X2JEL1_DROME Loading...

Misexpression suppressor of ras 3, isoform D

AlphaFold DB (Q7KJV2), UniProt , Accession X2JEL1, Species DROME (Drosophila melanogaster, Fruit fly), Gene MESR3, Length 280 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36	Very low	37.4	Very low	234 Å²	234	189.2 Å²	189.2	100%	1.153	88%	0.875	S	S	*	*				0	81.4	0	-64.9	178.8	176.6	0	0	106.3
2	S	34.8	Very low	37.2	Very low	102 Å²	102	188.2 Å²	188.2	71%	0.713	88%	0.879	S	S	*	*				68.4	101.3	99.2	-48.4	0	0	0	0	111.4
3	H	35.6	Very low	36.8	Very low	189 Å²	189	179.2 Å²	179.2	88%	0.875	87%	0.868	S	S	*	*				174.9	117.1	112.6	-88.1	-70	0	0	0	110
4	Q	37.4	Very low	36.7	Very low	175 Å²	175	174.9 Å²	174.9	82%	0.818	87%	0.865	S	S	*	*			trans	-88.8	122.4	174.7	-171.2	170.8	17.6	0	0	108.2	Q6	Q4-Q6 PolarHBondContact O-N 3.1Å
5	L	39.3	Very low	37	Very low	171 Å²	171	172.4 Å²	172.4	90%	0.895	86%	0.863	S	S	*	*			trans	-81	110	174.6	-81.6	158.2	0	0	0	109.5
6	Q	36.5	Very low	36.9	Very low	160 Å²	160	167.9 Å²	167.9	75%	0.748	85%	0.854	S	S	*	*			trans	-99.8	111.8	161.6	-84.5	-179.7	4.8	0	0	109	Q4	Q4-Q6 PolarHBondContact O-N 3.1Å
7	Q	38.7	Very low	36.9	Very low	190 Å²	190	167.9 Å²	167.9	89%	0.888	86%	0.856	S	S	*	*			trans	-86.2	113.8	163.7	-75.2	177.9	-9.6	0	0	108.4
8	T	38.5	Very low	37.3	Very low	123 Å²	123	164.1 Å²	164.1	76%	0.755	85%	0.847	S	S	*	*			trans	-106.5	106.1	171.6	-22.9	0	0	0	0	109	R10	T8-R10 PolarHBondContact O-N 3.13Å
9	R	38	Very low	37.5	Very low	246 Å²	246	160.1 Å²	160.1	93%	0.928	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-62.9	121	167.5	-82.6	-179.4	172.5	177.8	-2.6	109.2
10	R	38.7	Very low	38.1	Very low	248 Å²	248	158.1 Å²	158.1	94%	0.936	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-89.5	118.2	163.3	-72.7	-172.2	178.2	-170	0	108.9	T8	T8-R10 PolarHBondContact O-N 3.13Å
11	R	37.8	Very low	38.2	Very low	243 Å²	243	156.3 Å²	156.3	92%	0.917	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-92.3	133.8	179	-152.6	177.6	-171.6	-129.7	3.4	108.5	G13	R11-G13 PolarHBondContact O-N 2.9Å
12	L	34.6	Very low	38.5	Very low	177 Å²	177	150.7 Å²	150.7	93%	0.927	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-58.2	122.2	173.2	-73.6	151.8	0	0	0	110
13	G	32.8	Very low	38.8	Very low	71 Å²	71	155.1 Å²	155.1	73%	0.732	83%	0.828	S	S	*	*			trans	-100.2	112.5	171.1	0	0	0	0	0	109.7	R11	R11-G13 PolarHBondContact O-N 2.9Å
14	S	35.9	Very low	38.7	Very low	119 Å²	119	151.3 Å²	151.3	83%	0.832	82%	0.823	S	S	*	*			trans	-65.4	126.7	161.7	172.8	0	0	0	0	108.9
15	V	40.4	Very low	39	Very low	138 Å²	138	149 Å²	149	84%	0.836	83%	0.826	S	S	*	*			trans	-131.4	107.1	164.1	-78.1	0	0	0	0	108.2
16	S	36.2	Very low	39	Very low	101 Å²	101	149.8 Å²	149.8	71%	0.706	83%	0.825	S	S	*	*			trans	-60.8	122.3	164.1	47.3	0	0	0	0	109.7
17	D	36.2	Very low	38.9	Very low	168 Å²	168	145.5 Å²	145.5	90%	0.898	82%	0.824	S	S	*	*			trans	-96.8	91.3	169.9	-152.8	3.9	0	0	0	108
18	S	44	Very low	38.9	Very low	98 Å²	98	143.7 Å²	143.7	69%	0.685	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-76.9	125.8	174.5	-64.5	0	0	0	0	109
19	A	41.4	Very low	38.6	Very low	88 Å²	88	141.5 Å²	141.5	73%	0.727	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-53.2	145.5	171.8	0	0	0	0	0	111.8
20	P	48.5	Very low	38.3	Very low	120 Å²	120	134.8 Å²	134.8	78%	0.779	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-68	142.2	174.8	27.7	-32.4	0	0	0	110.7
21	P	40.9	Very low	38	Very low	121 Å²	121	128.9 Å²	128.9	79%	0.786	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-75.3	139.6	-177.2	29.8	-32.2	0	0	0	111.6	E23	P21-E23 PolarHBondContact O-N 3.33Å
22	S	41.5	Very low	37.8	Very low	116 Å²	116	124 Å²	124	81%	0.811	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-66.6	124.2	167.4	-58.5	0	0	0	0	109.9	S24	S22-S24 PolarHBondContact O-N 2.88Å
23	E	41.4	Very low	38	Very low	195 Å²	195	123.1 Å²	123.1	91%	0.911	80%	0.798	S	S	*	*			trans	-77.2	106.2	175.2	28.1	-168.8	85.3	0	0	110	P21	P21-E23 PolarHBondContact O-N 3.33Å
24	S	35.1	Very low	38.4	Very low	110 Å²	110	124.2 Å²	124.2	77%	0.769	79%	0.792	S	S	*	*			trans	-72.9	126.1	167.1	-46.9	0	0	0	0	109.4	S22	S22-S24 PolarHBondContact O-N 2.88Å
25	S	41.8	Very low	38.5	Very low	127 Å²	127	130.5 Å²	130.5	89%	0.888	80%	0.798	S	S	*	*			trans	-91.7	114.8	169.5	-178.1	0	0	0	0	109
26	E	40.2	Very low	38.2	Very low	187 Å²	187	130.9 Å²	130.9	87%	0.874	80%	0.795	S	S	*	*			trans	-128.4	135.9	170.2	-76.1	-169.3	119.2	0	0	111.6
27	G	35	Very low	38	Very low	70 Å²	70	134.8 Å²	134.8	72%	0.722	80%	0.802	S	S	*	*			trans	98.3	135.2	153.1	0	0	0	0	0	115.8
28	T	38	Very low	37.8	Very low	152 Å²	152	134.2 Å²	134.2	93%	0.933	80%	0.798	S	S	*	*			cis	-168.6	165	12.4	-9.6	0	0	0	0	109.7
29	G	32.7	Very low	37.4	Very low	76 Å²	76	136.1 Å²	136.1	78%	0.784	80%	0.799	S	S	*	*			trans	-69.1	-160.3	-169.1	0	0	0	0	0	116.7
30	S	31.5	Very low	36.8	Very low	105 Å²	105	139 Å²	139	73%	0.734	80%	0.802	S	S	*	*			cis	-167.5	147	6.6	174.3	0	0	0	0	107.1
31	S	32.7	Very low	36.1	Very low	125 Å²	125	141.5 Å²	141.5	87%	0.874	80%	0.803	S	S	*	*			trans	-151.5	109.6	148.9	-128.4	0	0	0	0	111.3
32	L	33	Very low	35.9	Very low	141 Å²	141	140.8 Å²	140.8	74%	0.738	80%	0.798	S	S	*	*			trans	-32.7	149.2	158.4	-64.9	160.6	0	0	0	113.4
33	E	39	Very low	35.3	Very low	157 Å²	157	142.2 Å²	142.2	73%	0.734	80%	0.796	S	S	*	*			cis	-174.2	-171.7	11.6	-93.3	-86.4	132.9	0	0	105.8
34	P	41.5	Very low	35	Very low	95 Å²	95	144.9 Å²	144.9	62%	0.617	80%	0.798	S	S	*	*				-120.1	164.2	-88.8	37.1	-17.6	0	0	0	112.3
35	R	37.1	Very low	35	Very low	250 Å²	250	144.6 Å²	144.6	94%	0.943	80%	0.796	S	S	*	*			trans	-153.8	104	153.8	-116.4	171.3	-178.8	171.2	0.3	110.4
36	D	34	Very low	34.6	Very low	146 Å²	146	142.6 Å²	142.6	78%	0.781	79%	0.788	S	S	*	*			trans	-55.7	127.6	162.9	-68.7	-58.9	0	0	0	110.4
37	E	33.4	Very low	34.2	Very low	184 Å²	184	143.2 Å²	143.2	86%	0.86	79%	0.79	S	S	*	*			trans	-156.5	95.6	142.9	-116.2	174	-176.6	0	0	109.5	I39	E37-I39 PolarHBondContact O-N 3.07Å
38	L	31.4	Very low	34	Very low	155 Å²	155	144.2 Å²	144.2	81%	0.812	79%	0.786	S	S	*	*			trans	-62.9	102.7	164.2	-87	145.4	0	0	0	108.8	L40	L38-L40 VanDerWaalsContact C-N 3.29Å; L38-L40 PolarHBondContact O-N 3.11Å
39	I	34.9	Very low	33.7	Very low	139 Å²	139	145.1 Å²	145.1	71%	0.713	78%	0.779	S	S	*	*			trans	-77.1	89.5	165.9	-58.4	179.1	0	0	0	107.7	E37 H41	E37-I39 PolarHBondContact O-N 3.07Å; I39-H41 PolarHBondContact O-N 3.01Å
40	L	29.9	Very low	33.6	Very low	148 Å²	148	147.1 Å²	147.1	78%	0.775	78%	0.781	S	S	*	*			trans	-68.6	114.4	161.5	-79.8	148.2	0	0	0	108.3	L38 P42	L38-L40 VanDerWaalsContact C-N 3.29Å; L38-L40 PolarHBondContact O-N 3.11Å; L40-P42 WeakPolarHBondContact O-CD 3.37Å
41	H	33.9	Very low	33.5	Very low	173 Å²	173	147.6 Å²	147.6	80%	0.801	78%	0.784	S	S	*	*			trans	-91.5	111.6	162.1	-80.6	-83.6	0	0	0	108.6	I39	I39-H41 PolarHBondContact O-N 3.01Å
42	P	35	Very low	33.5	Very low	105 Å²	105	146.4 Å²	146.4	68%	0.682	78%	0.783	S	S	*	*			trans	-84.8	152.7	173.8	33.6	-30	0	0	0	111.3	L40	L40-P42 WeakPolarHBondContact O-CD 3.37Å
43	D	30.5	Very low	33.6	Very low	146 Å²	146	148.9 Å²	148.9	78%	0.781	79%	0.79	S	S	*	*			trans	76	80.1	162.1	-59.5	-21.1	0	0	0	118.9
44	W	35.2	Very low	33.1	Very low	252 Å²	252	153.3 Å²	153.3	96%	0.955	80%	0.8	S	S	*	*			trans	-101	103.1	132	89.2	-73.2	0	0	0	107.4
45	S	34.8	Very low	32.7	Very low	104 Å²	104	154.4 Å²	154.4	73%	0.727	81%	0.81	S	S	*	*			trans	-143.6	131.7	169	-72	0	0	0	0	108.4
46	A	32.9	Very low	32.4	Very low	85 Å²	85	148.2 Å²	148.2	70%	0.702	81%	0.805	S	S	*	*			trans	-52.3	145.2	-172.5	0	0	0	0	0	114.1
47	H	31.8	Very low	32.5	Very low	199 Å²	199	145.4 Å²	145.4	92%	0.921	80%	0.802	S	S	*	*			trans	-152.8	132.3	136.4	-83.7	-59.1	0	0	0	110.9
48	S	31.4	Very low	32.4	Very low	92 Å²	92	146 Å²	146	64%	0.643	81%	0.805	S	S	*	*			trans	-89	157.5	174.8	51.4	0	0	0	0	111.4
49	H	31.5	Very low	32.4	Very low	171 Å²	171	141.8 Å²	141.8	79%	0.792	80%	0.798	S	S	*	*			trans	62.9	114	163.8	-54.5	-73.7	0	0	0	119.4
50	S	30	Very low	32.4	Very low	118 Å²	118	142 Å²	142	83%	0.825	81%	0.806	S	S	*	*				170.2	152.3	98	52.6	0	0	0	0	112.9
51	S	30	Very low	32.6	Very low	114 Å²	114	141.5 Å²	141.5	80%	0.797	81%	0.809	S	S	*	*			trans	-51.7	138.5	178.8	48.2	0	0	0	0	116.9
52	A	32.3	Very low	32.8	Very low	101 Å²	101	137.8 Å²	137.8	84%	0.835	80%	0.803	S	S	*	*			trans	-167.3	131.9	134.9	0	0	0	0	0	111.9
53	Q	34.4	Very low	32.9	Very low	193 Å²	193	140.5 Å²	140.5	90%	0.902	81%	0.811	S	S	*	*			trans	-58.1	142.1	170.5	-69.7	162.1	-82	0	0	112.3
54	R	30.2	Very low	33.3	Very low	249 Å²	249	143.4 Å²	143.4	94%	0.94	81%	0.813	S	S	*	*			trans	-163.2	135.9	135	-112.4	164.9	171.3	-115.5	-1.5	112.9
55	S	32.2	Very low	33.2	Very low	118 Å²	118	138.9 Å²	138.9	83%	0.825	81%	0.807	S	S	*	*			trans	-72.5	144.2	-178	47.5	0	0	0	0	114.4
56	S	31.6	Very low	33.5	Very low	121 Å²	121	138.2 Å²	138.2	85%	0.846	81%	0.808	S	S	*	*			trans	-162.8	121.3	146.4	177.8	0	0	0	0	110
57	A	34.8	Very low	33.7	Very low	86 Å²	86	138.1 Å²	138.1	71%	0.711	80%	0.802	S	S	*	*			trans	-72.8	142.9	176.4	0	0	0	0	0	111.5
58	H	32.6	Very low	34.2	Very low	198 Å²	198	136.4 Å²	136.4	92%	0.917	80%	0.8	S	S	*	*			trans	-174.1	122.5	138.2	-98	-64.3	0	0	0	110.8
59	G	31.1	Very low	34.9	Very low	65 Å²	65	139 Å²	139	67%	0.67	81%	0.805	S	S	*	*			trans	95.2	115.4	140.5	0	0	0	0	0	118.6
60	T	34.8	Very low	35.1	Very low	143 Å²	143	137.5 Å²	137.5	88%	0.877	80%	0.803	S	S	*	*			trans	75.6	93.6	154.6	59	0	0	0	0	118.2	S62	T60-S62 PolarHBondContact O-N 3.46Å; T60-S62 VanDerWaalsContact O-N 3.1Å
61	T	33.6	Very low	35.9	Very low	138 Å²	138	135.9 Å²	135.9	85%	0.847	80%	0.797	S	S	*	*			trans	-70	94.9	161.6	44.2	0	0	0	0	110.2
62	S	37.4	Very low	36.3	Very low	96 Å²	96	137.9 Å²	137.9	67%	0.671	80%	0.798	S	S	*	*			trans	-77.6	110.9	156.6	-179.8	0	0	0	0	107.8	T60 Y64	T60-S62 PolarHBondContact O-N 3.46Å; T60-S62 VanDerWaalsContact O-N 3.1Å; S62-Y64 VanDerWaalsContact C-N 3.3Å; S62-Y64 PolarHBondContact O-N 3.02Å; S62-Y64 VanDerWaalsContact O-N 3.13Å
63	L	38.1	Very low	36.9	Very low	162 Å²	162	138.3 Å²	138.3	85%	0.848	79%	0.79	S	S	*	*			trans	-83.3	77.1	173.8	-72.3	170	0	0	0	109.4
64	Y	39.2	Very low	37.6	Very low	207 Å²	207	134.1 Å²	134.1	81%	0.812	77%	0.773	S	S	*	*			trans	-125.1	95.9	153.3	-72.6	-80.4	0	0	0	106.8	S62 A66	S62-Y64 VanDerWaalsContact C-N 3.3Å; S62-Y64 PolarHBondContact O-N 3.02Å; S62-Y64 VanDerWaalsContact O-N 3.13Å; Y64-A66 PolarHBondContact O-N 3.18Å
65	N	32.2	Very low	38.4	Very low	156 Å²	156	126.9 Å²	126.9	83%	0.834	76%	0.761	S	S	*	*			trans	-71.2	79.8	171.7	-166.4	76.4	0	0	0	107.8	S67	N65-S67 PolarHBondContact O-N 2.91Å
66	A	41.1	Very low	39.3	Very low	91 Å²	91	123.8 Å²	123.8	75%	0.752	74%	0.737	S	S	*	*			trans	-74	87.1	164.1	0	0	0	0	0	106.8	Y64 D68	Y64-A66 PolarHBondContact O-N 3.18Å; A66-D68 PolarHBondContact O-N 3Å
67	S	37.7	Very low	40.2	Very low	83 Å²	83	123.8 Å²	123.8	58%	0.58	73%	0.727	S	S	*	*			trans	-61.7	121.8	157.7	46.7	0	0	0	0	107	N65 I69	N65-S67 PolarHBondContact O-N 2.91Å; S67-I69 PolarHBondContact O-N 2.96Å
68	D	41.2	Very low	41.2	Very low	162 Å²	162	120.8 Å²	120.8	87%	0.866	70%	0.701	S	S	*	*			trans	-43.1	102	167.7	-69.6	-54.6	0	0	0	109.3	A66	A66-D68 PolarHBondContact O-N 3Å
69	I	46.3	Very low	42.2	Very low	148 Å²	148	117.4 Å²	117.4	76%	0.759	69%	0.694	S	S	*	*			trans	-96	106.9	167	-126.6	153.3	0	0	0	104.1	S67 A71	S67-I69 PolarHBondContact O-N 2.96Å; I69-A71 PolarHBondContact O-N 3.2Å
70	D	35.8	Very low	43.5	Very low	139 Å²	139	118.8 Å²	118.8	74%	0.743	69%	0.693	S	S	*	*			trans	-53.8	112.1	169.1	-86.8	-48	0	0	0	107.6	D72	D70-D72 PolarHBondContact O-N 2.81Å; D70-D72 VanDerWaalsContact O-N 3.13Å
71	A	46.3	Very low	45.3	Very low	84 Å²	84	116.6 Å²	116.6	69%	0.694	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-3.2	-176.7	0	0	0	0	0	113.1	I69	I69-A71 PolarHBondContact O-N 3.2Å
72	D	39.8	Very low	47.3	Very low	156 Å²	156	113 Å²	113	83%	0.834	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	11.4	-174.1	-76.4	-13.3	0	0	0	113.8	D70	D70-D72 PolarHBondContact O-N 2.81Å; D70-D72 VanDerWaalsContact O-N 3.13Å
73	T	44.3	Very low	49.8	Very low	109 Å²	109	113 Å²	113	67%	0.669	65%	0.646	S	S	*	*			trans	-145.2	43.9	179.8	-32.2	0	0	0	0	115	S75	T73-S75 PolarHBondContact O-N 3.42Å
74	I	49.2	Very low	52.3	Low	105 Å²	105	106.1 Å²	106.1	54%	0.538	61%	0.611	S	S	.	*			trans	-90.9	67.9	152.4	-69.3	178.5	0	0	0	107.8	T76	I74-T76 WeakPolarHBondContact CG2-OG1 3.19Å; I74-T76 PolarHBondContact O-N 3.21Å
75	S	46.3	Very low	54.8	Low	97 Å²	97	98.4 Å²	98.4	68%	0.678	59%	0.587	S	S	*	*			trans	-72.2	77.7	147.6	-83.9	0	0	0	0	106	T73 D77	T73-S75 PolarHBondContact O-N 3.42Å; S75-D77 PolarHBondContact O-N 3.13Å; S75-D77 VanDerWaalsContact O-N 3.08Å
76	T	51.9	Low	57.6	Low	53 Å²	53	97.6 Å²	97.6	33%	0.325	58%	0.583	S	S	.	*			trans	-57	118.7	163.9	-25.5	0	0	0	0	105	I74 T78	I74-T76 WeakPolarHBondContact CG2-OG1 3.19Å; I74-T76 PolarHBondContact O-N 3.21Å; T76-T78 WeakPolarHBondContact O-CG2 3.42Å; T76-T78 PolarHBondContact O-N 3.34Å; T76-T78 PolarHBondContact O-OG1 3.21Å
77	D	49.9	Very low	59.9	Low	121 Å²	121	97.5 Å²	97.5	65%	0.647	56%	0.563	S	S	*	*			trans	-66.6	78.6	179	-146.8	-11	0	0	0	107.9	S75 T79	S75-D77 PolarHBondContact O-N 3.13Å; S75-D77 VanDerWaalsContact O-N 3.08Å; D77-T79 PolarHBondContact O-N 2.9Å
78	T	56.2	Low	62.5	Low	24 Å²	24	94 Å²	94	15%	0.147	54%	0.538	C	S	.	.			trans	-81.5	-5.4	-171.5	40.5	0	0	0	0	112.2	T76 S80 E88 R154	T76-T78 WeakPolarHBondContact O-CG2 3.42Å; T76-T78 PolarHBondContact O-N 3.34Å; T76-T78 PolarHBondContact O-OG1 3.21Å; T78-S80 VanDerWaalsContact C-N 3.33Å; T78-S80 PolarHBondContact O-N 2.86Å; T78-E88 WeakPolarHBondContact CG2-OE1 3.36Å; T78-R154 PolarHBondContact O-NH1 3.5Å
79	T	54	Low	65	Low	127 Å²	127	89.3 Å²	89.3	78%	0.779	51%	0.508	S	S	*	.	S	Bend	trans	-78.3	-16.2	-163.7	-27	0	0	0	0	113.1	D77	D77-T79 PolarHBondContact O-N 2.9Å
80	S	57.9	Low	67.2	Low	93 Å²	93	83 Å²	83	65%	0.65	48%	0.48	S	S	*	.	S	Bend	trans	-132.4	-8.6	-176.2	60.1	0	0	0	0	116.3	T78	T78-S80 VanDerWaalsContact C-N 3.33Å; T78-S80 PolarHBondContact O-N 2.86Å
81	N	72.3	Confident	69.9	Low	98 Å²	98	77.5 Å²	77.5	52%	0.524	45%	0.45	S	S	.	.			trans	-92.6	110.8	-177.5	-75.8	-29.9	0	0	0	110.9	N83 R154	N81-N83 VanDerWaalsContact C-N 3.33Å; N81-R154 PolarHBondContact O-NH1 2.68Å; N81-R154 PolarHBondContact O-NH2 3.4Å
82	T	75.5	Confident	72.2	Confident	62 Å²	62	73.6 Å²	73.6	38%	0.38	42%	0.417	S	S	.	.			trans	-73.6	-24.4	177.9	53.9	0	0	0	0	113.4	A108 L109 D196	T82-A108 WeakPolarHBondContact O-CA 3.39Å; T82-A108 WeakPolarHBondContact O-CB 3.48Å; T82-L109 PolarHBondContact O-N 3.35Å; T82-D196 HydrophobicContact CG2-CB 3.94Å; T82-D196 WeakPolarHBondContact CG2-OD2 3.33Å
83	N	89.8	Confident	74.8	Confident	96 Å²	96	71.1 Å²	71.1	51%	0.513	40%	0.4	S	S	.	.	B	Isolated β-bridge	trans	-85	142.7	172.8	-66.7	-56.2	0	0	0	111	N81 G107	N81-N83 VanDerWaalsContact C-N 3.33Å; N83-G107 WeakPolarHBondContact CA-O 2.95Å
84	L	91.8	Very high	77	Confident	18 Å²	18	68.1 Å²	68.1	9%	0.094	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-89.5	134.8	178.6	-73.4	149.8	0	0	0	110.6	E88 R89 S106 G107 I129	L84-E88 HydrophobicContact CD2-CB 3.76Å; L84-E88 HydrophobicContact CD2-CG 4.46Å; L84-R89 HydrophobicContact CB-CG 3.99Å; L84-S106 WeakPolarHBondContact CD1-O 3.34Å; L84-G107 PolarHBondContact N-O 2.92Å; L84-I129 HydrophobicContact CD1-CB 4.26Å; L84-I129 HydrophobicContact CD1-CD1 4.19Å; L84-I129 HydrophobicContact CD1-CG1 3.87Å; L84-I129 HydrophobicContact CD1-CG2 3.57Å; L84-I129 HydrophobicContact CD2-CD1 3.47Å; L84-I129 VanDerWaalsContact CD2-CD1 3.47Å; L84-I129 HydrophobicContact CD2-CG1 3.88Å; L84-I129 HydrophobicContact CG-CD1 4.48Å; L84-I129 HydrophobicContact CG-CG1 4.48Å
85	S	91.8	Very high	79.1	Confident	45 Å²	45	68 Å²	68	32%	0.315	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-71.9	158.6	169.6	62.6	0	0	0	0	111.8	Y87 E88 R89	S85-Y87 PolarHBondContact O-N 3.35Å; S85-E88 WeakPolarHBondContact CB-OE2 3.44Å; S85-E88 PolarHBondContact N-OE2 3.02Å; S85-E88 PolarHBondContact O-N 2.68Å; S85-E88 VanDerWaalsContact O-N 3.12Å; S85-E88 VanDerWaalsContact OG-CG 3.3Å; S85-E88 WeakPolarHBondContact OG-CG 3.4Å; S85-E88 PolarHBondContact OG-N 2.89Å; S85-E88 PolarHBondContact OG-OE2 3.03Å; S85-R89 WeakPolarHBondContact O-CG 3.5Å; S85-R89 PolarHBondContact O-N 2.92Å
86	D	90.4	Very high	81.2	Confident	139 Å²	139	64.8 Å²	64.8	74%	0.743	35%	0.354	S	S	*	.	H	α-helix	trans	-57.7	-32.5	174.6	-68.2	-32	0	0	0	112.3	R89 G90	D86-R89 PolarHBondContact O-N 2.83Å; D86-G90 PolarHBondContact O-N 3.1Å
87	Y	90	Very high	82.9	Confident	88 Å²	88	64.3 Å²	64.3	35%	0.345	36%	0.36	S	S	.	.	H	α-helix	trans	-62.4	-49.2	175.3	-179.6	-93.7	0	0	0	112	S85 R89 G90 Q91 H252	S85-Y87 PolarHBondContact O-N 3.35Å; Y87-R89 VanDerWaalsContact C-N 3.35Å; Y87-G90 PolarHBondContact O-N 3.18Å; Y87-Q91 WeakPolarHBondContact O-CB 3.06Å; Y87-Q91 PolarHBondContact O-N 2.93Å; Y87-H252 PolarHBondContact OH-CE1 3.39Å
88	E	92	Very high	84.5	Confident	9 Å²	9	60.1 Å²	60.1	4%	0.042	35%	0.345	C	S	.	.	H	α-helix	trans	-65.8	-39.7	178.8	-68.7	167	113.8	0	0	111.4	T78 L84 S85 Q91 V92 R154	T78-E88 WeakPolarHBondContact CG2-OE1 3.36Å; L84-E88 HydrophobicContact CD2-CB 3.76Å; L84-E88 HydrophobicContact CD2-CG 4.46Å; S85-E88 WeakPolarHBondContact CB-OE2 3.44Å; S85-E88 PolarHBondContact N-OE2 3.02Å; S85-E88 PolarHBondContact O-N 2.68Å; S85-E88 VanDerWaalsContact O-N 3.12Å; S85-E88 VanDerWaalsContact OG-CG 3.3Å; S85-E88 WeakPolarHBondContact OG-CG 3.4Å; S85-E88 PolarHBondContact OG-N 2.89Å; S85-E88 PolarHBondContact OG-OE2 3.03Å; E88-Q91 WeakPolarHBondContact O-CB 3.49Å; E88-Q91 PolarHBondContact O-N 3.43Å; E88-V92 WeakPolarHBondContact O-CG2 3.3Å; E88-V92 PolarHBondContact O-N 3.22Å; E88-R154 IonicContact OE1-CZ 3.32Å; E88-R154 IonicContact OE1-NE 2.75Å; E88-R154 PolarHBondContact OE1-NE 3.35Å; E88-R154 IonicContact OE1-NH2 3.18Å; E88-R154 PolarHBondContact OE1-NH2 3.19Å; E88-R154 IonicContact OE2-NH2 3.78Å; E88-R154 PolarHBondContact OE2-NH2 3.18Å
89	R	93.9	Very high	85.8	Confident	64 Å²	64	62.9 Å²	62.9	24%	0.242	36%	0.358	C	S	.	.	H	α-helix	trans	-60.7	-47	174.7	-68.2	175.3	63.1	116	9.6	111.2	L84 S85 D86 Y87 Q91 V92 E93 V105	L84-R89 HydrophobicContact CB-CG 3.99Å; S85-R89 WeakPolarHBondContact O-CG 3.5Å; S85-R89 PolarHBondContact O-N 2.92Å; D86-R89 PolarHBondContact O-N 2.83Å; Y87-R89 VanDerWaalsContact C-N 3.35Å; R89-Q91 VanDerWaalsContact C-N 3.3Å; R89-Q91 PolarHBondContact O-N 3.34Å; R89-V92 PolarHBondContact O-N 2.64Å; R89-E93 WeakPolarHBondContact O-CB 3.37Å; R89-E93 PolarHBondContact O-N 2.77Å; R89-V105 HydrophobicContact CB-CG1 4.45Å; R89-V105 HydrophobicContact CG-CG1 4.33Å; R89-V105 VanDerWaalsContact CZ-O 3.32Å; R89-V105 PolarHBondContact NH2-O 2.88Å
90	G	92.7	Very high	87.2	Confident	17 Å²	17	57.8 Å²	57.8	18%	0.175	33%	0.331	C	S	.	.	H	α-helix	trans	-60.6	-39.2	175.5	0	0	0	0	0	112.4	D86 Y87 E93 S94 Q250	D86-G90 PolarHBondContact O-N 3.1Å; Y87-G90 PolarHBondContact O-N 3.18Å; G90-E93 PolarHBondContact O-N 2.68Å; G90-S94 WeakPolarHBondContact O-CB 3.35Å; G90-S94 PolarHBondContact O-N 3.08Å; G90-S94 PolarHBondContact O-OG 2.99Å; G90-Q250 PolarHBondContact O-OE1 2.86Å
91	Q	92.3	Very high	88.7	Confident	23 Å²	23	54.3 Å²	54.3	11%	0.107	31%	0.306	C	S	.	.	H	α-helix	trans	-61.8	-48.2	179.3	-170	-169	32.9	0	0	110.8	Y87 E88 R89 S94 F95 G155 Q250	Y87-Q91 WeakPolarHBondContact O-CB 3.06Å; Y87-Q91 PolarHBondContact O-N 2.93Å; E88-Q91 WeakPolarHBondContact O-CB 3.49Å; E88-Q91 PolarHBondContact O-N 3.43Å; R89-Q91 VanDerWaalsContact C-N 3.3Å; R89-Q91 PolarHBondContact O-N 3.34Å; Q91-S94 PolarHBondContact O-N 3.34Å; Q91-F95 WeakPolarHBondContact O-CB 3.39Å; Q91-F95 PolarHBondContact O-N 3.12Å; Q91-G155 PolarHBondContact NE2-O 3.03Å; Q91-G155 PolarHBondContact OE1-O 2.89Å; Q91-Q250 VanDerWaalsContact CA-OE1 3.31Å
92	V	94.4	Very high	89.7	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.006	30%	0.3	C	S	.	.	H	α-helix	trans	-64.2	-44.2	177.2	175.7	0	0	0	0	110.9	E88 R89 S94 F95 F96 V105 I129 V131	E88-V92 WeakPolarHBondContact O-CG2 3.3Å; E88-V92 PolarHBondContact O-N 3.22Å; R89-V92 PolarHBondContact O-N 2.64Å; V92-S94 VanDerWaalsContact C-N 3.32Å; V92-S94 PolarHBondContact O-N 2.98Å; V92-F95 PolarHBondContact O-N 3.05Å; V92-F96 HydrophobicContact CG1-CD2 3.79Å; V92-F96 HydrophobicContact CG1-CE2 3.94Å; V92-F96 WeakPolarHBondContact O-CD2 3.5Å; V92-F96 PolarHBondContact O-N 3.32Å; V92-V105 HydrophobicContact CB-CG1 4.05Å; V92-V105 HydrophobicContact CB-CG2 4.16Å; V92-V105 HydrophobicContact CG1-CG1 3.9Å; V92-V105 HydrophobicContact CG1-CG2 3.85Å; V92-I129 HydrophobicContact CG2-CD1 3.64Å; V92-V131 HydrophobicContact CG1-CG2 3.47Å; V92-V131 VanDerWaalsContact CG1-CG2 3.47Å
93	E	94.3	Very high	90.6	Very high	104 Å²	104	52.1 Å²	52.1	49%	0.486	29%	0.289	S	S	.	.	H	α-helix	trans	-59.7	-43.5	177.1	-174.5	173.5	-174.4	0	0	111.6	R89 G90 F95 G97 I103 V105	R89-E93 WeakPolarHBondContact O-CB 3.37Å; R89-E93 PolarHBondContact O-N 2.77Å; G90-E93 PolarHBondContact O-N 2.68Å; E93-F95 PolarHBondContact O-N 3.24Å; E93-G97 WeakPolarHBondContact O-CA 3.44Å; E93-G97 PolarHBondContact O-N 2.92Å; E93-I103 HydrophobicContact CG-CB 4.3Å; E93-I103 HydrophobicContact CG-CD1 4.47Å; E93-I103 HydrophobicContact CG-CG2 4.38Å; E93-I103 VanDerWaalsContact O-CD1 3.29Å; E93-I103 WeakPolarHBondContact O-CD1 3.49Å; E93-V105 HydrophobicContact CB-CG2 4.12Å
94	S	90.8	Very high	91	Very high	47 Å²	47	49 Å²	49	33%	0.329	27%	0.271	S	S	.	.	H	α-helix	trans	-65.1	-38.1	176	-62.1	0	0	0	0	112.3	G90 Q91 V92 G97 Q250	G90-S94 WeakPolarHBondContact O-CB 3.35Å; G90-S94 PolarHBondContact O-N 3.08Å; G90-S94 PolarHBondContact O-OG 2.99Å; Q91-S94 PolarHBondContact O-N 3.34Å; V92-S94 VanDerWaalsContact C-N 3.32Å; V92-S94 PolarHBondContact O-N 2.98Å; S94-G97 PolarHBondContact O-N 2.83Å; S94-Q250 PolarHBondContact OG-OE1 2.83Å
95	F	92.1	Very high	91.3	Very high	101 Å²	101	48.4 Å²	48.4	44%	0.443	27%	0.268	S	S	.	.	H	α-helix	trans	-66.7	-46.3	-179.2	-177.6	-87.9	0	0	0	112.5	Q91 V92 E93 G97 C157 F158	Q91-F95 WeakPolarHBondContact O-CB 3.39Å; Q91-F95 PolarHBondContact O-N 3.12Å; V92-F95 PolarHBondContact O-N 3.05Å; E93-F95 PolarHBondContact O-N 3.24Å; F95-G97 VanDerWaalsContact C-N 3.28Å; F95-C157 HydrophobicContact CB-CB 3.58Å; F95-C157 HydrophobicContact CD1-CB 3.7Å; F95-C157 WeakPolarHBondContact CD1-O 3.13Å; F95-C157 HydrophobicContact CD2-CB 3.62Å; F95-C157 HydrophobicContact CE1-CB 4.29Å; F95-C157 WeakPolarHBondContact CE1-O 3.34Å; F95-C157 HydrophobicContact CE2-CB 4.21Å; F95-C157 HydrophobicContact CG-CB 3.34Å; F95-F158 HydrophobicContact CE2-CD1 4.15Å; F95-F158 HydrophobicContact CE2-CE1 4.36Å; F95-F158 AromaticContact CZ-CD1 3.87Å; F95-F158 HydrophobicContact CZ-CD1 3.87Å; F95-F158 HydrophobicContact CZ-CE1 4.41Å
96	F	91.7	Very high	91.5	Very high	30 Å²	30	46.3 Å²	46.3	13%	0.132	25%	0.253	C	S	.	.	H	α-helix	trans	-84.3	-7.2	177.5	-67.7	-73.8	0	0	0	113.1	V92 I103 V131 L133 V150 A152 C157 A159	V92-F96 HydrophobicContact CG1-CD2 3.79Å; V92-F96 HydrophobicContact CG1-CE2 3.94Å; V92-F96 WeakPolarHBondContact O-CD2 3.5Å; V92-F96 PolarHBondContact O-N 3.32Å; F96-I103 HydrophobicContact CB-CD1 3.91Å; F96-I103 WeakPolarHBondContact O-CD1 3.4Å; F96-V131 HydrophobicContact CD2-CG1 4.33Å; F96-V131 HydrophobicContact CE2-CG2 4.42Å; F96-L133 HydrophobicContact CB-CD2 3.64Å; F96-L133 HydrophobicContact CD1-CD1 4.04Å; F96-L133 HydrophobicContact CD1-CD2 4.39Å; F96-L133 HydrophobicContact CG-CD2 4.06Å; F96-V150 HydrophobicContact CE1-CG1 4.02Å; F96-V150 HydrophobicContact CZ-CG1 3.83Å; F96-A152 HydrophobicContact CE2-CB 3.64Å; F96-A152 HydrophobicContact CZ-CB 3.91Å; F96-C157 WeakPolarHBondContact CE2-O 3.24Å; F96-C157 VanDerWaalsContact CZ-O 3.24Å; F96-C157 WeakPolarHBondContact CZ-O 3.27Å; F96-A159 HydrophobicContact CE1-CB 4.3Å; F96-A159 HydrophobicContact CZ-CB 4.34Å
97	G	88	Confident	91.8	Very high	44 Å²	44	40.3 Å²	40.3	45%	0.454	22%	0.224	S	C	.	.			trans	-50.6	131.9	179.5	0	0	0	0	0	113.2	E93 S94 F95 I103	E93-G97 WeakPolarHBondContact O-CA 3.44Å; E93-G97 PolarHBondContact O-N 2.92Å; S94-G97 PolarHBondContact O-N 2.83Å; F95-G97 VanDerWaalsContact C-N 3.28Å; G97-I103 VanDerWaalsContact CA-CD1 3.42Å; G97-I103 VanDerWaalsContact N-CD1 3.27Å
98	G	83.3	Confident	92.1	Very high	32 Å²	32	36.1 Å²	36.1	33%	0.33	21%	0.207	S	C	.	.			trans	-170.7	164.5	167.8	0	0	0	0	0	113.7	G100 T101	G98-G100 PolarHBondContact O-N 3.21Å; G98-T101 PolarHBondContact O-N 3.01Å
99	L	82.2	Confident	92.4	Very high	82 Å²	82	36.7 Å²	36.7	43%	0.429	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	123.1	-175.3	-172.7	68.7	0	0	0	111.2	T101 P240 Q244	L99-T101 VanDerWaalsContact C-N 3.32Å; L99-P240 HydrophobicContact CD2-CB 4.38Å; L99-P240 HydrophobicContact CD2-CG 4.39Å; L99-Q244 HydrophobicContact CD1-CB 4.48Å
100	G	83.2	Confident	92.6	Very high	20 Å²	20	33.7 Å²	33.7	21%	0.206	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	12.9	178.1	0	0	0	0	0	114.9	G98 K136	G98-G100 PolarHBondContact O-N 3.21Å; G100-K136 PolarHBondContact O-N 3.02Å
101	T	89.8	Confident	92.8	Very high	21 Å²	21	34.4 Å²	34.4	13%	0.129	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	122.6	173.8	-55.9	0	0	0	0	109.1	G98 L99 I103 L133 H134 D135 R142	G98-T101 PolarHBondContact O-N 3.01Å; L99-T101 VanDerWaalsContact C-N 3.32Å; T101-I103 HydrophobicContact CG2-CG1 4.03Å; T101-L133 HydrophobicContact CG2-CB 4.25Å; T101-H134 CarbonylContact C-O 3.58Å; T101-H134 WeakPolarHBondContact CA-O 3.33Å; T101-D135 WeakPolarHBondContact CG2-OD1 3.49Å; T101-D135 PolarHBondContact OG1-OD1 3.43Å; T101-R142 PolarHBondContact OG1-NE 3.3Å; T101-R142 PolarHBondContact OG1-NH2 2.75Å
102	E	92.6	Very high	93.1	Very high	84 Å²	84	33.3 Å²	33.3	39%	0.393	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	141	166.2	-70.4	173.2	165.6	0	0	108.8	H134 K136	E102-H134 HydrophobicContact CB-CB 4.16Å; E102-H134 PolarHBondContact N-O 2.7Å; E102-H134 PolarHBondContact O-N 3.39Å; E102-H134 IonicContact OE2-CE1 3.44Å; E102-H134 IonicContact OE2-CG 3.35Å; E102-H134 IonicContact OE2-ND1 2.74Å; E102-H134 PolarHBondContact OE2-ND1 3.42Å; E102-K136 WeakPolarHBondContact OE1-CE 3.4Å; E102-K136 IonicContact OE1-NZ 2.64Å; E102-K136 PolarHBondContact OE1-NZ 3.4Å
103	I	95.3	Very high	93.2	Very high	30 Å²	30	36 Å²	36	15%	0.154	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136.4	-173	-57.5	170.9	0	0	0	108.5	E93 F96 G97 T101 V105 V131 I132 L133	E93-I103 HydrophobicContact CG-CB 4.3Å; E93-I103 HydrophobicContact CG-CD1 4.47Å; E93-I103 HydrophobicContact CG-CG2 4.38Å; E93-I103 VanDerWaalsContact O-CD1 3.29Å; E93-I103 WeakPolarHBondContact O-CD1 3.49Å; F96-I103 HydrophobicContact CB-CD1 3.91Å; F96-I103 WeakPolarHBondContact O-CD1 3.4Å; G97-I103 VanDerWaalsContact CA-CD1 3.42Å; G97-I103 VanDerWaalsContact N-CD1 3.27Å; T101-I103 HydrophobicContact CG2-CG1 4.03Å; I103-V105 HydrophobicContact CG2-CG2 3.95Å; I103-V131 HydrophobicContact CG2-CG1 3.74Å; I103-I132 WeakPolarHBondContact CA-O 3.32Å; I103-L133 HydrophobicContact CG1-CD2 3.97Å; I103-L133 HydrophobicContact CG2-CD2 4.11Å
104	F	97.7	Very high	93.4	Very high	31 Å²	31	32.4 Å²	32.4	14%	0.136	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.2	166	171	-89.6	0	0	0	108.8	V131 I132 E203 L204 H207	F104-V131 CarbonylContact O-C 3.53Å; F104-V131 WeakPolarHBondContact O-CA 3.29Å; F104-I132 HydrophobicContact CB-CB 4.24Å; F104-I132 HydrophobicContact CD1-CG1 4.28Å; F104-I132 PolarHBondContact N-O 3.19Å; F104-I132 PolarHBondContact O-N 2.92Å; F104-E203 HydrophobicContact CZ-CB 3.87Å; F104-L204 HydrophobicContact CD1-CD1 3.82Å; F104-L204 HydrophobicContact CE1-CB 4.15Å; F104-L204 HydrophobicContact CE1-CD1 3.65Å; F104-L204 HydrophobicContact CE1-CG 4.47Å; F104-H207 VanDerWaalsContact CB-CE1 3.49Å; F104-H207 WeakPolarHBondContact CB-CE1 3.45Å; F104-H207 HydrophobicContact CD1-CB 4.17Å; F104-H207 HydrophobicContact CD2-CB 4.42Å; F104-H207 AromaticContact CD2-ND1 3.51Å; F104-H207 HydrophobicContact CE1-CB 4.45Å; F104-H207 HydrophobicContact CG-CB 4.16Å; F104-H207 AromaticContact CG-CG 3.7Å; F104-H207 AromaticContact CG-ND1 3.56Å
105	V	98.1	Very high	93.5	Very high	5 Å²	5	30.7 Å²	30.7	3%	0.03	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	128.8	177.3	-172.8	0	0	0	0	108.5	R89 V92 E93 I103 I129 V131	R89-V105 HydrophobicContact CB-CG1 4.45Å; R89-V105 HydrophobicContact CG-CG1 4.33Å; R89-V105 VanDerWaalsContact CZ-O 3.32Å; R89-V105 PolarHBondContact NH2-O 2.88Å; V92-V105 HydrophobicContact CB-CG1 4.05Å; V92-V105 HydrophobicContact CB-CG2 4.16Å; V92-V105 HydrophobicContact CG1-CG1 3.9Å; V92-V105 HydrophobicContact CG1-CG2 3.85Å; E93-V105 HydrophobicContact CB-CG2 4.12Å; I103-V105 HydrophobicContact CG2-CG2 3.95Å; V105-I129 HydrophobicContact CG1-CG2 3.64Å; V105-V131 HydrophobicContact CG1-CG2 4.45Å; V105-V131 HydrophobicContact CG2-CG1 4.41Å
106	S	97.5	Very high	93.5	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.182	C	C	.	.			trans	-59.3	149.4	173.4	175.7	0	0	0	0	111.5	L84 A108 P130	L84-S106 WeakPolarHBondContact CD1-O 3.34Å; S106-A108 VanDerWaalsContact C-N 3.31Å; S106-A108 PolarHBondContact OG-N 3.37Å; S106-A108 PolarHBondContact OG-O 3.19Å; S106-P130 WeakPolarHBondContact CB-O 3.03Å; S106-P130 PolarHBondContact N-O 2.9Å
107	G	96.3	Very high	93	Very high	13 Å²	13	30 Å²	30	13%	0.134	19%	0.19	C	C	.	.	S	Bend	trans	-81.1	-6.6	174.7	0	0	0	0	0	114.9	N83 L84	N83-G107 WeakPolarHBondContact CA-O 2.95Å; L84-G107 PolarHBondContact N-O 2.92Å
108	A	96.6	Very high	93	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-144	164.9	178.5	0	0	0	0	0	112	T82 S106 P130 A200	T82-A108 WeakPolarHBondContact O-CA 3.39Å; T82-A108 WeakPolarHBondContact O-CB 3.48Å; S106-A108 VanDerWaalsContact C-N 3.31Å; S106-A108 PolarHBondContact OG-N 3.37Å; S106-A108 PolarHBondContact OG-O 3.19Å; A108-P130 WeakPolarHBondContact O-CD 3.32Å; A108-A200 HydrophobicContact CB-CB 3.77Å
109	L	97.1	Very high	92.9	Very high	22 Å²	22	39.4 Å²	39.4	12%	0.115	22%	0.223	C	C	.	.			trans	-68.4	160	170.9	-61.7	176.7	0	0	0	111.8	T82 G128 I129 R154 D196	T82-L109 PolarHBondContact O-N 3.35Å; L109-G128 CarbonylContact C-O 3.59Å; L109-G128 VanDerWaalsContact CA-O 3.32Å; L109-G128 WeakPolarHBondContact CA-O 3.3Å; L109-I129 HydrophobicContact CD2-CG1 3.64Å; L109-R154 HydrophobicContact CD2-CB 4.38Å; L109-D196 PolarHBondContact O-N 2.83Å
110	A	97.8	Very high	93.1	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	149.2	167.8	0	0	0	0	0	111.5	T127 G128 P130 S194 F195	A110-T127 WeakPolarHBondContact O-CA 3.46Å; A110-G128 PolarHBondContact N-O 2.95Å; A110-G128 PolarHBondContact O-N 2.84Å; A110-P130 HydrophobicContact CB-CG 3.49Å; A110-P130 VanDerWaalsContact CB-CG 3.49Å; A110-S194 CarbonylContact C-O 3.56Å; A110-S194 WeakPolarHBondContact CA-O 3.32Å; A110-S194 WeakPolarHBondContact CB-O 3.45Å; A110-F195 HydrophobicContact CB-CD1 3.92Å; A110-F195 HydrophobicContact CB-CE1 4.2Å; A110-F195 HydrophobicContact CB-CG 4.17Å
111	N	97.9	Very high	93.5	Very high	32 Å²	32	40.8 Å²	40.8	17%	0.171	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	128.5	167.3	-67.2	-29.1	0	0	0	109.4	Y113 L124 F126 T127 F193 S194	N111-Y113 HydrophobicContact CB-CD2 4.26Å; N111-Y113 HydrophobicContact CB-CE2 3.43Å; N111-Y113 VanDerWaalsContact CB-CE2 3.43Å; N111-L124 HydrophobicContact CB-CD1 3.7Å; N111-F126 WeakPolarHBondContact CA-O 3.34Å; N111-T127 WeakPolarHBondContact OD1-CB 3.49Å; N111-T127 WeakPolarHBondContact OD1-CG2 3.28Å; N111-T127 PolarHBondContact OD1-OG1 3.5Å; N111-F193 CarbonylContact O-C 3.53Å; N111-F193 WeakPolarHBondContact O-CA 3.45Å; N111-S194 PolarHBondContact N-O 2.73Å; N111-S194 PolarHBondContact O-N 3.17Å
112	L	98.1	Very high	93.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	123.9	173.1	-178.9	140.8	0	0	0	109.9	E114 V125 F126 L151 W161 I191 G192 F193	L112-E114 HydrophobicContact CD2-CG 4.43Å; L112-V125 HydrophobicContact CD2-CB 3.71Å; L112-V125 HydrophobicContact CD2-CG1 4.38Å; L112-V125 HydrophobicContact CD2-CG2 3.93Å; L112-V125 PolarHBondContact O-N 3.18Å; L112-F126 PolarHBondContact N-O 2.81Å; L112-F126 PolarHBondContact O-N 3.08Å; L112-L151 HydrophobicContact CB-CD2 3.73Å; L112-L151 HydrophobicContact CD1-CD2 4.47Å; L112-W161 HydrophobicContact CD1-CB 4.03Å; L112-W161 HydrophobicContact CD1-CD2 3.38Å; L112-W161 HydrophobicContact CD1-CE3 3.64Å; L112-W161 HydrophobicContact CD1-CG 3.59Å; L112-W161 HydrophobicContact CD1-CZ2 4.35Å; L112-W161 HydrophobicContact CD1-CZ3 4.25Å; L112-W161 HydrophobicContact CD2-CG 4.39Å; L112-I191 HydrophobicContact CD1-CG2 3.87Å; L112-I191 HydrophobicContact CG-CG2 4Å; L112-G192 CarbonylContact C-O 3.57Å; L112-G192 WeakPolarHBondContact CA-O 3.39Å; L112-F193 HydrophobicContact CB-CE1 4.46Å; L112-F193 HydrophobicContact CD1-CD1 4.49Å; L112-F193 HydrophobicContact CD1-CE1 3.64Å; L112-F193 HydrophobicContact CD1-CE2 4.48Å; L112-F193 HydrophobicContact CD1-CZ 3.62Å; L112-F193 HydrophobicContact CG-CE1 4.42Å
113	Y	97.6	Very high	93.9	Very high	58 Å²	58	45.7 Å²	45.7	23%	0.227	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	145.3	176.3	-60.7	-95.5	0	0	0	110.5	N111 W122 R123 L124 F178 I191 G192	N111-Y113 HydrophobicContact CB-CD2 4.26Å; N111-Y113 HydrophobicContact CB-CE2 3.43Å; N111-Y113 VanDerWaalsContact CB-CE2 3.43Å; Y113-W122 HydrophobicContact CD1-CB 4.22Å; Y113-R123 CarbonylContact C-O 3.58Å; Y113-R123 WeakPolarHBondContact CA-O 3.12Å; Y113-L124 HydrophobicContact CD1-CB 4.01Å; Y113-L124 HydrophobicContact CD1-CD1 4.42Å; Y113-L124 HydrophobicContact CE1-CB 3.72Å; Y113-L124 HydrophobicContact CE1-CD1 3.98Å; Y113-L124 HydrophobicContact CE1-CG 4.43Å; Y113-L124 HydrophobicContact CE2-CD1 4.35Å; Y113-F178 HydrophobicContact CD2-CE2 4.35Å; Y113-I191 CarbonylContact O-C 3.5Å; Y113-I191 WeakPolarHBondContact O-CA 3.4Å; Y113-G192 PolarHBondContact N-O 3.43Å; Y113-G192 PolarHBondContact O-N 2.98Å
114	E	96.8	Very high	93.9	Very high	28 Å²	28	48.1 Å²	48.1	13%	0.131	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	138.8	168.1	-74.1	-177.5	149.6	0	0	109.6	L112 R123 V125 R183 Q189 I191	L112-E114 HydrophobicContact CD2-CG 4.43Å; E114-R123 PolarHBondContact N-O 2.94Å; E114-R123 PolarHBondContact O-N 2.93Å; E114-R123 IonicContact OE2-CZ 3.89Å; E114-R123 IonicContact OE2-NH2 2.91Å; E114-R123 PolarHBondContact OE2-NH2 3.12Å; E114-V125 HydrophobicContact CB-CG2 3.97Å; E114-V125 HydrophobicContact CG-CG2 3.63Å; E114-R183 IonicContact OE1-NH1 2.72Å; E114-Q189 PolarHBondContact OE1-NE2 3.38Å; E114-I191 HydrophobicContact CG-CD1 3.77Å
115	G	94.9	Very high	93.8	Very high	11 Å²	11	48.4 Å²	48.4	11%	0.113	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	-173.1	177.3	0	0	0	0	0	111.8	M190	G115-M190 PolarHBondContact N-O 3.06Å; G115-M190 PolarHBondContact O-N 3.02Å
116	T	91.9	Very high	93.7	Very high	87 Å²	87	50.9 Å²	50.9	53%	0.534	29%	0.285	S	S	.	.			trans	-104.1	-3.3	169.5	70	0	0	0	0	112.1	N118 D121	T116-N118 PolarHBondContact OG1-ND2 3.41Å; T116-D121 VanDerWaalsContact CA-OD2 3.28Å; T116-D121 WeakPolarHBondContact CA-OD2 3.34Å; T116-D121 VanDerWaalsContact CB-OD2 3.3Å; T116-D121 WeakPolarHBondContact CB-OD2 3.15Å; T116-D121 VanDerWaalsContact N-CG 3.35Å; T116-D121 PolarHBondContact N-OD1 2.96Å; T116-D121 PolarHBondContact N-OD2 3.24Å; T116-D121 PolarHBondContact OG1-OD2 2.97Å
117	G	80.5	Confident	93.6	Very high	30 Å²	30	52.5 Å²	52.5	31%	0.309	30%	0.295	S	S	.	.	S	Bend	trans	95.9	8.3	179.8	0	0	0	0	0	114.6	D121	G117-D121 PolarHBondContact N-OD2 3.38Å
118	N	87	Confident	93.6	Very high	106 Å²	106	51.9 Å²	51.9	57%	0.567	29%	0.289	S	S	*	.	S	Bend	trans	-90.2	148.6	173.2	-63.8	-54.1	0	0	0	110	T116 G120 D121	T116-N118 PolarHBondContact OG1-ND2 3.41Å; N118-G120 PolarHBondContact O-N 3.39Å; N118-D121 PolarHBondContact N-OD2 2.82Å; N118-D121 PolarHBondContact O-N 3.32Å
119	D	82.4	Confident	93.7	Very high	168 Å²	168	52 Å²	52	90%	0.898	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	127.7	176	-70.2	-23.4	0	0	0	110.5
120	G	85.4	Confident	93.7	Very high	82 Å²	82	50.9 Å²	50.9	85%	0.845	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	3.2	178.7	0	0	0	0	0	116.1	N118	N118-G120 PolarHBondContact O-N 3.39Å
121	D	92.8	Very high	93.8	Very high	49 Å²	49	50.9 Å²	50.9	26%	0.262	28%	0.284	S	S	.	.			trans	-99.5	2.6	178	78.5	3	0	0	0	114.9	T116 G117 N118 R123	T116-D121 VanDerWaalsContact CA-OD2 3.28Å; T116-D121 WeakPolarHBondContact CA-OD2 3.34Å; T116-D121 VanDerWaalsContact CB-OD2 3.3Å; T116-D121 WeakPolarHBondContact CB-OD2 3.15Å; T116-D121 VanDerWaalsContact N-CG 3.35Å; T116-D121 PolarHBondContact N-OD1 2.96Å; T116-D121 PolarHBondContact N-OD2 3.24Å; T116-D121 PolarHBondContact OG1-OD2 2.97Å; G117-D121 PolarHBondContact N-OD2 3.38Å; N118-D121 PolarHBondContact N-OD2 2.82Å; N118-D121 PolarHBondContact O-N 3.32Å; D121-R123 PolarHBondContact O-N 2.9Å
122	W	95.3	Very high	93.8	Very high	70 Å²	70	49.4 Å²	49.4	27%	0.265	28%	0.276	S	S	.	.			trans	-76.1	118.4	-178.4	-65.1	104.6	0	0	0	111.7	Y113 F178 T180 M190	Y113-W122 HydrophobicContact CD1-CB 4.22Å; W122-F178 HydrophobicContact CZ2-CE1 4.47Å; W122-F178 HydrophobicContact CZ2-CZ 4.37Å; W122-T180 HydrophobicContact CH2-CG2 4.06Å; W122-T180 HydrophobicContact CZ2-CG2 4.33Å; W122-M190 HydrophobicContact CH2-CB 3.8Å; W122-M190 HydrophobicContact CH2-CE 4.08Å; W122-M190 HydrophobicContact CZ2-CE 4.08Å; W122-M190 HydrophobicContact CZ3-CB 4.17Å
123	R	95.6	Very high	93.7	Very high	138 Å²	138	50.4 Å²	50.4	52%	0.521	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.7	173	178.1	-177.2	64.9	-147.7	-0	110.1	Y113 E114 D121 V125	Y113-R123 CarbonylContact C-O 3.58Å; Y113-R123 WeakPolarHBondContact CA-O 3.12Å; E114-R123 PolarHBondContact N-O 2.94Å; E114-R123 PolarHBondContact O-N 2.93Å; E114-R123 IonicContact OE2-CZ 3.89Å; E114-R123 IonicContact OE2-NH2 2.91Å; E114-R123 PolarHBondContact OE2-NH2 3.12Å; D121-R123 PolarHBondContact O-N 2.9Å; R123-V125 PolarHBondContact O-N 3.25Å
124	L	95	Very high	93.5	Very high	81 Å²	81	48.5 Å²	48.5	42%	0.424	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	129	169.7	178.7	64.9	0	0	0	109.5	N111 Y113	N111-L124 HydrophobicContact CB-CD1 3.7Å; Y113-L124 HydrophobicContact CD1-CB 4.01Å; Y113-L124 HydrophobicContact CD1-CD1 4.42Å; Y113-L124 HydrophobicContact CE1-CB 3.72Å; Y113-L124 HydrophobicContact CE1-CD1 3.98Å; Y113-L124 HydrophobicContact CE1-CG 4.43Å; Y113-L124 HydrophobicContact CE2-CD1 4.35Å
125	V	95.5	Very high	93.2	Very high	36 Å²	36	47.6 Å²	47.6	22%	0.218	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-54	177.9	-169.4	0	0	0	0	110.5	L112 E114 R123	L112-V125 HydrophobicContact CD2-CB 3.71Å; L112-V125 HydrophobicContact CD2-CG1 4.38Å; L112-V125 HydrophobicContact CD2-CG2 3.93Å; L112-V125 PolarHBondContact O-N 3.18Å; E114-V125 HydrophobicContact CB-CG2 3.97Å; E114-V125 HydrophobicContact CG-CG2 3.63Å; R123-V125 PolarHBondContact O-N 3.25Å
126	F	95.9	Very high	92.7	Very high	58 Å²	58	51.7 Å²	51.7	25%	0.254	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	156.6	-174.7	-62.3	-56.7	0	0	0	111.6	N111 L112 L151 L160 W161 Y266	N111-F126 WeakPolarHBondContact CA-O 3.34Å; L112-F126 PolarHBondContact N-O 2.81Å; L112-F126 PolarHBondContact O-N 3.08Å; F126-L151 HydrophobicContact CB-CD2 3.58Å; F126-L160 HydrophobicContact CB-CB 4.28Å; F126-L160 HydrophobicContact CB-CD1 4.14Å; F126-L160 HydrophobicContact CD1-CB 4.34Å; F126-L160 HydrophobicContact CD2-CB 4.02Å; F126-L160 HydrophobicContact CE2-CB 4.46Å; F126-L160 VanDerWaalsContact CE2-O 3.24Å; F126-L160 WeakPolarHBondContact CE2-O 3.46Å; F126-L160 HydrophobicContact CG-CB 3.97Å; F126-L160 HydrophobicContact CG-CD1 4.45Å; F126-W161 HydrophobicContact CD2-CB 4.12Å; F126-W161 HydrophobicContact CE2-CB 4.43Å; F126-Y266 HydrophobicContact CD1-CD1 4.25Å
127	T	95.6	Very high	92.1	Very high	33 Å²	33	48.5 Å²	48.5	20%	0.202	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	131.1	166.3	-55.9	0	0	0	0	108.1	A110 N111 L160	A110-T127 WeakPolarHBondContact O-CA 3.46Å; N111-T127 WeakPolarHBondContact OD1-CB 3.49Å; N111-T127 WeakPolarHBondContact OD1-CG2 3.28Å; N111-T127 PolarHBondContact OD1-OG1 3.5Å; T127-L160 WeakPolarHBondContact O-CD1 3.16Å
128	G	96.3	Very high	91.9	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.01	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.1	-169.3	-177.5	0	0	0	0	0	113.3	L109 A110 P130 A152	L109-G128 CarbonylContact C-O 3.59Å; L109-G128 VanDerWaalsContact CA-O 3.32Å; L109-G128 WeakPolarHBondContact CA-O 3.3Å; A110-G128 PolarHBondContact N-O 2.95Å; A110-G128 PolarHBondContact O-N 2.84Å; G128-P130 WeakPolarHBondContact O-CD 3.41Å; G128-A152 CarbonylContact C-O 3.58Å; G128-A152 WeakPolarHBondContact CA-O 3.44Å
129	I	97.9	Very high	91	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	116.2	-177.8	-54.6	171.1	0	0	0	108.5	L84 V92 V105 L109 V131 A152 R154	L84-I129 HydrophobicContact CD1-CB 4.26Å; L84-I129 HydrophobicContact CD1-CD1 4.19Å; L84-I129 HydrophobicContact CD1-CG1 3.87Å; L84-I129 HydrophobicContact CD1-CG2 3.57Å; L84-I129 HydrophobicContact CD2-CD1 3.47Å; L84-I129 VanDerWaalsContact CD2-CD1 3.47Å; L84-I129 HydrophobicContact CD2-CG1 3.88Å; L84-I129 HydrophobicContact CG-CD1 4.48Å; L84-I129 HydrophobicContact CG-CG1 4.48Å; V92-I129 HydrophobicContact CG2-CD1 3.64Å; V105-I129 HydrophobicContact CG1-CG2 3.64Å; L109-I129 HydrophobicContact CD2-CG1 3.64Å; I129-V131 HydrophobicContact CG2-CG2 4.24Å; I129-V131 PolarHBondContact O-N 3.01Å; I129-A152 HydrophobicContact CB-CB 4.44Å; I129-A152 PolarHBondContact N-O 2.67Å; I129-A152 PolarHBondContact O-N 2.91Å; I129-R154 HydrophobicContact CD1-CB 4.14Å; I129-R154 HydrophobicContact CD1-CG 4.24Å; I129-R154 HydrophobicContact CG1-CB 4.39Å
130	P	98.3	Very high	90.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	131.7	171.7	-22.5	34.9	0	0	0	111.5	S106 A108 A110 G128 L149 V150 L151 F195 L204	S106-P130 WeakPolarHBondContact CB-O 3.03Å; S106-P130 PolarHBondContact N-O 2.9Å; A108-P130 WeakPolarHBondContact O-CD 3.32Å; A110-P130 HydrophobicContact CB-CG 3.49Å; A110-P130 VanDerWaalsContact CB-CG 3.49Å; G128-P130 WeakPolarHBondContact O-CD 3.41Å; P130-L149 HydrophobicContact CB-CD1 4.47Å; P130-V150 CarbonylContact C-O 3.55Å; P130-V150 WeakPolarHBondContact CA-O 3.34Å; P130-L151 HydrophobicContact CG-CD1 4.11Å; P130-F195 HydrophobicContact CB-CE1 4.12Å; P130-F195 HydrophobicContact CG-CD1 4.2Å; P130-F195 HydrophobicContact CG-CE1 3.68Å; P130-F195 HydrophobicContact CG-CZ 4.5Å; P130-L204 HydrophobicContact CB-CD1 4.28Å; P130-L204 HydrophobicContact CB-CD2 4.25Å
131	V	98.5	Very high	89.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	130	-179.4	-173.6	0	0	0	0	109.5	V92 F96 I103 F104 V105 I129 L133 V150 A152	V92-V131 HydrophobicContact CG1-CG2 3.47Å; V92-V131 VanDerWaalsContact CG1-CG2 3.47Å; F96-V131 HydrophobicContact CD2-CG1 4.33Å; F96-V131 HydrophobicContact CE2-CG2 4.42Å; I103-V131 HydrophobicContact CG2-CG1 3.74Å; F104-V131 CarbonylContact O-C 3.53Å; F104-V131 WeakPolarHBondContact O-CA 3.29Å; V105-V131 HydrophobicContact CG1-CG2 4.45Å; V105-V131 HydrophobicContact CG2-CG1 4.41Å; I129-V131 HydrophobicContact CG2-CG2 4.24Å; I129-V131 PolarHBondContact O-N 3.01Å; V131-L133 HydrophobicContact CG1-CD2 3.71Å; V131-L133 HydrophobicContact CG1-CG 4.48Å; V131-V150 HydrophobicContact CB-CB 4.3Å; V131-V150 PolarHBondContact N-O 3.41Å; V131-V150 PolarHBondContact O-N 2.86Å; V131-A152 HydrophobicContact CG2-CB 4.17Å
132	I	98	Very high	88.5	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126	169.5	-57.1	-66	0	0	0	108.8	I103 F104 V147 T148 L149 I165 L204 V208 L211	I103-I132 WeakPolarHBondContact CA-O 3.32Å; F104-I132 HydrophobicContact CB-CB 4.24Å; F104-I132 HydrophobicContact CD1-CG1 4.28Å; F104-I132 PolarHBondContact N-O 3.19Å; F104-I132 PolarHBondContact O-N 2.92Å; I132-V147 HydrophobicContact CG2-CG1 3.81Å; I132-T148 WeakPolarHBondContact CA-O 3.38Å; I132-L149 HydrophobicContact CD1-CB 4.15Å; I132-L149 HydrophobicContact CD1-CD1 3.53Å; I132-L149 HydrophobicContact CD1-CG 4.35Å; I132-I165 HydrophobicContact CD1-CD1 4.28Å; I132-L204 HydrophobicContact CD1-CD1 4Å; I132-L204 HydrophobicContact CG1-CD1 3.58Å; I132-L204 HydrophobicContact CG1-CG 4.4Å; I132-V208 HydrophobicContact CD1-CG2 3.62Å; I132-V208 HydrophobicContact CG1-CG2 4.25Å; I132-L211 HydrophobicContact CG2-CD1 3.72Å
133	L	95.8	Very high	87.4	Confident	22 Å²	22	51.7 Å²	51.7	12%	0.115	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119.6	171.4	-49.8	-179.3	0	0	0	108.7	F96 T101 I103 V131 V147 T148 V150	F96-L133 HydrophobicContact CB-CD2 3.64Å; F96-L133 HydrophobicContact CD1-CD1 4.04Å; F96-L133 HydrophobicContact CD1-CD2 4.39Å; F96-L133 HydrophobicContact CG-CD2 4.06Å; T101-L133 HydrophobicContact CG2-CB 4.25Å; I103-L133 HydrophobicContact CG1-CD2 3.97Å; I103-L133 HydrophobicContact CG2-CD2 4.11Å; V131-L133 HydrophobicContact CG1-CD2 3.71Å; V131-L133 HydrophobicContact CG1-CG 4.48Å; L133-V147 CarbonylContact O-C 3.38Å; L133-V147 WeakPolarHBondContact O-CA 3.32Å; L133-T148 PolarHBondContact N-O 3.3Å; L133-T148 PolarHBondContact O-N 3.15Å; L133-V150 HydrophobicContact CD1-CG2 3.69Å; L133-V150 HydrophobicContact CG-CG2 4.09Å
134	H	93.8	Very high	86.6	Confident	18 Å²	18	50.5 Å²	50.5	8%	0.083	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	100.8	175	175	-139.1	0	0	0	109.9	T101 E102 R146 L211	T101-H134 CarbonylContact C-O 3.58Å; T101-H134 WeakPolarHBondContact CA-O 3.33Å; E102-H134 HydrophobicContact CB-CB 4.16Å; E102-H134 PolarHBondContact N-O 2.7Å; E102-H134 PolarHBondContact O-N 3.39Å; E102-H134 IonicContact OE2-CE1 3.44Å; E102-H134 IonicContact OE2-CG 3.35Å; E102-H134 IonicContact OE2-ND1 2.74Å; E102-H134 PolarHBondContact OE2-ND1 3.42Å; H134-R146 WeakPolarHBondContact CA-O 3.39Å; H134-L211 HydrophobicContact CB-CD1 3.98Å; H134-L211 HydrophobicContact CB-CD2 4.25Å
135	D	90.8	Very high	86.2	Confident	9 Å²	9	48.5 Å²	48.5	5%	0.048	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	125.9	174.5	-66.3	-35.7	0	0	0	110.1	T101 G137 R142 P145 R146	T101-D135 WeakPolarHBondContact CG2-OD1 3.49Å; T101-D135 PolarHBondContact OG1-OD1 3.43Å; D135-G137 VanDerWaalsContact C-N 3.31Å; D135-G137 PolarHBondContact O-N 3.39Å; D135-R142 HydrophobicContact CB-CB 4.45Å; D135-R142 WeakPolarHBondContact OD1-CD 3.49Å; D135-R142 IonicContact OD1-NE 3.83Å; D135-R142 PolarHBondContact OD1-NE 2.68Å; D135-R142 VanDerWaalsContact OD2-CD 3.3Å; D135-R142 WeakPolarHBondContact OD2-CD 3.45Å; D135-P145 CarbonylContact O-C 3.56Å; D135-P145 WeakPolarHBondContact O-CA 3.48Å; D135-R146 HydrophobicContact CB-CG 3.78Å; D135-R146 PolarHBondContact N-O 3.13Å; D135-R146 PolarHBondContact O-N 2.86Å; D135-R146 VanDerWaalsContact OD2-CG 3.27Å; D135-R146 WeakPolarHBondContact OD2-CG 3.16Å; D135-R146 IonicContact OD2-CZ 2.7Å; D135-R146 IonicContact OD2-NE 3.34Å; D135-R146 PolarHBondContact OD2-NE 2.86Å
136	K	84.7	Confident	85.9	Confident	97 Å²	97	51.2 Å²	51.2	42%	0.422	27%	0.274	S	S	.	.			trans	-80.9	-2.4	-179.7	-64.6	-173.1	179.9	-178.1	0	114.9	G100 E102 N138	G100-K136 PolarHBondContact O-N 3.02Å; E102-K136 WeakPolarHBondContact OE1-CE 3.4Å; E102-K136 IonicContact OE1-NZ 2.64Å; E102-K136 PolarHBondContact OE1-NZ 3.4Å; K136-N138 PolarHBondContact O-N 2.84Å
137	G	78.6	Confident	85.8	Confident	19 Å²	19	48.5 Å²	48.5	20%	0.196	26%	0.262	C	S	.	.	S	Bend	trans	74.3	7.3	179.2	0	0	0	0	0	115.6	D135 R142 A143	D135-G137 VanDerWaalsContact C-N 3.31Å; D135-G137 PolarHBondContact O-N 3.39Å; G137-R142 CarbonylContact C-O 3.54Å; G137-R142 WeakPolarHBondContact CA-O 3.34Å; G137-A143 CarbonylContact O-C 3.14Å; G137-A143 WeakPolarHBondContact O-CA 3.48Å
138	N	75.8	Confident	85.8	Confident	112 Å²	112	47.8 Å²	47.8	60%	0.599	26%	0.258	S	S	*	.			trans	-97	-1.3	-171.3	65.2	5.9	0	0	0	114.3	K136	K136-N138 PolarHBondContact O-N 2.84Å
139	S	70	Confident	85.9	Confident	22 Å²	22	47.8 Å²	47.8	15%	0.154	26%	0.258	C	S	.	.	S	Bend	trans	-105.4	154.3	178.3	80.7	0	0	0	0	111.5	A141 R142 A143	S139-A141 VanDerWaalsContact C-N 3.28Å; S139-A141 PolarHBondContact O-N 3.07Å; S139-R142 CarbonylContact O-C 3.6Å; S139-R142 PolarHBondContact O-N 3.35Å; S139-R142 WeakPolarHBondContact OG-CB 3.48Å; S139-R142 PolarHBondContact OG-N 3.34Å; S139-R142 VanDerWaalsContact OG-N 3.07Å; S139-A143 WeakPolarHBondContact O-CA 3.4Å; S139-A143 PolarHBondContact O-N 2.9Å; S139-A143 VanDerWaalsContact O-N 3.11Å
140	K	69.8	Low	85.9	Confident	212 Å²	212	47.9 Å²	47.9	92%	0.922	26%	0.258	S	S	*	.	S	Bend	trans	-61.2	-37.3	178.7	-172.5	-178.1	176.9	-172.9	0	112.4
141	A	66.2	Low	85.9	Confident	91 Å²	91	47.9 Å²	47.9	75%	0.752	26%	0.258	S	S	*	.	S	Bend	trans	-76.7	-26.1	179.4	0	0	0	0	0	112.7	S139	S139-A141 VanDerWaalsContact C-N 3.28Å; S139-A141 PolarHBondContact O-N 3.07Å
142	R	71.9	Confident	85.9	Confident	69 Å²	69	47.9 Å²	47.9	26%	0.26	26%	0.258	S	S	.	.			trans	-133.4	70.9	-178.6	-58.1	-171.7	-84.3	-106	8.5	109	T101 D135 G137 S139 I144	T101-R142 PolarHBondContact OG1-NE 3.3Å; T101-R142 PolarHBondContact OG1-NH2 2.75Å; D135-R142 HydrophobicContact CB-CB 4.45Å; D135-R142 WeakPolarHBondContact OD1-CD 3.49Å; D135-R142 IonicContact OD1-NE 3.83Å; D135-R142 PolarHBondContact OD1-NE 2.68Å; D135-R142 VanDerWaalsContact OD2-CD 3.3Å; D135-R142 WeakPolarHBondContact OD2-CD 3.45Å; G137-R142 CarbonylContact C-O 3.54Å; G137-R142 WeakPolarHBondContact CA-O 3.34Å; S139-R142 CarbonylContact O-C 3.6Å; S139-R142 PolarHBondContact O-N 3.35Å; S139-R142 WeakPolarHBondContact OG-CB 3.48Å; S139-R142 PolarHBondContact OG-N 3.34Å; S139-R142 VanDerWaalsContact OG-N 3.07Å; R142-I144 VanDerWaalsContact C-N 3.31Å
143	A	71.4	Confident	85.7	Confident	67 Å²	67	48 Å²	48	55%	0.554	26%	0.259	S	S	*	.			trans	-83.4	-8.4	-174.7	0	0	0	0	0	113.6	G137 S139	G137-A143 CarbonylContact O-C 3.14Å; G137-A143 WeakPolarHBondContact O-CA 3.48Å; S139-A143 WeakPolarHBondContact O-CA 3.4Å; S139-A143 PolarHBondContact O-N 2.9Å; S139-A143 VanDerWaalsContact O-N 3.11Å
144	I	79.8	Confident	85.6	Confident	112 Å²	112	48.6 Å²	48.6	57%	0.574	26%	0.26	S	S	*	.	S	Bend	trans	-112.7	122.7	179.3	-54.1	177	0	0	0	106.1	R142	R142-I144 VanDerWaalsContact C-N 3.31Å
145	P	85.5	Confident	85.3	Confident	39 Å²	39	48.6 Å²	48.6	25%	0.253	27%	0.265	S	S	.	.			trans	-55	143.2	171.4	-22.1	32.2	0	0	0	110.1	D135 L220	D135-P145 CarbonylContact O-C 3.56Å; D135-P145 WeakPolarHBondContact O-CA 3.48Å; P145-L220 HydrophobicContact CB-CD2 3.96Å; P145-L220 WeakPolarHBondContact O-CD2 3.24Å
146	R	90.1	Very high	85.2	Confident	94 Å²	94	49.5 Å²	49.5	36%	0.355	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	147.4	174.5	56.5	177.8	153.2	-148.6	-13.1	112.6	H134 D135 L220	H134-R146 WeakPolarHBondContact CA-O 3.39Å; D135-R146 HydrophobicContact CB-CG 3.78Å; D135-R146 PolarHBondContact N-O 3.13Å; D135-R146 PolarHBondContact O-N 2.86Å; D135-R146 VanDerWaalsContact OD2-CG 3.27Å; D135-R146 WeakPolarHBondContact OD2-CG 3.16Å; D135-R146 IonicContact OD2-CZ 2.7Å; D135-R146 IonicContact OD2-NE 3.34Å; D135-R146 PolarHBondContact OD2-NE 2.86Å; R146-L220 HydrophobicContact CB-CD2 4.36Å
147	V	93.6	Very high	85.6	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.5	166.2	-175.7	0	0	0	0	107.4	I132 L133 I165 L211 L220	I132-V147 HydrophobicContact CG2-CG1 3.81Å; L133-V147 CarbonylContact O-C 3.38Å; L133-V147 WeakPolarHBondContact O-CA 3.32Å; V147-I165 HydrophobicContact CB-CB 4.33Å; V147-I165 HydrophobicContact CG1-CB 4.23Å; V147-I165 HydrophobicContact CG1-CD1 4.18Å; V147-I165 HydrophobicContact CG1-CG1 4.49Å; V147-I165 PolarHBondContact O-N 2.92Å; V147-L211 HydrophobicContact CG1-CD1 4Å; V147-L211 HydrophobicContact CG2-CB 4.04Å; V147-L211 HydrophobicContact CG2-CD1 4.08Å; V147-L220 HydrophobicContact CG2-CD1 4.23Å
148	T	95.9	Very high	86.3	Confident	19 Å²	19	49.1 Å²	49.1	12%	0.117	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	130	179.1	-48.7	0	0	0	0	108.2	I132 L133 V150 S162 D163	I132-T148 WeakPolarHBondContact CA-O 3.38Å; L133-T148 PolarHBondContact N-O 3.3Å; L133-T148 PolarHBondContact O-N 3.15Å; T148-V150 HydrophobicContact CG2-CG2 4.02Å; T148-S162 WeakPolarHBondContact CG2-OG 3.34Å; T148-D163 WeakPolarHBondContact CA-O 3.49Å; T148-D163 WeakPolarHBondContact CG2-O 3.27Å
149	L	97.9	Very high	87.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	130.1	167.5	178.7	59.2	0	0	0	107.9	P130 I132 W161 S162 D163 I165 Y171 M181 F193 L204	P130-L149 HydrophobicContact CB-CD1 4.47Å; I132-L149 HydrophobicContact CD1-CB 4.15Å; I132-L149 HydrophobicContact CD1-CD1 3.53Å; I132-L149 HydrophobicContact CD1-CG 4.35Å; L149-W161 HydrophobicContact CB-CZ3 4.25Å; L149-W161 HydrophobicContact CD2-CZ3 4.35Å; L149-W161 HydrophobicContact CG-CZ3 4.04Å; L149-W161 WeakPolarHBondContact O-CZ3 3.48Å; L149-S162 VanDerWaalsContact O-CA 3.3Å; L149-S162 WeakPolarHBondContact O-CA 3.36Å; L149-D163 PolarHBondContact N-O 2.74Å; L149-D163 PolarHBondContact O-N 3.26Å; L149-I165 HydrophobicContact CB-CD1 4.12Å; L149-I165 HydrophobicContact CB-CG1 4.27Å; L149-Y171 HydrophobicContact CD2-CE2 3.8Å; L149-M181 HydrophobicContact CD2-SD 3.98Å; L149-F193 HydrophobicContact CD2-CD2 4.2Å; L149-F193 HydrophobicContact CD2-CE1 4.12Å; L149-F193 HydrophobicContact CD2-CE2 3.43Å; L149-F193 VanDerWaalsContact CD2-CE2 3.43Å; L149-F193 HydrophobicContact CD2-CZ 3.38Å; L149-F193 HydrophobicContact CG-CE1 4.49Å; L149-F193 HydrophobicContact CG-CE2 4.48Å; L149-F193 HydrophobicContact CG-CZ 3.97Å; L149-L204 HydrophobicContact CD1-CD2 4.36Å
150	V	98.4	Very high	88.5	Confident	3 Å²	3	46.9 Å²	46.9	2%	0.018	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	141.1	179.3	179.6	0	0	0	0	108.1	F96 P130 V131 L133 T148 A159 W161	F96-V150 HydrophobicContact CE1-CG1 4.02Å; F96-V150 HydrophobicContact CZ-CG1 3.83Å; P130-V150 CarbonylContact C-O 3.55Å; P130-V150 WeakPolarHBondContact CA-O 3.34Å; V131-V150 HydrophobicContact CB-CB 4.3Å; V131-V150 PolarHBondContact N-O 3.41Å; V131-V150 PolarHBondContact O-N 2.86Å; L133-V150 HydrophobicContact CD1-CG2 3.69Å; L133-V150 HydrophobicContact CG-CG2 4.09Å; T148-V150 HydrophobicContact CG2-CG2 4.02Å; V150-A159 HydrophobicContact CG1-CB 3.84Å; V150-W161 CarbonylContact C-O 3.54Å; V150-W161 WeakPolarHBondContact CA-O 3.36Å; V150-W161 WeakPolarHBondContact CG1-O 3.46Å
151	L	98.4	Very high	89.8	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	112	163.3	-165.4	79.6	0	0	0	107.6	L112 F126 P130 L160 W161 F193	L112-L151 HydrophobicContact CB-CD2 3.73Å; L112-L151 HydrophobicContact CD1-CD2 4.47Å; F126-L151 HydrophobicContact CB-CD2 3.58Å; P130-L151 HydrophobicContact CG-CD1 4.11Å; L151-L160 WeakPolarHBondContact O-CB 3.19Å; L151-L160 PolarHBondContact O-N 3.11Å; L151-W161 HydrophobicContact CB-CB 4.2Å; L151-W161 PolarHBondContact N-O 3.32Å; L151-W161 PolarHBondContact O-N 3.34Å; L151-F193 HydrophobicContact CD1-CE1 4.25Å
152	A	97.6	Very high	91.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	144.7	-177.3	0	0	0	0	0	111.8	F96 G128 I129 V131 F158	F96-A152 HydrophobicContact CE2-CB 3.64Å; F96-A152 HydrophobicContact CZ-CB 3.91Å; G128-A152 CarbonylContact C-O 3.58Å; G128-A152 WeakPolarHBondContact CA-O 3.44Å; I129-A152 HydrophobicContact CB-CB 4.44Å; I129-A152 PolarHBondContact N-O 2.67Å; I129-A152 PolarHBondContact O-N 2.91Å; V131-A152 HydrophobicContact CG2-CB 4.17Å; A152-F158 CarbonylContact C-O 3.55Å; A152-F158 WeakPolarHBondContact CA-O 3.48Å
153	E	94.6	Very high	92.5	Very high	3 Å²	3	33.9 Å²	33.9	1%	0.014	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-68.1	130.3	171.5	-179.8	165.8	-100.8	0	0	110	G155 S156 C157 F158 L160 Y265 Y266 S267	E153-G155 PolarHBondContact O-N 3.42Å; E153-S156 WeakPolarHBondContact CB-OG 3.14Å; E153-S156 VanDerWaalsContact CD-OG 3.26Å; E153-S156 VanDerWaalsContact CG-OG 3.31Å; E153-S156 WeakPolarHBondContact CG-OG 3.45Å; E153-S156 WeakPolarHBondContact OE2-CB 3.48Å; E153-S156 PolarHBondContact OE2-OG 2.71Å; E153-C157 WeakPolarHBondContact O-CA 3.47Å; E153-C157 PolarHBondContact O-N 3.23Å; E153-F158 HydrophobicContact CB-CB 4.36Å; E153-F158 WeakPolarHBondContact CB-O 3.46Å; E153-F158 PolarHBondContact N-O 3.03Å; E153-L160 HydrophobicContact CB-CD1 4.12Å; E153-L160 HydrophobicContact CB-CD2 3.95Å; E153-L160 HydrophobicContact CB-CG 3.94Å; E153-Y265 HydrophobicContact CG-CD1 4.24Å; E153-Y265 VanDerWaalsContact OE1-CA 3.28Å; E153-Y265 WeakPolarHBondContact OE1-CA 3.47Å; E153-Y266 VanDerWaalsContact OE1-CA 3.29Å; E153-Y266 WeakPolarHBondContact OE1-CA 3.19Å; E153-Y266 WeakPolarHBondContact OE1-CB 3.35Å; E153-Y266 PolarHBondContact OE1-N 3.3Å; E153-S267 PolarHBondContact OE1-N 2.81Å; E153-S267 PolarHBondContact OE1-OG 3.13Å; E153-S267 WeakPolarHBondContact OE2-CB 3.3Å; E153-S267 PolarHBondContact OE2-OG 2.78Å
154	R	91.8	Very high	93.5	Very high	35 Å²	35	35 Å²	35	13%	0.132	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	133.5	175.9	-173.8	-176.8	-173.9	161.9	14.7	110	T78 N81 E88 L109 I129 S156	T78-R154 PolarHBondContact O-NH1 3.5Å; N81-R154 PolarHBondContact O-NH1 2.68Å; N81-R154 PolarHBondContact O-NH2 3.4Å; E88-R154 IonicContact OE1-CZ 3.32Å; E88-R154 IonicContact OE1-NE 2.75Å; E88-R154 PolarHBondContact OE1-NE 3.35Å; E88-R154 IonicContact OE1-NH2 3.18Å; E88-R154 PolarHBondContact OE1-NH2 3.19Å; E88-R154 IonicContact OE2-NH2 3.78Å; E88-R154 PolarHBondContact OE2-NH2 3.18Å; L109-R154 HydrophobicContact CD2-CB 4.38Å; I129-R154 HydrophobicContact CD1-CB 4.14Å; I129-R154 HydrophobicContact CD1-CG 4.24Å; I129-R154 HydrophobicContact CG1-CB 4.39Å; R154-S156 PolarHBondContact O-N 3.46Å
155	G	88	Confident	94.2	Very high	18 Å²	18	30 Å²	30	19%	0.186	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.4	-57	179.1	0	0	0	0	0	113.9	Q91 E153	Q91-G155 PolarHBondContact NE2-O 3.03Å; Q91-G155 PolarHBondContact OE1-O 2.89Å; E153-G155 PolarHBondContact O-N 3.42Å
156	S	89	Confident	94.3	Very high	27 Å²	27	29 Å²	29	19%	0.189	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-22.3	178.9	78.9	0	0	0	0	113.4	E153 R154 F158	E153-S156 WeakPolarHBondContact CB-OG 3.14Å; E153-S156 VanDerWaalsContact CD-OG 3.26Å; E153-S156 VanDerWaalsContact CG-OG 3.31Å; E153-S156 WeakPolarHBondContact CG-OG 3.45Å; E153-S156 WeakPolarHBondContact OE2-CB 3.48Å; E153-S156 PolarHBondContact OE2-OG 2.71Å; R154-S156 PolarHBondContact O-N 3.46Å; S156-F158 PolarHBondContact O-N 2.77Å; S156-F158 PolarHBondContact OG-N 2.68Å
157	C	93.1	Very high	94	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.014	16%	0.162	C	C	.	.			trans	63.8	8.4	-173.8	-53.5	0	0	0	0	115.2	F95 F96 E153 A159	F95-C157 HydrophobicContact CB-CB 3.58Å; F95-C157 HydrophobicContact CD1-CB 3.7Å; F95-C157 WeakPolarHBondContact CD1-O 3.13Å; F95-C157 HydrophobicContact CD2-CB 3.62Å; F95-C157 HydrophobicContact CE1-CB 4.29Å; F95-C157 WeakPolarHBondContact CE1-O 3.34Å; F95-C157 HydrophobicContact CE2-CB 4.21Å; F95-C157 HydrophobicContact CG-CB 3.34Å; F96-C157 WeakPolarHBondContact CE2-O 3.24Å; F96-C157 VanDerWaalsContact CZ-O 3.24Å; F96-C157 WeakPolarHBondContact CZ-O 3.27Å; E153-C157 WeakPolarHBondContact O-CA 3.47Å; E153-C157 PolarHBondContact O-N 3.23Å; C157-A159 PolarHBondContact O-N 2.75Å
158	F	93.6	Very high	93.8	Very high	107 Å²	107	33.8 Å²	33.8	47%	0.469	19%	0.185	S	C	.	.			trans	-60.7	137.5	177.8	-69.4	-13.6	0	0	0	111.9	F95 A152 E153 S156 L160	F95-F158 HydrophobicContact CE2-CD1 4.15Å; F95-F158 HydrophobicContact CE2-CE1 4.36Å; F95-F158 AromaticContact CZ-CD1 3.87Å; F95-F158 HydrophobicContact CZ-CD1 3.87Å; F95-F158 HydrophobicContact CZ-CE1 4.41Å; A152-F158 CarbonylContact C-O 3.55Å; A152-F158 WeakPolarHBondContact CA-O 3.48Å; E153-F158 HydrophobicContact CB-CB 4.36Å; E153-F158 WeakPolarHBondContact CB-O 3.46Å; E153-F158 PolarHBondContact N-O 3.03Å; S156-F158 PolarHBondContact O-N 2.77Å; S156-F158 PolarHBondContact OG-N 2.68Å; F158-L160 PolarHBondContact O-N 3.34Å; F158-L160 VanDerWaalsContact O-N 3.12Å
159	A	95.8	Very high	93.6	Very high	59 Å²	59	32.9 Å²	32.9	49%	0.488	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	109.4	175.7	0	0	0	0	0	109.9	F96 V150 C157	F96-A159 HydrophobicContact CE1-CB 4.3Å; F96-A159 HydrophobicContact CZ-CB 4.34Å; V150-A159 HydrophobicContact CG1-CB 3.84Å; C157-A159 PolarHBondContact O-N 2.75Å
160	L	95.9	Very high	93.3	Very high	28 Å²	28	37 Å²	37	15%	0.147	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	-39.4	174	-61	176.6	0	0	0	110.7	F126 T127 L151 E153 F158 Y266	F126-L160 HydrophobicContact CB-CB 4.28Å; F126-L160 HydrophobicContact CB-CD1 4.14Å; F126-L160 HydrophobicContact CD1-CB 4.34Å; F126-L160 HydrophobicContact CD2-CB 4.02Å; F126-L160 HydrophobicContact CE2-CB 4.46Å; F126-L160 VanDerWaalsContact CE2-O 3.24Å; F126-L160 WeakPolarHBondContact CE2-O 3.46Å; F126-L160 HydrophobicContact CG-CB 3.97Å; F126-L160 HydrophobicContact CG-CD1 4.45Å; T127-L160 WeakPolarHBondContact O-CD1 3.16Å; L151-L160 WeakPolarHBondContact O-CB 3.19Å; L151-L160 PolarHBondContact O-N 3.11Å; E153-L160 HydrophobicContact CB-CD1 4.12Å; E153-L160 HydrophobicContact CB-CD2 3.95Å; E153-L160 HydrophobicContact CB-CG 3.94Å; F158-L160 PolarHBondContact O-N 3.34Å; F158-L160 VanDerWaalsContact O-N 3.12Å; L160-Y266 HydrophobicContact CD1-CD2 4.37Å
161	W	97.5	Very high	93.2	Very high	21 Å²	21	37.9 Å²	37.9	8%	0.08	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	150.8	178.7	177.8	96.2	0	0	0	110.2	L112 F126 L149 V150 L151 D163 M181 I191 F193	L112-W161 HydrophobicContact CD1-CB 4.03Å; L112-W161 HydrophobicContact CD1-CD2 3.38Å; L112-W161 HydrophobicContact CD1-CE3 3.64Å; L112-W161 HydrophobicContact CD1-CG 3.59Å; L112-W161 HydrophobicContact CD1-CZ2 4.35Å; L112-W161 HydrophobicContact CD1-CZ3 4.25Å; L112-W161 HydrophobicContact CD2-CG 4.39Å; F126-W161 HydrophobicContact CD2-CB 4.12Å; F126-W161 HydrophobicContact CE2-CB 4.43Å; L149-W161 HydrophobicContact CB-CZ3 4.25Å; L149-W161 HydrophobicContact CD2-CZ3 4.35Å; L149-W161 HydrophobicContact CG-CZ3 4.04Å; L149-W161 WeakPolarHBondContact O-CZ3 3.48Å; V150-W161 CarbonylContact C-O 3.54Å; V150-W161 WeakPolarHBondContact CA-O 3.36Å; V150-W161 WeakPolarHBondContact CG1-O 3.46Å; L151-W161 HydrophobicContact CB-CB 4.2Å; L151-W161 PolarHBondContact N-O 3.32Å; L151-W161 PolarHBondContact O-N 3.34Å; W161-D163 HydrophobicContact CH2-CB 3.23Å; W161-D163 HydrophobicContact CZ2-CB 3.29Å; W161-D163 HydrophobicContact CZ3-CB 3.98Å; W161-M181 HydrophobicContact CH2-SD 4.06Å; W161-I191 HydrophobicContact CH2-CG2 4.31Å; W161-I191 HydrophobicContact CZ2-CD1 4.29Å; W161-I191 HydrophobicContact CZ2-CG1 3.94Å; W161-I191 HydrophobicContact CZ2-CG2 4.02Å; W161-F193 HydrophobicContact CE3-CZ 4.1Å; W161-F193 HydrophobicContact CH2-CE2 4.35Å; W161-F193 AromaticContact CH2-CZ 3.91Å; W161-F193 HydrophobicContact CH2-CZ 3.91Å; W161-F193 HydrophobicContact CZ3-CE1 4.47Å; W161-F193 HydrophobicContact CZ3-CE2 4.41Å; W161-F193 AromaticContact CZ3-CZ 3.58Å; W161-F193 HydrophobicContact CZ3-CZ 3.58Å
162	S	97.1	Very high	93.1	Very high	64 Å²	64	43.1 Å²	43.1	45%	0.448	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	140.8	174.2	178.5	0	0	0	0	110.9	T148 L149	T148-S162 WeakPolarHBondContact CG2-OG 3.34Å; L149-S162 VanDerWaalsContact O-CA 3.3Å; L149-S162 WeakPolarHBondContact O-CA 3.36Å
163	D	96.8	Very high	93.1	Very high	14 Å²	14	47.2 Å²	47.2	8%	0.075	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	155.4	170.3	-160.8	16	0	0	0	112	T148 L149 W161 M181 R183 S184	T148-D163 WeakPolarHBondContact CA-O 3.49Å; T148-D163 WeakPolarHBondContact CG2-O 3.27Å; L149-D163 PolarHBondContact N-O 2.74Å; L149-D163 PolarHBondContact O-N 3.26Å; W161-D163 HydrophobicContact CH2-CB 3.23Å; W161-D163 HydrophobicContact CZ2-CB 3.29Å; W161-D163 HydrophobicContact CZ3-CB 3.98Å; D163-M181 HydrophobicContact CB-CE 4.4Å; D163-R183 WeakPolarHBondContact OD2-CA 3.3Å; D163-R183 WeakPolarHBondContact OD2-CG 3.16Å; D163-S184 VanDerWaalsContact OD1-CB 3.25Å; D163-S184 WeakPolarHBondContact OD1-CB 3.46Å; D163-S184 PolarHBondContact OD1-OG 3.38Å; D163-S184 PolarHBondContact OD2-N 3.3Å
164	R	94	Very high	93.1	Very high	91 Å²	91	49.9 Å²	49.9	34%	0.343	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	136.7	177.1	-169.9	176.3	74.1	148.7	4.4	110	D166 S169 L220	R164-D166 IonicContact CZ-OD2 3.13Å; R164-D166 IonicContact NE-OD2 2.68Å; R164-D166 PolarHBondContact NE-OD2 2.85Å; R164-D166 IonicContact NH2-OD2 2.77Å; R164-D166 PolarHBondContact NH2-OD2 3.27Å; R164-S169 PolarHBondContact O-OG 3.36Å; R164-S169 VanDerWaalsContact O-OG 3.11Å; R164-L220 PolarHBondContact NH1-O 3.28Å
165	I	93.3	Very high	93.3	Very high	5 Å²	5	49.3 Å²	49.3	3%	0.026	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	114.5	165.1	-57.6	-178.4	0	0	0	107.8	I132 V147 L149 S169 Y171 M181 V208 V212	I132-I165 HydrophobicContact CD1-CD1 4.28Å; V147-I165 HydrophobicContact CB-CB 4.33Å; V147-I165 HydrophobicContact CG1-CB 4.23Å; V147-I165 HydrophobicContact CG1-CD1 4.18Å; V147-I165 HydrophobicContact CG1-CG1 4.49Å; V147-I165 PolarHBondContact O-N 2.92Å; L149-I165 HydrophobicContact CB-CD1 4.12Å; L149-I165 HydrophobicContact CB-CG1 4.27Å; I165-S169 WeakPolarHBondContact CA-OG 2.86Å; I165-Y171 HydrophobicContact CD1-CD2 4.37Å; I165-M181 HydrophobicContact CG1-CE 4.4Å; I165-V208 HydrophobicContact CD1-CG1 3.94Å; I165-V208 HydrophobicContact CD1-CG2 3.88Å; I165-V208 HydrophobicContact CG2-CG1 4.48Å; I165-V212 HydrophobicContact CG2-CG2 3.95Å
166	D	87.6	Confident	93.7	Very high	18 Å²	18	53.4 Å²	53.4	10%	0.096	30%	0.296	C	S	.	.			trans	-130.1	-173.6	173	63.8	33.9	0	0	0	111.3	R164 L168 S169	R164-D166 IonicContact CZ-OD2 3.13Å; R164-D166 IonicContact NE-OD2 2.68Å; R164-D166 PolarHBondContact NE-OD2 2.85Å; R164-D166 IonicContact NH2-OD2 2.77Å; R164-D166 PolarHBondContact NH2-OD2 3.27Å; D166-L168 PolarHBondContact O-N 3.47Å; D166-L168 PolarHBondContact OD1-N 3.03Å; D166-S169 PolarHBondContact N-OG 3.23Å; D166-S169 WeakPolarHBondContact O-CB 3.44Å; D166-S169 PolarHBondContact O-N 3.43Å; D166-S169 PolarHBondContact O-OG 3.03Å; D166-S169 PolarHBondContact OD1-N 3Å; D166-S169 VanDerWaalsContact OD1-N 3.12Å; D166-S169 PolarHBondContact OD1-OG 3.47Å
167	N	84.6	Confident	94.1	Very high	104 Å²	104	53.4 Å²	53.4	56%	0.556	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.7	-177	70	-44	0	0	0	113.9	T221	N167-T221 HydrophobicContact CB-CG2 3.79Å; N167-T221 WeakPolarHBondContact ND2-CG2 3.18Å; N167-T221 WeakPolarHBondContact OD1-CG2 3.37Å
168	L	88.5	Confident	94.3	Very high	92 Å²	92	55.7 Å²	55.7	48%	0.482	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-12.3	178.7	-59.6	-178.1	0	0	0	112.1	D166 N170 H187	D166-L168 PolarHBondContact O-N 3.47Å; D166-L168 PolarHBondContact OD1-N 3.03Å; L168-N170 PolarHBondContact O-N 3.46Å; L168-H187 WeakPolarHBondContact CB-CD2 2.85Å; L168-H187 WeakPolarHBondContact CB-NE2 3.49Å; L168-H187 PolarHBondContact O-CD2 3.39Å
169	S	91.6	Very high	94.5	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.283	C	S	.	.	S	Bend	trans	-61.6	-26	177.1	-59.9	0	0	0	0	113.8	R164 I165 D166 Y171 M181 C182	R164-S169 PolarHBondContact O-OG 3.36Å; R164-S169 VanDerWaalsContact O-OG 3.11Å; I165-S169 WeakPolarHBondContact CA-OG 2.86Å; D166-S169 PolarHBondContact N-OG 3.23Å; D166-S169 WeakPolarHBondContact O-CB 3.44Å; D166-S169 PolarHBondContact O-N 3.43Å; D166-S169 PolarHBondContact O-OG 3.03Å; D166-S169 PolarHBondContact OD1-N 3Å; D166-S169 VanDerWaalsContact OD1-N 3.12Å; D166-S169 PolarHBondContact OD1-OG 3.47Å; S169-Y171 PolarHBondContact O-N 2.94Å; S169-Y171 VanDerWaalsContact O-N 3.1Å; S169-M181 CarbonylContact O-C 3.53Å; S169-M181 WeakPolarHBondContact O-CA 3.32Å; S169-M181 WeakPolarHBondContact O-CB 3.46Å; S169-C182 PolarHBondContact O-N 3.33Å
170	N	93	Very high	94.6	Very high	86 Å²	86	48.1 Å²	48.1	46%	0.46	26%	0.262	S	S	.	.			trans	47.6	45.2	176	-166.3	7.3	0	0	0	113.4	L168 R172	L168-N170 PolarHBondContact O-N 3.46Å; N170-R172 PolarHBondContact ND2-NH2 2.8Å; N170-R172 PolarHBondContact O-N 3.08Å
171	Y	95.8	Very high	94.6	Very high	22 Å²	22	46.9 Å²	46.9	9%	0.086	26%	0.255	C	S	.	.			trans	-65.2	126.8	-179.9	-169	-87.6	0	0	0	109.6	L149 I165 S169 H179 T180 M181 L204 W205 V208	L149-Y171 HydrophobicContact CD2-CE2 3.8Å; I165-Y171 HydrophobicContact CD1-CD2 4.37Å; S169-Y171 PolarHBondContact O-N 2.94Å; S169-Y171 VanDerWaalsContact O-N 3.1Å; Y171-H179 HydrophobicContact CE1-CB 4.36Å; Y171-H179 AromaticContact CE1-ND1 3.72Å; Y171-H179 AromaticContact CZ-ND1 3.58Å; Y171-H179 PolarHBondContact OH-ND1 3.22Å; Y171-T180 CarbonylContact C-O 3.49Å; Y171-T180 WeakPolarHBondContact CA-O 3.31Å; Y171-M181 HydrophobicContact CD2-CB 3.74Å; Y171-M181 HydrophobicContact CD2-CG 4.16Å; Y171-M181 HydrophobicContact CD2-SD 3.85Å; Y171-M181 HydrophobicContact CE2-SD 4.22Å; Y171-M181 HydrophobicContact CG-CB 4.41Å; Y171-L204 VanDerWaalsContact OH-CD2 3.27Å; Y171-L204 WeakPolarHBondContact OH-CD2 3.38Å; Y171-W205 AromaticContact CD1-CE3 3.76Å; Y171-W205 HydrophobicContact CD1-CE3 3.76Å; Y171-W205 AromaticContact CD1-CZ3 3.72Å; Y171-W205 HydrophobicContact CD1-CZ3 3.72Å; Y171-W205 AromaticContact CE1-CE3 3.81Å; Y171-W205 HydrophobicContact CE1-CE3 3.81Å; Y171-W205 HydrophobicContact CE1-CZ3 4.26Å; Y171-W205 WeakPolarHBondContact O-CZ3 3.32Å; Y171-V208 HydrophobicContact CD1-CB 4.36Å; Y171-V208 HydrophobicContact CD1-CG1 3.84Å; Y171-V208 HydrophobicContact CD1-CG2 4.5Å; Y171-V208 HydrophobicContact CE1-CB 4.37Å; Y171-V208 HydrophobicContact CE1-CG1 4.33Å; Y171-V208 HydrophobicContact CE1-CG2 4.21Å; Y171-V208 HydrophobicContact CG-CG1 4.22Å
172	R	95.3	Very high	94.6	Very high	110 Å²	110	46.6 Å²	46.6	42%	0.415	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	158.3	-175.1	70.9	-179.2	96.7	165.8	17.1	113.2	N170 H179 T180	N170-R172 PolarHBondContact ND2-NH2 2.8Å; N170-R172 PolarHBondContact O-N 3.08Å; R172-H179 CarbonylContact O-C 3.59Å; R172-H179 VanDerWaalsContact O-CA 3.32Å; R172-H179 WeakPolarHBondContact O-CA 3.32Å; R172-T180 VanDerWaalsContact CG-OG1 3.23Å; R172-T180 WeakPolarHBondContact CG-OG1 3.4Å; R172-T180 PolarHBondContact N-O 2.82Å; R172-T180 PolarHBondContact O-N 2.79Å
173	I	97.4	Very high	94.5	Very high	85 Å²	85	47.3 Å²	47.3	44%	0.436	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	118.8	168.1	-53.2	178.9	0	0	0	108.5	G175 W205	I173-G175 VanDerWaalsContact CG2-O 3.24Å; I173-G175 WeakPolarHBondContact CG2-O 3.48Å; I173-W205 HydrophobicContact CD1-CB 4.15Å; I173-W205 HydrophobicContact CD1-CD2 3.75Å; I173-W205 HydrophobicContact CD1-CE3 4.38Å; I173-W205 HydrophobicContact CD1-CG 3.57Å; I173-W205 HydrophobicContact CG1-CB 4.3Å; I173-W205 HydrophobicContact CG1-CD2 3.66Å; I173-W205 HydrophobicContact CG1-CE3 3.77Å; I173-W205 HydrophobicContact CG1-CG 3.87Å; I173-W205 HydrophobicContact CG1-CZ3 4.43Å
174	A	95.3	Very high	94.3	Very high	60 Å²	60	48.3 Å²	48.3	50%	0.496	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-11.8	177.2	0	0	0	0	0	112.9	F178 T180	A174-F178 CarbonylContact C-O 3.56Å; A174-F178 WeakPolarHBondContact CA-O 3.32Å; A174-F178 HydrophobicContact CB-CD1 3.81Å; A174-F178 HydrophobicContact CB-CE1 4.37Å; A174-F178 PolarHBondContact N-O 3.11Å; A174-T180 HydrophobicContact CB-CG2 3.88Å
175	G	95.8	Very high	94.2	Very high	22 Å²	22	48.1 Å²	48.1	23%	0.227	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.9	175.2	173	0	0	0	0	0	111.1	I173 S177 F178	I173-G175 VanDerWaalsContact CG2-O 3.24Å; I173-G175 WeakPolarHBondContact CG2-O 3.48Å; G175-S177 VanDerWaalsContact C-N 3.25Å; G175-S177 PolarHBondContact O-N 2.91Å; G175-S177 VanDerWaalsContact O-N 3.17Å; G175-F178 PolarHBondContact N-O 2.83Å; G175-F178 PolarHBondContact O-N 2.83Å; G175-F178 VanDerWaalsContact O-N 3.15Å
176	P	96.3	Very high	94.2	Very high	104 Å²	104	51.1 Å²	51.1	68%	0.675	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-38.6	-174.2	-27.2	34.9	0	0	0	114.3	T198	P176-T198 HydrophobicContact CB-CG2 4.14Å; P176-T198 WeakPolarHBondContact O-CG2 3.07Å
177	S	97.3	Very high	94.3	Very high	27 Å²	27	53.9 Å²	53.9	19%	0.189	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.6	26.3	175.9	-52.4	0	0	0	0	111.4	G175 S194 F195 T198	G175-S177 VanDerWaalsContact C-N 3.25Å; G175-S177 PolarHBondContact O-N 2.91Å; G175-S177 VanDerWaalsContact O-N 3.17Å; S177-S194 CarbonylContact O-C 3.08Å; S177-S194 WeakPolarHBondContact O-CA 3.33Å; S177-F195 VanDerWaalsContact CB-O 3.32Å; S177-F195 WeakPolarHBondContact CB-O 3.49Å; S177-F195 WeakPolarHBondContact O-CD2 3.37Å; S177-F195 PolarHBondContact O-N 3.17Å; S177-T198 VanDerWaalsContact OG-CA 3.3Å; S177-T198 WeakPolarHBondContact OG-CA 3.38Å; S177-T198 PolarHBondContact OG-N 2.85Å; S177-T198 PolarHBondContact OG-OG1 2.76Å
178	F	97.6	Very high	94.6	Very high	50 Å²	50	56.8 Å²	56.8	22%	0.219	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	117.7	-178.1	-168	-111.9	0	0	0	111.4	Y113 W122 A174 G175 T180 F193	Y113-F178 HydrophobicContact CD2-CE2 4.35Å; W122-F178 HydrophobicContact CZ2-CE1 4.47Å; W122-F178 HydrophobicContact CZ2-CZ 4.37Å; A174-F178 CarbonylContact C-O 3.56Å; A174-F178 WeakPolarHBondContact CA-O 3.32Å; A174-F178 HydrophobicContact CB-CD1 3.81Å; A174-F178 HydrophobicContact CB-CE1 4.37Å; A174-F178 PolarHBondContact N-O 3.11Å; G175-F178 PolarHBondContact N-O 2.83Å; G175-F178 PolarHBondContact O-N 2.83Å; G175-F178 VanDerWaalsContact O-N 3.15Å; F178-T180 HydrophobicContact CD1-CG2 4.14Å; F178-T180 HydrophobicContact CE1-CG2 3.5Å; F178-T180 HydrophobicContact CZ-CG2 4.1Å; F178-F193 CarbonylContact C-O 3.45Å; F178-F193 VanDerWaalsContact CA-O 3.27Å; F178-F193 WeakPolarHBondContact CA-O 3.41Å; F178-F193 VanDerWaalsContact CD2-O 3.28Å; F178-F193 WeakPolarHBondContact CD2-O 3.24Å
179	H	98	Very high	94.9	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	153.8	177.5	-61.8	179.6	0	0	0	110.5	Y171 R172 G192 F193 F195 A201	Y171-H179 HydrophobicContact CE1-CB 4.36Å; Y171-H179 AromaticContact CE1-ND1 3.72Å; Y171-H179 AromaticContact CZ-ND1 3.58Å; Y171-H179 PolarHBondContact OH-ND1 3.22Å; R172-H179 CarbonylContact O-C 3.59Å; R172-H179 VanDerWaalsContact O-CA 3.32Å; R172-H179 WeakPolarHBondContact O-CA 3.32Å; H179-G192 CarbonylContact O-C 3.57Å; H179-G192 WeakPolarHBondContact O-CA 3.39Å; H179-F193 HydrophobicContact CB-CB 4.48Å; H179-F193 PolarHBondContact N-O 2.51Å; H179-F193 PolarHBondContact O-N 2.91Å; H179-F195 HydrophobicContact CB-CE2 4.04Å; H179-F195 AromaticContact CG-CE2 3.69Å; H179-F195 AromaticContact ND1-CE2 3.62Å; H179-F195 AromaticContact ND1-CZ 3.88Å; H179-A201 PolarHBondContact CE1-O 2.87Å
180	T	97.4	Very high	95.2	Very high	7 Å²	7	55.7 Å²	55.7	4%	0.043	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	153.2	176.2	57.7	0	0	0	0	112.2	W122 Y171 R172 A174 F178 I191	W122-T180 HydrophobicContact CH2-CG2 4.06Å; W122-T180 HydrophobicContact CZ2-CG2 4.33Å; Y171-T180 CarbonylContact C-O 3.49Å; Y171-T180 WeakPolarHBondContact CA-O 3.31Å; R172-T180 VanDerWaalsContact CG-OG1 3.23Å; R172-T180 WeakPolarHBondContact CG-OG1 3.4Å; R172-T180 PolarHBondContact N-O 2.82Å; R172-T180 PolarHBondContact O-N 2.79Å; A174-T180 HydrophobicContact CB-CG2 3.88Å; F178-T180 HydrophobicContact CD1-CG2 4.14Å; F178-T180 HydrophobicContact CE1-CG2 3.5Å; F178-T180 HydrophobicContact CZ-CG2 4.1Å; T180-I191 CarbonylContact C-O 3.53Å; T180-I191 WeakPolarHBondContact CA-O 3.21Å
181	M	96.9	Very high	95.4	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	156.6	170.9	63.6	179.5	-71.6	0	0	111.3	L149 W161 D163 I165 S169 Y171 M190 I191 F193	L149-M181 HydrophobicContact CD2-SD 3.98Å; W161-M181 HydrophobicContact CH2-SD 4.06Å; D163-M181 HydrophobicContact CB-CE 4.4Å; I165-M181 HydrophobicContact CG1-CE 4.4Å; S169-M181 CarbonylContact O-C 3.53Å; S169-M181 WeakPolarHBondContact O-CA 3.32Å; S169-M181 WeakPolarHBondContact O-CB 3.46Å; Y171-M181 HydrophobicContact CD2-CB 3.74Å; Y171-M181 HydrophobicContact CD2-CG 4.16Å; Y171-M181 HydrophobicContact CD2-SD 3.85Å; Y171-M181 HydrophobicContact CE2-SD 4.22Å; Y171-M181 HydrophobicContact CG-CB 4.41Å; M181-M190 CarbonylContact O-C 3.51Å; M181-M190 WeakPolarHBondContact O-CA 3.48Å; M181-I191 HydrophobicContact CG-CB 3.86Å; M181-I191 HydrophobicContact CG-CG1 4.42Å; M181-I191 HydrophobicContact CG-CG2 4.48Å; M181-I191 PolarHBondContact N-O 2.82Å; M181-I191 PolarHBondContact O-N 3.23Å; M181-F193 HydrophobicContact CG-CE2 4.43Å; M181-F193 HydrophobicContact SD-CE2 4.12Å
182	C	96.6	Very high	95.5	Very high	16 Å²	16	50.5 Å²	50.5	11%	0.108	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	140.1	165.7	-65.7	0	0	0	0	110	S169 H187 Q189	S169-C182 PolarHBondContact O-N 3.33Å; C182-H187 HydrophobicContact CB-CB 4.42Å; C182-Q189 WeakPolarHBondContact CA-O 3.15Å
183	R	95.1	Very high	95.6	Very high	79 Å²	79	45.3 Å²	45.3	30%	0.298	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	133.6	176.4	-169.6	-180	178.8	167.1	7.9	110.9	E114 D163 S185 N186 H187 Q189 I191	E114-R183 IonicContact OE1-NH1 2.72Å; D163-R183 WeakPolarHBondContact OD2-CA 3.3Å; D163-R183 WeakPolarHBondContact OD2-CG 3.16Å; R183-S185 VanDerWaalsContact C-N 3.26Å; R183-S185 PolarHBondContact NE-OG 2.7Å; R183-S185 VanDerWaalsContact NE-OG 3.17Å; R183-S185 PolarHBondContact O-N 3.16Å; R183-N186 CarbonylContact O-C 3.07Å; R183-N186 PolarHBondContact O-N 3.15Å; R183-H187 PolarHBondContact O-N 3.37Å; R183-Q189 HydrophobicContact CB-CB 4.26Å; R183-Q189 PolarHBondContact N-O 3.24Å; R183-I191 HydrophobicContact CB-CG1 4.3Å
184	S	93.1	Very high	95.6	Very high	34 Å²	34	43 Å²	43	24%	0.238	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-31.5	-175.6	75.9	0	0	0	0	113.5	D163 H187	D163-S184 VanDerWaalsContact OD1-CB 3.25Å; D163-S184 WeakPolarHBondContact OD1-CB 3.46Å; D163-S184 PolarHBondContact OD1-OG 3.38Å; D163-S184 PolarHBondContact OD2-N 3.3Å; S184-H187 PolarHBondContact O-CE1 2.89Å; S184-H187 VanDerWaalsContact O-CE1 3.31Å
185	S	92.4	Very high	95.8	Very high	88 Å²	88	40.5 Å²	40.5	62%	0.615	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-20.5	177.5	63.8	0	0	0	0	113.7	R183	R183-S185 VanDerWaalsContact C-N 3.26Å; R183-S185 PolarHBondContact NE-OG 2.7Å; R183-S185 VanDerWaalsContact NE-OG 3.17Å; R183-S185 PolarHBondContact O-N 3.16Å
186	N	92.9	Very high	95.8	Very high	68 Å²	68	42.7 Å²	42.7	36%	0.364	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	99.4	-179.6	-178.6	4.1	0	0	0	110.8	R183 Q188 Q189	R183-N186 CarbonylContact O-C 3.07Å; R183-N186 PolarHBondContact O-N 3.15Å; N186-Q188 PolarHBondContact O-N 2.85Å; N186-Q188 VanDerWaalsContact O-N 3.15Å; N186-Q188 WeakPolarHBondContact OD1-CB 3.4Å; N186-Q188 PolarHBondContact OD1-N 2.85Å; N186-Q188 VanDerWaalsContact OD1-N 3.08Å; N186-Q189 HydrophobicContact CB-CB 4.4Å; N186-Q189 WeakPolarHBondContact O-CB 3.41Å; N186-Q189 PolarHBondContact O-N 3.17Å
187	H	90.5	Very high	95.8	Very high	76 Å²	76	38.8 Å²	38.8	35%	0.352	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	-8.3	-176.5	-54.1	92	0	0	0	114.7	L168 C182 R183 S184 Q189	L168-H187 WeakPolarHBondContact CB-CD2 2.85Å; L168-H187 WeakPolarHBondContact CB-NE2 3.49Å; L168-H187 PolarHBondContact O-CD2 3.39Å; C182-H187 HydrophobicContact CB-CB 4.42Å; R183-H187 PolarHBondContact O-N 3.37Å; S184-H187 PolarHBondContact O-CE1 2.89Å; S184-H187 VanDerWaalsContact O-CE1 3.31Å; H187-Q189 VanDerWaalsContact C-N 3.29Å
188	Q	90.4	Very high	95.8	Very high	164 Å²	164	40.3 Å²	40.3	77%	0.766	22%	0.215	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	-15.2	169.2	-60.6	-170.4	-47.1	0	0	112.4	N186	N186-Q188 PolarHBondContact O-N 2.85Å; N186-Q188 VanDerWaalsContact O-N 3.15Å; N186-Q188 WeakPolarHBondContact OD1-CB 3.4Å; N186-Q188 PolarHBondContact OD1-N 2.85Å; N186-Q188 VanDerWaalsContact OD1-N 3.08Å
189	Q	94.6	Very high	95.8	Very high	36 Å²	36	42.1 Å²	42.1	17%	0.168	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	125.4	176.3	-168.3	-176.8	-17.3	0	0	109.5	E114 C182 R183 N186 H187	E114-Q189 PolarHBondContact OE1-NE2 3.38Å; C182-Q189 WeakPolarHBondContact CA-O 3.15Å; R183-Q189 HydrophobicContact CB-CB 4.26Å; R183-Q189 PolarHBondContact N-O 3.24Å; N186-Q189 HydrophobicContact CB-CB 4.4Å; N186-Q189 WeakPolarHBondContact O-CB 3.41Å; N186-Q189 PolarHBondContact O-N 3.17Å; H187-Q189 VanDerWaalsContact C-N 3.29Å
190	M	96.8	Very high	95.8	Very high	33 Å²	33	42.2 Å²	42.2	16%	0.163	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	141.7	174.9	-71.6	-116.4	-73	0	0	110.5	G115 W122 M181	G115-M190 PolarHBondContact N-O 3.06Å; G115-M190 PolarHBondContact O-N 3.02Å; W122-M190 HydrophobicContact CH2-CB 3.8Å; W122-M190 HydrophobicContact CH2-CE 4.08Å; W122-M190 HydrophobicContact CZ2-CE 4.08Å; W122-M190 HydrophobicContact CZ3-CB 4.17Å; M181-M190 CarbonylContact O-C 3.51Å; M181-M190 WeakPolarHBondContact O-CA 3.48Å
191	I	97.9	Very high	95.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.3	173.6	-51.8	-60.9	0	0	0	107.4	L112 Y113 E114 W161 T180 M181 R183 F193	L112-I191 HydrophobicContact CD1-CG2 3.87Å; L112-I191 HydrophobicContact CG-CG2 4Å; Y113-I191 CarbonylContact O-C 3.5Å; Y113-I191 WeakPolarHBondContact O-CA 3.4Å; E114-I191 HydrophobicContact CG-CD1 3.77Å; W161-I191 HydrophobicContact CH2-CG2 4.31Å; W161-I191 HydrophobicContact CZ2-CD1 4.29Å; W161-I191 HydrophobicContact CZ2-CG1 3.94Å; W161-I191 HydrophobicContact CZ2-CG2 4.02Å; T180-I191 CarbonylContact C-O 3.53Å; T180-I191 WeakPolarHBondContact CA-O 3.21Å; M181-I191 HydrophobicContact CG-CB 3.86Å; M181-I191 HydrophobicContact CG-CG1 4.42Å; M181-I191 HydrophobicContact CG-CG2 4.48Å; M181-I191 PolarHBondContact N-O 2.82Å; M181-I191 PolarHBondContact O-N 3.23Å; R183-I191 HydrophobicContact CB-CG1 4.3Å; I191-F193 HydrophobicContact CG2-CD2 4.17Å; I191-F193 HydrophobicContact CG2-CE2 3.54Å; I191-F193 HydrophobicContact CG2-CZ 3.99Å
192	G	97.5	Very high	95.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135.9	176.3	0	0	0	0	0	110.4	L112 Y113 H179	L112-G192 CarbonylContact C-O 3.57Å; L112-G192 WeakPolarHBondContact CA-O 3.39Å; Y113-G192 PolarHBondContact N-O 3.43Å; Y113-G192 PolarHBondContact O-N 2.98Å; H179-G192 CarbonylContact O-C 3.57Å; H179-G192 WeakPolarHBondContact O-CA 3.39Å
193	F	98.3	Very high	95.9	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	114	172.5	-69.5	-91.6	0	0	0	108.9	N111 L112 L149 L151 W161 F178 H179 M181 I191 F195	N111-F193 CarbonylContact O-C 3.53Å; N111-F193 WeakPolarHBondContact O-CA 3.45Å; L112-F193 HydrophobicContact CB-CE1 4.46Å; L112-F193 HydrophobicContact CD1-CD1 4.49Å; L112-F193 HydrophobicContact CD1-CE1 3.64Å; L112-F193 HydrophobicContact CD1-CE2 4.48Å; L112-F193 HydrophobicContact CD1-CZ 3.62Å; L112-F193 HydrophobicContact CG-CE1 4.42Å; L149-F193 HydrophobicContact CD2-CD2 4.2Å; L149-F193 HydrophobicContact CD2-CE1 4.12Å; L149-F193 HydrophobicContact CD2-CE2 3.43Å; L149-F193 VanDerWaalsContact CD2-CE2 3.43Å; L149-F193 HydrophobicContact CD2-CZ 3.38Å; L149-F193 HydrophobicContact CG-CE1 4.49Å; L149-F193 HydrophobicContact CG-CE2 4.48Å; L149-F193 HydrophobicContact CG-CZ 3.97Å; L151-F193 HydrophobicContact CD1-CE1 4.25Å; W161-F193 HydrophobicContact CE3-CZ 4.1Å; W161-F193 HydrophobicContact CH2-CE2 4.35Å; W161-F193 AromaticContact CH2-CZ 3.91Å; W161-F193 HydrophobicContact CH2-CZ 3.91Å; W161-F193 HydrophobicContact CZ3-CE1 4.47Å; W161-F193 HydrophobicContact CZ3-CE2 4.41Å; W161-F193 AromaticContact CZ3-CZ 3.58Å; W161-F193 HydrophobicContact CZ3-CZ 3.58Å; F178-F193 CarbonylContact C-O 3.45Å; F178-F193 VanDerWaalsContact CA-O 3.27Å; F178-F193 WeakPolarHBondContact CA-O 3.41Å; F178-F193 VanDerWaalsContact CD2-O 3.28Å; F178-F193 WeakPolarHBondContact CD2-O 3.24Å; H179-F193 HydrophobicContact CB-CB 4.48Å; H179-F193 PolarHBondContact N-O 2.51Å; H179-F193 PolarHBondContact O-N 2.91Å; M181-F193 HydrophobicContact CG-CE2 4.43Å; M181-F193 HydrophobicContact SD-CE2 4.12Å; I191-F193 HydrophobicContact CG2-CD2 4.17Å; I191-F193 HydrophobicContact CG2-CE2 3.54Å; I191-F193 HydrophobicContact CG2-CZ 3.99Å; F193-F195 HydrophobicContact CB-CD2 4.28Å; F193-F195 HydrophobicContact CB-CE2 3.49Å; F193-F195 VanDerWaalsContact CB-CE2 3.49Å; F193-F195 HydrophobicContact CB-CZ 3.8Å; F193-F195 HydrophobicContact CG-CZ 4.48Å
194	S	97.8	Very high	96	Very high	38 Å²	38	46.6 Å²	46.6	27%	0.266	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	112.5	170.3	-174.5	0	0	0	0	109.3	A110 N111 S177	A110-S194 CarbonylContact C-O 3.56Å; A110-S194 WeakPolarHBondContact CA-O 3.32Å; A110-S194 WeakPolarHBondContact CB-O 3.45Å; N111-S194 PolarHBondContact N-O 2.73Å; N111-S194 PolarHBondContact O-N 3.17Å; S177-S194 CarbonylContact O-C 3.08Å; S177-S194 WeakPolarHBondContact O-CA 3.33Å
195	F	98.1	Very high	96.2	Very high	6 Å²	6	47.7 Å²	47.7	3%	0.026	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	143.9	-177.8	-60.9	-101.3	0	0	0	110.8	A110 P130 S177 H179 F193 S197 A201 L204	A110-F195 HydrophobicContact CB-CD1 3.92Å; A110-F195 HydrophobicContact CB-CE1 4.2Å; A110-F195 HydrophobicContact CB-CG 4.17Å; P130-F195 HydrophobicContact CB-CE1 4.12Å; P130-F195 HydrophobicContact CG-CD1 4.2Å; P130-F195 HydrophobicContact CG-CE1 3.68Å; P130-F195 HydrophobicContact CG-CZ 4.5Å; S177-F195 VanDerWaalsContact CB-O 3.32Å; S177-F195 WeakPolarHBondContact CB-O 3.49Å; S177-F195 WeakPolarHBondContact O-CD2 3.37Å; S177-F195 PolarHBondContact O-N 3.17Å; H179-F195 HydrophobicContact CB-CE2 4.04Å; H179-F195 AromaticContact CG-CE2 3.69Å; H179-F195 AromaticContact ND1-CE2 3.62Å; H179-F195 AromaticContact ND1-CZ 3.88Å; F193-F195 HydrophobicContact CB-CD2 4.28Å; F193-F195 HydrophobicContact CB-CE2 3.49Å; F193-F195 VanDerWaalsContact CB-CE2 3.49Å; F193-F195 HydrophobicContact CB-CZ 3.8Å; F193-F195 HydrophobicContact CG-CZ 4.48Å; F195-S197 PolarHBondContact O-N 3.15Å; F195-A201 HydrophobicContact CB-CB 3.94Å; F195-A201 HydrophobicContact CD1-CB 4.2Å; F195-A201 HydrophobicContact CD2-CB 3.64Å; F195-A201 HydrophobicContact CE2-CB 4.21Å; F195-A201 HydrophobicContact CG-CB 3.66Å; F195-L204 HydrophobicContact CE1-CB 4.46Å; F195-L204 HydrophobicContact CE1-CD2 3.65Å; F195-L204 HydrophobicContact CZ-CD2 3.41Å; F195-L204 VanDerWaalsContact CZ-CD2 3.41Å
196	D	96.6	Very high	96.4	Very high	69 Å²	69	48.2 Å²	48.2	37%	0.369	24%	0.237	S	C	.	.	S	Bend	trans	-75.7	-11.1	174	-66.6	-16.4	0	0	0	112.6	T82 L109	T82-D196 HydrophobicContact CG2-CB 3.94Å; T82-D196 WeakPolarHBondContact CG2-OD2 3.33Å; L109-D196 PolarHBondContact O-N 2.83Å
197	S	96.4	Very high	96.5	Very high	21 Å²	21	46.3 Å²	46.3	15%	0.147	23%	0.225	C	C	.	.			trans	-134.9	126.2	177.5	173.4	0	0	0	0	111.4	F195 D199 A200 A201	F195-S197 PolarHBondContact O-N 3.15Å; S197-D199 VanDerWaalsContact C-N 3.25Å; S197-D199 PolarHBondContact O-N 3.3Å; S197-D199 PolarHBondContact OG-N 2.82Å; S197-A200 PolarHBondContact O-N 2.84Å; S197-A200 PolarHBondContact OG-N 3.49Å; S197-A201 PolarHBondContact O-N 2.92Å
198	T	97.3	Very high	96.7	Very high	60 Å²	60	42.9 Å²	42.9	37%	0.368	21%	0.21	S	C	.	.	H	α-helix	trans	-62.2	-34	172.9	-57.6	0	0	0	0	111.8	P176 S177 R202	P176-T198 HydrophobicContact CB-CG2 4.14Å; P176-T198 WeakPolarHBondContact O-CG2 3.07Å; S177-T198 VanDerWaalsContact OG-CA 3.3Å; S177-T198 WeakPolarHBondContact OG-CA 3.38Å; S177-T198 PolarHBondContact OG-N 2.85Å; S177-T198 PolarHBondContact OG-OG1 2.76Å; T198-R202 WeakPolarHBondContact O-CB 3.46Å; T198-R202 PolarHBondContact O-N 2.76Å
199	D	97.2	Very high	96.8	Very high	88 Å²	88	39.3 Å²	39.3	47%	0.471	19%	0.193	S	C	.	.	H	α-helix	trans	-69.5	-44.9	178.6	-67.3	-30.7	0	0	0	110.8	S197 A201 R202 E203	S197-D199 VanDerWaalsContact C-N 3.25Å; S197-D199 PolarHBondContact O-N 3.3Å; S197-D199 PolarHBondContact OG-N 2.82Å; D199-A201 VanDerWaalsContact C-N 3.32Å; D199-A201 PolarHBondContact O-N 2.83Å; D199-R202 WeakPolarHBondContact O-CB 3.44Å; D199-R202 PolarHBondContact O-N 3.12Å; D199-R202 IonicContact OD1-CZ 3.65Å; D199-R202 IonicContact OD1-NH1 4Å; D199-R202 PolarHBondContact OD1-NH1 2.93Å; D199-R202 IonicContact OD1-NH2 2.88Å; D199-R202 PolarHBondContact OD1-NH2 3.1Å; D199-E203 WeakPolarHBondContact O-CG 3.36Å; D199-E203 PolarHBondContact O-N 2.85Å
200	A	97	Very high	96.7	Very high	3 Å²	3	44.1 Å²	44.1	3%	0.025	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-39.9	175.6	0	0	0	0	0	112.1	A108 S197 E203 L204	A108-A200 HydrophobicContact CB-CB 3.77Å; S197-A200 PolarHBondContact O-N 2.84Å; S197-A200 PolarHBondContact OG-N 3.49Å; A200-E203 PolarHBondContact O-N 2.89Å; A200-L204 WeakPolarHBondContact O-CB 3.36Å; A200-L204 PolarHBondContact O-N 2.85Å
201	A	98	Very high	96.4	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.5	-51.2	173	0	0	0	0	0	110.8	H179 F195 S197 D199 E203 L204 W205	H179-A201 PolarHBondContact CE1-O 2.87Å; F195-A201 HydrophobicContact CB-CB 3.94Å; F195-A201 HydrophobicContact CD1-CB 4.2Å; F195-A201 HydrophobicContact CD2-CB 3.64Å; F195-A201 HydrophobicContact CE2-CB 4.21Å; F195-A201 HydrophobicContact CG-CB 3.66Å; S197-A201 PolarHBondContact O-N 2.92Å; D199-A201 VanDerWaalsContact C-N 3.32Å; D199-A201 PolarHBondContact O-N 2.83Å; A201-E203 PolarHBondContact O-N 2.88Å; A201-L204 PolarHBondContact O-N 3.2Å; A201-W205 PolarHBondContact O-N 3.05Å
202	R	98.1	Very high	95.7	Very high	112 Å²	112	46.3 Å²	46.3	42%	0.423	23%	0.225	S	C	.	.	H	α-helix	trans	-58.9	-44.8	179.4	-167.5	-168.3	-47.9	110.6	6.8	112.6	T198 D199 W205 Q206	T198-R202 WeakPolarHBondContact O-CB 3.46Å; T198-R202 PolarHBondContact O-N 2.76Å; D199-R202 WeakPolarHBondContact O-CB 3.44Å; D199-R202 PolarHBondContact O-N 3.12Å; D199-R202 IonicContact OD1-CZ 3.65Å; D199-R202 IonicContact OD1-NH1 4Å; D199-R202 PolarHBondContact OD1-NH1 2.93Å; D199-R202 IonicContact OD1-NH2 2.88Å; D199-R202 PolarHBondContact OD1-NH2 3.1Å; R202-W205 PolarHBondContact O-N 3.43Å; R202-Q206 WeakPolarHBondContact O-CG 2.96Å; R202-Q206 PolarHBondContact O-N 2.88Å
203	E	97.7	Very high	94.8	Very high	82 Å²	82	50.4 Å²	50.4	38%	0.383	25%	0.253	S	S	.	.	H	α-helix	trans	-62.1	-43.7	178.3	-71.9	179	177.1	0	0	111.8	F104 D199 A200 A201 Q206 H207	F104-E203 HydrophobicContact CZ-CB 3.87Å; D199-E203 WeakPolarHBondContact O-CG 3.36Å; D199-E203 PolarHBondContact O-N 2.85Å; A200-E203 PolarHBondContact O-N 2.89Å; A201-E203 PolarHBondContact O-N 2.88Å; E203-Q206 PolarHBondContact O-N 2.9Å; E203-H207 WeakPolarHBondContact O-CB 3.38Å; E203-H207 PolarHBondContact O-N 3.11Å
204	L	97.5	Very high	93.2	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61.4	-45.4	175.7	-170.2	85.7	0	0	0	110.9	F104 P130 I132 L149 Y171 F195 A200 A201 H207 V208	F104-L204 HydrophobicContact CD1-CD1 3.82Å; F104-L204 HydrophobicContact CE1-CB 4.15Å; F104-L204 HydrophobicContact CE1-CD1 3.65Å; F104-L204 HydrophobicContact CE1-CG 4.47Å; P130-L204 HydrophobicContact CB-CD1 4.28Å; P130-L204 HydrophobicContact CB-CD2 4.25Å; I132-L204 HydrophobicContact CD1-CD1 4Å; I132-L204 HydrophobicContact CG1-CD1 3.58Å; I132-L204 HydrophobicContact CG1-CG 4.4Å; L149-L204 HydrophobicContact CD1-CD2 4.36Å; Y171-L204 VanDerWaalsContact OH-CD2 3.27Å; Y171-L204 WeakPolarHBondContact OH-CD2 3.38Å; F195-L204 HydrophobicContact CE1-CB 4.46Å; F195-L204 HydrophobicContact CE1-CD2 3.65Å; F195-L204 HydrophobicContact CZ-CD2 3.41Å; F195-L204 VanDerWaalsContact CZ-CD2 3.41Å; A200-L204 WeakPolarHBondContact O-CB 3.36Å; A200-L204 PolarHBondContact O-N 2.85Å; A201-L204 PolarHBondContact O-N 3.2Å; L204-H207 WeakPolarHBondContact O-CA 3.26Å; L204-H207 WeakPolarHBondContact O-CB 3.42Å; L204-H207 PolarHBondContact O-N 2.71Å; L204-H207 VanDerWaalsContact O-N 3.12Å; L204-V208 WeakPolarHBondContact O-CG2 3.23Å; L204-V208 PolarHBondContact O-N 3.25Å
205	W	97.1	Very high	91.3	Very high	57 Å²	57	56.1 Å²	56.1	22%	0.216	29%	0.286	C	S	.	.	H	α-helix	trans	-57.1	-51.5	176.1	167	-98	0	0	0	111.4	Y171 I173 A201 R202 H207 V208 E209	Y171-W205 AromaticContact CD1-CE3 3.76Å; Y171-W205 HydrophobicContact CD1-CE3 3.76Å; Y171-W205 AromaticContact CD1-CZ3 3.72Å; Y171-W205 HydrophobicContact CD1-CZ3 3.72Å; Y171-W205 AromaticContact CE1-CE3 3.81Å; Y171-W205 HydrophobicContact CE1-CE3 3.81Å; Y171-W205 HydrophobicContact CE1-CZ3 4.26Å; Y171-W205 WeakPolarHBondContact O-CZ3 3.32Å; I173-W205 HydrophobicContact CD1-CB 4.15Å; I173-W205 HydrophobicContact CD1-CD2 3.75Å; I173-W205 HydrophobicContact CD1-CE3 4.38Å; I173-W205 HydrophobicContact CD1-CG 3.57Å; I173-W205 HydrophobicContact CG1-CB 4.3Å; I173-W205 HydrophobicContact CG1-CD2 3.66Å; I173-W205 HydrophobicContact CG1-CE3 3.77Å; I173-W205 HydrophobicContact CG1-CG 3.87Å; I173-W205 HydrophobicContact CG1-CZ3 4.43Å; A201-W205 PolarHBondContact O-N 3.05Å; R202-W205 PolarHBondContact O-N 3.43Å; W205-H207 PolarHBondContact O-N 3.01Å; W205-V208 PolarHBondContact O-N 2.74Å; W205-V208 VanDerWaalsContact O-N 3.11Å; W205-E209 HydrophobicContact CZ2-CB 4.23Å; W205-E209 HydrophobicContact CZ2-CG 4.33Å; W205-E209 PolarHBondContact NE1-OE2 2.92Å; W205-E209 WeakPolarHBondContact O-CB 3.49Å; W205-E209 PolarHBondContact O-N 3.35Å
206	Q	96.8	Very high	89.3	Confident	100 Å²	100	63.6 Å²	63.6	47%	0.467	32%	0.321	S	S	.	.	H	α-helix	trans	-57.9	-33.9	178.1	-71.9	173.5	-5.5	0	0	111.5	R202 E203 R210	R202-Q206 WeakPolarHBondContact O-CG 2.96Å; R202-Q206 PolarHBondContact O-N 2.88Å; E203-Q206 PolarHBondContact O-N 2.9Å; Q206-R210 VanDerWaalsContact O-CB 3.28Å; Q206-R210 WeakPolarHBondContact O-CB 3.49Å; Q206-R210 PolarHBondContact O-N 2.75Å; Q206-R210 VanDerWaalsContact O-N 3.08Å
207	H	95.5	Very high	87.4	Confident	27 Å²	27	61.4 Å²	61.4	13%	0.125	31%	0.309	C	S	.	.	H	α-helix	trans	-68.8	-46.3	175.7	-155.9	97.4	0	0	0	113.1	F104 E203 L204 W205 R210 L211	F104-H207 VanDerWaalsContact CB-CE1 3.49Å; F104-H207 WeakPolarHBondContact CB-CE1 3.45Å; F104-H207 HydrophobicContact CD1-CB 4.17Å; F104-H207 HydrophobicContact CD2-CB 4.42Å; F104-H207 AromaticContact CD2-ND1 3.51Å; F104-H207 HydrophobicContact CE1-CB 4.45Å; F104-H207 HydrophobicContact CG-CB 4.16Å; F104-H207 AromaticContact CG-CG 3.7Å; F104-H207 AromaticContact CG-ND1 3.56Å; E203-H207 WeakPolarHBondContact O-CB 3.38Å; E203-H207 PolarHBondContact O-N 3.11Å; L204-H207 WeakPolarHBondContact O-CA 3.26Å; L204-H207 WeakPolarHBondContact O-CB 3.42Å; L204-H207 PolarHBondContact O-N 2.71Å; L204-H207 VanDerWaalsContact O-N 3.12Å; W205-H207 PolarHBondContact O-N 3.01Å; H207-R210 VanDerWaalsContact CA-NH2 3.32Å; H207-R210 PolarHBondContact CE1-NH1 3.27Å; H207-R210 VanDerWaalsContact CG-NH1 3.27Å; H207-R210 PolarHBondContact ND1-NH1 3.14Å; H207-R210 PolarHBondContact ND1-NH2 3.07Å; H207-R210 PolarHBondContact O-NH1 3.31Å; H207-L211 WeakPolarHBondContact O-CG 3.28Å; H207-L211 PolarHBondContact O-N 2.96Å
208	V	94.3	Very high	85.2	Confident	4 Å²	4	67 Å²	67	2%	0.024	33%	0.333	C	S	.	.	H	α-helix	trans	-62	-48.7	174.7	173.9	0	0	0	0	110.7	I132 I165 Y171 L204 W205 R210 L211 V212	I132-V208 HydrophobicContact CD1-CG2 3.62Å; I132-V208 HydrophobicContact CG1-CG2 4.25Å; I165-V208 HydrophobicContact CD1-CG1 3.94Å; I165-V208 HydrophobicContact CD1-CG2 3.88Å; I165-V208 HydrophobicContact CG2-CG1 4.48Å; Y171-V208 HydrophobicContact CD1-CB 4.36Å; Y171-V208 HydrophobicContact CD1-CG1 3.84Å; Y171-V208 HydrophobicContact CD1-CG2 4.5Å; Y171-V208 HydrophobicContact CE1-CB 4.37Å; Y171-V208 HydrophobicContact CE1-CG1 4.33Å; Y171-V208 HydrophobicContact CE1-CG2 4.21Å; Y171-V208 HydrophobicContact CG-CG1 4.22Å; L204-V208 WeakPolarHBondContact O-CG2 3.23Å; L204-V208 PolarHBondContact O-N 3.25Å; W205-V208 PolarHBondContact O-N 2.74Å; W205-V208 VanDerWaalsContact O-N 3.11Å; V208-R210 PolarHBondContact O-N 3.01Å; V208-L211 PolarHBondContact O-N 2.62Å; V208-L211 VanDerWaalsContact O-N 3.13Å; V208-V212 HydrophobicContact CG1-CG2 4.03Å; V208-V212 WeakPolarHBondContact O-CB 3.38Å; V208-V212 WeakPolarHBondContact O-CG2 3.41Å; V208-V212 PolarHBondContact O-N 3.44Å
209	E	92.6	Very high	83	Confident	90 Å²	90	67.4 Å²	67.4	42%	0.421	34%	0.343	S	S	.	.	H	α-helix	trans	-58.7	-45.2	-178.6	-177.5	172.5	-147.3	0	0	111.7	W205 L211 V212 S213	W205-E209 HydrophobicContact CZ2-CB 4.23Å; W205-E209 HydrophobicContact CZ2-CG 4.33Å; W205-E209 PolarHBondContact NE1-OE2 2.92Å; W205-E209 WeakPolarHBondContact O-CB 3.49Å; W205-E209 PolarHBondContact O-N 3.35Å; E209-L211 VanDerWaalsContact C-N 3.31Å; E209-L211 PolarHBondContact O-N 2.81Å; E209-V212 PolarHBondContact O-N 3.15Å; E209-S213 WeakPolarHBondContact O-CB 3.22Å; E209-S213 PolarHBondContact O-N 3.2Å; E209-S213 PolarHBondContact O-OG 3.13Å
210	R	91.9	Very high	80.9	Confident	136 Å²	136	64 Å²	64	51%	0.513	32%	0.324	S	S	.	.	H	α-helix	trans	-61.1	-39.5	177	-168.9	-164.4	-33.7	94.3	3.1	112.6	Q206 H207 V208	Q206-R210 VanDerWaalsContact O-CB 3.28Å; Q206-R210 WeakPolarHBondContact O-CB 3.49Å; Q206-R210 PolarHBondContact O-N 2.75Å; Q206-R210 VanDerWaalsContact O-N 3.08Å; H207-R210 VanDerWaalsContact CA-NH2 3.32Å; H207-R210 PolarHBondContact CE1-NH1 3.27Å; H207-R210 VanDerWaalsContact CG-NH1 3.27Å; H207-R210 PolarHBondContact ND1-NH1 3.14Å; H207-R210 PolarHBondContact ND1-NH2 3.07Å; H207-R210 PolarHBondContact O-NH1 3.31Å; V208-R210 PolarHBondContact O-N 3.01Å
211	L	90.1	Very high	78.4	Confident	13 Å²	13	66.4 Å²	66.4	7%	0.068	34%	0.339	C	S	.	.	H	α-helix	trans	-73.9	-42.4	179.7	-68.7	175.8	0	0	0	111.4	I132 H134 V147 H207 V208 E209 N217	I132-L211 HydrophobicContact CG2-CD1 3.72Å; H134-L211 HydrophobicContact CB-CD1 3.98Å; H134-L211 HydrophobicContact CB-CD2 4.25Å; V147-L211 HydrophobicContact CG1-CD1 4Å; V147-L211 HydrophobicContact CG2-CB 4.04Å; V147-L211 HydrophobicContact CG2-CD1 4.08Å; H207-L211 WeakPolarHBondContact O-CG 3.28Å; H207-L211 PolarHBondContact O-N 2.96Å; V208-L211 PolarHBondContact O-N 2.62Å; V208-L211 VanDerWaalsContact O-N 3.13Å; E209-L211 VanDerWaalsContact C-N 3.31Å; E209-L211 PolarHBondContact O-N 2.81Å; L211-N217 PolarHBondContact O-ND2 2.65Å
212	V	83.7	Confident	75.9	Confident	67 Å²	67	71.9 Å²	71.9	41%	0.406	37%	0.372	S	S	.	.	H	α-helix	trans	-78.9	-29.2	-175.6	178.1	0	0	0	0	112.2	I165 V208 E209 N214	I165-V212 HydrophobicContact CG2-CG2 3.95Å; V208-V212 HydrophobicContact CG1-CG2 4.03Å; V208-V212 WeakPolarHBondContact O-CB 3.38Å; V208-V212 WeakPolarHBondContact O-CG2 3.41Å; V208-V212 PolarHBondContact O-N 3.44Å; E209-V212 PolarHBondContact O-N 3.15Å; V212-N214 PolarHBondContact O-N 2.92Å
213	S	79	Confident	73.3	Confident	86 Å²	86	71.9 Å²	71.9	60%	0.601	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-9	179.3	-56.4	0	0	0	0	114	E209 P215	E209-S213 WeakPolarHBondContact O-CB 3.22Å; E209-S213 PolarHBondContact O-N 3.2Å; E209-S213 PolarHBondContact O-OG 3.13Å; S213-P215 WeakPolarHBondContact O-CD 3.35Å
214	N	64.6	Low	70.7	Confident	61 Å²	61	69.9 Å²	69.9	33%	0.326	40%	0.397	S	S	.	.			trans	-80.8	116.8	178.1	-174.4	-8	0	0	0	110	V212 E216 N217	V212-N214 PolarHBondContact O-N 2.92Å; N214-E216 PolarHBondContact O-N 2.88Å; N214-E216 VanDerWaalsContact O-N 3.15Å; N214-E216 PolarHBondContact OD1-N 2.82Å; N214-E216 VanDerWaalsContact OD1-N 3.1Å; N214-N217 HydrophobicContact CB-CB 4.46Å; N214-N217 WeakPolarHBondContact O-CA 3.45Å; N214-N217 VanDerWaalsContact O-CB 3.3Å; N214-N217 WeakPolarHBondContact O-CB 3.29Å; N214-N217 PolarHBondContact O-N 2.78Å
215	P	57.5	Low	68.2	Low	97 Å²	97	76.5 Å²	76.5	63%	0.63	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-62.3	-22	-179.5	24.1	-33.7	0	0	0	113.9	S213 N217 E218	S213-P215 WeakPolarHBondContact O-CD 3.35Å; P215-N217 PolarHBondContact O-N 2.76Å; P215-E218 WeakPolarHBondContact O-CB 3.28Å; P215-E218 PolarHBondContact O-N 2.92Å
216	E	56.6	Low	66.2	Low	162 Å²	162	85.1 Å²	85.1	76%	0.757	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-67.8	-21.3	171.9	-63.6	-166	145.1	0	0	112.7	N214 E218	N214-E216 PolarHBondContact O-N 2.88Å; N214-E216 VanDerWaalsContact O-N 3.15Å; N214-E216 PolarHBondContact OD1-N 2.82Å; N214-E216 VanDerWaalsContact OD1-N 3.1Å; E216-E218 VanDerWaalsContact C-N 3.34Å
217	N	56.5	Low	64.3	Low	23 Å²	23	89.2 Å²	89.2	12%	0.123	49%	0.486	C	S	.	.	G	3₁₀ helix	trans	-86.8	1.7	171.3	-64.2	-24.9	0	0	0	112.3	L211 N214 P215 A219 L220	L211-N217 PolarHBondContact O-ND2 2.65Å; N214-N217 HydrophobicContact CB-CB 4.46Å; N214-N217 WeakPolarHBondContact O-CA 3.45Å; N214-N217 VanDerWaalsContact O-CB 3.3Å; N214-N217 WeakPolarHBondContact O-CB 3.29Å; N214-N217 PolarHBondContact O-N 2.78Å; P215-N217 PolarHBondContact O-N 2.76Å; N217-A219 PolarHBondContact O-N 2.79Å; N217-L220 HydrophobicContact CB-CD1 4.01Å; N217-L220 HydrophobicContact CB-CG 4.4Å; N217-L220 WeakPolarHBondContact O-CB 3.37Å; N217-L220 WeakPolarHBondContact O-CD1 3.38Å; N217-L220 WeakPolarHBondContact O-CG 3.49Å; N217-L220 PolarHBondContact O-N 2.87Å
218	E	51	Low	62.3	Low	138 Å²	138	93.9 Å²	93.9	65%	0.645	52%	0.519	S	S	*	.	G	3₁₀ helix	trans	-74.5	-10	168.4	-69.6	-157.2	152.3	0	0	112.9	P215 E216 L220 T221	P215-E218 WeakPolarHBondContact O-CB 3.28Å; P215-E218 PolarHBondContact O-N 2.92Å; E216-E218 VanDerWaalsContact C-N 3.34Å; E218-L220 PolarHBondContact O-N 3.12Å; E218-L220 VanDerWaalsContact O-N 3.16Å; E218-T221 WeakPolarHBondContact O-CB 3.27Å; E218-T221 PolarHBondContact O-N 2.72Å; E218-T221 PolarHBondContact O-OG1 3.25Å
219	A	50.5	Low	60.5	Low	69 Å²	69	102.8 Å²	102.8	57%	0.57	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-65.9	-7.3	167.4	0	0	0	0	0	113.4	N217 T221	N217-A219 PolarHBondContact O-N 2.79Å; A219-T221 PolarHBondContact O-N 3.18Å; A219-T221 VanDerWaalsContact O-N 3.15Å
220	L	53	Low	58.7	Low	17 Å²	17	108.6 Å²	108.6	9%	0.089	58%	0.581	C	S	.	*	G	3₁₀ helix	trans	-62.4	-12.4	172.4	-66.8	179.2	0	0	0	114	P145 R146 V147 R164 N217 E218	P145-L220 HydrophobicContact CB-CD2 3.96Å; P145-L220 WeakPolarHBondContact O-CD2 3.24Å; R146-L220 HydrophobicContact CB-CD2 4.36Å; V147-L220 HydrophobicContact CG2-CD1 4.23Å; R164-L220 PolarHBondContact NH1-O 3.28Å; N217-L220 HydrophobicContact CB-CD1 4.01Å; N217-L220 HydrophobicContact CB-CG 4.4Å; N217-L220 WeakPolarHBondContact O-CB 3.37Å; N217-L220 WeakPolarHBondContact O-CD1 3.38Å; N217-L220 WeakPolarHBondContact O-CG 3.49Å; N217-L220 PolarHBondContact O-N 2.87Å; E218-L220 PolarHBondContact O-N 3.12Å; E218-L220 VanDerWaalsContact O-N 3.16Å
221	T	44.9	Very low	57.2	Low	53 Å²	53	110.8 Å²	110.8	33%	0.325	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	-112.7	-15.3	-157	-22.8	0	0	0	0	115.9	N167 E218 A219	N167-T221 HydrophobicContact CB-CG2 3.79Å; N167-T221 WeakPolarHBondContact ND2-CG2 3.18Å; N167-T221 WeakPolarHBondContact OD1-CG2 3.37Å; E218-T221 WeakPolarHBondContact O-CB 3.27Å; E218-T221 PolarHBondContact O-N 2.72Å; E218-T221 PolarHBondContact O-OG1 3.25Å; A219-T221 PolarHBondContact O-N 3.18Å; A219-T221 VanDerWaalsContact O-N 3.15Å
222	V	44.8	Very low	56	Low	116 Å²	116	119.1 Å²	119.1	70%	0.703	63%	0.633	S	S	*	*			trans	-111.4	105.9	-173.9	-161.2	0	0	0	0	110.3	G224	V222-G224 PolarHBondContact O-N 3.47Å
223	A	43	Very low	54.8	Low	112 Å²	112	128.3 Å²	128.3	93%	0.926	66%	0.661	S	S	*	*			trans	-64.1	64	155.6	0	0	0	0	0	109.4
224	G	43.8	Very low	54.2	Low	39 Å²	39	130.2 Å²	130.2	40%	0.402	67%	0.668	S	S	.	*			trans	-99.3	94	-178.8	0	0	0	0	0	108.7	V222 R226	V222-G224 PolarHBondContact O-N 3.47Å; G224-R226 VanDerWaalsContact C-N 3.29Å; G224-R226 PolarHBondContact O-N 3.47Å
225	T	45.7	Very low	54.7	Low	139 Å²	139	136.1 Å²	136.1	85%	0.853	69%	0.691	S	S	*	*			trans	-14	75.3	157.8	37.8	0	0	0	0	115.6	K227	T225-K227 PolarHBondContact O-N 2.53Å
226	R	54.2	Low	55.3	Low	238 Å²	238	137.5 Å²	137.5	90%	0.898	70%	0.7	S	S	*	*			trans	-73.8	98.6	162.2	-69.9	-172.7	-177.2	-178.7	2.2	106.2	G224	G224-R226 VanDerWaalsContact C-N 3.29Å; G224-R226 PolarHBondContact O-N 3.47Å
227	K	57.4	Low	56.2	Low	186 Å²	186	133.9 Å²	133.9	81%	0.809	70%	0.698	S	S	*	*			trans	-46	128.4	171.2	-68.9	-175.9	179.6	-179.6	0	108.1	T225 K229	T225-K227 PolarHBondContact O-N 2.53Å; K227-K229 PolarHBondContact O-N 3.3Å
228	P	53.2	Low	57.2	Low	126 Å²	126	138.7 Å²	138.7	82%	0.818	73%	0.73	S	S	*	*			trans	-62.2	105.6	177	24.4	-31.1	0	0	0	107.5	K230	P228-K230 PolarHBondContact O-N 3.47Å
229	K	57.3	Low	58.4	Low	191 Å²	191	139.8 Å²	139.8	83%	0.83	74%	0.74	S	S	*	*			trans	-59.1	122.5	164.2	-76.9	-175.9	177.2	178.6	0	105.2	K227 Q231	K227-K229 PolarHBondContact O-N 3.3Å; K229-Q231 VanDerWaalsContact C-N 3.35Å; K229-Q231 PolarHBondContact O-N 2.92Å
230	K	54.4	Low	59.5	Low	211 Å²	211	138.8 Å²	138.8	92%	0.917	73%	0.727	S	S	*	*			trans	-48.8	102.7	172.7	-80	-175.7	176.3	-179	0	107.7	P228 K232	P228-K230 PolarHBondContact O-N 3.47Å; K230-K232 PolarHBondContact O-N 2.69Å; K230-K232 VanDerWaalsContact O-N 3.13Å
231	Q	60	Low	60.7	Low	183 Å²	183	141.1 Å²	141.1	86%	0.855	74%	0.744	S	S	*	*			trans	-68.4	113.4	176.4	-70.7	-176.8	-13	0	0	105.7	K229	K229-Q231 VanDerWaalsContact C-N 3.35Å; K229-Q231 PolarHBondContact O-N 2.92Å
232	K	64.3	Low	61.9	Low	187 Å²	187	146.5 Å²	146.5	81%	0.813	76%	0.762	S	S	*	*			trans	-50.5	142.7	159.2	-77.9	-177.8	174.5	-179.7	0	106.7	K230 V234	K230-K232 PolarHBondContact O-N 2.69Å; K230-K232 VanDerWaalsContact O-N 3.13Å; K232-V234 VanDerWaalsContact C-N 3.25Å; K232-V234 WeakPolarHBondContact O-CG2 3.41Å; K232-V234 PolarHBondContact O-N 2.86Å
233	R	58.9	Low	62.9	Low	261 Å²	261	145.1 Å²	145.1	99%	0.985	76%	0.758	S	S	*	*			trans	-56.4	91.8	176.1	-71.8	173.7	98.1	178.5	6.2	108.6
234	V	66.6	Low	63.9	Low	125 Å²	125	144.8 Å²	144.8	76%	0.758	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-76.2	136.7	170.5	-175.5	0	0	0	0	105.5	K232	K232-V234 VanDerWaalsContact C-N 3.25Å; K232-V234 WeakPolarHBondContact O-CG2 3.41Å; K232-V234 PolarHBondContact O-N 2.86Å
235	K	74.3	Confident	64.9	Low	186 Å²	186	148.2 Å²	148.2	81%	0.809	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-51	144.9	174.2	-67	-178.1	178.8	-178.5	0	109.1	A237	K235-A237 PolarHBondContact O-N 2.97Å
236	P	70.8	Confident	65.5	Low	125 Å²	125	144.7 Å²	144.7	81%	0.812	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-50.5	128.4	177.4	-22	30.8	0	0	0	109.4
237	A	74.8	Confident	65.7	Low	86 Å²	86	140.5 Å²	140.5	71%	0.711	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-56	138.6	172.3	0	0	0	0	0	108.2	K235 L239	K235-A237 PolarHBondContact O-N 2.97Å; A237-L239 PolarHBondContact O-N 3.49Å
238	P	78.9	Confident	65.9	Low	125 Å²	125	137 Å²	137	81%	0.812	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-52.3	139	175.5	-22.7	31.6	0	0	0	110.2
239	L	76.4	Confident	66.3	Low	160 Å²	160	135.5 Å²	135.5	84%	0.838	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-59.6	142.4	173.2	-70.2	170	0	0	0	109.2	A237	A237-L239 PolarHBondContact O-N 3.49Å
240	P	73.3	Confident	66.5	Low	48 Å²	48	129.5 Å²	129.5	31%	0.312	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-57.8	140.2	173.6	23.7	-31.7	0	0	0	109.6	L99 Q244 I245	L99-P240 HydrophobicContact CD2-CB 4.38Å; L99-P240 HydrophobicContact CD2-CG 4.39Å; P240-Q244 HydrophobicContact CB-CB 4.3Å; P240-I245 HydrophobicContact CB-CG2 4.21Å; P240-I245 HydrophobicContact CG-CG2 3.79Å
241	P	77.2	Confident	66.9	Low	67 Å²	67	126.7 Å²	126.7	44%	0.435	67%	0.667	S	S	.	*	P	Polyproline II helix	trans	-56.7	150.3	177.5	21.1	-32.6	0	0	0	111.2	S243 Q244	P241-S243 PolarHBondContact O-N 3.17Å; P241-S243 VanDerWaalsContact O-N 3.11Å; P241-Q244 HydrophobicContact CG-CB 4.27Å; P241-Q244 HydrophobicContact CG-CG 3.84Å; P241-Q244 WeakPolarHBondContact O-CA 3.23Å; P241-Q244 WeakPolarHBondContact O-CB 3.33Å; P241-Q244 PolarHBondContact O-N 2.9Å
242	K	70.1	Confident	67	Low	165 Å²	165	122.2 Å²	122.2	72%	0.717	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-54.3	-36.4	-176.2	-158.6	173.7	-178.9	-179.3	0	112.3	Q244 I245 S246	K242-Q244 PolarHBondContact O-N 3.08Å; K242-I245 HydrophobicContact CG-CG1 4.48Å; K242-I245 WeakPolarHBondContact O-CG1 3.3Å; K242-I245 PolarHBondContact O-N 3.23Å; K242-S246 WeakPolarHBondContact O-CB 3.21Å; K242-S246 PolarHBondContact O-N 3.43Å; K242-S246 PolarHBondContact O-OG 2.8Å
243	S	66.7	Low	66.7	Low	87 Å²	87	120.1 Å²	120.1	61%	0.608	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-60	-23.6	174.1	53.3	0	0	0	0	114.9	P241	P241-S243 PolarHBondContact O-N 3.17Å; P241-S243 VanDerWaalsContact O-N 3.11Å
244	Q	64.2	Low	67	Low	106 Å²	106	112.2 Å²	112.2	50%	0.495	62%	0.619	S	S	.	*	G	3₁₀ helix	trans	-88.3	-5.7	175.4	-73.2	-179	-5	0	0	113.6	L99 P240 P241 K242	L99-Q244 HydrophobicContact CD1-CB 4.48Å; P240-Q244 HydrophobicContact CB-CB 4.3Å; P241-Q244 HydrophobicContact CG-CB 4.27Å; P241-Q244 HydrophobicContact CG-CG 3.84Å; P241-Q244 WeakPolarHBondContact O-CA 3.23Å; P241-Q244 WeakPolarHBondContact O-CB 3.33Å; P241-Q244 PolarHBondContact O-N 2.9Å; K242-Q244 PolarHBondContact O-N 3.08Å
245	I	63.5	Low	67.2	Low	111 Å²	111	111.7 Å²	111.7	57%	0.569	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.1	-8.6	-176.1	58.1	169.7	0	0	0	114.1	P240 K242	P240-I245 HydrophobicContact CB-CG2 4.21Å; P240-I245 HydrophobicContact CG-CG2 3.79Å; K242-I245 HydrophobicContact CG-CG1 4.48Å; K242-I245 WeakPolarHBondContact O-CG1 3.3Å; K242-I245 PolarHBondContact O-N 3.23Å
246	S	58.2	Low	67.2	Low	65 Å²	65	106.6 Å²	106.6	46%	0.455	61%	0.605	S	S	.	*			trans	-128.1	46.9	-170.7	75.3	0	0	0	0	113.9	K242	K242-S246 WeakPolarHBondContact O-CB 3.21Å; K242-S246 PolarHBondContact O-N 3.43Å; K242-S246 PolarHBondContact O-OG 2.8Å
247	H	58.8	Low	67.4	Low	149 Å²	149	104.8 Å²	104.8	69%	0.69	59%	0.591	S	S	*	*	S	Bend	trans	-62.4	147.5	161.1	-66.8	88.5	0	0	0	108.5	C249	H247-C249 PolarHBondContact O-N 3.48Å
248	P	63.2	Low	67.8	Low	114 Å²	114	103.9 Å²	103.9	74%	0.74	58%	0.577	S	S	*	*			trans	-55.2	111.5	176.4	-19.5	30.2	0	0	0	108.8	Q250	P248-Q250 PolarHBondContact O-N 2.86Å
249	C	60.1	Low	67.9	Low	93 Å²	93	105.8 Å²	105.8	63%	0.628	57%	0.572	S	S	*	*			trans	-68.6	124.2	165	47.7	0	0	0	0	105.5	H247 F251	H247-C249 PolarHBondContact O-N 3.48Å; C249-F251 PolarHBondContact O-N 2.83Å
250	Q	62.4	Low	68.1	Low	65 Å²	65	104.7 Å²	104.7	30%	0.304	56%	0.563	S	S	.	*			trans	-69	59.8	172.3	-69.8	177.1	-85.4	0	0	109.8	G90 Q91 S94 P248 H252	G90-Q250 PolarHBondContact O-OE1 2.86Å; Q91-Q250 VanDerWaalsContact CA-OE1 3.31Å; S94-Q250 PolarHBondContact OG-OE1 2.83Å; P248-Q250 PolarHBondContact O-N 2.86Å; Q250-H252 PolarHBondContact O-N 2.99Å
251	F	61.7	Low	68.5	Low	153 Å²	153	104.3 Å²	104.3	67%	0.671	56%	0.558	S	S	*	*			trans	-70.8	118.2	-176.1	-175.9	-94.5	0	0	0	108.5	C249 H253	C249-F251 PolarHBondContact O-N 2.83Å; F251-H253 HydrophobicContact CD1-CB 4.49Å; F251-H253 HydrophobicContact CE1-CB 4.01Å
252	H	62.4	Low	68.6	Low	89 Å²	89	103 Å²	103	41%	0.412	55%	0.55	S	S	.	*			trans	-93.1	121.3	167.5	-99	99.5	0	0	0	108.8	Y87 Q250 V254	Y87-H252 PolarHBondContact OH-CE1 3.39Å; Q250-H252 PolarHBondContact O-N 2.99Å; H252-V254 PolarHBondContact O-N 3.17Å
253	H	58.9	Low	68.8	Low	142 Å²	142	103.7 Å²	103.7	66%	0.657	56%	0.556	S	S	*	*			trans	-79.8	102.9	173.4	-172.3	-135.7	0	0	0	109.1	F251 T255	F251-H253 HydrophobicContact CD1-CB 4.49Å; F251-H253 HydrophobicContact CE1-CB 4.01Å; H253-T255 VanDerWaalsContact CE1-CG2 3.49Å; H253-T255 WeakPolarHBondContact CE1-CG2 3.4Å; H253-T255 WeakPolarHBondContact ND1-CG2 3.48Å; H253-T255 PolarHBondContact O-N 3.39Å
254	V	65.4	Low	69.4	Low	95 Å²	95	104.5 Å²	104.5	58%	0.576	55%	0.546	S	S	*	.			trans	-85.3	104.4	172.8	-175.2	0	0	0	0	107.9	H252 S256 V257	H252-V254 PolarHBondContact O-N 3.17Å; V254-S256 WeakPolarHBondContact CG1-O 3.37Å; V254-V257 HydrophobicContact CG1-CG2 3.56Å
255	T	69.6	Low	70.2	Confident	115 Å²	115	101.4 Å²	101.4	71%	0.706	53%	0.53	S	S	*	.			trans	-81.9	-24.5	-178.1	49.8	0	0	0	0	113.2	H253	H253-T255 VanDerWaalsContact CE1-CG2 3.49Å; H253-T255 WeakPolarHBondContact CE1-CG2 3.4Å; H253-T255 WeakPolarHBondContact ND1-CG2 3.48Å; H253-T255 PolarHBondContact O-N 3.39Å
256	S	74.4	Confident	71.1	Confident	79 Å²	79	99.5 Å²	99.5	55%	0.552	52%	0.516	S	S	*	.			trans	-152.2	141.9	176.2	59.6	0	0	0	0	110.3	V254	V254-S256 WeakPolarHBondContact CG1-O 3.37Å
257	V	75.7	Confident	72.2	Confident	86 Å²	86	97.9 Å²	97.9	52%	0.521	51%	0.505	S	S	.	.			trans	-117.1	124	170.4	173.7	0	0	0	0	106.6	V254 M268	V254-V257 HydrophobicContact CG1-CG2 3.56Å; V257-M268 HydrophobicContact CG1-CE 3.21Å; V257-M268 HydrophobicContact CG1-CG 4.32Å; V257-M268 HydrophobicContact CG1-SD 3.23Å; V257-M268 WeakPolarHBondContact CG1-SD 3.5Å
258	V	82.9	Confident	73.2	Confident	68 Å²	68	92.7 Å²	92.7	41%	0.412	48%	0.481	S	S	.	.			trans	-110.5	162.1	-177.5	-61.9	0	0	0	0	110.9	E260 D261 M268	V258-E260 WeakPolarHBondContact CB-OE2 3.37Å; V258-E260 HydrophobicContact CG2-CB 4.15Å; V258-E260 WeakPolarHBondContact CG2-OE2 3.25Å; V258-E260 PolarHBondContact O-N 2.95Å; V258-E260 VanDerWaalsContact O-N 3.14Å; V258-D261 WeakPolarHBondContact CG2-OD2 3.21Å; V258-D261 PolarHBondContact N-OD2 3.31Å; V258-D261 VanDerWaalsContact O-CB 3.32Å; V258-D261 WeakPolarHBondContact O-CB 3.13Å; V258-D261 PolarHBondContact O-N 3.15Å; V258-M268 VanDerWaalsContact O-CE 3.26Å; V258-M268 WeakPolarHBondContact O-CE 3.41Å
259	K	80.4	Confident	74	Confident	164 Å²	164	89.9 Å²	89.9	71%	0.713	46%	0.458	S	S	*	.	G	3₁₀ helix	trans	-59.8	-31.4	-175.3	-174.1	-177.4	174.9	-171	0	112.1	D261 S262	K259-D261 PolarHBondContact O-N 3.05Å; K259-S262 VanDerWaalsContact O-CB 3.27Å; K259-S262 WeakPolarHBondContact O-CB 3.18Å; K259-S262 PolarHBondContact O-N 3.38Å; K259-S262 VanDerWaalsContact O-N 3.13Å; K259-S262 PolarHBondContact O-OG 3.15Å
260	E	81.5	Confident	74.4	Confident	138 Å²	138	89.2 Å²	89.2	65%	0.645	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-64.9	-23.3	179.3	-62.4	67.3	-145.9	0	0	112	V258 S262	V258-E260 WeakPolarHBondContact CB-OE2 3.37Å; V258-E260 HydrophobicContact CG2-CB 4.15Å; V258-E260 WeakPolarHBondContact CG2-OE2 3.25Å; V258-E260 PolarHBondContact O-N 2.95Å; V258-E260 VanDerWaalsContact O-N 3.14Å; E260-S262 PolarHBondContact O-N 3.15Å
261	D	81.6	Confident	74.7	Confident	40 Å²	40	95.1 Å²	95.1	21%	0.214	49%	0.485	C	S	.	.	G	3₁₀ helix	trans	-70.1	-11.1	175.3	-64.9	-44.8	0	0	0	113	V258 K259 E263 R264 Y265 M268	V258-D261 WeakPolarHBondContact CG2-OD2 3.21Å; V258-D261 PolarHBondContact N-OD2 3.31Å; V258-D261 VanDerWaalsContact O-CB 3.32Å; V258-D261 WeakPolarHBondContact O-CB 3.13Å; V258-D261 PolarHBondContact O-N 3.15Å; K259-D261 PolarHBondContact O-N 3.05Å; D261-E263 PolarHBondContact O-N 3.42Å; D261-R264 WeakPolarHBondContact O-CA 3.27Å; D261-R264 WeakPolarHBondContact O-CB 3.38Å; D261-R264 PolarHBondContact O-N 2.84Å; D261-Y265 HydrophobicContact CB-CD2 4.01Å; D261-Y265 HydrophobicContact CB-CE2 4.27Å; D261-Y265 PolarHBondContact O-N 3.22Å; D261-M268 HydrophobicContact CB-CE 4.01Å; D261-M268 HydrophobicContact CB-SD 3.49Å; D261-M268 WeakPolarHBondContact CB-SD 3.4Å
262	S	78.4	Confident	74.9	Confident	38 Å²	38	89.6 Å²	89.6	27%	0.266	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-64.4	-22.1	178.3	61.7	0	0	0	0	114.2	K259 E260 R264 Q269	K259-S262 VanDerWaalsContact O-CB 3.27Å; K259-S262 WeakPolarHBondContact O-CB 3.18Å; K259-S262 PolarHBondContact O-N 3.38Å; K259-S262 VanDerWaalsContact O-N 3.13Å; K259-S262 PolarHBondContact O-OG 3.15Å; E260-S262 PolarHBondContact O-N 3.15Å; S262-R264 VanDerWaalsContact C-N 3.32Å; S262-Q269 WeakPolarHBondContact O-CG 3.28Å; S262-Q269 PolarHBondContact O-NE2 3.08Å
263	E	75.8	Confident	75.1	Confident	181 Å²	181	90.7 Å²	90.7	85%	0.846	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-74.5	-28.3	171.6	-64.2	-173.9	176.2	0	0	111.7	D261	D261-E263 PolarHBondContact O-N 3.42Å
264	R	77.5	Confident	75.2	Confident	103 Å²	103	89.9 Å²	89.9	39%	0.389	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-37.1	-177.8	-168.1	177.3	-173.1	-172.5	2.3	112.7	D261 S262	D261-R264 WeakPolarHBondContact O-CA 3.27Å; D261-R264 WeakPolarHBondContact O-CB 3.38Å; D261-R264 PolarHBondContact O-N 2.84Å; S262-R264 VanDerWaalsContact C-N 3.32Å
265	Y	81.9	Confident	74.7	Confident	42 Å²	42	89.3 Å²	89.3	17%	0.165	49%	0.486	C	S	.	.			trans	-118	110.2	-176.1	-54.8	-55.8	0	0	0	111.3	E153 D261 S267 M268	E153-Y265 HydrophobicContact CG-CD1 4.24Å; E153-Y265 VanDerWaalsContact OE1-CA 3.28Å; E153-Y265 WeakPolarHBondContact OE1-CA 3.47Å; D261-Y265 HydrophobicContact CB-CD2 4.01Å; D261-Y265 HydrophobicContact CB-CE2 4.27Å; D261-Y265 PolarHBondContact O-N 3.22Å; Y265-S267 PolarHBondContact O-N 2.51Å; Y265-M268 HydrophobicContact CD2-SD 3.97Å; Y265-M268 WeakPolarHBondContact O-CB 3.48Å; Y265-M268 PolarHBondContact O-N 3.17Å; Y265-M268 VanDerWaalsContact O-N 3.07Å
266	Y	81.7	Confident	73.8	Confident	70 Å²	70	89 Å²	89	28%	0.275	49%	0.487	S	S	.	.	H	α-helix	trans	-50.9	-38	166.9	-86.1	-79.7	0	0	0	112.9	F126 E153 L160 M268 Q269	F126-Y266 HydrophobicContact CD1-CD1 4.25Å; E153-Y266 VanDerWaalsContact OE1-CA 3.29Å; E153-Y266 WeakPolarHBondContact OE1-CA 3.19Å; E153-Y266 WeakPolarHBondContact OE1-CB 3.35Å; E153-Y266 PolarHBondContact OE1-N 3.3Å; L160-Y266 HydrophobicContact CD1-CD2 4.37Å; Y266-M268 PolarHBondContact O-N 3.38Å; Y266-M268 VanDerWaalsContact O-N 3.15Å; Y266-Q269 WeakPolarHBondContact O-CB 3.3Å; Y266-Q269 PolarHBondContact O-N 2.72Å
267	S	81.2	Confident	72.8	Confident	31 Å²	31	93 Å²	93	22%	0.217	50%	0.497	C	S	.	.	H	α-helix	trans	-58.8	-27	178.9	59.2	0	0	0	0	113.1	E153 Y265 F271	E153-S267 PolarHBondContact OE1-N 2.81Å; E153-S267 PolarHBondContact OE1-OG 3.13Å; E153-S267 WeakPolarHBondContact OE2-CB 3.3Å; E153-S267 PolarHBondContact OE2-OG 2.78Å; Y265-S267 PolarHBondContact O-N 2.51Å; S267-F271 WeakPolarHBondContact O-CD2 3.4Å; S267-F271 WeakPolarHBondContact O-CE2 3.44Å
268	M	81.1	Confident	71.4	Confident	41 Å²	41	93.9 Å²	93.9	20%	0.202	50%	0.495	C	S	.	.	H	α-helix	trans	-81.3	-29.9	174.1	-67.3	-174.6	58.8	0	0	113.5	V257 V258 D261 Y265 Y266 A270 F271 G272	V257-M268 HydrophobicContact CG1-CE 3.21Å; V257-M268 HydrophobicContact CG1-CG 4.32Å; V257-M268 HydrophobicContact CG1-SD 3.23Å; V257-M268 WeakPolarHBondContact CG1-SD 3.5Å; V258-M268 VanDerWaalsContact O-CE 3.26Å; V258-M268 WeakPolarHBondContact O-CE 3.41Å; D261-M268 HydrophobicContact CB-CE 4.01Å; D261-M268 HydrophobicContact CB-SD 3.49Å; D261-M268 WeakPolarHBondContact CB-SD 3.4Å; Y265-M268 HydrophobicContact CD2-SD 3.97Å; Y265-M268 WeakPolarHBondContact O-CB 3.48Å; Y265-M268 PolarHBondContact O-N 3.17Å; Y265-M268 VanDerWaalsContact O-N 3.07Å; Y266-M268 PolarHBondContact O-N 3.38Å; Y266-M268 VanDerWaalsContact O-N 3.15Å; M268-A270 PolarHBondContact O-N 3.28Å; M268-F271 PolarHBondContact O-N 3.25Å; M268-F271 VanDerWaalsContact O-N 3.08Å; M268-G272 PolarHBondContact O-N 2.94Å
269	Q	78.6	Confident	69.3	Low	55 Å²	55	99 Å²	99	26%	0.257	51%	0.514	S	S	.	.	H	α-helix	trans	-62.7	-26.1	178.1	-60	-179.9	7.5	0	0	111.8	S262 Y266 F271 G272	S262-Q269 WeakPolarHBondContact O-CG 3.28Å; S262-Q269 PolarHBondContact O-NE2 3.08Å; Y266-Q269 WeakPolarHBondContact O-CB 3.3Å; Y266-Q269 PolarHBondContact O-N 2.72Å; Q269-F271 PolarHBondContact O-N 2.93Å; Q269-F271 VanDerWaalsContact O-N 3.17Å; Q269-G272 PolarHBondContact O-N 3.2Å; Q269-G272 VanDerWaalsContact O-N 3.15Å
270	A	69.8	Low	67	Low	79 Å²	79	105.5 Å²	105.5	65%	0.653	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.3	174.6	0	0	0	0	0	113.8	M268	M268-A270 PolarHBondContact O-N 3.28Å
271	F	68.7	Low	66.3	Low	189 Å²	189	103.9 Å²	103.9	83%	0.829	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.2	-0.7	-179.7	-54.2	-74.9	0	0	0	112.9	S267 M268 Q269	S267-F271 WeakPolarHBondContact O-CD2 3.4Å; S267-F271 WeakPolarHBondContact O-CE2 3.44Å; M268-F271 PolarHBondContact O-N 3.25Å; M268-F271 VanDerWaalsContact O-N 3.08Å; Q269-F271 PolarHBondContact O-N 2.93Å; Q269-F271 VanDerWaalsContact O-N 3.17Å
272	G	66.3	Low	65.5	Low	36 Å²	36	107.3 Å²	107.3	37%	0.371	55%	0.545	S	S	.	.	S	Bend	trans	-84.4	164	174.3	0	0	0	0	0	112.4	M268 Q269	M268-G272 PolarHBondContact O-N 2.94Å; Q269-G272 PolarHBondContact O-N 3.2Å; Q269-G272 VanDerWaalsContact O-N 3.15Å
273	P	66.4	Low	64.8	Low	113 Å²	113	111.1 Å²	111.1	73%	0.734	56%	0.561	S	S	*	*	S	Bend	trans	-56.8	140.5	169.1	24.2	-31.3	0	0	0	109.7	N275	P273-N275 PolarHBondContact O-N 2.94Å; P273-N275 VanDerWaalsContact O-N 3.15Å
274	P	59.7	Low	64.1	Low	125 Å²	125	107 Å²	107	81%	0.812	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-55.9	122.4	-172.5	19.8	-31.2	0	0	0	110.7	P276	P274-P276 VanDerWaalsContact O-CD 3.28Å; P274-P276 WeakPolarHBondContact O-CD 3.28Å
275	N	56.8	Low	63.3	Low	82 Å²	82	107.3 Å²	107.3	44%	0.439	55%	0.554	S	S	.	*			trans	-75.8	115.4	179	-163.5	-7.5	0	0	0	108.6	P273 Q277 Q278	P273-N275 PolarHBondContact O-N 2.94Å; P273-N275 VanDerWaalsContact O-N 3.15Å; N275-Q277 PolarHBondContact O-N 3.39Å; N275-Q278 PolarHBondContact O-N 3.4Å
276	P	49.7	Very low	62.1	Low	110 Å²	110	111.6 Å²	111.6	71%	0.714	58%	0.58	S	S	*	*	G	3₁₀ helix	trans	-64.4	-6.6	-172.8	22.5	-32.3	0	0	0	114.5	P274	P274-P276 VanDerWaalsContact O-CD 3.28Å; P274-P276 WeakPolarHBondContact O-CD 3.28Å
277	Q	52.5	Low	60.7	Low	162 Å²	162	114.6 Å²	114.6	76%	0.757	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-86.4	-10.8	178	-65	-171	-15.4	0	0	114.7	N275 H279	N275-Q277 PolarHBondContact O-N 3.39Å; Q277-H279 VanDerWaalsContact C-N 3.25Å; Q277-H279 PolarHBondContact O-N 3.48Å
278	Q	47.9	Very low	59.1	Low	105 Å²	105	121 Å²	121	49%	0.491	63%	0.631	S	S	.	*	G	3₁₀ helix	trans	-80.9	-0.5	177.7	-71.7	-176.6	-7	0	0	114	N275	N275-Q278 PolarHBondContact O-N 3.4Å
279	H	38.5	Very low	57.2	Low	175 Å²	175	127.7 Å²	127.7	81%	0.81	67%	0.667	S	S	*	*	G	3₁₀ helix	trans	-120.1	24.9	-176.6	-91	-71.1	0	0	0	114.2	Q277	Q277-H279 VanDerWaalsContact C-N 3.25Å; Q277-H279 PolarHBondContact O-N 3.48Å
280	R	32.2	Very low	55.3	Low	301 Å²	301	134.3 Å²	134.3	100%	1.136	70%	0.704	S	S	*	*			trans	-115.6	0	172.3	-102.9	-171	-179.4	-177.9	1.4	112.6

Retrieved 280 of 280 residues in 138.5 ms (Link to these results)

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