P53_HUMAN Loading...

Isoform 2 of Cellular tumor antigen p53 AlphaSync

Canonical isoform description: Multifunctional transcription factor that induces cell cycle arrest, DNA repair or apoptosis upon binding to its target DNA sequence^{1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17}. Acts as a tumor suppressor in many tumor types; induces growth arrest or apoptosis depending on the physiological circumstances and cell type^{18,19,20,21,22,23,24,25,26,27,28,29,30,31,32,33}. Negatively regulates cell division by controlling expression of a set of genes required for this process^{34,35,36,37,38,39,40,41,42,43,44,45,46,47}. One of the activated genes is an inhibitor of cyclin-dependent kinases. Apoptosis induction seems to be mediated either by stimulation of BAX and FAS antigen expression, or by repression of Bcl-2 expression^48,49. Its pro-apoptotic activity is activated via its interaction with PPP1R13B/ASPP1 or TP53BP2/ASPP2⁵⁰. However, this activity is inhibited when the interaction with PPP1R13B/ASPP1 or TP53BP2/ASPP2 is displaced by PPP1R13L/iASPP⁵¹. In cooperation with mitochondrial PPIF is involved in activating oxidative stress-induced necrosis; the function is largely independent of transcription. Induces the transcription of long intergenic non-coding RNA p21 (lincRNA-p21) and lincRNA-Mkln1. LincRNA-p21 participates in TP53-dependent transcriptional repression leading to apoptosis and seems to have an effect on cell-cycle regulation. Implicated in Notch signaling cross-over. Prevents CDK7 kinase activity when associated to CAK complex in response to DNA damage, thus stopping cell cycle progression. Isoform 2 enhances the transactivation activity of isoform 1 from some but not all TP53-inducible promoters. Isoform 4 suppresses transactivation activity and impairs growth suppression mediated by isoform 1. Isoform 7 inhibits isoform 1-mediated apoptosis. Regulates the circadian clock by repressing CLOCK-BMAL1-mediated transcriptional activation of PER2⁵².

AlphaFold DB , UniProt , Accession P04637-2 (canonical: P04637), Species HUMAN (Homo sapiens, Human), Gene TP53, Length 341 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	41.6	Very low	43.7	Very low	238 Å²	238	161.6 Å²	161.6	100%	1.172	88%	0.877	S	S	*	*				0	131.7	0	-95.1	166.9	-174.1	0	0	106.4
2	E	46	Very low	44.2	Very low	198 Å²	198	157.3 Å²	157.3	93%	0.925	86%	0.863	S	S	*	*			trans	80.6	95.8	172.1	-57.9	-176.2	106.5	0	0	117.6
3	E	45.3	Very low	44.7	Very low	196 Å²	196	155 Å²	155	92%	0.916	86%	0.86	S	S	*	*	P	Polyproline II helix	trans	-90.6	145.9	151.4	-80.9	-175.6	105.9	0	0	109.5
4	P	48.7	Very low	45.4	Very low	126 Å²	126	153.3 Å²	153.3	82%	0.818	85%	0.848	S	S	*	*	P	Polyproline II helix	trans	-97.8	160.9	174.7	37.3	-30.6	0	0	0	113.7
5	Q	42.5	Very low	46.5	Very low	195 Å²	195	146.7 Å²	146.7	91%	0.911	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-74	153.2	-159.5	-66.1	155.2	-81.1	0	0	116.6
6	S	44	Very low	46.7	Very low	114 Å²	114	148.8 Å²	148.8	80%	0.797	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-81.7	135.4	171.5	49.1	0	0	0	0	113.7
7	D	42.8	Very low	47.1	Very low	166 Å²	166	148.8 Å²	148.8	89%	0.888	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-64.5	136.3	169.7	-110.5	-35	0	0	0	113
8	P	38.1	Very low	47.8	Very low	114 Å²	114	144.4 Å²	144.4	74%	0.74	79%	0.79	S	S	*	*			trans	-109.8	128.8	167.5	35.6	-23.1	0	0	0	111.5
9	S	40.5	Very low	48.2	Very low	113 Å²	113	143.5 Å²	143.5	79%	0.79	78%	0.778	S	S	*	*			trans	158.7	90.5	136.8	-168.3	0	0	0	0	109.7
10	V	41.9	Very low	48.9	Very low	144 Å²	144	139.9 Å²	139.9	87%	0.873	76%	0.764	S	S	*	*			trans	-102.5	106.5	161.8	175.8	0	0	0	0	105.6
11	E	49.7	Very low	49.6	Very low	174 Å²	174	137.4 Å²	137.4	81%	0.813	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-65.8	133.8	172.7	-106.7	-177.8	138.4	0	0	110.4
12	P	49.6	Very low	50.8	Low	110 Å²	110	131.6 Å²	131.6	71%	0.714	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-77	155.2	177.1	31.2	-31.7	0	0	0	111.4	L14	P12-L14 PolarHBondContact O-N 3.45Å
13	P	50.1	Low	51.6	Low	127 Å²	127	131 Å²	131	83%	0.825	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-69.5	131.9	-175.8	28.9	-32.9	0	0	0	111.1	S15	P13-S15 PolarHBondContact O-N 3.36Å
14	L	54.9	Low	52.6	Low	131 Å²	131	129 Å²	129	69%	0.686	70%	0.7	S	S	*	*			trans	-37.7	120.9	176.8	-77.1	148.6	0	0	0	112.7	P12 T18	P12-L14 PolarHBondContact O-N 3.45Å; L14-T18 HydrophobicContact CD2-CG2 3.68Å
15	S	62.6	Low	53.3	Low	55 Å²	55	130 Å²	130	39%	0.385	70%	0.698	S	S	.	*			trans	-71	156.4	178	104.9	0	0	0	0	110.8	P13 E17 T18	P13-S15 PolarHBondContact O-N 3.36Å; S15-E17 PolarHBondContact O-N 2.95Å; S15-E17 VanDerWaalsContact O-N 3.08Å; S15-E17 WeakPolarHBondContact OG-CB 3.32Å; S15-E17 PolarHBondContact OG-N 3.21Å; S15-T18 PolarHBondContact O-N 3.06Å; S15-T18 VanDerWaalsContact O-N 3.15Å
16	Q	49.9	Very low	53.7	Low	179 Å²	179	125.6 Å²	125.6	84%	0.836	68%	0.68	S	S	*	*	H	α-helix	trans	-58.3	-19.4	177.4	-166.4	174.7	23.4	0	0	113.1
17	E	52.3	Low	54.5	Low	150 Å²	150	125.7 Å²	125.7	70%	0.701	68%	0.678	S	S	*	*	H	α-helix	trans	-78.1	-35.2	179.6	-60.5	177.9	150.6	0	0	111.7	S15 F19 S20 D21	S15-E17 PolarHBondContact O-N 2.95Å; S15-E17 VanDerWaalsContact O-N 3.08Å; S15-E17 WeakPolarHBondContact OG-CB 3.32Å; S15-E17 PolarHBondContact OG-N 3.21Å; E17-F19 PolarHBondContact O-N 3.21Å; E17-S20 PolarHBondContact O-N 3.49Å; E17-D21 PolarHBondContact O-N 3.26Å
18	T	60.2	Low	54.7	Low	70 Å²	70	126.9 Å²	126.9	43%	0.429	68%	0.678	S	S	.	*	H	α-helix	trans	-64.5	-28.9	175.9	-39.8	0	0	0	0	111.8	L14 S15 L22	L14-T18 HydrophobicContact CD2-CG2 3.68Å; S15-T18 PolarHBondContact O-N 3.06Å; S15-T18 VanDerWaalsContact O-N 3.15Å; T18-L22 PolarHBondContact O-N 3.37Å
19	F	55.4	Low	54.8	Low	127 Å²	127	128.4 Å²	128.4	56%	0.557	68%	0.68	S	S	*	*	H	α-helix	trans	-70.4	-32.9	173.7	-97.4	-92.7	0	0	0	112.9	E17 W23	E17-F19 PolarHBondContact O-N 3.21Å; F19-W23 VanDerWaalsContact O-CD1 3.29Å; F19-W23 PolarHBondContact O-N 2.87Å
20	S	61.6	Low	54.5	Low	71 Å²	71	131.1 Å²	131.1	50%	0.497	69%	0.686	S	S	.	*	H	α-helix	trans	-71	-34.4	-179.9	-96.6	0	0	0	0	112.8	E17 W23 K24	E17-S20 PolarHBondContact O-N 3.49Å; S20-W23 PolarHBondContact O-N 2.71Å; S20-K24 WeakPolarHBondContact O-CG 3.37Å; S20-K24 PolarHBondContact O-N 2.74Å
21	D	64.8	Low	54.1	Low	87 Å²	87	129.7 Å²	129.7	47%	0.465	68%	0.677	S	S	.	*	H	α-helix	trans	-75.8	-29.8	179.2	-70.6	-24.1	0	0	0	112.5	E17 W23 K24 L25	E17-D21 PolarHBondContact O-N 3.26Å; D21-W23 VanDerWaalsContact C-N 3.28Å; D21-W23 PolarHBondContact O-N 2.79Å; D21-K24 PolarHBondContact O-N 2.88Å; D21-K24 IonicContact OD1-NZ 2.8Å; D21-K24 PolarHBondContact OD1-NZ 3.06Å; D21-L25 PolarHBondContact O-N 3.49Å
22	L	66.3	Low	53.6	Low	116 Å²	116	130 Å²	130	61%	0.607	68%	0.684	S	S	*	*	H	α-helix	trans	-65.3	-32.4	174.1	-152.2	146	0	0	0	112.1	T18	T18-L22 PolarHBondContact O-N 3.37Å
23	W	63.6	Low	52.9	Low	185 Å²	185	129.5 Å²	129.5	70%	0.701	68%	0.683	S	S	*	*	H	α-helix	trans	-76.2	-23.8	174.5	-83.2	102.5	0	0	0	114	F19 S20 D21 L25 L26	F19-W23 VanDerWaalsContact O-CD1 3.29Å; F19-W23 PolarHBondContact O-N 2.87Å; S20-W23 PolarHBondContact O-N 2.71Å; D21-W23 VanDerWaalsContact C-N 3.28Å; D21-W23 PolarHBondContact O-N 2.79Å; W23-L25 VanDerWaalsContact C-N 3.32Å; W23-L26 HydrophobicContact CE3-CD1 3.87Å; W23-L26 HydrophobicContact CZ3-CD1 4Å
24	K	65.3	Low	52	Low	155 Å²	155	129.7 Å²	129.7	67%	0.674	68%	0.684	S	S	*	*	H	α-helix	trans	-78.8	-16.5	175.9	-67.1	174.3	-163.4	157	0	113.2	S20 D21	S20-K24 WeakPolarHBondContact O-CG 3.37Å; S20-K24 PolarHBondContact O-N 2.74Å; D21-K24 PolarHBondContact O-N 2.88Å; D21-K24 IonicContact OD1-NZ 2.8Å; D21-K24 PolarHBondContact OD1-NZ 3.06Å
25	L	63	Low	51.2	Low	148 Å²	148	131.6 Å²	131.6	78%	0.775	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-3	179.6	-72.1	167.8	0	0	0	113.5	D21 W23	D21-L25 PolarHBondContact O-N 3.49Å; W23-L25 VanDerWaalsContact C-N 3.32Å
26	L	51.5	Low	49.7	Very low	102 Å²	102	134.2 Å²	134.2	53%	0.534	71%	0.71	S	S	.	*	S	Bend	trans	-88	120.7	178.1	-74.5	169	0	0	0	110.6	W23 E28	W23-L26 HydrophobicContact CE3-CD1 3.87Å; W23-L26 HydrophobicContact CZ3-CD1 4Å; L26-E28 PolarHBondContact O-N 3.23Å
27	P	60.3	Low	48.7	Very low	116 Å²	116	131.2 Å²	131.2	75%	0.753	71%	0.708	S	S	*	*			trans	-67.6	131.2	-178.1	23.6	-30.2	0	0	0	112.2	N29	P27-N29 VanDerWaalsContact C-N 3.27Å; P27-N29 PolarHBondContact O-N 3.08Å
28	E	46.2	Very low	48	Very low	190 Å²	190	132.6 Å²	132.6	89%	0.888	72%	0.715	S	S	*	*	S	Bend	trans	-74.3	71.6	170.6	-65.4	-169.7	153.7	0	0	110.5	L26	L26-E28 PolarHBondContact O-N 3.23Å
29	N	40.4	Very low	46.6	Very low	147 Å²	147	133 Å²	133	79%	0.786	73%	0.725	S	S	*	*			trans	-162.5	123.4	158.2	-109.4	-26.1	0	0	0	113.5	P27 V31	P27-N29 VanDerWaalsContact C-N 3.27Å; P27-N29 PolarHBondContact O-N 3.08Å; N29-V31 VanDerWaalsContact C-N 3.3Å; N29-V31 PolarHBondContact O-N 3.28Å
30	N	34.3	Very low	45.5	Very low	170 Å²	170	134.8 Å²	134.8	91%	0.909	74%	0.737	S	S	*	*			trans	-67.3	72.1	176.6	-78.8	-55.4	0	0	0	112.6
31	V	35.1	Very low	44	Very low	114 Å²	114	138.8 Å²	138.8	69%	0.691	75%	0.753	S	S	*	*			trans	-145	87.8	171.6	-167.8	0	0	0	0	111.2	N29	N29-V31 VanDerWaalsContact C-N 3.3Å; N29-V31 PolarHBondContact O-N 3.28Å
32	L	37.2	Very low	42.6	Very low	181 Å²	181	141.8 Å²	141.8	95%	0.948	77%	0.769	S	S	*	*			trans	-134.6	101.1	157.1	-86.1	168.9	0	0	0	109.4
33	S	35.3	Very low	41	Very low	99 Å²	99	144.4 Å²	144.4	69%	0.692	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-64.7	142.2	170.6	-55.4	0	0	0	0	110.7
34	P	32.7	Very low	39.6	Very low	131 Å²	131	143 Å²	143	85%	0.851	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-81.1	121.2	-177.1	31	-32.2	0	0	0	111.5
35	L	37.3	Very low	38.1	Very low	170 Å²	170	143.8 Å²	143.8	89%	0.89	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-93.9	143.2	168.7	-89.9	147.2	0	0	0	110.8
36	P	31.6	Very low	36.6	Very low	111 Å²	111	141.1 Å²	141.1	72%	0.721	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-87.7	161	-164.7	35.9	-34.4	0	0	0	113.8
37	S	28.9	Very low	35.9	Very low	115 Å²	115	141.4 Å²	141.4	80%	0.804	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-52.3	126.2	172.9	49.1	0	0	0	0	115.4
38	Q	37	Very low	35	Very low	179 Å²	179	141.9 Å²	141.9	84%	0.836	80%	0.795	S	S	*	*			trans	-168	103.6	146.9	-103	171	11	0	0	105.9
39	A	30.5	Very low	34.7	Very low	79 Å²	79	140.2 Å²	140.2	65%	0.653	79%	0.792	S	S	*	*				77	136.3	90.4	0	0	0	0	0	113.3
40	M	32.3	Very low	34.7	Very low	164 Å²	164	140.3 Å²	140.3	81%	0.808	79%	0.791	S	S	*	*			trans	72.2	114	166	67.3	-102	176.5	0	0	120
41	D	30.1	Very low	35	Very low	156 Å²	156	140.3 Å²	140.3	83%	0.834	79%	0.785	S	S	*	*			trans	28.9	105.4	133	-75.9	-47.3	0	0	0	117.5
42	D	36.1	Very low	35.2	Very low	149 Å²	149	143.3 Å²	143.3	80%	0.797	79%	0.792	S	S	*	*				-176.5	98.4	115.8	-111.7	-37.8	0	0	0	109.5	M44	D42-M44 PolarHBondContact O-N 3.21Å
43	L	32	Very low	35.3	Very low	172 Å²	172	145.8 Å²	145.8	90%	0.901	79%	0.789	S	S	*	*			trans	-80.6	86.6	165.8	-79	169.1	0	0	0	108
44	M	34.6	Very low	35.2	Very low	156 Å²	156	149.9 Å²	149.9	77%	0.768	79%	0.794	S	S	*	*			trans	-130.8	115.5	164.4	-79.6	-79.6	94.2	0	0	110.4	D42	D42-M44 PolarHBondContact O-N 3.21Å
45	L	32.9	Very low	35.3	Very low	170 Å²	170	149.7 Å²	149.7	89%	0.89	79%	0.791	S	S	*	*			trans	-45.8	132.6	173.5	-61.9	146.3	0	0	0	112.4
46	S	32.9	Very low	35.4	Very low	92 Å²	92	151.5 Å²	151.5	64%	0.643	80%	0.795	S	S	*	*			trans	-133.3	124.3	151.6	-150.5	0	0	0	0	109.9	D48	S46-D48 VanDerWaalsContact C-N 3.27Å; S46-D48 PolarHBondContact O-N 2.94Å; S46-D48 PolarHBondContact OG-OD2 3.27Å
47	P	36.4	Very low	35.8	Very low	108 Å²	108	153.9 Å²	153.9	70%	0.701	80%	0.802	S	S	*	*			trans	-77.1	20.4	-177.7	-16.1	32	0	0	0	117.1
48	D	40.6	Very low	36.3	Very low	126 Å²	126	154 Å²	154	67%	0.674	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	0.6	-163.5	-59.5	-63.3	0	0	0	116	S46	S46-D48 VanDerWaalsContact C-N 3.27Å; S46-D48 PolarHBondContact O-N 2.94Å; S46-D48 PolarHBondContact OG-OD2 3.27Å
49	D	39.8	Very low	36.4	Very low	156 Å²	156	148.9 Å²	148.9	83%	0.834	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	5.3	-179.8	-95.3	-57.1	0	0	0	114.3
50	I	42.1	Very low	36.8	Very low	148 Å²	148	151.2 Å²	151.2	76%	0.759	80%	0.803	S	S	*	*	S	Bend	trans	-100	-8.5	-176.2	-68	177.4	0	0	0	113.4
51	E	39.8	Very low	37.5	Very low	170 Å²	170	150.5 Å²	150.5	79%	0.794	80%	0.803	S	S	*	*	S	Bend	trans	-100	0.1	-174.9	-71.2	-146.2	137.6	0	0	115.9
52	Q	39.4	Very low	38.1	Very low	177 Å²	177	151.2 Å²	151.2	83%	0.827	80%	0.801	S	S	*	*	S	Bend	trans	-94.2	-1	-172.6	-136.3	167.9	71.3	0	0	115.6
53	W	39	Very low	38.6	Very low	234 Å²	234	148.3 Å²	148.3	89%	0.886	80%	0.798	S	S	*	*	S	Bend	trans	-110.1	2.7	-176.2	-74	1.4	0	0	0	115.4
54	F	34	Very low	38.8	Very low	185 Å²	185	146.1 Å²	146.1	81%	0.811	79%	0.794	S	S	*	*	S	Bend	trans	-138.3	72.1	-178.6	-69.4	-80.1	0	0	0	111.7
55	T	34.9	Very low	39.1	Very low	127 Å²	127	150.9 Å²	150.9	78%	0.779	80%	0.803	S	S	*	*			trans	-157	105.8	162.3	-49	0	0	0	0	110.6
56	E	38.6	Very low	40.1	Very low	207 Å²	207	151.6 Å²	151.6	97%	0.967	80%	0.804	S	S	*	*			trans	-159.5	111.3	146.7	-107.8	178.8	132.5	0	0	108.3
57	D	41.1	Very low	40.4	Very low	162 Å²	162	152.4 Å²	152.4	87%	0.866	81%	0.807	S	S	*	*			trans	-97.8	157.1	-176.1	-158.3	38.2	0	0	0	110.1
58	P	39.4	Very low	40.4	Very low	117 Å²	117	156.4 Å²	156.4	76%	0.76	82%	0.817	S	S	*	*			trans	-98.9	163.3	-155.8	39.3	-35.4	0	0	0	114.6
59	G	37.5	Very low	40.5	Very low	71 Å²	71	154.8 Å²	154.8	73%	0.732	82%	0.821	S	S	*	*			trans	-139.4	150	171.2	0	0	0	0	0	112.9
60	P	40.2	Very low	40.8	Very low	129 Å²	129	152.1 Å²	152.1	84%	0.838	82%	0.82	S	S	*	*			trans	-112.2	-176.8	-149.5	37.9	-23.9	0	0	0	114.9
61	D	45.4	Very low	41.7	Very low	148 Å²	148	150.6 Å²	150.6	79%	0.791	82%	0.82	S	S	*	*			trans	86.7	107.9	165.6	-113.9	-10.9	0	0	0	117.9
62	E	43.2	Very low	42.2	Very low	171 Å²	171	148.5 Å²	148.5	80%	0.799	82%	0.821	S	S	*	*				171.1	127.4	82.8	-124	-173.8	105.1	0	0	111.8
63	A	47.1	Very low	42.9	Very low	88 Å²	88	147 Å²	147	73%	0.727	82%	0.824	S	S	*	*			trans	53.5	141.4	149.9	0	0	0	0	0	124.5
64	P	36.5	Very low	43.6	Very low	126 Å²	126	139.8 Å²	139.8	82%	0.818	81%	0.814	S	S	*	*			trans	-103.2	143.8	-167.2	38.1	-27.2	0	0	0	113.7
65	R	40.9	Very low	44.6	Very low	256 Å²	256	136.9 Å²	136.9	97%	0.966	81%	0.814	S	S	*	*			trans	-142.4	134.5	160.2	-110.2	177.3	-178	174.1	0.8	113.1
66	M	53.7	Low	45.7	Very low	186 Å²	186	135.1 Å²	135.1	92%	0.916	81%	0.812	S	S	*	*			trans	-59.7	169.7	-167.8	-81.9	-80.7	178.2	0	0	116.5
67	P	39.8	Very low	46.6	Very low	108 Å²	108	131.2 Å²	131.2	70%	0.701	80%	0.804	S	S	*	*			trans	-100.5	145.2	-144.8	38.1	-32.3	0	0	0	112.7
68	E	36.3	Very low	47.2	Very low	193 Å²	193	128.1 Å²	128.1	90%	0.902	80%	0.802	S	S	*	*			trans	-153.3	138.7	163.5	-152.2	157.4	134.9	0	0	113.9
69	A	42.2	Very low	48.1	Very low	92 Å²	92	126.6 Å²	126.6	76%	0.76	80%	0.799	S	S	*	*			trans	72.9	102.3	161.6	0	0	0	0	0	119
70	A	46.7	Very low	49	Very low	100 Å²	100	129.1 Å²	129.1	83%	0.826	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-56.4	133.3	166.5	0	0	0	0	0	112.7
71	P	59.7	Low	49.8	Very low	116 Å²	116	129.1 Å²	129.1	75%	0.753	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-84.1	155.9	167.3	34	-30.2	0	0	0	110.7
72	P	50.9	Low	50.4	Low	125 Å²	125	127.9 Å²	127.9	81%	0.812	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-71.9	146.9	-169.4	29.8	-33.3	0	0	0	112	A74	P72-A74 PolarHBondContact O-N 3.01Å; P72-A74 VanDerWaalsContact O-N 3.1Å
73	V	53.6	Low	51.1	Low	147 Å²	147	124.4 Å²	124.4	89%	0.891	80%	0.8	S	S	*	*			trans	-53.1	110.5	175.8	-179.6	0	0	0	0	110.1
74	A	54.7	Low	51.5	Low	82 Å²	82	124.3 Å²	124.3	68%	0.678	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-68.5	140.2	169.8	0	0	0	0	0	109.8	P72 A76	P72-A74 PolarHBondContact O-N 3.01Å; P72-A74 VanDerWaalsContact O-N 3.1Å; A74-A76 PolarHBondContact O-N 3.18Å
75	P	54.1	Low	52.3	Low	124 Å²	124	124.2 Å²	124.2	81%	0.805	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-68.5	134.9	-178	29.3	-33.1	0	0	0	110.1
76	A	58.2	Low	53.1	Low	89 Å²	89	116.2 Å²	116.2	74%	0.736	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-53.8	141	179.5	0	0	0	0	0	111.7	A74 A78	A74-A76 PolarHBondContact O-N 3.18Å; A76-A78 PolarHBondContact O-N 3.37Å
77	P	57	Low	53.4	Low	125 Å²	125	113.2 Å²	113.2	81%	0.812	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-64.7	132	178.2	26.6	-30.3	0	0	0	109.3	A79	P77-A79 PolarHBondContact O-N 3.19Å
78	A	54.2	Low	54.4	Low	98 Å²	98	112 Å²	112	81%	0.81	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-55.1	123.6	174.8	0	0	0	0	0	109.5	A76	A76-A78 PolarHBondContact O-N 3.37Å
79	A	58.2	Low	55.7	Low	85 Å²	85	105.8 Å²	105.8	70%	0.702	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-53.8	137.1	176.2	0	0	0	0	0	110.2	P77 T81	P77-A79 PolarHBondContact O-N 3.19Å; A79-T81 PolarHBondContact O-N 3Å; A79-T81 VanDerWaalsContact O-N 3.15Å
80	P	57.5	Low	57.5	Low	124 Å²	124	107 Å²	107	81%	0.805	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-62.3	122	178	24.2	-29.7	0	0	0	108.8
81	T	56.7	Low	59.5	Low	129 Å²	129	108.2 Å²	108.2	79%	0.791	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-52.1	134.6	171.9	-14.2	0	0	0	0	108.8	A79 A83	A79-T81 PolarHBondContact O-N 3Å; A79-T81 VanDerWaalsContact O-N 3.15Å; T81-A83 PolarHBondContact O-N 3.25Å
82	P	57.4	Low	61.1	Low	122 Å²	122	106 Å²	106	79%	0.792	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-56.7	119.3	176.7	-19.7	29.6	0	0	0	109.1	A84	P82-A84 PolarHBondContact O-N 3.23Å
83	A	58.1	Low	63.1	Low	97 Å²	97	105 Å²	105	80%	0.802	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-52.8	127.1	173.1	0	0	0	0	0	108.6	T81	T81-A83 PolarHBondContact O-N 3.25Å
84	A	54.8	Low	65.1	Low	86 Å²	86	98.2 Å²	98.2	71%	0.711	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-53.6	139.8	177	0	0	0	0	0	109.7	P82 A86	P82-A84 PolarHBondContact O-N 3.23Å; A84-A86 PolarHBondContact O-N 3.49Å
85	P	54.2	Low	67	Low	124 Å²	124	99.3 Å²	99.3	81%	0.805	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-58.2	127	-179.9	22	-29.8	0	0	0	109
86	A	57.6	Low	68.9	Low	88 Å²	88	95.9 Å²	95.9	73%	0.727	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-51.8	137.5	177.3	0	0	0	0	0	109.9	A84 A88	A84-A86 PolarHBondContact O-N 3.49Å; A86-A88 PolarHBondContact O-N 3.48Å
87	P	58.9	Low	70.7	Confident	123 Å²	123	94.7 Å²	94.7	80%	0.799	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-56.7	134.6	178.7	21.6	-30.3	0	0	0	109.4
88	A	60.7	Low	72.6	Confident	83 Å²	83	90.6 Å²	90.6	69%	0.686	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-53.7	143.3	174	0	0	0	0	0	109.3	A86 S90	A86-A88 PolarHBondContact O-N 3.48Å; A88-S90 PolarHBondContact O-N 3.26Å
89	P	64.3	Low	74.6	Confident	62 Å²	62	88.8 Å²	88.8	40%	0.403	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-57	118.1	179.5	23.7	-33	0	0	0	109.6	W91 P177	P89-W91 PolarHBondContact O-N 3.31Å; P89-W91 VanDerWaalsContact O-N 3.17Å; P89-P177 HydrophobicContact CG-CG 4.22Å
90	S	80.1	Confident	76.3	Confident	119 Å²	119	88.7 Å²	88.7	83%	0.832	58%	0.581	S	S	*	*			trans	-86.4	84.3	-176.2	59.6	0	0	0	0	110.2	A88	A88-S90 PolarHBondContact O-N 3.26Å
91	W	88.6	Confident	78.2	Confident	124 Å²	124	90.4 Å²	90.4	47%	0.47	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-87.3	146.5	172.2	-62.6	109.9	0	0	0	111	P89	P89-W91 PolarHBondContact O-N 3.31Å; P89-W91 VanDerWaalsContact O-N 3.17Å
92	P	92.5	Very high	80.1	Confident	70 Å²	70	87.7 Å²	87.7	46%	0.455	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-63.5	140.9	175.8	27.7	-34.1	0	0	0	110.7	F212	P92-F212 HydrophobicContact CB-CD2 4.17Å; P92-F212 HydrophobicContact CB-CE2 4.13Å; P92-F212 HydrophobicContact CG-CD1 4.43Å; P92-F212 HydrophobicContact CG-CD2 4.23Å; P92-F212 HydrophobicContact CG-CE2 4.44Å; P92-F212 HydrophobicContact CG-CG 4.22Å
93	L	94.2	Very high	82.1	Confident	104 Å²	104	86.9 Å²	86.9	55%	0.545	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-78.1	149.2	171	-61.2	178.1	0	0	0	110.1	E171	L93-E171 HydrophobicContact CD2-CB 3.96Å; L93-E171 HydrophobicContact CD2-CG 4.17Å
94	S	95.9	Very high	84	Confident	4 Å²	4	87.5 Å²	87.5	3%	0.028	53%	0.527	C	S	.	.	P	Polyproline II helix	trans	-72.4	137.6	171.6	-166	0	0	0	0	110.6	S96 T170 T211 R213	S94-S96 VanDerWaalsContact C-N 3.26Å; S94-S96 PolarHBondContact O-N 3.22Å; S94-S96 PolarHBondContact OG-O 2.81Å; S94-S96 VanDerWaalsContact OG-O 3.07Å; S94-T170 WeakPolarHBondContact CA-O 3.36Å; S94-T170 WeakPolarHBondContact CB-O 3.49Å; S94-T170 PolarHBondContact N-O 2.88Å; S94-T211 WeakPolarHBondContact CB-O 3.44Å; S94-T211 PolarHBondContact OG-O 2.97Å; S94-R213 PolarHBondContact OG-NE 2.85Å
95	S	94	Very high	85.9	Confident	106 Å²	106	84.5 Å²	84.5	74%	0.741	50%	0.504	S	S	*	.	S	Bend	trans	-79	-7.2	175.3	57.8	0	0	0	0	113.6
96	S	94.8	Very high	87.9	Confident	51 Å²	51	83.5 Å²	83.5	36%	0.357	50%	0.5	S	S	.	.			trans	-138.8	154.2	-178.4	69.7	0	0	0	0	111.9	S94 T211 R213	S94-S96 VanDerWaalsContact C-N 3.26Å; S94-S96 PolarHBondContact O-N 3.22Å; S94-S96 PolarHBondContact OG-O 2.81Å; S94-S96 VanDerWaalsContact OG-O 3.07Å; S96-T211 WeakPolarHBondContact OG-CG2 3.41Å; S96-R213 PolarHBondContact O-NE 3.38Å; S96-R213 PolarHBondContact O-NH2 3.03Å
97	V	96.1	Very high	89.8	Confident	65 Å²	65	81.7 Å²	81.7	39%	0.394	48%	0.475	S	S	.	.			trans	-115.5	121	173.6	-178.7	0	0	0	0	107.9	M169 T170	V97-M169 HydrophobicContact CG1-CB 4.03Å; V97-M169 HydrophobicContact CG1-CG 4.44Å; V97-M169 HydrophobicContact CG1-SD 4.16Å; V97-M169 HydrophobicContact CG2-CB 3.91Å; V97-T170 HydrophobicContact CG2-CG2 4.08Å
98	P	96	Very high	91.7	Very high	38 Å²	38	76.1 Å²	76.1	25%	0.247	44%	0.44	C	S	.	.			trans	-64.6	145.2	178.1	29	-36	0	0	0	109.7	Q100 M160 I162 I254	P98-Q100 PolarHBondContact O-N 3.4Å; P98-M160 HydrophobicContact CB-SD 4.37Å; P98-M160 HydrophobicContact CG-SD 3.92Å; P98-I162 HydrophobicContact CG-CG2 3.56Å; P98-I254 HydrophobicContact CB-CD1 4.36Å; P98-I254 HydrophobicContact CG-CD1 4.03Å
99	S	95.7	Very high	93.5	Very high	60 Å²	60	72.1 Å²	72.1	42%	0.42	41%	0.407	S	S	.	.			trans	-65.8	133	178.1	176.9	0	0	0	0	110.6	K101 R267	S99-K101 PolarHBondContact OG-N 2.93Å; S99-R267 WeakPolarHBondContact O-CD 3.4Å; S99-R267 PolarHBondContact O-NE 3.5Å; S99-R267 VanDerWaalsContact O-NE 3.11Å; S99-R267 PolarHBondContact OG-NH2 3.06Å; S99-R267 VanDerWaalsContact OG-NH2 3.16Å
100	Q	94.4	Very high	95.1	Very high	83 Å²	83	73.1 Å²	73.1	39%	0.388	40%	0.403	S	S	.	.			trans	-97.4	-0.5	175.5	66.6	-172.9	13.6	0	0	112.9	P98 T102 L252 I254 S269	P98-Q100 PolarHBondContact O-N 3.4Å; Q100-T102 PolarHBondContact O-N 3.11Å; Q100-L252 HydrophobicContact CB-CD1 4.46Å; Q100-I254 HydrophobicContact CB-CD1 4.35Å; Q100-S269 PolarHBondContact O-OG 3.49Å
101	K	96.8	Very high	96	Very high	160 Å²	160	68.6 Å²	68.6	70%	0.696	37%	0.369	S	S	*	.			trans	-69.7	123.7	-175.7	-176	178.3	179.3	179.6	0	110.3	S99 Y103 R267	S99-K101 PolarHBondContact OG-N 2.93Å; K101-Y103 PolarHBondContact O-N 3.33Å; K101-R267 PolarHBondContact O-NE 3.43Å; K101-R267 PolarHBondContact O-NH2 3.26Å
102	T	97.7	Very high	96.4	Very high	73 Å²	73	63.3 Å²	63.3	45%	0.448	35%	0.353	S	S	.	.			trans	-57.2	134	173.4	-56.4	0	0	0	0	110.7	Q100 R267 N268	Q100-T102 PolarHBondContact O-N 3.11Å; T102-R267 CarbonylContact C-O 3.55Å; T102-R267 WeakPolarHBondContact CA-O 3.43Å; T102-N268 HydrophobicContact CG2-CB 4.49Å; T102-N268 PolarHBondContact OG1-OD1 3.46Å
103	Y	98	Very high	96.6	Very high	104 Å²	104	61.6 Å²	61.6	41%	0.408	34%	0.338	S	S	.	.	B	Isolated β-bridge	trans	-146.3	108.4	-177.8	173.1	-120	0	0	0	108.3	K101 G105 L264 G266 R267	K101-Y103 PolarHBondContact O-N 3.33Å; Y103-G105 VanDerWaalsContact C-N 3.31Å; Y103-L264 HydrophobicContact CD1-CD2 3.93Å; Y103-L264 HydrophobicContact CD1-CG 4.24Å; Y103-L264 HydrophobicContact CE1-CD2 4.46Å; Y103-G266 CarbonylContact O-C 3.49Å; Y103-G266 VanDerWaalsContact O-CA 3.29Å; Y103-G266 WeakPolarHBondContact O-CA 3.46Å; Y103-R267 PolarHBondContact N-O 3.06Å; Y103-R267 PolarHBondContact O-N 3.35Å
104	Q	97.6	Very high	96.7	Very high	111 Å²	111	60.5 Å²	60.5	52%	0.519	33%	0.333	S	S	.	.			trans	-72.3	-29.6	179.5	-67.1	179.6	-11.9	0	0	112.2	G108 F109	Q104-G108 PolarHBondContact O-N 3.5Å; Q104-F109 WeakPolarHBondContact CA-O 3.36Å; Q104-F109 WeakPolarHBondContact O-CB 3.39Å; Q104-F109 PolarHBondContact O-N 2.68Å
105	G	96.1	Very high	96.2	Very high	22 Å²	22	68.6 Å²	68.6	23%	0.227	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	-168.8	-176.2	0	0	0	0	0	114.1	Y103 Y107 G108 L265	Y103-G105 VanDerWaalsContact C-N 3.31Å; G105-Y107 PolarHBondContact O-N 2.81Å; G105-G108 PolarHBondContact O-N 2.75Å; G105-L265 WeakPolarHBondContact CA-O 3.47Å
106	S	96.7	Very high	95.8	Very high	103 Å²	103	65.3 Å²	65.3	72%	0.72	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-16.5	-174.3	-50.6	0	0	0	0	114
107	Y	97.5	Very high	95.6	Very high	50 Å²	50	65 Å²	65	20%	0.196	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	4.9	-175.9	-53.5	-76.4	0	0	0	113.2	G105 F109 V147 D148 S149 P151 P152 L265	G105-Y107 PolarHBondContact O-N 2.81Å; Y107-F109 VanDerWaalsContact C-N 3.3Å; Y107-F109 PolarHBondContact O-N 3.47Å; Y107-V147 CarbonylContact O-C 3.59Å; Y107-V147 VanDerWaalsContact O-CA 3.3Å; Y107-V147 WeakPolarHBondContact O-CA 3.35Å; Y107-V147 WeakPolarHBondContact O-CB 3.31Å; Y107-D148 PolarHBondContact O-N 2.91Å; Y107-S149 WeakPolarHBondContact CD1-OG 3.46Å; Y107-P151 HydrophobicContact CD1-CB 4.17Å; Y107-P151 HydrophobicContact CD2-CB 4.33Å; Y107-P151 HydrophobicContact CE1-CB 4.34Å; Y107-P151 HydrophobicContact CE2-CB 4.48Å; Y107-P151 HydrophobicContact CG-CB 4.18Å; Y107-P152 VanDerWaalsContact OH-CD 3.27Å; Y107-P152 WeakPolarHBondContact OH-CD 3.4Å; Y107-P152 VanDerWaalsContact OH-CG 3.25Å; Y107-P152 WeakPolarHBondContact OH-CG 3.24Å; Y107-L265 HydrophobicContact CD2-CB 4.13Å; Y107-L265 HydrophobicContact CD2-CD1 4.42Å; Y107-L265 HydrophobicContact CE2-CB 4.2Å; Y107-L265 HydrophobicContact CE2-CD1 3.98Å; Y107-L265 HydrophobicContact CE2-CD2 4.12Å; Y107-L265 HydrophobicContact CE2-CG 4.33Å
108	G	97.6	Very high	95.5	Very high	6 Å²	6	63.6 Å²	63.6	6%	0.062	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	28.6	178.4	0	0	0	0	0	114.1	Q104 G105 R110 D148	Q104-G108 PolarHBondContact O-N 3.5Å; G105-G108 PolarHBondContact O-N 2.75Å; G108-R110 PolarHBondContact O-N 2.95Å; G108-R110 PolarHBondContact O-NH1 2.88Å; G108-D148 WeakPolarHBondContact CA-OD2 3.28Å
109	F	98.3	Very high	95.5	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.352	C	S	.	.			trans	-59.7	120.7	-172.9	178.1	-109.8	0	0	0	112.1	Q104 Y107 L111 L145 W146 V147 I255 L257 N268	Q104-F109 WeakPolarHBondContact CA-O 3.36Å; Q104-F109 WeakPolarHBondContact O-CB 3.39Å; Q104-F109 PolarHBondContact O-N 2.68Å; Y107-F109 VanDerWaalsContact C-N 3.3Å; Y107-F109 PolarHBondContact O-N 3.47Å; F109-L111 HydrophobicContact CE1-CD2 4.37Å; F109-L111 HydrophobicContact CE2-CD2 4.36Å; F109-L111 HydrophobicContact CZ-CD2 3.75Å; F109-L145 HydrophobicContact CE2-CB 4.32Å; F109-L145 HydrophobicContact CE2-CD2 4.02Å; F109-L145 HydrophobicContact CZ-CD2 4.21Å; F109-W146 WeakPolarHBondContact CA-O 3.3Å; F109-V147 HydrophobicContact CD2-CG1 4.25Å; F109-I255 HydrophobicContact CZ-CG2 3.91Å; F109-L257 HydrophobicContact CB-CD2 4.31Å; F109-L257 HydrophobicContact CD1-CB 4.31Å; F109-L257 HydrophobicContact CD2-CB 4.06Å; F109-L257 HydrophobicContact CD2-CD2 4.02Å; F109-L257 HydrophobicContact CD2-CG 4.47Å; F109-L257 HydrophobicContact CE1-CB 4.43Å; F109-L257 HydrophobicContact CE2-CB 4.19Å; F109-L257 HydrophobicContact CG-CB 4.11Å; F109-L257 HydrophobicContact CG-CD2 4.29Å; F109-L257 HydrophobicContact CZ-CB 4.38Å; F109-N268 HydrophobicContact CE1-CB 4.43Å
110	R	98.1	Very high	95.3	Very high	82 Å²	82	70.8 Å²	70.8	31%	0.309	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	158.6	175.9	65.2	-167.9	169.1	-88.8	8	110.8	G108 W146 D148	G108-R110 PolarHBondContact O-N 2.95Å; G108-R110 PolarHBondContact O-NH1 2.88Å; R110-W146 HydrophobicContact CG-CB 3.53Å; R110-W146 HydrophobicContact CG-CG 4.34Å; R110-W146 PolarHBondContact N-O 3.39Å; R110-W146 PolarHBondContact O-N 2.87Å; R110-D148 IonicContact CZ-OD1 3.37Å; R110-D148 VanDerWaalsContact CZ-OD1 3.27Å; R110-D148 VanDerWaalsContact NH1-CG 3.32Å; R110-D148 IonicContact NH1-OD1 2.87Å; R110-D148 PolarHBondContact NH1-OD1 2.97Å; R110-D148 IonicContact NH1-OD2 3.82Å; R110-D148 PolarHBondContact NH1-OD2 2.73Å; R110-D148 IonicContact NH2-OD1 3.27Å; R110-D148 PolarHBondContact NH2-OD1 2.87Å
111	L	98.4	Very high	95.4	Very high	25 Å²	25	71.8 Å²	71.8	13%	0.131	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	141.9	177.9	-59.5	178.9	0	0	0	110.2	F109 F113 V143 Q144 L145 I255 N268 F270	F109-L111 HydrophobicContact CE1-CD2 4.37Å; F109-L111 HydrophobicContact CE2-CD2 4.36Å; F109-L111 HydrophobicContact CZ-CD2 3.75Å; L111-F113 HydrophobicContact CB-CE2 4.17Å; L111-F113 HydrophobicContact CB-CZ 4.24Å; L111-F113 HydrophobicContact CD1-CZ 4.43Å; L111-V143 HydrophobicContact CD1-CG1 4.46Å; L111-V143 HydrophobicContact CD2-CG1 3.99Å; L111-Q144 CarbonylContact C-O 3.47Å; L111-Q144 VanDerWaalsContact CA-O 3.31Å; L111-Q144 WeakPolarHBondContact CA-O 3.5Å; L111-L145 HydrophobicContact CD2-CD2 3.6Å; L111-I255 HydrophobicContact CD1-CB 4.06Å; L111-I255 HydrophobicContact CD1-CG1 3.76Å; L111-I255 HydrophobicContact CD2-CB 4.12Å; L111-I255 HydrophobicContact CD2-CG1 4.26Å; L111-I255 HydrophobicContact CD2-CG2 4.11Å; L111-N268 HydrophobicContact CD1-CB 3.75Å; L111-N268 HydrophobicContact CG-CB 3.74Å; L111-F270 HydrophobicContact CD1-CD1 3.73Å; L111-F270 HydrophobicContact CD1-CE1 3.85Å
112	G	97.7	Very high	95.4	Very high	12 Å²	12	65.3 Å²	65.3	12%	0.124	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	158.2	167.7	0	0	0	0	0	110.6	Q144	G112-Q144 PolarHBondContact N-O 3.42Å; G112-Q144 WeakPolarHBondContact O-CB 3.38Å; G112-Q144 PolarHBondContact O-N 3Å
113	F	97.9	Very high	95.3	Very high	34 Å²	34	64.6 Å²	64.6	15%	0.149	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	143.2	177	-57.9	-86.9	0	0	0	108.5	L111 H115 Y126 M133 V143 F270	L111-F113 HydrophobicContact CB-CE2 4.17Å; L111-F113 HydrophobicContact CB-CZ 4.24Å; L111-F113 HydrophobicContact CD1-CZ 4.43Å; F113-H115 PolarHBondContact O-N 2.86Å; F113-Y126 HydrophobicContact CB-CD1 3.79Å; F113-Y126 HydrophobicContact CB-CD2 4.37Å; F113-Y126 HydrophobicContact CB-CG 3.69Å; F113-Y126 AromaticContact CD1-CD2 3.93Å; F113-Y126 HydrophobicContact CD1-CD2 3.93Å; F113-Y126 HydrophobicContact CD1-CE2 4.46Å; F113-Y126 HydrophobicContact CD1-CG 4.09Å; F113-Y126 AromaticContact CD2-CD1 3.59Å; F113-Y126 HydrophobicContact CD2-CD1 3.59Å; F113-Y126 AromaticContact CD2-CD2 3.67Å; F113-Y126 HydrophobicContact CD2-CD2 3.67Å; F113-Y126 AromaticContact CD2-CE1 3.51Å; F113-Y126 HydrophobicContact CD2-CE1 3.51Å; F113-Y126 AromaticContact CD2-CE2 3.6Å; F113-Y126 HydrophobicContact CD2-CE2 3.6Å; F113-Y126 AromaticContact CD2-CG 3.66Å; F113-Y126 HydrophobicContact CD2-CG 3.66Å; F113-Y126 AromaticContact CD2-CZ 3.5Å; F113-Y126 HydrophobicContact CE1-CD2 4.1Å; F113-Y126 HydrophobicContact CE1-CE2 4.31Å; F113-Y126 HydrophobicContact CE2-CD1 4.4Å; F113-Y126 AromaticContact CE2-CD2 3.86Å; F113-Y126 HydrophobicContact CE2-CD2 3.86Å; F113-Y126 HydrophobicContact CE2-CE1 4.01Å; F113-Y126 AromaticContact CE2-CE2 3.42Å; F113-Y126 HydrophobicContact CE2-CE2 3.42Å; F113-Y126 VanDerWaalsContact CE2-CE2 3.42Å; F113-Y126 HydrophobicContact CE2-CG 4.32Å; F113-Y126 AromaticContact CE2-CZ 3.49Å; F113-Y126 VanDerWaalsContact CE2-CZ 3.49Å; F113-Y126 AromaticContact CG-CD1 3.81Å; F113-Y126 HydrophobicContact CG-CD1 3.81Å; F113-Y126 AromaticContact CG-CD2 3.7Å; F113-Y126 HydrophobicContact CG-CD2 3.7Å; F113-Y126 HydrophobicContact CG-CE1 4.21Å; F113-Y126 HydrophobicContact CG-CE2 4.13Å; F113-Y126 AromaticContact CG-CG 3.52Å; F113-Y126 HydrophobicContact CG-CG 3.52Å; F113-Y126 HydrophobicContact CZ-CD2 4.07Å; F113-Y126 AromaticContact CZ-CE2 3.81Å; F113-Y126 HydrophobicContact CZ-CE2 3.81Å; F113-M133 HydrophobicContact CD1-CE 3.67Å; F113-M133 HydrophobicContact CE1-CE 3.57Å; F113-V143 HydrophobicContact CD1-CG2 4.5Å; F113-V143 HydrophobicContact CE1-CG1 4.27Å; F113-V143 HydrophobicContact CE1-CG2 4.09Å; F113-F270 HydrophobicContact CE1-CD1 4.05Å; F113-F270 HydrophobicContact CE1-CD2 4.18Å; F113-F270 HydrophobicContact CE1-CE1 4.03Å; F113-F270 HydrophobicContact CE1-CE2 4.16Å; F113-F270 HydrophobicContact CE1-CG 4.12Å; F113-F270 HydrophobicContact CE1-CZ 4.09Å; F113-F270 HydrophobicContact CZ-CB 4.08Å; F113-F270 AromaticContact CZ-CD1 3.55Å; F113-F270 HydrophobicContact CZ-CD1 3.55Å; F113-F270 HydrophobicContact CZ-CD2 4.19Å; F113-F270 AromaticContact CZ-CE1 3.93Å; F113-F270 HydrophobicContact CZ-CE1 3.93Å; F113-F270 AromaticContact CZ-CG 3.68Å; F113-F270 HydrophobicContact CZ-CG 3.68Å; F113-F270 HydrophobicContact CZ-CZ 4.41Å
114	L	94.4	Very high	95.4	Very high	81 Å²	81	60.3 Å²	60.3	42%	0.424	34%	0.344	S	S	.	.			trans	-59.8	137.9	174.3	-61.7	-176.3	0	0	0	109.9	S116 P142	L114-S116 PolarHBondContact O-N 3.08Å; L114-P142 HydrophobicContact CD1-CB 4.01Å; L114-P142 HydrophobicContact CD1-CG 3.46Å; L114-P142 VanDerWaalsContact CD1-CG 3.46Å; L114-P142 HydrophobicContact CG-CB 4.31Å; L114-P142 HydrophobicContact CG-CG 3.95Å
115	H	87.1	Confident	95.4	Very high	175 Å²	175	55 Å²	55	81%	0.81	32%	0.319	S	S	*	.			trans	-77.1	71.8	179.3	-150.3	90	0	0	0	110.4	F113	F113-H115 PolarHBondContact O-N 2.86Å
116	S	85.5	Confident	95.5	Very high	36 Å²	36	55.9 Å²	55.9	25%	0.252	32%	0.316	S	S	.	.			trans	-79	134.4	175.2	-60.4	0	0	0	0	109.7	L114 C124 T125 R282	L114-S116 PolarHBondContact O-N 3.08Å; S116-C124 WeakPolarHBondContact CB-O 3.34Å; S116-C124 PolarHBondContact OG-O 3.36Å; S116-T125 PolarHBondContact O-OG1 3.42Å; S116-R282 PolarHBondContact O-NH1 3.08Å
117	G	90.4	Very high	95.5	Very high	46 Å²	46	51 Å²	51	47%	0.474	28%	0.282	S	S	.	.			trans	-66.8	-166.1	169.4	0	0	0	0	0	112.6	T125	G117-T125 PolarHBondContact O-OG1 3.38Å
118	T	94	Very high	95.5	Very high	34 Å²	34	52.4 Å²	52.4	21%	0.209	30%	0.297	C	S	.	.			trans	-114.9	27.2	-178.5	58.6	0	0	0	0	112.6	G279 R282 R283	T118-G279 WeakPolarHBondContact CB-O 3.4Å; T118-R282 HydrophobicContact CG2-CB 4.43Å; T118-R282 HydrophobicContact CG2-CG 4.12Å; T118-R283 HydrophobicContact CG2-CG 3.75Å; T118-R283 PolarHBondContact O-NH2 2.88Å; T118-R283 VanDerWaalsContact OG1-CD 3.28Å; T118-R283 WeakPolarHBondContact OG1-CD 3.33Å; T118-R283 WeakPolarHBondContact OG1-CG 3.39Å
119	A	94.9	Very high	95.4	Very high	52 Å²	52	55.6 Å²	55.6	43%	0.43	32%	0.323	S	S	.	.			trans	-64.8	157.8	178	0	0	0	0	0	111.4	S121 V122	A119-S121 PolarHBondContact O-N 3.17Å; A119-V122 HydrophobicContact CB-CG2 4.02Å; A119-V122 WeakPolarHBondContact O-CB 3.2Å; A119-V122 PolarHBondContact O-N 2.94Å
120	K	93.1	Very high	95.3	Very high	197 Å²	197	57.7 Å²	57.7	86%	0.857	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-27.5	-178.1	-67.2	-177.1	180	179.8	0	113	V122	K120-V122 VanDerWaalsContact C-N 3.3Å
121	S	94.9	Very high	95.3	Very high	105 Å²	105	56.8 Å²	56.8	73%	0.734	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-8.9	179.5	51.9	0	0	0	0	114.1	A119 T123	A119-S121 PolarHBondContact O-N 3.17Å; S121-T123 PolarHBondContact O-N 3.03Å
122	V	96.6	Very high	95.3	Very high	24 Å²	24	56.1 Å²	56.1	15%	0.145	33%	0.331	C	S	.	.			trans	-72.7	120.5	-175	179.6	0	0	0	0	110.4	A119 K120 C124 T125	A119-V122 HydrophobicContact CB-CG2 4.02Å; A119-V122 WeakPolarHBondContact O-CB 3.2Å; A119-V122 PolarHBondContact O-N 2.94Å; K120-V122 VanDerWaalsContact C-N 3.3Å; V122-C124 WeakPolarHBondContact CG1-O 3.29Å; V122-T125 HydrophobicContact CG1-CG2 4.49Å
123	T	97.5	Very high	95.3	Very high	57 Å²	57	55.6 Å²	55.6	35%	0.35	33%	0.325	S	S	.	.	S	Bend	trans	-84.7	-28.5	178.9	57.4	0	0	0	0	112.7	S121 C135 Q136 K139	S121-T123 PolarHBondContact O-N 3.03Å; T123-C135 CarbonylContact O-C 3.47Å; T123-C135 VanDerWaalsContact O-CA 3.25Å; T123-C135 WeakPolarHBondContact O-CA 3.45Å; T123-Q136 PolarHBondContact O-N 3.06Å; T123-K139 HydrophobicContact CG2-CG 4.24Å
124	C	98.2	Very high	95.4	Very high	14 Å²	14	54 Å²	54	10%	0.095	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	129	176.9	-175.7	0	0	0	0	110.7	S116 V122 F134 C135	S116-C124 WeakPolarHBondContact CB-O 3.34Å; S116-C124 PolarHBondContact OG-O 3.36Å; V122-C124 WeakPolarHBondContact CG1-O 3.29Å; C124-F134 CarbonylContact C-O 3.57Å; C124-F134 WeakPolarHBondContact CA-O 3.44Å; C124-C135 HydrophobicContact CB-CB 4.19Å
125	T	98.3	Very high	95.6	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.006	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	149.8	-179.9	-168.4	0	0	0	0	110.7	S116 G117 V122 M133 F134 P278 R282	S116-T125 PolarHBondContact O-OG1 3.42Å; G117-T125 PolarHBondContact O-OG1 3.38Å; V122-T125 HydrophobicContact CG1-CG2 4.49Å; T125-M133 WeakPolarHBondContact O-CA 3.47Å; T125-F134 HydrophobicContact CG2-CB 3.88Å; T125-F134 PolarHBondContact N-O 2.85Å; T125-F134 PolarHBondContact O-N 3.46Å; T125-P278 HydrophobicContact CG2-CB 4.04Å; T125-R282 HydrophobicContact CG2-CB 4.03Å; T125-R282 HydrophobicContact CG2-CG 4.48Å; T125-R282 PolarHBondContact OG1-NH1 3.32Å
126	Y	98.4	Very high	96.1	Very high	40 Å²	40	44.1 Å²	44.1	16%	0.157	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	135.9	-179.8	176.6	-100.9	0	0	0	110.4	F113 P128 N131 M133 F270 R282	F113-Y126 HydrophobicContact CB-CD1 3.79Å; F113-Y126 HydrophobicContact CB-CD2 4.37Å; F113-Y126 HydrophobicContact CB-CG 3.69Å; F113-Y126 AromaticContact CD1-CD2 3.93Å; F113-Y126 HydrophobicContact CD1-CD2 3.93Å; F113-Y126 HydrophobicContact CD1-CE2 4.46Å; F113-Y126 HydrophobicContact CD1-CG 4.09Å; F113-Y126 AromaticContact CD2-CD1 3.59Å; F113-Y126 HydrophobicContact CD2-CD1 3.59Å; F113-Y126 AromaticContact CD2-CD2 3.67Å; F113-Y126 HydrophobicContact CD2-CD2 3.67Å; F113-Y126 AromaticContact CD2-CE1 3.51Å; F113-Y126 HydrophobicContact CD2-CE1 3.51Å; F113-Y126 AromaticContact CD2-CE2 3.6Å; F113-Y126 HydrophobicContact CD2-CE2 3.6Å; F113-Y126 AromaticContact CD2-CG 3.66Å; F113-Y126 HydrophobicContact CD2-CG 3.66Å; F113-Y126 AromaticContact CD2-CZ 3.5Å; F113-Y126 HydrophobicContact CE1-CD2 4.1Å; F113-Y126 HydrophobicContact CE1-CE2 4.31Å; F113-Y126 HydrophobicContact CE2-CD1 4.4Å; F113-Y126 AromaticContact CE2-CD2 3.86Å; F113-Y126 HydrophobicContact CE2-CD2 3.86Å; F113-Y126 HydrophobicContact CE2-CE1 4.01Å; F113-Y126 AromaticContact CE2-CE2 3.42Å; F113-Y126 HydrophobicContact CE2-CE2 3.42Å; F113-Y126 VanDerWaalsContact CE2-CE2 3.42Å; F113-Y126 HydrophobicContact CE2-CG 4.32Å; F113-Y126 AromaticContact CE2-CZ 3.49Å; F113-Y126 VanDerWaalsContact CE2-CZ 3.49Å; F113-Y126 AromaticContact CG-CD1 3.81Å; F113-Y126 HydrophobicContact CG-CD1 3.81Å; F113-Y126 AromaticContact CG-CD2 3.7Å; F113-Y126 HydrophobicContact CG-CD2 3.7Å; F113-Y126 HydrophobicContact CG-CE1 4.21Å; F113-Y126 HydrophobicContact CG-CE2 4.13Å; F113-Y126 AromaticContact CG-CG 3.52Å; F113-Y126 HydrophobicContact CG-CG 3.52Å; F113-Y126 HydrophobicContact CZ-CD2 4.07Å; F113-Y126 AromaticContact CZ-CE2 3.81Å; F113-Y126 HydrophobicContact CZ-CE2 3.81Å; Y126-P128 HydrophobicContact CD1-CG 4.16Å; Y126-P128 HydrophobicContact CE1-CB 4.26Å; Y126-P128 HydrophobicContact CE1-CG 4.11Å; Y126-P128 WeakPolarHBondContact O-CD 3.4Å; Y126-N131 WeakPolarHBondContact OH-CA 3.29Å; Y126-N131 PolarHBondContact OH-OD1 3.16Å; Y126-M133 HydrophobicContact CD2-CB 4.41Å; Y126-F270 HydrophobicContact CE2-CB 4.3Å; Y126-R282 PolarHBondContact O-NE 2.95Å; Y126-R282 PolarHBondContact O-NH1 2.94Å
127	S	97.7	Very high	96.7	Very high	0 Å²	0	45 Å²	45	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	111.6	171.9	-179.9	0	0	0	0	109.6	A129 L130 N131 K132 E286	S127-A129 VanDerWaalsContact C-N 3.31Å; S127-A129 PolarHBondContact O-N 3.18Å; S127-L130 PolarHBondContact O-N 3.43Å; S127-L130 PolarHBondContact OG-N 3.42Å; S127-N131 WeakPolarHBondContact O-CA 3.11Å; S127-N131 PolarHBondContact O-N 2.98Å; S127-K132 PolarHBondContact N-O 2.81Å; S127-K132 PolarHBondContact O-N 3.4Å; S127-K132 VanDerWaalsContact O-N 3.17Å; S127-E286 WeakPolarHBondContact CB-OE1 3.37Å; S127-E286 WeakPolarHBondContact OG-CG 3.26Å; S127-E286 PolarHBondContact OG-OE1 3.3Å
128	P	96.4	Very high	97	Very high	79 Å²	79	45.2 Å²	45.2	51%	0.513	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-39.6	173	-23.9	34.6	0	0	0	112.4	Y126 L130 N131	Y126-P128 HydrophobicContact CD1-CG 4.16Å; Y126-P128 HydrophobicContact CE1-CB 4.26Å; Y126-P128 HydrophobicContact CE1-CG 4.11Å; Y126-P128 WeakPolarHBondContact O-CD 3.4Å; P128-L130 VanDerWaalsContact C-N 3.27Å; P128-L130 PolarHBondContact O-N 2.65Å; P128-N131 PolarHBondContact O-N 2.96Å
129	A	95.8	Very high	97.2	Very high	74 Å²	74	48.3 Å²	48.3	61%	0.612	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-31.5	-178.2	0	0	0	0	0	113.2	S127 L289	S127-A129 VanDerWaalsContact C-N 3.31Å; S127-A129 PolarHBondContact O-N 3.18Å; A129-L289 HydrophobicContact CB-CD2 4.12Å
130	L	96.7	Very high	97.3	Very high	43 Å²	43	48.3 Å²	48.3	23%	0.225	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-7.2	179.8	-64.6	169.4	0	0	0	113.3	S127 P128 K132 F134 E285 E286 L289	S127-L130 PolarHBondContact O-N 3.43Å; S127-L130 PolarHBondContact OG-N 3.42Å; P128-L130 VanDerWaalsContact C-N 3.27Å; P128-L130 PolarHBondContact O-N 2.65Å; L130-K132 HydrophobicContact CB-CB 3.69Å; L130-K132 PolarHBondContact O-N 3.25Å; L130-F134 HydrophobicContact CD1-CE2 4.34Å; L130-F134 HydrophobicContact CD1-CZ 4.14Å; L130-E285 HydrophobicContact CD1-CB 3.68Å; L130-E286 HydrophobicContact CD1-CG 4.05Å; L130-L289 HydrophobicContact CD2-CB 4.21Å; L130-L289 HydrophobicContact CD2-CD1 4.34Å; L130-L289 HydrophobicContact CD2-CD2 3.79Å; L130-L289 HydrophobicContact CD2-CG 4.34Å; L130-L289 HydrophobicContact CG-CD2 4.41Å
131	N	97.6	Very high	97.5	Very high	63 Å²	63	39 Å²	39	34%	0.337	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.2	52.1	-162.8	-175	26.4	0	0	0	111.9	Y126 S127 P128 S269 F270 E271	Y126-N131 WeakPolarHBondContact OH-CA 3.29Å; Y126-N131 PolarHBondContact OH-OD1 3.16Å; S127-N131 WeakPolarHBondContact O-CA 3.11Å; S127-N131 PolarHBondContact O-N 2.98Å; P128-N131 PolarHBondContact O-N 2.96Å; N131-S269 PolarHBondContact ND2-O 3.18Å; N131-F270 WeakPolarHBondContact OD1-CB 3.31Å; N131-E271 PolarHBondContact O-N 3.47Å
132	K	98.3	Very high	97.7	Very high	11 Å²	11	35 Å²	35	5%	0.048	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	125.8	-167.7	-174.7	169.5	178.7	168.7	0	112.8	S127 L130 F134 E271 E285	S127-K132 PolarHBondContact N-O 2.81Å; S127-K132 PolarHBondContact O-N 3.4Å; S127-K132 VanDerWaalsContact O-N 3.17Å; L130-K132 HydrophobicContact CB-CB 3.69Å; L130-K132 PolarHBondContact O-N 3.25Å; K132-F134 HydrophobicContact CB-CE2 4.01Å; K132-F134 HydrophobicContact CB-CZ 4.49Å; K132-F134 HydrophobicContact CD-CE1 4.2Å; K132-F134 HydrophobicContact CD-CE2 3.91Å; K132-F134 HydrophobicContact CD-CZ 3.56Å; K132-F134 HydrophobicContact CG-CD2 4.24Å; K132-F134 HydrophobicContact CG-CE2 3.68Å; K132-F134 HydrophobicContact CG-CZ 3.87Å; K132-E271 CarbonylContact C-O 3.47Å; K132-E271 WeakPolarHBondContact CA-O 3.46Å; K132-E271 HydrophobicContact CB-CB 4.05Å; K132-E271 HydrophobicContact CD-CB 4.24Å; K132-E271 HydrophobicContact CD-CG 3.88Å; K132-E271 WeakPolarHBondContact CD-OE1 3.2Å; K132-E271 WeakPolarHBondContact CE-OE1 3.44Å; K132-E271 HydrophobicContact CG-CB 3.85Å; K132-E271 HydrophobicContact CG-CG 3.9Å; K132-E271 IonicContact NZ-OE1 3.53Å; K132-E271 PolarHBondContact NZ-OE1 2.59Å; K132-E285 WeakPolarHBondContact CE-OE2 3.29Å; K132-E285 VanDerWaalsContact NZ-CD 3.28Å; K132-E285 IonicContact NZ-OE1 3.86Å; K132-E285 PolarHBondContact NZ-OE1 3.33Å; K132-E285 VanDerWaalsContact NZ-OE1 3.08Å; K132-E285 IonicContact NZ-OE2 3.29Å; K132-E285 PolarHBondContact NZ-OE2 3.17Å
133	M	98.6	Very high	97.8	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	134.6	170.2	-176.9	-176.8	-72.1	0	0	110.4	F113 T125 Y126 C141 V143 Y236 F270 E271 V272 R273	F113-M133 HydrophobicContact CD1-CE 3.67Å; F113-M133 HydrophobicContact CE1-CE 3.57Å; T125-M133 WeakPolarHBondContact O-CA 3.47Å; Y126-M133 HydrophobicContact CD2-CB 4.41Å; M133-C141 HydrophobicContact CE-CB 4.39Å; M133-C141 HydrophobicContact SD-CB 3.86Å; M133-V143 HydrophobicContact CE-CG2 3.8Å; M133-Y236 HydrophobicContact SD-CE2 4.1Å; M133-F270 HydrophobicContact CB-CD2 3.9Å; M133-F270 HydrophobicContact CB-CE2 4.03Å; M133-F270 HydrophobicContact CE-CD2 4.39Å; M133-F270 HydrophobicContact CE-CE2 3.66Å; M133-F270 HydrophobicContact CE-CZ 4.09Å; M133-F270 HydrophobicContact SD-CE2 3.98Å; M133-E271 PolarHBondContact N-O 3.42Å; M133-V272 HydrophobicContact CB-CG2 4.41Å; M133-V272 CarbonylContact O-C 3.58Å; M133-V272 WeakPolarHBondContact O-CA 3.48Å; M133-R273 PolarHBondContact O-N 3.4Å
134	F	98.6	Very high	97.8	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	124.6	170.3	-59.7	-103.3	0	0	0	107.5	C124 T125 L130 K132 R273 P278 D281 R282 E285	C124-F134 CarbonylContact C-O 3.57Å; C124-F134 WeakPolarHBondContact CA-O 3.44Å; T125-F134 HydrophobicContact CG2-CB 3.88Å; T125-F134 PolarHBondContact N-O 2.85Å; T125-F134 PolarHBondContact O-N 3.46Å; L130-F134 HydrophobicContact CD1-CE2 4.34Å; L130-F134 HydrophobicContact CD1-CZ 4.14Å; K132-F134 HydrophobicContact CB-CE2 4.01Å; K132-F134 HydrophobicContact CB-CZ 4.49Å; K132-F134 HydrophobicContact CD-CE1 4.2Å; K132-F134 HydrophobicContact CD-CE2 3.91Å; K132-F134 HydrophobicContact CD-CZ 3.56Å; K132-F134 HydrophobicContact CG-CD2 4.24Å; K132-F134 HydrophobicContact CG-CE2 3.68Å; K132-F134 HydrophobicContact CG-CZ 3.87Å; F134-R273 WeakPolarHBondContact CA-O 3.35Å; F134-R273 HydrophobicContact CD1-CB 4.03Å; F134-R273 HydrophobicContact CD1-CG 4.31Å; F134-R273 HydrophobicContact CE1-CB 4.34Å; F134-P278 HydrophobicContact CB-CB 3.77Å; F134-P278 WeakPolarHBondContact O-CB 3.29Å; F134-D281 HydrophobicContact CD1-CB 3.84Å; F134-D281 HydrophobicContact CE1-CB 4.08Å; F134-R282 HydrophobicContact CD1-CB 4.4Å; F134-R282 HydrophobicContact CD2-CB 3.67Å; F134-R282 HydrophobicContact CD2-CG 4.1Å; F134-R282 HydrophobicContact CE2-CB 3.82Å; F134-R282 HydrophobicContact CE2-CG 4Å; F134-R282 HydrophobicContact CG-CB 4Å; F134-R282 HydrophobicContact CZ-CB 4.24Å; F134-E285 HydrophobicContact CE1-CB 4.49Å; F134-E285 HydrophobicContact CE1-CG 4.22Å; F134-E285 WeakPolarHBondContact CE1-OE1 3.25Å; F134-E285 HydrophobicContact CZ-CB 4.07Å; F134-E285 HydrophobicContact CZ-CG 4.25Å
135	C	98.5	Very high	97.8	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	161.2	-177.8	59.8	0	0	0	0	112.4	T123 C124 C141 R273 V274 C275	T123-C135 CarbonylContact O-C 3.47Å; T123-C135 VanDerWaalsContact O-CA 3.25Å; T123-C135 WeakPolarHBondContact O-CA 3.45Å; C124-C135 HydrophobicContact CB-CB 4.19Å; C135-C141 WeakPolarHBondContact CB-SG 3.27Å; C135-R273 PolarHBondContact N-O 3.11Å; C135-V274 CarbonylContact O-C 3.48Å; C135-V274 VanDerWaalsContact O-CA 3.27Å; C135-V274 WeakPolarHBondContact O-CA 3.16Å; C135-C275 PolarHBondContact O-N 2.76Å
136	Q	98.4	Very high	97.8	Very high	50 Å²	50	35.4 Å²	35.4	23%	0.234	20%	0.197	C	C	.	.			trans	-86.8	154.9	170.5	-74.5	179.4	-29.1	0	0	111.2	T123 A138 K139 C275 A276 P278	T123-Q136 PolarHBondContact O-N 3.06Å; Q136-A138 PolarHBondContact O-N 2.84Å; Q136-K139 HydrophobicContact CB-CB 4.15Å; Q136-K139 HydrophobicContact CB-CG 3.56Å; Q136-K139 PolarHBondContact O-N 2.63Å; Q136-C275 WeakPolarHBondContact CA-O 3.3Å; Q136-C275 WeakPolarHBondContact CG-O 3.06Å; Q136-A276 PolarHBondContact NE2-O 2.78Å; Q136-P278 HydrophobicContact CG-CG 3.76Å
137	L	97.7	Very high	97.8	Very high	55 Å²	55	34.6 Å²	34.6	29%	0.288	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	131.4	173.8	-177.4	68.8	0	0	0	111	K139 C238 V274	L137-K139 PolarHBondContact O-N 3.26Å; L137-C238 VanDerWaalsContact CD1-CA 3.45Å; L137-V274 HydrophobicContact CB-CG1 4.45Å
138	A	96.8	Very high	97.8	Very high	49 Å²	49	40 Å²	40	41%	0.405	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	23	174.9	0	0	0	0	0	114.9	Q136 Y236 M237	Q136-A138 PolarHBondContact O-N 2.84Å; A138-Y236 PolarHBondContact N-O 2.99Å; A138-M237 HydrophobicContact CB-CE 3.73Å; A138-M237 HydrophobicContact CB-SD 4.01Å
139	K	97.6	Very high	97.7	Very high	99 Å²	99	38.8 Å²	38.8	43%	0.43	22%	0.219	S	C	.	.			trans	-96.2	151.3	171.2	-63.1	-54.3	-175.1	-177.1	0	111	T123 Q136 L137 C141 N235	T123-K139 HydrophobicContact CG2-CG 4.24Å; Q136-K139 HydrophobicContact CB-CB 4.15Å; Q136-K139 HydrophobicContact CB-CG 3.56Å; Q136-K139 PolarHBondContact O-N 2.63Å; L137-K139 PolarHBondContact O-N 3.26Å; K139-C141 PolarHBondContact O-N 3.46Å; K139-C141 PolarHBondContact O-SG 2.78Å; K139-N235 PolarHBondContact O-ND2 3.26Å
140	T	97.8	Very high	97.8	Very high	53 Å²	53	40 Å²	40	33%	0.325	22%	0.219	S	C	.	.			trans	-61.9	124.8	179.4	-45.4	0	0	0	0	111.2	E198 H233	T140-E198 PolarHBondContact OG1-OE2 3.26Å; T140-H233 HydrophobicContact CG2-CB 3.79Å; T140-H233 VanDerWaalsContact CG2-CD2 3.49Å; T140-H233 WeakPolarHBondContact CG2-CD2 3.25Å
141	C	98.2	Very high	97.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	92.3	179.1	-60.8	0	0	0	0	109	M133 C135 K139 V143 Y234 Y236	M133-C141 HydrophobicContact CE-CB 4.39Å; M133-C141 HydrophobicContact SD-CB 3.86Å; C135-C141 WeakPolarHBondContact CB-SG 3.27Å; K139-C141 PolarHBondContact O-N 3.46Å; K139-C141 PolarHBondContact O-SG 2.78Å; C141-V143 PolarHBondContact O-N 2.77Å; C141-Y234 WeakPolarHBondContact CA-O 3.27Å; C141-Y234 VanDerWaalsContact CB-O 3.27Å; C141-Y234 WeakPolarHBondContact CB-O 3.44Å; C141-Y234 PolarHBondContact N-O 2.78Å; C141-Y234 PolarHBondContact O-N 3.34Å; C141-Y236 HydrophobicContact CB-CD2 4.49Å; C141-Y236 HydrophobicContact CB-CE2 4.25Å
142	P	97.9	Very high	97.8	Very high	22 Å²	22	37.9 Å²	37.9	14%	0.143	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	126	179.7	26.1	-30.5	0	0	0	110.8	L114 T231	L114-P142 HydrophobicContact CD1-CB 4.01Å; L114-P142 HydrophobicContact CD1-CG 3.46Å; L114-P142 VanDerWaalsContact CD1-CG 3.46Å; L114-P142 HydrophobicContact CG-CB 4.31Å; L114-P142 HydrophobicContact CG-CG 3.95Å; P142-T231 HydrophobicContact CB-CG2 3.7Å
143	V	98.5	Very high	97.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	120.3	173.8	179.3	0	0	0	0	107.9	L111 F113 M133 C141 T231 I232 Y234 F270	L111-V143 HydrophobicContact CD1-CG1 4.46Å; L111-V143 HydrophobicContact CD2-CG1 3.99Å; F113-V143 HydrophobicContact CD1-CG2 4.5Å; F113-V143 HydrophobicContact CE1-CG1 4.27Å; F113-V143 HydrophobicContact CE1-CG2 4.09Å; M133-V143 HydrophobicContact CE-CG2 3.8Å; C141-V143 PolarHBondContact O-N 2.77Å; V143-T231 WeakPolarHBondContact O-CA 3.39Å; V143-I232 PolarHBondContact N-O 3.18Å; V143-I232 PolarHBondContact O-N 3.15Å; V143-Y234 HydrophobicContact CB-CD2 4.01Å; V143-Y234 HydrophobicContact CB-CE2 3.95Å; V143-Y234 HydrophobicContact CG2-CD2 3.68Å; V143-Y234 HydrophobicContact CG2-CE2 4.05Å; V143-F270 HydrophobicContact CG1-CE1 4.48Å; V143-F270 HydrophobicContact CG2-CE1 4.5Å; V143-F270 HydrophobicContact CG2-CZ 4.02Å
144	Q	98.2	Very high	97.6	Very high	32 Å²	32	45.8 Å²	45.8	15%	0.15	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	137.9	-179.3	-61.1	175.7	-38.2	0	0	110.2	L111 G112 T230	L111-Q144 CarbonylContact C-O 3.47Å; L111-Q144 VanDerWaalsContact CA-O 3.31Å; L111-Q144 WeakPolarHBondContact CA-O 3.5Å; G112-Q144 PolarHBondContact N-O 3.42Å; G112-Q144 WeakPolarHBondContact O-CB 3.38Å; G112-Q144 PolarHBondContact O-N 3Å; Q144-T230 CarbonylContact C-O 3.59Å; Q144-T230 WeakPolarHBondContact CA-O 3.16Å
145	L	98.2	Very high	97.6	Very high	1 Å²	1	46 Å²	46	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.1	176	-49.1	-178.7	0	0	0	108	F109 L111 V157 Y220 C229 T230 I232 I255	F109-L145 HydrophobicContact CE2-CB 4.32Å; F109-L145 HydrophobicContact CE2-CD2 4.02Å; F109-L145 HydrophobicContact CZ-CD2 4.21Å; L111-L145 HydrophobicContact CD2-CD2 3.6Å; L145-V157 HydrophobicContact CD1-CB 4.26Å; L145-V157 HydrophobicContact CD1-CG1 3.92Å; L145-V157 HydrophobicContact CD1-CG2 3.52Å; L145-V157 HydrophobicContact CD2-CG1 4.3Å; L145-Y220 HydrophobicContact CD1-CD2 4.36Å; L145-C229 WeakPolarHBondContact O-CB 3.49Å; L145-T230 PolarHBondContact N-O 2.97Å; L145-T230 PolarHBondContact O-N 2.82Å; L145-T230 VanDerWaalsContact O-N 3.11Å; L145-I232 HydrophobicContact CD1-CD1 3.69Å; L145-I232 HydrophobicContact CD1-CG1 4.16Å; L145-I232 HydrophobicContact CG-CD1 4.42Å; L145-I255 HydrophobicContact CD2-CG2 4.32Å
146	W	98.3	Very high	97.6	Very high	71 Å²	71	48.7 Å²	48.7	27%	0.269	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.7	178.9	-66.7	79.2	0	0	0	108.9	F109 R110 D228 C229	F109-W146 WeakPolarHBondContact CA-O 3.3Å; R110-W146 HydrophobicContact CG-CB 3.53Å; R110-W146 HydrophobicContact CG-CG 4.34Å; R110-W146 PolarHBondContact N-O 3.39Å; R110-W146 PolarHBondContact O-N 2.87Å; W146-D228 HydrophobicContact CE3-CB 4.43Å; W146-D228 HydrophobicContact CH2-CB 3.87Å; W146-D228 HydrophobicContact CZ3-CB 3.53Å; W146-C229 HydrophobicContact CD2-CB 3.61Å; W146-C229 VanDerWaalsContact CE2-CB 3.49Å; W146-C229 HydrophobicContact CE3-CB 4.03Å; W146-C229 HydrophobicContact CG-CB 4Å; W146-C229 HydrophobicContact CH2-CB 4.24Å; W146-C229 HydrophobicContact CZ2-CB 3.83Å; W146-C229 HydrophobicContact CZ3-CB 4.33Å
147	V	97.8	Very high	97.6	Very high	24 Å²	24	46.4 Å²	46.4	15%	0.145	27%	0.273	C	S	.	.			trans	-136.8	146.6	175.1	-64.4	0	0	0	0	108.7	Y107 F109 Y220 L257	Y107-V147 CarbonylContact O-C 3.59Å; Y107-V147 VanDerWaalsContact O-CA 3.3Å; Y107-V147 WeakPolarHBondContact O-CA 3.35Å; Y107-V147 WeakPolarHBondContact O-CB 3.31Å; F109-V147 HydrophobicContact CD2-CG1 4.25Å; V147-Y220 VanDerWaalsContact CG2-OH 3.24Å; V147-Y220 WeakPolarHBondContact CG2-OH 3.38Å; V147-L257 HydrophobicContact CG1-CD2 4.38Å
148	D	97.1	Very high	97.7	Very high	112 Å²	112	45.2 Å²	45.2	60%	0.599	27%	0.265	S	S	*	.	S	Bend	trans	-87.5	-21.8	176.8	-60.8	-31.6	0	0	0	111.8	Y107 G108 R110	Y107-D148 PolarHBondContact O-N 2.91Å; G108-D148 WeakPolarHBondContact CA-OD2 3.28Å; R110-D148 IonicContact CZ-OD1 3.37Å; R110-D148 VanDerWaalsContact CZ-OD1 3.27Å; R110-D148 VanDerWaalsContact NH1-CG 3.32Å; R110-D148 IonicContact NH1-OD1 2.87Å; R110-D148 PolarHBondContact NH1-OD1 2.97Å; R110-D148 IonicContact NH1-OD2 3.82Å; R110-D148 PolarHBondContact NH1-OD2 2.73Å; R110-D148 IonicContact NH2-OD1 3.27Å; R110-D148 PolarHBondContact NH2-OD1 2.87Å
149	S	96.2	Very high	97.7	Very high	55 Å²	55	42.9 Å²	42.9	39%	0.385	25%	0.246	S	C	.	.	S	Bend	trans	-142.5	147.3	173	54.9	0	0	0	0	110.6	Y107 P151	Y107-S149 WeakPolarHBondContact CD1-OG 3.46Å; S149-P151 WeakPolarHBondContact O-CD 3.47Å
150	T	96.5	Very high	97.8	Very high	98 Å²	98	39.4 Å²	39.4	60%	0.601	23%	0.231	S	C	*	.	P	Polyproline II helix	trans	-65.9	123.6	-176.7	-53.4	0	0	0	0	110.8	P222	T150-P222 HydrophobicContact CG2-CG 4.38Å
151	P	97.3	Very high	97.8	Very high	8 Å²	8	37.4 Å²	37.4	5%	0.052	22%	0.22	C	C	.	.	P	Polyproline II helix	trans	-70.4	165.5	177.7	32.2	-37.6	0	0	0	112	Y107 S149 T155 Y220 L257 L265	Y107-P151 HydrophobicContact CD1-CB 4.17Å; Y107-P151 HydrophobicContact CD2-CB 4.33Å; Y107-P151 HydrophobicContact CE1-CB 4.34Å; Y107-P151 HydrophobicContact CE2-CB 4.48Å; Y107-P151 HydrophobicContact CG-CB 4.18Å; S149-P151 WeakPolarHBondContact O-CD 3.47Å; P151-T155 HydrophobicContact CB-CG2 4Å; P151-T155 HydrophobicContact CG-CG2 4Å; P151-Y220 VanDerWaalsContact CD-CE1 3.49Å; P151-Y220 HydrophobicContact CG-CD1 3.51Å; P151-Y220 HydrophobicContact CG-CE1 3.32Å; P151-Y220 HydrophobicContact CG-CE2 4.4Å; P151-Y220 HydrophobicContact CG-CG 4.15Å; P151-L257 HydrophobicContact CB-CD2 4.31Å; P151-L257 HydrophobicContact CG-CD2 4.41Å; P151-L265 HydrophobicContact CB-CD1 4.43Å
152	P	96.9	Very high	97.8	Very high	55 Å²	55	37.4 Å²	37.4	36%	0.357	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-64.6	157	-174.4	-21.1	34.6	0	0	0	112.6	Y107 T155	Y107-P152 VanDerWaalsContact OH-CD 3.27Å; Y107-P152 WeakPolarHBondContact OH-CD 3.4Å; Y107-P152 VanDerWaalsContact OH-CG 3.25Å; Y107-P152 WeakPolarHBondContact OH-CG 3.24Å; P152-T155 WeakPolarHBondContact O-CB 3.39Å; P152-T155 PolarHBondContact O-N 2.61Å; P152-T155 PolarHBondContact O-OG1 3.36Å
153	P	96.6	Very high	97.9	Very high	130 Å²	130	36.5 Å²	36.5	84%	0.844	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	141.6	173	-25.1	34.7	0	0	0	112.4	T155	P153-T155 VanDerWaalsContact C-N 3.32Å
154	G	96.9	Very high	97.8	Very high	48 Å²	48	41 Å²	41	50%	0.495	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	7.8	-177.4	0	0	0	0	0	114.6	S260	G154-S260 WeakPolarHBondContact O-CA 3.47Å; G154-S260 PolarHBondContact O-N 3.27Å
155	T	98.4	Very high	97.8	Very high	4 Å²	4	43.1 Å²	43.1	3%	0.025	24%	0.243	C	C	.	.			trans	-60.4	144.7	169.7	-64.1	0	0	0	0	110.8	P151 P152 P153 Y220 L257 E258 L265	P151-T155 HydrophobicContact CB-CG2 4Å; P151-T155 HydrophobicContact CG-CG2 4Å; P152-T155 WeakPolarHBondContact O-CB 3.39Å; P152-T155 PolarHBondContact O-N 2.61Å; P152-T155 PolarHBondContact O-OG1 3.36Å; P153-T155 VanDerWaalsContact C-N 3.32Å; T155-Y220 HydrophobicContact CG2-CD1 4.48Å; T155-Y220 HydrophobicContact CG2-CG 4.12Å; T155-Y220 WeakPolarHBondContact O-CB 3.42Å; T155-Y220 PolarHBondContact O-N 3.22Å; T155-L257 HydrophobicContact CG2-CD1 3.38Å; T155-L257 HydrophobicContact CG2-CD2 4.32Å; T155-L257 HydrophobicContact CG2-CG 3.64Å; T155-E258 CarbonylContact C-O 3.58Å; T155-E258 VanDerWaalsContact CA-O 3.25Å; T155-E258 WeakPolarHBondContact CA-O 3.39Å; T155-E258 WeakPolarHBondContact CG2-O 3.34Å; T155-L265 HydrophobicContact CG2-CD1 4.12Å
156	R	98.4	Very high	97.7	Very high	57 Å²	57	47.8 Å²	47.8	22%	0.215	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	156.8	-179	-58.3	-176.1	-62	179.4	-2.3	110.8	V217 V218 E258	R156-V217 HydrophobicContact CB-CG1 3.71Å; R156-V217 HydrophobicContact CG-CG1 4.31Å; R156-V218 CarbonylContact C-O 3.56Å; R156-V218 WeakPolarHBondContact CA-O 3.5Å; R156-E258 PolarHBondContact N-O 3.43Å; R156-E258 PolarHBondContact O-N 3.5Å
157	V	98.6	Very high	97.6	Very high	1 Å²	1	51 Å²	51	1%	0.006	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	118.1	177.2	-172.2	0	0	0	0	108.3	L145 V217 V218 Y220 I232 I255 T256 L257	L145-V157 HydrophobicContact CD1-CB 4.26Å; L145-V157 HydrophobicContact CD1-CG1 3.92Å; L145-V157 HydrophobicContact CD1-CG2 3.52Å; L145-V157 HydrophobicContact CD2-CG1 4.3Å; V157-V217 WeakPolarHBondContact O-CA 3.49Å; V157-V218 HydrophobicContact CB-CG2 4.17Å; V157-V218 PolarHBondContact N-O 3.4Å; V157-V218 PolarHBondContact O-N 3.16Å; V157-Y220 HydrophobicContact CG2-CD2 4.03Å; V157-I232 HydrophobicContact CB-CD1 3.8Å; V157-I232 HydrophobicContact CG1-CD1 3.66Å; V157-I232 HydrophobicContact CG2-CD1 4.19Å; V157-I255 HydrophobicContact CG1-CG2 3.6Å; V157-T256 WeakPolarHBondContact CA-O 3.39Å; V157-L257 HydrophobicContact CG2-CD1 3.92Å
158	R	98.6	Very high	97.5	Very high	31 Å²	31	51.9 Å²	51.9	12%	0.117	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.6	178.7	176.8	-170.9	-50.8	-78	-8.9	110.3	S215 V216 V217 I255 T256 E258	R158-S215 PolarHBondContact NH1-OG 3.31Å; R158-V216 CarbonylContact C-O 3.55Å; R158-V216 WeakPolarHBondContact CA-O 3.49Å; R158-V217 HydrophobicContact CB-CG2 4.05Å; R158-V217 HydrophobicContact CG-CG2 3.99Å; R158-I255 CarbonylContact O-C 3.48Å; R158-I255 VanDerWaalsContact O-CA 3.29Å; R158-I255 WeakPolarHBondContact O-CA 3.41Å; R158-T256 WeakPolarHBondContact CB-OG1 3.44Å; R158-T256 PolarHBondContact N-O 2.89Å; R158-T256 PolarHBondContact O-N 3.01Å; R158-E258 WeakPolarHBondContact CB-OE1 3.37Å; R158-E258 WeakPolarHBondContact CD-OE1 3.36Å; R158-E258 IonicContact CZ-OE1 2.66Å; R158-E258 IonicContact CZ-OE2 3.46Å; R158-E258 IonicContact NE-OE1 3.11Å; R158-E258 PolarHBondContact NE-OE1 3.13Å; R158-E258 IonicContact NE-OE2 3.63Å; R158-E258 PolarHBondContact NE-OE2 2.86Å; R158-E258 VanDerWaalsContact NE-OE2 3.13Å; R158-E258 IonicContact NH2-OE1 2.98Å; R158-E258 IonicContact NH2-OE2 3.66Å; R158-E258 PolarHBondContact NH2-OE2 2.89Å
159	A	98.7	Very high	97.4	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	134.3	166.9	0	0	0	0	0	110.9	I195 S215 V216 Y234 T253 I254 I255	A159-I195 HydrophobicContact CB-CD1 4.42Å; A159-I195 HydrophobicContact CB-CG2 4.32Å; A159-S215 WeakPolarHBondContact O-CA 3.38Å; A159-S215 WeakPolarHBondContact O-CB 3.1Å; A159-V216 HydrophobicContact CB-CG1 3.88Å; A159-V216 PolarHBondContact N-O 3.08Å; A159-V216 PolarHBondContact O-N 3.18Å; A159-Y234 HydrophobicContact CB-CD1 4.29Å; A159-Y234 HydrophobicContact CB-CE1 3.49Å; A159-Y234 VanDerWaalsContact CB-CE1 3.49Å; A159-T253 HydrophobicContact CB-CG2 4.5Å; A159-I254 WeakPolarHBondContact CA-O 3.3Å; A159-I255 HydrophobicContact CB-CD1 3.51Å
160	M	98.6	Very high	97.4	Very high	26 Å²	26	48.3 Å²	48.3	13%	0.128	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	138.3	178.6	-179.6	180	-67.7	0	0	110.4	P98 R213 T253 I254	P98-M160 HydrophobicContact CB-SD 4.37Å; P98-M160 HydrophobicContact CG-SD 3.92Å; M160-R213 HydrophobicContact CE-CB 3.9Å; M160-R213 HydrophobicContact SD-CB 4Å; M160-R213 HydrophobicContact SD-CG 4.44Å; M160-T253 WeakPolarHBondContact O-CA 3.27Å; M160-I254 PolarHBondContact N-O 2.67Å; M160-I254 PolarHBondContact O-N 2.72Å
161	A	98.6	Very high	97.5	Very high	10 Å²	10	46.3 Å²	46.3	8%	0.083	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	137.7	173.2	0	0	0	0	0	111.6	V173 L194 I195 I251 L252	A161-V173 HydrophobicContact CB-CB 3.86Å; A161-V173 HydrophobicContact CB-CG1 3.76Å; A161-V173 HydrophobicContact CB-CG2 4.22Å; A161-L194 HydrophobicContact CB-CD2 4.14Å; A161-I195 HydrophobicContact CB-CD1 3.95Å; A161-I195 HydrophobicContact CB-CG1 4.41Å; A161-I251 HydrophobicContact CB-CD1 4.46Å; A161-L252 WeakPolarHBondContact CA-O 3.25Å
162	I	98.4	Very high	97.5	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	154.4	167.5	65.3	166.3	0	0	0	110.4	P98 I251 L252 I254	P98-I162 HydrophobicContact CG-CG2 3.56Å; I162-I251 CarbonylContact O-C 3.6Å; I162-I251 WeakPolarHBondContact O-CA 3.2Å; I162-I251 WeakPolarHBondContact O-CB 3.43Å; I162-L252 HydrophobicContact CD1-CD1 4.44Å; I162-L252 HydrophobicContact CG1-CB 3.99Å; I162-L252 PolarHBondContact N-O 2.83Å; I162-L252 PolarHBondContact O-N 2.61Å; I162-I254 HydrophobicContact CD1-CD1 3.69Å; I162-I254 HydrophobicContact CG1-CD1 4Å; I162-I254 HydrophobicContact CG2-CD1 4.34Å
163	Y	98.5	Very high	97.5	Very high	3 Å²	3	44 Å²	44	1%	0.012	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	138.8	169.9	-70.5	-69.3	0	0	0	110.8	H168 M169 E171 V173 G245 M246 R249 I251	Y163-H168 HydrophobicContact CD2-CB 3.98Å; Y163-H168 WeakPolarHBondContact CD2-O 3.23Å; Y163-H168 HydrophobicContact CG-CB 3.86Å; Y163-M169 WeakPolarHBondContact O-CG 3.42Å; Y163-E171 HydrophobicContact CD2-CB 3.97Å; Y163-E171 HydrophobicContact CD2-CG 4.45Å; Y163-E171 HydrophobicContact CE2-CB 3.94Å; Y163-E171 HydrophobicContact CE2-CG 3.91Å; Y163-V173 HydrophobicContact CD1-CG2 4.28Å; Y163-V173 HydrophobicContact CD2-CG2 3.72Å; Y163-V173 HydrophobicContact CE1-CG2 4.28Å; Y163-V173 HydrophobicContact CE2-CG2 3.75Å; Y163-V173 HydrophobicContact CG-CG2 4.01Å; Y163-G245 PolarHBondContact OH-O 3.13Å; Y163-M246 HydrophobicContact CE1-CB 4.45Å; Y163-M246 HydrophobicContact CE1-CG 4.32Å; Y163-R249 HydrophobicContact CD1-CB 3.76Å; Y163-R249 HydrophobicContact CE1-CB 3.83Å; Y163-R249 PolarHBondContact OH-NH2 3.47Å; Y163-I251 HydrophobicContact CD1-CG2 3.69Å; Y163-I251 HydrophobicContact CE1-CG2 3.9Å
164	K	97.9	Very high	97.5	Very high	94 Å²	94	39.6 Å²	39.6	41%	0.409	21%	0.209	S	C	.	.	S	Bend	trans	-73.9	-34.4	-179	-177	-179.2	179.3	-177.5	0	112.6	M169 P250 L252 E271	K164-M169 VanDerWaalsContact O-CE 3.24Å; K164-M169 WeakPolarHBondContact O-CE 3.08Å; K164-P250 HydrophobicContact CB-CB 4.2Å; K164-P250 HydrophobicContact CB-CG 4.15Å; K164-P250 WeakPolarHBondContact CB-O 3.43Å; K164-P250 HydrophobicContact CD-CB 4.37Å; K164-P250 PolarHBondContact N-O 3.36Å; K164-L252 HydrophobicContact CB-CG 4.04Å; K164-L252 HydrophobicContact CD-CD2 4.32Å; K164-L252 HydrophobicContact CG-CD1 4.37Å; K164-L252 HydrophobicContact CG-CD2 4.26Å; K164-L252 HydrophobicContact CG-CG 4.14Å; K164-E271 HydrophobicContact CD-CG 4.41Å; K164-E271 WeakPolarHBondContact CD-OE2 3.49Å; K164-E271 IonicContact NZ-OE2 3.7Å; K164-E271 PolarHBondContact NZ-OE2 2.9Å
165	Q	96.9	Very high	97.6	Very high	78 Å²	78	37.4 Å²	37.4	36%	0.364	19%	0.186	S	C	.	.	S	Bend	trans	-77.1	131.5	-177.9	-69.4	173.3	-20.7	0	0	110.4	Q167 H168 M169 P250	Q165-Q167 VanDerWaalsContact C-N 3.26Å; Q165-Q167 HydrophobicContact CB-CG 4.29Å; Q165-Q167 PolarHBondContact O-N 3.08Å; Q165-H168 PolarHBondContact O-N 2.73Å; Q165-H168 PolarHBondContact OE1-CD2 2.84Å; Q165-M169 PolarHBondContact O-N 3.11Å; Q165-P250 HydrophobicContact CG-CG 4.15Å
166	S	95.6	Very high	97.5	Very high	99 Å²	99	37.4 Å²	37.4	69%	0.692	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-53.2	-40.9	-175.9	50.7	0	0	0	0	113.4	H168 M169	S166-H168 PolarHBondContact O-N 3.41Å; S166-H168 VanDerWaalsContact O-N 3.12Å; S166-M169 PolarHBondContact O-N 2.67Å
167	Q	96.3	Very high	97.4	Very high	139 Å²	139	35.9 Å²	35.9	65%	0.65	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-62.3	-17.2	179.4	72.7	-160.6	38.5	0	0	114.6	Q165	Q165-Q167 VanDerWaalsContact C-N 3.26Å; Q165-Q167 HydrophobicContact CB-CG 4.29Å; Q165-Q167 PolarHBondContact O-N 3.08Å
168	H	95.8	Very high	97.2	Very high	41 Å²	41	42.4 Å²	42.4	19%	0.19	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-117.7	1.7	-179.2	-59.6	-56.7	0	0	0	113	Y163 Q165 S166 T170 E171 R249	Y163-H168 HydrophobicContact CD2-CB 3.98Å; Y163-H168 WeakPolarHBondContact CD2-O 3.23Å; Y163-H168 HydrophobicContact CG-CB 3.86Å; Q165-H168 PolarHBondContact O-N 2.73Å; Q165-H168 PolarHBondContact OE1-CD2 2.84Å; S166-H168 PolarHBondContact O-N 3.41Å; S166-H168 VanDerWaalsContact O-N 3.12Å; H168-T170 PolarHBondContact O-N 3.08Å; H168-E171 IonicContact ND1-OE2 3.96Å; H168-E171 WeakPolarHBondContact O-CB 3.34Å; H168-E171 PolarHBondContact O-N 2.76Å; H168-R249 VanDerWaalsContact CD2-CD 3.44Å; H168-R249 WeakPolarHBondContact CD2-CD 3.43Å; H168-R249 PolarHBondContact ND1-NH1 2.89Å; H168-R249 WeakPolarHBondContact NE2-CD 3.49Å
169	M	95.8	Very high	97.1	Very high	36 Å²	36	42 Å²	42	18%	0.177	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-28.4	-173.1	-80.8	-176.5	179.3	0	0	114	V97 Y163 K164 Q165 S166 R213	V97-M169 HydrophobicContact CG1-CB 4.03Å; V97-M169 HydrophobicContact CG1-CG 4.44Å; V97-M169 HydrophobicContact CG1-SD 4.16Å; V97-M169 HydrophobicContact CG2-CB 3.91Å; Y163-M169 WeakPolarHBondContact O-CG 3.42Å; K164-M169 VanDerWaalsContact O-CE 3.24Å; K164-M169 WeakPolarHBondContact O-CE 3.08Å; Q165-M169 PolarHBondContact O-N 3.11Å; S166-M169 PolarHBondContact O-N 2.67Å; M169-R213 PolarHBondContact O-NH2 2.81Å
170	T	96.7	Very high	96.9	Very high	56 Å²	56	43.5 Å²	43.5	34%	0.344	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-18.6	176.2	54.3	0	0	0	0	112.7	S94 V97 H168	S94-T170 WeakPolarHBondContact CA-O 3.36Å; S94-T170 WeakPolarHBondContact CB-O 3.49Å; S94-T170 PolarHBondContact N-O 2.88Å; V97-T170 HydrophobicContact CG2-CG2 4.08Å; H168-T170 PolarHBondContact O-N 3.08Å
171	E	97.1	Very high	96.7	Very high	57 Å²	57	51.2 Å²	51.2	27%	0.266	25%	0.248	S	C	.	.	S	Bend	trans	-72.2	135.6	175.5	-168.1	-178.3	136.6	0	0	110.2	L93 Y163 H168 V173 R249	L93-E171 HydrophobicContact CD2-CB 3.96Å; L93-E171 HydrophobicContact CD2-CG 4.17Å; Y163-E171 HydrophobicContact CD2-CB 3.97Å; Y163-E171 HydrophobicContact CD2-CG 4.45Å; Y163-E171 HydrophobicContact CE2-CB 3.94Å; Y163-E171 HydrophobicContact CE2-CG 3.91Å; H168-E171 IonicContact ND1-OE2 3.96Å; H168-E171 WeakPolarHBondContact O-CB 3.34Å; H168-E171 PolarHBondContact O-N 2.76Å; E171-V173 PolarHBondContact O-N 2.92Å; E171-R249 IonicContact OE1-CZ 2.81Å; E171-R249 VanDerWaalsContact OE1-CZ 3.29Å; E171-R249 IonicContact OE1-NH1 2.67Å; E171-R249 PolarHBondContact OE1-NH1 3.44Å; E171-R249 IonicContact OE1-NH2 3.4Å; E171-R249 PolarHBondContact OE1-NH2 2.64Å; E171-R249 IonicContact OE2-CZ 2.68Å; E171-R249 IonicContact OE2-NH1 2.61Å; E171-R249 PolarHBondContact OE2-NH1 2.79Å; E171-R249 IonicContact OE2-NH2 3.54Å
172	V	97.6	Very high	96.2	Very high	9 Å²	9	53.6 Å²	53.6	6%	0.055	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-75	127.8	176.9	-179.1	0	0	0	0	108.8	R174 F212	V172-R174 HydrophobicContact CB-CG 4.25Å; V172-R174 HydrophobicContact CG1-CG 3.76Å; V172-R174 PolarHBondContact O-N 2.85Å; V172-F212 VanDerWaalsContact CG1-O 3.3Å; V172-F212 WeakPolarHBondContact CG1-O 3.4Å; V172-F212 HydrophobicContact CG2-CB 3.92Å; V172-F212 WeakPolarHBondContact CG2-O 3.13Å
173	V	98	Very high	95.4	Very high	5 Å²	5	59.6 Å²	59.6	3%	0.03	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-74.2	116.1	173	-179.2	0	0	0	0	108.8	A161 Y163 E171 L194 M246 I251	A161-V173 HydrophobicContact CB-CB 3.86Å; A161-V173 HydrophobicContact CB-CG1 3.76Å; A161-V173 HydrophobicContact CB-CG2 4.22Å; Y163-V173 HydrophobicContact CD1-CG2 4.28Å; Y163-V173 HydrophobicContact CD2-CG2 3.72Å; Y163-V173 HydrophobicContact CE1-CG2 4.28Å; Y163-V173 HydrophobicContact CE2-CG2 3.75Å; Y163-V173 HydrophobicContact CG-CG2 4.01Å; E171-V173 PolarHBondContact O-N 2.92Å; V173-L194 HydrophobicContact CG1-CB 4.34Å; V173-L194 HydrophobicContact CG1-CD2 3.42Å; V173-L194 VanDerWaalsContact CG1-CD2 3.42Å; V173-L194 HydrophobicContact CG1-CG 4.48Å; V173-M246 HydrophobicContact CG1-CG 4.49Å; V173-I251 HydrophobicContact CG1-CG2 4.21Å; V173-I251 HydrophobicContact CG2-CG2 4.09Å
174	R	97	Very high	94.8	Very high	37 Å²	37	62 Å²	62	14%	0.14	32%	0.319	C	S	.	.			trans	-131.4	166.2	179.9	-51.5	179.4	71.3	100	2.3	110.2	V172 E180 Q192 H214	V172-R174 HydrophobicContact CB-CG 4.25Å; V172-R174 HydrophobicContact CG1-CG 3.76Å; V172-R174 PolarHBondContact O-N 2.85Å; R174-E180 IonicContact NE-OE1 3.13Å; R174-Q192 VanDerWaalsContact NH2-CB 3.28Å; R174-Q192 VanDerWaalsContact NH2-CG 3.34Å; R174-H214 PolarHBondContact NH1-CE1 2.96Å; R174-H214 PolarHBondContact NH1-NE2 3.39Å; R174-H214 PolarHBondContact NH2-CE1 2.79Å; R174-H214 PolarHBondContact NH2-NE2 3.35Å
175	R	97.5	Very high	94.2	Very high	3 Å²	3	60.7 Å²	60.7	1%	0.011	32%	0.321	C	S	.	.			trans	-67.6	156.7	170.3	-68.8	178	69.5	-163.1	15.5	110	H179 E180 D184 P191 Q192 H193 R196 M237 C238	R175-H179 HydrophobicContact CB-CB 4.19Å; R175-H179 PolarHBondContact NH1-O 2.86Å; R175-H179 VanDerWaalsContact NH1-O 3.08Å; R175-H179 PolarHBondContact NH2-O 3.35Å; R175-E180 HydrophobicContact CB-CG 3.71Å; R175-D184 IonicContact CZ-OD1 3.86Å; R175-D184 IonicContact CZ-OD2 3.75Å; R175-D184 IonicContact NH1-OD1 3.4Å; R175-D184 PolarHBondContact NH1-OD1 2.77Å; R175-D184 IonicContact NH1-OD2 2.78Å; R175-D184 VanDerWaalsContact NH2-CG 3.27Å; R175-D184 IonicContact NH2-OD1 2.73Å; R175-D184 PolarHBondContact NH2-OD1 2.98Å; R175-D184 VanDerWaalsContact NH2-OD1 3.11Å; R175-D184 IonicContact NH2-OD2 3.2Å; R175-D184 PolarHBondContact NH2-OD2 3.41Å; R175-P191 VanDerWaalsContact CD-O 3.25Å; R175-P191 WeakPolarHBondContact CD-O 3.45Å; R175-P191 PolarHBondContact NH1-O 2.91Å; R175-P191 VanDerWaalsContact NH1-O 3.08Å; R175-Q192 PolarHBondContact N-O 2.85Å; R175-H193 WeakPolarHBondContact CD-O 3.33Å; R175-H193 WeakPolarHBondContact CG-O 3.48Å; R175-R196 VanDerWaalsContact NH1-NH2 3.19Å; R175-M237 HydrophobicContact CG-CB 4.35Å; R175-M237 PolarHBondContact NE-O 2.86Å; R175-M237 PolarHBondContact NH2-O 2.95Å; R175-C238 HydrophobicContact CG-CB 4.3Å
176	C	96.8	Very high	93.5	Very high	4 Å²	4	60.6 Å²	60.6	3%	0.027	32%	0.323	C	S	.	.			trans	-72	158.6	174.6	68.5	0	0	0	0	110.9	H178 H179 E180 C242 M243	C176-H178 PolarHBondContact O-N 2.84Å; C176-H179 PolarHBondContact O-N 2.9Å; C176-H179 PolarHBondContact SG-ND1 2.94Å; C176-H179 VanDerWaalsContact SG-ND1 3.35Å; C176-E180 WeakPolarHBondContact O-CG 3.45Å; C176-E180 PolarHBondContact O-N 3.21Å; C176-C242 HydrophobicContact CB-CB 3.92Å; C176-M243 VanDerWaalsContact CB-O 3.26Å; C176-M243 WeakPolarHBondContact CB-O 3.32Å
177	P	95.5	Very high	93.2	Very high	25 Å²	25	59.1 Å²	59.1	16%	0.162	32%	0.323	C	S	.	.	H	α-helix	trans	-55.9	-29.7	-178.6	-27	34.1	0	0	0	114.6	P89 R181 G244	P89-P177 HydrophobicContact CG-CG 4.22Å; P177-R181 WeakPolarHBondContact O-CG 3.44Å; P177-R181 PolarHBondContact O-N 3.38Å; P177-R181 PolarHBondContact O-NE 2.88Å; P177-R181 PolarHBondContact O-NH1 2.85Å; P177-R181 PolarHBondContact O-NH2 3.03Å; P177-G244 WeakPolarHBondContact CD-O 3.45Å
178	H	95.5	Very high	93	Very high	137 Å²	137	56.8 Å²	56.8	63%	0.634	32%	0.315	S	S	*	.	H	α-helix	trans	-65.5	-45.9	175.1	176.6	68	0	0	0	112	C176 C182	C176-H178 PolarHBondContact O-N 2.84Å; H178-C182 PolarHBondContact O-N 2.81Å
179	H	95.8	Very high	92.9	Very high	23 Å²	23	55 Å²	55	11%	0.106	31%	0.307	C	S	.	.	H	α-helix	trans	-77.8	-31.5	-179.9	-76.9	145.3	0	0	0	112.7	R175 C176 R181 C182 C238 C242	R175-H179 HydrophobicContact CB-CB 4.19Å; R175-H179 PolarHBondContact NH1-O 2.86Å; R175-H179 VanDerWaalsContact NH1-O 3.08Å; R175-H179 PolarHBondContact NH2-O 3.35Å; C176-H179 PolarHBondContact O-N 2.9Å; C176-H179 PolarHBondContact SG-ND1 2.94Å; C176-H179 VanDerWaalsContact SG-ND1 3.35Å; H179-R181 VanDerWaalsContact C-N 3.25Å; H179-R181 PolarHBondContact O-N 2.79Å; H179-C182 PolarHBondContact O-N 2.76Å; H179-C238 PolarHBondContact ND1-SG 3.37Å; H179-C242 PolarHBondContact CE1-SG 2.91Å
180	E	95.1	Very high	92.9	Very high	31 Å²	31	54.9 Å²	54.9	15%	0.145	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-29.1	173.7	-68.8	-169.5	154.1	0	0	112.9	R174 R175 C176 P191 Q192	R174-E180 IonicContact NE-OE1 3.13Å; R175-E180 HydrophobicContact CB-CG 3.71Å; C176-E180 WeakPolarHBondContact O-CG 3.45Å; C176-E180 PolarHBondContact O-N 3.21Å; E180-P191 WeakPolarHBondContact O-CB 3.29Å; E180-Q192 HydrophobicContact CG-CB 4.4Å; E180-Q192 HydrophobicContact CG-CG 4.21Å; E180-Q192 VanDerWaalsContact OE1-CB 3.28Å; E180-Q192 WeakPolarHBondContact OE1-CB 3.35Å; E180-Q192 WeakPolarHBondContact OE1-CG 3.19Å
181	R	93.7	Very high	92.9	Very high	189 Å²	189	54.5 Å²	54.5	71%	0.713	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-9.5	177.8	-70	-172.6	-68.1	-95.4	3.7	113.8	P177 H179	P177-R181 WeakPolarHBondContact O-CG 3.44Å; P177-R181 PolarHBondContact O-N 3.38Å; P177-R181 PolarHBondContact O-NE 2.88Å; P177-R181 PolarHBondContact O-NH1 2.85Å; P177-R181 PolarHBondContact O-NH2 3.03Å; H179-R181 VanDerWaalsContact C-N 3.25Å; H179-R181 PolarHBondContact O-N 2.79Å
182	C	89.3	Confident	92.8	Very high	59 Å²	59	54.3 Å²	54.3	40%	0.399	31%	0.307	S	S	.	.	S	Bend	trans	-74.5	131.6	177.1	-168	0	0	0	0	109	H178 H179 D184	H178-C182 PolarHBondContact O-N 2.81Å; H179-C182 PolarHBondContact O-N 2.76Å; C182-D184 PolarHBondContact O-N 3.34Å
183	S	81.6	Confident	92.8	Very high	127 Å²	127	54 Å²	54	89%	0.888	31%	0.305	S	S	*	.			trans	-77.4	47.9	177.8	-56	0	0	0	0	112.2	S185	S183-S185 VanDerWaalsContact C-N 3.28Å; S183-S185 PolarHBondContact O-N 3.12Å
184	D	85.6	Confident	92.9	Very high	54 Å²	54	54 Å²	54	29%	0.289	30%	0.304	S	S	.	.			trans	-94.1	24.6	178.7	75.5	-11.9	0	0	0	112.8	R175 C182 R196	R175-D184 IonicContact CZ-OD1 3.86Å; R175-D184 IonicContact CZ-OD2 3.75Å; R175-D184 IonicContact NH1-OD1 3.4Å; R175-D184 PolarHBondContact NH1-OD1 2.77Å; R175-D184 IonicContact NH1-OD2 2.78Å; R175-D184 VanDerWaalsContact NH2-CG 3.27Å; R175-D184 IonicContact NH2-OD1 2.73Å; R175-D184 PolarHBondContact NH2-OD1 2.98Å; R175-D184 VanDerWaalsContact NH2-OD1 3.11Å; R175-D184 IonicContact NH2-OD2 3.2Å; R175-D184 PolarHBondContact NH2-OD2 3.41Å; C182-D184 PolarHBondContact O-N 3.34Å; D184-R196 PolarHBondContact O-NH1 3.3Å; D184-R196 PolarHBondContact O-NH2 3.29Å; D184-R196 IonicContact OD1-NH2 3.64Å; D184-R196 PolarHBondContact OD1-NH2 3.2Å
185	S	84.1	Confident	92.9	Very high	65 Å²	65	52.7 Å²	52.7	46%	0.455	30%	0.3	S	S	.	.			trans	-71	138	179.8	-174.6	0	0	0	0	110.4	S183 G187 A189	S183-S185 VanDerWaalsContact C-N 3.28Å; S183-S185 PolarHBondContact O-N 3.12Å; S185-G187 PolarHBondContact O-N 3.35Å; S185-G187 PolarHBondContact OG-N 3.31Å; S185-G187 VanDerWaalsContact OG-N 3.12Å; S185-A189 PolarHBondContact OG-O 2.97Å
186	D	84	Confident	92.9	Very high	77 Å²	77	52.9 Å²	52.9	41%	0.412	30%	0.301	S	S	.	.			trans	-84.2	7.1	169.4	52.1	20.6	0	0	0	112.2	L188 A189 R196	D186-L188 PolarHBondContact O-N 2.86Å; D186-L188 PolarHBondContact OD1-N 2.88Å; D186-A189 WeakPolarHBondContact OD1-CB 3.34Å; D186-A189 PolarHBondContact OD1-N 3.44Å; D186-R196 IonicContact OD2-NH1 3.85Å
187	G	88.6	Confident	93	Very high	68 Å²	68	53.2 Å²	53.2	70%	0.701	30%	0.302	S	S	*	.	S	Bend	trans	82	-12.4	-175.9	0	0	0	0	0	114.6	S185	S185-G187 PolarHBondContact O-N 3.35Å; S185-G187 PolarHBondContact OG-N 3.31Å; S185-G187 VanDerWaalsContact OG-N 3.12Å
188	L	91.8	Very high	93	Very high	90 Å²	90	56 Å²	56	47%	0.471	31%	0.314	S	S	.	.	S	Bend	trans	-108.3	-43.5	-178.6	-61.3	175.7	0	0	0	111.9	D186 V203 Y205	D186-L188 PolarHBondContact O-N 2.86Å; D186-L188 PolarHBondContact OD1-N 2.88Å; L188-V203 HydrophobicContact CB-CG1 4.39Å; L188-V203 HydrophobicContact CD1-CG1 3.84Å; L188-Y205 HydrophobicContact CB-CE2 4.07Å; L188-Y205 VanDerWaalsContact O-CD2 3.29Å; L188-Y205 WeakPolarHBondContact O-CD2 3.25Å
189	A	94.9	Very high	92.8	Very high	3 Å²	3	53.6 Å²	53.6	3%	0.025	33%	0.325	C	S	.	.	S	Bend	trans	-82.6	125.7	-175.1	0	0	0	0	0	111.9	S185 D186 R196 Y205	S185-A189 PolarHBondContact OG-O 2.97Å; D186-A189 WeakPolarHBondContact OD1-CB 3.34Å; D186-A189 PolarHBondContact OD1-N 3.44Å; A189-R196 VanDerWaalsContact CB-CD 3.46Å; A189-R196 HydrophobicContact CB-CG 3.69Å; A189-Y205 HydrophobicContact CB-CD1 4.37Å; A189-Y205 HydrophobicContact CB-CD2 4.37Å; A189-Y205 HydrophobicContact CB-CE1 3.78Å; A189-Y205 HydrophobicContact CB-CE2 3.79Å; A189-Y205 VanDerWaalsContact CB-CZ 3.46Å
190	P	95.5	Very high	92.7	Very high	33 Å²	33	53.9 Å²	53.9	21%	0.214	33%	0.328	C	S	.	.			trans	-60.8	142.8	170.4	-18.9	30.1	0	0	0	110.5	Q192 H193 Y205	P190-Q192 PolarHBondContact O-N 3.45Å; P190-H193 PolarHBondContact O-N 3.48Å; P190-H193 VanDerWaalsContact O-N 3.12Å; P190-Y205 VanDerWaalsContact CD-CG 3.49Å
191	P	95.8	Very high	92.6	Very high	49 Å²	49	60 Å²	60	32%	0.318	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-11.5	-170.2	23.6	-32.9	0	0	0	114.2	R175 E180	R175-P191 VanDerWaalsContact CD-O 3.25Å; R175-P191 WeakPolarHBondContact CD-O 3.45Å; R175-P191 PolarHBondContact NH1-O 2.91Å; R175-P191 VanDerWaalsContact NH1-O 3.08Å; E180-P191 WeakPolarHBondContact O-CB 3.29Å
192	Q	96	Very high	92.8	Very high	53 Å²	53	57.6 Å²	57.6	25%	0.248	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	-11.7	-178.8	-48.3	89.9	-13.1	0	0	114	R174 R175 E180 P190 L194 H214	R174-Q192 VanDerWaalsContact NH2-CB 3.28Å; R174-Q192 VanDerWaalsContact NH2-CG 3.34Å; R175-Q192 PolarHBondContact N-O 2.85Å; E180-Q192 HydrophobicContact CG-CB 4.4Å; E180-Q192 HydrophobicContact CG-CG 4.21Å; E180-Q192 VanDerWaalsContact OE1-CB 3.28Å; E180-Q192 WeakPolarHBondContact OE1-CB 3.35Å; E180-Q192 WeakPolarHBondContact OE1-CG 3.19Å; P190-Q192 PolarHBondContact O-N 3.45Å; Q192-L194 PolarHBondContact O-N 3.22Å; Q192-H214 PolarHBondContact O-ND1 3.04Å
193	H	97.8	Very high	93.2	Very high	3 Å²	3	55.5 Å²	55.5	1%	0.014	34%	0.337	C	S	.	.			trans	-74.2	125.1	-177.9	-81.2	-119	0	0	0	111.4	R175 P190 Y205 L206 D207 H214 S215	R175-H193 WeakPolarHBondContact CD-O 3.33Å; R175-H193 WeakPolarHBondContact CG-O 3.48Å; P190-H193 PolarHBondContact O-N 3.48Å; P190-H193 VanDerWaalsContact O-N 3.12Å; H193-Y205 HydrophobicContact CB-CD1 4.35Å; H193-Y205 AromaticContact CG-CD1 3.98Å; H193-Y205 AromaticContact ND1-CD1 3.48Å; H193-Y205 WeakPolarHBondContact ND1-CD1 3.38Å; H193-L206 PolarHBondContact CE1-O 2.82Å; H193-D207 IonicContact CD2-OD1 2.82Å; H193-D207 IonicContact CE1-OD1 3.87Å; H193-D207 IonicContact NE2-OD1 2.91Å; H193-D207 PolarHBondContact NE2-OD1 2.96Å; H193-H214 AromaticContact NE2-CG 3.88Å; H193-S215 PolarHBondContact CE1-O 2.85Å
194	L	98.3	Very high	93.9	Very high	4 Å²	4	53.9 Å²	53.9	2%	0.021	32%	0.315	C	S	.	.	S	Bend	trans	-71.5	-39.8	176.8	176.7	64.3	0	0	0	112.2	A161 V173 Q192 Y236 M237 C238 M246 I251	A161-L194 HydrophobicContact CB-CD2 4.14Å; V173-L194 HydrophobicContact CG1-CB 4.34Å; V173-L194 HydrophobicContact CG1-CD2 3.42Å; V173-L194 VanDerWaalsContact CG1-CD2 3.42Å; V173-L194 HydrophobicContact CG1-CG 4.48Å; Q192-L194 PolarHBondContact O-N 3.22Å; L194-Y236 HydrophobicContact CD2-CD1 4.44Å; L194-Y236 HydrophobicContact CG-CD1 4.32Å; L194-Y236 WeakPolarHBondContact O-CA 3.33Å; L194-M237 PolarHBondContact O-N 2.7Å; L194-C238 HydrophobicContact CD1-CB 3.49Å; L194-C238 VanDerWaalsContact CD1-CB 3.49Å; L194-M246 HydrophobicContact CD1-CE 4.03Å; L194-M246 HydrophobicContact CD2-CE 4.29Å; L194-M246 HydrophobicContact CD2-SD 4.07Å; L194-I251 HydrophobicContact CD2-CD1 3.55Å
195	I	98.5	Very high	94.5	Very high	9 Å²	9	52.9 Å²	52.9	5%	0.046	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.3	-174.3	-53	178.4	0	0	0	108.3	A159 A161 V216 Y234 N235 Y236 T253	A159-I195 HydrophobicContact CB-CD1 4.42Å; A159-I195 HydrophobicContact CB-CG2 4.32Å; A161-I195 HydrophobicContact CB-CD1 3.95Å; A161-I195 HydrophobicContact CB-CG1 4.41Å; I195-V216 HydrophobicContact CB-CG1 4.24Å; I195-V216 HydrophobicContact CG2-CG1 3.84Å; I195-Y234 HydrophobicContact CG2-CD1 3.56Å; I195-Y234 HydrophobicContact CG2-CE1 4.24Å; I195-Y234 HydrophobicContact CG2-CG 4.22Å; I195-N235 WeakPolarHBondContact CA-O 3.25Å; I195-Y236 HydrophobicContact CD1-CE1 4.06Å; I195-Y236 HydrophobicContact CG1-CD1 4.13Å; I195-Y236 HydrophobicContact CG1-CE1 3.79Å; I195-T253 HydrophobicContact CD1-CG2 3.95Å
196	R	97.9	Very high	95.1	Very high	8 Å²	8	53 Å²	53	3%	0.03	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	160	170.5	-64.3	-172	-172.1	174.8	9.3	111	R175 D184 D186 A189 Y205 Y234 N235 M237	R175-R196 VanDerWaalsContact NH1-NH2 3.19Å; D184-R196 PolarHBondContact O-NH1 3.3Å; D184-R196 PolarHBondContact O-NH2 3.29Å; D184-R196 IonicContact OD1-NH2 3.64Å; D184-R196 PolarHBondContact OD1-NH2 3.2Å; D186-R196 IonicContact OD2-NH1 3.85Å; A189-R196 VanDerWaalsContact CB-CD 3.46Å; A189-R196 HydrophobicContact CB-CG 3.69Å; R196-Y205 VanDerWaalsContact CA-OH 3.3Å; R196-Y205 WeakPolarHBondContact CA-OH 3.35Å; R196-Y205 HydrophobicContact CB-CE1 4.49Å; R196-Y205 WeakPolarHBondContact CB-OH 3.27Å; R196-Y205 HydrophobicContact CG-CE1 4.27Å; R196-Y234 CarbonylContact O-C 3.49Å; R196-Y234 VanDerWaalsContact O-CA 3.23Å; R196-Y234 WeakPolarHBondContact O-CA 3.41Å; R196-N235 HydrophobicContact CB-CB 4.38Å; R196-N235 PolarHBondContact N-O 3.07Å; R196-N235 PolarHBondContact O-N 2.74Å; R196-M237 HydrophobicContact CB-CG 4.36Å; R196-M237 HydrophobicContact CG-CG 3.66Å; R196-M237 HydrophobicContact CG-SD 4.28Å
197	V	98	Very high	95.8	Very high	10 Å²	10	53.1 Å²	53.1	6%	0.061	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	129.8	169.7	177.1	0	0	0	0	109.5	N200 V203 Y205 V216 V218 I232 H233 Y234	V197-N200 HydrophobicContact CG1-CB 4.08Å; V197-V203 HydrophobicContact CB-CG2 3.96Å; V197-V203 HydrophobicContact CG2-CG2 4.29Å; V197-Y205 PolarHBondContact N-OH 2.92Å; V197-Y205 VanDerWaalsContact N-OH 3.13Å; V197-V216 HydrophobicContact CB-CG2 4.3Å; V197-V216 HydrophobicContact CG2-CG1 4.03Å; V197-V216 HydrophobicContact CG2-CG2 3.63Å; V197-V218 HydrophobicContact CB-CG1 4.29Å; V197-V218 HydrophobicContact CG1-CG1 3.95Å; V197-V218 HydrophobicContact CG2-CG1 4.14Å; V197-I232 HydrophobicContact CG1-CG2 3.9Å; V197-I232 HydrophobicContact CG2-CG2 4.12Å; V197-H233 WeakPolarHBondContact CA-O 3.46Å; V197-Y234 HydrophobicContact CG2-CD1 3.62Å; V197-Y234 HydrophobicContact CG2-CE1 3.47Å; V197-Y234 VanDerWaalsContact CG2-CE1 3.47Å
198	E	94.7	Very high	96.1	Very high	85 Å²	85	52.7 Å²	52.7	40%	0.397	29%	0.285	S	S	.	.	S	Bend	trans	-94.3	142.3	179.1	-169.1	177.7	170	0	0	110.6	T140 N200 H233 N235	T140-E198 PolarHBondContact OG1-OE2 3.26Å; E198-N200 VanDerWaalsContact C-N 3.31Å; E198-N200 PolarHBondContact O-N 2.65Å; E198-H233 HydrophobicContact CB-CB 4.07Å; E198-H233 PolarHBondContact N-O 2.98Å; E198-N235 PolarHBondContact OE2-ND2 3.19Å; E198-N235 VanDerWaalsContact OE2-ND2 3.08Å
199	G	92.8	Very high	96.3	Very high	85 Å²	85	59.1 Å²	59.1	88%	0.876	30%	0.303	S	S	*	.	S	Bend	trans	73.3	12.5	169.6	0	0	0	0	0	116.1
200	N	92.4	Very high	96.3	Very high	30 Å²	30	65.2 Å²	65.2	16%	0.16	34%	0.335	C	S	.	.			trans	-127.3	111.9	176.4	-162.3	-37.9	0	0	0	111.6	V197 E198 R202 V203 V218 E221	V197-N200 HydrophobicContact CG1-CB 4.08Å; E198-N200 VanDerWaalsContact C-N 3.31Å; E198-N200 PolarHBondContact O-N 2.65Å; N200-R202 VanDerWaalsContact C-N 3.28Å; N200-R202 PolarHBondContact O-N 2.79Å; N200-R202 WeakPolarHBondContact OD1-CA 3.38Å; N200-R202 WeakPolarHBondContact OD1-CB 3.41Å; N200-R202 PolarHBondContact OD1-N 2.87Å; N200-V203 WeakPolarHBondContact O-CB 3.49Å; N200-V203 WeakPolarHBondContact O-CG1 3.37Å; N200-V203 PolarHBondContact O-N 2.81Å; N200-V218 HydrophobicContact CB-CG1 4.38Å; N200-E221 PolarHBondContact ND2-OE1 3.31Å
201	L	94.2	Very high	96.3	Very high	160 Å²	160	64.7 Å²	64.7	84%	0.838	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-14.2	178.9	-63	178.2	0	0	0	113.6	V203	L201-V203 PolarHBondContact O-N 3.03Å
202	R	96.4	Very high	96.4	Very high	138 Å²	138	66.4 Å²	66.4	52%	0.521	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	15.3	176.5	-59.7	-178.3	-73.1	-99.5	-0.1	112.3	N200 P219 E221	N200-R202 VanDerWaalsContact C-N 3.28Å; N200-R202 PolarHBondContact O-N 2.79Å; N200-R202 WeakPolarHBondContact OD1-CA 3.38Å; N200-R202 WeakPolarHBondContact OD1-CB 3.41Å; N200-R202 PolarHBondContact OD1-N 2.87Å; R202-P219 HydrophobicContact CB-CG 3.82Å; R202-P219 VanDerWaalsContact O-CD 3.3Å; R202-P219 WeakPolarHBondContact O-CD 3.48Å; R202-E221 IonicContact CZ-OE1 2.99Å; R202-E221 IonicContact NE-OE1 2.69Å; R202-E221 IonicContact NH2-OE1 3.56Å; R202-E221 PolarHBondContact NH2-OE1 2.9Å; R202-E221 IonicContact NH2-OE2 3.76Å; R202-E221 PolarHBondContact NH2-OE2 3.19Å
203	V	97.5	Very high	96.4	Very high	15 Å²	15	64 Å²	64	9%	0.091	32%	0.323	C	S	.	.			trans	-70.1	135.6	177.1	65.7	0	0	0	0	111	L188 V197 N200 L201 Y205 V216 V217 V218	L188-V203 HydrophobicContact CB-CG1 4.39Å; L188-V203 HydrophobicContact CD1-CG1 3.84Å; V197-V203 HydrophobicContact CB-CG2 3.96Å; V197-V203 HydrophobicContact CG2-CG2 4.29Å; N200-V203 WeakPolarHBondContact O-CB 3.49Å; N200-V203 WeakPolarHBondContact O-CG1 3.37Å; N200-V203 PolarHBondContact O-N 2.81Å; L201-V203 PolarHBondContact O-N 3.03Å; V203-Y205 HydrophobicContact CB-CE2 4.44Å; V203-Y205 HydrophobicContact CG1-CD2 4.5Å; V203-Y205 HydrophobicContact CG1-CE2 3.83Å; V203-Y205 HydrophobicContact CG2-CD2 4.2Å; V203-Y205 HydrophobicContact CG2-CE2 3.7Å; V203-V216 HydrophobicContact CG2-CG2 3.22Å; V203-V217 WeakPolarHBondContact CA-O 3.24Å; V203-V218 HydrophobicContact CB-CG1 3.98Å; V203-V218 HydrophobicContact CG2-CG1 3.98Å
204	E	97.5	Very high	96.5	Very high	93 Å²	93	64.6 Å²	64.6	44%	0.435	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.4	174.4	-68.3	174.3	-146.5	0	0	109.3	L206 V217	E204-L206 HydrophobicContact CB-CD1 4.5Å; E204-V217 HydrophobicContact CB-CB 4.41Å; E204-V217 PolarHBondContact N-O 3.38Å; E204-V217 PolarHBondContact O-N 2.76Å
205	Y	98	Very high	96.5	Very high	33 Å²	33	64.7 Å²	64.7	13%	0.129	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	126.6	173.6	-68.5	-89	0	0	0	109.6	L188 A189 P190 H193 R196 V197 V203 V216	L188-Y205 HydrophobicContact CB-CE2 4.07Å; L188-Y205 VanDerWaalsContact O-CD2 3.29Å; L188-Y205 WeakPolarHBondContact O-CD2 3.25Å; A189-Y205 HydrophobicContact CB-CD1 4.37Å; A189-Y205 HydrophobicContact CB-CD2 4.37Å; A189-Y205 HydrophobicContact CB-CE1 3.78Å; A189-Y205 HydrophobicContact CB-CE2 3.79Å; A189-Y205 VanDerWaalsContact CB-CZ 3.46Å; P190-Y205 VanDerWaalsContact CD-CG 3.49Å; H193-Y205 HydrophobicContact CB-CD1 4.35Å; H193-Y205 AromaticContact CG-CD1 3.98Å; H193-Y205 AromaticContact ND1-CD1 3.48Å; H193-Y205 WeakPolarHBondContact ND1-CD1 3.38Å; R196-Y205 VanDerWaalsContact CA-OH 3.3Å; R196-Y205 WeakPolarHBondContact CA-OH 3.35Å; R196-Y205 HydrophobicContact CB-CE1 4.49Å; R196-Y205 WeakPolarHBondContact CB-OH 3.27Å; R196-Y205 HydrophobicContact CG-CE1 4.27Å; V197-Y205 PolarHBondContact N-OH 2.92Å; V197-Y205 VanDerWaalsContact N-OH 3.13Å; V203-Y205 HydrophobicContact CB-CE2 4.44Å; V203-Y205 HydrophobicContact CG1-CD2 4.5Å; V203-Y205 HydrophobicContact CG1-CE2 3.83Å; V203-Y205 HydrophobicContact CG2-CD2 4.2Å; V203-Y205 HydrophobicContact CG2-CE2 3.7Å; Y205-V216 HydrophobicContact CD1-CB 3.88Å; Y205-V216 HydrophobicContact CD1-CG2 3.8Å; Y205-V216 HydrophobicContact CE1-CB 3.82Å; Y205-V216 HydrophobicContact CE1-CG2 3.5Å; Y205-V216 VanDerWaalsContact CE1-CG2 3.5Å; Y205-V216 HydrophobicContact CE2-CG2 4.4Å; Y205-V216 HydrophobicContact CG-CG2 4.39Å
206	L	97.3	Very high	96.5	Very high	67 Å²	67	64.3 Å²	64.3	35%	0.351	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	124.1	-177.4	-108.9	71.3	0	0	0	111.5	H193 E204 H214 S215	H193-L206 PolarHBondContact CE1-O 2.82Å; E204-L206 HydrophobicContact CB-CD1 4.5Å; L206-H214 WeakPolarHBondContact O-CA 3.48Å; L206-S215 PolarHBondContact N-O 2.89Å; L206-S215 PolarHBondContact O-N 3.32Å
207	D	97.2	Very high	96.5	Very high	80 Å²	80	64 Å²	64	43%	0.428	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	102.2	161.8	-68.4	-25.6	0	0	0	108.6	H193 R209 H214	H193-D207 IonicContact CD2-OD1 2.82Å; H193-D207 IonicContact CE1-OD1 3.87Å; H193-D207 IonicContact NE2-OD1 2.91Å; H193-D207 PolarHBondContact NE2-OD1 2.96Å; D207-R209 PolarHBondContact O-N 3.13Å; D207-H214 IonicContact OD1-CD2 3.55Å; D207-H214 PolarHBondContact OD1-CD2 2.84Å; D207-H214 IonicContact OD1-CG 3.08Å; D207-H214 IonicContact OD1-NE2 2.65Å; D207-H214 PolarHBondContact OD1-NE2 2.86Å
208	D	96.4	Very high	96.5	Very high	58 Å²	58	63.7 Å²	63.7	31%	0.31	32%	0.321	S	S	.	.			trans	-65.8	118.9	-178.2	-174.9	-37.7	0	0	0	110.5	N210 T211 F212 R213	D208-N210 PolarHBondContact O-N 2.78Å; D208-N210 WeakPolarHBondContact OD1-CA 3.36Å; D208-N210 WeakPolarHBondContact OD1-CB 3.37Å; D208-N210 PolarHBondContact OD1-N 2.7Å; D208-T211 VanDerWaalsContact CB-OG1 3.29Å; D208-T211 WeakPolarHBondContact CB-OG1 3.5Å; D208-T211 PolarHBondContact OD1-N 2.8Å; D208-T211 PolarHBondContact OD2-OG1 3.03Å; D208-F212 WeakPolarHBondContact O-CA 3.46Å; D208-F212 PolarHBondContact O-N 3.22Å; D208-R213 PolarHBondContact N-O 2.99Å
209	R	95.3	Very high	96.7	Very high	226 Å²	226	61.6 Å²	61.6	85%	0.853	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-22.5	-177.6	-67.4	-87.8	179.1	158.6	-2	113.2	D207	D207-R209 PolarHBondContact O-N 3.13Å
210	N	95.2	Very high	96.9	Very high	130 Å²	130	58.6 Å²	58.6	70%	0.695	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-44.3	-176.1	-65.2	75.5	0	0	0	111.3	D208	D208-N210 PolarHBondContact O-N 2.78Å; D208-N210 WeakPolarHBondContact OD1-CA 3.36Å; D208-N210 WeakPolarHBondContact OD1-CB 3.37Å; D208-N210 PolarHBondContact OD1-N 2.7Å
211	T	95.6	Very high	97.1	Very high	22 Å²	22	60.6 Å²	60.6	14%	0.135	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-11.4	-176.4	72.2	0	0	0	0	113.4	S94 S96 D208 R213	S94-T211 WeakPolarHBondContact CB-O 3.44Å; S94-T211 PolarHBondContact OG-O 2.97Å; S96-T211 WeakPolarHBondContact OG-CG2 3.41Å; D208-T211 VanDerWaalsContact CB-OG1 3.29Å; D208-T211 WeakPolarHBondContact CB-OG1 3.5Å; D208-T211 PolarHBondContact OD1-N 2.8Å; D208-T211 PolarHBondContact OD2-OG1 3.03Å; T211-R213 PolarHBondContact O-N 3.09Å; T211-R213 VanDerWaalsContact O-N 3.13Å; T211-R213 PolarHBondContact OG1-N 2.9Å
212	F	96.8	Very high	97.1	Very high	85 Å²	85	56.6 Å²	56.6	37%	0.373	27%	0.27	S	S	.	.			trans	61.7	7	-173	-49.9	-62.9	0	0	0	114.8	P92 V172 D208	P92-F212 HydrophobicContact CB-CD2 4.17Å; P92-F212 HydrophobicContact CB-CE2 4.13Å; P92-F212 HydrophobicContact CG-CD1 4.43Å; P92-F212 HydrophobicContact CG-CD2 4.23Å; P92-F212 HydrophobicContact CG-CE2 4.44Å; P92-F212 HydrophobicContact CG-CG 4.22Å; V172-F212 VanDerWaalsContact CG1-O 3.3Å; V172-F212 WeakPolarHBondContact CG1-O 3.4Å; V172-F212 HydrophobicContact CG2-CB 3.92Å; V172-F212 WeakPolarHBondContact CG2-O 3.13Å; D208-F212 WeakPolarHBondContact O-CA 3.46Å; D208-F212 PolarHBondContact O-N 3.22Å
213	R	97.8	Very high	97.1	Very high	4 Å²	4	52 Å²	52	2%	0.015	26%	0.258	C	S	.	.			trans	-79.3	140.1	-176	-64.4	-171.7	178.4	-82.9	1.6	110.8	S94 S96 M160 M169 D208 T211	S94-R213 PolarHBondContact OG-NE 2.85Å; S96-R213 PolarHBondContact O-NE 3.38Å; S96-R213 PolarHBondContact O-NH2 3.03Å; M160-R213 HydrophobicContact CE-CB 3.9Å; M160-R213 HydrophobicContact SD-CB 4Å; M160-R213 HydrophobicContact SD-CG 4.44Å; M169-R213 PolarHBondContact O-NH2 2.81Å; D208-R213 PolarHBondContact N-O 2.99Å; T211-R213 PolarHBondContact O-N 3.09Å; T211-R213 VanDerWaalsContact O-N 3.13Å; T211-R213 PolarHBondContact OG1-N 2.9Å
214	H	98.2	Very high	96.9	Very high	15 Å²	15	58.9 Å²	58.9	7%	0.069	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	137.3	173	-59	167.3	0	0	0	109.7	R174 Q192 H193 L206 D207	R174-H214 PolarHBondContact NH1-CE1 2.96Å; R174-H214 PolarHBondContact NH1-NE2 3.39Å; R174-H214 PolarHBondContact NH2-CE1 2.79Å; R174-H214 PolarHBondContact NH2-NE2 3.35Å; Q192-H214 PolarHBondContact O-ND1 3.04Å; H193-H214 AromaticContact NE2-CG 3.88Å; L206-H214 WeakPolarHBondContact O-CA 3.48Å; D207-H214 IonicContact OD1-CD2 3.55Å; D207-H214 PolarHBondContact OD1-CD2 2.84Å; D207-H214 IonicContact OD1-CG 3.08Å; D207-H214 IonicContact OD1-NE2 2.65Å; D207-H214 PolarHBondContact OD1-NE2 2.86Å
215	S	98.4	Very high	96.8	Very high	5 Å²	5	62.1 Å²	62.1	4%	0.035	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	155	170.7	60.2	0	0	0	0	111.1	R158 A159 H193 L206	R158-S215 PolarHBondContact NH1-OG 3.31Å; A159-S215 WeakPolarHBondContact O-CA 3.38Å; A159-S215 WeakPolarHBondContact O-CB 3.1Å; H193-S215 PolarHBondContact CE1-O 2.85Å; L206-S215 PolarHBondContact N-O 2.89Å; L206-S215 PolarHBondContact O-N 3.32Å
216	V	98.5	Very high	96.6	Very high	1 Å²	1	64.4 Å²	64.4	1%	0.006	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	135.2	172.1	61.6	0	0	0	0	108.6	R158 A159 I195 V197 V203 Y205 Y234	R158-V216 CarbonylContact C-O 3.55Å; R158-V216 WeakPolarHBondContact CA-O 3.49Å; A159-V216 HydrophobicContact CB-CG1 3.88Å; A159-V216 PolarHBondContact N-O 3.08Å; A159-V216 PolarHBondContact O-N 3.18Å; I195-V216 HydrophobicContact CB-CG1 4.24Å; I195-V216 HydrophobicContact CG2-CG1 3.84Å; V197-V216 HydrophobicContact CB-CG2 4.3Å; V197-V216 HydrophobicContact CG2-CG1 4.03Å; V197-V216 HydrophobicContact CG2-CG2 3.63Å; V203-V216 HydrophobicContact CG2-CG2 3.22Å; Y205-V216 HydrophobicContact CD1-CB 3.88Å; Y205-V216 HydrophobicContact CD1-CG2 3.8Å; Y205-V216 HydrophobicContact CE1-CB 3.82Å; Y205-V216 HydrophobicContact CE1-CG2 3.5Å; Y205-V216 VanDerWaalsContact CE1-CG2 3.5Å; Y205-V216 HydrophobicContact CE2-CG2 4.4Å; Y205-V216 HydrophobicContact CG-CG2 4.39Å; V216-Y234 HydrophobicContact CG1-CD1 4.48Å; V216-Y234 HydrophobicContact CG1-CE1 4.12Å
217	V	98.4	Very high	96.5	Very high	2 Å²	2	64.1 Å²	64.1	1%	0.012	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	137.7	-174.7	-171.2	0	0	0	0	108.9	R156 V157 R158 V203 E204	R156-V217 HydrophobicContact CB-CG1 3.71Å; R156-V217 HydrophobicContact CG-CG1 4.31Å; V157-V217 WeakPolarHBondContact O-CA 3.49Å; R158-V217 HydrophobicContact CB-CG2 4.05Å; R158-V217 HydrophobicContact CG-CG2 3.99Å; V203-V217 WeakPolarHBondContact CA-O 3.24Å; E204-V217 HydrophobicContact CB-CB 4.41Å; E204-V217 PolarHBondContact N-O 3.38Å; E204-V217 PolarHBondContact O-N 2.76Å
218	V	98.3	Very high	96.4	Very high	3 Å²	3	66.5 Å²	66.5	2%	0.018	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	151	168.3	-68.2	0	0	0	0	110	R156 V157 V197 N200 V203 Y220 I232	R156-V218 CarbonylContact C-O 3.56Å; R156-V218 WeakPolarHBondContact CA-O 3.5Å; V157-V218 HydrophobicContact CB-CG2 4.17Å; V157-V218 PolarHBondContact N-O 3.4Å; V157-V218 PolarHBondContact O-N 3.16Å; V197-V218 HydrophobicContact CB-CG1 4.29Å; V197-V218 HydrophobicContact CG1-CG1 3.95Å; V197-V218 HydrophobicContact CG2-CG1 4.14Å; N200-V218 HydrophobicContact CB-CG1 4.38Å; V203-V218 HydrophobicContact CB-CG1 3.98Å; V203-V218 HydrophobicContact CG2-CG1 3.98Å; V218-Y220 PolarHBondContact O-N 2.87Å; V218-I232 HydrophobicContact CG2-CD1 3.47Å; V218-I232 VanDerWaalsContact CG2-CD1 3.47Å; V218-I232 HydrophobicContact CG2-CG1 4.22Å
219	P	98	Very high	96.4	Very high	42 Å²	42	64.6 Å²	64.6	27%	0.273	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	138.3	167.3	-24.8	35	0	0	0	110.8	R202 E221	R202-P219 HydrophobicContact CB-CG 3.82Å; R202-P219 VanDerWaalsContact O-CD 3.3Å; R202-P219 WeakPolarHBondContact O-CD 3.48Å; P219-E221 PolarHBondContact O-N 2.74Å
220	Y	97.9	Very high	96.5	Very high	22 Å²	22	54.8 Å²	54.8	9%	0.086	32%	0.321	C	S	.	.			trans	-71.6	126.7	169.9	172.3	-94.5	0	0	0	109.1	L145 V147 P151 T155 V157 V218 P222 L257	L145-Y220 HydrophobicContact CD1-CD2 4.36Å; V147-Y220 VanDerWaalsContact CG2-OH 3.24Å; V147-Y220 WeakPolarHBondContact CG2-OH 3.38Å; P151-Y220 VanDerWaalsContact CD-CE1 3.49Å; P151-Y220 HydrophobicContact CG-CD1 3.51Å; P151-Y220 HydrophobicContact CG-CE1 3.32Å; P151-Y220 HydrophobicContact CG-CE2 4.4Å; P151-Y220 HydrophobicContact CG-CG 4.15Å; T155-Y220 HydrophobicContact CG2-CD1 4.48Å; T155-Y220 HydrophobicContact CG2-CG 4.12Å; T155-Y220 WeakPolarHBondContact O-CB 3.42Å; T155-Y220 PolarHBondContact O-N 3.22Å; V157-Y220 HydrophobicContact CG2-CD2 4.03Å; V218-Y220 PolarHBondContact O-N 2.87Å; Y220-P222 HydrophobicContact CE1-CB 4.48Å; Y220-P222 HydrophobicContact CE1-CG 4.14Å; Y220-L257 HydrophobicContact CD2-CD1 3.85Å; Y220-L257 HydrophobicContact CG-CD1 4.23Å
221	E	96.1	Very high	96.6	Very high	71 Å²	71	51.1 Å²	51.1	33%	0.332	30%	0.303	S	S	.	.			trans	-109.8	124.4	175.9	-68.1	173.4	-137.2	0	0	107.7	N200 R202 P219 T230	N200-E221 PolarHBondContact ND2-OE1 3.31Å; R202-E221 IonicContact CZ-OE1 2.99Å; R202-E221 IonicContact NE-OE1 2.69Å; R202-E221 IonicContact NH2-OE1 3.56Å; R202-E221 PolarHBondContact NH2-OE1 2.9Å; R202-E221 IonicContact NH2-OE2 3.76Å; R202-E221 PolarHBondContact NH2-OE2 3.19Å; P219-E221 PolarHBondContact O-N 2.74Å; E221-T230 HydrophobicContact CB-CG2 4.38Å; E221-T230 WeakPolarHBondContact O-CB 3.35Å; E221-T230 WeakPolarHBondContact O-CG2 3.39Å; E221-T230 PolarHBondContact O-OG1 3.28Å
222	P	95.3	Very high	96.7	Very high	77 Å²	77	50.8 Å²	50.8	50%	0.5	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-57	151.8	172.3	-23.9	34.1	0	0	0	111.2	T150 Y220 E224	T150-P222 HydrophobicContact CG2-CG 4.38Å; Y220-P222 HydrophobicContact CE1-CB 4.48Å; Y220-P222 HydrophobicContact CE1-CG 4.14Å; P222-E224 PolarHBondContact O-N 3.25Å
223	P	95.3	Very high	96.7	Very high	42 Å²	42	50.5 Å²	50.5	27%	0.273	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-53.5	139.9	177.7	-26.5	34.6	0	0	0	112	S227	P223-S227 WeakPolarHBondContact CB-O 3.21Å
224	E	94.4	Very high	96.8	Very high	159 Å²	159	50.3 Å²	50.3	74%	0.743	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-60.9	154.3	173.4	-64.6	-177.1	179.6	0	0	110.7	P222 G226 S227	P222-E224 PolarHBondContact O-N 3.25Å; E224-G226 PolarHBondContact O-N 3.12Å; E224-S227 PolarHBondContact O-N 3.45Å
225	V	94.7	Very high	96.8	Very high	161 Å²	161	50.5 Å²	50.5	98%	0.976	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	118.1	178.5	-179.6	0	0	0	0	109.8
226	G	94.5	Very high	96.8	Very high	80 Å²	80	50.2 Å²	50.2	83%	0.825	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	98.5	-4.4	-177	0	0	0	0	0	115	E224	E224-G226 PolarHBondContact O-N 3.12Å
227	S	94.6	Very high	96.8	Very high	62 Å²	62	50.8 Å²	50.8	43%	0.434	30%	0.302	S	S	.	.			trans	-106.9	143.1	170.9	-66.3	0	0	0	0	111.1	P223 E224	P223-S227 WeakPolarHBondContact CB-O 3.21Å; E224-S227 PolarHBondContact O-N 3.45Å
228	D	94.9	Very high	96.7	Very high	129 Å²	129	50.7 Å²	50.7	69%	0.69	30%	0.301	S	S	*	.	S	Bend	trans	-90.4	-8.7	177.9	-58.2	-44.1	0	0	0	113.3	W146	W146-D228 HydrophobicContact CE3-CB 4.43Å; W146-D228 HydrophobicContact CH2-CB 3.87Å; W146-D228 HydrophobicContact CZ3-CB 3.53Å
229	C	96	Very high	96.7	Very high	18 Å²	18	52.4 Å²	52.4	12%	0.122	31%	0.31	C	S	.	.	S	Bend	trans	-148.4	161.1	-174.1	68.8	0	0	0	0	112.3	L145 W146	L145-C229 WeakPolarHBondContact O-CB 3.49Å; W146-C229 HydrophobicContact CD2-CB 3.61Å; W146-C229 VanDerWaalsContact CE2-CB 3.49Å; W146-C229 HydrophobicContact CE3-CB 4.03Å; W146-C229 HydrophobicContact CG-CB 4Å; W146-C229 HydrophobicContact CH2-CB 4.24Å; W146-C229 HydrophobicContact CZ2-CB 3.83Å; W146-C229 HydrophobicContact CZ3-CB 4.33Å
230	T	96.8	Very high	96.7	Very high	21 Å²	21	51.1 Å²	51.1	13%	0.129	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	135.2	175.5	-56.4	0	0	0	0	109.3	Q144 L145 E221	Q144-T230 CarbonylContact C-O 3.59Å; Q144-T230 WeakPolarHBondContact CA-O 3.16Å; L145-T230 PolarHBondContact N-O 2.97Å; L145-T230 PolarHBondContact O-N 2.82Å; L145-T230 VanDerWaalsContact O-N 3.11Å; E221-T230 HydrophobicContact CB-CG2 4.38Å; E221-T230 WeakPolarHBondContact O-CB 3.35Å; E221-T230 WeakPolarHBondContact O-CG2 3.39Å; E221-T230 PolarHBondContact O-OG1 3.28Å
231	T	97.5	Very high	96.7	Very high	53 Å²	53	53.4 Å²	53.4	33%	0.325	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.2	179.7	-57.8	0	0	0	0	111.1	P142 V143	P142-T231 HydrophobicContact CB-CG2 3.7Å; V143-T231 WeakPolarHBondContact O-CA 3.39Å
232	I	98.1	Very high	96.7	Very high	14 Å²	14	51 Å²	51	7%	0.072	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	133.1	168.4	-59.9	173.3	0	0	0	109	V143 L145 V157 V197 V218 Y234	V143-I232 PolarHBondContact N-O 3.18Å; V143-I232 PolarHBondContact O-N 3.15Å; L145-I232 HydrophobicContact CD1-CD1 3.69Å; L145-I232 HydrophobicContact CD1-CG1 4.16Å; L145-I232 HydrophobicContact CG-CD1 4.42Å; V157-I232 HydrophobicContact CB-CD1 3.8Å; V157-I232 HydrophobicContact CG1-CD1 3.66Å; V157-I232 HydrophobicContact CG2-CD1 4.19Å; V197-I232 HydrophobicContact CG1-CG2 3.9Å; V197-I232 HydrophobicContact CG2-CG2 4.12Å; V218-I232 HydrophobicContact CG2-CD1 3.47Å; V218-I232 VanDerWaalsContact CG2-CD1 3.47Å; V218-I232 HydrophobicContact CG2-CG1 4.22Å; I232-Y234 HydrophobicContact CB-CD2 4.46Å; I232-Y234 HydrophobicContact CB-CE2 3.86Å; I232-Y234 HydrophobicContact CG2-CD1 4.23Å; I232-Y234 HydrophobicContact CG2-CD2 4.07Å; I232-Y234 HydrophobicContact CG2-CE1 3.79Å; I232-Y234 HydrophobicContact CG2-CE2 3.63Å; I232-Y234 HydrophobicContact CG2-CG 4.37Å; I232-Y234 VanDerWaalsContact CG2-CZ 3.47Å
233	H	98	Very high	96.7	Very high	79 Å²	79	55 Å²	55	37%	0.366	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	107	176.4	-64.7	116.3	0	0	0	110.2	T140 V197 E198	T140-H233 HydrophobicContact CG2-CB 3.79Å; T140-H233 VanDerWaalsContact CG2-CD2 3.49Å; T140-H233 WeakPolarHBondContact CG2-CD2 3.25Å; V197-H233 WeakPolarHBondContact CA-O 3.46Å; E198-H233 HydrophobicContact CB-CB 4.07Å; E198-H233 PolarHBondContact N-O 2.98Å
234	Y	98.6	Very high	96.6	Very high	1 Å²	1	54.7 Å²	54.7	0%	0.004	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	154	175.6	-66.3	-73.3	0	0	0	111.9	C141 V143 A159 I195 R196 V197 V216 I232 I255	C141-Y234 WeakPolarHBondContact CA-O 3.27Å; C141-Y234 VanDerWaalsContact CB-O 3.27Å; C141-Y234 WeakPolarHBondContact CB-O 3.44Å; C141-Y234 PolarHBondContact N-O 2.78Å; C141-Y234 PolarHBondContact O-N 3.34Å; V143-Y234 HydrophobicContact CB-CD2 4.01Å; V143-Y234 HydrophobicContact CB-CE2 3.95Å; V143-Y234 HydrophobicContact CG2-CD2 3.68Å; V143-Y234 HydrophobicContact CG2-CE2 4.05Å; A159-Y234 HydrophobicContact CB-CD1 4.29Å; A159-Y234 HydrophobicContact CB-CE1 3.49Å; A159-Y234 VanDerWaalsContact CB-CE1 3.49Å; I195-Y234 HydrophobicContact CG2-CD1 3.56Å; I195-Y234 HydrophobicContact CG2-CE1 4.24Å; I195-Y234 HydrophobicContact CG2-CG 4.22Å; R196-Y234 CarbonylContact O-C 3.49Å; R196-Y234 VanDerWaalsContact O-CA 3.23Å; R196-Y234 WeakPolarHBondContact O-CA 3.41Å; V197-Y234 HydrophobicContact CG2-CD1 3.62Å; V197-Y234 HydrophobicContact CG2-CE1 3.47Å; V197-Y234 VanDerWaalsContact CG2-CE1 3.47Å; V216-Y234 HydrophobicContact CG1-CD1 4.48Å; V216-Y234 HydrophobicContact CG1-CE1 4.12Å; I232-Y234 HydrophobicContact CB-CD2 4.46Å; I232-Y234 HydrophobicContact CB-CE2 3.86Å; I232-Y234 HydrophobicContact CG2-CD1 4.23Å; I232-Y234 HydrophobicContact CG2-CD2 4.07Å; I232-Y234 HydrophobicContact CG2-CE1 3.79Å; I232-Y234 HydrophobicContact CG2-CE2 3.63Å; I232-Y234 HydrophobicContact CG2-CG 4.37Å; I232-Y234 VanDerWaalsContact CG2-CZ 3.47Å; Y234-I255 HydrophobicContact CE2-CD1 4.11Å
235	N	98.2	Very high	96.6	Very high	18 Å²	18	47.3 Å²	47.3	10%	0.096	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	140.9	164.6	-47.9	125.2	0	0	0	110.2	K139 I195 R196 E198 M237	K139-N235 PolarHBondContact O-ND2 3.26Å; I195-N235 WeakPolarHBondContact CA-O 3.25Å; R196-N235 HydrophobicContact CB-CB 4.38Å; R196-N235 PolarHBondContact N-O 3.07Å; R196-N235 PolarHBondContact O-N 2.74Å; E198-N235 PolarHBondContact OE2-ND2 3.19Å; E198-N235 VanDerWaalsContact OE2-ND2 3.08Å; N235-M237 HydrophobicContact CB-SD 3.61Å
236	Y	98.5	Very high	96.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	120.6	173.7	-67.8	-95.3	0	0	0	109.8	M133 A138 C141 L194 I195 T253 V272 V274	M133-Y236 HydrophobicContact SD-CE2 4.1Å; A138-Y236 PolarHBondContact N-O 2.99Å; C141-Y236 HydrophobicContact CB-CD2 4.49Å; C141-Y236 HydrophobicContact CB-CE2 4.25Å; L194-Y236 HydrophobicContact CD2-CD1 4.44Å; L194-Y236 HydrophobicContact CG-CD1 4.32Å; L194-Y236 WeakPolarHBondContact O-CA 3.33Å; I195-Y236 HydrophobicContact CD1-CE1 4.06Å; I195-Y236 HydrophobicContact CG1-CD1 4.13Å; I195-Y236 HydrophobicContact CG1-CE1 3.79Å; Y236-T253 WeakPolarHBondContact CE1-OG1 3.23Å; Y236-T253 PolarHBondContact OH-OG1 2.96Å; Y236-V272 HydrophobicContact CD1-CG1 3.99Å; Y236-V272 HydrophobicContact CD2-CG1 4.31Å; Y236-V272 HydrophobicContact CE1-CB 4.21Å; Y236-V272 HydrophobicContact CE1-CG1 3.78Å; Y236-V272 HydrophobicContact CE1-CG2 4.01Å; Y236-V272 HydrophobicContact CE2-CG1 4.13Å; Y236-V272 HydrophobicContact CG-CG1 4.26Å; Y236-V274 HydrophobicContact CD1-CG2 4.28Å; Y236-V274 HydrophobicContact CG-CG2 4.01Å
237	M	97.9	Very high	96.8	Very high	12 Å²	12	39.9 Å²	39.9	6%	0.059	23%	0.233	C	C	.	.			trans	-102	19.1	-163.1	-51.9	-49.7	-67.7	0	0	113.8	A138 R175 L194 R196 N235	A138-M237 HydrophobicContact CB-CE 3.73Å; A138-M237 HydrophobicContact CB-SD 4.01Å; R175-M237 HydrophobicContact CG-CB 4.35Å; R175-M237 PolarHBondContact NE-O 2.86Å; R175-M237 PolarHBondContact NH2-O 2.95Å; L194-M237 PolarHBondContact O-N 2.7Å; R196-M237 HydrophobicContact CB-CG 4.36Å; R196-M237 HydrophobicContact CG-CG 3.66Å; R196-M237 HydrophobicContact CG-SD 4.28Å; N235-M237 HydrophobicContact CB-SD 3.61Å
238	C	97.7	Very high	96.9	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.249	C	C	.	.	S	Bend	trans	-152.5	139.8	172.3	-161.1	0	0	0	0	110.2	L137 R175 H179 L194 C242 M246 V274	L137-C238 VanDerWaalsContact CD1-CA 3.45Å; R175-C238 HydrophobicContact CG-CB 4.3Å; H179-C238 PolarHBondContact ND1-SG 3.37Å; L194-C238 HydrophobicContact CD1-CB 3.49Å; L194-C238 VanDerWaalsContact CD1-CB 3.49Å; C238-C242 WeakPolarHBondContact SG-CB 3.45Å; C238-M246 HydrophobicContact CB-CE 4.15Å; C238-M246 WeakPolarHBondContact O-CE 3.33Å; C238-V274 WeakPolarHBondContact O-CB 3.39Å; C238-V274 WeakPolarHBondContact O-CG1 3.46Å
239	N	98	Very high	97.1	Very high	40 Å²	40	42.1 Å²	42.1	21%	0.214	22%	0.222	C	C	.	.			trans	-72.5	149.2	173	-72.6	-48.2	0	0	0	110.5	S241 C242 M246	N239-S241 PolarHBondContact O-N 3.11Å; N239-S241 VanDerWaalsContact O-N 3.11Å; N239-C242 WeakPolarHBondContact O-CB 3.27Å; N239-C242 PolarHBondContact O-N 2.83Å; N239-M246 VanDerWaalsContact C-CE 3.46Å; N239-M246 WeakPolarHBondContact O-CE 3.32Å
240	S	97.8	Very high	97.2	Very high	14 Å²	14	42.8 Å²	42.8	10%	0.098	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.3	174.6	-63.2	0	0	0	0	112.1	R248 V274	S240-R248 WeakPolarHBondContact O-CA 3.48Å; S240-R248 PolarHBondContact O-N 2.92Å; S240-V274 WeakPolarHBondContact CB-O 3.48Å; S240-V274 PolarHBondContact N-O 3.35Å; S240-V274 PolarHBondContact OG-N 2.66Å; S240-V274 PolarHBondContact OG-O 2.98Å
241	S	97.2	Very high	97.3	Very high	71 Å²	71	41.8 Å²	41.8	50%	0.497	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-5.9	178.4	56.6	0	0	0	0	115.3	N239 M243	N239-S241 PolarHBondContact O-N 3.11Å; N239-S241 VanDerWaalsContact O-N 3.11Å; S241-M243 PolarHBondContact O-N 3.45Å
242	C	97	Very high	97.3	Very high	20 Å²	20	40 Å²	40	14%	0.135	21%	0.209	C	C	.	.			trans	-64.5	123.5	-175.4	-73.9	0	0	0	0	111.9	C176 H179 C238 N239 G245 N247	C176-C242 HydrophobicContact CB-CB 3.92Å; H179-C242 PolarHBondContact CE1-SG 2.91Å; C238-C242 WeakPolarHBondContact SG-CB 3.45Å; N239-C242 WeakPolarHBondContact O-CB 3.27Å; N239-C242 PolarHBondContact O-N 2.83Å; C242-G245 PolarHBondContact O-N 2.79Å; C242-N247 WeakPolarHBondContact O-CA 3.34Å; C242-N247 PolarHBondContact O-N 2.84Å
243	M	95.8	Very high	97.3	Very high	161 Å²	161	39.4 Å²	39.4	79%	0.793	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	137.1	175.9	-177.8	169.2	52.5	0	0	110.8	C176 S241 G245	C176-M243 VanDerWaalsContact CB-O 3.26Å; C176-M243 WeakPolarHBondContact CB-O 3.32Å; S241-M243 PolarHBondContact O-N 3.45Å; M243-G245 PolarHBondContact O-N 2.88Å
244	G	92.5	Very high	97.4	Very high	35 Å²	35	35.9 Å²	35.9	36%	0.361	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	-3.8	-178.3	0	0	0	0	0	115.6	P177	P177-G244 WeakPolarHBondContact CD-O 3.45Å
245	G	94.6	Very high	97.4	Very high	5 Å²	5	35.9 Å²	35.9	5%	0.052	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-118.4	169.6	0	0	0	0	0	110.3	Y163 C242 M243 N247 R249	Y163-G245 PolarHBondContact OH-O 3.13Å; C242-G245 PolarHBondContact O-N 2.79Å; M243-G245 PolarHBondContact O-N 2.88Å; G245-N247 VanDerWaalsContact C-N 3.25Å; G245-N247 PolarHBondContact O-N 2.82Å; G245-R249 PolarHBondContact O-NH2 3.33Å
246	M	97	Very high	97.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-33.3	176.4	-73.4	-172	-80.8	0	0	113.7	Y163 V173 L194 C238 N239 R248 R249 I251 V274	Y163-M246 HydrophobicContact CE1-CB 4.45Å; Y163-M246 HydrophobicContact CE1-CG 4.32Å; V173-M246 HydrophobicContact CG1-CG 4.49Å; L194-M246 HydrophobicContact CD1-CE 4.03Å; L194-M246 HydrophobicContact CD2-CE 4.29Å; L194-M246 HydrophobicContact CD2-SD 4.07Å; C238-M246 HydrophobicContact CB-CE 4.15Å; C238-M246 WeakPolarHBondContact O-CE 3.33Å; N239-M246 VanDerWaalsContact C-CE 3.46Å; N239-M246 WeakPolarHBondContact O-CE 3.32Å; M246-R248 PolarHBondContact O-N 3.01Å; M246-R249 WeakPolarHBondContact O-CB 3.43Å; M246-R249 WeakPolarHBondContact O-CG 3.43Å; M246-R249 PolarHBondContact O-N 3.46Å; M246-R249 PolarHBondContact O-NE 3.45Å; M246-I251 HydrophobicContact CG-CG2 4.12Å; M246-I251 HydrophobicContact SD-CD1 3.71Å; M246-I251 HydrophobicContact SD-CG1 4Å; M246-I251 HydrophobicContact SD-CG2 3.8Å; M246-V274 HydrophobicContact CE-CG2 4.26Å
247	N	96.8	Very high	97.4	Very high	84 Å²	84	35.8 Å²	35.8	45%	0.449	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	51.9	173.2	-163.5	33.5	0	0	0	114.4	C242 G245 R249	C242-N247 WeakPolarHBondContact O-CA 3.34Å; C242-N247 PolarHBondContact O-N 2.84Å; G245-N247 VanDerWaalsContact C-N 3.25Å; G245-N247 PolarHBondContact O-N 2.82Å; N247-R249 PolarHBondContact O-N 3.48Å
248	R	96.8	Very high	97.4	Very high	203 Å²	203	36 Å²	36	77%	0.766	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	65	9.4	-179.2	-54.2	175.5	-179.1	-110.2	1	115.3	S240 M246	S240-R248 WeakPolarHBondContact O-CA 3.48Å; S240-R248 PolarHBondContact O-N 2.92Å; M246-R248 PolarHBondContact O-N 3.01Å
249	R	97.7	Very high	97.4	Very high	36 Å²	36	37.5 Å²	37.5	14%	0.136	20%	0.199	C	C	.	.			trans	-84.4	130.9	175.8	-59.4	171.2	-71.4	175.3	-0.6	110.1	Y163 H168 E171 G245 M246 N247	Y163-R249 HydrophobicContact CD1-CB 3.76Å; Y163-R249 HydrophobicContact CE1-CB 3.83Å; Y163-R249 PolarHBondContact OH-NH2 3.47Å; H168-R249 VanDerWaalsContact CD2-CD 3.44Å; H168-R249 WeakPolarHBondContact CD2-CD 3.43Å; H168-R249 PolarHBondContact ND1-NH1 2.89Å; H168-R249 WeakPolarHBondContact NE2-CD 3.49Å; E171-R249 IonicContact OE1-CZ 2.81Å; E171-R249 VanDerWaalsContact OE1-CZ 3.29Å; E171-R249 IonicContact OE1-NH1 2.67Å; E171-R249 PolarHBondContact OE1-NH1 3.44Å; E171-R249 IonicContact OE1-NH2 3.4Å; E171-R249 PolarHBondContact OE1-NH2 2.64Å; E171-R249 IonicContact OE2-CZ 2.68Å; E171-R249 IonicContact OE2-NH1 2.61Å; E171-R249 PolarHBondContact OE2-NH1 2.79Å; E171-R249 IonicContact OE2-NH2 3.54Å; G245-R249 PolarHBondContact O-NH2 3.33Å; M246-R249 WeakPolarHBondContact O-CB 3.43Å; M246-R249 WeakPolarHBondContact O-CG 3.43Å; M246-R249 PolarHBondContact O-N 3.46Å; M246-R249 PolarHBondContact O-NE 3.45Å; N247-R249 PolarHBondContact O-N 3.48Å
250	P	98.1	Very high	97.3	Very high	31 Å²	31	39.5 Å²	39.5	20%	0.201	22%	0.216	C	C	.	.			trans	-69.7	146	178.4	27.3	-32.6	0	0	0	111.3	K164 Q165	K164-P250 HydrophobicContact CB-CB 4.2Å; K164-P250 HydrophobicContact CB-CG 4.15Å; K164-P250 WeakPolarHBondContact CB-O 3.43Å; K164-P250 HydrophobicContact CD-CB 4.37Å; K164-P250 PolarHBondContact N-O 3.36Å; Q165-P250 HydrophobicContact CG-CG 4.15Å
251	I	98.7	Very high	97.2	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	155	178.9	60	162.6	0	0	0	111.2	A161 I162 Y163 V173 L194 M246 E271 V272	A161-I251 HydrophobicContact CB-CD1 4.46Å; I162-I251 CarbonylContact O-C 3.6Å; I162-I251 WeakPolarHBondContact O-CA 3.2Å; I162-I251 WeakPolarHBondContact O-CB 3.43Å; Y163-I251 HydrophobicContact CD1-CG2 3.69Å; Y163-I251 HydrophobicContact CE1-CG2 3.9Å; V173-I251 HydrophobicContact CG1-CG2 4.21Å; V173-I251 HydrophobicContact CG2-CG2 4.09Å; L194-I251 HydrophobicContact CD2-CD1 3.55Å; M246-I251 HydrophobicContact CG-CG2 4.12Å; M246-I251 HydrophobicContact SD-CD1 3.71Å; M246-I251 HydrophobicContact SD-CG1 4Å; M246-I251 HydrophobicContact SD-CG2 3.8Å; I251-E271 WeakPolarHBondContact O-CA 3.3Å; I251-E271 WeakPolarHBondContact O-CG 3.45Å; I251-V272 HydrophobicContact CD1-CB 4.11Å; I251-V272 HydrophobicContact CG1-CB 4.08Å; I251-V272 WeakPolarHBondContact CG1-O 3.2Å; I251-V272 PolarHBondContact O-N 3.26Å
252	L	98.6	Very high	97.1	Very high	17 Å²	17	41.6 Å²	41.6	9%	0.089	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	137.5	165.2	-63.4	174.2	0	0	0	108.6	Q100 A161 I162 K164 F270 E271	Q100-L252 HydrophobicContact CB-CD1 4.46Å; A161-L252 WeakPolarHBondContact CA-O 3.25Å; I162-L252 HydrophobicContact CD1-CD1 4.44Å; I162-L252 HydrophobicContact CG1-CB 3.99Å; I162-L252 PolarHBondContact N-O 2.83Å; I162-L252 PolarHBondContact O-N 2.61Å; K164-L252 HydrophobicContact CB-CG 4.04Å; K164-L252 HydrophobicContact CD-CD2 4.32Å; K164-L252 HydrophobicContact CG-CD1 4.37Å; K164-L252 HydrophobicContact CG-CD2 4.26Å; K164-L252 HydrophobicContact CG-CG 4.14Å; L252-F270 WeakPolarHBondContact CA-O 3.34Å; L252-E271 HydrophobicContact CD2-CB 4.02Å
253	T	98.8	Very high	97.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	123.1	162.2	-65.6	0	0	0	0	108	A159 M160 I195 Y236 I255 S269 F270 V272	A159-T253 HydrophobicContact CB-CG2 4.5Å; M160-T253 WeakPolarHBondContact O-CA 3.27Å; I195-T253 HydrophobicContact CD1-CG2 3.95Å; Y236-T253 WeakPolarHBondContact CE1-OG1 3.23Å; Y236-T253 PolarHBondContact OH-OG1 2.96Å; T253-I255 HydrophobicContact CG2-CD1 3.65Å; T253-I255 HydrophobicContact CG2-CG1 4.36Å; T253-S269 WeakPolarHBondContact O-CA 3.43Å; T253-S269 WeakPolarHBondContact O-CB 3.44Å; T253-F270 HydrophobicContact CG2-CE1 4.04Å; T253-F270 HydrophobicContact CG2-CE2 4.43Å; T253-F270 HydrophobicContact CG2-CZ 3.79Å; T253-F270 PolarHBondContact N-O 2.69Å; T253-F270 PolarHBondContact O-N 3.12Å; T253-F270 VanDerWaalsContact O-N 3.08Å; T253-V272 WeakPolarHBondContact OG1-CG2 3.49Å
254	I	98.7	Very high	97.2	Very high	6 Å²	6	40.5 Å²	40.5	3%	0.031	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.8	173.9	-58.6	173.6	0	0	0	107.4	P98 Q100 A159 M160 I162 T256 R267	P98-I254 HydrophobicContact CB-CD1 4.36Å; P98-I254 HydrophobicContact CG-CD1 4.03Å; Q100-I254 HydrophobicContact CB-CD1 4.35Å; A159-I254 WeakPolarHBondContact CA-O 3.3Å; M160-I254 PolarHBondContact N-O 2.67Å; M160-I254 PolarHBondContact O-N 2.72Å; I162-I254 HydrophobicContact CD1-CD1 3.69Å; I162-I254 HydrophobicContact CG1-CD1 4Å; I162-I254 HydrophobicContact CG2-CD1 4.34Å; I254-T256 HydrophobicContact CG2-CG2 4.11Å; I254-R267 HydrophobicContact CG2-CG 3.81Å
255	I	98.7	Very high	97.5	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	124.3	171.9	-49.7	-61.7	0	0	0	108.3	F109 L111 L145 V157 R158 A159 Y234 T253 R267 N268 F270	F109-I255 HydrophobicContact CZ-CG2 3.91Å; L111-I255 HydrophobicContact CD1-CB 4.06Å; L111-I255 HydrophobicContact CD1-CG1 3.76Å; L111-I255 HydrophobicContact CD2-CB 4.12Å; L111-I255 HydrophobicContact CD2-CG1 4.26Å; L111-I255 HydrophobicContact CD2-CG2 4.11Å; L145-I255 HydrophobicContact CD2-CG2 4.32Å; V157-I255 HydrophobicContact CG1-CG2 3.6Å; R158-I255 CarbonylContact O-C 3.48Å; R158-I255 VanDerWaalsContact O-CA 3.29Å; R158-I255 WeakPolarHBondContact O-CA 3.41Å; A159-I255 HydrophobicContact CB-CD1 3.51Å; Y234-I255 HydrophobicContact CE2-CD1 4.11Å; T253-I255 HydrophobicContact CG2-CD1 3.65Å; T253-I255 HydrophobicContact CG2-CG1 4.36Å; I255-R267 WeakPolarHBondContact O-CA 3.42Å; I255-N268 PolarHBondContact N-O 3.34Å; I255-N268 PolarHBondContact O-N 3.44Å; I255-F270 HydrophobicContact CD1-CE1 4.34Å; I255-F270 HydrophobicContact CG1-CE1 3.88Å
256	T	98.7	Very high	97.6	Very high	16 Å²	16	39.9 Å²	39.9	10%	0.098	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	136.2	175.3	46.4	0	0	0	0	110.8	V157 R158 I254 E258 L264 G266 R267	V157-T256 WeakPolarHBondContact CA-O 3.39Å; R158-T256 WeakPolarHBondContact CB-OG1 3.44Å; R158-T256 PolarHBondContact N-O 2.89Å; R158-T256 PolarHBondContact O-N 3.01Å; I254-T256 HydrophobicContact CG2-CG2 4.11Å; T256-E258 PolarHBondContact OG1-OE1 2.81Å; T256-L264 HydrophobicContact CG2-CD1 3.56Å; T256-G266 CarbonylContact C-O 3.53Å; T256-G266 WeakPolarHBondContact CA-O 3.48Å; T256-R267 HydrophobicContact CG2-CB 4.11Å; T256-R267 HydrophobicContact CG2-CG 3.83Å
257	L	98.6	Very high	97.7	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	123	165.3	-168.4	71.4	0	0	0	107.1	F109 V147 P151 T155 V157 Y220 L265 G266	F109-L257 HydrophobicContact CB-CD2 4.31Å; F109-L257 HydrophobicContact CD1-CB 4.31Å; F109-L257 HydrophobicContact CD2-CB 4.06Å; F109-L257 HydrophobicContact CD2-CD2 4.02Å; F109-L257 HydrophobicContact CD2-CG 4.47Å; F109-L257 HydrophobicContact CE1-CB 4.43Å; F109-L257 HydrophobicContact CE2-CB 4.19Å; F109-L257 HydrophobicContact CG-CB 4.11Å; F109-L257 HydrophobicContact CG-CD2 4.29Å; F109-L257 HydrophobicContact CZ-CB 4.38Å; V147-L257 HydrophobicContact CG1-CD2 4.38Å; P151-L257 HydrophobicContact CB-CD2 4.31Å; P151-L257 HydrophobicContact CG-CD2 4.41Å; T155-L257 HydrophobicContact CG2-CD1 3.38Å; T155-L257 HydrophobicContact CG2-CD2 4.32Å; T155-L257 HydrophobicContact CG2-CG 3.64Å; V157-L257 HydrophobicContact CG2-CD1 3.92Å; Y220-L257 HydrophobicContact CD2-CD1 3.85Å; Y220-L257 HydrophobicContact CG-CD1 4.23Å; L257-L265 HydrophobicContact CB-CB 4.35Å; L257-L265 HydrophobicContact CD2-CB 4.2Å; L257-L265 HydrophobicContact CG-CB 4.22Å; L257-L265 WeakPolarHBondContact O-CA 3.37Å; L257-L265 WeakPolarHBondContact O-CB 3.03Å; L257-L265 PolarHBondContact O-N 3.29Å; L257-G266 PolarHBondContact N-O 2.99Å; L257-G266 PolarHBondContact O-N 3.38Å
258	E	98.5	Very high	97.8	Very high	17 Å²	17	39 Å²	39	8%	0.079	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	143.5	-171.3	-66.1	171.3	-162.9	0	0	110.4	T155 R156 R158 T256 N263	T155-E258 CarbonylContact C-O 3.58Å; T155-E258 VanDerWaalsContact CA-O 3.25Å; T155-E258 WeakPolarHBondContact CA-O 3.39Å; T155-E258 WeakPolarHBondContact CG2-O 3.34Å; R156-E258 PolarHBondContact N-O 3.43Å; R156-E258 PolarHBondContact O-N 3.5Å; R158-E258 WeakPolarHBondContact CB-OE1 3.37Å; R158-E258 WeakPolarHBondContact CD-OE1 3.36Å; R158-E258 IonicContact CZ-OE1 2.66Å; R158-E258 IonicContact CZ-OE2 3.46Å; R158-E258 IonicContact NE-OE1 3.11Å; R158-E258 PolarHBondContact NE-OE1 3.13Å; R158-E258 IonicContact NE-OE2 3.63Å; R158-E258 PolarHBondContact NE-OE2 2.86Å; R158-E258 VanDerWaalsContact NE-OE2 3.13Å; R158-E258 IonicContact NH2-OE1 2.98Å; R158-E258 IonicContact NH2-OE2 3.66Å; R158-E258 PolarHBondContact NH2-OE2 2.89Å; T256-E258 PolarHBondContact OG1-OE1 2.81Å; E258-N263 CarbonylContact C-O 3.52Å; E258-N263 VanDerWaalsContact CA-O 3.25Å; E258-N263 WeakPolarHBondContact CA-O 3.45Å
259	D	97.6	Very high	97.9	Very high	32 Å²	32	30 Å²	30	17%	0.171	18%	0.179	C	C	.	.			trans	-74.1	179.7	169.7	72.3	13	0	0	0	111.8	S261 G262 N263 L265	D259-S261 PolarHBondContact O-N 2.78Å; D259-S261 VanDerWaalsContact OD1-C 3.3Å; D259-S261 VanDerWaalsContact OD1-CA 3.27Å; D259-S261 WeakPolarHBondContact OD1-CA 3.39Å; D259-S261 WeakPolarHBondContact OD1-CB 3.22Å; D259-S261 PolarHBondContact OD1-N 3.31Å; D259-G262 PolarHBondContact O-N 3.45Å; D259-G262 PolarHBondContact OD1-N 3.21Å; D259-N263 PolarHBondContact N-O 3.26Å; D259-N263 PolarHBondContact OD1-N 3.01Å; D259-N263 PolarHBondContact OD1-ND2 3.29Å; D259-N263 WeakPolarHBondContact OD2-CB 3.19Å; D259-N263 PolarHBondContact OD2-ND2 3.43Å; D259-L265 HydrophobicContact CB-CD1 4.09Å; D259-L265 HydrophobicContact CB-CD2 4.26Å; D259-L265 HydrophobicContact CB-CG 4.27Å
260	S	96.2	Very high	97.9	Very high	82 Å²	82	28.2 Å²	28.2	57%	0.573	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-21.9	177.7	56.6	0	0	0	0	113.8	G154	G154-S260 WeakPolarHBondContact O-CA 3.47Å; G154-S260 PolarHBondContact O-N 3.27Å
261	S	95.9	Very high	97.9	Very high	95 Å²	95	27.7 Å²	27.7	66%	0.664	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-4.5	176.3	-58.2	0	0	0	0	112.8	D259	D259-S261 PolarHBondContact O-N 2.78Å; D259-S261 VanDerWaalsContact OD1-C 3.3Å; D259-S261 VanDerWaalsContact OD1-CA 3.27Å; D259-S261 WeakPolarHBondContact OD1-CA 3.39Å; D259-S261 WeakPolarHBondContact OD1-CB 3.22Å; D259-S261 PolarHBondContact OD1-N 3.31Å
262	G	94	Very high	97.9	Very high	34 Å²	34	27.8 Å²	27.8	35%	0.351	17%	0.167	S	C	.	.			trans	83.8	12.1	-176.6	0	0	0	0	0	114.4	D259	D259-G262 PolarHBondContact O-N 3.45Å; D259-G262 PolarHBondContact OD1-N 3.21Å
263	N	96.8	Very high	97.9	Very high	96 Å²	96	31.2 Å²	31.2	51%	0.513	18%	0.179	S	C	.	.			trans	-75.5	143.7	174.9	-54.7	-58.9	0	0	0	110.7	E258 D259 L265	E258-N263 CarbonylContact C-O 3.52Å; E258-N263 VanDerWaalsContact CA-O 3.25Å; E258-N263 WeakPolarHBondContact CA-O 3.45Å; D259-N263 PolarHBondContact N-O 3.26Å; D259-N263 PolarHBondContact OD1-N 3.01Å; D259-N263 PolarHBondContact OD1-ND2 3.29Å; D259-N263 WeakPolarHBondContact OD2-CB 3.19Å; D259-N263 PolarHBondContact OD2-ND2 3.43Å; N263-L265 PolarHBondContact O-N 3.2Å
264	L	98	Very high	97.9	Very high	62 Å²	62	31.3 Å²	31.3	33%	0.325	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	117.6	-177.6	-173.4	72.5	0	0	0	112	Y103 T256 G266 R267	Y103-L264 HydrophobicContact CD1-CD2 3.93Å; Y103-L264 HydrophobicContact CD1-CG 4.24Å; Y103-L264 HydrophobicContact CE1-CD2 4.46Å; T256-L264 HydrophobicContact CG2-CD1 3.56Å; L264-G266 VanDerWaalsContact CD1-O 3.23Å; L264-G266 WeakPolarHBondContact CD1-O 3.47Å; L264-R267 HydrophobicContact CD1-CB 4.22Å; L264-R267 HydrophobicContact CD2-CB 4.46Å; L264-R267 VanDerWaalsContact CD2-NH1 3.31Å
265	L	98.3	Very high	97.9	Very high	26 Å²	26	31.6 Å²	31.6	14%	0.136	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-28.4	172.4	-55.7	-174.9	0	0	0	112.4	G105 Y107 P151 T155 L257 D259 N263	G105-L265 WeakPolarHBondContact CA-O 3.47Å; Y107-L265 HydrophobicContact CD2-CB 4.13Å; Y107-L265 HydrophobicContact CD2-CD1 4.42Å; Y107-L265 HydrophobicContact CE2-CB 4.2Å; Y107-L265 HydrophobicContact CE2-CD1 3.98Å; Y107-L265 HydrophobicContact CE2-CD2 4.12Å; Y107-L265 HydrophobicContact CE2-CG 4.33Å; P151-L265 HydrophobicContact CB-CD1 4.43Å; T155-L265 HydrophobicContact CG2-CD1 4.12Å; L257-L265 HydrophobicContact CB-CB 4.35Å; L257-L265 HydrophobicContact CD2-CB 4.2Å; L257-L265 HydrophobicContact CG-CB 4.22Å; L257-L265 WeakPolarHBondContact O-CA 3.37Å; L257-L265 WeakPolarHBondContact O-CB 3.03Å; L257-L265 PolarHBondContact O-N 3.29Å; D259-L265 HydrophobicContact CB-CD1 4.09Å; D259-L265 HydrophobicContact CB-CD2 4.26Å; D259-L265 HydrophobicContact CB-CG 4.27Å; N263-L265 PolarHBondContact O-N 3.2Å
266	G	98.2	Very high	97.8	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.1	155.6	179.9	0	0	0	0	0	111.9	Y103 T256 L257 L264	Y103-G266 CarbonylContact O-C 3.49Å; Y103-G266 VanDerWaalsContact O-CA 3.29Å; Y103-G266 WeakPolarHBondContact O-CA 3.46Å; T256-G266 CarbonylContact C-O 3.53Å; T256-G266 WeakPolarHBondContact CA-O 3.48Å; L257-G266 PolarHBondContact N-O 2.99Å; L257-G266 PolarHBondContact O-N 3.38Å; L264-G266 VanDerWaalsContact CD1-O 3.23Å; L264-G266 WeakPolarHBondContact CD1-O 3.47Å
267	R	98.7	Very high	97.8	Very high	39 Å²	39	37.2 Å²	37.2	15%	0.147	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	140.1	177.3	-175.4	165.2	54.9	-128.5	-11	111.8	S99 K101 T102 Y103 I254 I255 T256 L264	S99-R267 WeakPolarHBondContact O-CD 3.4Å; S99-R267 PolarHBondContact O-NE 3.5Å; S99-R267 VanDerWaalsContact O-NE 3.11Å; S99-R267 PolarHBondContact OG-NH2 3.06Å; S99-R267 VanDerWaalsContact OG-NH2 3.16Å; K101-R267 PolarHBondContact O-NE 3.43Å; K101-R267 PolarHBondContact O-NH2 3.26Å; T102-R267 CarbonylContact C-O 3.55Å; T102-R267 WeakPolarHBondContact CA-O 3.43Å; Y103-R267 PolarHBondContact N-O 3.06Å; Y103-R267 PolarHBondContact O-N 3.35Å; I254-R267 HydrophobicContact CG2-CG 3.81Å; I255-R267 WeakPolarHBondContact O-CA 3.42Å; T256-R267 HydrophobicContact CG2-CB 4.11Å; T256-R267 HydrophobicContact CG2-CG 3.83Å; L264-R267 HydrophobicContact CD1-CB 4.22Å; L264-R267 HydrophobicContact CD2-CB 4.46Å; L264-R267 VanDerWaalsContact CD2-NH1 3.31Å
268	N	98.4	Very high	97.8	Very high	28 Å²	28	37.3 Å²	37.3	15%	0.15	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	165.9	165.3	-149.8	-26.4	0	0	0	110	T102 F109 L111 I255	T102-N268 HydrophobicContact CG2-CB 4.49Å; T102-N268 PolarHBondContact OG1-OD1 3.46Å; F109-N268 HydrophobicContact CE1-CB 4.43Å; L111-N268 HydrophobicContact CD1-CB 3.75Å; L111-N268 HydrophobicContact CG-CB 3.74Å; I255-N268 PolarHBondContact N-O 3.34Å; I255-N268 PolarHBondContact O-N 3.44Å
269	S	98.3	Very high	97.7	Very high	12 Å²	12	36.5 Å²	36.5	8%	0.084	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	154.5	178.7	66.3	0	0	0	0	112.4	Q100 N131 T253	Q100-S269 PolarHBondContact O-OG 3.49Å; N131-S269 PolarHBondContact ND2-O 3.18Å; T253-S269 WeakPolarHBondContact O-CA 3.43Å; T253-S269 WeakPolarHBondContact O-CB 3.44Å
270	F	98.6	Very high	97.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	150.1	177.5	56.1	-84.8	0	0	0	110.1	L111 F113 Y126 N131 M133 V143 L252 T253 I255 V272	L111-F270 HydrophobicContact CD1-CD1 3.73Å; L111-F270 HydrophobicContact CD1-CE1 3.85Å; F113-F270 HydrophobicContact CE1-CD1 4.05Å; F113-F270 HydrophobicContact CE1-CD2 4.18Å; F113-F270 HydrophobicContact CE1-CE1 4.03Å; F113-F270 HydrophobicContact CE1-CE2 4.16Å; F113-F270 HydrophobicContact CE1-CG 4.12Å; F113-F270 HydrophobicContact CE1-CZ 4.09Å; F113-F270 HydrophobicContact CZ-CB 4.08Å; F113-F270 AromaticContact CZ-CD1 3.55Å; F113-F270 HydrophobicContact CZ-CD1 3.55Å; F113-F270 HydrophobicContact CZ-CD2 4.19Å; F113-F270 AromaticContact CZ-CE1 3.93Å; F113-F270 HydrophobicContact CZ-CE1 3.93Å; F113-F270 AromaticContact CZ-CG 3.68Å; F113-F270 HydrophobicContact CZ-CG 3.68Å; F113-F270 HydrophobicContact CZ-CZ 4.41Å; Y126-F270 HydrophobicContact CE2-CB 4.3Å; N131-F270 WeakPolarHBondContact OD1-CB 3.31Å; M133-F270 HydrophobicContact CB-CD2 3.9Å; M133-F270 HydrophobicContact CB-CE2 4.03Å; M133-F270 HydrophobicContact CE-CD2 4.39Å; M133-F270 HydrophobicContact CE-CE2 3.66Å; M133-F270 HydrophobicContact CE-CZ 4.09Å; M133-F270 HydrophobicContact SD-CE2 3.98Å; V143-F270 HydrophobicContact CG1-CE1 4.48Å; V143-F270 HydrophobicContact CG2-CE1 4.5Å; V143-F270 HydrophobicContact CG2-CZ 4.02Å; L252-F270 WeakPolarHBondContact CA-O 3.34Å; T253-F270 HydrophobicContact CG2-CE1 4.04Å; T253-F270 HydrophobicContact CG2-CE2 4.43Å; T253-F270 HydrophobicContact CG2-CZ 3.79Å; T253-F270 PolarHBondContact N-O 2.69Å; T253-F270 PolarHBondContact O-N 3.12Å; T253-F270 VanDerWaalsContact O-N 3.08Å; I255-F270 HydrophobicContact CD1-CE1 4.34Å; I255-F270 HydrophobicContact CG1-CE1 3.88Å; F270-V272 HydrophobicContact CD2-CG2 3.67Å; F270-V272 HydrophobicContact CE2-CG2 3.49Å; F270-V272 VanDerWaalsContact CE2-CG2 3.49Å
271	E	98.6	Very high	97.8	Very high	20 Å²	20	38.4 Å²	38.4	9%	0.093	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	146	174.3	-176.8	176	157.5	0	0	110.5	N131 K132 M133 K164 I251 L252	N131-E271 PolarHBondContact O-N 3.47Å; K132-E271 CarbonylContact C-O 3.47Å; K132-E271 WeakPolarHBondContact CA-O 3.46Å; K132-E271 HydrophobicContact CB-CB 4.05Å; K132-E271 HydrophobicContact CD-CB 4.24Å; K132-E271 HydrophobicContact CD-CG 3.88Å; K132-E271 WeakPolarHBondContact CD-OE1 3.2Å; K132-E271 WeakPolarHBondContact CE-OE1 3.44Å; K132-E271 HydrophobicContact CG-CB 3.85Å; K132-E271 HydrophobicContact CG-CG 3.9Å; K132-E271 IonicContact NZ-OE1 3.53Å; K132-E271 PolarHBondContact NZ-OE1 2.59Å; M133-E271 PolarHBondContact N-O 3.42Å; K164-E271 HydrophobicContact CD-CG 4.41Å; K164-E271 WeakPolarHBondContact CD-OE2 3.49Å; K164-E271 IonicContact NZ-OE2 3.7Å; K164-E271 PolarHBondContact NZ-OE2 2.9Å; I251-E271 WeakPolarHBondContact O-CA 3.3Å; I251-E271 WeakPolarHBondContact O-CG 3.45Å; L252-E271 HydrophobicContact CD2-CB 4.02Å
272	V	98.7	Very high	97.9	Very high	1 Å²	1	35 Å²	35	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	133.3	176.4	-174.5	0	0	0	0	110.9	M133 Y236 I251 T253 F270 V274	M133-V272 HydrophobicContact CB-CG2 4.41Å; M133-V272 CarbonylContact O-C 3.58Å; M133-V272 WeakPolarHBondContact O-CA 3.48Å; Y236-V272 HydrophobicContact CD1-CG1 3.99Å; Y236-V272 HydrophobicContact CD2-CG1 4.31Å; Y236-V272 HydrophobicContact CE1-CB 4.21Å; Y236-V272 HydrophobicContact CE1-CG1 3.78Å; Y236-V272 HydrophobicContact CE1-CG2 4.01Å; Y236-V272 HydrophobicContact CE2-CG1 4.13Å; Y236-V272 HydrophobicContact CG-CG1 4.26Å; I251-V272 HydrophobicContact CD1-CB 4.11Å; I251-V272 HydrophobicContact CG1-CB 4.08Å; I251-V272 WeakPolarHBondContact CG1-O 3.2Å; I251-V272 PolarHBondContact O-N 3.26Å; T253-V272 WeakPolarHBondContact OG1-CG2 3.49Å; F270-V272 HydrophobicContact CD2-CG2 3.67Å; F270-V272 HydrophobicContact CE2-CG2 3.49Å; F270-V272 VanDerWaalsContact CE2-CG2 3.49Å; V272-V274 HydrophobicContact CG1-CG2 4.07Å
273	R	98.5	Very high	98	Very high	90 Å²	90	39 Å²	39	34%	0.34	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	112.3	169.4	-178.4	179.7	176.3	104.3	2	110	M133 F134 C135 C275 D281 E285	M133-R273 PolarHBondContact O-N 3.4Å; F134-R273 WeakPolarHBondContact CA-O 3.35Å; F134-R273 HydrophobicContact CD1-CB 4.03Å; F134-R273 HydrophobicContact CD1-CG 4.31Å; F134-R273 HydrophobicContact CE1-CB 4.34Å; C135-R273 PolarHBondContact N-O 3.11Å; R273-C275 HydrophobicContact CG-CB 4.3Å; R273-D281 IonicContact CZ-OD2 3.48Å; R273-D281 IonicContact NE-OD2 3.65Å; R273-D281 PolarHBondContact NE-OD2 3.35Å; R273-D281 IonicContact NH2-OD2 3.75Å; R273-D281 PolarHBondContact NH2-OD2 2.88Å; R273-D281 VanDerWaalsContact NH2-OD2 3.09Å; R273-E285 WeakPolarHBondContact CD-OE1 3.12Å; R273-E285 IonicContact CZ-OE1 2.67Å; R273-E285 IonicContact NE-OE1 3.01Å; R273-E285 IonicContact NH1-OE1 2.72Å
274	V	98.7	Very high	98.1	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	112.2	176.8	-166.7	0	0	0	0	108.5	C135 L137 Y236 C238 S240 M246 V272	C135-V274 CarbonylContact O-C 3.48Å; C135-V274 VanDerWaalsContact O-CA 3.27Å; C135-V274 WeakPolarHBondContact O-CA 3.16Å; L137-V274 HydrophobicContact CB-CG1 4.45Å; Y236-V274 HydrophobicContact CD1-CG2 4.28Å; Y236-V274 HydrophobicContact CG-CG2 4.01Å; C238-V274 WeakPolarHBondContact O-CB 3.39Å; C238-V274 WeakPolarHBondContact O-CG1 3.46Å; S240-V274 WeakPolarHBondContact CB-O 3.48Å; S240-V274 PolarHBondContact N-O 3.35Å; S240-V274 PolarHBondContact OG-N 2.66Å; S240-V274 PolarHBondContact OG-O 2.98Å; M246-V274 HydrophobicContact CE-CG2 4.26Å; V272-V274 HydrophobicContact CG1-CG2 4.07Å
275	C	98.2	Very high	98	Very high	13 Å²	13	36.7 Å²	36.7	9%	0.088	18%	0.182	C	C	.	.			trans	-147.1	164.2	-169	64	0	0	0	0	112.5	C135 Q136 R273	C135-C275 PolarHBondContact O-N 2.76Å; Q136-C275 WeakPolarHBondContact CA-O 3.3Å; Q136-C275 WeakPolarHBondContact CG-O 3.06Å; R273-C275 HydrophobicContact CG-CB 4.3Å
276	A	97.6	Very high	98	Very high	75 Å²	75	37.8 Å²	37.8	62%	0.62	19%	0.186	S	C	*	.	S	Bend	trans	-69.9	-32.4	-178.3	0	0	0	0	0	113.6	Q136	Q136-A276 PolarHBondContact NE2-O 2.78Å
277	C	97.3	Very high	97.9	Very high	59 Å²	59	41.6 Å²	41.6	40%	0.399	20%	0.204	S	C	.	.			trans	-131	74.6	-174.1	-58.4	0	0	0	0	112.1	G279 R280 D281	C277-G279 PolarHBondContact O-N 2.97Å; C277-R280 HydrophobicContact CB-CB 4.01Å; C277-R280 PolarHBondContact O-N 3.36Å; C277-R280 VanDerWaalsContact O-N 3.12Å; C277-D281 PolarHBondContact O-N 2.8Å
278	P	98.1	Very high	97.7	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-54.1	-46.9	-174.6	-30.4	37.9	0	0	0	114.9	T125 F134 Q136 R280 D281 R282	T125-P278 HydrophobicContact CG2-CB 4.04Å; F134-P278 HydrophobicContact CB-CB 3.77Å; F134-P278 WeakPolarHBondContact O-CB 3.29Å; Q136-P278 HydrophobicContact CG-CG 3.76Å; P278-R280 VanDerWaalsContact C-N 3.3Å; P278-R280 PolarHBondContact O-N 3.34Å; P278-D281 PolarHBondContact O-N 3.48Å; P278-R282 WeakPolarHBondContact O-CB 3.38Å; P278-R282 PolarHBondContact O-N 3.04Å
279	G	97.6	Very high	97.5	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-65.4	-30.3	-179.4	0	0	0	0	0	113.9	T118 C277 R283	T118-G279 WeakPolarHBondContact CB-O 3.4Å; C277-G279 PolarHBondContact O-N 2.97Å; G279-R283 PolarHBondContact O-N 3.4Å; G279-R283 PolarHBondContact O-NE 3.42Å
280	R	97.6	Very high	97.3	Very high	143 Å²	143	52.5 Å²	52.5	54%	0.54	25%	0.253	S	S	.	.	H	α-helix	trans	-73.2	-51.9	173.5	-177	-159.3	65.6	161.1	-3.2	110.2	C277 P278 R282 R283 T284	C277-R280 HydrophobicContact CB-CB 4.01Å; C277-R280 PolarHBondContact O-N 3.36Å; C277-R280 VanDerWaalsContact O-N 3.12Å; P278-R280 VanDerWaalsContact C-N 3.3Å; P278-R280 PolarHBondContact O-N 3.34Å; R280-R282 VanDerWaalsContact C-N 3.3Å; R280-R282 PolarHBondContact O-N 3.44Å; R280-R283 PolarHBondContact O-N 2.91Å; R280-R283 VanDerWaalsContact O-N 3.16Å; R280-T284 PolarHBondContact O-N 3.49Å; R280-T284 PolarHBondContact O-OG1 3.44Å
281	D	97.7	Very high	97	Very high	11 Å²	11	58 Å²	58	6%	0.059	28%	0.276	C	S	.	.	H	α-helix	trans	-60.5	-41	-176.8	-78.1	27.6	0	0	0	111.1	F134 R273 C277 P278 T284 E285	F134-D281 HydrophobicContact CD1-CB 3.84Å; F134-D281 HydrophobicContact CE1-CB 4.08Å; R273-D281 IonicContact CZ-OD2 3.48Å; R273-D281 IonicContact NE-OD2 3.65Å; R273-D281 PolarHBondContact NE-OD2 3.35Å; R273-D281 IonicContact NH2-OD2 3.75Å; R273-D281 PolarHBondContact NH2-OD2 2.88Å; R273-D281 VanDerWaalsContact NH2-OD2 3.09Å; C277-D281 PolarHBondContact O-N 2.8Å; P278-D281 PolarHBondContact O-N 3.48Å; D281-T284 PolarHBondContact O-N 3.12Å; D281-E285 WeakPolarHBondContact O-CB 3.48Å; D281-E285 WeakPolarHBondContact O-CG 3.48Å; D281-E285 PolarHBondContact O-N 3.03Å
282	R	97.7	Very high	96.4	Very high	24 Å²	24	65.6 Å²	65.6	9%	0.091	31%	0.309	C	S	.	.	H	α-helix	trans	-57.2	-52	172.7	176.4	174.3	158.8	-156.8	-5	112.1	S116 T118 T125 Y126 F134 P278 R280 T284 E285 E286	S116-R282 PolarHBondContact O-NH1 3.08Å; T118-R282 HydrophobicContact CG2-CB 4.43Å; T118-R282 HydrophobicContact CG2-CG 4.12Å; T125-R282 HydrophobicContact CG2-CB 4.03Å; T125-R282 HydrophobicContact CG2-CG 4.48Å; T125-R282 PolarHBondContact OG1-NH1 3.32Å; Y126-R282 PolarHBondContact O-NE 2.95Å; Y126-R282 PolarHBondContact O-NH1 2.94Å; F134-R282 HydrophobicContact CD1-CB 4.4Å; F134-R282 HydrophobicContact CD2-CB 3.67Å; F134-R282 HydrophobicContact CD2-CG 4.1Å; F134-R282 HydrophobicContact CE2-CB 3.82Å; F134-R282 HydrophobicContact CE2-CG 4Å; F134-R282 HydrophobicContact CG-CB 4Å; F134-R282 HydrophobicContact CZ-CB 4.24Å; P278-R282 WeakPolarHBondContact O-CB 3.38Å; P278-R282 PolarHBondContact O-N 3.04Å; R280-R282 VanDerWaalsContact C-N 3.3Å; R280-R282 PolarHBondContact O-N 3.44Å; R282-T284 VanDerWaalsContact C-N 3.35Å; R282-T284 PolarHBondContact O-N 3.5Å; R282-E285 PolarHBondContact O-N 2.95Å; R282-E286 HydrophobicContact CG-CG 4.24Å; R282-E286 IonicContact CZ-OE1 2.9Å; R282-E286 IonicContact NE-OE1 3.42Å; R282-E286 PolarHBondContact NE-OE1 3.18Å; R282-E286 IonicContact NE-OE2 3.94Å; R282-E286 IonicContact NH2-OE1 3.96Å; R282-E286 PolarHBondContact NH2-OE1 3.15Å; R282-E286 IonicContact NH2-OE2 3.09Å; R282-E286 WeakPolarHBondContact O-CB 3.37Å; R282-E286 WeakPolarHBondContact O-CG 3.46Å; R282-E286 PolarHBondContact O-N 3.48Å
283	R	97	Very high	95	Very high	116 Å²	116	68.5 Å²	68.5	44%	0.438	34%	0.339	S	S	.	.	H	α-helix	trans	-58.9	-46.2	179.5	-82.9	-174.5	-70.8	172.6	0.3	112.1	T118 G279 R280 E285 E286 E287	T118-R283 HydrophobicContact CG2-CG 3.75Å; T118-R283 PolarHBondContact O-NH2 2.88Å; T118-R283 VanDerWaalsContact OG1-CD 3.28Å; T118-R283 WeakPolarHBondContact OG1-CD 3.33Å; T118-R283 WeakPolarHBondContact OG1-CG 3.39Å; G279-R283 PolarHBondContact O-N 3.4Å; G279-R283 PolarHBondContact O-NE 3.42Å; R280-R283 PolarHBondContact O-N 2.91Å; R280-R283 VanDerWaalsContact O-N 3.16Å; R283-E285 VanDerWaalsContact C-N 3.34Å; R283-E285 PolarHBondContact O-N 3.08Å; R283-E286 PolarHBondContact O-N 3.49Å; R283-E287 VanDerWaalsContact O-CB 3.27Å; R283-E287 WeakPolarHBondContact O-CB 3.28Å; R283-E287 PolarHBondContact O-N 3.08Å
284	T	97.3	Very high	93	Very high	66 Å²	66	70.1 Å²	70.1	41%	0.405	35%	0.351	S	S	.	.	H	α-helix	trans	-61.1	-44.2	178.7	-59.5	0	0	0	0	111	R280 D281 R282 N288	R280-T284 PolarHBondContact O-N 3.49Å; R280-T284 PolarHBondContact O-OG1 3.44Å; D281-T284 PolarHBondContact O-N 3.12Å; R282-T284 VanDerWaalsContact C-N 3.35Å; R282-T284 PolarHBondContact O-N 3.5Å; T284-N288 VanDerWaalsContact O-CB 3.31Å; T284-N288 WeakPolarHBondContact O-CB 3.47Å; T284-N288 PolarHBondContact O-N 3.18Å; T284-N288 PolarHBondContact O-ND2 3.31Å; T284-N288 VanDerWaalsContact O-ND2 3.08Å
285	E	97.5	Very high	90.7	Very high	44 Å²	44	75 Å²	75	21%	0.206	38%	0.382	C	S	.	.	H	α-helix	trans	-70	-38.4	179.2	-70.6	-165.2	-152	0	0	113	L130 K132 F134 R273 D281 R282 R283 N288 L289	L130-E285 HydrophobicContact CD1-CB 3.68Å; K132-E285 WeakPolarHBondContact CE-OE2 3.29Å; K132-E285 VanDerWaalsContact NZ-CD 3.28Å; K132-E285 IonicContact NZ-OE1 3.86Å; K132-E285 PolarHBondContact NZ-OE1 3.33Å; K132-E285 VanDerWaalsContact NZ-OE1 3.08Å; K132-E285 IonicContact NZ-OE2 3.29Å; K132-E285 PolarHBondContact NZ-OE2 3.17Å; F134-E285 HydrophobicContact CE1-CB 4.49Å; F134-E285 HydrophobicContact CE1-CG 4.22Å; F134-E285 WeakPolarHBondContact CE1-OE1 3.25Å; F134-E285 HydrophobicContact CZ-CB 4.07Å; F134-E285 HydrophobicContact CZ-CG 4.25Å; R273-E285 WeakPolarHBondContact CD-OE1 3.12Å; R273-E285 IonicContact CZ-OE1 2.67Å; R273-E285 IonicContact NE-OE1 3.01Å; R273-E285 IonicContact NH1-OE1 2.72Å; D281-E285 WeakPolarHBondContact O-CB 3.48Å; D281-E285 WeakPolarHBondContact O-CG 3.48Å; D281-E285 PolarHBondContact O-N 3.03Å; R282-E285 PolarHBondContact O-N 2.95Å; R283-E285 VanDerWaalsContact C-N 3.34Å; R283-E285 PolarHBondContact O-N 3.08Å; E285-N288 PolarHBondContact O-N 3.48Å; E285-L289 PolarHBondContact O-N 3.48Å
286	E	96.7	Very high	88.1	Confident	49 Å²	49	82 Å²	82	23%	0.229	41%	0.413	C	S	.	.	H	α-helix	trans	-65.4	-42.7	174.3	-74.3	177.5	166.8	0	0	112	S127 L130 R282 R283 N288 L289 R290	S127-E286 WeakPolarHBondContact CB-OE1 3.37Å; S127-E286 WeakPolarHBondContact OG-CG 3.26Å; S127-E286 PolarHBondContact OG-OE1 3.3Å; L130-E286 HydrophobicContact CD1-CG 4.05Å; R282-E286 HydrophobicContact CG-CG 4.24Å; R282-E286 IonicContact CZ-OE1 2.9Å; R282-E286 IonicContact NE-OE1 3.42Å; R282-E286 PolarHBondContact NE-OE1 3.18Å; R282-E286 IonicContact NE-OE2 3.94Å; R282-E286 IonicContact NH2-OE1 3.96Å; R282-E286 PolarHBondContact NH2-OE1 3.15Å; R282-E286 IonicContact NH2-OE2 3.09Å; R282-E286 WeakPolarHBondContact O-CB 3.37Å; R282-E286 WeakPolarHBondContact O-CG 3.46Å; R282-E286 PolarHBondContact O-N 3.48Å; R283-E286 PolarHBondContact O-N 3.49Å; E286-N288 VanDerWaalsContact C-N 3.33Å; E286-N288 PolarHBondContact O-N 3.26Å; E286-L289 WeakPolarHBondContact O-CB 3.5Å; E286-L289 PolarHBondContact O-N 3.31Å; E286-R290 PolarHBondContact O-N 3.39Å
287	E	96.4	Very high	85.6	Confident	81 Å²	81	85.9 Å²	85.9	38%	0.379	42%	0.418	S	S	.	.	H	α-helix	trans	-63.2	-41.1	175	-174.9	-176.9	170.5	0	0	111.3	R283 L289 R290 K291	R283-E287 VanDerWaalsContact O-CB 3.27Å; R283-E287 WeakPolarHBondContact O-CB 3.28Å; R283-E287 PolarHBondContact O-N 3.08Å; E287-L289 VanDerWaalsContact C-N 3.32Å; E287-L289 PolarHBondContact O-N 3.28Å; E287-R290 PolarHBondContact O-N 3.42Å; E287-K291 HydrophobicContact CG-CD 4.38Å; E287-K291 WeakPolarHBondContact O-CG 3.44Å; E287-K291 PolarHBondContact O-N 3.44Å; E287-K291 WeakPolarHBondContact OE1-CE 3.39Å; E287-K291 IonicContact OE1-NZ 3.49Å; E287-K291 PolarHBondContact OE1-NZ 3.49Å
288	N	96	Very high	83	Confident	73 Å²	73	90.7 Å²	90.7	39%	0.39	44%	0.435	S	S	.	.	H	α-helix	trans	-65	-34.6	175.4	-72	-23.2	0	0	0	112.3	T284 E285 E286 K292	T284-N288 VanDerWaalsContact O-CB 3.31Å; T284-N288 WeakPolarHBondContact O-CB 3.47Å; T284-N288 PolarHBondContact O-N 3.18Å; T284-N288 PolarHBondContact O-ND2 3.31Å; T284-N288 VanDerWaalsContact O-ND2 3.08Å; E285-N288 PolarHBondContact O-N 3.48Å; E286-N288 VanDerWaalsContact C-N 3.33Å; E286-N288 PolarHBondContact O-N 3.26Å; N288-K292 VanDerWaalsContact O-CG 3.29Å; N288-K292 WeakPolarHBondContact O-CG 3.49Å; N288-K292 PolarHBondContact O-N 3.21Å
289	L	94.2	Very high	80.2	Confident	79 Å²	79	97.4 Å²	97.4	41%	0.414	47%	0.47	S	S	.	.	H	α-helix	trans	-65.1	-44.7	173	-174.5	70	0	0	0	110.6	A129 L130 E285 E286 E287 K292 G293	A129-L289 HydrophobicContact CB-CD2 4.12Å; L130-L289 HydrophobicContact CD2-CB 4.21Å; L130-L289 HydrophobicContact CD2-CD1 4.34Å; L130-L289 HydrophobicContact CD2-CD2 3.79Å; L130-L289 HydrophobicContact CD2-CG 4.34Å; L130-L289 HydrophobicContact CG-CD2 4.41Å; E285-L289 PolarHBondContact O-N 3.48Å; E286-L289 WeakPolarHBondContact O-CB 3.5Å; E286-L289 PolarHBondContact O-N 3.31Å; E287-L289 VanDerWaalsContact C-N 3.32Å; E287-L289 PolarHBondContact O-N 3.28Å; L289-K292 PolarHBondContact O-N 3.21Å; L289-G293 PolarHBondContact O-N 2.82Å
290	R	93.2	Very high	77.5	Confident	156 Å²	156	102.4 Å²	102.4	59%	0.589	50%	0.502	S	S	*	.	H	α-helix	trans	-61.2	-47.4	177.8	-169.9	180	70.3	-159.9	-1.1	112	E286 E287 K292 G293 E294	E286-R290 PolarHBondContact O-N 3.39Å; E287-R290 PolarHBondContact O-N 3.42Å; R290-K292 PolarHBondContact O-N 3.04Å; R290-G293 PolarHBondContact O-N 3.06Å; R290-E294 PolarHBondContact O-N 3.18Å; R290-E294 VanDerWaalsContact O-N 3.08Å
291	K	93.1	Very high	74.9	Confident	114 Å²	114	102.2 Å²	102.2	50%	0.496	52%	0.52	S	S	.	.	H	α-helix	trans	-63.2	-27.6	178.3	-72.4	178	-177.9	170	0	113.6	E287	E287-K291 HydrophobicContact CG-CD 4.38Å; E287-K291 WeakPolarHBondContact O-CG 3.44Å; E287-K291 PolarHBondContact O-N 3.44Å; E287-K291 WeakPolarHBondContact OE1-CE 3.39Å; E287-K291 IonicContact OE1-NZ 3.49Å; E287-K291 PolarHBondContact OE1-NZ 3.49Å
292	K	84.5	Confident	72.3	Confident	181 Å²	181	104.6 Å²	104.6	79%	0.787	55%	0.547	S	S	*	.	H	α-helix	trans	-78.3	-23.3	173.9	-74	175	-179.1	-175.4	0	112.8	N288 L289 R290	N288-K292 VanDerWaalsContact O-CG 3.29Å; N288-K292 WeakPolarHBondContact O-CG 3.49Å; N288-K292 PolarHBondContact O-N 3.21Å; L289-K292 PolarHBondContact O-N 3.21Å; R290-K292 PolarHBondContact O-N 3.04Å
293	G	70.4	Confident	69.8	Low	62 Å²	62	109.7 Å²	109.7	64%	0.639	59%	0.586	S	S	*	*	H	α-helix	trans	-84.2	-23.1	175.4	0	0	0	0	0	113.7	L289 R290 P295	L289-G293 PolarHBondContact O-N 2.82Å; R290-G293 PolarHBondContact O-N 3.06Å; G293-P295 VanDerWaalsContact O-CD 3.32Å; G293-P295 WeakPolarHBondContact O-CD 3.47Å
294	E	56.1	Low	67.3	Low	123 Å²	123	110.6 Å²	110.6	58%	0.575	61%	0.605	S	S	*	*	S	Bend	trans	-83.1	115.3	173.4	-73.5	-179.1	144.1	0	0	110.3	R290 H296	R290-E294 PolarHBondContact O-N 3.18Å; R290-E294 VanDerWaalsContact O-N 3.08Å; E294-H296 PolarHBondContact O-N 3.45Å
295	P	49.6	Very low	64.8	Low	103 Å²	103	117.3 Å²	117.3	67%	0.669	63%	0.628	S	S	*	*			trans	-63.4	123.6	167.6	24.4	-28.8	0	0	0	108.2	G293 H297	G293-P295 VanDerWaalsContact O-CD 3.32Å; G293-P295 WeakPolarHBondContact O-CD 3.47Å; P295-H297 VanDerWaalsContact C-N 3.27Å; P295-H297 PolarHBondContact O-N 3.21Å
296	H	45.2	Very low	62.3	Low	161 Å²	161	126.6 Å²	126.6	75%	0.745	66%	0.662	S	S	*	*			trans	-61.2	83.4	180	-155.7	-77.6	0	0	0	110.8	E294 E298	E294-H296 PolarHBondContact O-N 3.45Å; H296-E298 VanDerWaalsContact C-N 3.33Å; H296-E298 IonicContact CE1-OE2 2.71Å; H296-E298 PolarHBondContact CE1-OE2 3.37Å; H296-E298 PolarHBondContact O-N 2.78Å
297	H	44.7	Very low	59.7	Low	156 Å²	156	129 Å²	129	72%	0.722	69%	0.689	S	S	*	*			trans	-96.3	59.2	166.8	-92.2	-77.4	0	0	0	109.6	P295 L299	P295-H297 VanDerWaalsContact C-N 3.27Å; P295-H297 PolarHBondContact O-N 3.21Å; H297-L299 VanDerWaalsContact C-N 3.25Å; H297-L299 PolarHBondContact O-N 3.15Å
298	E	41.4	Very low	57.1	Low	161 Å²	161	132.7 Å²	132.7	75%	0.752	71%	0.711	S	S	*	*			trans	-82.5	82.9	154	-73.2	-166.2	153.9	0	0	107.7	H296	H296-E298 VanDerWaalsContact C-N 3.33Å; H296-E298 IonicContact CE1-OE2 2.71Å; H296-E298 PolarHBondContact CE1-OE2 3.37Å; H296-E298 PolarHBondContact O-N 2.78Å
299	L	39.6	Very low	54.9	Low	141 Å²	141	135 Å²	135	74%	0.738	73%	0.73	S	S	*	*			trans	-71.6	132.6	152.9	-81.4	160.6	0	0	0	107	H297	H297-L299 VanDerWaalsContact C-N 3.25Å; H297-L299 PolarHBondContact O-N 3.15Å
300	P	41.3	Very low	52.4	Low	106 Å²	106	138.1 Å²	138.1	69%	0.688	75%	0.747	S	S	*	*			trans	-60.9	137.3	-176.5	24.2	-32.1	0	0	0	110.4	G302	P300-G302 PolarHBondContact O-N 3.22Å
301	P	43	Very low	50.3	Low	140 Å²	140	138.5 Å²	138.5	91%	0.909	76%	0.761	S	S	*	*	S	Bend	trans	-72.5	98.2	177.9	29.9	-30.6	0	0	0	107.8
302	G	43.9	Very low	47.8	Very low	61 Å²	61	139.9 Å²	139.9	63%	0.629	78%	0.779	S	S	*	*			trans	-161.1	-2.1	-177.2	0	0	0	0	0	117.8	P300	P300-G302 PolarHBondContact O-N 3.22Å
303	S	43.8	Very low	45.7	Very low	130 Å²	130	137 Å²	137	91%	0.909	78%	0.782	S	S	*	*			trans	-109	66.9	-179	-145.2	0	0	0	0	112
304	T	45.3	Very low	44.2	Very low	135 Å²	135	139.3 Å²	139.3	83%	0.828	79%	0.788	S	S	*	*	S	Bend	trans	-111.1	115	163.8	-7.9	0	0	0	0	107.4
305	K	45.3	Very low	42.9	Very low	207 Å²	207	138.5 Å²	138.5	90%	0.9	80%	0.796	S	S	*	*			trans	59.3	95.8	171.7	-89.9	177.5	166.7	176.3	0	116.4
306	R	44.5	Very low	42.5	Very low	240 Å²	240	139.5 Å²	139.5	91%	0.906	80%	0.802	S	S	*	*			trans	-130.1	127.9	143.7	-108.3	-178.7	-81.8	-170.4	-3.3	109.5
307	A	42.4	Very low	42.3	Very low	98 Å²	98	140.4 Å²	140.4	81%	0.81	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-65.6	143.5	-177.6	0	0	0	0	0	111.5
308	L	41	Very low	41.9	Very low	159 Å²	159	139.1 Å²	139.1	83%	0.832	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-66.5	134.3	173.5	-87.6	78.5	0	0	0	111
309	P	50.7	Low	41.9	Very low	121 Å²	121	140.6 Å²	140.6	79%	0.786	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-81.2	123.5	153.7	-4.3	22.6	0	0	0	109.7	N311	P309-N311 PolarHBondContact O-N 2.97Å
310	N	42.3	Very low	41.9	Very low	145 Å²	145	142.9 Å²	142.9	78%	0.775	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-61.8	125.8	162	-90.9	-12.5	0	0	0	108.4
311	N	47.7	Very low	41.7	Very low	164 Å²	164	147 Å²	147	88%	0.877	83%	0.827	S	S	*	*			trans	-171.4	125.8	143.8	-82.2	-27.4	0	0	0	110.2	P309	P309-N311 PolarHBondContact O-N 2.97Å
312	T	41.8	Very low	41.4	Very low	144 Å²	144	146.2 Å²	146.2	88%	0.883	82%	0.822	S	S	*	*			trans	-54.7	122.7	177.3	33.3	0	0	0	0	114.5
313	S	40	Very low	41.2	Very low	120 Å²	120	152 Å²	152	84%	0.839	84%	0.838	S	S	*	*			trans	-166.5	150	145.2	-165.9	0	0	0	0	111.8
314	S	38.7	Very low	41	Very low	110 Å²	110	153.9 Å²	153.9	77%	0.769	84%	0.838	S	S	*	*			trans	-68.2	142.4	-163.2	45.7	0	0	0	0	117.3
315	S	29.6	Very low	40.7	Very low	106 Å²	106	150.5 Å²	150.5	74%	0.741	83%	0.83	S	S	*	*			trans	-54.8	156.5	176.6	-173.9	0	0	0	0	115.7	Q317	S315-Q317 PolarHBondContact OG-N 2.89Å
316	P	40.2	Very low	40.4	Very low	124 Å²	124	149.6 Å²	149.6	81%	0.805	83%	0.829	S	S	*	*				-141.1	121.7	115.6	20.8	0.5	0	0	0	117.2
317	Q	41	Very low	39.9	Very low	180 Å²	180	147.8 Å²	147.8	84%	0.841	82%	0.823	S	S	*	*			trans	39.9	138.4	138.3	-67.3	-167.9	-27.3	0	0	125.2	S315	S315-Q317 PolarHBondContact OG-N 2.89Å
318	P	37.2	Very low	39.5	Very low	129 Å²	129	152.5 Å²	152.5	84%	0.838	83%	0.826	S	S	*	*			trans	-98.8	163.9	177.7	39.6	-33.3	0	0	0	114.7
319	K	40.2	Very low	39.2	Very low	193 Å²	193	150 Å²	150	84%	0.839	82%	0.817	S	S	*	*			trans	-130.4	107.9	170.8	-104.4	179.5	179.8	171	0	112.7
320	K	39.9	Very low	38.8	Very low	188 Å²	188	152.1 Å²	152.1	82%	0.817	82%	0.821	S	S	*	*			trans	62.9	145.9	148.5	-57.1	-178.6	176.3	-178.4	0	118.6
321	K	38.1	Very low	38.9	Very low	192 Å²	192	152.3 Å²	152.3	84%	0.835	82%	0.817	S	S	*	*			cis	-167.9	142	-22.1	-109.7	-174.7	179.5	-171.4	0	103.8
322	P	35.8	Very low	38.6	Very low	125 Å²	125	151.9 Å²	151.9	81%	0.812	82%	0.815	S	S	*	*			trans	-88	161.1	-174.1	36	-33.3	0	0	0	112.5
323	L	39.4	Very low	38.6	Very low	181 Å²	181	152.2 Å²	152.2	95%	0.948	81%	0.807	S	S	*	*			trans	-143.1	127.4	164.2	-100.4	162.5	0	0	0	111
324	D	39.2	Very low	38.6	Very low	170 Å²	170	153.5 Å²	153.5	91%	0.909	81%	0.81	S	S	*	*			trans	-66.7	168.6	175.5	-88.8	-44.4	0	0	0	115
325	G	39.5	Very low	38.9	Very low	64 Å²	64	153.2 Å²	153.2	66%	0.66	81%	0.808	S	S	*	*			trans	122.7	93.8	149.6	0	0	0	0	0	113.6
326	E	39.9	Very low	39.5	Very low	189 Å²	189	157.1 Å²	157.1	88%	0.883	81%	0.812	S	S	*	*				88.3	141.4	77.8	-76.1	-173.6	177.2	0	0	115
327	Y	34.4	Very low	39.8	Very low	202 Å²	202	160.1 Å²	160.1	79%	0.792	82%	0.815	S	S	*	*			trans	-78	148.5	-166.5	-160.7	-94.8	0	0	0	112.7	T329	Y327-T329 HydrophobicContact CE1-CG2 4.42Å
328	F	33.4	Very low	39.9	Very low	196 Å²	196	159.9 Å²	159.9	86%	0.86	81%	0.811	S	S	*	*			trans	-139.7	117.8	165.2	-84.1	-85.1	0	0	0	113.9
329	T	35.1	Very low	40.3	Very low	106 Å²	106	162.7 Å²	162.7	65%	0.65	81%	0.813	S	S	*	*			trans	-74.9	127.4	158.8	18.8	0	0	0	0	110.2	Y327 Q331	Y327-T329 HydrophobicContact CE1-CG2 4.42Å; T329-Q331 PolarHBondContact O-N 3.37Å
330	L	42.3	Very low	40.5	Very low	167 Å²	167	161.5 Å²	161.5	87%	0.874	82%	0.816	S	S	*	*			trans	-80.7	96	167.5	-95.9	151.3	0	0	0	109.2
331	Q	43.1	Very low	40.8	Very low	148 Å²	148	162.3 Å²	162.3	69%	0.692	84%	0.843	S	S	*	*			trans	-114.6	104.5	157.1	-76.3	-178.4	-9.1	0	0	107.3	T329 Q333	T329-Q331 PolarHBondContact O-N 3.37Å; Q331-Q333 VanDerWaalsContact C-N 3.27Å; Q331-Q333 PolarHBondContact O-N 3.49Å
332	D	42.6	Very low	41	Very low	155 Å²	155	160.9 Å²	160.9	83%	0.829	84%	0.843	S	S	*	*			trans	-70.6	93.2	157	-82.8	-31.9	0	0	0	107
333	Q	42	Very low	41.2	Very low	151 Å²	151	162.7 Å²	162.7	71%	0.706	85%	0.845	S	S	*	*			trans	-125.7	89.3	161.2	-78.3	-168.5	-6.1	0	0	108.5	Q331 S335	Q331-Q333 VanDerWaalsContact C-N 3.27Å; Q331-Q333 PolarHBondContact O-N 3.49Å; Q333-S335 PolarHBondContact O-N 3.1Å
334	T	38.7	Very low	41.3	Very low	148 Å²	148	161.7 Å²	161.7	91%	0.908	84%	0.839	S	S	*	*			trans	-71.2	99	156.4	45.1	0	0	0	0	108.4
335	S	44.5	Very low	41.5	Very low	103 Å²	103	161.2 Å²	161.2	72%	0.72	84%	0.835	S	S	*	*			trans	-114.7	105.3	158.4	51.2	0	0	0	0	108.4	Q333	Q333-S335 PolarHBondContact O-N 3.1Å
336	F	43.1	Very low	41.6	Very low	189 Å²	189	167.3 Å²	167.3	83%	0.829	85%	0.846	S	S	*	*			trans	-83.8	112.1	166.5	-123.7	-93.3	0	0	0	106.8
337	Q	45.9	Very low	41.7	Very low	186 Å²	186	165.9 Å²	165.9	87%	0.869	84%	0.844	S	S	*	*			trans	-135.3	101.1	160.2	-139.3	171.2	-2.8	0	0	107.8
338	K	43	Very low	42.2	Very low	175 Å²	175	163.3 Å²	163.3	76%	0.761	85%	0.848	S	S	*	*			trans	-80	123.8	165.5	-95.9	177	169.3	176.8	0	107
339	E	45.5	Very low	42.9	Very low	188 Å²	188	160.8 Å²	160.8	88%	0.879	85%	0.847	S	S	*	*			trans	-154.4	125.2	145.1	-111.4	170.7	163.6	0	0	109
340	N	46	Very low	43.5	Very low	168 Å²	168	165.3 Å²	165.3	90%	0.898	86%	0.863	S	S	*	*			trans	-72.3	139.9	-177.7	-76.7	-16.2	0	0	0	111.3
341	C	45.7	Very low	43.6	Very low	206 Å²	206	165.2 Å²	165.2	100%	1.392	86%	0.862	S	S	*	*			trans	-150.1	0	134.1	-152.2	0	0	0	0	108.5

Retrieved 341 of 341 residues in 139.2 ms (Link to these results)

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