A0A093K0Y1_STRCA Loading...

Complement C1q tumor necrosis factor-related protein 3

AlphaFold DB , UniProt , Accession A0A093K0Y1, Species STRCA (Struthio camelus australis), Gene n/a, Length 246 aa.

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(Predicted Aligned Error values between residue pairs)

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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	33.4	Very low	34.7	Very low	234 Å²	234	155.8 Å²	155.8	100%	1.153	78%	0.777	S	S	*	*				0	109.4	0	-172.3	-175.6	-64.7	0	0	106.1
2	A	35.7	Very low	35.1	Very low	92 Å²	92	156.1 Å²	156.1	76%	0.76	78%	0.781	S	S	*	*			trans	59.5	144.9	165.4	0	0	0	0	0	117.8
3	E	33	Very low	35.4	Very low	142 Å²	142	151.7 Å²	151.7	66%	0.664	78%	0.784	S	S	*	*			cis	178.2	138.4	-5	173.2	173.7	166.7	0	0	106.2
4	K	35.4	Very low	36.1	Very low	179 Å²	179	152.9 Å²	152.9	78%	0.778	79%	0.791	S	S	*	*			trans	69.6	118.1	153.2	-72.6	168.9	-170.8	165.8	0	121.3
5	D	41.8	Very low	36.1	Very low	163 Å²	163	154.6 Å²	154.6	87%	0.872	79%	0.791	S	S	*	*			trans	-57.6	129.5	162.4	-63.5	-55.8	0	0	0	113.4
6	F	34.6	Very low	36.3	Very low	187 Å²	187	156.1 Å²	156.1	82%	0.82	79%	0.79	S	S	*	*			trans	-153.2	107.5	160.8	-142.6	-108.3	0	0	0	110.9
7	I	37	Very low	36.4	Very low	127 Å²	127	155.1 Å²	155.1	65%	0.651	79%	0.787	S	S	*	*			trans	68.9	113.6	138.1	-57.5	-167.8	0	0	0	120.2
8	S	31.6	Very low	36.6	Very low	81 Å²	81	153.6 Å²	153.6	57%	0.566	79%	0.789	S	S	*	*			trans	75	121.9	134.9	-158.1	0	0	0	0	119.4
9	W	29	Very low	36.7	Very low	205 Å²	205	154.3 Å²	154.3	78%	0.777	79%	0.786	S	S	*	*				177.5	128.5	90.6	-92.7	81.8	0	0	0	108.4
10	H	35.5	Very low	36.5	Very low	145 Å²	145	152.9 Å²	152.9	67%	0.671	79%	0.789	S	S	*	*			trans	53.8	119.2	153.9	-60	-19.9	0	0	0	121.5
11	L	34.6	Very low	36.6	Very low	159 Å²	159	152.4 Å²	152.4	83%	0.832	79%	0.787	S	S	*	*				-171.8	137.2	124.1	-100.8	153.7	0	0	0	111
12	L	39.1	Very low	36.8	Very low	159 Å²	159	147.4 Å²	147.4	83%	0.832	77%	0.774	S	S	*	*			trans	69.3	98.8	152.8	-75.2	145.5	0	0	0	119.4
13	A	40.2	Very low	36.8	Very low	99 Å²	99	151 Å²	151	82%	0.818	78%	0.775	S	S	*	*				179.5	87.3	118.9	0	0	0	0	0	110.9	F15	A13-F15 PolarHBondContact O-N 3.43Å
14	L	44.6	Very low	37	Very low	168 Å²	168	151.1 Å²	151.1	88%	0.88	78%	0.78	S	S	*	*			trans	-67.3	115.8	144.1	-82.2	160.6	0	0	0	106.5
15	F	36.6	Very low	37.1	Very low	179 Å²	179	151.1 Å²	151.1	79%	0.785	78%	0.783	S	S	*	*			trans	-171.5	120.2	143.5	-99.8	-59.5	0	0	0	111.5	A13	A13-F15 PolarHBondContact O-N 3.43Å
16	F	38	Very low	37	Very low	178 Å²	178	153.9 Å²	153.9	78%	0.781	78%	0.783	S	S	*	*			trans	70.1	79.1	157.7	-61.7	-68.2	0	0	0	120.1
17	L	39.1	Very low	37.1	Very low	140 Å²	140	153.9 Å²	153.9	73%	0.733	79%	0.787	S	S	*	*			trans	-79.3	133.4	140.9	-72.9	163.6	0	0	0	108.8	F19	L17-F19 HydrophobicContact CB-CD2 4.05Å; L17-F19 HydrophobicContact CB-CE2 4.43Å; L17-F19 HydrophobicContact CD1-CD2 4.32Å; L17-F19 HydrophobicContact CD1-CE2 3.89Å; L17-F19 PolarHBondContact O-N 3.12Å; L17-F19 VanDerWaalsContact O-N 3.14Å
18	P	39.7	Very low	37.2	Very low	127 Å²	127	156.5 Å²	156.5	83%	0.825	80%	0.797	S	S	*	*			trans	-80.5	89.4	162	31.9	-26.6	0	0	0	108.1	C20	P18-C20 PolarHBondContact O-N 3.33Å
19	F	37.7	Very low	37.5	Very low	168 Å²	168	158 Å²	158	74%	0.737	81%	0.805	S	S	*	*			trans	-73.1	103.4	157.3	-94.9	-88.5	0	0	0	107.5	L17 L21	L17-F19 HydrophobicContact CB-CD2 4.05Å; L17-F19 HydrophobicContact CB-CE2 4.43Å; L17-F19 HydrophobicContact CD1-CD2 4.32Å; L17-F19 HydrophobicContact CD1-CE2 3.89Å; L17-F19 PolarHBondContact O-N 3.12Å; L17-F19 VanDerWaalsContact O-N 3.14Å; F19-L21 VanDerWaalsContact C-N 3.34Å; F19-L21 PolarHBondContact O-N 3.38Å; F19-L21 VanDerWaalsContact O-N 3.11Å
20	C	33.8	Very low	37.9	Very low	126 Å²	126	154.4 Å²	154.4	85%	0.851	81%	0.808	S	S	*	*			trans	-76.8	91.1	166	-159.2	0	0	0	0	107.5	P18 C22	P18-C20 PolarHBondContact O-N 3.33Å; C20-C22 PolarHBondContact O-N 3.46Å
21	L	38.7	Very low	38	Very low	143 Å²	143	155.7 Å²	155.7	75%	0.749	81%	0.814	S	S	*	*			trans	-70.3	106.1	166.9	-71.1	165.6	0	0	0	107.9	F19	F19-L21 VanDerWaalsContact C-N 3.34Å; F19-L21 PolarHBondContact O-N 3.38Å; F19-L21 VanDerWaalsContact O-N 3.11Å
22	C	37.6	Very low	38.1	Very low	129 Å²	129	154.7 Å²	154.7	87%	0.872	82%	0.815	S	S	*	*			trans	-85.8	102.7	159.8	-157.1	0	0	0	0	106.1	C20	C20-C22 PolarHBondContact O-N 3.46Å
23	Q	34.9	Very low	38	Very low	167 Å²	167	150.6 Å²	150.6	78%	0.78	81%	0.811	S	S	*	*			trans	-76.1	133.4	170	-78.5	179	-46.9	0	0	109.1	E25	Q23-E25 PolarHBondContact O-N 3.42Å; Q23-E25 VanDerWaalsContact O-N 3.14Å
24	D	38.4	Very low	38.4	Very low	145 Å²	145	151.5 Å²	151.5	78%	0.775	81%	0.809	S	S	*	*			trans	-60.7	102	163.2	-78.3	-45.2	0	0	0	109.5	Y26	D24-Y26 HydrophobicContact CB-CE2 4.44Å
25	E	36.4	Very low	38.3	Very low	179 Å²	179	152.5 Å²	152.5	84%	0.836	81%	0.809	S	S	*	*			trans	-86.8	110	158.2	-80.5	-167.7	146.7	0	0	109	Q23 M27	Q23-E25 PolarHBondContact O-N 3.42Å; Q23-E25 VanDerWaalsContact O-N 3.14Å; E25-M27 PolarHBondContact O-N 2.81Å
26	Y	39.6	Very low	38.9	Very low	221 Å²	221	151.3 Å²	151.3	87%	0.867	81%	0.811	S	S	*	*			trans	-64.2	114.9	166.7	-75.7	-100.6	0	0	0	109.4	D24	D24-Y26 HydrophobicContact CB-CE2 4.44Å
27	M	37	Very low	39.5	Very low	186 Å²	186	148.8 Å²	148.8	92%	0.916	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-93	119.3	165.7	-86.9	177.4	159.7	0	0	110.1	E25	E25-M27 PolarHBondContact O-N 2.81Å
28	E	39.2	Very low	40	Very low	183 Å²	183	147.5 Å²	147.5	86%	0.855	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-61.4	148.4	167.4	-86.9	179.3	142.2	0	0	112
29	P	37	Very low	40.6	Very low	113 Å²	113	146.1 Å²	146.1	73%	0.734	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-87.7	131.3	178.6	33.3	-29.7	0	0	0	111.3
30	P	39.3	Very low	41.6	Very low	129 Å²	129	140.5 Å²	140.5	84%	0.838	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-83.7	126.5	163.7	28.9	-23.6	0	0	0	109.8
31	Q	37.4	Very low	42.6	Very low	171 Å²	171	139.4 Å²	139.4	80%	0.799	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-87.7	147.3	168.9	-66.3	-147.4	-14.4	0	0	112.9
32	T	36.3	Very low	43.1	Very low	138 Å²	138	138.4 Å²	138.4	85%	0.847	77%	0.773	S	S	*	*			trans	87	116.1	154.6	71.9	0	0	0	0	119.2
33	G	36.1	Very low	43.5	Very low	74 Å²	74	137.4 Å²	137.4	76%	0.763	77%	0.766	S	S	*	*			trans	149.5	122	164.2	0	0	0	0	0	112.7
34	P	49.5	Very low	43.9	Very low	117 Å²	117	138.2 Å²	138.2	76%	0.76	76%	0.762	S	S	*	*			trans	-89.9	136.7	-161.7	34.8	-31.2	0	0	0	112.1
35	Q	41.2	Very low	44.2	Very low	189 Å²	189	133.6 Å²	133.6	88%	0.883	75%	0.749	S	S	*	*			trans	-176.8	107.7	140.1	-99.1	151.6	60.9	0	0	109.2
36	N	49	Very low	44.6	Very low	154 Å²	154	132.6 Å²	132.6	82%	0.824	75%	0.75	S	S	*	*			trans	-52.6	138.5	159.3	-79.8	-31.5	0	0	0	108.3	D38	N36-D38 PolarHBondContact O-N 3.45Å
37	P	52.5	Low	45.1	Very low	126 Å²	126	130.9 Å²	130.9	82%	0.818	75%	0.747	S	S	*	*			trans	-60.8	112.9	167.5	25	-30.1	0	0	0	107.6	C39	P37-C39 PolarHBondContact O-N 2.85Å
38	D	49.6	Very low	45.4	Very low	112 Å²	112	125.4 Å²	125.4	60%	0.599	74%	0.738	S	S	*	*			trans	-65.3	107.7	-177.5	-176.1	10	0	0	0	109.8	N36 S40	N36-D38 PolarHBondContact O-N 3.45Å; D38-S40 PolarHBondContact O-N 3.24Å; D38-S40 VanDerWaalsContact O-N 3.1Å; D38-S40 WeakPolarHBondContact OD1-CB 3.33Å; D38-S40 PolarHBondContact OD1-N 2.84Å; D38-S40 PolarHBondContact OD1-OG 3.48Å; D38-S40 VanDerWaalsContact OD1-OG 3.07Å; D38-S40 WeakPolarHBondContact OD2-CB 3.32Å; D38-S40 PolarHBondContact OD2-OG 2.91Å
39	C	51.8	Low	45.9	Very low	98 Å²	98	123 Å²	123	66%	0.662	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	1.2	175.9	-162.4	0	0	0	0	112.5	P37 T41	P37-C39 PolarHBondContact O-N 2.85Å; C39-T41 PolarHBondContact O-N 3.01Å
40	S	59	Low	46.4	Very low	51 Å²	51	128.9 Å²	128.9	36%	0.357	74%	0.743	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.3	-13.6	178.7	80.4	0	0	0	0	114.8	D38	D38-S40 PolarHBondContact O-N 3.24Å; D38-S40 VanDerWaalsContact O-N 3.1Å; D38-S40 WeakPolarHBondContact OD1-CB 3.33Å; D38-S40 PolarHBondContact OD1-N 2.84Å; D38-S40 PolarHBondContact OD1-OG 3.48Å; D38-S40 VanDerWaalsContact OD1-OG 3.07Å; D38-S40 WeakPolarHBondContact OD2-CB 3.32Å; D38-S40 PolarHBondContact OD2-OG 2.91Å
41	T	54.2	Low	46.3	Very low	103 Å²	103	129.2 Å²	129.2	63%	0.632	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-22.5	-174.8	-34.3	0	0	0	0	113.5	C39	C39-T41 PolarHBondContact O-N 3.01Å
42	C	49.9	Very low	46.8	Very low	122 Å²	122	132.7 Å²	132.7	82%	0.824	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-26.3	178.6	-141.6	0	0	0	0	112.3	R44	C42-R44 VanDerWaalsContact C-N 3.31Å
43	C	44.9	Very low	47.3	Very low	107 Å²	107	134.5 Å²	134.5	72%	0.723	74%	0.743	S	S	*	*	S	Bend	trans	-86	3.9	175.7	-65	0	0	0	0	113.9	G45	C43-G45 PolarHBondContact O-N 3.01Å
44	R	43.3	Very low	48	Very low	184 Å²	184	133.8 Å²	133.8	69%	0.694	74%	0.736	S	S	*	*			trans	-84.4	65.4	173.6	-148	178.8	-68	-174.9	1.2	109.4	C42 D46	C42-R44 VanDerWaalsContact C-N 3.31Å; R44-D46 VanDerWaalsContact C-N 3.33Å; R44-D46 PolarHBondContact O-N 2.77Å
45	G	45.6	Very low	48.1	Very low	49 Å²	49	134.1 Å²	134.1	51%	0.505	74%	0.738	S	S	.	*			trans	-62.3	102.2	157.8	0	0	0	0	0	107	C43 F47	C43-G45 PolarHBondContact O-N 3.01Å; G45-F47 PolarHBondContact O-N 2.89Å
46	D	44.7	Very low	48.5	Very low	158 Å²	158	131.2 Å²	131.2	85%	0.845	74%	0.736	S	S	*	*			trans	-72.4	50.3	165.7	-134.7	5.6	0	0	0	108.6	R44 G48	R44-D46 VanDerWaalsContact C-N 3.33Å; R44-D46 PolarHBondContact O-N 2.77Å; D46-G48 VanDerWaalsContact C-N 3.31Å; D46-G48 PolarHBondContact O-N 2.9Å; D46-G48 VanDerWaalsContact O-N 3.16Å
47	F	50.8	Low	48.5	Very low	185 Å²	185	127 Å²	127	81%	0.811	73%	0.729	S	S	*	*			trans	-76.5	96.8	160.5	-77.5	-78.5	0	0	0	104.7	G45 V49	G45-F47 PolarHBondContact O-N 2.89Å; F47-V49 VanDerWaalsContact C-N 3.27Å; F47-V49 PolarHBondContact O-N 3.1Å
48	G	43.2	Very low	48.7	Very low	70 Å²	70	126.9 Å²	126.9	72%	0.722	73%	0.728	S	S	*	*			trans	-51.2	96.5	169.9	0	0	0	0	0	109.4	D46 R50	D46-G48 VanDerWaalsContact C-N 3.31Å; D46-G48 PolarHBondContact O-N 2.9Å; D46-G48 VanDerWaalsContact O-N 3.16Å; G48-R50 PolarHBondContact O-N 3.43Å
49	V	48.3	Very low	49	Very low	132 Å²	132	127.5 Å²	127.5	80%	0.8	74%	0.738	S	S	*	*			trans	-68.1	79.7	166.2	-177.1	0	0	0	0	105.7	F47 L51	F47-V49 VanDerWaalsContact C-N 3.27Å; F47-V49 PolarHBondContact O-N 3.1Å; V49-L51 PolarHBondContact O-N 3.47Å
50	R	47.1	Very low	48.9	Very low	237 Å²	237	126 Å²	126	89%	0.894	74%	0.739	S	S	*	*			trans	-69.3	96.5	159.3	-90	-170.8	174.4	-170.8	-0.3	106.1	G48 Y52	G48-R50 PolarHBondContact O-N 3.43Å; R50-Y52 PolarHBondContact O-N 2.86Å
51	L	37.6	Very low	48.7	Very low	137 Å²	137	129.3 Å²	129.3	72%	0.717	76%	0.759	S	S	*	*			trans	9.9	113.2	144.6	-59.4	168.6	0	0	0	112.9	V49 Q53	V49-L51 PolarHBondContact O-N 3.47Å; L51-Q53 PolarHBondContact O-N 3.41Å
52	Y	48.7	Very low	49.2	Very low	244 Å²	244	130.4 Å²	130.4	96%	0.957	77%	0.768	S	S	*	*			trans	-56.6	87.1	155.4	-81.5	-92.3	0	0	0	107.8	R50 G54	R50-Y52 PolarHBondContact O-N 2.86Å; Y52-G54 PolarHBondContact O-N 3.5Å
53	Q	45.9	Very low	49.4	Very low	175 Å²	175	128.2 Å²	128.2	82%	0.818	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-67.7	125.1	164.8	-88.8	-179.2	-11.4	0	0	106.5	L51	L51-Q53 PolarHBondContact O-N 3.41Å
54	G	51.3	Low	49.5	Very low	59 Å²	59	131.7 Å²	131.7	61%	0.608	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-53.8	160.1	175.2	0	0	0	0	0	111.5	Y52	Y52-G54 PolarHBondContact O-N 3.5Å
55	P	51.3	Low	50.5	Low	125 Å²	125	128.7 Å²	128.7	81%	0.812	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-53	141.4	-178.8	22.9	-33.1	0	0	0	110.5	G57	P55-G57 PolarHBondContact O-N 3.01Å
56	P	49.8	Very low	51	Low	128 Å²	128	129.7 Å²	129.7	83%	0.831	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-50.1	137.7	172.9	-25.9	33.7	0	0	0	110.6
57	G	50.3	Low	51.2	Low	65 Å²	65	130 Å²	130	67%	0.67	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-57.5	153.5	179.1	0	0	0	0	0	112.1	P55	P55-G57 PolarHBondContact O-N 3.01Å
58	P	54.9	Low	51.8	Low	123 Å²	123	129.9 Å²	129.9	80%	0.799	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-58.5	155	177	25.7	-33.9	0	0	0	111.4	G60	P58-G60 PolarHBondContact O-N 2.88Å
59	P	55.9	Low	52.3	Low	126 Å²	126	130 Å²	130	82%	0.818	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-51.8	140.3	176.4	-24.9	33.4	0	0	0	112.1
60	G	51.4	Low	52.3	Low	66 Å²	66	131.5 Å²	131.5	68%	0.68	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-60.2	143.9	173.5	0	0	0	0	0	111.3	P58	P58-G60 PolarHBondContact O-N 2.88Å
61	P	54.1	Low	53.1	Low	121 Å²	121	127.7 Å²	127.7	79%	0.786	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-62.7	154.7	177.8	26.4	-33.7	0	0	0	111.4
62	P	64.6	Low	54	Low	126 Å²	126	124.4 Å²	124.4	82%	0.818	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-53.5	142.8	172.5	-23.7	33.2	0	0	0	111.9
63	G	53.9	Low	54.2	Low	75 Å²	75	120.7 Å²	120.7	77%	0.773	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-59.8	140	175.9	0	0	0	0	0	112
64	M	47.9	Very low	54.9	Low	181 Å²	181	120.2 Å²	120.2	89%	0.892	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-61.9	142.4	-179.2	-69.5	-179.6	69.6	0	0	111.6
65	P	63.4	Low	55.2	Low	121 Å²	121	120.9 Å²	120.9	79%	0.786	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-56.1	141.4	170.1	-21.9	32.3	0	0	0	111.5
66	G	56.3	Low	55.6	Low	69 Å²	69	120 Å²	120	71%	0.711	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-62.8	144.1	177.3	0	0	0	0	0	112.9
67	N	49.1	Very low	55.9	Low	165 Å²	165	121 Å²	121	88%	0.882	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-59.8	142.3	179.7	-73.6	-25.9	0	0	0	112.1
68	H	61.9	Low	56.1	Low	183 Å²	183	121.1 Å²	121.1	85%	0.847	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-66.9	137.7	170.4	-75.7	38.8	0	0	0	109.8
69	G	54.2	Low	56.1	Low	71 Å²	71	125 Å²	125	73%	0.732	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-69.8	140.2	176.4	0	0	0	0	0	111.6
70	N	49.2	Very low	55.8	Low	165 Å²	165	128.7 Å²	128.7	88%	0.882	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-62.3	136.8	178.8	-72.2	-17.1	0	0	0	111.4	G72	N70-G72 PolarHBondContact O-N 3.34Å
71	N	62.8	Low	55.9	Low	156 Å²	156	128.9 Å²	128.9	83%	0.834	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-60.9	133.4	170.5	-78.4	-12.4	0	0	0	110
72	G	57.4	Low	56	Low	68 Å²	68	128.4 Å²	128.4	70%	0.701	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-67	135.2	175.9	0	0	0	0	0	111.4	N70	N70-G72 PolarHBondContact O-N 3.34Å
73	N	53.3	Low	55.2	Low	166 Å²	166	132.2 Å²	132.2	89%	0.888	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-61.2	136.9	177.7	-69.7	-17.2	0	0	0	111.2	G75	N73-G75 PolarHBondContact O-N 2.8Å
74	N	59.9	Low	55.5	Low	165 Å²	165	131.9 Å²	131.9	88%	0.882	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-61.2	130.8	173.2	-73.7	-8.6	0	0	0	110.3
75	G	58.5	Low	55.9	Low	74 Å²	74	133.3 Å²	133.3	76%	0.763	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-68.7	146.2	177.7	0	0	0	0	0	112.4	N73	N73-G75 PolarHBondContact O-N 2.8Å
76	A	59	Low	55.5	Low	105 Å²	105	137 Å²	137	87%	0.868	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-62.1	140.2	179.1	0	0	0	0	0	112.3	G78	A76-G78 PolarHBondContact O-N 2.82Å
77	T	54.8	Low	55.7	Low	149 Å²	149	137 Å²	137	91%	0.914	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-62.2	120.4	-179	-41.2	0	0	0	0	111.3
78	G	55.7	Low	56.2	Low	68 Å²	68	137.1 Å²	137.1	70%	0.701	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-89.9	144.3	175.9	0	0	0	0	0	112.8	A76	A76-G78 PolarHBondContact O-N 2.82Å
79	Q	54.4	Low	56.2	Low	206 Å²	206	138 Å²	138	96%	0.963	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-69.3	147.5	174	-82.3	-175.3	-28.4	0	0	112.4
80	E	50.2	Low	56.6	Low	203 Å²	203	137.9 Å²	137.9	95%	0.949	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-77.6	136.4	-163.5	-164.7	173.1	-163.8	0	0	114.2
81	G	52.6	Low	57.3	Low	70 Å²	70	137.8 Å²	137.8	72%	0.722	84%	0.838	S	S	*	*			trans	-160.4	124.6	167	0	0	0	0	0	110.9	K83	G81-K83 PolarHBondContact O-N 2.91Å
82	A	57.2	Low	57.5	Low	111 Å²	111	139.4 Å²	139.4	92%	0.917	84%	0.843	S	S	*	*			trans	-74.6	116.6	-171.4	0	0	0	0	0	112.9
83	K	47.8	Very low	57.9	Low	206 Å²	206	139 Å²	139	90%	0.896	84%	0.839	S	S	*	*			trans	-161.4	129.2	166.8	-163.8	171.6	-177.7	178.1	0	113.6	G81	G81-K83 PolarHBondContact O-N 2.91Å
84	G	59.6	Low	58.6	Low	68 Å²	68	137.3 Å²	137.3	70%	0.701	84%	0.837	S	S	*	*			trans	51.5	119.1	151.3	0	0	0	0	0	119.3	K86	G84-K86 PolarHBondContact O-N 2.85Å; G84-K86 VanDerWaalsContact O-N 3.12Å
85	E	55.9	Low	59.3	Low	211 Å²	211	141.1 Å²	141.1	99%	0.986	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-56.2	117.1	171.1	-68.6	-174.3	151.6	0	0	110.7
86	K	55.3	Low	59.8	Low	198 Å²	198	140.8 Å²	140.8	86%	0.861	84%	0.836	S	S	*	*	P	Polyproline II helix	trans	-85.4	126.8	179.8	-172.8	177.8	-174.4	178.5	0	108	G84	G84-K86 PolarHBondContact O-N 2.85Å; G84-K86 VanDerWaalsContact O-N 3.12Å
87	G	61.8	Low	60.4	Low	69 Å²	69	145 Å²	145	71%	0.711	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-54.2	145.8	-179.4	0	0	0	0	0	113.3
88	D	59.2	Low	61.5	Low	167 Å²	167	148.6 Å²	148.6	89%	0.893	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-55.6	138.8	-173.6	-65.4	-42.4	0	0	0	112.4	G90	D88-G90 PolarHBondContact O-N 3.42Å
89	K	61.9	Low	62.2	Low	201 Å²	201	148.2 Å²	148.2	87%	0.874	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-68.9	123.9	178.6	-171	179.6	-176.1	-177.5	0	108.7
90	G	61.3	Low	63.1	Low	69 Å²	69	147.3 Å²	147.3	71%	0.711	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-56.8	144.5	179.6	0	0	0	0	0	113.2	D88	D88-G90 PolarHBondContact O-N 3.42Å
91	D	65.4	Low	64.5	Low	163 Å²	163	146.2 Å²	146.2	87%	0.872	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-60.1	145.1	-174.5	-66.3	-41.6	0	0	0	112.8
92	M	66.5	Low	65.5	Low	190 Å²	190	145.9 Å²	145.9	94%	0.936	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-66.6	133.5	177.6	-165.6	173.3	-178.4	0	0	110.2
93	G	66.6	Low	66.5	Low	59 Å²	59	146.9 Å²	146.9	61%	0.608	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-59.8	152.5	-179.2	0	0	0	0	0	113.2
94	P	67.3	Low	68	Low	131 Å²	131	146.9 Å²	146.9	85%	0.851	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-64.6	148.5	-176.5	26.4	-33.6	0	0	0	111.9
95	R	75.1	Confident	68.8	Low	245 Å²	245	146.7 Å²	146.7	93%	0.925	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-63.6	139.1	177.5	-175	178.3	-179.3	164.6	3.5	110.6
96	G	68.6	Low	70	Confident	68 Å²	68	145.7 Å²	145.7	70%	0.701	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-61.7	148.3	175.3	0	0	0	0	0	113.3
97	E	71.9	Confident	70.8	Confident	192 Å²	192	146 Å²	146	90%	0.897	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-64.9	153.5	-178.3	-66.8	-169.6	158.5	0	0	112.8
98	R	76.8	Confident	71.2	Confident	225 Å²	225	145.6 Å²	145.6	85%	0.849	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-70.2	135.3	176.8	-174.6	-175.8	-68.5	170.9	-0.7	109.7
99	G	71.2	Confident	71.7	Confident	61 Å²	61	148 Å²	148	63%	0.629	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-58	147.9	173.7	0	0	0	0	0	112.9
100	H	73.4	Confident	71.9	Confident	186 Å²	186	144.2 Å²	144.2	86%	0.861	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-65.8	154.6	179.9	-61.9	-61.2	0	0	0	112.3
101	H	78.3	Confident	71.7	Confident	180 Å²	180	144.2 Å²	144.2	83%	0.833	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-64.4	141.7	173.1	-70.7	78.5	0	0	0	110.1
102	G	74.4	Confident	71.1	Confident	63 Å²	63	144.3 Å²	144.3	65%	0.649	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-62	156.6	173.5	0	0	0	0	0	112
103	P	78.1	Confident	70.7	Confident	133 Å²	133	140.1 Å²	140.1	86%	0.864	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-61.6	148.5	178.4	26.9	-34.1	0	0	0	111.1
104	K	79.4	Confident	70.5	Confident	206 Å²	206	143.5 Å²	143.5	90%	0.896	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-64	134.9	173.4	-172.4	178.5	178.5	178.4	0	109.2
105	G	76.4	Confident	70.9	Confident	63 Å²	63	145 Å²	145	65%	0.649	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-59.2	151	173.2	0	0	0	0	0	112.1
106	E	80.6	Confident	71.4	Confident	190 Å²	190	136 Å²	136	89%	0.888	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-62.3	151.1	179.2	-63.6	-173.9	156.5	0	0	111.8	G108	E106-G108 PolarHBondContact O-N 2.85Å
107	K	73.1	Confident	72.5	Confident	204 Å²	204	139 Å²	139	89%	0.887	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-68.7	129.9	175.1	-168.4	-179.4	-178.7	-177	0	108.6
108	G	69.1	Low	73.7	Confident	61 Å²	61	130.2 Å²	130.2	63%	0.629	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-57.8	148.6	171.5	0	0	0	0	0	111.6	E106	E106-G108 PolarHBondContact O-N 2.85Å
109	Y	69.8	Low	74.7	Confident	218 Å²	218	121 Å²	121	86%	0.855	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-62.1	148.4	175.6	-68.9	-83.5	0	0	0	111.1	G111	Y109-G111 PolarHBondContact O-N 3.02Å
110	P	67.3	Low	76	Confident	121 Å²	121	118.3 Å²	118.3	79%	0.786	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-54.2	137.9	167.6	-20.8	31.8	0	0	0	110.5
111	G	55.7	Low	77.2	Confident	69 Å²	69	113.3 Å²	113.3	71%	0.711	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-63.8	151.1	170.6	0	0	0	0	0	111.2	Y109	Y109-G111 PolarHBondContact O-N 3.02Å
112	I	53.6	Low	78.1	Confident	166 Å²	166	104.7 Å²	104.7	85%	0.851	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-67.3	125.5	172.9	-56	170.4	0	0	0	107.3
113	P	58.7	Low	79.2	Confident	102 Å²	102	101.8 Å²	101.8	66%	0.662	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-57.7	148.2	173.2	-19.9	30.8	0	0	0	110.5	E115	P113-E115 PolarHBondContact O-N 3.21Å
114	P	62.6	Low	80	Confident	130 Å²	130	95.4 Å²	95.4	84%	0.844	53%	0.526	S	S	*	.			trans	-60.4	111.3	168.2	25.1	-30.5	0	0	0	108.1	L116	P114-L116 PolarHBondContact O-N 3.07Å
115	E	75.3	Confident	80.7	Confident	161 Å²	161	87.8 Å²	87.8	75%	0.752	50%	0.501	S	S	*	.			trans	-66.3	120	178.1	-160.5	168.1	-157.4	0	0	107.6	P113 Q117	P113-E115 PolarHBondContact O-N 3.21Å; E115-Q117 PolarHBondContact O-N 3.28Å
116	L	86	Confident	81.6	Confident	58 Å²	58	89.2 Å²	89.2	30%	0.304	50%	0.497	S	S	.	.			trans	-63.8	112.2	178.1	173.6	66	0	0	0	108.6	P114 V118 F147 P158 V159 L241	P114-L116 PolarHBondContact O-N 3.07Å; L116-V118 HydrophobicContact CD1-CG2 4.09Å; L116-V118 HydrophobicContact CD2-CG2 4.27Å; L116-V118 HydrophobicContact CG-CG2 3.9Å; L116-F147 HydrophobicContact CD1-CE2 4.5Å; L116-P158 HydrophobicContact CD2-CG 4.47Å; L116-V159 HydrophobicContact CD2-CB 4.07Å; L116-V159 HydrophobicContact CD2-CG1 3.38Å; L116-V159 HydrophobicContact CD2-CG2 3.48Å; L116-V159 VanDerWaalsContact CD2-CG2 3.48Å; L116-L241 HydrophobicContact CD2-CD2 4.32Å
117	Q	91.5	Very high	82.3	Confident	130 Å²	130	84.9 Å²	84.9	61%	0.607	48%	0.477	S	S	*	.			trans	-99.4	126.8	176.2	-64.3	178	22.9	0	0	109.6	E115 V144	E115-Q117 PolarHBondContact O-N 3.28Å; Q117-V144 HydrophobicContact CB-CG1 3.73Å
118	V	96.6	Very high	83.4	Confident	8 Å²	8	76.4 Å²	76.4	5%	0.048	44%	0.44	C	S	.	.			trans	-136.4	116	179.5	-178.5	0	0	0	0	108.2	L116 F147 F155 P158 Y163 F240 L241	L116-V118 HydrophobicContact CD1-CG2 4.09Å; L116-V118 HydrophobicContact CD2-CG2 4.27Å; L116-V118 HydrophobicContact CG-CG2 3.9Å; V118-F147 HydrophobicContact CG1-CD2 3.98Å; V118-F147 HydrophobicContact CG2-CD2 3.98Å; V118-F147 HydrophobicContact CG2-CE2 4Å; V118-F155 HydrophobicContact CG1-CE2 3.64Å; V118-F155 HydrophobicContact CG1-CZ 3.72Å; V118-P158 HydrophobicContact CG1-CG 4.45Å; V118-P158 HydrophobicContact CG2-CG 3.71Å; V118-Y163 HydrophobicContact CG1-CE1 4.22Å; V118-F240 VanDerWaalsContact O-CA 3.22Å; V118-F240 WeakPolarHBondContact O-CA 3.24Å; V118-F240 VanDerWaalsContact O-CB 3.28Å; V118-F240 WeakPolarHBondContact O-CB 3.5Å; V118-L241 HydrophobicContact CB-CB 3.85Å; V118-L241 HydrophobicContact CG2-CB 4.38Å; V118-L241 HydrophobicContact CG2-CD2 4.34Å; V118-L241 PolarHBondContact O-N 3.28Å
119	A	98	Very high	84.7	Confident	30 Å²	30	76.7 Å²	76.7	25%	0.248	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	142.3	175	0	0	0	0	0	110.1	T142 N143 V144 G239 F240	A119-T142 HydrophobicContact CB-CG2 4.44Å; A119-N143 CarbonylContact O-C 3.59Å; A119-N143 WeakPolarHBondContact O-CA 3.4Å; A119-V144 HydrophobicContact CB-CB 4.41Å; A119-V144 HydrophobicContact CB-CG2 4.47Å; A119-V144 PolarHBondContact N-O 2.97Å; A119-V144 PolarHBondContact O-N 2.79Å; A119-G239 CarbonylContact C-O 3.46Å; A119-G239 VanDerWaalsContact CA-O 3.3Å; A119-G239 WeakPolarHBondContact CA-O 3.44Å; A119-F240 HydrophobicContact CB-CB 3.81Å
120	F	98.6	Very high	86	Confident	6 Å²	6	71.3 Å²	71.3	3%	0.026	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	153	168.4	74.2	-83.6	0	0	0	110.9	T142 F148 F155 F165 F237 A238 G239	F120-T142 CarbonylContact C-O 3.47Å; F120-T142 WeakPolarHBondContact CA-O 3.27Å; F120-F148 HydrophobicContact CB-CB 3.64Å; F120-F148 HydrophobicContact CB-CG 4.13Å; F120-F148 HydrophobicContact CD1-CB 4.21Å; F120-F148 HydrophobicContact CD1-CD2 4.39Å; F120-F148 HydrophobicContact CD2-CB 4.01Å; F120-F148 HydrophobicContact CD2-CD1 4.17Å; F120-F148 AromaticContact CD2-CD2 3.45Å; F120-F148 HydrophobicContact CD2-CD2 3.45Å; F120-F148 VanDerWaalsContact CD2-CD2 3.45Å; F120-F148 AromaticContact CD2-CE2 3.88Å; F120-F148 HydrophobicContact CD2-CE2 3.88Å; F120-F148 AromaticContact CD2-CG 3.61Å; F120-F148 HydrophobicContact CD2-CG 3.61Å; F120-F148 HydrophobicContact CD2-CZ 4.39Å; F120-F148 HydrophobicContact CE1-CD2 4.43Å; F120-F148 AromaticContact CE2-CD2 3.51Å; F120-F148 HydrophobicContact CE2-CD2 3.51Å; F120-F148 AromaticContact CE2-CE2 3.65Å; F120-F148 HydrophobicContact CE2-CE2 3.65Å; F120-F148 HydrophobicContact CE2-CG 4.17Å; F120-F148 HydrophobicContact CE2-CZ 4.39Å; F120-F148 HydrophobicContact CG-CB 3.68Å; F120-F148 AromaticContact CG-CD2 3.92Å; F120-F148 HydrophobicContact CG-CD2 3.92Å; F120-F148 AromaticContact CG-CG 3.84Å; F120-F148 HydrophobicContact CG-CG 3.84Å; F120-F148 HydrophobicContact CZ-CD2 4.02Å; F120-F148 HydrophobicContact CZ-CE2 4.34Å; F120-F155 HydrophobicContact CD1-CB 4.49Å; F120-F155 AromaticContact CD1-CD2 3.51Å; F120-F155 HydrophobicContact CD1-CD2 3.51Å; F120-F155 HydrophobicContact CD1-CE2 4.04Å; F120-F155 HydrophobicContact CD1-CG 4.21Å; F120-F155 HydrophobicContact CE1-CB 3.83Å; F120-F155 AromaticContact CE1-CD2 3.49Å; F120-F155 HydrophobicContact CE1-CD2 3.49Å; F120-F155 VanDerWaalsContact CE1-CD2 3.49Å; F120-F155 HydrophobicContact CE1-CE2 4.21Å; F120-F155 AromaticContact CE1-CG 3.71Å; F120-F155 HydrophobicContact CE1-CG 3.71Å; F120-F155 HydrophobicContact CZ-CB 4.14Å; F120-F155 HydrophobicContact CZ-CG 4.48Å; F120-F165 HydrophobicContact CE1-CD1 4.12Å; F120-F165 AromaticContact CE1-CE1 3.84Å; F120-F165 HydrophobicContact CE1-CE1 3.84Å; F120-F165 HydrophobicContact CZ-CD1 4.05Å; F120-F165 HydrophobicContact CZ-CE1 4.11Å; F120-F237 AromaticContact CE2-CD1 3.67Å; F120-F237 HydrophobicContact CE2-CD1 3.67Å; F120-F237 HydrophobicContact CE2-CD2 4.36Å; F120-F237 AromaticContact CE2-CE1 3.78Å; F120-F237 HydrophobicContact CE2-CE1 3.78Å; F120-F237 HydrophobicContact CE2-CE2 4.47Å; F120-F237 AromaticContact CE2-CG 3.98Å; F120-F237 HydrophobicContact CE2-CG 3.98Å; F120-F237 HydrophobicContact CE2-CZ 4.2Å; F120-F237 HydrophobicContact CZ-CD1 4.06Å; F120-F237 HydrophobicContact CZ-CD2 4.41Å; F120-F237 AromaticContact CZ-CE1 3.7Å; F120-F237 HydrophobicContact CZ-CE1 3.7Å; F120-F237 HydrophobicContact CZ-CE2 4.09Å; F120-F237 HydrophobicContact CZ-CG 4.41Å; F120-F237 AromaticContact CZ-CZ 3.72Å; F120-F237 HydrophobicContact CZ-CZ 3.72Å; F120-A238 VanDerWaalsContact O-CA 3.24Å; F120-A238 WeakPolarHBondContact O-CA 3.35Å; F120-A238 WeakPolarHBondContact O-CB 3.3Å; F120-G239 WeakPolarHBondContact CD1-O 3.45Å; F120-G239 PolarHBondContact N-O 3.31Å; F120-G239 PolarHBondContact O-N 2.97Å
121	M	98.1	Very high	87.3	Confident	80 Å²	80	69.1 Å²	69.1	39%	0.394	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	127.4	168.2	179.4	167	-174.4	0	0	107.5	E141 T142 T236 A238	M121-E141 HydrophobicContact CB-CB 4.47Å; M121-E141 HydrophobicContact CG-CB 4.4Å; M121-E141 PolarHBondContact O-N 3.46Å; M121-T142 PolarHBondContact N-O 2.81Å; M121-T142 PolarHBondContact O-N 3.12Å; M121-T142 VanDerWaalsContact O-N 3.09Å; M121-T236 HydrophobicContact CE-CG2 4.34Å; M121-A238 HydrophobicContact CB-CB 4.07Å; M121-A238 HydrophobicContact CG-CB 4.12Å
122	A	97.9	Very high	89.1	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	153.1	178.8	0	0	0	0	0	110.3	F137 S139 V140 E141 F148 T236 F237	A122-F137 HydrophobicContact CB-CB 3.44Å; A122-F137 VanDerWaalsContact CB-CB 3.44Å; A122-F137 HydrophobicContact CB-CG 4.11Å; A122-S139 CarbonylContact C-O 3.54Å; A122-S139 VanDerWaalsContact CA-O 3.23Å; A122-S139 WeakPolarHBondContact CA-O 3.3Å; A122-S139 WeakPolarHBondContact CB-O 3.45Å; A122-V140 HydrophobicContact CB-CG2 4.19Å; A122-E141 WeakPolarHBondContact CA-OE2 3.46Å; A122-F148 HydrophobicContact CB-CD1 4.46Å; A122-F148 HydrophobicContact CB-CE1 3.72Å; A122-F148 HydrophobicContact CB-CZ 4.16Å; A122-T236 CarbonylContact O-C 3.52Å; A122-T236 WeakPolarHBondContact O-CA 3.42Å; A122-F237 PolarHBondContact N-O 2.97Å; A122-F237 PolarHBondContact O-N 3.4Å
123	S	97.4	Very high	91.1	Very high	1 Å²	1	65.1 Å²	65.1	1%	0.007	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	155.8	179.7	63.9	0	0	0	0	111.7	F137 S138 S139 E141 R233 S235	S123-F137 CarbonylContact O-C 3.53Å; S123-S138 PolarHBondContact O-N 3.3Å; S123-S139 PolarHBondContact N-O 3.49Å; S123-S139 PolarHBondContact O-N 2.92Å; S123-S139 WeakPolarHBondContact OG-CB 3.13Å; S123-S139 PolarHBondContact OG-OG 3.4Å; S123-E141 PolarHBondContact N-OE2 2.83Å; S123-E141 PolarHBondContact OG-OE1 2.82Å; S123-R233 WeakPolarHBondContact OG-CD 3.46Å; S123-R233 WeakPolarHBondContact OG-CG 3.27Å; S123-S235 CarbonylContact C-O 3.43Å; S123-S235 VanDerWaalsContact CA-O 3.29Å; S123-S235 WeakPolarHBondContact CA-O 3.27Å
124	M	95.3	Very high	92.9	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.344	C	S	.	.			trans	-84.1	118.5	177.3	-63.6	178.2	52.3	0	0	110.2	T126 F128 I135 F137 L227 G229 D230 S235	M124-T126 WeakPolarHBondContact CE-O 3.42Å; M124-F128 HydrophobicContact CE-CB 3.33Å; M124-F128 HydrophobicContact CE-CG 4.43Å; M124-I135 HydrophobicContact SD-CG2 3.97Å; M124-F137 HydrophobicContact CG-CD1 3.63Å; M124-F137 HydrophobicContact CG-CE1 3.67Å; M124-F137 HydrophobicContact SD-CE1 4.29Å; M124-L227 HydrophobicContact CE-CB 3.76Å; M124-L227 HydrophobicContact CE-CD1 4.45Å; M124-L227 HydrophobicContact SD-CB 4.11Å; M124-L227 HydrophobicContact SD-CD1 4.05Å; M124-G229 WeakPolarHBondContact O-CA 3.34Å; M124-D230 PolarHBondContact O-N 2.84Å; M124-S235 PolarHBondContact N-O 2.97Å; M124-S235 WeakPolarHBondContact SD-CB 3.45Å
125	A	93.9	Very high	94.6	Very high	45 Å²	45	55.1 Å²	55.1	37%	0.372	30%	0.304	S	S	.	.	S	Bend	trans	-87.9	-12.9	174.7	0	0	0	0	0	113.4	S138 D230	A125-S138 WeakPolarHBondContact CB-OG 3.47Å; A125-S138 PolarHBondContact N-OG 2.77Å; A125-D230 WeakPolarHBondContact O-CA 3.37Å
126	T	93.9	Very high	95.5	Very high	93 Å²	93	51 Å²	51	57%	0.571	29%	0.286	S	S	*	.	S	Bend	trans	-139.3	150	-177.8	56.9	0	0	0	0	110.3	M124 G229	M124-T126 WeakPolarHBondContact CE-O 3.42Å; T126-G229 CarbonylContact C-O 3.57Å; T126-G229 WeakPolarHBondContact CA-O 3.37Å
127	H	95.9	Very high	96	Very high	100 Å²	100	48.3 Å²	48.3	46%	0.463	27%	0.272	S	S	.	.			trans	-55.5	150.9	174	-48.9	-65.4	0	0	0	112.2	H172 L227 H228 G229	H127-H172 AromaticContact CE1-CD2 3.79Å; H127-H172 AromaticContact CE1-NE2 3.61Å; H127-H172 AromaticContact CG-CD2 3.89Å; H127-H172 AromaticContact CG-NE2 3.88Å; H127-H172 AromaticContact ND1-CD2 3.34Å; H127-H172 PolarHBondContact ND1-CD2 2.84Å; H127-H172 VanDerWaalsContact ND1-CD2 3.34Å; H127-H172 AromaticContact ND1-NE2 3.54Å; H127-L227 VanDerWaalsContact CA-O 3.29Å; H127-L227 WeakPolarHBondContact CA-O 3.31Å; H127-H228 AromaticContact CE1-CE1 3.47Å; H127-H228 PolarHBondContact CE1-CE1 2.81Å; H127-H228 VanDerWaalsContact CE1-CE1 3.47Å; H127-H228 AromaticContact CE1-ND1 3.29Å; H127-H228 PolarHBondContact CE1-ND1 3.48Å; H127-H228 VanDerWaalsContact CE1-ND1 3.29Å; H127-H228 AromaticContact ND1-CG 3.97Å; H127-H228 AromaticContact ND1-ND1 3.57Å; H127-G229 PolarHBondContact N-O 3.49Å; H127-G229 PolarHBondContact ND1-N 3.33Å
128	F	96.6	Very high	95.9	Very high	25 Å²	25	45.2 Å²	45.2	11%	0.11	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-138.4	128.5	-179.8	-168.8	-86.6	0	0	0	111.3	M124 N130 S133 G134 I135 M222 A226 L227	M124-F128 HydrophobicContact CE-CB 3.33Å; M124-F128 HydrophobicContact CE-CG 4.43Å; F128-N130 HydrophobicContact CE1-CB 4.01Å; F128-N130 WeakPolarHBondContact CE1-O 3.43Å; F128-N130 HydrophobicContact CE2-CB 4.45Å; F128-N130 HydrophobicContact CZ-CB 3.88Å; F128-S133 WeakPolarHBondContact CZ-OG 3.37Å; F128-G134 VanDerWaalsContact CZ-O 3.26Å; F128-G134 WeakPolarHBondContact CZ-O 3.23Å; F128-I135 HydrophobicContact CD1-CG1 4.07Å; F128-I135 HydrophobicContact CE1-CB 4.48Å; F128-I135 HydrophobicContact CE1-CG1 3.88Å; F128-I135 HydrophobicContact CZ-CG1 4.49Å; F128-M222 HydrophobicContact CD1-CB 4.25Å; F128-M222 HydrophobicContact CD1-CG 4.26Å; F128-M222 HydrophobicContact CD1-SD 4.49Å; F128-M222 HydrophobicContact CE1-CB 3.75Å; F128-M222 HydrophobicContact CE1-CG 4.16Å; F128-A226 WeakPolarHBondContact O-CA 3.48Å; F128-L227 PolarHBondContact N-O 2.93Å; F128-L227 PolarHBondContact O-N 2.92Å
129	S	96.4	Very high	95.8	Very high	67 Å²	67	46 Å²	46	47%	0.469	27%	0.271	S	S	.	.			trans	-140.5	9.3	-177.4	57.1	0	0	0	0	113.6	Q131	S129-Q131 PolarHBondContact O-N 2.8Å; S129-Q131 PolarHBondContact O-NE2 3.5Å
130	N	96.2	Very high	95.7	Very high	105 Å²	105	47.3 Å²	47.3	56%	0.561	28%	0.275	S	S	*	.			trans	-72.5	103.4	-179.3	-72.2	-6.6	0	0	0	110.1	F128 S133 M222	F128-N130 HydrophobicContact CE1-CB 4.01Å; F128-N130 WeakPolarHBondContact CE1-O 3.43Å; F128-N130 HydrophobicContact CE2-CB 4.45Å; F128-N130 HydrophobicContact CZ-CB 3.88Å; N130-S133 WeakPolarHBondContact CB-OG 3.27Å; N130-S133 PolarHBondContact O-OG 3.37Å; N130-M222 WeakPolarHBondContact O-CB 3.47Å
131	Q	95.3	Very high	95.5	Very high	76 Å²	76	50 Å²	50	36%	0.355	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	148.3	-176.5	-50.3	-52.3	-19.5	0	0	112.4	S129 S133 G223 G225	S129-Q131 PolarHBondContact O-N 2.8Å; S129-Q131 PolarHBondContact O-NE2 3.5Å; Q131-S133 PolarHBondContact O-N 2.71Å; Q131-G223 VanDerWaalsContact OE1-C 3.3Å; Q131-G223 PolarHBondContact OE1-O 3.47Å; Q131-G225 PolarHBondContact NE2-O 3.34Å
132	N	94.1	Very high	95.5	Very high	114 Å²	114	48.9 Å²	48.9	61%	0.61	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.3	14.8	-179.6	-62.7	-57.2	0	0	0	115.3	M222	N132-M222 WeakPolarHBondContact CA-O 3.3Å; N132-M222 PolarHBondContact N-O 3.34Å
133	S	95.6	Very high	95.5	Very high	37 Å²	37	50.6 Å²	50.6	26%	0.259	30%	0.295	S	S	.	.	S	Bend	trans	-108	158.5	-179.4	73.9	0	0	0	0	112	F128 N130 Q131 R221 M222	F128-S133 WeakPolarHBondContact CZ-OG 3.37Å; N130-S133 WeakPolarHBondContact CB-OG 3.27Å; N130-S133 PolarHBondContact O-OG 3.37Å; Q131-S133 PolarHBondContact O-N 2.71Å; S133-R221 WeakPolarHBondContact O-CA 3.48Å; S133-R221 WeakPolarHBondContact O-CG 3.36Å; S133-M222 PolarHBondContact O-N 3.38Å
134	G	96.2	Very high	95.4	Very high	22 Å²	22	53.3 Å²	53.3	23%	0.227	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-66.2	131.7	172.8	0	0	0	0	0	110.2	F128 L220	F128-G134 VanDerWaalsContact CZ-O 3.26Å; F128-G134 WeakPolarHBondContact CZ-O 3.23Å; G134-L220 WeakPolarHBondContact CA-O 3.49Å
135	I	97.1	Very high	95.3	Very high	0 Å²	0	55 Å²	55	0%	0	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-75	129.3	178	-63.4	166.4	0	0	0	108.4	M124 F128 F137 V180 L220 M222 L227	M124-I135 HydrophobicContact SD-CG2 3.97Å; F128-I135 HydrophobicContact CD1-CG1 4.07Å; F128-I135 HydrophobicContact CE1-CB 4.48Å; F128-I135 HydrophobicContact CE1-CG1 3.88Å; F128-I135 HydrophobicContact CZ-CG1 4.49Å; I135-F137 HydrophobicContact CB-CE2 4.19Å; I135-F137 HydrophobicContact CB-CZ 4.42Å; I135-F137 HydrophobicContact CG2-CD2 4.44Å; I135-F137 HydrophobicContact CG2-CE1 4.35Å; I135-F137 HydrophobicContact CG2-CE2 3.75Å; I135-F137 HydrophobicContact CG2-CZ 3.68Å; I135-V180 HydrophobicContact CD1-CG1 3.7Å; I135-V180 HydrophobicContact CD1-CG2 4.09Å; I135-L220 HydrophobicContact CB-CB 4.29Å; I135-L220 HydrophobicContact CD1-CB 3.96Å; I135-L220 PolarHBondContact N-O 3.08Å; I135-M222 HydrophobicContact CD1-CB 4.32Å; I135-M222 HydrophobicContact CD1-SD 4.4Å; I135-M222 HydrophobicContact CG1-CB 4Å; I135-L227 HydrophobicContact CD1-CD1 3.6Å; I135-L227 HydrophobicContact CG1-CD1 4.32Å; I135-L227 HydrophobicContact CG2-CD1 4.46Å
136	I	95.3	Very high	95.4	Very high	75 Å²	75	59.2 Å²	59.2	39%	0.385	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-101.5	133.6	-178.8	-61.1	171.7	0	0	0	109.2	V150	I136-V150 WeakPolarHBondContact CG2-O 3.49Å
137	F	95.3	Very high	95.6	Very high	0 Å²	0	58 Å²	58	0%	0	33%	0.332	C	S	.	.			trans	-110.5	101.3	178.4	-62.7	-91.5	0	0	0	109.1	A122 S123 M124 I135 F148 V150 M169 L220 F237	A122-F137 HydrophobicContact CB-CB 3.44Å; A122-F137 VanDerWaalsContact CB-CB 3.44Å; A122-F137 HydrophobicContact CB-CG 4.11Å; S123-F137 CarbonylContact O-C 3.53Å; M124-F137 HydrophobicContact CG-CD1 3.63Å; M124-F137 HydrophobicContact CG-CE1 3.67Å; M124-F137 HydrophobicContact SD-CE1 4.29Å; I135-F137 HydrophobicContact CB-CE2 4.19Å; I135-F137 HydrophobicContact CB-CZ 4.42Å; I135-F137 HydrophobicContact CG2-CD2 4.44Å; I135-F137 HydrophobicContact CG2-CE1 4.35Å; I135-F137 HydrophobicContact CG2-CE2 3.75Å; I135-F137 HydrophobicContact CG2-CZ 3.68Å; F137-F148 HydrophobicContact CB-CZ 4.36Å; F137-F148 HydrophobicContact CD2-CZ 4.07Å; F137-V150 WeakPolarHBondContact O-CG1 3.45Å; F137-M169 HydrophobicContact CE1-CE 4.08Å; F137-M169 HydrophobicContact CZ-CE 4.09Å; F137-L220 HydrophobicContact CE2-CD1 4.38Å; F137-L220 HydrophobicContact CZ-CD1 3.89Å; F137-F237 HydrophobicContact CD1-CB 4.23Å; F137-F237 HydrophobicContact CD2-CB 4.26Å; F137-F237 HydrophobicContact CD2-CD1 4.33Å; F137-F237 HydrophobicContact CE1-CB 3.71Å; F137-F237 HydrophobicContact CE2-CB 3.73Å; F137-F237 AromaticContact CE2-CD1 3.88Å; F137-F237 HydrophobicContact CE2-CD1 3.88Å; F137-F237 HydrophobicContact CE2-CG 4.22Å; F137-F237 HydrophobicContact CG-CB 4.5Å; F137-F237 HydrophobicContact CZ-CB 3.45Å; F137-F237 VanDerWaalsContact CZ-CB 3.45Å; F137-F237 HydrophobicContact CZ-CD1 4.41Å; F137-F237 HydrophobicContact CZ-CG 4.29Å
138	S	91.2	Very high	95.7	Very high	66 Å²	66	53.5 Å²	53.5	46%	0.462	31%	0.311	S	S	.	.			trans	-82.8	-12	-171.2	46.5	0	0	0	0	114.7	S123 A125	S123-S138 PolarHBondContact O-N 3.3Å; A125-S138 WeakPolarHBondContact CB-OG 3.47Å; A125-S138 PolarHBondContact N-OG 2.77Å
139	S	94.4	Very high	95.7	Very high	25 Å²	25	55.7 Å²	55.7	18%	0.175	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123.6	171.1	177.6	0	0	0	0	108.9	A122 S123 E141	A122-S139 CarbonylContact C-O 3.54Å; A122-S139 VanDerWaalsContact CA-O 3.23Å; A122-S139 WeakPolarHBondContact CA-O 3.3Å; A122-S139 WeakPolarHBondContact CB-O 3.45Å; S123-S139 PolarHBondContact N-O 3.49Å; S123-S139 PolarHBondContact O-N 2.92Å; S123-S139 WeakPolarHBondContact OG-CB 3.13Å; S123-S139 PolarHBondContact OG-OG 3.4Å; S139-E141 PolarHBondContact OG-OE1 3.26Å
140	V	95.4	Very high	95.5	Very high	56 Å²	56	54.9 Å²	54.9	34%	0.339	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	119.3	179.9	-180	0	0	0	0	109	A122 N143 V150	A122-V140 HydrophobicContact CB-CG2 4.19Å; V140-N143 HydrophobicContact CG1-CB 3.97Å; V140-V150 HydrophobicContact CG2-CB 4.34Å; V140-V150 HydrophobicContact CG2-CG1 3.75Å; V140-V150 HydrophobicContact CG2-CG2 3.62Å
141	E	95.1	Very high	95.3	Very high	62 Å²	62	57.1 Å²	57.1	29%	0.29	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-38.3	177.5	-65.7	73.7	-150.5	0	0	111.5	M121 A122 S123 S139 R233	M121-E141 HydrophobicContact CB-CB 4.47Å; M121-E141 HydrophobicContact CG-CB 4.4Å; M121-E141 PolarHBondContact O-N 3.46Å; A122-E141 WeakPolarHBondContact CA-OE2 3.46Å; S123-E141 PolarHBondContact N-OE2 2.83Å; S123-E141 PolarHBondContact OG-OE1 2.82Å; S139-E141 PolarHBondContact OG-OE1 3.26Å; E141-R233 IonicContact OE1-CZ 3.86Å; E141-R233 IonicContact OE1-NE 3.4Å; E141-R233 IonicContact OE1-NH1 2.8Å; E141-R233 PolarHBondContact OE1-NH1 3.31Å
142	T	97.1	Very high	95.3	Very high	58 Å²	58	56 Å²	56	36%	0.356	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	138.4	-178.7	-60.9	0	0	0	0	110	A119 F120 M121 V144	A119-T142 HydrophobicContact CB-CG2 4.44Å; F120-T142 CarbonylContact C-O 3.47Å; F120-T142 WeakPolarHBondContact CA-O 3.27Å; M121-T142 PolarHBondContact N-O 2.81Å; M121-T142 PolarHBondContact O-N 3.12Å; M121-T142 VanDerWaalsContact O-N 3.09Å; T142-V144 HydrophobicContact CG2-CG2 3.79Å
143	N	97.1	Very high	95.4	Very high	35 Å²	35	50.6 Å²	50.6	19%	0.187	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	61.5	170.6	-163.4	1.5	0	0	0	111.1	A119 V140 G145 N146 F147 F148	A119-N143 CarbonylContact O-C 3.59Å; A119-N143 WeakPolarHBondContact O-CA 3.4Å; V140-N143 HydrophobicContact CG1-CB 3.97Å; N143-G145 PolarHBondContact O-N 3.39Å; N143-N146 PolarHBondContact O-N 3.42Å; N143-N146 VanDerWaalsContact O-N 3.12Å; N143-N146 PolarHBondContact O-OD1 2.93Å; N143-N146 WeakPolarHBondContact OD1-CA 3.42Å; N143-F147 PolarHBondContact OD1-N 2.84Å; N143-F148 PolarHBondContact ND2-O 2.94Å; N143-F148 PolarHBondContact OD1-N 2.83Å
144	V	96.3	Very high	95.5	Very high	58 Å²	58	52 Å²	52	35%	0.352	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	121.4	178.6	-174.3	0	0	0	0	109.3	Q117 A119 T142	Q117-V144 HydrophobicContact CB-CG1 3.73Å; A119-V144 HydrophobicContact CB-CB 4.41Å; A119-V144 HydrophobicContact CB-CG2 4.47Å; A119-V144 PolarHBondContact N-O 2.97Å; A119-V144 PolarHBondContact O-N 2.79Å; T142-V144 HydrophobicContact CG2-CG2 3.79Å
145	G	93.7	Very high	95.6	Very high	36 Å²	36	51 Å²	51	37%	0.371	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.8	-7.2	-176.4	0	0	0	0	0	114.8	N143 F147	N143-G145 PolarHBondContact O-N 3.39Å; G145-F147 VanDerWaalsContact C-N 3.27Å; G145-F147 WeakPolarHBondContact O-CD2 3.35Å; G145-F147 VanDerWaalsContact O-CE2 3.3Å; G145-F147 WeakPolarHBondContact O-CE2 3.35Å; G145-F147 WeakPolarHBondContact O-CZ 3.42Å; G145-F147 PolarHBondContact O-N 3Å
146	N	96.1	Very high	95.7	Very high	134 Å²	134	52.2 Å²	52.2	72%	0.717	30%	0.296	S	S	*	.	S	Bend	trans	55.5	37.4	179.8	-58	-52.3	0	0	0	114	N143	N143-N146 PolarHBondContact O-N 3.42Å; N143-N146 VanDerWaalsContact O-N 3.12Å; N143-N146 PolarHBondContact O-OD1 2.93Å; N143-N146 WeakPolarHBondContact OD1-CA 3.42Å
147	F	97.4	Very high	95.8	Very high	67 Å²	67	48.8 Å²	48.8	29%	0.294	28%	0.279	S	S	.	.			trans	-95.9	-4.1	-178.8	-61.6	-60.5	0	0	0	113.6	L116 V118 N143 G145 F155 G156 P158	L116-F147 HydrophobicContact CD1-CE2 4.5Å; V118-F147 HydrophobicContact CG1-CD2 3.98Å; V118-F147 HydrophobicContact CG2-CD2 3.98Å; V118-F147 HydrophobicContact CG2-CE2 4Å; N143-F147 PolarHBondContact OD1-N 2.84Å; G145-F147 VanDerWaalsContact C-N 3.27Å; G145-F147 WeakPolarHBondContact O-CD2 3.35Å; G145-F147 VanDerWaalsContact O-CE2 3.3Å; G145-F147 WeakPolarHBondContact O-CE2 3.35Å; G145-F147 WeakPolarHBondContact O-CZ 3.42Å; G145-F147 PolarHBondContact O-N 3Å; F147-F155 HydrophobicContact CB-CD2 4.27Å; F147-F155 HydrophobicContact CB-CE2 3.84Å; F147-F155 WeakPolarHBondContact O-CA 3.42Å; F147-G156 PolarHBondContact O-N 2.89Å; F147-P158 HydrophobicContact CD1-CB 3.83Å; F147-P158 HydrophobicContact CD1-CG 4.19Å; F147-P158 HydrophobicContact CD2-CB 4.16Å; F147-P158 HydrophobicContact CD2-CG 3.75Å; F147-P158 HydrophobicContact CE1-CB 3.51Å; F147-P158 HydrophobicContact CE1-CG 4.18Å; F147-P158 HydrophobicContact CE2-CB 3.82Å; F147-P158 HydrophobicContact CE2-CG 3.69Å; F147-P158 HydrophobicContact CG-CB 4.16Å; F147-P158 HydrophobicContact CG-CG 4Å; F147-P158 HydrophobicContact CZ-CB 3.48Å; F147-P158 VanDerWaalsContact CZ-CB 3.48Å; F147-P158 HydrophobicContact CZ-CG 3.93Å
148	F	98.1	Very high	95.9	Very high	5 Å²	5	49.8 Å²	49.8	2%	0.022	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	117.1	168.3	-177	-104.3	0	0	0	110.2	F120 A122 F137 N143 V150 G153 F155 F237	F120-F148 HydrophobicContact CB-CB 3.64Å; F120-F148 HydrophobicContact CB-CG 4.13Å; F120-F148 HydrophobicContact CD1-CB 4.21Å; F120-F148 HydrophobicContact CD1-CD2 4.39Å; F120-F148 HydrophobicContact CD2-CB 4.01Å; F120-F148 HydrophobicContact CD2-CD1 4.17Å; F120-F148 AromaticContact CD2-CD2 3.45Å; F120-F148 HydrophobicContact CD2-CD2 3.45Å; F120-F148 VanDerWaalsContact CD2-CD2 3.45Å; F120-F148 AromaticContact CD2-CE2 3.88Å; F120-F148 HydrophobicContact CD2-CE2 3.88Å; F120-F148 AromaticContact CD2-CG 3.61Å; F120-F148 HydrophobicContact CD2-CG 3.61Å; F120-F148 HydrophobicContact CD2-CZ 4.39Å; F120-F148 HydrophobicContact CE1-CD2 4.43Å; F120-F148 AromaticContact CE2-CD2 3.51Å; F120-F148 HydrophobicContact CE2-CD2 3.51Å; F120-F148 AromaticContact CE2-CE2 3.65Å; F120-F148 HydrophobicContact CE2-CE2 3.65Å; F120-F148 HydrophobicContact CE2-CG 4.17Å; F120-F148 HydrophobicContact CE2-CZ 4.39Å; F120-F148 HydrophobicContact CG-CB 3.68Å; F120-F148 AromaticContact CG-CD2 3.92Å; F120-F148 HydrophobicContact CG-CD2 3.92Å; F120-F148 AromaticContact CG-CG 3.84Å; F120-F148 HydrophobicContact CG-CG 3.84Å; F120-F148 HydrophobicContact CZ-CD2 4.02Å; F120-F148 HydrophobicContact CZ-CE2 4.34Å; A122-F148 HydrophobicContact CB-CD1 4.46Å; A122-F148 HydrophobicContact CB-CE1 3.72Å; A122-F148 HydrophobicContact CB-CZ 4.16Å; F137-F148 HydrophobicContact CB-CZ 4.36Å; F137-F148 HydrophobicContact CD2-CZ 4.07Å; N143-F148 PolarHBondContact ND2-O 2.94Å; N143-F148 PolarHBondContact OD1-N 2.83Å; F148-V150 HydrophobicContact CD1-CG2 4.36Å; F148-V150 PolarHBondContact O-N 2.85Å; F148-G153 WeakPolarHBondContact CE2-O 3.18Å; F148-F155 HydrophobicContact CD2-CB 4.21Å; F148-F237 AromaticContact CE2-CD1 3.98Å; F148-F237 HydrophobicContact CE2-CD1 3.98Å; F148-F237 HydrophobicContact CE2-CE1 4.08Å; F148-F237 HydrophobicContact CZ-CD1 4.46Å
149	D	96.6	Very high	96.1	Very high	72 Å²	72	48.1 Å²	48.1	39%	0.385	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	108.6	174.5	177.6	7.2	0	0	0	110.3	M151 T152 G153 R154	D149-M151 VanDerWaalsContact C-N 3.28Å; D149-M151 PolarHBondContact O-N 2.66Å; D149-M151 WeakPolarHBondContact OD1-CB 3.43Å; D149-M151 PolarHBondContact OD1-N 3.05Å; D149-T152 WeakPolarHBondContact CB-OG1 3.36Å; D149-T152 PolarHBondContact O-N 3.28Å; D149-T152 WeakPolarHBondContact OD2-CB 3.18Å; D149-T152 WeakPolarHBondContact OD2-CG2 3.49Å; D149-T152 PolarHBondContact OD2-OG1 2.87Å; D149-G153 WeakPolarHBondContact O-CA 3.43Å; D149-G153 PolarHBondContact O-N 2.89Å; D149-R154 PolarHBondContact N-O 2.73Å; D149-R154 PolarHBondContact O-N 3.4Å
150	V	92.9	Very high	96.3	Very high	50 Å²	50	50.2 Å²	50.2	30%	0.303	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-30.2	-177.9	-168.8	0	0	0	0	112.1	I136 F137 V140 F148 T152	I136-V150 WeakPolarHBondContact CG2-O 3.49Å; F137-V150 WeakPolarHBondContact O-CG1 3.45Å; V140-V150 HydrophobicContact CG2-CB 4.34Å; V140-V150 HydrophobicContact CG2-CG1 3.75Å; V140-V150 HydrophobicContact CG2-CG2 3.62Å; F148-V150 HydrophobicContact CD1-CG2 4.36Å; F148-V150 PolarHBondContact O-N 2.85Å; V150-T152 VanDerWaalsContact C-N 3.3Å; V150-T152 PolarHBondContact O-N 3Å
151	M	91.9	Very high	96.3	Very high	152 Å²	152	47.6 Å²	47.6	75%	0.749	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-28.4	-177.5	-63.8	-58	-60.8	0	0	111.9	D149	D149-M151 VanDerWaalsContact C-N 3.28Å; D149-M151 PolarHBondContact O-N 2.66Å; D149-M151 WeakPolarHBondContact OD1-CB 3.43Å; D149-M151 PolarHBondContact OD1-N 3.05Å
152	T	94.4	Very high	96.5	Very high	52 Å²	52	45.5 Å²	45.5	32%	0.319	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.2	-13.6	-175.6	63.4	0	0	0	0	113.6	D149 V150 R154	D149-T152 WeakPolarHBondContact CB-OG1 3.36Å; D149-T152 PolarHBondContact O-N 3.28Å; D149-T152 WeakPolarHBondContact OD2-CB 3.18Å; D149-T152 WeakPolarHBondContact OD2-CG2 3.49Å; D149-T152 PolarHBondContact OD2-OG1 2.87Å; V150-T152 VanDerWaalsContact C-N 3.3Å; V150-T152 PolarHBondContact O-N 3Å; T152-R154 VanDerWaalsContact C-N 3.25Å; T152-R154 PolarHBondContact O-N 3.05Å; T152-R154 WeakPolarHBondContact OG1-CB 3.41Å; T152-R154 WeakPolarHBondContact OG1-CG 3.49Å
153	G	95.8	Very high	96.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.9	19.6	-173.9	0	0	0	0	0	113.5	F148 D149 W219	F148-G153 WeakPolarHBondContact CE2-O 3.18Å; D149-G153 WeakPolarHBondContact O-CA 3.43Å; D149-G153 PolarHBondContact O-N 2.89Å; G153-W219 WeakPolarHBondContact O-CB 3.41Å
154	R	97.9	Very high	96.6	Very high	68 Å²	68	43.7 Å²	43.7	26%	0.257	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	135	-173.9	-63.8	176.5	176.8	-102.1	-12.4	111.5	D149 T152 E217 W219	D149-R154 PolarHBondContact N-O 2.73Å; D149-R154 PolarHBondContact O-N 3.4Å; T152-R154 VanDerWaalsContact C-N 3.25Å; T152-R154 PolarHBondContact O-N 3.05Å; T152-R154 WeakPolarHBondContact OG1-CB 3.41Å; T152-R154 WeakPolarHBondContact OG1-CG 3.49Å; R154-E217 IonicContact CZ-OE2 3.67Å; R154-E217 IonicContact NH1-OE2 2.8Å; R154-E217 PolarHBondContact NH1-OE2 2.56Å; R154-W219 HydrophobicContact CB-CB 4.36Å; R154-W219 HydrophobicContact CG-CB 3.83Å; R154-W219 HydrophobicContact CG-CD2 4.36Å; R154-W219 HydrophobicContact CG-CG 4.1Å
155	F	98.6	Very high	96.7	Very high	1 Å²	1	41 Å²	41	0%	0.004	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	128.4	167.1	173.1	-97.7	0	0	0	109.8	V118 F120 F147 F148 A157 Y163 F165 L212 E217 V218	V118-F155 HydrophobicContact CG1-CE2 3.64Å; V118-F155 HydrophobicContact CG1-CZ 3.72Å; F120-F155 HydrophobicContact CD1-CB 4.49Å; F120-F155 AromaticContact CD1-CD2 3.51Å; F120-F155 HydrophobicContact CD1-CD2 3.51Å; F120-F155 HydrophobicContact CD1-CE2 4.04Å; F120-F155 HydrophobicContact CD1-CG 4.21Å; F120-F155 HydrophobicContact CE1-CB 3.83Å; F120-F155 AromaticContact CE1-CD2 3.49Å; F120-F155 HydrophobicContact CE1-CD2 3.49Å; F120-F155 VanDerWaalsContact CE1-CD2 3.49Å; F120-F155 HydrophobicContact CE1-CE2 4.21Å; F120-F155 AromaticContact CE1-CG 3.71Å; F120-F155 HydrophobicContact CE1-CG 3.71Å; F120-F155 HydrophobicContact CZ-CB 4.14Å; F120-F155 HydrophobicContact CZ-CG 4.48Å; F147-F155 HydrophobicContact CB-CD2 4.27Å; F147-F155 HydrophobicContact CB-CE2 3.84Å; F147-F155 WeakPolarHBondContact O-CA 3.42Å; F148-F155 HydrophobicContact CD2-CB 4.21Å; F155-A157 HydrophobicContact CE1-CB 4.27Å; F155-Y163 AromaticContact CE1-CD1 3.95Å; F155-Y163 HydrophobicContact CE1-CD1 3.95Å; F155-Y163 AromaticContact CE1-CE1 3.98Å; F155-Y163 HydrophobicContact CE1-CE1 3.98Å; F155-Y163 AromaticContact CZ-CD1 3.86Å; F155-Y163 HydrophobicContact CZ-CD1 3.86Å; F155-Y163 AromaticContact CZ-CE1 3.66Å; F155-Y163 HydrophobicContact CZ-CE1 3.66Å; F155-F165 HydrophobicContact CB-CE1 4.34Å; F155-F165 AromaticContact CD1-CE1 3.7Å; F155-F165 HydrophobicContact CD1-CE1 3.7Å; F155-F165 AromaticContact CD1-CZ 3.62Å; F155-F165 HydrophobicContact CD1-CZ 3.62Å; F155-F165 HydrophobicContact CE1-CE1 4.2Å; F155-F165 AromaticContact CE1-CZ 3.84Å; F155-F165 HydrophobicContact CE1-CZ 3.84Å; F155-F165 HydrophobicContact CG-CE1 4.04Å; F155-F165 HydrophobicContact CG-CZ 4.41Å; F155-L212 HydrophobicContact CE1-CD1 4.25Å; F155-E217 CarbonylContact O-C 3.6Å; F155-E217 VanDerWaalsContact O-CA 3.27Å; F155-E217 WeakPolarHBondContact O-CA 3.46Å; F155-V218 HydrophobicContact CD1-CB 4.47Å; F155-V218 PolarHBondContact N-O 2.97Å; F155-V218 PolarHBondContact O-N 2.84Å
156	G	98.2	Very high	97	Very high	24 Å²	24	41.3 Å²	41.3	25%	0.247	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.9	173.7	0	0	0	0	0	111.8	F147 P158 D216	F147-G156 PolarHBondContact O-N 2.89Å; G156-P158 VanDerWaalsContact O-CD 3.23Å; G156-P158 WeakPolarHBondContact O-CD 3.44Å; G156-D216 WeakPolarHBondContact CA-O 3.42Å
157	A	98.1	Very high	97	Very high	4 Å²	4	35 Å²	35	3%	0.033	19%	0.187	C	C	.	.			trans	-69.3	116.3	-178.8	0	0	0	0	0	111.5	F155 Y163 L212 A213 K214 G215 D216	F155-A157 HydrophobicContact CE1-CB 4.27Å; A157-Y163 HydrophobicContact CB-CE2 4.22Å; A157-L212 HydrophobicContact CB-CB 3.89Å; A157-L212 HydrophobicContact CB-CD1 4Å; A157-A213 WeakPolarHBondContact CB-O 3.38Å; A157-K214 WeakPolarHBondContact O-CA 3.44Å; A157-G215 PolarHBondContact O-N 2.71Å; A157-D216 HydrophobicContact CB-CB 4.36Å; A157-D216 PolarHBondContact N-O 2.9Å
158	P	97	Very high	97.1	Very high	21 Å²	21	35.3 Å²	35.3	14%	0.136	19%	0.192	C	C	.	.	S	Bend	trans	-76.1	-23.4	-177.5	28.4	-35.9	0	0	0	114.3	L116 V118 F147 G156 Y163 K214	L116-P158 HydrophobicContact CD2-CG 4.47Å; V118-P158 HydrophobicContact CG1-CG 4.45Å; V118-P158 HydrophobicContact CG2-CG 3.71Å; F147-P158 HydrophobicContact CD1-CB 3.83Å; F147-P158 HydrophobicContact CD1-CG 4.19Å; F147-P158 HydrophobicContact CD2-CB 4.16Å; F147-P158 HydrophobicContact CD2-CG 3.75Å; F147-P158 HydrophobicContact CE1-CB 3.51Å; F147-P158 HydrophobicContact CE1-CG 4.18Å; F147-P158 HydrophobicContact CE2-CB 3.82Å; F147-P158 HydrophobicContact CE2-CG 3.69Å; F147-P158 HydrophobicContact CG-CB 4.16Å; F147-P158 HydrophobicContact CG-CG 4Å; F147-P158 HydrophobicContact CZ-CB 3.48Å; F147-P158 VanDerWaalsContact CZ-CB 3.48Å; F147-P158 HydrophobicContact CZ-CG 3.93Å; G156-P158 VanDerWaalsContact O-CD 3.23Å; G156-P158 WeakPolarHBondContact O-CD 3.44Å; P158-Y163 WeakPolarHBondContact CD-OH 3.47Å; P158-K214 WeakPolarHBondContact O-CD 3.37Å; P158-K214 VanDerWaalsContact O-CG 3.32Å; P158-K214 WeakPolarHBondContact O-CG 3.33Å
159	V	96.3	Very high	97	Very high	31 Å²	31	35.2 Å²	35.2	19%	0.188	19%	0.192	C	C	.	.	S	Bend	trans	-142.6	165.4	-176.3	-65.9	0	0	0	0	110.2	L116 G161 Y163 L241 E244	L116-V159 HydrophobicContact CD2-CB 4.07Å; L116-V159 HydrophobicContact CD2-CG1 3.38Å; L116-V159 HydrophobicContact CD2-CG2 3.48Å; L116-V159 VanDerWaalsContact CD2-CG2 3.48Å; V159-G161 PolarHBondContact O-N 2.75Å; V159-Y163 WeakPolarHBondContact CG2-OH 3.45Å; V159-Y163 PolarHBondContact O-OH 2.8Å; V159-Y163 VanDerWaalsContact O-OH 3.1Å; V159-L241 HydrophobicContact CG2-CD2 4.25Å; V159-E244 HydrophobicContact CG2-CG 4.03Å
160	N	97.5	Very high	97.1	Very high	69 Å²	69	32.8 Å²	32.8	37%	0.369	18%	0.178	S	C	.	.	S	Bend	trans	-69.9	126	168.3	-63.2	-8.1	0	0	0	108.4	L212 A213 K214 E244 T245	N160-L212 WeakPolarHBondContact CA-O 3.43Å; N160-A213 WeakPolarHBondContact OD1-CA 3.22Å; N160-K214 PolarHBondContact OD1-N 2.97Å; N160-E244 WeakPolarHBondContact O-CA 3.44Å; N160-T245 WeakPolarHBondContact CB-O 3.32Å; N160-T245 PolarHBondContact O-N 3.5Å; N160-T245 PolarHBondContact O-OG1 3.14Å
161	G	97.2	Very high	97.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	173.5	-174.5	0	0	0	0	0	113.6	V159 K211 L212 F243 T245	V159-G161 PolarHBondContact O-N 2.75Å; G161-K211 CarbonylContact O-C 3.48Å; G161-K211 WeakPolarHBondContact O-CA 3.23Å; G161-L212 PolarHBondContact N-O 3.34Å; G161-L212 PolarHBondContact O-N 2.92Å; G161-F243 VanDerWaalsContact CA-O 3.31Å; G161-F243 WeakPolarHBondContact CA-O 3.28Å; G161-T245 PolarHBondContact N-OG1 3.33Å
162	V	98.1	Very high	97.5	Very high	19 Å²	19	24.3 Å²	24.3	12%	0.115	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	126.4	168.3	-177	0	0	0	0	108	V209 L210 K211 L242 F243 T245	V162-V209 HydrophobicContact CG1-CG1 3.34Å; V162-L210 CarbonylContact C-O 3.54Å; V162-L210 WeakPolarHBondContact CA-O 3.2Å; V162-K211 HydrophobicContact CG2-CB 4.48Å; V162-L242 HydrophobicContact CG1-CD1 4.04Å; V162-L242 WeakPolarHBondContact O-CB 3.3Å; V162-L242 PolarHBondContact O-N 2.9Å; V162-F243 HydrophobicContact CB-CD2 4.29Å; V162-F243 HydrophobicContact CB-CE1 4.08Å; V162-F243 HydrophobicContact CB-CE2 3.8Å; V162-F243 HydrophobicContact CB-CZ 3.67Å; V162-F243 HydrophobicContact CG1-CE1 4.41Å; V162-F243 HydrophobicContact CG1-CZ 4.16Å; V162-F243 HydrophobicContact CG2-CD2 4.19Å; V162-F243 HydrophobicContact CG2-CE1 4.42Å; V162-F243 HydrophobicContact CG2-CE2 3.39Å; V162-F243 HydrophobicContact CG2-CZ 3.53Å; V162-F243 PolarHBondContact N-O 2.9Å; V162-F243 PolarHBondContact O-N 2.9Å; V162-T245 HydrophobicContact CG2-CG2 3.98Å
163	Y	98.6	Very high	97.6	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	144.3	-175	-66.5	-96.8	0	0	0	109.9	V118 F155 A157 P158 V159 F165 V209 L210 L212 F240 L241	V118-Y163 HydrophobicContact CG1-CE1 4.22Å; F155-Y163 AromaticContact CE1-CD1 3.95Å; F155-Y163 HydrophobicContact CE1-CD1 3.95Å; F155-Y163 AromaticContact CE1-CE1 3.98Å; F155-Y163 HydrophobicContact CE1-CE1 3.98Å; F155-Y163 AromaticContact CZ-CD1 3.86Å; F155-Y163 HydrophobicContact CZ-CD1 3.86Å; F155-Y163 AromaticContact CZ-CE1 3.66Å; F155-Y163 HydrophobicContact CZ-CE1 3.66Å; A157-Y163 HydrophobicContact CB-CE2 4.22Å; P158-Y163 WeakPolarHBondContact CD-OH 3.47Å; V159-Y163 WeakPolarHBondContact CG2-OH 3.45Å; V159-Y163 PolarHBondContact O-OH 2.8Å; V159-Y163 VanDerWaalsContact O-OH 3.1Å; Y163-F165 VanDerWaalsContact CB-CE2 3.5Å; Y163-F165 HydrophobicContact CG-CE2 4.47Å; Y163-F165 HydrophobicContact CG-CZ 4.46Å; Y163-V209 CarbonylContact O-C 3.59Å; Y163-V209 WeakPolarHBondContact O-CA 3.29Å; Y163-L210 PolarHBondContact N-O 2.83Å; Y163-L210 PolarHBondContact O-N 2.81Å; Y163-L212 HydrophobicContact CD2-CB 3.77Å; Y163-L212 HydrophobicContact CD2-CD1 3.63Å; Y163-L212 HydrophobicContact CD2-CG 3.77Å; Y163-L212 HydrophobicContact CE2-CB 3.87Å; Y163-L212 HydrophobicContact CE2-CD1 4.18Å; Y163-L212 HydrophobicContact CE2-CG 4.35Å; Y163-L212 HydrophobicContact CG-CD1 3.94Å; Y163-L212 HydrophobicContact CG-CG 4.45Å; Y163-F240 WeakPolarHBondContact CA-O 3.38Å; Y163-L241 HydrophobicContact CD1-CB 4.02Å; Y163-L241 HydrophobicContact CD1-CD1 4.2Å; Y163-L241 HydrophobicContact CD2-CD1 4.37Å; Y163-L241 HydrophobicContact CE1-CB 3.72Å; Y163-L241 HydrophobicContact CE1-CD1 3.74Å; Y163-L241 HydrophobicContact CE1-CG 4.29Å; Y163-L241 HydrophobicContact CE2-CD1 3.95Å; Y163-L241 HydrophobicContact CG-CD1 4.49Å
164	F	98.6	Very high	97.6	Very high	55 Å²	55	32 Å²	32	24%	0.241	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	136.3	169.7	178.3	-99.7	0	0	0	109.5	T166 A208 V209 G239 F240 L242	F164-T166 HydrophobicContact CE1-CG2 3.86Å; F164-A208 WeakPolarHBondContact CA-O 3.02Å; F164-V209 HydrophobicContact CD2-CG2 3.86Å; F164-G239 CarbonylContact O-C 3.59Å; F164-G239 WeakPolarHBondContact O-CA 3.4Å; F164-F240 HydrophobicContact CB-CE1 4.11Å; F164-F240 HydrophobicContact CB-CE2 4.32Å; F164-F240 HydrophobicContact CB-CZ 3.98Å; F164-F240 HydrophobicContact CD1-CD1 4.18Å; F164-F240 AromaticContact CD1-CE1 3.43Å; F164-F240 HydrophobicContact CD1-CE1 3.43Å; F164-F240 VanDerWaalsContact CD1-CE1 3.43Å; F164-F240 AromaticContact CD1-CZ 3.87Å; F164-F240 HydrophobicContact CD1-CZ 3.87Å; F164-F240 HydrophobicContact CE1-CE1 4.24Å; F164-F240 HydrophobicContact CG-CE1 4.15Å; F164-F240 HydrophobicContact CG-CZ 4.19Å; F164-F240 PolarHBondContact N-O 3.14Å; F164-F240 PolarHBondContact O-N 3.11Å; F164-L242 HydrophobicContact CB-CD1 4.08Å; F164-L242 HydrophobicContact CB-CG 4.21Å
165	F	98.6	Very high	97.5	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141.3	174.1	-62.2	-84.1	0	0	0	109.8	F120 F155 Y163 S207 A208 L210 L212 V218 F237 A238	F120-F165 HydrophobicContact CE1-CD1 4.12Å; F120-F165 AromaticContact CE1-CE1 3.84Å; F120-F165 HydrophobicContact CE1-CE1 3.84Å; F120-F165 HydrophobicContact CZ-CD1 4.05Å; F120-F165 HydrophobicContact CZ-CE1 4.11Å; F155-F165 HydrophobicContact CB-CE1 4.34Å; F155-F165 AromaticContact CD1-CE1 3.7Å; F155-F165 HydrophobicContact CD1-CE1 3.7Å; F155-F165 AromaticContact CD1-CZ 3.62Å; F155-F165 HydrophobicContact CD1-CZ 3.62Å; F155-F165 HydrophobicContact CE1-CE1 4.2Å; F155-F165 AromaticContact CE1-CZ 3.84Å; F155-F165 HydrophobicContact CE1-CZ 3.84Å; F155-F165 HydrophobicContact CG-CE1 4.04Å; F155-F165 HydrophobicContact CG-CZ 4.41Å; Y163-F165 VanDerWaalsContact CB-CE2 3.5Å; Y163-F165 HydrophobicContact CG-CE2 4.47Å; Y163-F165 HydrophobicContact CG-CZ 4.46Å; F165-S207 CarbonylContact O-C 3.54Å; F165-S207 WeakPolarHBondContact O-CA 3.48Å; F165-S207 VanDerWaalsContact O-CB 3.3Å; F165-S207 WeakPolarHBondContact O-CB 3.32Å; F165-A208 PolarHBondContact N-O 2.74Å; F165-A208 PolarHBondContact O-N 2.98Å; F165-L210 HydrophobicContact CD2-CD1 3.97Å; F165-L210 HydrophobicContact CD2-CG 4.25Å; F165-L210 HydrophobicContact CE2-CB 4.33Å; F165-L210 HydrophobicContact CE2-CD1 4.05Å; F165-L210 HydrophobicContact CE2-CG 4.44Å; F165-L212 HydrophobicContact CE2-CD1 3.91Å; F165-L212 HydrophobicContact CZ-CD1 3.86Å; F165-V218 HydrophobicContact CD1-CG1 4.11Å; F165-V218 HydrophobicContact CD2-CG1 4.34Å; F165-V218 HydrophobicContact CE1-CB 4.09Å; F165-V218 HydrophobicContact CE1-CG1 3.93Å; F165-V218 HydrophobicContact CE2-CB 4.41Å; F165-V218 HydrophobicContact CE2-CG1 4.18Å; F165-V218 HydrophobicContact CE2-CG2 4.07Å; F165-V218 HydrophobicContact CG-CG1 4.3Å; F165-V218 HydrophobicContact CZ-CB 3.91Å; F165-V218 HydrophobicContact CZ-CG1 3.98Å; F165-V218 HydrophobicContact CZ-CG2 3.87Å; F165-F237 HydrophobicContact CB-CE2 4.24Å; F165-F237 HydrophobicContact CD1-CE2 4Å; F165-F237 HydrophobicContact CD1-CZ 4Å; F165-A238 WeakPolarHBondContact CA-O 3.35Å
166	T	98.3	Very high	97.4	Very high	43 Å²	43	34.3 Å²	34.3	26%	0.264	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	144	173.7	-173.3	0	0	0	0	109.8	F164 F237 A238	F164-T166 HydrophobicContact CE1-CG2 3.86Å; T166-F237 WeakPolarHBondContact O-CD2 3.29Å; T166-A238 HydrophobicContact CG2-CB 4.13Å; T166-A238 PolarHBondContact N-O 3.06Å; T166-A238 PolarHBondContact O-N 3.47Å
167	F	97.8	Very high	97.3	Very high	1 Å²	1	36 Å²	36	0%	0.004	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	142.1	176.3	62.5	-81.9	0	0	0	110.5	M169 V180 L182 L192 G205 N206 L220 T236 F237	F167-M169 HydrophobicContact CB-CE 3.86Å; F167-M169 HydrophobicContact CD2-CE 4.17Å; F167-M169 HydrophobicContact CD2-CG 3.94Å; F167-V180 HydrophobicContact CE2-CG1 4.17Å; F167-L182 HydrophobicContact CE1-CB 4.16Å; F167-L192 HydrophobicContact CD2-CD1 4.16Å; F167-L192 HydrophobicContact CE2-CB 3.73Å; F167-L192 HydrophobicContact CE2-CD1 3.65Å; F167-L192 HydrophobicContact CE2-CG 4.32Å; F167-L192 HydrophobicContact CZ-CB 4.13Å; F167-G205 CarbonylContact O-C 3.5Å; F167-G205 WeakPolarHBondContact O-CA 3.2Å; F167-N206 VanDerWaalsContact CD1-O 3.31Å; F167-N206 WeakPolarHBondContact CD1-O 3.35Å; F167-N206 HydrophobicContact CE1-CB 3.89Å; F167-N206 HydrophobicContact CE2-CB 4.37Å; F167-N206 HydrophobicContact CZ-CB 3.71Å; F167-N206 PolarHBondContact N-O 2.88Å; F167-N206 PolarHBondContact O-N 3.42Å; F167-L220 HydrophobicContact CB-CD1 3.64Å; F167-L220 HydrophobicContact CD1-CD1 4.41Å; F167-L220 HydrophobicContact CD1-CD2 3.86Å; F167-L220 HydrophobicContact CD2-CD1 3.78Å; F167-L220 HydrophobicContact CD2-CD2 4.21Å; F167-L220 HydrophobicContact CE1-CD2 4.02Å; F167-L220 HydrophobicContact CE2-CD2 4.33Å; F167-L220 HydrophobicContact CG-CD1 3.71Å; F167-L220 HydrophobicContact CG-CD2 3.97Å; F167-L220 HydrophobicContact CZ-CD2 4.25Å; F167-T236 WeakPolarHBondContact CA-O 3.47Å; F167-T236 WeakPolarHBondContact CB-O 3.16Å; F167-F237 HydrophobicContact CB-CB 4.42Å; F167-F237 HydrophobicContact CB-CD2 3.92Å
168	N	97.7	Very high	97.3	Very high	75 Å²	75	35.9 Å²	35.9	40%	0.401	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131.2	173.1	-64.5	-55.7	0	0	0	108.1	S204 G205 S235 T236	N168-S204 CarbonylContact C-O 3.56Å; N168-S204 WeakPolarHBondContact CA-O 3.38Å; N168-G205 WeakPolarHBondContact OD1-CA 3.26Å; N168-S235 CarbonylContact O-C 3.45Å; N168-S235 VanDerWaalsContact O-CA 3.23Å; N168-S235 WeakPolarHBondContact O-CA 3.19Å; N168-T236 PolarHBondContact N-O 3.07Å; N168-T236 PolarHBondContact O-N 2.6Å
169	M	97.5	Very high	97.3	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	130.1	-173	-64.9	-60.9	117	0	0	109.1	F137 F167 V180 L192 T203 S204 L220 L227 T236	F137-M169 HydrophobicContact CE1-CE 4.08Å; F137-M169 HydrophobicContact CZ-CE 4.09Å; F167-M169 HydrophobicContact CB-CE 3.86Å; F167-M169 HydrophobicContact CD2-CE 4.17Å; F167-M169 HydrophobicContact CD2-CG 3.94Å; M169-V180 HydrophobicContact CG-CG2 4.23Å; M169-L192 HydrophobicContact CB-CD1 4.33Å; M169-L192 HydrophobicContact CB-CD2 4.33Å; M169-L192 HydrophobicContact CG-CD1 4.32Å; M169-T203 WeakPolarHBondContact O-CA 3.29Å; M169-S204 PolarHBondContact N-O 3.35Å; M169-S204 PolarHBondContact O-N 3.05Å; M169-L220 HydrophobicContact CE-CD1 3.8Å; M169-L220 HydrophobicContact SD-CD1 4.44Å; M169-L227 HydrophobicContact CB-CD2 3.72Å; M169-L227 HydrophobicContact CG-CD2 4.22Å; M169-L227 HydrophobicContact SD-CD1 3.86Å; M169-L227 HydrophobicContact SD-CD2 4.2Å; M169-T236 WeakPolarHBondContact CE-O 3.4Å
170	M	97.3	Very high	97.4	Very high	21 Å²	21	36.9 Å²	36.9	10%	0.103	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	123.8	169.7	-179.2	176.4	-83.1	0	0	109.5	D202 T203 L227 H228 F234 S235	M170-D202 WeakPolarHBondContact CA-O 3.26Å; M170-T203 HydrophobicContact CB-CG2 4.02Å; M170-T203 HydrophobicContact CE-CG2 3.54Å; M170-T203 HydrophobicContact CG-CG2 4.07Å; M170-L227 WeakPolarHBondContact O-CA 3.25Å; M170-H228 HydrophobicContact CB-CB 4.03Å; M170-H228 HydrophobicContact CG-CB 3.78Å; M170-H228 PolarHBondContact O-N 3.26Å; M170-H228 HydrophobicContact SD-CB 3.95Å; M170-F234 HydrophobicContact CB-CB 3.79Å; M170-F234 HydrophobicContact CE-CB 3.64Å; M170-F234 HydrophobicContact CE-CD1 3.38Å; M170-F234 HydrophobicContact CE-CD2 3.77Å; M170-F234 HydrophobicContact CE-CE1 3.84Å; M170-F234 HydrophobicContact CE-CE2 4.16Å; M170-F234 HydrophobicContact CE-CG 3.31Å; M170-F234 HydrophobicContact CE-CZ 4.18Å; M170-F234 HydrophobicContact CG-CB 4.38Å; M170-F234 HydrophobicContact SD-CB 3.72Å; M170-F234 HydrophobicContact SD-CD1 4.32Å; M170-F234 HydrophobicContact SD-CD2 3.63Å; M170-F234 HydrophobicContact SD-CE2 4.24Å; M170-F234 HydrophobicContact SD-CG 3.64Å; M170-S235 PolarHBondContact N-OG 2.77Å
171	K	97	Very high	97.4	Very high	1 Å²	1	36 Å²	36	0%	0.004	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-66.9	135.5	173.7	-172.3	-154.5	65	151.8	0	109.6	V175 V178 E196 S197 K200 D202	K171-V175 HydrophobicContact CD-CG2 4.25Å; K171-V175 WeakPolarHBondContact CE-O 3.36Å; K171-V175 HydrophobicContact CG-CG2 3.81Å; K171-V175 PolarHBondContact NZ-O 3.4Å; K171-V178 HydrophobicContact CB-CG1 3.97Å; K171-V178 HydrophobicContact CG-CB 4.18Å; K171-V178 HydrophobicContact CG-CG1 3.95Å; K171-E196 PolarHBondContact NZ-O 2.99Å; K171-S197 PolarHBondContact NZ-O 2.76Å; K171-K200 VanDerWaalsContact CE-O 3.24Å; K171-K200 WeakPolarHBondContact CE-O 3.46Å; K171-K200 PolarHBondContact NZ-O 2.96Å; K171-D202 PolarHBondContact N-O 3Å
172	H	96.9	Very high	97.4	Very high	23 Å²	23	36 Å²	36	11%	0.106	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-68.9	144.3	171.2	-161.1	-96	0	0	0	111.2	H127 D174 V175 A226 H228	H127-H172 AromaticContact CE1-CD2 3.79Å; H127-H172 AromaticContact CE1-NE2 3.61Å; H127-H172 AromaticContact CG-CD2 3.89Å; H127-H172 AromaticContact CG-NE2 3.88Å; H127-H172 AromaticContact ND1-CD2 3.34Å; H127-H172 PolarHBondContact ND1-CD2 2.84Å; H127-H172 VanDerWaalsContact ND1-CD2 3.34Å; H127-H172 AromaticContact ND1-NE2 3.54Å; H172-D174 VanDerWaalsContact C-N 3.26Å; H172-D174 IonicContact CE1-OD2 3.85Å; H172-D174 PolarHBondContact CE1-OD2 2.74Å; H172-D174 WeakPolarHBondContact ND1-CB 3.41Å; H172-D174 PolarHBondContact ND1-N 3.27Å; H172-D174 IonicContact ND1-OD2 3.64Å; H172-D174 PolarHBondContact ND1-OD2 2.78Å; H172-D174 PolarHBondContact O-N 2.98Å; H172-V175 HydrophobicContact CB-CG2 4.32Å; H172-V175 VanDerWaalsContact O-CG2 3.25Å; H172-V175 WeakPolarHBondContact O-CG2 3.49Å; H172-V175 PolarHBondContact O-N 3.16Å; H172-A226 HydrophobicContact CB-CB 3.71Å; H172-A226 WeakPolarHBondContact CB-O 3.46Å; H172-A226 PolarHBondContact N-O 2.81Å; H172-H228 AromaticContact CD2-ND1 3.85Å
173	E	95.9	Very high	97.5	Very high	103 Å²	103	35.4 Å²	35.4	48%	0.481	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-22.7	-175.3	61.9	-177.1	-176.4	0	0	114.3	V175 K198 G199	E173-V175 VanDerWaalsContact C-N 3.26Å; E173-V175 PolarHBondContact O-N 3.35Å; E173-K198 CarbonylContact O-C 3.48Å; E173-K198 WeakPolarHBondContact O-CA 3.05Å; E173-G199 PolarHBondContact O-N 3.48Å
174	D	95.6	Very high	97.4	Very high	110 Å²	110	37.6 Å²	37.6	59%	0.588	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-13.4	179.4	-68.8	-27.2	0	0	0	114.2	H172	H172-D174 VanDerWaalsContact C-N 3.26Å; H172-D174 IonicContact CE1-OD2 3.85Å; H172-D174 PolarHBondContact CE1-OD2 2.74Å; H172-D174 WeakPolarHBondContact ND1-CB 3.41Å; H172-D174 PolarHBondContact ND1-N 3.27Å; H172-D174 IonicContact ND1-OD2 3.64Å; H172-D174 PolarHBondContact ND1-OD2 2.78Å; H172-D174 PolarHBondContact O-N 2.98Å
175	V	96.4	Very high	97.3	Very high	31 Å²	31	38.8 Å²	38.8	19%	0.188	19%	0.19	C	C	.	.			trans	-114.1	152.4	-179.1	-60.4	0	0	0	0	111.2	K171 H172 E173 A226	K171-V175 HydrophobicContact CD-CG2 4.25Å; K171-V175 WeakPolarHBondContact CE-O 3.36Å; K171-V175 HydrophobicContact CG-CG2 3.81Å; K171-V175 PolarHBondContact NZ-O 3.4Å; H172-V175 HydrophobicContact CB-CG2 4.32Å; H172-V175 VanDerWaalsContact O-CG2 3.25Å; H172-V175 WeakPolarHBondContact O-CG2 3.49Å; H172-V175 PolarHBondContact O-N 3.16Å; E173-V175 VanDerWaalsContact C-N 3.26Å; E173-V175 PolarHBondContact O-N 3.35Å; V175-A226 HydrophobicContact CG1-CB 3.81Å; V175-A226 HydrophobicContact CG2-CB 4.14Å
176	E	96.8	Very high	97.2	Very high	88 Å²	88	40.8 Å²	40.8	41%	0.411	21%	0.211	S	C	.	.	S	Bend	trans	-87.9	-31.8	178.1	-71	170.1	-172.1	0	0	111.9	Y195 E196 K198	E176-Y195 HydrophobicContact CB-CD2 4.46Å; E176-Y195 HydrophobicContact CB-CE2 4.04Å; E176-Y195 CarbonylContact O-C 3.55Å; E176-Y195 VanDerWaalsContact O-CA 3.3Å; E176-Y195 WeakPolarHBondContact O-CA 3.23Å; E176-E196 CarbonylContact C-O 3.6Å; E176-E196 VanDerWaalsContact CA-O 3.27Å; E176-E196 WeakPolarHBondContact CA-O 3.17Å; E176-E196 PolarHBondContact O-N 2.93Å; E176-K198 HydrophobicContact CG-CD 4.29Å; E176-K198 HydrophobicContact CG-CG 3.58Å; E176-K198 VanDerWaalsContact OE1-CE 3.3Å; E176-K198 WeakPolarHBondContact OE1-CE 3.5Å
177	E	95.9	Very high	97.1	Very high	59 Å²	59	44.2 Å²	44.2	28%	0.276	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	155.5	-177.2	59.1	175.1	-145.2	0	0	112.2	Y193 S194 Y195 N224 G225	E177-Y193 HydrophobicContact CB-CE2 3.91Å; E177-S194 CarbonylContact C-O 3.49Å; E177-S194 VanDerWaalsContact CA-O 3.24Å; E177-S194 WeakPolarHBondContact CA-O 3.46Å; E177-Y195 HydrophobicContact CB-CD2 4.25Å; E177-N224 PolarHBondContact OE1-ND2 3.29Å; E177-G225 VanDerWaalsContact O-CA 3.26Å; E177-G225 WeakPolarHBondContact O-CA 3.42Å
178	V	97.4	Very high	97	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	137.4	167.9	66.5	0	0	0	0	111.1	K171 V180 L192 Y193 S194 M222 N224 L227	K171-V178 HydrophobicContact CB-CG1 3.97Å; K171-V178 HydrophobicContact CG-CB 4.18Å; K171-V178 HydrophobicContact CG-CG1 3.95Å; V178-V180 HydrophobicContact CG2-CG2 4.17Å; V178-L192 HydrophobicContact CG1-CD2 4.47Å; V178-Y193 WeakPolarHBondContact O-CA 3.3Å; V178-S194 PolarHBondContact N-O 2.77Å; V178-S194 PolarHBondContact O-N 2.8Å; V178-S194 VanDerWaalsContact O-N 3.1Å; V178-M222 HydrophobicContact CG2-CE 3.9Å; V178-M222 HydrophobicContact CG2-SD 4.36Å; V178-N224 WeakPolarHBondContact CA-O 3.41Å; V178-L227 HydrophobicContact CG2-CD2 3.71Å; V178-L227 HydrophobicContact CG2-CG 4.15Å
179	Y	97.3	Very high	96.9	Very high	73 Å²	73	45.9 Å²	45.9	29%	0.286	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	128.1	172.2	-77.1	-87.2	0	0	0	110.1	L192 Y193 G223 N224	Y179-L192 WeakPolarHBondContact CA-O 3.43Å; Y179-Y193 AromaticContact CD1-CD2 3.73Å; Y179-Y193 HydrophobicContact CD1-CD2 3.73Å; Y179-Y193 HydrophobicContact CD1-CG 4.29Å; Y179-Y193 AromaticContact CD2-CD2 3.8Å; Y179-Y193 HydrophobicContact CD2-CD2 3.8Å; Y179-Y193 HydrophobicContact CD2-CE2 4.1Å; Y179-Y193 AromaticContact CE1-CD2 3.24Å; Y179-Y193 HydrophobicContact CE1-CD2 3.24Å; Y179-Y193 AromaticContact CE1-CE2 3.96Å; Y179-Y193 HydrophobicContact CE1-CE2 3.96Å; Y179-Y193 AromaticContact CE1-CG 3.74Å; Y179-Y193 HydrophobicContact CE1-CG 3.74Å; Y179-Y193 AromaticContact CE2-CD2 3.34Å; Y179-Y193 HydrophobicContact CE2-CD2 3.34Å; Y179-Y193 AromaticContact CE2-CE2 3.32Å; Y179-Y193 HydrophobicContact CE2-CE2 3.32Å; Y179-Y193 AromaticContact CG-CD2 4Å; Y179-Y193 HydrophobicContact CG-CD2 4Å; Y179-Y193 AromaticContact CZ-CD2 3.03Å; Y179-Y193 AromaticContact CZ-CE2 3.24Å; Y179-Y193 AromaticContact CZ-CG 3.89Å; Y179-Y193 WeakPolarHBondContact OH-CD2 3.37Å; Y179-Y193 WeakPolarHBondContact OH-CE2 3.39Å; Y179-G223 WeakPolarHBondContact O-CA 3.46Å; Y179-G223 PolarHBondContact O-N 2.8Å; Y179-N224 HydrophobicContact CD2-CB 4.11Å; Y179-N224 PolarHBondContact N-O 3.47Å
180	V	98.1	Very high	96.7	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	141.1	174.9	179.1	0	0	0	0	109.4	I135 F167 M169 V178 S191 L192 L220 M222 L227	I135-V180 HydrophobicContact CD1-CG1 3.7Å; I135-V180 HydrophobicContact CD1-CG2 4.09Å; F167-V180 HydrophobicContact CE2-CG1 4.17Å; M169-V180 HydrophobicContact CG-CG2 4.23Å; V178-V180 HydrophobicContact CG2-CG2 4.17Å; V180-S191 CarbonylContact O-C 3.54Å; V180-S191 WeakPolarHBondContact O-CA 3.2Å; V180-L192 HydrophobicContact CB-CB 4.31Å; V180-L192 HydrophobicContact CB-CD2 4.28Å; V180-L192 HydrophobicContact CG2-CD2 4.35Å; V180-L192 PolarHBondContact N-O 3.06Å; V180-L192 PolarHBondContact O-N 3.03Å; V180-L220 HydrophobicContact CG1-CB 4.09Å; V180-L220 HydrophobicContact CG1-CD1 4.26Å; V180-L220 HydrophobicContact CG1-CD2 4.43Å; V180-M222 HydrophobicContact CG2-SD 4.37Å; V180-L227 HydrophobicContact CG2-CD1 4.08Å; V180-L227 HydrophobicContact CG2-CD2 4.26Å
181	Y	98	Very high	96.6	Very high	52 Å²	52	52.2 Å²	52.2	20%	0.204	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.6	-178.8	-56.5	-71.8	0	0	0	110.7	M183 T188 S191 L220 R221	Y181-M183 VanDerWaalsContact CB-SD 3.59Å; Y181-T188 HydrophobicContact CD1-CG2 3.66Å; Y181-T188 HydrophobicContact CG-CG2 4.23Å; Y181-S191 VanDerWaalsContact CD1-OG 3.29Å; Y181-S191 WeakPolarHBondContact CD1-OG 3.38Å; Y181-S191 WeakPolarHBondContact CE1-OG 3.37Å; Y181-L220 CarbonylContact O-C 3.59Å; Y181-L220 WeakPolarHBondContact O-CA 3.37Å; Y181-R221 PolarHBondContact N-O 3.29Å; Y181-R221 PolarHBondContact O-N 3.35Å
182	L	98.4	Very high	96.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	121.4	163.1	-176	72.7	0	0	0	108.2	F167 V189 F190 A208 L210 V218 L220 F237	F167-L182 HydrophobicContact CE1-CB 4.16Å; L182-V189 PolarHBondContact O-N 2.75Å; L182-F190 HydrophobicContact CD2-CD2 4.47Å; L182-F190 PolarHBondContact N-O 2.91Å; L182-A208 HydrophobicContact CD2-CB 3.63Å; L182-L210 HydrophobicContact CD2-CD1 4.21Å; L182-V218 HydrophobicContact CD1-CG1 3.6Å; L182-V218 HydrophobicContact CG-CG1 4.24Å; L182-L220 HydrophobicContact CB-CD2 4.06Å; L182-L220 HydrophobicContact CD1-CD2 3.53Å; L182-L220 HydrophobicContact CG-CD2 4.42Å; L182-F237 HydrophobicContact CD1-CE2 4.17Å; L182-F237 HydrophobicContact CD1-CZ 4.17Å
183	M	98.3	Very high	96.5	Very high	5 Å²	5	56.6 Å²	56.6	3%	0.025	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	141	-176.4	-51.9	-58.4	-61.7	0	0	110.3	Y181 G186 N187 V218 W219 R221	Y181-M183 VanDerWaalsContact CB-SD 3.59Å; M183-G186 WeakPolarHBondContact CE-O 2.99Å; M183-N187 CarbonylContact C-O 3.54Å; M183-N187 VanDerWaalsContact CA-O 3.3Å; M183-N187 WeakPolarHBondContact CA-O 3.45Å; M183-V218 VanDerWaalsContact O-CA 3.27Å; M183-V218 WeakPolarHBondContact O-CA 3.4Å; M183-W219 HydrophobicContact CB-CD2 3.62Å; M183-W219 VanDerWaalsContact CB-CE2 3.44Å; M183-W219 HydrophobicContact CB-CE3 3.99Å; M183-W219 HydrophobicContact CB-CG 4.13Å; M183-W219 HydrophobicContact CB-CH2 4.14Å; M183-W219 HydrophobicContact CB-CZ2 3.73Å; M183-W219 HydrophobicContact CB-CZ3 4.23Å; M183-W219 WeakPolarHBondContact CB-O 3.24Å; M183-W219 HydrophobicContact CG-CD2 4.21Å; M183-W219 HydrophobicContact CG-CG 4.4Å; M183-W219 HydrophobicContact CG-CZ2 4.11Å; M183-W219 PolarHBondContact N-O 2.73Å; M183-W219 PolarHBondContact O-N 3.03Å; M183-R221 HydrophobicContact CG-CB 3.61Å; M183-R221 HydrophobicContact SD-CB 3.87Å
184	H	97.9	Very high	96.6	Very high	47 Å²	47	51.9 Å²	51.9	22%	0.218	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	115.5	167.4	170.4	-147.4	0	0	0	108.6	G186 N187 V189 D216 E217	H184-G186 PolarHBondContact O-N 2.82Å; H184-N187 PolarHBondContact N-O 3.09Å; H184-N187 PolarHBondContact O-N 3.36Å; H184-V189 HydrophobicContact CB-CG2 3.41Å; H184-V189 VanDerWaalsContact CB-CG2 3.41Å; H184-D216 IonicContact CD2-OD2 4Å; H184-D216 IonicContact CE1-OD2 3.35Å; H184-D216 VanDerWaalsContact NE2-CG 3.31Å; H184-D216 IonicContact NE2-OD1 3.93Å; H184-D216 IonicContact NE2-OD2 2.9Å; H184-D216 PolarHBondContact NE2-OD2 2.86Å; H184-E217 WeakPolarHBondContact CA-O 3.29Å
185	N	97.1	Very high	96.6	Very high	79 Å²	79	52.9 Å²	52.9	42%	0.422	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.8	34.7	-178.1	-66.7	-12.8	0	0	0	114.1	D216 E217	N185-D216 PolarHBondContact ND2-OD1 2.9Å; N185-D216 WeakPolarHBondContact OD1-CA 3.48Å; N185-E217 PolarHBondContact N-O 2.87Å; N185-E217 PolarHBondContact OD1-N 3.47Å
186	G	94.6	Very high	96.6	Very high	42 Å²	42	54 Å²	54	43%	0.433	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.4	-9.4	178.3	0	0	0	0	0	114.9	M183 H184	M183-G186 WeakPolarHBondContact CE-O 2.99Å; H184-G186 PolarHBondContact O-N 2.82Å
187	N	96.5	Very high	96.6	Very high	115 Å²	115	52.4 Å²	52.4	62%	0.615	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	140	174.8	-60	-55.9	0	0	0	110.8	M183 H184 V189	M183-N187 CarbonylContact C-O 3.54Å; M183-N187 VanDerWaalsContact CA-O 3.3Å; M183-N187 WeakPolarHBondContact CA-O 3.45Å; H184-N187 PolarHBondContact N-O 3.09Å; H184-N187 PolarHBondContact O-N 3.36Å; N187-V189 PolarHBondContact O-N 2.93Å
188	T	96.5	Very high	96.5	Very high	66 Å²	66	55.9 Å²	55.9	41%	0.405	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	123.9	170.6	-60	0	0	0	0	109.4	Y181	Y181-T188 HydrophobicContact CD1-CG2 3.66Å; Y181-T188 HydrophobicContact CG-CG2 4.23Å
189	V	94.8	Very high	96.4	Very high	46 Å²	46	58.6 Å²	58.6	28%	0.279	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	-56.5	173.9	-170.5	0	0	0	0	110.1	L182 H184 N187 L210	L182-V189 PolarHBondContact O-N 2.75Å; H184-V189 HydrophobicContact CB-CG2 3.41Å; H184-V189 VanDerWaalsContact CB-CG2 3.41Å; N187-V189 PolarHBondContact O-N 2.93Å; V189-L210 HydrophobicContact CG1-CD2 3.78Å
190	F	93.3	Very high	96.2	Very high	94 Å²	94	60.5 Å²	60.5	41%	0.412	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	158	178.7	-62.1	-69.3	0	0	0	110.5	L182 A208	L182-F190 HydrophobicContact CD2-CD2 4.47Å; L182-F190 PolarHBondContact N-O 2.91Å; F190-A208 HydrophobicContact CD2-CB 3.69Å; F190-A208 HydrophobicContact CE2-CB 3.65Å
191	S	94.9	Very high	95.8	Very high	61 Å²	61	63.5 Å²	63.5	43%	0.427	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	151.2	179.2	-50	0	0	0	0	110	V180 Y181 N206	V180-S191 CarbonylContact O-C 3.54Å; V180-S191 WeakPolarHBondContact O-CA 3.2Å; Y181-S191 VanDerWaalsContact CD1-OG 3.29Å; Y181-S191 WeakPolarHBondContact CD1-OG 3.38Å; Y181-S191 WeakPolarHBondContact CE1-OG 3.37Å; S191-N206 PolarHBondContact O-ND2 3.33Å
192	L	96.7	Very high	95.7	Very high	7 Å²	7	63.5 Å²	63.5	4%	0.037	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.7	166.2	174	148.5	0	0	0	107.1	F167 M169 V178 Y179 V180 S204	F167-L192 HydrophobicContact CD2-CD1 4.16Å; F167-L192 HydrophobicContact CE2-CB 3.73Å; F167-L192 HydrophobicContact CE2-CD1 3.65Å; F167-L192 HydrophobicContact CE2-CG 4.32Å; F167-L192 HydrophobicContact CZ-CB 4.13Å; M169-L192 HydrophobicContact CB-CD1 4.33Å; M169-L192 HydrophobicContact CB-CD2 4.33Å; M169-L192 HydrophobicContact CG-CD1 4.32Å; V178-L192 HydrophobicContact CG1-CD2 4.47Å; Y179-L192 WeakPolarHBondContact CA-O 3.43Å; V180-L192 HydrophobicContact CB-CB 4.31Å; V180-L192 HydrophobicContact CB-CD2 4.28Å; V180-L192 HydrophobicContact CG2-CD2 4.35Å; V180-L192 PolarHBondContact N-O 3.06Å; V180-L192 PolarHBondContact O-N 3.03Å; L192-S204 VanDerWaalsContact CD1-C 3.44Å; L192-S204 WeakPolarHBondContact CD1-O 3.31Å
193	Y	96.7	Very high	95.6	Very high	109 Å²	109	67.5 Å²	67.5	43%	0.427	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	133.4	173.2	172.8	-111.8	0	0	0	108.2	E177 V178 Y179 Y195	E177-Y193 HydrophobicContact CB-CE2 3.91Å; V178-Y193 WeakPolarHBondContact O-CA 3.3Å; Y179-Y193 AromaticContact CD1-CD2 3.73Å; Y179-Y193 HydrophobicContact CD1-CD2 3.73Å; Y179-Y193 HydrophobicContact CD1-CG 4.29Å; Y179-Y193 AromaticContact CD2-CD2 3.8Å; Y179-Y193 HydrophobicContact CD2-CD2 3.8Å; Y179-Y193 HydrophobicContact CD2-CE2 4.1Å; Y179-Y193 AromaticContact CE1-CD2 3.24Å; Y179-Y193 HydrophobicContact CE1-CD2 3.24Å; Y179-Y193 AromaticContact CE1-CE2 3.96Å; Y179-Y193 HydrophobicContact CE1-CE2 3.96Å; Y179-Y193 AromaticContact CE1-CG 3.74Å; Y179-Y193 HydrophobicContact CE1-CG 3.74Å; Y179-Y193 AromaticContact CE2-CD2 3.34Å; Y179-Y193 HydrophobicContact CE2-CD2 3.34Å; Y179-Y193 AromaticContact CE2-CE2 3.32Å; Y179-Y193 HydrophobicContact CE2-CE2 3.32Å; Y179-Y193 AromaticContact CG-CD2 4Å; Y179-Y193 HydrophobicContact CG-CD2 4Å; Y179-Y193 AromaticContact CZ-CD2 3.03Å; Y179-Y193 AromaticContact CZ-CE2 3.24Å; Y179-Y193 AromaticContact CZ-CG 3.89Å; Y179-Y193 WeakPolarHBondContact OH-CD2 3.37Å; Y179-Y193 WeakPolarHBondContact OH-CE2 3.39Å; Y193-Y195 WeakPolarHBondContact OH-CB 3.17Å
194	S	96.6	Very high	95.5	Very high	5 Å²	5	68.7 Å²	68.7	4%	0.035	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	140.2	171.5	158.7	0	0	0	0	108.2	E177 V178 D202 S204	E177-S194 CarbonylContact C-O 3.49Å; E177-S194 VanDerWaalsContact CA-O 3.24Å; E177-S194 WeakPolarHBondContact CA-O 3.46Å; V178-S194 PolarHBondContact N-O 2.77Å; V178-S194 PolarHBondContact O-N 2.8Å; V178-S194 VanDerWaalsContact O-N 3.1Å; S194-D202 WeakPolarHBondContact CB-OD2 3.36Å; S194-D202 PolarHBondContact OG-OD2 3.1Å; S194-S204 WeakPolarHBondContact CB-OG 3.44Å
195	Y	96.6	Very high	95.5	Very high	130 Å²	130	68.4 Å²	68.4	51%	0.51	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	129.3	175.7	174.3	-86.1	0	0	0	109.4	E176 E177 Y193	E176-Y195 HydrophobicContact CB-CD2 4.46Å; E176-Y195 HydrophobicContact CB-CE2 4.04Å; E176-Y195 CarbonylContact O-C 3.55Å; E176-Y195 VanDerWaalsContact O-CA 3.3Å; E176-Y195 WeakPolarHBondContact O-CA 3.23Å; E177-Y195 HydrophobicContact CB-CD2 4.25Å; Y193-Y195 WeakPolarHBondContact OH-CB 3.17Å
196	E	96.4	Very high	95.5	Very high	55 Å²	55	67.5 Å²	67.5	26%	0.257	39%	0.388	S	S	.	.			trans	-157.4	151.9	171.8	175.6	58.9	-91.8	0	0	108.9	K171 E176 K200 D202	K171-E196 PolarHBondContact NZ-O 2.99Å; E176-E196 CarbonylContact C-O 3.6Å; E176-E196 VanDerWaalsContact CA-O 3.27Å; E176-E196 WeakPolarHBondContact CA-O 3.17Å; E176-E196 PolarHBondContact O-N 2.93Å; E196-K200 HydrophobicContact CG-CB 3.54Å; E196-K200 HydrophobicContact CG-CD 4.03Å; E196-K200 HydrophobicContact CG-CG 4.49Å; E196-K200 WeakPolarHBondContact OE1-CD 3.47Å; E196-K200 IonicContact OE1-NZ 3.85Å; E196-D202 HydrophobicContact CB-CB 4.02Å
197	S	96.4	Very high	95.7	Very high	55 Å²	55	68.3 Å²	68.3	39%	0.385	39%	0.387	S	S	.	.			trans	-51.5	150.4	177.1	-41.5	0	0	0	0	112.4	K171 K200	K171-S197 PolarHBondContact NZ-O 2.76Å; S197-K200 PolarHBondContact O-N 2.82Å
198	K	94.8	Very high	95.7	Very high	132 Å²	132	63 Å²	63	57%	0.574	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	147.6	173.6	-62.8	-173.2	-180	176.6	0	111.8	E173 E176 K200	E173-K198 CarbonylContact O-C 3.48Å; E173-K198 WeakPolarHBondContact O-CA 3.05Å; E176-K198 HydrophobicContact CG-CD 4.29Å; E176-K198 HydrophobicContact CG-CG 3.58Å; E176-K198 VanDerWaalsContact OE1-CE 3.3Å; E176-K198 WeakPolarHBondContact OE1-CE 3.5Å; K198-K200 PolarHBondContact O-N 3.03Å
199	G	94.3	Very high	95.8	Very high	57 Å²	57	64 Å²	64	59%	0.588	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.7	5.2	-175.4	0	0	0	0	0	114.1	E173	E173-G199 PolarHBondContact O-N 3.48Å
200	K	93.8	Very high	95.9	Very high	113 Å²	113	62.8 Å²	62.8	49%	0.491	36%	0.357	S	S	.	.			trans	-122.9	134	172.6	-69.1	-178.6	179	-177.4	0	110.1	K171 E196 S197 K198	K171-K200 VanDerWaalsContact CE-O 3.24Å; K171-K200 WeakPolarHBondContact CE-O 3.46Å; K171-K200 PolarHBondContact NZ-O 2.96Å; E196-K200 HydrophobicContact CG-CB 3.54Å; E196-K200 HydrophobicContact CG-CD 4.03Å; E196-K200 HydrophobicContact CG-CG 4.49Å; E196-K200 WeakPolarHBondContact OE1-CD 3.47Å; E196-K200 IonicContact OE1-NZ 3.85Å; S197-K200 PolarHBondContact O-N 2.82Å; K198-K200 PolarHBondContact O-N 3.03Å
201	A	89.8	Confident	96.1	Very high	63 Å²	63	65.7 Å²	65.7	52%	0.521	37%	0.369	S	S	.	.			trans	-82.9	146.4	170.5	0	0	0	0	0	110.1
202	D	95.5	Very high	96.3	Very high	53 Å²	53	62.9 Å²	62.9	28%	0.283	35%	0.35	S	S	.	.			trans	-136.7	150.5	169	-178.7	41.3	0	0	0	108.6	M170 K171 S194 E196	M170-D202 WeakPolarHBondContact CA-O 3.26Å; K171-D202 PolarHBondContact N-O 3Å; S194-D202 WeakPolarHBondContact CB-OD2 3.36Å; S194-D202 PolarHBondContact OG-OD2 3.1Å; E196-D202 HydrophobicContact CB-CB 4.02Å
203	T	95.9	Very high	96.4	Very high	84 Å²	84	64.7 Å²	64.7	52%	0.515	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.7	176.1	61.6	0	0	0	0	109.9	M169 M170	M169-T203 WeakPolarHBondContact O-CA 3.29Å; M170-T203 HydrophobicContact CB-CG2 4.02Å; M170-T203 HydrophobicContact CE-CG2 3.54Å; M170-T203 HydrophobicContact CG-CG2 4.07Å
204	S	96.9	Very high	96.4	Very high	30 Å²	30	66.8 Å²	66.8	21%	0.21	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	150.5	177.9	-76.8	0	0	0	0	109.4	N168 M169 L192 S194	N168-S204 CarbonylContact C-O 3.56Å; N168-S204 WeakPolarHBondContact CA-O 3.38Å; M169-S204 PolarHBondContact N-O 3.35Å; M169-S204 PolarHBondContact O-N 3.05Å; L192-S204 VanDerWaalsContact CD1-C 3.44Å; L192-S204 WeakPolarHBondContact CD1-O 3.31Å; S194-S204 WeakPolarHBondContact CB-OG 3.44Å
205	G	97.3	Very high	96.4	Very high	41 Å²	41	69.2 Å²	69.2	42%	0.423	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	156.5	179.9	0	0	0	0	0	112.3	F167 N168	F167-G205 CarbonylContact O-C 3.5Å; F167-G205 WeakPolarHBondContact O-CA 3.2Å; N168-G205 WeakPolarHBondContact OD1-CA 3.26Å
206	N	97.7	Very high	96.5	Very high	59 Å²	59	64.2 Å²	64.2	32%	0.316	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	160.9	172.7	-152.8	-17.5	0	0	0	110	F167 S191	F167-N206 VanDerWaalsContact CD1-O 3.31Å; F167-N206 WeakPolarHBondContact CD1-O 3.35Å; F167-N206 HydrophobicContact CE1-CB 3.89Å; F167-N206 HydrophobicContact CE2-CB 4.37Å; F167-N206 HydrophobicContact CZ-CB 3.71Å; F167-N206 PolarHBondContact N-O 2.88Å; F167-N206 PolarHBondContact O-N 3.42Å; S191-N206 PolarHBondContact O-ND2 3.33Å
207	S	97.5	Very high	96.6	Very high	59 Å²	59	65.3 Å²	65.3	41%	0.413	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	155.8	-179.2	64.2	0	0	0	0	111.5	F165	F165-S207 CarbonylContact O-C 3.54Å; F165-S207 WeakPolarHBondContact O-CA 3.48Å; F165-S207 VanDerWaalsContact O-CB 3.3Å; F165-S207 WeakPolarHBondContact O-CB 3.32Å
208	A	96.9	Very high	96.7	Very high	5 Å²	5	62.7 Å²	62.7	4%	0.041	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	141.8	-177.4	0	0	0	0	0	111.3	F164 F165 L182 F190 L210	F164-A208 WeakPolarHBondContact CA-O 3.02Å; F165-A208 PolarHBondContact N-O 2.74Å; F165-A208 PolarHBondContact O-N 2.98Å; L182-A208 HydrophobicContact CD2-CB 3.63Å; F190-A208 HydrophobicContact CD2-CB 3.69Å; F190-A208 HydrophobicContact CE2-CB 3.65Å; A208-L210 HydrophobicContact CB-CD2 4.14Å; A208-L210 HydrophobicContact CB-CG 4.14Å
209	V	98.3	Very high	96.9	Very high	87 Å²	87	57.3 Å²	57.3	53%	0.527	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	117.1	165.3	178.7	0	0	0	0	107.4	V162 Y163 F164 L242	V162-V209 HydrophobicContact CG1-CG1 3.34Å; Y163-V209 CarbonylContact O-C 3.59Å; Y163-V209 WeakPolarHBondContact O-CA 3.29Å; F164-V209 HydrophobicContact CD2-CG2 3.86Å; V209-L242 HydrophobicContact CG1-CD1 4.09Å
210	L	98	Very high	97.1	Very high	19 Å²	19	54.6 Å²	54.6	10%	0.099	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.9	-174.9	-56.8	-179.7	0	0	0	110.8	V162 Y163 F165 L182 V189 A208 L212 V218	V162-L210 CarbonylContact C-O 3.54Å; V162-L210 WeakPolarHBondContact CA-O 3.2Å; Y163-L210 PolarHBondContact N-O 2.83Å; Y163-L210 PolarHBondContact O-N 2.81Å; F165-L210 HydrophobicContact CD2-CD1 3.97Å; F165-L210 HydrophobicContact CD2-CG 4.25Å; F165-L210 HydrophobicContact CE2-CB 4.33Å; F165-L210 HydrophobicContact CE2-CD1 4.05Å; F165-L210 HydrophobicContact CE2-CG 4.44Å; L182-L210 HydrophobicContact CD2-CD1 4.21Å; V189-L210 HydrophobicContact CG1-CD2 3.78Å; A208-L210 HydrophobicContact CB-CD2 4.14Å; A208-L210 HydrophobicContact CB-CG 4.14Å; L210-L212 HydrophobicContact CB-CD2 3.85Å; L210-L212 HydrophobicContact CB-CG 4.17Å; L210-L212 HydrophobicContact CD1-CD2 4.43Å; L210-V218 HydrophobicContact CD1-CG2 4.25Å
211	K	98	Very high	97.3	Very high	155 Å²	155	52.4 Å²	52.4	67%	0.674	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	116.9	164.1	-175.4	179.8	-180	-179.1	0	107.9	G161 V162	G161-K211 CarbonylContact O-C 3.48Å; G161-K211 WeakPolarHBondContact O-CA 3.23Å; V162-K211 HydrophobicContact CG2-CB 4.48Å
212	L	98.4	Very high	97.7	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.016	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	143.8	-178.1	-57.1	-177.7	0	0	0	110.4	F155 A157 N160 G161 Y163 F165 L210 D216 V218	F155-L212 HydrophobicContact CE1-CD1 4.25Å; A157-L212 HydrophobicContact CB-CB 3.89Å; A157-L212 HydrophobicContact CB-CD1 4Å; N160-L212 WeakPolarHBondContact CA-O 3.43Å; G161-L212 PolarHBondContact N-O 3.34Å; G161-L212 PolarHBondContact O-N 2.92Å; Y163-L212 HydrophobicContact CD2-CB 3.77Å; Y163-L212 HydrophobicContact CD2-CD1 3.63Å; Y163-L212 HydrophobicContact CD2-CG 3.77Å; Y163-L212 HydrophobicContact CE2-CB 3.87Å; Y163-L212 HydrophobicContact CE2-CD1 4.18Å; Y163-L212 HydrophobicContact CE2-CG 4.35Å; Y163-L212 HydrophobicContact CG-CD1 3.94Å; Y163-L212 HydrophobicContact CG-CG 4.45Å; F165-L212 HydrophobicContact CE2-CD1 3.91Å; F165-L212 HydrophobicContact CZ-CD1 3.86Å; L210-L212 HydrophobicContact CB-CD2 3.85Å; L210-L212 HydrophobicContact CB-CG 4.17Å; L210-L212 HydrophobicContact CD1-CD2 4.43Å; L212-D216 HydrophobicContact CB-CB 4.19Å; L212-D216 HydrophobicContact CD2-CB 4.31Å; L212-V218 HydrophobicContact CD1-CG2 3.73Å; L212-V218 HydrophobicContact CD2-CG2 3.99Å
213	A	98.3	Very high	97.7	Very high	45 Å²	45	47.4 Å²	47.4	37%	0.372	28%	0.276	S	S	.	.			trans	-86.8	155.3	165.3	0	0	0	0	0	110.2	A157 N160 G215 D216	A157-A213 WeakPolarHBondContact CB-O 3.38Å; N160-A213 WeakPolarHBondContact OD1-CA 3.22Å; A213-G215 PolarHBondContact O-N 3.22Å; A213-D216 PolarHBondContact N-OD2 3.03Å; A213-D216 VanDerWaalsContact O-CB 3.27Å; A213-D216 WeakPolarHBondContact O-CB 3.09Å; A213-D216 PolarHBondContact O-N 2.92Å
214	K	97.2	Very high	97.7	Very high	152 Å²	152	46.8 Å²	46.8	66%	0.661	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	126.6	171.8	175.7	174.1	-178.2	-179.9	0	110.2	A157 P158 N160	A157-K214 WeakPolarHBondContact O-CA 3.44Å; P158-K214 WeakPolarHBondContact O-CD 3.37Å; P158-K214 VanDerWaalsContact O-CG 3.32Å; P158-K214 WeakPolarHBondContact O-CG 3.33Å; N160-K214 PolarHBondContact OD1-N 2.97Å
215	G	97.1	Very high	97.6	Very high	57 Å²	57	45.7 Å²	45.7	59%	0.588	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.2	-5.4	-178.4	0	0	0	0	0	114.6	A157 A213	A157-G215 PolarHBondContact O-N 2.71Å; A213-G215 PolarHBondContact O-N 3.22Å
216	D	98.5	Very high	97.6	Very high	25 Å²	25	44.4 Å²	44.4	13%	0.134	25%	0.248	C	C	.	.			trans	-65	142.8	171.4	-76.2	-9.8	0	0	0	111.1	G156 A157 H184 N185 L212 A213	G156-D216 WeakPolarHBondContact CA-O 3.42Å; A157-D216 HydrophobicContact CB-CB 4.36Å; A157-D216 PolarHBondContact N-O 2.9Å; H184-D216 IonicContact CD2-OD2 4Å; H184-D216 IonicContact CE1-OD2 3.35Å; H184-D216 VanDerWaalsContact NE2-CG 3.31Å; H184-D216 IonicContact NE2-OD1 3.93Å; H184-D216 IonicContact NE2-OD2 2.9Å; H184-D216 PolarHBondContact NE2-OD2 2.86Å; N185-D216 PolarHBondContact ND2-OD1 2.9Å; N185-D216 WeakPolarHBondContact OD1-CA 3.48Å; L212-D216 HydrophobicContact CB-CB 4.19Å; L212-D216 HydrophobicContact CD2-CB 4.31Å; A213-D216 PolarHBondContact N-OD2 3.03Å; A213-D216 VanDerWaalsContact O-CB 3.27Å; A213-D216 WeakPolarHBondContact O-CB 3.09Å; A213-D216 PolarHBondContact O-N 2.92Å
217	E	98.3	Very high	97.6	Very high	77 Å²	77	41.6 Å²	41.6	36%	0.36	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	138	176.8	-65.4	-167.5	137.7	0	0	111.8	R154 F155 H184 N185 W219	R154-E217 IonicContact CZ-OE2 3.67Å; R154-E217 IonicContact NH1-OE2 2.8Å; R154-E217 PolarHBondContact NH1-OE2 2.56Å; F155-E217 CarbonylContact O-C 3.6Å; F155-E217 VanDerWaalsContact O-CA 3.27Å; F155-E217 WeakPolarHBondContact O-CA 3.46Å; H184-E217 WeakPolarHBondContact CA-O 3.29Å; N185-E217 PolarHBondContact N-O 2.87Å; N185-E217 PolarHBondContact OD1-N 3.47Å; E217-W219 HydrophobicContact CB-CE3 4.05Å; E217-W219 HydrophobicContact CB-CZ3 3.89Å
218	V	98.6	Very high	97.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	131.9	173.7	-179.7	0	0	0	0	110.1	F155 F165 L182 M183 L210 L212 F237	F155-V218 HydrophobicContact CD1-CB 4.47Å; F155-V218 PolarHBondContact N-O 2.97Å; F155-V218 PolarHBondContact O-N 2.84Å; F165-V218 HydrophobicContact CD1-CG1 4.11Å; F165-V218 HydrophobicContact CD2-CG1 4.34Å; F165-V218 HydrophobicContact CE1-CB 4.09Å; F165-V218 HydrophobicContact CE1-CG1 3.93Å; F165-V218 HydrophobicContact CE2-CB 4.41Å; F165-V218 HydrophobicContact CE2-CG1 4.18Å; F165-V218 HydrophobicContact CE2-CG2 4.07Å; F165-V218 HydrophobicContact CG-CG1 4.3Å; F165-V218 HydrophobicContact CZ-CB 3.91Å; F165-V218 HydrophobicContact CZ-CG1 3.98Å; F165-V218 HydrophobicContact CZ-CG2 3.87Å; L182-V218 HydrophobicContact CD1-CG1 3.6Å; L182-V218 HydrophobicContact CG-CG1 4.24Å; M183-V218 VanDerWaalsContact O-CA 3.27Å; M183-V218 WeakPolarHBondContact O-CA 3.4Å; L210-V218 HydrophobicContact CD1-CG2 4.25Å; L212-V218 HydrophobicContact CD1-CG2 3.73Å; L212-V218 HydrophobicContact CD2-CG2 3.99Å; V218-F237 HydrophobicContact CG1-CZ 4.4Å
219	W	98.4	Very high	97.5	Very high	19 Å²	19	40.5 Å²	40.5	7%	0.072	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	166.8	178	70.3	99.9	0	0	0	112	G153 R154 M183 E217	G153-W219 WeakPolarHBondContact O-CB 3.41Å; R154-W219 HydrophobicContact CB-CB 4.36Å; R154-W219 HydrophobicContact CG-CB 3.83Å; R154-W219 HydrophobicContact CG-CD2 4.36Å; R154-W219 HydrophobicContact CG-CG 4.1Å; M183-W219 HydrophobicContact CB-CD2 3.62Å; M183-W219 VanDerWaalsContact CB-CE2 3.44Å; M183-W219 HydrophobicContact CB-CE3 3.99Å; M183-W219 HydrophobicContact CB-CG 4.13Å; M183-W219 HydrophobicContact CB-CH2 4.14Å; M183-W219 HydrophobicContact CB-CZ2 3.73Å; M183-W219 HydrophobicContact CB-CZ3 4.23Å; M183-W219 WeakPolarHBondContact CB-O 3.24Å; M183-W219 HydrophobicContact CG-CD2 4.21Å; M183-W219 HydrophobicContact CG-CG 4.4Å; M183-W219 HydrophobicContact CG-CZ2 4.11Å; M183-W219 PolarHBondContact N-O 2.73Å; M183-W219 PolarHBondContact O-N 3.03Å; E217-W219 HydrophobicContact CB-CE3 4.05Å; E217-W219 HydrophobicContact CB-CZ3 3.89Å
220	L	98.4	Very high	97.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	135.4	170.3	-58.7	-173.9	0	0	0	110.7	G134 I135 F137 F167 M169 V180 Y181 L182 F237	G134-L220 WeakPolarHBondContact CA-O 3.49Å; I135-L220 HydrophobicContact CB-CB 4.29Å; I135-L220 HydrophobicContact CD1-CB 3.96Å; I135-L220 PolarHBondContact N-O 3.08Å; F137-L220 HydrophobicContact CE2-CD1 4.38Å; F137-L220 HydrophobicContact CZ-CD1 3.89Å; F167-L220 HydrophobicContact CB-CD1 3.64Å; F167-L220 HydrophobicContact CD1-CD1 4.41Å; F167-L220 HydrophobicContact CD1-CD2 3.86Å; F167-L220 HydrophobicContact CD2-CD1 3.78Å; F167-L220 HydrophobicContact CD2-CD2 4.21Å; F167-L220 HydrophobicContact CE1-CD2 4.02Å; F167-L220 HydrophobicContact CE2-CD2 4.33Å; F167-L220 HydrophobicContact CG-CD1 3.71Å; F167-L220 HydrophobicContact CG-CD2 3.97Å; F167-L220 HydrophobicContact CZ-CD2 4.25Å; M169-L220 HydrophobicContact CE-CD1 3.8Å; M169-L220 HydrophobicContact SD-CD1 4.44Å; V180-L220 HydrophobicContact CG1-CB 4.09Å; V180-L220 HydrophobicContact CG1-CD1 4.26Å; V180-L220 HydrophobicContact CG1-CD2 4.43Å; Y181-L220 CarbonylContact O-C 3.59Å; Y181-L220 WeakPolarHBondContact O-CA 3.37Å; L182-L220 HydrophobicContact CB-CD2 4.06Å; L182-L220 HydrophobicContact CD1-CD2 3.53Å; L182-L220 HydrophobicContact CG-CD2 4.42Å; L220-F237 HydrophobicContact CD1-CB 4.2Å; L220-F237 HydrophobicContact CD1-CD1 4.48Å; L220-F237 HydrophobicContact CD1-CD2 4.21Å; L220-F237 HydrophobicContact CD1-CG 4.07Å; L220-F237 HydrophobicContact CD2-CE2 4.39Å; L220-F237 HydrophobicContact CG-CD1 4.23Å; L220-F237 HydrophobicContact CG-CD2 4.28Å; L220-F237 HydrophobicContact CG-CE1 4.33Å; L220-F237 HydrophobicContact CG-CE2 4.37Å; L220-F237 HydrophobicContact CG-CG 4.21Å; L220-F237 HydrophobicContact CG-CZ 4.39Å
221	R	97.8	Very high	96.9	Very high	67 Å²	67	44.4 Å²	44.4	25%	0.253	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	133.8	174.6	-176.6	179.3	66	136.4	3.1	110.1	S133 Y181 M183	S133-R221 WeakPolarHBondContact O-CA 3.48Å; S133-R221 WeakPolarHBondContact O-CG 3.36Å; Y181-R221 PolarHBondContact N-O 3.29Å; Y181-R221 PolarHBondContact O-N 3.35Å; M183-R221 HydrophobicContact CG-CB 3.61Å; M183-R221 HydrophobicContact SD-CB 3.87Å
222	M	97.8	Very high	96.6	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	128.9	172.9	-170.6	64.8	175	0	0	110.3	F128 N130 N132 S133 I135 V178 V180 N224 G225 L227	F128-M222 HydrophobicContact CD1-CB 4.25Å; F128-M222 HydrophobicContact CD1-CG 4.26Å; F128-M222 HydrophobicContact CD1-SD 4.49Å; F128-M222 HydrophobicContact CE1-CB 3.75Å; F128-M222 HydrophobicContact CE1-CG 4.16Å; N130-M222 WeakPolarHBondContact O-CB 3.47Å; N132-M222 WeakPolarHBondContact CA-O 3.3Å; N132-M222 PolarHBondContact N-O 3.34Å; S133-M222 PolarHBondContact O-N 3.38Å; I135-M222 HydrophobicContact CD1-CB 4.32Å; I135-M222 HydrophobicContact CD1-SD 4.4Å; I135-M222 HydrophobicContact CG1-CB 4Å; V178-M222 HydrophobicContact CG2-CE 3.9Å; V178-M222 HydrophobicContact CG2-SD 4.36Å; V180-M222 HydrophobicContact CG2-SD 4.37Å; M222-N224 WeakPolarHBondContact CE-O 3.42Å; M222-G225 WeakPolarHBondContact CE-O 3.4Å; M222-L227 HydrophobicContact CE-CG 4.26Å; M222-L227 HydrophobicContact SD-CD1 3.95Å; M222-L227 HydrophobicContact SD-CG 4.08Å
223	G	96.4	Very high	96.4	Very high	11 Å²	11	48.3 Å²	48.3	11%	0.113	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-75.6	176.8	0	0	0	0	0	112.5	Q131 Y179	Q131-G223 VanDerWaalsContact OE1-C 3.3Å; Q131-G223 PolarHBondContact OE1-O 3.47Å; Y179-G223 WeakPolarHBondContact O-CA 3.46Å; Y179-G223 PolarHBondContact O-N 2.8Å
224	N	95.6	Very high	96.2	Very high	72 Å²	72	49.9 Å²	49.9	39%	0.385	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	157.7	176	-167.1	26.5	0	0	0	109.6	E177 V178 Y179 M222	E177-N224 PolarHBondContact OE1-ND2 3.29Å; V178-N224 WeakPolarHBondContact CA-O 3.41Å; Y179-N224 HydrophobicContact CD2-CB 4.11Å; Y179-N224 PolarHBondContact N-O 3.47Å; M222-N224 WeakPolarHBondContact CE-O 3.42Å
225	G	95.7	Very high	96.2	Very high	7 Å²	7	42.7 Å²	42.7	7%	0.072	22%	0.216	C	C	.	.	S	Bend	trans	97	-151.5	172.9	0	0	0	0	0	114.8	Q131 E177 M222	Q131-G225 PolarHBondContact NE2-O 3.34Å; E177-G225 VanDerWaalsContact O-CA 3.26Å; E177-G225 WeakPolarHBondContact O-CA 3.42Å; M222-G225 WeakPolarHBondContact CE-O 3.4Å
226	A	97	Very high	96.2	Very high	13 Å²	13	41 Å²	41	11%	0.107	20%	0.195	C	C	.	.			trans	-149.4	145.4	177.6	0	0	0	0	0	110.3	F128 H172 V175	F128-A226 WeakPolarHBondContact O-CA 3.48Å; H172-A226 HydrophobicContact CB-CB 3.71Å; H172-A226 WeakPolarHBondContact CB-O 3.46Å; H172-A226 PolarHBondContact N-O 2.81Å; V175-A226 HydrophobicContact CG1-CB 3.81Å; V175-A226 HydrophobicContact CG2-CB 4.14Å
227	L	97.4	Very high	96.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-108.1	139.5	180	-69.2	173.7	0	0	0	110.6	M124 H127 F128 I135 M169 M170 V178 V180 M222	M124-L227 HydrophobicContact CE-CB 3.76Å; M124-L227 HydrophobicContact CE-CD1 4.45Å; M124-L227 HydrophobicContact SD-CB 4.11Å; M124-L227 HydrophobicContact SD-CD1 4.05Å; H127-L227 VanDerWaalsContact CA-O 3.29Å; H127-L227 WeakPolarHBondContact CA-O 3.31Å; F128-L227 PolarHBondContact N-O 2.93Å; F128-L227 PolarHBondContact O-N 2.92Å; I135-L227 HydrophobicContact CD1-CD1 3.6Å; I135-L227 HydrophobicContact CG1-CD1 4.32Å; I135-L227 HydrophobicContact CG2-CD1 4.46Å; M169-L227 HydrophobicContact CB-CD2 3.72Å; M169-L227 HydrophobicContact CG-CD2 4.22Å; M169-L227 HydrophobicContact SD-CD1 3.86Å; M169-L227 HydrophobicContact SD-CD2 4.2Å; M170-L227 WeakPolarHBondContact O-CA 3.25Å; V178-L227 HydrophobicContact CG2-CD2 3.71Å; V178-L227 HydrophobicContact CG2-CG 4.15Å; V180-L227 HydrophobicContact CG2-CD1 4.08Å; V180-L227 HydrophobicContact CG2-CD2 4.26Å; M222-L227 HydrophobicContact CE-CG 4.26Å; M222-L227 HydrophobicContact SD-CD1 3.95Å; M222-L227 HydrophobicContact SD-CG 4.08Å
228	H	96.7	Very high	96.3	Very high	40 Å²	40	37.1 Å²	37.1	19%	0.185	18%	0.179	C	C	.	.			trans	-81.3	134.2	174.8	-168.9	87.2	0	0	0	110.9	H127 M170 H172 D230 F234 S235	H127-H228 AromaticContact CE1-CE1 3.47Å; H127-H228 PolarHBondContact CE1-CE1 2.81Å; H127-H228 VanDerWaalsContact CE1-CE1 3.47Å; H127-H228 AromaticContact CE1-ND1 3.29Å; H127-H228 PolarHBondContact CE1-ND1 3.48Å; H127-H228 VanDerWaalsContact CE1-ND1 3.29Å; H127-H228 AromaticContact ND1-CG 3.97Å; H127-H228 AromaticContact ND1-ND1 3.57Å; M170-H228 HydrophobicContact CB-CB 4.03Å; M170-H228 HydrophobicContact CG-CB 3.78Å; M170-H228 PolarHBondContact O-N 3.26Å; M170-H228 HydrophobicContact SD-CB 3.95Å; H172-H228 AromaticContact CD2-ND1 3.85Å; H228-D230 IonicContact CD2-OD2 3.08Å; H228-D230 IonicContact CE1-OD2 3.55Å; H228-D230 IonicContact NE2-OD2 3.22Å; H228-D230 PolarHBondContact NE2-OD2 3.39Å; H228-F234 AromaticContact CD2-CD2 3.89Å; H228-S235 WeakPolarHBondContact O-CB 3.42Å; H228-S235 PolarHBondContact O-OG 3.21Å
229	G	95	Very high	96.3	Very high	2 Å²	2	37.1 Å²	37.1	2%	0.021	18%	0.179	C	C	.	.			trans	-147.5	128.8	175.6	0	0	0	0	0	110	M124 T126 H127	M124-G229 WeakPolarHBondContact O-CA 3.34Å; T126-G229 CarbonylContact C-O 3.57Å; T126-G229 WeakPolarHBondContact CA-O 3.37Å; H127-G229 PolarHBondContact N-O 3.49Å; H127-G229 PolarHBondContact ND1-N 3.33Å
230	D	93.5	Very high	96.3	Very high	32 Å²	32	40.3 Å²	40.3	17%	0.171	19%	0.194	C	C	.	.	S	Bend	trans	-156.7	-172.8	-178.2	65.3	15.7	0	0	0	110.6	M124 A125 H228 Q232 R233	M124-D230 PolarHBondContact O-N 2.84Å; A125-D230 WeakPolarHBondContact O-CA 3.37Å; H228-D230 IonicContact CD2-OD2 3.08Å; H228-D230 IonicContact CE1-OD2 3.55Å; H228-D230 IonicContact NE2-OD2 3.22Å; H228-D230 PolarHBondContact NE2-OD2 3.39Å; D230-Q232 PolarHBondContact O-N 2.89Å; D230-Q232 WeakPolarHBondContact OD1-CA 3.3Å; D230-Q232 VanDerWaalsContact OD1-CB 3.29Å; D230-Q232 WeakPolarHBondContact OD1-CB 3.24Å; D230-Q232 PolarHBondContact OD1-N 3.29Å; D230-R233 PolarHBondContact O-N 3.31Å; D230-R233 PolarHBondContact OD1-N 2.75Å
231	H	91.9	Very high	96.2	Very high	156 Å²	156	41.6 Å²	41.6	72%	0.722	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-12.2	178.7	65.8	-80.9	0	0	0	114.3
232	Q	91.7	Very high	96.2	Very high	115 Å²	115	42.2 Å²	42.2	54%	0.537	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-9.1	178.2	-56.8	-172.1	-9.3	0	0	112.6	D230 F234	D230-Q232 PolarHBondContact O-N 2.89Å; D230-Q232 WeakPolarHBondContact OD1-CA 3.3Å; D230-Q232 VanDerWaalsContact OD1-CB 3.29Å; D230-Q232 WeakPolarHBondContact OD1-CB 3.24Å; D230-Q232 PolarHBondContact OD1-N 3.29Å; Q232-F234 HydrophobicContact CB-CD2 4.02Å; Q232-F234 HydrophobicContact CB-CE2 3.51Å; Q232-F234 HydrophobicContact CB-CZ 3.81Å; Q232-F234 HydrophobicContact CG-CE2 4.28Å; Q232-F234 PolarHBondContact O-N 3.02Å
233	R	92.3	Very high	96	Very high	125 Å²	125	48 Å²	48	47%	0.472	23%	0.233	S	C	.	.			trans	62.3	42.6	166.3	-53.3	179.2	-179.6	-178.2	-3.2	114.4	S123 E141 D230 S235 T236	S123-R233 WeakPolarHBondContact OG-CD 3.46Å; S123-R233 WeakPolarHBondContact OG-CG 3.27Å; E141-R233 IonicContact OE1-CZ 3.86Å; E141-R233 IonicContact OE1-NE 3.4Å; E141-R233 IonicContact OE1-NH1 2.8Å; E141-R233 PolarHBondContact OE1-NH1 3.31Å; D230-R233 PolarHBondContact O-N 3.31Å; D230-R233 PolarHBondContact OD1-N 2.75Å; R233-S235 VanDerWaalsContact C-N 3.35Å; R233-S235 PolarHBondContact O-N 3.1Å; R233-T236 WeakPolarHBondContact O-CG2 3.49Å
234	F	94.7	Very high	95.9	Very high	78 Å²	78	52.8 Å²	52.8	34%	0.342	25%	0.253	S	S	.	.			trans	-66.6	-33.6	179.7	-64.2	-67.9	0	0	0	114.4	M170 H228 Q232	M170-F234 HydrophobicContact CB-CB 3.79Å; M170-F234 HydrophobicContact CE-CB 3.64Å; M170-F234 HydrophobicContact CE-CD1 3.38Å; M170-F234 HydrophobicContact CE-CD2 3.77Å; M170-F234 HydrophobicContact CE-CE1 3.84Å; M170-F234 HydrophobicContact CE-CE2 4.16Å; M170-F234 HydrophobicContact CE-CG 3.31Å; M170-F234 HydrophobicContact CE-CZ 4.18Å; M170-F234 HydrophobicContact CG-CB 4.38Å; M170-F234 HydrophobicContact SD-CB 3.72Å; M170-F234 HydrophobicContact SD-CD1 4.32Å; M170-F234 HydrophobicContact SD-CD2 3.63Å; M170-F234 HydrophobicContact SD-CE2 4.24Å; M170-F234 HydrophobicContact SD-CG 3.64Å; H228-F234 AromaticContact CD2-CD2 3.89Å; Q232-F234 HydrophobicContact CB-CD2 4.02Å; Q232-F234 HydrophobicContact CB-CE2 3.51Å; Q232-F234 HydrophobicContact CB-CZ 3.81Å; Q232-F234 HydrophobicContact CG-CE2 4.28Å; Q232-F234 PolarHBondContact O-N 3.02Å
235	S	97.5	Very high	95.8	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.244	C	C	.	.	S	Bend	trans	-98.6	116.8	179.8	-60.2	0	0	0	0	110.3	S123 M124 N168 M170 H228 R233	S123-S235 CarbonylContact C-O 3.43Å; S123-S235 VanDerWaalsContact CA-O 3.29Å; S123-S235 WeakPolarHBondContact CA-O 3.27Å; M124-S235 PolarHBondContact N-O 2.97Å; M124-S235 WeakPolarHBondContact SD-CB 3.45Å; N168-S235 CarbonylContact O-C 3.45Å; N168-S235 VanDerWaalsContact O-CA 3.23Å; N168-S235 WeakPolarHBondContact O-CA 3.19Å; M170-S235 PolarHBondContact N-OG 2.77Å; H228-S235 WeakPolarHBondContact O-CB 3.42Å; H228-S235 PolarHBondContact O-OG 3.21Å; R233-S235 VanDerWaalsContact C-N 3.35Å; R233-S235 PolarHBondContact O-N 3.1Å
236	T	98	Very high	95	Very high	23 Å²	23	63.4 Å²	63.4	14%	0.141	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	148.7	-169.7	56.8	0	0	0	0	112.4	M121 A122 F167 N168 M169 R233	M121-T236 HydrophobicContact CE-CG2 4.34Å; A122-T236 CarbonylContact O-C 3.52Å; A122-T236 WeakPolarHBondContact O-CA 3.42Å; F167-T236 WeakPolarHBondContact CA-O 3.47Å; F167-T236 WeakPolarHBondContact CB-O 3.16Å; N168-T236 PolarHBondContact N-O 3.07Å; N168-T236 PolarHBondContact O-N 2.6Å; M169-T236 WeakPolarHBondContact CE-O 3.4Å; R233-T236 WeakPolarHBondContact O-CG2 3.49Å
237	F	98.4	Very high	94.9	Very high	0 Å²	0	66 Å²	66	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	128.8	171.3	-179.6	-145.8	0	0	0	109.6	F120 A122 F137 F148 F165 T166 F167 L182 V218 L220	F120-F237 AromaticContact CE2-CD1 3.67Å; F120-F237 HydrophobicContact CE2-CD1 3.67Å; F120-F237 HydrophobicContact CE2-CD2 4.36Å; F120-F237 AromaticContact CE2-CE1 3.78Å; F120-F237 HydrophobicContact CE2-CE1 3.78Å; F120-F237 HydrophobicContact CE2-CE2 4.47Å; F120-F237 AromaticContact CE2-CG 3.98Å; F120-F237 HydrophobicContact CE2-CG 3.98Å; F120-F237 HydrophobicContact CE2-CZ 4.2Å; F120-F237 HydrophobicContact CZ-CD1 4.06Å; F120-F237 HydrophobicContact CZ-CD2 4.41Å; F120-F237 AromaticContact CZ-CE1 3.7Å; F120-F237 HydrophobicContact CZ-CE1 3.7Å; F120-F237 HydrophobicContact CZ-CE2 4.09Å; F120-F237 HydrophobicContact CZ-CG 4.41Å; F120-F237 AromaticContact CZ-CZ 3.72Å; F120-F237 HydrophobicContact CZ-CZ 3.72Å; A122-F237 PolarHBondContact N-O 2.97Å; A122-F237 PolarHBondContact O-N 3.4Å; F137-F237 HydrophobicContact CD1-CB 4.23Å; F137-F237 HydrophobicContact CD2-CB 4.26Å; F137-F237 HydrophobicContact CD2-CD1 4.33Å; F137-F237 HydrophobicContact CE1-CB 3.71Å; F137-F237 HydrophobicContact CE2-CB 3.73Å; F137-F237 AromaticContact CE2-CD1 3.88Å; F137-F237 HydrophobicContact CE2-CD1 3.88Å; F137-F237 HydrophobicContact CE2-CG 4.22Å; F137-F237 HydrophobicContact CG-CB 4.5Å; F137-F237 HydrophobicContact CZ-CB 3.45Å; F137-F237 VanDerWaalsContact CZ-CB 3.45Å; F137-F237 HydrophobicContact CZ-CD1 4.41Å; F137-F237 HydrophobicContact CZ-CG 4.29Å; F148-F237 AromaticContact CE2-CD1 3.98Å; F148-F237 HydrophobicContact CE2-CD1 3.98Å; F148-F237 HydrophobicContact CE2-CE1 4.08Å; F148-F237 HydrophobicContact CZ-CD1 4.46Å; F165-F237 HydrophobicContact CB-CE2 4.24Å; F165-F237 HydrophobicContact CD1-CE2 4Å; F165-F237 HydrophobicContact CD1-CZ 4Å; T166-F237 WeakPolarHBondContact O-CD2 3.29Å; F167-F237 HydrophobicContact CB-CB 4.42Å; F167-F237 HydrophobicContact CB-CD2 3.92Å; L182-F237 HydrophobicContact CD1-CE2 4.17Å; L182-F237 HydrophobicContact CD1-CZ 4.17Å; V218-F237 HydrophobicContact CG1-CZ 4.4Å; L220-F237 HydrophobicContact CD1-CB 4.2Å; L220-F237 HydrophobicContact CD1-CD1 4.48Å; L220-F237 HydrophobicContact CD1-CD2 4.21Å; L220-F237 HydrophobicContact CD1-CG 4.07Å; L220-F237 HydrophobicContact CD2-CE2 4.39Å; L220-F237 HydrophobicContact CG-CD1 4.23Å; L220-F237 HydrophobicContact CG-CD2 4.28Å; L220-F237 HydrophobicContact CG-CE1 4.33Å; L220-F237 HydrophobicContact CG-CE2 4.37Å; L220-F237 HydrophobicContact CG-CG 4.21Å; L220-F237 HydrophobicContact CG-CZ 4.39Å
238	A	98.7	Very high	94.8	Very high	19 Å²	19	69.4 Å²	69.4	16%	0.157	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	155.1	-179.1	0	0	0	0	0	111.2	F120 M121 F165 T166	F120-A238 VanDerWaalsContact O-CA 3.24Å; F120-A238 WeakPolarHBondContact O-CA 3.35Å; F120-A238 WeakPolarHBondContact O-CB 3.3Å; M121-A238 HydrophobicContact CB-CB 4.07Å; M121-A238 HydrophobicContact CG-CB 4.12Å; F165-A238 WeakPolarHBondContact CA-O 3.35Å; T166-A238 HydrophobicContact CG2-CB 4.13Å; T166-A238 PolarHBondContact N-O 3.06Å; T166-A238 PolarHBondContact O-N 3.47Å
239	G	98.5	Very high	94.7	Very high	1 Å²	1	71.1 Å²	71.1	1%	0.01	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.7	158.7	171.3	0	0	0	0	0	113.2	A119 F120 F164	A119-G239 CarbonylContact C-O 3.46Å; A119-G239 VanDerWaalsContact CA-O 3.3Å; A119-G239 WeakPolarHBondContact CA-O 3.44Å; F120-G239 WeakPolarHBondContact CD1-O 3.45Å; F120-G239 PolarHBondContact N-O 3.31Å; F120-G239 PolarHBondContact O-N 2.97Å; F164-G239 CarbonylContact O-C 3.59Å; F164-G239 WeakPolarHBondContact O-CA 3.4Å
240	F	98.4	Very high	94.7	Very high	86 Å²	86	75.1 Å²	75.1	38%	0.377	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	159.3	-179.4	60.4	-89	0	0	0	112.1	V118 A119 Y163 F164 L242	V118-F240 VanDerWaalsContact O-CA 3.22Å; V118-F240 WeakPolarHBondContact O-CA 3.24Å; V118-F240 VanDerWaalsContact O-CB 3.28Å; V118-F240 WeakPolarHBondContact O-CB 3.5Å; A119-F240 HydrophobicContact CB-CB 3.81Å; Y163-F240 WeakPolarHBondContact CA-O 3.38Å; F164-F240 HydrophobicContact CB-CE1 4.11Å; F164-F240 HydrophobicContact CB-CE2 4.32Å; F164-F240 HydrophobicContact CB-CZ 3.98Å; F164-F240 HydrophobicContact CD1-CD1 4.18Å; F164-F240 AromaticContact CD1-CE1 3.43Å; F164-F240 HydrophobicContact CD1-CE1 3.43Å; F164-F240 VanDerWaalsContact CD1-CE1 3.43Å; F164-F240 AromaticContact CD1-CZ 3.87Å; F164-F240 HydrophobicContact CD1-CZ 3.87Å; F164-F240 HydrophobicContact CE1-CE1 4.24Å; F164-F240 HydrophobicContact CG-CE1 4.15Å; F164-F240 HydrophobicContact CG-CZ 4.19Å; F164-F240 PolarHBondContact N-O 3.14Å; F164-F240 PolarHBondContact O-N 3.11Å; F240-L242 HydrophobicContact CD2-CD2 4.41Å; F240-L242 HydrophobicContact CE2-CD2 3.58Å; F240-L242 HydrophobicContact CE2-CG 4.21Å; F240-L242 HydrophobicContact CZ-CD2 4.27Å
241	L	97.8	Very high	94.8	Very high	26 Å²	26	77.8 Å²	77.8	14%	0.136	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	125.2	173.3	175.3	65.8	0	0	0	109.8	L116 V118 V159 Y163 F243 E244	L116-L241 HydrophobicContact CD2-CD2 4.32Å; V118-L241 HydrophobicContact CB-CB 3.85Å; V118-L241 HydrophobicContact CG2-CB 4.38Å; V118-L241 HydrophobicContact CG2-CD2 4.34Å; V118-L241 PolarHBondContact O-N 3.28Å; V159-L241 HydrophobicContact CG2-CD2 4.25Å; Y163-L241 HydrophobicContact CD1-CB 4.02Å; Y163-L241 HydrophobicContact CD1-CD1 4.2Å; Y163-L241 HydrophobicContact CD2-CD1 4.37Å; Y163-L241 HydrophobicContact CE1-CB 3.72Å; Y163-L241 HydrophobicContact CE1-CD1 3.74Å; Y163-L241 HydrophobicContact CE1-CG 4.29Å; Y163-L241 HydrophobicContact CE2-CD1 3.95Å; Y163-L241 HydrophobicContact CG-CD1 4.49Å; L241-F243 WeakPolarHBondContact CD1-O 3.09Å; L241-E244 HydrophobicContact CD2-CG 3.98Å
242	L	96.5	Very high	95	Very high	81 Å²	81	72.6 Å²	72.6	42%	0.424	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-50.5	171.6	-71.6	165	0	0	0	110.7	V162 F164 V209 F240	V162-L242 HydrophobicContact CG1-CD1 4.04Å; V162-L242 WeakPolarHBondContact O-CB 3.3Å; V162-L242 PolarHBondContact O-N 2.9Å; F164-L242 HydrophobicContact CB-CD1 4.08Å; F164-L242 HydrophobicContact CB-CG 4.21Å; V209-L242 HydrophobicContact CG1-CD1 4.09Å; F240-L242 HydrophobicContact CD2-CD2 4.41Å; F240-L242 HydrophobicContact CE2-CD2 3.58Å; F240-L242 HydrophobicContact CE2-CG 4.21Å; F240-L242 HydrophobicContact CZ-CD2 4.27Å
243	F	94.3	Very high	95.2	Very high	120 Å²	120	69.6 Å²	69.6	53%	0.526	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	149.7	176.8	51.2	-92.6	0	0	0	111.4	G161 V162 L241 T245	G161-F243 VanDerWaalsContact CA-O 3.31Å; G161-F243 WeakPolarHBondContact CA-O 3.28Å; V162-F243 HydrophobicContact CB-CD2 4.29Å; V162-F243 HydrophobicContact CB-CE1 4.08Å; V162-F243 HydrophobicContact CB-CE2 3.8Å; V162-F243 HydrophobicContact CB-CZ 3.67Å; V162-F243 HydrophobicContact CG1-CE1 4.41Å; V162-F243 HydrophobicContact CG1-CZ 4.16Å; V162-F243 HydrophobicContact CG2-CD2 4.19Å; V162-F243 HydrophobicContact CG2-CE1 4.42Å; V162-F243 HydrophobicContact CG2-CE2 3.39Å; V162-F243 HydrophobicContact CG2-CZ 3.53Å; V162-F243 PolarHBondContact N-O 2.9Å; V162-F243 PolarHBondContact O-N 2.9Å; L241-F243 WeakPolarHBondContact CD1-O 3.09Å; F243-T245 HydrophobicContact CD2-CG2 4.31Å; F243-T245 HydrophobicContact CE2-CG2 4.18Å
244	E	95	Very high	95.4	Very high	112 Å²	112	65.3 Å²	65.3	52%	0.523	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	145.2	173.3	-61.4	-173.2	-125.6	0	0	111.2	V159 N160 L241	V159-E244 HydrophobicContact CG2-CG 4.03Å; N160-E244 WeakPolarHBondContact O-CA 3.44Å; L241-E244 HydrophobicContact CD2-CG 3.98Å
245	T	92.4	Very high	95.5	Very high	34 Å²	34	64.3 Å²	64.3	21%	0.209	31%	0.306	C	S	.	.			trans	-112.1	137.2	171.7	60.8	0	0	0	0	109.5	N160 G161 V162 F243	N160-T245 WeakPolarHBondContact CB-O 3.32Å; N160-T245 PolarHBondContact O-N 3.5Å; N160-T245 PolarHBondContact O-OG1 3.14Å; G161-T245 PolarHBondContact N-OG1 3.33Å; V162-T245 HydrophobicContact CG2-CG2 3.98Å; F243-T245 HydrophobicContact CD2-CG2 4.31Å; F243-T245 HydrophobicContact CE2-CG2 4.18Å
246	K	80.2	Confident	95.3	Very high	269 Å²	269	70.1 Å²	70.1	100%	1.17	33%	0.334	S	S	*	.			trans	-74.7	0	176.3	-64.8	-177	-179.6	177.7	0	112.3

Retrieved 246 of 246 residues in 297.9 ms (Link to these results)

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