondContact CD1-OG1 3.36Å; L453-T494 HydrophobicContact CG-CG2 4.37Å; L453-T494 VanDerWaalsContact CG-OG1 3.28Å; L453-T494 WeakPolarHBondContact CG-OG1 3.32Å; D486-T494 WeakPolarHBondContact O-CB 3.3Å; T487-T494 HydrophobicContact CG2-CG2 4.03Å
495	P	92.1	Very high	92.1	Very high	70 Å²	70	56.2 Å²	56.2	46%	0.455	33%	0.326	S	S	.	.			trans	-60.2	137.8	177.4	-19.8	29.6	0	0	0	112.8	Y485 D486	Y485-P495 CarbonylContact C-O 3.54Å; Y485-P495 VanDerWaalsContact CA-O 3.26Å; Y485-P495 WeakPolarHBondContact CA-O 3.31Å; D486-P495 HydrophobicContact CB-CB 4.16Å; D486-P495 HydrophobicContact CB-CG 4.23Å; D486-P495 PolarHBondContact N-O 3.38Å
496	L	94.4	Very high	91.5	Very high	89 Å²	89	56.4 Å²	56.4	47%	0.466	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	108.5	171.9	177.6	68.6	0	0	0	109.8	R483 Y485 K498	R483-L496 HydrophobicContact CB-CD1 3.78Å; R483-L496 HydrophobicContact CG-CD1 4.11Å; Y485-L496 HydrophobicContact CD1-CB 4.22Å; Y485-L496 HydrophobicContact CD1-CD1 4.11Å; Y485-L496 HydrophobicContact CE1-CB 4.13Å; Y485-L496 HydrophobicContact CE1-CD1 3.78Å; Y485-L496 HydrophobicContact CE2-CD1 4.25Å; Y485-L496 HydrophobicContact CG-CD1 4.49Å; L496-K498 WeakPolarHBondContact CD1-O 3.1Å
497	I	94.6	Very high	91	Very high	72 Å²	72	56.3 Å²	56.3	37%	0.369	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-48.4	176.2	-58.5	172.4	0	0	0	110.1	R472 I484 D486	R472-I497 HydrophobicContact CG-CD1 3.77Å; I484-I497 HydrophobicContact CG2-CD1 4.39Å; I484-I497 WeakPolarHBondContact O-CB 3.35Å; I484-I497 PolarHBondContact O-N 2.81Å; D486-I497 HydrophobicContact CB-CD1 3.86Å; D486-I497 HydrophobicContact CB-CG1 3.91Å
498	K	96.6	Very high	90.5	Very high	79 Å²	79	63.7 Å²	63.7	34%	0.343	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	141.9	-174.6	-157.7	75	-170.3	-157.6	0	113	R483 I484 L496 I500 E541 S542	R483-K498 CarbonylContact C-O 3.59Å; R483-K498 VanDerWaalsContact CA-O 3.28Å; R483-K498 WeakPolarHBondContact CA-O 3.13Å; I484-K498 HydrophobicContact CB-CB 4.49Å; I484-K498 PolarHBondContact N-O 3.28Å; I484-K498 PolarHBondContact O-N 3.4Å; L496-K498 WeakPolarHBondContact CD1-O 3.1Å; K498-I500 HydrophobicContact CG-CD1 4.22Å; K498-I500 HydrophobicContact CG-CG1 3.77Å; K498-E541 WeakPolarHBondContact CB-O 3.49Å; K498-S542 WeakPolarHBondContact CD-O 3.42Å; K498-S542 WeakPolarHBondContact CE-O 3.42Å; K498-S542 PolarHBondContact NZ-O 3.14Å
499	S	97.1	Very high	90.2	Very high	52 Å²	52	69.3 Å²	69.3	36%	0.364	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134	160.6	-172.2	0	0	0	0	109	H481	H481-S499 PolarHBondContact CD2-OG 2.9Å; H481-S499 VanDerWaalsContact CD2-OG 3.29Å
500	I	97.4	Very high	90.3	Very high	13 Å²	13	67.1 Å²	67.1	7%	0.067	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	118.8	-173.5	-58.3	164.2	0	0	0	107.5	H481 I482 I484 K498 H502 F525 F539	H481-I500 WeakPolarHBondContact CA-O 3.36Å; I482-I500 HydrophobicContact CB-CB 4.48Å; I482-I500 PolarHBondContact N-O 2.8Å; I482-I500 PolarHBondContact O-N 2.99Å; I484-I500 HydrophobicContact CD1-CD1 4.32Å; K498-I500 HydrophobicContact CG-CD1 4.22Å; K498-I500 HydrophobicContact CG-CG1 3.77Å; I500-H502 PolarHBondContact O-N 3.3Å; I500-F525 HydrophobicContact CD1-CE1 4.26Å; I500-F525 HydrophobicContact CD1-CZ 3.7Å; I500-F539 HydrophobicContact CG2-CD1 4.42Å; I500-F539 HydrophobicContact CG2-CE1 4.19Å
501	S	96.6	Very high	90.7	Very high	87 Å²	87	65.2 Å²	65.2	61%	0.608	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.4	179.7	-166.4	0	0	0	0	111.4	N480	N480-S501 WeakPolarHBondContact O-CA 3.21Å; N480-S501 PolarHBondContact O-OG 3.47Å
502	H	96.1	Very high	91.1	Very high	5 Å²	5	66.2 Å²	66.2	2%	0.023	35%	0.348	C	S	.	.			trans	-148.7	144.3	-178.6	-175	-78.9	0	0	0	109.9	N480 I482 I500 M504 L513 G528 S529 E537	N480-H502 CarbonylContact C-O 3.48Å; N480-H502 WeakPolarHBondContact CA-O 3.25Å; N480-H502 WeakPolarHBondContact CB-O 3.16Å; N480-H502 PolarHBondContact O-N 3Å; I482-H502 HydrophobicContact CD1-CB 3.89Å; I482-H502 HydrophobicContact CG1-CB 4.4Å; I500-H502 PolarHBondContact O-N 3.3Å; H502-M504 PolarHBondContact ND1-SD 3.07Å; H502-M504 VanDerWaalsContact ND1-SD 3.39Å; H502-M504 PolarHBondContact O-N 3.28Å; H502-L513 WeakPolarHBondContact CE1-CD1 3.26Å; H502-G528 PolarHBondContact CE1-O 2.88Å; H502-G528 PolarHBondContact NE2-O 3.36Å; H502-S529 WeakPolarHBondContact CE1-CA 3.19Å; H502-S529 VanDerWaalsContact NE2-CA 3.3Å; H502-S529 WeakPolarHBondContact NE2-CA 3.49Å; H502-S529 WeakPolarHBondContact NE2-CB 3.16Å; H502-S529 PolarHBondContact NE2-OG 3.32Å; H502-E537 IonicContact CD2-OE2 2.63Å; H502-E537 PolarHBondContact CD2-OE2 3.18Å; H502-E537 VanDerWaalsContact CD2-OE2 3.27Å; H502-E537 IonicContact NE2-OE2 2.7Å; H502-E537 PolarHBondContact NE2-OE2 2.86Å
503	D	94.1	Very high	91.7	Very high	55 Å²	55	62.8 Å²	62.8	29%	0.294	32%	0.319	S	S	.	.			trans	-80.5	106.6	-178	180	13.6	0	0	0	111.6	Q505 M530	D503-Q505 WeakPolarHBondContact OD1-CB 2.98Å; D503-Q505 PolarHBondContact OD1-N 3.48Å; D503-M530 HydrophobicContact CB-CB 3.99Å; D503-M530 VanDerWaalsContact O-CG 3.25Å; D503-M530 WeakPolarHBondContact O-CG 3.22Å; D503-M530 WeakPolarHBondContact OD2-CB 3.49Å
504	M	93.7	Very high	92.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.295	C	S	.	.			trans	-101.9	5.6	-177.8	-57.5	-61	-92.1	0	0	112.5	C477 L478 N480 I482 H502 T506 L513 V527	C477-M504 WeakPolarHBondContact O-CB 3.47Å; C477-M504 WeakPolarHBondContact O-CG 3.47Å; L478-M504 WeakPolarHBondContact CD2-O 3.39Å; N480-M504 PolarHBondContact OD1-N 3.11Å; I482-M504 HydrophobicContact CG1-CE 4.25Å; I482-M504 HydrophobicContact CG1-SD 4.45Å; H502-M504 PolarHBondContact ND1-SD 3.07Å; H502-M504 VanDerWaalsContact ND1-SD 3.39Å; H502-M504 PolarHBondContact O-N 3.28Å; M504-T506 VanDerWaalsContact C-N 3.25Å; M504-T506 PolarHBondContact O-N 2.9Å; M504-L513 HydrophobicContact CE-CB 3.77Å; M504-L513 WeakPolarHBondContact CE-O 3.24Å; M504-L513 HydrophobicContact SD-CB 3.85Å; M504-L513 HydrophobicContact SD-CD1 4.21Å; M504-V527 HydrophobicContact CE-CG2 4.33Å; M504-V527 HydrophobicContact SD-CG2 4.27Å
505	Q	89.4	Confident	92.6	Very high	124 Å²	124	56.7 Å²	56.7	58%	0.579	29%	0.292	S	S	*	.			trans	-81.6	60.9	-172.3	-66.2	-174	21.7	0	0	114.1	N480 D503 G507	N480-Q505 PolarHBondContact ND2-NE2 2.75Å; N480-Q505 WeakPolarHBondContact OD1-CG 3.37Å; D503-Q505 WeakPolarHBondContact OD1-CB 2.98Å; D503-Q505 PolarHBondContact OD1-N 3.48Å; Q505-G507 PolarHBondContact O-N 2.92Å
506	T	84.8	Confident	92.8	Very high	6 Å²	6	55 Å²	55	4%	0.037	28%	0.28	C	S	.	.			trans	-62	-7	178.6	54.4	0	0	0	0	116.3	M504 L510 S511 K512 L513 M530	M504-T506 VanDerWaalsContact C-N 3.25Å; M504-T506 PolarHBondContact O-N 2.9Å; T506-L510 WeakPolarHBondContact O-CB 3.4Å; T506-S511 VanDerWaalsContact CB-O 3.27Å; T506-S511 WeakPolarHBondContact CB-O 3.38Å; T506-S511 WeakPolarHBondContact CG2-O 3.38Å; T506-S511 PolarHBondContact OG1-O 2.86Å; T506-K512 WeakPolarHBondContact OG1-CD 3.02Å; T506-K512 PolarHBondContact OG1-NZ 3.44Å; T506-L513 HydrophobicContact CG2-CB 4.12Å; T506-L513 HydrophobicContact CG2-CD1 3.8Å; T506-L513 HydrophobicContact CG2-CG 3.63Å; T506-M530 HydrophobicContact CG2-CG 4.47Å; T506-M530 HydrophobicContact CG2-SD 3.93Å
507	G	86.1	Confident	93	Very high	48 Å²	48	51.2 Å²	51.2	50%	0.495	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.7	-147.4	178.5	0	0	0	0	0	114.6	Q505 K512	Q505-G507 PolarHBondContact O-N 2.92Å; G507-K512 PolarHBondContact O-NZ 3.43Å
508	R	83.7	Confident	93	Very high	159 Å²	159	47.9 Å²	47.9	60%	0.6	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-28.3	-179.2	-174.7	179.5	-177	-175.6	1	113.7	R278	R278-R508 PolarHBondContact NH1-O 2.91Å
509	W	84.6	Confident	92.9	Very high	183 Å²	183	46 Å²	46	69%	0.693	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-24.2	-163.3	-54.7	121	0	0	0	114.4	R278	R278-W509 WeakPolarHBondContact CD-O 3.32Å; R278-W509 PolarHBondContact NE-O 2.77Å; R278-W509 PolarHBondContact NH1-O 2.89Å
510	L	89.9	Confident	92.6	Very high	31 Å²	31	44.7 Å²	44.7	16%	0.162	23%	0.226	C	C	.	.	S	Bend	trans	-88.7	170.1	171.1	-57	179.1	0	0	0	110.6	R278 T506 M530 V557 S575	R278-L510 PolarHBondContact NH1-O 3.37Å; T506-L510 WeakPolarHBondContact O-CB 3.4Å; L510-M530 HydrophobicContact CD1-CE 4.06Å; L510-M530 HydrophobicContact CD1-SD 3.65Å; L510-V557 HydrophobicContact CD1-CB 4.08Å; L510-V557 HydrophobicContact CD1-CG1 4.31Å; L510-V557 HydrophobicContact CD1-CG2 4.31Å; L510-S575 WeakPolarHBondContact CD2-OG 3.12Å
511	S	93.1	Very high	92.3	Very high	6 Å²	6	44.4 Å²	44.4	4%	0.042	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-76.8	166.7	163.6	-64.4	0	0	0	0	109.5	R278 I279 T506	R278-S511 VanDerWaalsContact CD-OG 3.3Å; R278-S511 WeakPolarHBondContact CD-OG 3.18Å; R278-S511 WeakPolarHBondContact CG-OG 3.4Å; I279-S511 PolarHBondContact O-OG 3.11Å; T506-S511 VanDerWaalsContact CB-O 3.27Å; T506-S511 WeakPolarHBondContact CB-O 3.38Å; T506-S511 WeakPolarHBondContact CG2-O 3.38Å; T506-S511 PolarHBondContact OG1-O 2.86Å
512	K	94	Very high	92.1	Very high	91 Å²	91	41 Å²	41	40%	0.396	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-79.3	132.4	177	-64.9	-44.7	-165.4	-178.3	0	109.7	T461 L478 T506 G507	T461-K512 HydrophobicContact CG2-CB 3.78Å; T461-K512 HydrophobicContact CG2-CG 4.22Å; L478-K512 HydrophobicContact CD2-CD 4.24Å; T506-K512 WeakPolarHBondContact OG1-CD 3.02Å; T506-K512 PolarHBondContact OG1-NZ 3.44Å; G507-K512 PolarHBondContact O-NZ 3.43Å
513	L	95.4	Very high	92	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-64.2	135.9	173.2	-80.2	167.9	0	0	0	109.8	T461 H502 M504 T506 V527 G528 M530	T461-L513 WeakPolarHBondContact CB-O 3.24Å; T461-L513 PolarHBondContact OG1-O 3.13Å; H502-L513 WeakPolarHBondContact CE1-CD1 3.26Å; M504-L513 HydrophobicContact CE-CB 3.77Å; M504-L513 WeakPolarHBondContact CE-O 3.24Å; M504-L513 HydrophobicContact SD-CB 3.85Å; M504-L513 HydrophobicContact SD-CD1 4.21Å; T506-L513 HydrophobicContact CG2-CB 4.12Å; T506-L513 HydrophobicContact CG2-CD1 3.8Å; T506-L513 HydrophobicContact CG2-CG 3.63Å; L513-V527 HydrophobicContact CD2-CG2 4.41Å; L513-G528 VanDerWaalsContact CD1-O 3.24Å; L513-G528 WeakPolarHBondContact CD1-O 3.47Å; L513-G528 WeakPolarHBondContact CD2-O 3.28Å; L513-M530 HydrophobicContact CD1-CG 3.9Å
514	S	93.9	Very high	92.1	Very high	19 Å²	19	39.1 Å²	39.1	13%	0.133	19%	0.189	C	C	.	.			trans	-131.1	124.6	174.4	49.4	0	0	0	0	107.2	S462	S462-S514 VanDerWaalsContact OG-CB 3.27Å; S462-S514 WeakPolarHBondContact OG-CB 3.44Å
515	A	97	Very high	92.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.189	C	C	.	.			trans	-73.4	136.1	164.2	0	0	0	0	0	109	Y464 L474 S476 I482 F525 V526 V527	Y464-A515 WeakPolarHBondContact CD2-O 3.4Å; L474-A515 HydrophobicContact CD1-CB 4.21Å; L474-A515 HydrophobicContact CD2-CB 3.83Å; L474-A515 HydrophobicContact CG-CB 4.13Å; S476-A515 WeakPolarHBondContact OG-CB 3.38Å; S476-A515 PolarHBondContact OG-N 3.21Å; I482-A515 HydrophobicContact CD1-CB 4.1Å; I482-A515 HydrophobicContact CG1-CB 4.37Å; I482-A515 HydrophobicContact CG2-CB 4.07Å; A515-F525 HydrophobicContact CB-CD2 3.87Å; A515-F525 HydrophobicContact CB-CE2 4.17Å; A515-V526 VanDerWaalsContact CA-O 3.31Å; A515-V526 WeakPolarHBondContact CA-O 3.39Å; A515-V527 HydrophobicContact CB-CB 4.11Å; A515-V527 HydrophobicContact CB-CG2 4.29Å
516	V	97.1	Very high	92.7	Very high	34 Å²	34	33.2 Å²	33.2	21%	0.206	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	132.9	-175.3	-173.4	0	0	0	0	108.8	Y464 F525 V526	Y464-V516 HydrophobicContact CE2-CG2 4Å; V516-F525 CarbonylContact O-C 3.52Å; V516-F525 VanDerWaalsContact O-CA 3.29Å; V516-F525 WeakPolarHBondContact O-CA 3.09Å; V516-F525 VanDerWaalsContact O-CB 3.31Å; V516-F525 WeakPolarHBondContact O-CB 3.36Å; V516-V526 PolarHBondContact N-O 3.42Å; V516-V526 PolarHBondContact O-N 3.34Å
517	W	97.5	Very high	93.4	Very high	11 Å²	11	33 Å²	33	4%	0.042	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	153.8	175.6	-60.1	108.8	0	0	0	112	Y464 F465 P467 R472 L474 I484 C524 F525	Y464-W517 PolarHBondContact O-NE1 2.85Å; F465-W517 PolarHBondContact O-NE1 2.79Å; F465-W517 VanDerWaalsContact O-NE1 3.14Å; P467-W517 HydrophobicContact CG-CB 4.2Å; R472-W517 HydrophobicContact CB-CH2 4.37Å; R472-W517 HydrophobicContact CB-CZ2 4.19Å; L474-W517 HydrophobicContact CB-CD2 4.34Å; L474-W517 VanDerWaalsContact CB-CE2 3.46Å; L474-W517 HydrophobicContact CB-CH2 4.46Å; L474-W517 HydrophobicContact CB-CZ2 3.57Å; L474-W517 HydrophobicContact CD2-CD2 4.1Å; L474-W517 HydrophobicContact CD2-CG 4.25Å; I484-W517 HydrophobicContact CG2-CH2 4.25Å; W517-C524 WeakPolarHBondContact CA-O 3.49Å; W517-F525 HydrophobicContact CD2-CB 4.34Å; W517-F525 HydrophobicContact CE3-CB 3.93Å; W517-F525 HydrophobicContact CE3-CD1 4.32Å; W517-F525 HydrophobicContact CZ3-CD1 4.1Å
518	D	95.7	Very high	93.8	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	121.2	159.5	-171.2	-35.9	0	0	0	108.1	P467 K520 Q521 C524 F563	P467-D518 WeakPolarHBondContact CG-O 3.3Å; D518-K520 PolarHBondContact O-N 2.98Å; D518-K520 VanDerWaalsContact OD1-CB 3.27Å; D518-K520 WeakPolarHBondContact OD1-CB 3.47Å; D518-K520 WeakPolarHBondContact OD1-CG 3.28Å; D518-K520 PolarHBondContact OD1-N 3.13Å; D518-K520 IonicContact OD1-NZ 3.81Å; D518-K520 PolarHBondContact OD1-NZ 3.32Å; D518-K520 IonicContact OD2-NZ 2.73Å; D518-K520 PolarHBondContact OD2-NZ 3.44Å; D518-Q521 HydrophobicContact CB-CB 4.31Å; D518-Q521 CarbonylContact O-C 3.51Å; D518-Q521 PolarHBondContact O-N 3.28Å; D518-C524 PolarHBondContact N-O 3.44Å; D518-F563 HydrophobicContact CB-CB 4.35Å; D518-F563 HydrophobicContact CB-CD2 3.45Å; D518-F563 VanDerWaalsContact CB-CD2 3.45Å; D518-F563 HydrophobicContact CB-CE2 3.71Å; D518-F563 HydrophobicContact CB-CG 3.95Å; D518-F563 HydrophobicContact CB-CZ 4.44Å; D518-F563 WeakPolarHBondContact OD2-CD1 3.41Å; D518-F563 WeakPolarHBondContact OD2-CG 3.46Å
519	P	93.1	Very high	94.3	Very high	40 Å²	40	23.1 Å²	23.1	26%	0.26	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-11.1	178.1	26.5	-35.8	0	0	0	114.4	Q249	Q249-P519 PolarHBondContact NE2-O 2.89Å
520	K	91	Very high	94.7	Very high	25 Å²	25	16.2 Å²	16.2	11%	0.109	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-12.8	176.9	-53.9	177.7	-57.4	-58.9	0	113.7	D518 H564 P565 T566 R567	D518-K520 PolarHBondContact O-N 2.98Å; D518-K520 VanDerWaalsContact OD1-CB 3.27Å; D518-K520 WeakPolarHBondContact OD1-CB 3.47Å; D518-K520 WeakPolarHBondContact OD1-CG 3.28Å; D518-K520 PolarHBondContact OD1-N 3.13Å; D518-K520 IonicContact OD1-NZ 3.81Å; D518-K520 PolarHBondContact OD1-NZ 3.32Å; D518-K520 IonicContact OD2-NZ 2.73Å; D518-K520 PolarHBondContact OD2-NZ 3.44Å; K520-H564 PolarHBondContact NZ-O 3.36Å; K520-P565 WeakPolarHBondContact CG-O 3.42Å; K520-T566 WeakPolarHBondContact CD-O 3.48Å; K520-R567 WeakPolarHBondContact CE-O 3.47Å; K520-R567 PolarHBondContact NZ-O 3.33Å
521	Q	91.9	Very high	94.8	Very high	7 Å²	7	18.1 Å²	18.1	3%	0.033	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	106.5	-173.9	-71.1	-69	4	0	0	112.5	L252 Y257 D518 D523 C524	L252-Q521 PolarHBondContact O-NE2 3.41Å; Y257-Q521 HydrophobicContact CD1-CG 4.43Å; Y257-Q521 HydrophobicContact CD2-CG 3.92Å; Y257-Q521 HydrophobicContact CE1-CG 4.46Å; Y257-Q521 HydrophobicContact CE2-CG 3.96Å; Y257-Q521 HydrophobicContact CG-CG 4.17Å; D518-Q521 HydrophobicContact CB-CB 4.31Å; D518-Q521 CarbonylContact O-C 3.51Å; D518-Q521 PolarHBondContact O-N 3.28Å; Q521-D523 PolarHBondContact O-N 3.49Å; Q521-C524 HydrophobicContact CB-CB 3.93Å; Q521-C524 PolarHBondContact O-N 3.28Å
522	E	92.3	Very high	94.5	Very high	15 Å²	15	27.6 Å²	27.6	7%	0.07	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	-14.8	-175	-174.4	60.6	-174.4	0	0	116	S466 P467 C468 T469	S466-E522 WeakPolarHBondContact CB-OE1 3.27Å; S466-E522 PolarHBondContact OG-OE1 3.1Å; P467-E522 WeakPolarHBondContact CD-OE2 3.25Å; C468-E522 WeakPolarHBondContact CA-OE2 3.44Å; C468-E522 WeakPolarHBondContact CB-OE2 3.19Å; C468-E522 PolarHBondContact N-OE2 3.02Å; T469-E522 VanDerWaalsContact CB-OE1 3.28Å; T469-E522 WeakPolarHBondContact CB-OE1 3.39Å; T469-E522 HydrophobicContact CG2-CG 4.21Å; T469-E522 PolarHBondContact N-OE1 2.94Å; T469-E522 VanDerWaalsContact N-OE1 3.1Å; T469-E522 PolarHBondContact N-OE2 3Å; T469-E522 PolarHBondContact OG1-OE1 2.86Å
523	D	94.4	Very high	94.3	Very high	21 Å²	21	27.5 Å²	27.5	11%	0.112	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	2.7	-171.9	48.7	48.9	0	0	0	113.1	K251 Q521 H540 E541	K251-D523 IonicContact NZ-OD2 2.85Å; K251-D523 PolarHBondContact NZ-OD2 2.91Å; Q521-D523 PolarHBondContact O-N 3.49Å; D523-H540 CarbonylContact O-C 3.57Å; D523-H540 WeakPolarHBondContact O-CA 3.48Å; D523-H540 IonicContact OD1-CD2 2.69Å; D523-E541 HydrophobicContact CB-CG 4.1Å; D523-E541 PolarHBondContact O-N 2.67Å
524	C	96.4	Very high	94.2	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	138.2	-173.2	-69.8	0	0	0	0	113.6	Y257 W517 D518 Q521 F539 L546	Y257-C524 HydrophobicContact CD1-CB 4.48Å; Y257-C524 HydrophobicContact CE1-CB 3.57Å; Y257-C524 WeakPolarHBondContact CE1-SG 3.49Å; W517-C524 WeakPolarHBondContact CA-O 3.49Å; D518-C524 PolarHBondContact N-O 3.44Å; Q521-C524 HydrophobicContact CB-CB 3.93Å; Q521-C524 PolarHBondContact O-N 3.28Å; C524-F539 WeakPolarHBondContact CA-O 3.46Å; C524-L546 VanDerWaalsContact SG-CD1 3.52Å
525	F	97.8	Very high	94.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	159.5	-177.9	67.3	-88.5	0	0	0	112.8	L474 I482 I484 I500 A515 V516 W517 V538 F539	L474-F525 HydrophobicContact CD1-CD1 4.2Å; L474-F525 HydrophobicContact CD1-CD2 4.13Å; L474-F525 HydrophobicContact CD1-CE1 4.27Å; L474-F525 HydrophobicContact CD1-CE2 4.17Å; L474-F525 HydrophobicContact CD1-CG 4.13Å; L474-F525 HydrophobicContact CD1-CZ 4.22Å; L474-F525 HydrophobicContact CD2-CB 3.66Å; L474-F525 HydrophobicContact CD2-CD1 4.45Å; L474-F525 HydrophobicContact CD2-CD2 4.03Å; L474-F525 HydrophobicContact CD2-CG 3.79Å; I482-F525 HydrophobicContact CD1-CE2 4.36Å; I482-F525 HydrophobicContact CG2-CE2 3.95Å; I482-F525 HydrophobicContact CG2-CZ 4.13Å; I484-F525 HydrophobicContact CD1-CD1 4.37Å; I484-F525 HydrophobicContact CD1-CE1 3.66Å; I484-F525 HydrophobicContact CD1-CZ 4.32Å; I500-F525 HydrophobicContact CD1-CE1 4.26Å; I500-F525 HydrophobicContact CD1-CZ 3.7Å; A515-F525 HydrophobicContact CB-CD2 3.87Å; A515-F525 HydrophobicContact CB-CE2 4.17Å; V516-F525 CarbonylContact O-C 3.52Å; V516-F525 VanDerWaalsContact O-CA 3.29Å; V516-F525 WeakPolarHBondContact O-CA 3.09Å; V516-F525 VanDerWaalsContact O-CB 3.31Å; V516-F525 WeakPolarHBondContact O-CB 3.36Å; W517-F525 HydrophobicContact CD2-CB 4.34Å; W517-F525 HydrophobicContact CE3-CB 3.93Å; W517-F525 HydrophobicContact CE3-CD1 4.32Å; W517-F525 HydrophobicContact CZ3-CD1 4.1Å; F525-V538 WeakPolarHBondContact O-CA 3.39Å; F525-F539 HydrophobicContact CD1-CB 4.36Å; F525-F539 HydrophobicContact CD2-CB 4.4Å; F525-F539 HydrophobicContact CE1-CB 3.72Å; F525-F539 HydrophobicContact CE2-CB 3.79Å; F525-F539 HydrophobicContact CE2-CD2 4.01Å; F525-F539 HydrophobicContact CE2-CG 4.21Å; F525-F539 HydrophobicContact CZ-CB 3.41Å; F525-F539 VanDerWaalsContact CZ-CB 3.41Å; F525-F539 HydrophobicContact CZ-CD2 4.34Å; F525-F539 HydrophobicContact CZ-CG 4.08Å; F525-F539 PolarHBondContact N-O 3.14Å; F525-F539 PolarHBondContact O-N 3.35Å
526	V	98	Very high	94.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	145.5	-178.1	63.4	0	0	0	0	112.3	A515 V516 V536 V538 F563 L570	A515-V526 VanDerWaalsContact CA-O 3.31Å; A515-V526 WeakPolarHBondContact CA-O 3.39Å; V516-V526 PolarHBondContact N-O 3.42Å; V516-V526 PolarHBondContact O-N 3.34Å; V526-V536 HydrophobicContact CG2-CG1 3.13Å; V526-V538 HydrophobicContact CB-CG2 4.2Å; V526-V538 HydrophobicContact CG2-CG2 3.94Å; V526-F563 HydrophobicContact CB-CD2 4.17Å; V526-F563 HydrophobicContact CB-CE2 3.45Å; V526-F563 VanDerWaalsContact CB-CE2 3.45Å; V526-F563 HydrophobicContact CB-CZ 3.92Å; V526-F563 HydrophobicContact CG1-CD2 3.61Å; V526-F563 HydrophobicContact CG1-CE2 3.44Å; V526-F563 VanDerWaalsContact CG1-CE2 3.44Å; V526-F563 HydrophobicContact CG1-CZ 4.22Å; V526-F563 HydrophobicContact CG2-CE2 4.44Å; V526-L570 HydrophobicContact CB-CD1 4.39Å; V526-L570 HydrophobicContact CG1-CD1 4.01Å; V526-L570 HydrophobicContact CG2-CD1 3.88Å; V526-L570 HydrophobicContact CG2-CD2 4.18Å
527	V	97.5	Very high	94.2	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	135.4	171.1	68.4	0	0	0	0	111.5	I482 M504 L513 A515 E537 F539	I482-V527 HydrophobicContact CD1-CB 4.19Å; I482-V527 HydrophobicContact CD1-CG1 3.8Å; I482-V527 HydrophobicContact CD1-CG2 4.14Å; M504-V527 HydrophobicContact CE-CG2 4.33Å; M504-V527 HydrophobicContact SD-CG2 4.27Å; L513-V527 HydrophobicContact CD2-CG2 4.41Å; A515-V527 HydrophobicContact CB-CB 4.11Å; A515-V527 HydrophobicContact CB-CG2 4.29Å; V527-E537 PolarHBondContact N-O 2.86Å; V527-E537 PolarHBondContact O-N 3.3Å; V527-F539 HydrophobicContact CG1-CD2 4.21Å; V527-F539 HydrophobicContact CG1-CE2 3.86Å
528	G	95.6	Very high	94.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	147.9	171.1	0	0	0	0	0	112.2	H502 L513 L558	H502-G528 PolarHBondContact CE1-O 2.88Å; H502-G528 PolarHBondContact NE2-O 3.36Å; L513-G528 VanDerWaalsContact CD1-O 3.24Å; L513-G528 WeakPolarHBondContact CD1-O 3.47Å; L513-G528 WeakPolarHBondContact CD2-O 3.28Å; G528-L558 WeakPolarHBondContact CA-O 3.34Å
529	S	94.3	Very high	94.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.1	-173	-152.2	0	0	0	0	113.7	H502 K531 R535 E537	H502-S529 WeakPolarHBondContact CE1-CA 3.19Å; H502-S529 VanDerWaalsContact NE2-CA 3.3Å; H502-S529 WeakPolarHBondContact NE2-CA 3.49Å; H502-S529 WeakPolarHBondContact NE2-CB 3.16Å; H502-S529 PolarHBondContact NE2-OG 3.32Å; S529-K531 PolarHBondContact O-N 3.35Å; S529-K531 WeakPolarHBondContact OG-CD 3.42Å; S529-K531 WeakPolarHBondContact OG-CG 3.31Å; S529-R535 WeakPolarHBondContact CB-O 3.4Å; S529-R535 PolarHBondContact N-O 3.29Å; S529-E537 WeakPolarHBondContact CB-OE2 3.28Å; S529-E537 PolarHBondContact OG-OE2 2.95Å
530	M	92.8	Very high	94.5	Very high	38 Å²	38	29.8 Å²	29.8	19%	0.187	13%	0.133	C	C	.	.	S	Bend	trans	-70.7	-12.6	173.4	-73.1	-63.3	-64.6	0	0	113.8	D503 T506 L510 L513 R534 V557	D503-M530 HydrophobicContact CB-CB 3.99Å; D503-M530 VanDerWaalsContact O-CG 3.25Å; D503-M530 WeakPolarHBondContact O-CG 3.22Å; D503-M530 WeakPolarHBondContact OD2-CB 3.49Å; T506-M530 HydrophobicContact CG2-CG 4.47Å; T506-M530 HydrophobicContact CG2-SD 3.93Å; L510-M530 HydrophobicContact CD1-CE 4.06Å; L510-M530 HydrophobicContact CD1-SD 3.65Å; L513-M530 HydrophobicContact CD1-CG 3.9Å; M530-R534 PolarHBondContact O-NH1 2.9Å; M530-V557 HydrophobicContact SD-CG1 3.97Å; M530-V557 HydrophobicContact SD-CG2 4.11Å
531	K	91.2	Very high	94.7	Very high	71 Å²	71	30 Å²	30	31%	0.309	14%	0.135	S	C	.	.	S	Bend	trans	-64.2	171.8	-177.4	-58.9	171.4	-165.4	158.2	0	112.8	S529 R534 R535 E537	S529-K531 PolarHBondContact O-N 3.35Å; S529-K531 WeakPolarHBondContact OG-CD 3.42Å; S529-K531 WeakPolarHBondContact OG-CG 3.31Å; K531-R534 PolarHBondContact O-NH1 2.7Å; K531-R535 VanDerWaalsContact CD-NH2 3.35Å; K531-E537 IonicContact NZ-OE1 3.82Å; K531-E537 PolarHBondContact NZ-OE1 3.32Å; K531-E537 IonicContact NZ-OE2 3.86Å; K531-E537 PolarHBondContact NZ-OE2 2.95Å
532	R	88.7	Confident	94.8	Very high	205 Å²	205	32.5 Å²	32.5	77%	0.774	15%	0.153	S	C	*	.	S	Bend	trans	-121.3	148.3	168.6	-70.9	-178	175.9	137.4	-3.6	109.8	R535	R532-R535 PolarHBondContact O-NH1 3.19Å
533	P	89.9	Confident	94.9	Very high	89 Å²	89	33 Å²	33	58%	0.578	16%	0.161	S	C	*	.	S	Bend	cis	-51.6	159.7	-19.2	28.2	-36.9	0	0	0	111.2	R535 M550	P533-R535 PolarHBondContact O-NH1 3.36Å; P533-M550 HydrophobicContact CG-SD 3.99Å
534	R	92.6	Very high	95	Very high	55 Å²	55	38.8 Å²	38.8	21%	0.208	18%	0.182	C	C	.	.			trans	-63.9	145.8	-177.5	-64.3	-53.2	-174.4	-163.9	11.7	110	M530 K531 L554 V557	M530-R534 PolarHBondContact O-NH1 2.9Å; K531-R534 PolarHBondContact O-NH1 2.7Å; R534-L554 HydrophobicContact CB-CB 4.38Å; R534-L554 HydrophobicContact CB-CD2 4.02Å; R534-L554 HydrophobicContact CB-CG 3.91Å; R534-L554 WeakPolarHBondContact CB-O 3.26Å; R534-L554 WeakPolarHBondContact CG-O 3.44Å; R534-V557 VanDerWaalsContact CZ-CG2 3.41Å
535	R	94.2	Very high	95	Very high	46 Å²	46	42.6 Å²	42.6	17%	0.174	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163	162.8	-177	55.2	-175.3	172.5	-97.7	29.8	114.1	S529 K531 R532 P533 E537 S548 F549 M550	S529-R535 WeakPolarHBondContact CB-O 3.4Å; S529-R535 PolarHBondContact N-O 3.29Å; K531-R535 VanDerWaalsContact CD-NH2 3.35Å; R532-R535 PolarHBondContact O-NH1 3.19Å; P533-R535 PolarHBondContact O-NH1 3.36Å; R535-E537 HydrophobicContact CG-CG 4.09Å; R535-E537 IonicContact CZ-OE1 2.86Å; R535-E537 IonicContact NE-OE1 2.73Å; R535-E537 PolarHBondContact NE-OE1 2.6Å; R535-E537 IonicContact NH2-OE1 2.68Å; R535-S548 WeakPolarHBondContact CD-OG 3.39Å; R535-F549 CarbonylContact C-O 3.57Å; R535-F549 WeakPolarHBondContact CA-O 3.42Å; R535-F549 WeakPolarHBondContact CB-O 3.47Å; R535-M550 HydrophobicContact CB-CG 3.65Å
536	V	96	Very high	95	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	128.6	162.7	179.8	0	0	0	0	107.9	V526 S548 F549 L558 T561 L570	V526-V536 HydrophobicContact CG2-CG1 3.13Å; V536-S548 CarbonylContact O-C 3.14Å; V536-S548 WeakPolarHBondContact O-CA 3.3Å; V536-F549 HydrophobicContact CB-CB 4.36Å; V536-F549 HydrophobicContact CB-CD2 4.5Å; V536-F549 PolarHBondContact N-O 3.38Å; V536-F549 VanDerWaalsContact N-O 3.09Å; V536-F549 PolarHBondContact O-N 3.37Å; V536-L558 HydrophobicContact CG2-CB 4.08Å; V536-L558 HydrophobicContact CG2-CD1 3.64Å; V536-L558 HydrophobicContact CG2-CG 4.13Å; V536-T561 HydrophobicContact CG1-CG2 4.02Å; V536-T561 HydrophobicContact CG2-CG2 4.22Å; V536-L570 HydrophobicContact CG1-CD2 4.08Å
537	E	97	Very high	94.9	Very high	6 Å²	6	45.5 Å²	45.5	3%	0.028	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	126.1	-173.5	-70.2	172.2	147	0	0	109.1	H502 V527 S529 K531 R535 F539 L545	H502-E537 IonicContact CD2-OE2 2.63Å; H502-E537 PolarHBondContact CD2-OE2 3.18Å; H502-E537 VanDerWaalsContact CD2-OE2 3.27Å; H502-E537 IonicContact NE2-OE2 2.7Å; H502-E537 PolarHBondContact NE2-OE2 2.86Å; V527-E537 PolarHBondContact N-O 2.86Å; V527-E537 PolarHBondContact O-N 3.3Å; S529-E537 WeakPolarHBondContact CB-OE2 3.28Å; S529-E537 PolarHBondContact OG-OE2 2.95Å; K531-E537 IonicContact NZ-OE1 3.82Å; K531-E537 PolarHBondContact NZ-OE1 3.32Å; K531-E537 IonicContact NZ-OE2 3.86Å; K531-E537 PolarHBondContact NZ-OE2 2.95Å; R535-E537 HydrophobicContact CG-CG 4.09Å; R535-E537 IonicContact CZ-OE1 2.86Å; R535-E537 IonicContact NE-OE1 2.73Å; R535-E537 PolarHBondContact NE-OE1 2.6Å; R535-E537 IonicContact NH2-OE1 2.68Å; E537-F539 HydrophobicContact CB-CD2 4.34Å; E537-F539 HydrophobicContact CB-CE2 3.52Å; E537-F539 HydrophobicContact CB-CZ 4Å; E537-L545 HydrophobicContact CB-CD1 3.73Å; E537-L545 HydrophobicContact CG-CD1 4.12Å
538	V	97.9	Very high	94.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	129.6	177.8	-177.8	0	0	0	0	109.3	L261 F525 V526 L546 H547 F549 F563	L261-V538 HydrophobicContact CD1-CB 4.33Å; L261-V538 HydrophobicContact CD1-CG1 3.85Å; L261-V538 HydrophobicContact CD2-CG2 4.43Å; F525-V538 WeakPolarHBondContact O-CA 3.39Å; V526-V538 HydrophobicContact CB-CG2 4.2Å; V526-V538 HydrophobicContact CG2-CG2 3.94Å; V538-L546 PolarHBondContact O-N 2.96Å; V538-H547 PolarHBondContact N-O 2.65Å; V538-H547 PolarHBondContact O-N 3.04Å; V538-F549 HydrophobicContact CG2-CD2 4.19Å; V538-F549 HydrophobicContact CG2-CE2 3.7Å; V538-F563 HydrophobicContact CG1-CZ 4.29Å; V538-F563 HydrophobicContact CG2-CZ 4.05Å
539	F	97.8	Very high	94.8	Very high	15 Å²	15	46.8 Å²	46.8	7%	0.066	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	149.4	-174.5	-66.4	-92.1	0	0	0	111.7	I500 C524 F525 V527 E537 R544 L545	I500-F539 HydrophobicContact CG2-CD1 4.42Å; I500-F539 HydrophobicContact CG2-CE1 4.19Å; C524-F539 WeakPolarHBondContact CA-O 3.46Å; F525-F539 HydrophobicContact CD1-CB 4.36Å; F525-F539 HydrophobicContact CD2-CB 4.4Å; F525-F539 HydrophobicContact CE1-CB 3.72Å; F525-F539 HydrophobicContact CE2-CB 3.79Å; F525-F539 HydrophobicContact CE2-CD2 4.01Å; F525-F539 HydrophobicContact CE2-CG 4.21Å; F525-F539 HydrophobicContact CZ-CB 3.41Å; F525-F539 VanDerWaalsContact CZ-CB 3.41Å; F525-F539 HydrophobicContact CZ-CD2 4.34Å; F525-F539 HydrophobicContact CZ-CG 4.08Å; F525-F539 PolarHBondContact N-O 3.14Å; F525-F539 PolarHBondContact O-N 3.35Å; V527-F539 HydrophobicContact CG1-CD2 4.21Å; V527-F539 HydrophobicContact CG1-CE2 3.86Å; E537-F539 HydrophobicContact CB-CD2 4.34Å; E537-F539 HydrophobicContact CB-CE2 3.52Å; E537-F539 HydrophobicContact CB-CZ 4Å; F539-R544 WeakPolarHBondContact CA-O 3.38Å; F539-L545 HydrophobicContact CD1-CB 4.15Å; F539-L545 HydrophobicContact CD1-CD1 4.14Å; F539-L545 HydrophobicContact CD2-CD1 4.43Å; F539-L545 HydrophobicContact CE1-CB 3.98Å; F539-L545 HydrophobicContact CE1-CD1 3.77Å; F539-L545 HydrophobicContact CE1-CG 4.49Å; F539-L545 HydrophobicContact CE2-CD1 4.09Å; F539-L545 HydrophobicContact CG-CD1 4.46Å; F539-L545 HydrophobicContact CZ-CD1 3.75Å
540	H	96.9	Very high	94.6	Very high	32 Å²	32	51.9 Å²	51.9	15%	0.148	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	151.2	162.1	176.5	-99.2	0	0	0	109.7	D523 S542 G543 R544 L546	D523-H540 CarbonylContact O-C 3.57Å; D523-H540 WeakPolarHBondContact O-CA 3.48Å; D523-H540 IonicContact OD1-CD2 2.69Å; H540-S542 PolarHBondContact ND1-N 3.1Å; H540-S542 PolarHBondContact ND1-OG 2.88Å; H540-S542 PolarHBondContact O-N 2.96Å; H540-G543 PolarHBondContact O-N 2.99Å; H540-R544 HydrophobicContact CB-CB 4.49Å; H540-R544 PolarHBondContact N-O 2.68Å; H540-R544 PolarHBondContact O-N 3.32Å; H540-L546 HydrophobicContact CB-CD1 4.03Å; H540-L546 HydrophobicContact CB-CD2 3.9Å; H540-L546 HydrophobicContact CB-CG 4Å
541	E	95	Very high	94.3	Very high	31 Å²	31	52.9 Å²	52.9	15%	0.145	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-29.1	-175.9	63.1	179.5	-146	0	0	115.8	R472 I484 K498 D523 G543	R472-E541 WeakPolarHBondContact CD-OE2 3.32Å; R472-E541 VanDerWaalsContact CZ-CD 3.49Å; R472-E541 IonicContact CZ-OE1 3.51Å; R472-E541 IonicContact CZ-OE2 3.46Å; R472-E541 IonicContact NE-OE2 2.9Å; R472-E541 PolarHBondContact NE-OE2 2.91Å; R472-E541 IonicContact NH1-OE1 2.81Å; R472-E541 PolarHBondContact NH1-OE1 2.82Å; R472-E541 IonicContact NH1-OE2 3.35Å; R472-E541 PolarHBondContact NH1-OE2 3.36Å; R472-E541 IonicContact NH2-OE1 3.47Å; R472-E541 IonicContact NH2-OE2 2.72Å; R472-E541 PolarHBondContact NH2-OE2 2.97Å; R472-E541 VanDerWaalsContact NH2-OE2 3.12Å; I484-E541 HydrophobicContact CD1-CB 3.9Å; K498-E541 WeakPolarHBondContact CB-O 3.49Å; D523-E541 HydrophobicContact CB-CG 4.1Å; D523-E541 PolarHBondContact O-N 2.67Å; E541-G543 PolarHBondContact O-N 3.08Å
542	S	94.8	Very high	93.9	Very high	58 Å²	58	57.4 Å²	57.4	41%	0.406	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-3.8	174.6	66.8	0	0	0	0	114	K498 H540	K498-S542 WeakPolarHBondContact CD-O 3.42Å; K498-S542 WeakPolarHBondContact CE-O 3.42Å; K498-S542 PolarHBondContact NZ-O 3.14Å; H540-S542 PolarHBondContact ND1-N 3.1Å; H540-S542 PolarHBondContact ND1-OG 2.88Å; H540-S542 PolarHBondContact O-N 2.96Å
543	G	94.6	Very high	93.4	Very high	25 Å²	25	49.5 Å²	49.5	26%	0.258	25%	0.251	S	S	.	.	S	Bend	trans	86.7	9.2	-174.7	0	0	0	0	0	114	H540 E541	H540-G543 PolarHBondContact O-N 2.99Å; E541-G543 PolarHBondContact O-N 3.08Å
544	R	96.1	Very high	93.1	Very high	144 Å²	144	45.5 Å²	45.5	54%	0.543	23%	0.225	S	C	.	.			trans	-78.5	122.7	177	178.8	-179.6	177.1	-178.9	0.9	110	F539 H540 L546	F539-R544 WeakPolarHBondContact CA-O 3.38Å; H540-R544 HydrophobicContact CB-CB 4.49Å; H540-R544 PolarHBondContact N-O 2.68Å; H540-R544 PolarHBondContact O-N 3.32Å; R544-L546 HydrophobicContact CG-CD2 4.24Å; R544-L546 PolarHBondContact O-N 2.84Å
545	L	97.1	Very high	92.6	Very high	80 Å²	80	46 Å²	46	42%	0.419	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	125.4	164.6	-176.1	72.7	0	0	0	109.1	E537 F539 H547	E537-L545 HydrophobicContact CB-CD1 3.73Å; E537-L545 HydrophobicContact CG-CD1 4.12Å; F539-L545 HydrophobicContact CD1-CB 4.15Å; F539-L545 HydrophobicContact CD1-CD1 4.14Å; F539-L545 HydrophobicContact CD2-CD1 4.43Å; F539-L545 HydrophobicContact CE1-CB 3.98Å; F539-L545 HydrophobicContact CE1-CD1 3.77Å; F539-L545 HydrophobicContact CE1-CG 4.49Å; F539-L545 HydrophobicContact CE2-CD1 4.09Å; F539-L545 HydrophobicContact CG-CD1 4.46Å; F539-L545 HydrophobicContact CZ-CD1 3.75Å; L545-H547 WeakPolarHBondContact CD1-O 3.48Å
546	L	96.4	Very high	92.4	Very high	18 Å²	18	45.8 Å²	45.8	9%	0.094	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	-47.7	179.2	-62.3	-173.8	0	0	0	111.8	L254 Y257 I258 L261 C524 V538 H540 R544	L254-L546 HydrophobicContact CD1-CD1 3.86Å; L254-L546 HydrophobicContact CD1-CD2 4.13Å; Y257-L546 HydrophobicContact CD1-CD1 4.15Å; Y257-L546 HydrophobicContact CE1-CD1 3.93Å; I258-L546 HydrophobicContact CD1-CD2 3.95Å; I258-L546 HydrophobicContact CG1-CB 4.28Å; I258-L546 HydrophobicContact CG1-CD2 4.09Å; L261-L546 HydrophobicContact CD1-CB 4.34Å; C524-L546 VanDerWaalsContact SG-CD1 3.52Å; V538-L546 PolarHBondContact O-N 2.96Å; H540-L546 HydrophobicContact CB-CD1 4.03Å; H540-L546 HydrophobicContact CB-CD2 3.9Å; H540-L546 HydrophobicContact CB-CG 4Å; R544-L546 HydrophobicContact CG-CD2 4.24Å; R544-L546 PolarHBondContact O-N 2.84Å
547	H	96.4	Very high	92.3	Very high	43 Å²	43	46.1 Å²	46.1	20%	0.199	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	159.3	-179.5	-166.1	76.4	0	0	0	111.1	L261 V538 L545 F549	L261-H547 HydrophobicContact CB-CB 4.03Å; L261-H547 HydrophobicContact CD1-CB 4.08Å; V538-H547 PolarHBondContact N-O 2.65Å; V538-H547 PolarHBondContact O-N 3.04Å; L545-H547 WeakPolarHBondContact CD1-O 3.48Å; H547-F549 AromaticContact CD2-CD1 3.5Å; H547-F549 AromaticContact CD2-CD2 3.84Å; H547-F549 AromaticContact CD2-CE1 3.38Å; H547-F549 WeakPolarHBondContact CD2-CE1 3.42Å; H547-F549 AromaticContact CD2-CE2 3.76Å; H547-F549 AromaticContact CD2-CG 3.72Å; H547-F549 AromaticContact CD2-CZ 3.52Å; H547-F549 AromaticContact NE2-CD1 3.52Å; H547-F549 AromaticContact NE2-CE1 3.58Å
548	S	95.9	Very high	92.2	Very high	23 Å²	23	46 Å²	46	16%	0.161	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	94.7	178.5	162.7	0	0	0	0	109.3	R535 V536 M550	R535-S548 WeakPolarHBondContact CD-OG 3.39Å; V536-S548 CarbonylContact O-C 3.14Å; V536-S548 WeakPolarHBondContact O-CA 3.3Å; S548-M550 PolarHBondContact O-N 3.16Å
549	F	94.3	Very high	92	Very high	4 Å²	4	46 Å²	46	2%	0.018	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	118.6	177.5	-65.2	-70.1	0	0	0	110	L261 L264 R535 V536 V538 H547 L570 F582	L261-F549 HydrophobicContact CB-CZ 4.34Å; L261-F549 HydrophobicContact CD2-CE2 4.22Å; L261-F549 HydrophobicContact CD2-CZ 3.92Å; L261-F549 WeakPolarHBondContact O-CE1 3.48Å; L261-F549 WeakPolarHBondContact O-CZ 3.09Å; L264-F549 HydrophobicContact CB-CE1 3.9Å; L264-F549 HydrophobicContact CB-CZ 4.37Å; L264-F549 HydrophobicContact CD1-CE1 4.43Å; L264-F549 HydrophobicContact CD1-CZ 4.06Å; L264-F549 HydrophobicContact CG-CE1 4.48Å; L264-F549 HydrophobicContact CG-CZ 4.49Å; R535-F549 CarbonylContact C-O 3.57Å; R535-F549 WeakPolarHBondContact CA-O 3.42Å; R535-F549 WeakPolarHBondContact CB-O 3.47Å; V536-F549 HydrophobicContact CB-CB 4.36Å; V536-F549 HydrophobicContact CB-CD2 4.5Å; V536-F549 PolarHBondContact N-O 3.38Å; V536-F549 VanDerWaalsContact N-O 3.09Å; V536-F549 PolarHBondContact O-N 3.37Å; V538-F549 HydrophobicContact CG2-CD2 4.19Å; V538-F549 HydrophobicContact CG2-CE2 3.7Å; H547-F549 AromaticContact CD2-CD1 3.5Å; H547-F549 AromaticContact CD2-CD2 3.84Å; H547-F549 AromaticContact CD2-CE1 3.38Å; H547-F549 WeakPolarHBondContact CD2-CE1 3.42Å; H547-F549 AromaticContact CD2-CE2 3.76Å; H547-F549 AromaticContact CD2-CG 3.72Å; H547-F549 AromaticContact CD2-CZ 3.52Å; H547-F549 AromaticContact NE2-CD1 3.52Å; H547-F549 AromaticContact NE2-CE1 3.58Å; F549-L570 HydrophobicContact CD2-CD2 3.34Å; F549-L570 HydrophobicContact CE2-CD2 3.34Å; F549-L570 HydrophobicContact CG-CD2 4.22Å; F549-L570 HydrophobicContact CZ-CD2 4.24Å; F549-F582 HydrophobicContact CB-CD1 4.16Å; F549-F582 HydrophobicContact CB-CE1 3.81Å; F549-F582 HydrophobicContact CB-CE2 4.3Å; F549-F582 HydrophobicContact CB-CZ 3.89Å; F549-F582 HydrophobicContact CD1-CB 4.42Å; F549-F582 AromaticContact CD1-CD1 3.92Å; F549-F582 HydrophobicContact CD1-CD1 3.92Å; F549-F582 HydrophobicContact CD1-CE1 4.39Å; F549-F582 HydrophobicContact CD1-CG 4.16Å; F549-F582 HydrophobicContact CG-CD1 4.23Å; F549-F582 HydrophobicContact CG-CE1 4.38Å; F549-F582 HydrophobicContact CG-CG 4.33Å
550	M	91.8	Very high	92	Very high	107 Å²	107	46 Å²	46	53%	0.527	25%	0.254	S	S	.	.			trans	-135.6	136.2	-179.7	-74.8	176.6	-59.3	0	0	107.9	P533 R535 S548	P533-M550 HydrophobicContact CG-SD 3.99Å; R535-M550 HydrophobicContact CB-CG 3.65Å; S548-M550 PolarHBondContact O-N 3.16Å
551	D	86.5	Confident	92	Very high	59 Å²	59	44.8 Å²	44.8	32%	0.316	25%	0.248	S	C	.	.			trans	-152.3	157.7	178.4	-168.2	-97.6	0	0	0	110.4	M266 N553 L554	M266-D551 HydrophobicContact CE-CB 3.7Å; M266-D551 HydrophobicContact SD-CB 4.45Å; D551-N553 WeakPolarHBondContact OD1-CB 3.41Å; D551-N553 PolarHBondContact OD1-N 2.95Å; D551-N553 PolarHBondContact OD1-ND2 3.34Å; D551-L554 HydrophobicContact CB-CB 4.29Å; D551-L554 VanDerWaalsContact O-CB 3.3Å; D551-L554 WeakPolarHBondContact O-CB 3.28Å; D551-L554 PolarHBondContact O-N 3.32Å
552	E	81.9	Confident	92	Very high	166 Å²	166	44.1 Å²	44.1	78%	0.776	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-33.9	177.4	-59.6	-156.6	165.1	0	0	112.7	L554	E552-L554 PolarHBondContact O-N 3.11Å
553	N	77.9	Confident	92.1	Very high	39 Å²	39	42 Å²	42	21%	0.209	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-12.9	174.5	-63.7	-68.3	0	0	0	112.6	M266 V271 D551 G555	M266-N553 HydrophobicContact SD-CB 3.84Å; V271-N553 HydrophobicContact CG2-CB 4.47Å; D551-N553 WeakPolarHBondContact OD1-CB 3.41Å; D551-N553 PolarHBondContact OD1-N 2.95Å; D551-N553 PolarHBondContact OD1-ND2 3.34Å; N553-G555 PolarHBondContact O-N 2.97Å
554	L	84.6	Confident	92	Very high	5 Å²	5	40.8 Å²	40.8	3%	0.026	22%	0.219	C	C	.	.			trans	-78.5	55	-179.9	-159.7	64.4	0	0	0	112.7	M266 R534 D551 E552 T556 L558 F582	M266-L554 HydrophobicContact CE-CB 4.34Å; M266-L554 HydrophobicContact CE-CD1 4.13Å; R534-L554 HydrophobicContact CB-CB 4.38Å; R534-L554 HydrophobicContact CB-CD2 4.02Å; R534-L554 HydrophobicContact CB-CG 3.91Å; R534-L554 WeakPolarHBondContact CB-O 3.26Å; R534-L554 WeakPolarHBondContact CG-O 3.44Å; D551-L554 HydrophobicContact CB-CB 4.29Å; D551-L554 VanDerWaalsContact O-CB 3.3Å; D551-L554 WeakPolarHBondContact O-CB 3.28Å; D551-L554 PolarHBondContact O-N 3.32Å; E552-L554 PolarHBondContact O-N 3.11Å; L554-T556 PolarHBondContact O-N 3.01Å; L554-L558 HydrophobicContact CD1-CD1 3.71Å; L554-L558 HydrophobicContact CD1-CD2 3.78Å; L554-L558 HydrophobicContact CD1-CG 3.77Å; L554-F582 HydrophobicContact CD1-CZ 4.5Å; L554-F582 HydrophobicContact CD2-CZ 4.48Å
555	G	82.2	Confident	91.8	Very high	65 Å²	65	35.7 Å²	35.7	67%	0.67	21%	0.205	S	C	*	.			trans	-64.7	-9.4	-178.6	0	0	0	0	0	115.8	N553	N553-G555 PolarHBondContact O-N 2.97Å
556	T	89.4	Confident	91.3	Very high	41 Å²	41	33.4 Å²	33.4	25%	0.252	19%	0.194	S	C	.	.	S	Bend	trans	-130.9	165.8	-170.4	62.5	0	0	0	0	113.4	L554 N574	L554-T556 PolarHBondContact O-N 3.01Å; T556-N574 WeakPolarHBondContact OG1-CB 3.45Å; T556-N574 PolarHBondContact OG1-ND2 2.82Å
557	V	93.5	Very high	90.9	Very high	7 Å²	7	36 Å²	36	4%	0.042	20%	0.203	C	C	.	.			trans	-82.4	118.7	171.7	179.7	0	0	0	0	108.7	L510 M530 R534 S559	L510-V557 HydrophobicContact CD1-CB 4.08Å; L510-V557 HydrophobicContact CD1-CG1 4.31Å; L510-V557 HydrophobicContact CD1-CG2 4.31Å; M530-V557 HydrophobicContact SD-CG1 3.97Å; M530-V557 HydrophobicContact SD-CG2 4.11Å; R534-V557 VanDerWaalsContact CZ-CG2 3.41Å; V557-S559 PolarHBondContact O-N 3.5Å; V557-S559 PolarHBondContact O-OG 2.96Å
558	L	95.1	Very high	90.6	Very high	3 Å²	3	36.8 Å²	36.8	2%	0.016	21%	0.208	C	C	.	.			trans	-72	113.8	167.3	-48.1	-170.6	0	0	0	106.9	G528 V536 L554 T561 G573 N574 H580 F582	G528-L558 WeakPolarHBondContact CA-O 3.34Å; V536-L558 HydrophobicContact CG2-CB 4.08Å; V536-L558 HydrophobicContact CG2-CD1 3.64Å; V536-L558 HydrophobicContact CG2-CG 4.13Å; L554-L558 HydrophobicContact CD1-CD1 3.71Å; L554-L558 HydrophobicContact CD1-CD2 3.78Å; L554-L558 HydrophobicContact CD1-CG 3.77Å; L558-T561 HydrophobicContact CB-CG2 4.45Å; L558-G573 CarbonylContact C-O 3.5Å; L558-G573 WeakPolarHBondContact CA-O 3.26Å; L558-N574 HydrophobicContact CD2-CB 4.11Å; L558-H580 HydrophobicContact CD1-CB 4.11Å; L558-H580 HydrophobicContact CD2-CB 4.32Å; L558-H580 WeakPolarHBondContact CD2-CD2 3.35Å; L558-F582 HydrophobicContact CD1-CE2 4.07Å
559	S	94.7	Very high	90.5	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.007	20%	0.201	C	C	.	.			trans	-99.2	-21.8	-171.7	-54	0	0	0	0	112.5	V557 G573	V557-S559 PolarHBondContact O-N 3.5Å; V557-S559 PolarHBondContact O-OG 2.96Å; S559-G573 PolarHBondContact N-O 3.48Å
560	V	96.5	Very high	90.5	Very high	16 Å²	16	35.5 Å²	35.5	10%	0.097	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	132.8	173.4	179.8	0	0	0	0	106.3	I279 A282 G572 G573	I279-V560 HydrophobicContact CG2-CB 4.48Å; I279-V560 HydrophobicContact CG2-CG2 4.24Å; A282-V560 HydrophobicContact CB-CG1 4.03Å; V560-G572 CarbonylContact O-C 3.58Å; V560-G572 VanDerWaalsContact O-CA 3.27Å; V560-G572 WeakPolarHBondContact O-CA 3.43Å; V560-G573 PolarHBondContact N-O 3Å; V560-G573 PolarHBondContact O-N 2.76Å
561	T	96.8	Very high	90.7	Very high	5 Å²	5	30.5 Å²	30.5	3%	0.031	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	140.1	179.6	44.4	0	0	0	0	110.4	V536 L558 L571	V536-T561 HydrophobicContact CG1-CG2 4.02Å; V536-T561 HydrophobicContact CG2-CG2 4.22Å; L558-T561 HydrophobicContact CB-CG2 4.45Å; T561-L571 VanDerWaalsContact CA-O 3.28Å; T561-L571 WeakPolarHBondContact CA-O 3.38Å
562	A	95.8	Very high	91.2	Very high	18 Å²	18	27.7 Å²	27.7	15%	0.149	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	142.2	177.6	0	0	0	0	0	110.4	F284 L571	F284-A562 WeakPolarHBondContact CE2-O 3.42Å; A562-L571 PolarHBondContact N-O 2.7Å; A562-L571 VanDerWaalsContact N-O 3.09Å; A562-L571 PolarHBondContact O-N 2.89Å
563	F	95.6	Very high	91.8	Very high	12 Å²	12	19.8 Å²	19.8	5%	0.053	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	153.8	169	-79.3	-71.8	0	0	0	111	L261 D518 V526 V538 L570	L261-F563 HydrophobicContact CD2-CE1 4.11Å; L261-F563 HydrophobicContact CD2-CZ 4.25Å; D518-F563 HydrophobicContact CB-CB 4.35Å; D518-F563 HydrophobicContact CB-CD2 3.45Å; D518-F563 VanDerWaalsContact CB-CD2 3.45Å; D518-F563 HydrophobicContact CB-CE2 3.71Å; D518-F563 HydrophobicContact CB-CG 3.95Å; D518-F563 HydrophobicContact CB-CZ 4.44Å; D518-F563 WeakPolarHBondContact OD2-CD1 3.41Å; D518-F563 WeakPolarHBondContact OD2-CG 3.46Å; V526-F563 HydrophobicContact CB-CD2 4.17Å; V526-F563 HydrophobicContact CB-CE2 3.45Å; V526-F563 VanDerWaalsContact CB-CE2 3.45Å; V526-F563 HydrophobicContact CB-CZ 3.92Å; V526-F563 HydrophobicContact CG1-CD2 3.61Å; V526-F563 HydrophobicContact CG1-CE2 3.44Å; V526-F563 VanDerWaalsContact CG1-CE2 3.44Å; V526-F563 HydrophobicContact CG1-CZ 4.22Å; V526-F563 HydrophobicContact CG2-CE2 4.44Å; V538-F563 HydrophobicContact CG1-CZ 4.29Å; V538-F563 HydrophobicContact CG2-CZ 4.05Å; F563-L570 HydrophobicContact CD1-CB 4Å; F563-L570 HydrophobicContact CD1-CD1 3.98Å; F563-L570 HydrophobicContact CE1-CB 4Å; F563-L570 HydrophobicContact CE1-CD1 4.01Å; F563-L570 HydrophobicContact CE1-CD2 4.49Å; F563-L570 HydrophobicContact CE1-CG 4.39Å; F563-L570 HydrophobicContact CG-CD1 4.29Å; F563-L570 HydrophobicContact CZ-CD1 4.36Å
564	H	94.4	Very high	92.6	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.114	C	C	.	.			trans	-71.8	139.7	173.1	-172	-74.7	0	0	0	111	F284 C287 L291 K520 T566 R567 A569	F284-H564 HydrophobicContact CD1-CB 4.31Å; F284-H564 AromaticContact CD1-CD2 3.48Å; F284-H564 VanDerWaalsContact CD1-CD2 3.48Å; F284-H564 WeakPolarHBondContact CD1-CD2 3.36Å; F284-H564 HydrophobicContact CD2-CB 3.94Å; F284-H564 HydrophobicContact CE1-CB 4.35Å; F284-H564 AromaticContact CE1-CD2 3.89Å; F284-H564 HydrophobicContact CE2-CB 3.97Å; F284-H564 HydrophobicContact CG-CB 4.09Å; F284-H564 AromaticContact CG-CD2 3.83Å; F284-H564 HydrophobicContact CZ-CB 4.19Å; C287-H564 PolarHBondContact O-CE1 3.32Å; C287-H564 PolarHBondContact O-NE2 2.7Å; L291-H564 VanDerWaalsContact CD2-CD2 3.44Å; L291-H564 WeakPolarHBondContact CD2-CD2 3.19Å; K520-H564 PolarHBondContact NZ-O 3.36Å; H564-T566 PolarHBondContact ND1-N 3.28Å; H564-T566 PolarHBondContact O-N 3.35Å; H564-R567 HydrophobicContact CB-CB 4.48Å; H564-R567 WeakPolarHBondContact ND1-CB 3.44Å; H564-R567 PolarHBondContact ND1-N 3.5Å; H564-A569 HydrophobicContact CB-CB 4Å; H564-A569 PolarHBondContact N-O 2.64Å
565	P	90.6	Very high	93	Very high	37 Å²	37	19.7 Å²	19.7	24%	0.24	13%	0.126	C	C	.	.	S	Bend	trans	-56.7	-42.1	-175.3	-30.3	37.2	0	0	0	116.1	P286 K520	P286-P565 HydrophobicContact CB-CB 4.46Å; P286-P565 HydrophobicContact CB-CG 4.33Å; K520-P565 WeakPolarHBondContact CG-O 3.42Å
566	T	86.7	Confident	93.5	Very high	33 Å²	33	18.9 Å²	18.9	20%	0.202	11%	0.111	C	C	.	.	S	Bend	trans	-119.1	-51.5	-178.1	66.9	0	0	0	0	113.6	E247 K520 H564	E247-T566 HydrophobicContact CB-CG2 4.26Å; E247-T566 WeakPolarHBondContact OE2-CB 3.45Å; E247-T566 PolarHBondContact OE2-OG1 3.09Å; K520-T566 WeakPolarHBondContact CD-O 3.48Å; H564-T566 PolarHBondContact ND1-N 3.28Å; H564-T566 PolarHBondContact O-N 3.35Å
567	R	88.1	Confident	93.7	Very high	73 Å²	73	17 Å²	17	28%	0.275	10%	0.099	S	C	.	.	S	Bend	trans	-63.7	156.4	175.9	-56.7	173.5	71.1	149.1	-4.9	113.3	S288 S289 K520 H564 A569	S288-R567 WeakPolarHBondContact O-CD 3.5Å; S288-R567 PolarHBondContact O-NH1 3.47Å; S289-R567 PolarHBondContact O-NH1 2.95Å; K520-R567 WeakPolarHBondContact CE-O 3.47Å; K520-R567 PolarHBondContact NZ-O 3.33Å; H564-R567 HydrophobicContact CB-CB 4.48Å; H564-R567 WeakPolarHBondContact ND1-CB 3.44Å; H564-R567 PolarHBondContact ND1-N 3.5Å; R567-A569 PolarHBondContact O-N 3.07Å; R567-A569 VanDerWaalsContact O-N 3.13Å
568	N	89.9	Confident	93.8	Very high	58 Å²	58	18.4 Å²	18.4	31%	0.31	10%	0.103	S	C	.	.	S	Bend	trans	-81.1	83.5	167.6	-70.8	-40.4	0	0	0	110.5	L264	L264-N568 HydrophobicContact CD2-CB 4.06Å; L264-N568 VanDerWaalsContact CD2-O 3.27Å; L264-N568 WeakPolarHBondContact CD2-O 3.34Å
569	A	93.4	Very high	93.8	Very high	1 Å²	1	18.2 Å²	18.2	1%	0.008	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	149.6	171.9	0	0	0	0	0	111.7	F284 L291 H564 R567 F582 H583	F284-A569 HydrophobicContact CZ-CB 4.16Å; L291-A569 HydrophobicContact CD1-CB 4.14Å; L291-A569 HydrophobicContact CD2-CB 3.97Å; H564-A569 HydrophobicContact CB-CB 4Å; H564-A569 PolarHBondContact N-O 2.64Å; R567-A569 PolarHBondContact O-N 3.07Å; R567-A569 VanDerWaalsContact O-N 3.13Å; A569-F582 CarbonylContact C-O 3.57Å; A569-F582 WeakPolarHBondContact CA-O 3.48Å; A569-H583 HydrophobicContact CB-CB 4.06Å
570	L	95.8	Very high	93.8	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	129.5	-179.9	169.7	66.6	0	0	0	110	V526 V536 F549 F563 V581 F582	V526-L570 HydrophobicContact CB-CD1 4.39Å; V526-L570 HydrophobicContact CG1-CD1 4.01Å; V526-L570 HydrophobicContact CG2-CD1 3.88Å; V526-L570 HydrophobicContact CG2-CD2 4.18Å; V536-L570 HydrophobicContact CG1-CD2 4.08Å; F549-L570 HydrophobicContact CD2-CD2 3.34Å; F549-L570 HydrophobicContact CE2-CD2 3.34Å; F549-L570 HydrophobicContact CG-CD2 4.22Å; F549-L570 HydrophobicContact CZ-CD2 4.24Å; F563-L570 HydrophobicContact CD1-CB 4Å; F563-L570 HydrophobicContact CD1-CD1 3.98Å; F563-L570 HydrophobicContact CE1-CB 4Å; F563-L570 HydrophobicContact CE1-CD1 4.01Å; F563-L570 HydrophobicContact CE1-CD2 4.49Å; F563-L570 HydrophobicContact CE1-CG 4.39Å; F563-L570 HydrophobicContact CG-CD1 4.29Å; F563-L570 HydrophobicContact CZ-CD1 4.36Å; L570-V581 CarbonylContact O-C 3.57Å; L570-V581 WeakPolarHBondContact O-CA 3.36Å; L570-F582 HydrophobicContact CB-CB 4.37Å; L570-F582 HydrophobicContact CD2-CD2 4.14Å; L570-F582 HydrophobicContact CG-CD2 4.27Å; L570-F582 PolarHBondContact N-O 3.12Å; L570-F582 PolarHBondContact O-N 2.78Å
571	L	95.4	Very high	93.7	Very high	2 Å²	2	17.6 Å²	17.6	1%	0.01	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	141	173.3	164.6	65.4	0	0	0	110.2	A282 F284 L293 T561 A562 M579 V581	A282-L571 HydrophobicContact CB-CD2 3.78Å; F284-L571 HydrophobicContact CD2-CB 4.19Å; F284-L571 HydrophobicContact CE2-CB 3.43Å; F284-L571 VanDerWaalsContact CE2-CB 3.43Å; F284-L571 HydrophobicContact CZ-CB 3.7Å; L293-L571 HydrophobicContact CD2-CB 4.25Å; L293-L571 HydrophobicContact CD2-CD1 3.9Å; L293-L571 HydrophobicContact CD2-CD2 4.13Å; L293-L571 HydrophobicContact CD2-CG 4.31Å; T561-L571 VanDerWaalsContact CA-O 3.28Å; T561-L571 WeakPolarHBondContact CA-O 3.38Å; A562-L571 PolarHBondContact N-O 2.7Å; A562-L571 VanDerWaalsContact N-O 3.09Å; A562-L571 PolarHBondContact O-N 2.89Å; L571-M579 HydrophobicContact CD1-CB 3.78Å; L571-M579 HydrophobicContact CD1-CE 3.54Å; L571-M579 HydrophobicContact CD1-CG 4.04Å; L571-M579 HydrophobicContact CD2-CE 3.55Å; L571-M579 HydrophobicContact CG-CE 4.2Å; L571-V581 HydrophobicContact CD1-CG2 4.49Å
572	G	96	Very high	93.6	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	127.5	157.2	0	0	0	0	0	114.1	V560 H580	V560-G572 CarbonylContact O-C 3.58Å; V560-G572 VanDerWaalsContact O-CA 3.27Å; V560-G572 WeakPolarHBondContact O-CA 3.43Å; G572-H580 PolarHBondContact N-O 3.07Å; G572-H580 PolarHBondContact O-N 3.14Å
573	G	95.8	Very high	93.4	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	139.4	177.4	0	0	0	0	0	112.7	L558 S559 V560	L558-G573 CarbonylContact C-O 3.5Å; L558-G573 WeakPolarHBondContact CA-O 3.26Å; S559-G573 PolarHBondContact N-O 3.48Å; V560-G573 PolarHBondContact N-O 3Å; V560-G573 PolarHBondContact O-N 2.76Å
574	N	94.9	Very high	92.9	Very high	1 Å²	1	19 Å²	19	1%	0.005	11%	0.106	C	C	.	.			trans	-112	179.4	-175	84.8	4.8	0	0	0	114.6	I279 T556 L558 S576 G577 R578	I279-N574 PolarHBondContact N-O 3.41Å; I279-N574 VanDerWaalsContact N-O 3.17Å; T556-N574 WeakPolarHBondContact OG1-CB 3.45Å; T556-N574 PolarHBondContact OG1-ND2 2.82Å; L558-N574 HydrophobicContact CD2-CB 4.11Å; N574-S576 VanDerWaalsContact C-N 3.34Å; N574-S576 PolarHBondContact ND2-OG 3.45Å; N574-S576 VanDerWaalsContact ND2-OG 3.13Å; N574-S576 PolarHBondContact O-N 2.86Å; N574-S576 WeakPolarHBondContact OD1-CA 3.48Å; N574-S576 PolarHBondContact OD1-N 3.41Å; N574-S576 PolarHBondContact OD1-OG 3.15Å; N574-S576 VanDerWaalsContact OD1-OG 3.14Å; N574-G577 PolarHBondContact OD1-N 3.27Å; N574-G577 VanDerWaalsContact OD1-N 3.12Å; N574-R578 PolarHBondContact N-O 3.38Å; N574-R578 PolarHBondContact OD1-N 3.1Å; N574-R578 PolarHBondContact OD1-O 3.33Å
575	S	93.4	Very high	91.5	Very high	40 Å²	40	25.1 Å²	25.1	28%	0.28	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	0.3	-179.4	67.9	0	0	0	0	115.6	R278 L510	R278-S575 WeakPolarHBondContact CA-O 3.18Å; R278-S575 WeakPolarHBondContact CB-O 3.37Å; L510-S575 WeakPolarHBondContact CD2-OG 3.12Å
576	S	92.3	Very high	89.7	Confident	49 Å²	49	30 Å²	30	34%	0.343	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	13	175.7	63.6	0	0	0	0	113.3	K273 N574	K273-S576 PolarHBondContact NZ-O 2.87Å; N574-S576 VanDerWaalsContact C-N 3.34Å; N574-S576 PolarHBondContact ND2-OG 3.45Å; N574-S576 VanDerWaalsContact ND2-OG 3.13Å; N574-S576 PolarHBondContact O-N 2.86Å; N574-S576 WeakPolarHBondContact OD1-CA 3.48Å; N574-S576 PolarHBondContact OD1-N 3.41Å; N574-S576 PolarHBondContact OD1-OG 3.15Å; N574-S576 VanDerWaalsContact OD1-OG 3.14Å
577	G	93.8	Very high	87.2	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	81.5	17.1	175.6	0	0	0	0	0	114.8	K273 V274 V275 D277 N574	K273-G577 CarbonylContact C-O 3.55Å; V274-G577 PolarHBondContact N-O 2.95Å; V275-G577 PolarHBondContact N-O 3.04Å; V275-G577 VanDerWaalsContact N-O 3.12Å; V275-G577 WeakPolarHBondContact O-CA 3.23Å; D277-G577 WeakPolarHBondContact O-CA 3.16Å; D277-G577 PolarHBondContact O-N 3.36Å; N574-G577 PolarHBondContact OD1-N 3.27Å; N574-G577 VanDerWaalsContact OD1-N 3.12Å
578	R	94.6	Very high	84.6	Confident	37 Å²	37	37.1 Å²	37.1	14%	0.14	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	141.7	174.5	-55.9	-179.5	174.8	-133.9	-8.8	111.3	S165 V272 K273 I279 N574	S165-R578 PolarHBondContact O-NH1 2.95Å; S165-R578 PolarHBondContact O-NH2 3.28Å; S165-R578 PolarHBondContact OG-NH1 3.22Å; V272-R578 VanDerWaalsContact O-CA 3.32Å; V272-R578 WeakPolarHBondContact O-CA 3.04Å; K273-R578 HydrophobicContact CB-CG 4.2Å; K273-R578 HydrophobicContact CG-CG 4.43Å; I279-R578 WeakPolarHBondContact CD1-O 3.44Å; N574-R578 PolarHBondContact N-O 3.38Å; N574-R578 PolarHBondContact OD1-N 3.1Å; N574-R578 PolarHBondContact OD1-O 3.33Å
579	M	94.7	Very high	81.7	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	139.7	165.2	-65.2	171.6	87.9	0	0	107.4	V271 V272 V274 I279 A282 L293 A295 W305 L571	V271-M579 WeakPolarHBondContact CA-O 3.49Å; V272-M579 PolarHBondContact N-O 2.84Å; V272-M579 VanDerWaalsContact N-O 3.15Å; V272-M579 PolarHBondContact O-N 2.78Å; V274-M579 HydrophobicContact CB-CG 4.13Å; V274-M579 HydrophobicContact CB-SD 3.55Å; V274-M579 VanDerWaalsContact CB-SD 3.55Å; V274-M579 HydrophobicContact CG1-SD 3.65Å; V274-M579 HydrophobicContact CG2-CB 4.1Å; V274-M579 HydrophobicContact CG2-CG 3.96Å; V274-M579 HydrophobicContact CG2-SD 3.49Å; V274-M579 WeakPolarHBondContact CG2-SD 3.43Å; I279-M579 HydrophobicContact CD1-CG 3.71Å; A282-M579 HydrophobicContact CB-CE 4.33Å; L293-M579 HydrophobicContact CB-CE 3.52Å; L293-M579 HydrophobicContact CD2-CE 4.02Å; L293-M579 HydrophobicContact CG-CE 4.4Å; A295-M579 HydrophobicContact CB-CE 3.95Å; A295-M579 HydrophobicContact CB-CG 4.2Å; A295-M579 HydrophobicContact CB-SD 3.5Å; A295-M579 WeakPolarHBondContact CB-SD 3.38Å; W305-M579 HydrophobicContact CE3-CB 3.77Å; W305-M579 HydrophobicContact CE3-SD 4.09Å; W305-M579 HydrophobicContact CZ3-CB 3.61Å; L571-M579 HydrophobicContact CD1-CB 3.78Å; L571-M579 HydrophobicContact CD1-CE 3.54Å; L571-M579 HydrophobicContact CD1-CG 4.04Å; L571-M579 HydrophobicContact CD2-CE 3.55Å; L571-M579 HydrophobicContact CG-CE 4.2Å
580	H	94.7	Very high	81.1	Confident	3 Å²	3	49.8 Å²	49.8	1%	0.014	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	131.1	171.1	-63.2	-112.4	0	0	0	106.8	M266 D270 V271 L558 G572	M266-H580 HydrophobicContact CE-CB 4.48Å; D270-H580 WeakPolarHBondContact O-CA 3.02Å; V271-H580 WeakPolarHBondContact CG1-CE1 3.41Å; V271-H580 WeakPolarHBondContact CG1-ND1 3.26Å; V271-H580 WeakPolarHBondContact CG2-ND1 3.46Å; L558-H580 HydrophobicContact CD1-CB 4.11Å; L558-H580 HydrophobicContact CD2-CB 4.32Å; L558-H580 WeakPolarHBondContact CD2-CD2 3.35Å; G572-H580 PolarHBondContact N-O 3.07Å; G572-H580 PolarHBondContact O-N 3.14Å
581	V	94.7	Very high	80.3	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	141.6	175.5	178.8	0	0	0	0	109.7	M266 D270 L291 L293 W305 M307 L570 L571 H583	M266-V581 WeakPolarHBondContact CG-O 3.41Å; D270-V581 HydrophobicContact CB-CB 4.32Å; D270-V581 WeakPolarHBondContact CB-O 3.31Å; D270-V581 PolarHBondContact O-N 2.93Å; L291-V581 HydrophobicContact CD1-CG1 4.21Å; L293-V581 HydrophobicContact CD2-CG2 3.66Å; W305-V581 HydrophobicContact CH2-CB 4.47Å; W305-V581 HydrophobicContact CH2-CG2 3.74Å; W305-V581 HydrophobicContact CZ3-CG2 3.59Å; M307-V581 HydrophobicContact CE-CB 3.76Å; M307-V581 HydrophobicContact CE-CG1 3.83Å; M307-V581 HydrophobicContact CE-CG2 4.15Å; L570-V581 CarbonylContact O-C 3.57Å; L570-V581 WeakPolarHBondContact O-CA 3.36Å; L571-V581 HydrophobicContact CD1-CG2 4.49Å; V581-H583 HydrophobicContact CG1-CB 4.27Å
582	F	94.4	Very high	79.5	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.018	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	120	165.2	-55	-94.3	0	0	0	107.2	L264 K265 M266 F549 L554 L558 A569 L570	L264-F582 HydrophobicContact CB-CB 4.11Å; K265-F582 VanDerWaalsContact O-CA 3.31Å; K265-F582 WeakPolarHBondContact O-CA 3.43Å; M266-F582 HydrophobicContact CB-CD1 3.85Å; M266-F582 HydrophobicContact CB-CE1 3.95Å; M266-F582 HydrophobicContact CE-CD1 4.36Å; M266-F582 HydrophobicContact CE-CE1 3.46Å; M266-F582 VanDerWaalsContact CE-CE1 3.46Å; M266-F582 HydrophobicContact CE-CE2 4.38Å; M266-F582 HydrophobicContact CE-CZ 3.47Å; M266-F582 VanDerWaalsContact CE-CZ 3.47Å; F549-F582 HydrophobicContact CB-CD1 4.16Å; F549-F582 HydrophobicContact CB-CE1 3.81Å; F549-F582 HydrophobicContact CB-CE2 4.3Å; F549-F582 HydrophobicContact CB-CZ 3.89Å; F549-F582 HydrophobicContact CD1-CB 4.42Å; F549-F582 AromaticContact CD1-CD1 3.92Å; F549-F582 HydrophobicContact CD1-CD1 3.92Å; F549-F582 HydrophobicContact CD1-CE1 4.39Å; F549-F582 HydrophobicContact CD1-CG 4.16Å; F549-F582 HydrophobicContact CG-CD1 4.23Å; F549-F582 HydrophobicContact CG-CE1 4.38Å; F549-F582 HydrophobicContact CG-CG 4.33Å; L554-F582 HydrophobicContact CD1-CZ 4.5Å; L554-F582 HydrophobicContact CD2-CZ 4.48Å; L558-F582 HydrophobicContact CD1-CE2 4.07Å; A569-F582 CarbonylContact C-O 3.57Å; A569-F582 WeakPolarHBondContact CA-O 3.48Å; L570-F582 HydrophobicContact CB-CB 4.37Å; L570-F582 HydrophobicContact CD2-CD2 4.14Å; L570-F582 HydrophobicContact CG-CD2 4.27Å; L570-F582 PolarHBondContact N-O 3.12Å; L570-F582 PolarHBondContact O-N 2.78Å
583	H	91.8	Very high	78.5	Confident	21 Å²	21	58.5 Å²	58.5	10%	0.097	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	163.3	179.3	71.5	90.3	0	0	0	111.4	L264 K265 D270 L291 A569 V581 W585	L264-H583 WeakPolarHBondContact CA-O 3.43Å; K265-H583 PolarHBondContact N-O 3.24Å; K265-H583 PolarHBondContact O-N 2.91Å; D270-H583 IonicContact OD1-CD2 2.94Å; D270-H583 IonicContact OD1-NE2 3.89Å; D270-H583 PolarHBondContact OD1-NE2 3.15Å; D270-H583 IonicContact OD2-CD2 2.75Å; D270-H583 IonicContact OD2-NE2 2.69Å; L291-H583 HydrophobicContact CD1-CB 3.96Å; A569-H583 HydrophobicContact CB-CB 4.06Å; V581-H583 HydrophobicContact CG1-CB 4.27Å; H583-W585 AromaticContact CE1-CD1 3.93Å; H583-W585 AromaticContact CE1-CD2 3.79Å; H583-W585 AromaticContact CE1-CE2 3.61Å; H583-W585 AromaticContact CE1-CG 4Å; H583-W585 AromaticContact CE1-NE1 3.68Å; H583-W585 AromaticContact NE2-CE2 3.63Å; H583-W585 AromaticContact NE2-CZ2 3.68Å; H583-W585 AromaticContact NE2-NE1 3.71Å
584	S	85.9	Confident	77.4	Confident	39 Å²	39	62.1 Å²	62.1	27%	0.273	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	128.1	168.1	54.5	0	0	0	0	109.3	N586	S584-N586 PolarHBondContact O-N 3.44Å
585	W	64.2	Low	76.2	Confident	129 Å²	129	66.2 Å²	66.2	49%	0.489	35%	0.35	S	S	.	.			trans	-80.6	114.8	169.9	-69.1	71.6	0	0	0	108	D270 H583 E587	D270-W585 WeakPolarHBondContact OD2-CZ2 3.11Å; H583-W585 AromaticContact CE1-CD1 3.93Å; H583-W585 AromaticContact CE1-CD2 3.79Å; H583-W585 AromaticContact CE1-CE2 3.61Å; H583-W585 AromaticContact CE1-CG 4Å; H583-W585 AromaticContact CE1-NE1 3.68Å; H583-W585 AromaticContact NE2-CE2 3.63Å; H583-W585 AromaticContact NE2-CZ2 3.68Å; H583-W585 AromaticContact NE2-NE1 3.71Å; W585-E587 PolarHBondContact O-N 3.28Å
586	N	54.2	Low	75	Confident	140 Å²	140	68.1 Å²	68.1	75%	0.749	36%	0.355	S	S	*	.			trans	-78	102	167.2	-73.2	9.8	0	0	0	106.9	S584 G588	S584-N586 PolarHBondContact O-N 3.44Å; N586-G588 VanDerWaalsContact C-N 3.27Å; N586-G588 PolarHBondContact O-N 3.26Å
587	E	33.3	Very low	73.7	Confident	191 Å²	191	69.5 Å²	69.5	89%	0.893	36%	0.356	S	S	*	.			trans	-70.4	84.2	174.9	-70.1	179.4	175.4	0	0	109.9	W585	W585-E587 PolarHBondContact O-N 3.28Å
588	G	33	Very low	72	Confident	65 Å²	65	75.3 Å²	75.3	67%	0.67	39%	0.385	S	S	*	.			trans	117.4	105.1	169.3	0	0	0	0	0	115.8	N586	N586-G588 VanDerWaalsContact C-N 3.27Å; N586-G588 PolarHBondContact O-N 3.26Å
589	Q	28.8	Very low	70	Confident	275 Å²	275	78.8 Å²	78.8	100%	1.285	41%	0.408	S	S	*	.				-134.4	0	128.8	-85.2	-163.6	-38.6	0	0	108.1

Retrieved 589 of 589 residues in 246.9 ms (Link to these results)

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